data_nef_c18709_2ly4 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLY start . false 2 A 2 LYS middle . . 3 A 3 GLY middle . false 4 A 4 ASP middle . . 5 A 5 PRO middle . false 6 A 6 LYS middle . . 7 A 7 LYS middle . . 8 A 8 PRO middle . false 9 A 9 ARG middle . . 10 A 10 GLY middle . false 11 A 11 LYS middle . . 12 A 12 MET middle . . 13 A 13 SER middle . . 14 A 14 SER middle . . 15 A 15 TYR middle . . 16 A 16 ALA middle . . 17 A 17 PHE middle . . 18 A 18 PHE middle . . 19 A 19 VAL middle . . 20 A 20 GLN middle . . 21 A 21 THR middle . . 22 A 22 CYS middle . . 23 A 23 ARG middle . . 24 A 24 GLU middle . . 25 A 25 GLU middle . . 26 A 26 HIS middle . . 27 A 27 LYS middle . . 28 A 28 LYS middle . . 29 A 29 LYS middle . . 30 A 30 HIS middle . . 31 A 31 PRO middle . false 32 A 32 ASP middle . . 33 A 33 ALA middle . . 34 A 34 SER middle . . 35 A 35 VAL middle . . 36 A 36 ASN middle . . 37 A 37 PHE middle . . 38 A 38 SER middle . . 39 A 39 GLU middle . . 40 A 40 PHE middle . . 41 A 41 SER middle . . 42 A 42 LYS middle . . 43 A 43 LYS middle . . 44 A 44 CYS middle . . 45 A 45 SER middle . . 46 A 46 GLU middle . . 47 A 47 ARG middle . . 48 A 48 TRP middle . . 49 A 49 LYS middle . . 50 A 50 THR middle . . 51 A 51 MET middle . . 52 A 52 SER middle . . 53 A 53 ALA middle . . 54 A 54 LYS middle . . 55 A 55 GLU middle . . 56 A 56 LYS middle . . 57 A 57 GLY middle . false 58 A 58 LYS middle . . 59 A 59 PHE middle . . 60 A 60 GLU middle . . 61 A 61 ASP middle . . 62 A 62 MET middle . . 63 A 63 ALA middle . . 64 A 64 LYS middle . . 65 A 65 ALA middle . . 66 A 66 ASP middle . . 67 A 67 LYS middle . . 68 A 68 ALA middle . . 69 A 69 ARG middle . . 70 A 70 TYR middle . . 71 A 71 GLU middle . . 72 A 72 ARG middle . . 73 A 73 GLU middle . . 74 A 74 MET middle . . 75 A 75 LYS middle . . 76 A 76 THR middle . . 77 A 77 TYR middle . . 78 A 78 ILE middle . . 79 A 79 PRO middle . false 80 A 80 PRO middle . false 81 A 81 LYS middle . . 82 A 82 GLY middle . false 83 A 83 GLU end . . 84 B 1 MET start . . 85 B 2 GLU middle . . 86 B 3 GLU middle . . 87 B 4 PRO middle . false 88 B 5 GLN middle . . 89 B 6 SER middle . . 90 B 7 ASP middle . . 91 B 8 PRO middle . false 92 B 9 SER middle . . 93 B 10 VAL middle . . 94 B 11 GLU middle . . 95 B 12 PRO middle . false 96 B 13 PRO middle . false 97 B 14 LEU middle . . 98 B 15 SER middle . . 99 B 16 GLN middle . . 100 B 17 GLU middle . . 101 B 18 THR middle . . 102 B 19 PHE middle . . 103 B 20 SER middle . . 104 B 21 ASP middle . . 105 B 22 LEU middle . . 106 B 23 TRP middle . . 107 B 24 LYS middle . . 108 B 25 LEU middle . . 109 B 26 LEU middle . . 110 B 27 PRO middle . false 111 B 28 GLU middle . . 112 B 29 ASN middle . . 113 B 30 ASN middle . . 114 B 31 VAL middle . . 115 B 32 LEU middle . . 116 B 33 SER middle . . 117 B 34 PRO middle . false 118 B 35 LEU middle . . 119 B 36 PRO middle . false 120 B 37 SER middle . . 121 B 38 GLN middle . . 122 B 39 ALA middle . . 123 B 40 MET middle . . 124 B 41 ASP middle . . 125 B 42 ASP middle . . 126 B 43 LEU middle . . 127 B 44 MET middle . . 128 B 45 LEU middle . . 129 B 46 SER middle . . 130 B 47 PRO middle . false 131 B 48 ASP middle . . 132 B 49 ASP middle . . 133 B 50 ILE middle . . 134 B 51 GLU middle . . 135 B 52 GLN middle . . 136 B 53 TRP middle . . 137 B 54 PHE middle . . 138 B 55 THR middle . . 139 B 56 GLU middle . . 140 B 57 ASP middle . . 141 B 58 PRO middle . false 142 B 59 GLY middle . false 143 B 60 PRO middle . false 144 B 61 ASP middle . . 145 B 62 GLU middle . . 146 B 63 ALA middle . . 147 B 64 PRO middle . false 148 B 65 ARG middle . . 149 B 66 MET middle . . 150 B 67 PRO middle . false 151 B 68 GLU middle . . 152 B 69 ALA middle . . 153 B 70 ALA middle . . 154 B 71 PRO middle . false 155 B 72 PRO middle . false 156 B 73 VAL middle . . 157 B 74 ALA middle . . 158 B 75 PRO middle . false 159 B 76 ALA middle . . 160 B 77 PRO middle . false 161 B 78 ALA middle . . 162 B 79 ALA middle . . 163 B 80 PRO middle . false 164 B 81 THR middle . . 165 B 82 PRO middle . false 166 B 83 ALA middle . . 167 B 84 ALA middle . . 168 B 85 PRO middle . false 169 B 86 ALA middle . . 170 B 87 PRO middle . false 171 B 88 ALA middle . . 172 B 89 PRO middle . false 173 B 90 SER middle . . 174 B 91 TRP middle . . 175 B 92 PRO middle . false 176 B 93 LEU end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 LYS H H 1 8.346 0.000 A 2 LYS HA H 1 4.291 0.005 A 2 LYS HB2 H 1 1.804 0.004 A 2 LYS HB3 H 1 1.800 0.000 A 2 LYS HD2 H 1 1.652 0.000 A 2 LYS HG2 H 1 1.453 0.000 A 2 LYS HGx H 1 1.453 0.000 A 2 LYS HGy H 1 1.477 0.000 A 2 LYS C C 13 178.301 0.000 A 2 LYS CA C 13 57.039 0.011 A 2 LYS CB C 13 32.936 0.016 A 2 LYS CD C 13 29.379 0.037 A 2 LYS CG C 13 24.721 0.037 A 2 LYS N N 15 119.832 0.000 A 3 GLY H H 1 8.651 0.002 A 3 GLY HA2 H 1 3.935 0.000 A 3 GLY HA3 H 1 3.935 0.000 A 3 GLY C C 13 174.723 0.000 A 3 GLY CA C 13 44.945 0.034 A 3 GLY N N 15 110.425 0.021 A 4 ASP H H 1 8.144 0.003 A 4 ASP HA H 1 4.881 0.004 A 4 ASP HBx H 1 2.615 0.000 A 4 ASP HBy H 1 2.764 0.000 A 4 ASP CA C 13 52.310 0.058 A 4 ASP CB C 13 41.108 0.000 A 4 ASP N N 15 121.097 0.018 A 5 PRO HA H 1 4.457 0.005 A 5 PRO HBx H 1 2.044 0.014 A 5 PRO HBy H 1 2.358 0.002 A 5 PRO HDx H 1 3.864 0.000 A 5 PRO HDy H 1 3.881 0.000 A 5 PRO HG2 H 1 2.025 0.000 A 5 PRO HG3 H 1 2.025 0.000 A 5 PRO C C 13 178.183 0.000 A 5 PRO CA C 13 63.501 0.028 A 5 PRO CB C 13 32.172 0.127 A 5 PRO CD C 13 50.781 0.076 A 5 PRO CG C 13 27.256 0.012 A 6 LYS H H 1 8.351 0.003 A 6 LYS HA H 1 4.280 0.006 A 6 LYS HBx H 1 1.796 0.000 A 6 LYS HBy H 1 1.862 0.012 A 6 LYS HD2 H 1 1.671 0.000 A 6 LYS HD3 H 1 1.671 0.000 A 6 LYS HE2 H 1 3.025 0.000 A 6 LYS HE3 H 1 3.025 0.000 A 6 LYS HG2 H 1 1.441 0.000 A 6 LYS HG3 H 1 1.441 0.000 A 6 LYS C C 13 177.086 0.000 A 6 LYS CA C 13 55.802 0.013 A 6 LYS CB C 13 32.733 0.034 A 6 LYS CD C 13 29.077 0.049 A 6 LYS CE C 13 42.177 0.000 A 6 LYS CG C 13 24.970 0.015 A 6 LYS N N 15 119.845 0.033 A 7 LYS H H 1 7.906 0.004 A 7 LYS HA H 1 3.857 0.003 A 7 LYS HBx H 1 1.581 0.001 A 7 LYS HBy H 1 1.671 0.007 A 7 LYS HD2 H 1 1.647 0.000 A 7 LYS HD3 H 1 1.647 0.000 A 7 LYS HE2 H 1 2.994 0.000 A 7 LYS HE3 H 1 2.994 0.000 A 7 LYS HGx H 1 1.057 0.000 A 7 LYS HGy H 1 1.336 0.000 A 7 LYS CA C 13 54.542 0.019 A 7 LYS CB C 13 32.960 0.064 A 7 LYS CD C 13 29.414 0.000 A 7 LYS CE C 13 41.952 0.000 A 7 LYS CG C 13 24.214 0.009 A 7 LYS N N 15 123.314 0.042 A 8 PRO HA H 1 4.237 0.007 A 8 PRO HBx H 1 1.526 0.012 A 8 PRO HBy H 1 2.390 0.000 A 8 PRO HDx H 1 2.926 0.000 A 8 PRO HDy H 1 3.322 0.000 A 8 PRO HGx H 1 1.539 0.000 A 8 PRO HGy H 1 1.625 0.000 A 8 PRO C C 13 177.256 0.000 A 8 PRO CA C 13 62.899 0.089 A 8 PRO CB C 13 31.806 0.018 A 8 PRO CD C 13 50.756 0.022 A 8 PRO CG C 13 27.975 0.011 A 9 ARG H H 1 8.914 0.003 A 9 ARG HA H 1 4.127 0.000 A 9 ARG HB2 H 1 1.763 0.000 A 9 ARG HB3 H 1 1.763 0.000 A 9 ARG HDx H 1 3.146 0.000 A 9 ARG HDy H 1 3.206 0.000 A 9 ARG HGx H 1 1.675 0.000 A 9 ARG HGy H 1 1.928 0.000 A 9 ARG C C 13 178.935 0.000 A 9 ARG CA C 13 56.593 0.020 A 9 ARG CB C 13 30.292 0.003 A 9 ARG CD C 13 43.086 0.008 A 9 ARG CG C 13 26.917 0.004 A 9 ARG N N 15 124.175 0.021 A 10 GLY H H 1 8.621 0.002 A 10 GLY HAx H 1 3.643 0.004 A 10 GLY HAy H 1 3.889 0.006 A 10 GLY C C 13 174.366 0.000 A 10 GLY CA C 13 45.288 0.058 A 10 GLY N N 15 110.777 0.030 A 11 LYS H H 1 7.628 0.005 A 11 LYS HA H 1 4.083 0.003 A 11 LYS HB2 H 1 1.543 0.000 A 11 LYS HB3 H 1 1.534 0.008 A 11 LYS HD2 H 1 1.490 0.000 A 11 LYS HEx H 1 2.554 0.000 A 11 LYS HEy H 1 2.792 0.000 A 11 LYS HGx H 1 0.858 0.000 A 11 LYS HGy H 1 1.178 0.000 A 11 LYS C C 13 177.975 0.000 A 11 LYS CA C 13 56.427 0.042 A 11 LYS CB C 13 32.051 0.038 A 11 LYS CD C 13 29.398 0.002 A 11 LYS CE C 13 41.558 0.010 A 11 LYS CG C 13 24.393 0.050 A 11 LYS N N 15 119.463 0.053 A 12 MET H H 1 8.969 0.005 A 12 MET HA H 1 4.389 0.007 A 12 MET HBx H 1 1.385 0.009 A 12 MET HBy H 1 1.559 0.014 A 12 MET HE% H 1 1.192 0.000 A 12 MET HGx H 1 2.015 0.000 A 12 MET HGy H 1 2.146 0.001 A 12 MET C C 13 176.746 0.000 A 12 MET CA C 13 54.936 0.023 A 12 MET CB C 13 35.098 0.021 A 12 MET CE C 13 15.511 0.007 A 12 MET CG C 13 31.961 0.057 A 12 MET N N 15 124.112 0.026 A 13 SER H H 1 8.150 0.003 A 13 SER HA H 1 4.616 0.006 A 13 SER HBx H 1 4.081 0.001 A 13 SER HBy H 1 4.511 0.000 A 13 SER C C 13 175.799 0.000 A 13 SER CA C 13 57.056 0.048 A 13 SER CB C 13 65.745 0.023 A 13 SER N N 15 118.524 0.015 A 14 SER H H 1 9.294 0.002 A 14 SER HA H 1 4.386 0.002 A 14 SER HBx H 1 4.126 0.002 A 14 SER HBy H 1 4.156 0.000 A 14 SER C C 13 177.317 0.000 A 14 SER CA C 13 61.412 0.029 A 14 SER CB C 13 62.444 0.064 A 14 SER N N 15 115.999 0.026 A 15 TYR H H 1 7.913 0.003 A 15 TYR HA H 1 2.886 0.010 A 15 TYR HBx H 1 2.344 0.004 A 15 TYR HBy H 1 2.371 0.019 A 15 TYR HDx H 1 5.811 0.001 A 15 TYR HDy H 1 5.811 0.001 A 15 TYR HEx H 1 6.349 0.001 A 15 TYR HEy H 1 6.349 0.001 A 15 TYR C C 13 177.310 0.000 A 15 TYR CA C 13 60.365 0.009 A 15 TYR CB C 13 38.088 0.067 A 15 TYR CDx C 13 132.386 0.002 A 15 TYR CDy C 13 132.386 0.002 A 15 TYR CEx C 13 117.394 0.004 A 15 TYR CEy C 13 117.394 0.004 A 15 TYR N N 15 121.512 0.014 A 16 ALA H H 1 7.879 0.005 A 16 ALA HA H 1 3.602 0.004 A 16 ALA HB% H 1 1.327 0.006 A 16 ALA C C 13 182.068 0.000 A 16 ALA CA C 13 55.388 0.020 A 16 ALA CB C 13 18.171 0.055 A 16 ALA N N 15 121.554 0.061 A 17 PHE H H 1 8.219 0.004 A 17 PHE HA H 1 4.147 0.009 A 17 PHE HBx H 1 3.372 0.006 A 17 PHE HBy H 1 3.644 0.007 A 17 PHE HDx H 1 7.604 0.000 A 17 PHE HDy H 1 7.604 0.000 A 17 PHE HEx H 1 7.328 0.000 A 17 PHE HEy H 1 7.328 0.000 A 17 PHE HZ H 1 7.106 0.000 A 17 PHE C C 13 180.287 0.000 A 17 PHE CA C 13 63.688 0.059 A 17 PHE CB C 13 39.751 0.026 A 17 PHE CDx C 13 132.077 0.010 A 17 PHE CDy C 13 132.077 0.010 A 17 PHE CEx C 13 132.085 0.001 A 17 PHE CEy C 13 132.085 0.001 A 17 PHE CZ C 13 129.330 0.000 A 17 PHE N N 15 116.486 0.007 A 18 PHE H H 1 8.079 0.008 A 18 PHE HA H 1 3.728 0.000 A 18 PHE HBx H 1 2.113 0.000 A 18 PHE HBy H 1 2.609 0.000 A 18 PHE HDx H 1 6.437 0.002 A 18 PHE HDy H 1 6.437 0.002 A 18 PHE HEx H 1 7.393 0.000 A 18 PHE HEy H 1 7.393 0.000 A 18 PHE HZ H 1 7.110 0.001 A 18 PHE C C 13 178.450 0.000 A 18 PHE CA C 13 60.944 0.002 A 18 PHE CB C 13 38.501 0.041 A 18 PHE CDx C 13 132.069 0.000 A 18 PHE CDy C 13 132.069 0.000 A 18 PHE CEx C 13 131.238 0.000 A 18 PHE CEy C 13 131.238 0.000 A 18 PHE CZ C 13 129.810 0.001 A 18 PHE N N 15 124.588 0.051 A 19 VAL H H 1 8.536 0.006 A 19 VAL HA H 1 2.999 0.000 A 19 VAL HB H 1 1.758 0.001 A 19 VAL HGx% H 1 0.286 0.003 A 19 VAL HGy% H 1 0.816 0.001 A 19 VAL C C 13 179.235 0.000 A 19 VAL CA C 13 67.155 0.017 A 19 VAL CB C 13 31.265 0.075 A 19 VAL CGy C 13 22.850 0.002 A 19 VAL CGx C 13 21.414 0.008 A 19 VAL N N 15 122.571 0.034 A 20 GLN H H 1 8.130 0.006 A 20 GLN HA H 1 3.864 0.012 A 20 GLN HB2 H 1 2.065 0.007 A 20 GLN HB3 H 1 2.065 0.007 A 20 GLN HE21 H 1 6.667 0.000 A 20 GLN HE22 H 1 7.597 0.000 A 20 GLN HG2 H 1 2.276 0.013 A 20 GLN HG3 H 1 2.276 0.013 A 20 GLN C C 13 179.608 0.000 A 20 GLN CA C 13 59.599 0.098 A 20 GLN CB C 13 28.988 0.030 A 20 GLN CG C 13 33.775 0.026 A 20 GLN N N 15 118.387 0.046 A 20 GLN NE2 N 15 110.554 0.002 A 21 THR H H 1 8.150 0.005 A 21 THR HA H 1 4.132 0.000 A 21 THR HB H 1 4.534 0.000 A 21 THR HG2% H 1 1.550 0.000 A 21 THR C C 13 178.154 0.000 A 21 THR CA C 13 67.176 0.035 A 21 THR CB C 13 68.901 0.005 A 21 THR CG2 C 13 21.377 0.064 A 21 THR N N 15 116.315 0.036 A 22 CYS H H 1 8.361 0.008 A 22 CYS HA H 1 4.118 0.007 A 22 CYS HBx H 1 2.493 0.006 A 22 CYS HBy H 1 2.953 0.012 A 22 CYS C C 13 179.499 0.000 A 22 CYS CA C 13 63.859 0.098 A 22 CYS CB C 13 27.007 0.067 A 22 CYS N N 15 120.604 0.040 A 23 ARG H H 1 8.883 0.002 A 23 ARG HA H 1 3.756 0.000 A 23 ARG HBx H 1 1.750 0.001 A 23 ARG HBy H 1 1.959 0.000 A 23 ARG HDx H 1 2.652 0.000 A 23 ARG HDy H 1 2.736 0.001 A 23 ARG HGx H 1 1.297 0.000 A 23 ARG HGy H 1 1.390 0.000 A 23 ARG C C 13 179.433 0.000 A 23 ARG CA C 13 59.667 0.011 A 23 ARG CB C 13 29.637 0.034 A 23 ARG CD C 13 42.985 0.010 A 23 ARG CG C 13 27.337 0.015 A 23 ARG N N 15 122.556 0.027 A 24 GLU H H 1 8.160 0.005 A 24 GLU HA H 1 4.041 0.000 A 24 GLU HBx H 1 2.146 0.000 A 24 GLU HBy H 1 2.254 0.001 A 24 GLU HGx H 1 2.334 0.000 A 24 GLU HGy H 1 2.470 0.000 A 24 GLU C C 13 180.566 0.000 A 24 GLU CA C 13 59.396 0.000 A 24 GLU CB C 13 29.272 0.012 A 24 GLU CG C 13 36.288 0.004 A 24 GLU N N 15 120.155 0.034 A 25 GLU H H 1 8.262 0.004 A 25 GLU HA H 1 4.058 0.000 A 25 GLU HBx H 1 2.139 0.000 A 25 GLU HBy H 1 2.219 0.000 A 25 GLU HGx H 1 2.333 0.000 A 25 GLU HGy H 1 2.471 0.000 A 25 GLU C C 13 180.029 0.000 A 25 GLU CA C 13 59.291 0.000 A 25 GLU CB C 13 29.647 0.066 A 25 GLU CG C 13 36.303 0.002 A 25 GLU N N 15 119.304 0.029 A 26 HIS H H 1 8.234 0.005 A 26 HIS HA H 1 4.228 0.004 A 26 HIS HBx H 1 3.161 0.004 A 26 HIS HBy H 1 3.277 0.003 A 26 HIS HD2 H 1 6.865 0.000 A 26 HIS HE1 H 1 7.504 0.000 A 26 HIS C C 13 178.349 0.000 A 26 HIS CA C 13 60.870 0.017 A 26 HIS CB C 13 31.110 0.081 A 26 HIS CD2 C 13 119.290 0.000 A 26 HIS CE1 C 13 138.226 0.000 A 26 HIS N N 15 119.771 0.049 A 27 LYS H H 1 7.984 0.005 A 27 LYS HA H 1 3.978 0.009 A 27 LYS HB2 H 1 1.887 0.005 A 27 LYS HB3 H 1 1.887 0.005 A 27 LYS HD2 H 1 1.687 0.000 A 27 LYS HD3 H 1 1.687 0.000 A 27 LYS HE2 H 1 2.940 0.000 A 27 LYS HE3 H 1 2.940 0.000 A 27 LYS HG2 H 1 1.553 0.001 A 27 LYS HG3 H 1 1.553 0.001 A 27 LYS C C 13 179.155 0.000 A 27 LYS CA C 13 58.453 0.114 A 27 LYS CB C 13 32.390 0.086 A 27 LYS CD C 13 29.278 0.064 A 27 LYS CE C 13 42.012 0.000 A 27 LYS CG C 13 24.987 0.005 A 27 LYS N N 15 117.630 0.021 A 28 LYS H H 1 7.496 0.007 A 28 LYS HA H 1 3.986 0.007 A 28 LYS HBx H 1 1.886 0.002 A 28 LYS HBy H 1 1.984 0.000 A 28 LYS HD2 H 1 1.686 0.000 A 28 LYS HD3 H 1 1.686 0.000 A 28 LYS HE2 H 1 2.944 0.000 A 28 LYS HE3 H 1 2.944 0.000 A 28 LYS HGx H 1 1.403 0.000 A 28 LYS HGy H 1 1.566 0.000 A 28 LYS C C 13 179.462 0.000 A 28 LYS CA C 13 58.526 0.020 A 28 LYS CB C 13 32.611 0.068 A 28 LYS CD C 13 29.283 0.028 A 28 LYS CE C 13 41.963 0.000 A 28 LYS CG C 13 25.340 0.004 A 28 LYS N N 15 116.168 0.032 A 29 LYS H H 1 7.439 0.006 A 29 LYS HA H 1 3.979 0.009 A 29 LYS HBx H 1 1.300 0.013 A 29 LYS HBy H 1 1.531 0.008 A 29 LYS HD2 H 1 1.599 0.000 A 29 LYS HE2 H 1 2.932 0.000 A 29 LYS HE3 H 1 2.932 0.000 A 29 LYS HGx H 1 1.096 0.000 A 29 LYS HGy H 1 1.309 0.000 A 29 LYS C C 13 177.422 0.000 A 29 LYS CA C 13 57.474 0.049 A 29 LYS CB C 13 33.771 0.034 A 29 LYS CD C 13 28.889 0.034 A 29 LYS CE C 13 42.057 0.011 A 29 LYS CG C 13 25.234 0.001 A 29 LYS N N 15 116.319 0.046 A 30 HIS H H 1 8.030 0.004 A 30 HIS HA H 1 4.990 0.011 A 30 HIS HBx H 1 2.613 0.009 A 30 HIS HBy H 1 2.823 0.007 A 30 HIS HD2 H 1 6.513 0.000 A 30 HIS HE1 H 1 7.786 0.000 A 30 HIS CA C 13 52.548 0.095 A 30 HIS CB C 13 29.144 0.087 A 30 HIS CD2 C 13 122.393 0.000 A 30 HIS CE1 C 13 137.985 0.000 A 30 HIS N N 15 115.706 0.084 A 31 PRO HA H 1 4.501 0.002 A 31 PRO HBx H 1 1.926 0.004 A 31 PRO HBy H 1 2.366 0.002 A 31 PRO HDx H 1 3.301 0.000 A 31 PRO HDy H 1 3.550 0.000 A 31 PRO HGx H 1 1.924 0.000 A 31 PRO HGy H 1 1.987 0.000 A 31 PRO C C 13 178.605 0.000 A 31 PRO CA C 13 64.856 0.061 A 31 PRO CB C 13 31.878 0.032 A 31 PRO CD C 13 50.118 0.013 A 31 PRO CG C 13 27.086 0.000 A 32 ASP H H 1 8.520 0.004 A 32 ASP HA H 1 4.665 0.009 A 32 ASP HBx H 1 2.664 0.002 A 32 ASP HBy H 1 2.767 0.010 A 32 ASP C C 13 176.840 0.000 A 32 ASP CA C 13 53.745 0.008 A 32 ASP CB C 13 40.886 0.040 A 32 ASP N N 15 115.547 0.010 A 33 ALA H H 1 7.494 0.003 A 33 ALA HA H 1 4.431 0.004 A 33 ALA HB% H 1 1.421 0.001 A 33 ALA C C 13 178.778 0.000 A 33 ALA CA C 13 52.119 0.021 A 33 ALA CB C 13 20.290 0.028 A 33 ALA N N 15 122.453 0.016 A 34 SER H H 1 8.567 0.002 A 34 SER HA H 1 4.507 0.006 A 34 SER HB2 H 1 3.812 0.000 A 34 SER HB3 H 1 3.814 0.002 A 34 SER C C 13 175.445 0.000 A 34 SER CA C 13 57.848 0.041 A 34 SER CB C 13 63.625 0.025 A 34 SER N N 15 117.373 0.020 A 35 VAL H H 1 8.319 0.002 A 35 VAL HA H 1 3.983 0.003 A 35 VAL HB H 1 1.665 0.005 A 35 VAL HGx% H 1 0.348 0.000 A 35 VAL HGy% H 1 0.534 0.000 A 35 VAL C C 13 176.077 0.000 A 35 VAL CA C 13 61.354 0.012 A 35 VAL CB C 13 33.404 0.048 A 35 VAL CGy C 13 20.679 0.000 A 35 VAL CGx C 13 20.528 0.003 A 35 VAL N N 15 122.324 0.023 A 36 ASN H H 1 8.656 0.006 A 36 ASN HA H 1 4.779 0.000 A 36 ASN HBx H 1 2.783 0.003 A 36 ASN HBy H 1 2.932 0.005 A 36 ASN HD21 H 1 7.051 0.000 A 36 ASN HD22 H 1 7.719 0.000 A 36 ASN C C 13 176.712 0.000 A 36 ASN CA C 13 52.464 0.009 A 36 ASN CB C 13 38.618 0.041 A 36 ASN N N 15 124.887 0.021 A 36 ASN ND2 N 15 112.904 0.002 A 37 PHE H H 1 9.000 0.006 A 37 PHE HA H 1 4.036 0.005 A 37 PHE HBx H 1 3.003 0.013 A 37 PHE HBy H 1 3.072 0.003 A 37 PHE HDx H 1 7.081 0.000 A 37 PHE HDy H 1 7.081 0.000 A 37 PHE HEx H 1 7.003 0.000 A 37 PHE HEy H 1 7.003 0.000 A 37 PHE HZ H 1 7.087 0.000 A 37 PHE C C 13 178.625 0.000 A 37 PHE CA C 13 62.154 0.062 A 37 PHE CB C 13 38.985 0.030 A 37 PHE CDx C 13 131.239 0.008 A 37 PHE CDy C 13 131.239 0.008 A 37 PHE CEx C 13 131.282 0.001 A 37 PHE CEy C 13 131.282 0.001 A 37 PHE CZ C 13 129.566 0.008 A 37 PHE N N 15 126.002 0.046 A 38 SER H H 1 8.645 0.004 A 38 SER HA H 1 4.109 0.000 A 38 SER HBx H 1 3.677 0.000 A 38 SER HBy H 1 3.750 0.000 A 38 SER C C 13 178.043 0.000 A 38 SER CA C 13 62.113 0.042 A 38 SER CB C 13 62.362 0.036 A 38 SER N N 15 116.083 0.014 A 39 GLU H H 1 7.795 0.003 A 39 GLU HA H 1 4.062 0.000 A 39 GLU HBx H 1 2.017 0.000 A 39 GLU HBy H 1 2.073 0.000 A 39 GLU HGx H 1 2.214 0.000 A 39 GLU HGy H 1 2.331 0.000 A 39 GLU C C 13 179.743 0.000 A 39 GLU CA C 13 58.726 0.003 A 39 GLU CB C 13 29.887 0.032 A 39 GLU CG C 13 36.239 0.044 A 39 GLU N N 15 121.496 0.008 A 40 PHE H H 1 8.578 0.003 A 40 PHE HA H 1 4.036 0.001 A 40 PHE HBx H 1 2.764 0.000 A 40 PHE HBy H 1 2.982 0.000 A 40 PHE HDx H 1 6.899 0.000 A 40 PHE HDy H 1 6.899 0.000 A 40 PHE HEx H 1 6.894 0.000 A 40 PHE HEy H 1 6.894 0.000 A 40 PHE HZ H 1 6.809 0.000 A 40 PHE C C 13 178.959 0.000 A 40 PHE CA C 13 61.762 0.107 A 40 PHE CB C 13 39.928 0.016 A 40 PHE CDx C 13 131.452 0.006 A 40 PHE CDy C 13 131.452 0.006 A 40 PHE CEx C 13 131.113 0.005 A 40 PHE CEy C 13 131.113 0.005 A 40 PHE CZ C 13 129.023 0.003 A 40 PHE N N 15 121.185 0.022 A 41 SER H H 1 8.559 0.003 A 41 SER HA H 1 3.755 0.000 A 41 SER HBx H 1 3.681 0.000 A 41 SER HBy H 1 3.748 0.000 A 41 SER C C 13 177.666 0.000 A 41 SER CA C 13 61.842 0.034 A 41 SER CB C 13 62.531 0.077 A 41 SER N N 15 114.325 0.014 A 42 LYS H H 1 7.471 0.003 A 42 LYS HA H 1 4.067 0.001 A 42 LYS HBx H 1 1.874 0.000 A 42 LYS HBy H 1 1.983 0.000 A 42 LYS HD2 H 1 1.486 0.000 A 42 LYS HD3 H 1 1.486 0.000 A 42 LYS HE2 H 1 2.944 0.000 A 42 LYS HE3 H 1 2.944 0.000 A 42 LYS HGx H 1 1.409 0.000 A 42 LYS HGy H 1 1.486 0.000 A 42 LYS C C 13 180.095 0.000 A 42 LYS CA C 13 59.495 0.015 A 42 LYS CB C 13 32.382 0.154 A 42 LYS CD C 13 29.089 0.000 A 42 LYS CE C 13 41.985 0.000 A 42 LYS CG C 13 24.871 0.036 A 42 LYS N N 15 121.621 0.010 A 43 LYS H H 1 7.788 0.007 A 43 LYS HA H 1 4.075 0.010 A 43 LYS HBx H 1 1.786 0.000 A 43 LYS HBy H 1 1.810 0.006 A 43 LYS HD2 H 1 1.623 0.000 A 43 LYS HE2 H 1 2.928 0.000 A 43 LYS HE3 H 1 2.928 0.000 A 43 LYS HGx H 1 1.413 0.000 A 43 LYS HGy H 1 1.520 0.000 A 43 LYS C C 13 181.348 0.000 A 43 LYS CA C 13 59.098 0.029 A 43 LYS CB C 13 31.702 0.007 A 43 LYS CD C 13 28.858 0.000 A 43 LYS CE C 13 41.939 0.000 A 43 LYS CG C 13 25.007 0.011 A 43 LYS N N 15 119.163 0.014 A 44 CYS H H 1 8.071 0.008 A 44 CYS HA H 1 4.110 0.006 A 44 CYS HBx H 1 2.589 0.015 A 44 CYS HBy H 1 3.074 0.003 A 44 CYS C C 13 177.925 0.000 A 44 CYS CA C 13 64.320 0.064 A 44 CYS CB C 13 26.927 0.053 A 44 CYS N N 15 117.281 0.012 A 45 SER H H 1 8.387 0.003 A 45 SER HA H 1 4.268 0.000 A 45 SER HBx H 1 4.013 0.001 A 45 SER HBy H 1 4.074 0.000 A 45 SER C C 13 178.326 0.000 A 45 SER CA C 13 62.152 0.012 A 45 SER CB C 13 62.795 0.058 A 45 SER N N 15 117.053 0.015 A 46 GLU H H 1 7.988 0.006 A 46 GLU HA H 1 4.079 0.015 A 46 GLU HBx H 1 2.098 0.000 A 46 GLU HBy H 1 2.191 0.000 A 46 GLU HGx H 1 2.334 0.000 A 46 GLU HGy H 1 2.462 0.000 A 46 GLU C C 13 180.437 0.000 A 46 GLU CA C 13 59.298 0.010 A 46 GLU CB C 13 29.561 0.006 A 46 GLU CG C 13 36.409 0.141 A 46 GLU N N 15 120.506 0.036 A 47 ARG H H 1 7.954 0.014 A 47 ARG HA H 1 4.162 0.000 A 47 ARG HBx H 1 2.150 0.000 A 47 ARG HBy H 1 2.231 0.010 A 47 ARG HDx H 1 3.209 0.000 A 47 ARG HDy H 1 3.367 0.000 A 47 ARG HGx H 1 1.869 0.000 A 47 ARG HGy H 1 1.934 0.000 A 47 ARG C C 13 179.987 0.000 A 47 ARG CA C 13 58.640 0.067 A 47 ARG CB C 13 30.582 0.113 A 47 ARG CD C 13 43.656 0.074 A 47 ARG CG C 13 27.380 0.033 A 47 ARG N N 15 119.074 0.026 A 48 TRP H H 1 8.721 0.006 A 48 TRP HA H 1 4.356 0.005 A 48 TRP HBx H 1 3.333 0.012 A 48 TRP HBy H 1 3.390 0.002 A 48 TRP HD1 H 1 6.961 0.000 A 48 TRP HE1 H 1 10.174 0.000 A 48 TRP HE3 H 1 6.122 0.000 A 48 TRP HH2 H 1 7.090 0.000 A 48 TRP HZ2 H 1 7.586 0.000 A 48 TRP HZ3 H 1 6.436 0.000 A 48 TRP C C 13 179.340 0.000 A 48 TRP CA C 13 59.689 0.037 A 48 TRP CB C 13 30.744 0.048 A 48 TRP CD1 C 13 127.430 0.005 A 48 TRP CE3 C 13 121.442 0.000 A 48 TRP CH2 C 13 123.806 0.005 A 48 TRP CZ2 C 13 114.238 0.007 A 48 TRP CZ3 C 13 121.812 0.012 A 48 TRP N N 15 120.896 0.024 A 48 TRP NE1 N 15 127.836 0.001 A 49 LYS H H 1 7.684 0.007 A 49 LYS HA H 1 4.031 0.000 A 49 LYS HBx H 1 1.969 0.002 A 49 LYS HBy H 1 1.972 0.000 A 49 LYS HD2 H 1 1.705 0.000 A 49 LYS HD3 H 1 1.705 0.000 A 49 LYS HE2 H 1 2.935 0.000 A 49 LYS HE3 H 1 2.935 0.000 A 49 LYS HGx H 1 1.514 0.001 A 49 LYS HGy H 1 1.729 0.000 A 49 LYS C C 13 179.267 0.000 A 49 LYS CA C 13 58.932 0.008 A 49 LYS CB C 13 32.960 0.056 A 49 LYS CD C 13 29.576 0.050 A 49 LYS CE C 13 41.988 0.000 A 49 LYS CG C 13 25.521 0.017 A 49 LYS N N 15 114.334 0.012 A 50 THR H H 1 7.414 0.006 A 50 THR HA H 1 4.387 0.002 A 50 THR HB H 1 4.462 0.007 A 50 THR HG2% H 1 1.261 0.001 A 50 THR C C 13 176.014 0.000 A 50 THR CA C 13 61.360 0.027 A 50 THR CB C 13 69.777 0.033 A 50 THR CG2 C 13 21.736 0.038 A 50 THR N N 15 106.338 0.015 A 51 MET H H 1 7.133 0.005 A 51 MET HA H 1 4.208 0.000 A 51 MET HBx H 1 1.650 0.000 A 51 MET HBy H 1 1.819 0.000 A 51 MET HE% H 1 1.814 0.000 A 51 MET HG2 H 1 2.536 0.000 A 51 MET HG3 H 1 2.536 0.000 A 51 MET C C 13 177.029 0.000 A 51 MET CA C 13 56.413 0.000 A 51 MET CB C 13 35.103 0.039 A 51 MET CE C 13 16.366 0.003 A 51 MET CG C 13 31.449 0.018 A 51 MET N N 15 123.497 0.076 A 52 SER H H 1 9.002 0.003 A 52 SER HA H 1 4.354 0.003 A 52 SER HBx H 1 4.072 0.005 A 52 SER HBy H 1 4.340 0.000 A 52 SER C C 13 175.791 0.000 A 52 SER CA C 13 57.199 0.100 A 52 SER CB C 13 65.433 0.036 A 52 SER N N 15 119.527 0.013 A 53 ALA H H 1 8.862 0.005 A 53 ALA HA H 1 3.919 0.005 A 53 ALA HB% H 1 1.431 0.001 A 53 ALA C C 13 182.403 0.000 A 53 ALA CA C 13 55.462 0.026 A 53 ALA CB C 13 17.818 0.028 A 53 ALA N N 15 123.016 0.018 A 54 LYS H H 1 8.254 0.004 A 54 LYS HA H 1 4.057 0.003 A 54 LYS HB2 H 1 1.857 0.003 A 54 LYS HB3 H 1 1.857 0.003 A 54 LYS HD2 H 1 1.715 0.000 A 54 LYS HD3 H 1 1.715 0.000 A 54 LYS HE2 H 1 2.948 0.000 A 54 LYS HE3 H 1 2.948 0.000 A 54 LYS HG2 H 1 1.435 0.000 A 54 LYS HG3 H 1 1.435 0.000 A 54 LYS C C 13 180.752 0.000 A 54 LYS CA C 13 59.106 0.019 A 54 LYS CB C 13 32.398 0.008 A 54 LYS CD C 13 28.827 0.000 A 54 LYS CE C 13 41.833 0.000 A 54 LYS CG C 13 24.896 0.000 A 54 LYS N N 15 117.698 0.017 A 55 GLU H H 1 7.652 0.004 A 55 GLU HA H 1 4.071 0.002 A 55 GLU HBx H 1 2.144 0.001 A 55 GLU HBy H 1 2.217 0.001 A 55 GLU HG2 H 1 2.376 0.000 A 55 GLU HG3 H 1 2.376 0.000 A 55 GLU C C 13 179.888 0.000 A 55 GLU CA C 13 59.121 0.098 A 55 GLU CB C 13 30.230 0.054 A 55 GLU CG C 13 37.686 0.096 A 55 GLU N N 15 120.039 0.027 A 56 LYS H H 1 8.115 0.005 A 56 LYS HA H 1 4.098 0.000 A 56 LYS HBx H 1 1.566 0.000 A 56 LYS HBy H 1 1.766 0.000 A 56 LYS HDx H 1 0.819 0.000 A 56 LYS HDy H 1 0.866 0.000 A 56 LYS HEx H 1 1.245 0.000 A 56 LYS HEy H 1 1.928 0.000 A 56 LYS HGx H 1 -0.012 0.000 A 56 LYS HGy H 1 0.997 0.000 A 56 LYS C C 13 180.132 0.000 A 56 LYS CA C 13 59.502 0.001 A 56 LYS CB C 13 32.855 0.000 A 56 LYS CD C 13 29.199 0.004 A 56 LYS CE C 13 41.971 0.006 A 56 LYS CG C 13 26.238 0.001 A 56 LYS N N 15 116.710 0.020 A 57 GLY H H 1 7.855 0.004 A 57 GLY HAx H 1 3.863 0.000 A 57 GLY HAy H 1 4.032 0.000 A 57 GLY C C 13 176.353 0.000 A 57 GLY CA C 13 47.874 0.049 A 57 GLY N N 15 106.706 0.008 A 58 LYS H H 1 7.865 0.003 A 58 LYS HA H 1 4.067 0.007 A 58 LYS HBx H 1 1.337 0.008 A 58 LYS HBy H 1 1.641 0.006 A 58 LYS HD2 H 1 1.476 0.000 A 58 LYS HD3 H 1 1.476 0.000 A 58 LYS HEx H 1 2.562 0.000 A 58 LYS HEy H 1 2.792 0.000 A 58 LYS HGx H 1 0.820 0.000 A 58 LYS HGy H 1 0.873 0.000 A 58 LYS C C 13 179.696 0.000 A 58 LYS CA C 13 58.964 0.009 A 58 LYS CB C 13 31.733 0.091 A 58 LYS CD C 13 29.089 0.000 A 58 LYS CE C 13 41.726 0.015 A 58 LYS CG C 13 23.627 0.018 A 58 LYS N N 15 119.114 0.010 A 59 PHE H H 1 7.284 0.003 A 59 PHE HA H 1 4.457 0.013 A 59 PHE HBx H 1 3.399 0.008 A 59 PHE HBy H 1 4.129 0.007 A 59 PHE HDx H 1 7.604 0.000 A 59 PHE HDy H 1 7.604 0.000 A 59 PHE HEx H 1 7.732 0.000 A 59 PHE HEy H 1 7.732 0.000 A 59 PHE HZ H 1 7.800 0.000 A 59 PHE C C 13 179.638 0.000 A 59 PHE CA C 13 60.845 0.052 A 59 PHE CB C 13 38.788 0.162 A 59 PHE CDx C 13 132.157 0.012 A 59 PHE CDy C 13 132.157 0.012 A 59 PHE CEx C 13 132.179 0.000 A 59 PHE CEy C 13 132.179 0.000 A 59 PHE CZ C 13 130.459 0.000 A 59 PHE N N 15 119.468 0.062 A 60 GLU H H 1 8.405 0.003 A 60 GLU HA H 1 4.442 0.000 A 60 GLU HBx H 1 2.241 0.000 A 60 GLU HBy H 1 2.349 0.000 A 60 GLU HGx H 1 2.514 0.000 A 60 GLU HGy H 1 2.571 0.000 A 60 GLU C C 13 181.322 0.000 A 60 GLU CA C 13 59.269 0.014 A 60 GLU CB C 13 28.860 0.085 A 60 GLU CG C 13 35.921 0.032 A 60 GLU N N 15 121.775 0.029 A 61 ASP H H 1 8.607 0.004 A 61 ASP HA H 1 4.446 0.001 A 61 ASP HBx H 1 2.587 0.009 A 61 ASP HBy H 1 2.771 0.000 A 61 ASP C C 13 180.889 0.000 A 61 ASP CA C 13 57.675 0.004 A 61 ASP CB C 13 39.619 0.040 A 61 ASP N N 15 120.932 0.042 A 62 MET H H 1 7.380 0.002 A 62 MET HA H 1 3.786 0.000 A 62 MET HBx H 1 0.495 0.001 A 62 MET HBy H 1 1.698 0.000 A 62 MET HE% H 1 1.915 0.000 A 62 MET HGx H 1 2.208 0.000 A 62 MET HGy H 1 2.668 0.000 A 62 MET C C 13 179.675 0.000 A 62 MET CA C 13 59.350 0.003 A 62 MET CB C 13 31.752 0.192 A 62 MET CE C 13 17.957 0.000 A 62 MET CG C 13 32.313 0.076 A 62 MET N N 15 120.526 0.008 A 63 ALA H H 1 7.993 0.006 A 63 ALA HA H 1 4.384 0.007 A 63 ALA HB% H 1 1.780 0.001 A 63 ALA C C 13 181.806 0.000 A 63 ALA CA C 13 55.498 0.056 A 63 ALA CB C 13 18.506 0.028 A 63 ALA N N 15 122.909 0.050 A 64 LYS H H 1 8.577 0.002 A 64 LYS HA H 1 4.131 0.000 A 64 LYS HB2 H 1 2.016 0.000 A 64 LYS HB3 H 1 2.016 0.000 A 64 LYS HD2 H 1 1.755 0.017 A 64 LYS HD3 H 1 1.755 0.017 A 64 LYS HE2 H 1 3.025 0.000 A 64 LYS HE3 H 1 3.025 0.000 A 64 LYS HGx H 1 1.501 0.001 A 64 LYS HGy H 1 1.712 0.001 A 64 LYS C C 13 180.987 0.000 A 64 LYS CA C 13 60.097 0.025 A 64 LYS CB C 13 32.576 0.041 A 64 LYS CD C 13 29.668 0.000 A 64 LYS CE C 13 42.069 0.000 A 64 LYS CG C 13 25.427 0.005 A 64 LYS N N 15 121.944 0.073 A 65 ALA H H 1 7.917 0.006 A 65 ALA HA H 1 4.297 0.006 A 65 ALA HB% H 1 1.556 0.012 A 65 ALA C C 13 181.878 0.000 A 65 ALA CA C 13 54.788 0.043 A 65 ALA CB C 13 17.725 0.033 A 65 ALA N N 15 122.617 0.088 A 66 ASP H H 1 8.361 0.003 A 66 ASP HA H 1 4.937 0.001 A 66 ASP HBx H 1 3.116 0.006 A 66 ASP HBy H 1 3.141 0.012 A 66 ASP C C 13 178.903 0.000 A 66 ASP CA C 13 57.464 0.020 A 66 ASP CB C 13 42.815 0.026 A 66 ASP N N 15 120.199 0.020 A 67 LYS H H 1 8.212 0.009 A 67 LYS HA H 1 4.066 0.004 A 67 LYS HBx H 1 1.998 0.013 A 67 LYS HBy H 1 2.128 0.016 A 67 LYS HD2 H 1 1.777 0.000 A 67 LYS HD3 H 1 1.777 0.000 A 67 LYS HE2 H 1 3.097 0.000 A 67 LYS HE3 H 1 3.097 0.000 A 67 LYS HG2 H 1 1.492 0.000 A 67 LYS HG3 H 1 1.492 0.000 A 67 LYS C C 13 178.960 0.000 A 67 LYS CA C 13 59.765 0.011 A 67 LYS CB C 13 32.476 0.002 A 67 LYS CD C 13 30.029 0.000 A 67 LYS CE C 13 42.406 0.000 A 67 LYS CG C 13 25.066 0.000 A 67 LYS N N 15 120.267 0.040 A 68 ALA H H 1 7.467 0.005 A 68 ALA HA H 1 4.306 0.008 A 68 ALA HB% H 1 1.563 0.017 A 68 ALA C C 13 181.468 0.000 A 68 ALA CA C 13 54.828 0.090 A 68 ALA CB C 13 17.809 0.018 A 68 ALA N N 15 120.487 0.006 A 69 ARG H H 1 7.961 0.003 A 69 ARG HA H 1 4.078 0.000 A 69 ARG HBx H 1 2.055 0.000 A 69 ARG HBy H 1 2.517 0.000 A 69 ARG HGx H 1 1.413 0.000 A 69 ARG HGy H 1 1.495 0.000 A 69 ARG C C 13 179.224 0.000 A 69 ARG CA C 13 59.241 0.079 A 69 ARG CB C 13 27.453 0.051 A 69 ARG CG C 13 24.897 0.000 A 69 ARG N N 15 120.652 0.032 A 70 TYR H H 1 8.593 0.007 A 70 TYR HA H 1 3.992 0.014 A 70 TYR HBx H 1 3.083 0.005 A 70 TYR HBy H 1 3.184 0.000 A 70 TYR HDx H 1 7.211 0.000 A 70 TYR HDy H 1 7.211 0.000 A 70 TYR HEx H 1 6.807 0.000 A 70 TYR HEy H 1 6.807 0.000 A 70 TYR C C 13 177.820 0.000 A 70 TYR CA C 13 62.371 0.014 A 70 TYR CB C 13 39.347 0.040 A 70 TYR CDx C 13 133.423 0.000 A 70 TYR CDy C 13 133.423 0.000 A 70 TYR CEx C 13 118.235 0.000 A 70 TYR CEy C 13 118.235 0.000 A 70 TYR N N 15 121.581 0.021 A 71 GLU H H 1 8.430 0.002 A 71 GLU HA H 1 3.779 0.000 A 71 GLU HBx H 1 2.058 0.000 A 71 GLU HBy H 1 2.152 0.000 A 71 GLU HGx H 1 2.407 0.000 A 71 GLU HGy H 1 2.744 0.000 A 71 GLU C C 13 180.547 0.000 A 71 GLU CA C 13 59.386 0.014 A 71 GLU CB C 13 29.274 0.037 A 71 GLU CG C 13 37.062 0.031 A 71 GLU N N 15 116.694 0.015 A 72 ARG H H 1 8.007 0.005 A 72 ARG HA H 1 4.105 0.008 A 72 ARG HB2 H 1 2.020 0.001 A 72 ARG HB3 H 1 2.020 0.001 A 72 ARG HD2 H 1 3.274 0.000 A 72 ARG HD3 H 1 3.274 0.000 A 72 ARG HGx H 1 1.638 0.000 A 72 ARG HGy H 1 1.758 0.000 A 72 ARG C C 13 180.676 0.000 A 72 ARG CA C 13 59.398 0.012 A 72 ARG CB C 13 30.058 0.044 A 72 ARG CD C 13 43.445 0.000 A 72 ARG CG C 13 27.342 0.042 A 72 ARG N N 15 119.041 0.019 A 73 GLU H H 1 8.483 0.002 A 73 GLU HA H 1 4.020 0.018 A 73 GLU HBx H 1 1.637 0.000 A 73 GLU HBy H 1 2.056 0.036 A 73 GLU HGx H 1 2.163 0.000 A 73 GLU HGy H 1 2.648 0.000 A 73 GLU C C 13 180.892 0.000 A 73 GLU CA C 13 59.356 0.118 A 73 GLU CB C 13 27.460 0.053 A 73 GLU CG C 13 37.627 0.016 A 73 GLU N N 15 119.530 0.008 A 74 MET H H 1 8.449 0.002 A 74 MET HA H 1 4.447 0.001 A 74 MET HBx H 1 1.883 0.000 A 74 MET HBy H 1 1.886 0.003 A 74 MET HE% H 1 2.020 0.000 A 74 MET HGx H 1 1.987 0.000 A 74 MET HGy H 1 2.302 0.000 A 74 MET C C 13 179.791 0.000 A 74 MET CA C 13 55.882 0.000 A 74 MET CB C 13 30.671 0.141 A 74 MET CE C 13 16.189 0.000 A 74 MET CG C 13 32.268 0.064 A 74 MET N N 15 117.100 0.006 A 75 LYS H H 1 7.511 0.004 A 75 LYS HA H 1 4.182 0.005 A 75 LYS HB2 H 1 1.993 0.015 A 75 LYS HB3 H 1 1.993 0.015 A 75 LYS HD2 H 1 1.705 0.000 A 75 LYS HE2 H 1 2.979 0.000 A 75 LYS HE3 H 1 2.979 0.000 A 75 LYS HGx H 1 1.557 0.000 A 75 LYS HGy H 1 1.705 0.000 A 75 LYS C C 13 179.046 0.000 A 75 LYS CA C 13 58.633 0.042 A 75 LYS CB C 13 32.531 0.090 A 75 LYS CD C 13 29.187 0.000 A 75 LYS CE C 13 42.003 0.000 A 75 LYS CG C 13 25.128 0.000 A 75 LYS N N 15 118.484 0.045 A 76 THR H H 1 7.337 0.006 A 76 THR HA H 1 4.391 0.004 A 76 THR HB H 1 4.441 0.000 A 76 THR HG2% H 1 1.203 0.000 A 76 THR C C 13 175.182 0.000 A 76 THR CA C 13 61.352 0.000 A 76 THR CB C 13 69.207 0.082 A 76 THR CG2 C 13 21.693 0.009 A 76 THR N N 15 106.656 0.093 A 77 TYR H H 1 7.495 0.005 A 77 TYR HA H 1 4.532 0.004 A 77 TYR HBx H 1 2.952 0.004 A 77 TYR HBy H 1 3.077 0.004 A 77 TYR HDx H 1 7.087 0.000 A 77 TYR HDy H 1 7.087 0.000 A 77 TYR HEx H 1 6.739 0.000 A 77 TYR HEy H 1 6.739 0.000 A 77 TYR C C 13 175.532 0.000 A 77 TYR CA C 13 58.388 0.055 A 77 TYR CB C 13 39.105 0.033 A 77 TYR CDx C 13 133.223 0.000 A 77 TYR CDy C 13 133.223 0.000 A 77 TYR CEx C 13 117.660 0.000 A 77 TYR CEy C 13 117.660 0.000 A 77 TYR N N 15 123.458 0.037 A 78 ILE H H 1 7.782 0.003 A 78 ILE HA H 1 4.289 0.008 A 78 ILE HB H 1 1.666 0.011 A 78 ILE HD1% H 1 0.799 0.002 A 78 ILE HG1x H 1 1.024 0.000 A 78 ILE HG1y H 1 1.439 0.000 A 78 ILE HG2% H 1 0.801 0.000 A 78 ILE CA C 13 57.281 0.081 A 78 ILE CB C 13 39.063 0.040 A 78 ILE CD1 C 13 12.539 0.000 A 78 ILE CG1 C 13 26.694 0.009 A 78 ILE CG2 C 13 16.899 0.000 A 78 ILE N N 15 128.921 0.030 A 79 PRO HA H 1 4.417 0.009 A 79 PRO HBx H 1 1.905 0.000 A 79 PRO HBy H 1 2.350 0.010 A 79 PRO HDx H 1 3.512 0.012 A 79 PRO HDy H 1 3.597 0.012 A 79 PRO HGx H 1 1.986 0.000 A 79 PRO HGy H 1 2.044 0.000 A 79 PRO CA C 13 61.034 0.045 A 79 PRO CB C 13 30.895 0.032 A 79 PRO CD C 13 50.744 0.013 A 79 PRO CG C 13 27.223 0.002 A 80 PRO HA H 1 4.408 0.006 A 80 PRO HBx H 1 1.904 0.006 A 80 PRO HBy H 1 2.297 0.003 A 80 PRO HDx H 1 3.628 0.009 A 80 PRO HDy H 1 3.859 0.008 A 80 PRO HG2 H 1 2.019 0.009 A 80 PRO HG3 H 1 2.019 0.009 A 80 PRO C C 13 178.001 0.000 A 80 PRO CA C 13 62.759 0.082 A 80 PRO CB C 13 32.112 0.046 A 80 PRO CD C 13 50.591 0.045 A 80 PRO CG C 13 27.410 0.012 A 81 LYS H H 1 8.396 0.003 A 81 LYS HA H 1 4.276 0.009 A 81 LYS HBx H 1 1.809 0.006 A 81 LYS HBy H 1 1.813 0.000 A 81 LYS HD2 H 1 1.698 0.000 A 81 LYS HD3 H 1 1.698 0.000 A 81 LYS HE2 H 1 3.025 0.000 A 81 LYS HE3 H 1 3.025 0.000 A 81 LYS HG2 H 1 1.460 0.000 A 81 LYS HG3 H 1 1.460 0.000 A 81 LYS C C 13 178.331 0.000 A 81 LYS CA C 13 56.655 0.067 A 81 LYS CB C 13 33.123 0.010 A 81 LYS CD C 13 29.078 0.080 A 81 LYS CE C 13 42.151 0.004 A 81 LYS CG C 13 24.643 0.000 A 81 LYS N N 15 121.427 0.035 A 82 GLY H H 1 8.455 0.003 A 82 GLY HA2 H 1 3.949 0.000 A 82 GLY HA3 H 1 3.949 0.000 A 82 GLY C C 13 174.296 0.000 A 82 GLY CA C 13 45.326 0.000 A 82 GLY N N 15 110.760 0.011 A 83 GLU H H 1 7.885 0.002 A 83 GLU HA H 1 4.156 0.002 A 83 GLU HB2 H 1 2.079 0.014 A 83 GLU HB3 H 1 1.869 0.008 A 83 GLU HG2 H 1 2.181 0.005 A 83 GLU HG3 H 1 2.181 0.005 A 83 GLU CA C 13 57.854 0.057 A 83 GLU CB C 13 31.219 0.108 A 83 GLU CG C 13 36.701 0.000 A 83 GLU N N 15 125.324 0.025 B 1 MET HA H 1 4.442 0.013 B 1 MET HBx H 1 2.013 0.013 B 1 MET HBy H 1 2.516 0.002 B 1 MET HG2 H 1 2.507 0.000 B 1 MET C C 13 175.517 0.000 B 1 MET CA C 13 55.540 0.066 B 1 MET CB C 13 32.043 0.184 B 2 GLU H H 1 8.652 0.011 B 2 GLU HA H 1 4.293 0.003 B 2 GLU HBx H 1 1.954 0.027 B 2 GLU HBy H 1 2.039 0.002 B 2 GLU HGx H 1 2.246 0.021 B 2 GLU HGy H 1 2.277 0.000 B 2 GLU C C 13 176.141 0.000 B 2 GLU CA C 13 56.472 0.041 B 2 GLU CB C 13 30.302 0.109 B 2 GLU CG C 13 36.304 0.023 B 2 GLU N N 15 122.378 0.024 B 3 GLU H H 1 8.462 0.005 B 3 GLU HA H 1 4.576 0.005 B 3 GLU HBx H 1 1.891 0.011 B 3 GLU HBy H 1 2.028 0.005 B 3 GLU HG2 H 1 2.290 0.000 B 3 GLU CA C 13 54.349 0.024 B 3 GLU CB C 13 29.930 0.024 B 3 GLU CG C 13 36.285 0.000 B 3 GLU N N 15 123.125 0.016 B 4 PRO HA H 1 4.414 0.011 B 4 PRO HBx H 1 1.902 0.002 B 4 PRO HBy H 1 2.290 0.007 B 4 PRO HDx H 1 3.672 0.000 B 4 PRO HDy H 1 3.790 0.027 B 4 PRO HG2 H 1 2.003 0.032 B 4 PRO C C 13 177.015 0.000 B 4 PRO CA C 13 63.015 0.078 B 4 PRO CB C 13 32.077 0.016 B 4 PRO CD C 13 50.685 0.013 B 4 PRO CG C 13 27.292 0.016 B 5 GLN H H 1 8.566 0.006 B 5 GLN HA H 1 4.351 0.009 B 5 GLN HBx H 1 2.050 0.044 B 5 GLN HBy H 1 2.119 0.004 B 5 GLN HE21 H 1 6.896 0.000 B 5 GLN HE22 H 1 7.612 0.000 B 5 GLN HG2 H 1 2.385 0.025 B 5 GLN C C 13 175.982 0.000 B 5 GLN CA C 13 55.581 0.002 B 5 GLN CB C 13 29.622 0.106 B 5 GLN CG C 13 33.902 0.022 B 5 GLN N N 15 120.568 0.027 B 5 GLN NE2 N 15 112.661 0.001 B 6 SER H H 1 8.393 0.005 B 6 SER HA H 1 4.434 0.005 B 6 SER HBx H 1 3.826 0.002 B 6 SER HBy H 1 3.867 0.001 B 6 SER C C 13 173.295 0.000 B 6 SER CA C 13 58.268 0.090 B 6 SER CB C 13 64.022 0.003 B 6 SER N N 15 117.321 0.010 B 7 ASP H H 1 8.446 0.005 B 7 ASP HA H 1 4.912 0.010 B 7 ASP HBx H 1 2.543 0.010 B 7 ASP HBy H 1 2.786 0.005 B 7 ASP CA C 13 52.187 0.042 B 7 ASP CB C 13 41.286 0.021 B 7 ASP N N 15 123.218 0.033 B 8 PRO HA H 1 4.448 0.013 B 8 PRO HBx H 1 1.902 0.003 B 8 PRO HBy H 1 2.280 0.011 B 8 PRO HDx H 1 3.677 0.000 B 8 PRO HDy H 1 3.834 0.012 B 8 PRO HG2 H 1 2.010 0.000 B 8 PRO C C 13 177.287 0.000 B 8 PRO CA C 13 63.379 0.091 B 8 PRO CB C 13 32.062 0.064 B 8 PRO CD C 13 50.815 0.001 B 8 PRO CG C 13 27.004 0.000 B 9 SER H H 1 8.533 0.004 B 9 SER HA H 1 4.397 0.004 B 9 SER HB2 H 1 3.890 0.005 B 9 SER C C 13 174.237 0.000 B 9 SER CA C 13 58.940 0.000 B 9 SER CB C 13 63.720 0.073 B 9 SER N N 15 115.588 0.012 B 10 VAL H H 1 7.871 0.004 B 10 VAL HA H 1 4.184 0.003 B 10 VAL HB H 1 2.114 0.004 B 10 VAL HGx% H 1 0.922 0.002 B 10 VAL HGy% H 1 0.924 0.001 B 10 VAL C C 13 175.758 0.000 B 10 VAL CA C 13 61.842 0.002 B 10 VAL CB C 13 32.897 0.023 B 10 VAL CGx C 13 20.795 0.015 B 10 VAL CGy C 13 20.810 0.006 B 10 VAL N N 15 120.621 0.015 B 11 GLU H H 1 8.341 0.006 B 11 GLU HA H 1 4.575 0.000 B 11 GLU HBx H 1 1.890 0.000 B 11 GLU HBy H 1 2.035 0.000 B 11 GLU HG2 H 1 2.288 0.000 B 11 GLU CA C 13 54.259 0.048 B 11 GLU CB C 13 29.914 0.028 B 11 GLU CG C 13 35.952 0.000 B 11 GLU N N 15 125.690 0.031 B 12 PRO HD2 H 1 3.866 0.000 B 12 PRO HD3 H 1 3.866 0.000 B 13 PRO HA H 1 4.445 0.000 B 13 PRO HBx H 1 1.902 0.000 B 13 PRO HBy H 1 2.289 0.000 B 13 PRO HDx H 1 3.628 0.000 B 13 PRO HDy H 1 3.797 0.000 B 13 PRO HG2 H 1 1.981 0.000 B 13 PRO C C 13 177.111 0.000 B 13 PRO CA C 13 62.744 0.000 B 13 PRO CB C 13 31.976 0.013 B 13 PRO CD C 13 50.382 0.000 B 13 PRO CG C 13 27.287 0.000 B 14 LEU H H 1 8.353 0.005 B 14 LEU HA H 1 4.323 0.004 B 14 LEU HBx H 1 1.584 0.000 B 14 LEU HBy H 1 1.636 0.012 B 14 LEU HD1% H 1 0.927 0.006 B 14 LEU HD2% H 1 0.886 0.003 B 14 LEU C C 13 177.801 0.000 B 14 LEU CA C 13 55.248 0.058 B 14 LEU CB C 13 42.317 0.068 B 14 LEU CD1 C 13 24.990 0.000 B 14 LEU CD2 C 13 23.670 0.000 B 14 LEU N N 15 121.962 0.013 B 15 SER H H 1 8.345 0.005 B 15 SER HA H 1 4.444 0.007 B 15 SER HBx H 1 3.826 0.000 B 15 SER HBy H 1 3.859 0.023 B 15 SER C C 13 174.336 0.000 B 15 SER CA C 13 58.100 0.000 B 15 SER CB C 13 63.795 0.080 B 15 SER N N 15 116.301 0.012 B 16 GLN H H 1 8.521 0.006 B 16 GLN HA H 1 4.305 0.008 B 16 GLN HBx H 1 1.996 0.016 B 16 GLN HBy H 1 2.120 0.008 B 16 GLN HE21 H 1 6.896 0.000 B 16 GLN HE22 H 1 7.612 0.000 B 16 GLN HG2 H 1 2.328 0.008 B 16 GLN C C 13 176.072 0.000 B 16 GLN CA C 13 56.125 0.016 B 16 GLN CB C 13 29.819 0.001 B 16 GLN CG C 13 33.849 0.000 B 16 GLN N N 15 122.080 0.047 B 16 GLN NE2 N 15 112.661 0.001 B 17 GLU H H 1 8.489 0.005 B 17 GLU HA H 1 4.257 0.008 B 17 GLU HBx H 1 1.923 0.010 B 17 GLU HBy H 1 2.036 0.000 B 17 GLU HG2 H 1 2.219 0.016 B 17 GLU C C 13 176.742 0.000 B 17 GLU CA C 13 57.021 0.002 B 17 GLU CB C 13 30.181 0.001 B 17 GLU CG C 13 36.369 0.027 B 17 GLU N N 15 121.433 0.011 B 18 THR H H 1 8.122 0.004 B 18 THR HA H 1 4.240 0.004 B 18 THR HB H 1 4.124 0.006 B 18 THR HG2% H 1 1.104 0.001 B 18 THR C C 13 174.157 0.000 B 18 THR CA C 13 61.922 0.000 B 18 THR CB C 13 69.708 0.056 B 18 THR CG2 C 13 21.579 0.018 B 18 THR N N 15 114.507 0.014 B 19 PHE H H 1 8.269 0.004 B 19 PHE HA H 1 4.573 0.002 B 19 PHE HBx H 1 3.034 0.005 B 19 PHE HBy H 1 3.139 0.003 B 19 PHE HDx H 1 7.204 0.000 B 19 PHE HDy H 1 7.204 0.000 B 19 PHE HEx H 1 7.295 0.000 B 19 PHE HEy H 1 7.295 0.000 B 19 PHE HZ H 1 7.247 0.000 B 19 PHE C C 13 175.869 0.000 B 19 PHE CA C 13 58.197 0.057 B 19 PHE CB C 13 39.357 0.020 B 19 PHE CDx C 13 131.654 0.000 B 19 PHE CDy C 13 131.654 0.000 B 19 PHE CEx C 13 131.530 0.000 B 19 PHE CEy C 13 131.530 0.000 B 19 PHE CZ C 13 129.797 0.000 B 19 PHE N N 15 121.719 0.026 B 20 SER H H 1 8.123 0.003 B 20 SER HA H 1 4.287 0.005 B 20 SER HBx H 1 3.746 0.004 B 20 SER HBy H 1 3.858 0.000 B 20 SER C C 13 174.320 0.000 B 20 SER CA C 13 58.921 0.005 B 20 SER CB C 13 63.811 0.008 B 20 SER N N 15 116.043 0.026 B 21 ASP H H 1 8.258 0.006 B 21 ASP HA H 1 4.541 0.001 B 21 ASP HBx H 1 2.594 0.007 B 21 ASP HBy H 1 2.703 0.000 B 21 ASP C C 13 177.033 0.000 B 21 ASP CA C 13 54.969 0.016 B 21 ASP CB C 13 40.830 0.068 B 21 ASP N N 15 121.509 0.029 B 22 LEU H H 1 7.934 0.004 B 22 LEU HA H 1 4.069 0.005 B 22 LEU HBx H 1 1.387 0.016 B 22 LEU HBy H 1 1.518 0.006 B 22 LEU HD1% H 1 0.841 0.001 B 22 LEU HD2% H 1 0.772 0.003 B 22 LEU HG H 1 1.536 0.000 B 22 LEU C C 13 178.338 0.000 B 22 LEU CA C 13 56.676 0.063 B 22 LEU CB C 13 41.792 0.011 B 22 LEU CD1 C 13 24.918 0.003 B 22 LEU CD2 C 13 23.476 0.004 B 22 LEU CG C 13 26.881 0.000 B 22 LEU N N 15 120.657 0.014 B 23 TRP H H 1 7.852 0.004 B 23 TRP HA H 1 4.502 0.001 B 23 TRP HBx H 1 3.279 0.007 B 23 TRP HBy H 1 3.299 0.010 B 23 TRP HD1 H 1 7.264 0.000 B 23 TRP HE1 H 1 10.181 0.001 B 23 TRP HE3 H 1 7.527 0.000 B 23 TRP HH2 H 1 7.173 0.000 B 23 TRP HZ2 H 1 7.441 0.000 B 23 TRP HZ3 H 1 7.093 0.000 B 23 TRP C C 13 176.877 0.000 B 23 TRP CA C 13 57.774 0.000 B 23 TRP CB C 13 28.931 0.015 B 23 TRP CD1 C 13 127.091 0.010 B 23 TRP CE3 C 13 120.851 0.007 B 23 TRP CH2 C 13 124.592 0.002 B 23 TRP CZ2 C 13 114.613 0.004 B 23 TRP CZ3 C 13 121.936 0.001 B 23 TRP N N 15 118.551 0.025 B 23 TRP NE1 N 15 128.967 0.008 B 24 LYS H H 1 7.568 0.003 B 24 LYS HA H 1 4.059 0.008 B 24 LYS HBx H 1 1.620 0.018 B 24 LYS HBy H 1 1.706 0.001 B 24 LYS HD2 H 1 1.596 0.000 B 24 LYS HD3 H 1 1.596 0.000 B 24 LYS HE2 H 1 2.922 0.003 B 24 LYS HE3 H 1 2.922 0.003 B 24 LYS HG2 H 1 1.124 0.002 B 24 LYS HG3 H 1 1.124 0.002 B 24 LYS C C 13 176.251 0.000 B 24 LYS CA C 13 56.887 0.027 B 24 LYS CB C 13 32.836 0.014 B 24 LYS CD C 13 29.232 0.005 B 24 LYS CE C 13 42.164 0.013 B 24 LYS CG C 13 24.697 0.028 B 24 LYS N N 15 119.709 0.028 B 25 LEU H H 1 7.831 0.004 B 25 LEU HA H 1 4.285 0.006 B 25 LEU HBx H 1 1.583 0.002 B 25 LEU HBy H 1 1.651 0.002 B 25 LEU HD1% H 1 0.905 0.011 B 25 LEU HD2% H 1 0.850 0.000 B 25 LEU HG H 1 1.622 0.002 B 25 LEU C C 13 177.196 0.000 B 25 LEU CA C 13 54.926 0.005 B 25 LEU CB C 13 42.356 0.008 B 25 LEU CD1 C 13 25.180 0.005 B 25 LEU CD2 C 13 23.370 0.000 B 25 LEU CG C 13 26.946 0.000 B 25 LEU N N 15 120.149 0.033 B 26 LEU H H 1 7.890 0.004 B 26 LEU HA H 1 4.585 0.008 B 26 LEU HBx H 1 1.565 0.000 B 26 LEU HBy H 1 1.627 0.014 B 26 LEU HD1% H 1 0.926 0.000 B 26 LEU HD2% H 1 0.896 0.001 B 26 LEU HG H 1 1.706 0.000 B 26 LEU CA C 13 53.052 0.000 B 26 LEU CB C 13 41.570 0.000 B 26 LEU CD1 C 13 25.313 0.000 B 26 LEU CD2 C 13 23.155 0.010 B 26 LEU CG C 13 27.040 0.000 B 26 LEU N N 15 122.897 0.029 B 27 PRO HA H 1 4.353 0.006 B 27 PRO HBx H 1 1.912 0.006 B 27 PRO HBy H 1 2.290 0.004 B 27 PRO HDx H 1 3.649 0.013 B 27 PRO HDy H 1 3.815 0.017 B 27 PRO HG2 H 1 1.993 0.027 B 27 PRO HG3 H 1 2.006 0.023 B 27 PRO C C 13 177.674 0.000 B 27 PRO CA C 13 63.558 0.076 B 27 PRO CB C 13 31.889 0.047 B 27 PRO CD C 13 50.528 0.002 B 27 PRO CG C 13 27.352 0.002 B 28 GLU H H 1 8.714 0.006 B 28 GLU HA H 1 4.195 0.001 B 28 GLU HBx H 1 1.967 0.011 B 28 GLU HBy H 1 2.005 0.017 B 28 GLU HG2 H 1 2.236 0.002 B 28 GLU HGx H 1 2.236 0.002 B 28 GLU HGy H 1 2.263 0.000 B 28 GLU C C 13 176.410 0.000 B 28 GLU CA C 13 57.023 0.054 B 28 GLU CB C 13 29.946 0.016 B 28 GLU CG C 13 36.235 0.047 B 28 GLU N N 15 119.367 0.015 B 29 ASN H H 1 8.292 0.003 B 29 ASN HA H 1 4.739 0.007 B 29 ASN HBx H 1 2.734 0.017 B 29 ASN HBy H 1 2.816 0.000 B 29 ASN HD21 H 1 6.788 0.000 B 29 ASN HD22 H 1 7.561 0.000 B 29 ASN C C 13 174.545 0.000 B 29 ASN CA C 13 53.232 0.027 B 29 ASN CB C 13 39.020 0.039 B 29 ASN N N 15 118.356 0.032 B 29 ASN ND2 N 15 112.326 0.011 B 30 ASN H H 1 8.297 0.003 B 30 ASN HA H 1 4.722 0.008 B 30 ASN HBx H 1 2.725 0.000 B 30 ASN HBy H 1 2.820 0.000 B 30 ASN HD21 H 1 6.915 0.000 B 30 ASN HD22 H 1 7.561 0.000 B 30 ASN C C 13 174.694 0.000 B 30 ASN CA C 13 53.352 0.019 B 30 ASN CB C 13 39.152 0.000 B 30 ASN N N 15 119.024 0.017 B 30 ASN ND2 N 15 112.345 0.008 B 31 VAL H H 1 8.038 0.004 B 31 VAL HA H 1 4.094 0.001 B 31 VAL HB H 1 2.102 0.005 B 31 VAL HG1% H 1 0.922 0.006 B 31 VAL HG2% H 1 0.929 0.000 B 31 VAL C C 13 176.013 0.000 B 31 VAL CA C 13 62.497 0.005 B 31 VAL CB C 13 35.993 3.122 B 31 VAL CG1 C 13 20.417 0.006 B 31 VAL CG2 C 13 20.417 0.006 B 31 VAL N N 15 119.607 0.015 B 32 LEU H H 1 8.280 0.004 B 32 LEU HA H 1 4.389 0.002 B 32 LEU HBx H 1 1.577 0.000 B 32 LEU HBy H 1 1.653 0.000 B 32 LEU HD1% H 1 0.921 0.000 B 32 LEU HD2% H 1 0.868 0.002 B 32 LEU HG H 1 1.615 0.001 B 32 LEU C C 13 177.221 0.000 B 32 LEU CA C 13 54.954 0.000 B 32 LEU CB C 13 42.459 0.003 B 32 LEU CD1 C 13 25.317 0.000 B 32 LEU CD2 C 13 23.505 0.004 B 32 LEU CG C 13 27.033 0.000 B 32 LEU N N 15 124.759 0.053 B 33 SER H H 1 8.209 0.006 B 33 SER HA H 1 4.730 0.009 B 33 SER HBx H 1 3.800 0.015 B 33 SER HBy H 1 3.857 0.018 B 33 SER CA C 13 56.172 0.017 B 33 SER CB C 13 63.332 0.102 B 33 SER N N 15 117.482 0.011 B 34 PRO HA H 1 4.430 0.002 B 34 PRO HBx H 1 1.945 0.012 B 34 PRO HBy H 1 2.234 0.017 B 34 PRO HDx H 1 3.659 0.000 B 34 PRO HDy H 1 3.755 0.000 B 34 PRO HG2 H 1 2.042 0.000 B 34 PRO HG3 H 1 2.042 0.000 B 34 PRO C C 13 176.836 0.000 B 34 PRO CA C 13 62.952 0.000 B 34 PRO CB C 13 32.075 0.012 B 34 PRO CD C 13 50.640 0.000 B 34 PRO CG C 13 27.195 0.000 B 35 LEU H H 1 8.297 0.004 B 35 LEU HA H 1 4.583 0.008 B 35 LEU HBx H 1 1.564 0.007 B 35 LEU HBy H 1 1.628 0.000 B 35 LEU HD1% H 1 0.933 0.004 B 35 LEU HD2% H 1 0.907 0.000 B 35 LEU HG H 1 1.699 0.008 B 35 LEU CA C 13 53.188 0.032 B 35 LEU CB C 13 41.603 0.094 B 35 LEU CD1 C 13 25.095 0.000 B 35 LEU CD2 C 13 23.354 0.008 B 35 LEU CG C 13 26.885 0.014 B 35 LEU N N 15 123.118 0.014 B 36 PRO HA H 1 4.425 0.008 B 36 PRO HBx H 1 1.917 0.004 B 36 PRO HBy H 1 2.304 0.007 B 36 PRO HDx H 1 3.636 0.000 B 36 PRO HDy H 1 3.830 0.000 B 36 PRO HG2 H 1 1.986 0.006 B 36 PRO HG3 H 1 1.989 0.006 B 36 PRO C C 13 177.254 0.000 B 36 PRO CA C 13 63.227 0.001 B 36 PRO CB C 13 31.962 0.051 B 36 PRO CD C 13 50.481 0.000 B 36 PRO CG C 13 27.352 0.032 B 37 SER H H 1 8.342 0.006 B 37 SER HA H 1 4.382 0.003 B 37 SER HBx H 1 3.828 0.000 B 37 SER HBy H 1 3.899 0.000 B 37 SER C C 13 174.526 0.000 B 37 SER CA C 13 58.561 0.061 B 37 SER CB C 13 63.693 0.000 B 37 SER N N 15 115.186 0.050 B 38 GLN H H 1 8.387 0.004 B 38 GLN HA H 1 4.300 0.018 B 38 GLN HBx H 1 2.053 0.014 B 38 GLN HBy H 1 2.127 0.001 B 38 GLN HE21 H 1 6.880 0.000 B 38 GLN HE22 H 1 7.611 0.000 B 38 GLN HG2 H 1 2.360 0.007 B 38 GLN HG3 H 1 2.367 0.000 B 38 GLN C C 13 175.568 0.000 B 38 GLN CA C 13 55.940 0.000 B 38 GLN CB C 13 29.861 0.175 B 38 GLN CG C 13 33.913 0.000 B 38 GLN N N 15 121.665 0.009 B 38 GLN NE2 N 15 112.262 0.001 B 39 ALA H H 1 8.284 0.005 B 39 ALA HA H 1 4.290 0.003 B 39 ALA HB% H 1 1.383 0.011 B 39 ALA C C 13 178.259 0.000 B 39 ALA CA C 13 52.224 0.000 B 39 ALA CB C 13 19.183 0.123 B 39 ALA N N 15 124.469 0.042 B 40 MET H H 1 8.315 0.004 B 40 MET HA H 1 4.438 0.006 B 40 MET HBx H 1 2.008 0.000 B 40 MET HBy H 1 2.099 0.000 B 40 MET HE% H 1 2.041 0.000 B 40 MET HGx H 1 2.562 0.005 B 40 MET HGy H 1 2.671 0.000 B 40 MET C C 13 176.324 0.000 B 40 MET CA C 13 55.707 0.021 B 40 MET CB C 13 32.177 0.018 B 40 MET CE C 13 17.046 0.000 B 40 MET CG C 13 32.109 0.012 B 40 MET N N 15 118.819 0.035 B 41 ASP H H 1 8.242 0.003 B 41 ASP HA H 1 4.535 0.006 B 41 ASP HBx H 1 2.638 0.000 B 41 ASP HBy H 1 2.651 0.011 B 41 ASP C C 13 176.304 0.000 B 41 ASP CA C 13 54.920 0.007 B 41 ASP N N 15 120.451 0.021 B 42 ASP H H 1 8.228 0.003 B 42 ASP HA H 1 4.537 0.001 B 42 ASP HBx H 1 2.622 0.000 B 42 ASP HBy H 1 2.653 0.001 B 42 ASP C C 13 176.501 0.000 B 42 ASP CA C 13 54.787 0.005 B 42 ASP CB C 13 41.033 0.015 B 42 ASP N N 15 119.647 0.017 B 43 LEU H H 1 8.040 0.004 B 43 LEU HA H 1 4.218 0.004 B 43 LEU HBx H 1 1.519 0.000 B 43 LEU HBy H 1 1.656 0.002 B 43 LEU HD1% H 1 0.869 0.003 B 43 LEU HD2% H 1 0.779 0.012 B 43 LEU HG H 1 1.585 0.001 B 43 LEU C C 13 177.481 0.000 B 43 LEU CA C 13 55.439 0.000 B 43 LEU CB C 13 42.099 0.039 B 43 LEU CD1 C 13 25.137 0.012 B 43 LEU CD2 C 13 23.519 0.009 B 43 LEU CG C 13 26.916 0.000 B 43 LEU N N 15 120.945 0.033 B 44 MET H H 1 8.149 0.004 B 44 MET HA H 1 4.423 0.018 B 44 MET HB2 H 1 2.021 0.000 B 44 MET HB3 H 1 2.021 0.000 B 44 MET HE% H 1 2.037 0.000 B 44 MET HGx H 1 2.470 0.000 B 44 MET HGy H 1 2.557 0.022 B 44 MET C C 13 175.784 0.000 B 44 MET CA C 13 55.444 0.040 B 44 MET CB C 13 32.330 0.178 B 44 MET CE C 13 17.052 0.000 B 44 MET CG C 13 32.170 0.018 B 44 MET N N 15 119.351 0.023 B 45 LEU H H 1 8.004 0.005 B 45 LEU HA H 1 4.423 0.018 B 45 LEU HBx H 1 1.573 0.001 B 45 LEU HBy H 1 1.649 0.001 B 45 LEU HD1% H 1 0.863 0.003 B 45 LEU HD2% H 1 0.819 0.006 B 45 LEU HG H 1 1.611 0.001 B 45 LEU C C 13 176.954 0.000 B 45 LEU CA C 13 54.654 0.046 B 45 LEU CB C 13 42.384 0.009 B 45 LEU CD1 C 13 25.229 0.012 B 45 LEU CD2 C 13 23.442 0.008 B 45 LEU CG C 13 27.050 0.000 B 45 LEU N N 15 122.160 0.035 B 46 SER H H 1 8.706 0.014 B 46 SER HA H 1 4.753 0.033 B 46 SER HBx H 1 3.887 0.000 B 46 SER HBy H 1 3.958 0.032 B 46 SER CA C 13 56.011 0.001 B 46 SER CB C 13 63.582 0.030 B 46 SER N N 15 118.466 0.051 B 47 PRO HA H 1 4.283 0.008 B 47 PRO HBx H 1 1.941 0.011 B 47 PRO HBy H 1 2.232 0.000 B 47 PRO HDx H 1 3.631 0.001 B 47 PRO HDy H 1 3.792 0.013 B 47 PRO HG2 H 1 2.022 0.000 B 47 PRO HG3 H 1 2.022 0.000 B 47 PRO C C 13 176.926 0.000 B 47 PRO CA C 13 64.426 0.083 B 47 PRO CB C 13 31.797 0.030 B 47 PRO CD C 13 50.540 0.071 B 47 PRO CG C 13 27.430 0.100 B 48 ASP H H 1 8.126 0.005 B 48 ASP HA H 1 4.471 0.001 B 48 ASP HBx H 1 2.516 0.010 B 48 ASP HBy H 1 2.668 0.012 B 48 ASP C C 13 176.056 0.000 B 48 ASP CA C 13 55.429 0.005 B 48 ASP CB C 13 41.048 0.002 B 48 ASP N N 15 117.231 0.031 B 49 ASP H H 1 7.940 0.006 B 49 ASP HA H 1 4.506 0.010 B 49 ASP HBx H 1 2.646 0.027 B 49 ASP HBy H 1 2.691 0.018 B 49 ASP C C 13 176.986 0.000 B 49 ASP CA C 13 54.835 0.011 B 49 ASP CB C 13 41.148 0.054 B 49 ASP N N 15 119.678 0.062 B 50 ILE H H 1 7.754 0.008 B 50 ILE HA H 1 3.823 0.012 B 50 ILE HB H 1 1.817 0.004 B 50 ILE HD1% H 1 0.768 0.002 B 50 ILE HG1x H 1 1.070 0.010 B 50 ILE HG1y H 1 1.416 0.004 B 50 ILE HG2% H 1 0.792 0.009 B 50 ILE CA C 13 62.602 0.055 B 50 ILE CB C 13 38.452 0.046 B 50 ILE CD1 C 13 13.346 0.008 B 50 ILE CG1 C 13 27.921 0.070 B 50 ILE CG2 C 13 17.615 0.034 B 50 ILE N N 15 118.967 0.040 B 51 GLU H H 1 8.168 0.006 B 51 GLU HA H 1 3.967 0.005 B 51 GLU HBx H 1 1.899 0.000 B 51 GLU HBy H 1 2.024 0.000 B 51 GLU HG2 H 1 2.178 0.000 B 51 GLU HG3 H 1 2.177 0.000 B 51 GLU C C 13 177.545 0.000 B 51 GLU CA C 13 57.904 0.001 B 51 GLU CB C 13 29.691 0.015 B 51 GLU CG C 13 36.284 0.027 B 51 GLU N N 15 121.128 0.052 B 52 GLN H H 1 7.970 0.008 B 52 GLN HA H 1 4.120 0.007 B 52 GLN HBx H 1 1.860 0.001 B 52 GLN HBy H 1 1.890 0.008 B 52 GLN HE21 H 1 6.773 0.000 B 52 GLN HE22 H 1 7.422 0.000 B 52 GLN HGx H 1 2.125 0.000 B 52 GLN HGy H 1 2.131 0.004 B 52 GLN C C 13 175.995 0.000 B 52 GLN CA C 13 56.620 0.030 B 52 GLN CB C 13 28.918 0.015 B 52 GLN CG C 13 33.660 0.021 B 52 GLN N N 15 117.919 0.025 B 52 GLN NE2 N 15 111.890 0.001 B 53 TRP H H 1 7.871 0.013 B 53 TRP HA H 1 4.555 0.006 B 53 TRP HB2 H 1 3.020 0.000 B 53 TRP HB3 H 1 3.021 0.005 B 53 TRP HD1 H 1 7.016 0.000 B 53 TRP HE1 H 1 10.068 0.000 B 53 TRP HE3 H 1 7.410 0.000 B 53 TRP HH2 H 1 7.060 0.001 B 53 TRP HZ2 H 1 7.348 0.000 B 53 TRP HZ3 H 1 6.958 0.000 B 53 TRP C C 13 176.049 0.000 B 53 TRP CA C 13 57.369 0.007 B 53 TRP CB C 13 29.725 0.002 B 53 TRP CD1 C 13 126.695 0.000 B 53 TRP CE3 C 13 120.598 0.006 B 53 TRP CH2 C 13 124.219 0.000 B 53 TRP CZ2 C 13 114.428 0.005 B 53 TRP CZ3 C 13 121.491 0.000 B 53 TRP N N 15 119.632 0.043 B 53 TRP NE1 N 15 128.548 0.003 B 54 PHE H H 1 7.923 0.005 B 54 PHE HA H 1 4.643 0.011 B 54 PHE HBx H 1 2.863 0.001 B 54 PHE HBy H 1 3.066 0.001 B 54 PHE HDx H 1 7.173 0.004 B 54 PHE HDy H 1 7.173 0.004 B 54 PHE HEx H 1 7.295 0.002 B 54 PHE HEy H 1 7.295 0.002 B 54 PHE HZ H 1 7.125 0.002 B 54 PHE C C 13 175.373 0.000 B 54 PHE CA C 13 57.525 0.010 B 54 PHE CB C 13 39.529 0.032 B 54 PHE CDx C 13 131.843 0.000 B 54 PHE CDy C 13 131.843 0.000 B 54 PHE CEx C 13 131.286 0.000 B 54 PHE CEy C 13 131.286 0.000 B 54 PHE CZ C 13 129.349 0.000 B 54 PHE N N 15 118.710 0.040 B 55 THR H H 1 7.887 0.006 B 55 THR HA H 1 4.289 0.000 B 55 THR HB H 1 4.160 0.006 B 55 THR HG2% H 1 1.165 0.001 B 55 THR C C 13 173.490 0.000 B 55 THR CA C 13 61.819 0.011 B 55 THR CB C 13 69.891 0.038 B 55 THR CG2 C 13 21.479 0.000 B 55 THR N N 15 114.621 0.055 B 56 GLU H H 1 8.287 0.003 B 56 GLU HA H 1 4.242 0.007 B 56 GLU HBx H 1 1.911 0.017 B 56 GLU HBy H 1 2.046 0.001 B 56 GLU HGx H 1 2.214 0.013 B 56 GLU HGy H 1 2.279 0.000 B 56 GLU C C 13 175.637 0.000 B 56 GLU CA C 13 56.180 0.000 B 56 GLU CB C 13 30.665 0.006 B 56 GLU CG C 13 36.303 0.016 B 56 GLU N N 15 122.837 0.032 B 57 ASP H H 1 8.395 0.005 B 57 ASP HA H 1 4.811 0.000 B 57 ASP HBx H 1 2.513 0.003 B 57 ASP HBy H 1 2.723 0.003 B 57 ASP CA C 13 52.313 0.069 B 57 ASP CB C 13 41.177 0.059 B 57 ASP N N 15 122.781 0.018 B 58 PRO HA H 1 4.421 0.007 B 58 PRO HBx H 1 1.902 0.000 B 58 PRO HBy H 1 2.231 0.006 B 58 PRO HDx H 1 3.638 0.000 B 58 PRO HDy H 1 3.768 0.008 B 58 PRO HG2 H 1 1.992 0.000 B 58 PRO HG3 H 1 1.992 0.000 B 58 PRO C C 13 177.538 0.000 B 58 PRO CA C 13 63.302 0.000 B 58 PRO CB C 13 32.229 0.002 B 58 PRO CD C 13 50.444 0.119 B 58 PRO CG C 13 26.971 0.000 B 59 GLY H H 1 8.401 0.004 B 59 GLY HAx H 1 4.009 0.000 B 59 GLY HAy H 1 4.074 0.000 B 59 GLY CA C 13 44.480 0.035 B 59 GLY N N 15 108.848 0.014 B 60 PRO HA H 1 4.411 0.000 B 60 PRO HBx H 1 1.911 0.000 B 60 PRO HBy H 1 2.253 0.006 B 60 PRO HDx H 1 3.586 0.014 B 60 PRO HDy H 1 3.620 0.000 B 60 PRO HG2 H 1 1.983 0.008 B 60 PRO HG3 H 1 1.983 0.008 B 60 PRO C C 13 177.195 0.000 B 60 PRO CA C 13 63.320 0.002 B 60 PRO CB C 13 32.165 0.018 B 60 PRO CD C 13 49.670 0.046 B 60 PRO CG C 13 27.066 0.034 B 61 ASP H H 1 8.454 0.004 B 61 ASP HA H 1 4.579 0.004 B 61 ASP HBx H 1 2.589 0.009 B 61 ASP HBy H 1 2.711 0.014 B 61 ASP C C 13 176.154 0.000 B 61 ASP CA C 13 54.554 0.047 B 61 ASP CB C 13 41.099 0.059 B 61 ASP N N 15 119.570 0.014 B 62 GLU H H 1 8.143 0.005 B 62 GLU HA H 1 4.275 0.005 B 62 GLU HBx H 1 1.908 0.003 B 62 GLU HBy H 1 2.029 0.002 B 62 GLU HGx H 1 2.215 0.011 B 62 GLU HGy H 1 2.276 0.002 B 62 GLU C C 13 175.731 0.000 B 62 GLU CA C 13 56.100 0.002 B 62 GLU CB C 13 30.770 0.001 B 62 GLU CG C 13 36.282 0.000 B 62 GLU N N 15 120.545 0.016 B 63 ALA H H 1 8.282 0.005 B 63 ALA HA H 1 4.580 0.004 B 63 ALA HB% H 1 1.360 0.006 B 63 ALA CA C 13 50.531 0.170 B 63 ALA CB C 13 18.149 0.015 B 63 ALA N N 15 126.231 0.014 B 64 PRO HA H 1 4.382 0.010 B 64 PRO HBx H 1 1.911 0.000 B 64 PRO HBy H 1 2.298 0.013 B 64 PRO HDx H 1 3.632 0.008 B 64 PRO HDy H 1 3.791 0.008 B 64 PRO HG2 H 1 2.010 0.007 B 64 PRO HG3 H 1 2.010 0.007 B 64 PRO C C 13 176.915 0.000 B 64 PRO CA C 13 62.910 0.001 B 64 PRO CB C 13 32.074 0.000 B 64 PRO CD C 13 50.439 0.000 B 64 PRO CG C 13 27.398 0.000 B 65 ARG H H 1 8.469 0.005 B 65 ARG HA H 1 4.322 0.005 B 65 ARG HBx H 1 1.739 0.006 B 65 ARG HBy H 1 1.813 0.001 B 65 ARG HD2 H 1 3.193 0.000 B 65 ARG HD3 H 1 3.193 0.001 B 65 ARG HGx H 1 1.638 0.000 B 65 ARG HGy H 1 1.667 0.015 B 65 ARG C C 13 176.315 0.000 B 65 ARG CA C 13 55.709 0.054 B 65 ARG CB C 13 30.976 0.019 B 65 ARG CD C 13 43.341 0.022 B 65 ARG CG C 13 27.130 0.008 B 65 ARG N N 15 121.536 0.024 B 66 MET H H 1 8.505 0.005 B 66 MET HA H 1 4.798 0.002 B 66 MET HBx H 1 1.963 0.001 B 66 MET HBy H 1 2.083 0.003 B 66 MET HE% H 1 2.020 0.000 B 66 MET HG2 H 1 2.622 0.000 B 66 MET HG3 H 1 2.622 0.000 B 66 MET CA C 13 53.177 0.016 B 66 MET CB C 13 32.233 0.007 B 66 MET CE C 13 14.852 0.000 B 66 MET N N 15 122.996 0.013 B 67 PRO HA H 1 4.413 0.007 B 67 PRO HBx H 1 1.922 0.000 B 67 PRO HBy H 1 2.293 0.006 B 67 PRO HDx H 1 3.705 0.004 B 67 PRO HDy H 1 3.813 0.000 B 67 PRO HG2 H 1 1.991 0.008 B 67 PRO HG3 H 1 2.000 0.000 B 67 PRO C C 13 176.969 0.000 B 67 PRO CA C 13 63.152 0.025 B 67 PRO CB C 13 32.098 0.019 B 67 PRO CD C 13 50.713 0.020 B 67 PRO CG C 13 27.349 0.010 B 68 GLU H H 1 8.539 0.004 B 68 GLU HA H 1 4.240 0.012 B 68 GLU HB2 H 1 1.966 0.000 B 68 GLU HG2 H 1 2.292 0.000 B 68 GLU C C 13 176.224 0.000 B 68 GLU CA C 13 56.460 0.004 B 68 GLU CB C 13 29.964 0.000 B 68 GLU CG C 13 31.825 0.000 B 68 GLU N N 15 120.890 0.026 B 69 ALA H H 1 8.329 0.008 B 69 ALA HA H 1 4.301 0.000 B 69 ALA HB% H 1 1.390 0.000 B 69 ALA C C 13 177.064 0.000 B 69 ALA CA C 13 52.138 0.033 B 69 ALA CB C 13 19.331 0.000 B 69 ALA N N 15 125.243 0.031 B 70 ALA H H 1 8.279 0.006 B 70 ALA HA H 1 4.572 0.019 B 70 ALA HB% H 1 1.352 0.002 B 70 ALA CA C 13 50.294 0.019 B 70 ALA CB C 13 18.321 0.000 B 70 ALA N N 15 124.753 0.021 B 72 PRO HA H 1 4.454 0.000 B 72 PRO HBx H 1 1.917 0.000 B 72 PRO HBy H 1 2.284 0.000 B 72 PRO HDx H 1 3.659 0.000 B 72 PRO HDy H 1 3.807 0.000 B 72 PRO HG2 H 1 1.988 0.000 B 72 PRO C C 13 176.986 0.000 B 72 PRO CA C 13 62.789 0.000 B 72 PRO CB C 13 31.999 0.021 B 72 PRO CD C 13 50.423 0.000 B 72 PRO CG C 13 27.245 0.000 B 73 VAL H H 1 8.170 0.006 B 73 VAL HA H 1 4.062 0.003 B 73 VAL HB H 1 2.012 0.007 B 73 VAL HG1% H 1 0.940 0.000 B 73 VAL HG2% H 1 0.940 0.000 B 73 VAL C C 13 175.526 0.000 B 73 VAL CA C 13 61.928 0.018 B 73 VAL CB C 13 32.826 0.009 B 73 VAL CGy C 13 20.999 0.012 B 73 VAL CGx C 13 20.930 0.070 B 73 VAL N N 15 120.048 0.018 B 74 ALA H H 1 8.403 0.006 B 74 ALA HA H 1 4.591 0.015 B 74 ALA HB% H 1 1.361 0.007 B 74 ALA CA C 13 50.322 0.017 B 74 ALA CB C 13 18.391 0.015 B 74 ALA N N 15 129.229 0.029 B 75 PRO HA H 1 4.401 0.000 B 75 PRO HBx H 1 1.881 0.000 B 75 PRO HBy H 1 2.275 0.000 B 75 PRO HDx H 1 3.649 0.000 B 75 PRO HDy H 1 3.780 0.000 B 75 PRO HG2 H 1 1.966 0.000 B 75 PRO C C 13 176.326 0.000 B 75 PRO CA C 13 62.661 0.000 B 75 PRO CB C 13 32.029 0.000 B 75 PRO CD C 13 50.320 0.000 B 75 PRO CG C 13 27.195 0.000 B 76 ALA H H 1 8.378 0.008 B 76 ALA HA H 1 4.602 0.000 B 76 ALA HB% H 1 1.364 0.000 B 76 ALA CA C 13 50.370 0.027 B 76 ALA CB C 13 18.227 0.023 B 76 ALA N N 15 125.383 0.010 B 77 PRO HA H 1 4.393 0.000 B 77 PRO HBx H 1 1.919 0.000 B 77 PRO HBy H 1 2.298 0.000 B 77 PRO HDx H 1 3.684 0.008 B 77 PRO HDy H 1 3.816 0.001 B 77 PRO HG2 H 1 2.029 0.000 B 77 PRO C C 13 176.590 0.000 B 77 PRO CA C 13 62.705 0.000 B 77 PRO CB C 13 31.893 0.000 B 77 PRO CD C 13 50.388 0.014 B 77 PRO CG C 13 27.272 0.000 B 78 ALA H H 1 8.367 0.002 B 78 ALA HA H 1 4.280 0.000 B 78 ALA HB% H 1 1.383 0.000 B 78 ALA C C 13 177.168 0.000 B 78 ALA CA C 13 52.102 0.000 B 78 ALA CB C 13 19.473 0.000 B 78 ALA N N 15 124.237 0.008 B 79 ALA H H 1 8.290 0.012 B 79 ALA HA H 1 4.581 0.000 B 79 ALA HB% H 1 1.380 0.000 B 79 ALA CA C 13 50.309 0.014 B 79 ALA CB C 13 18.101 0.000 B 79 ALA N N 15 124.518 0.036 B 80 PRO HA H 1 4.469 0.014 B 80 PRO HBx H 1 1.908 0.000 B 80 PRO HBy H 1 2.300 0.008 B 80 PRO HDx H 1 3.678 0.000 B 80 PRO HDy H 1 3.792 0.000 B 80 PRO HG2 H 1 1.984 0.000 B 80 PRO C C 13 176.970 0.000 B 80 PRO CA C 13 62.855 0.016 B 80 PRO CB C 13 32.082 0.019 B 80 PRO CD C 13 50.460 0.000 B 80 PRO CG C 13 27.276 0.000 B 81 THR H H 1 8.322 0.006 B 81 THR HA H 1 4.571 0.000 B 81 THR HB H 1 4.142 0.000 B 81 THR HG2% H 1 1.270 0.000 B 81 THR CA C 13 59.805 0.004 B 81 THR CB C 13 69.715 0.019 B 81 THR CG2 C 13 21.455 0.000 B 81 THR N N 15 117.018 0.023 B 82 PRO HA H 1 4.393 0.000 B 82 PRO HBx H 1 1.927 0.000 B 82 PRO HBy H 1 2.306 0.008 B 82 PRO HDx H 1 3.703 0.000 B 82 PRO HDy H 1 3.860 0.000 B 82 PRO HG2 H 1 1.975 0.000 B 82 PRO C C 13 176.602 0.000 B 82 PRO CA C 13 62.976 0.000 B 82 PRO CB C 13 32.119 0.023 B 82 PRO CD C 13 50.835 0.028 B 82 PRO CG C 13 27.304 0.000 B 83 ALA H H 1 8.367 0.005 B 83 ALA HA H 1 4.287 0.000 B 83 ALA HB% H 1 1.379 0.003 B 83 ALA C C 13 177.334 0.000 B 83 ALA CA C 13 52.161 0.025 B 83 ALA CB C 13 19.298 0.021 B 83 ALA N N 15 124.221 0.010 B 84 ALA H H 1 8.270 0.005 B 84 ALA HA H 1 4.590 0.000 B 84 ALA HB% H 1 1.361 0.000 B 84 ALA CA C 13 50.344 0.023 B 84 ALA CB C 13 18.037 0.000 B 84 ALA N N 15 124.531 0.049 B 85 PRO HA H 1 4.398 0.000 B 85 PRO HBx H 1 1.884 0.000 B 85 PRO HBy H 1 2.274 0.000 B 85 PRO HDx H 1 3.650 0.000 B 85 PRO HDy H 1 3.781 0.000 B 85 PRO HG2 H 1 1.965 0.000 B 85 PRO C C 13 176.332 0.000 B 85 PRO CA C 13 62.683 0.000 B 85 PRO CB C 13 32.043 0.000 B 85 PRO CD C 13 50.313 0.000 B 85 PRO CG C 13 27.248 0.000 B 86 ALA H H 1 8.384 0.006 B 86 ALA HA H 1 4.594 0.000 B 86 ALA HB% H 1 1.360 0.000 B 86 ALA CA C 13 50.339 0.035 B 86 ALA CB C 13 18.224 0.019 B 86 ALA N N 15 125.388 0.009 B 87 PRO HA H 1 4.401 0.000 B 87 PRO HBx H 1 1.887 0.000 B 87 PRO HBy H 1 2.281 0.000 B 87 PRO HDx H 1 3.655 0.000 B 87 PRO HDy H 1 3.782 0.000 B 87 PRO HG2 H 1 2.008 0.000 B 87 PRO C C 13 176.001 0.000 B 87 PRO CA C 13 62.664 0.000 B 88 ALA H H 1 8.323 0.009 B 88 ALA HA H 1 4.581 0.000 B 88 ALA HB% H 1 1.363 0.000 B 88 ALA CA C 13 50.373 0.022 B 88 ALA CB C 13 18.230 0.000 B 88 ALA N N 15 125.205 0.031 B 89 PRO HA H 1 4.312 0.000 B 89 PRO HB2 H 1 2.017 0.000 B 89 PRO HB3 H 1 2.017 0.000 B 89 PRO HDy H 1 3.773 0.000 B 89 PRO HDx H 1 3.650 0.000 B 89 PRO HG2 H 1 1.647 0.000 B 89 PRO HG3 H 1 1.647 0.000 B 89 PRO C C 13 176.705 0.000 B 89 PRO CA C 13 62.953 0.000 B 89 PRO CB C 13 31.933 0.000 B 89 PRO CG C 13 27.261 0.000 B 90 SER H H 1 8.139 0.005 B 90 SER HA H 1 4.364 0.000 B 90 SER HB2 H 1 3.747 0.000 B 90 SER HB3 H 1 3.747 0.000 B 90 SER C C 13 173.113 0.000 B 90 SER CB C 13 63.899 0.001 B 90 SER N N 15 115.323 0.015 B 91 TRP H H 1 8.037 0.004 B 91 TRP HA H 1 5.011 0.000 B 91 TRP HBy H 1 3.347 0.001 B 91 TRP HBx H 1 3.140 0.003 B 91 TRP HD1 H 1 7.261 0.000 B 91 TRP HE1 H 1 10.148 0.000 B 91 TRP HE3 H 1 7.713 0.000 B 91 TRP HH2 H 1 7.251 0.000 B 91 TRP HZ2 H 1 7.513 0.000 B 91 TRP HZ3 H 1 7.180 0.000 B 91 TRP CA C 13 54.725 0.000 B 91 TRP CB C 13 29.314 0.060 B 91 TRP CD1 C 13 127.477 0.000 B 91 TRP CE3 C 13 120.902 0.000 B 91 TRP CH2 C 13 124.620 0.000 B 91 TRP CZ2 C 13 114.644 0.000 B 91 TRP CZ3 C 13 122.116 0.000 B 91 TRP N N 15 123.450 0.020 B 91 TRP NE1 N 15 128.823 0.001 B 92 PRO HA H 1 4.446 0.000 B 92 PRO HBy H 1 2.240 0.000 B 92 PRO HBx H 1 1.977 0.000 B 92 PRO HDy H 1 3.781 0.000 B 92 PRO HDx H 1 3.502 0.000 B 92 PRO HG2 H 1 1.977 0.000 B 92 PRO HG3 H 1 1.977 0.000 B 92 PRO C C 13 175.851 0.000 B 92 PRO CA C 13 63.334 0.019 B 92 PRO CB C 13 31.844 0.000 B 92 PRO CD C 13 50.720 0.000 B 92 PRO CG C 13 27.237 0.000 B 93 LEU H H 1 7.824 0.006 B 93 LEU HA H 1 4.218 0.004 B 93 LEU HB2 H 1 1.601 0.003 B 93 LEU HB3 H 1 1.601 0.003 B 93 LEU HD1% H 1 0.921 0.005 B 93 LEU HD2% H 1 0.902 0.027 B 93 LEU HG H 1 1.650 0.007 B 93 LEU CA C 13 56.748 0.021 B 93 LEU CB C 13 43.517 0.025 B 93 LEU CD1 C 13 25.184 0.016 B 93 LEU CD2 C 13 23.598 0.002 B 93 LEU CG C 13 27.206 0.038 B 93 LEU N N 15 127.919 0.011 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 14 SER H A 15 TYR H 1.0 1.9 4.3 2 2 A 48 TRP HBy A 48 TRP H 1.0 1.8 3.6 3 2 A 48 TRP HBx A 48 TRP H 1.0 1.8 3.6 4 3 A 57 GLY HAx A 60 GLU H 1.0 2.0 5.0 5 4 A 23 ARG HGy A 23 ARG H 1.0 2.0 5.8 6 5 A 43 LYS H A 44 CYS H 1.0 1.8 3.6 7 6 A 66 ASP HBx A 66 ASP H 1.0 1.7 3.5 8 6 A 66 ASP HBy A 66 ASP H 1.0 1.7 3.5 9 7 A 33 ALA H A 32 ASP HA 1.0 1.8 3.6 10 8 A 21 THR H A 22 CYS H 1.0 1.9 4.1 11 9 A 59 PHE H A 60 GLU H 1.0 1.7 3.5 12 10 A 13 SER H A 12 MET HA 1.0 1.8 3.4 13 11 A 78 ILE H A 78 ILE HA 1.0 1.8 3.6 14 12 A 59 PHE HBx A 59 PHE H 1.0 1.8 3.8 15 13 A 83 GLU H A 83 GLU HA 1.0 1.9 4.1 16 14 A 41 SER H A 40 PHE HBx 1.0 2.0 5.6 17 15 A 61 ASP H A 62 MET H 1.0 1.8 3.8 18 16 A 39 GLU H A 36 ASN HBx 1.0 2.0 5.0 19 17 A 71 GLU HA A 71 GLU H 1.0 1.9 3.9 20 18 A 60 GLU HBx A 60 GLU H 1.0 1.8 3.6 21 19 A 78 ILE H A 77 TYR HBy 1.0 2.0 5.6 22 20 A 42 LYS H A 43 LYS H 1.0 1.8 3.4 23 21 A 36 ASN HBx A 36 ASN HD21 1.0 1.9 3.7 24 22 A 36 ASN HBx A 36 ASN HD22 1.0 2.0 4.8 25 23 A 74 MET HBx A 74 MET H 1.0 1.7 3.1 26 23 A 74 MET HBy A 74 MET H 1.0 1.7 3.1 27 24 A 6 LYS H A 5 PRO HDy 1.0 1.9 4.1 28 24 A 6 LYS H A 5 PRO HDx 1.0 1.9 4.1 29 25 A 67 LYS H A 68 ALA H 1.0 1.8 3.6 30 26 A 47 ARG H A 48 TRP H 1.0 1.8 3.8 31 27 A 7 LYS H A 7 LYS HBy 1.0 1.7 3.1 32 27 A 7 LYS H A 7 LYS HBx 1.0 1.7 3.1 33 28 A 69 ARG HBy A 69 ARG H 1.0 2.0 4.4 34 29 A 68 ALA HA A 68 ALA H 1.0 1.8 3.6 35 30 A 23 ARG HBy A 24 GLU H 1.0 1.8 4.0 36 31 A 33 ALA H A 33 ALA HB% 1.0 1.6 2.8 37 32 A 63 ALA H A 64 LYS H 1.0 1.8 3.8 38 33 A 70 TYR H A 71 GLU H 1.0 1.9 3.9 39 34 A 51 MET H A 49 LYS H 1.0 2.0 6.0 40 35 A 65 ALA HB% A 65 ALA H 1.0 1.7 3.1 41 36 A 55 GLU H A 55 GLU HG3 1.0 1.7 3.3 42 36 A 55 GLU H A 55 GLU HG2 1.0 1.7 3.3 43 37 A 78 ILE H A 78 ILE HG2% 1.0 2.0 4.4 44 37 A 78 ILE H A 78 ILE HD1% 1.0 2.0 4.4 45 38 A 70 TYR HBy A 69 ARG H 1.0 2.0 5.8 46 38 A 70 TYR HBx A 69 ARG H 1.0 2.0 5.8 47 39 A 69 ARG H A 70 TYR H 1.0 1.8 3.8 48 40 A 53 ALA H A 53 ALA HB% 1.0 1.8 4.0 49 41 A 62 MET HGx A 63 ALA H 1.0 2.0 6.0 50 42 A 81 LYS H A 81 LYS HBx 1.0 1.6 2.8 51 42 A 81 LYS H A 81 LYS HBy 1.0 1.6 2.8 52 43 A 23 ARG H A 24 GLU H 1.0 1.9 3.9 53 44 A 81 LYS HBy A 82 GLY H 1.0 2.0 5.2 54 44 A 81 LYS HBx A 82 GLY H 1.0 2.0 5.2 55 45 A 9 ARG H A 9 ARG HDx 1.0 2.0 5.8 56 46 A 50 THR HB A 50 THR H 1.0 2.0 4.8 57 47 A 6 LYS H A 5 PRO HBy 1.0 1.9 4.3 58 47 A 6 LYS H A 5 PRO HG3 1.0 1.9 4.3 59 47 A 6 LYS H A 5 PRO HG2 1.0 1.9 4.3 60 48 A 51 MET H A 50 THR H 1.0 1.7 3.1 61 49 A 41 SER HA A 44 CYS H 1.0 1.9 4.5 62 50 A 33 ALA H A 32 ASP H 1.0 1.6 3.0 63 51 A 6 LYS H A 7 LYS H 1.0 1.7 3.3 64 52 A 29 LYS HBy A 29 LYS H 1.0 1.9 4.3 65 53 A 4 ASP H A 3 GLY HA2 1.0 1.7 3.3 66 53 A 4 ASP H A 3 GLY HA3 1.0 1.7 3.3 67 54 A 7 LYS H A 7 LYS HGy 1.0 2.0 4.8 68 55 A 78 ILE H A 78 ILE HB 1.0 1.7 3.1 69 56 A 77 TYR H A 76 THR HG2% 1.0 2.0 6.0 70 57 A 17 PHE H A 17 PHE HBy 1.0 2.0 5.0 71 58 A 56 LYS H A 57 GLY H 1.0 1.8 3.6 72 59 A 10 GLY H A 9 ARG HGx 1.0 2.0 5.2 73 60 A 51 MET H A 49 LYS HA 1.0 2.0 5.0 74 61 A 71 GLU HBy A 71 GLU H 1.0 2.0 4.8 75 62 A 10 GLY H A 9 ARG HB2 1.0 1.9 4.5 76 62 A 10 GLY H A 9 ARG HB3 1.0 1.9 4.5 77 63 A 52 SER H A 51 MET HBy 1.0 1.9 4.9 78 64 A 17 PHE HE% A 66 ASP H 1.0 2.0 6.0 79 65 A 71 GLU H A 72 ARG H 1.0 1.8 4.0 80 66 A 17 PHE H A 17 PHE HBx 1.0 1.8 3.4 81 67 A 43 LYS HE2 A 43 LYS H 1.0 2.0 6.0 82 67 A 43 LYS HE3 A 43 LYS H 1.0 2.0 6.0 83 68 A 12 MET HA A 12 MET H 1.0 1.9 4.3 84 69 A 55 GLU HG3 A 56 LYS H 1.0 2.0 6.0 85 69 A 55 GLU HG2 A 56 LYS H 1.0 2.0 6.0 86 70 A 52 SER H A 51 MET HA 1.0 1.7 3.1 87 71 A 71 GLU HBy A 72 ARG H 1.0 1.9 4.7 88 72 A 68 ALA H A 69 ARG H 1.0 1.8 3.6 89 73 A 19 VAL HGy% A 20 GLN H 1.0 2.0 6.0 90 74 A 55 GLU H A 57 GLY H 1.0 2.0 5.2 91 75 A 83 GLU H A 82 GLY HA2 1.0 1.8 3.4 92 75 A 83 GLU H A 82 GLY HA3 1.0 1.8 3.4 93 76 A 28 LYS HBy A 29 LYS H 1.0 1.6 3.0 94 77 A 51 MET H A 56 LYS HEx 1.0 1.9 4.3 95 78 A 34 SER H A 34 SER HB2 1.0 1.9 3.9 96 78 A 34 SER H A 34 SER HB3 1.0 1.9 3.9 97 79 A 61 ASP HBx A 61 ASP H 1.0 1.7 3.5 98 80 A 74 MET H A 75 LYS H 1.0 1.8 3.4 99 81 A 44 CYS H A 45 SER H 1.0 1.8 3.8 100 82 A 54 LYS H A 52 SER HA 1.0 2.0 5.8 101 82 A 54 LYS H A 52 SER HBx 1.0 2.0 5.8 102 83 A 36 ASN HD22 A 39 GLU HGx 1.0 1.9 6.0 103 84 A 32 ASP H A 31 PRO HGx 1.0 1.8 4.0 104 84 A 32 ASP H A 31 PRO HGy 1.0 1.8 4.0 105 84 A 32 ASP H A 31 PRO HBy 1.0 1.8 4.0 106 85 A 68 ALA HA A 72 ARG H 1.0 1.9 4.9 107 86 A 23 ARG HA A 27 LYS H 1.0 2.0 5.6 108 87 A 77 TYR H A 76 THR HB 1.0 1.8 3.6 109 87 A 77 TYR H A 76 THR HA 1.0 1.8 3.6 110 88 A 67 LYS HBx A 67 LYS H 1.0 1.7 3.1 111 89 A 35 VAL H A 35 VAL HGx% 1.0 1.8 3.6 112 90 A 76 THR H A 75 LYS HGx 1.0 2.0 5.6 113 91 A 62 MET HGy A 62 MET H 1.0 1.9 3.9 114 92 A 48 TRP HBx A 49 LYS H 1.0 1.8 4.0 115 92 A 48 TRP HBy A 49 LYS H 1.0 1.8 4.0 116 93 A 9 ARG H A 8 PRO HGy 1.0 1.9 4.7 117 93 A 9 ARG H A 8 PRO HBy 1.0 1.9 4.7 118 94 A 67 LYS HD2 A 67 LYS H 1.0 2.0 5.2 119 94 A 67 LYS HD3 A 67 LYS H 1.0 2.0 5.2 120 95 A 58 LYS HD2 A 58 LYS H 1.0 2.0 6.0 121 95 A 58 LYS HD3 A 58 LYS H 1.0 2.0 6.0 122 96 A 30 HIS H A 29 LYS HBx 1.0 1.8 3.4 123 97 A 46 GLU HGx A 46 GLU H 1.0 1.9 4.3 124 98 A 20 GLN HG2 A 21 THR H 1.0 1.9 4.7 125 98 A 20 GLN HG3 A 21 THR H 1.0 1.9 4.7 126 99 A 26 HIS H A 27 LYS H 1.0 1.8 3.6 127 100 A 20 GLN HE22 A 20 GLN HE21 1.0 1.2 2.2 128 101 A 83 GLU H A 83 GLU HB2 1.0 1.9 4.5 129 102 A 43 LYS HBy A 44 CYS H 1.0 1.7 3.5 130 102 A 43 LYS HBx A 44 CYS H 1.0 1.7 3.5 131 103 A 41 SER H A 42 LYS H 1.0 1.8 3.6 132 104 A 62 MET HE% A 62 MET H 1.0 2.0 6.0 133 105 A 52 SER H A 52 SER HBy 1.0 1.9 4.3 134 106 A 10 GLY H A 10 GLY HAy 1.0 1.8 3.8 135 107 A 65 ALA H A 66 ASP H 1.0 1.7 3.5 136 108 A 50 THR HA A 50 THR H 1.0 1.9 3.7 137 109 A 17 PHE H A 17 PHE HE% 1.0 2.0 6.0 138 110 A 22 CYS HBx A 22 CYS H 1.0 1.8 4.0 139 111 A 26 HIS HBx A 27 LYS H 1.0 2.0 5.8 140 112 A 81 LYS H A 80 PRO HBy 1.0 1.9 4.5 141 113 A 20 GLN HB3 A 21 THR H 1.0 1.9 4.3 142 113 A 20 GLN HB2 A 21 THR H 1.0 1.9 4.3 143 114 A 55 GLU H A 55 GLU HBx 1.0 1.8 3.4 144 115 A 15 TYR H A 15 TYR HD% 1.0 2.0 6.0 145 116 A 57 GLY HAx A 58 LYS H 1.0 2.0 5.6 146 117 A 41 SER H A 40 PHE HD% 1.0 2.0 5.6 147 118 A 32 ASP H A 31 PRO HBx 1.0 1.9 4.5 148 119 A 66 ASP H A 67 LYS H 1.0 1.7 3.5 149 120 A 59 PHE HD% A 59 PHE H 1.0 1.8 4.2 150 121 A 81 LYS H A 81 LYS HG2 1.0 2.0 4.8 151 121 A 81 LYS H A 81 LYS HG3 1.0 2.0 4.8 152 122 A 11 LYS H A 11 LYS HDy 1.0 1.8 3.6 153 122 A 11 LYS H A 11 LYS HB2 1.0 1.8 3.6 154 122 A 11 LYS H A 11 LYS HB3 1.0 1.8 3.6 155 123 A 11 LYS H A 11 LYS HGy 1.0 1.9 4.3 156 124 A 51 MET H A 52 SER H 1.0 2.0 6.0 157 125 A 35 VAL H A 35 VAL HB 1.0 1.8 4.0 158 126 A 36 ASN HBx A 36 ASN H 1.0 1.9 4.3 159 127 A 52 SER H A 52 SER HBx 1.0 1.8 3.4 160 127 A 52 SER H A 52 SER HA 1.0 1.8 3.4 161 128 A 30 HIS H A 29 LYS H 1.0 1.7 3.1 162 129 A 78 ILE H A 78 ILE HG1y 1.0 1.9 4.5 163 130 A 62 MET HA A 62 MET H 1.0 1.9 4.1 164 131 A 58 LYS HBx A 59 PHE H 1.0 2.0 6.0 165 132 A 66 ASP HA A 69 ARG H 1.0 2.0 4.6 166 133 A 33 ALA H A 33 ALA HA 1.0 1.8 3.4 167 134 A 48 TRP HE1 A 48 TRP HZ2 1.0 1.8 4.2 168 135 A 11 LYS H A 11 LYS HGx 1.0 1.9 4.3 169 136 A 49 LYS H A 50 THR H 1.0 1.8 3.6 170 137 A 21 THR HB A 21 THR H 1.0 1.9 3.9 171 138 A 20 GLN HG3 A 20 GLN HE22 1.0 1.8 4.2 172 138 A 20 GLN HG2 A 20 GLN HE22 1.0 1.8 4.2 173 139 A 56 LYS HBx A 57 GLY H 1.0 1.9 4.3 174 140 A 17 PHE H A 18 PHE H 1.0 1.9 4.1 175 141 A 10 GLY H A 11 LYS H 1.0 1.9 4.7 176 142 A 52 SER H A 51 MET HG2 1.0 1.9 4.1 177 142 A 52 SER H A 51 MET HG3 1.0 1.9 4.1 178 143 A 7 LYS H A 6 LYS HA 1.0 1.7 2.9 179 144 A 32 ASP H A 31 PRO HDx 1.0 1.9 4.1 180 145 A 39 GLU H A 39 GLU HBy 1.0 1.8 3.4 181 145 A 39 GLU H A 39 GLU HBx 1.0 1.8 3.4 182 146 A 39 GLU H A 36 ASN HBy 1.0 1.9 4.3 183 147 A 75 LYS HGx A 75 LYS H 1.0 1.8 3.8 184 147 A 75 LYS HDy A 75 LYS H 1.0 1.8 3.8 185 148 A 34 SER HB3 A 35 VAL H 1.0 2.0 4.8 186 148 A 34 SER HB2 A 35 VAL H 1.0 2.0 4.8 187 149 A 62 MET HGy A 63 ALA H 1.0 2.0 5.2 188 150 A 55 GLU H A 55 GLU HBy 1.0 1.8 3.6 189 150 A 55 GLU H A 55 GLU HBx 1.0 1.8 3.6 190 151 A 17 PHE H A 17 PHE HA 1.0 1.8 4.0 191 152 A 32 ASP H A 30 HIS HA 1.0 2.0 4.8 192 153 A 16 ALA H A 16 ALA HA 1.0 1.9 4.3 193 154 A 55 GLU H A 54 LYS H 1.0 1.9 4.3 194 155 A 9 ARG H A 9 ARG HA 1.0 1.8 4.0 195 156 A 68 ALA HA A 69 ARG H 1.0 2.0 5.0 196 157 A 30 HIS H A 29 LYS HGy 1.0 2.0 6.0 197 158 A 20 GLN HG3 A 20 GLN HE21 1.0 1.7 3.3 198 158 A 20 GLN HG2 A 20 GLN HE21 1.0 1.7 3.3 199 159 A 20 GLN HB2 A 20 GLN H 1.0 1.9 3.9 200 159 A 20 GLN HB3 A 20 GLN H 1.0 1.9 3.9 201 160 A 55 GLU H A 52 SER HA 1.0 2.0 5.2 202 160 A 55 GLU H A 52 SER HBx 1.0 2.0 5.2 203 161 A 75 LYS HGy A 75 LYS H 1.0 2.0 5.4 204 162 A 69 ARG HBx A 69 ARG H 1.0 1.7 3.3 205 163 A 30 HIS H A 31 PRO HDx 1.0 1.9 5.5 206 164 A 48 TRP H A 49 LYS H 1.0 1.8 3.8 207 165 A 17 PHE H A 16 ALA H 1.0 1.9 3.9 208 166 A 51 MET HG3 A 50 THR H 1.0 2.0 6.0 209 166 A 51 MET HG2 A 50 THR H 1.0 2.0 6.0 210 167 A 43 LYS H A 45 SER H 1.0 2.0 5.6 211 168 A 44 CYS HBx A 44 CYS H 1.0 1.8 3.8 212 169 A 43 LYS HGy A 44 CYS H 1.0 1.9 4.5 213 170 A 10 GLY HAy A 11 LYS H 1.0 1.8 3.6 214 171 A 41 SER H A 42 LYS HBy 1.0 2.0 6.0 215 172 A 28 LYS HGx A 28 LYS H 1.0 2.0 5.2 216 173 A 56 LYS H A 56 LYS HDy 1.0 1.9 6.0 217 173 A 56 LYS H A 56 LYS HDx 1.0 1.9 6.0 218 174 A 70 TYR HBy A 70 TYR H 1.0 1.8 3.8 219 174 A 70 TYR HBx A 70 TYR H 1.0 1.8 3.8 220 175 A 53 ALA H A 52 SER HBx 1.0 1.8 3.8 221 175 A 53 ALA H A 52 SER HA 1.0 1.8 3.8 222 176 A 36 ASN HD21 A 36 ASN HBy 1.0 1.9 3.9 223 177 A 64 LYS HD3 A 65 ALA H 1.0 1.9 4.5 224 177 A 64 LYS HGx A 65 ALA H 1.0 1.9 4.5 225 178 A 7 LYS H A 7 LYS HBx 1.0 1.7 2.9 226 179 A 26 HIS HA A 27 LYS H 1.0 2.0 5.0 227 180 A 25 GLU HBy A 27 LYS H 1.0 2.0 5.8 228 181 A 23 ARG HA A 24 GLU H 1.0 2.0 5.0 229 182 A 30 HIS H A 31 PRO HDy 1.0 2.0 4.4 230 183 A 51 MET H A 51 MET HG3 1.0 1.9 4.7 231 183 A 51 MET H A 51 MET HG2 1.0 1.9 4.7 232 184 A 29 LYS HE2 A 29 LYS H 1.0 2.0 6.0 233 184 A 29 LYS HE3 A 29 LYS H 1.0 2.0 6.0 234 185 A 54 LYS H A 54 LYS HD3 1.0 1.9 5.1 235 185 A 54 LYS H A 54 LYS HD2 1.0 1.9 5.1 236 186 A 27 LYS H A 28 LYS H 1.0 1.7 3.3 237 187 A 71 GLU HA A 72 ARG H 1.0 1.9 5.1 238 188 A 77 TYR HBy A 77 TYR H 1.0 1.7 3.3 239 189 A 36 ASN H A 36 ASN HBy 1.0 2.0 6.0 240 190 A 57 GLY HAy A 57 GLY H 1.0 1.6 3.0 241 191 A 72 ARG HGx A 72 ARG H 1.0 1.8 4.0 242 192 A 9 ARG H A 8 PRO HBx 1.0 2.0 4.6 243 193 A 56 LYS H A 56 LYS HGx 1.0 2.0 5.2 244 194 A 75 LYS HB2 A 75 LYS H 1.0 1.6 2.8 245 194 A 75 LYS HB3 A 75 LYS H 1.0 1.6 2.8 246 195 A 15 TYR HA A 18 PHE H 1.0 2.0 5.0 247 196 A 36 ASN HD21 A 36 ASN HD22 1.0 1.3 2.2 248 197 A 20 GLN HA A 21 THR H 1.0 2.0 5.2 249 198 A 49 LYS HA A 50 THR H 1.0 1.9 4.5 250 199 A 36 ASN HD21 A 39 GLU HGx 1.0 2.0 5.8 251 200 A 83 GLU H A 83 GLU HB2 1.0 1.8 3.6 252 200 A 83 GLU H A 83 GLU HB3 1.0 1.8 3.6 253 201 A 42 LYS HBy A 42 LYS H 1.0 1.6 3.0 254 202 A 74 MET HA A 74 MET H 1.0 1.8 3.8 255 203 A 73 GLU HGx A 73 GLU H 1.0 2.0 5.6 256 204 A 47 ARG HBx A 48 TRP H 1.0 2.0 5.0 257 205 A 24 GLU HBx A 24 GLU H 1.0 1.8 3.6 258 206 A 27 LYS HB2 A 26 HIS H 1.0 2.0 6.0 259 206 A 27 LYS HB3 A 26 HIS H 1.0 2.0 6.0 260 207 A 42 LYS HGy A 42 LYS H 1.0 2.0 5.6 261 207 A 42 LYS HD3 A 42 LYS H 1.0 2.0 5.6 262 207 A 42 LYS HD2 A 42 LYS H 1.0 2.0 5.6 263 208 A 78 ILE H A 77 TYR H 1.0 2.0 6.0 264 209 A 32 ASP H A 32 ASP HBx 1.0 1.8 3.6 265 210 A 38 SER H A 37 PHE HA 1.0 1.9 4.5 266 211 A 43 LYS HGx A 43 LYS H 1.0 1.8 3.6 267 212 A 22 CYS HBx A 23 ARG H 1.0 1.9 5.3 268 213 A 7 LYS H A 7 LYS HA 1.0 1.8 3.6 269 214 A 39 GLU H A 40 PHE H 1.0 1.8 3.8 270 215 A 9 ARG H A 10 GLY H 1.0 2.0 4.8 271 216 A 44 CYS HBy A 44 CYS H 1.0 1.9 4.7 272 217 A 48 TRP HE1 A 15 TYR HBx 1.0 1.9 4.5 273 218 A 29 LYS HBy A 30 HIS H 1.0 1.9 4.7 274 219 A 22 CYS HBy A 23 ARG H 1.0 1.9 4.5 275 220 A 32 ASP H A 31 PRO HDy 1.0 2.0 5.6 276 221 A 6 LYS H A 5 PRO HBx 1.0 1.9 4.5 277 222 A 64 LYS H A 65 ALA H 1.0 1.8 3.6 278 223 A 70 TYR HBy A 71 GLU H 1.0 1.8 3.8 279 224 A 9 ARG H A 9 ARG HGx 1.0 2.0 5.0 280 225 A 11 LYS H A 11 LYS HDy 1.0 1.9 4.5 281 225 A 11 LYS H A 11 LYS HB3 1.0 1.9 4.5 282 226 A 58 LYS HBy A 58 LYS H 1.0 1.7 3.1 283 227 A 55 GLU H A 56 LYS H 1.0 1.8 3.6 284 228 A 51 MET H A 51 MET HE% 1.0 1.8 3.4 285 228 A 51 MET H A 51 MET HBx 1.0 1.8 3.4 286 229 A 35 VAL H A 34 SER HA 1.0 1.6 2.8 287 230 A 59 PHE HBx A 60 GLU H 1.0 1.9 4.9 288 231 A 78 ILE H A 79 PRO HDy 1.0 2.0 6.0 289 232 A 41 SER HA A 42 LYS H 1.0 1.9 3.9 290 232 A 41 SER HBx A 42 LYS H 1.0 1.9 3.9 291 232 A 41 SER HBy A 42 LYS H 1.0 1.9 3.9 292 233 A 76 THR H A 75 LYS HA 1.0 2.0 4.4 293 234 A 51 MET H A 56 LYS HEy 1.0 1.9 4.1 294 235 A 19 VAL HGx% A 23 ARG H 1.0 2.0 5.6 295 236 A 48 TRP HE1 A 15 TYR HE% 1.0 2.0 6.0 296 237 A 70 TYR HA A 70 TYR H 1.0 1.8 3.8 297 238 A 18 PHE HA A 21 THR H 1.0 2.0 5.6 298 239 A 45 SER HA A 45 SER H 1.0 1.8 4.0 299 240 A 26 HIS HA A 26 HIS H 1.0 1.8 3.8 300 241 A 22 CYS HBy A 22 CYS H 1.0 1.9 4.5 301 242 A 15 TYR H A 15 TYR HA 1.0 1.9 4.3 302 243 A 28 LYS HD2 A 28 LYS H 1.0 2.0 5.4 303 243 A 28 LYS HD3 A 28 LYS H 1.0 2.0 5.4 304 244 A 14 SER H A 14 SER HA 1.0 1.8 4.2 305 245 A 48 TRP HE1 A 48 TRP HD1 1.0 1.8 3.6 306 246 A 73 GLU HA A 73 GLU H 1.0 1.9 3.9 307 247 A 51 MET H A 51 MET HBy 1.0 1.8 3.6 308 248 A 77 TYR H A 77 TYR HBx 1.0 1.7 3.3 309 249 A 62 MET H A 63 ALA H 1.0 1.8 3.6 310 250 A 56 LYS HBy A 57 GLY H 1.0 2.0 5.6 311 251 A 49 LYS HBy A 50 THR H 1.0 1.9 3.9 312 251 A 49 LYS HBx A 50 THR H 1.0 1.9 3.9 313 252 A 47 ARG HGy A 47 ARG H 1.0 1.9 4.5 314 252 A 47 ARG HGx A 47 ARG H 1.0 1.9 4.5 315 253 A 19 VAL H A 20 GLN H 1.0 1.9 4.3 316 254 A 13 SER H A 13 SER HA 1.0 1.9 4.5 317 255 A 26 HIS HBx A 26 HIS H 1.0 1.8 3.8 318 256 A 24 GLU HBy A 24 GLU H 1.0 1.7 3.3 319 257 A 12 MET H A 11 LYS HA 1.0 1.8 3.8 320 258 A 78 ILE H A 77 TYR HA 1.0 1.5 2.7 321 259 A 71 GLU HBx A 71 GLU H 1.0 1.8 3.4 322 260 A 57 GLY HAx A 57 GLY H 1.0 1.9 4.1 323 261 A 12 MET H A 12 MET HGx 1.0 2.0 5.0 324 262 A 75 LYS HA A 75 LYS H 1.0 1.7 3.3 325 263 A 36 ASN HD21 A 39 GLU HBy 1.0 1.9 6.0 326 263 A 36 ASN HD21 A 39 GLU HBx 1.0 1.9 6.0 327 264 A 18 PHE HA A 19 VAL H 1.0 2.0 5.6 328 265 A 81 LYS H A 81 LYS HA 1.0 1.7 3.3 329 266 A 41 SER H A 40 PHE HBy 1.0 1.8 3.8 330 267 A 38 SER H A 37 PHE HBx 1.0 2.0 5.2 331 267 A 38 SER H A 37 PHE HBy 1.0 2.0 5.2 332 268 A 72 ARG HA A 72 ARG H 1.0 1.8 3.4 333 269 A 18 PHE HBx A 18 PHE H 1.0 2.0 5.0 334 270 A 74 MET HBy A 73 GLU H 1.0 1.9 5.7 335 270 A 74 MET HBx A 73 GLU H 1.0 1.9 5.7 336 271 A 77 TYR H A 76 THR H 1.0 1.7 3.1 337 272 A 66 ASP HBy A 65 ALA H 1.0 1.9 6.0 338 272 A 66 ASP HBx A 65 ALA H 1.0 1.9 6.0 339 273 A 17 PHE H A 14 SER HA 1.0 2.0 6.0 340 274 A 67 LYS HBx A 68 ALA H 1.0 1.9 4.9 341 275 A 49 LYS HD3 A 49 LYS H 1.0 1.9 4.1 342 275 A 49 LYS HGx A 49 LYS H 1.0 1.9 4.1 343 275 A 49 LYS HD2 A 49 LYS H 1.0 1.9 4.1 344 276 A 33 ALA HB% A 34 SER H 1.0 1.9 4.1 345 277 A 12 MET H A 11 LYS H 1.0 2.0 4.8 346 278 A 9 ARG H A 8 PRO HA 1.0 1.7 3.1 347 279 A 36 ASN H A 35 VAL HA 1.0 1.8 3.8 348 280 A 48 TRP HBy A 48 TRP HE1 1.0 2.0 6.0 349 281 A 60 GLU HBx A 61 ASP H 1.0 2.0 5.2 350 282 A 62 MET HA A 63 ALA H 1.0 2.0 5.0 351 283 A 11 LYS H A 10 GLY HAx 1.0 1.8 3.6 352 284 A 64 LYS HA A 65 ALA H 1.0 1.9 4.7 353 285 A 40 PHE HZ A 23 ARG H 1.0 2.0 5.0 354 286 A 58 LYS HGx A 58 LYS H 1.0 2.0 6.0 355 286 A 58 LYS HGy A 58 LYS H 1.0 2.0 6.0 356 287 A 26 HIS HBy A 27 LYS H 1.0 1.8 4.0 357 288 A 77 TYR HBy A 76 THR H 1.0 2.0 6.0 358 289 A 18 PHE H A 19 VAL H 1.0 1.9 4.3 359 290 A 71 GLU HGy A 71 GLU H 1.0 1.8 3.6 360 291 A 55 GLU H A 52 SER H 1.0 2.0 5.6 361 292 A 16 ALA H A 16 ALA HB% 1.0 1.8 3.4 362 293 A 19 VAL HA A 19 VAL H 1.0 1.9 4.7 363 294 A 68 ALA H A 70 TYR H 1.0 2.0 6.0 364 295 A 58 LYS H A 59 PHE H 1.0 1.9 4.1 365 296 A 56 LYS H A 55 GLU HBx 1.0 1.9 3.9 366 297 A 11 LYS H A 11 LYS HA 1.0 1.9 3.9 367 298 A 76 THR H A 75 LYS HB2 1.0 1.8 3.8 368 298 A 76 THR H A 75 LYS HB3 1.0 1.8 3.8 369 299 A 4 ASP H A 4 ASP HBx 1.0 1.8 3.4 370 300 A 45 SER HBy A 45 SER H 1.0 1.7 3.1 371 300 A 45 SER HBx A 45 SER H 1.0 1.7 3.1 372 301 A 64 LYS HB3 A 63 ALA H 1.0 1.9 6.0 373 301 A 64 LYS HB2 A 63 ALA H 1.0 1.9 6.0 374 302 A 23 ARG HBy A 23 ARG H 1.0 1.8 4.0 375 303 A 7 LYS H A 8 PRO HDx 1.0 2.0 6.0 376 304 A 59 PHE HA A 59 PHE H 1.0 1.9 3.9 377 305 A 48 TRP HA A 48 TRP H 1.0 1.9 4.3 378 306 A 53 ALA H A 53 ALA HA 1.0 2.0 4.8 379 307 A 39 GLU H A 39 GLU HA 1.0 1.7 3.3 380 308 A 16 ALA H A 15 TYR HBy 1.0 1.8 3.6 381 308 A 16 ALA H A 15 TYR HBx 1.0 1.8 3.6 382 309 A 7 LYS H A 6 LYS HBy 1.0 1.9 4.5 383 309 A 7 LYS H A 6 LYS HBx 1.0 1.9 4.5 384 310 A 7 LYS H A 7 LYS HGx 1.0 2.0 5.6 385 311 A 82 GLY H A 82 GLY HA3 1.0 1.7 3.3 386 311 A 82 GLY H A 82 GLY HA2 1.0 1.7 3.3 387 312 A 67 LYS HD2 A 68 ALA H 1.0 2.0 5.6 388 312 A 67 LYS HD3 A 68 ALA H 1.0 2.0 5.6 389 313 A 20 GLN HE22 A 17 PHE HA 1.0 2.0 5.8 390 314 A 73 GLU HGy A 73 GLU H 1.0 2.0 5.6 391 315 A 4 ASP H A 4 ASP HBy 1.0 1.9 4.1 392 316 A 7 LYS H A 7 LYS HD2 1.0 1.8 4.0 393 316 A 7 LYS H A 7 LYS HBy 1.0 1.8 4.0 394 317 A 10 GLY H A 9 ARG HA 1.0 1.8 3.4 395 318 A 27 LYS HB3 A 27 LYS H 1.0 1.6 3.0 396 318 A 27 LYS HB2 A 27 LYS H 1.0 1.6 3.0 397 319 A 76 THR H A 73 GLU HA 1.0 1.9 4.9 398 320 A 20 GLN HG2 A 20 GLN H 1.0 2.0 4.8 399 320 A 20 GLN HG3 A 20 GLN H 1.0 2.0 4.8 400 321 A 60 GLU HBx A 57 GLY H 1.0 2.0 5.8 401 322 A 23 ARG HA A 23 ARG H 1.0 1.9 4.5 402 323 A 35 VAL H A 35 VAL HA 1.0 1.8 4.0 403 324 A 19 VAL HB A 20 GLN H 1.0 1.9 4.3 404 325 A 26 HIS HBy A 26 HIS H 1.0 1.7 3.3 405 326 A 40 PHE HD% A 40 PHE H 1.0 1.9 6.0 406 327 A 56 LYS H A 56 LYS HBx 1.0 1.8 3.4 407 328 A 58 LYS HGx A 59 PHE H 1.0 2.0 5.2 408 328 A 58 LYS HGy A 59 PHE H 1.0 2.0 5.2 409 329 A 31 PRO HBy A 30 HIS H 1.0 2.0 4.6 410 329 A 31 PRO HGx A 30 HIS H 1.0 2.0 4.6 411 330 A 46 GLU HBx A 46 GLU H 1.0 1.7 3.3 412 330 A 46 GLU HBy A 46 GLU H 1.0 1.7 3.3 413 331 A 29 LYS HGx A 29 LYS H 1.0 1.7 3.1 414 331 A 29 LYS HBx A 29 LYS H 1.0 1.7 3.1 415 332 A 30 HIS H A 30 HIS HBx 1.0 1.9 3.9 416 333 A 20 GLN HE21 B 45 LEU HD1% 1.0 2.0 5.4 417 333 A 20 GLN HE21 B 45 LEU HD2% 1.0 2.0 5.4 418 334 A 20 GLN HE22 B 45 LEU HD1% 1.0 1.9 4.3 419 334 A 20 GLN HE22 B 45 LEU HD2% 1.0 1.9 4.3 420 335 A 12 MET H A 12 MET HBy 1.0 2.0 5.6 421 336 A 14 SER H A 13 SER HA 1.0 1.7 3.5 422 337 A 15 TYR H A 15 TYR HBx 1.0 1.7 3.3 423 337 A 15 TYR H A 15 TYR HBy 1.0 1.7 3.3 424 338 A 82 GLY H A 81 LYS HA 1.0 1.7 2.9 425 339 A 62 MET HBx A 62 MET H 1.0 1.9 4.1 426 340 A 56 LYS H A 55 GLU HBy 1.0 1.8 4.0 427 340 A 56 LYS H A 55 GLU HBx 1.0 1.8 4.0 428 341 A 72 ARG H A 73 GLU H 1.0 1.8 3.6 429 342 A 54 LYS H A 54 LYS HB2 1.0 1.9 4.1 430 342 A 54 LYS H A 54 LYS HB3 1.0 1.9 4.1 431 343 A 60 GLU HBy A 60 GLU H 1.0 1.9 4.1 432 344 A 52 SER H A 51 MET HE% 1.0 2.0 5.4 433 344 A 52 SER H A 51 MET HBx 1.0 2.0 5.4 434 345 A 76 THR HB A 76 THR H 1.0 1.7 3.5 435 345 A 76 THR HA A 76 THR H 1.0 1.7 3.5 436 346 A 76 THR H A 75 LYS H 1.0 1.8 3.4 437 347 A 20 GLN HE22 A 12 MET HE% 1.0 2.0 5.2 438 348 A 51 MET H A 51 MET HA 1.0 1.8 3.8 439 349 A 73 GLU HA A 75 LYS H 1.0 2.0 5.0 440 350 A 67 LYS HA A 67 LYS H 1.0 1.8 3.8 441 351 A 41 SER HA A 43 LYS H 1.0 2.0 5.0 442 352 A 23 ARG HBx A 23 ARG H 1.0 1.9 4.1 443 353 A 67 LYS HBy A 68 ALA H 1.0 1.7 3.3 444 354 A 33 ALA HB% A 32 ASP H 1.0 2.0 5.4 445 355 A 44 CYS HBy A 45 SER H 1.0 2.0 5.2 446 356 A 18 PHE HBy A 18 PHE H 1.0 1.8 3.8 447 357 A 48 TRP HE1 A 56 LYS HDx 1.0 2.0 5.4 448 357 A 48 TRP HE1 A 56 LYS HDy 1.0 2.0 5.4 449 358 A 67 LYS HBy A 67 LYS H 1.0 1.8 3.6 450 359 A 27 LYS HA A 27 LYS H 1.0 1.8 3.6 451 360 A 44 CYS HBx A 45 SER H 1.0 1.9 4.3 452 361 A 73 GLU HBy A 73 GLU H 1.0 2.0 4.6 453 362 A 52 SER H A 55 GLU HBy 1.0 2.0 4.6 454 362 A 52 SER H A 55 GLU HBx 1.0 2.0 4.6 455 363 A 64 LYS HB2 A 65 ALA H 1.0 1.8 3.4 456 363 A 64 LYS HB3 A 65 ALA H 1.0 1.8 3.4 457 364 A 37 PHE HBy A 37 PHE H 1.0 2.0 6.0 458 365 A 36 ASN HD22 A 39 GLU HBy 1.0 1.8 6.0 459 365 A 36 ASN HD22 A 39 GLU HBx 1.0 1.8 6.0 460 366 A 19 VAL HB A 19 VAL H 1.0 1.8 3.6 461 367 A 58 LYS HBx A 58 LYS H 1.0 1.9 3.7 462 368 A 20 GLN HA A 20 GLN H 1.0 1.9 4.3 463 369 A 41 SER H A 41 SER HBy 1.0 1.7 3.3 464 369 A 41 SER H A 41 SER HBx 1.0 1.7 3.3 465 369 A 41 SER H A 41 SER HA 1.0 1.7 3.3 466 370 A 70 TYR HA A 69 ARG H 1.0 2.0 5.2 467 371 A 9 ARG H A 9 ARG HB3 1.0 1.7 3.3 468 371 A 9 ARG H A 9 ARG HB2 1.0 1.7 3.3 469 372 A 18 PHE HD% A 18 PHE H 1.0 2.0 6.0 470 373 A 49 LYS HBy A 49 LYS H 1.0 1.6 3.0 471 373 A 49 LYS HBx A 49 LYS H 1.0 1.6 3.0 472 374 A 30 HIS H A 30 HIS HBy 1.0 2.0 5.6 473 375 A 7 LYS H A 5 PRO HA 1.0 2.0 4.6 474 376 A 13 SER H A 13 SER HBx 1.0 1.9 4.1 475 377 A 22 CYS H A 23 ARG H 1.0 1.8 4.2 476 378 A 59 PHE H A 61 ASP H 1.0 2.0 6.0 477 379 A 70 TYR HE% A 70 TYR H 1.0 1.9 6.0 478 380 A 60 GLU HGy A 60 GLU H 1.0 2.0 5.4 479 381 A 10 GLY H A 10 GLY HAx 1.0 1.9 3.9 480 382 A 24 GLU HGy A 24 GLU H 1.0 2.0 5.4 481 383 A 27 LYS HG2 A 27 LYS H 1.0 2.0 4.8 482 383 A 27 LYS HG3 A 27 LYS H 1.0 2.0 4.8 483 384 A 60 GLU H A 61 ASP H 1.0 1.8 3.8 484 385 A 78 ILE H A 77 TYR HBx 1.0 2.0 5.8 485 386 A 55 GLU HG2 A 52 SER H 1.0 1.9 4.7 486 386 A 55 GLU HG3 A 52 SER H 1.0 1.9 4.7 487 387 A 17 PHE H A 12 MET HE% 1.0 2.0 5.2 488 388 A 32 ASP HA A 32 ASP H 1.0 1.8 3.4 489 389 A 17 PHE H A 16 ALA HB% 1.0 1.9 4.3 490 390 A 83 GLU H A 82 GLY H 1.0 1.8 4.0 491 391 A 36 ASN HD22 A 36 ASN HBy 1.0 2.0 5.2 492 392 A 48 TRP HE1 A 48 TRP HH2 1.0 2.0 5.8 493 393 A 39 GLU H A 38 SER H 1.0 2.0 5.0 494 394 A 14 SER H A 63 ALA HB% 1.0 1.9 4.3 495 395 A 34 SER H A 35 VAL H 1.0 2.0 6.0 496 396 A 62 MET HE% A 59 PHE HD% 1.0 1.8 3.4 497 397 A 62 MET HBx A 62 MET HBy 1.0 1.8 3.6 498 398 A 36 ASN HBx A 39 GLU HGy 1.0 2.0 5.0 499 399 A 50 THR HG2% A 50 THR H 1.0 1.7 3.3 500 400 A 17 PHE HE% A 17 PHE HA 1.0 2.0 5.0 501 401 A 23 ARG HGy A 23 ARG HDx 1.0 1.8 3.8 502 401 A 23 ARG HDx A 23 ARG HGx 1.0 1.8 3.8 503 402 A 57 GLY HAx A 60 GLU HGx 1.0 2.0 6.0 504 402 A 57 GLY HAx A 60 GLU HGy 1.0 2.0 6.0 505 403 A 62 MET HGx A 62 MET HGy 1.0 1.5 2.7 506 404 A 76 THR HG2% A 75 LYS HB2 1.0 1.8 3.6 507 404 A 76 THR HG2% A 75 LYS HB3 1.0 1.8 3.6 508 405 A 56 LYS HDx A 51 MET HE% 1.0 2.0 5.4 509 405 A 56 LYS HDy A 51 MET HE% 1.0 2.0 5.4 510 406 A 40 PHE HD% A 35 VAL HGy% 1.0 1.9 4.3 511 407 A 17 PHE HE% A 12 MET HE% 1.0 1.9 3.9 512 408 A 57 GLY HAx A 60 GLU HBy 1.0 1.8 3.8 513 409 A 13 SER HBx A 13 SER HBy 1.0 1.8 3.4 514 410 A 35 VAL HGx% A 35 VAL HGy% 1.0 1.5 2.5 515 411 A 51 MET HA A 56 LYS HEy 1.0 2.0 5.6 516 412 A 74 MET HBy A 74 MET HA 1.0 1.7 3.3 517 412 A 74 MET HBx A 74 MET HA 1.0 1.7 3.3 518 413 A 7 LYS HBy A 77 TYR HD% 1.0 2.0 6.0 519 414 A 22 CYS HBx A 40 PHE HZ 1.0 2.0 6.0 520 415 A 58 LYS HBx A 58 LYS HBy 1.0 1.3 2.2 521 416 A 31 PRO HBy A 31 PRO HDy 1.0 2.0 5.0 522 417 A 77 TYR HBx A 77 TYR HD% 1.0 1.7 3.3 523 418 A 78 ILE H A 78 ILE HG2% 1.0 2.0 5.0 524 419 A 31 PRO HDx A 31 PRO HDy 1.0 1.4 2.2 525 420 A 71 GLU HA A 71 GLU HGy 1.0 1.8 4.2 526 421 A 80 PRO HBx A 80 PRO HDx 1.0 1.9 4.5 527 422 A 75 LYS HA A 75 LYS HE2 1.0 2.0 6.0 528 422 A 75 LYS HA A 75 LYS HE3 1.0 2.0 6.0 529 423 A 8 PRO HBy A 8 PRO HDy 1.0 2.0 6.0 530 424 A 62 MET HGx A 62 MET HA 1.0 2.0 4.6 531 425 A 56 LYS HBx A 56 LYS HDy 1.0 1.9 4.3 532 425 A 56 LYS HBx A 56 LYS HDx 1.0 1.9 4.3 533 426 A 58 LYS HGx A 59 PHE H 1.0 1.9 4.5 534 427 A 78 ILE HA A 79 PRO HDx 1.0 1.4 2.2 535 427 A 78 ILE HA A 79 PRO HDy 1.0 1.4 2.2 536 428 A 23 ARG HGx A 23 ARG HDy 1.0 1.8 3.8 537 428 A 23 ARG HGy A 23 ARG HDy 1.0 1.8 3.8 538 429 A 40 PHE HA A 43 LYS H 1.0 1.9 4.5 539 430 A 60 GLU HBx A 60 GLU HA 1.0 1.9 4.1 540 431 A 58 LYS HBy A 58 LYS HGy 1.0 1.7 3.3 541 431 A 58 LYS HBy A 58 LYS HGx 1.0 1.7 3.3 542 432 A 79 PRO HDy A 77 TYR HD% 1.0 1.9 4.5 543 433 A 58 LYS HBy A 59 PHE H 1.0 1.8 3.4 544 434 A 70 TYR HBx A 67 LYS HA 1.0 2.0 5.4 545 435 A 16 ALA HA A 19 VAL H 1.0 1.9 4.9 546 436 A 7 LYS HBy A 8 PRO HA 1.0 2.0 5.2 547 437 A 72 ARG HGy A 72 ARG HB2 1.0 1.7 3.1 548 437 A 72 ARG HGy A 72 ARG HB3 1.0 1.7 3.1 549 438 A 49 LYS HBx A 50 THR HG2% 1.0 1.7 3.3 550 438 A 49 LYS HBy A 50 THR HG2% 1.0 1.7 3.3 551 439 A 26 HIS HBx A 26 HIS HD2 1.0 2.0 4.8 552 440 A 61 ASP HBx A 58 LYS HA 1.0 1.9 4.5 553 441 A 6 LYS HA A 6 LYS HD3 1.0 1.8 4.0 554 441 A 6 LYS HA A 6 LYS HD2 1.0 1.8 4.0 555 442 A 31 PRO HGy A 31 PRO HA 1.0 1.7 2.9 556 442 A 31 PRO HBy A 31 PRO HA 1.0 1.7 2.9 557 443 A 80 PRO HBx A 80 PRO HA 1.0 1.7 3.1 558 444 A 19 VAL HGx% A 19 VAL H 1.0 2.0 5.0 559 445 A 56 LYS HEx A 56 LYS HDx 1.0 2.0 4.8 560 446 A 23 ARG HGy A 40 PHE HZ 1.0 2.0 5.4 561 446 A 23 ARG HGy A 40 PHE HE% 1.0 2.0 5.4 562 447 A 67 LYS HBx A 67 LYS HG3 1.0 1.8 3.4 563 447 A 67 LYS HBx A 67 LYS HG2 1.0 1.8 3.4 564 448 A 68 ALA HA A 71 GLU HBy 1.0 2.0 6.0 565 449 A 47 ARG HDy A 18 PHE HZ 1.0 2.0 5.2 566 450 A 31 PRO HGx A 31 PRO HA 1.0 2.0 5.6 567 451 A 48 TRP HBy A 48 TRP HD1 1.0 1.9 4.7 568 452 A 38 SER HA A 38 SER HBx 1.0 1.9 4.7 569 453 A 37 PHE HA A 37 PHE HE% 1.0 2.0 5.6 570 454 A 5 PRO HBy A 4 ASP HBx 1.0 2.0 6.0 571 454 A 5 PRO HG2 A 4 ASP HBx 1.0 2.0 6.0 572 454 A 5 PRO HG3 A 4 ASP HBx 1.0 2.0 6.0 573 455 A 12 MET HA A 12 MET HGx 1.0 1.9 4.1 574 456 A 24 GLU HBy A 24 GLU HA 1.0 1.8 4.0 575 457 A 31 PRO HBy A 31 PRO HDx 1.0 1.9 5.3 576 458 A 41 SER HA A 40 PHE HE% 1.0 2.0 5.2 577 458 A 41 SER HA A 40 PHE HD% 1.0 2.0 5.2 578 459 A 47 ARG HGx A 18 PHE HZ 1.0 2.0 4.6 579 460 A 35 VAL HGx% A 40 PHE HE% 1.0 1.8 3.8 580 460 A 35 VAL HGx% A 40 PHE HD% 1.0 1.8 3.8 581 461 A 44 CYS HA A 45 SER H 1.0 2.0 4.6 582 462 A 7 LYS HBy A 8 PRO HDx 1.0 1.9 4.3 583 463 A 40 PHE HBy A 40 PHE HA 1.0 1.9 4.3 584 464 A 47 ARG HGy A 47 ARG HA 1.0 1.8 4.0 585 465 A 59 PHE HD% A 58 LYS HEx 1.0 2.0 6.0 586 466 A 51 MET H A 51 MET HBx 1.0 1.9 4.1 587 467 A 76 THR HG2% A 76 THR HA 1.0 1.5 2.5 588 467 A 76 THR HG2% A 76 THR HB 1.0 1.5 2.5 589 468 A 78 ILE HD1% A 78 ILE HB 1.0 1.5 2.7 590 469 A 56 LYS HEy A 53 ALA HA 1.0 2.0 5.6 591 470 A 29 LYS HGy A 29 LYS HA 1.0 1.8 3.6 592 471 A 77 TYR HE% A 79 PRO HBx 1.0 2.0 5.2 593 472 A 23 ARG HA A 23 ARG HBx 1.0 1.8 4.0 594 473 A 12 MET H A 12 MET HBx 1.0 1.9 4.1 595 474 A 33 ALA HB% A 33 ALA HA 1.0 1.6 2.8 596 475 A 29 LYS HE3 A 29 LYS HGx 1.0 1.8 4.0 597 475 A 29 LYS HE2 A 29 LYS HGx 1.0 1.8 4.0 598 476 A 67 LYS HD2 A 67 LYS HE2 1.0 1.6 3.0 599 476 A 67 LYS HD3 A 67 LYS HE3 1.0 1.6 3.0 600 476 A 67 LYS HD3 A 67 LYS HE2 1.0 1.6 3.0 601 476 A 67 LYS HD2 A 67 LYS HE3 1.0 1.6 3.0 602 477 A 8 PRO HBy A 8 PRO HDy 1.0 1.8 3.6 603 477 A 8 PRO HGy A 8 PRO HDy 1.0 1.8 3.6 604 478 A 77 TYR HE% A 7 LYS HE2 1.0 2.0 5.0 605 478 A 77 TYR HE% A 7 LYS HE3 1.0 2.0 5.0 606 479 A 49 LYS HD3 A 50 THR HG2% 1.0 0.0 6.0 607 479 A 49 LYS HD2 A 50 THR HG2% 1.0 0.0 6.0 608 479 A 49 LYS HGx A 50 THR HG2% 1.0 0.0 6.0 609 480 A 17 PHE HBy A 17 PHE HA 1.0 2.0 4.6 610 481 A 29 LYS HBy A 29 LYS HGx 1.0 1.4 2.2 611 481 A 29 LYS HBy A 29 LYS HBx 1.0 1.4 2.2 612 482 A 77 TYR HE% A 80 PRO HDy 1.0 2.0 6.0 613 483 A 18 PHE HD% A 18 PHE HE% 1.0 1.9 4.3 614 484 A 28 LYS HBy A 29 LYS HGy 1.0 1.8 4.0 615 485 A 15 TYR HE% B 44 MET HE% 1.0 2.0 5.4 616 486 A 50 THR HG2% A 46 GLU HA 1.0 1.8 4.0 617 487 A 47 ARG HGx A 47 ARG H 1.0 2.0 5.0 618 488 A 40 PHE HD% A 40 PHE HBy 1.0 1.8 4.0 619 489 A 33 ALA HB% A 27 LYS HA 1.0 2.0 4.6 620 490 A 32 ASP HA A 32 ASP HBx 1.0 1.7 3.5 621 491 A 78 ILE HD1% A 77 TYR HD% 1.0 0.0 6.0 622 492 A 58 LYS HBy A 58 LYS HGy 1.0 1.9 4.1 623 493 A 53 ALA HB% A 53 ALA HA 1.0 1.5 2.7 624 494 A 78 ILE HA A 78 ILE HG2% 1.0 1.6 2.8 625 495 A 63 ALA HB% A 64 LYS H 1.0 1.8 3.4 626 496 A 5 PRO HDy A 4 ASP HA 1.0 1.6 2.8 627 497 A 50 THR HB A 50 THR HG2% 1.0 1.6 2.6 628 498 A 31 PRO HGy A 30 HIS HA 1.0 2.0 6.0 629 499 A 61 ASP HA A 62 MET H 1.0 2.0 4.8 630 500 A 50 THR HG2% A 47 ARG HA 1.0 1.9 4.3 631 501 A 35 VAL HGy% A 37 PHE HD% 1.0 2.0 6.0 632 502 A 51 MET HE% A 18 PHE HE% 1.0 1.8 3.6 633 503 A 49 LYS HGx A 49 LYS H 1.0 1.9 4.5 634 504 A 19 VAL HGx% A 23 ARG HGx 1.0 2.0 5.2 635 505 A 48 TRP HBx A 48 TRP HD1 1.0 1.9 4.3 636 505 A 48 TRP HBy A 48 TRP HD1 1.0 1.9 4.3 637 506 A 15 TYR HE% A 48 TRP HD1 1.0 2.0 5.6 638 507 A 15 TYR HE% A 18 PHE HE% 1.0 2.0 5.8 639 508 A 60 GLU HBy A 62 MET H 1.0 2.0 6.0 640 509 A 29 LYS HBy A 29 LYS HGy 1.0 1.9 4.1 641 510 A 15 TYR HD% B 44 MET HB3 1.0 2.0 6.0 642 510 A 15 TYR HD% B 44 MET HE% 1.0 2.0 6.0 643 511 A 29 LYS HGx A 29 LYS H 1.0 2.0 5.0 644 512 A 29 LYS HBx A 29 LYS HA 1.0 1.8 3.8 645 513 A 72 ARG HB2 A 72 ARG H 1.0 1.7 3.3 646 513 A 72 ARG HB3 A 72 ARG H 1.0 1.7 3.3 647 514 A 62 MET HGy A 62 MET HBy 1.0 2.0 5.4 648 515 A 46 GLU HGx B 43 LEU HD1% 1.0 2.0 5.6 649 516 A 19 VAL HGy% A 19 VAL HB 1.0 1.7 3.1 650 517 A 56 LYS HDy A 56 LYS HEy 1.0 1.9 4.7 651 518 A 59 PHE HBx A 59 PHE HA 1.0 2.0 5.0 652 519 A 24 GLU HA A 24 GLU H 1.0 1.7 3.5 653 520 A 26 HIS HE1 A 30 HIS HD2 1.0 2.0 6.0 654 521 A 7 LYS HGx A 8 PRO HDy 1.0 2.0 5.6 655 522 A 62 MET HE% A 58 LYS HGx 1.0 1.8 3.8 656 523 A 62 MET HBy A 63 ALA H 1.0 2.0 6.0 657 524 A 62 MET HE% A 21 THR HG2% 1.0 1.6 2.8 658 525 A 21 THR HG2% A 21 THR H 1.0 1.8 3.4 659 526 A 51 MET HA A 51 MET HG2 1.0 1.8 3.6 660 526 A 51 MET HA A 51 MET HG3 1.0 1.8 3.6 661 527 A 62 MET HA A 62 MET HBx 1.0 2.0 5.0 662 528 A 30 HIS HBy A 26 HIS HE1 1.0 1.9 6.0 663 529 A 77 TYR HA A 77 TYR HD% 1.0 1.7 3.3 664 530 A 7 LYS HGy A 7 LYS HA 1.0 1.8 4.0 665 531 A 18 PHE HBx A 18 PHE HD% 1.0 1.9 4.7 666 532 A 48 TRP HBx A 48 TRP HA 1.0 1.9 4.1 667 533 A 44 CYS HBx A 44 CYS HA 1.0 2.0 4.6 668 534 A 11 LYS HB3 A 11 LYS HEy 1.0 1.7 3.5 669 534 A 11 LYS HB2 A 11 LYS HEy 1.0 1.7 3.5 670 534 A 11 LYS HDy A 11 LYS HEy 1.0 1.7 3.5 671 535 A 35 VAL HGx% A 39 GLU HBy 1.0 2.0 6.0 672 535 A 35 VAL HGx% A 39 GLU HBx 1.0 2.0 6.0 673 536 A 45 SER HBx A 46 GLU H 1.0 2.0 5.6 674 537 A 6 LYS H A 6 LYS HBx 1.0 1.7 3.3 675 538 A 12 MET HGx A 12 MET HBx 1.0 1.9 4.7 676 539 A 78 ILE HA A 77 TYR HD% 1.0 2.0 4.4 677 540 A 22 CYS HBx A 22 CYS HA 1.0 1.8 4.0 678 541 A 78 ILE HA A 78 ILE HD1% 1.0 1.7 2.9 679 541 A 78 ILE HA A 78 ILE HG2% 1.0 1.7 2.9 680 542 A 35 VAL HA A 35 VAL HGy% 1.0 1.9 3.7 681 543 A 29 LYS HGy A 29 LYS HGx 1.0 1.2 2.2 682 544 A 52 SER H A 52 SER HBx 1.0 1.9 4.3 683 545 A 71 GLU HA A 71 GLU HBy 1.0 1.8 3.6 684 546 A 36 ASN HBy A 39 GLU HGy 1.0 1.9 4.1 685 547 A 7 LYS HBx A 8 PRO HDx 1.0 1.9 6.0 686 548 A 48 TRP HBy A 15 TYR HD% 1.0 2.0 5.8 687 548 A 48 TRP HBx A 15 TYR HD% 1.0 2.0 5.8 688 549 A 11 LYS HGy A 70 TYR HD% 1.0 2.0 5.8 689 550 A 72 ARG HA A 72 ARG HB3 1.0 1.6 2.8 690 550 A 72 ARG HA A 72 ARG HB2 1.0 1.6 2.8 691 551 A 23 ARG HBx A 23 ARG HDy 1.0 2.0 5.4 692 552 A 30 HIS HBy A 30 HIS HD2 1.0 2.0 6.0 693 553 A 77 TYR HBy A 78 ILE HG2% 1.0 1.9 6.0 694 553 A 77 TYR HBy A 78 ILE HD1% 1.0 1.9 6.0 695 554 A 56 LYS H A 56 LYS HEy 1.0 1.9 6.0 696 555 A 16 ALA HA A 19 VAL HB 1.0 1.9 4.1 697 556 A 56 LYS HEx A 56 LYS HDx 1.0 1.7 3.3 698 556 A 56 LYS HEx A 56 LYS HDy 1.0 1.7 3.3 699 557 A 67 LYS HBx A 67 LYS HD2 1.0 1.9 4.3 700 557 A 67 LYS HBx A 67 LYS HD3 1.0 1.9 4.3 701 558 A 7 LYS HGy A 8 PRO HDy 1.0 2.0 6.0 702 559 A 48 TRP HA A 49 LYS H 1.0 1.9 4.5 703 560 A 31 PRO HGy A 31 PRO HDy 1.0 1.6 2.8 704 560 A 31 PRO HGx A 31 PRO HDy 1.0 1.6 2.8 705 561 A 15 TYR HD% A 15 TYR HE% 1.0 1.7 3.3 706 562 A 56 LYS HBx A 56 LYS HGy 1.0 1.9 4.1 707 563 A 56 LYS HEx A 56 LYS HGx 1.0 1.9 4.1 708 564 A 43 LYS HE2 A 43 LYS H 1.0 1.9 4.5 709 565 A 13 SER HA A 13 SER HBx 1.0 1.9 4.3 710 566 A 37 PHE HBy A 37 PHE HD% 1.0 1.9 4.5 711 566 A 37 PHE HBx A 37 PHE HD% 1.0 1.9 4.5 712 567 A 12 MET HGx A 12 MET HE% 1.0 1.8 3.6 713 568 A 16 ALA HA A 16 ALA HB% 1.0 1.8 3.4 714 569 A 18 PHE HZ A 44 CYS HA 1.0 2.0 5.4 715 570 A 5 PRO HDy A 4 ASP HBy 1.0 1.9 4.9 716 570 A 5 PRO HDx A 4 ASP HBy 1.0 1.9 4.9 717 571 A 51 MET HG2 A 56 LYS HEy 1.0 1.9 4.3 718 571 A 51 MET HG3 A 56 LYS HEy 1.0 1.9 4.3 719 572 A 11 LYS HB2 A 11 LYS HGy 1.0 1.8 3.8 720 572 A 11 LYS HB3 A 11 LYS HGy 1.0 1.8 3.8 721 573 A 6 LYS HBx A 77 TYR HE% 1.0 1.9 4.9 722 574 A 71 GLU HA A 70 TYR HD% 1.0 2.0 4.8 723 575 A 47 ARG HBx A 18 PHE HZ 1.0 2.0 5.8 724 576 A 49 LYS HGx A 49 LYS HE2 1.0 1.8 3.6 725 576 A 49 LYS HGx A 49 LYS HE3 1.0 1.8 3.6 726 577 A 30 HIS HD2 A 29 LYS H 1.0 2.0 5.6 727 578 A 18 PHE HA A 18 PHE HBx 1.0 1.9 4.1 728 579 A 47 ARG HGx A 47 ARG HA 1.0 1.9 4.3 729 580 A 58 LYS HGy A 62 MET HBy 1.0 2.0 6.0 730 580 A 58 LYS HGx A 62 MET HBy 1.0 2.0 6.0 731 581 A 58 LYS HD2 A 58 LYS HGy 1.0 1.5 2.7 732 581 A 58 LYS HD2 A 58 LYS HGx 1.0 1.5 2.7 733 581 A 58 LYS HD3 A 58 LYS HGy 1.0 1.5 2.7 734 581 A 58 LYS HD3 A 58 LYS HGx 1.0 1.5 2.7 735 582 A 51 MET HBy A 56 LYS HEy 1.0 1.7 3.5 736 583 A 72 ARG HGy A 72 ARG HD3 1.0 1.6 3.0 737 583 A 72 ARG HGy A 72 ARG HD2 1.0 1.6 3.0 738 584 A 17 PHE HE% A 63 ALA HB% 1.0 2.0 5.0 739 585 A 79 PRO HDy A 79 PRO HGx 1.0 1.7 3.3 740 586 A 30 HIS H A 30 HIS HD2 1.0 2.0 4.6 741 587 A 11 LYS HGx A 11 LYS HEx 1.0 1.8 3.8 742 588 A 7 LYS HA A 7 LYS HD3 1.0 2.0 5.8 743 588 A 7 LYS HA A 7 LYS HD2 1.0 2.0 5.8 744 589 A 23 ARG HBx A 23 ARG HGx 1.0 1.9 4.5 745 590 A 71 GLU HGx A 71 GLU H 1.0 2.0 4.6 746 591 A 28 LYS HGx A 28 LYS HA 1.0 1.7 3.5 747 592 A 19 VAL HGx% A 19 VAL HA 1.0 1.9 3.7 748 593 A 61 ASP HA A 64 LYS HGy 1.0 1.9 4.1 749 594 A 63 ALA HB% A 63 ALA H 1.0 1.6 3.0 750 595 A 42 LYS HGy A 42 LYS HE3 1.0 1.6 2.8 751 595 A 42 LYS HGy A 42 LYS HE2 1.0 1.6 2.8 752 596 A 65 ALA HB% A 62 MET HA 1.0 1.7 3.5 753 597 A 51 MET HG3 A 51 MET HBx 1.0 1.7 3.3 754 597 A 51 MET HG2 A 51 MET HBx 1.0 1.7 3.3 755 597 A 51 MET HG2 A 51 MET HE% 1.0 1.7 3.3 756 598 A 53 ALA HB% A 54 LYS H 1.0 2.0 5.6 757 599 A 51 MET HE% A 48 TRP HA 1.0 1.9 3.9 758 599 A 51 MET HBx A 48 TRP HA 1.0 1.9 3.9 759 600 A 66 ASP HBx A 63 ALA HA 1.0 2.0 4.8 760 600 A 66 ASP HBy A 63 ALA HA 1.0 2.0 4.8 761 601 A 17 PHE HBx A 17 PHE HA 1.0 1.9 4.5 762 602 A 48 TRP HE3 A 48 TRP HZ3 1.0 2.0 4.4 763 603 A 78 ILE HG2% A 79 PRO HDy 1.0 2.0 4.8 764 604 A 11 LYS HGx A 11 LYS HA 1.0 1.8 4.0 765 605 A 59 PHE HD% A 59 PHE HA 1.0 1.9 4.1 766 606 A 5 PRO HA A 6 LYS HG3 1.0 2.0 5.2 767 606 A 5 PRO HA A 6 LYS HG2 1.0 2.0 5.2 768 607 A 7 LYS HGy A 77 TYR HD% 1.0 2.0 6.0 769 608 A 70 TYR HE% A 11 LYS HEx 1.0 2.0 6.0 770 609 A 80 PRO HDx A 79 PRO HA 1.0 1.7 3.1 771 610 A 62 MET HE% A 58 LYS HEx 1.0 1.7 3.3 772 611 A 70 TYR HA A 70 TYR HD% 1.0 1.9 4.3 773 612 A 72 ARG HD3 A 72 ARG H 1.0 2.0 5.8 774 612 A 72 ARG HD2 A 72 ARG H 1.0 2.0 5.8 775 613 A 55 GLU HG2 A 55 GLU HBy 1.0 1.7 3.3 776 613 A 55 GLU HG3 A 55 GLU HBy 1.0 1.7 3.3 777 614 A 26 HIS HBx A 26 HIS HA 1.0 1.8 3.6 778 615 A 7 LYS HA A 8 PRO HGx 1.0 1.9 6.0 779 616 A 21 THR HB A 21 THR HA 1.0 1.9 4.1 780 617 A 19 VAL HGy% A 15 TYR HD% 1.0 2.0 5.4 781 618 A 77 TYR HD% A 79 PRO HDx 1.0 1.9 4.5 782 618 A 79 PRO HDy A 77 TYR HD% 1.0 1.9 4.5 783 619 A 7 LYS H A 7 LYS HBy 1.0 2.0 4.6 784 620 A 30 HIS H A 29 LYS HGx 1.0 2.0 6.0 785 621 A 63 ALA HB% A 17 PHE HZ 1.0 2.0 5.8 786 622 A 17 PHE HE% A 12 MET HBx 1.0 2.0 4.6 787 623 A 49 LYS HD2 A 49 LYS H 1.0 2.0 5.4 788 623 A 49 LYS HD3 A 49 LYS H 1.0 2.0 5.4 789 624 A 75 LYS HDy A 75 LYS HA 1.0 1.7 3.1 790 625 A 74 MET HA A 74 MET HE% 1.0 1.8 3.4 791 626 A 58 LYS HEx A 21 THR HG2% 1.0 1.9 5.1 792 627 A 62 MET HBy A 62 MET H 1.0 2.0 5.2 793 628 A 78 ILE HD1% A 77 TYR H 1.0 1.9 4.3 794 629 A 11 LYS HGx A 11 LYS HEy 1.0 1.9 4.3 795 630 A 51 MET HG3 A 48 TRP HA 1.0 2.0 6.0 796 630 A 51 MET HG2 A 48 TRP HA 1.0 2.0 6.0 797 631 A 80 PRO HBy A 80 PRO HA 1.0 1.6 2.8 798 632 A 71 GLU HBx A 71 GLU HGx 1.0 1.9 4.1 799 633 A 11 LYS HGy A 11 LYS HGx 1.0 1.5 2.5 800 634 A 70 TYR HD% A 71 GLU HGx 1.0 2.0 4.6 801 635 A 43 LYS HGy A 43 LYS H 1.0 1.9 4.1 802 636 A 29 LYS HBy A 30 HIS HD2 1.0 1.9 4.7 803 637 A 57 GLY HAx A 57 GLY HAy 1.0 1.7 3.1 804 638 A 78 ILE HA A 79 PRO HDy 1.0 1.4 2.4 805 639 A 53 ALA HB% A 52 SER HA 1.0 2.0 6.0 806 640 A 51 MET HE% A 48 TRP HA 1.0 1.9 3.9 807 641 A 23 ARG HGy A 23 ARG HBy 1.0 1.9 4.5 808 642 A 55 GLU HG2 A 55 GLU HBx 1.0 1.6 2.8 809 642 A 55 GLU HG3 A 55 GLU HBx 1.0 1.6 2.8 810 643 A 22 CYS HBx A 22 CYS HBy 1.0 1.7 3.1 811 644 A 54 LYS H A 54 LYS HE3 1.0 1.9 5.3 812 644 A 54 LYS H A 54 LYS HE2 1.0 1.9 5.3 813 645 A 56 LYS HGx A 51 MET HE% 1.0 1.8 3.4 814 646 A 72 ARG HGy A 72 ARG H 1.0 1.9 4.5 815 647 A 53 ALA HB% A 56 LYS HDy 1.0 0.0 6.0 816 648 A 24 GLU HBy A 24 GLU HGy 1.0 1.8 3.6 817 649 A 21 THR HG2% A 22 CYS H 1.0 1.8 4.0 818 650 A 78 ILE H A 77 TYR HD% 1.0 1.8 3.8 819 651 A 23 ARG HA A 23 ARG HDy 1.0 2.0 5.8 820 652 A 19 VAL HA A 19 VAL HB 1.0 1.9 4.7 821 653 A 8 PRO HGy A 77 TYR HD% 1.0 2.0 6.0 822 654 A 22 CYS HBx A 21 THR HG2% 1.0 1.9 4.3 823 655 A 61 ASP HA A 61 ASP H 1.0 1.8 3.6 824 656 A 33 ALA HB% A 30 HIS HBx 1.0 1.8 3.4 825 657 A 7 LYS HA A 8 PRO HDx 1.0 1.8 3.8 826 658 A 23 ARG HBy A 23 ARG HDx 1.0 2.0 5.0 827 659 A 83 GLU HA A 83 GLU HB2 1.0 1.7 3.5 828 659 A 83 GLU HA A 83 GLU HB3 1.0 1.7 3.5 829 660 A 56 LYS H A 56 LYS HBy 1.0 2.0 6.0 830 661 A 25 GLU HBy A 25 GLU HGy 1.0 1.7 3.1 831 662 A 29 LYS HGy A 29 LYS HDy 1.0 1.6 3.0 832 663 A 5 PRO HDy A 4 ASP HBy 1.0 2.0 6.0 833 664 A 56 LYS HEy A 56 LYS HBy 1.0 2.0 5.6 834 665 A 69 ARG HGx A 69 ARG H 1.0 1.9 5.5 835 666 A 17 PHE HE% A 63 ALA HA 1.0 1.9 3.9 836 667 A 6 LYS H A 5 PRO HDx 1.0 2.0 4.6 837 668 A 68 ALA HB% A 68 ALA H 1.0 1.6 2.8 838 669 A 7 LYS HGx A 77 TYR HE% 1.0 2.0 4.6 839 670 A 66 ASP HBx A 17 PHE HZ 1.0 1.9 4.5 840 670 A 66 ASP HBy A 17 PHE HZ 1.0 1.9 4.5 841 671 A 23 ARG HA A 26 HIS HBx 1.0 2.0 6.0 842 672 A 14 SER HA A 14 SER HBx 1.0 1.9 4.5 843 673 A 16 ALA HA A 19 VAL HGx% 1.0 1.9 4.9 844 674 A 51 MET HE% A 48 TRP HE3 1.0 1.9 4.5 845 675 A 80 PRO HDx A 77 TYR HE% 1.0 2.0 6.0 846 676 A 49 LYS HGy A 49 LYS H 1.0 1.8 3.8 847 677 A 19 VAL HGy% A 19 VAL HA 1.0 1.8 3.4 848 678 A 32 ASP H A 32 ASP HBy 1.0 1.9 4.3 849 679 A 35 VAL HB A 40 PHE HE% 1.0 2.0 5.6 850 679 A 40 PHE HD% A 35 VAL HB 1.0 2.0 5.6 851 680 A 8 PRO HGy A 8 PRO HA 1.0 1.8 3.4 852 680 A 8 PRO HBy A 8 PRO HA 1.0 1.8 3.4 853 681 A 77 TYR HBy A 74 MET HE% 1.0 2.0 5.0 854 682 A 63 ALA HB% A 66 ASP H 1.0 1.9 5.1 855 683 A 23 ARG HGx A 23 ARG HDy 1.0 1.8 4.0 856 683 A 23 ARG HDx A 23 ARG HGx 1.0 1.8 4.0 857 684 A 10 GLY HAx A 70 TYR HE% 1.0 1.9 4.3 858 685 A 79 PRO HDx A 79 PRO HBx 1.0 2.0 5.0 859 686 A 29 LYS HBx A 29 LYS H 1.0 1.7 3.3 860 687 A 11 LYS HA A 70 TYR HD% 1.0 2.0 5.6 861 688 A 7 LYS HD2 A 77 TYR HE% 1.0 2.0 5.6 862 688 A 77 TYR HE% A 7 LYS HD3 1.0 2.0 5.6 863 689 A 71 GLU HBx A 71 GLU HGy 1.0 1.7 3.1 864 690 A 60 GLU HBy A 61 ASP H 1.0 1.9 4.3 865 691 A 48 TRP HZ2 A 56 LYS HDx 1.0 1.9 4.9 866 691 A 48 TRP HZ2 A 56 LYS HDy 1.0 1.9 4.9 867 692 A 17 PHE HBy A 17 PHE HBx 1.0 1.7 3.3 868 693 A 40 PHE HD% A 40 PHE HA 1.0 1.8 3.8 869 694 A 78 ILE HB A 78 ILE HG1x 1.0 1.7 3.1 870 695 A 9 ARG HB3 A 9 ARG HA 1.0 1.7 3.3 871 695 A 9 ARG HB2 A 9 ARG HA 1.0 1.7 3.3 872 696 A 67 LYS HG2 A 67 LYS HE3 1.0 1.7 3.5 873 696 A 67 LYS HG2 A 67 LYS HE2 1.0 1.7 3.5 874 696 A 67 LYS HG3 A 67 LYS HE2 1.0 1.7 3.5 875 696 A 67 LYS HG3 A 67 LYS HE3 1.0 1.7 3.5 876 697 A 56 LYS HGx A 56 LYS HEy 1.0 1.9 4.7 877 698 A 78 ILE H A 79 PRO HDx 1.0 1.9 6.0 878 699 A 29 LYS HGy A 26 HIS HA 1.0 2.0 5.4 879 700 A 73 GLU HA A 73 GLU HGy 1.0 1.8 4.0 880 701 A 62 MET HE% A 62 MET HBy 1.0 1.9 4.1 881 702 A 34 SER HB3 A 35 VAL HGx% 1.0 1.9 6.0 882 702 A 34 SER HB2 A 35 VAL HGx% 1.0 1.9 6.0 883 703 A 11 LYS HGy A 11 LYS HEx 1.0 2.0 5.2 884 704 A 33 ALA HB% A 30 HIS HA 1.0 0.0 6.0 885 705 A 16 ALA H A 12 MET HE% 1.0 2.0 6.0 886 706 A 72 ARG HGx A 72 ARG HGy 1.0 1.3 2.2 887 707 A 48 TRP HA A 48 TRP HE3 1.0 1.9 4.1 888 708 A 18 PHE HBx A 18 PHE HBy 1.0 1.7 3.5 889 709 A 48 TRP HBx A 48 TRP H 1.0 1.9 5.1 890 710 A 72 ARG HA A 72 ARG HD3 1.0 2.0 6.0 891 710 A 72 ARG HA A 72 ARG HD2 1.0 2.0 6.0 892 711 A 29 LYS HBy A 26 HIS HA 1.0 2.0 5.6 893 711 A 26 HIS HA A 29 LYS HDy 1.0 2.0 5.6 894 712 A 30 HIS HA A 30 HIS HBx 1.0 1.9 4.5 895 713 A 36 ASN HBx A 39 GLU HBy 1.0 1.8 3.6 896 713 A 36 ASN HBx A 39 GLU HBx 1.0 1.8 3.6 897 714 A 47 ARG HGx A 47 ARG HDy 1.0 1.7 3.1 898 714 A 47 ARG HGy A 47 ARG HDy 1.0 1.7 3.1 899 715 A 14 SER H A 13 SER HBy 1.0 1.9 4.7 900 716 A 78 ILE HB A 79 PRO HDy 1.0 2.0 6.0 901 716 A 78 ILE HB A 79 PRO HDx 1.0 2.0 6.0 902 717 A 73 GLU HGx A 73 GLU HGy 1.0 1.6 2.8 903 718 A 18 PHE HA A 18 PHE HBy 1.0 2.0 5.6 904 719 A 81 LYS H A 80 PRO HA 1.0 1.6 2.8 905 720 A 58 LYS HD3 A 62 MET HE% 1.0 0.0 6.0 906 720 A 58 LYS HD2 A 62 MET HE% 1.0 0.0 6.0 907 721 A 5 PRO HDy A 4 ASP HBx 1.0 1.9 5.5 908 721 A 5 PRO HDx A 4 ASP HBx 1.0 1.9 5.5 909 722 A 48 TRP HBx A 15 TYR HE% 1.0 1.9 4.7 910 722 A 48 TRP HBy A 15 TYR HE% 1.0 1.9 4.7 911 723 A 77 TYR H A 77 TYR HA 1.0 1.8 3.8 912 724 A 15 TYR HD% A 15 TYR HA 1.0 1.8 4.2 913 725 A 19 VAL HGx% A 23 ARG HDx 1.0 2.0 5.6 914 725 A 19 VAL HGx% A 23 ARG HDy 1.0 2.0 5.6 915 726 A 6 LYS HBx A 77 TYR HD% 1.0 2.0 5.4 916 727 A 51 MET HE% A 56 LYS HA 1.0 1.7 3.3 917 728 A 23 ARG HA A 23 ARG HGx 1.0 2.0 5.0 918 729 A 11 LYS HB3 A 11 LYS HA 1.0 1.8 3.6 919 729 A 11 LYS HB2 A 11 LYS HA 1.0 1.8 3.6 920 730 A 39 GLU HBx A 40 PHE H 1.0 1.8 3.6 921 731 A 5 PRO HDy A 4 ASP HBx 1.0 1.9 6.0 922 732 A 33 ALA HB% A 35 VAL HGx% 1.0 1.8 4.2 923 733 A 29 LYS HBx A 29 LYS HE3 1.0 2.0 6.0 924 733 A 29 LYS HBx A 29 LYS HE2 1.0 2.0 6.0 925 734 A 77 TYR HD% A 74 MET HE% 1.0 1.7 3.1 926 735 A 58 LYS HBy A 58 LYS HEx 1.0 2.0 5.0 927 736 A 72 ARG HGx A 72 ARG HB3 1.0 1.7 3.3 928 736 A 72 ARG HGx A 72 ARG HB2 1.0 1.7 3.3 929 737 A 11 LYS HB3 A 11 LYS HEy 1.0 2.0 5.6 930 737 A 11 LYS HB2 A 11 LYS HEy 1.0 2.0 5.6 931 738 A 47 ARG HA A 47 ARG H 1.0 1.9 3.9 932 739 A 72 ARG HGx A 73 GLU H 1.0 2.0 5.6 933 740 A 15 TYR HD% A 18 PHE HE% 1.0 2.0 6.0 934 741 A 11 LYS HGx A 70 TYR HD% 1.0 2.0 5.0 935 742 A 77 TYR HD% A 77 TYR HE% 1.0 1.5 2.5 936 743 A 29 LYS HGx A 29 LYS HDy 1.0 1.5 2.5 937 743 A 29 LYS HBy A 29 LYS HGx 1.0 1.5 2.5 938 744 A 26 HIS HBy A 26 HIS HD2 1.0 2.0 5.4 939 745 A 19 VAL HGy% A 19 VAL H 1.0 1.8 3.8 940 746 A 29 LYS HBy A 29 LYS HA 1.0 1.7 3.1 941 747 A 73 GLU HA A 73 GLU HBx 1.0 1.8 3.6 942 748 A 8 PRO HA A 8 PRO HDx 1.0 2.0 6.0 943 749 A 51 MET HBy A 51 MET HE% 1.0 1.6 2.8 944 749 A 51 MET HBy A 51 MET HBx 1.0 1.6 2.8 945 750 A 56 LYS HBx A 56 LYS HA 1.0 2.0 4.6 946 751 A 7 LYS HGy A 7 LYS HE3 1.0 1.7 3.3 947 751 A 7 LYS HGy A 7 LYS HE2 1.0 1.7 3.3 948 752 A 51 MET HA A 51 MET HE% 1.0 1.9 4.5 949 752 A 51 MET HA A 51 MET HBx 1.0 1.9 4.5 950 753 A 77 TYR HBx A 77 TYR HE% 1.0 2.0 6.0 951 754 A 48 TRP HBy A 15 TYR HE% 1.0 2.0 5.2 952 755 A 29 LYS HBx A 29 LYS HA 1.0 1.7 2.9 953 755 A 29 LYS HGx A 29 LYS HA 1.0 1.7 2.9 954 756 A 23 ARG HBy A 23 ARG HA 1.0 2.0 4.6 955 757 A 37 PHE HA A 37 PHE HD% 1.0 1.9 4.7 956 758 A 78 ILE HG2% A 78 ILE HG1x 1.0 1.5 2.5 957 758 A 78 ILE HD1% A 78 ILE HG1x 1.0 1.5 2.5 958 759 A 78 ILE HD1% A 78 ILE HB 1.0 1.4 2.4 959 759 A 78 ILE HG2% A 78 ILE HB 1.0 1.4 2.4 960 760 A 29 LYS HA A 29 LYS H 1.0 1.8 3.4 961 761 A 55 GLU H A 54 LYS HB2 1.0 1.9 4.3 962 761 A 55 GLU H A 54 LYS HB3 1.0 1.9 4.3 963 762 A 32 ASP HA A 32 ASP HBy 1.0 1.6 3.0 964 763 A 77 TYR HD% A 79 PRO HDx 1.0 2.0 6.0 965 764 A 29 LYS HE3 A 29 LYS HA 1.0 1.9 6.0 966 764 A 29 LYS HE2 A 29 LYS HA 1.0 1.9 6.0 967 765 A 58 LYS HBx A 58 LYS HGx 1.0 1.9 4.1 968 766 A 70 TYR HBy A 70 TYR H 1.0 1.9 4.5 969 767 A 48 TRP HBx A 49 LYS HBx 1.0 2.0 6.0 970 767 A 48 TRP HBy A 49 LYS HBx 1.0 2.0 6.0 971 767 A 48 TRP HBy A 49 LYS HBy 1.0 2.0 6.0 972 768 A 60 GLU HGy A 61 ASP H 1.0 2.0 6.0 973 769 A 8 PRO HBy A 8 PRO HA 1.0 1.8 4.0 974 770 A 30 HIS H A 29 LYS HA 1.0 1.9 4.1 975 771 A 62 MET HGx A 62 MET H 1.0 1.8 4.2 976 772 A 47 ARG HBy A 48 TRP H 1.0 1.9 4.7 977 773 A 78 ILE HA A 77 TYR HE% 1.0 1.9 5.1 978 774 A 7 LYS HA A 77 TYR HD% 1.0 2.0 4.8 979 775 A 7 LYS HBx A 7 LYS HGx 1.0 1.9 4.1 980 776 A 14 SER HA A 14 SER HBy 1.0 1.9 4.3 981 776 A 14 SER HA A 14 SER HBx 1.0 1.9 4.3 982 777 A 2 LYS HA A 2 LYS HB3 1.0 1.6 2.6 983 777 A 2 LYS HA A 2 LYS HB2 1.0 1.6 2.6 984 778 A 64 LYS HD3 A 64 LYS HE3 1.0 1.6 2.6 985 778 A 64 LYS HE2 A 64 LYS HD2 1.0 1.6 2.6 986 778 A 64 LYS HD2 A 64 LYS HE3 1.0 1.6 2.6 987 778 A 64 LYS HD3 A 64 LYS HE2 1.0 1.6 2.6 988 779 A 17 PHE HBy A 17 PHE HD% 1.0 2.0 4.8 989 780 A 78 ILE HB A 77 TYR HA 1.0 2.0 5.8 990 781 A 78 ILE HA A 78 ILE HG1y 1.0 0.0 6.0 991 782 A 80 PRO HDx A 80 PRO HDy 1.0 1.3 2.2 992 783 A 59 PHE HBx A 62 MET HE% 1.0 1.8 3.8 993 784 A 43 LYS HDy A 43 LYS H 1.0 2.0 5.4 994 785 A 6 LYS HA A 6 LYS HBx 1.0 1.6 2.6 995 785 A 6 LYS HA A 6 LYS HBy 1.0 1.6 2.6 996 786 A 60 GLU HBx A 60 GLU HA 1.0 1.9 4.3 997 786 A 60 GLU HBy A 60 GLU HA 1.0 1.9 4.3 998 787 A 6 LYS H A 6 LYS HA 1.0 1.8 3.6 999 788 A 35 VAL HGx% A 26 HIS HD2 1.0 0.0 6.0 1000 789 A 10 GLY HAy A 10 GLY HAx 1.0 1.7 3.1 1001 790 A 47 ARG HGy A 47 ARG HDx 1.0 1.7 2.9 1002 790 A 47 ARG HGx A 47 ARG HDx 1.0 1.7 2.9 1003 791 A 29 LYS HGx A 29 LYS HDy 1.0 1.4 2.4 1004 791 A 29 LYS HBx A 29 LYS HDy 1.0 1.4 2.4 1005 792 A 29 LYS HGy A 29 LYS H 1.0 1.7 3.3 1006 793 A 23 ARG HGx A 23 ARG H 1.0 2.0 6.0 1007 794 A 44 CYS HBx A 44 CYS HBy 1.0 1.7 3.3 1008 795 A 67 LYS HE2 A 67 LYS H 1.0 0.0 6.0 1009 795 A 67 LYS HE3 A 67 LYS H 1.0 0.0 6.0 1010 796 A 78 ILE HA A 79 PRO HDx 1.0 1.6 3.0 1011 797 A 58 LYS HGy A 58 LYS HA 1.0 1.8 4.2 1012 798 A 41 SER HBy B 43 LEU HD2% 1.0 2.0 5.0 1013 798 A 41 SER HBy B 43 LEU HD1% 1.0 2.0 5.0 1014 799 A 78 ILE HG2% A 79 PRO HBy 1.0 2.0 6.0 1015 800 A 47 ARG HBx A 47 ARG HDx 1.0 1.9 4.3 1016 800 A 47 ARG HBy A 47 ARG HDx 1.0 1.9 4.3 1017 801 A 39 GLU H A 39 GLU HGx 1.0 1.7 3.1 1018 802 A 31 PRO HBy A 30 HIS HA 1.0 1.8 6.0 1019 803 A 26 HIS HD2 A 26 HIS HE1 1.0 2.0 6.0 1020 804 A 61 ASP HA A 61 ASP HBy 1.0 1.8 4.2 1021 805 A 47 ARG HDy A 47 ARG H 1.0 2.0 6.0 1022 806 A 40 PHE HD% B 54 PHE HD% 1.0 2.0 5.6 1023 806 A 40 PHE HE% B 54 PHE HD% 1.0 2.0 5.6 1024 807 A 34 SER HA A 35 VAL HGy% 1.0 1.9 4.3 1025 808 A 77 TYR HBy A 77 TYR HA 1.0 1.8 4.2 1026 809 A 20 GLN HE21 A 12 MET HE% 1.0 1.9 4.3 1027 810 A 62 MET HE% A 59 PHE HA 1.0 1.7 3.3 1028 811 A 14 SER H A 13 SER HBx 1.0 2.0 5.4 1029 812 A 45 SER HBx A 45 SER H 1.0 1.9 4.1 1030 813 A 78 ILE HB A 78 ILE HG1y 1.0 1.8 3.4 1031 814 A 53 ALA HB% A 52 SER HBx 1.0 2.0 6.0 1032 814 A 53 ALA HB% A 52 SER HA 1.0 2.0 6.0 1033 815 A 58 LYS HGy A 58 LYS H 1.0 1.9 6.0 1034 816 A 39 GLU H A 39 GLU HBx 1.0 1.8 3.8 1035 817 A 37 PHE HBy A 37 PHE HE% 1.0 2.0 5.4 1036 817 A 37 PHE HBx A 37 PHE HE% 1.0 2.0 5.4 1037 818 A 23 ARG HGy A 23 ARG HBx 1.0 1.9 3.9 1038 819 A 40 PHE HZ A 23 ARG HGx 1.0 2.0 6.0 1039 820 A 66 ASP HBx A 65 ALA HB% 1.0 2.0 5.8 1040 820 A 66 ASP HBy A 65 ALA HB% 1.0 2.0 5.8 1041 821 A 20 GLN HG3 B 45 LEU HD1% 1.0 1.9 4.9 1042 821 A 20 GLN HG3 B 45 LEU HD2% 1.0 1.9 4.9 1043 821 A 20 GLN HG2 B 45 LEU HD2% 1.0 1.9 4.9 1044 821 A 20 GLN HG2 B 45 LEU HD1% 1.0 1.9 4.9 1045 822 A 51 MET HE% A 59 PHE HE% 1.0 1.7 3.1 1046 823 A 70 TYR HBy A 70 TYR HA 1.0 1.9 4.5 1047 824 A 35 VAL HB A 35 VAL HGy% 1.0 1.6 2.8 1048 825 A 19 VAL HGy% A 44 CYS HBx 1.0 1.9 4.7 1049 826 A 8 PRO HA A 8 PRO HDy 1.0 2.0 5.4 1050 827 A 29 LYS HA A 29 LYS HDy 1.0 1.6 3.0 1051 827 A 29 LYS HBy A 29 LYS HA 1.0 1.6 3.0 1052 828 A 64 LYS HD3 A 64 LYS H 1.0 1.9 4.5 1053 828 A 64 LYS HD2 A 64 LYS H 1.0 1.9 4.5 1054 829 A 60 GLU HGx A 60 GLU HA 1.0 1.9 4.3 1055 830 A 12 MET HBy A 12 MET HBx 1.0 1.5 2.7 1056 831 A 56 LYS H A 53 ALA HA 1.0 2.0 5.2 1057 832 A 39 GLU HGy A 35 VAL HGy% 1.0 2.0 6.0 1058 832 A 39 GLU HGx A 35 VAL HGy% 1.0 2.0 6.0 1059 833 A 33 ALA HB% A 35 VAL HGy% 1.0 2.0 5.8 1060 834 A 67 LYS HBx A 67 LYS HE3 1.0 2.0 5.4 1061 834 A 67 LYS HBx A 67 LYS HE2 1.0 2.0 5.4 1062 835 A 79 PRO HDy A 78 ILE HG1x 1.0 1.9 6.0 1063 836 A 60 GLU HBy A 60 GLU HA 1.0 1.9 4.9 1064 837 A 47 ARG HDy A 18 PHE HE% 1.0 2.0 5.6 1065 838 A 29 LYS HGy A 29 LYS HE3 1.0 1.7 3.1 1066 838 A 29 LYS HGy A 29 LYS HE2 1.0 1.7 3.1 1067 839 A 6 LYS HA A 6 LYS HG3 1.0 1.7 3.1 1068 839 A 6 LYS HA A 6 LYS HG2 1.0 1.7 3.1 1069 840 A 59 PHE HD% A 18 PHE HA 1.0 2.0 5.2 1070 841 A 35 VAL HGx% A 23 ARG HGx 1.0 1.8 3.8 1071 842 A 31 PRO HDy A 31 PRO HA 1.0 2.0 4.8 1072 843 A 21 THR HG2% A 59 PHE HZ 1.0 0.0 6.0 1073 844 A 60 GLU HGy A 63 ALA HB% 1.0 1.8 3.8 1074 844 A 63 ALA HB% A 60 GLU HGx 1.0 1.8 3.8 1075 845 A 36 ASN HBx A 39 GLU HGx 1.0 2.0 5.0 1076 846 A 33 ALA H A 32 ASP HBy 1.0 2.0 5.8 1077 847 A 17 PHE HBx A 17 PHE HD% 1.0 2.0 5.0 1078 848 A 35 VAL HGy% A 26 HIS HE1 1.0 1.9 6.0 1079 849 A 56 LYS HDy A 56 LYS HA 1.0 1.9 6.0 1080 850 A 8 PRO HDx A 7 LYS HGx 1.0 2.0 5.0 1081 851 A 78 ILE HG2% A 79 PRO HGx 1.0 2.0 5.4 1082 852 A 17 PHE HA A 12 MET HE% 1.0 1.8 3.4 1083 853 A 27 LYS HD3 A 27 LYS H 1.0 1.9 5.1 1084 853 A 27 LYS HD2 A 27 LYS H 1.0 1.9 5.1 1085 854 A 31 PRO HGy A 30 HIS HBy 1.0 1.9 6.0 1086 854 A 31 PRO HGx A 30 HIS HBy 1.0 1.9 6.0 1087 855 A 19 VAL HGx% A 40 PHE HE% 1.0 1.8 3.6 1088 856 A 35 VAL HGx% A 40 PHE HD% 1.0 2.0 5.4 1089 857 A 11 LYS H A 11 LYS HB2 1.0 1.9 4.3 1090 857 A 11 LYS H A 11 LYS HB3 1.0 1.9 4.3 1091 858 A 8 PRO HBy A 8 PRO HDx 1.0 1.9 4.7 1092 858 A 8 PRO HGy A 8 PRO HDx 1.0 1.9 4.7 1093 859 A 20 GLN HG3 B 54 PHE HD% 1.0 2.0 6.0 1094 859 A 20 GLN HG2 B 54 PHE HD% 1.0 2.0 6.0 1095 860 A 9 ARG H A 9 ARG HGy 1.0 2.0 5.2 1096 861 A 35 VAL H A 35 VAL HGy% 1.0 2.0 5.6 1097 862 A 31 PRO HBx A 31 PRO HDy 1.0 2.0 5.8 1098 863 A 35 VAL HGx% A 34 SER HA 1.0 2.0 6.0 1099 864 A 78 ILE HG2% A 78 ILE HG1y 1.0 1.7 3.1 1100 865 A 22 CYS HBy A 22 CYS HA 1.0 1.9 4.7 1101 866 A 64 LYS HGy A 64 LYS H 1.0 1.8 3.8 1102 867 A 4 ASP HBx A 4 ASP HBy 1.0 1.3 2.2 1103 868 A 31 PRO HBy A 31 PRO HA 1.0 1.6 3.0 1104 869 A 26 HIS HA A 30 HIS HD2 1.0 1.9 4.3 1105 870 A 5 PRO HDx A 4 ASP HA 1.0 1.4 2.4 1106 870 A 5 PRO HDy A 4 ASP HA 1.0 1.4 2.4 1107 871 A 71 GLU HGy A 70 TYR HD% 1.0 1.9 4.5 1108 872 A 59 PHE HBy A 59 PHE H 1.0 2.0 6.0 1109 873 A 77 TYR HBy A 76 THR HG2% 1.0 2.0 5.6 1110 874 A 7 LYS HBx A 77 TYR HE% 1.0 2.0 6.0 1111 875 A 22 CYS HBx A 40 PHE HE% 1.0 2.0 5.4 1112 875 A 22 CYS HBx A 40 PHE HZ 1.0 2.0 5.4 1113 876 A 73 GLU HA A 72 ARG H 1.0 0.0 6.0 1114 877 A 30 HIS HBx A 30 HIS HBy 1.0 1.6 2.6 1115 878 A 50 THR HG2% A 49 LYS HE2 1.0 0.0 6.0 1116 878 A 50 THR HG2% A 49 LYS HE3 1.0 0.0 6.0 1117 879 A 8 PRO HGy A 70 TYR HE% 1.0 1.9 4.1 1118 879 A 8 PRO HBy A 70 TYR HE% 1.0 1.9 4.1 1119 880 A 8 PRO HBy A 8 PRO HBx 1.0 1.6 2.8 1120 881 A 32 ASP H A 31 PRO HGy 1.0 2.0 6.0 1121 882 A 39 GLU HA A 39 GLU HGy 1.0 1.9 4.5 1122 883 A 70 TYR HE% A 74 MET HGx 1.0 2.0 5.2 1123 884 A 11 LYS HB3 A 11 LYS HGx 1.0 1.8 4.0 1124 884 A 11 LYS HB2 A 11 LYS HGx 1.0 1.8 4.0 1125 885 A 19 VAL HGx% A 19 VAL HB 1.0 1.7 3.1 1126 886 A 80 PRO HDy A 79 PRO HA 1.0 1.4 2.4 1127 887 A 64 LYS HA A 64 LYS H 1.0 1.9 3.7 1128 888 A 78 ILE HA A 78 ILE HD1% 1.0 2.0 4.4 1129 889 A 20 GLN HG3 A 12 MET HE% 1.0 2.0 5.2 1130 889 A 20 GLN HG2 A 12 MET HE% 1.0 2.0 5.2 1131 890 A 48 TRP HZ2 A 48 TRP HH2 1.0 1.9 4.1 1132 891 A 26 HIS HA A 26 HIS HD2 1.0 2.0 5.4 1133 892 A 56 LYS HDx A 56 LYS HBy 1.0 1.8 4.2 1134 892 A 56 LYS HDy A 56 LYS HBy 1.0 1.8 4.2 1135 893 A 7 LYS HBy A 7 LYS HA 1.0 1.8 3.6 1136 894 A 78 ILE HG2% A 78 ILE HG1y 1.0 1.6 2.6 1137 894 A 78 ILE HD1% A 78 ILE HG1y 1.0 1.6 2.6 1138 895 A 60 GLU HGx A 60 GLU H 1.0 2.0 5.6 1139 896 A 7 LYS HGx A 77 TYR HD% 1.0 2.0 6.0 1140 897 A 35 VAL HGy% A 37 PHE HE% 1.0 0.0 6.0 1141 898 A 43 LYS HGy A 40 PHE HE% 1.0 2.0 5.0 1142 898 A 40 PHE HD% A 43 LYS HGy 1.0 2.0 5.0 1143 899 A 31 PRO HGx A 30 HIS HA 1.0 1.9 6.0 1144 900 A 19 VAL HGx% A 40 PHE HZ 1.0 2.0 5.8 1145 901 A 18 PHE HA A 18 PHE H 1.0 1.9 4.3 1146 902 A 17 PHE HE% A 62 MET HE% 1.0 2.0 5.2 1147 903 A 61 ASP HBx A 62 MET H 1.0 2.0 5.6 1148 904 A 31 PRO HA A 27 LYS HE2 1.0 0.0 6.0 1149 904 A 31 PRO HA A 27 LYS HE3 1.0 0.0 6.0 1150 905 A 60 GLU HA A 60 GLU H 1.0 1.9 4.1 1151 906 A 78 ILE HG1y A 79 PRO HDx 1.0 2.0 6.0 1152 907 A 60 GLU HGy A 60 GLU HA 1.0 1.9 4.3 1153 908 A 13 SER H A 12 MET HBx 1.0 2.0 6.0 1154 909 A 34 SER HB2 A 34 SER HA 1.0 1.6 3.0 1155 909 A 34 SER HB3 A 34 SER HA 1.0 1.6 3.0 1156 910 A 74 MET HBx A 70 TYR HD% 1.0 2.0 5.2 1157 910 A 74 MET HBy A 70 TYR HD% 1.0 2.0 5.2 1158 911 A 39 GLU HBy A 35 VAL HGy% 1.0 2.0 5.6 1159 911 A 39 GLU HBx A 35 VAL HGy% 1.0 2.0 5.6 1160 912 A 6 LYS HA A 6 LYS HBy 1.0 1.6 2.8 1161 913 A 37 PHE HBy A 37 PHE HE% 1.0 2.0 5.6 1162 914 A 6 LYS H A 5 PRO HA 1.0 1.7 3.1 1163 915 A 7 LYS HBy A 7 LYS HGy 1.0 1.9 4.5 1164 916 A 79 PRO HDx A 79 PRO HGx 1.0 1.5 2.5 1165 917 A 56 LYS HEx A 53 ALA HA 1.0 1.9 6.0 1166 918 A 58 LYS HGx A 58 LYS HA 1.0 1.8 3.6 1167 918 A 58 LYS HGy A 58 LYS HA 1.0 1.8 3.6 1168 919 A 12 MET H A 12 MET HGy 1.0 2.0 5.0 1169 920 A 77 TYR H A 77 TYR HD% 1.0 2.0 6.0 1170 921 A 75 LYS HGx A 75 LYS HA 1.0 1.7 3.1 1171 921 A 75 LYS HDy A 75 LYS HA 1.0 1.7 3.1 1172 922 A 83 GLU HA A 83 GLU HG2 1.0 2.0 5.0 1173 922 A 83 GLU HA A 83 GLU HG3 1.0 2.0 5.0 1174 923 A 41 SER H A 41 SER HBy 1.0 1.9 4.1 1175 924 A 78 ILE HG2% A 79 PRO HBx 1.0 2.0 6.0 1176 925 A 4 ASP HBx A 7 LYS HD2 1.0 2.0 4.8 1177 925 A 7 LYS HBy A 4 ASP HBx 1.0 2.0 4.8 1178 925 A 7 LYS HBx A 4 ASP HBx 1.0 2.0 4.8 1179 925 A 4 ASP HBx A 7 LYS HD3 1.0 2.0 4.8 1180 926 A 31 PRO HDx A 31 PRO HA 1.0 1.9 5.1 1181 927 A 64 LYS HGx A 64 LYS H 1.0 1.9 4.3 1182 928 A 48 TRP HH2 A 48 TRP HZ3 1.0 1.9 4.3 1183 929 A 77 TYR HE% A 79 PRO HBy 1.0 1.9 4.1 1184 930 A 13 SER H A 12 MET HBy 1.0 1.9 4.9 1185 931 A 57 GLY HAy A 60 GLU HGx 1.0 1.9 6.0 1186 931 A 57 GLY HAy A 60 GLU HGy 1.0 1.9 6.0 1187 932 A 43 LYS HBx A 43 LYS HA 1.0 1.7 3.3 1188 932 A 43 LYS HBy A 43 LYS HA 1.0 1.7 3.3 1189 933 A 43 LYS HE2 A 40 PHE HD% 1.0 2.0 4.8 1190 933 A 43 LYS HE3 A 40 PHE HD% 1.0 2.0 4.8 1191 934 A 5 PRO HBy A 4 ASP HBy 1.0 2.0 5.8 1192 934 A 5 PRO HG2 A 4 ASP HBy 1.0 2.0 5.8 1193 934 A 5 PRO HG3 A 4 ASP HBy 1.0 2.0 5.8 1194 935 A 66 ASP HBx A 17 PHE HE% 1.0 1.9 4.5 1195 935 A 66 ASP HBy A 17 PHE HE% 1.0 1.9 4.5 1196 936 A 34 SER HB2 A 33 ALA HA 1.0 2.0 6.0 1197 936 A 34 SER HB3 A 33 ALA HA 1.0 2.0 6.0 1198 937 A 51 MET HA A 56 LYS HEx 1.0 2.0 6.0 1199 938 A 78 ILE HG2% A 78 ILE HB 1.0 1.4 2.4 1200 939 A 28 LYS HGx A 28 LYS HGy 1.0 1.3 2.2 1201 940 A 17 PHE HE% A 17 PHE HZ 1.0 1.8 3.4 1202 941 A 74 MET HE% A 74 MET H 1.0 2.0 4.6 1203 942 A 77 TYR HD% A 8 PRO HDy 1.0 2.0 5.0 1204 943 A 56 LYS HGx A 56 LYS HGy 1.0 1.7 2.9 1205 944 A 68 ALA HA A 71 GLU HGy 1.0 2.0 4.8 1206 945 A 13 SER H A 12 MET HGx 1.0 2.0 5.8 1207 946 A 35 VAL HGx% A 35 VAL HB 1.0 1.6 2.8 1208 947 A 29 LYS HGx A 29 LYS HA 1.0 1.7 3.3 1209 948 A 30 HIS HBx A 30 HIS HD2 1.0 1.9 4.1 1210 949 A 62 MET HE% A 58 LYS HGy 1.0 2.0 5.6 1211 950 A 68 ALA HA A 71 GLU HGx 1.0 2.0 6.0 1212 951 A 39 GLU H A 39 GLU HBy 1.0 2.0 5.2 1213 952 A 2 LYS HA A 2 LYS HGx 1.0 1.7 3.5 1214 952 A 2 LYS HA A 2 LYS HGy 1.0 1.7 3.5 1215 953 A 83 GLU HA A 83 GLU HB2 1.0 1.9 4.1 1216 954 A 30 HIS H A 30 HIS HA 1.0 1.8 3.6 1217 955 A 56 LYS H A 51 MET HE% 1.0 1.9 4.3 1218 956 A 17 PHE HBx A 63 ALA HB% 1.0 2.0 5.0 1219 957 A 78 ILE H A 78 ILE HD1% 1.0 1.9 4.5 1220 958 A 58 LYS HGx A 58 LYS H 1.0 2.0 6.0 1221 959 A 55 GLU HBy A 55 GLU HA 1.0 1.7 3.1 1222 960 A 47 ARG HBx A 18 PHE HZ 1.0 2.0 5.4 1223 960 A 18 PHE HZ A 47 ARG HBy 1.0 2.0 5.4 1224 961 A 7 LYS HBy A 77 TYR HE% 1.0 2.0 6.0 1225 962 A 73 GLU HGx A 73 GLU HA 1.0 1.9 4.5 1226 963 A 33 ALA HB% A 26 HIS HE1 1.0 1.8 4.0 1227 964 A 5 PRO HBx A 5 PRO HA 1.0 1.7 2.9 1228 965 A 35 VAL HB A 35 VAL HA 1.0 1.7 3.5 1229 966 A 15 TYR HA A 18 PHE HBx 1.0 2.0 6.0 1230 967 A 9 ARG HGx A 9 ARG HDy 1.0 1.7 3.1 1231 967 A 9 ARG HDx A 9 ARG HGx 1.0 1.7 3.1 1232 968 A 70 TYR HBx A 70 TYR HD% 1.0 1.8 3.8 1233 968 A 70 TYR HBy A 70 TYR HD% 1.0 1.8 3.8 1234 969 A 8 PRO HDx A 77 TYR HD% 1.0 1.9 4.9 1235 970 A 26 HIS HD2 A 30 HIS HD2 1.0 2.0 5.0 1236 971 A 12 MET HBy A 12 MET HE% 1.0 1.9 3.9 1237 972 A 29 LYS HDy A 29 LYS H 1.0 2.0 6.0 1238 973 A 20 GLN HG2 A 20 GLN HB2 1.0 1.6 3.0 1239 973 A 20 GLN HG3 A 20 GLN HB3 1.0 1.6 3.0 1240 973 A 20 GLN HG2 A 20 GLN HB3 1.0 1.6 3.0 1241 973 A 20 GLN HG3 A 20 GLN HB2 1.0 1.6 3.0 1242 974 A 5 PRO HDx A 5 PRO HA 1.0 1.9 4.5 1243 974 A 5 PRO HDy A 5 PRO HA 1.0 1.9 4.5 1244 975 A 12 MET HBy A 12 MET HGy 1.0 1.9 4.9 1245 976 A 23 ARG HGy A 23 ARG HA 1.0 2.0 5.0 1246 977 A 7 LYS HBy A 4 ASP HBy 1.0 1.9 4.3 1247 977 A 4 ASP HBy A 7 LYS HD2 1.0 1.9 4.3 1248 977 A 4 ASP HBy A 7 LYS HD3 1.0 1.9 4.3 1249 978 A 63 ALA HA A 17 PHE HZ 1.0 2.0 5.4 1250 979 A 77 TYR HE% A 79 PRO HGx 1.0 2.0 6.0 1251 980 A 61 ASP HBx A 61 ASP HA 1.0 1.7 3.5 1252 981 A 77 TYR HBx A 77 TYR HA 1.0 1.7 3.3 1253 982 A 64 LYS HB3 A 64 LYS H 1.0 1.7 3.3 1254 982 A 64 LYS HB2 A 64 LYS H 1.0 1.7 3.3 1255 983 A 17 PHE HE% A 12 MET HBy 1.0 2.0 5.8 1256 984 A 7 LYS HBy A 4 ASP HBy 1.0 2.0 6.0 1257 985 A 19 VAL HGx% A 18 PHE HD% 1.0 2.0 6.0 1258 986 A 11 LYS HGy A 11 LYS HA 1.0 2.0 5.0 1259 987 A 26 HIS HA A 29 LYS HGx 1.0 1.9 4.3 1260 987 A 29 LYS HBx A 26 HIS HA 1.0 1.9 4.3 1261 988 A 81 LYS HG3 A 81 LYS HA 1.0 1.8 3.4 1262 988 A 81 LYS HG2 A 81 LYS HA 1.0 1.8 3.4 1263 989 A 16 ALA HB% B 45 LEU HD1% 1.0 1.8 4.0 1264 989 A 16 ALA HB% B 45 LEU HD2% 1.0 1.8 4.0 1265 990 A 79 PRO HDy A 77 TYR HE% 1.0 2.0 5.6 1266 991 A 78 ILE H A 78 ILE HG1x 1.0 2.0 5.2 1267 992 A 29 LYS HBx A 30 HIS HD2 1.0 1.8 3.8 1268 993 A 8 PRO HGy A 8 PRO HBx 1.0 1.6 2.6 1269 993 A 8 PRO HBy A 8 PRO HBx 1.0 1.6 2.6 1270 994 A 8 PRO HBx A 8 PRO HA 1.0 1.9 4.3 1271 995 A 10 GLY HAy A 70 TYR HE% 1.0 2.0 6.0 1272 996 A 72 ARG HA A 72 ARG HGy 1.0 1.8 4.0 1273 997 A 18 PHE HZ A 47 ARG HDx 1.0 2.0 5.2 1274 998 A 40 PHE HBx A 40 PHE HD% 1.0 1.9 4.1 1275 999 A 13 SER H A 12 MET HGy 1.0 2.0 6.0 1276 1000 A 40 PHE HZ A 23 ARG HDy 1.0 2.0 5.8 1277 1000 A 23 ARG HDy A 40 PHE HE% 1.0 2.0 5.8 1278 1001 A 58 LYS HEx A 58 LYS HEy 1.0 1.4 2.2 1279 1002 A 29 LYS HBy A 29 LYS HGy 1.0 1.7 3.1 1280 1002 A 29 LYS HGy A 29 LYS HDy 1.0 1.7 3.1 1281 1003 A 72 ARG HGx A 72 ARG HA 1.0 1.8 3.8 1282 1004 A 47 ARG HGy A 18 PHE HZ 1.0 1.9 4.9 1283 1005 A 10 GLY HAy A 11 LYS HGy 1.0 0.0 6.0 1284 1006 A 41 SER HBy A 42 LYS H 1.0 2.0 4.6 1285 1007 A 50 THR HG2% A 49 LYS H 1.0 2.0 5.4 1286 1008 A 37 PHE HA A 37 PHE HBy 1.0 1.8 4.0 1287 1009 A 51 MET HE% A 48 TRP HZ3 1.0 1.7 3.3 1288 1010 A 47 ARG HDx A 47 ARG H 1.0 1.9 6.0 1289 1011 A 66 ASP HBx A 66 ASP HA 1.0 2.0 5.4 1290 1012 A 5 PRO HDy A 5 PRO HBx 1.0 2.0 5.8 1291 1013 A 8 PRO HDy A 77 TYR HE% 1.0 2.0 5.8 1292 1014 A 56 LYS HEx A 56 LYS HEy 1.0 1.3 2.2 1293 1015 A 62 MET HGx A 62 MET HE% 1.0 1.8 3.4 1294 1016 A 39 GLU H A 38 SER HA 1.0 2.0 5.2 1295 1017 A 15 TYR HE% B 43 LEU HG 1.0 2.0 5.2 1296 1017 A 15 TYR HE% B 43 LEU HBy 1.0 2.0 5.2 1297 1018 A 15 TYR HD% A 15 TYR HBx 1.0 1.8 4.0 1298 1018 A 15 TYR HD% A 15 TYR HBy 1.0 1.8 4.0 1299 1019 A 78 ILE HB A 79 PRO HDy 1.0 1.9 6.0 1300 1020 A 56 LYS HDx A 56 LYS HEy 1.0 1.8 3.8 1301 1021 A 12 MET H A 12 MET HE% 1.0 2.0 6.0 1302 1022 A 77 TYR HD% A 79 PRO HBx 1.0 2.0 6.0 1303 1023 A 6 LYS H A 5 PRO HDy 1.0 2.0 6.0 1304 1024 A 19 VAL HGy% A 18 PHE HD% 1.0 1.9 4.1 1305 1025 A 75 LYS HGx A 75 LYS H 1.0 0.0 6.0 1306 1026 A 78 ILE HG1y A 77 TYR HA 1.0 2.0 6.0 1307 1027 A 11 LYS HB3 A 11 LYS HGx 1.0 1.8 3.4 1308 1027 A 11 LYS HDy A 11 LYS HGx 1.0 1.8 3.4 1309 1027 A 11 LYS HB2 A 11 LYS HGx 1.0 1.8 3.4 1310 1028 A 7 LYS HGy A 77 TYR HE% 1.0 1.9 4.5 1311 1029 A 39 GLU H A 39 GLU HGy 1.0 1.9 4.9 1312 1030 A 78 ILE HA A 78 ILE HB 1.0 1.8 3.4 1313 1031 A 61 ASP HBy A 62 MET H 1.0 1.9 4.7 1314 1032 A 78 ILE HG1y A 78 ILE HG1x 1.0 1.2 2.2 1315 1033 A 25 GLU HBy A 25 GLU HGx 1.0 1.5 2.3 1316 1034 A 35 VAL HGx% A 35 VAL HA 1.0 1.8 3.6 1317 1035 A 11 LYS HDy A 11 LYS HEy 1.0 2.0 4.8 1318 1036 A 11 LYS HB2 A 11 LYS HGy 1.0 1.7 3.5 1319 1036 A 11 LYS HDy A 11 LYS HGy 1.0 1.7 3.5 1320 1036 A 11 LYS HB3 A 11 LYS HGy 1.0 1.7 3.5 1321 1037 A 11 LYS HDy A 70 TYR HD% 1.0 2.0 6.0 1322 1038 A 8 PRO HBx A 8 PRO HDy 1.0 2.0 6.0 1323 1039 A 8 PRO HDx A 77 TYR HE% 1.0 2.0 5.8 1324 1040 A 20 GLN HG3 A 19 VAL HGx% 1.0 2.0 6.0 1325 1040 A 20 GLN HG2 A 19 VAL HGx% 1.0 2.0 6.0 1326 1041 A 31 PRO HBx A 31 PRO HA 1.0 1.7 3.5 1327 1042 A 8 PRO HGy A 7 LYS HA 1.0 1.9 6.0 1328 1043 A 66 ASP HBx A 63 ALA HA 1.0 1.9 4.7 1329 1044 A 9 ARG HGy A 9 ARG HDy 1.0 1.7 3.3 1330 1045 A 18 PHE HA A 59 PHE HZ 1.0 2.0 5.2 1331 1045 A 18 PHE HA A 59 PHE HE% 1.0 2.0 5.2 1332 1046 A 49 LYS HA A 48 TRP HD1 1.0 2.0 5.0 1333 1047 B 43 LEU HD1% A 49 LYS HE2 1.0 1.8 3.6 1334 1047 B 43 LEU HD1% A 49 LYS HE3 1.0 1.8 3.6 1335 1048 A 73 GLU HGy A 74 MET HGx 1.0 1.9 4.5 1336 1048 A 73 GLU HGy A 74 MET HE% 1.0 1.9 4.5 1337 1049 A 70 TYR HE% A 11 LYS HEy 1.0 2.0 4.8 1338 1050 A 8 PRO HBx A 70 TYR HD% 1.0 2.0 5.8 1339 1051 A 18 PHE HA A 18 PHE HD% 1.0 2.0 4.6 1340 1052 A 5 PRO HDy A 5 PRO HG3 1.0 1.6 2.8 1341 1052 A 5 PRO HDy A 5 PRO HG2 1.0 1.6 2.8 1342 1053 A 20 GLN HB2 A 20 GLN HA 1.0 1.8 3.8 1343 1053 A 20 GLN HB3 A 20 GLN HA 1.0 1.8 3.8 1344 1054 A 5 PRO HG3 A 5 PRO HA 1.0 1.6 2.8 1345 1054 A 5 PRO HBy A 5 PRO HA 1.0 1.6 2.8 1346 1055 A 25 GLU HBy A 22 CYS HA 1.0 1.8 3.6 1347 1055 A 22 CYS HA A 25 GLU HBx 1.0 1.8 3.6 1348 1056 A 31 PRO HDx A 30 HIS HA 1.0 1.7 3.3 1349 1057 A 18 PHE HBy A 18 PHE HD% 1.0 1.9 4.3 1350 1058 A 45 SER HBy A 45 SER H 1.0 1.8 3.6 1351 1059 A 77 TYR HBy A 77 TYR HD% 1.0 1.7 3.1 1352 1060 A 62 MET HBx A 63 ALA H 1.0 1.9 4.9 1353 1061 A 18 PHE HE% A 47 ARG HDx 1.0 2.0 5.8 1354 1062 A 78 ILE HD1% A 78 ILE HG1y 1.0 1.4 2.2 1355 1063 A 17 PHE HE% A 17 PHE HBx 1.0 2.0 5.8 1356 1064 A 78 ILE HG2% A 78 ILE HG1x 1.0 0.0 6.0 1357 1065 A 18 PHE HA A 21 THR HG2% 1.0 2.0 4.6 1358 1066 A 53 ALA HB% A 56 LYS H 1.0 2.0 6.0 1359 1067 A 58 LYS HBx A 58 LYS HEx 1.0 2.0 6.0 1360 1068 A 63 ALA HB% A 62 MET HBy 1.0 0.0 6.0 1361 1069 A 63 ALA HB% A 63 ALA HA 1.0 1.8 3.4 1362 1070 A 7 LYS HA A 7 LYS HGx 1.0 1.8 3.8 1363 1071 A 5 PRO HDy A 6 LYS HBx 1.0 2.0 6.0 1364 1072 A 78 ILE HA A 78 ILE HG1x 1.0 1.8 3.8 1365 1073 A 11 LYS HGy A 11 LYS HEy 1.0 2.0 4.6 1366 1074 A 74 MET HA A 8 PRO HGx 1.0 2.0 6.0 1367 1075 A 47 ARG HGy A 47 ARG H 1.0 2.0 5.4 1368 1076 A 20 GLN HA A 12 MET HE% 1.0 2.0 6.0 1369 1077 A 8 PRO HGy A 74 MET HA 1.0 2.0 5.6 1370 1078 A 5 PRO HDy A 5 PRO HBx 1.0 1.9 4.9 1371 1078 A 5 PRO HDx A 5 PRO HBx 1.0 1.9 4.9 1372 1079 A 18 PHE HZ A 18 PHE HE% 1.0 1.9 3.7 1373 1080 A 71 GLU HA A 71 GLU HBx 1.0 1.9 4.5 1374 1081 A 63 ALA HB% A 67 LYS H 1.0 2.0 4.8 1375 1082 A 78 ILE HD1% A 77 TYR HE% 1.0 2.0 6.0 1376 1082 A 78 ILE HG2% A 77 TYR HE% 1.0 2.0 6.0 1377 1083 A 8 PRO HGy A 8 PRO HDx 1.0 2.0 5.2 1378 1084 A 7 LYS HA A 8 PRO HDy 1.0 1.7 3.1 1379 1085 A 8 PRO HGy A 8 PRO HBx 1.0 2.0 5.0 1380 1086 A 62 MET HE% A 58 LYS HGy 1.0 1.6 3.0 1381 1086 A 62 MET HE% A 58 LYS HGx 1.0 1.6 3.0 1382 1087 A 18 PHE HD% A 21 THR HG2% 1.0 2.0 5.6 1383 1088 A 29 LYS HBx A 29 LYS HGy 1.0 1.2 2.2 1384 1088 A 29 LYS HGy A 29 LYS HGx 1.0 1.2 2.2 1385 1089 A 12 MET HGx A 12 MET HBy 1.0 1.8 3.8 1386 1090 A 51 MET HA A 51 MET HBx 1.0 1.9 4.5 1387 1091 A 30 HIS HA A 31 PRO HDy 1.0 1.7 3.3 1388 1092 A 62 MET HGy A 62 MET HBx 1.0 1.9 4.7 1389 1093 A 19 VAL HGy% A 19 VAL HGx% 1.0 1.5 2.7 1390 1094 A 56 LYS HEx A 56 LYS HGy 1.0 1.9 4.5 1391 1095 A 83 GLU HB3 A 83 GLU HG2 1.0 1.7 3.3 1392 1095 A 83 GLU HB2 A 83 GLU HG3 1.0 1.7 3.3 1393 1095 A 83 GLU HB3 A 83 GLU HG3 1.0 1.7 3.3 1394 1095 A 83 GLU HB2 A 83 GLU HG2 1.0 1.7 3.3 1395 1096 A 47 ARG HBx A 47 ARG H 1.0 1.9 4.1 1396 1097 A 64 LYS HD3 A 64 LYS HA 1.0 1.8 3.6 1397 1097 A 64 LYS HA A 64 LYS HD2 1.0 1.8 3.6 1398 1097 A 64 LYS HGx A 64 LYS HA 1.0 1.8 3.6 1399 1098 A 64 LYS HB2 A 61 ASP HA 1.0 1.8 3.6 1400 1098 A 64 LYS HB3 A 61 ASP HA 1.0 1.8 3.6 1401 1099 A 52 SER HA A 52 SER HBy 1.0 1.6 3.0 1402 1099 A 52 SER HBx A 52 SER HBy 1.0 1.6 3.0 1403 1100 A 15 TYR HE% A 45 SER HA 1.0 1.9 4.5 1404 1101 A 65 ALA HB% A 66 ASP H 1.0 1.7 3.5 1405 1102 A 43 LYS HBy A 43 LYS H 1.0 1.9 3.9 1406 1102 A 43 LYS HBx A 43 LYS H 1.0 1.9 3.9 1407 1103 A 57 GLY HAy A 60 GLU HBy 1.0 2.0 6.0 1408 1103 A 60 GLU HBx A 57 GLY HAy 1.0 2.0 6.0 1409 1104 A 23 ARG HA A 40 PHE HZ 1.0 2.0 4.8 1410 1105 A 17 PHE HBy A 17 PHE HE% 1.0 2.0 6.0 1411 1106 A 40 PHE HD% A 23 ARG HGx 1.0 2.0 6.0 1412 1106 A 23 ARG HGx A 40 PHE HE% 1.0 2.0 6.0 1413 1107 A 40 PHE H A 39 GLU HGy 1.0 1.9 6.0 1414 1108 A 52 SER HBx A 52 SER HBy 1.0 1.7 3.3 1415 1109 A 12 MET HA A 12 MET HBx 1.0 1.9 4.1 1416 1110 A 21 THR HG2% A 21 THR HA 1.0 1.9 4.1 1417 1111 A 51 MET HBy A 51 MET HA 1.0 2.0 4.4 1418 1112 A 58 LYS HGy A 59 PHE H 1.0 2.0 6.0 1419 1113 A 78 ILE HD1% A 79 PRO HDx 1.0 0.0 6.0 1420 1113 A 78 ILE HD1% A 79 PRO HDy 1.0 0.0 6.0 1421 1114 A 52 SER H A 52 SER HA 1.0 1.9 4.5 1422 1115 A 22 CYS HBy A 40 PHE HE% 1.0 2.0 5.4 1423 1115 A 22 CYS HBy A 40 PHE HZ 1.0 2.0 5.4 1424 1116 A 79 PRO HBx A 79 PRO HBy 1.0 1.2 2.2 1425 1117 A 71 GLU HGy A 71 GLU HGx 1.0 1.3 2.2 1426 1118 A 8 PRO HDx A 7 LYS HD3 1.0 2.0 5.6 1427 1118 A 8 PRO HDx A 7 LYS HD2 1.0 2.0 5.6 1428 1119 A 41 SER HA A 44 CYS HBx 1.0 1.9 4.5 1429 1120 A 61 ASP HA A 64 LYS HD2 1.0 1.8 3.6 1430 1120 A 64 LYS HD3 A 61 ASP HA 1.0 1.8 3.6 1431 1121 A 58 LYS HD3 A 59 PHE HZ 1.0 1.9 4.7 1432 1121 A 58 LYS HD3 A 59 PHE HE% 1.0 1.9 4.7 1433 1121 A 58 LYS HD2 A 59 PHE HE% 1.0 1.9 4.7 1434 1122 A 41 SER H A 41 SER HBx 1.0 1.9 4.1 1435 1123 A 77 TYR HA A 78 ILE HG1x 1.0 2.0 6.0 1436 1124 A 28 LYS HBy A 29 LYS HGx 1.0 2.0 6.0 1437 1125 A 5 PRO HG2 A 5 PRO HBx 1.0 1.2 2.2 1438 1125 A 5 PRO HG3 A 5 PRO HBx 1.0 1.2 2.2 1439 1125 A 5 PRO HBy A 5 PRO HBx 1.0 1.2 2.2 1440 1126 A 35 VAL HGy% A 40 PHE HE% 1.0 1.8 3.6 1441 1126 A 40 PHE HD% A 35 VAL HGy% 1.0 1.8 3.6 1442 1127 A 12 MET HA A 12 MET HBy 1.0 1.8 3.6 1443 1128 A 62 MET HE% A 59 PHE HE% 1.0 1.9 4.1 1444 1129 A 58 LYS HBx A 58 LYS HA 1.0 1.7 3.1 1445 1130 A 59 PHE HD% A 59 PHE HBy 1.0 1.9 4.9 1446 1131 A 11 LYS HB3 A 11 LYS HEx 1.0 2.0 4.8 1447 1131 A 11 LYS HB2 A 11 LYS HEx 1.0 2.0 4.8 1448 1132 A 77 TYR HE% A 74 MET HE% 1.0 1.8 3.8 1449 1133 A 35 VAL HGx% A 26 HIS HE1 1.0 2.0 4.4 1450 1134 A 15 TYR HA A 15 TYR HBx 1.0 2.0 4.8 1451 1134 A 15 TYR HA A 15 TYR HBy 1.0 2.0 4.8 1452 1135 A 58 LYS HD2 A 58 LYS HGy 1.0 1.6 3.0 1453 1135 A 58 LYS HD3 A 58 LYS HGy 1.0 1.6 3.0 1454 1136 A 80 PRO HA A 80 PRO HG3 1.0 1.9 4.1 1455 1136 A 80 PRO HA A 80 PRO HG2 1.0 1.9 4.1 1456 1137 A 62 MET HE% A 63 ALA H 1.0 0.0 6.0 1457 1138 A 74 MET HGx A 74 MET HGy 1.0 1.2 2.2 1458 1139 A 62 MET HA A 62 MET HBy 1.0 1.9 4.1 1459 1140 A 23 ARG HBx A 23 ARG HDx 1.0 1.9 4.9 1460 1141 A 48 TRP HD1 A 49 LYS H 1.0 1.9 5.5 1461 1142 A 31 PRO HGy A 31 PRO HDx 1.0 1.8 4.0 1462 1143 A 72 ARG HGx A 72 ARG HD2 1.0 1.6 2.8 1463 1143 A 72 ARG HGx A 72 ARG HD3 1.0 1.6 2.8 1464 1144 A 29 LYS HBy A 29 LYS HBx 1.0 1.3 2.2 1465 1145 A 64 LYS HE2 A 64 LYS H 1.0 0.0 6.0 1466 1145 A 64 LYS HE3 A 64 LYS H 1.0 0.0 6.0 1467 1146 A 21 THR HB A 21 THR HG2% 1.0 1.6 3.0 1468 1147 A 17 PHE HE% A 12 MET HGx 1.0 2.0 6.0 1469 1148 A 64 LYS HA A 67 LYS H 1.0 1.9 4.5 1470 1149 A 7 LYS HGy A 7 LYS HGx 1.0 1.3 2.2 1471 1150 A 19 VAL HGy% A 16 ALA HA 1.0 2.0 4.6 1472 1151 A 79 PRO HDy A 79 PRO HBx 1.0 2.0 5.8 1473 1152 A 51 MET HG2 A 55 GLU HBy 1.0 1.9 4.3 1474 1152 A 51 MET HG3 A 55 GLU HBy 1.0 1.9 4.3 1475 1152 A 55 GLU HBx A 51 MET HG2 1.0 1.9 4.3 1476 1152 A 55 GLU HBx A 51 MET HG3 1.0 1.9 4.3 1477 1153 A 21 THR HG2% A 59 PHE HE% 1.0 1.7 3.1 1478 1154 A 8 PRO HGy A 8 PRO HA 1.0 2.0 5.4 1479 1155 A 28 LYS HA A 28 LYS HGy 1.0 1.7 3.1 1480 1156 A 53 ALA HB% A 56 LYS HDx 1.0 1.9 4.7 1481 1157 A 62 MET HGy A 62 MET HA 1.0 2.0 4.8 1482 1158 A 68 ALA HA A 71 GLU HBx 1.0 1.9 4.1 1483 1159 A 9 ARG HB2 A 8 PRO HA 1.0 2.0 5.6 1484 1159 A 9 ARG HB3 A 8 PRO HA 1.0 2.0 5.6 1485 1160 A 23 ARG HGy A 23 ARG HA 1.0 2.0 4.6 1486 1160 A 23 ARG HA A 23 ARG HGx 1.0 2.0 4.6 1487 1161 A 48 TRP HD1 A 49 LYS HGy 1.0 2.0 5.2 1488 1162 A 56 LYS HDy A 56 LYS HGy 1.0 1.9 4.1 1489 1162 A 56 LYS HDx A 56 LYS HGy 1.0 1.9 4.1 1490 1163 A 41 SER HBx A 42 LYS H 1.0 1.9 4.5 1491 1164 A 17 PHE HBx A 12 MET HE% 1.0 2.0 6.0 1492 1165 A 31 PRO HBy A 31 PRO HDx 1.0 1.6 3.0 1493 1165 A 31 PRO HGx A 31 PRO HDx 1.0 1.6 3.0 1494 1166 A 51 MET HBx A 56 LYS HEy 1.0 2.0 6.0 1495 1167 A 59 PHE HA A 59 PHE HBy 1.0 1.8 3.6 1496 1168 A 33 ALA HB% A 26 HIS HD2 1.0 1.9 5.7 1497 1169 A 48 TRP HD1 A 48 TRP HA 1.0 2.0 6.0 1498 1170 A 62 MET HGx A 62 MET HBx 1.0 2.0 5.6 1499 1171 A 26 HIS HA A 26 HIS HBy 1.0 1.9 4.5 1500 1172 A 51 MET HBy A 48 TRP HA 1.0 2.0 5.2 1501 1173 A 22 CYS HA A 22 CYS H 1.0 1.9 4.5 1502 1174 A 47 ARG HDy A 47 ARG HDx 1.0 1.4 2.2 1503 1175 A 19 VAL HGx% B 45 LEU HBx 1.0 2.0 5.0 1504 1175 A 19 VAL HGx% B 45 LEU HG 1.0 2.0 5.0 1505 1176 A 78 ILE HB A 79 PRO HDx 1.0 2.0 6.0 1506 1177 A 38 SER HA A 38 SER HBy 1.0 2.0 5.0 1507 1178 A 78 ILE HG2% A 79 PRO HDy 1.0 1.7 3.1 1508 1178 A 78 ILE HG2% A 79 PRO HDx 1.0 1.7 3.1 1509 1179 A 71 GLU HBy A 71 GLU HGx 1.0 1.8 3.6 1510 1180 A 20 GLN HB2 A 12 MET HE% 1.0 2.0 4.8 1511 1180 A 20 GLN HB3 A 12 MET HE% 1.0 2.0 4.8 1512 1181 A 12 MET HE% A 12 MET HBx 1.0 1.9 4.3 1513 1182 A 7 LYS HGy A 8 PRO HDx 1.0 2.0 5.8 1514 1183 A 18 PHE HZ A 47 ARG HBy 1.0 2.0 4.8 1515 1184 A 50 THR HA A 50 THR HG2% 1.0 1.5 2.5 1516 1184 A 50 THR HB A 50 THR HG2% 1.0 1.5 2.5 1517 1185 A 48 TRP HD1 A 49 LYS HD2 1.0 2.0 5.0 1518 1185 A 48 TRP HD1 A 49 LYS HD3 1.0 2.0 5.0 1519 1185 A 48 TRP HD1 A 49 LYS HGx 1.0 2.0 5.0 1520 1186 A 58 LYS HGy A 58 LYS HEx 1.0 1.9 4.5 1521 1187 A 75 LYS HGy A 75 LYS HA 1.0 1.9 4.3 1522 1188 A 56 LYS HDy A 56 LYS HEy 1.0 1.7 3.3 1523 1188 A 56 LYS HDx A 56 LYS HEy 1.0 1.7 3.3 1524 1189 A 76 THR HG2% A 76 THR HB 1.0 1.6 2.6 1525 1190 A 70 TYR HD% A 70 TYR H 1.0 2.0 6.0 1526 1191 A 80 PRO HDx A 80 PRO HG2 1.0 1.5 2.5 1527 1191 A 80 PRO HDx A 80 PRO HG3 1.0 1.5 2.5 1528 1192 A 48 TRP HBy A 48 TRP H 1.0 1.9 4.5 1529 1193 A 19 VAL HGy% A 18 PHE HE% 1.0 2.0 6.0 1530 1194 A 7 LYS HBy A 7 LYS HGy 1.0 1.6 2.8 1531 1194 A 7 LYS HGy A 7 LYS HD2 1.0 1.6 2.8 1532 1194 A 7 LYS HGy A 7 LYS HD3 1.0 1.6 2.8 1533 1194 A 7 LYS HBx A 7 LYS HGy 1.0 1.6 2.8 1534 1195 A 51 MET HG3 A 51 MET HBx 1.0 1.9 3.9 1535 1195 A 51 MET HG2 A 51 MET HBx 1.0 1.9 3.9 1536 1196 A 56 LYS HEy A 56 LYS HGy 1.0 1.8 3.8 1537 1197 A 7 LYS HBx A 7 LYS HGx 1.0 1.6 2.8 1538 1197 A 7 LYS HGx A 7 LYS HD2 1.0 1.6 2.8 1539 1197 A 7 LYS HBy A 7 LYS HGx 1.0 1.6 2.8 1540 1197 A 7 LYS HGx A 7 LYS HD3 1.0 1.6 2.8 1541 1198 A 52 SER HBy A 55 GLU HBx 1.0 1.9 5.1 1542 1199 A 78 ILE HG1y A 79 PRO HDy 1.0 2.0 6.0 1543 1200 A 62 MET HE% A 59 PHE HBy 1.0 1.9 4.5 1544 1201 A 5 PRO HDy A 5 PRO HA 1.0 2.0 4.8 1545 1202 A 29 LYS HBx A 29 LYS HGy 1.0 1.6 3.0 1546 1203 A 12 MET HA A 17 PHE HE% 1.0 2.0 5.4 1547 1204 A 76 THR HG2% A 76 THR H 1.0 1.9 3.7 1548 1205 A 9 ARG HDx A 9 ARG HB3 1.0 1.8 3.6 1549 1205 A 9 ARG HDx A 9 ARG HB2 1.0 1.8 3.6 1550 1205 A 9 ARG HDx A 9 ARG HGy 1.0 1.8 3.6 1551 1206 A 23 ARG HA A 23 ARG HDx 1.0 2.0 6.0 1552 1207 A 77 TYR HE% A 79 PRO HA 1.0 1.8 3.6 1553 1208 A 58 LYS HEx A 59 PHE HZ 1.0 1.9 3.9 1554 1208 A 58 LYS HEx A 59 PHE HE% 1.0 1.9 3.9 1555 1209 A 47 ARG HGx A 47 ARG HDy 1.0 1.8 3.6 1556 1210 A 63 ALA HA A 63 ALA H 1.0 1.9 4.5 1557 1211 A 49 LYS HA A 49 LYS HGx 1.0 1.8 3.4 1558 1212 A 48 TRP HBy A 48 TRP HA 1.0 2.0 5.8 1559 1213 A 64 LYS HGx A 61 ASP HA 1.0 1.8 3.8 1560 1213 A 61 ASP HA A 64 LYS HD2 1.0 1.8 3.8 1561 1213 A 64 LYS HD3 A 61 ASP HA 1.0 1.8 3.8 1562 1214 A 40 PHE HZ A 23 ARG HBx 1.0 2.0 5.2 1563 1214 A 23 ARG HBx A 40 PHE HE% 1.0 2.0 5.2 1564 1215 A 51 MET H A 50 THR HG2% 1.0 0.0 6.0 1565 1216 A 8 PRO HDy A 74 MET HE% 1.0 1.9 5.3 1566 1217 A 11 LYS HDy A 11 LYS HEx 1.0 1.6 2.8 1567 1218 A 34 SER H A 33 ALA HA 1.0 1.9 4.5 1568 1219 A 23 ARG HGy A 23 ARG HDx 1.0 1.9 3.9 1569 1219 A 23 ARG HGy A 23 ARG HDy 1.0 1.9 3.9 1570 1220 A 70 TYR HE% A 70 TYR HD% 1.0 1.6 2.8 1571 1221 A 65 ALA HB% A 62 MET HBy 1.0 0.0 6.0 1572 1222 A 67 LYS HBy A 67 LYS HE3 1.0 1.9 4.7 1573 1222 A 67 LYS HBy A 67 LYS HE2 1.0 1.9 4.7 1574 1223 A 7 LYS HBy A 7 LYS HGx 1.0 1.7 3.1 1575 1224 A 59 PHE HA A 60 GLU H 1.0 1.9 4.7 1576 1225 A 33 ALA HB% A 34 SER HB2 1.0 2.0 6.0 1577 1225 A 33 ALA HB% A 34 SER HB3 1.0 2.0 6.0 1578 1226 A 47 ARG HBx A 47 ARG HDy 1.0 1.9 4.3 1579 1227 A 61 ASP HBx A 64 LYS HB2 1.0 1.9 6.0 1580 1227 A 61 ASP HBx A 64 LYS HB3 1.0 1.9 6.0 1581 1228 A 20 GLN HG3 A 20 GLN HA 1.0 1.8 3.4 1582 1228 A 20 GLN HG2 A 20 GLN HA 1.0 1.8 3.4 1583 1229 A 12 MET HBx A 12 MET HGy 1.0 1.9 4.1 1584 1230 A 78 ILE HD1% A 78 ILE HG1x 1.0 1.5 2.5 1585 1231 A 29 LYS HBy A 29 LYS HE3 1.0 2.0 6.0 1586 1231 A 29 LYS HBy A 29 LYS HE2 1.0 2.0 6.0 1587 1232 A 62 MET HGx A 62 MET HBy 1.0 1.9 4.3 1588 1233 A 30 HIS HD2 A 29 LYS HDy 1.0 2.0 6.0 1589 1234 A 79 PRO HBx A 80 PRO HDy 1.0 2.0 5.0 1590 1235 A 72 ARG HB2 A 72 ARG HD2 1.0 1.8 3.4 1591 1235 A 72 ARG HB3 A 72 ARG HD3 1.0 1.8 3.4 1592 1235 A 72 ARG HB3 A 72 ARG HD2 1.0 1.8 3.4 1593 1235 A 72 ARG HB2 A 72 ARG HD3 1.0 1.8 3.4 1594 1236 A 67 LYS HD3 A 70 TYR HD% 1.0 2.0 5.2 1595 1236 A 67 LYS HD2 A 70 TYR HD% 1.0 2.0 5.2 1596 1237 A 6 LYS HA A 6 LYS HE3 1.0 2.0 6.0 1597 1237 A 6 LYS HA A 6 LYS HE2 1.0 2.0 6.0 1598 1238 A 51 MET HBy A 51 MET HBx 1.0 1.6 2.8 1599 1239 A 31 PRO HBx A 31 PRO HDx 1.0 2.0 4.8 1600 1240 A 33 ALA H A 32 ASP HBx 1.0 2.0 6.0 1601 1241 A 77 TYR HBx A 74 MET HE% 1.0 1.9 4.7 1602 1242 A 79 PRO HGx A 79 PRO HA 1.0 1.6 2.8 1603 1242 A 79 PRO HA A 79 PRO HBy 1.0 1.6 2.8 1604 1243 A 77 TYR HD% A 7 LYS HE2 1.0 2.0 5.2 1605 1243 A 77 TYR HD% A 7 LYS HE3 1.0 2.0 5.2 1606 1244 A 8 PRO HDx A 8 PRO HDy 1.0 1.6 2.6 1607 1245 A 67 LYS HG2 A 67 LYS H 1.0 2.0 5.8 1608 1245 A 67 LYS HG3 A 67 LYS H 1.0 2.0 5.8 1609 1246 A 30 HIS HA A 30 HIS HBy 1.0 1.8 3.4 1610 1247 A 56 LYS HEx A 56 LYS HDy 1.0 1.9 4.1 1611 1248 A 70 TYR HE% A 71 GLU HGx 1.0 2.0 4.8 1612 1249 A 31 PRO HGy A 31 PRO HA 1.0 1.9 5.5 1613 1250 A 19 VAL HGy% A 44 CYS HBy 1.0 2.0 4.8 1614 1251 A 64 LYS HGx A 64 LYS HA 1.0 1.8 3.8 1615 1252 A 30 HIS HBx A 26 HIS HE1 1.0 2.0 5.6 1616 1253 A 80 PRO HDy A 79 PRO HBy 1.0 2.0 5.0 1617 1254 A 44 CYS HBy A 44 CYS HA 1.0 1.9 4.5 1618 1255 A 19 VAL HGy% A 40 PHE HZ 1.0 2.0 5.4 1619 1255 A 19 VAL HGy% A 40 PHE HE% 1.0 2.0 5.4 1620 1256 A 47 ARG HBy A 47 ARG H 1.0 1.8 4.0 1621 1257 A 48 TRP HBy A 18 PHE HE% 1.0 2.0 5.2 1622 1257 A 48 TRP HBx A 18 PHE HE% 1.0 2.0 5.2 1623 1258 A 58 LYS HBx A 58 LYS HGx 1.0 1.7 3.3 1624 1258 A 58 LYS HBx A 58 LYS HGy 1.0 1.7 3.3 1625 1259 A 56 LYS HEx A 48 TRP HZ2 1.0 2.0 5.2 1626 1260 A 30 HIS H A 29 LYS HDy 1.0 2.0 6.0 1627 1261 A 70 TYR HD% A 71 GLU H 1.0 1.9 4.7 1628 1262 A 77 TYR HD% A 7 LYS HD3 1.0 2.0 6.0 1629 1262 A 7 LYS HD2 A 77 TYR HD% 1.0 2.0 6.0 1630 1263 A 78 ILE HD1% A 76 THR HB 1.0 1.9 4.3 1631 1264 A 83 GLU HB2 A 83 GLU HG3 1.0 1.6 2.8 1632 1264 A 83 GLU HB2 A 83 GLU HG2 1.0 1.6 2.8 1633 1265 A 71 GLU HA A 71 GLU HGx 1.0 1.9 3.7 1634 1266 A 47 ARG HA A 47 ARG HBy 1.0 1.8 3.4 1635 1266 A 47 ARG HBx A 47 ARG HA 1.0 1.8 3.4 1636 1267 A 71 GLU HBy A 70 TYR HD% 1.0 2.0 6.0 1637 1268 A 51 MET HE% A 56 LYS HGy 1.0 1.8 3.6 1638 1269 A 2 LYS HGx A 2 LYS H 1.0 2.0 4.6 1639 1269 A 2 LYS HGy A 2 LYS H 1.0 2.0 4.6 1640 1270 A 7 LYS HA A 77 TYR HE% 1.0 1.9 4.5 1641 1271 A 33 ALA HB% A 30 HIS HBy 1.0 1.7 3.3 1642 1272 A 70 TYR HD% A 11 LYS HEx 1.0 2.0 5.8 1643 1273 A 79 PRO HBx A 79 PRO HA 1.0 1.7 3.1 1644 1274 A 79 PRO HDx A 77 TYR HE% 1.0 2.0 5.0 1645 1274 A 79 PRO HDy A 77 TYR HE% 1.0 2.0 5.0 1646 1275 A 51 MET HBy A 51 MET HG2 1.0 1.8 3.8 1647 1275 A 51 MET HBy A 51 MET HG3 1.0 1.8 3.8 1648 1276 A 7 LYS HA A 74 MET HE% 1.0 2.0 4.6 1649 1277 A 29 LYS HA A 29 LYS HDy 1.0 1.9 4.7 1650 1278 A 81 LYS HA A 81 LYS HD3 1.0 1.6 3.0 1651 1278 A 81 LYS HA A 81 LYS HD2 1.0 1.6 3.0 1652 1279 A 50 THR HB A 50 THR HA 1.0 1.4 2.4 1653 1280 A 23 ARG HGx A 35 VAL HGy% 1.0 1.9 5.1 1654 1281 A 78 ILE HD1% A 77 TYR HD% 1.0 1.9 6.0 1655 1281 A 78 ILE HG2% A 77 TYR HD% 1.0 1.9 6.0 1656 1282 A 71 GLU HBy A 71 GLU HGy 1.0 1.8 3.4 1657 1283 A 8 PRO HGy A 8 PRO HDy 1.0 1.8 4.0 1658 1284 A 23 ARG HBy A 23 ARG HDy 1.0 1.9 4.5 1659 1285 A 56 LYS HDy A 56 LYS HBy 1.0 1.8 3.6 1660 1286 A 23 ARG HBy B 45 LEU HD1% 1.0 2.0 5.4 1661 1287 A 35 VAL HGy% B 54 PHE HD% 1.0 2.0 6.0 1662 1288 A 49 LYS HGx B 43 LEU HD1% 1.0 1.9 6.0 1663 1289 A 41 SER HBy B 43 LEU HD1% 1.0 2.0 6.0 1664 1290 B 44 MET HE% A 49 LYS HGy 1.0 1.9 6.0 1665 1291 A 19 VAL HGx% B 54 PHE HZ 1.0 2.0 6.0 1666 1292 A 19 VAL HGy% B 44 MET HE% 1.0 2.0 6.0 1667 1292 A 19 VAL HGy% B 44 MET HB2 1.0 2.0 6.0 1668 1292 A 19 VAL HGy% B 44 MET HB3 1.0 2.0 6.0 1669 1293 A 12 MET HE% B 54 PHE HBx 1.0 1.9 6.0 1670 1294 A 12 MET HE% B 44 MET HE% 1.0 1.9 6.0 1671 1294 A 12 MET HE% B 44 MET HB2 1.0 1.9 6.0 1672 1294 A 12 MET HE% B 44 MET HB3 1.0 1.9 6.0 1673 1295 B 45 LEU HD1% A 23 ARG HDy 1.0 2.0 5.8 1674 1296 A 16 ALA HB% B 44 MET HB2 1.0 1.9 6.0 1675 1296 A 16 ALA HB% B 44 MET HB3 1.0 1.9 6.0 1676 1297 A 20 GLN HB2 B 45 LEU HD1% 1.0 2.0 5.8 1677 1297 A 20 GLN HB3 B 45 LEU HD1% 1.0 2.0 5.8 1678 1298 A 12 MET HGx B 45 LEU HD1% 1.0 2.0 6.0 1679 1298 A 12 MET HGx B 45 LEU HD2% 1.0 2.0 6.0 1680 1299 A 48 TRP HD1 B 43 LEU HD1% 1.0 2.0 6.0 1681 1300 A 24 GLU HBy B 45 LEU HD1% 1.0 0.0 6.0 1682 1301 A 35 VAL HGx% B 54 PHE HD% 1.0 2.0 6.0 1683 1302 A 20 GLN HG3 B 45 LEU HBx 1.0 1.9 6.0 1684 1302 A 20 GLN HG3 B 45 LEU HG 1.0 1.9 6.0 1685 1302 A 20 GLN HG2 B 45 LEU HG 1.0 1.9 6.0 1686 1303 B 45 LEU HD1% A 9 ARG HDy 1.0 0.0 6.0 1687 1304 B 45 LEU HD1% A 12 MET HGy 1.0 1.9 6.0 1688 1304 B 45 LEU HD2% A 12 MET HGy 1.0 1.9 6.0 1689 1305 B 43 LEU HD1% A 46 GLU HGy 1.0 2.0 6.0 1690 1306 A 19 VAL HGy% B 45 LEU HD2% 1.0 2.0 5.4 1691 1306 A 19 VAL HGy% B 45 LEU HD1% 1.0 2.0 5.4 1692 1307 A 16 ALA HA B 45 LEU HD1% 1.0 1.9 5.3 1693 1307 A 16 ALA HA B 45 LEU HD2% 1.0 1.9 5.3 1694 1308 B 54 PHE HD% A 27 LYS HE3 1.0 0.0 6.0 1695 1308 B 54 PHE HD% A 27 LYS HE2 1.0 0.0 6.0 1696 1309 A 15 TYR HE% B 43 LEU HD1% 1.0 2.0 5.8 1697 1310 B 45 LEU HD1% A 12 MET HE% 1.0 1.8 4.0 1698 1310 B 45 LEU HD2% A 12 MET HE% 1.0 1.8 4.0 1699 1311 A 19 VAL HB B 45 LEU HD2% 1.0 2.0 6.0 1700 1311 A 19 VAL HB B 45 LEU HD1% 1.0 2.0 6.0 1701 1312 B 45 LEU HD1% A 21 THR HG2% 1.0 1.9 6.0 1702 1313 A 45 SER HBx B 43 LEU HD1% 1.0 1.9 4.7 1703 1314 A 48 TRP HBy B 43 LEU HD1% 1.0 1.9 6.0 1704 1315 A 49 LYS HGx B 44 MET HE% 1.0 1.9 6.0 1705 1316 A 45 SER HBy B 43 LEU HD1% 1.0 2.0 6.0 1706 1317 A 17 PHE HE% B 45 LEU HD1% 1.0 1.8 6.0 1707 1317 A 17 PHE HE% B 45 LEU HD2% 1.0 1.8 6.0 1708 1318 A 20 GLN HA B 45 LEU HD2% 1.0 2.0 5.2 1709 1318 A 20 GLN HA B 45 LEU HD1% 1.0 2.0 5.2 1710 1319 A 12 MET HE% B 45 LEU HBx 1.0 2.0 6.0 1711 1319 A 12 MET HE% B 45 LEU HG 1.0 2.0 6.0 1712 1320 A 16 ALA HB% B 54 PHE HD% 1.0 1.9 6.0 1713 1321 A 19 VAL HGx% B 54 PHE HD% 1.0 1.9 5.7 1714 1322 B 45 LEU HD2% A 37 PHE HD% 1.0 2.0 6.0 1715 1322 B 45 LEU HD1% A 37 PHE HD% 1.0 2.0 6.0 1716 1323 A 24 GLU HBx B 45 LEU HD1% 1.0 0.0 6.0 1717 1324 A 37 PHE HA B 54 PHE HD% 1.0 1.9 6.0 1718 1325 B 45 LEU HD2% A 40 PHE HE% 1.0 2.0 6.0 1719 1325 B 45 LEU HD1% A 40 PHE HE% 1.0 2.0 6.0 1720 1326 A 45 SER HBx B 44 MET HE% 1.0 1.9 6.0 1721 1327 B 43 LEU HD1% A 49 LYS HGy 1.0 2.0 5.8 1722 1328 A 17 PHE HA B 45 LEU HD1% 1.0 1.9 6.0 1723 1328 A 17 PHE HA B 45 LEU HD2% 1.0 1.9 6.0 1724 1329 A 23 ARG HDy B 54 PHE HD% 1.0 2.0 6.0 1725 1330 A 9 ARG HGx B 45 LEU HD1% 1.0 0.0 6.0 1726 1331 A 23 ARG HDx B 54 PHE HD% 1.0 2.0 5.8 1727 1332 B 45 LEU HD1% A 35 VAL HGy% 1.0 2.0 6.0 1728 1333 A 41 SER HBx B 54 PHE HD% 1.0 2.0 6.0 1729 1333 A 41 SER HBx B 54 PHE HE% 1.0 2.0 6.0 1730 1334 A 41 SER HBx B 43 LEU HD1% 1.0 2.0 5.8 1731 1335 A 19 VAL HGy% B 54 PHE HD% 1.0 2.0 6.0 1732 1336 A 35 VAL HGx% B 45 LEU HD1% 1.0 1.9 6.0 1733 1337 A 20 GLN HG3 B 45 LEU HD2% 1.0 2.0 5.6 1734 1337 A 20 GLN HG3 B 45 LEU HD1% 1.0 2.0 5.6 1735 1337 A 20 GLN HG2 B 45 LEU HD1% 1.0 2.0 5.6 1736 1338 A 12 MET HE% B 54 PHE HD% 1.0 2.0 6.0 1737 1339 B 28 GLU H B 28 GLU HA 1.0 1.9 3.9 1738 1340 B 37 SER H B 37 SER HBy 1.0 2.0 4.8 1739 1340 B 37 SER H B 37 SER HBx 1.0 2.0 4.8 1740 1341 B 30 ASN HD21 B 32 LEU HBy 1.0 1.9 4.5 1741 1341 B 30 ASN HD21 B 32 LEU HBx 1.0 1.9 4.5 1742 1341 B 30 ASN HD21 B 32 LEU HG 1.0 1.9 4.5 1743 1342 B 44 MET HB3 B 44 MET H 1.0 1.7 3.3 1744 1342 B 44 MET HB2 B 44 MET H 1.0 1.7 3.3 1745 1343 B 24 LYS H B 23 TRP HBy 1.0 2.0 5.4 1746 1343 B 24 LYS H B 23 TRP HBx 1.0 2.0 5.4 1747 1344 B 28 GLU HA B 29 ASN H 1.0 1.8 4.0 1748 1345 B 22 LEU H B 22 LEU HBy 1.0 1.9 4.9 1749 1346 B 56 GLU H B 55 THR HG2% 1.0 2.0 6.0 1750 1347 B 53 TRP HE1 B 50 ILE HA 1.0 2.0 5.6 1751 1348 B 53 TRP H B 53 TRP HD1 1.0 1.9 4.9 1752 1349 B 33 SER H B 32 LEU HD2% 1.0 2.0 6.0 1753 1350 B 31 VAL H B 30 ASN HBy 1.0 2.0 5.4 1754 1350 B 31 VAL H B 30 ASN HBx 1.0 2.0 5.4 1755 1351 B 52 GLN HE21 B 52 GLN HGx 1.0 1.8 3.8 1756 1351 B 52 GLN HE21 B 52 GLN HGy 1.0 1.8 3.8 1757 1352 B 15 SER H B 15 SER HBx 1.0 1.9 4.3 1758 1352 B 15 SER H B 15 SER HBy 1.0 1.9 4.3 1759 1353 B 14 LEU H B 14 LEU HD1% 1.0 2.0 6.0 1760 1353 B 14 LEU H B 14 LEU HD2% 1.0 2.0 6.0 1761 1354 B 35 LEU H B 36 PRO HDx 1.0 2.0 6.0 1762 1355 B 48 ASP H B 48 ASP HBx 1.0 1.8 3.6 1763 1356 B 48 ASP H B 47 PRO HA 1.0 1.8 3.8 1764 1357 B 43 LEU H B 42 ASP HBx 1.0 1.9 4.5 1765 1357 B 43 LEU H B 42 ASP HBy 1.0 1.9 4.5 1766 1358 B 52 GLN H B 51 GLU H 1.0 1.8 4.0 1767 1359 B 53 TRP HE1 B 52 GLN HBx 1.0 2.0 5.8 1768 1359 B 53 TRP HE1 B 52 GLN HBy 1.0 2.0 5.8 1769 1360 B 25 LEU H B 25 LEU HBy 1.0 1.6 2.8 1770 1360 B 25 LEU H B 25 LEU HBx 1.0 1.6 2.8 1771 1360 B 25 LEU H B 25 LEU HG 1.0 1.6 2.8 1772 1361 B 51 GLU H B 50 ILE HG2% 1.0 2.0 5.2 1773 1361 B 51 GLU H B 50 ILE HD1% 1.0 2.0 5.2 1774 1362 B 48 ASP H B 47 PRO HDx 1.0 1.9 3.9 1775 1363 B 57 ASP H B 56 GLU HA 1.0 1.6 3.0 1776 1364 B 25 LEU H B 24 LYS HA 1.0 1.7 3.3 1777 1365 B 18 THR H B 18 THR HB 1.0 2.0 4.8 1778 1366 B 55 THR H B 55 THR HA 1.0 1.8 4.0 1779 1367 B 44 MET H B 44 MET HA 1.0 1.8 3.8 1780 1368 B 35 LEU H B 34 PRO HA 1.0 1.6 2.8 1781 1369 B 18 THR H B 18 THR HG2% 1.0 2.0 5.4 1782 1370 B 17 GLU H B 17 GLU HG2 1.0 1.9 4.5 1783 1371 B 43 LEU HG B 43 LEU H 1.0 1.8 3.6 1784 1371 B 43 LEU HBy B 43 LEU H 1.0 1.8 3.6 1785 1372 B 44 MET H B 43 LEU HA 1.0 1.9 3.7 1786 1373 B 50 ILE H B 49 ASP H 1.0 1.8 3.4 1787 1374 B 51 GLU H B 49 ASP HA 1.0 1.9 4.9 1788 1375 B 17 GLU H B 17 GLU HBy 1.0 1.8 3.8 1789 1376 B 24 LYS H B 25 LEU H 1.0 1.8 3.8 1790 1377 B 48 ASP H B 49 ASP H 1.0 1.7 3.5 1791 1378 B 47 PRO HA B 49 ASP H 1.0 2.0 6.0 1792 1379 B 57 ASP H B 57 ASP HBx 1.0 1.9 4.1 1793 1380 B 22 LEU H B 20 SER HBy 1.0 1.9 6.0 1794 1381 B 52 GLN H B 49 ASP HA 1.0 2.0 5.4 1795 1382 B 24 LYS H B 24 LYS HD2 1.0 1.7 3.1 1796 1382 B 24 LYS H B 24 LYS HD3 1.0 1.7 3.1 1797 1382 B 24 LYS H B 24 LYS HBx 1.0 1.7 3.1 1798 1383 B 38 GLN HE22 B 38 GLN HE21 1.0 1.2 2.2 1799 1384 B 55 THR H B 54 PHE HBy 1.0 2.0 5.0 1800 1385 B 26 LEU H B 25 LEU HA 1.0 0.0 6.0 1801 1386 B 22 LEU H B 21 ASP H 1.0 1.7 3.5 1802 1387 B 35 LEU H B 35 LEU HBx 1.0 1.7 3.3 1803 1387 B 35 LEU H B 35 LEU HBy 1.0 1.7 3.3 1804 1388 B 19 PHE H B 19 PHE HBx 1.0 1.9 4.3 1805 1389 B 48 ASP H B 48 ASP HBy 1.0 1.9 4.3 1806 1390 B 16 GLN H B 16 GLN HBx 1.0 2.0 5.4 1807 1391 B 25 LEU H B 24 LYS HG2 1.0 0.0 6.0 1808 1391 B 25 LEU H B 24 LYS HG3 1.0 0.0 6.0 1809 1392 B 32 LEU HBx B 30 ASN HD22 1.0 0.0 6.0 1810 1392 B 32 LEU HG B 30 ASN HD22 1.0 0.0 6.0 1811 1393 B 35 LEU H B 35 LEU HD1% 1.0 2.0 6.0 1812 1393 B 35 LEU H B 35 LEU HD2% 1.0 2.0 6.0 1813 1394 B 49 ASP H B 46 SER H 1.0 2.0 6.0 1814 1395 B 43 LEU HD1% B 43 LEU H 1.0 2.0 5.6 1815 1395 B 43 LEU HD2% B 43 LEU H 1.0 2.0 5.6 1816 1396 B 54 PHE HD% B 54 PHE H 1.0 1.9 6.0 1817 1397 B 52 GLN HE21 B 52 GLN HBy 1.0 2.0 5.4 1818 1397 B 52 GLN HE21 B 52 GLN HBx 1.0 2.0 5.4 1819 1398 B 40 MET H B 39 ALA HB% 1.0 2.0 4.6 1820 1399 B 48 ASP H B 50 ILE H 1.0 1.9 6.0 1821 1400 B 53 TRP HE1 B 52 GLN HGy 1.0 0.0 6.0 1822 1400 B 53 TRP HE1 B 52 GLN HGx 1.0 0.0 6.0 1823 1401 B 57 ASP H B 58 PRO HDx 1.0 2.0 6.0 1824 1402 B 43 LEU H B 43 LEU HA 1.0 1.8 3.6 1825 1403 B 43 LEU HD1% B 42 ASP H 1.0 1.9 6.0 1826 1404 B 30 ASN HBy B 30 ASN HD22 1.0 2.0 6.0 1827 1405 B 52 GLN H B 52 GLN HA 1.0 1.8 4.2 1828 1406 B 50 ILE HA B 50 ILE H 1.0 1.9 3.9 1829 1407 B 59 GLY H B 59 GLY HAx 1.0 1.7 3.1 1830 1407 B 59 GLY H B 59 GLY HAy 1.0 1.7 3.1 1831 1408 B 41 ASP H B 40 MET HBx 1.0 1.9 4.9 1832 1408 B 41 ASP H B 40 MET HBy 1.0 1.9 4.9 1833 1409 B 31 VAL H B 31 VAL HG1% 1.0 1.8 3.8 1834 1409 B 31 VAL H B 31 VAL HG2% 1.0 1.8 3.8 1835 1410 B 19 PHE H B 19 PHE HBy 1.0 2.0 5.4 1836 1411 B 53 TRP HE1 B 53 TRP HD1 1.0 1.8 3.6 1837 1412 B 57 ASP H B 56 GLU HBx 1.0 2.0 5.4 1838 1413 B 56 GLU H B 55 THR H 1.0 2.0 5.8 1839 1414 B 15 SER H B 14 LEU HA 1.0 1.7 3.3 1840 1415 B 52 GLN HE21 B 52 GLN HE22 1.0 1.2 2.2 1841 1416 B 46 SER H B 46 SER HBy 1.0 1.9 4.5 1842 1416 B 46 SER H B 46 SER HBx 1.0 1.9 4.5 1843 1417 B 23 TRP HBy B 23 TRP H 1.0 1.7 3.1 1844 1417 B 23 TRP HBx B 23 TRP H 1.0 1.7 3.1 1845 1418 B 25 LEU H B 25 LEU HA 1.0 1.8 3.8 1846 1419 B 59 GLY H B 58 PRO HBy 1.0 2.0 5.8 1847 1420 B 57 ASP H B 56 GLU HGx 1.0 2.0 6.0 1848 1421 B 46 SER H B 45 LEU H 1.0 2.0 5.8 1849 1422 B 50 ILE HD1% B 49 ASP H 1.0 2.0 6.0 1850 1422 B 50 ILE HG2% B 49 ASP H 1.0 2.0 6.0 1851 1423 B 44 MET H B 44 MET HGy 1.0 1.9 5.1 1852 1424 B 53 TRP H B 52 GLN HBx 1.0 1.9 4.3 1853 1424 B 53 TRP H B 52 GLN HBy 1.0 1.9 4.3 1854 1425 B 48 ASP H B 46 SER HBy 1.0 1.9 4.7 1855 1426 B 54 PHE HBx B 55 THR H 1.0 2.0 5.4 1856 1427 B 18 THR H B 17 GLU H 1.0 1.9 4.9 1857 1428 B 39 ALA HB% B 41 ASP H 1.0 2.0 5.8 1858 1429 B 16 GLN H B 15 SER HA 1.0 1.9 4.9 1859 1430 B 33 SER H B 33 SER HBy 1.0 1.9 4.3 1860 1430 B 33 SER H B 33 SER HBx 1.0 1.9 4.3 1861 1431 B 52 GLN HGx B 52 GLN HE22 1.0 1.9 4.7 1862 1431 B 52 GLN HGy B 52 GLN HE22 1.0 1.9 4.7 1863 1432 B 31 VAL H B 30 ASN HA 1.0 1.7 3.5 1864 1433 B 52 GLN H B 52 GLN HBx 1.0 1.7 3.3 1865 1433 B 52 GLN H B 52 GLN HBy 1.0 1.7 3.3 1866 1434 B 29 ASN H B 29 ASN HBx 1.0 2.0 5.4 1867 1435 B 57 ASP H B 57 ASP HBy 1.0 1.8 3.8 1868 1436 B 38 GLN H B 36 PRO HG2 1.0 2.0 5.8 1869 1437 B 43 LEU HG B 42 ASP H 1.0 2.0 6.0 1870 1438 B 59 GLY H B 58 PRO HA 1.0 0.0 6.0 1871 1439 B 50 ILE H B 49 ASP HBx 1.0 2.0 4.8 1872 1439 B 50 ILE H B 49 ASP HBy 1.0 2.0 4.8 1873 1440 B 18 THR H B 17 GLU HBy 1.0 1.9 4.7 1874 1441 B 45 LEU HBx B 45 LEU H 1.0 1.7 3.1 1875 1441 B 45 LEU HG B 45 LEU H 1.0 1.7 3.1 1876 1441 B 45 LEU H B 45 LEU HBy 1.0 1.7 3.1 1877 1442 B 41 ASP H B 40 MET HA 1.0 1.7 3.3 1878 1443 B 50 ILE HD1% B 50 ILE H 1.0 1.8 3.8 1879 1443 B 50 ILE HG2% B 50 ILE H 1.0 1.8 3.8 1880 1444 B 55 THR HG2% B 55 THR H 1.0 1.9 4.3 1881 1445 B 51 GLU H B 50 ILE H 1.0 1.8 3.6 1882 1446 B 14 LEU H B 14 LEU HBy 1.0 1.7 3.5 1883 1446 B 14 LEU H B 14 LEU HBx 1.0 1.7 3.5 1884 1447 B 41 ASP H B 41 ASP HBy 1.0 1.7 3.5 1885 1447 B 41 ASP H B 41 ASP HBx 1.0 1.7 3.5 1886 1448 B 53 TRP HE1 B 53 TRP HA 1.0 1.9 6.0 1887 1449 B 45 LEU H B 44 MET HGx 1.0 2.0 6.0 1888 1450 B 53 TRP H B 52 GLN HA 1.0 1.9 4.3 1889 1451 B 35 LEU H B 36 PRO HDy 1.0 2.0 6.0 1890 1452 B 51 GLU H B 51 GLU HA 1.0 1.9 3.9 1891 1453 B 25 LEU H B 23 TRP HA 1.0 1.9 4.9 1892 1454 B 53 TRP HE1 B 53 TRP HB2 1.0 2.0 6.0 1893 1454 B 53 TRP HE1 B 53 TRP HB3 1.0 2.0 6.0 1894 1455 B 24 LYS HA B 26 LEU H 1.0 1.9 4.9 1895 1456 B 32 LEU HG B 33 SER H 1.0 2.0 5.6 1896 1456 B 32 LEU HBx B 33 SER H 1.0 2.0 5.6 1897 1456 B 32 LEU HBy B 33 SER H 1.0 2.0 5.6 1898 1457 B 30 ASN HD21 B 30 ASN HD22 1.0 1.2 2.2 1899 1458 B 40 MET H B 39 ALA HA 1.0 1.7 3.3 1900 1459 B 50 ILE HA B 51 GLU H 1.0 1.9 4.1 1901 1460 B 51 GLU H B 51 GLU HG3 1.0 2.0 5.0 1902 1460 B 51 GLU H B 51 GLU HG2 1.0 2.0 5.0 1903 1461 B 33 SER H B 32 LEU HA 1.0 1.7 3.3 1904 1462 B 55 THR H B 55 THR HB 1.0 1.9 4.7 1905 1463 B 24 LYS H B 23 TRP H 1.0 1.7 3.3 1906 1464 B 58 PRO HDx B 59 GLY H 1.0 1.9 4.1 1907 1465 B 28 GLU H B 27 PRO HA 1.0 1.7 3.1 1908 1466 B 55 THR H B 54 PHE HA 1.0 1.8 3.6 1909 1467 B 31 VAL H B 31 VAL HA 1.0 1.9 4.1 1910 1468 B 23 TRP H B 22 LEU HG 1.0 1.9 3.9 1911 1468 B 23 TRP H B 22 LEU HBx 1.0 1.9 3.9 1912 1469 B 57 ASP H B 56 GLU HBy 1.0 2.0 5.8 1913 1470 B 24 LYS H B 24 LYS HA 1.0 1.8 3.6 1914 1471 B 54 PHE HD% B 55 THR H 1.0 2.0 5.4 1915 1472 B 26 LEU H B 26 LEU HD2% 1.0 1.9 4.1 1916 1472 B 26 LEU H B 26 LEU HD1% 1.0 1.9 4.1 1917 1473 B 28 GLU H B 26 LEU HBy 1.0 1.9 4.5 1918 1473 B 28 GLU H B 26 LEU HBx 1.0 1.9 4.5 1919 1474 B 15 SER H B 14 LEU HBy 1.0 2.0 6.0 1920 1474 B 15 SER H B 14 LEU HBx 1.0 2.0 6.0 1921 1475 B 38 GLN H B 38 GLN HG3 1.0 2.0 5.6 1922 1475 B 38 GLN H B 38 GLN HBy 1.0 2.0 5.6 1923 1476 B 39 ALA HB% B 42 ASP H 1.0 0.0 6.0 1924 1477 B 22 LEU H B 22 LEU HD1% 1.0 2.0 6.0 1925 1477 B 22 LEU H B 22 LEU HD2% 1.0 2.0 6.0 1926 1478 B 48 ASP H B 47 PRO HBy 1.0 2.0 5.0 1927 1479 B 53 TRP H B 52 GLN HGy 1.0 2.0 6.0 1928 1479 B 53 TRP H B 52 GLN HGx 1.0 2.0 6.0 1929 1480 B 29 ASN HD21 B 28 GLU HBx 1.0 2.0 6.0 1930 1480 B 29 ASN HD21 B 28 GLU HBy 1.0 2.0 6.0 1931 1481 B 59 GLY H B 58 PRO HG2 1.0 2.0 4.6 1932 1481 B 59 GLY H B 58 PRO HG3 1.0 2.0 4.6 1933 1482 B 22 LEU H B 22 LEU HBx 1.0 1.6 2.6 1934 1482 B 22 LEU H B 22 LEU HG 1.0 1.6 2.6 1935 1483 B 45 LEU HG B 46 SER H 1.0 2.0 6.0 1936 1483 B 45 LEU HBx B 46 SER H 1.0 2.0 6.0 1937 1484 B 53 TRP HE1 B 53 TRP HZ2 1.0 1.9 4.1 1938 1485 B 31 VAL H B 31 VAL HB 1.0 1.9 4.3 1939 1486 B 44 MET HB3 B 45 LEU H 1.0 1.9 3.9 1940 1486 B 44 MET HB2 B 45 LEU H 1.0 1.9 3.9 1941 1487 B 40 MET H B 40 MET HGx 1.0 2.0 5.2 1942 1488 B 28 GLU H B 27 PRO HDy 1.0 0.0 6.0 1943 1489 B 48 ASP H B 47 PRO HBx 1.0 1.9 4.7 1944 1490 B 23 TRP HE1 B 23 TRP HZ2 1.0 1.8 3.8 1945 1491 B 22 LEU H B 22 LEU HA 1.0 1.8 3.6 1946 1492 B 53 TRP HE1 B 50 ILE HD1% 1.0 2.0 6.0 1947 1492 B 53 TRP HE1 B 50 ILE HG2% 1.0 2.0 6.0 1948 1493 B 21 ASP H B 21 ASP HBx 1.0 1.8 3.8 1949 1494 B 43 LEU H B 42 ASP H 1.0 1.8 3.4 1950 1495 B 44 MET HB3 B 43 LEU H 1.0 2.0 6.0 1951 1495 B 44 MET HE% B 43 LEU H 1.0 2.0 6.0 1952 1495 B 44 MET HB2 B 43 LEU H 1.0 2.0 6.0 1953 1496 B 38 GLN HE21 B 38 GLN HG3 1.0 1.9 3.7 1954 1496 B 38 GLN HE21 B 38 GLN HG2 1.0 1.9 3.7 1955 1497 B 22 LEU HBy B 23 TRP H 1.0 2.0 5.6 1956 1498 B 54 PHE HBy B 54 PHE H 1.0 1.9 3.9 1957 1499 B 24 LYS H B 24 LYS HG2 1.0 1.8 4.0 1958 1499 B 24 LYS H B 24 LYS HG3 1.0 1.8 4.0 1959 1500 B 52 GLN HBy B 52 GLN HE22 1.0 2.0 6.0 1960 1500 B 52 GLN HBx B 52 GLN HE22 1.0 2.0 6.0 1961 1501 B 32 LEU HBx B 29 ASN HD22 1.0 2.0 5.6 1962 1501 B 32 LEU HG B 29 ASN HD22 1.0 2.0 5.6 1963 1502 B 53 TRP H B 53 TRP HA 1.0 1.9 4.1 1964 1503 B 29 ASN HD21 B 29 ASN HD22 1.0 1.3 2.2 1965 1504 B 50 ILE H B 49 ASP HBx 1.0 2.0 4.8 1966 1505 B 53 TRP HZ3 B 53 TRP HE3 1.0 1.9 4.3 1967 1506 B 19 PHE HBx B 22 LEU HD1% 1.0 2.0 6.0 1968 1507 B 26 LEU HD1% B 23 TRP HZ2 1.0 0.0 6.0 1969 1508 B 19 PHE HBy B 19 PHE HD% 1.0 1.7 3.5 1970 1509 B 24 LYS HBx B 23 TRP HZ2 1.0 2.0 6.0 1971 1509 B 24 LYS HD2 B 23 TRP HZ2 1.0 2.0 6.0 1972 1509 B 24 LYS HD3 B 23 TRP HZ2 1.0 2.0 6.0 1973 1510 B 24 LYS HG3 B 23 TRP HE3 1.0 2.0 6.0 1974 1510 B 24 LYS HG2 B 23 TRP HE3 1.0 2.0 6.0 1975 1511 B 35 LEU HD1% B 36 PRO HDy 1.0 1.9 4.3 1976 1512 B 19 PHE HBx B 19 PHE HD% 1.0 1.8 3.6 1977 1513 B 50 ILE HG2% B 54 PHE HBy 1.0 2.0 6.0 1978 1514 A 48 TRP HD1 B 44 MET HE% 1.0 2.0 5.8 1979 1515 B 23 TRP HBx B 23 TRP HA 1.0 1.6 3.0 1980 1515 B 23 TRP HBy B 23 TRP HA 1.0 1.6 3.0 1981 1516 B 50 ILE HD1% B 51 GLU HG3 1.0 2.0 5.6 1982 1516 B 50 ILE HD1% B 51 GLU HG2 1.0 2.0 5.6 1983 1517 B 55 THR HG2% B 55 THR HB 1.0 1.6 2.8 1984 1518 B 59 GLY H B 59 GLY HAx 1.0 1.8 3.6 1985 1519 B 35 LEU H B 35 LEU HBx 1.0 1.7 3.3 1986 1520 B 46 SER H B 45 LEU HA 1.0 1.7 3.1 1987 1521 B 50 ILE HD1% B 50 ILE H 1.0 2.0 5.4 1988 1522 B 54 PHE HD% B 50 ILE HG2% 1.0 1.8 4.2 1989 1523 B 24 LYS HA B 23 TRP HZ3 1.0 2.0 6.0 1990 1524 B 39 ALA HA B 40 MET HE% 1.0 1.9 5.1 1991 1524 B 40 MET HBx B 39 ALA HA 1.0 1.9 5.1 1992 1525 B 33 SER H B 31 VAL HG2% 1.0 1.9 4.7 1993 1525 B 33 SER H B 31 VAL HG1% 1.0 1.9 4.7 1994 1526 B 54 PHE HBx B 50 ILE HD1% 1.0 2.0 5.8 1995 1527 B 35 LEU H B 35 LEU HG 1.0 2.0 4.8 1996 1528 B 28 GLU H B 28 GLU HBx 1.0 2.0 4.4 1997 1529 B 57 ASP HBx B 58 PRO HDx 1.0 1.8 3.6 1998 1530 B 24 LYS HA B 24 LYS HG3 1.0 1.7 3.3 1999 1530 B 24 LYS HA B 24 LYS HG2 1.0 1.7 3.3 2000 1531 B 44 MET HE% B 44 MET HGy 1.0 1.6 3.0 2001 1531 B 44 MET HB2 B 44 MET HGy 1.0 1.6 3.0 2002 1531 B 44 MET HB3 B 44 MET HGy 1.0 1.6 3.0 2003 1532 B 24 LYS HG2 B 24 LYS HE2 1.0 1.7 3.3 2004 1532 B 24 LYS HG3 B 24 LYS HE3 1.0 1.7 3.3 2005 1532 B 24 LYS HG3 B 24 LYS HE2 1.0 1.7 3.3 2006 1532 B 24 LYS HG2 B 24 LYS HE3 1.0 1.7 3.3 2007 1533 B 53 TRP HD1 B 52 GLN HGy 1.0 2.0 6.0 2008 1533 B 53 TRP HD1 B 52 GLN HGx 1.0 2.0 6.0 2009 1534 B 36 PRO HDx B 35 LEU HD1% 1.0 2.0 4.4 2010 1535 B 50 ILE HA B 53 TRP HD1 1.0 2.0 5.6 2011 1536 B 48 ASP H B 48 ASP HA 1.0 1.8 3.6 2012 1537 B 24 LYS HA B 24 LYS HE2 1.0 2.0 6.0 2013 1537 B 24 LYS HA B 24 LYS HE3 1.0 2.0 6.0 2014 1538 B 16 GLN HBx B 19 PHE HD% 1.0 0.0 6.0 2015 1539 B 28 GLU H B 28 GLU HBy 1.0 2.0 5.0 2016 1540 B 50 ILE HD1% B 50 ILE HB 1.0 1.7 3.1 2017 1541 B 26 LEU HD2% B 23 TRP HE3 1.0 2.0 5.0 2018 1541 B 26 LEU HD1% B 23 TRP HE3 1.0 2.0 5.0 2019 1542 B 18 THR HB B 18 THR HG2% 1.0 1.7 2.9 2020 1543 B 24 LYS H B 24 LYS HD2 1.0 2.0 6.0 2021 1543 B 24 LYS H B 24 LYS HD3 1.0 2.0 6.0 2022 1544 B 26 LEU H B 26 LEU HA 1.0 1.8 3.6 2023 1545 B 22 LEU H B 22 LEU HD1% 1.0 2.0 5.6 2024 1546 B 44 MET HE% B 44 MET H 1.0 2.0 5.4 2025 1547 B 19 PHE HBx B 19 PHE HA 1.0 1.7 3.3 2026 1548 B 50 ILE HG2% B 50 ILE H 1.0 1.8 3.6 2027 1549 B 50 ILE HB B 50 ILE HG1y 1.0 1.8 3.6 2028 1550 B 56 GLU H B 55 THR HA 1.0 1.7 3.3 2029 1551 B 19 PHE HA B 19 PHE HE% 1.0 1.9 6.0 2030 1552 B 50 ILE H B 50 ILE HG1y 1.0 1.9 3.9 2031 1553 B 23 TRP HBy B 23 TRP HA 1.0 1.8 3.6 2032 1554 B 22 LEU HBy B 23 TRP HA 1.0 2.0 5.2 2033 1555 B 32 LEU HA B 32 LEU HD1% 1.0 1.7 3.3 2034 1555 B 32 LEU HD2% B 32 LEU HA 1.0 1.7 3.3 2035 1556 B 24 LYS HD2 B 21 ASP HA 1.0 1.9 4.9 2036 1556 B 24 LYS HD3 B 21 ASP HA 1.0 1.9 4.9 2037 1557 B 43 LEU HA B 43 LEU HBx 1.0 1.8 3.6 2038 1558 B 22 LEU HD2% B 19 PHE HA 1.0 2.0 5.8 2039 1559 B 44 MET HE% B 43 LEU HD1% 1.0 1.8 3.8 2040 1560 B 34 PRO HA B 35 LEU HBy 1.0 2.0 5.2 2041 1561 B 54 PHE HBx B 50 ILE HG2% 1.0 2.0 6.0 2042 1561 B 54 PHE HBx B 50 ILE HD1% 1.0 2.0 6.0 2043 1562 B 19 PHE HBx B 19 PHE HBy 1.0 1.2 2.2 2044 1563 B 48 ASP HBx B 49 ASP H 1.0 2.0 5.0 2045 1564 B 47 PRO HA B 47 PRO HG3 1.0 2.0 5.4 2046 1564 B 47 PRO HA B 47 PRO HG2 1.0 2.0 5.4 2047 1565 B 23 TRP HE3 B 23 TRP HZ3 1.0 1.9 4.1 2048 1566 B 52 GLN H B 51 GLU HA 1.0 1.9 3.9 2049 1567 B 24 LYS HG3 B 24 LYS HBy 1.0 1.8 3.4 2050 1567 B 24 LYS HG2 B 24 LYS HBy 1.0 1.8 3.4 2051 1568 B 28 GLU H B 27 PRO HBx 1.0 2.0 6.0 2052 1569 B 55 THR HG2% B 51 GLU HA 1.0 1.9 4.7 2053 1570 B 54 PHE HBx B 54 PHE HBy 1.0 1.4 2.4 2054 1571 B 47 PRO HA B 50 ILE HD1% 1.0 1.9 3.9 2055 1572 B 45 LEU HBx B 44 MET HGx 1.0 2.0 5.8 2056 1572 B 45 LEU HBy B 44 MET HGx 1.0 2.0 5.8 2057 1572 B 45 LEU HG B 44 MET HGx 1.0 2.0 5.8 2058 1573 B 55 THR HA B 56 GLU HBy 1.0 2.0 6.0 2059 1574 B 50 ILE HG2% B 53 TRP HE3 1.0 2.0 5.6 2060 1574 B 50 ILE HG2% B 53 TRP HZ2 1.0 2.0 5.6 2061 1575 B 18 THR HB B 22 LEU HG 1.0 1.9 4.7 2062 1576 B 24 LYS HA B 24 LYS HD3 1.0 2.0 5.8 2063 1576 B 24 LYS HA B 24 LYS HD2 1.0 2.0 5.8 2064 1577 B 52 GLN H B 52 GLN HBy 1.0 2.0 4.4 2065 1578 B 23 TRP HA B 23 TRP HD1 1.0 2.0 6.0 2066 1579 B 45 LEU H B 44 MET HGy 1.0 2.0 6.0 2067 1580 B 23 TRP HD1 B 20 SER HA 1.0 2.0 4.8 2068 1581 B 44 MET HA B 44 MET HGy 1.0 1.8 4.0 2069 1582 B 29 ASN HBx B 29 ASN HD22 1.0 2.0 6.0 2070 1583 B 30 ASN HBy B 32 LEU HA 1.0 2.0 5.6 2071 1584 B 59 GLY HAx B 60 PRO HDx 1.0 1.7 3.1 2072 1584 B 59 GLY HAx B 60 PRO HDy 1.0 1.7 3.1 2073 1585 B 51 GLU H B 50 ILE HD1% 1.0 2.0 5.2 2074 1586 B 50 ILE HG2% B 50 ILE HB 1.0 1.6 2.8 2075 1587 B 24 LYS HBx B 24 LYS HE3 1.0 2.0 6.0 2076 1587 B 24 LYS HBx B 24 LYS HE2 1.0 2.0 6.0 2077 1588 B 19 PHE HD% B 16 GLN HA 1.0 2.0 4.8 2078 1589 B 15 SER HBx B 16 GLN H 1.0 2.0 5.0 2079 1590 B 17 GLU HBy B 17 GLU HA 1.0 1.6 3.0 2080 1591 B 50 ILE HG1y B 50 ILE HG1x 1.0 1.4 2.2 2081 1592 B 59 GLY HAx B 60 PRO HG3 1.0 1.9 6.0 2082 1592 B 59 GLY HAx B 60 PRO HG2 1.0 1.9 6.0 2083 1593 B 58 PRO HBy B 58 PRO HA 1.0 1.4 2.4 2084 1594 B 47 PRO HA B 47 PRO HBx 1.0 1.8 3.6 2085 1595 B 23 TRP HBy B 23 TRP H 1.0 1.8 3.6 2086 1596 B 53 TRP HD1 B 50 ILE HD1% 1.0 2.0 6.0 2087 1596 B 53 TRP HD1 B 50 ILE HG2% 1.0 2.0 6.0 2088 1597 B 23 TRP HBy B 20 SER HA 1.0 2.0 6.0 2089 1597 B 23 TRP HBx B 20 SER HA 1.0 2.0 6.0 2090 1598 B 19 PHE HD% B 19 PHE HA 1.0 1.8 3.4 2091 1599 B 24 LYS HA B 24 LYS HBy 1.0 1.7 3.3 2092 1600 B 49 ASP H B 47 PRO HBy 1.0 2.0 6.0 2093 1601 B 53 TRP HD1 B 53 TRP HE3 1.0 2.0 6.0 2094 1601 B 53 TRP HD1 B 53 TRP HZ2 1.0 2.0 6.0 2095 1602 B 54 PHE HD% B 54 PHE HBy 1.0 1.8 3.6 2096 1603 B 16 GLN HBx B 16 GLN HA 1.0 1.7 3.1 2097 1604 B 45 LEU HBx B 54 PHE HBy 1.0 0.0 6.0 2098 1605 B 49 ASP H B 49 ASP HBy 1.0 2.0 4.8 2099 1606 B 33 SER H B 32 LEU HD1% 1.0 2.0 6.0 2100 1607 B 45 LEU HD2% B 53 TRP HE3 1.0 2.0 5.8 2101 1607 B 45 LEU HD2% B 53 TRP HZ2 1.0 2.0 5.8 2102 1608 B 54 PHE HD% B 53 TRP HB3 1.0 2.0 6.0 2103 1608 B 54 PHE HD% B 53 TRP HB2 1.0 2.0 6.0 2104 1609 B 47 PRO HA B 50 ILE HB 1.0 2.0 5.8 2105 1610 B 47 PRO HA B 47 PRO HBy 1.0 1.6 2.8 2106 1611 B 55 THR HG2% B 54 PHE HA 1.0 0.0 6.0 2107 1612 B 45 LEU HD1% B 45 LEU HA 1.0 1.9 4.5 2108 1613 B 24 LYS HE2 B 24 LYS HBy 1.0 2.0 6.0 2109 1613 B 24 LYS HE3 B 24 LYS HBy 1.0 2.0 6.0 2110 1614 B 26 LEU H B 27 PRO HDy 1.0 2.0 6.0 2111 1615 B 23 TRP HE3 B 26 LEU HG 1.0 2.0 6.0 2112 1616 B 50 ILE HB B 50 ILE HG1x 1.0 1.8 3.8 2113 1617 B 59 GLY H B 59 GLY HAy 1.0 1.8 3.8 2114 1618 B 53 TRP HA B 53 TRP HB2 1.0 1.8 4.0 2115 1618 B 53 TRP HA B 53 TRP HB3 1.0 1.8 4.0 2116 1619 B 50 ILE HD1% B 50 ILE HB 1.0 1.6 2.8 2117 1619 B 50 ILE HG2% B 50 ILE HB 1.0 1.6 2.8 2118 1620 B 50 ILE HA B 53 TRP HB3 1.0 1.9 6.0 2119 1620 B 50 ILE HA B 53 TRP HB2 1.0 1.9 6.0 2120 1621 B 32 LEU HBy B 31 VAL HA 1.0 2.0 6.0 2121 1621 B 32 LEU HG B 31 VAL HA 1.0 2.0 6.0 2122 1621 B 32 LEU HBx B 31 VAL HA 1.0 2.0 6.0 2123 1622 B 20 SER HA B 20 SER HBx 1.0 1.7 3.3 2124 1623 B 52 GLN H B 51 GLU HG2 1.0 2.0 5.6 2125 1623 B 52 GLN H B 51 GLU HG3 1.0 2.0 5.6 2126 1624 B 24 LYS HBx B 21 ASP HA 1.0 1.9 4.9 2127 1625 B 27 PRO HA B 26 LEU HD2% 1.0 2.0 5.4 2128 1625 B 27 PRO HA B 26 LEU HD1% 1.0 2.0 5.4 2129 1626 B 23 TRP HBx B 23 TRP HE3 1.0 1.8 3.8 2130 1626 B 23 TRP HBy B 23 TRP HE3 1.0 1.8 3.8 2131 1627 B 50 ILE HG2% B 50 ILE HG1y 1.0 1.6 3.0 2132 1627 B 50 ILE HD1% B 50 ILE HG1y 1.0 1.6 3.0 2133 1628 B 24 LYS H B 24 LYS HBy 1.0 1.9 5.1 2134 1629 B 24 LYS HD3 B 24 LYS HG2 1.0 1.7 2.9 2135 1629 B 24 LYS HD2 B 24 LYS HG3 1.0 1.7 2.9 2136 1629 B 24 LYS HD3 B 24 LYS HG3 1.0 1.7 2.9 2137 1629 B 24 LYS HD2 B 24 LYS HG2 1.0 1.7 2.9 2138 1630 B 50 ILE HA B 50 ILE HB 1.0 1.8 3.6 2139 1631 B 51 GLU H B 50 ILE HB 1.0 1.9 4.5 2140 1632 B 26 LEU H B 26 LEU HG 1.0 1.7 3.1 2141 1633 B 50 ILE HD1% B 50 ILE HG1x 1.0 1.6 2.8 2142 1634 B 53 TRP HD1 B 53 TRP HA 1.0 2.0 5.0 2143 1635 B 54 PHE HBx B 55 THR HG2% 1.0 0.0 6.0 2144 1636 B 24 LYS HA B 26 LEU HD1% 1.0 1.9 3.9 2145 1637 A 20 GLN HA B 45 LEU HD1% 1.0 1.9 4.5 2146 1638 B 53 TRP HA B 53 TRP HE3 1.0 2.0 6.0 2147 1639 B 26 LEU H B 26 LEU HD2% 1.0 1.9 6.0 2148 1640 B 24 LYS HE3 B 21 ASP HA 1.0 2.0 5.6 2149 1640 B 24 LYS HE2 B 21 ASP HA 1.0 2.0 5.6 2150 1641 B 23 TRP H B 23 TRP HD1 1.0 1.8 3.8 2151 1642 B 32 LEU HBy B 30 ASN HBy 1.0 1.9 4.5 2152 1642 B 32 LEU HG B 30 ASN HBy 1.0 1.9 4.5 2153 1643 B 14 LEU HD1% B 14 LEU HA 1.0 1.7 3.5 2154 1643 B 14 LEU HD2% B 14 LEU HA 1.0 1.7 3.5 2155 1644 B 24 LYS HE2 B 23 TRP HH2 1.0 0.0 6.0 2156 1644 B 24 LYS HE3 B 23 TRP HH2 1.0 0.0 6.0 2157 1645 B 50 ILE HA B 50 ILE HG2% 1.0 1.7 3.3 2158 1646 B 23 TRP HZ2 B 23 TRP HZ3 1.0 2.0 6.0 2159 1647 B 58 PRO HDx B 57 ASP HBy 1.0 1.9 4.3 2160 1648 B 24 LYS HG2 B 23 TRP H 1.0 2.0 5.2 2161 1648 B 24 LYS HG3 B 23 TRP H 1.0 2.0 5.2 2162 1649 B 55 THR HG2% B 54 PHE HBy 1.0 2.0 5.0 2163 1650 B 22 LEU HG B 22 LEU HD2% 1.0 1.6 2.8 2164 1650 B 22 LEU HG B 22 LEU HD1% 1.0 1.6 2.8 2165 1651 B 51 GLU HA B 51 GLU HBy 1.0 1.7 3.5 2166 1652 B 18 THR HG2% B 18 THR HA 1.0 1.7 3.1 2167 1653 B 24 LYS HA B 23 TRP HE3 1.0 1.9 5.1 2168 1654 B 22 LEU HBy B 22 LEU HBx 1.0 1.2 2.2 2169 1655 B 22 LEU HD2% B 22 LEU HA 1.0 1.6 2.8 2170 1656 B 14 LEU HD2% B 14 LEU HA 1.0 1.9 4.1 2171 1657 B 50 ILE HA B 50 ILE HD1% 1.0 1.9 4.7 2172 1658 B 43 LEU HG B 43 LEU HA 1.0 1.7 3.3 2173 1658 B 43 LEU HA B 43 LEU HBx 1.0 1.7 3.3 2174 1659 B 50 ILE HA B 53 TRP HH2 1.0 2.0 5.6 2175 1659 B 50 ILE HA B 53 TRP HD1 1.0 2.0 5.6 2176 1660 B 31 VAL HA B 31 VAL HB 1.0 1.7 3.5 2177 1661 B 39 ALA HA B 38 GLN HG3 1.0 2.0 4.6 2178 1661 B 39 ALA HA B 38 GLN HG2 1.0 2.0 4.6 2179 1662 B 48 ASP HBy B 48 ASP HA 1.0 1.8 3.4 2180 1663 B 25 LEU HA B 25 LEU HD2% 1.0 1.5 2.7 2181 1664 B 51 GLU H B 50 ILE HG2% 1.0 2.0 4.8 2182 1665 B 23 TRP HBy B 23 TRP HD1 1.0 1.9 4.1 2183 1666 B 22 LEU HBx B 22 LEU HA 1.0 1.8 4.0 2184 1667 B 46 SER HBy B 46 SER HA 1.0 1.7 3.3 2185 1668 B 59 GLY HAx B 60 PRO HBy 1.0 2.0 6.0 2186 1669 B 50 ILE HA B 53 TRP HE3 1.0 2.0 5.6 2187 1670 B 50 ILE HD1% B 45 LEU HBy 1.0 1.8 3.6 2188 1670 B 45 LEU HBx B 50 ILE HD1% 1.0 1.8 3.6 2189 1671 B 25 LEU H B 25 LEU HD2% 1.0 2.0 5.2 2190 1672 B 50 ILE HG2% B 54 PHE HBy 1.0 2.0 5.4 2191 1672 B 50 ILE HD1% B 54 PHE HBy 1.0 2.0 5.4 2192 1673 B 28 GLU H B 27 PRO HBy 1.0 1.9 6.0 2193 1674 B 23 TRP HZ2 B 23 TRP HH2 1.0 1.6 3.0 2194 1675 B 25 LEU H B 25 LEU HG 1.0 1.7 3.5 2195 1676 B 59 GLY HAy B 60 PRO HDy 1.0 1.6 3.0 2196 1676 B 59 GLY HAy B 60 PRO HDx 1.0 1.6 3.0 2197 1677 B 48 ASP HBx B 48 ASP HA 1.0 1.8 3.8 2198 1678 B 53 TRP HE1 B 53 TRP HH2 1.0 2.0 6.0 2199 1679 B 52 GLN HBx B 52 GLN HA 1.0 1.8 3.8 2200 1680 B 21 ASP HA B 23 TRP HD1 1.0 1.9 5.3 2201 1681 B 45 LEU HD1% B 45 LEU HA 1.0 1.7 3.1 2202 1681 B 45 LEU HD2% B 45 LEU HA 1.0 1.7 3.1 2203 1682 B 45 LEU HD2% B 45 LEU HA 1.0 1.6 2.8 2204 1683 B 21 ASP HA B 24 LYS HBy 1.0 2.0 6.0 2205 1684 B 52 GLN HGy B 52 GLN HA 1.0 1.7 3.5 2206 1684 B 52 GLN HGx B 52 GLN HA 1.0 1.7 3.5 2207 1685 B 53 TRP HB3 B 53 TRP HE3 1.0 1.9 4.5 2208 1685 B 53 TRP HB2 B 53 TRP HE3 1.0 1.9 4.5 2209 1686 B 46 SER H B 46 SER HBx 1.0 1.9 4.3 2210 1687 B 50 ILE HG2% B 50 ILE HG1y 1.0 1.9 3.9 2211 1688 B 22 LEU H B 22 LEU HBx 1.0 1.7 3.1 2212 1689 B 48 ASP H B 47 PRO HG2 1.0 2.0 5.2 2213 1689 B 48 ASP H B 47 PRO HG3 1.0 2.0 5.2 2214 1690 B 46 SER H B 46 SER HBy 1.0 1.9 4.5 2215 1691 B 26 LEU HD2% B 23 TRP HZ3 1.0 2.0 5.4 2216 1691 B 26 LEU HD1% B 23 TRP HZ3 1.0 2.0 5.4 2217 1692 B 54 PHE HBx B 50 ILE HG2% 1.0 2.0 5.4 2218 1693 B 45 LEU HG B 45 LEU HA 1.0 1.8 3.4 2219 1693 B 45 LEU HBx B 45 LEU HA 1.0 1.8 3.4 2220 1694 B 44 MET HA B 45 LEU H 1.0 1.7 3.5 2221 1695 B 23 TRP HE1 B 23 TRP HD1 1.0 1.7 3.3 2222 1696 B 47 PRO HA B 50 ILE HG1x 1.0 2.0 5.0 2223 1697 B 45 LEU HD1% B 54 PHE HD% 1.0 1.9 3.9 2224 1698 A 18 PHE HE% B 44 MET HE% 1.0 1.9 4.3 2225 1699 B 50 ILE HG2% B 51 GLU HG2 1.0 2.0 5.4 2226 1699 B 50 ILE HG2% B 51 GLU HG3 1.0 2.0 5.4 2227 1699 B 50 ILE HD1% B 51 GLU HG3 1.0 2.0 5.4 2228 1699 B 50 ILE HD1% B 51 GLU HG2 1.0 2.0 5.4 2229 1700 B 22 LEU H B 22 LEU HG 1.0 1.7 3.1 2230 1701 B 19 PHE H B 19 PHE HA 1.0 1.9 4.5 2231 1702 B 52 GLN HGy B 52 GLN H 1.0 1.9 4.1 2232 1702 B 52 GLN HGx B 52 GLN H 1.0 1.9 4.1 2233 1703 B 32 LEU HD2% B 32 LEU HA 1.0 1.6 3.0 2234 1704 B 22 LEU HBy B 22 LEU HA 1.0 1.6 3.0 2235 1705 B 26 LEU HD1% B 23 TRP HE3 1.0 1.9 4.3 2236 1706 B 45 LEU HD2% B 46 SER H 1.0 2.0 5.8 2237 1707 B 22 LEU HD2% B 19 PHE HD% 1.0 0.0 6.0 2238 1708 B 54 PHE HD% B 50 ILE HG1y 1.0 2.0 6.0 2239 1709 B 55 THR HG2% B 55 THR HA 1.0 1.8 3.4 2240 1710 B 50 ILE H B 50 ILE HB 1.0 1.9 3.9 2241 1711 B 22 LEU HG B 19 PHE HD% 1.0 2.0 6.0 2242 1712 B 23 TRP HZ2 B 24 LYS HE2 1.0 2.0 5.6 2243 1712 B 23 TRP HZ2 B 24 LYS HE3 1.0 2.0 5.6 2244 1713 B 43 LEU HD2% B 43 LEU H 1.0 2.0 5.2 2245 1714 B 50 ILE HD1% B 53 TRP HZ2 1.0 1.9 4.9 2246 1714 B 50 ILE HG2% B 53 TRP HZ2 1.0 1.9 4.9 2247 1715 B 24 LYS HD3 B 24 LYS HE3 1.0 1.6 2.8 2248 1715 B 24 LYS HD2 B 24 LYS HE2 1.0 1.6 2.8 2249 1715 B 24 LYS HD2 B 24 LYS HE3 1.0 1.6 2.8 2250 1715 B 24 LYS HD3 B 24 LYS HE2 1.0 1.6 2.8 2251 1716 B 50 ILE HG2% B 51 GLU HA 1.0 2.0 5.0 2252 1717 B 22 LEU H B 22 LEU HD2% 1.0 2.0 5.8 2253 1718 B 51 GLU H B 51 GLU HBy 1.0 1.7 3.5 2254 1719 B 54 PHE HBx B 54 PHE HA 1.0 1.8 3.6 2255 1720 B 28 GLU HA B 28 GLU HBy 1.0 1.6 3.0 2256 1720 B 28 GLU HA B 28 GLU HBx 1.0 1.6 3.0 2257 1721 B 23 TRP HA B 23 TRP HE3 1.0 2.0 5.6 2258 1722 B 14 LEU HD1% B 19 PHE HE% 1.0 0.0 6.0 2259 1722 B 14 LEU HD1% B 19 PHE HD% 1.0 0.0 6.0 2260 1723 B 50 ILE H B 49 ASP HBy 1.0 1.9 5.1 2261 1724 B 52 GLN HBy B 52 GLN HA 1.0 1.7 3.1 2262 1724 B 52 GLN HBx B 52 GLN HA 1.0 1.7 3.1 2263 1725 B 56 GLU HA B 57 ASP HBx 1.0 2.0 6.0 2264 1726 B 22 LEU HD1% B 19 PHE HA 1.0 1.9 4.1 2265 1727 B 54 PHE HD% B 54 PHE HA 1.0 1.9 3.9 2266 1728 B 20 SER HBy B 20 SER HA 1.0 1.7 3.3 2267 1729 B 59 GLY HAx B 60 PRO HDx 1.0 1.7 2.9 2268 1729 B 59 GLY HAy B 60 PRO HDx 1.0 1.7 2.9 2269 1730 A 41 SER HBx B 44 MET HB3 1.0 0.0 6.0 2270 1730 A 41 SER HA B 44 MET HB3 1.0 0.0 6.0 2271 1730 A 41 SER HBx B 44 MET HB2 1.0 0.0 6.0 2272 1730 A 41 SER HA B 44 MET HB2 1.0 0.0 6.0 2273 1731 B 54 PHE HD% B 55 THR HG2% 1.0 1.9 5.3 2274 1732 B 53 TRP HD1 B 52 GLN HBy 1.0 1.9 4.9 2275 1732 B 53 TRP HD1 B 52 GLN HBx 1.0 1.9 4.9 2276 1733 B 26 LEU HD1% B 23 TRP HZ3 1.0 1.9 4.7 2277 1734 B 55 THR HA B 56 GLU HGy 1.0 2.0 6.0 2278 1734 B 55 THR HA B 56 GLU HGx 1.0 2.0 6.0 2279 1735 B 22 LEU H B 20 SER HA 1.0 2.0 5.6 2280 1736 B 60 PRO HDx B 60 PRO HG2 1.0 1.5 2.7 2281 1736 B 60 PRO HDx B 60 PRO HG3 1.0 1.5 2.7 2282 1737 B 44 MET H B 44 MET HGx 1.0 2.0 5.8 2283 1738 B 43 LEU HD2% B 43 LEU HA 1.0 1.7 2.9 2284 1739 B 32 LEU HBy B 30 ASN HBx 1.0 1.9 5.3 2285 1739 B 32 LEU HG B 30 ASN HBx 1.0 1.9 5.3 2286 1740 B 24 LYS HD2 B 21 ASP HA 1.0 1.7 3.3 2287 1740 B 24 LYS HD3 B 21 ASP HA 1.0 1.7 3.3 2288 1740 B 24 LYS HBx B 21 ASP HA 1.0 1.7 3.3 2289 1741 B 35 LEU HD1% B 35 LEU HA 1.0 1.8 3.6 2290 1742 B 31 VAL HG2% B 31 VAL HA 1.0 1.6 3.0 2291 1742 B 31 VAL HG1% B 31 VAL HA 1.0 1.6 3.0 2292 1743 B 19 PHE HBy B 19 PHE HA 1.0 1.7 2.9 2293 1744 B 24 LYS HG2 B 21 ASP HBx 1.0 2.0 5.4 2294 1744 B 24 LYS HG3 B 21 ASP HBx 1.0 2.0 5.4 2295 1745 B 22 LEU HG B 22 LEU HA 1.0 1.9 4.3 2296 1746 B 40 MET HBx B 40 MET HGy 1.0 1.6 2.8 2297 1747 B 32 LEU HG B 32 LEU HA 1.0 1.7 3.1 2298 1747 B 32 LEU HBx B 32 LEU HA 1.0 1.7 3.1 2299 1747 B 32 LEU HBy B 32 LEU HA 1.0 1.7 3.1 2300 1748 B 22 LEU HBy B 22 LEU HD1% 1.0 1.7 3.3 2301 1748 B 22 LEU HBy B 22 LEU HD2% 1.0 1.7 3.3 2302 1749 B 53 TRP HZ2 B 53 TRP HH2 1.0 1.7 3.3 2303 1750 B 40 MET HE% B 40 MET HGy 1.0 1.6 3.0 2304 1750 B 40 MET HBy B 40 MET HGy 1.0 1.6 3.0 2305 1751 B 53 TRP HZ2 B 50 ILE HB 1.0 2.0 5.6 2306 1752 B 26 LEU HD2% B 23 TRP HZ2 1.0 2.0 6.0 2307 1752 B 26 LEU HD1% B 23 TRP HZ2 1.0 2.0 6.0 2308 1753 B 23 TRP HBy B 23 TRP HD1 1.0 1.7 3.5 2309 1753 B 23 TRP HBx B 23 TRP HD1 1.0 1.7 3.5 2310 1754 B 23 TRP HBy B 20 SER HA 1.0 2.0 6.0 2311 1755 B 47 PRO HA B 50 ILE HG1y 1.0 2.0 5.6 2312 1756 B 24 LYS HD3 B 24 LYS HG2 1.0 1.6 2.6 2313 1756 B 24 LYS HD3 B 24 LYS HG3 1.0 1.6 2.6 2314 1756 B 24 LYS HD2 B 24 LYS HG2 1.0 1.6 2.6 2315 1756 B 24 LYS HBx B 24 LYS HG3 1.0 1.6 2.6 2316 1756 B 24 LYS HBx B 24 LYS HG2 1.0 1.6 2.6 2317 1757 B 43 LEU HBy B 43 LEU HA 1.0 1.7 3.1 2318 1758 B 50 ILE HD1% B 53 TRP HE3 1.0 2.0 6.0 2319 1758 B 50 ILE HD1% B 53 TRP HZ2 1.0 2.0 6.0 2320 1759 B 40 MET H B 40 MET HBx 1.0 1.9 4.5 2321 1760 B 54 PHE HD% B 54 PHE HBx 1.0 1.8 3.4 2322 1761 B 28 GLU HA B 28 GLU HGx 1.0 1.8 3.8 2323 1761 B 28 GLU HA B 28 GLU HGy 1.0 1.8 3.8 2324 1762 A 12 MET HE% B 44 MET HGx 1.0 2.0 6.0 2325 1763 B 50 ILE HA B 51 GLU HBx 1.0 0.0 6.0 2326 1764 B 33 SER H B 33 SER HBx 1.0 2.0 5.2 2327 1765 B 36 PRO HDx B 35 LEU HA 1.0 1.4 2.2 2328 1766 B 24 LYS H B 24 LYS HBx 1.0 1.7 3.5 2329 1767 B 52 GLN HGy B 52 GLN HBx 1.0 1.5 2.5 2330 1767 B 52 GLN HGx B 52 GLN HBy 1.0 1.5 2.5 2331 1767 B 52 GLN HGx B 52 GLN HBx 1.0 1.5 2.5 2332 1767 B 52 GLN HGy B 52 GLN HBy 1.0 1.5 2.5 2333 1768 B 24 LYS HG2 B 23 TRP HD1 1.0 2.0 6.0 2334 1768 B 24 LYS HG3 B 23 TRP HD1 1.0 2.0 6.0 2335 1769 B 50 ILE HA B 50 ILE HG1x 1.0 2.0 5.0 2336 1770 B 22 LEU H B 21 ASP HBx 1.0 1.9 4.3 2337 1771 B 54 PHE HBy B 54 PHE HA 1.0 2.0 4.6 2338 1772 B 50 ILE HD1% B 50 ILE HG1y 1.0 1.5 2.7 2339 1773 B 36 PRO HDx B 35 LEU HD2% 1.0 1.8 3.6 2340 1773 B 36 PRO HDx B 35 LEU HD1% 1.0 1.8 3.6 2341 1774 B 28 GLU H B 28 GLU HGx 1.0 2.0 5.2 2342 1774 B 28 GLU H B 28 GLU HGy 1.0 2.0 5.2 2343 1775 B 59 GLY HAy B 60 PRO HG2 1.0 2.0 6.0 2344 1775 B 59 GLY HAy B 60 PRO HG3 1.0 2.0 6.0 2345 1776 B 51 GLU HA B 51 GLU HG3 1.0 1.8 3.8 2346 1776 B 51 GLU HA B 51 GLU HG2 1.0 1.8 3.8 2347 1777 B 24 LYS HA B 24 LYS HBx 1.0 1.8 3.8 2348 1778 B 50 ILE HG2% B 51 GLU HA 1.0 2.0 5.4 2349 1778 B 50 ILE HD1% B 51 GLU HA 1.0 2.0 5.4 2350 1779 B 52 GLN HBy B 52 GLN HA 1.0 1.8 3.6 2351 1780 B 25 LEU HG B 25 LEU HA 1.0 1.7 2.9 2352 1780 B 25 LEU HBx B 25 LEU HA 1.0 1.7 2.9 2353 1780 B 25 LEU HBy B 25 LEU HA 1.0 1.7 2.9 2354 1781 B 53 TRP HD1 B 53 TRP HB2 1.0 1.9 4.5 2355 1781 B 53 TRP HD1 B 53 TRP HB3 1.0 1.9 4.5 2356 1782 B 38 GLN HE22 B 38 GLN HG3 1.0 2.0 6.0 2357 1782 B 38 GLN HE22 B 38 GLN HG2 1.0 2.0 6.0 2358 1783 B 47 PRO HA B 50 ILE HG2% 1.0 2.0 6.0 2359 1784 B 22 LEU HBy B 22 LEU HG 1.0 1.2 2.2 2360 1784 B 22 LEU HBy B 22 LEU HBx 1.0 1.2 2.2 2361 1785 B 22 LEU HD1% B 19 PHE HD% 1.0 1.8 4.2 2362 1786 B 24 LYS HBx B 24 LYS HG2 1.0 1.7 3.3 2363 1786 B 24 LYS HBx B 24 LYS HG3 1.0 1.7 3.3 2364 1787 B 45 LEU HD1% A 23 ARG HDx 1.0 1.8 3.6 2365 1788 B 50 ILE HA B 50 ILE HG1y 1.0 2.0 4.6 2366 1789 B 14 LEU HA B 14 LEU HBx 1.0 1.6 3.0 2367 1789 B 14 LEU HA B 14 LEU HBy 1.0 1.6 3.0 2368 1790 B 54 PHE HD% B 51 GLU HA 1.0 0.0 6.0 2369 1791 B 39 ALA HB% B 40 MET HGx 1.0 1.9 6.0 2370 1792 B 24 LYS HD2 B 21 ASP HBx 1.0 1.9 4.9 2371 1793 B 22 LEU HBx B 19 PHE HD% 1.0 2.0 6.0 2372 1794 B 26 LEU H B 27 PRO HDx 1.0 2.0 6.0 2373 1795 B 24 LYS HG2 B 21 ASP HA 1.0 1.9 4.3 2374 1795 B 24 LYS HG3 B 21 ASP HA 1.0 1.9 4.3 2375 1796 B 45 LEU HD2% B 45 LEU H 1.0 1.9 5.1 2376 1797 B 54 PHE HD% B 50 ILE HA 1.0 2.0 6.0 2377 1798 B 49 ASP H B 48 ASP HA 1.0 1.8 3.6 2378 1799 B 50 ILE H B 50 ILE HG1x 1.0 1.8 3.6 2379 1800 B 31 VAL HA B 32 LEU H 1.0 1.7 3.1 2380 1801 A 70 TYR HA A 71 GLU H 1.0 1.9 4.5 2381 1801 A 70 TYR HA A 74 MET H 1.0 1.9 4.5 2382 1801 A 73 GLU HA A 74 MET H 1.0 1.9 4.5 2383 1802 A 48 TRP H A 50 THR H 1.0 2.0 5.8 2384 1802 A 18 PHE HE% A 48 TRP H 1.0 2.0 5.8 2385 1803 A 6 LYS H A 6 LYS HA 1.0 1.8 3.4 2386 1803 A 2 LYS HA A 2 LYS H 1.0 1.8 3.4 2387 1804 A 24 GLU HBy A 25 GLU H 1.0 1.8 3.6 2388 1804 A 25 GLU HGx A 25 GLU H 1.0 1.8 3.6 2389 1804 A 24 GLU HGx A 25 GLU H 1.0 1.8 3.6 2390 1805 A 43 LYS HA A 43 LYS H 1.0 1.7 3.3 2391 1805 A 40 PHE HA A 43 LYS H 1.0 1.7 3.3 2392 1805 A 42 LYS HA A 43 LYS H 1.0 1.7 3.3 2393 1806 A 24 GLU HBx A 25 GLU H 1.0 1.7 3.3 2394 1806 A 25 GLU HBy A 25 GLU H 1.0 1.7 3.3 2395 1807 A 14 SER H A 13 SER HBx 1.0 1.9 4.1 2396 1807 A 14 SER H A 14 SER HBx 1.0 1.9 4.1 2397 1808 A 15 TYR H A 13 SER HBx 1.0 1.9 4.7 2398 1808 A 15 TYR H A 14 SER HBx 1.0 1.9 4.7 2399 1808 A 15 TYR H A 14 SER HBy 1.0 1.9 4.7 2400 1809 A 67 LYS HG2 A 67 LYS H 1.0 2.0 4.8 2401 1809 A 68 ALA HB% A 67 LYS H 1.0 2.0 4.8 2402 1809 A 67 LYS HG3 A 67 LYS H 1.0 2.0 4.8 2403 1810 A 60 GLU HBy A 60 GLU H 1.0 1.7 3.3 2404 1810 A 81 LYS H A 80 PRO HBx 1.0 1.7 3.3 2405 1811 A 41 SER H A 43 LYS H 1.0 2.0 5.4 2406 1811 A 41 SER H A 39 GLU H 1.0 2.0 5.4 2407 1812 A 25 GLU HBy A 28 LYS H 1.0 0.0 6.0 2408 1812 A 24 GLU HBx A 28 LYS H 1.0 0.0 6.0 2409 1813 A 66 ASP HA A 66 ASP H 1.0 1.9 4.7 2410 1813 A 6 LYS H A 4 ASP HA 1.0 1.9 4.7 2411 1814 A 53 ALA H A 54 LYS HA 1.0 2.0 5.0 2412 1814 A 53 ALA H A 52 SER HBy 1.0 2.0 5.0 2413 1814 A 22 CYS HA A 23 ARG H 1.0 2.0 5.0 2414 1815 A 64 LYS HA A 63 ALA H 1.0 2.0 5.2 2415 1815 A 14 SER HBy A 63 ALA H 1.0 2.0 5.2 2416 1815 A 14 SER HBx A 63 ALA H 1.0 2.0 5.2 2417 1816 A 46 GLU HBx A 47 ARG H 1.0 1.7 3.1 2418 1816 A 46 GLU HBy A 47 ARG H 1.0 1.7 3.1 2419 1816 A 47 ARG HBx A 47 ARG H 1.0 1.7 3.1 2420 1817 A 56 LYS H A 55 GLU HA 1.0 1.8 3.8 2421 1817 A 56 LYS H A 56 LYS HA 1.0 1.8 3.8 2422 1818 A 18 PHE HBx A 19 VAL H 1.0 2.0 6.0 2423 1818 A 20 GLN HB2 A 19 VAL H 1.0 2.0 6.0 2424 1818 A 20 GLN HB3 A 19 VAL H 1.0 2.0 6.0 2425 1819 A 46 GLU H A 49 LYS H 1.0 2.0 5.4 2426 1819 A 47 ARG H A 49 LYS H 1.0 2.0 5.4 2427 1820 A 55 GLU H A 53 ALA HB% 1.0 2.0 5.2 2428 1820 A 55 GLU H A 54 LYS HG2 1.0 2.0 5.2 2429 1820 A 55 GLU H A 54 LYS HG3 1.0 2.0 5.2 2430 1821 A 43 LYS HBy A 43 LYS H 1.0 1.7 3.1 2431 1821 A 42 LYS HBy A 43 LYS H 1.0 1.7 3.1 2432 1821 A 43 LYS HBx A 43 LYS H 1.0 1.7 3.1 2433 1822 A 46 GLU HGy A 46 GLU H 1.0 1.9 3.9 2434 1822 A 69 ARG HBy A 69 ARG H 1.0 1.9 3.9 2435 1823 A 63 ALA HA A 64 LYS H 1.0 1.9 4.1 2436 1823 A 61 ASP HA A 64 LYS H 1.0 1.9 4.1 2437 1824 A 76 THR H A 75 LYS H 1.0 1.6 2.8 2438 1824 A 77 TYR H A 76 THR H 1.0 1.6 2.8 2439 1825 A 28 LYS HGy A 28 LYS H 1.0 1.8 4.0 2440 1825 A 27 LYS HG2 A 28 LYS H 1.0 1.8 4.0 2441 1825 A 27 LYS HG3 A 28 LYS H 1.0 1.8 4.0 2442 1826 A 74 MET HA A 75 LYS H 1.0 1.9 4.5 2443 1826 A 76 THR HA A 75 LYS H 1.0 1.9 4.5 2444 1827 A 28 LYS HE2 A 28 LYS H 1.0 2.0 6.0 2445 1827 A 29 LYS HE2 A 28 LYS H 1.0 2.0 6.0 2446 1827 A 28 LYS HE3 A 28 LYS H 1.0 2.0 6.0 2447 1828 A 21 THR HG2% A 24 GLU H 1.0 2.0 5.2 2448 1828 A 27 LYS HG2 A 24 GLU H 1.0 2.0 5.2 2449 1828 A 27 LYS HG3 A 24 GLU H 1.0 2.0 5.2 2450 1829 A 39 GLU H A 40 PHE H 1.0 1.8 3.4 2451 1829 A 39 GLU H A 38 SER H 1.0 1.8 3.4 2452 1830 A 72 ARG HB3 A 72 ARG H 1.0 1.5 2.7 2453 1830 A 71 GLU HBx A 72 ARG H 1.0 1.5 2.7 2454 1830 A 72 ARG HB2 A 72 ARG H 1.0 1.5 2.7 2455 1831 B 45 LEU HD1% A 20 GLN H 1.0 2.0 4.6 2456 1831 A 19 VAL HGx% A 20 GLN H 1.0 2.0 4.6 2457 1832 A 50 THR HA A 49 LYS H 1.0 1.9 4.9 2458 1832 A 48 TRP HA A 49 LYS H 1.0 1.9 4.9 2459 1833 A 64 LYS HA A 64 LYS H 1.0 1.8 3.6 2460 1833 A 69 ARG HA A 70 TYR H 1.0 1.8 3.6 2461 1834 A 51 MET H A 48 TRP HA 1.0 1.8 3.8 2462 1834 A 51 MET H A 50 THR HA 1.0 1.8 3.8 2463 1835 A 41 SER H A 43 LYS H 1.0 2.0 5.6 2464 1835 A 40 PHE H A 43 LYS H 1.0 2.0 5.6 2465 1836 A 44 CYS HA A 47 ARG H 1.0 1.8 3.6 2466 1836 A 47 ARG HA A 47 ARG H 1.0 1.8 3.6 2467 1836 A 46 GLU HA A 47 ARG H 1.0 1.8 3.6 2468 1837 A 47 ARG HA A 50 THR H 1.0 2.0 4.8 2469 1837 A 51 MET HA A 50 THR H 1.0 2.0 4.8 2470 1838 A 9 ARG H A 8 PRO HGx 1.0 1.9 4.9 2471 1838 A 9 ARG H A 9 ARG HGy 1.0 1.9 4.9 2472 1839 A 16 ALA H A 14 SER HBx 1.0 2.0 5.4 2473 1839 A 17 PHE HA A 16 ALA H 1.0 2.0 5.4 2474 1839 A 16 ALA H A 13 SER HBx 1.0 2.0 5.4 2475 1840 A 28 LYS HBy A 25 GLU H 1.0 2.0 5.8 2476 1840 A 27 LYS HB3 A 25 GLU H 1.0 2.0 5.8 2477 1840 A 27 LYS HB2 A 25 GLU H 1.0 2.0 5.8 2478 1841 A 61 ASP HBy A 61 ASP H 1.0 1.8 3.6 2479 1841 A 40 PHE HBx A 40 PHE H 1.0 1.8 3.6 2480 1842 A 65 ALA H A 66 ASP H 1.0 1.7 3.1 2481 1842 A 6 LYS H A 7 LYS H 1.0 1.7 3.1 2482 1843 A 43 LYS HBx A 45 SER H 1.0 0.0 6.0 2483 1843 A 43 LYS HBy A 45 SER H 1.0 0.0 6.0 2484 1843 A 19 VAL HB A 45 SER H 1.0 0.0 6.0 2485 1844 A 63 ALA HB% A 64 LYS H 1.0 1.8 3.4 2486 1844 A 64 LYS HGx A 64 LYS H 1.0 1.8 3.4 2487 1845 A 45 SER H A 46 GLU H 1.0 1.7 3.5 2488 1845 A 44 CYS H A 45 SER H 1.0 1.7 3.5 2489 1846 A 33 ALA H A 32 ASP HBx 1.0 2.0 4.6 2490 1846 A 33 ALA H A 30 HIS HBx 1.0 2.0 4.6 2491 1847 A 58 LYS HA A 58 LYS H 1.0 1.7 3.3 2492 1847 A 57 GLY HAy A 58 LYS H 1.0 1.7 3.3 2493 1848 A 44 CYS HA A 48 TRP H 1.0 2.0 5.4 2494 1848 A 49 LYS HA A 48 TRP H 1.0 2.0 5.4 2495 1848 A 46 GLU HA A 48 TRP H 1.0 2.0 5.4 2496 1849 A 74 MET HGx A 74 MET H 1.0 1.8 3.8 2497 1849 A 75 LYS HB2 A 74 MET H 1.0 1.8 3.8 2498 1849 A 74 MET HE% A 74 MET H 1.0 1.8 3.8 2499 1850 A 20 GLN HE21 B 45 LEU HBx 1.0 2.0 6.0 2500 1850 A 20 GLN HE21 A 12 MET HBx 1.0 2.0 6.0 2501 1851 A 12 MET H A 11 LYS HB2 1.0 1.8 3.6 2502 1851 A 12 MET H A 12 MET HBx 1.0 1.8 3.6 2503 1851 A 12 MET H A 11 LYS HB3 1.0 1.8 3.6 2504 1852 A 64 LYS H A 65 ALA H 1.0 1.7 3.3 2505 1852 A 63 ALA H A 64 LYS H 1.0 1.7 3.3 2506 1853 A 24 GLU HGy A 25 GLU H 1.0 1.9 5.1 2507 1853 A 25 GLU HGy A 25 GLU H 1.0 1.9 5.1 2508 1854 A 46 GLU HA A 49 LYS H 1.0 1.8 3.4 2509 1854 A 49 LYS HA A 49 LYS H 1.0 1.8 3.4 2510 1855 A 14 SER HBx A 18 PHE H 1.0 1.9 4.9 2511 1855 A 59 PHE HBy A 18 PHE H 1.0 1.9 4.9 2512 1855 A 17 PHE HA A 18 PHE H 1.0 1.9 4.9 2513 1856 A 63 ALA HA A 63 ALA H 1.0 1.8 3.8 2514 1856 A 60 GLU HA A 63 ALA H 1.0 1.8 3.8 2515 1857 A 55 GLU H A 57 GLY H 1.0 2.0 5.4 2516 1857 A 55 GLU H A 58 LYS H 1.0 2.0 5.4 2517 1858 A 45 SER HBy A 46 GLU H 1.0 1.7 3.1 2518 1858 A 69 ARG HA A 69 ARG H 1.0 1.7 3.1 2519 1858 A 46 GLU HA A 46 GLU H 1.0 1.7 3.1 2520 1858 A 45 SER HBx A 46 GLU H 1.0 1.7 3.1 2521 1859 A 61 ASP HBx A 60 GLU H 1.0 2.0 5.4 2522 1859 A 60 GLU HGy A 60 GLU H 1.0 2.0 5.4 2523 1859 A 60 GLU HGx A 60 GLU H 1.0 2.0 5.4 2524 1860 A 16 ALA HB% A 20 GLN H 1.0 1.9 4.1 2525 1860 A 13 SER H A 16 ALA HB% 1.0 1.9 4.1 2526 1861 A 49 LYS HBy A 48 TRP H 1.0 2.0 6.0 2527 1861 A 49 LYS HBx A 48 TRP H 1.0 2.0 6.0 2528 1861 A 47 ARG HGy A 48 TRP H 1.0 2.0 6.0 2529 1862 A 24 GLU HBy A 23 ARG H 1.0 2.0 6.0 2530 1862 A 25 GLU HBx A 23 ARG H 1.0 2.0 6.0 2531 1862 A 20 GLN HG3 A 23 ARG H 1.0 2.0 6.0 2532 1863 A 42 LYS HGy A 43 LYS H 1.0 1.9 4.3 2533 1863 A 43 LYS HGy A 43 LYS H 1.0 1.9 4.3 2534 1864 A 81 LYS H A 83 GLU HB2 1.0 0.0 6.0 2535 1864 A 81 LYS H A 80 PRO HG2 1.0 0.0 6.0 2536 1864 A 81 LYS H A 80 PRO HG3 1.0 0.0 6.0 2537 1865 A 77 TYR H A 75 LYS HB2 1.0 2.0 5.2 2538 1865 A 77 TYR H A 74 MET HE% 1.0 2.0 5.2 2539 1866 A 55 GLU H A 52 SER HBy 1.0 1.8 3.4 2540 1866 A 55 GLU H A 54 LYS HA 1.0 1.8 3.4 2541 1866 A 55 GLU H A 55 GLU HA 1.0 1.8 3.4 2542 1867 A 58 LYS HA A 61 ASP H 1.0 1.8 4.0 2543 1867 A 40 PHE H A 39 GLU HA 1.0 1.8 4.0 2544 1867 A 40 PHE H A 40 PHE HA 1.0 1.8 4.0 2545 1868 A 29 LYS HA A 29 LYS H 1.0 1.8 3.4 2546 1868 A 28 LYS HA A 29 LYS H 1.0 1.8 3.4 2547 1869 A 48 TRP HE1 A 49 LYS HBy 1.0 2.0 6.0 2548 1869 A 48 TRP HE1 A 49 LYS HBx 1.0 2.0 6.0 2549 1869 A 48 TRP HE1 A 56 LYS HEy 1.0 2.0 6.0 2550 1870 A 47 ARG HBx A 47 ARG H 1.0 1.7 3.5 2551 1870 A 46 GLU HBy A 47 ARG H 1.0 1.7 3.5 2552 1870 A 47 ARG HBy A 47 ARG H 1.0 1.7 3.5 2553 1871 A 60 GLU HA A 60 GLU H 1.0 1.4 2.4 2554 1871 A 81 LYS H A 80 PRO HA 1.0 1.4 2.4 2555 1872 A 46 GLU HBx A 45 SER H 1.0 2.0 5.8 2556 1872 A 47 ARG HBx A 45 SER H 1.0 2.0 5.8 2557 1873 A 12 MET HE% A 20 GLN H 1.0 2.0 6.0 2558 1873 A 13 SER H A 12 MET HE% 1.0 2.0 6.0 2559 1874 A 22 CYS HA A 22 CYS H 1.0 1.9 3.9 2560 1874 A 21 THR HA A 22 CYS H 1.0 1.9 3.9 2561 1875 A 54 LYS H A 54 LYS HG3 1.0 1.9 4.5 2562 1875 A 54 LYS H A 54 LYS HG2 1.0 1.9 4.5 2563 1875 A 53 ALA HB% A 54 LYS H 1.0 1.9 4.5 2564 1876 A 27 LYS HB3 A 24 GLU H 1.0 2.0 4.6 2565 1876 A 23 ARG HBx A 24 GLU H 1.0 2.0 4.6 2566 1877 A 68 ALA HB% A 69 ARG H 1.0 1.8 3.6 2567 1877 A 69 ARG HGy A 69 ARG H 1.0 1.8 3.6 2568 1878 A 53 ALA H A 54 LYS HA 1.0 2.0 5.0 2569 1878 A 53 ALA H A 52 SER HBy 1.0 2.0 5.0 2570 1879 A 19 VAL H A 20 GLN H 1.0 1.8 3.8 2571 1879 A 18 PHE H A 19 VAL H 1.0 1.8 3.8 2572 1880 A 72 ARG HB3 A 73 GLU H 1.0 1.7 3.5 2573 1880 A 74 MET HGx A 73 GLU H 1.0 1.7 3.5 2574 1880 A 72 ARG HB2 A 73 GLU H 1.0 1.7 3.5 2575 1881 A 25 GLU HA A 25 GLU H 1.0 1.8 3.6 2576 1881 A 24 GLU HA A 25 GLU H 1.0 1.8 3.6 2577 1882 A 6 LYS H A 7 LYS HE3 1.0 2.0 6.0 2578 1882 A 6 LYS H A 6 LYS HE3 1.0 2.0 6.0 2579 1882 A 6 LYS H A 6 LYS HE2 1.0 2.0 6.0 2580 1883 A 36 ASN HD21 A 40 PHE HA 1.0 2.0 5.4 2581 1883 A 36 ASN HD21 A 37 PHE HA 1.0 2.0 5.4 2582 1883 A 36 ASN HD21 A 35 VAL HA 1.0 2.0 5.4 2583 1884 A 64 LYS HB3 A 64 LYS H 1.0 1.7 3.1 2584 1884 A 69 ARG HBx A 70 TYR H 1.0 1.7 3.1 2585 1884 A 64 LYS HB2 A 64 LYS H 1.0 1.7 3.1 2586 1885 A 21 THR H A 22 CYS H 1.0 1.7 3.5 2587 1885 A 66 ASP H A 67 LYS H 1.0 1.7 3.5 2588 1886 A 34 SER H A 26 HIS HE1 1.0 2.0 6.0 2589 1886 A 33 ALA H A 34 SER H 1.0 2.0 6.0 2590 1887 A 61 ASP HA A 62 MET H 1.0 1.8 4.2 2591 1887 A 59 PHE HA A 62 MET H 1.0 1.8 4.2 2592 1888 A 69 ARG HA A 68 ALA H 1.0 1.9 4.9 2593 1888 A 67 LYS HA A 68 ALA H 1.0 1.9 4.9 2594 1889 A 36 ASN HD22 A 40 PHE HA 1.0 0.0 6.0 2595 1889 A 36 ASN HD22 A 37 PHE HA 1.0 0.0 6.0 2596 1889 A 36 ASN HD22 A 35 VAL HA 1.0 0.0 6.0 2597 1890 A 40 PHE H A 39 GLU HA 1.0 1.7 3.3 2598 1890 A 40 PHE H A 40 PHE HA 1.0 1.7 3.3 2599 1891 A 2 LYS HB2 A 2 LYS H 1.0 1.6 3.0 2600 1891 A 6 LYS H A 6 LYS HBy 1.0 1.6 3.0 2601 1891 A 2 LYS HB3 A 2 LYS H 1.0 1.6 3.0 2602 1891 A 6 LYS H A 6 LYS HBx 1.0 1.6 3.0 2603 1892 A 36 ASN HBy A 40 PHE H 1.0 1.8 3.6 2604 1892 A 40 PHE H A 40 PHE HBy 1.0 1.8 3.6 2605 1893 A 30 HIS H A 27 LYS HA 1.0 1.8 3.6 2606 1893 A 30 HIS H A 29 LYS HA 1.0 1.8 3.6 2607 1894 A 65 ALA HA A 67 LYS H 1.0 2.0 5.6 2608 1894 A 68 ALA HA A 67 LYS H 1.0 2.0 5.6 2609 1895 A 65 ALA HB% A 64 LYS H 1.0 1.8 3.8 2610 1895 A 64 LYS HGy A 64 LYS H 1.0 1.8 3.8 2611 1896 A 41 SER H A 37 PHE HA 1.0 1.9 3.9 2612 1896 A 41 SER H A 40 PHE HA 1.0 1.9 3.9 2613 1896 A 41 SER H A 42 LYS HA 1.0 1.9 3.9 2614 1897 A 40 PHE H A 41 SER HBx 1.0 2.0 6.0 2615 1897 A 62 MET HA A 61 ASP H 1.0 2.0 6.0 2616 1897 A 41 SER HA A 40 PHE H 1.0 2.0 6.0 2617 1898 A 17 PHE HA A 20 GLN H 1.0 1.9 4.5 2618 1898 A 13 SER H A 13 SER HBx 1.0 1.9 4.5 2619 1899 A 62 MET HGx A 62 MET H 1.0 1.9 4.1 2620 1899 A 61 ASP HBx A 62 MET H 1.0 1.9 4.1 2621 1900 A 47 ARG HDy A 47 ARG H 1.0 2.0 6.0 2622 1900 A 48 TRP HBy A 47 ARG H 1.0 2.0 6.0 2623 1900 A 48 TRP HBx A 47 ARG H 1.0 2.0 6.0 2624 1901 A 45 SER HBy A 44 CYS H 1.0 1.8 3.6 2625 1901 A 43 LYS HA A 44 CYS H 1.0 1.8 3.6 2626 1901 A 44 CYS HA A 44 CYS H 1.0 1.8 3.6 2627 1902 A 60 GLU HBy A 61 ASP H 1.0 1.9 4.3 2628 1902 A 40 PHE H A 39 GLU HGy 1.0 1.9 4.3 2629 1903 A 32 ASP H A 33 ALA HA 1.0 1.8 3.6 2630 1903 A 32 ASP H A 31 PRO HA 1.0 1.8 3.6 2631 1904 A 69 ARG H A 71 GLU H 1.0 1.8 4.0 2632 1904 A 45 SER H A 46 GLU H 1.0 1.8 4.0 2633 1905 A 61 ASP HBx A 60 GLU H 1.0 2.0 5.8 2634 1905 A 60 GLU HGx A 60 GLU H 1.0 2.0 5.8 2635 1906 A 59 PHE HBy A 60 GLU H 1.0 1.9 4.7 2636 1906 A 56 LYS HA A 60 GLU H 1.0 1.9 4.7 2637 1906 A 58 LYS HA A 60 GLU H 1.0 1.9 4.7 2638 1907 A 56 LYS H A 56 LYS HBy 1.0 2.0 4.4 2639 1907 A 56 LYS H A 51 MET HE% 1.0 2.0 4.4 2640 1908 A 6 LYS H A 6 LYS HD2 1.0 2.0 5.4 2641 1908 A 6 LYS H A 6 LYS HD3 1.0 2.0 5.4 2642 1908 A 2 LYS H A 2 LYS HDy 1.0 2.0 5.4 2643 1908 A 6 LYS H A 7 LYS HBy 1.0 2.0 5.4 2644 1909 A 54 LYS H A 52 SER HBy 1.0 1.9 4.3 2645 1909 A 54 LYS H A 54 LYS HA 1.0 1.9 4.3 2646 1910 A 28 LYS HA A 28 LYS H 1.0 1.7 3.1 2647 1910 A 27 LYS HA A 28 LYS H 1.0 1.7 3.1 2648 1911 A 61 ASP HBy A 58 LYS H 1.0 1.9 6.0 2649 1911 A 58 LYS HEx A 58 LYS H 1.0 1.9 6.0 2650 1912 A 28 LYS HBy A 28 LYS H 1.0 1.6 2.8 2651 1912 A 27 LYS HB3 A 28 LYS H 1.0 1.6 2.8 2652 1912 A 27 LYS HB2 A 28 LYS H 1.0 1.6 2.8 2653 1913 A 33 ALA H A 32 ASP HBy 1.0 1.9 4.5 2654 1913 A 33 ALA H A 30 HIS HBy 1.0 1.9 4.5 2655 1914 A 51 MET HBy A 50 THR H 1.0 2.0 5.8 2656 1914 A 49 LYS HGx A 50 THR H 1.0 2.0 5.8 2657 1915 A 25 GLU H A 28 LYS H 1.0 2.0 5.4 2658 1915 A 26 HIS H A 28 LYS H 1.0 2.0 5.4 2659 1916 A 75 LYS HGy A 71 GLU H 1.0 1.9 4.1 2660 1916 A 67 LYS HG3 A 71 GLU H 1.0 1.9 4.1 2661 1916 A 67 LYS HG2 A 71 GLU H 1.0 1.9 4.1 2662 1916 A 68 ALA HB% A 71 GLU H 1.0 1.9 4.1 2663 1917 A 21 THR HG2% A 20 GLN H 1.0 2.0 5.6 2664 1917 A 13 SER H A 12 MET HBx 1.0 2.0 5.6 2665 1918 A 48 TRP HE1 A 56 LYS HA 1.0 2.0 6.0 2666 1918 A 49 LYS HA A 48 TRP HE1 1.0 2.0 6.0 2667 1919 A 72 ARG H A 73 GLU H 1.0 1.7 3.1 2668 1919 A 71 GLU H A 72 ARG H 1.0 1.7 3.1 2669 1920 A 59 PHE HBy A 59 PHE H 1.0 1.9 4.5 2670 1920 A 56 LYS HA A 59 PHE H 1.0 1.9 4.5 2671 1920 A 58 LYS HA A 59 PHE H 1.0 1.9 4.5 2672 1921 A 39 GLU HA A 42 LYS H 1.0 1.8 3.4 2673 1921 A 40 PHE HA A 42 LYS H 1.0 1.8 3.4 2674 1921 A 42 LYS HA A 42 LYS H 1.0 1.8 3.4 2675 1922 A 27 LYS HG3 A 26 HIS H 1.0 2.0 5.8 2676 1922 A 29 LYS HBy A 26 HIS H 1.0 2.0 5.8 2677 1922 A 28 LYS HGy A 25 GLU H 1.0 2.0 5.8 2678 1922 A 27 LYS HG2 A 25 GLU H 1.0 2.0 5.8 2679 1922 A 27 LYS HG2 A 26 HIS H 1.0 2.0 5.8 2680 1922 A 28 LYS HGy A 26 HIS H 1.0 2.0 5.8 2681 1923 A 67 LYS HD3 A 69 ARG H 1.0 2.0 5.2 2682 1923 A 67 LYS HD2 A 69 ARG H 1.0 2.0 5.2 2683 1923 A 72 ARG HGx A 69 ARG H 1.0 2.0 5.2 2684 1924 A 57 GLY H A 60 GLU H 1.0 2.0 5.2 2685 1924 A 58 LYS H A 60 GLU H 1.0 2.0 5.2 2686 1925 A 17 PHE HA A 21 THR H 1.0 1.8 3.8 2687 1925 A 21 THR HA A 21 THR H 1.0 1.8 3.8 2688 1926 A 61 ASP HA A 61 ASP H 1.0 1.8 3.6 2689 1926 A 60 GLU HA A 61 ASP H 1.0 1.8 3.6 2690 1927 A 55 GLU H A 56 LYS HBy 1.0 1.9 4.7 2691 1927 A 55 GLU H A 54 LYS HD2 1.0 1.9 4.7 2692 1927 A 55 GLU H A 51 MET HE% 1.0 1.9 4.7 2693 1928 A 34 SER H A 34 SER HA 1.0 1.7 3.1 2694 1928 A 34 SER H A 33 ALA HA 1.0 1.7 3.1 2695 1929 A 15 TYR H A 17 PHE H 1.0 1.9 4.5 2696 1929 A 17 PHE H A 16 ALA H 1.0 1.9 4.5 2697 1930 A 72 ARG HGy A 72 ARG H 1.0 1.9 4.3 2698 1930 A 73 GLU HBy A 72 ARG H 1.0 1.9 4.3 2699 1931 A 42 LYS HGx A 42 LYS H 1.0 2.0 5.8 2700 1931 A 43 LYS HGx A 42 LYS H 1.0 2.0 5.8 2701 1932 A 2 LYS HGx A 2 LYS H 1.0 1.8 3.6 2702 1932 A 2 LYS HGy A 2 LYS H 1.0 1.8 3.6 2703 1932 A 6 LYS H A 6 LYS HG2 1.0 1.8 3.6 2704 1932 A 6 LYS H A 6 LYS HG3 1.0 1.8 3.6 2705 1933 A 57 GLY HAx A 56 LYS H 1.0 1.9 4.9 2706 1933 A 56 LYS H A 53 ALA HA 1.0 1.9 4.9 2707 1934 A 10 GLY H A 8 PRO HGx 1.0 2.0 5.4 2708 1934 A 10 GLY H A 9 ARG HGy 1.0 2.0 5.4 2709 1935 A 9 ARG HDx A 9 ARG HB3 1.0 1.6 3.0 2710 1935 A 67 LYS HD2 A 67 LYS HE2 1.0 1.6 3.0 2711 1935 A 67 LYS HD3 A 67 LYS HE3 1.0 1.6 3.0 2712 1935 A 67 LYS HD3 A 67 LYS HE2 1.0 1.6 3.0 2713 1935 A 67 LYS HD2 A 67 LYS HE3 1.0 1.6 3.0 2714 1936 A 33 ALA HB% A 27 LYS H 1.0 0.0 6.0 2715 1936 A 33 ALA HB% A 30 HIS H 1.0 0.0 6.0 2716 1937 A 25 GLU HBy A 25 GLU H 1.0 1.7 3.1 2717 1937 A 25 GLU HBy A 26 HIS H 1.0 1.7 3.1 2718 1938 A 67 LYS HA A 68 ALA HB% 1.0 2.0 5.0 2719 1938 A 68 ALA HB% A 69 ARG HA 1.0 2.0 5.0 2720 1939 A 7 LYS HBy A 77 TYR HD% 1.0 1.9 4.1 2721 1939 A 77 TYR HD% A 8 PRO HGx 1.0 1.9 4.1 2722 1939 A 78 ILE HB A 77 TYR HD% 1.0 1.9 4.1 2723 1940 A 80 PRO HBy A 80 PRO HG3 1.0 1.4 2.2 2724 1940 A 80 PRO HBy A 80 PRO HG2 1.0 1.4 2.2 2725 1940 A 79 PRO HBy A 79 PRO HGy 1.0 1.4 2.2 2726 1941 A 61 ASP HBx A 63 ALA HB% 1.0 1.9 6.0 2727 1941 A 61 ASP HBx A 62 MET HBx 1.0 1.9 6.0 2728 1941 A 61 ASP HBx A 64 LYS HD2 1.0 1.9 6.0 2729 1941 A 61 ASP HBx A 64 LYS HD3 1.0 1.9 6.0 2730 1942 A 35 VAL HGx% A 37 PHE HD% 1.0 2.0 5.2 2731 1942 A 35 VAL HGx% B 54 PHE HD% 1.0 2.0 5.2 2732 1942 A 35 VAL HGx% B 54 PHE HZ 1.0 2.0 5.2 2733 1943 A 65 ALA HB% A 64 LYS H 1.0 2.0 5.8 2734 1943 A 68 ALA HB% A 70 TYR H 1.0 2.0 5.8 2735 1944 A 50 THR HA A 51 MET HBx 1.0 1.8 4.0 2736 1944 A 14 SER HA A 63 ALA HB% 1.0 1.8 4.0 2737 1945 A 57 GLY HAy A 57 GLY H 1.0 1.8 3.6 2738 1945 A 57 GLY HAy A 58 LYS H 1.0 1.8 3.6 2739 1946 A 64 LYS HB2 A 61 ASP HA 1.0 1.7 3.1 2740 1946 A 64 LYS HB3 A 61 ASP HA 1.0 1.7 3.1 2741 1946 A 74 MET HA A 74 MET HGx 1.0 1.7 3.1 2742 1947 A 42 LYS HGx A 43 LYS H 1.0 1.7 3.3 2743 1947 A 43 LYS HGx A 43 LYS H 1.0 1.7 3.3 2744 1948 A 66 ASP HBx A 12 MET HE% 1.0 1.9 4.5 2745 1948 A 12 MET HE% B 54 PHE HBx 1.0 1.9 4.5 2746 1948 A 9 ARG HDx A 12 MET HE% 1.0 1.9 4.5 2747 1949 A 22 CYS HA A 25 GLU H 1.0 1.9 3.9 2748 1949 A 17 PHE H A 17 PHE HA 1.0 1.9 3.9 2749 1950 A 19 VAL HB A 18 PHE H 1.0 2.0 4.4 2750 1950 A 19 VAL HB A 20 GLN H 1.0 2.0 4.4 2751 1950 A 43 LYS HBy A 44 CYS H 1.0 2.0 4.4 2752 1951 A 70 TYR HBy A 70 TYR HA 1.0 1.8 4.2 2753 1951 A 37 PHE HA A 37 PHE HBx 1.0 1.8 4.2 2754 1952 A 20 GLN HA A 19 VAL HB 1.0 1.9 4.5 2755 1952 A 23 ARG HBy A 20 GLN HA 1.0 1.9 4.5 2756 1953 A 15 TYR HE% A 44 CYS HA 1.0 2.0 5.8 2757 1953 A 15 TYR HE% A 45 SER HBx 1.0 2.0 5.8 2758 1953 A 49 LYS HA A 15 TYR HE% 1.0 2.0 5.8 2759 1953 A 15 TYR HE% A 45 SER HBy 1.0 2.0 5.8 2760 1954 A 66 ASP HBy A 11 LYS HA 1.0 2.0 5.4 2761 1954 A 70 TYR HBx A 11 LYS HA 1.0 2.0 5.4 2762 1955 A 41 SER H A 40 PHE HA 1.0 1.8 3.6 2763 1955 A 40 PHE H A 40 PHE HA 1.0 1.8 3.6 2764 1956 A 59 PHE HBx A 51 MET HE% 1.0 1.9 4.9 2765 1956 A 48 TRP HBx A 51 MET HE% 1.0 1.9 4.9 2766 1957 A 22 CYS HBx A 21 THR HA 1.0 2.0 6.0 2767 1957 A 24 GLU HGy A 21 THR HA 1.0 2.0 6.0 2768 1958 A 19 VAL HGx% A 42 LYS H 1.0 2.0 6.0 2769 1958 A 19 VAL HGx% B 53 TRP HE3 1.0 2.0 6.0 2770 1959 A 36 ASN HBx A 35 VAL HGy% 1.0 2.0 4.6 2771 1959 A 40 PHE HBx A 35 VAL HGy% 1.0 2.0 4.6 2772 1960 A 40 PHE HZ A 19 VAL HB 1.0 2.0 6.0 2773 1960 A 23 ARG HBy A 40 PHE HZ 1.0 2.0 6.0 2774 1961 A 47 ARG HGy A 47 ARG HA 1.0 1.6 2.8 2775 1961 A 75 LYS HB3 A 75 LYS HA 1.0 1.6 2.8 2776 1961 A 75 LYS HB2 A 75 LYS HA 1.0 1.6 2.8 2777 1962 A 66 ASP HBy A 69 ARG HBy 1.0 2.0 6.0 2778 1962 A 69 ARG HBy A 70 TYR HBy 1.0 2.0 6.0 2779 1963 A 56 LYS HEy A 55 GLU HA 1.0 0.0 6.0 2780 1963 A 52 SER HBy A 56 LYS HEy 1.0 0.0 6.0 2781 1963 A 56 LYS HEy A 56 LYS HA 1.0 0.0 6.0 2782 1964 A 56 LYS HGx A 51 MET HE% 1.0 1.8 3.8 2783 1964 A 56 LYS HGx A 56 LYS HBy 1.0 1.8 3.8 2784 1965 A 20 GLN HG2 A 21 THR HG2% 1.0 2.0 6.0 2785 1965 A 20 GLN HG3 B 45 LEU HBx 1.0 2.0 6.0 2786 1965 A 20 GLN HG3 B 45 LEU HG 1.0 2.0 6.0 2787 1965 A 20 GLN HG2 B 45 LEU HG 1.0 2.0 6.0 2788 1965 A 20 GLN HG3 A 21 THR HG2% 1.0 2.0 6.0 2789 1966 A 55 GLU HG2 A 51 MET HE% 1.0 2.0 4.4 2790 1966 A 55 GLU HG3 A 51 MET HE% 1.0 2.0 4.4 2791 1966 A 55 GLU HG2 A 54 LYS HB2 1.0 2.0 4.4 2792 1966 A 55 GLU HG2 A 54 LYS HB3 1.0 2.0 4.4 2793 1967 A 48 TRP HA A 50 THR H 1.0 2.0 5.4 2794 1967 A 48 TRP HA A 18 PHE HE% 1.0 2.0 5.4 2795 1968 A 59 PHE HD% A 18 PHE HD% 1.0 2.0 5.6 2796 1968 A 59 PHE HD% A 48 TRP HZ3 1.0 2.0 5.6 2797 1969 A 23 ARG HBy A 22 CYS HA 1.0 2.0 4.6 2798 1969 A 43 LYS HBy A 44 CYS HA 1.0 2.0 4.6 2799 1969 A 43 LYS HBx A 44 CYS HA 1.0 2.0 4.6 2800 1970 A 26 HIS HD2 A 29 LYS HA 1.0 2.0 5.8 2801 1970 A 27 LYS HA A 26 HIS HD2 1.0 2.0 5.8 2802 1971 A 28 LYS HBy A 25 GLU HGy 1.0 1.8 4.0 2803 1971 A 27 LYS HB3 A 24 GLU HGy 1.0 1.8 4.0 2804 1971 A 27 LYS HB2 A 24 GLU HGy 1.0 1.8 4.0 2805 1971 A 28 LYS HBy A 24 GLU HGy 1.0 1.8 4.0 2806 1972 A 62 MET HE% A 61 ASP H 1.0 0.0 6.0 2807 1972 A 62 MET HE% A 64 LYS H 1.0 0.0 6.0 2808 1973 A 23 ARG HA A 24 GLU H 1.0 2.0 4.8 2809 1973 A 23 ARG HA A 26 HIS H 1.0 2.0 4.8 2810 1974 A 7 LYS HA A 8 PRO HGx 1.0 1.9 4.3 2811 1974 A 8 PRO HGy A 7 LYS HA 1.0 1.9 4.3 2812 1974 A 7 LYS HBx A 7 LYS HA 1.0 1.9 4.3 2813 1975 A 58 LYS HA A 58 LYS HEx 1.0 2.0 5.0 2814 1975 A 67 LYS HA A 11 LYS HEx 1.0 2.0 5.0 2815 1975 A 11 LYS HA A 11 LYS HEx 1.0 2.0 5.0 2816 1976 A 29 LYS HBy A 25 GLU HGx 1.0 1.9 3.9 2817 1976 A 27 LYS HG2 A 24 GLU HGx 1.0 1.9 3.9 2818 1976 A 27 LYS HG3 A 24 GLU HGx 1.0 1.9 3.9 2819 1976 A 29 LYS HDy A 25 GLU HGx 1.0 1.9 3.9 2820 1976 A 28 LYS HGy A 24 GLU HGx 1.0 1.9 3.9 2821 1977 A 66 ASP HBy A 11 LYS HGy 1.0 2.0 6.0 2822 1977 A 66 ASP HBx A 11 LYS HGy 1.0 2.0 6.0 2823 1977 A 70 TYR HBy A 11 LYS HGy 1.0 2.0 6.0 2824 1978 A 7 LYS HGx A 8 PRO HDy 1.0 1.8 3.6 2825 1978 A 7 LYS HGx A 7 LYS HE2 1.0 1.8 3.6 2826 1978 A 7 LYS HGx A 7 LYS HE3 1.0 1.8 3.6 2827 1979 A 48 TRP HE3 A 49 LYS H 1.0 1.9 6.0 2828 1979 A 48 TRP HE3 A 59 PHE HE% 1.0 1.9 6.0 2829 1980 A 28 LYS HA A 28 LYS H 1.0 1.7 3.3 2830 1980 A 28 LYS HA A 29 LYS H 1.0 1.7 3.3 2831 1980 A 27 LYS HA A 28 LYS H 1.0 1.7 3.3 2832 1981 A 63 ALA HB% A 64 LYS HE3 1.0 2.0 6.0 2833 1981 A 66 ASP HBx A 63 ALA HB% 1.0 2.0 6.0 2834 1982 A 58 LYS HBy A 58 LYS HA 1.0 1.5 2.7 2835 1982 A 49 LYS HA A 49 LYS HGx 1.0 1.5 2.7 2836 1982 A 54 LYS HD3 A 54 LYS HA 1.0 1.5 2.7 2837 1982 A 49 LYS HA A 49 LYS HD3 1.0 1.5 2.7 2838 1982 A 58 LYS HBy A 55 GLU HA 1.0 1.5 2.7 2839 1982 A 49 LYS HGx A 46 GLU HA 1.0 1.5 2.7 2840 1982 A 49 LYS HA A 49 LYS HD2 1.0 1.5 2.7 2841 1982 A 54 LYS HD2 A 54 LYS HA 1.0 1.5 2.7 2842 1983 A 37 PHE HE% B 51 GLU HBx 1.0 2.0 5.8 2843 1983 A 37 PHE HE% B 47 PRO HG3 1.0 2.0 5.8 2844 1983 A 37 PHE HE% B 47 PRO HG2 1.0 2.0 5.8 2845 1983 A 37 PHE HE% B 44 MET HB2 1.0 2.0 5.8 2846 1984 A 23 ARG HBx A 21 THR HA 1.0 2.0 6.0 2847 1984 A 23 ARG HBx A 22 CYS HA 1.0 2.0 6.0 2848 1985 A 56 LYS HBy A 56 LYS HGy 1.0 1.9 4.5 2849 1985 A 51 MET HE% A 56 LYS HGy 1.0 1.9 4.5 2850 1986 A 12 MET HE% A 20 GLN H 1.0 1.9 4.5 2851 1986 A 17 PHE H A 12 MET HE% 1.0 1.9 4.5 2852 1986 A 13 SER H A 12 MET HE% 1.0 1.9 4.5 2853 1987 A 20 GLN HB2 A 12 MET HE% 1.0 1.7 3.1 2854 1987 A 12 MET HE% A 12 MET HGy 1.0 1.7 3.1 2855 1987 A 20 GLN HB3 A 12 MET HE% 1.0 1.7 3.1 2856 1988 A 75 LYS HGx A 74 MET HA 1.0 2.0 5.0 2857 1988 A 64 LYS HGx A 61 ASP HA 1.0 2.0 5.0 2858 1989 A 20 GLN HG2 A 21 THR HA 1.0 2.0 5.0 2859 1989 A 20 GLN HG2 A 17 PHE HA 1.0 2.0 5.0 2860 1989 A 20 GLN HG3 A 17 PHE HA 1.0 2.0 5.0 2861 1990 A 74 MET HBy A 74 MET HA 1.0 1.6 2.8 2862 1990 A 74 MET HBx A 74 MET HA 1.0 1.6 2.8 2863 1990 A 79 PRO HA A 79 PRO HBy 1.0 1.6 2.8 2864 1991 A 26 HIS HA A 27 LYS H 1.0 1.9 4.7 2865 1991 A 30 HIS H A 26 HIS HA 1.0 1.9 4.7 2866 1992 A 70 TYR HBy A 11 LYS HB2 1.0 1.9 4.3 2867 1992 A 37 PHE HBx B 45 LEU HBx 1.0 1.9 4.3 2868 1992 A 7 LYS HBx A 77 TYR HBx 1.0 1.9 4.3 2869 1992 A 70 TYR HBy A 8 PRO HGy 1.0 1.9 4.3 2870 1992 A 70 TYR HBy A 68 ALA HB% 1.0 1.9 4.3 2871 1992 A 70 TYR HBy A 11 LYS HB3 1.0 1.9 4.3 2872 1992 A 70 TYR HBy A 8 PRO HBy 1.0 1.9 4.3 2873 1992 A 8 PRO HGy A 77 TYR HBx 1.0 1.9 4.3 2874 1993 A 77 TYR HD% A 79 PRO HA 1.0 1.9 4.1 2875 1993 A 51 MET H A 50 THR HA 1.0 1.9 4.1 2876 1994 A 29 LYS HE2 A 29 LYS HDy 1.0 1.4 2.4 2877 1994 A 43 LYS HE2 A 43 LYS HDy 1.0 1.4 2.4 2878 1994 A 29 LYS HE3 A 29 LYS HDy 1.0 1.4 2.4 2879 1994 A 43 LYS HE3 A 43 LYS HDy 1.0 1.4 2.4 2880 1995 A 36 ASN HD21 A 38 SER HA 1.0 0.0 6.0 2881 1995 A 38 SER HA A 37 PHE HD% 1.0 0.0 6.0 2882 1996 A 48 TRP HZ2 A 48 TRP HZ3 1.0 2.0 5.8 2883 1996 A 59 PHE HD% A 48 TRP HZ3 1.0 2.0 5.8 2884 1997 A 52 SER HBx A 54 LYS HG2 1.0 2.0 6.0 2885 1997 A 53 ALA HB% A 52 SER HBx 1.0 2.0 6.0 2886 1998 A 71 GLU HBx A 72 ARG HA 1.0 1.9 4.1 2887 1998 A 20 GLN HB3 A 17 PHE HA 1.0 1.9 4.1 2888 1998 A 20 GLN HB2 A 17 PHE HA 1.0 1.9 4.1 2889 1999 A 19 VAL HB A 40 PHE HE% 1.0 2.0 5.6 2890 1999 A 23 ARG HBy A 40 PHE HE% 1.0 2.0 5.6 2891 2000 A 5 PRO HBx A 5 PRO HA 1.0 1.7 2.9 2892 2000 A 31 PRO HBx A 31 PRO HA 1.0 1.7 2.9 2893 2001 A 74 MET HA A 8 PRO HDy 1.0 1.9 4.5 2894 2001 A 77 TYR HBy A 74 MET HA 1.0 1.9 4.5 2895 2002 B 45 LEU HD1% A 21 THR HG2% 1.0 2.0 5.4 2896 2002 A 58 LYS HGx A 21 THR HG2% 1.0 2.0 5.4 2897 2003 A 64 LYS HB2 A 64 LYS HE3 1.0 2.0 4.4 2898 2003 A 75 LYS HB3 A 75 LYS HE2 1.0 2.0 4.4 2899 2003 A 28 LYS HE3 A 28 LYS HBx 1.0 2.0 4.4 2900 2003 A 64 LYS HB2 A 64 LYS HE2 1.0 2.0 4.4 2901 2003 A 42 LYS HE3 A 42 LYS HBx 1.0 2.0 4.4 2902 2003 A 75 LYS HB3 A 75 LYS HE3 1.0 2.0 4.4 2903 2003 A 64 LYS HB3 A 64 LYS HE3 1.0 2.0 4.4 2904 2003 A 64 LYS HB3 A 64 LYS HE2 1.0 2.0 4.4 2905 2003 A 28 LYS HE2 A 28 LYS HBx 1.0 2.0 4.4 2906 2003 A 42 LYS HE2 A 42 LYS HBx 1.0 2.0 4.4 2907 2004 A 27 LYS HA A 27 LYS H 1.0 1.8 3.6 2908 2004 A 30 HIS H A 27 LYS HA 1.0 1.8 3.6 2909 2005 A 27 LYS HD3 A 26 HIS H 1.0 0.0 6.0 2910 2005 A 35 VAL H A 27 LYS HD2 1.0 0.0 6.0 2911 2005 A 28 LYS HD2 A 25 GLU H 1.0 0.0 6.0 2912 2005 A 28 LYS HD3 A 26 HIS H 1.0 0.0 6.0 2913 2005 A 27 LYS HD2 A 26 HIS H 1.0 0.0 6.0 2914 2005 A 27 LYS HD2 A 25 GLU H 1.0 0.0 6.0 2915 2005 A 28 LYS HD3 A 25 GLU H 1.0 0.0 6.0 2916 2005 A 35 VAL H A 27 LYS HD3 1.0 0.0 6.0 2917 2006 A 55 GLU HBx A 56 LYS HA 1.0 1.8 3.4 2918 2006 A 55 GLU HBx A 55 GLU HA 1.0 1.8 3.4 2919 2007 A 59 PHE HD% A 59 PHE H 1.0 1.9 4.5 2920 2007 A 17 PHE HE% A 17 PHE HD% 1.0 1.9 4.5 2921 2008 A 41 SER HA A 37 PHE HD% 1.0 2.0 6.0 2922 2008 A 38 SER HBx A 37 PHE HD% 1.0 2.0 6.0 2923 2008 A 41 SER HBx A 37 PHE HD% 1.0 2.0 6.0 2924 2009 A 71 GLU HBx A 70 TYR HE% 1.0 1.9 4.1 2925 2009 A 70 TYR HE% A 74 MET HE% 1.0 1.9 4.1 2926 2009 A 70 TYR HE% A 74 MET HGx 1.0 1.9 4.1 2927 2010 A 75 LYS HB3 A 75 LYS HA 1.0 1.6 2.8 2928 2010 A 64 LYS HA A 64 LYS HB3 1.0 1.6 2.8 2929 2010 A 75 LYS HB2 A 75 LYS HA 1.0 1.6 2.8 2930 2010 A 64 LYS HA A 64 LYS HB2 1.0 1.6 2.8 2931 2011 A 6 LYS HA A 6 LYS HG3 1.0 1.8 3.6 2932 2011 A 2 LYS HA A 2 LYS HGx 1.0 1.8 3.6 2933 2011 A 6 LYS HA A 6 LYS HG2 1.0 1.8 3.6 2934 2012 A 40 PHE HE% B 44 MET HGx 1.0 2.0 6.0 2935 2012 A 22 CYS HBx A 40 PHE HE% 1.0 2.0 6.0 2936 2013 A 79 PRO HDx A 79 PRO HBy 1.0 1.8 3.6 2937 2013 A 80 PRO HDx A 79 PRO HBy 1.0 1.8 3.6 2938 2014 A 59 PHE HE% A 59 PHE HBy 1.0 2.0 6.0 2939 2014 A 56 LYS HA A 59 PHE HE% 1.0 2.0 6.0 2940 2015 A 19 VAL HGx% A 18 PHE HZ 1.0 1.9 4.3 2941 2015 A 19 VAL HGx% B 54 PHE HZ 1.0 1.9 4.3 2942 2016 A 20 GLN HG2 A 21 THR H 1.0 1.9 4.5 2943 2016 A 20 GLN HG2 A 20 GLN H 1.0 1.9 4.5 2944 2016 A 20 GLN HG3 A 20 GLN H 1.0 1.9 4.5 2945 2016 A 20 GLN HG3 A 21 THR H 1.0 1.9 4.5 2946 2017 A 41 SER H A 40 PHE HBy 1.0 1.8 4.0 2947 2017 A 40 PHE H A 40 PHE HBy 1.0 1.8 4.0 2948 2018 A 11 LYS HDy A 67 LYS HE2 1.0 2.0 6.0 2949 2018 A 70 TYR HBy A 11 LYS HDy 1.0 2.0 6.0 2950 2019 A 7 LYS HA A 8 PRO HGx 1.0 1.8 3.8 2951 2019 A 7 LYS HA A 7 LYS HD3 1.0 1.8 3.8 2952 2019 A 7 LYS HBy A 7 LYS HA 1.0 1.8 3.8 2953 2020 A 28 LYS HGy A 25 GLU HBx 1.0 2.0 5.4 2954 2020 A 29 LYS HBy A 25 GLU HBx 1.0 2.0 5.4 2955 2020 A 46 GLU HBy A 49 LYS HGy 1.0 2.0 5.4 2956 2020 A 29 LYS HDy A 25 GLU HBx 1.0 2.0 5.4 2957 2021 A 19 VAL HA A 21 THR HG2% 1.0 2.0 6.0 2958 2021 A 22 CYS HBy A 21 THR HG2% 1.0 2.0 6.0 2959 2022 A 11 LYS HB3 A 70 TYR HD% 1.0 2.0 5.8 2960 2022 A 11 LYS HB2 A 70 TYR HD% 1.0 2.0 5.8 2961 2022 A 8 PRO HBy A 70 TYR HD% 1.0 2.0 5.8 2962 2023 A 46 GLU HA A 45 SER H 1.0 1.9 4.3 2963 2023 A 42 LYS HA A 45 SER H 1.0 1.9 4.3 2964 2023 A 69 ARG HA A 71 GLU H 1.0 1.9 4.3 2965 2023 A 43 LYS HA A 45 SER H 1.0 1.9 4.3 2966 2024 A 25 GLU HGx A 25 GLU H 1.0 1.8 3.8 2967 2024 A 24 GLU HGx A 25 GLU H 1.0 1.8 3.8 2968 2024 A 25 GLU HGx A 26 HIS H 1.0 1.8 3.8 2969 2025 A 31 PRO HGx A 31 PRO HDx 1.0 1.7 3.1 2970 2025 A 47 ARG HGy A 47 ARG HDy 1.0 1.7 3.1 2971 2026 A 68 ALA HA A 67 LYS HBy 1.0 1.9 3.9 2972 2026 A 64 LYS HB2 A 65 ALA HA 1.0 1.9 3.9 2973 2026 A 64 LYS HB3 A 65 ALA HA 1.0 1.9 3.9 2974 2026 A 68 ALA HA A 71 GLU HBx 1.0 1.9 3.9 2975 2026 A 68 ALA HA A 69 ARG HBx 1.0 1.9 3.9 2976 2027 A 48 TRP HBy A 47 ARG HA 1.0 2.0 5.8 2977 2027 A 47 ARG HDy A 47 ARG HA 1.0 2.0 5.8 2978 2028 A 16 ALA HA A 20 GLN H 1.0 2.0 5.2 2979 2028 A 17 PHE H A 16 ALA HA 1.0 2.0 5.2 2980 2029 A 55 GLU HG3 A 55 GLU HA 1.0 1.6 3.0 2981 2029 A 46 GLU HGx A 46 GLU HA 1.0 1.6 3.0 2982 2029 A 55 GLU HG2 A 55 GLU HA 1.0 1.6 3.0 2983 2029 A 25 GLU HGx A 25 GLU HA 1.0 1.6 3.0 2984 2030 A 8 PRO HBx A 70 TYR HD% 1.0 1.9 4.7 2985 2030 A 71 GLU HGy A 70 TYR HD% 1.0 1.9 4.7 2986 2031 A 40 PHE HBy A 40 PHE HA 1.0 1.8 3.6 2987 2031 A 37 PHE HA A 37 PHE HBy 1.0 1.8 3.6 2988 2032 A 81 LYS HG3 A 81 LYS HE2 1.0 1.5 2.5 2989 2032 A 6 LYS HG3 A 6 LYS HE2 1.0 1.5 2.5 2990 2032 A 81 LYS HG3 A 81 LYS HE3 1.0 1.5 2.5 2991 2032 A 6 LYS HG3 A 6 LYS HE3 1.0 1.5 2.5 2992 2032 A 64 LYS HGy A 64 LYS HE3 1.0 1.5 2.5 2993 2032 A 81 LYS HG2 A 81 LYS HE2 1.0 1.5 2.5 2994 2032 A 81 LYS HG2 A 81 LYS HE3 1.0 1.5 2.5 2995 2032 A 64 LYS HGy A 64 LYS HE2 1.0 1.5 2.5 2996 2033 A 55 GLU HBx A 55 GLU HA 1.0 1.5 2.5 2997 2033 A 46 GLU HBx A 46 GLU HA 1.0 1.5 2.5 2998 2033 A 46 GLU HBy A 46 GLU HA 1.0 1.5 2.5 2999 2033 A 25 GLU HBy A 25 GLU HA 1.0 1.5 2.5 3000 2033 A 24 GLU HBx A 24 GLU HA 1.0 1.5 2.5 3001 2034 A 80 PRO HBx A 80 PRO HDx 1.0 1.7 3.5 3002 2034 A 80 PRO HDx A 79 PRO HBx 1.0 1.7 3.5 3003 2035 A 42 LYS HBy A 42 LYS HGx 1.0 1.5 2.3 3004 2035 A 54 LYS HB3 A 54 LYS HG3 1.0 1.5 2.3 3005 2035 A 6 LYS HBx A 6 LYS HG2 1.0 1.5 2.3 3006 2035 A 54 LYS HB2 A 54 LYS HG2 1.0 1.5 2.3 3007 2035 A 54 LYS HB2 A 54 LYS HG3 1.0 1.5 2.3 3008 2035 A 6 LYS HBx A 6 LYS HG3 1.0 1.5 2.3 3009 2035 A 54 LYS HB3 A 54 LYS HG2 1.0 1.5 2.3 3010 2036 A 82 GLY H A 81 LYS HD3 1.0 2.0 5.6 3011 2036 A 6 LYS H A 6 LYS HD3 1.0 2.0 5.6 3012 2036 A 6 LYS H A 6 LYS HD2 1.0 2.0 5.6 3013 2036 A 81 LYS H A 81 LYS HD2 1.0 2.0 5.6 3014 2036 A 82 GLY H A 81 LYS HD2 1.0 2.0 5.6 3015 2037 A 2 LYS HA A 2 LYS HB3 1.0 1.6 2.8 3016 2037 A 81 LYS HBy A 81 LYS HA 1.0 1.6 2.8 3017 2037 A 81 LYS HBx A 81 LYS HA 1.0 1.6 2.8 3018 2037 A 2 LYS HA A 2 LYS HB2 1.0 1.6 2.8 3019 2038 A 65 ALA HB% A 67 LYS H 1.0 2.0 5.8 3020 2038 A 68 ALA HB% A 67 LYS H 1.0 2.0 5.8 3021 2039 A 27 LYS HB2 A 27 LYS HA 1.0 1.6 2.6 3022 2039 A 28 LYS HBy A 28 LYS HA 1.0 1.6 2.6 3023 2039 A 27 LYS HB3 A 27 LYS HA 1.0 1.6 2.6 3024 2040 A 7 LYS HD2 A 77 TYR HE% 1.0 0.0 6.0 3025 2040 A 77 TYR HE% A 7 LYS HD3 1.0 0.0 6.0 3026 2040 A 7 LYS HBy A 77 TYR HE% 1.0 0.0 6.0 3027 2040 A 78 ILE HB A 77 TYR HE% 1.0 0.0 6.0 3028 2041 A 29 LYS HBy A 25 GLU HBy 1.0 1.9 4.5 3029 2041 A 25 GLU HBy A 29 LYS HDy 1.0 1.9 4.5 3030 2041 A 24 GLU HBx A 27 LYS HG3 1.0 1.9 4.5 3031 2041 A 25 GLU HBy A 28 LYS HGy 1.0 1.9 4.5 3032 2041 A 24 GLU HBx A 27 LYS HG2 1.0 1.9 4.5 3033 2041 A 71 GLU HBy A 75 LYS HGy 1.0 1.9 4.5 3034 2041 A 24 GLU HBx A 28 LYS HGy 1.0 1.9 4.5 3035 2042 A 41 SER HBx A 38 SER HA 1.0 1.9 4.3 3036 2042 A 38 SER HA A 38 SER HBx 1.0 1.9 4.3 3037 2043 A 41 SER HBx B 43 LEU HD2% 1.0 1.9 4.7 3038 2043 A 41 SER HBx A 19 VAL HGx% 1.0 1.9 4.7 3039 2043 A 41 SER HBx B 43 LEU HD1% 1.0 1.9 4.7 3040 2044 A 57 GLY HAx A 57 GLY H 1.0 1.9 4.7 3041 2044 A 57 GLY HAx A 58 LYS H 1.0 1.9 4.7 3042 2045 A 24 GLU HGy A 28 LYS HGy 1.0 1.9 4.1 3043 2045 A 29 LYS HBy A 25 GLU HGy 1.0 1.9 4.1 3044 2045 A 25 GLU HGy A 29 LYS HDy 1.0 1.9 4.1 3045 2045 A 24 GLU HGy A 27 LYS HG3 1.0 1.9 4.1 3046 2045 A 25 GLU HGy A 28 LYS HGy 1.0 1.9 4.1 3047 2045 A 24 GLU HGy A 27 LYS HG2 1.0 1.9 4.1 3048 2046 A 58 LYS HA A 61 ASP H 1.0 1.9 4.3 3049 2046 A 69 ARG HA A 70 TYR H 1.0 1.9 4.3 3050 2046 A 40 PHE H A 39 GLU HA 1.0 1.9 4.3 3051 2047 A 19 VAL HA A 18 PHE H 1.0 2.0 5.4 3052 2047 A 19 VAL HA A 20 GLN H 1.0 2.0 5.4 3053 2048 A 65 ALA HB% A 64 LYS HA 1.0 1.8 3.8 3054 2048 A 64 LYS HA A 67 LYS HG3 1.0 1.8 3.8 3055 2048 A 64 LYS HA A 64 LYS HGy 1.0 1.8 3.8 3056 2049 A 46 GLU HBx A 46 GLU H 1.0 1.7 3.1 3057 2049 A 46 GLU HBx A 47 ARG H 1.0 1.7 3.1 3058 2050 A 16 ALA HA B 45 LEU HD2% 1.0 1.9 4.3 3059 2050 A 16 ALA HA A 19 VAL HGx% 1.0 1.9 4.3 3060 2051 A 79 PRO HDx A 79 PRO HGy 1.0 1.5 2.7 3061 2051 A 80 PRO HDx A 80 PRO HG2 1.0 1.5 2.7 3062 2051 A 80 PRO HDx A 80 PRO HG3 1.0 1.5 2.7 3063 2052 A 36 ASN HBx A 35 VAL HGx% 1.0 2.0 5.4 3064 2052 A 40 PHE HBx A 35 VAL HGx% 1.0 2.0 5.4 3065 2053 A 25 GLU HA A 28 LYS H 1.0 1.7 3.3 3066 2053 A 24 GLU HA A 28 LYS H 1.0 1.7 3.3 3067 2053 A 42 LYS HA A 42 LYS H 1.0 1.7 3.3 3068 2053 A 43 LYS HA A 42 LYS H 1.0 1.7 3.3 3069 2054 A 24 GLU HBx A 21 THR HG2% 1.0 1.9 4.9 3070 2054 A 18 PHE HBx A 21 THR HG2% 1.0 1.9 4.9 3071 2055 A 56 LYS HBy A 48 TRP HZ3 1.0 2.0 5.2 3072 2055 A 51 MET HE% A 48 TRP HZ3 1.0 2.0 5.2 3073 2056 A 67 LYS HA A 65 ALA HA 1.0 2.0 5.0 3074 2056 A 68 ALA HA A 67 LYS HA 1.0 2.0 5.0 3075 2056 A 68 ALA HA A 69 ARG HA 1.0 2.0 5.0 3076 2057 A 24 GLU HA A 27 LYS HD2 1.0 1.7 3.1 3077 2057 A 27 LYS HA A 27 LYS HD3 1.0 1.7 3.1 3078 2057 A 28 LYS HD2 A 28 LYS HA 1.0 1.7 3.1 3079 2057 A 49 LYS HA A 49 LYS HD3 1.0 1.7 3.1 3080 2057 A 49 LYS HD2 A 46 GLU HA 1.0 1.7 3.1 3081 2057 A 27 LYS HA A 27 LYS HD2 1.0 1.7 3.1 3082 2057 A 28 LYS HD3 A 28 LYS HA 1.0 1.7 3.1 3083 2057 A 49 LYS HA A 49 LYS HD2 1.0 1.7 3.1 3084 2058 A 21 THR HG2% A 17 PHE HZ 1.0 2.0 4.8 3085 2058 B 45 LEU HG A 37 PHE HZ 1.0 2.0 4.8 3086 2058 A 65 ALA HB% A 17 PHE HZ 1.0 2.0 4.8 3087 2058 B 45 LEU HBx A 37 PHE HZ 1.0 2.0 4.8 3088 2058 A 12 MET HBx A 17 PHE HZ 1.0 2.0 4.8 3089 2059 A 6 LYS H A 6 LYS HBy 1.0 1.9 3.9 3090 2059 A 81 LYS H A 81 LYS HBx 1.0 1.9 3.9 3091 2059 A 81 LYS H A 81 LYS HBy 1.0 1.9 3.9 3092 2059 A 81 LYS HBy A 82 GLY H 1.0 1.9 3.9 3093 2060 A 54 LYS HB2 A 54 LYS HA 1.0 1.5 2.5 3094 2060 A 28 LYS HBy A 28 LYS HA 1.0 1.5 2.5 3095 2060 A 27 LYS HB3 A 27 LYS HA 1.0 1.5 2.5 3096 2060 A 54 LYS HB3 A 54 LYS HA 1.0 1.5 2.5 3097 2060 A 27 LYS HB3 A 24 GLU HA 1.0 1.5 2.5 3098 2060 A 27 LYS HB2 A 27 LYS HA 1.0 1.5 2.5 3099 2061 A 74 MET HGx A 74 MET H 1.0 1.9 4.5 3100 2061 A 75 LYS HB2 A 74 MET H 1.0 1.9 4.5 3101 2061 A 75 LYS HB3 A 74 MET H 1.0 1.9 4.5 3102 2062 A 31 PRO HBx A 31 PRO HDx 1.0 1.9 4.5 3103 2062 A 8 PRO HBx A 8 PRO HDx 1.0 1.9 4.5 3104 2063 A 30 HIS HBy A 26 HIS HE1 1.0 2.0 5.8 3105 2063 A 33 ALA H A 30 HIS HBy 1.0 2.0 5.8 3106 2064 A 74 MET HGy A 74 MET H 1.0 1.9 5.1 3107 2064 A 81 LYS H A 80 PRO HBx 1.0 1.9 5.1 3108 2065 A 41 SER HBy A 38 SER HA 1.0 1.9 4.7 3109 2065 A 38 SER HA A 38 SER HBy 1.0 1.9 4.7 3110 2066 A 55 GLU H A 54 LYS HA 1.0 1.7 3.5 3111 2066 A 55 GLU H A 55 GLU HA 1.0 1.7 3.5 3112 2066 A 49 LYS HA A 49 LYS H 1.0 1.7 3.5 3113 2067 A 23 ARG HA A 19 VAL HA 1.0 2.0 5.6 3114 2067 A 18 PHE HA A 19 VAL HA 1.0 2.0 5.6 3115 2068 A 39 GLU HBy A 40 PHE HBy 1.0 2.0 6.0 3116 2068 A 39 GLU HBy A 36 ASN HBy 1.0 2.0 6.0 3117 2069 A 28 LYS HD2 A 28 LYS H 1.0 1.8 4.0 3118 2069 A 28 LYS HD3 A 28 LYS H 1.0 1.8 4.0 3119 2069 A 75 LYS HDy A 75 LYS H 1.0 1.8 4.0 3120 2070 A 49 LYS HBx A 49 LYS HGx 1.0 1.6 2.8 3121 2070 A 64 LYS HGx A 64 LYS HB3 1.0 1.6 2.8 3122 2070 A 49 LYS HBy A 49 LYS HGx 1.0 1.6 2.8 3123 2070 A 64 LYS HGx A 64 LYS HB2 1.0 1.6 2.8 3124 2071 A 67 LYS HBy A 68 ALA HB% 1.0 1.8 3.8 3125 2071 A 65 ALA HB% A 69 ARG HBx 1.0 1.8 3.8 3126 2071 A 71 GLU HBx A 68 ALA HB% 1.0 1.8 3.8 3127 2071 A 69 ARG HBx A 68 ALA HB% 1.0 1.8 3.8 3128 2072 A 39 GLU HGx A 42 LYS HBy 1.0 1.8 4.2 3129 2072 A 28 LYS HBy A 24 GLU HGx 1.0 1.8 4.2 3130 2072 A 27 LYS HB3 A 24 GLU HGx 1.0 1.8 4.2 3131 2072 A 27 LYS HB2 A 24 GLU HGx 1.0 1.8 4.2 3132 2072 A 28 LYS HBy A 25 GLU HGx 1.0 1.8 4.2 3133 2073 A 75 LYS HB2 A 77 TYR HD% 1.0 1.9 5.5 3134 2073 A 75 LYS HB3 A 77 TYR HD% 1.0 1.9 5.5 3135 2073 A 77 TYR HD% A 74 MET HGx 1.0 1.9 5.5 3136 2074 A 62 MET HA A 63 ALA H 1.0 1.9 4.3 3137 2074 A 71 GLU HA A 72 ARG H 1.0 1.9 4.3 3138 2075 A 64 LYS HB2 A 61 ASP HBy 1.0 2.0 5.4 3139 2075 A 40 PHE HBx A 39 GLU HBx 1.0 2.0 5.4 3140 2076 A 12 MET H A 11 LYS HB2 1.0 2.0 5.0 3141 2076 A 9 ARG H A 8 PRO HBy 1.0 2.0 5.0 3142 2077 A 80 PRO HDy A 79 PRO HBy 1.0 1.9 4.5 3143 2077 A 80 PRO HBy A 80 PRO HDy 1.0 1.9 4.5 3144 2078 A 21 THR HG2% A 22 CYS HA 1.0 1.8 3.6 3145 2078 A 21 THR HG2% A 21 THR HA 1.0 1.8 3.6 3146 2079 A 31 PRO HGx A 29 LYS HA 1.0 0.0 6.0 3147 2079 A 28 LYS HBy A 29 LYS HA 1.0 0.0 6.0 3148 2080 A 37 PHE HD% A 27 LYS HE3 1.0 0.0 6.0 3149 2080 A 43 LYS HE3 B 54 PHE HZ 1.0 0.0 6.0 3150 2080 A 37 PHE HD% A 27 LYS HE2 1.0 0.0 6.0 3151 2080 B 54 PHE HD% A 27 LYS HE2 1.0 0.0 6.0 3152 2080 B 54 PHE HD% A 27 LYS HE3 1.0 0.0 6.0 3153 2080 A 43 LYS HE2 A 18 PHE HZ 1.0 0.0 6.0 3154 2080 A 18 PHE HZ A 49 LYS HE2 1.0 0.0 6.0 3155 2080 A 27 LYS HE2 B 54 PHE HZ 1.0 0.0 6.0 3156 2080 A 51 MET H A 49 LYS HE2 1.0 0.0 6.0 3157 2080 A 51 MET H A 49 LYS HE3 1.0 0.0 6.0 3158 2080 A 43 LYS HE3 A 37 PHE HD% 1.0 0.0 6.0 3159 2080 A 43 LYS HE2 B 54 PHE HZ 1.0 0.0 6.0 3160 2080 A 48 TRP HH2 A 49 LYS HE2 1.0 0.0 6.0 3161 2080 A 43 LYS HE3 A 18 PHE HZ 1.0 0.0 6.0 3162 2080 A 27 LYS HE3 B 54 PHE HZ 1.0 0.0 6.0 3163 2080 A 43 LYS HE2 A 37 PHE HD% 1.0 0.0 6.0 3164 2081 A 66 ASP HBx A 64 LYS HA 1.0 2.0 6.0 3165 2081 A 66 ASP HBy A 64 LYS HA 1.0 2.0 6.0 3166 2081 A 9 ARG HDx A 9 ARG HA 1.0 2.0 6.0 3167 2082 A 23 ARG HA A 23 ARG HDy 1.0 1.8 3.6 3168 2082 A 71 GLU HA A 71 GLU HGx 1.0 1.8 3.6 3169 2083 A 15 TYR HE% A 18 PHE HZ 1.0 2.0 6.0 3170 2083 A 15 TYR HE% A 48 TRP HH2 1.0 2.0 6.0 3171 2084 A 32 ASP HBx A 31 PRO HA 1.0 2.0 6.0 3172 2084 A 30 HIS HBx A 31 PRO HA 1.0 2.0 6.0 3173 2085 A 5 PRO HDx A 6 LYS HD3 1.0 2.0 6.0 3174 2085 A 5 PRO HDy A 7 LYS HBy 1.0 2.0 6.0 3175 2085 A 5 PRO HDy A 6 LYS HD3 1.0 2.0 6.0 3176 2085 A 5 PRO HDx A 7 LYS HBy 1.0 2.0 6.0 3177 2085 A 5 PRO HDx A 6 LYS HD2 1.0 2.0 6.0 3178 2085 A 5 PRO HDy A 6 LYS HD2 1.0 2.0 6.0 3179 2086 A 71 GLU HA A 74 MET H 1.0 1.8 3.8 3180 2086 A 71 GLU HA A 71 GLU H 1.0 1.8 3.8 3181 2087 A 46 GLU HBy A 46 GLU H 1.0 1.9 4.5 3182 2087 A 46 GLU HBy A 47 ARG H 1.0 1.9 4.5 3183 2088 A 25 GLU HA A 28 LYS HBx 1.0 1.6 2.8 3184 2088 A 49 LYS HBx A 46 GLU HA 1.0 1.6 2.8 3185 2088 A 49 LYS HA A 49 LYS HBy 1.0 1.6 2.8 3186 2088 A 49 LYS HA A 49 LYS HBx 1.0 1.6 2.8 3187 2089 B 45 LEU HD1% A 21 THR HG2% 1.0 2.0 5.0 3188 2089 A 58 LYS HGx A 21 THR HG2% 1.0 2.0 5.0 3189 2089 A 19 VAL HGx% A 21 THR HG2% 1.0 2.0 5.0 3190 2090 A 58 LYS HD3 A 58 LYS HA 1.0 1.9 4.5 3191 2090 A 11 LYS HDy A 11 LYS HA 1.0 1.9 4.5 3192 2090 A 58 LYS HD2 A 58 LYS HA 1.0 1.9 4.5 3193 2090 A 42 LYS HD3 A 42 LYS HA 1.0 1.9 4.5 3194 2090 A 42 LYS HD2 A 42 LYS HA 1.0 1.9 4.5 3195 2091 A 80 PRO HDy A 80 PRO HG3 1.0 1.5 2.5 3196 2091 A 5 PRO HDy A 5 PRO HG2 1.0 1.5 2.5 3197 2091 A 5 PRO HDx A 5 PRO HG2 1.0 1.5 2.5 3198 2091 A 5 PRO HDx A 5 PRO HG3 1.0 1.5 2.5 3199 2091 A 5 PRO HDy A 5 PRO HG3 1.0 1.5 2.5 3200 2091 A 80 PRO HDy A 80 PRO HG2 1.0 1.5 2.5 3201 2092 A 47 ARG HBx A 18 PHE HE% 1.0 2.0 6.0 3202 2092 A 18 PHE HE% A 47 ARG HBy 1.0 2.0 6.0 3203 2092 A 55 GLU HBy A 18 PHE HE% 1.0 2.0 6.0 3204 2093 A 25 GLU HGy A 25 GLU HA 1.0 1.6 2.8 3205 2093 A 24 GLU HGy A 24 GLU HA 1.0 1.6 2.8 3206 2093 A 46 GLU HA A 46 GLU HGy 1.0 1.6 2.8 3207 2094 A 56 LYS HEx A 52 SER HA 1.0 1.9 5.1 3208 2094 A 56 LYS HEx A 48 TRP HA 1.0 1.9 5.1 3209 2095 A 19 VAL HGy% A 17 PHE HA 1.0 2.0 5.8 3210 2095 A 19 VAL HGy% A 22 CYS HA 1.0 2.0 5.8 3211 2095 A 19 VAL HGy% A 45 SER HBy 1.0 2.0 5.8 3212 2095 A 19 VAL HGy% A 44 CYS HA 1.0 2.0 5.8 3213 2096 B 45 LEU HD2% A 23 ARG HDx 1.0 1.9 4.7 3214 2096 A 19 VAL HGx% A 23 ARG HDx 1.0 1.9 4.7 3215 2096 B 45 LEU HD1% A 23 ARG HDx 1.0 1.9 4.7 3216 2097 A 55 GLU HA A 58 LYS H 1.0 1.7 3.3 3217 2097 A 54 LYS HA A 57 GLY H 1.0 1.7 3.3 3218 2097 A 43 LYS HA A 43 LYS H 1.0 1.7 3.3 3219 2097 A 58 LYS HA A 58 LYS H 1.0 1.7 3.3 3220 2098 A 23 ARG HA A 23 ARG HDx 1.0 1.9 4.5 3221 2098 A 62 MET HGx A 62 MET HA 1.0 1.9 4.5 3222 2099 A 19 VAL HB A 18 PHE HD% 1.0 2.0 5.2 3223 2099 A 51 MET HE% A 18 PHE HD% 1.0 2.0 5.2 3224 2100 A 58 LYS HA A 61 ASP HBy 1.0 1.7 3.5 3225 2100 A 40 PHE HBx A 40 PHE HA 1.0 1.7 3.5 3226 2101 A 19 VAL HGy% B 54 PHE HD% 1.0 2.0 5.4 3227 2101 A 19 VAL HGy% B 54 PHE HZ 1.0 2.0 5.4 3228 2101 A 19 VAL HGy% A 18 PHE HZ 1.0 2.0 5.4 3229 2102 A 28 LYS HE2 A 28 LYS H 1.0 1.8 3.6 3230 2102 A 29 LYS HE3 A 29 LYS H 1.0 1.8 3.6 3231 2102 A 28 LYS HE3 A 28 LYS H 1.0 1.8 3.6 3232 2102 A 29 LYS HE2 A 29 LYS H 1.0 1.8 3.6 3233 2103 A 78 ILE HG2% A 77 TYR HBx 1.0 1.9 6.0 3234 2103 A 78 ILE HD1% A 77 TYR HBx 1.0 1.9 6.0 3235 2103 A 37 PHE HBx B 50 ILE HD1% 1.0 1.9 6.0 3236 2104 A 21 THR HA A 21 THR H 1.0 1.8 4.0 3237 2104 A 21 THR HA A 24 GLU H 1.0 1.8 4.0 3238 2105 A 46 GLU HGy A 46 GLU H 1.0 1.7 3.3 3239 2105 A 46 GLU HGy A 47 ARG H 1.0 1.7 3.3 3240 2106 A 65 ALA HB% A 65 ALA H 1.0 1.6 2.8 3241 2106 A 68 ALA HB% A 69 ARG H 1.0 1.6 2.8 3242 2107 A 25 GLU HA A 25 GLU H 1.0 1.8 3.4 3243 2107 A 25 GLU HA A 26 HIS H 1.0 1.8 3.4 3244 2107 A 54 LYS H A 54 LYS HA 1.0 1.8 3.4 3245 2108 A 39 GLU HGx A 43 LYS HGx 1.0 1.9 4.7 3246 2108 A 28 LYS HGx A 25 GLU HGx 1.0 1.9 4.7 3247 2108 A 29 LYS HBx A 25 GLU HGx 1.0 1.9 4.7 3248 2108 A 28 LYS HGx A 24 GLU HGx 1.0 1.9 4.7 3249 2108 A 29 LYS HGx A 25 GLU HGx 1.0 1.9 4.7 3250 2109 A 47 ARG HBy A 50 THR H 1.0 2.0 5.4 3251 2109 A 18 PHE HE% A 47 ARG HBy 1.0 2.0 5.4 3252 2110 A 73 GLU HBx A 74 MET H 1.0 2.0 5.4 3253 2110 A 6 LYS H A 5 PRO HG3 1.0 2.0 5.4 3254 2110 A 6 LYS H A 5 PRO HG2 1.0 2.0 5.4 3255 2111 A 76 THR HG2% A 75 LYS H 1.0 1.9 5.1 3256 2111 A 77 TYR H A 76 THR HG2% 1.0 1.9 5.1 3257 2112 A 36 ASN HBy A 35 VAL HGy% 1.0 1.9 4.1 3258 2112 A 40 PHE HBy A 35 VAL HGy% 1.0 1.9 4.1 3259 2113 A 72 ARG HB3 A 73 GLU H 1.0 1.9 3.9 3260 2113 A 72 ARG HB2 A 71 GLU H 1.0 1.9 3.9 3261 2113 A 72 ARG HB2 A 73 GLU H 1.0 1.9 3.9 3262 2114 A 55 GLU HG3 A 56 LYS HDx 1.0 1.9 6.0 3263 2114 A 55 GLU HG3 A 56 LYS HDy 1.0 1.9 6.0 3264 2114 A 55 GLU HG2 A 58 LYS HGx 1.0 1.9 6.0 3265 2114 A 55 GLU HG2 A 56 LYS HDx 1.0 1.9 6.0 3266 2114 A 55 GLU HG2 A 58 LYS HGy 1.0 1.9 6.0 3267 2114 A 55 GLU HG2 A 56 LYS HDy 1.0 1.9 6.0 3268 2115 A 12 MET HE% A 17 PHE HD% 1.0 2.0 4.8 3269 2115 A 20 GLN HE22 A 12 MET HE% 1.0 2.0 4.8 3270 2116 A 72 ARG HD3 A 69 ARG HA 1.0 2.0 5.2 3271 2116 A 72 ARG HA A 72 ARG HD3 1.0 2.0 5.2 3272 2116 A 72 ARG HA A 72 ARG HD2 1.0 2.0 5.2 3273 2117 A 46 GLU HA A 46 GLU H 1.0 1.8 3.6 3274 2117 A 46 GLU HA A 47 ARG H 1.0 1.8 3.6 3275 2117 A 25 GLU HA A 27 LYS H 1.0 1.8 3.6 3276 2118 A 76 THR HG2% A 75 LYS HA 1.0 2.0 5.4 3277 2118 A 50 THR HG2% A 47 ARG HA 1.0 2.0 5.4 3278 2119 A 20 GLN HG2 A 19 VAL HB 1.0 2.0 5.4 3279 2119 A 20 GLN HG3 A 19 VAL HB 1.0 2.0 5.4 3280 2119 A 23 ARG HBy A 20 GLN HG3 1.0 2.0 5.4 3281 2119 A 23 ARG HBy A 20 GLN HG2 1.0 2.0 5.4 3282 2120 A 62 MET HE% A 62 MET HA 1.0 0.0 6.0 3283 2120 A 62 MET HE% A 18 PHE HA 1.0 0.0 6.0 3284 2121 A 13 SER H A 16 ALA HB% 1.0 1.8 3.8 3285 2121 A 17 PHE H A 16 ALA HB% 1.0 1.8 3.8 3286 2122 A 20 GLN HB2 A 19 VAL HGx% 1.0 1.9 4.9 3287 2122 A 20 GLN HB3 A 19 VAL HGx% 1.0 1.9 4.9 3288 2122 A 19 VAL HGx% B 44 MET HB2 1.0 1.9 4.9 3289 2122 A 19 VAL HGx% B 44 MET HB3 1.0 1.9 4.9 3290 2123 A 78 ILE HG1y A 77 TYR HD% 1.0 2.0 6.0 3291 2123 A 7 LYS HGy A 77 TYR HD% 1.0 2.0 6.0 3292 2124 A 20 GLN HA A 20 GLN H 1.0 1.8 3.8 3293 2124 A 20 GLN HA A 21 THR H 1.0 1.8 3.8 3294 2125 A 28 LYS HGx A 24 GLU HBy 1.0 2.0 6.0 3295 2125 A 24 GLU HBy A 23 ARG HGx 1.0 2.0 6.0 3296 2126 A 55 GLU HBx A 59 PHE HE% 1.0 1.9 4.1 3297 2126 A 55 GLU H A 55 GLU HBx 1.0 1.9 4.1 3298 2127 A 46 GLU HGx A 46 GLU H 1.0 1.8 3.8 3299 2127 A 46 GLU HGx A 47 ARG H 1.0 1.8 3.8 3300 2128 A 31 PRO HA A 28 LYS HA 1.0 1.9 4.3 3301 2128 A 27 LYS HA A 31 PRO HA 1.0 1.9 4.3 3302 2129 A 40 PHE HBy A 40 PHE HE% 1.0 1.9 3.9 3303 2129 A 19 VAL HA A 40 PHE HE% 1.0 1.9 3.9 3304 2129 A 40 PHE HD% A 40 PHE HBy 1.0 1.9 3.9 3305 2130 A 67 LYS HD2 A 67 LYS HBy 1.0 1.7 2.9 3306 2130 A 9 ARG HGx A 9 ARG HB3 1.0 1.7 2.9 3307 2130 A 9 ARG HGx A 9 ARG HB2 1.0 1.7 2.9 3308 2131 B 45 LEU HD2% A 37 PHE HD% 1.0 0.0 6.0 3309 2131 A 37 PHE HD% B 50 ILE HG2% 1.0 0.0 6.0 3310 2131 B 45 LEU HD1% A 37 PHE HD% 1.0 0.0 6.0 3311 2132 A 72 ARG HGx A 72 ARG HA 1.0 1.6 2.8 3312 2132 A 56 LYS HBy A 56 LYS HA 1.0 1.6 2.8 3313 2133 A 59 PHE HD% A 56 LYS HA 1.0 1.9 4.1 3314 2133 A 17 PHE HA A 17 PHE HD% 1.0 1.9 4.1 3315 2133 A 59 PHE HD% A 59 PHE HBy 1.0 1.9 4.1 3316 2134 A 44 CYS HBy A 19 VAL HGx% 1.0 2.0 5.8 3317 2134 A 19 VAL HGx% B 44 MET HGx 1.0 2.0 5.8 3318 2135 A 27 LYS HG2 A 24 GLU HA 1.0 1.7 3.1 3319 2135 A 43 LYS HGy A 43 LYS HA 1.0 1.7 3.1 3320 2135 A 43 LYS HGy A 40 PHE HA 1.0 1.7 3.1 3321 2136 A 40 PHE HBy A 40 PHE HZ 1.0 2.0 5.2 3322 2136 A 22 CYS HBy A 40 PHE HZ 1.0 2.0 5.2 3323 2137 A 69 ARG HBx A 71 GLU H 1.0 1.9 4.7 3324 2137 A 6 LYS H A 5 PRO HG2 1.0 1.9 4.7 3325 2137 A 6 LYS H A 5 PRO HG3 1.0 1.9 4.7 3326 2138 A 19 VAL HGx% A 22 CYS H 1.0 2.0 6.0 3327 2138 A 19 VAL HGx% A 45 SER H 1.0 2.0 6.0 3328 2139 A 65 ALA HB% A 65 ALA HA 1.0 1.6 2.6 3329 2139 A 68 ALA HA A 68 ALA HB% 1.0 1.6 2.6 3330 2140 B 45 LEU HD2% A 37 PHE HE% 1.0 1.9 4.7 3331 2140 B 45 LEU HD1% A 37 PHE HE% 1.0 1.9 4.7 3332 2140 A 37 PHE HE% B 50 ILE HG2% 1.0 1.9 4.7 3333 2141 A 42 LYS HBy A 38 SER HBy 1.0 2.0 5.8 3334 2141 A 42 LYS HBy A 41 SER HBy 1.0 2.0 5.8 3335 2142 A 76 THR HG2% A 76 THR HA 1.0 1.6 2.8 3336 2142 A 50 THR HA A 50 THR HG2% 1.0 1.6 2.8 3337 2143 A 35 VAL HGx% A 37 PHE HBx 1.0 2.0 5.6 3338 2143 A 35 VAL HGx% A 26 HIS HBx 1.0 2.0 5.6 3339 2144 A 16 ALA HB% A 13 SER HBx 1.0 2.0 5.0 3340 2144 A 17 PHE HA A 16 ALA HB% 1.0 2.0 5.0 3341 2145 A 55 GLU HG3 A 52 SER HBy 1.0 1.8 3.8 3342 2145 A 55 GLU HG2 A 52 SER HBy 1.0 1.8 3.8 3343 2145 A 55 GLU HG3 A 55 GLU HA 1.0 1.8 3.8 3344 2145 A 55 GLU HG2 A 55 GLU HA 1.0 1.8 3.8 3345 2146 A 76 THR HG2% A 75 LYS HB2 1.0 1.8 3.6 3346 2146 A 49 LYS HBx A 50 THR HG2% 1.0 1.8 3.6 3347 2146 A 76 THR HG2% A 75 LYS HB3 1.0 1.8 3.6 3348 2146 A 49 LYS HBy A 50 THR HG2% 1.0 1.8 3.6 3349 2147 A 78 ILE HG2% A 79 PRO HA 1.0 1.9 5.1 3350 2147 A 78 ILE HD1% A 76 THR HA 1.0 1.9 5.1 3351 2148 A 70 TYR HD% A 74 MET HE% 1.0 1.9 4.9 3352 2148 A 70 TYR HD% A 73 GLU HBx 1.0 1.9 4.9 3353 2148 A 70 TYR HD% A 74 MET HGx 1.0 1.9 4.9 3354 2149 A 79 PRO HDx A 79 PRO HBx 1.0 1.7 3.5 3355 2149 A 80 PRO HDx A 79 PRO HBx 1.0 1.7 3.5 3356 2150 A 25 GLU HBx A 25 GLU H 1.0 1.7 3.5 3357 2150 A 25 GLU HBx A 26 HIS H 1.0 1.7 3.5 3358 2151 A 48 TRP HH2 A 14 SER HBx 1.0 2.0 4.6 3359 2151 A 48 TRP HH2 A 59 PHE HBy 1.0 2.0 4.6 3360 2151 A 48 TRP HH2 A 56 LYS HA 1.0 2.0 4.6 3361 2152 A 71 GLU HA A 74 MET HGx 1.0 1.8 4.0 3362 2152 A 71 GLU HA A 71 GLU HBx 1.0 1.8 4.0 3363 2153 A 26 HIS HA A 29 LYS HA 1.0 2.0 5.2 3364 2153 A 26 HIS HA A 25 GLU HA 1.0 2.0 5.2 3365 2153 A 26 HIS HA A 27 LYS HA 1.0 2.0 5.2 3366 2154 A 55 GLU H A 56 LYS HEy 1.0 0.0 6.0 3367 2154 A 48 TRP HZ2 A 56 LYS HEy 1.0 0.0 6.0 3368 2155 A 23 ARG HA B 45 LEU HD1% 1.0 2.0 6.0 3369 2155 A 23 ARG HA A 19 VAL HGx% 1.0 2.0 6.0 3370 2156 A 65 ALA HA A 65 ALA H 1.0 1.8 3.6 3371 2156 A 68 ALA HA A 69 ARG H 1.0 1.8 3.6 3372 2157 A 70 TYR HBy A 11 LYS HB2 1.0 2.0 5.4 3373 2157 A 66 ASP HBx A 11 LYS HB3 1.0 2.0 5.4 3374 2157 A 66 ASP HBy A 11 LYS HB2 1.0 2.0 5.4 3375 2157 A 70 TYR HBy A 11 LYS HB3 1.0 2.0 5.4 3376 2157 A 66 ASP HBy A 11 LYS HB3 1.0 2.0 5.4 3377 2157 A 70 TYR HBy A 8 PRO HBy 1.0 2.0 5.4 3378 2157 A 9 ARG HDx A 8 PRO HBy 1.0 2.0 5.4 3379 2158 A 64 LYS HGx A 63 ALA H 1.0 2.0 5.2 3380 2158 A 64 LYS HGx A 65 ALA H 1.0 2.0 5.2 3381 2159 A 11 LYS H A 11 LYS HEx 1.0 1.9 5.3 3382 2159 A 59 PHE HD% A 58 LYS HEx 1.0 1.9 5.3 3383 2160 A 41 SER H A 35 VAL HGy% 1.0 2.0 5.2 3384 2160 A 40 PHE H A 35 VAL HGy% 1.0 2.0 5.2 3385 2161 A 23 ARG HGy A 19 VAL HGx% 1.0 2.0 5.0 3386 2161 A 19 VAL HGx% A 16 ALA HB% 1.0 2.0 5.0 3387 2162 A 62 MET HE% A 62 MET HA 1.0 1.9 4.1 3388 2162 A 71 GLU HA A 74 MET HBx 1.0 1.9 4.1 3389 2162 A 71 GLU HA A 74 MET HBy 1.0 1.9 4.1 3390 2163 A 60 GLU HBy A 63 ALA HB% 1.0 0.0 6.0 3391 2163 A 62 MET HGy A 63 ALA HB% 1.0 0.0 6.0 3392 2164 A 77 TYR HBx A 77 TYR HD% 1.0 1.8 3.4 3393 2164 A 37 PHE HBx A 37 PHE HD% 1.0 1.8 3.4 3394 2165 A 35 VAL HGy% A 42 LYS H 1.0 0.0 6.0 3395 2165 A 35 VAL HGy% A 26 HIS HE1 1.0 0.0 6.0 3396 2166 A 20 GLN HA A 19 VAL HGx% 1.0 1.9 4.1 3397 2166 A 20 GLN HA B 45 LEU HD1% 1.0 1.9 4.1 3398 2167 A 75 LYS HGx A 75 LYS HE3 1.0 1.8 3.4 3399 2167 A 75 LYS HGx A 75 LYS HE2 1.0 1.8 3.4 3400 2167 A 64 LYS HGx A 64 LYS HE3 1.0 1.8 3.4 3401 2167 A 64 LYS HGx A 64 LYS HE2 1.0 1.8 3.4 3402 2168 A 25 GLU HBx A 28 LYS HE2 1.0 2.0 6.0 3403 2168 A 25 GLU HBx A 28 LYS HE3 1.0 2.0 6.0 3404 2168 A 46 GLU HBy A 49 LYS HE3 1.0 2.0 6.0 3405 2168 A 29 LYS HE2 A 25 GLU HBx 1.0 2.0 6.0 3406 2168 A 29 LYS HE3 A 25 GLU HBx 1.0 2.0 6.0 3407 2169 A 39 GLU HGx A 38 SER H 1.0 1.9 6.0 3408 2169 A 39 GLU HGx A 40 PHE H 1.0 1.9 6.0 3409 2170 A 5 PRO HG3 A 5 PRO HA 1.0 1.8 4.0 3410 2170 A 80 PRO HA A 80 PRO HG3 1.0 1.8 4.0 3411 2170 A 5 PRO HG2 A 5 PRO HA 1.0 1.8 4.0 3412 2170 A 79 PRO HA A 80 PRO HG3 1.0 1.8 4.0 3413 2170 A 80 PRO HA A 80 PRO HG2 1.0 1.8 4.0 3414 2170 A 79 PRO HA A 80 PRO HG2 1.0 1.8 4.0 3415 2171 A 15 TYR HA A 15 TYR HE% 1.0 2.0 6.0 3416 2171 A 15 TYR HA A 18 PHE HD% 1.0 2.0 6.0 3417 2172 A 11 LYS HGx A 11 LYS HEx 1.0 1.6 3.0 3418 2172 A 58 LYS HGy A 58 LYS HEx 1.0 1.6 3.0 3419 2172 A 58 LYS HGx A 58 LYS HEx 1.0 1.6 3.0 3420 2173 A 23 ARG HDy A 24 GLU H 1.0 2.0 5.6 3421 2173 A 23 ARG HDy A 26 HIS H 1.0 2.0 5.6 3422 2174 A 54 LYS HE3 A 54 LYS HG3 1.0 1.7 2.9 3423 2174 A 54 LYS HE2 A 54 LYS HG2 1.0 1.7 2.9 3424 2174 A 42 LYS HE2 A 42 LYS HGx 1.0 1.7 2.9 3425 2174 A 54 LYS HE2 A 54 LYS HG3 1.0 1.7 2.9 3426 2174 A 54 LYS HE3 A 54 LYS HG2 1.0 1.7 2.9 3427 2174 A 43 LYS HE2 A 43 LYS HGx 1.0 1.7 2.9 3428 2174 A 42 LYS HE3 A 42 LYS HGx 1.0 1.7 2.9 3429 2175 A 35 VAL HGx% A 37 PHE HBy 1.0 1.9 5.3 3430 2175 A 35 VAL HGx% A 36 ASN HBy 1.0 1.9 5.3 3431 2175 A 35 VAL HGx% A 40 PHE HBy 1.0 1.9 5.3 3432 2176 A 15 TYR HD% B 43 LEU HBy 1.0 2.0 6.0 3433 2176 A 15 TYR HD% A 12 MET HBx 1.0 2.0 6.0 3434 2176 A 15 TYR HD% B 43 LEU HG 1.0 2.0 6.0 3435 2176 A 15 TYR HD% B 45 LEU HG 1.0 2.0 6.0 3436 2176 A 15 TYR HD% A 21 THR HG2% 1.0 2.0 6.0 3437 2176 A 15 TYR HD% B 45 LEU HBx 1.0 2.0 6.0 3438 2177 A 81 LYS H A 81 LYS HA 1.0 1.8 3.6 3439 2177 A 82 GLY H A 81 LYS HA 1.0 1.8 3.6 3440 2178 A 46 GLU HGx A 46 GLU HA 1.0 1.6 2.8 3441 2178 A 24 GLU HA A 24 GLU HGx 1.0 1.6 2.8 3442 2178 A 25 GLU HGx A 25 GLU HA 1.0 1.6 2.8 3443 2178 A 39 GLU HGx A 39 GLU HA 1.0 1.6 2.8 3444 2179 A 17 PHE HA A 21 THR HG2% 1.0 2.0 5.2 3445 2179 A 17 PHE HA A 12 MET HBx 1.0 2.0 5.2 3446 2179 A 21 THR HG2% A 22 CYS HA 1.0 2.0 5.2 3447 2180 A 40 PHE HD% A 40 PHE H 1.0 2.0 5.0 3448 2180 A 41 SER H A 40 PHE HD% 1.0 2.0 5.0 3449 2181 A 62 MET HE% A 48 TRP HH2 1.0 0.0 6.0 3450 2181 A 62 MET HE% A 17 PHE HZ 1.0 0.0 6.0 3451 2182 A 58 LYS HA A 58 LYS HEx 1.0 1.9 4.5 3452 2182 A 36 ASN HBx A 39 GLU HA 1.0 1.9 4.5 3453 2182 A 58 LYS HA A 61 ASP HBy 1.0 1.9 4.5 3454 2183 A 28 LYS HE2 A 25 GLU HA 1.0 1.8 4.0 3455 2183 A 54 LYS HE2 A 54 LYS HA 1.0 1.8 4.0 3456 2183 A 43 LYS HE3 A 43 LYS HA 1.0 1.8 4.0 3457 2183 A 54 LYS HE3 A 54 LYS HA 1.0 1.8 4.0 3458 2183 A 28 LYS HE3 A 25 GLU HA 1.0 1.8 4.0 3459 2183 A 43 LYS HE2 A 43 LYS HA 1.0 1.8 4.0 3460 2183 A 46 GLU HA A 49 LYS HE3 1.0 1.8 4.0 3461 2184 A 62 MET HGy A 62 MET HA 1.0 1.8 3.6 3462 2184 A 71 GLU HA A 71 GLU HBy 1.0 1.8 3.6 3463 2185 A 19 VAL HGx% A 20 GLN H 1.0 1.9 4.5 3464 2185 A 19 VAL HGx% B 44 MET H 1.0 1.9 4.5 3465 2185 A 19 VAL HGx% A 21 THR H 1.0 1.9 4.5 3466 2186 A 40 PHE H A 38 SER HA 1.0 2.0 5.4 3467 2186 A 41 SER H A 38 SER HA 1.0 2.0 5.4 3468 2187 A 16 ALA HB% B 54 PHE HZ 1.0 2.0 6.0 3469 2187 A 16 ALA HB% A 48 TRP HH2 1.0 2.0 6.0 3470 2187 A 16 ALA HB% A 17 PHE HZ 1.0 2.0 6.0 3471 2187 A 16 ALA HB% B 54 PHE HD% 1.0 2.0 6.0 3472 2188 A 41 SER HBx A 19 VAL HGx% 1.0 2.0 5.2 3473 2188 A 19 VAL HGx% A 18 PHE HA 1.0 2.0 5.2 3474 2188 A 23 ARG HA A 19 VAL HGx% 1.0 2.0 5.2 3475 2188 A 41 SER HA A 19 VAL HGx% 1.0 2.0 5.2 3476 2189 A 47 ARG HA A 47 ARG HDx 1.0 1.9 4.7 3477 2189 A 44 CYS HA A 47 ARG HDx 1.0 1.9 4.7 3478 2190 A 47 ARG HDy A 47 ARG HA 1.0 2.0 4.6 3479 2190 A 47 ARG HDy A 44 CYS HA 1.0 2.0 4.6 3480 2191 A 31 PRO HGy A 31 PRO HDy 1.0 1.5 2.5 3481 2191 A 79 PRO HDy A 79 PRO HGx 1.0 1.5 2.5 3482 2191 A 79 PRO HDx A 79 PRO HGx 1.0 1.5 2.5 3483 2192 A 29 LYS HE2 A 25 GLU HGx 1.0 1.7 3.3 3484 2192 A 29 LYS HE3 A 25 GLU HGx 1.0 1.7 3.3 3485 2192 A 39 GLU HGx A 36 ASN HBy 1.0 1.7 3.3 3486 2193 A 51 MET HE% A 48 TRP HH2 1.0 1.9 4.7 3487 2193 A 51 MET H A 51 MET HE% 1.0 1.9 4.7 3488 2194 A 36 ASN HBx A 36 ASN HD22 1.0 2.0 5.8 3489 2194 A 39 GLU H A 36 ASN HBx 1.0 2.0 5.8 3490 2195 A 58 LYS HGy A 58 LYS HEy 1.0 1.8 3.8 3491 2195 A 58 LYS HGx A 58 LYS HEy 1.0 1.8 3.8 3492 2195 A 11 LYS HGx A 11 LYS HEy 1.0 1.8 3.8 3493 2196 A 43 LYS HGx A 19 VAL HA 1.0 0.0 6.0 3494 2196 A 7 LYS HE3 A 2 LYS HGx 1.0 0.0 6.0 3495 2196 A 7 LYS HE2 A 2 LYS HGx 1.0 0.0 6.0 3496 2196 A 43 LYS HGx A 40 PHE HBy 1.0 0.0 6.0 3497 2197 A 27 LYS HD3 A 24 GLU HGx 1.0 1.8 4.0 3498 2197 A 46 GLU HGx A 49 LYS HGx 1.0 1.8 4.0 3499 2197 A 28 LYS HD2 A 24 GLU HGx 1.0 1.8 4.0 3500 2197 A 46 GLU HGx A 49 LYS HD2 1.0 1.8 4.0 3501 2197 A 28 LYS HD2 A 25 GLU HGx 1.0 1.8 4.0 3502 2197 A 28 LYS HD3 A 25 GLU HGx 1.0 1.8 4.0 3503 2197 A 28 LYS HD3 A 24 GLU HGx 1.0 1.8 4.0 3504 2197 A 27 LYS HD2 A 24 GLU HGx 1.0 1.8 4.0 3505 2198 A 72 ARG HA A 72 ARG HB3 1.0 1.6 3.0 3506 2198 A 72 ARG HA A 72 ARG HB2 1.0 1.6 3.0 3507 2198 A 39 GLU HBy A 39 GLU HA 1.0 1.6 3.0 3508 2199 A 75 LYS HGx A 75 LYS HA 1.0 1.8 3.6 3509 2199 A 64 LYS HGx A 64 LYS HA 1.0 1.8 3.6 3510 2200 A 24 GLU HGy A 24 GLU H 1.0 1.9 4.5 3511 2200 A 25 GLU HGy A 26 HIS H 1.0 1.9 4.5 3512 2200 A 25 GLU HGy A 25 GLU H 1.0 1.9 4.5 3513 2200 A 24 GLU HGy A 25 GLU H 1.0 1.9 4.5 3514 2201 A 5 PRO HDy A 5 PRO HA 1.0 1.5 2.5 3515 2201 A 80 PRO HDy A 79 PRO HA 1.0 1.5 2.5 3516 2202 A 73 GLU HA A 73 GLU H 1.0 1.8 3.8 3517 2202 A 73 GLU HA A 74 MET H 1.0 1.8 3.8 3518 2203 A 77 TYR HD% A 79 PRO HGy 1.0 1.7 3.5 3519 2203 A 77 TYR HD% A 74 MET HE% 1.0 1.7 3.5 3520 2204 A 17 PHE HE% A 21 THR H 1.0 2.0 5.0 3521 2204 A 17 PHE HE% A 67 LYS H 1.0 2.0 5.0 3522 2205 A 25 GLU HBy A 29 LYS HE3 1.0 2.0 5.2 3523 2205 A 24 GLU HBx A 27 LYS HE2 1.0 2.0 5.2 3524 2205 A 24 GLU HBx A 27 LYS HE3 1.0 2.0 5.2 3525 2205 A 71 GLU HBy A 75 LYS HE3 1.0 2.0 5.2 3526 2205 A 71 GLU HBy A 75 LYS HE2 1.0 2.0 5.2 3527 2205 A 25 GLU HBy A 28 LYS HE3 1.0 2.0 5.2 3528 2205 A 25 GLU HBy A 28 LYS HE2 1.0 2.0 5.2 3529 2205 A 25 GLU HBy A 29 LYS HE2 1.0 2.0 5.2 3530 2206 A 19 VAL HGy% A 20 GLN HB2 1.0 2.0 5.2 3531 2206 A 19 VAL HGy% A 18 PHE HBx 1.0 2.0 5.2 3532 2206 A 19 VAL HGy% B 44 MET HE% 1.0 2.0 5.2 3533 2207 A 27 LYS HA A 30 HIS HD2 1.0 0.0 6.0 3534 2207 A 29 LYS HA A 30 HIS HD2 1.0 0.0 6.0 3535 2208 A 58 LYS HA A 58 LYS HEy 1.0 2.0 6.0 3536 2208 A 67 LYS HA A 11 LYS HEy 1.0 2.0 6.0 3537 2208 A 11 LYS HA A 11 LYS HEy 1.0 2.0 6.0 3538 2209 A 16 ALA H A 15 TYR HA 1.0 2.0 5.0 3539 2209 A 15 TYR H A 15 TYR HA 1.0 2.0 5.0 3540 2210 A 62 MET HBx A 63 ALA HA 1.0 2.0 5.2 3541 2210 A 59 PHE HA A 62 MET HBx 1.0 2.0 5.2 3542 2211 A 51 MET HG3 A 50 THR HG2% 1.0 0.0 6.0 3543 2211 A 50 THR HG2% A 46 GLU HGy 1.0 0.0 6.0 3544 2212 A 48 TRP HZ2 A 14 SER HBx 1.0 2.0 6.0 3545 2212 A 48 TRP HZ2 A 14 SER HBy 1.0 2.0 6.0 3546 2212 A 48 TRP HZ2 A 56 LYS HA 1.0 2.0 6.0 3547 2213 A 48 TRP HA A 18 PHE HD% 1.0 2.0 6.0 3548 2213 A 48 TRP HA A 48 TRP HZ3 1.0 2.0 6.0 3549 2214 A 20 GLN HB3 A 20 GLN H 1.0 1.8 3.8 3550 2214 A 20 GLN HB2 A 20 GLN H 1.0 1.8 3.8 3551 2214 A 20 GLN HB3 A 21 THR H 1.0 1.8 3.8 3552 2214 A 20 GLN HB2 A 21 THR H 1.0 1.8 3.8 3553 2215 A 28 LYS HGx A 25 GLU HGy 1.0 1.9 4.9 3554 2215 A 29 LYS HGx A 25 GLU HGy 1.0 1.9 4.9 3555 2215 A 28 LYS HGx A 24 GLU HGy 1.0 1.9 4.9 3556 2216 A 5 PRO HDx A 5 PRO HG2 1.0 1.4 2.4 3557 2216 A 80 PRO HDy A 80 PRO HG3 1.0 1.4 2.4 3558 2216 A 5 PRO HDx A 5 PRO HG3 1.0 1.4 2.4 3559 2216 A 5 PRO HDy A 5 PRO HG2 1.0 1.4 2.4 3560 2216 A 5 PRO HDy A 5 PRO HG3 1.0 1.4 2.4 3561 2217 A 27 LYS HB3 A 27 LYS HG3 1.0 1.6 2.6 3562 2217 A 27 LYS HB2 A 27 LYS HG2 1.0 1.6 2.6 3563 2217 A 28 LYS HBy A 28 LYS HGy 1.0 1.6 2.6 3564 2217 A 27 LYS HB3 A 27 LYS HG2 1.0 1.6 2.6 3565 2217 A 27 LYS HB2 A 27 LYS HG3 1.0 1.6 2.6 3566 2218 A 48 TRP HD1 A 49 LYS HBx 1.0 2.0 5.4 3567 2218 A 48 TRP HD1 A 49 LYS HBy 1.0 2.0 5.4 3568 2218 A 48 TRP HD1 B 44 MET HE% 1.0 2.0 5.4 3569 2219 A 19 VAL HGy% A 22 CYS H 1.0 1.9 6.0 3570 2219 A 19 VAL HGy% A 45 SER H 1.0 1.9 6.0 3571 2220 A 23 ARG HBy A 23 ARG HA 1.0 1.9 3.9 3572 2220 A 62 MET HA A 62 MET HBx 1.0 1.9 3.9 3573 2221 A 59 PHE HD% A 21 THR HG2% 1.0 2.0 5.2 3574 2221 A 12 MET HBx A 17 PHE HD% 1.0 2.0 5.2 3575 2222 A 16 ALA HB% B 44 MET HA 1.0 1.9 4.3 3576 2222 A 16 ALA HB% B 45 LEU HA 1.0 1.9 4.3 3577 2222 A 12 MET HA A 16 ALA HB% 1.0 1.9 4.3 3578 2223 A 73 GLU HGx A 73 GLU H 1.0 2.0 5.6 3579 2223 A 73 GLU HGx A 74 MET H 1.0 2.0 5.6 3580 2224 A 15 TYR HE% A 18 PHE HBy 1.0 2.0 6.0 3581 2224 A 15 TYR HE% B 44 MET HGx 1.0 2.0 6.0 3582 2225 A 15 TYR H A 15 TYR HD% 1.0 2.0 5.8 3583 2225 A 15 TYR HD% A 16 ALA H 1.0 2.0 5.8 3584 2226 A 15 TYR H A 15 TYR HBx 1.0 1.9 4.5 3585 2226 A 16 ALA H A 15 TYR HBx 1.0 1.9 4.5 3586 2227 B 45 LEU HD2% A 37 PHE HZ 1.0 0.0 6.0 3587 2227 B 45 LEU HD1% A 37 PHE HZ 1.0 0.0 6.0 3588 2227 B 50 ILE HG2% A 37 PHE HZ 1.0 0.0 6.0 3589 2228 A 19 VAL HGy% B 44 MET HGx 1.0 1.9 4.1 3590 2228 A 19 VAL HGy% A 44 CYS HBy 1.0 1.9 4.1 3591 2229 A 20 GLN HG3 A 16 ALA HB% 1.0 2.0 6.0 3592 2229 A 20 GLN HG3 A 23 ARG HGx 1.0 2.0 6.0 3593 2229 A 23 ARG HGy A 20 GLN HG3 1.0 2.0 6.0 3594 2229 A 20 GLN HG2 A 23 ARG HGx 1.0 2.0 6.0 3595 2229 A 20 GLN HG2 A 16 ALA HB% 1.0 2.0 6.0 3596 2230 A 49 LYS HBx A 49 LYS HGx 1.0 1.5 2.5 3597 2230 A 75 LYS HGx A 75 LYS HB3 1.0 1.5 2.5 3598 2230 A 49 LYS HBy A 49 LYS HD2 1.0 1.5 2.5 3599 2230 A 49 LYS HBx A 49 LYS HD2 1.0 1.5 2.5 3600 2230 A 49 LYS HBy A 49 LYS HGx 1.0 1.5 2.5 3601 2230 A 75 LYS HGx A 75 LYS HB2 1.0 1.5 2.5 3602 2230 A 49 LYS HBy A 49 LYS HD3 1.0 1.5 2.5 3603 2230 A 28 LYS HD2 A 28 LYS HBx 1.0 1.5 2.5 3604 2230 A 49 LYS HBx A 49 LYS HD3 1.0 1.5 2.5 3605 2231 A 40 PHE HD% A 19 VAL HGx% 1.0 1.8 3.8 3606 2231 B 45 LEU HD1% A 40 PHE HE% 1.0 1.8 3.8 3607 2231 A 19 VAL HGx% A 40 PHE HE% 1.0 1.8 3.8 3608 2232 A 74 MET HE% A 75 LYS H 1.0 2.0 5.6 3609 2232 A 77 TYR H A 74 MET HE% 1.0 2.0 5.6 3610 2233 A 27 LYS HB3 A 27 LYS HE2 1.0 1.8 3.8 3611 2233 A 28 LYS HBy A 28 LYS HE2 1.0 1.8 3.8 3612 2233 A 27 LYS HB2 A 27 LYS HE2 1.0 1.8 3.8 3613 2233 A 42 LYS HBy A 42 LYS HE2 1.0 1.8 3.8 3614 2233 A 27 LYS HB3 A 27 LYS HE3 1.0 1.8 3.8 3615 2233 A 28 LYS HBy A 28 LYS HE3 1.0 1.8 3.8 3616 2233 A 27 LYS HB2 A 27 LYS HE3 1.0 1.8 3.8 3617 2234 A 11 LYS H A 11 LYS HEy 1.0 2.0 6.0 3618 2234 A 59 PHE HD% A 58 LYS HEy 1.0 2.0 6.0 3619 2235 A 7 LYS HBx A 7 LYS HE3 1.0 2.0 5.8 3620 2235 A 7 LYS HBx A 7 LYS HE2 1.0 2.0 5.8 3621 2235 A 7 LYS HBx A 8 PRO HDy 1.0 2.0 5.8 3622 2236 A 28 LYS HGy A 28 LYS HBx 1.0 1.5 2.5 3623 2236 A 64 LYS HB2 A 64 LYS HGy 1.0 1.5 2.5 3624 2236 A 75 LYS HGy A 75 LYS HB2 1.0 1.5 2.5 3625 2236 A 75 LYS HGy A 75 LYS HB3 1.0 1.5 2.5 3626 2236 A 67 LYS HBy A 67 LYS HG3 1.0 1.5 2.5 3627 2236 A 67 LYS HBy A 67 LYS HG2 1.0 1.5 2.5 3628 2236 A 64 LYS HB3 A 64 LYS HGy 1.0 1.5 2.5 3629 2236 A 42 LYS HGy A 42 LYS HBx 1.0 1.5 2.5 3630 2237 A 62 MET HBy A 61 ASP HA 1.0 2.0 6.0 3631 2237 A 59 PHE HA A 62 MET HBy 1.0 2.0 6.0 3632 2238 A 17 PHE HA A 19 VAL HA 1.0 1.9 6.0 3633 2238 A 19 VAL HA A 44 CYS HA 1.0 1.9 6.0 3634 2238 A 19 VAL HA A 22 CYS HA 1.0 1.9 6.0 3635 2238 A 19 VAL HA A 21 THR HA 1.0 1.9 6.0 3636 2239 A 62 MET HE% A 21 THR H 1.0 0.0 6.0 3637 2239 A 17 PHE H A 62 MET HE% 1.0 0.0 6.0 3638 2240 A 19 VAL HGx% A 23 ARG HDy 1.0 1.9 4.9 3639 2240 B 45 LEU HD1% A 23 ARG HDy 1.0 1.9 4.9 3640 2241 A 41 SER HA A 40 PHE HE% 1.0 1.9 4.9 3641 2241 A 40 PHE HD% A 41 SER HBx 1.0 1.9 4.9 3642 2241 A 23 ARG HA A 40 PHE HE% 1.0 1.9 4.9 3643 2241 A 41 SER HA A 40 PHE HD% 1.0 1.9 4.9 3644 2242 A 6 LYS HD2 A 6 LYS HE3 1.0 1.2 2.2 3645 2242 A 27 LYS HD3 A 27 LYS HE3 1.0 1.2 2.2 3646 2242 A 28 LYS HD2 A 28 LYS HE2 1.0 1.2 2.2 3647 2242 A 75 LYS HDy A 75 LYS HE3 1.0 1.2 2.2 3648 2242 A 81 LYS HD3 A 81 LYS HE2 1.0 1.2 2.2 3649 2242 A 28 LYS HD3 A 28 LYS HE3 1.0 1.2 2.2 3650 2242 A 27 LYS HD3 A 27 LYS HE2 1.0 1.2 2.2 3651 2242 A 81 LYS HD3 A 81 LYS HE3 1.0 1.2 2.2 3652 2242 A 28 LYS HD3 A 28 LYS HE2 1.0 1.2 2.2 3653 2242 A 81 LYS HD2 A 81 LYS HE2 1.0 1.2 2.2 3654 2242 A 6 LYS HD2 A 6 LYS HE2 1.0 1.2 2.2 3655 2242 A 6 LYS HD3 A 6 LYS HE2 1.0 1.2 2.2 3656 2242 A 27 LYS HD2 A 27 LYS HE3 1.0 1.2 2.2 3657 2242 A 27 LYS HD2 A 27 LYS HE2 1.0 1.2 2.2 3658 2242 A 6 LYS HD3 A 6 LYS HE3 1.0 1.2 2.2 3659 2243 A 21 THR HA A 24 GLU HGx 1.0 1.8 3.8 3660 2243 A 20 GLN HG2 A 21 THR HA 1.0 1.8 3.8 3661 2243 A 24 GLU HBy A 21 THR HA 1.0 1.8 3.8 3662 2244 A 41 SER HBx A 35 VAL HGy% 1.0 2.0 5.4 3663 2244 A 41 SER HA A 35 VAL HGy% 1.0 2.0 5.4 3664 2244 A 23 ARG HA A 35 VAL HGy% 1.0 2.0 5.4 3665 2245 A 8 PRO HDy A 74 MET HE% 1.0 1.8 3.4 3666 2245 A 77 TYR HBy A 74 MET HE% 1.0 1.8 3.4 3667 2246 A 27 LYS HB2 A 27 LYS HG2 1.0 1.5 2.5 3668 2246 A 27 LYS HB3 A 27 LYS HG2 1.0 1.5 2.5 3669 2246 A 28 LYS HBy A 28 LYS HGy 1.0 1.5 2.5 3670 2246 A 27 LYS HB2 A 27 LYS HG3 1.0 1.5 2.5 3671 2246 A 27 LYS HB3 A 27 LYS HG3 1.0 1.5 2.5 3672 2246 A 42 LYS HBy A 42 LYS HGy 1.0 1.5 2.5 3673 2247 A 63 ALA HB% A 14 SER HBy 1.0 1.8 3.6 3674 2247 A 63 ALA HB% A 14 SER HBx 1.0 1.8 3.6 3675 2247 A 64 LYS HA A 63 ALA HB% 1.0 1.8 3.6 3676 2248 A 71 GLU HBy A 68 ALA HB% 1.0 1.9 4.5 3677 2248 A 65 ALA HB% A 67 LYS HBx 1.0 1.9 4.5 3678 2249 A 6 LYS HA A 6 LYS HD3 1.0 1.7 3.3 3679 2249 A 81 LYS HA A 81 LYS HD3 1.0 1.7 3.3 3680 2249 A 81 LYS HA A 81 LYS HD2 1.0 1.7 3.3 3681 2250 A 35 VAL HGx% A 42 LYS HBy 1.0 0.0 6.0 3682 2250 A 35 VAL HGx% A 27 LYS HB2 1.0 0.0 6.0 3683 2250 A 35 VAL HGx% A 27 LYS HB3 1.0 0.0 6.0 3684 2251 A 58 LYS HD2 A 58 LYS HEx 1.0 1.4 2.2 3685 2251 A 58 LYS HD3 A 58 LYS HEx 1.0 1.4 2.2 3686 2251 A 11 LYS HDy A 11 LYS HEx 1.0 1.4 2.2 3687 2252 A 15 TYR HE% A 49 LYS HE2 1.0 2.0 6.0 3688 2252 A 15 TYR HA A 15 TYR HE% 1.0 2.0 6.0 3689 2253 A 20 GLN HG2 A 21 THR HG2% 1.0 1.9 4.9 3690 2253 A 20 GLN HG3 A 21 THR HG2% 1.0 1.9 4.9 3691 2253 A 24 GLU HBy A 21 THR HG2% 1.0 1.9 4.9 3692 2254 A 30 HIS HBx A 29 LYS H 1.0 2.0 5.4 3693 2254 A 30 HIS HBx A 26 HIS HE1 1.0 2.0 5.4 3694 2254 A 33 ALA H A 30 HIS HBx 1.0 2.0 5.4 3695 2255 A 43 LYS HE2 A 40 PHE HA 1.0 1.6 2.8 3696 2255 A 54 LYS HE2 A 54 LYS HA 1.0 1.6 2.8 3697 2255 A 24 GLU HA A 27 LYS HE3 1.0 1.6 2.8 3698 2255 A 43 LYS HE3 A 40 PHE HA 1.0 1.6 2.8 3699 2255 A 24 GLU HA A 27 LYS HE2 1.0 1.6 2.8 3700 2255 A 54 LYS HE3 A 54 LYS HA 1.0 1.6 2.8 3701 2255 A 42 LYS HE2 A 42 LYS HA 1.0 1.6 2.8 3702 2255 A 49 LYS HA A 49 LYS HE2 1.0 1.6 2.8 3703 2255 A 42 LYS HE3 A 42 LYS HA 1.0 1.6 2.8 3704 2256 A 67 LYS HA A 68 ALA HB% 1.0 2.0 5.0 3705 2256 A 65 ALA HB% A 64 LYS HA 1.0 2.0 5.0 3706 2256 A 68 ALA HB% A 69 ARG HA 1.0 2.0 5.0 3707 2257 A 23 ARG HBy A 24 GLU H 1.0 1.8 4.0 3708 2257 A 23 ARG HBy A 26 HIS H 1.0 1.8 4.0 3709 2258 A 11 LYS HB3 A 70 TYR HE% 1.0 2.0 6.0 3710 2258 A 11 LYS HB2 A 70 TYR HE% 1.0 2.0 6.0 3711 2258 A 8 PRO HBy A 70 TYR HE% 1.0 2.0 6.0 3712 2259 A 37 PHE HE% B 51 GLU HG3 1.0 2.0 6.0 3713 2259 A 37 PHE HE% B 51 GLU HG2 1.0 2.0 6.0 3714 2259 A 37 PHE HE% B 47 PRO HBx 1.0 2.0 6.0 3715 2260 A 74 MET HBy A 7 LYS HA 1.0 2.0 5.6 3716 2260 A 74 MET HBx A 7 LYS HA 1.0 2.0 5.6 3717 2260 A 7 LYS HA A 6 LYS HBx 1.0 2.0 5.6 3718 2261 A 28 LYS HBy A 29 LYS H 1.0 1.5 2.7 3719 2261 A 28 LYS HBy A 28 LYS H 1.0 1.5 2.7 3720 2261 A 27 LYS HB3 A 28 LYS H 1.0 1.5 2.7 3721 2261 A 42 LYS HBy A 42 LYS H 1.0 1.5 2.7 3722 2262 A 61 ASP HBy A 61 ASP H 1.0 1.8 3.8 3723 2262 A 41 SER H A 40 PHE HBx 1.0 1.8 3.8 3724 2262 A 40 PHE HBx A 40 PHE H 1.0 1.8 3.8 3725 2263 A 62 MET HE% A 59 PHE H 1.0 1.9 3.9 3726 2263 A 62 MET HE% A 62 MET H 1.0 1.9 3.9 3727 2264 A 19 VAL HA B 44 MET HGx 1.0 1.9 5.3 3728 2264 A 22 CYS HBx A 19 VAL HA 1.0 1.9 5.3 3729 2265 A 69 ARG HA A 69 ARG HGy 1.0 1.6 3.0 3730 2265 A 58 LYS HD3 A 58 LYS HA 1.0 1.6 3.0 3731 2265 A 49 LYS HA A 49 LYS HGy 1.0 1.6 3.0 3732 2265 A 43 LYS HGy A 43 LYS HA 1.0 1.6 3.0 3733 2265 A 54 LYS HA A 54 LYS HG3 1.0 1.6 3.0 3734 2265 A 58 LYS HD2 A 58 LYS HA 1.0 1.6 3.0 3735 2265 A 54 LYS HA A 54 LYS HG2 1.0 1.6 3.0 3736 2266 A 33 ALA HB% A 26 HIS HE1 1.0 1.6 2.8 3737 2266 A 33 ALA H A 33 ALA HB% 1.0 1.6 2.8 3738 2267 A 67 LYS HBx A 64 LYS HA 1.0 1.8 3.8 3739 2267 A 67 LYS HBx A 67 LYS HA 1.0 1.8 3.8 3740 2268 A 51 MET HE% A 18 PHE HZ 1.0 2.0 4.8 3741 2268 A 47 ARG HGx A 18 PHE HZ 1.0 2.0 4.8 3742 2269 A 17 PHE HBx A 17 PHE HD% 1.0 1.9 4.5 3743 2269 A 59 PHE HBx A 59 PHE HD% 1.0 1.9 4.5 3744 2270 A 6 LYS HA A 6 LYS HBx 1.0 1.6 2.8 3745 2270 A 81 LYS HBy A 81 LYS HA 1.0 1.6 2.8 3746 2270 A 81 LYS HBx A 81 LYS HA 1.0 1.6 2.8 3747 2271 A 54 LYS HD3 A 54 LYS HE2 1.0 1.2 2.2 3748 2271 A 28 LYS HD2 A 28 LYS HE3 1.0 1.2 2.2 3749 2271 A 27 LYS HD3 A 27 LYS HE3 1.0 1.2 2.2 3750 2271 A 28 LYS HD2 A 28 LYS HE2 1.0 1.2 2.2 3751 2271 A 49 LYS HD3 A 49 LYS HE3 1.0 1.2 2.2 3752 2271 A 43 LYS HE3 A 43 LYS HDy 1.0 1.2 2.2 3753 2271 A 28 LYS HD3 A 28 LYS HE3 1.0 1.2 2.2 3754 2271 A 27 LYS HD3 A 27 LYS HE2 1.0 1.2 2.2 3755 2271 A 54 LYS HD2 A 54 LYS HE2 1.0 1.2 2.2 3756 2271 A 28 LYS HD3 A 28 LYS HE2 1.0 1.2 2.2 3757 2271 A 27 LYS HD2 A 27 LYS HE2 1.0 1.2 2.2 3758 2271 A 54 LYS HD3 A 54 LYS HE3 1.0 1.2 2.2 3759 2271 A 27 LYS HD2 A 27 LYS HE3 1.0 1.2 2.2 3760 2271 A 54 LYS HD2 A 54 LYS HE3 1.0 1.2 2.2 3761 2271 A 49 LYS HD2 A 49 LYS HE3 1.0 1.2 2.2 3762 2271 A 43 LYS HE2 A 43 LYS HDy 1.0 1.2 2.2 3763 2272 A 74 MET HA A 74 MET HGy 1.0 1.6 3.0 3764 2272 A 80 PRO HBx A 80 PRO HA 1.0 1.6 3.0 3765 2273 A 67 LYS HD3 A 67 LYS HG3 1.0 1.6 2.6 3766 2273 A 67 LYS HD3 A 67 LYS HG2 1.0 1.6 2.6 3767 2273 A 64 LYS HD3 A 64 LYS HGy 1.0 1.6 2.6 3768 2273 A 67 LYS HD2 A 67 LYS HG2 1.0 1.6 2.6 3769 2273 A 64 LYS HGy A 64 LYS HD2 1.0 1.6 2.6 3770 2274 A 28 LYS HGx A 28 LYS H 1.0 1.9 4.3 3771 2274 A 28 LYS HGx A 29 LYS H 1.0 1.9 4.3 3772 2274 A 42 LYS HGx A 42 LYS H 1.0 1.9 4.3 3773 2275 A 32 ASP HBx A 32 ASP HBy 1.0 1.2 2.2 3774 2275 A 4 ASP HBx A 4 ASP HBy 1.0 1.2 2.2 3775 2276 A 33 ALA HB% A 40 PHE HD% 1.0 0.0 6.0 3776 2276 A 33 ALA HB% A 26 HIS HD2 1.0 0.0 6.0 3777 2277 A 11 LYS HEx A 67 LYS H 1.0 2.0 5.8 3778 2277 A 56 LYS H A 58 LYS HEx 1.0 2.0 5.8 3779 2278 A 56 LYS HDx A 51 MET HE% 1.0 1.9 4.7 3780 2278 A 56 LYS HDx A 56 LYS HBy 1.0 1.9 4.7 3781 2279 A 72 ARG HA A 71 GLU H 1.0 1.9 4.7 3782 2279 A 72 ARG HA A 73 GLU H 1.0 1.9 4.7 3783 2280 A 26 HIS HA A 28 LYS H 1.0 1.9 4.5 3784 2280 A 26 HIS HA A 29 LYS H 1.0 1.9 4.5 3785 2281 A 6 LYS HD2 A 6 LYS HE3 1.0 1.2 2.2 3786 2281 A 64 LYS HD2 A 64 LYS HE3 1.0 1.2 2.2 3787 2281 A 6 LYS HD2 A 6 LYS HE2 1.0 1.2 2.2 3788 2281 A 75 LYS HDy A 75 LYS HE3 1.0 1.2 2.2 3789 2281 A 81 LYS HD3 A 81 LYS HE2 1.0 1.2 2.2 3790 2281 A 7 LYS HE3 A 7 LYS HD3 1.0 1.2 2.2 3791 2281 A 6 LYS HD3 A 6 LYS HE3 1.0 1.2 2.2 3792 2281 A 75 LYS HDy A 75 LYS HE2 1.0 1.2 2.2 3793 2281 A 81 LYS HD2 A 81 LYS HE3 1.0 1.2 2.2 3794 2281 A 81 LYS HD3 A 81 LYS HE3 1.0 1.2 2.2 3795 2281 A 81 LYS HD2 A 81 LYS HE2 1.0 1.2 2.2 3796 2281 A 7 LYS HD2 A 7 LYS HE3 1.0 1.2 2.2 3797 2281 A 6 LYS HD3 A 6 LYS HE2 1.0 1.2 2.2 3798 2281 A 64 LYS HD3 A 64 LYS HE3 1.0 1.2 2.2 3799 2281 A 64 LYS HD3 A 64 LYS HE2 1.0 1.2 2.2 3800 2281 A 64 LYS HE2 A 64 LYS HD2 1.0 1.2 2.2 3801 2281 A 7 LYS HE2 A 7 LYS HD3 1.0 1.2 2.2 3802 2282 A 8 PRO HGy A 70 TYR HD% 1.0 1.9 3.9 3803 2282 A 67 LYS HG2 A 70 TYR HD% 1.0 1.9 3.9 3804 2282 A 11 LYS HDy A 70 TYR HD% 1.0 1.9 3.9 3805 2282 A 8 PRO HBy A 70 TYR HD% 1.0 1.9 3.9 3806 2283 A 81 LYS H A 81 LYS HG2 1.0 2.0 5.0 3807 2283 A 2 LYS HGx A 2 LYS H 1.0 2.0 5.0 3808 2283 A 2 LYS HGy A 2 LYS H 1.0 2.0 5.0 3809 2283 A 6 LYS H A 6 LYS HG2 1.0 2.0 5.0 3810 2283 A 6 LYS H A 6 LYS HG3 1.0 2.0 5.0 3811 2284 A 27 LYS HA A 27 LYS HE3 1.0 1.7 3.1 3812 2284 A 49 LYS HA A 49 LYS HE2 1.0 1.7 3.1 3813 2284 A 27 LYS HA A 27 LYS HE2 1.0 1.7 3.1 3814 2284 A 43 LYS HE2 A 40 PHE HA 1.0 1.7 3.1 3815 2284 A 43 LYS HE3 A 40 PHE HA 1.0 1.7 3.1 3816 2285 A 80 PRO HBy A 80 PRO HDx 1.0 1.8 3.6 3817 2285 A 80 PRO HDx A 79 PRO HBy 1.0 1.8 3.6 3818 2286 A 12 MET HA A 13 SER HBx 1.0 2.0 5.4 3819 2286 A 12 MET HA A 11 LYS HA 1.0 2.0 5.4 3820 2287 A 71 GLU HA A 70 TYR HE% 1.0 1.9 4.5 3821 2287 A 23 ARG HA A 40 PHE HE% 1.0 1.9 4.5 3822 2287 A 23 ARG HA A 40 PHE HZ 1.0 1.9 4.5 3823 2288 A 58 LYS HBy A 55 GLU HA 1.0 1.7 3.5 3824 2288 A 58 LYS HBy A 58 LYS HA 1.0 1.7 3.5 3825 2289 A 56 LYS HBx A 56 LYS HGx 1.0 1.8 3.6 3826 2289 A 7 LYS HBx A 7 LYS HGy 1.0 1.8 3.6 3827 2290 A 39 GLU HBx A 40 PHE HBy 1.0 2.0 5.2 3828 2290 A 39 GLU HBx A 36 ASN HBy 1.0 2.0 5.2 3829 2291 A 77 TYR HE% A 7 LYS HE2 1.0 1.9 4.5 3830 2291 A 8 PRO HDy A 77 TYR HE% 1.0 1.9 4.5 3831 2291 A 77 TYR HBy A 77 TYR HE% 1.0 1.9 4.5 3832 2292 A 7 LYS HBx A 7 LYS HA 1.0 1.8 3.8 3833 2292 A 56 LYS HBx A 53 ALA HA 1.0 1.8 3.8 3834 2293 A 77 TYR HE% A 80 PRO HDy 1.0 1.9 3.7 3835 2293 A 7 LYS HA A 77 TYR HE% 1.0 1.9 3.7 3836 2294 A 40 PHE HZ A 47 ARG HDx 1.0 0.0 6.0 3837 2294 A 40 PHE HZ A 26 HIS HBy 1.0 0.0 6.0 3838 2295 A 49 LYS HE2 A 46 GLU H 1.0 0.0 6.0 3839 2295 A 49 LYS HE3 B 43 LEU H 1.0 0.0 6.0 3840 2295 A 49 LYS HE2 B 43 LEU H 1.0 0.0 6.0 3841 2295 A 30 HIS H A 29 LYS HE3 1.0 0.0 6.0 3842 2295 A 49 LYS HE3 A 46 GLU H 1.0 0.0 6.0 3843 2295 A 28 LYS HE2 A 27 LYS H 1.0 0.0 6.0 3844 2295 A 42 LYS HE2 A 46 GLU H 1.0 0.0 6.0 3845 2295 A 28 LYS HE3 A 27 LYS H 1.0 0.0 6.0 3846 2295 A 30 HIS H A 29 LYS HE2 1.0 0.0 6.0 3847 2295 A 49 LYS HE3 A 47 ARG H 1.0 0.0 6.0 3848 2295 A 49 LYS HE2 A 47 ARG H 1.0 0.0 6.0 3849 2295 A 27 LYS HE3 A 27 LYS H 1.0 0.0 6.0 3850 2295 A 42 LYS HE3 A 46 GLU H 1.0 0.0 6.0 3851 2295 A 27 LYS HE2 A 27 LYS H 1.0 0.0 6.0 3852 2296 A 17 PHE HA A 19 VAL HGx% 1.0 2.0 6.0 3853 2296 A 17 PHE HA B 45 LEU HD1% 1.0 2.0 6.0 3854 2296 A 17 PHE HA B 45 LEU HD2% 1.0 2.0 6.0 3855 2297 A 19 VAL HGx% A 15 TYR HE% 1.0 1.9 4.7 3856 2297 A 15 TYR HE% B 43 LEU HD1% 1.0 1.9 4.7 3857 2298 A 15 TYR HD% A 17 PHE HA 1.0 2.0 6.0 3858 2298 A 15 TYR HD% A 45 SER HBy 1.0 2.0 6.0 3859 2298 A 15 TYR HD% A 14 SER HBx 1.0 2.0 6.0 3860 2298 A 15 TYR HD% A 14 SER HBy 1.0 2.0 6.0 3861 2298 A 15 TYR HD% A 13 SER HBx 1.0 2.0 6.0 3862 2299 A 24 GLU HGy A 28 LYS H 1.0 2.0 5.8 3863 2299 A 25 GLU HGy A 29 LYS H 1.0 2.0 5.8 3864 2299 A 25 GLU HGy A 28 LYS H 1.0 2.0 5.8 3865 2300 A 2 LYS HGx A 2 LYS H 1.0 2.0 4.6 3866 2300 A 6 LYS H A 6 LYS HG2 1.0 2.0 4.6 3867 2300 A 6 LYS H A 6 LYS HG3 1.0 2.0 4.6 3868 2301 A 58 LYS HEy A 59 PHE H 1.0 1.9 5.1 3869 2301 A 11 LYS HEy A 70 TYR HD% 1.0 1.9 5.1 3870 2302 A 27 LYS HG2 A 28 LYS H 1.0 1.9 3.9 3871 2302 A 75 LYS HGy A 75 LYS H 1.0 1.9 3.9 3872 2302 A 28 LYS HGy A 29 LYS H 1.0 1.9 3.9 3873 2302 A 28 LYS HGy A 28 LYS H 1.0 1.9 3.9 3874 2303 A 67 LYS HBy A 68 ALA H 1.0 1.7 2.9 3875 2303 A 42 LYS HBx A 42 LYS H 1.0 1.7 2.9 3876 2303 A 75 LYS HB2 A 75 LYS H 1.0 1.7 2.9 3877 2303 A 75 LYS HB3 A 75 LYS H 1.0 1.7 2.9 3878 2303 A 28 LYS HBx A 28 LYS H 1.0 1.7 2.9 3879 2304 A 62 MET HE% A 22 CYS H 1.0 0.0 6.0 3880 2304 A 62 MET HE% A 60 GLU H 1.0 0.0 6.0 3881 2305 A 50 THR HA A 50 THR H 1.0 1.7 3.5 3882 2305 A 76 THR HA A 76 THR H 1.0 1.7 3.5 3883 2306 A 19 VAL HGx% A 21 THR HA 1.0 2.0 6.0 3884 2306 A 19 VAL HGx% A 40 PHE HA 1.0 2.0 6.0 3885 2306 A 17 PHE HA A 19 VAL HGx% 1.0 2.0 6.0 3886 2306 A 19 VAL HGx% A 44 CYS HA 1.0 2.0 6.0 3887 2306 A 19 VAL HGx% A 22 CYS HA 1.0 2.0 6.0 3888 2306 A 37 PHE HA A 19 VAL HGx% 1.0 2.0 6.0 3889 2307 A 19 VAL HB A 18 PHE HE% 1.0 2.0 5.4 3890 2307 A 47 ARG HGx A 18 PHE HE% 1.0 2.0 5.4 3891 2307 A 51 MET HE% A 18 PHE HE% 1.0 2.0 5.4 3892 2308 A 61 ASP HBx A 60 GLU HBy 1.0 2.0 6.0 3893 2308 A 61 ASP HBx A 62 MET HGy 1.0 2.0 6.0 3894 2309 A 59 PHE HD% A 55 GLU HBy 1.0 2.0 6.0 3895 2309 A 55 GLU H A 55 GLU HBy 1.0 2.0 6.0 3896 2310 A 7 LYS HBx A 8 PRO HA 1.0 2.0 5.4 3897 2310 A 7 LYS HBx A 6 LYS HA 1.0 2.0 5.4 3898 2311 A 73 GLU HBy A 73 GLU H 1.0 1.9 4.5 3899 2311 A 73 GLU HBy A 74 MET H 1.0 1.9 4.5 3900 2312 A 19 VAL HGy% A 18 PHE H 1.0 2.0 5.2 3901 2312 A 19 VAL HGy% A 20 GLN H 1.0 2.0 5.2 3902 2312 A 19 VAL HGy% B 44 MET H 1.0 2.0 5.2 3903 2313 A 30 HIS HBy A 29 LYS HA 1.0 2.0 6.0 3904 2313 A 27 LYS HA A 30 HIS HBy 1.0 2.0 6.0 3905 2314 A 79 PRO HBx A 80 PRO HDy 1.0 1.9 4.5 3906 2314 A 5 PRO HDy A 5 PRO HBx 1.0 1.9 4.5 3907 2314 A 80 PRO HBx A 80 PRO HDy 1.0 1.9 4.5 3908 2314 A 5 PRO HDx A 5 PRO HBx 1.0 1.9 4.5 3909 2315 A 63 ALA HB% A 62 MET H 1.0 1.9 4.3 3910 2315 A 17 PHE HE% A 63 ALA HB% 1.0 1.9 4.3 3911 2316 A 43 LYS HGx A 40 PHE HA 1.0 1.7 2.9 3912 2316 A 54 LYS HA A 54 LYS HG3 1.0 1.7 2.9 3913 2316 A 69 ARG HGx A 69 ARG HA 1.0 1.7 2.9 3914 2316 A 43 LYS HGx A 43 LYS HA 1.0 1.7 2.9 3915 2316 A 42 LYS HA A 42 LYS HGx 1.0 1.7 2.9 3916 2316 A 54 LYS HA A 54 LYS HG2 1.0 1.7 2.9 3917 2317 A 12 MET HE% A 17 PHE HZ 1.0 2.0 5.0 3918 2317 A 12 MET HE% B 54 PHE HD% 1.0 2.0 5.0 3919 2318 A 23 ARG HGy A 19 VAL HGy% 1.0 2.0 6.0 3920 2318 A 19 VAL HGy% A 16 ALA HB% 1.0 2.0 6.0 3921 2319 A 51 MET HE% A 48 TRP HH2 1.0 1.9 4.9 3922 2319 A 56 LYS HBy A 48 TRP HH2 1.0 1.9 4.9 3923 2320 A 12 MET HE% B 45 LEU HA 1.0 2.0 4.8 3924 2320 A 12 MET HA A 12 MET HE% 1.0 2.0 4.8 3925 2321 A 63 ALA HB% A 60 GLU HA 1.0 1.6 2.8 3926 2321 A 63 ALA HB% A 63 ALA HA 1.0 1.6 2.8 3927 2322 A 17 PHE HE% A 21 THR HG2% 1.0 1.9 4.7 3928 2322 A 17 PHE HE% A 12 MET HBx 1.0 1.9 4.7 3929 2323 A 42 LYS HBy A 42 LYS HGx 1.0 1.4 2.4 3930 2323 A 54 LYS HB3 A 54 LYS HG3 1.0 1.4 2.4 3931 2323 A 54 LYS HB2 A 54 LYS HG2 1.0 1.4 2.4 3932 2323 A 6 LYS HBx A 6 LYS HG2 1.0 1.4 2.4 3933 2323 A 28 LYS HBy A 28 LYS HGx 1.0 1.4 2.4 3934 2323 A 42 LYS HBy A 42 LYS HGy 1.0 1.4 2.4 3935 2323 A 54 LYS HB3 A 54 LYS HG2 1.0 1.4 2.4 3936 2323 A 54 LYS HB2 A 54 LYS HG3 1.0 1.4 2.4 3937 2323 A 6 LYS HBx A 6 LYS HG3 1.0 1.4 2.4 3938 2324 A 27 LYS HG3 A 27 LYS HE3 1.0 1.6 3.0 3939 2324 A 43 LYS HE3 A 43 LYS HGy 1.0 1.6 3.0 3940 2324 A 75 LYS HGy A 75 LYS HE3 1.0 1.6 3.0 3941 2324 A 27 LYS HG3 A 27 LYS HE2 1.0 1.6 3.0 3942 2324 A 43 LYS HE2 A 43 LYS HGy 1.0 1.6 3.0 3943 2324 A 27 LYS HG2 A 27 LYS HE2 1.0 1.6 3.0 3944 2324 A 75 LYS HGy A 75 LYS HE2 1.0 1.6 3.0 3945 2325 A 70 TYR HD% A 11 LYS HEx 1.0 1.9 4.5 3946 2325 A 70 TYR HD% A 71 GLU HGx 1.0 1.9 4.5 3947 2326 A 41 SER HA A 35 VAL HGx% 1.0 1.9 4.5 3948 2326 A 34 SER HB2 A 35 VAL HGx% 1.0 1.9 4.5 3949 2326 A 23 ARG HA A 35 VAL HGx% 1.0 1.9 4.5 3950 2327 A 21 THR HA A 25 GLU HBx 1.0 2.0 5.2 3951 2327 A 24 GLU HBx A 21 THR HA 1.0 2.0 5.2 3952 2328 A 24 GLU HGy A 28 LYS HE2 1.0 1.8 3.8 3953 2328 A 25 GLU HGy A 28 LYS HE2 1.0 1.8 3.8 3954 2328 A 29 LYS HE2 A 25 GLU HGy 1.0 1.8 3.8 3955 2328 A 29 LYS HE3 A 25 GLU HGy 1.0 1.8 3.8 3956 2328 A 24 GLU HGy A 28 LYS HE3 1.0 1.8 3.8 3957 2329 A 67 LYS HBx A 65 ALA HA 1.0 2.0 4.8 3958 2329 A 68 ALA HA A 71 GLU HBy 1.0 2.0 4.8 3959 2330 A 39 GLU HGx A 42 LYS H 1.0 2.0 5.6 3960 2330 A 25 GLU HGx A 28 LYS H 1.0 2.0 5.6 3961 2330 A 24 GLU HGx A 28 LYS H 1.0 2.0 5.6 3962 2330 A 25 GLU HGx A 29 LYS H 1.0 2.0 5.6 3963 2331 A 7 LYS H A 7 LYS HBx 1.0 1.8 3.4 3964 2331 A 56 LYS HBx A 57 GLY H 1.0 1.8 3.4 3965 2332 A 2 LYS HA A 2 LYS HB3 1.0 1.6 2.8 3966 2332 A 81 LYS HBx A 81 LYS HA 1.0 1.6 2.8 3967 2332 A 2 LYS HA A 2 LYS HB2 1.0 1.6 2.8 3968 2332 A 6 LYS HA A 6 LYS HBy 1.0 1.6 2.8 3969 2333 A 78 ILE H A 77 TYR HBy 1.0 2.0 4.8 3970 2333 A 39 GLU H A 36 ASN HBy 1.0 2.0 4.8 3971 2334 A 15 TYR HD% B 45 LEU HD2% 1.0 2.0 5.2 3972 2334 A 15 TYR HD% B 43 LEU HD1% 1.0 2.0 5.2 3973 2334 A 15 TYR HD% A 19 VAL HGx% 1.0 2.0 5.2 3974 2334 A 15 TYR HD% B 43 LEU HD2% 1.0 2.0 5.2 3975 2335 A 28 LYS HBy A 25 GLU HA 1.0 1.5 2.5 3976 2335 A 27 LYS HB2 A 24 GLU HA 1.0 1.5 2.5 3977 2335 A 54 LYS HB3 A 54 LYS HA 1.0 1.5 2.5 3978 2335 A 54 LYS HB2 A 54 LYS HA 1.0 1.5 2.5 3979 2335 A 27 LYS HB3 A 24 GLU HA 1.0 1.5 2.5 3980 2336 A 7 LYS H A 6 LYS HE3 1.0 0.0 6.0 3981 2336 A 64 LYS HE3 A 65 ALA H 1.0 0.0 6.0 3982 2336 A 64 LYS HE2 A 65 ALA H 1.0 0.0 6.0 3983 2336 A 7 LYS H A 7 LYS HE2 1.0 0.0 6.0 3984 2336 A 7 LYS H A 7 LYS HE3 1.0 0.0 6.0 3985 2337 A 78 ILE HG2% A 80 PRO HA 1.0 1.9 4.9 3986 2337 A 78 ILE HG2% A 79 PRO HA 1.0 1.9 4.9 3987 2338 A 77 TYR HE% A 80 PRO HG3 1.0 1.8 3.8 3988 2338 A 77 TYR HE% A 80 PRO HG2 1.0 1.8 3.8 3989 2338 A 77 TYR HE% A 79 PRO HGx 1.0 1.8 3.8 3990 2339 A 36 ASN HBx A 37 PHE HA 1.0 1.9 4.7 3991 2339 A 40 PHE HBx A 37 PHE HA 1.0 1.9 4.7 3992 2340 A 73 GLU HGy A 73 GLU H 1.0 1.9 5.5 3993 2340 A 73 GLU HGy A 74 MET H 1.0 1.9 5.5 3994 2341 A 62 MET HA A 59 PHE HA 1.0 2.0 5.6 3995 2341 A 71 GLU HA A 74 MET HA 1.0 2.0 5.6 3996 2341 A 62 MET HA A 63 ALA HA 1.0 2.0 5.6 3997 2341 A 62 MET HA A 61 ASP HA 1.0 2.0 5.6 3998 2342 A 7 LYS HBy A 7 LYS HE2 1.0 2.0 5.6 3999 2342 A 7 LYS HBy A 7 LYS HE3 1.0 2.0 5.6 4000 2342 A 7 LYS HBy A 8 PRO HDy 1.0 2.0 5.6 4001 2343 A 79 PRO HBx A 79 PRO HGy 1.0 1.6 2.6 4002 2343 A 5 PRO HG2 A 5 PRO HBx 1.0 1.6 2.6 4003 2343 A 5 PRO HG3 A 5 PRO HBx 1.0 1.6 2.6 4004 2344 A 17 PHE HBy A 12 MET HE% 1.0 2.0 5.6 4005 2344 A 16 ALA HA A 12 MET HE% 1.0 2.0 5.6 4006 2345 A 19 VAL HGy% A 41 SER HBx 1.0 2.0 4.8 4007 2345 A 19 VAL HGy% A 18 PHE HA 1.0 2.0 4.8 4008 2345 A 41 SER HA A 19 VAL HGy% 1.0 2.0 4.8 4009 2346 A 75 LYS HGy A 75 LYS HB2 1.0 1.5 2.5 4010 2346 A 49 LYS HBx A 49 LYS HGy 1.0 1.5 2.5 4011 2346 A 75 LYS HGy A 75 LYS HB3 1.0 1.5 2.5 4012 2346 A 64 LYS HB3 A 64 LYS HGy 1.0 1.5 2.5 4013 2346 A 64 LYS HB2 A 64 LYS HGy 1.0 1.5 2.5 4014 2347 A 28 LYS HD3 A 25 GLU HGy 1.0 1.9 4.1 4015 2347 A 28 LYS HD2 A 25 GLU HGy 1.0 1.9 4.1 4016 2347 A 28 LYS HD3 A 24 GLU HGy 1.0 1.9 4.1 4017 2347 A 24 GLU HGy A 27 LYS HD3 1.0 1.9 4.1 4018 2347 A 24 GLU HGy A 27 LYS HD2 1.0 1.9 4.1 4019 2347 A 28 LYS HD2 A 24 GLU HGy 1.0 1.9 4.1 4020 2347 A 49 LYS HD2 A 46 GLU HGy 1.0 1.9 4.1 4021 2348 A 59 PHE HD% A 56 LYS HBy 1.0 2.0 5.4 4022 2348 A 63 ALA HB% A 17 PHE HD% 1.0 2.0 5.4 4023 2348 A 59 PHE HD% A 51 MET HE% 1.0 2.0 5.4 4024 2349 A 56 LYS HDx A 48 TRP HD1 1.0 2.0 6.0 4025 2349 A 56 LYS HDy A 48 TRP HD1 1.0 2.0 6.0 4026 2349 A 48 TRP HD1 B 43 LEU HD1% 1.0 2.0 6.0 4027 2350 A 64 LYS HB2 A 64 LYS HE3 1.0 1.9 4.5 4028 2350 A 75 LYS HB3 A 75 LYS HE2 1.0 1.9 4.5 4029 2350 A 64 LYS HB2 A 64 LYS HE2 1.0 1.9 4.5 4030 2350 A 64 LYS HB3 A 64 LYS HE2 1.0 1.9 4.5 4031 2350 A 64 LYS HB3 A 64 LYS HE3 1.0 1.9 4.5 4032 2350 A 75 LYS HB3 A 75 LYS HE3 1.0 1.9 4.5 4033 2350 A 75 LYS HB2 A 75 LYS HE2 1.0 1.9 4.5 4034 2351 A 15 TYR HBy B 45 LEU HD1% 1.0 1.6 6.0 4035 2351 A 15 TYR HBy B 45 LEU HD2% 1.0 1.6 6.0 4036 2351 A 15 TYR HBy B 43 LEU HD1% 1.0 1.6 6.0 4037 2352 A 15 TYR HD% B 45 LEU HD2% 1.0 2.0 6.0 4038 2352 A 15 TYR HD% B 43 LEU HD1% 1.0 2.0 6.0 4039 2353 A 15 TYR HD% B 45 LEU HBx 1.0 1.9 6.0 4040 2353 A 15 TYR HD% B 45 LEU HG 1.0 1.9 6.0 4041 2353 A 15 TYR HD% B 43 LEU HG 1.0 1.9 6.0 4042 2353 A 15 TYR HD% B 43 LEU HBy 1.0 1.9 6.0 4043 2354 B 45 LEU HD1% A 37 PHE HE% 1.0 2.0 6.0 4044 2354 A 37 PHE HE% B 50 ILE HG2% 1.0 2.0 6.0 4045 2355 A 43 LYS HGx B 43 LEU HD1% 1.0 1.9 6.0 4046 2355 B 43 LEU HD1% A 42 LYS HGx 1.0 1.9 6.0 4047 2356 A 46 GLU HA B 43 LEU HD1% 1.0 2.0 6.0 4048 2356 B 43 LEU HD1% A 42 LYS HA 1.0 2.0 6.0 4049 2357 A 40 PHE HZ B 43 LEU HD1% 1.0 0.0 6.0 4050 2357 A 40 PHE HZ B 45 LEU HD1% 1.0 0.0 6.0 4051 2358 A 15 TYR HBx B 45 LEU HD2% 1.0 1.7 6.0 4052 2358 A 15 TYR HBy B 45 LEU HD1% 1.0 1.7 6.0 4053 2358 A 15 TYR HBy B 43 LEU HD1% 1.0 1.7 6.0 4054 2358 A 15 TYR HBy B 45 LEU HD2% 1.0 1.7 6.0 4055 2358 A 15 TYR HBx B 43 LEU HD2% 1.0 1.7 6.0 4056 2358 A 15 TYR HBx B 43 LEU HD1% 1.0 1.7 6.0 4057 2358 A 15 TYR HBy B 43 LEU HD2% 1.0 1.7 6.0 4058 2359 A 18 PHE HZ B 43 LEU HD1% 1.0 2.0 6.0 4059 2359 B 45 LEU HD2% A 37 PHE HZ 1.0 2.0 6.0 4060 2359 B 45 LEU HD1% A 37 PHE HZ 1.0 2.0 6.0 4061 2360 B 24 LYS H B 23 TRP HA 1.0 1.8 3.8 4062 2360 B 24 LYS H B 21 ASP HA 1.0 1.8 3.8 4063 2361 B 49 ASP H B 51 GLU HBy 1.0 2.0 6.0 4064 2361 B 49 ASP H B 50 ILE HB 1.0 2.0 6.0 4065 2362 B 28 GLU HBy B 30 ASN H 1.0 1.9 4.1 4066 2362 B 40 MET H B 40 MET HE% 1.0 1.9 4.1 4067 2362 B 40 MET H B 40 MET HBx 1.0 1.9 4.1 4068 2363 B 42 ASP H B 41 ASP HA 1.0 1.7 3.1 4069 2363 B 42 ASP H B 42 ASP HA 1.0 1.7 3.1 4070 2364 B 54 PHE HBx B 53 TRP H 1.0 1.9 4.1 4071 2364 B 53 TRP H B 53 TRP HB2 1.0 1.9 4.1 4072 2364 B 53 TRP H B 53 TRP HB3 1.0 1.9 4.1 4073 2365 B 45 LEU HD1% B 45 LEU H 1.0 2.0 5.2 4074 2365 A 19 VAL HGx% B 45 LEU H 1.0 2.0 5.2 4075 2365 B 45 LEU HD2% B 45 LEU H 1.0 2.0 5.2 4076 2366 B 45 LEU HBx B 44 MET H 1.0 2.0 5.4 4077 2366 B 43 LEU HG B 44 MET H 1.0 2.0 5.4 4078 2367 B 44 MET HA B 45 LEU H 1.0 1.7 3.1 4079 2367 B 45 LEU H B 45 LEU HA 1.0 1.7 3.1 4080 2368 B 56 GLU H B 56 GLU HA 1.0 1.7 3.1 4081 2368 B 56 GLU H B 55 THR HA 1.0 1.7 3.1 4082 2369 B 54 PHE H B 53 TRP HB2 1.0 1.8 3.6 4083 2369 B 54 PHE HBx B 54 PHE H 1.0 1.8 3.6 4084 2370 B 48 ASP HBy B 46 SER H 1.0 1.9 5.1 4085 2370 B 46 SER H B 49 ASP HBx 1.0 1.9 5.1 4086 2370 B 46 SER H B 49 ASP HBy 1.0 1.9 5.1 4087 2371 B 21 ASP H B 21 ASP HA 1.0 1.8 4.0 4088 2371 B 19 PHE H B 19 PHE HA 1.0 1.8 4.0 4089 2372 B 23 TRP H B 25 LEU HD2% 1.0 2.0 5.0 4090 2372 B 23 TRP H B 22 LEU HD1% 1.0 2.0 5.0 4091 2373 B 50 ILE HG2% B 46 SER H 1.0 2.0 5.6 4092 2373 B 45 LEU HD2% B 46 SER H 1.0 2.0 5.6 4093 2373 B 45 LEU HD1% B 46 SER H 1.0 2.0 5.6 4094 2374 B 21 ASP H B 18 THR HA 1.0 1.9 3.9 4095 2374 B 19 PHE H B 16 GLN HA 1.0 1.9 3.9 4096 2374 B 19 PHE H B 18 THR HA 1.0 1.9 3.9 4097 2374 B 21 ASP H B 20 SER HA 1.0 1.9 3.9 4098 2375 B 49 ASP H B 49 ASP HBx 1.0 1.8 3.4 4099 2375 B 49 ASP H B 48 ASP HBy 1.0 1.8 3.4 4100 2375 B 49 ASP H B 49 ASP HBy 1.0 1.8 3.4 4101 2376 B 31 VAL H B 32 LEU H 1.0 1.9 4.7 4102 2376 B 31 VAL H B 30 ASN H 1.0 1.9 4.7 4103 2377 B 48 ASP H B 50 ILE H 1.0 1.8 3.8 4104 2377 B 51 GLU H B 50 ILE H 1.0 1.8 3.8 4105 2378 B 22 LEU H B 19 PHE HA 1.0 1.8 3.8 4106 2378 B 22 LEU H B 21 ASP HA 1.0 1.8 3.8 4107 2379 B 19 PHE H B 20 SER H 1.0 1.9 5.3 4108 2379 B 21 ASP H B 20 SER H 1.0 1.9 5.3 4109 2380 B 29 ASN HD22 B 32 LEU HD1% 1.0 2.0 5.6 4110 2380 B 31 VAL HG1% B 29 ASN HD22 1.0 2.0 5.6 4111 2380 B 31 VAL HG2% B 29 ASN HD22 1.0 2.0 5.6 4112 2381 B 37 SER H B 37 SER HA 1.0 1.7 3.5 4113 2381 B 37 SER H B 36 PRO HA 1.0 1.7 3.5 4114 2382 B 22 LEU H B 18 THR HA 1.0 2.0 5.8 4115 2382 B 22 LEU H B 20 SER HA 1.0 2.0 5.8 4116 2383 B 38 GLN H B 37 SER HA 1.0 1.8 4.2 4117 2383 B 38 GLN H B 38 GLN HA 1.0 1.8 4.2 4118 2384 B 23 TRP HA B 23 TRP HE1 1.0 2.0 6.0 4119 2384 B 23 TRP HE1 B 21 ASP HA 1.0 2.0 6.0 4120 2385 B 23 TRP H B 21 ASP HA 1.0 1.8 3.6 4121 2385 B 23 TRP H B 23 TRP HA 1.0 1.8 3.6 4122 2386 B 51 GLU H B 50 ILE HB 1.0 1.7 3.3 4123 2386 B 51 GLU H B 51 GLU HBy 1.0 1.7 3.3 4124 2387 B 50 ILE HA B 49 ASP H 1.0 2.0 6.0 4125 2387 B 49 ASP H B 46 SER HBx 1.0 2.0 6.0 4126 2388 B 18 THR HA B 20 SER H 1.0 2.0 5.2 4127 2388 B 20 SER HA B 20 SER H 1.0 2.0 5.2 4128 2389 B 44 MET H B 45 LEU H 1.0 1.8 3.8 4129 2389 B 44 MET H B 43 LEU H 1.0 1.8 3.8 4130 2390 B 24 LYS H B 25 LEU H 1.0 1.6 3.0 4131 2390 B 24 LYS H B 23 TRP H 1.0 1.6 3.0 4132 2391 B 25 LEU H B 26 LEU HD1% 1.0 2.0 5.8 4133 2391 B 25 LEU H B 25 LEU HD1% 1.0 2.0 5.8 4134 2391 B 25 LEU H B 25 LEU HD2% 1.0 2.0 5.8 4135 2392 B 59 GLY H B 60 PRO HDy 1.0 2.0 6.0 4136 2392 B 59 GLY H B 60 PRO HDx 1.0 2.0 6.0 4137 2392 B 59 GLY H B 58 PRO HDy 1.0 2.0 6.0 4138 2393 B 30 ASN HD21 B 30 ASN HBy 1.0 1.7 3.1 4139 2393 B 29 ASN HBx B 29 ASN HD21 1.0 1.7 3.1 4140 2394 B 35 LEU H B 34 PRO HBx 1.0 1.8 4.0 4141 2394 B 56 GLU H B 56 GLU HBy 1.0 1.8 4.0 4142 2395 B 18 THR H B 17 GLU HA 1.0 1.8 3.6 4143 2395 B 18 THR H B 18 THR HA 1.0 1.8 3.6 4144 2396 B 28 GLU H B 27 PRO HBy 1.0 1.9 4.9 4145 2396 B 28 GLU H B 28 GLU HGx 1.0 1.9 4.9 4146 2396 B 28 GLU H B 28 GLU HGy 1.0 1.9 4.9 4147 2397 B 28 GLU H B 27 PRO HBx 1.0 1.8 3.6 4148 2397 B 28 GLU H B 28 GLU HBx 1.0 1.8 3.6 4149 2397 B 28 GLU H B 28 GLU HBy 1.0 1.8 3.6 4150 2398 B 56 GLU H B 56 GLU HGx 1.0 1.9 4.7 4151 2398 B 35 LEU H B 34 PRO HBy 1.0 1.9 4.7 4152 2398 B 56 GLU H B 56 GLU HGy 1.0 1.9 4.7 4153 2399 B 29 ASN HBx B 30 ASN H 1.0 2.0 5.6 4154 2399 B 30 ASN HBy B 30 ASN H 1.0 2.0 5.6 4155 2400 B 28 GLU H B 30 ASN H 1.0 2.0 5.6 4156 2400 B 28 GLU H B 29 ASN H 1.0 2.0 5.6 4157 2401 B 21 ASP HA B 20 SER H 1.0 2.0 5.0 4158 2401 B 19 PHE HA B 20 SER H 1.0 2.0 5.0 4159 2402 B 25 LEU HBy B 26 LEU H 1.0 1.8 3.4 4160 2402 B 25 LEU HBx B 26 LEU H 1.0 1.8 3.4 4161 2402 B 26 LEU H B 26 LEU HBx 1.0 1.8 3.4 4162 2403 B 51 GLU H B 49 ASP H 1.0 1.8 3.8 4163 2403 B 52 GLN H B 51 GLU H 1.0 1.8 3.8 4164 2404 B 31 VAL HG1% B 29 ASN HD21 1.0 1.9 4.9 4165 2404 B 30 ASN HD21 B 31 VAL HG2% 1.0 1.9 4.9 4166 2404 B 31 VAL HG2% B 29 ASN HD21 1.0 1.9 4.9 4167 2404 B 30 ASN HD21 B 32 LEU HD1% 1.0 1.9 4.9 4168 2404 B 30 ASN HD21 B 32 LEU HD2% 1.0 1.9 4.9 4169 2405 B 19 PHE H B 20 SER H 1.0 2.0 4.8 4170 2405 B 18 THR H B 19 PHE H 1.0 2.0 4.8 4171 2405 B 21 ASP H B 20 SER H 1.0 2.0 4.8 4172 2406 B 35 LEU H B 34 PRO HG2 1.0 1.9 4.5 4173 2406 B 56 GLU H B 56 GLU HBx 1.0 1.9 4.5 4174 2407 B 42 ASP H B 41 ASP HBx 1.0 1.7 3.3 4175 2407 B 42 ASP HBx B 42 ASP H 1.0 1.7 3.3 4176 2407 B 42 ASP HBy B 42 ASP H 1.0 1.7 3.3 4177 2408 A 19 VAL HGx% B 44 MET H 1.0 2.0 6.0 4178 2408 B 43 LEU HD2% B 44 MET H 1.0 2.0 6.0 4179 2409 B 54 PHE H B 53 TRP HA 1.0 1.8 4.0 4180 2409 B 54 PHE H B 54 PHE HA 1.0 1.8 4.0 4181 2410 B 14 LEU HD1% B 16 GLN HE21 1.0 2.0 4.4 4182 2410 B 30 ASN HD22 B 31 VAL HG2% 1.0 2.0 4.4 4183 2410 B 30 ASN HD22 B 32 LEU HD1% 1.0 2.0 4.4 4184 2410 B 32 LEU HD2% B 30 ASN HD22 1.0 2.0 4.4 4185 2411 B 24 LYS HA B 23 TRP H 1.0 1.9 4.3 4186 2411 B 23 TRP H B 22 LEU HA 1.0 1.9 4.3 4187 2412 B 49 ASP H B 48 ASP HA 1.0 1.8 3.6 4188 2412 B 49 ASP H B 49 ASP HA 1.0 1.8 3.6 4189 2413 B 44 MET HB3 B 42 ASP H 1.0 2.0 4.8 4190 2413 B 44 MET HE% B 42 ASP H 1.0 2.0 4.8 4191 2413 B 44 MET HB2 B 42 ASP H 1.0 2.0 4.8 4192 2413 B 42 ASP H B 40 MET HBx 1.0 2.0 4.8 4193 2414 B 52 GLN H B 51 GLU HG2 1.0 1.9 4.5 4194 2414 B 52 GLN HGy B 52 GLN H 1.0 1.9 4.5 4195 2414 B 52 GLN HGx B 52 GLN H 1.0 1.9 4.5 4196 2415 B 35 LEU HD1% B 36 PRO HA 1.0 2.0 5.0 4197 2415 B 34 PRO HA B 35 LEU HD1% 1.0 2.0 5.0 4198 2415 B 34 PRO HA B 35 LEU HD2% 1.0 2.0 5.0 4199 2416 B 55 THR H B 54 PHE HA 1.0 1.8 3.8 4200 2416 B 54 PHE H B 54 PHE HA 1.0 1.8 3.8 4201 2417 B 23 TRP HBy B 25 LEU HD1% 1.0 2.0 6.0 4202 2417 B 23 TRP HBy B 26 LEU HD2% 1.0 2.0 6.0 4203 2417 B 23 TRP HBy B 26 LEU HD1% 1.0 2.0 6.0 4204 2418 B 23 TRP H B 23 TRP HE3 1.0 2.0 5.6 4205 2418 B 26 LEU H B 23 TRP HE3 1.0 2.0 5.6 4206 2418 B 25 LEU H B 23 TRP HE3 1.0 2.0 5.6 4207 2419 B 14 LEU H B 14 LEU HD1% 1.0 2.0 5.6 4208 2419 B 35 LEU H B 35 LEU HD1% 1.0 2.0 5.6 4209 2419 B 32 LEU HD1% B 32 LEU H 1.0 2.0 5.6 4210 2419 B 15 SER H B 14 LEU HD1% 1.0 2.0 5.6 4211 2420 B 45 LEU HD1% B 53 TRP HE3 1.0 2.0 6.0 4212 2420 B 50 ILE HG2% B 53 TRP HE3 1.0 2.0 6.0 4213 2420 B 50 ILE HD1% B 53 TRP HE3 1.0 2.0 6.0 4214 2421 B 56 GLU HBy B 53 TRP HE3 1.0 0.0 6.0 4215 2421 A 9 ARG HGx B 53 TRP HE3 1.0 0.0 6.0 4216 2421 A 27 LYS HB2 B 53 TRP HE3 1.0 0.0 6.0 4217 2421 B 52 GLN HBx B 53 TRP HE3 1.0 0.0 6.0 4218 2421 B 52 GLN HBy B 53 TRP HE3 1.0 0.0 6.0 4219 2422 B 26 LEU HBy B 27 PRO HDy 1.0 1.9 4.3 4220 2422 B 35 LEU HBx B 36 PRO HDy 1.0 1.9 4.3 4221 2422 B 26 LEU HBx B 27 PRO HDy 1.0 1.9 4.3 4222 2423 B 43 LEU HBy B 44 MET HGy 1.0 2.0 5.6 4223 2423 B 45 LEU HG B 44 MET HGy 1.0 2.0 5.6 4224 2423 B 44 MET HGy B 45 LEU HBy 1.0 2.0 5.6 4225 2424 B 34 PRO HBy B 34 PRO HDx 1.0 2.0 4.6 4226 2424 B 58 PRO HDx B 58 PRO HBy 1.0 2.0 4.6 4227 2425 B 46 SER HBy B 49 ASP HBx 1.0 2.0 5.8 4228 2425 B 46 SER HBy B 49 ASP HBy 1.0 2.0 5.8 4229 2425 B 48 ASP HBy B 46 SER HBy 1.0 2.0 5.8 4230 2426 B 47 PRO HDx B 47 PRO HBx 1.0 1.9 4.3 4231 2426 B 34 PRO HBy B 34 PRO HDx 1.0 1.9 4.3 4232 2426 B 58 PRO HDx B 58 PRO HBy 1.0 1.9 4.3 4233 2427 B 22 LEU HBy B 23 TRP H 1.0 1.9 4.9 4234 2427 B 22 LEU H B 22 LEU HBy 1.0 1.9 4.9 4235 2428 B 45 LEU HD1% B 54 PHE HBx 1.0 2.0 5.4 4236 2428 B 19 PHE HBy B 22 LEU HD1% 1.0 2.0 5.4 4237 2429 B 24 LYS HBx B 23 TRP H 1.0 2.0 5.8 4238 2429 B 25 LEU H B 24 LYS HBx 1.0 2.0 5.8 4239 2430 B 23 TRP HA B 24 LYS HBy 1.0 1.8 4.2 4240 2430 B 25 LEU HBx B 23 TRP HA 1.0 1.8 4.2 4241 2430 B 25 LEU HG B 23 TRP HA 1.0 1.8 4.2 4242 2431 B 31 VAL HG1% B 28 GLU HBx 1.0 1.9 4.3 4243 2431 B 31 VAL HG2% B 28 GLU HBx 1.0 1.9 4.3 4244 2431 B 26 LEU HD1% B 28 GLU HBx 1.0 1.9 4.3 4245 2432 B 57 ASP H B 58 PRO HDx 1.0 2.0 4.4 4246 2432 B 58 PRO HDx B 59 GLY H 1.0 2.0 4.4 4247 2433 A 40 PHE HD% B 45 LEU HD2% 1.0 2.0 5.6 4248 2433 B 45 LEU HD2% A 37 PHE HE% 1.0 2.0 5.6 4249 2433 B 45 LEU HD2% B 53 TRP HZ3 1.0 2.0 5.6 4250 2434 B 26 LEU HD2% B 27 PRO HDy 1.0 2.0 6.0 4251 2434 B 35 LEU HD2% B 36 PRO HDy 1.0 2.0 6.0 4252 2435 B 24 LYS HBx B 25 LEU HD1% 1.0 2.0 5.6 4253 2435 B 24 LYS HBx B 26 LEU HD1% 1.0 2.0 5.6 4254 2435 B 24 LYS HBx B 25 LEU HD2% 1.0 2.0 5.6 4255 2436 B 50 ILE HD1% B 54 PHE H 1.0 2.0 6.0 4256 2436 B 50 ILE HD1% B 49 ASP H 1.0 2.0 6.0 4257 2437 B 52 GLN H B 50 ILE HG2% 1.0 2.0 6.0 4258 2437 B 50 ILE HG2% B 54 PHE H 1.0 2.0 6.0 4259 2437 B 50 ILE HG2% B 49 ASP H 1.0 2.0 6.0 4260 2438 B 42 ASP H B 40 MET HA 1.0 1.8 3.6 4261 2438 B 41 ASP H B 40 MET HA 1.0 1.8 3.6 4262 2439 B 53 TRP H B 52 GLN HA 1.0 1.9 3.7 4263 2439 B 52 GLN H B 52 GLN HA 1.0 1.9 3.7 4264 2440 B 59 GLY HAx B 60 PRO HA 1.0 2.0 5.6 4265 2440 B 59 GLY HAx B 58 PRO HA 1.0 2.0 5.6 4266 2441 B 24 LYS HA B 24 LYS HD3 1.0 1.7 3.1 4267 2441 B 25 LEU HG B 24 LYS HA 1.0 1.7 3.1 4268 2441 B 24 LYS HA B 24 LYS HD2 1.0 1.7 3.1 4269 2441 B 24 LYS HA B 24 LYS HBx 1.0 1.7 3.1 4270 2442 B 49 ASP H B 50 ILE HB 1.0 2.0 5.6 4271 2442 B 52 GLN H B 50 ILE HB 1.0 2.0 5.6 4272 2442 B 54 PHE H B 50 ILE HB 1.0 2.0 5.6 4273 2443 B 24 LYS H B 23 TRP HBy 1.0 2.0 5.8 4274 2443 B 23 TRP HBy B 23 TRP HE3 1.0 2.0 5.8 4275 2444 B 43 LEU H B 41 ASP HA 1.0 1.7 3.1 4276 2444 B 43 LEU H B 42 ASP HA 1.0 1.7 3.1 4277 2445 B 43 LEU HD1% B 42 ASP HBx 1.0 1.9 4.7 4278 2445 B 22 LEU HD1% B 21 ASP HBx 1.0 1.9 4.7 4279 2445 B 43 LEU HD2% B 42 ASP HBx 1.0 1.9 4.7 4280 2445 B 22 LEU HD2% B 21 ASP HBx 1.0 1.9 4.7 4281 2446 B 50 ILE HD1% A 37 PHE HZ 1.0 1.9 4.3 4282 2446 B 54 PHE HD% B 50 ILE HD1% 1.0 1.9 4.3 4283 2447 B 54 PHE HBx B 55 THR H 1.0 1.9 4.3 4284 2447 B 54 PHE HBx B 54 PHE H 1.0 1.9 4.3 4285 2448 A 41 SER HBy B 40 MET HGx 1.0 0.0 6.0 4286 2448 A 41 SER HBx B 40 MET HGx 1.0 0.0 6.0 4287 2448 B 40 MET HGx B 47 PRO HDy 1.0 0.0 6.0 4288 2449 B 32 LEU HBx B 32 LEU HA 1.0 1.7 3.1 4289 2449 B 45 LEU HBy B 45 LEU HA 1.0 1.7 3.1 4290 2450 B 54 PHE HD% B 54 PHE H 1.0 2.0 5.0 4291 2450 B 54 PHE HD% B 55 THR H 1.0 2.0 5.0 4292 2451 B 23 TRP H B 22 LEU HA 1.0 1.7 3.1 4293 2451 B 24 LYS HA B 26 LEU H 1.0 1.7 3.1 4294 2451 B 25 LEU H B 24 LYS HA 1.0 1.7 3.1 4295 2452 B 25 LEU HBx B 25 LEU HD2% 1.0 1.4 2.4 4296 2452 B 45 LEU HD2% B 45 LEU HBy 1.0 1.4 2.4 4297 2452 B 25 LEU HBy B 25 LEU HD2% 1.0 1.4 2.4 4298 2452 B 25 LEU HG B 25 LEU HD2% 1.0 1.4 2.4 4299 2452 B 45 LEU HD2% B 45 LEU HG 1.0 1.4 2.4 4300 2453 B 21 ASP HA B 21 ASP HBy 1.0 1.7 2.9 4301 2453 B 49 ASP HA B 49 ASP HBy 1.0 1.7 2.9 4302 2453 B 48 ASP HBy B 48 ASP HA 1.0 1.7 2.9 4303 2453 B 42 ASP HBy B 42 ASP HA 1.0 1.7 2.9 4304 2454 B 25 LEU H B 25 LEU HD1% 1.0 1.9 4.1 4305 2454 B 26 LEU H B 26 LEU HD1% 1.0 1.9 4.1 4306 2455 B 35 LEU HD2% B 35 LEU HG 1.0 1.5 2.7 4307 2455 B 35 LEU HD1% B 35 LEU HG 1.0 1.5 2.7 4308 2455 B 26 LEU HD1% B 26 LEU HG 1.0 1.5 2.7 4309 2455 B 26 LEU HD2% B 26 LEU HG 1.0 1.5 2.7 4310 2456 A 23 ARG HDx B 50 ILE HG2% 1.0 1.9 4.3 4311 2456 A 23 ARG HDy B 50 ILE HG2% 1.0 1.9 4.3 4312 2456 B 50 ILE HG2% B 49 ASP HBx 1.0 1.9 4.3 4313 2456 B 50 ILE HG2% B 49 ASP HBy 1.0 1.9 4.3 4314 2457 A 37 PHE HE% B 50 ILE HG2% 1.0 2.0 5.0 4315 2457 B 50 ILE HG2% B 53 TRP HZ3 1.0 2.0 5.0 4316 2457 B 50 ILE HG2% B 53 TRP HH2 1.0 2.0 5.0 4317 2458 B 45 LEU HD1% A 20 GLN H 1.0 2.0 5.0 4318 2458 B 43 LEU HD1% B 44 MET H 1.0 2.0 5.0 4319 2459 B 36 PRO HDx B 35 LEU HBx 1.0 1.9 4.5 4320 2459 B 26 LEU HBy B 27 PRO HDx 1.0 1.9 4.5 4321 2460 B 44 MET HB2 B 42 ASP HBx 1.0 1.9 4.3 4322 2460 B 44 MET HE% B 42 ASP HBx 1.0 1.9 4.3 4323 2460 B 44 MET HB3 B 42 ASP HBx 1.0 1.9 4.3 4324 2460 B 42 ASP HBx B 47 PRO HG3 1.0 1.9 4.3 4325 2460 B 42 ASP HBx B 40 MET HBx 1.0 1.9 4.3 4326 2461 B 30 ASN H B 29 ASN HBy 1.0 2.0 5.4 4327 2461 B 30 ASN HBx B 30 ASN H 1.0 2.0 5.4 4328 2461 B 29 ASN H B 29 ASN HBy 1.0 2.0 5.4 4329 2462 B 54 PHE H B 53 TRP HB3 1.0 1.9 4.1 4330 2462 B 54 PHE H B 53 TRP HB2 1.0 1.9 4.1 4331 2462 B 53 TRP H B 53 TRP HB3 1.0 1.9 4.1 4332 2462 B 53 TRP H B 53 TRP HB2 1.0 1.9 4.1 4333 2463 B 50 ILE HD1% B 49 ASP HBy 1.0 2.0 5.0 4334 2463 B 50 ILE HG2% B 48 ASP HBy 1.0 2.0 5.0 4335 2463 B 50 ILE HD1% B 48 ASP HBy 1.0 2.0 5.0 4336 2463 B 43 LEU HD2% B 42 ASP HBy 1.0 2.0 5.0 4337 2463 B 50 ILE HG2% B 49 ASP HBy 1.0 2.0 5.0 4338 2464 B 22 LEU HG B 21 ASP HBx 1.0 2.0 4.8 4339 2464 B 24 LYS HD2 B 21 ASP HBx 1.0 2.0 4.8 4340 2464 B 24 LYS HD3 B 21 ASP HBx 1.0 2.0 4.8 4341 2464 B 24 LYS HBx B 21 ASP HBx 1.0 2.0 4.8 4342 2465 B 21 ASP HA B 23 TRP HD1 1.0 2.0 5.4 4343 2465 B 23 TRP HA B 23 TRP HD1 1.0 2.0 5.4 4344 2466 B 19 PHE HBx B 18 THR HA 1.0 1.9 4.9 4345 2466 B 19 PHE HBx B 20 SER HA 1.0 1.9 4.9 4346 2466 B 19 PHE HBx B 16 GLN HA 1.0 1.9 4.9 4347 2467 B 44 MET HB2 B 44 MET HA 1.0 1.6 2.8 4348 2467 B 44 MET HB3 B 44 MET HA 1.0 1.6 2.8 4349 2467 B 40 MET HBx B 40 MET HA 1.0 1.6 2.8 4350 2468 B 46 SER HBx B 46 SER HA 1.0 1.7 3.1 4351 2468 B 33 SER HBy B 33 SER HA 1.0 1.7 3.1 4352 2469 B 30 ASN HBy B 31 VAL HG2% 1.0 1.9 5.1 4353 2469 B 30 ASN HBy B 32 LEU HD1% 1.0 1.9 5.1 4354 2469 B 32 LEU HD2% B 30 ASN HBy 1.0 1.9 5.1 4355 2470 B 26 LEU HG B 27 PRO HDx 1.0 2.0 5.0 4356 2470 B 36 PRO HDx B 35 LEU HG 1.0 2.0 5.0 4357 2471 B 36 PRO HDx B 35 LEU HD2% 1.0 2.0 5.0 4358 2471 B 26 LEU HD2% B 27 PRO HDx 1.0 2.0 5.0 4359 2472 B 48 ASP H B 50 ILE HG1y 1.0 2.0 5.2 4360 2472 B 51 GLU H B 50 ILE HG1y 1.0 2.0 5.2 4361 2473 B 50 ILE HD1% B 48 ASP HA 1.0 1.9 4.5 4362 2473 B 50 ILE HD1% B 45 LEU HA 1.0 1.9 4.5 4363 2474 B 36 PRO HDx B 35 LEU HBx 1.0 1.8 3.6 4364 2474 B 26 LEU HBy B 27 PRO HDx 1.0 1.8 3.6 4365 2474 B 26 LEU HBx B 27 PRO HDx 1.0 1.8 3.6 4366 2475 B 14 LEU HA B 14 LEU HBy 1.0 1.6 2.8 4367 2475 B 25 LEU HBy B 25 LEU HA 1.0 1.6 2.8 4368 2476 B 40 MET HA B 40 MET HGx 1.0 2.0 4.8 4369 2476 B 44 MET HA B 44 MET HGx 1.0 2.0 4.8 4370 2477 B 32 LEU HD2% B 31 VAL HA 1.0 2.0 5.2 4371 2477 B 22 LEU HA B 25 LEU HD2% 1.0 2.0 5.2 4372 2478 B 31 VAL HG1% B 23 TRP HH2 1.0 0.0 6.0 4373 2478 B 26 LEU HD2% B 23 TRP HH2 1.0 0.0 6.0 4374 2479 B 26 LEU HA B 26 LEU HG 1.0 1.9 3.9 4375 2479 B 35 LEU HG B 35 LEU HA 1.0 1.9 3.9 4376 2480 B 14 LEU HD1% B 15 SER HA 1.0 1.9 4.3 4377 2480 B 23 TRP HA B 25 LEU HD1% 1.0 1.9 4.3 4378 2481 B 26 LEU HD2% B 26 LEU HA 1.0 1.6 2.8 4379 2481 B 35 LEU HD2% B 35 LEU HA 1.0 1.6 2.8 4380 2481 B 35 LEU HD1% B 35 LEU HA 1.0 1.6 2.8 4381 2482 B 50 ILE HA B 49 ASP H 1.0 1.9 5.1 4382 2482 B 50 ILE HA B 54 PHE H 1.0 1.9 5.1 4383 2482 B 50 ILE HA B 52 GLN H 1.0 1.9 5.1 4384 2483 B 48 ASP H B 46 SER HBx 1.0 2.0 4.8 4385 2483 B 20 SER HBy B 20 SER H 1.0 2.0 4.8 4386 2484 A 19 VAL HA B 45 LEU HD1% 1.0 1.9 4.1 4387 2484 B 43 LEU HD1% A 49 LYS HE2 1.0 1.9 4.1 4388 2484 B 43 LEU HD1% A 49 LYS HE3 1.0 1.9 4.1 4389 2485 B 30 ASN HBx B 30 ASN HA 1.0 1.6 3.0 4390 2485 B 29 ASN HBy B 29 ASN HA 1.0 1.6 3.0 4391 2486 B 48 ASP HBx B 47 PRO HA 1.0 2.0 6.0 4392 2486 B 56 GLU HA B 57 ASP HBy 1.0 2.0 6.0 4393 2487 B 40 MET HBy B 40 MET HA 1.0 1.6 2.8 4394 2487 B 44 MET HB2 B 44 MET HA 1.0 1.6 2.8 4395 2487 B 44 MET HB3 B 44 MET HA 1.0 1.6 2.8 4396 2487 B 40 MET HBx B 40 MET HA 1.0 1.6 2.8 4397 2488 B 32 LEU HG B 32 LEU HD2% 1.0 1.5 2.7 4398 2488 B 26 LEU HD2% B 26 LEU HBx 1.0 1.5 2.7 4399 2488 B 35 LEU HD2% B 35 LEU HG 1.0 1.5 2.7 4400 2488 B 26 LEU HD2% B 26 LEU HG 1.0 1.5 2.7 4401 2488 B 35 LEU HBy B 35 LEU HD2% 1.0 1.5 2.7 4402 2489 B 51 GLU HG3 B 55 THR HB 1.0 2.0 5.6 4403 2489 B 56 GLU HGx B 55 THR HB 1.0 2.0 5.6 4404 2489 B 18 THR HB B 17 GLU HG2 1.0 2.0 5.6 4405 2490 B 47 PRO HDx B 46 SER HA 1.0 1.6 2.6 4406 2490 B 34 PRO HDx B 33 SER HA 1.0 1.6 2.6 4407 2491 B 24 LYS HA B 23 TRP HD1 1.0 2.0 6.0 4408 2491 B 22 LEU HA B 23 TRP HD1 1.0 2.0 6.0 4409 2492 B 45 LEU HD1% B 53 TRP HB2 1.0 2.0 6.0 4410 2492 B 50 ILE HD1% B 53 TRP HB2 1.0 2.0 6.0 4411 2492 B 50 ILE HG2% B 53 TRP HB3 1.0 2.0 6.0 4412 2492 B 50 ILE HG2% B 53 TRP HB2 1.0 2.0 6.0 4413 2492 B 50 ILE HD1% B 53 TRP HB3 1.0 2.0 6.0 4414 2493 B 37 SER HBx B 38 GLN H 1.0 2.0 4.8 4415 2493 B 37 SER H B 37 SER HBx 1.0 2.0 4.8 4416 2494 B 43 LEU HG B 43 LEU H 1.0 1.9 3.9 4417 2494 B 45 LEU HG B 45 LEU H 1.0 1.9 3.9 4418 2495 B 45 LEU HD2% B 49 ASP HBx 1.0 1.9 4.3 4419 2495 B 45 LEU HD2% B 49 ASP HBy 1.0 1.9 4.3 4420 2495 B 45 LEU HD2% A 23 ARG HDx 1.0 1.9 4.3 4421 2496 B 51 GLU H B 51 GLU HG3 1.0 1.9 4.9 4422 2496 B 51 GLU H B 51 GLU HG2 1.0 1.9 4.9 4423 2496 B 18 THR H B 17 GLU HG2 1.0 1.9 4.9 4424 2497 B 24 LYS HA B 23 TRP HE3 1.0 1.7 3.5 4425 2497 B 24 LYS H B 24 LYS HA 1.0 1.7 3.5 4426 2498 B 29 ASN HD21 B 29 ASN HBy 1.0 1.9 4.1 4427 2498 B 30 ASN HD21 B 30 ASN HBx 1.0 1.9 4.1 4428 2499 B 22 LEU HBx B 22 LEU HD1% 1.0 1.5 2.3 4429 2499 B 43 LEU HD1% B 43 LEU HBx 1.0 1.5 2.3 4430 2499 B 22 LEU HG B 22 LEU HD1% 1.0 1.5 2.3 4431 2499 B 43 LEU HD1% B 43 LEU HG 1.0 1.5 2.3 4432 2499 B 45 LEU HD1% B 45 LEU HG 1.0 1.5 2.3 4433 2500 A 40 PHE HD% B 45 LEU HD1% 1.0 1.9 4.7 4434 2500 B 45 LEU HD1% B 53 TRP HZ3 1.0 1.9 4.7 4435 2500 B 45 LEU HD1% A 40 PHE HE% 1.0 1.9 4.7 4436 2501 B 44 MET HE% B 54 PHE HD% 1.0 0.0 6.0 4437 2501 B 44 MET HE% B 54 PHE HZ 1.0 0.0 6.0 4438 2501 A 18 PHE HZ B 44 MET HE% 1.0 0.0 6.0 4439 2502 B 50 ILE HG2% B 48 ASP HA 1.0 2.0 6.0 4440 2502 B 50 ILE HG2% B 49 ASP HA 1.0 2.0 6.0 4441 2503 A 45 SER HA B 43 LEU HD1% 1.0 2.0 4.4 4442 2503 B 43 LEU HD1% B 43 LEU HA 1.0 2.0 4.4 4443 2504 B 25 LEU HBy B 25 LEU HD1% 1.0 1.5 2.3 4444 2504 B 32 LEU HBx B 32 LEU HD1% 1.0 1.5 2.3 4445 2504 B 32 LEU HG B 32 LEU HD1% 1.0 1.5 2.3 4446 2504 B 14 LEU HD1% B 14 LEU HBx 1.0 1.5 2.3 4447 2504 B 14 LEU HD1% B 14 LEU HBy 1.0 1.5 2.3 4448 2504 B 25 LEU HBx B 25 LEU HD1% 1.0 1.5 2.3 4449 2504 B 25 LEU HG B 25 LEU HD1% 1.0 1.5 2.3 4450 2504 B 26 LEU HD1% B 26 LEU HBx 1.0 1.5 2.3 4451 2504 B 32 LEU HBy B 32 LEU HD1% 1.0 1.5 2.3 4452 2505 B 44 MET HB2 B 42 ASP HA 1.0 2.0 4.4 4453 2505 B 44 MET HB3 B 42 ASP HA 1.0 2.0 4.4 4454 2505 B 44 MET HE% B 42 ASP HA 1.0 2.0 4.4 4455 2505 B 49 ASP HA B 51 GLU HBx 1.0 2.0 4.4 4456 2505 B 40 MET HBy B 41 ASP HA 1.0 2.0 4.4 4457 2505 B 40 MET HBx B 41 ASP HA 1.0 2.0 4.4 4458 2506 B 26 LEU HD2% B 26 LEU HA 1.0 1.8 3.8 4459 2506 B 35 LEU HD2% B 35 LEU HA 1.0 1.8 3.8 4460 2507 B 24 LYS HD3 B 26 LEU HD1% 1.0 0.0 6.0 4461 2507 B 24 LYS HD3 B 25 LEU HD2% 1.0 0.0 6.0 4462 2507 B 24 LYS HD3 B 31 VAL HG1% 1.0 0.0 6.0 4463 2507 B 24 LYS HD2 B 26 LEU HD1% 1.0 0.0 6.0 4464 2507 B 24 LYS HD3 B 31 VAL HG2% 1.0 0.0 6.0 4465 2507 B 24 LYS HD2 B 31 VAL HG2% 1.0 0.0 6.0 4466 2507 B 24 LYS HD3 B 26 LEU HD2% 1.0 0.0 6.0 4467 2507 B 24 LYS HD2 B 25 LEU HD2% 1.0 0.0 6.0 4468 2508 B 25 LEU H B 23 TRP HA 1.0 1.8 3.6 4469 2508 B 23 TRP H B 23 TRP HA 1.0 1.8 3.6 4470 2509 B 41 ASP HBx B 41 ASP HA 1.0 1.5 2.5 4471 2509 B 42 ASP HBy B 42 ASP HA 1.0 1.5 2.5 4472 2509 B 41 ASP HBy B 41 ASP HA 1.0 1.5 2.5 4473 2509 B 42 ASP HBx B 42 ASP HA 1.0 1.5 2.5 4474 2510 B 25 LEU H B 31 VAL HG2% 1.0 0.0 6.0 4475 2510 B 25 LEU H B 31 VAL HG1% 1.0 0.0 6.0 4476 2510 B 26 LEU H B 31 VAL HG1% 1.0 0.0 6.0 4477 2510 B 26 LEU H B 31 VAL HG2% 1.0 0.0 6.0 4478 2511 B 50 ILE HG1x A 37 PHE HZ 1.0 2.0 6.0 4479 2511 B 54 PHE HD% B 50 ILE HG1x 1.0 2.0 6.0 4480 2512 B 20 SER HBy B 24 LYS HD2 1.0 1.9 4.9 4481 2512 B 45 LEU HBx B 46 SER HBx 1.0 1.9 4.9 4482 2512 B 20 SER HBy B 24 LYS HBx 1.0 1.9 4.9 4483 2512 B 20 SER HBy B 24 LYS HD3 1.0 1.9 4.9 4484 2512 B 35 LEU HBx B 33 SER HBy 1.0 1.9 4.9 4485 2512 B 20 SER HBy B 22 LEU HG 1.0 1.9 4.9 4486 2513 B 55 THR H B 54 PHE HBy 1.0 1.9 4.1 4487 2513 B 54 PHE HBy B 54 PHE H 1.0 1.9 4.1 4488 2514 B 25 LEU HBy B 24 LYS HA 1.0 2.0 6.0 4489 2514 B 32 LEU HBy B 31 VAL HA 1.0 2.0 6.0 4490 2515 B 28 GLU HBx B 27 PRO HDy 1.0 0.0 6.0 4491 2515 B 16 GLN HBx B 20 SER HBx 1.0 0.0 6.0 4492 2516 B 26 LEU H B 27 PRO HG3 1.0 2.0 6.0 4493 2516 B 49 ASP H B 47 PRO HG2 1.0 2.0 6.0 4494 2516 B 26 LEU H B 27 PRO HG2 1.0 2.0 6.0 4495 2516 B 49 ASP H B 47 PRO HG3 1.0 2.0 6.0 4496 2517 B 23 TRP HA B 25 LEU HD2% 1.0 2.0 4.8 4497 2517 B 23 TRP HA B 26 LEU HD1% 1.0 2.0 4.8 4498 2517 B 23 TRP HA B 25 LEU HD1% 1.0 2.0 4.8 4499 2518 B 45 LEU HD2% B 53 TRP HH2 1.0 2.0 4.6 4500 2518 B 50 ILE HG2% B 53 TRP HH2 1.0 2.0 4.6 4501 2519 B 43 LEU HD1% B 43 LEU HG 1.0 1.4 2.4 4502 2519 B 32 LEU HG B 32 LEU HD2% 1.0 1.4 2.4 4503 2519 B 25 LEU HG B 25 LEU HD2% 1.0 1.4 2.4 4504 2519 B 45 LEU HD1% B 45 LEU HG 1.0 1.4 2.4 4505 2519 B 45 LEU HD2% B 45 LEU HG 1.0 1.4 2.4 4506 2520 B 36 PRO HDx B 36 PRO HBx 1.0 1.7 3.3 4507 2520 B 27 PRO HBx B 27 PRO HDx 1.0 1.7 3.3 4508 2521 B 14 LEU H B 14 LEU HA 1.0 1.7 3.3 4509 2521 B 15 SER H B 14 LEU HA 1.0 1.7 3.3 4510 2522 B 24 LYS HD2 B 23 TRP HD1 1.0 2.0 5.0 4511 2522 B 22 LEU HBx B 23 TRP HD1 1.0 2.0 5.0 4512 2523 B 23 TRP HD1 B 25 LEU HD2% 1.0 2.0 5.0 4513 2523 B 22 LEU HD1% B 23 TRP HD1 1.0 2.0 5.0 4514 2524 B 52 GLN HGx B 50 ILE HG2% 1.0 1.9 4.7 4515 2524 B 52 GLN HGy B 50 ILE HG2% 1.0 1.9 4.7 4516 2524 B 50 ILE HG2% B 51 GLU HG3 1.0 1.9 4.7 4517 2524 B 50 ILE HG2% B 51 GLU HG2 1.0 1.9 4.7 4518 2525 B 26 LEU H B 25 LEU HA 1.0 1.6 3.0 4519 2525 B 25 LEU H B 25 LEU HA 1.0 1.6 3.0 4520 2526 B 59 GLY H B 57 ASP HBy 1.0 1.9 4.1 4521 2526 B 57 ASP H B 57 ASP HBy 1.0 1.9 4.1 4522 2527 B 14 LEU HD2% B 14 LEU HBy 1.0 1.5 2.5 4523 2527 B 14 LEU HD1% B 14 LEU HBy 1.0 1.5 2.5 4524 2527 B 25 LEU HBy B 25 LEU HD1% 1.0 1.5 2.5 4525 2527 B 25 LEU HBy B 25 LEU HD2% 1.0 1.5 2.5 4526 2528 B 26 LEU HD2% B 24 LYS HE2 1.0 0.0 6.0 4527 2528 B 26 LEU HD1% B 24 LYS HE3 1.0 0.0 6.0 4528 2528 B 31 VAL HG1% B 24 LYS HE2 1.0 0.0 6.0 4529 2528 B 24 LYS HE3 B 25 LEU HD2% 1.0 0.0 6.0 4530 2528 B 26 LEU HD1% B 24 LYS HE2 1.0 0.0 6.0 4531 2528 B 24 LYS HE2 B 25 LEU HD2% 1.0 0.0 6.0 4532 2528 B 31 VAL HG1% B 24 LYS HE3 1.0 0.0 6.0 4533 2529 B 16 GLN HA B 16 GLN HG2 1.0 1.8 3.6 4534 2529 B 38 GLN HG3 B 38 GLN HA 1.0 1.8 3.6 4535 2529 B 38 GLN HG2 B 38 GLN HA 1.0 1.8 3.6 4536 2530 B 54 PHE H B 53 TRP HA 1.0 1.8 3.8 4537 2530 B 53 TRP H B 53 TRP HA 1.0 1.8 3.8 4538 2531 B 49 ASP HBx B 45 LEU HBy 1.0 2.0 5.0 4539 2531 B 49 ASP HBy B 45 LEU HBy 1.0 2.0 5.0 4540 2531 A 23 ARG HDx B 45 LEU HBy 1.0 2.0 5.0 4541 2532 B 23 TRP HBx B 25 LEU HBx 1.0 1.9 6.0 4542 2532 B 23 TRP HBy B 25 LEU HG 1.0 1.9 6.0 4543 2532 B 23 TRP HBy B 25 LEU HBx 1.0 1.9 6.0 4544 2532 B 23 TRP HBy B 24 LYS HBx 1.0 1.9 6.0 4545 2532 B 23 TRP HBx B 25 LEU HBy 1.0 1.9 6.0 4546 2532 B 23 TRP HBx B 25 LEU HG 1.0 1.9 6.0 4547 2532 B 23 TRP HBy B 25 LEU HBy 1.0 1.9 6.0 4548 2532 B 23 TRP HBx B 24 LYS HBx 1.0 1.9 6.0 4549 2533 B 23 TRP H B 24 LYS HBy 1.0 2.0 5.8 4550 2533 B 26 LEU H B 24 LYS HBy 1.0 2.0 5.8 4551 2533 B 25 LEU H B 24 LYS HBy 1.0 2.0 5.8 4552 2534 B 27 PRO HDy B 26 LEU HG 1.0 2.0 6.0 4553 2534 B 36 PRO HDy B 35 LEU HG 1.0 2.0 6.0 4554 2535 B 50 ILE H B 48 ASP HA 1.0 1.9 3.9 4555 2535 B 50 ILE H B 49 ASP HA 1.0 1.9 3.9 4556 2536 B 48 ASP HBx B 48 ASP HBy 1.0 1.1 2.2 4557 2536 B 57 ASP HBx B 57 ASP HBy 1.0 1.1 2.2 4558 2537 B 36 PRO HA B 36 PRO HBy 1.0 1.3 2.2 4559 2537 B 34 PRO HA B 34 PRO HBy 1.0 1.3 2.2 4560 2538 B 40 MET H B 39 ALA HB% 1.0 1.8 3.6 4561 2538 B 39 ALA HB% B 39 ALA H 1.0 1.8 3.6 4562 2539 B 43 LEU HD1% B 42 ASP HA 1.0 2.0 5.2 4563 2539 B 43 LEU HD2% B 42 ASP HA 1.0 2.0 5.2 4564 2539 B 43 LEU HD1% B 41 ASP HA 1.0 2.0 5.2 4565 2539 B 22 LEU HD1% B 21 ASP HA 1.0 2.0 5.2 4566 2539 B 22 LEU HD2% B 21 ASP HA 1.0 2.0 5.2 4567 2539 B 43 LEU HD2% B 41 ASP HA 1.0 2.0 5.2 4568 2540 B 40 MET HA B 40 MET HE% 1.0 2.0 4.6 4569 2540 B 44 MET HE% B 44 MET HA 1.0 2.0 4.6 4570 2541 B 22 LEU HBy B 19 PHE HD% 1.0 1.9 6.0 4571 2541 B 22 LEU HBy B 23 TRP HD1 1.0 1.9 6.0 4572 2542 B 34 PRO HG2 B 34 PRO HDy 1.0 1.3 2.2 4573 2542 B 47 PRO HG3 B 47 PRO HDy 1.0 1.3 2.2 4574 2542 B 27 PRO HDy B 27 PRO HG3 1.0 1.3 2.2 4575 2542 B 34 PRO HG3 B 34 PRO HDy 1.0 1.3 2.2 4576 2542 B 27 PRO HDy B 27 PRO HG2 1.0 1.3 2.2 4577 2543 B 59 GLY HAy B 58 PRO HA 1.0 2.0 5.8 4578 2543 B 59 GLY HAy B 60 PRO HA 1.0 2.0 5.8 4579 2544 B 45 LEU HD2% B 54 PHE HZ 1.0 2.0 5.0 4580 2544 B 45 LEU HD2% B 53 TRP HH2 1.0 2.0 5.0 4581 2545 B 29 ASN H B 28 GLU HGy 1.0 2.0 5.2 4582 2545 B 29 ASN H B 28 GLU HGx 1.0 2.0 5.2 4583 2545 B 56 GLU H B 56 GLU HGy 1.0 2.0 5.2 4584 2546 B 15 SER H B 14 LEU HD2% 1.0 2.0 6.0 4585 2546 B 14 LEU H B 14 LEU HD2% 1.0 2.0 6.0 4586 2547 B 22 LEU HBx B 22 LEU HD2% 1.0 1.5 2.5 4587 2547 B 22 LEU HG B 22 LEU HD2% 1.0 1.5 2.5 4588 2547 B 43 LEU HD2% B 43 LEU HG 1.0 1.5 2.5 4589 2548 B 35 LEU HBy B 36 PRO HDy 1.0 2.0 6.0 4590 2548 B 26 LEU HBx B 27 PRO HDy 1.0 2.0 6.0 4591 2549 B 53 TRP HD1 B 54 PHE H 1.0 1.9 4.5 4592 2549 B 53 TRP H B 53 TRP HD1 1.0 1.9 4.5 4593 2550 B 17 GLU HG2 B 19 PHE HD% 1.0 1.9 4.5 4594 2550 B 23 TRP HH2 B 28 GLU HGy 1.0 1.9 4.5 4595 2550 B 23 TRP HH2 B 28 GLU HGx 1.0 1.9 4.5 4596 2551 B 30 ASN HBy B 30 ASN HA 1.0 1.7 3.1 4597 2551 B 29 ASN HBx B 29 ASN HA 1.0 1.7 3.1 4598 2552 B 23 TRP HBx B 26 LEU HD1% 1.0 2.0 6.0 4599 2552 B 23 TRP HBx B 26 LEU HD2% 1.0 2.0 6.0 4600 2552 B 23 TRP HBx B 25 LEU HD1% 1.0 2.0 6.0 4601 2552 B 23 TRP HBy B 26 LEU HD2% 1.0 2.0 6.0 4602 2552 B 23 TRP HBy B 26 LEU HD1% 1.0 2.0 6.0 4603 2553 B 46 SER HBx B 47 PRO HBy 1.0 2.0 5.6 4604 2553 B 33 SER HBy B 34 PRO HBx 1.0 2.0 5.6 4605 2553 B 15 SER HBx B 17 GLU HBy 1.0 2.0 5.6 4606 2554 B 22 LEU HD1% B 22 LEU HA 1.0 1.9 4.1 4607 2554 A 45 SER HBx B 43 LEU HD1% 1.0 1.9 4.1 4608 2554 A 45 SER HBy B 43 LEU HD1% 1.0 1.9 4.1 4609 2555 B 30 ASN HBx B 31 VAL HG2% 1.0 2.0 5.8 4610 2555 B 30 ASN HBx B 32 LEU HD1% 1.0 2.0 5.8 4611 2555 B 32 LEU HD2% B 30 ASN HBx 1.0 2.0 5.8 4612 2556 B 35 LEU HBx B 35 LEU HA 1.0 1.6 3.0 4613 2556 B 26 LEU HBy B 26 LEU HA 1.0 1.6 3.0 4614 2557 B 38 GLN H B 37 SER HA 1.0 1.9 4.7 4615 2557 B 37 SER H B 37 SER HA 1.0 1.9 4.7 4616 2558 B 54 PHE HBx B 54 PHE HE% 1.0 1.9 6.0 4617 2558 B 19 PHE HBy B 19 PHE HE% 1.0 1.9 6.0 4618 2559 B 26 LEU HBy B 27 PRO HDy 1.0 2.0 5.0 4619 2559 B 35 LEU HBx B 36 PRO HDy 1.0 2.0 5.0 4620 2560 B 31 VAL HB B 23 TRP HH2 1.0 0.0 6.0 4621 2560 B 28 GLU HBx B 23 TRP HH2 1.0 0.0 6.0 4622 2561 B 45 LEU HD1% B 45 LEU H 1.0 1.9 4.9 4623 2561 B 43 LEU HD1% B 43 LEU H 1.0 1.9 4.9 4624 2562 B 32 LEU HG B 32 LEU HA 1.0 1.8 3.6 4625 2562 B 45 LEU HG B 45 LEU HA 1.0 1.8 3.6 4626 2563 B 43 LEU HBy B 43 LEU H 1.0 1.9 4.3 4627 2563 B 45 LEU H B 45 LEU HBy 1.0 1.9 4.3 4628 2564 B 19 PHE HBy B 18 THR HA 1.0 2.0 5.4 4629 2564 B 19 PHE HBy B 16 GLN HA 1.0 2.0 5.4 4630 2564 B 19 PHE HBy B 20 SER HA 1.0 2.0 5.4 4631 2565 B 19 PHE HD% B 20 SER HA 1.0 2.0 5.2 4632 2565 B 19 PHE HD% B 16 GLN HA 1.0 2.0 5.2 4633 2566 B 22 LEU HD1% B 19 PHE HE% 1.0 1.9 5.1 4634 2566 B 45 LEU HD1% B 54 PHE HE% 1.0 1.9 5.1 4635 2567 B 35 LEU HD2% B 33 SER HBy 1.0 1.9 4.3 4636 2567 B 31 VAL HG1% B 33 SER HBy 1.0 1.9 4.3 4637 2567 B 35 LEU HD1% B 33 SER HBy 1.0 1.9 4.3 4638 2567 B 15 SER HBx B 14 LEU HD1% 1.0 1.9 4.3 4639 2567 B 45 LEU HD1% B 46 SER HBx 1.0 1.9 4.3 4640 2567 B 20 SER HBy B 22 LEU HD1% 1.0 1.9 4.3 4641 2568 B 50 ILE HA B 53 TRP HB2 1.0 2.0 5.2 4642 2568 B 54 PHE HBx B 50 ILE HA 1.0 2.0 5.2 4643 2569 B 25 LEU HA B 25 LEU HD1% 1.0 1.9 4.7 4644 2569 B 14 LEU HD1% B 14 LEU HA 1.0 1.9 4.7 4645 2570 B 22 LEU HBy B 19 PHE HA 1.0 2.0 6.0 4646 2570 B 22 LEU HBy B 23 TRP HA 1.0 2.0 6.0 4647 2571 B 24 LYS HBy B 25 LEU HD2% 1.0 2.0 5.8 4648 2571 B 26 LEU HD1% B 24 LYS HBy 1.0 2.0 5.8 4649 2571 B 24 LYS HBy B 25 LEU HD1% 1.0 2.0 5.8 4650 2572 B 14 LEU H B 14 LEU HBx 1.0 1.8 3.6 4651 2572 B 32 LEU HBx B 32 LEU H 1.0 1.8 3.6 4652 2573 A 44 CYS HBy B 43 LEU HD2% 1.0 1.9 4.3 4653 2573 B 43 LEU HD2% B 42 ASP HBx 1.0 1.9 4.3 4654 2573 B 43 LEU HD2% B 44 MET HGx 1.0 1.9 4.3 4655 2573 B 22 LEU HD2% B 21 ASP HBx 1.0 1.9 4.3 4656 2574 B 20 SER HBy B 16 GLN HBx 1.0 2.0 5.0 4657 2574 B 50 ILE HA B 51 GLU HBx 1.0 2.0 5.0 4658 2574 B 15 SER HBy B 16 GLN HBx 1.0 2.0 5.0 4659 2575 B 31 VAL HG2% B 28 GLU HGy 1.0 1.8 4.0 4660 2575 B 26 LEU HD1% B 28 GLU HGy 1.0 1.8 4.0 4661 2576 B 24 LYS HBx B 23 TRP HE3 1.0 2.0 6.0 4662 2576 B 25 LEU HG B 23 TRP HE3 1.0 2.0 6.0 4663 2576 B 26 LEU HBy B 23 TRP HE3 1.0 2.0 6.0 4664 2576 B 26 LEU HBx B 23 TRP HE3 1.0 2.0 6.0 4665 2577 B 21 ASP HBx B 21 ASP HA 1.0 1.6 3.0 4666 2577 B 42 ASP HBx B 42 ASP HA 1.0 1.6 3.0 4667 2578 B 35 LEU HBx B 35 LEU HA 1.0 1.5 2.7 4668 2578 B 26 LEU HBx B 26 LEU HA 1.0 1.5 2.7 4669 2578 B 26 LEU HBy B 26 LEU HA 1.0 1.5 2.7 4670 2579 B 27 PRO HDy B 27 PRO HG3 1.0 1.4 2.2 4671 2579 B 36 PRO HDy B 36 PRO HG3 1.0 1.4 2.2 4672 2579 B 47 PRO HG3 B 47 PRO HDy 1.0 1.4 2.2 4673 2579 B 27 PRO HDy B 27 PRO HG2 1.0 1.4 2.2 4674 2579 B 58 PRO HG3 B 58 PRO HDy 1.0 1.4 2.2 4675 2579 B 47 PRO HG2 B 47 PRO HDy 1.0 1.4 2.2 4676 2579 B 58 PRO HG2 B 58 PRO HDy 1.0 1.4 2.2 4677 2580 A 44 CYS HBy B 43 LEU HG 1.0 1.9 4.5 4678 2580 B 45 LEU HG B 49 ASP HBx 1.0 1.9 4.5 4679 2580 B 43 LEU HG B 42 ASP HBx 1.0 1.9 4.5 4680 2580 B 43 LEU HG B 42 ASP HBy 1.0 1.9 4.5 4681 2580 A 23 ARG HDx B 45 LEU HG 1.0 1.9 4.5 4682 2581 B 17 GLU HG2 B 17 GLU HA 1.0 1.8 3.6 4683 2581 B 56 GLU HA B 56 GLU HGx 1.0 1.8 3.6 4684 2581 B 28 GLU HA B 28 GLU HGx 1.0 1.8 3.6 4685 2581 B 28 GLU HA B 28 GLU HGy 1.0 1.8 3.6 4686 2582 B 25 LEU HG B 24 LYS HA 1.0 1.9 5.1 4687 2582 A 45 SER HBx B 43 LEU HG 1.0 1.9 5.1 4688 2582 B 32 LEU HG B 31 VAL HA 1.0 1.9 5.1 4689 2582 B 25 LEU HG B 22 LEU HA 1.0 1.9 5.1 4690 2583 B 43 LEU HBy B 44 MET HB2 1.0 2.0 4.8 4691 2583 B 44 MET HB3 B 43 LEU HBy 1.0 2.0 4.8 4692 2583 B 44 MET HB2 B 45 LEU HBy 1.0 2.0 4.8 4693 2583 B 44 MET HB3 B 45 LEU HBy 1.0 2.0 4.8 4694 2583 B 44 MET HE% B 43 LEU HBy 1.0 2.0 4.8 4695 2584 B 21 ASP H B 21 ASP HBx 1.0 1.8 3.6 4696 2584 B 42 ASP HBx B 42 ASP H 1.0 1.8 3.6 4697 2585 B 25 LEU HBy B 26 LEU H 1.0 2.0 4.8 4698 2585 B 25 LEU H B 25 LEU HBy 1.0 2.0 4.8 4699 2586 B 50 ILE HD1% B 49 ASP HBx 1.0 1.9 4.7 4700 2586 A 23 ARG HDx B 50 ILE HD1% 1.0 1.9 4.7 4701 2586 B 50 ILE HD1% B 49 ASP HBy 1.0 1.9 4.7 4702 2587 B 50 ILE HD1% B 53 TRP HZ3 1.0 1.9 4.7 4703 2587 B 50 ILE HG2% B 53 TRP HZ3 1.0 1.9 4.7 4704 2587 B 45 LEU HD1% B 53 TRP HZ3 1.0 1.9 4.7 4705 2588 B 53 TRP HA B 50 ILE HB 1.0 2.0 6.0 4706 2588 B 49 ASP HA B 50 ILE HB 1.0 2.0 6.0 4707 2589 B 53 TRP H B 53 TRP HE3 1.0 2.0 5.6 4708 2589 B 54 PHE H B 53 TRP HE3 1.0 2.0 5.6 4709 2590 B 55 THR HG2% B 56 GLU HGx 1.0 1.9 4.1 4710 2590 B 55 THR HG2% B 51 GLU HG3 1.0 1.9 4.1 4711 2591 B 22 LEU HBx B 22 LEU HD2% 1.0 1.7 3.1 4712 2591 B 43 LEU HD2% B 43 LEU HBx 1.0 1.7 3.1 4713 2591 B 43 LEU HD1% B 43 LEU HBx 1.0 1.7 3.1 4714 2591 B 22 LEU HBx B 22 LEU HD1% 1.0 1.7 3.1 4715 2592 B 22 LEU H B 20 SER HBy 1.0 2.0 5.4 4716 2592 B 49 ASP H B 46 SER HBx 1.0 2.0 5.4 4717 2593 B 44 MET HB2 B 44 MET HGx 1.0 1.4 2.4 4718 2593 B 40 MET HGx B 40 MET HE% 1.0 1.4 2.4 4719 2593 B 44 MET HB3 B 44 MET HGx 1.0 1.4 2.4 4720 2593 B 40 MET HBx B 40 MET HGx 1.0 1.4 2.4 4721 2594 B 24 LYS HD2 B 21 ASP HBy 1.0 2.0 5.2 4722 2594 B 24 LYS HD3 B 21 ASP HBy 1.0 2.0 5.2 4723 2594 B 22 LEU HBx B 21 ASP HBy 1.0 2.0 5.2 4724 2594 B 24 LYS HBx B 21 ASP HBy 1.0 2.0 5.2 4725 2594 B 22 LEU HG B 21 ASP HBy 1.0 2.0 5.2 4726 2595 B 37 SER H B 37 SER HBy 1.0 1.9 4.7 4727 2595 B 15 SER H B 15 SER HBx 1.0 1.9 4.7 4728 2595 B 15 SER H B 15 SER HBy 1.0 1.9 4.7 4729 2596 B 48 ASP H B 50 ILE HG1x 1.0 2.0 5.6 4730 2596 B 51 GLU H B 50 ILE HG1x 1.0 2.0 5.6 4731 2597 B 55 THR HG2% B 56 GLU HBy 1.0 1.9 4.3 4732 2597 B 55 THR HG2% B 51 GLU HBy 1.0 1.9 4.3 4733 2598 B 47 PRO HA B 51 GLU H 1.0 1.9 4.1 4734 2598 B 48 ASP H B 47 PRO HA 1.0 1.9 4.1 4735 2599 B 42 ASP HBx B 42 ASP H 1.0 1.8 3.8 4736 2599 B 42 ASP HBy B 42 ASP H 1.0 1.8 3.8 4737 2599 B 21 ASP H B 21 ASP HBy 1.0 1.8 3.8 4738 2600 B 25 LEU HBx B 25 LEU HD2% 1.0 1.5 2.7 4739 2600 B 43 LEU HD1% B 43 LEU HBy 1.0 1.5 2.7 4740 2600 B 32 LEU HBx B 32 LEU HD1% 1.0 1.5 2.7 4741 2600 B 45 LEU HD1% B 45 LEU HBy 1.0 1.5 2.7 4742 2600 B 25 LEU HBx B 25 LEU HD1% 1.0 1.5 2.7 4743 2600 B 14 LEU HD1% B 14 LEU HBx 1.0 1.5 2.7 4744 2600 B 14 LEU HD2% B 14 LEU HBx 1.0 1.5 2.7 4745 2601 B 43 LEU HD1% B 44 MET HGy 1.0 2.0 6.0 4746 2601 B 45 LEU HD2% B 44 MET HGy 1.0 2.0 6.0 4747 2601 A 19 VAL HGx% B 44 MET HGy 1.0 2.0 6.0 4748 2602 B 49 ASP HA B 50 ILE HG1y 1.0 2.0 6.0 4749 2602 B 48 ASP HA B 50 ILE HG1y 1.0 2.0 6.0 4750 2603 B 21 ASP H B 21 ASP HA 1.0 1.6 3.0 4751 2603 B 42 ASP H B 42 ASP HA 1.0 1.6 3.0 4752 2603 B 41 ASP H B 41 ASP HA 1.0 1.6 3.0 4753 2604 A 41 SER HBy B 40 MET HGy 1.0 1.9 4.5 4754 2604 B 40 MET HGy B 47 PRO HDy 1.0 1.9 4.5 4755 2605 B 23 TRP HA B 23 TRP HE3 1.0 1.9 3.9 4756 2605 B 24 LYS H B 23 TRP HA 1.0 1.9 3.9 4757 2606 B 60 PRO HG3 B 60 PRO HBy 1.0 1.1 2.2 4758 2606 B 34 PRO HBx B 34 PRO HBy 1.0 1.1 2.2 4759 2606 B 58 PRO HBy B 58 PRO HBx 1.0 1.1 2.2 4760 2606 B 60 PRO HBy B 60 PRO HBx 1.0 1.1 2.2 4761 2606 B 47 PRO HBy B 47 PRO HBx 1.0 1.1 2.2 4762 2606 B 58 PRO HBy B 58 PRO HG3 1.0 1.1 2.2 4763 2607 B 50 ILE HD1% B 51 GLU HBx 1.0 1.9 4.1 4764 2607 B 50 ILE HD1% B 47 PRO HG3 1.0 1.9 4.1 4765 2608 B 26 LEU HBx B 26 LEU HA 1.0 1.9 3.9 4766 2608 B 35 LEU HBy B 35 LEU HA 1.0 1.9 3.9 4767 2609 A 19 VAL HGx% B 44 MET HE% 1.0 1.6 2.8 4768 2609 B 44 MET HE% B 43 LEU HD2% 1.0 1.6 2.8 4769 2610 B 44 MET HE% B 43 LEU H 1.0 1.9 4.1 4770 2610 B 44 MET HE% A 47 ARG H 1.0 1.9 4.1 4771 2610 B 44 MET HE% B 45 LEU H 1.0 1.9 4.1 4772 2610 B 44 MET HE% A 46 GLU H 1.0 1.9 4.1 4773 2611 B 45 LEU HA B 50 ILE HG1x 1.0 2.0 5.8 4774 2611 B 49 ASP HA B 50 ILE HG1x 1.0 2.0 5.8 4775 2611 B 48 ASP HA B 50 ILE HG1x 1.0 2.0 5.8 4776 2612 B 51 GLU HG2 B 53 TRP HZ2 1.0 0.0 6.0 4777 2612 B 51 GLU HG3 B 53 TRP HZ2 1.0 0.0 6.0 4778 2612 A 24 GLU HBx B 53 TRP HZ2 1.0 0.0 6.0 4779 2612 A 12 MET HGx B 53 TRP HZ2 1.0 0.0 6.0 4780 2613 B 45 LEU HD2% B 44 MET HGx 1.0 2.0 6.0 4781 2613 A 19 VAL HGx% B 44 MET HGx 1.0 2.0 6.0 4782 2613 B 45 LEU HD1% B 44 MET HGx 1.0 2.0 6.0 4783 2614 B 18 THR HB B 19 PHE H 1.0 2.0 4.8 4784 2614 B 56 GLU H B 55 THR HB 1.0 2.0 4.8 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 14 SER O A 18 PHE N 1.0 2.4 3.5 2 2 A 14 SER O A 18 PHE H 1.0 1.5 2.5 3 3 A 15 TYR O A 19 VAL N 1.0 2.4 3.5 4 4 A 15 TYR O A 19 VAL H 1.0 1.5 2.5 5 5 A 16 ALA O A 20 GLN N 1.0 2.4 3.5 6 6 A 16 ALA O A 20 GLN H 1.0 1.5 2.5 7 7 A 17 PHE O A 21 THR N 1.0 2.4 3.5 8 8 A 17 PHE O A 21 THR H 1.0 1.5 2.5 9 9 A 18 PHE O A 22 CYS N 1.0 2.4 3.5 10 10 A 18 PHE O A 22 CYS H 1.0 1.5 2.5 11 11 A 19 VAL O A 23 ARG N 1.0 2.4 3.5 12 12 A 19 VAL O A 23 ARG H 1.0 1.5 2.5 13 13 A 20 GLN O A 24 GLU N 1.0 2.4 3.5 14 14 A 20 GLN O A 24 GLU H 1.0 1.5 2.5 15 15 A 21 THR O A 25 GLU N 1.0 2.4 3.5 16 16 A 21 THR O A 25 GLU H 1.0 1.5 2.5 17 17 A 22 CYS O A 26 HIS N 1.0 2.4 3.5 18 18 A 22 CYS O A 26 HIS H 1.0 1.5 2.5 19 19 A 23 ARG O A 27 LYS N 1.0 2.4 3.5 20 20 A 23 ARG O A 27 LYS H 1.0 1.5 2.5 21 21 A 24 GLU O A 28 LYS N 1.0 2.4 3.5 22 22 A 24 GLU O A 28 LYS H 1.0 1.5 2.5 23 23 A 25 GLU O A 29 LYS N 1.0 2.4 3.5 24 24 A 25 GLU O A 29 LYS H 1.0 1.5 2.5 25 25 A 37 PHE O A 41 SER N 1.0 2.4 3.5 26 26 A 37 PHE O A 41 SER N 1.0 2.4 3.5 27 27 A 38 SER O A 42 LYS H 1.0 1.5 2.5 28 28 A 38 SER O A 42 LYS H 1.0 1.5 2.5 29 29 A 39 GLU O A 43 LYS N 1.0 2.4 3.5 30 30 A 39 GLU O A 43 LYS H 1.0 1.5 2.5 31 31 A 40 PHE O A 44 CYS N 1.0 2.4 3.5 32 32 A 40 PHE O A 44 CYS H 1.0 1.5 2.5 33 33 A 41 SER O A 45 SER N 1.0 2.4 3.5 34 34 A 41 SER O A 45 SER H 1.0 1.5 2.5 35 35 A 42 LYS O A 46 GLU N 1.0 2.4 3.5 36 36 A 42 LYS O A 46 GLU H 1.0 1.5 2.5 37 37 A 43 LYS O A 47 ARG N 1.0 2.4 3.5 38 38 A 43 LYS O A 47 ARG H 1.0 1.5 2.5 39 39 A 44 CYS O A 48 TRP N 1.0 2.4 3.5 40 40 A 44 CYS O A 48 TRP H 1.0 1.5 2.5 41 41 A 45 SER O A 49 LYS N 1.0 2.4 3.5 42 42 A 45 SER O A 49 LYS H 1.0 1.5 2.5 43 43 A 46 GLU O A 50 THR N 1.0 2.4 3.5 44 44 A 46 GLU O A 50 THR H 1.0 1.5 2.5 45 45 A 53 ALA O A 57 GLY N 1.0 2.4 3.5 46 46 A 53 ALA O A 57 GLY H 1.0 1.5 2.5 47 47 A 54 LYS O A 58 LYS N 1.0 2.4 3.5 48 48 A 54 LYS O A 58 LYS H 1.0 1.5 2.5 49 49 A 55 GLU O A 59 PHE N 1.0 2.4 3.5 50 50 A 55 GLU O A 59 PHE H 1.0 1.5 2.5 51 51 A 56 LYS O A 60 GLU N 1.0 2.4 3.5 52 52 A 56 LYS O A 60 GLU H 1.0 1.5 2.5 53 53 A 57 GLY O A 61 ASP N 1.0 2.4 3.5 54 54 A 57 GLY O A 61 ASP H 1.0 1.5 2.5 55 55 A 58 LYS O A 62 MET N 1.0 2.4 3.5 56 56 A 58 LYS O A 62 MET H 1.0 1.5 2.5 57 57 A 59 PHE O A 63 ALA N 1.0 2.4 3.5 58 58 A 59 PHE O A 63 ALA H 1.0 1.5 2.5 59 59 A 60 GLU O A 64 LYS N 1.0 2.4 3.5 60 60 A 60 GLU O A 64 LYS H 1.0 1.5 2.5 61 61 A 61 ASP O A 65 ALA N 1.0 2.4 3.5 62 62 A 61 ASP O A 65 ALA H 1.0 1.5 2.5 63 63 A 62 MET O A 66 ASP N 1.0 2.4 3.5 64 64 A 62 MET O A 66 ASP H 1.0 1.5 2.5 65 65 A 63 ALA O A 67 LYS N 1.0 2.4 3.5 66 66 A 63 ALA O A 67 LYS H 1.0 1.5 2.5 67 67 A 64 LYS O A 68 ALA N 1.0 2.4 3.5 68 68 A 64 LYS O A 68 ALA H 1.0 1.5 2.5 69 69 A 65 ALA O A 69 ARG N 1.0 2.4 3.5 70 70 A 65 ALA O A 69 ARG H 1.0 1.5 2.5 71 71 A 66 ASP O A 70 TYR N 1.0 2.4 3.5 72 72 A 66 ASP O A 70 TYR H 1.0 1.5 2.5 73 73 A 67 LYS O A 71 GLU N 1.0 2.4 3.5 74 74 A 67 LYS O A 71 GLU H 1.0 1.5 2.5 75 75 A 68 ALA O A 72 ARG N 1.0 2.4 3.5 76 76 A 68 ALA O A 72 ARG H 1.0 1.5 2.5 77 77 A 69 ARG O A 73 GLU N 1.0 2.4 3.5 78 78 A 69 ARG O A 73 GLU H 1.0 1.5 2.5 79 79 A 70 TYR O A 74 MET N 1.0 2.4 3.5 80 80 A 70 TYR O A 74 MET H 1.0 1.5 2.5 81 81 A 71 GLU O A 75 LYS N 1.0 2.4 3.5 82 82 A 71 GLU O A 75 LYS H 1.0 1.5 2.5 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 4 ASP C A 5 PRO N A 5 PRO CA A 5 PRO C 1.0 -110.00 -15.92 PHI 2 2 A 5 PRO N A 5 PRO CA A 5 PRO C A 6 LYS N 1.0 -70.00 15.34 PSI 3 3 A 5 PRO C A 6 LYS N A 6 LYS CA A 6 LYS C 1.0 -130.00 -28.98 PHI 4 4 A 6 LYS N A 6 LYS CA A 6 LYS C A 7 LYS N 1.0 -70.00 40.94 PSI 5 5 A 6 LYS C A 7 LYS N A 7 LYS CA A 7 LYS C 1.0 -140.00 -5.78 PHI 6 6 A 7 LYS N A 7 LYS CA A 7 LYS C A 8 PRO N 1.0 90.00 208.06 PSI 7 7 A 7 LYS C A 8 PRO N A 8 PRO CA A 8 PRO C 1.0 -110.00 -19.84 PHI 8 8 A 8 PRO N A 8 PRO CA A 8 PRO C A 9 ARG N 1.0 100.00 188.94 PSI 9 9 A 8 PRO C A 9 ARG N A 9 ARG CA A 9 ARG C 1.0 -130.00 1.44 PHI 10 10 A 9 ARG N A 9 ARG CA A 9 ARG C A 10 GLY N 1.0 -70.00 24.92 PSI 11 11 A 10 GLY C A 11 LYS N A 11 LYS CA A 11 LYS C 1.0 -130.00 -6.10 PHI 12 12 A 11 LYS N A 11 LYS CA A 11 LYS C A 12 MET N 1.0 -70.00 21.38 PSI 13 13 A 11 LYS C A 12 MET N A 12 MET CA A 12 MET C 1.0 -180.00 31.62 PHI 14 14 A 12 MET N A 12 MET CA A 12 MET C A 13 SER N 1.0 90.00 204.04 PSI 15 15 A 12 MET C A 13 SER N A 13 SER CA A 13 SER C 1.0 -120.00 -49.62 PHI 16 16 A 13 SER N A 13 SER CA A 13 SER C A 14 SER N 1.0 140.00 190.66 PSI 17 17 A 13 SER C A 14 SER N A 14 SER CA A 14 SER C 1.0 -90.00 -34.32 PHI 18 18 A 14 SER N A 14 SER CA A 14 SER C A 15 TYR N 1.0 -70.00 -10.70 PSI 19 19 A 14 SER C A 15 TYR N A 15 TYR CA A 15 TYR C 1.0 -90.00 -38.08 PHI 20 20 A 15 TYR N A 15 TYR CA A 15 TYR C A 16 ALA N 1.0 -70.00 -14.70 PSI 21 21 A 15 TYR C A 16 ALA N A 16 ALA CA A 16 ALA C 1.0 -90.00 -38.48 PHI 22 22 A 16 ALA N A 16 ALA CA A 16 ALA C A 17 PHE N 1.0 -70.00 -15.88 PSI 23 23 A 16 ALA C A 17 PHE N A 17 PHE CA A 17 PHE C 1.0 -90.00 -39.56 PHI 24 24 A 29 LYS C A 30 HIS N A 30 HIS CA A 30 HIS C 1.0 -160.00 -94.64 PHI 25 25 A 30 HIS N A 30 HIS CA A 30 HIS C A 31 PRO N 1.0 40.00 92.98 PSI 26 26 A 30 HIS C A 31 PRO N A 31 PRO CA A 31 PRO C 1.0 -90.00 -22.92 PHI 27 27 A 31 PRO N A 31 PRO CA A 31 PRO C A 32 ASP N 1.0 -60.00 4.98 PSI 28 28 A 31 PRO C A 32 ASP N A 32 ASP CA A 32 ASP C 1.0 -130.00 -26.98 PHI 29 29 A 32 ASP N A 32 ASP CA A 32 ASP C A 33 ALA N 1.0 -70.00 48.36 PSI 30 30 A 32 ASP C A 33 ALA N A 33 ALA CA A 33 ALA C 1.0 -130.00 -7.66 PHI 31 31 A 33 ALA N A 33 ALA CA A 33 ALA C A 34 SER N 1.0 90.00 199.94 PSI 32 32 A 33 ALA C A 34 SER N A 34 SER CA A 34 SER C 1.0 -170.00 26.12 PHI 33 33 A 34 SER N A 34 SER CA A 34 SER C A 35 VAL N 1.0 80.00 199.78 PSI 34 34 A 34 SER C A 35 VAL N A 35 VAL CA A 35 VAL C 1.0 -170.00 27.22 PHI 35 35 A 35 VAL N A 35 VAL CA A 35 VAL C A 36 ASN N 1.0 90.00 188.70 PSI 36 36 A 35 VAL C A 36 ASN N A 36 ASN CA A 36 ASN C 1.0 -120.00 -42.14 PHI 37 37 A 36 ASN N A 36 ASN CA A 36 ASN C A 37 PHE N 1.0 80.00 245.22 PSI 38 38 A 36 ASN C A 37 PHE N A 37 PHE CA A 37 PHE C 1.0 -90.00 -32.30 PHI 39 39 A 37 PHE N A 37 PHE CA A 37 PHE C A 38 SER N 1.0 -70.00 -10.30 PSI 40 40 A 37 PHE C A 38 SER N A 38 SER CA A 38 SER C 1.0 -90.00 -38.20 PHI 41 41 A 38 SER N A 38 SER CA A 38 SER C A 39 GLU N 1.0 -70.00 -6.56 PSI 42 42 A 38 SER C A 39 GLU N A 39 GLU CA A 39 GLU C 1.0 -90.00 -40.30 PHI 43 43 A 39 GLU N A 39 GLU CA A 39 GLU C A 40 PHE N 1.0 -70.00 -8.36 PSI 44 44 A 39 GLU C A 40 PHE N A 40 PHE CA A 40 PHE C 1.0 -90.00 -39.00 PHI 45 45 A 41 SER C A 42 LYS N A 42 LYS CA A 42 LYS C 1.0 -90.00 -37.02 PHI 46 46 A 50 THR C A 51 MET N A 51 MET CA A 51 MET C 1.0 -180.00 33.94 PHI 47 47 A 51 MET N A 51 MET CA A 51 MET C A 52 SER N 1.0 50.00 223.84 PSI 48 48 A 51 MET C A 52 SER N A 52 SER CA A 52 SER C 1.0 -120.00 -49.60 PHI 49 49 A 52 SER N A 52 SER CA A 52 SER C A 53 ALA N 1.0 130.00 200.04 PSI 50 50 A 52 SER C A 53 ALA N A 53 ALA CA A 53 ALA C 1.0 -90.00 -33.26 PHI 51 51 A 53 ALA N A 53 ALA CA A 53 ALA C A 54 LYS N 1.0 -70.00 -14.08 PSI 52 52 A 53 ALA C A 54 LYS N A 54 LYS CA A 54 LYS C 1.0 -90.00 -38.74 PHI 53 53 A 54 LYS N A 54 LYS CA A 54 LYS C A 55 GLU N 1.0 -70.00 -16.82 PSI 54 54 A 54 LYS C A 55 GLU N A 55 GLU CA A 55 GLU C 1.0 -90.00 -37.00 PHI 55 55 A 55 GLU N A 55 GLU CA A 55 GLU C A 56 LYS N 1.0 -70.00 -18.88 PSI 56 56 A 55 GLU C A 56 LYS N A 56 LYS CA A 56 LYS C 1.0 -90.00 -39.28 PHI 57 57 A 75 LYS C A 76 THR N A 76 THR CA A 76 THR C 1.0 -130.00 -25.58 PHI 58 58 A 76 THR N A 76 THR CA A 76 THR C A 77 TYR N 1.0 -70.00 39.74 PSI 59 59 A 76 THR C A 77 TYR N A 77 TYR CA A 77 TYR C 1.0 -180.00 42.08 PHI 60 60 A 77 TYR N A 77 TYR CA A 77 TYR C A 78 ILE N 1.0 90.00 193.78 PSI 61 61 A 77 TYR C A 78 ILE N A 78 ILE CA A 78 ILE C 1.0 -170.00 -3.94 PHI 62 62 A 78 ILE N A 78 ILE CA A 78 ILE C A 79 PRO N 1.0 60.00 186.92 PSI 63 63 A 78 ILE C A 79 PRO N A 79 PRO CA A 79 PRO C 1.0 -100.00 -30.52 PHI 64 64 A 79 PRO N A 79 PRO CA A 79 PRO C A 80 PRO N 1.0 110.00 181.86 PSI 65 65 A 79 PRO C A 80 PRO N A 80 PRO CA A 80 PRO C 1.0 -100.00 -21.02 PHI 66 66 A 80 PRO N A 80 PRO CA A 80 PRO C A 81 LYS N 1.0 110.00 185.68 PSI 67 67 B 14 LEU N B 14 LEU CA B 14 LEU C B 15 SER N 1.0 80.00 198.78 PSI 68 68 B 14 LEU C B 15 SER N B 15 SER CA B 15 SER C 1.0 -130.00 -8.64 PHI 69 69 B 15 SER N B 15 SER CA B 15 SER C B 16 GLN N 1.0 -70.00 15.40 PSI 70 70 B 16 GLN C B 17 GLU N B 17 GLU CA B 17 GLU C 1.0 -130.00 -17.70 PHI 71 71 B 17 GLU N B 17 GLU CA B 17 GLU C B 18 THR N 1.0 -70.00 5.20 PSI 72 72 B 17 GLU C B 18 THR N B 18 THR CA B 18 THR C 1.0 -120.00 -11.92 PHI 73 73 B 18 THR N B 18 THR CA B 18 THR C B 19 PHE N 1.0 -70.00 18.68 PSI 74 74 B 18 THR C B 19 PHE N B 19 PHE CA B 19 PHE C 1.0 -130.00 -0.34 PHI 75 75 B 19 PHE N B 19 PHE CA B 19 PHE C B 20 SER N 1.0 -70.00 10.62 PSI 76 76 B 19 PHE C B 20 SER N B 20 SER CA B 20 SER C 1.0 -110.00 -10.32 PHI 77 77 B 20 SER N B 20 SER CA B 20 SER C B 21 ASP N 1.0 -70.00 3.34 PSI 78 78 B 20 SER C B 21 ASP N B 21 ASP CA B 21 ASP C 1.0 -100.00 -34.76 PHI 79 79 B 21 ASP N B 21 ASP CA B 21 ASP C B 22 LEU N 1.0 -70.00 -6.00 PSI 80 80 B 21 ASP C B 22 LEU N B 22 LEU CA B 22 LEU C 1.0 -100.00 -32.12 PHI 81 81 B 22 LEU N B 22 LEU CA B 22 LEU C B 23 TRP N 1.0 -70.00 -8.92 PSI 82 82 B 22 LEU C B 23 TRP N B 23 TRP CA B 23 TRP C 1.0 -110.00 -17.48 PHI 83 83 B 23 TRP N B 23 TRP CA B 23 TRP C B 24 LYS N 1.0 -70.00 13.36 PSI 84 84 B 23 TRP C B 24 LYS N B 24 LYS CA B 24 LYS C 1.0 -130.00 -17.04 PHI 85 85 B 24 LYS N B 24 LYS CA B 24 LYS C B 25 LEU N 1.0 -70.00 24.64 PSI 86 86 B 24 LYS C B 25 LEU N B 25 LEU CA B 25 LEU C 1.0 -130.00 -28.48 PHI 87 87 B 25 LEU N B 25 LEU CA B 25 LEU C B 26 LEU N 1.0 -70.00 33.50 PSI 88 88 B 25 LEU C B 26 LEU N B 26 LEU CA B 26 LEU C 1.0 -130.00 -13.72 PHI 89 89 B 26 LEU N B 26 LEU CA B 26 LEU C B 27 PRO N 1.0 100.00 200.34 PSI 90 90 B 26 LEU C B 27 PRO N B 27 PRO CA B 27 PRO C 1.0 -110.00 -11.82 PHI 91 91 B 27 PRO N B 27 PRO CA B 27 PRO C B 28 GLU N 1.0 97.04 137.04 PSI 92 92 B 27 PRO C B 28 GLU N B 28 GLU CA B 28 GLU C 1.0 -180.00 26.60 PHI 93 93 B 28 GLU N B 28 GLU CA B 28 GLU C B 29 ASN N 1.0 50.00 225.22 PSI 94 94 B 28 GLU C B 29 ASN N B 29 ASN CA B 29 ASN C 1.0 -130.00 -23.50 PHI 95 95 B 29 ASN N B 29 ASN CA B 29 ASN C B 30 ASN N 1.0 -70.00 10.92 PSI 96 96 B 32 LEU C B 33 SER N B 33 SER CA B 33 SER C 1.0 -130.00 -17.20 PHI 97 97 B 33 SER N B 33 SER CA B 33 SER C B 34 PRO N 1.0 100.00 206.74 PSI 98 98 B 33 SER C B 34 PRO N B 34 PRO CA B 34 PRO C 1.0 -100.00 -30.98 PHI 99 99 B 34 PRO N B 34 PRO CA B 34 PRO C B 35 LEU N 1.0 110.00 186.42 PSI 100 100 B 34 PRO C B 35 LEU N B 35 LEU CA B 35 LEU C 1.0 -160.00 12.64 PHI 101 101 B 35 LEU N B 35 LEU CA B 35 LEU C B 36 PRO N 1.0 90.00 205.46 PSI 102 102 B 35 LEU C B 36 PRO N B 36 PRO CA B 36 PRO C 1.0 -100.00 -14.52 PHI 103 103 B 36 PRO N B 36 PRO CA B 36 PRO C B 37 SER N 1.0 110.00 170.40 PSI 104 104 B 36 PRO C B 37 SER N B 37 SER CA B 37 SER C 1.0 -150.00 -31.04 PHI 105 105 B 37 SER N B 37 SER CA B 37 SER C B 38 GLN N 1.0 -70.00 50.56 PSI 106 106 B 37 SER C B 38 GLN N B 38 GLN CA B 38 GLN C 1.0 -130.00 -24.08 PHI 107 107 B 38 GLN N B 38 GLN CA B 38 GLN C B 39 ALA N 1.0 -70.00 39.30 PSI 108 108 B 39 ALA C B 40 MET N B 40 MET CA B 40 MET C 1.0 -130.00 -10.46 PHI 109 109 B 40 MET N B 40 MET CA B 40 MET C B 41 ASP N 1.0 -70.00 28.04 PSI 110 110 B 40 MET C B 41 ASP N B 41 ASP CA B 41 ASP C 1.0 -120.00 5.42 PHI 111 111 B 41 ASP N B 41 ASP CA B 41 ASP C B 42 ASP N 1.0 -80.00 11.46 PSI 112 112 B 41 ASP C B 42 ASP N B 42 ASP CA B 42 ASP C 1.0 -110.00 -36.50 PHI 113 113 B 42 ASP N B 42 ASP CA B 42 ASP C B 43 LEU N 1.0 -70.00 34.44 PSI 114 114 B 42 ASP C B 43 LEU N B 43 LEU CA B 43 LEU C 1.0 -110.00 -22.12 PHI 115 115 B 43 LEU N B 43 LEU CA B 43 LEU C B 44 MET N 1.0 -70.00 11.80 PSI 116 116 B 43 LEU C B 44 MET N B 44 MET CA B 44 MET C 1.0 -130.00 -7.56 PHI 117 117 B 44 MET N B 44 MET CA B 44 MET C B 45 LEU N 1.0 -70.00 25.76 PSI 118 118 B 45 LEU C B 46 SER N B 46 SER CA B 46 SER C 1.0 -130.00 -9.52 PHI 119 119 B 46 SER N B 46 SER CA B 46 SER C B 47 PRO N 1.0 100.00 195.80 PSI 120 120 B 46 SER C B 47 PRO N B 47 PRO CA B 47 PRO C 1.0 -100.00 -24.84 PHI 121 121 B 47 PRO N B 47 PRO CA B 47 PRO C B 48 ASP N 1.0 -60.00 12.84 PSI 122 122 B 47 PRO C B 48 ASP N B 48 ASP CA B 48 ASP C 1.0 -120.00 -5.34 PHI 123 123 B 48 ASP N B 48 ASP CA B 48 ASP C B 49 ASP N 1.0 -70.00 24.72 PSI 124 124 B 48 ASP C B 49 ASP N B 49 ASP CA B 49 ASP C 1.0 -100.00 -27.10 PHI 125 125 B 49 ASP N B 49 ASP CA B 49 ASP C B 50 ILE N 1.0 -70.00 -15.20 PSI 126 126 B 49 ASP C B 50 ILE N B 50 ILE CA B 50 ILE C 1.0 -100.00 -26.76 PHI 127 127 B 50 ILE N B 50 ILE CA B 50 ILE C B 51 GLU N 1.0 -70.00 -12.46 PSI 128 128 B 50 ILE C B 51 GLU N B 51 GLU CA B 51 GLU C 1.0 -90.00 -38.44 PHI 129 129 B 51 GLU N B 51 GLU CA B 51 GLU C B 52 GLN N 1.0 -70.00 -6.68 PSI 130 130 B 51 GLU C B 52 GLN N B 52 GLN CA B 52 GLN C 1.0 -120.00 -26.72 PHI 131 131 B 52 GLN N B 52 GLN CA B 52 GLN C B 53 TRP N 1.0 -70.00 21.58 PSI 132 132 B 52 GLN C B 53 TRP N B 53 TRP CA B 53 TRP C 1.0 -130.00 -45.08 PHI 133 133 B 53 TRP N B 53 TRP CA B 53 TRP C B 54 PHE N 1.0 -70.00 46.58 PSI 134 134 B 54 PHE C B 55 THR N B 55 THR CA B 55 THR C 1.0 -170.00 27.74 PHI 135 135 B 55 THR N B 55 THR CA B 55 THR C B 56 GLU N 1.0 90.00 181.80 PSI 136 136 B 55 THR C B 56 GLU N B 56 GLU CA B 56 GLU C 1.0 -180.00 16.92 PHI 137 137 B 56 GLU N B 56 GLU CA B 56 GLU C B 57 ASP N 1.0 90.00 188.14 PSI 138 138 B 56 GLU C B 57 ASP N B 57 ASP CA B 57 ASP C 1.0 -180.00 38.70 PHI 139 139 B 57 ASP N B 57 ASP CA B 57 ASP C B 58 PRO N 1.0 80.00 201.72 PSI 140 140 B 57 ASP C B 58 PRO N B 58 PRO CA B 58 PRO C 1.0 -100.00 -29.80 PHI 141 141 B 58 PRO N B 58 PRO CA B 58 PRO C B 59 GLY N 1.0 -60.00 27.68 PSI 142 142 B 59 GLY C B 60 PRO N B 60 PRO CA B 60 PRO C 1.0 -120.00 -16.10 PHI 143 143 A 17 PHE N A 17 PHE CA A 17 PHE C A 18 PHE N 1.0 -70.00 -6.22 PSI 144 144 A 17 PHE C A 18 PHE N A 18 PHE CA A 18 PHE C 1.0 -90.00 -39.74 PHI 145 145 A 18 PHE C A 19 VAL N A 19 VAL CA A 19 VAL C 1.0 -90.00 -38.22 PHI 146 146 A 18 PHE N A 18 PHE CA A 18 PHE C A 19 VAL N 1.0 -70.00 -15.58 PSI 147 147 A 19 VAL C A 20 GLN N A 20 GLN CA A 20 GLN C 1.0 -90.00 -36.22 PHI 148 148 A 19 VAL N A 19 VAL CA A 19 VAL C A 20 GLN N 1.0 -70.00 -17.34 PSI 149 149 A 20 GLN C A 21 THR N A 21 THR CA A 21 THR C 1.0 -90.00 -38.50 PHI 150 150 A 20 GLN N A 20 GLN CA A 20 GLN C A 21 THR N 1.0 -70.00 -10.04 PSI 151 151 A 21 THR C A 22 CYS N A 22 CYS CA A 22 CYS C 1.0 -90.00 -38.46 PHI 152 152 A 21 THR N A 21 THR CA A 21 THR C A 22 CYS N 1.0 -70.00 -18.16 PSI 153 153 A 22 CYS C A 23 ARG N A 23 ARG CA A 23 ARG C 1.0 -90.00 -37.10 PHI 154 154 A 22 CYS N A 22 CYS CA A 22 CYS C A 23 ARG N 1.0 -70.00 -6.14 PSI 155 155 A 23 ARG C A 24 GLU N A 24 GLU CA A 24 GLU C 1.0 -90.00 -39.06 PHI 156 156 A 23 ARG N A 23 ARG CA A 23 ARG C A 24 GLU N 1.0 -70.00 -12.32 PSI 157 157 A 24 GLU C A 25 GLU N A 25 GLU CA A 25 GLU C 1.0 -90.00 -39.02 PHI 158 158 A 24 GLU N A 24 GLU CA A 24 GLU C A 25 GLU N 1.0 -70.00 -15.60 PSI 159 159 A 25 GLU C A 26 HIS N A 26 HIS CA A 26 HIS C 1.0 -90.00 -39.14 PHI 160 160 A 25 GLU N A 25 GLU CA A 25 GLU C A 26 HIS N 1.0 -70.00 -8.62 PSI 161 161 A 26 HIS C A 27 LYS N A 27 LYS CA A 27 LYS C 1.0 -90.00 -37.02 PHI 162 162 A 26 HIS N A 26 HIS CA A 26 HIS C A 27 LYS N 1.0 -70.00 -12.78 PSI 163 163 A 27 LYS C A 28 LYS N A 28 LYS CA A 28 LYS C 1.0 -90.00 -38.18 PHI 164 164 A 27 LYS N A 27 LYS CA A 27 LYS C A 28 LYS N 1.0 -70.00 -11.70 PSI 165 165 A 28 LYS C A 29 LYS N A 29 LYS CA A 29 LYS C 1.0 -130.00 -27.44 PHI 166 166 A 29 LYS N A 29 LYS CA A 29 LYS C A 30 HIS N 1.0 -70.00 20.14 PSI 167 167 A 28 LYS N A 28 LYS CA A 28 LYS C A 29 LYS N 1.0 -70.00 -13.70 PSI 168 168 A 40 PHE N A 40 PHE CA A 40 PHE C A 41 SER N 1.0 -70.00 -15.42 PSI 169 169 A 40 PHE C A 41 SER N A 41 SER CA A 41 SER C 1.0 -90.00 -38.90 PHI 170 170 A 41 SER N A 41 SER CA A 41 SER C A 42 LYS N 1.0 -70.00 -12.24 PSI 171 171 A 42 LYS N A 42 LYS CA A 42 LYS C A 43 LYS N 1.0 -70.00 -17.12 PSI 172 172 A 42 LYS C A 43 LYS N A 43 LYS CA A 43 LYS C 1.0 -90.00 -29.84 PHI 173 173 A 43 LYS C A 44 CYS N A 44 CYS CA A 44 CYS C 1.0 -90.00 -36.82 PHI 174 174 A 43 LYS N A 43 LYS CA A 43 LYS C A 44 CYS N 1.0 -70.00 -17.48 PSI 175 175 A 44 CYS C A 45 SER N A 45 SER CA A 45 SER C 1.0 -90.00 -38.00 PHI 176 176 A 44 CYS N A 44 CYS CA A 44 CYS C A 45 SER N 1.0 -70.00 -9.02 PSI 177 177 A 45 SER C A 46 GLU N A 46 GLU CA A 46 GLU C 1.0 -90.00 -38.36 PHI 178 178 A 45 SER N A 45 SER CA A 45 SER C A 46 GLU N 1.0 -70.00 -15.90 PSI 179 179 A 46 GLU C A 47 ARG N A 47 ARG CA A 47 ARG C 1.0 -90.00 -39.64 PHI 180 180 A 46 GLU N A 46 GLU CA A 46 GLU C A 47 ARG N 1.0 -70.00 -13.20 PSI 181 181 A 47 ARG C A 48 TRP N A 48 TRP CA A 48 TRP C 1.0 -90.00 -35.86 PHI 182 182 A 47 ARG N A 47 ARG CA A 47 ARG C A 48 TRP N 1.0 -70.00 -15.22 PSI 183 183 A 48 TRP C A 49 LYS N A 49 LYS CA A 49 LYS C 1.0 -100.00 -27.88 PHI 184 184 A 48 TRP N A 48 TRP CA A 48 TRP C A 49 LYS N 1.0 -70.00 -12.78 PSI 185 185 A 49 LYS C A 50 THR N A 50 THR CA A 50 THR C 1.0 -140.00 -39.98 PHI 186 186 A 49 LYS N A 49 LYS CA A 49 LYS C A 50 THR N 1.0 -70.00 11.34 PSI 187 187 A 50 THR N A 50 THR CA A 50 THR C A 51 MET N 1.0 -60.00 40.00 PSI 188 188 A 56 LYS N A 56 LYS CA A 56 LYS C A 57 GLY N 1.0 -70.00 -7.96 PSI 189 189 A 56 LYS C A 57 GLY N A 57 GLY CA A 57 GLY C 1.0 -90.00 -37.58 PHI 190 190 A 57 GLY C A 58 LYS N A 58 LYS CA A 58 LYS C 1.0 -90.00 -38.78 PHI 191 191 A 57 GLY N A 57 GLY CA A 57 GLY C A 58 LYS N 1.0 -70.00 -16.96 PSI 192 192 A 58 LYS C A 59 PHE N A 59 PHE CA A 59 PHE C 1.0 -90.00 -38.98 PHI 193 193 A 58 LYS N A 58 LYS CA A 58 LYS C A 59 PHE N 1.0 -70.00 -10.46 PSI 194 194 A 59 PHE C A 60 GLU N A 60 GLU CA A 60 GLU C 1.0 -90.00 -38.20 PHI 195 195 A 59 PHE N A 59 PHE CA A 59 PHE C A 60 GLU N 1.0 -70.00 -14.34 PSI 196 196 A 60 GLU C A 61 ASP N A 61 ASP CA A 61 ASP C 1.0 -90.00 -39.18 PHI 197 197 A 60 GLU N A 60 GLU CA A 60 GLU C A 61 ASP N 1.0 -70.00 -14.56 PSI 198 198 A 61 ASP C A 62 MET N A 62 MET CA A 62 MET C 1.0 -90.00 -38.64 PHI 199 199 A 61 ASP N A 61 ASP CA A 61 ASP C A 62 MET N 1.0 -70.00 -14.34 PSI 200 200 A 62 MET C A 63 ALA N A 63 ALA CA A 63 ALA C 1.0 -90.00 -39.06 PHI 201 201 A 62 MET N A 62 MET CA A 62 MET C A 63 ALA N 1.0 -70.00 -7.30 PSI 202 202 A 63 ALA C A 64 LYS N A 64 LYS CA A 64 LYS C 1.0 -90.00 -39.04 PHI 203 203 A 63 ALA N A 63 ALA CA A 63 ALA C A 64 LYS N 1.0 -70.00 -14.42 PSI 204 204 A 64 LYS C A 65 ALA N A 65 ALA CA A 65 ALA C 1.0 -90.00 -39.12 PHI 205 205 A 64 LYS N A 64 LYS CA A 64 LYS C A 65 ALA N 1.0 -70.00 -12.88 PSI 206 206 A 65 ALA C A 66 ASP N A 66 ASP CA A 66 ASP C 1.0 -90.00 -37.82 PHI 207 207 A 65 ALA N A 65 ALA CA A 65 ALA C A 66 ASP N 1.0 -70.00 -12.66 PSI 208 208 A 66 ASP C A 67 LYS N A 67 LYS CA A 67 LYS C 1.0 -90.00 -39.26 PHI 209 209 A 66 ASP N A 66 ASP CA A 66 ASP C A 67 LYS N 1.0 -70.00 -13.28 PSI 210 210 A 67 LYS C A 68 ALA N A 68 ALA CA A 68 ALA C 1.0 -90.00 -39.42 PHI 211 211 A 67 LYS N A 67 LYS CA A 67 LYS C A 68 ALA N 1.0 -70.00 -5.36 PSI 212 212 A 68 ALA C A 69 ARG N A 69 ARG CA A 69 ARG C 1.0 -90.00 -39.32 PHI 213 213 A 68 ALA N A 68 ALA CA A 68 ALA C A 69 ARG N 1.0 -70.00 -15.16 PSI 214 214 A 69 ARG C A 70 TYR N A 70 TYR CA A 70 TYR C 1.0 -90.00 -37.54 PHI 215 215 A 69 ARG N A 69 ARG CA A 69 ARG C A 70 TYR N 1.0 -70.00 -17.26 PSI 216 216 A 70 TYR C A 71 GLU N A 71 GLU CA A 71 GLU C 1.0 -90.00 -37.06 PHI 217 217 A 70 TYR N A 70 TYR CA A 70 TYR C A 71 GLU N 1.0 -70.00 -18.10 PSI 218 218 A 71 GLU C A 72 ARG N A 72 ARG CA A 72 ARG C 1.0 -90.00 -39.26 PHI 219 219 A 71 GLU N A 71 GLU CA A 71 GLU C A 72 ARG N 1.0 -70.00 -14.56 PSI 220 220 A 72 ARG C A 73 GLU N A 73 GLU CA A 73 GLU C 1.0 -90.00 -39.28 PHI 221 221 A 72 ARG N A 72 ARG CA A 72 ARG C A 73 GLU N 1.0 -70.00 -16.92 PSI 222 222 A 73 GLU C A 74 MET N A 74 MET CA A 74 MET C 1.0 -90.00 -38.60 PHI 223 223 A 73 GLU N A 73 GLU CA A 73 GLU C A 74 MET N 1.0 -70.00 -14.36 PSI 224 224 A 74 MET C A 75 LYS N A 75 LYS CA A 75 LYS C 1.0 -100.00 -25.16 PHI 225 225 A 75 LYS N A 75 LYS CA A 75 LYS C A 76 THR N 1.0 -70.00 8.74 PSI 226 226 A 74 MET N A 74 MET CA A 74 MET C A 75 LYS N 1.0 -70.00 -2.36 PSI stop_ save_