data_nef_c17865_2lht 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_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 22 CYS SG 1 32 CYS SG 1 39 CYS SG 1 52 CYS SG 1 78 CYS SG 1 88 CYS SG 1 95 CYS SG 1 104 CYS SG stop_ 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 26 ALA start . . 2 A 27 ASP middle . . 3 A 28 VAL middle . . 4 A 29 PHE middle . . 5 A 30 ASP middle . . 6 A 31 PRO middle . false 7 A 32 PRO middle . false 8 A 33 THR middle . . 9 A 34 GLN middle . . 10 A 35 TYR middle . . 11 A 36 GLY middle . false 12 A 37 TYR middle . . 13 A 38 ASP middle . . 14 A 39 GLY middle . false 15 A 40 LYS middle . . 16 A 41 PRO middle . false 17 A 42 LEU middle . . 18 A 43 ASP middle . . 19 A 44 ALA middle . . 20 A 45 SER middle . . 21 A 46 PHE middle . . 22 A 47 CYS middle -HG . 23 A 48 ARG middle . . 24 A 49 THR middle . . 25 A 50 ALA middle . . 26 A 51 GLY middle . false 27 A 52 SER middle . . 28 A 53 ARG middle . . 29 A 54 GLU middle . . 30 A 55 LYS middle . . 31 A 56 ASP middle . . 32 A 57 CYS middle -HG . 33 A 58 ARG middle . . 34 A 59 LYS middle . . 35 A 60 ASP middle . . 36 A 61 VAL middle . . 37 A 62 GLN middle . . 38 A 63 ALA middle . . 39 A 64 CYS middle -HG . 40 A 65 ASP middle . . 41 A 66 LYS middle . . 42 A 67 LYS middle . . 43 A 68 TYR middle . . 44 A 69 ASP middle . . 45 A 70 ASP middle . . 46 A 71 GLN middle . . 47 A 72 GLY middle . false 48 A 73 ARG middle . . 49 A 74 GLU middle . . 50 A 75 THR middle . . 51 A 76 ALA middle . . 52 A 77 CYS middle -HG . 53 A 78 ALA middle . . 54 A 79 LYS middle . . 55 A 80 GLY middle . false 56 A 81 ILE middle . . 57 A 82 ARG middle . . 58 A 83 GLU middle . . 59 A 84 LYS middle . . 60 A 85 TYR middle . . 61 A 86 LYS middle . . 62 A 87 PRO middle . false 63 A 88 ALA middle . . 64 A 89 VAL middle . . 65 A 90 VAL middle . . 66 A 91 TYR middle . . 67 A 92 GLY middle . false 68 A 93 TYR middle . . 69 A 94 ASP middle . . 70 A 95 GLY middle . false 71 A 96 LYS middle . . 72 A 97 PRO middle . false 73 A 98 LEU middle . . 74 A 99 ASP middle . . 75 A 100 LEU middle . . 76 A 101 GLY middle . false 77 A 102 PHE middle . . 78 A 103 CYS middle -HG . 79 A 104 THR middle . . 80 A 105 LEU middle . . 81 A 106 ALA middle . . 82 A 107 GLY middle . false 83 A 108 ILE middle . . 84 A 109 ARG middle . . 85 A 110 GLU middle . . 86 A 111 VAL middle . . 87 A 112 ASP middle . . 88 A 113 CYS middle -HG . 89 A 114 ARG middle . . 90 A 115 LYS middle . . 91 A 116 ASP middle . . 92 A 117 ALA middle . . 93 A 118 GLN middle . . 94 A 119 THR middle . . 95 A 120 CYS middle -HG . 96 A 121 ASP middle . . 97 A 122 LYS middle . . 98 A 123 LYS middle . . 99 A 124 TYR middle . . 100 A 125 GLU middle . . 101 A 126 SER middle . . 102 A 127 ASP middle . . 103 A 128 LYS middle . . 104 A 129 CYS middle -HG . 105 A 130 LEU middle . . 106 A 131 ASN middle . . 107 A 132 ALA middle . . 108 A 133 ILE middle . . 109 A 134 LYS middle . . 110 A 135 GLU middle . . 111 A 136 LYS middle . . 112 A 137 TYR middle . . 113 A 138 LYS middle . . 114 A 139 PRO middle . false 115 A 140 VAL middle . . 116 A 141 VAL middle . . 117 A 142 ASP middle . . 118 A 143 PRO middle . false 119 A 144 ASN middle . . 120 A 145 PRO middle . false 121 A 146 PRO middle . false 122 A 147 ALA 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 26 ALA HA H 1 4.067 0.003 A 26 ALA HB% H 1 1.486 0.001 A 26 ALA C C 13 173.546 0.100 A 26 ALA CA C 13 51.879 0.187 A 26 ALA CB C 13 19.454 0.078 A 27 ASP H H 1 8.639 0.002 A 27 ASP HA H 1 4.638 0.003 A 27 ASP HBx H 1 2.482 0.004 A 27 ASP HBy H 1 2.569 0.001 A 27 ASP C C 13 175.878 0.100 A 27 ASP CA C 13 54.382 0.088 A 27 ASP CB C 13 41.729 0.072 A 27 ASP N N 15 121.041 0.100 A 28 VAL H H 1 8.113 0.002 A 28 VAL HA H 1 4.033 0.004 A 28 VAL HB H 1 1.960 0.003 A 28 VAL HG1% H 1 0.805 0.006 A 28 VAL HG2% H 1 0.805 0.006 A 28 VAL C C 13 175.521 0.100 A 28 VAL CA C 13 62.216 0.072 A 28 VAL CB C 13 33.003 0.050 A 28 VAL CG1 C 13 20.813 0.127 A 28 VAL CG2 C 13 20.813 0.127 A 28 VAL N N 15 119.901 0.100 A 29 PHE H H 1 8.255 0.002 A 29 PHE HA H 1 4.656 0.009 A 29 PHE HBx H 1 2.957 0.005 A 29 PHE HBy H 1 3.101 0.007 A 29 PHE HDx H 1 7.305 0.002 A 29 PHE HDy H 1 7.305 0.002 A 29 PHE HEx H 1 7.219 0.002 A 29 PHE HEy H 1 7.219 0.002 A 29 PHE C C 13 174.874 0.100 A 29 PHE CA C 13 57.159 0.143 A 29 PHE CB C 13 39.795 0.049 A 29 PHE N N 15 123.707 0.100 A 30 ASP H H 1 8.226 0.002 A 30 ASP HA H 1 4.838 0.003 A 30 ASP HBx H 1 2.392 0.006 A 30 ASP HBy H 1 2.614 0.004 A 30 ASP CA C 13 52.385 0.041 A 30 ASP CB C 13 40.801 0.020 A 30 ASP N N 15 124.203 0.100 A 31 PRO HA H 1 4.537 0.002 A 31 PRO HBx H 1 1.879 0.001 A 31 PRO HBy H 1 2.265 0.003 A 31 PRO HDx H 1 3.611 0.005 A 31 PRO HDy H 1 3.646 0.002 A 31 PRO HGx H 1 1.952 0.006 A 31 PRO HGy H 1 1.995 0.001 A 31 PRO CA C 13 61.664 0.023 A 31 PRO CB C 13 30.826 0.003 A 31 PRO CD C 13 50.363 0.070 A 31 PRO CG C 13 27.505 0.053 A 32 PRO HA H 1 4.426 0.001 A 32 PRO HBx H 1 1.870 0.003 A 32 PRO HBy H 1 2.247 0.001 A 32 PRO HDy H 1 3.764 0.005 A 32 PRO HDx H 1 3.620 0.001 A 32 PRO HG2 H 1 1.988 0.001 A 32 PRO HG3 H 1 1.988 0.001 A 32 PRO C C 13 177.226 0.100 A 32 PRO CA C 13 63.169 0.116 A 32 PRO CB C 13 31.948 0.066 A 32 PRO CD C 13 50.429 0.001 A 32 PRO CG C 13 27.440 0.053 A 33 THR H H 1 8.096 0.002 A 33 THR HA H 1 4.195 0.004 A 33 THR HB H 1 4.067 0.004 A 33 THR HG2% H 1 1.075 0.007 A 33 THR C C 13 174.468 0.100 A 33 THR CA C 13 62.110 0.122 A 33 THR CB C 13 69.975 0.087 A 33 THR CG2 C 13 21.641 0.034 A 33 THR N N 15 114.158 0.100 A 34 GLN H H 1 8.278 0.002 A 34 GLN HA H 1 4.263 0.004 A 34 GLN HBx H 1 1.828 0.002 A 34 GLN HBy H 1 1.922 0.003 A 34 GLN HE2y H 1 7.399 0.002 A 34 GLN HE2x H 1 6.790 0.002 A 34 GLN HG2 H 1 2.146 0.002 A 34 GLN HG3 H 1 2.146 0.002 A 34 GLN C C 13 175.445 0.100 A 34 GLN CA C 13 55.763 0.122 A 34 GLN CB C 13 29.691 0.102 A 34 GLN CG C 13 33.665 0.035 A 34 GLN N N 15 122.411 0.100 A 34 GLN NE2 N 15 112.064 0.014 A 35 TYR H H 1 8.227 0.002 A 35 TYR HA H 1 4.520 0.017 A 35 TYR HBy H 1 3.014 0.002 A 35 TYR HBx H 1 2.820 0.001 A 35 TYR HDx H 1 7.056 0.003 A 35 TYR HDy H 1 7.056 0.003 A 35 TYR HEx H 1 6.777 0.002 A 35 TYR HEy H 1 6.777 0.002 A 35 TYR C C 13 176.314 0.100 A 35 TYR CA C 13 57.972 0.122 A 35 TYR CB C 13 38.936 0.025 A 35 TYR CD1 C 13 133.399 0.053 A 35 TYR CD2 C 13 133.399 0.053 A 35 TYR CE1 C 13 118.753 0.097 A 35 TYR CE2 C 13 118.753 0.097 A 35 TYR N N 15 121.048 0.100 A 36 GLY H H 1 8.247 0.002 A 36 GLY HA2 H 1 3.859 0.003 A 36 GLY HA3 H 1 3.859 0.003 A 36 GLY C C 13 174.128 0.100 A 36 GLY CA C 13 45.212 0.070 A 36 GLY N N 15 109.711 0.100 A 37 TYR H H 1 8.101 0.002 A 37 TYR HA H 1 4.482 0.002 A 37 TYR HBy H 1 3.024 0.002 A 37 TYR HBx H 1 2.974 0.002 A 37 TYR HDx H 1 7.097 0.021 A 37 TYR HDy H 1 7.097 0.021 A 37 TYR HEx H 1 6.817 0.022 A 37 TYR HEy H 1 6.817 0.022 A 37 TYR C C 13 175.864 0.100 A 37 TYR CA C 13 58.541 0.078 A 37 TYR CB C 13 38.715 0.043 A 37 TYR CD1 C 13 133.229 0.155 A 37 TYR CD2 C 13 133.229 0.155 A 37 TYR CE1 C 13 118.287 0.092 A 37 TYR CE2 C 13 118.287 0.092 A 37 TYR N N 15 120.302 0.100 A 38 ASP H H 1 8.266 0.002 A 38 ASP HA H 1 4.486 0.007 A 38 ASP HBx H 1 2.603 0.001 A 38 ASP HBy H 1 2.647 0.001 A 38 ASP C C 13 176.538 0.100 A 38 ASP CA C 13 54.223 0.105 A 38 ASP CB C 13 40.988 0.038 A 38 ASP N N 15 121.883 0.100 A 39 GLY H H 1 7.647 0.002 A 39 GLY HAx H 1 3.806 0.001 A 39 GLY HAy H 1 3.861 0.008 A 39 GLY C C 13 173.822 0.100 A 39 GLY CA C 13 45.404 0.050 A 39 GLY N N 15 107.705 0.100 A 40 LYS H H 1 7.908 0.002 A 40 LYS HA H 1 4.575 0.006 A 40 LYS HBy H 1 1.791 0.001 A 40 LYS HBx H 1 1.718 0.003 A 40 LYS HD2 H 1 1.629 0.002 A 40 LYS HD3 H 1 1.629 0.002 A 40 LYS HE2 H 1 2.944 0.008 A 40 LYS HE3 H 1 2.944 0.008 A 40 LYS HG2 H 1 1.391 0.008 A 40 LYS HG3 H 1 1.391 0.008 A 40 LYS CA C 13 54.100 0.077 A 40 LYS CB C 13 32.510 0.042 A 40 LYS CD C 13 29.327 0.053 A 40 LYS CE C 13 42.157 0.097 A 40 LYS CG C 13 24.645 0.034 A 40 LYS N N 15 121.621 0.100 A 41 PRO HA H 1 4.352 0.014 A 41 PRO HBx H 1 1.813 0.003 A 41 PRO HBy H 1 2.182 0.002 A 41 PRO HDx H 1 3.574 0.006 A 41 PRO HDy H 1 3.755 0.007 A 41 PRO HGx H 1 1.889 0.008 A 41 PRO HGy H 1 1.987 0.005 A 41 PRO C C 13 176.806 0.100 A 41 PRO CA C 13 62.758 0.086 A 41 PRO CB C 13 32.314 0.049 A 41 PRO CD C 13 50.830 0.053 A 41 PRO CG C 13 27.049 0.008 A 42 LEU H H 1 8.499 0.002 A 42 LEU HA H 1 4.049 0.004 A 42 LEU HB2 H 1 1.377 0.001 A 42 LEU HB3 H 1 1.377 0.001 A 42 LEU HD1% H 1 0.505 0.005 A 42 LEU HD2% H 1 0.451 0.003 A 42 LEU HG H 1 1.301 0.015 A 42 LEU C C 13 174.973 0.100 A 42 LEU CA C 13 55.436 0.172 A 42 LEU CB C 13 42.093 0.113 A 42 LEU CD1 C 13 24.704 0.053 A 42 LEU CD2 C 13 24.704 0.053 A 42 LEU CG C 13 27.053 0.022 A 42 LEU N N 15 123.488 0.100 A 43 ASP H H 1 7.789 0.002 A 43 ASP HA H 1 4.498 0.006 A 43 ASP HBy H 1 3.030 0.013 A 43 ASP HBx H 1 2.744 0.007 A 43 ASP C C 13 175.947 0.100 A 43 ASP CA C 13 52.858 0.067 A 43 ASP CB C 13 42.221 0.027 A 43 ASP N N 15 123.354 0.100 A 44 ALA H H 1 8.561 0.002 A 44 ALA HA H 1 3.986 0.003 A 44 ALA HB% H 1 1.395 0.009 A 44 ALA C C 13 179.476 0.100 A 44 ALA CA C 13 55.163 0.131 A 44 ALA CB C 13 18.387 0.081 A 44 ALA N N 15 120.147 0.100 A 45 SER H H 1 8.466 0.002 A 45 SER HA H 1 4.151 0.003 A 45 SER HB2 H 1 3.973 0.009 A 45 SER HB3 H 1 3.973 0.009 A 45 SER C C 13 177.191 0.100 A 45 SER CA C 13 61.629 0.074 A 45 SER CB C 13 62.804 0.070 A 45 SER N N 15 115.037 0.100 A 46 PHE H H 1 8.034 0.002 A 46 PHE HA H 1 4.231 0.003 A 46 PHE HBy H 1 3.558 0.002 A 46 PHE HBx H 1 3.049 0.001 A 46 PHE C C 13 176.850 0.100 A 46 PHE CA C 13 60.806 0.141 A 46 PHE CB C 13 39.881 0.053 A 46 PHE N N 15 125.030 0.100 A 47 CYS H H 1 7.691 0.002 A 47 CYS HA H 1 4.251 0.026 A 47 CYS HBy H 1 3.162 0.025 A 47 CYS HBx H 1 2.881 0.005 A 47 CYS C C 13 176.449 0.100 A 47 CYS CA C 13 53.600 0.167 A 47 CYS CB C 13 36.391 0.011 A 47 CYS N N 15 113.943 0.100 A 48 ARG H H 1 7.628 0.002 A 48 ARG HA H 1 4.080 0.004 A 48 ARG HB2 H 1 1.902 0.007 A 48 ARG HB3 H 1 1.902 0.007 A 48 ARG HD2 H 1 3.226 0.008 A 48 ARG HD3 H 1 3.226 0.008 A 48 ARG HG2 H 1 1.707 0.006 A 48 ARG HG3 H 1 1.707 0.006 A 48 ARG C C 13 177.904 0.060 A 48 ARG CA C 13 58.907 0.134 A 48 ARG CB C 13 30.171 0.092 A 48 ARG CD C 13 43.517 0.022 A 48 ARG CG C 13 27.477 0.063 A 48 ARG N N 15 119.958 0.100 A 49 THR H H 1 7.307 0.002 A 49 THR HA H 1 4.385 0.010 A 49 THR HB H 1 4.457 0.002 A 49 THR HG2% H 1 1.112 0.003 A 49 THR C C 13 174.758 0.100 A 49 THR CA C 13 61.573 0.136 A 49 THR CB C 13 68.794 0.040 A 49 THR CG2 C 13 21.357 0.106 A 49 THR N N 15 106.445 0.517 A 50 ALA H H 1 7.401 0.002 A 50 ALA HA H 1 4.404 0.015 A 50 ALA HB% H 1 1.202 0.003 A 50 ALA C C 13 178.554 0.100 A 50 ALA CA C 13 52.381 0.112 A 50 ALA CB C 13 18.395 0.066 A 50 ALA N N 15 122.242 0.100 A 51 GLY H H 1 8.285 0.002 A 51 GLY HAy H 1 3.995 0.013 A 51 GLY HAx H 1 3.780 0.018 A 51 GLY CA C 13 47.022 0.086 A 51 GLY N N 15 110.604 0.100 A 52 SER HA H 1 4.382 0.001 A 52 SER HBy H 1 4.106 0.004 A 52 SER HBx H 1 4.001 0.001 A 52 SER C C 13 175.774 0.035 A 52 SER CA C 13 60.803 0.174 A 52 SER CB C 13 62.827 0.090 A 53 ARG H H 1 7.894 0.043 A 53 ARG HA H 1 4.880 0.009 A 53 ARG HBy H 1 2.547 0.003 A 53 ARG HBx H 1 1.966 0.004 A 53 ARG HD2 H 1 3.365 0.012 A 53 ARG HD3 H 1 3.365 0.012 A 53 ARG HGx H 1 1.784 0.006 A 53 ARG HGy H 1 1.870 0.009 A 53 ARG C C 13 175.796 0.100 A 53 ARG CA C 13 55.738 0.091 A 53 ARG CB C 13 30.237 0.064 A 53 ARG CD C 13 44.142 0.075 A 53 ARG CG C 13 27.178 0.053 A 53 ARG N N 15 119.682 0.111 A 54 GLU H H 1 7.730 0.002 A 54 GLU HA H 1 3.595 0.004 A 54 GLU HBx H 1 1.948 0.003 A 54 GLU HBy H 1 2.188 0.008 A 54 GLU HGy H 1 2.087 0.014 A 54 GLU HGx H 1 1.954 0.007 A 54 GLU C C 13 177.523 0.100 A 54 GLU CA C 13 61.223 0.125 A 54 GLU CB C 13 28.937 0.075 A 54 GLU CG C 13 35.856 0.029 A 54 GLU N N 15 122.318 0.100 A 55 LYS H H 1 8.659 0.002 A 55 LYS HA H 1 3.828 0.006 A 55 LYS HBy H 1 1.857 0.003 A 55 LYS HBx H 1 1.800 0.001 A 55 LYS HD2 H 1 1.654 0.003 A 55 LYS HD3 H 1 1.654 0.003 A 55 LYS HE2 H 1 2.968 0.001 A 55 LYS HE3 H 1 2.968 0.001 A 55 LYS HGy H 1 1.486 0.002 A 55 LYS HGx H 1 1.340 0.015 A 55 LYS C C 13 179.205 0.100 A 55 LYS CA C 13 60.427 0.103 A 55 LYS CB C 13 31.601 0.038 A 55 LYS CD C 13 29.446 0.059 A 55 LYS CE C 13 42.156 0.097 A 55 LYS CG C 13 25.029 0.053 A 55 LYS N N 15 118.377 0.100 A 56 ASP H H 1 7.646 0.002 A 56 ASP HA H 1 4.311 0.009 A 56 ASP HBy H 1 2.949 0.005 A 56 ASP HBx H 1 2.748 0.006 A 56 ASP C C 13 177.393 0.100 A 56 ASP CA C 13 57.316 0.106 A 56 ASP CB C 13 40.423 0.060 A 56 ASP N N 15 121.614 0.100 A 57 CYS H H 1 8.042 0.002 A 57 CYS HA H 1 3.601 0.002 A 57 CYS HBx H 1 1.181 0.001 A 57 CYS HBy H 1 2.909 0.001 A 57 CYS C C 13 175.772 0.100 A 57 CYS CA C 13 60.197 0.122 A 57 CYS CB C 13 33.966 0.014 A 57 CYS N N 15 120.345 0.100 A 58 ARG H H 1 8.531 0.002 A 58 ARG HA H 1 3.676 0.003 A 58 ARG HB2 H 1 1.784 0.013 A 58 ARG HB3 H 1 1.784 0.013 A 58 ARG HDx H 1 3.062 0.007 A 58 ARG HDy H 1 3.140 0.006 A 58 ARG HG2 H 1 1.411 0.004 A 58 ARG HG3 H 1 1.411 0.004 A 58 ARG C C 13 179.633 0.100 A 58 ARG CA C 13 60.386 0.101 A 58 ARG CB C 13 29.841 0.020 A 58 ARG CD C 13 43.459 0.070 A 58 ARG CG C 13 29.848 0.053 A 58 ARG N N 15 120.293 0.100 A 59 LYS H H 1 7.633 0.002 A 59 LYS HA H 1 4.036 0.003 A 59 LYS HB2 H 1 1.948 0.012 A 59 LYS HB3 H 1 1.948 0.012 A 59 LYS HD2 H 1 1.692 0.008 A 59 LYS HD3 H 1 1.692 0.008 A 59 LYS HE2 H 1 2.955 0.005 A 59 LYS HE3 H 1 2.955 0.005 A 59 LYS HGy H 1 1.573 0.007 A 59 LYS HGx H 1 1.410 0.012 A 59 LYS C C 13 179.220 0.100 A 59 LYS CA C 13 59.530 0.132 A 59 LYS CB C 13 32.110 0.071 A 59 LYS CD C 13 29.434 0.023 A 59 LYS CE C 13 42.105 0.013 A 59 LYS CG C 13 24.922 0.031 A 59 LYS N N 15 121.166 0.100 A 60 ASP H H 1 8.221 0.002 A 60 ASP HA H 1 4.431 0.012 A 60 ASP HBx H 1 2.612 0.008 A 60 ASP HBy H 1 2.978 0.007 A 60 ASP C C 13 179.709 0.100 A 60 ASP CA C 13 57.703 0.112 A 60 ASP CB C 13 40.672 0.158 A 60 ASP N N 15 122.166 0.100 A 61 VAL H H 1 8.916 0.002 A 61 VAL HA H 1 3.401 0.003 A 61 VAL HB H 1 2.074 0.018 A 61 VAL HG1% H 1 0.724 0.019 A 61 VAL HG2% H 1 1.019 0.002 A 61 VAL C C 13 178.339 0.100 A 61 VAL CA C 13 67.133 0.151 A 61 VAL CB C 13 31.657 0.061 A 61 VAL CGx C 13 21.593 0.066 A 61 VAL CGy C 13 24.716 0.063 A 61 VAL N N 15 121.312 0.100 A 62 GLN H H 1 7.697 0.002 A 62 GLN HA H 1 3.942 0.005 A 62 GLN HB2 H 1 2.142 0.011 A 62 GLN HB3 H 1 2.142 0.011 A 62 GLN HE2x H 1 6.806 0.002 A 62 GLN HE2y H 1 7.441 0.002 A 62 GLN HGx H 1 2.398 0.001 A 62 GLN HGy H 1 2.450 0.003 A 62 GLN C C 13 177.293 0.100 A 62 GLN CA C 13 58.280 0.081 A 62 GLN CB C 13 28.371 0.045 A 62 GLN CG C 13 33.832 0.053 A 62 GLN N N 15 119.166 0.100 A 62 GLN NE2 N 15 111.707 0.002 A 63 ALA H H 1 7.508 0.002 A 63 ALA HA H 1 4.242 0.004 A 63 ALA HB% H 1 1.493 0.005 A 63 ALA C C 13 177.221 0.100 A 63 ALA CA C 13 53.137 0.126 A 63 ALA CB C 13 18.897 0.110 A 63 ALA N N 15 118.964 0.100 A 64 CYS H H 1 7.354 0.002 A 64 CYS HA H 1 4.953 0.007 A 64 CYS HBy H 1 2.994 0.010 A 64 CYS HBx H 1 2.683 0.013 A 64 CYS C C 13 172.052 0.100 A 64 CYS CA C 13 51.880 0.051 A 64 CYS CB C 13 34.328 0.154 A 64 CYS N N 15 119.081 0.100 A 65 ASP H H 1 8.142 0.002 A 65 ASP HA H 1 4.325 0.008 A 65 ASP HBy H 1 2.708 0.001 A 65 ASP HBx H 1 2.676 0.001 A 65 ASP C C 13 176.496 0.100 A 65 ASP CA C 13 56.724 0.089 A 65 ASP CB C 13 41.313 0.037 A 65 ASP N N 15 124.167 0.100 A 66 LYS H H 1 7.858 0.002 A 66 LYS HA H 1 4.524 0.003 A 66 LYS HBy H 1 1.784 0.001 A 66 LYS HBx H 1 1.702 0.002 A 66 LYS HD2 H 1 1.702 0.006 A 66 LYS HD3 H 1 1.702 0.006 A 66 LYS HE2 H 1 3.013 0.002 A 66 LYS HE3 H 1 3.013 0.002 A 66 LYS HGy H 1 1.433 0.010 A 66 LYS HGx H 1 1.316 0.005 A 66 LYS C C 13 175.586 0.100 A 66 LYS CA C 13 55.275 0.119 A 66 LYS CB C 13 32.598 0.093 A 66 LYS CD C 13 29.317 0.053 A 66 LYS CE C 13 42.242 0.032 A 66 LYS CG C 13 24.783 0.032 A 66 LYS N N 15 118.844 0.100 A 67 LYS H H 1 8.790 0.002 A 67 LYS HA H 1 3.915 0.002 A 67 LYS HB2 H 1 1.574 0.002 A 67 LYS HB3 H 1 1.574 0.002 A 67 LYS HDy H 1 1.614 0.001 A 67 LYS HDx H 1 1.590 0.001 A 67 LYS HEx H 1 2.750 0.003 A 67 LYS HEy H 1 3.013 0.002 A 67 LYS HGx H 1 1.213 0.005 A 67 LYS HGy H 1 1.432 0.008 A 67 LYS C C 13 174.665 0.100 A 67 LYS CA C 13 57.827 0.120 A 67 LYS CB C 13 34.059 0.143 A 67 LYS CD C 13 29.317 0.053 A 67 LYS CE C 13 43.209 0.097 A 67 LYS CG C 13 26.544 0.030 A 67 LYS N N 15 126.081 0.100 A 68 TYR H H 1 7.294 0.002 A 68 TYR HA H 1 5.259 0.002 A 68 TYR HBx H 1 2.627 0.002 A 68 TYR HBy H 1 2.818 0.002 A 68 TYR HDx H 1 6.919 0.004 A 68 TYR HDy H 1 6.919 0.004 A 68 TYR HEx H 1 6.729 0.002 A 68 TYR HEy H 1 6.729 0.002 A 68 TYR C C 13 175.767 0.100 A 68 TYR CA C 13 55.880 0.116 A 68 TYR CB C 13 42.363 0.005 A 68 TYR CD1 C 13 133.617 0.122 A 68 TYR CD2 C 13 133.617 0.122 A 68 TYR N N 15 114.138 0.100 A 69 ASP H H 1 8.995 0.002 A 69 ASP HA H 1 4.640 0.009 A 69 ASP HBx H 1 2.550 0.017 A 69 ASP HBy H 1 3.352 0.013 A 69 ASP C C 13 177.812 0.100 A 69 ASP CA C 13 52.110 0.140 A 69 ASP CB C 13 41.440 0.027 A 69 ASP N N 15 121.807 0.100 A 70 ASP H H 1 8.369 0.002 A 70 ASP HA H 1 4.424 0.007 A 70 ASP HB2 H 1 2.736 0.006 A 70 ASP HB3 H 1 2.736 0.006 A 70 ASP C C 13 177.054 0.100 A 70 ASP CA C 13 56.381 0.053 A 70 ASP CB C 13 40.248 0.129 A 70 ASP N N 15 116.686 0.100 A 71 GLN H H 1 8.274 0.002 A 71 GLN HA H 1 4.456 0.013 A 71 GLN HBx H 1 2.006 0.008 A 71 GLN HBy H 1 2.311 0.003 A 71 GLN HE2x H 1 6.758 0.002 A 71 GLN HE2y H 1 7.539 0.002 A 71 GLN HG2 H 1 2.308 0.011 A 71 GLN HG3 H 1 2.308 0.011 A 71 GLN C C 13 176.273 0.100 A 71 GLN CA C 13 55.367 0.146 A 71 GLN CB C 13 29.330 0.027 A 71 GLN CG C 13 34.293 0.074 A 71 GLN N N 15 117.949 0.100 A 71 GLN NE2 N 15 112.670 0.001 A 72 GLY H H 1 8.174 0.002 A 72 GLY HAx H 1 3.554 0.003 A 72 GLY HAy H 1 4.089 0.005 A 72 GLY C C 13 174.145 0.100 A 72 GLY CA C 13 45.823 0.057 A 72 GLY N N 15 108.369 0.100 A 73 ARG H H 1 8.462 0.002 A 73 ARG HA H 1 4.485 0.010 A 73 ARG HBx H 1 1.798 0.010 A 73 ARG HBy H 1 2.057 0.006 A 73 ARG HDx H 1 3.129 0.007 A 73 ARG HDy H 1 3.217 0.004 A 73 ARG HG2 H 1 1.589 0.006 A 73 ARG HG3 H 1 1.589 0.006 A 73 ARG C C 13 176.855 0.100 A 73 ARG CA C 13 55.289 0.096 A 73 ARG CB C 13 30.558 0.051 A 73 ARG CD C 13 43.341 0.019 A 73 ARG CG C 13 27.332 0.054 A 73 ARG N N 15 121.554 0.100 A 74 GLU H H 1 8.703 0.002 A 74 GLU HA H 1 4.483 0.002 A 74 GLU HBy H 1 1.944 0.003 A 74 GLU HBx H 1 1.934 0.006 A 74 GLU HGx H 1 2.203 0.009 A 74 GLU HGy H 1 2.359 0.005 A 74 GLU C C 13 178.098 0.100 A 74 GLU CA C 13 57.184 0.163 A 74 GLU CB C 13 30.777 0.036 A 74 GLU CG C 13 38.002 0.037 A 74 GLU N N 15 122.784 0.100 A 75 THR H H 1 7.717 0.002 A 75 THR HA H 1 4.212 0.007 A 75 THR HB H 1 4.625 0.003 A 75 THR HG2% H 1 0.926 0.003 A 75 THR C C 13 175.170 0.100 A 75 THR CA C 13 60.589 0.132 A 75 THR CB C 13 70.952 0.137 A 75 THR CG2 C 13 22.163 0.151 A 75 THR N N 15 114.563 0.100 A 76 ALA H H 1 8.734 0.002 A 76 ALA HA H 1 4.038 0.014 A 76 ALA HB% H 1 1.428 0.004 A 76 ALA C C 13 181.906 0.100 A 76 ALA CA C 13 55.654 0.158 A 76 ALA CB C 13 17.993 0.147 A 76 ALA N N 15 122.097 0.100 A 77 CYS H H 1 9.073 0.002 A 77 CYS HA H 1 4.480 0.005 A 77 CYS HBx H 1 3.035 0.011 A 77 CYS HBy H 1 3.262 0.014 A 77 CYS C C 13 176.299 0.100 A 77 CYS CA C 13 57.701 0.101 A 77 CYS CB C 13 35.631 0.117 A 77 CYS N N 15 115.347 0.100 A 78 ALA H H 1 7.174 0.002 A 78 ALA HA H 1 3.855 0.014 A 78 ALA HB% H 1 1.397 0.005 A 78 ALA C C 13 178.736 0.100 A 78 ALA CA C 13 55.633 0.187 A 78 ALA CB C 13 19.191 0.129 A 78 ALA N N 15 128.517 0.100 A 79 LYS H H 1 8.313 0.002 A 79 LYS HA H 1 3.803 0.007 A 79 LYS HB2 H 1 1.751 0.009 A 79 LYS HB3 H 1 1.751 0.009 A 79 LYS HD2 H 1 1.599 0.003 A 79 LYS HD3 H 1 1.599 0.003 A 79 LYS HEy H 1 2.920 0.003 A 79 LYS HEx H 1 2.881 0.004 A 79 LYS HGx H 1 1.337 0.003 A 79 LYS HGy H 1 1.431 0.001 A 79 LYS C C 13 179.611 0.100 A 79 LYS CA C 13 59.725 0.078 A 79 LYS CB C 13 32.653 0.103 A 79 LYS CD C 13 29.518 0.036 A 79 LYS CE C 13 41.917 0.097 A 79 LYS CG C 13 25.315 0.030 A 79 LYS N N 15 118.706 0.100 A 80 GLY H H 1 8.175 0.002 A 80 GLY HA2 H 1 3.791 0.005 A 80 GLY HA3 H 1 3.791 0.005 A 80 GLY C C 13 176.504 0.100 A 80 GLY CA C 13 46.839 0.075 A 80 GLY N N 15 104.822 0.100 A 81 ILE H H 1 7.590 0.002 A 81 ILE HA H 1 3.795 0.002 A 81 ILE HB H 1 1.913 0.005 A 81 ILE HD1% H 1 0.766 0.003 A 81 ILE HG1x H 1 1.095 0.004 A 81 ILE HG1y H 1 1.974 0.009 A 81 ILE HG2% H 1 0.963 0.004 A 81 ILE C C 13 177.334 0.001 A 81 ILE CA C 13 65.281 0.088 A 81 ILE CB C 13 38.335 0.080 A 81 ILE CD1 C 13 14.445 0.035 A 81 ILE CG1 C 13 30.746 0.062 A 81 ILE CG2 C 13 19.035 0.041 A 81 ILE N N 15 123.697 0.100 A 82 ARG H H 1 7.569 0.048 A 82 ARG HA H 1 3.935 0.009 A 82 ARG HB2 H 1 1.782 0.020 A 82 ARG HB3 H 1 1.782 0.020 A 82 ARG HD2 H 1 3.022 0.003 A 82 ARG HD3 H 1 3.022 0.003 A 82 ARG HGx H 1 1.281 0.005 A 82 ARG HGy H 1 1.585 0.004 A 82 ARG C C 13 178.662 0.105 A 82 ARG CA C 13 59.702 0.149 A 82 ARG CB C 13 29.899 0.134 A 82 ARG CD C 13 43.278 0.053 A 82 ARG CG C 13 27.908 0.034 A 82 ARG N N 15 118.161 0.088 A 83 GLU H H 1 7.786 0.042 A 83 GLU HA H 1 4.031 0.006 A 83 GLU HB2 H 1 1.980 0.012 A 83 GLU HB3 H 1 1.980 0.012 A 83 GLU HGy H 1 2.332 0.005 A 83 GLU HGx H 1 2.236 0.014 A 83 GLU C C 13 178.224 0.025 A 83 GLU CA C 13 58.304 0.080 A 83 GLU CB C 13 30.031 0.097 A 83 GLU CG C 13 36.170 0.019 A 83 GLU N N 15 115.085 0.196 A 84 LYS H H 1 7.968 0.042 A 84 LYS HA H 1 3.830 0.005 A 84 LYS HBy H 1 1.244 0.002 A 84 LYS HBx H 1 1.220 0.018 A 84 LYS HD2 H 1 1.361 0.006 A 84 LYS HD3 H 1 1.361 0.006 A 84 LYS HE2 H 1 2.734 0.002 A 84 LYS HE3 H 1 2.734 0.002 A 84 LYS HGx H 1 0.192 0.005 A 84 LYS HGy H 1 0.984 0.016 A 84 LYS C C 13 177.933 0.100 A 84 LYS CA C 13 59.043 0.147 A 84 LYS CB C 13 33.650 0.021 A 84 LYS CD C 13 29.838 0.053 A 84 LYS CE C 13 42.056 0.031 A 84 LYS CG C 13 24.872 0.035 A 84 LYS N N 15 119.183 0.244 A 85 TYR H H 1 7.562 0.023 A 85 TYR HA H 1 4.703 0.020 A 85 TYR HBx H 1 2.814 0.006 A 85 TYR HBy H 1 3.208 0.002 A 85 TYR HDx H 1 7.362 0.005 A 85 TYR HDy H 1 7.362 0.005 A 85 TYR HEx H 1 6.912 0.012 A 85 TYR HEy H 1 6.912 0.012 A 85 TYR C C 13 174.729 0.100 A 85 TYR CA C 13 57.202 0.149 A 85 TYR CB C 13 37.902 0.110 A 85 TYR CD1 C 13 133.458 0.145 A 85 TYR CD2 C 13 133.458 0.145 A 85 TYR CE1 C 13 117.585 0.102 A 85 TYR CE2 C 13 117.585 0.102 A 85 TYR N N 15 113.663 0.211 A 86 LYS H H 1 7.222 0.002 A 86 LYS HA H 1 4.512 0.006 A 86 LYS HB2 H 1 1.949 0.008 A 86 LYS HB3 H 1 1.949 0.008 A 86 LYS HD2 H 1 1.691 0.012 A 86 LYS HD3 H 1 1.691 0.012 A 86 LYS HE2 H 1 2.969 0.003 A 86 LYS HE3 H 1 2.969 0.003 A 86 LYS HGx H 1 1.423 0.002 A 86 LYS HGy H 1 1.477 0.012 A 86 LYS CA C 13 54.942 0.123 A 86 LYS CB C 13 32.102 0.012 A 86 LYS CD C 13 29.774 0.053 A 86 LYS CE C 13 42.050 0.097 A 86 LYS CG C 13 24.088 0.053 A 86 LYS N N 15 121.862 0.100 A 87 PRO HA H 1 4.323 0.008 A 87 PRO HB2 H 1 1.746 0.001 A 87 PRO HB3 H 1 1.746 0.001 A 87 PRO HDy H 1 4.009 0.001 A 87 PRO HDx H 1 3.704 0.001 A 87 PRO HGx H 1 1.923 0.009 A 87 PRO HGy H 1 2.123 0.001 A 87 PRO C C 13 176.576 0.100 A 87 PRO CA C 13 63.020 0.134 A 87 PRO CB C 13 32.240 0.041 A 87 PRO CD C 13 50.652 0.018 A 87 PRO CG C 13 27.778 0.052 A 88 ALA H H 1 8.329 0.002 A 88 ALA HA H 1 4.254 0.014 A 88 ALA HB% H 1 1.311 0.002 A 88 ALA C C 13 177.301 0.100 A 88 ALA CA C 13 52.281 0.095 A 88 ALA CB C 13 19.202 0.032 A 88 ALA N N 15 125.029 0.100 A 89 VAL H H 1 8.075 0.002 A 89 VAL HA H 1 3.944 0.007 A 89 VAL HB H 1 1.747 0.011 A 89 VAL HG1% H 1 0.472 0.005 A 89 VAL HG2% H 1 0.429 0.005 A 89 VAL C C 13 174.791 0.100 A 89 VAL CA C 13 61.981 0.250 A 89 VAL CB C 13 33.485 0.156 A 89 VAL CGy C 13 21.004 0.053 A 89 VAL CGx C 13 20.986 0.035 A 89 VAL N N 15 121.843 0.100 A 90 VAL H H 1 8.229 0.002 A 90 VAL HA H 1 4.138 0.004 A 90 VAL HB H 1 1.804 0.012 A 90 VAL HG1% H 1 0.912 0.001 A 90 VAL HG2% H 1 0.812 0.003 A 90 VAL C C 13 174.340 0.100 A 90 VAL CA C 13 61.162 0.126 A 90 VAL CB C 13 33.866 0.111 A 90 VAL CGx C 13 21.847 0.043 A 90 VAL N N 15 125.399 0.100 A 91 TYR H H 1 9.145 0.002 A 91 TYR HA H 1 4.771 0.029 A 91 TYR HB2 H 1 2.820 0.004 A 91 TYR HB3 H 1 2.820 0.004 A 91 TYR HDx H 1 7.014 0.009 A 91 TYR HDy H 1 7.014 0.009 A 91 TYR HEx H 1 6.737 0.007 A 91 TYR HEy H 1 6.737 0.007 A 91 TYR C C 13 176.658 0.100 A 91 TYR CA C 13 58.084 0.171 A 91 TYR CB C 13 41.535 0.033 A 91 TYR CD1 C 13 133.219 0.138 A 91 TYR CD2 C 13 133.219 0.138 A 91 TYR CE1 C 13 118.127 0.080 A 91 TYR CE2 C 13 118.127 0.080 A 91 TYR N N 15 124.848 0.100 A 92 GLY H H 1 8.730 0.002 A 92 GLY HAy H 1 4.517 0.008 A 92 GLY HAx H 1 4.145 0.008 A 92 GLY C C 13 175.681 0.100 A 92 GLY CA C 13 43.975 0.107 A 92 GLY N N 15 106.185 0.100 A 93 TYR H H 1 8.711 0.002 A 93 TYR HA H 1 3.975 0.000 A 93 TYR HBy H 1 3.402 0.004 A 93 TYR HBx H 1 2.975 0.001 A 93 TYR HDx H 1 7.178 0.020 A 93 TYR HDy H 1 7.178 0.020 A 93 TYR HEx H 1 6.935 0.020 A 93 TYR HEy H 1 6.935 0.020 A 93 TYR C C 13 176.035 0.100 A 93 TYR CA C 13 61.046 0.133 A 93 TYR CB C 13 38.425 0.081 A 93 TYR CD1 C 13 133.487 0.086 A 93 TYR CD2 C 13 133.487 0.086 A 93 TYR CE1 C 13 118.353 0.259 A 93 TYR CE2 C 13 118.353 0.259 A 93 TYR N N 15 121.815 0.100 A 94 ASP H H 1 8.010 0.002 A 94 ASP HA H 1 4.288 0.003 A 94 ASP HBy H 1 2.944 0.013 A 94 ASP HBx H 1 2.498 0.002 A 94 ASP C C 13 177.063 0.100 A 94 ASP CA C 13 53.011 0.151 A 94 ASP CB C 13 40.167 0.090 A 94 ASP N N 15 115.507 0.100 A 95 GLY H H 1 7.986 0.002 A 95 GLY HAx H 1 3.565 0.027 A 95 GLY HAy H 1 4.127 0.003 A 95 GLY C C 13 173.936 0.100 A 95 GLY CA C 13 45.392 0.056 A 95 GLY N N 15 107.196 0.100 A 96 LYS H H 1 7.877 0.002 A 96 LYS HA H 1 4.784 0.001 A 96 LYS HB2 H 1 1.827 0.001 A 96 LYS HB3 H 1 1.827 0.001 A 96 LYS HD2 H 1 1.676 0.001 A 96 LYS HD3 H 1 1.676 0.001 A 96 LYS HE2 H 1 2.976 0.008 A 96 LYS HE3 H 1 2.976 0.008 A 96 LYS HG2 H 1 1.347 0.001 A 96 LYS HG3 H 1 1.347 0.001 A 96 LYS CA C 13 54.114 0.066 A 96 LYS CB C 13 31.762 0.014 A 96 LYS CD C 13 29.310 0.070 A 96 LYS CE C 13 42.206 0.071 A 96 LYS CG C 13 25.239 0.052 A 96 LYS N N 15 121.258 0.100 A 97 PRO C C 13 177.170 0.100 A 97 PRO CA C 13 63.137 0.144 A 97 PRO CB C 13 32.240 0.015 A 98 LEU H H 1 8.850 0.002 A 98 LEU HA H 1 4.360 0.014 A 98 LEU HBy H 1 1.465 0.005 A 98 LEU HBx H 1 1.253 0.003 A 98 LEU HD1% H 1 0.845 0.005 A 98 LEU HD2% H 1 0.750 0.003 A 98 LEU HG H 1 1.536 0.002 A 98 LEU C C 13 176.354 0.100 A 98 LEU CA C 13 53.927 0.087 A 98 LEU CB C 13 42.272 0.062 A 98 LEU CDx C 13 22.943 0.053 A 98 LEU CDy C 13 25.601 0.041 A 98 LEU CG C 13 26.626 0.053 A 98 LEU N N 15 123.503 0.100 A 99 ASP H H 1 8.517 0.002 A 99 ASP HA H 1 4.597 0.022 A 99 ASP HBx H 1 2.607 0.019 A 99 ASP HBy H 1 2.989 0.009 A 99 ASP C C 13 175.819 0.100 A 99 ASP CA C 13 53.856 0.125 A 99 ASP CB C 13 40.989 0.042 A 99 ASP N N 15 122.212 0.100 A 100 LEU H H 1 8.281 0.002 A 100 LEU HA H 1 4.366 0.023 A 100 LEU HB2 H 1 1.369 0.002 A 100 LEU HB3 H 1 1.369 0.002 A 100 LEU HD1% H 1 0.736 0.003 A 100 LEU HD2% H 1 0.658 0.004 A 100 LEU HG H 1 1.488 0.003 A 100 LEU C C 13 178.426 0.100 A 100 LEU CA C 13 53.631 0.149 A 100 LEU CB C 13 40.676 0.076 A 100 LEU CDy C 13 26.060 0.173 A 100 LEU CDx C 13 24.930 0.188 A 100 LEU CG C 13 27.597 0.098 A 100 LEU N N 15 125.874 0.100 A 101 GLY H H 1 8.914 0.002 A 101 GLY HAy H 1 3.986 0.012 A 101 GLY HAx H 1 3.712 0.042 A 101 GLY C C 13 176.936 0.100 A 101 GLY CA C 13 47.827 0.074 A 101 GLY N N 15 110.604 0.100 A 102 PHE H H 1 7.992 0.002 A 102 PHE HA H 1 4.381 0.005 A 102 PHE HBx H 1 3.067 0.001 A 102 PHE HBy H 1 3.219 0.006 A 102 PHE C C 13 177.878 0.100 A 102 PHE CA C 13 59.139 0.129 A 102 PHE CB C 13 36.935 0.043 A 102 PHE N N 15 117.639 0.100 A 103 CYS H H 1 7.362 0.002 A 103 CYS HA H 1 4.385 0.016 A 103 CYS HBy H 1 2.886 0.014 A 103 CYS HBx H 1 2.553 0.041 A 103 CYS C C 13 172.780 0.100 A 103 CYS CA C 13 53.696 0.138 A 103 CYS CB C 13 34.237 0.079 A 103 CYS N N 15 121.136 0.100 A 104 THR H H 1 7.864 0.002 A 104 THR HA H 1 3.984 0.016 A 104 THR HB H 1 4.231 0.011 A 104 THR HG2% H 1 1.262 0.005 A 104 THR C C 13 176.624 0.100 A 104 THR CA C 13 65.180 0.135 A 104 THR CB C 13 69.062 0.024 A 104 THR CG2 C 13 21.985 0.051 A 104 THR N N 15 114.773 0.100 A 105 LEU H H 1 7.238 0.002 A 105 LEU HA H 1 4.331 0.004 A 105 LEU HBx H 1 1.977 0.006 A 105 LEU HBy H 1 2.004 0.002 A 105 LEU HD1% H 1 0.994 0.001 A 105 LEU HD2% H 1 0.875 0.002 A 105 LEU HG H 1 1.724 0.008 A 105 LEU C C 13 177.208 0.100 A 105 LEU CA C 13 55.453 0.196 A 105 LEU CB C 13 41.293 0.035 A 105 LEU CDy C 13 25.307 0.013 A 105 LEU CDx C 13 22.515 0.032 A 105 LEU CG C 13 27.290 0.111 A 105 LEU N N 15 119.785 0.100 A 106 ALA H H 1 7.432 0.002 A 106 ALA HA H 1 4.527 0.004 A 106 ALA HB% H 1 1.425 0.004 A 106 ALA C C 13 178.769 0.100 A 106 ALA CA C 13 52.049 0.223 A 106 ALA CB C 13 18.820 0.064 A 106 ALA N N 15 119.309 0.100 A 107 GLY H H 1 7.918 0.002 A 107 GLY HAy H 1 4.072 0.005 A 107 GLY HAx H 1 3.811 0.021 A 107 GLY CA C 13 47.119 0.091 A 107 GLY N N 15 109.793 0.100 A 108 ILE HA H 1 4.266 0.007 A 108 ILE HB H 1 2.095 0.003 A 108 ILE HD1% H 1 0.961 0.003 A 108 ILE HG1y H 1 1.483 0.002 A 108 ILE HG1x H 1 1.433 0.001 A 108 ILE HG2% H 1 1.069 0.003 A 108 ILE CA C 13 63.263 0.062 A 108 ILE CB C 13 38.261 0.023 A 108 ILE CD1 C 13 14.149 0.019 A 108 ILE CG1 C 13 27.888 0.053 A 108 ILE CG2 C 13 17.961 0.046 A 109 ARG HA H 1 4.755 0.001 A 109 ARG HBy H 1 2.523 0.001 A 109 ARG HBx H 1 1.991 0.002 A 109 ARG HD2 H 1 3.415 0.003 A 109 ARG HD3 H 1 3.415 0.003 A 109 ARG HGx H 1 1.808 0.002 A 109 ARG HGy H 1 1.891 0.002 A 109 ARG C C 13 181.344 0.100 A 109 ARG CA C 13 55.939 0.055 A 109 ARG CB C 13 30.283 0.039 A 109 ARG CD C 13 44.168 0.015 A 109 ARG CG C 13 27.536 0.076 A 110 GLU H H 1 8.003 0.002 A 110 GLU HA H 1 3.617 0.010 A 110 GLU HB2 H 1 2.232 0.003 A 110 GLU HB3 H 1 2.232 0.003 A 110 GLU HG2 H 1 1.814 0.002 A 110 GLU HG3 H 1 1.814 0.002 A 110 GLU C C 13 177.797 0.100 A 110 GLU CA C 13 60.728 0.095 A 110 GLU CB C 13 28.871 0.053 A 110 GLU CG C 13 36.032 0.059 A 110 GLU N N 15 122.944 0.100 A 111 VAL H H 1 8.106 0.002 A 111 VAL HA H 1 3.511 0.009 A 111 VAL HB H 1 2.087 0.004 A 111 VAL HG1% H 1 0.905 0.003 A 111 VAL HG2% H 1 0.954 0.005 A 111 VAL C C 13 177.710 0.100 A 111 VAL CA C 13 66.430 0.123 A 111 VAL CB C 13 31.213 0.101 A 111 VAL CGx C 13 20.786 0.023 A 111 VAL CGy C 13 22.450 0.030 A 111 VAL N N 15 117.101 0.100 A 112 ASP H H 1 7.401 0.002 A 112 ASP HA H 1 4.304 0.034 A 112 ASP HBy H 1 2.947 0.020 A 112 ASP HBx H 1 2.687 0.010 A 112 ASP C C 13 176.912 0.100 A 112 ASP CA C 13 57.417 0.080 A 112 ASP CB C 13 40.476 0.022 A 112 ASP N N 15 122.242 0.100 A 113 CYS H H 1 7.785 0.002 A 113 CYS HA H 1 3.309 0.015 A 113 CYS HBx H 1 1.264 0.002 A 113 CYS HBy H 1 2.903 0.002 A 113 CYS C C 13 175.270 0.100 A 113 CYS CA C 13 59.759 0.116 A 113 CYS CB C 13 33.835 0.108 A 113 CYS N N 15 120.819 0.100 A 114 ARG H H 1 8.142 0.002 A 114 ARG HA H 1 3.641 0.003 A 114 ARG HB2 H 1 1.667 0.005 A 114 ARG HB3 H 1 1.667 0.005 A 114 ARG HD2 H 1 2.958 0.001 A 114 ARG HD3 H 1 2.958 0.001 A 114 ARG HG2 H 1 1.250 0.003 A 114 ARG HG3 H 1 1.250 0.003 A 114 ARG C C 13 179.018 0.100 A 114 ARG CA C 13 60.193 0.098 A 114 ARG CB C 13 29.713 0.064 A 114 ARG CD C 13 43.086 0.060 A 114 ARG N N 15 118.654 0.100 A 115 LYS H H 1 7.936 0.002 A 115 LYS HA H 1 4.030 0.003 A 115 LYS HB2 H 1 1.916 0.006 A 115 LYS HB3 H 1 1.916 0.006 A 115 LYS HD2 H 1 1.669 0.005 A 115 LYS HD3 H 1 1.669 0.005 A 115 LYS HE2 H 1 2.933 0.006 A 115 LYS HE3 H 1 2.933 0.006 A 115 LYS HGx H 1 1.414 0.005 A 115 LYS HGy H 1 1.546 0.001 A 115 LYS C C 13 180.092 0.100 A 115 LYS CA C 13 59.568 0.141 A 115 LYS CB C 13 32.221 0.092 A 115 LYS CD C 13 29.632 0.070 A 115 LYS CE C 13 42.136 0.097 A 115 LYS CG C 13 25.027 0.052 A 115 LYS N N 15 120.964 0.100 A 116 ASP H H 1 8.558 0.002 A 116 ASP HA H 1 4.513 0.016 A 116 ASP HBx H 1 2.792 0.006 A 116 ASP HBy H 1 3.038 0.001 A 116 ASP C C 13 179.419 0.100 A 116 ASP CA C 13 57.237 0.091 A 116 ASP CB C 13 40.648 0.056 A 116 ASP N N 15 121.690 0.100 A 117 ALA H H 1 8.703 0.002 A 117 ALA HA H 1 4.023 0.005 A 117 ALA HB% H 1 1.431 0.002 A 117 ALA C C 13 178.789 0.100 A 117 ALA CA C 13 55.051 0.129 A 117 ALA CB C 13 19.175 0.018 A 117 ALA N N 15 122.784 0.100 A 118 GLN H H 1 7.664 0.002 A 118 GLN HA H 1 3.944 0.003 A 118 GLN HB2 H 1 2.253 0.009 A 118 GLN HB3 H 1 2.253 0.009 A 118 GLN HE2y H 1 7.429 0.002 A 118 GLN HE2x H 1 6.796 0.002 A 118 GLN HGy H 1 2.628 0.008 A 118 GLN HGx H 1 2.478 0.005 A 118 GLN C C 13 178.745 0.100 A 118 GLN CA C 13 58.482 0.201 A 118 GLN CB C 13 28.397 0.026 A 118 GLN CG C 13 34.302 0.086 A 118 GLN N N 15 115.510 0.100 A 118 GLN NE2 N 15 111.473 0.008 A 119 THR H H 1 7.726 0.002 A 119 THR HA H 1 4.237 0.006 A 119 THR HB H 1 4.360 0.003 A 119 THR HG2% H 1 1.452 0.002 A 119 THR C C 13 175.861 0.100 A 119 THR CA C 13 64.604 0.131 A 119 THR CB C 13 69.716 0.062 A 119 THR CG2 C 13 21.503 0.083 A 119 THR N N 15 110.110 0.100 A 120 CYS H H 1 7.756 0.002 A 120 CYS HA H 1 4.733 0.009 A 120 CYS HBx H 1 2.771 0.015 A 120 CYS HBy H 1 3.360 0.001 A 120 CYS C C 13 175.165 0.100 A 120 CYS CA C 13 52.973 0.099 A 120 CYS CB C 13 36.731 0.044 A 120 CYS N N 15 118.523 0.100 A 121 ASP H H 1 7.354 0.002 A 121 ASP HA H 1 4.678 0.008 A 121 ASP HBy H 1 2.891 0.006 A 121 ASP HBx H 1 2.799 0.006 A 121 ASP CA C 13 56.224 0.059 A 121 ASP CB C 13 42.731 0.005 A 121 ASP N N 15 119.081 0.100 A 122 LYS HA H 1 3.575 0.003 A 122 LYS HBy H 1 2.004 0.006 A 122 LYS HBx H 1 1.955 0.006 A 122 LYS HD2 H 1 1.700 0.001 A 122 LYS HD3 H 1 1.700 0.001 A 122 LYS HE2 H 1 2.919 0.008 A 122 LYS HE3 H 1 2.919 0.008 A 122 LYS HGy H 1 1.540 0.001 A 122 LYS HGx H 1 1.324 0.003 A 122 LYS C C 13 175.510 0.100 A 122 LYS CA C 13 57.839 0.109 A 122 LYS CB C 13 30.750 0.025 A 122 LYS CD C 13 28.628 0.005 A 122 LYS CE C 13 42.556 0.053 A 122 LYS CG C 13 26.219 0.074 A 123 LYS H H 1 7.799 0.002 A 123 LYS HA H 1 4.294 0.013 A 123 LYS HBy H 1 1.721 0.001 A 123 LYS HBx H 1 1.629 0.002 A 123 LYS HD2 H 1 1.722 0.003 A 123 LYS HD3 H 1 1.722 0.003 A 123 LYS HE2 H 1 3.098 0.002 A 123 LYS HE3 H 1 3.098 0.002 A 123 LYS HGx H 1 1.392 0.002 A 123 LYS HGy H 1 1.552 0.003 A 123 LYS C C 13 176.968 0.100 A 123 LYS CA C 13 55.904 0.127 A 123 LYS CB C 13 33.232 0.074 A 123 LYS CD C 13 29.072 0.039 A 123 LYS CE C 13 42.437 0.026 A 123 LYS CG C 13 25.261 0.023 A 123 LYS N N 15 119.980 0.100 A 124 TYR H H 1 8.536 0.002 A 124 TYR HA H 1 3.895 0.002 A 124 TYR HBy H 1 2.912 0.002 A 124 TYR HBx H 1 2.790 0.002 A 124 TYR HDx H 1 6.736 0.010 A 124 TYR HDy H 1 6.736 0.010 A 124 TYR HEx H 1 6.727 0.002 A 124 TYR HEy H 1 6.727 0.002 A 124 TYR C C 13 177.126 0.100 A 124 TYR CA C 13 60.211 0.153 A 124 TYR CB C 13 38.271 0.059 A 124 TYR CD1 C 13 132.877 0.011 A 124 TYR CD2 C 13 132.877 0.011 A 124 TYR N N 15 122.378 0.100 A 125 GLU H H 1 8.385 0.002 A 125 GLU HA H 1 4.268 0.021 A 125 GLU HB2 H 1 2.027 0.002 A 125 GLU HB3 H 1 2.027 0.002 A 125 GLU HG2 H 1 1.975 0.006 A 125 GLU HG3 H 1 1.975 0.006 A 125 GLU C C 13 177.387 0.100 A 125 GLU CA C 13 55.759 0.077 A 125 GLU CB C 13 27.321 0.189 A 125 GLU CG C 13 36.488 0.072 A 125 GLU N N 15 118.610 0.100 A 126 SER H H 1 7.823 0.002 A 126 SER HA H 1 3.959 0.008 A 126 SER C C 13 176.047 0.100 A 126 SER CA C 13 62.439 0.236 A 126 SER CB C 13 63.299 0.019 A 126 SER N N 15 115.949 0.100 A 127 ASP H H 1 8.683 0.002 A 127 ASP HA H 1 4.407 0.011 A 127 ASP HB2 H 1 2.657 0.011 A 127 ASP HB3 H 1 2.657 0.011 A 127 ASP C C 13 178.234 0.100 A 127 ASP CA C 13 57.411 0.146 A 127 ASP CB C 13 39.716 0.169 A 127 ASP N N 15 120.920 0.100 A 128 LYS H H 1 7.771 0.002 A 128 LYS HA H 1 4.004 0.009 A 128 LYS HB2 H 1 1.860 0.017 A 128 LYS HB3 H 1 1.860 0.017 A 128 LYS HD2 H 1 1.634 0.010 A 128 LYS HD3 H 1 1.634 0.010 A 128 LYS HE2 H 1 2.947 0.004 A 128 LYS HE3 H 1 2.947 0.004 A 128 LYS HGx H 1 1.362 0.001 A 128 LYS HGy H 1 1.494 0.001 A 128 LYS C C 13 179.395 0.100 A 128 LYS CA C 13 59.471 0.092 A 128 LYS CB C 13 32.401 0.168 A 128 LYS CD C 13 29.349 0.070 A 128 LYS CE C 13 42.243 0.097 A 128 LYS CG C 13 24.921 0.053 A 128 LYS N N 15 121.753 0.100 A 129 CYS H H 1 7.973 0.002 A 129 CYS HA H 1 4.194 0.007 A 129 CYS HB2 H 1 3.370 0.002 A 129 CYS HBy H 1 3.370 0.002 A 129 CYS HBx H 1 3.173 0.002 A 129 CYS C C 13 176.779 0.100 A 129 CYS CA C 13 59.790 0.103 A 129 CYS CB C 13 36.879 0.055 A 129 CYS N N 15 120.109 0.100 A 130 LEU H H 1 8.666 0.002 A 130 LEU HA H 1 4.090 0.006 A 130 LEU HBy H 1 1.905 0.001 A 130 LEU HBx H 1 1.658 0.001 A 130 LEU HD2% H 1 1.074 0.012 A 130 LEU HG H 1 1.797 0.004 A 130 LEU C C 13 179.373 0.100 A 130 LEU CA C 13 57.368 0.128 A 130 LEU CB C 13 42.098 0.083 A 130 LEU CDy C 13 25.249 0.007 A 130 LEU CG C 13 27.044 0.074 A 130 LEU N N 15 121.804 0.100 A 131 ASN H H 1 8.438 0.002 A 131 ASN HA H 1 4.238 0.011 A 131 ASN HBy H 1 2.844 0.005 A 131 ASN HBx H 1 2.753 0.005 A 131 ASN HD2x H 1 6.899 0.002 A 131 ASN HD2y H 1 7.507 0.002 A 131 ASN C C 13 177.830 0.100 A 131 ASN CA C 13 56.256 0.081 A 131 ASN CB C 13 37.817 0.056 A 131 ASN N N 15 118.535 0.100 A 131 ASN ND2 N 15 111.953 0.007 A 132 ALA H H 1 7.541 0.002 A 132 ALA HA H 1 4.219 0.004 A 132 ALA HB% H 1 1.545 0.005 A 132 ALA C C 13 180.726 0.100 A 132 ALA CA C 13 54.963 0.181 A 132 ALA CB C 13 17.821 0.070 A 132 ALA N N 15 121.485 0.100 A 133 ILE H H 1 7.551 0.002 A 133 ILE HA H 1 3.931 0.007 A 133 ILE HB H 1 2.471 0.008 A 133 ILE HD1% H 1 0.826 0.003 A 133 ILE HG1x H 1 1.527 0.008 A 133 ILE HG1y H 1 1.924 0.004 A 133 ILE HG2% H 1 1.455 0.013 A 133 ILE C C 13 178.114 0.100 A 133 ILE CA C 13 63.353 0.040 A 133 ILE CB C 13 36.454 0.127 A 133 ILE CD1 C 13 11.276 0.057 A 133 ILE CG1 C 13 28.555 0.053 A 133 ILE CG2 C 13 19.445 0.030 A 133 ILE N N 15 120.979 0.100 A 134 LYS H H 1 8.414 0.002 A 134 LYS HA H 1 3.588 0.007 A 134 LYS HBy H 1 1.450 0.005 A 134 LYS HBx H 1 1.289 0.009 A 134 LYS HD2 H 1 1.284 0.004 A 134 LYS HD3 H 1 1.284 0.004 A 134 LYS HEy H 1 2.572 0.004 A 134 LYS HEx H 1 2.465 0.005 A 134 LYS HGx H 1 -0.108 0.008 A 134 LYS HGy H 1 0.660 0.009 A 134 LYS C C 13 179.561 0.100 A 134 LYS CA C 13 60.108 0.165 A 134 LYS CB C 13 32.161 0.063 A 134 LYS CD C 13 29.551 0.101 A 134 LYS CE C 13 42.449 0.109 A 134 LYS CG C 13 24.405 0.143 A 134 LYS N N 15 121.415 0.100 A 135 GLU H H 1 7.473 0.002 A 135 GLU HA H 1 3.929 0.004 A 135 GLU HB2 H 1 2.011 0.010 A 135 GLU HB3 H 1 2.011 0.010 A 135 GLU HG2 H 1 2.274 0.005 A 135 GLU HG3 H 1 2.274 0.005 A 135 GLU C C 13 178.239 0.100 A 135 GLU CA C 13 58.646 0.093 A 135 GLU CB C 13 29.638 0.175 A 135 GLU CG C 13 35.990 0.037 A 135 GLU N N 15 116.099 0.100 A 136 LYS H H 1 7.540 0.002 A 136 LYS HA H 1 3.906 0.003 A 136 LYS HBx H 1 1.782 0.003 A 136 LYS HBy H 1 1.845 0.001 A 136 LYS HDy H 1 1.539 0.001 A 136 LYS HDx H 1 1.506 0.001 A 136 LYS HEx H 1 2.687 0.001 A 136 LYS HEy H 1 2.803 0.002 A 136 LYS HGx H 1 0.371 0.004 A 136 LYS HGy H 1 1.172 0.004 A 136 LYS C C 13 177.600 0.100 A 136 LYS CA C 13 58.749 0.104 A 136 LYS CB C 13 33.238 0.004 A 136 LYS CD C 13 30.111 0.070 A 136 LYS CE C 13 42.289 0.097 A 136 LYS CG C 13 24.783 0.041 A 136 LYS N N 15 119.805 0.100 A 137 TYR H H 1 7.488 0.002 A 137 TYR HA H 1 4.523 0.002 A 137 TYR HBx H 1 2.718 0.002 A 137 TYR HBy H 1 3.330 0.035 A 137 TYR HDx H 1 7.405 0.008 A 137 TYR HDy H 1 7.405 0.008 A 137 TYR HEx H 1 6.986 0.012 A 137 TYR HEy H 1 6.986 0.012 A 137 TYR C C 13 174.690 0.100 A 137 TYR CA C 13 58.359 0.103 A 137 TYR CB C 13 38.328 0.066 A 137 TYR CD1 C 13 133.636 0.193 A 137 TYR CD2 C 13 133.636 0.193 A 137 TYR CE1 C 13 117.644 0.142 A 137 TYR CE2 C 13 117.644 0.142 A 137 TYR N N 15 114.768 0.100 A 138 LYS H H 1 7.217 0.002 A 138 LYS HA H 1 4.501 0.007 A 138 LYS HB2 H 1 1.854 0.005 A 138 LYS HB3 H 1 1.854 0.005 A 138 LYS HD2 H 1 1.675 0.009 A 138 LYS HD3 H 1 1.675 0.009 A 138 LYS HE2 H 1 2.959 0.013 A 138 LYS HE3 H 1 2.959 0.013 A 138 LYS HG2 H 1 1.487 0.005 A 138 LYS HG3 H 1 1.487 0.005 A 138 LYS CA C 13 55.282 0.151 A 138 LYS CB C 13 32.124 0.031 A 138 LYS CD C 13 29.645 0.033 A 138 LYS CE C 13 42.227 0.063 A 138 LYS CG C 13 24.409 0.037 A 138 LYS N N 15 123.694 0.100 A 139 PRO HA H 1 4.452 0.007 A 139 PRO HBx H 1 1.898 0.003 A 139 PRO HBy H 1 2.325 0.007 A 139 PRO HDx H 1 3.647 0.001 A 139 PRO HDy H 1 3.924 0.004 A 139 PRO HG2 H 1 2.062 0.005 A 139 PRO HG3 H 1 2.062 0.005 A 139 PRO C C 13 176.974 0.100 A 139 PRO CA C 13 63.189 0.139 A 139 PRO CB C 13 32.251 0.094 A 139 PRO CD C 13 50.704 0.031 A 139 PRO CG C 13 27.846 0.031 A 140 VAL H H 1 8.272 0.002 A 140 VAL HA H 1 4.102 0.004 A 140 VAL HB H 1 2.058 0.005 A 140 VAL HG1% H 1 0.959 0.021 A 140 VAL HG2% H 1 0.928 0.001 A 140 VAL C C 13 176.207 0.100 A 140 VAL CA C 13 62.356 0.116 A 140 VAL CB C 13 33.256 0.011 A 140 VAL CG1 C 13 20.784 0.020 A 140 VAL CG2 C 13 20.784 0.020 A 140 VAL N N 15 121.098 0.100 A 141 VAL H H 1 8.142 0.002 A 141 VAL HA H 1 4.122 0.005 A 141 VAL HB H 1 2.002 0.007 A 141 VAL HG1% H 1 0.884 0.009 A 141 VAL HG2% H 1 0.884 0.009 A 141 VAL C C 13 175.415 0.100 A 141 VAL CA C 13 61.731 0.090 A 141 VAL CB C 13 33.145 0.068 A 141 VAL CG1 C 13 20.869 0.031 A 141 VAL CG2 C 13 20.869 0.031 A 141 VAL N N 15 124.167 0.100 A 142 ASP H H 1 8.419 0.002 A 142 ASP HA H 1 4.812 0.007 A 142 ASP HBx H 1 2.504 0.002 A 142 ASP HBy H 1 2.744 0.005 A 142 ASP CA C 13 52.217 0.169 A 142 ASP CB C 13 41.368 0.099 A 142 ASP N N 15 126.737 0.100 A 143 PRO HA H 1 4.411 0.002 A 143 PRO HBy H 1 2.230 0.005 A 143 PRO HBx H 1 1.953 0.001 A 143 PRO HD2 H 1 3.839 0.001 A 143 PRO HD3 H 1 3.839 0.001 A 143 PRO HGx H 1 1.952 0.001 A 143 PRO HGy H 1 2.010 0.001 A 143 PRO C C 13 176.662 0.100 A 143 PRO CA C 13 63.247 0.085 A 143 PRO CB C 13 32.310 0.158 A 143 PRO CD C 13 50.715 0.014 A 143 PRO CG C 13 26.747 0.053 A 144 ASN H H 1 8.432 0.002 A 144 ASN HA H 1 4.947 0.009 A 144 ASN HBy H 1 2.712 0.001 A 144 ASN HBx H 1 2.628 0.006 A 144 ASN HD2y H 1 7.723 0.002 A 144 ASN HD2x H 1 6.895 0.002 A 144 ASN CA C 13 51.633 0.129 A 144 ASN CB C 13 38.859 0.063 A 144 ASN N N 15 119.287 0.100 A 144 ASN ND2 N 15 113.876 0.007 A 145 PRO HA H 1 4.680 0.001 A 145 PRO HBy H 1 2.301 0.004 A 145 PRO HBx H 1 1.922 0.002 A 145 PRO HDx H 1 3.605 0.004 A 145 PRO HDy H 1 3.745 0.003 A 145 PRO HG2 H 1 2.013 0.001 A 145 PRO HG3 H 1 2.013 0.001 A 145 PRO CA C 13 61.640 0.034 A 145 PRO CB C 13 30.918 0.051 A 145 PRO CD C 13 50.509 0.036 A 145 PRO CG C 13 27.268 0.005 A 146 PRO HA H 1 4.377 0.005 A 146 PRO HBy H 1 2.261 0.003 A 146 PRO HBx H 1 1.952 0.003 A 146 PRO HDy H 1 3.798 0.001 A 146 PRO HDx H 1 3.621 0.003 A 146 PRO HG2 H 1 2.015 0.001 A 146 PRO HG3 H 1 2.015 0.001 A 146 PRO C C 13 175.876 0.100 A 146 PRO CA C 13 63.174 0.124 A 146 PRO CB C 13 31.939 0.047 A 146 PRO CD C 13 50.582 0.004 A 146 PRO CG C 13 27.005 0.052 A 147 ALA H H 1 7.935 0.002 A 147 ALA HA H 1 4.082 0.004 A 147 ALA HB% H 1 1.301 0.012 A 147 ALA CA C 13 53.730 0.091 A 147 ALA CB C 13 20.181 0.172 A 147 ALA N N 15 130.109 0.100 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 78 ALA H A 81 ILE HD1% 1.0 1.8 6.5 2 2 A 78 ALA H A 75 THR H 1.0 1.8 6.5 3 3 A 78 ALA H A 75 THR HG2% 1.0 1.8 6.5 4 4 A 142 ASP H A 141 VAL HG1% 1.0 1.8 6.0 5 4 A 141 VAL HG2% A 142 ASP H 1.0 1.8 6.0 6 5 A 142 ASP H A 141 VAL HA 1.0 1.8 3.0 7 6 A 142 ASP H A 143 PRO HD2 1.0 1.8 6.0 8 6 A 142 ASP H A 143 PRO HD3 1.0 1.8 6.0 9 7 A 142 ASP H A 142 ASP HBy 1.0 1.8 4.5 10 8 A 142 ASP H A 142 ASP HBx 1.0 1.8 4.5 11 9 A 99 ASP HBy A 100 LEU H 1.0 1.8 6.0 12 10 A 100 LEU H A 102 PHE H 1.0 1.8 6.5 13 11 A 100 LEU H A 100 LEU HG 1.0 1.8 6.0 14 12 A 100 LEU H A 100 LEU HB2 1.0 1.8 6.0 15 12 A 100 LEU H A 100 LEU HB3 1.0 1.8 6.0 16 13 A 100 LEU H A 100 LEU HD1% 1.0 1.8 6.0 17 14 A 100 LEU H A 101 GLY HAx 1.0 1.8 6.5 18 15 A 100 LEU H A 99 ASP HBx 1.0 1.8 6.0 19 16 A 100 LEU H A 98 LEU HD1% 1.0 1.8 6.5 20 17 A 90 VAL H A 90 VAL HB 1.0 1.8 6.0 21 18 A 90 VAL H A 90 VAL HG2% 1.0 1.8 6.0 22 19 A 90 VAL H A 89 VAL HG2% 1.0 1.8 6.0 23 20 A 88 ALA H A 89 VAL HG1% 1.0 1.8 6.5 24 21 A 90 VAL H A 91 TYR H 1.0 1.8 6.5 25 22 A 91 TYR H A 91 TYR HD% 1.0 1.8 6.0 26 23 A 91 TYR H A 90 VAL HG1% 1.0 1.8 6.0 27 24 A 90 VAL HG2% A 91 TYR H 1.0 1.8 6.5 28 25 A 90 VAL HB A 91 TYR H 1.0 1.8 6.5 29 26 A 88 ALA H A 86 LYS HGx 1.0 1.8 6.5 30 27 A 89 VAL HG2% A 88 ALA H 1.0 1.8 6.5 31 28 A 45 SER H A 46 PHE H 1.0 1.8 6.0 32 29 A 46 PHE H A 43 ASP H 1.0 1.8 6.0 33 30 A 46 PHE H A 47 CYS H 1.0 1.8 6.0 34 31 A 46 PHE H A 45 SER HB2 1.0 1.8 6.0 35 31 A 46 PHE H A 45 SER HB3 1.0 1.8 6.0 36 32 A 46 PHE H A 46 PHE HBy 1.0 1.8 6.0 37 33 A 46 PHE H A 46 PHE HBx 1.0 1.8 6.0 38 34 A 46 PHE H A 47 CYS HBx 1.0 1.8 6.5 39 35 A 46 PHE H A 44 ALA HB% 1.0 1.8 6.5 40 36 A 29 PHE HBx A 30 ASP H 1.0 1.8 6.0 41 37 A 30 ASP H A 30 ASP HBy 1.0 1.8 6.0 42 38 A 30 ASP H A 30 ASP HBx 1.0 1.8 4.5 43 39 A 64 CYS HBy A 65 ASP H 1.0 1.8 6.0 44 40 A 65 ASP H A 65 ASP HBx 1.0 1.8 4.5 45 41 A 141 VAL HA A 141 VAL H 1.0 1.8 4.5 46 42 A 141 VAL H A 141 VAL HB 1.0 1.8 4.5 47 43 A 141 VAL H A 141 VAL HG1% 1.0 1.8 4.5 48 43 A 141 VAL HG2% A 141 VAL H 1.0 1.8 4.5 49 44 A 28 VAL HA A 29 PHE H 1.0 1.8 3.0 50 45 A 29 PHE H A 29 PHE HBy 1.0 1.8 6.0 51 46 A 29 PHE HBx A 29 PHE H 1.0 1.8 4.5 52 47 A 29 PHE H A 28 VAL HG1% 1.0 1.8 6.0 53 47 A 29 PHE H A 28 VAL HG2% 1.0 1.8 6.0 54 48 A 29 PHE H A 28 VAL H 1.0 1.8 4.5 55 49 A 29 PHE H A 28 VAL HB 1.0 1.8 6.0 56 50 A 81 ILE H A 84 LYS H 1.0 1.8 6.5 57 51 A 81 ILE H A 81 ILE HB 1.0 1.8 4.5 58 52 A 81 ILE H A 80 GLY H 1.0 1.8 6.0 59 53 A 81 ILE H A 78 ALA HB% 1.0 1.8 6.5 60 54 A 81 ILE H A 81 ILE HG2% 1.0 1.8 6.0 61 55 A 81 ILE H A 83 GLU H 1.0 1.8 6.0 62 56 A 81 ILE H A 82 ARG HB2 1.0 1.8 6.5 63 56 A 81 ILE H A 82 ARG HB3 1.0 1.8 6.5 64 57 A 137 TYR H A 138 LYS H 1.0 1.8 4.5 65 58 A 138 LYS H A 137 TYR HBx 1.0 1.8 6.0 66 59 A 138 LYS H A 138 LYS HE2 1.0 1.8 6.5 67 59 A 138 LYS H A 138 LYS HE3 1.0 1.8 6.5 68 60 A 138 LYS H A 137 TYR HBy 1.0 1.8 6.0 69 61 A 138 LYS H A 138 LYS HB2 1.0 1.8 3.0 70 61 A 138 LYS H A 138 LYS HB3 1.0 1.8 3.0 71 62 A 138 LYS H A 138 LYS HD2 1.0 1.8 6.0 72 62 A 138 LYS H A 138 LYS HD3 1.0 1.8 6.0 73 63 A 92 GLY HAx A 98 LEU H 1.0 1.8 6.5 74 64 A 98 LEU H A 92 GLY H 1.0 1.8 6.0 75 65 A 98 LEU H A 99 ASP H 1.0 1.8 6.5 76 66 A 91 TYR HD% A 98 LEU H 1.0 1.8 6.5 77 67 A 98 LEU HD1% A 98 LEU H 1.0 1.8 6.0 78 68 A 43 ASP H A 42 LEU H 1.0 1.8 6.0 79 69 A 42 LEU H A 68 TYR HD% 1.0 1.8 6.5 80 70 A 42 LEU H A 68 TYR HE% 1.0 1.8 6.0 81 71 A 42 LEU H A 43 ASP HA 1.0 1.8 6.5 82 72 A 42 LEU H A 41 PRO HA 1.0 1.8 4.5 83 73 A 42 LEU H A 41 PRO HBy 1.0 1.8 6.0 84 74 A 42 LEU H A 41 PRO HBx 1.0 1.8 6.0 85 75 A 42 LEU H A 67 LYS HDx 1.0 1.8 6.5 86 76 A 42 LEU H A 42 LEU HB2 1.0 1.8 4.5 87 76 A 42 LEU H A 42 LEU HB3 1.0 1.8 4.5 88 77 A 42 LEU H A 42 LEU HD1% 1.0 1.8 6.0 89 78 A 43 ASP H A 43 ASP HBy 1.0 1.8 6.0 90 79 A 43 ASP H A 42 LEU HB2 1.0 1.8 6.0 91 79 A 43 ASP H A 42 LEU HB3 1.0 1.8 6.0 92 80 A 43 ASP H A 46 PHE HBy 1.0 1.8 6.0 93 81 A 43 ASP H A 42 LEU HD1% 1.0 1.8 6.0 94 82 A 81 ILE H A 77 CYS HA 1.0 1.8 6.5 95 83 A 43 ASP H A 61 VAL HG1% 1.0 1.8 6.5 96 84 A 73 ARG HA A 74 GLU H 1.0 1.8 4.5 97 85 A 74 GLU H A 68 TYR HA 1.0 1.8 6.5 98 86 A 108 ILE HA A 110 GLU H 1.0 1.8 6.5 99 87 A 110 GLU H A 111 VAL HA 1.0 1.8 6.5 100 88 A 110 GLU H A 110 GLU HB2 1.0 1.8 6.0 101 88 A 110 GLU H A 110 GLU HB3 1.0 1.8 6.0 102 89 A 110 GLU H A 109 ARG HGy 1.0 1.8 6.0 103 90 A 110 GLU H A 109 ARG HBy 1.0 1.8 6.5 104 91 A 110 GLU H A 111 VAL HG1% 1.0 1.8 6.5 105 92 A 116 ASP H A 117 ALA H 1.0 1.8 6.0 106 93 A 117 ALA H A 118 GLN H 1.0 1.8 6.0 107 94 A 68 TYR HD% A 74 GLU H 1.0 1.8 6.5 108 95 A 68 TYR HE% A 74 GLU H 1.0 1.8 6.0 109 96 A 117 ALA H A 114 ARG HA 1.0 1.8 6.0 110 97 A 117 ALA H A 116 ASP HBy 1.0 1.8 6.0 111 98 A 117 ALA H A 116 ASP HBx 1.0 1.8 6.0 112 99 A 123 LYS HBy A 124 TYR H 1.0 1.8 6.5 113 100 A 124 TYR H A 123 LYS H 1.0 1.8 6.5 114 101 A 34 GLN H A 35 TYR HD% 1.0 1.8 6.5 115 102 A 34 GLN H A 33 THR HA 1.0 1.8 4.5 116 103 A 34 GLN H A 33 THR HB 1.0 1.8 6.0 117 104 A 34 GLN H A 34 GLN HG2 1.0 1.8 6.0 118 104 A 34 GLN H A 34 GLN HG3 1.0 1.8 6.0 119 105 A 34 GLN H A 34 GLN HBy 1.0 1.8 6.0 120 106 A 34 GLN H A 34 GLN HBx 1.0 1.8 6.0 121 107 A 51 GLY H A 54 GLU H 1.0 1.8 6.5 122 108 A 54 GLU H A 51 GLY HAy 1.0 1.8 6.5 123 109 A 75 THR H A 76 ALA H 1.0 1.8 6.0 124 110 A 78 ALA H A 76 ALA H 1.0 1.8 6.5 125 111 A 124 TYR H A 125 GLU H 1.0 1.8 6.0 126 112 A 100 LEU H A 99 ASP H 1.0 1.8 6.0 127 113 A 99 ASP H A 98 LEU HA 1.0 1.8 4.5 128 114 A 99 ASP HBy A 99 ASP H 1.0 1.8 4.5 129 115 A 99 ASP HBx A 99 ASP H 1.0 1.8 6.0 130 116 A 100 LEU HG A 99 ASP H 1.0 1.8 6.5 131 117 A 99 ASP H A 98 LEU HBx 1.0 1.8 6.0 132 118 A 38 ASP H A 40 LYS H 1.0 1.8 6.0 133 119 A 60 ASP H A 61 VAL H 1.0 1.8 4.5 134 120 A 60 ASP H A 85 TYR HE% 1.0 1.8 6.0 135 121 A 60 ASP H A 60 ASP HBy 1.0 1.8 4.5 136 122 A 60 ASP H A 59 LYS HB2 1.0 1.8 4.5 137 122 A 60 ASP H A 59 LYS HB3 1.0 1.8 4.5 138 123 A 60 ASP H A 59 LYS HD2 1.0 1.8 6.5 139 123 A 60 ASP H A 59 LYS HD3 1.0 1.8 6.5 140 124 A 81 ILE HD1% A 60 ASP H 1.0 1.8 6.5 141 125 A 54 GLU H A 55 LYS HGy 1.0 1.8 6.5 142 126 A 54 GLU H A 52 SER HA 1.0 1.8 6.0 143 127 A 54 GLU H A 47 CYS HBy 1.0 1.8 6.5 144 128 A 54 GLU H A 57 CYS HBy 1.0 1.8 6.0 145 129 A 54 GLU H A 53 ARG HBy 1.0 1.8 6.0 146 130 A 54 GLU H A 54 GLU HBy 1.0 1.8 4.5 147 131 A 54 GLU H A 54 GLU HBx 1.0 1.8 4.5 148 132 A 54 GLU H A 53 ARG H 1.0 1.8 4.5 149 133 A 54 GLU H A 85 TYR HD% 1.0 1.8 6.5 150 134 A 54 GLU H A 52 SER HBy 1.0 1.8 6.5 151 135 A 48 ARG HA A 50 ALA H 1.0 1.8 6.5 152 136 A 110 GLU HA A 112 ASP H 1.0 1.8 6.0 153 137 A 54 GLU HBy A 50 ALA H 1.0 1.8 6.5 154 138 A 112 ASP H A 109 ARG HA 1.0 1.8 6.5 155 139 A 112 ASP H A 112 ASP HBy 1.0 1.8 6.0 156 140 A 111 VAL HG1% A 112 ASP H 1.0 1.8 6.0 157 141 A 76 ALA H A 77 CYS H 1.0 1.8 6.0 158 142 A 93 TYR H A 98 LEU HG 1.0 1.8 6.5 159 143 A 38 ASP H A 35 TYR HE% 1.0 1.8 6.5 160 144 A 38 ASP H A 36 GLY HA2 1.0 1.8 6.0 161 144 A 38 ASP H A 36 GLY HA3 1.0 1.8 6.0 162 145 A 38 ASP H A 37 TYR HBy 1.0 1.8 6.0 163 146 A 38 ASP H A 38 ASP HBx 1.0 1.8 4.5 164 147 A 60 ASP H A 56 ASP HA 1.0 1.8 6.0 165 148 A 91 TYR H A 89 VAL H 1.0 1.8 6.5 166 149 A 89 VAL H A 91 TYR HE% 1.0 1.8 6.5 167 150 A 110 GLU H A 112 ASP H 1.0 1.8 6.5 168 151 A 74 GLU H A 69 ASP H 1.0 1.8 6.5 169 152 A 69 ASP H A 73 ARG HBy 1.0 1.8 6.5 170 153 A 75 THR H A 69 ASP H 1.0 1.8 6.0 171 154 A 69 ASP H A 68 TYR H 1.0 1.8 6.0 172 155 A 68 TYR HA A 69 ASP H 1.0 1.8 4.5 173 156 A 69 ASP H A 72 GLY HAx 1.0 1.8 6.5 174 157 A 69 ASP H A 69 ASP HBy 1.0 1.8 6.0 175 158 A 68 TYR HD% A 69 ASP H 1.0 1.8 6.0 176 159 A 69 ASP H A 68 TYR HBy 1.0 1.8 6.0 177 160 A 69 ASP H A 69 ASP HBx 1.0 1.8 6.0 178 161 A 69 ASP H A 73 ARG HG2 1.0 1.8 6.5 179 161 A 69 ASP H A 73 ARG HG3 1.0 1.8 6.5 180 162 A 93 TYR H A 93 TYR HE% 1.0 1.8 6.5 181 163 A 93 TYR H A 93 TYR HD% 1.0 1.8 6.0 182 164 A 93 TYR H A 93 TYR HBx 1.0 1.8 6.0 183 165 A 128 LYS H A 130 LEU H 1.0 1.8 6.0 184 166 A 130 LEU H A 127 ASP HA 1.0 1.8 6.0 185 167 A 130 LEU H A 129 CYS HBy 1.0 1.8 6.0 186 168 A 130 LEU H A 129 CYS HBx 1.0 1.8 6.0 187 169 A 130 LEU H A 130 LEU HBy 1.0 1.8 6.0 188 170 A 130 LEU H A 130 LEU HBx 1.0 1.8 6.0 189 171 A 130 LEU H A 130 LEU HD2% 1.0 1.8 6.0 190 172 A 130 LEU H A 133 ILE HD1% 1.0 1.8 6.5 191 173 A 116 ASP H A 112 ASP HA 1.0 1.8 6.5 192 174 A 116 ASP H A 116 ASP HBy 1.0 1.8 6.0 193 175 A 116 ASP H A 116 ASP HBx 1.0 1.8 6.0 194 176 A 116 ASP H A 115 LYS HB2 1.0 1.8 6.0 195 176 A 116 ASP H A 115 LYS HB3 1.0 1.8 6.0 196 177 A 116 ASP H A 115 LYS HD2 1.0 1.8 6.5 197 177 A 116 ASP H A 115 LYS HD3 1.0 1.8 6.5 198 178 A 116 ASP H A 117 ALA HB% 1.0 1.8 6.0 199 179 A 89 VAL H A 90 VAL HA 1.0 1.8 6.5 200 180 A 88 ALA H A 89 VAL H 1.0 1.8 6.0 201 181 A 89 VAL H A 89 VAL HB 1.0 1.8 6.0 202 182 A 89 VAL H A 88 ALA HB% 1.0 1.8 6.0 203 183 A 90 VAL HG1% A 89 VAL H 1.0 1.8 6.5 204 184 A 89 VAL HG1% A 89 VAL H 1.0 1.8 6.0 205 185 A 40 LYS H A 37 TYR HE% 1.0 1.8 6.5 206 186 A 40 LYS H A 39 GLY HAy 1.0 1.8 6.0 207 186 A 40 LYS H A 39 GLY HAx 1.0 1.8 6.0 208 187 A 125 GLU H A 128 LYS H 1.0 1.8 6.5 209 188 A 128 LYS H A 129 CYS H 1.0 1.8 6.0 210 189 A 128 LYS H A 128 LYS HB2 1.0 1.8 4.5 211 189 A 128 LYS H A 128 LYS HB3 1.0 1.8 4.5 212 190 A 128 LYS H A 131 ASN HD2x 1.0 1.8 6.5 213 191 A 128 LYS H A 129 CYS HBx 1.0 1.8 6.5 214 192 A 128 LYS H A 128 LYS HGy 1.0 1.8 6.0 215 193 A 56 ASP H A 57 CYS H 1.0 1.8 4.5 216 194 A 54 GLU HBy A 56 ASP H 1.0 1.8 6.5 217 195 A 56 ASP H A 55 LYS HGx 1.0 1.8 6.5 218 196 A 84 LYS H A 86 LYS H 1.0 1.8 6.0 219 197 A 83 GLU H A 86 LYS H 1.0 1.8 6.5 220 198 A 86 LYS H A 85 TYR H 1.0 1.8 6.0 221 199 A 86 LYS H A 85 TYR HBy 1.0 1.8 6.0 222 200 A 86 LYS H A 86 LYS HB2 1.0 1.8 4.5 223 200 A 86 LYS H A 86 LYS HB3 1.0 1.8 4.5 224 201 A 86 LYS H A 86 LYS HGy 1.0 1.8 6.0 225 202 A 68 TYR HD% A 73 ARG H 1.0 1.8 6.5 226 203 A 73 ARG H A 68 TYR HBx 1.0 1.8 6.5 227 204 A 69 ASP H A 73 ARG H 1.0 1.8 6.0 228 205 A 73 ARG H A 71 GLN HBy 1.0 1.8 6.0 229 206 A 73 ARG HBy A 73 ARG H 1.0 1.8 4.5 230 207 A 73 ARG H A 73 ARG HBx 1.0 1.8 6.0 231 208 A 73 ARG H A 73 ARG HG2 1.0 1.8 4.5 232 208 A 73 ARG HG3 A 73 ARG H 1.0 1.8 4.5 233 209 A 73 ARG H A 71 GLN HE2x 1.0 1.8 6.5 234 210 A 131 ASN HBy A 134 LYS H 1.0 1.8 6.5 235 211 A 134 LYS H A 133 ILE H 1.0 1.8 4.5 236 212 A 134 LYS H A 131 ASN HA 1.0 1.8 6.0 237 213 A 134 LYS H A 130 LEU HA 1.0 1.8 6.5 238 214 A 134 LYS H A 133 ILE HB 1.0 1.8 6.0 239 215 A 134 LYS H A 135 GLU HB2 1.0 1.8 6.0 240 215 A 134 LYS H A 135 GLU HB3 1.0 1.8 6.0 241 216 A 134 LYS H A 133 ILE HG1y 1.0 1.8 6.0 242 217 A 134 LYS H A 132 ALA HB% 1.0 1.8 6.0 243 218 A 134 LYS H A 134 LYS HBy 1.0 1.8 4.5 244 219 A 134 LYS H A 134 LYS HD2 1.0 1.8 4.5 245 219 A 134 LYS H A 134 LYS HD3 1.0 1.8 4.5 246 220 A 130 LEU HD2% A 134 LYS H 1.0 1.8 6.5 247 221 A 134 LYS H A 134 LYS HGy 1.0 1.8 6.0 248 222 A 134 LYS H A 135 GLU HG2 1.0 1.8 6.0 249 222 A 134 LYS H A 135 GLU HG3 1.0 1.8 6.0 250 223 A 40 LYS H A 38 ASP HA 1.0 1.8 6.0 251 224 A 40 LYS H A 40 LYS HBy 1.0 1.8 4.5 252 225 A 40 LYS H A 40 LYS HG2 1.0 1.8 6.0 253 225 A 40 LYS H A 40 LYS HG3 1.0 1.8 6.0 254 226 A 40 LYS H A 37 TYR H 1.0 1.8 6.0 255 227 A 40 LYS H A 35 TYR HBx 1.0 1.8 6.0 256 228 A 54 GLU H A 56 ASP H 1.0 1.8 6.0 257 229 A 56 ASP H A 53 ARG HA 1.0 1.8 6.5 258 230 A 56 ASP H A 56 ASP HBy 1.0 1.8 4.5 259 231 A 56 ASP H A 56 ASP HBx 1.0 1.8 4.5 260 232 A 53 ARG HBy A 56 ASP H 1.0 1.8 6.5 261 233 A 56 ASP H A 55 LYS HBx 1.0 1.8 4.5 262 234 A 56 ASP H A 57 CYS HBx 1.0 1.8 6.5 263 235 A 85 TYR HE% A 56 ASP H 1.0 1.8 6.5 264 236 A 56 ASP H A 54 GLU HA 1.0 1.8 6.0 265 237 A 131 ASN HBy A 132 ALA H 1.0 1.8 6.0 266 238 A 132 ALA H A 131 ASN HBx 1.0 1.8 6.0 267 239 A 132 ALA H A 135 GLU HG2 1.0 1.8 6.5 268 239 A 135 GLU HG3 A 132 ALA H 1.0 1.8 6.5 269 240 A 132 ALA H A 135 GLU HB2 1.0 1.8 6.5 270 240 A 135 GLU HB3 A 132 ALA H 1.0 1.8 6.5 271 241 A 130 LEU HBx A 132 ALA H 1.0 1.8 6.5 272 242 A 132 ALA H A 128 LYS HA 1.0 1.8 6.5 273 243 A 61 VAL H A 60 ASP HBy 1.0 1.8 6.0 274 244 A 61 VAL H A 61 VAL HB 1.0 1.8 4.5 275 245 A 61 VAL H A 59 LYS HB2 1.0 1.8 6.0 276 245 A 61 VAL H A 59 LYS HB3 1.0 1.8 6.0 277 246 A 61 VAL H A 85 TYR HE% 1.0 1.8 6.5 278 247 A 61 VAL H A 63 ALA HB% 1.0 1.8 6.5 279 248 A 91 TYR HE% A 96 LYS H 1.0 1.8 6.5 280 249 A 96 LYS H A 95 GLY H 1.0 1.8 4.5 281 250 A 91 TYR HD% A 96 LYS H 1.0 1.8 6.0 282 251 A 96 LYS H A 94 ASP HBy 1.0 1.8 6.0 283 252 A 96 LYS H A 96 LYS HB2 1.0 1.8 4.5 284 252 A 96 LYS H A 96 LYS HB3 1.0 1.8 4.5 285 253 A 96 LYS H A 96 LYS HG2 1.0 1.8 6.0 286 253 A 96 LYS H A 96 LYS HG3 1.0 1.8 6.0 287 254 A 96 LYS H A 96 LYS HD2 1.0 1.8 6.0 288 254 A 96 LYS H A 96 LYS HD3 1.0 1.8 6.0 289 255 A 60 ASP H A 59 LYS H 1.0 1.8 4.5 290 256 A 59 LYS H A 59 LYS HB2 1.0 1.8 4.5 291 256 A 59 LYS HB3 A 59 LYS H 1.0 1.8 4.5 292 257 A 59 LYS H A 58 ARG HB2 1.0 1.8 6.0 293 257 A 59 LYS H A 58 ARG HB3 1.0 1.8 6.0 294 258 A 59 LYS H A 59 LYS HGy 1.0 1.8 6.0 295 259 A 59 LYS H A 58 ARG HG2 1.0 1.8 6.0 296 259 A 59 LYS H A 58 ARG HG3 1.0 1.8 6.0 297 260 A 61 VAL H A 59 LYS H 1.0 1.8 6.5 298 261 A 103 CYS H A 110 GLU HG2 1.0 1.8 6.5 299 261 A 103 CYS H A 110 GLU HG3 1.0 1.8 6.5 300 262 A 103 CYS H A 105 LEU HG 1.0 1.8 6.5 301 263 A 103 CYS H A 104 THR H 1.0 1.8 6.0 302 264 A 103 CYS H A 102 PHE HBx 1.0 1.8 6.5 303 265 A 127 ASP H A 128 LYS HE2 1.0 1.8 6.5 304 265 A 127 ASP H A 128 LYS HE3 1.0 1.8 6.5 305 266 A 127 ASP H A 128 LYS HGx 1.0 1.8 6.5 306 267 A 129 CYS H A 127 ASP H 1.0 1.8 6.0 307 268 A 128 LYS H A 127 ASP H 1.0 1.8 4.5 308 269 A 127 ASP H A 125 GLU HA 1.0 1.8 6.5 309 270 A 128 LYS HA A 127 ASP H 1.0 1.8 6.5 310 271 A 127 ASP H A 124 TYR HA 1.0 1.8 6.5 311 272 A 127 ASP H A 127 ASP HB2 1.0 1.8 4.5 312 272 A 127 ASP H A 127 ASP HB3 1.0 1.8 4.5 313 273 A 127 ASP H A 125 GLU HG2 1.0 1.8 6.5 314 273 A 127 ASP H A 125 GLU HG3 1.0 1.8 6.5 315 274 A 127 ASP H A 128 LYS HB2 1.0 1.8 6.0 316 274 A 128 LYS HB3 A 127 ASP H 1.0 1.8 6.0 317 275 A 141 VAL H A 140 VAL H 1.0 1.8 4.5 318 276 A 140 VAL H A 138 LYS HD2 1.0 1.8 6.5 319 276 A 138 LYS HD3 A 140 VAL H 1.0 1.8 6.5 320 277 A 33 THR H A 35 TYR H 1.0 1.8 6.5 321 278 A 35 TYR HD% A 35 TYR H 1.0 1.8 6.0 322 279 A 35 TYR HBx A 35 TYR H 1.0 1.8 6.0 323 280 A 35 TYR H A 35 TYR HBy 1.0 1.8 4.5 324 281 A 35 TYR H A 34 GLN HG2 1.0 1.8 6.0 325 281 A 34 GLN HG3 A 35 TYR H 1.0 1.8 6.0 326 282 A 34 GLN HBy A 35 TYR H 1.0 1.8 6.0 327 283 A 34 GLN HBx A 35 TYR H 1.0 1.8 6.0 328 284 A 35 TYR H A 33 THR HG2% 1.0 1.8 6.5 329 285 A 33 THR HB A 35 TYR H 1.0 1.8 6.5 330 286 A 118 GLN H A 115 LYS H 1.0 1.8 6.5 331 287 A 117 ALA H A 115 LYS H 1.0 1.8 6.0 332 288 A 116 ASP H A 115 LYS H 1.0 1.8 6.0 333 289 A 115 LYS H A 114 ARG H 1.0 1.8 6.0 334 290 A 115 LYS H A 113 CYS H 1.0 1.8 6.0 335 291 A 112 ASP HA A 115 LYS H 1.0 1.8 6.0 336 292 A 115 LYS H A 115 LYS HE2 1.0 1.8 6.5 337 292 A 115 LYS H A 115 LYS HE3 1.0 1.8 6.5 338 293 A 115 LYS H A 115 LYS HB2 1.0 1.8 4.5 339 293 A 115 LYS HB3 A 115 LYS H 1.0 1.8 4.5 340 294 A 115 LYS H A 114 ARG HB2 1.0 1.8 6.0 341 294 A 115 LYS H A 114 ARG HB3 1.0 1.8 6.0 342 295 A 115 LYS H A 115 LYS HGx 1.0 1.8 6.0 343 296 A 116 ASP HBx A 115 LYS H 1.0 1.8 6.5 344 297 A 133 ILE H A 133 ILE HG1y 1.0 1.8 6.0 345 298 A 133 ILE H A 133 ILE HG2% 1.0 1.8 6.0 346 299 A 133 ILE H A 134 LYS HD2 1.0 1.8 6.5 347 299 A 133 ILE H A 134 LYS HD3 1.0 1.8 6.5 348 300 A 130 LEU HD2% A 133 ILE H 1.0 1.8 6.5 349 301 A 133 ILE H A 133 ILE HB 1.0 1.8 6.0 350 302 A 103 CYS H A 105 LEU H 1.0 1.8 6.0 351 303 A 103 CYS H A 103 CYS HBy 1.0 1.8 6.0 352 304 A 103 CYS H A 103 CYS HBx 1.0 1.8 6.0 353 305 A 103 CYS H A 106 ALA HB% 1.0 1.8 6.5 354 306 A 103 CYS H A 104 THR HG2% 1.0 1.8 6.5 355 307 A 101 GLY HAx A 103 CYS H 1.0 1.8 6.5 356 308 A 111 VAL HG1% A 113 CYS H 1.0 1.8 6.5 357 309 A 114 ARG H A 113 CYS H 1.0 1.8 6.0 358 310 A 112 ASP H A 113 CYS H 1.0 1.8 6.0 359 311 A 110 GLU HA A 113 CYS H 1.0 1.8 6.0 360 312 A 113 CYS H A 113 CYS HBy 1.0 1.8 6.0 361 313 A 113 CYS H A 112 ASP HBx 1.0 1.8 6.0 362 314 A 113 CYS H A 113 CYS HBx 1.0 1.8 6.0 363 315 A 38 ASP H A 37 TYR H 1.0 1.8 6.0 364 316 A 43 ASP HBy A 44 ALA H 1.0 1.8 6.0 365 317 A 44 ALA H A 43 ASP HBx 1.0 1.8 6.0 366 318 A 61 VAL HG1% A 44 ALA H 1.0 1.8 6.5 367 319 A 61 VAL H A 58 ARG H 1.0 1.8 6.0 368 320 A 60 ASP H A 58 ARG H 1.0 1.8 6.0 369 321 A 57 CYS H A 58 ARG H 1.0 1.8 4.5 370 322 A 59 LYS H A 58 ARG H 1.0 1.8 4.5 371 323 A 56 ASP HA A 58 ARG H 1.0 1.8 6.5 372 324 A 58 ARG H A 55 LYS HA 1.0 1.8 6.0 373 325 A 58 ARG H A 58 ARG HDy 1.0 1.8 6.0 374 326 A 57 CYS HBy A 58 ARG H 1.0 1.8 6.0 375 327 A 58 ARG H A 54 GLU HGy 1.0 1.8 6.5 376 328 A 58 ARG H A 59 LYS HB2 1.0 1.8 6.0 377 328 A 59 LYS HB3 A 58 ARG H 1.0 1.8 6.0 378 329 A 58 ARG H A 58 ARG HB2 1.0 1.8 4.5 379 329 A 58 ARG HB3 A 58 ARG H 1.0 1.8 4.5 380 330 A 58 ARG H A 58 ARG HG2 1.0 1.8 6.0 381 330 A 58 ARG HG3 A 58 ARG H 1.0 1.8 6.0 382 331 A 57 CYS HBx A 58 ARG H 1.0 1.8 6.0 383 332 A 58 ARG H A 61 VAL HG2% 1.0 1.8 6.5 384 333 A 37 TYR H A 37 TYR HD% 1.0 1.8 6.0 385 334 A 37 TYR HE% A 37 TYR H 1.0 1.8 6.0 386 335 A 37 TYR H A 36 GLY HA2 1.0 1.8 4.5 387 335 A 36 GLY HA3 A 37 TYR H 1.0 1.8 4.5 388 336 A 37 TYR H A 40 LYS HA 1.0 1.8 6.5 389 337 A 57 CYS H A 57 CYS HBx 1.0 1.8 6.0 390 338 A 57 CYS HBy A 57 CYS H 1.0 1.8 4.5 391 339 A 57 CYS H A 56 ASP HBx 1.0 1.8 6.0 392 340 A 57 CYS H A 58 ARG HB2 1.0 1.8 6.0 393 340 A 57 CYS H A 58 ARG HB3 1.0 1.8 6.0 394 341 A 85 TYR HE% A 57 CYS H 1.0 1.8 6.0 395 342 A 57 CYS H A 55 LYS H 1.0 1.8 6.0 396 343 A 57 CYS H A 53 ARG HD2 1.0 1.8 6.5 397 343 A 57 CYS H A 53 ARG HD3 1.0 1.8 6.5 398 344 A 44 ALA H A 61 VAL HG2% 1.0 1.8 6.5 399 345 A 28 VAL H A 28 VAL HB 1.0 1.8 6.0 400 346 A 28 VAL H A 28 VAL HG1% 1.0 1.8 6.0 401 346 A 28 VAL HG2% A 28 VAL H 1.0 1.8 6.0 402 347 A 129 CYS HBx A 129 CYS H 1.0 1.8 6.0 403 348 A 130 LEU H A 129 CYS H 1.0 1.8 6.0 404 349 A 129 CYS HBy A 129 CYS H 1.0 1.8 6.0 405 350 A 129 CYS H A 128 LYS HB2 1.0 1.8 6.0 406 350 A 129 CYS H A 128 LYS HB3 1.0 1.8 6.0 407 351 A 129 CYS H A 128 LYS HGx 1.0 1.8 6.5 408 352 A 129 CYS H A 126 SER H 1.0 1.8 6.5 409 353 A 123 LYS H A 123 LYS HD2 1.0 1.8 6.0 410 353 A 123 LYS H A 123 LYS HD3 1.0 1.8 6.0 411 354 A 123 LYS H A 123 LYS HBx 1.0 1.8 6.0 412 355 A 123 LYS H A 123 LYS HGx 1.0 1.8 6.0 413 356 A 123 LYS H A 123 LYS HE2 1.0 1.8 6.5 414 356 A 123 LYS H A 123 LYS HE3 1.0 1.8 6.5 415 357 A 50 ALA H A 48 ARG H 1.0 1.8 6.0 416 358 A 48 ARG H A 49 THR H 1.0 1.8 6.0 417 359 A 47 CYS HBx A 48 ARG H 1.0 1.8 6.0 418 360 A 48 ARG H A 48 ARG HB2 1.0 1.8 4.5 419 360 A 48 ARG H A 48 ARG HB3 1.0 1.8 4.5 420 361 A 48 ARG H A 48 ARG HG2 1.0 1.8 4.5 421 361 A 48 ARG H A 48 ARG HG3 1.0 1.8 4.5 422 362 A 134 LYS H A 136 LYS H 1.0 1.8 6.5 423 363 A 133 ILE HB A 136 LYS H 1.0 1.8 6.5 424 364 A 28 VAL H A 27 ASP H 1.0 1.8 6.0 425 365 A 28 VAL H A 27 ASP HBy 1.0 1.8 6.0 426 366 A 53 ARG H A 51 GLY HAx 1.0 1.8 6.5 427 367 A 85 TYR HE% A 53 ARG H 1.0 1.8 6.5 428 368 A 53 ARG H A 85 TYR HD% 1.0 1.8 6.5 429 369 A 53 ARG H A 52 SER HBx 1.0 1.8 6.0 430 370 A 53 ARG H A 53 ARG HGx 1.0 1.8 6.0 431 371 A 138 LYS H A 136 LYS H 1.0 1.8 6.0 432 372 A 136 LYS H A 137 TYR HA 1.0 1.8 6.5 433 373 A 136 LYS H A 134 LYS HA 1.0 1.8 6.5 434 374 A 136 LYS H A 136 LYS HEx 1.0 1.8 6.5 435 375 A 136 LYS H A 135 GLU HG2 1.0 1.8 6.0 436 375 A 135 GLU HG3 A 136 LYS H 1.0 1.8 6.0 437 376 A 136 LYS H A 135 GLU HB2 1.0 1.8 6.0 438 376 A 135 GLU HB3 A 136 LYS H 1.0 1.8 6.0 439 377 A 136 LYS H A 136 LYS HBx 1.0 1.8 4.5 440 378 A 133 ILE HD1% A 136 LYS H 1.0 1.8 6.5 441 379 A 136 LYS H A 136 LYS HGx 1.0 1.8 6.0 442 380 A 136 LYS H A 132 ALA HA 1.0 1.8 6.5 443 381 A 105 LEU H A 106 ALA HB% 1.0 1.8 6.5 444 382 A 104 THR H A 105 LEU H 1.0 1.8 6.0 445 383 A 105 LEU H A 106 ALA H 1.0 1.8 6.0 446 384 A 105 LEU H A 104 THR HB 1.0 1.8 6.0 447 385 A 105 LEU H A 105 LEU HBy 1.0 1.8 6.0 448 386 A 105 LEU H A 105 LEU HD1% 1.0 1.8 6.0 449 387 A 53 ARG H A 50 ALA HB% 1.0 1.8 6.0 450 388 A 53 ARG H A 52 SER HBy 1.0 1.8 6.5 451 389 A 53 ARG H A 53 ARG HBx 1.0 1.8 6.0 452 390 A 144 ASN H A 144 ASN HD2y 1.0 1.8 6.0 453 391 A 144 ASN H A 144 ASN HD2x 1.0 1.8 6.5 454 392 A 144 ASN H A 143 PRO HA 1.0 1.8 4.5 455 393 A 144 ASN H A 144 ASN HBy 1.0 1.8 6.0 456 394 A 144 ASN H A 144 ASN HBx 1.0 1.8 4.5 457 395 A 144 ASN H A 143 PRO HBx 1.0 1.8 6.0 458 396 A 84 LYS H A 83 GLU HGx 1.0 1.8 6.5 459 397 A 61 VAL H A 62 GLN H 1.0 1.8 6.0 460 398 A 62 GLN H A 58 ARG HA 1.0 1.8 6.5 461 399 A 60 ASP HBy A 62 GLN H 1.0 1.8 6.5 462 400 A 63 ALA HB% A 62 GLN H 1.0 1.8 6.0 463 401 A 62 GLN H A 59 LYS HA 1.0 1.8 6.0 464 402 A 62 GLN H A 62 GLN HB2 1.0 1.8 4.5 465 402 A 62 GLN H A 62 GLN HB3 1.0 1.8 4.5 466 403 A 106 ALA H A 105 LEU HBy 1.0 1.8 6.5 467 404 A 84 LYS H A 85 TYR HE% 1.0 1.8 6.5 468 405 A 84 LYS H A 83 GLU H 1.0 1.8 4.5 469 406 A 84 LYS H A 85 TYR H 1.0 1.8 4.5 470 407 A 84 LYS H A 83 GLU HB2 1.0 1.8 6.0 471 407 A 84 LYS H A 83 GLU HB3 1.0 1.8 6.0 472 408 A 84 LYS H A 84 LYS HBy 1.0 1.8 6.0 473 409 A 84 LYS H A 84 LYS HBx 1.0 1.8 6.0 474 410 A 84 LYS H A 84 LYS HGy 1.0 1.8 6.0 475 411 A 84 LYS H A 82 ARG HA 1.0 1.8 6.5 476 412 A 84 LYS H A 84 LYS HGx 1.0 1.8 6.0 477 413 A 60 ASP H A 62 GLN H 1.0 1.8 6.0 478 414 A 64 CYS HBy A 63 ALA H 1.0 1.8 6.5 479 415 A 63 ALA H A 64 CYS HBx 1.0 1.8 6.5 480 416 A 63 ALA H A 62 GLN HB2 1.0 1.8 6.0 481 416 A 62 GLN HB3 A 63 ALA H 1.0 1.8 6.0 482 417 A 61 VAL HG2% A 63 ALA H 1.0 1.8 6.5 483 418 A 61 VAL H A 63 ALA H 1.0 1.8 6.0 484 419 A 62 GLN H A 63 ALA H 1.0 1.8 4.5 485 420 A 63 ALA H A 64 CYS H 1.0 1.8 4.5 486 421 A 60 ASP H A 63 ALA H 1.0 1.8 6.5 487 422 A 63 ALA H A 59 LYS HD2 1.0 1.8 6.5 488 422 A 59 LYS HD3 A 63 ALA H 1.0 1.8 6.5 489 423 A 120 CYS H A 121 ASP H 1.0 1.8 6.0 490 424 A 64 CYS H A 65 ASP HA 1.0 1.8 6.5 491 425 A 65 ASP H A 64 CYS H 1.0 1.8 6.0 492 426 A 64 CYS HBy A 64 CYS H 1.0 1.8 6.0 493 427 A 64 CYS HBx A 64 CYS H 1.0 1.8 4.5 494 428 A 131 ASN H A 127 ASP HB2 1.0 1.8 6.5 495 428 A 127 ASP HB3 A 131 ASN H 1.0 1.8 6.5 496 429 A 127 ASP HA A 131 ASN H 1.0 1.8 6.0 497 430 A 78 ALA H A 79 LYS H 1.0 1.8 4.5 498 431 A 79 LYS H A 74 GLU HBy 1.0 1.8 6.0 499 432 A 79 LYS H A 79 LYS HB2 1.0 1.8 4.5 500 432 A 79 LYS H A 79 LYS HB3 1.0 1.8 4.5 501 433 A 79 LYS H A 79 LYS HD2 1.0 1.8 6.0 502 433 A 79 LYS H A 79 LYS HD3 1.0 1.8 6.0 503 434 A 81 ILE HD1% A 79 LYS H 1.0 1.8 6.5 504 435 A 81 ILE H A 79 LYS H 1.0 1.8 6.0 505 436 A 75 THR HG2% A 79 LYS H 1.0 1.8 6.5 506 437 A 112 ASP H A 114 ARG H 1.0 1.8 6.5 507 438 A 114 ARG H A 114 ARG HG2 1.0 1.8 6.0 508 438 A 114 ARG H A 114 ARG HG3 1.0 1.8 6.0 509 439 A 66 LYS H A 67 LYS HA 1.0 1.8 6.5 510 440 A 65 ASP H A 66 LYS H 1.0 1.8 4.5 511 441 A 66 LYS H A 64 CYS HA 1.0 1.8 6.0 512 442 A 66 LYS H A 66 LYS HE2 1.0 1.8 6.0 513 442 A 66 LYS H A 66 LYS HE3 1.0 1.8 6.0 514 443 A 65 ASP HBx A 66 LYS H 1.0 1.8 4.5 515 444 A 66 LYS H A 66 LYS HBx 1.0 1.8 4.5 516 445 A 66 LYS H A 66 LYS HGy 1.0 1.8 6.0 517 446 A 66 LYS H A 66 LYS HGx 1.0 1.8 6.0 518 447 A 75 THR HG2% A 66 LYS H 1.0 1.8 6.5 519 448 A 130 LEU H A 131 ASN H 1.0 1.8 6.0 520 449 A 132 ALA H A 131 ASN H 1.0 1.8 4.5 521 450 A 131 ASN HD2x A 131 ASN H 1.0 1.8 6.5 522 451 A 130 LEU HBy A 131 ASN H 1.0 1.8 6.0 523 452 A 130 LEU HBx A 131 ASN H 1.0 1.8 6.0 524 453 A 132 ALA HB% A 131 ASN H 1.0 1.8 6.5 525 454 A 131 ASN H A 134 LYS HD2 1.0 1.8 6.5 526 454 A 134 LYS HD3 A 131 ASN H 1.0 1.8 6.5 527 455 A 130 LEU HD2% A 131 ASN H 1.0 1.8 6.0 528 456 A 129 CYS H A 131 ASN H 1.0 1.8 6.0 529 457 A 125 GLU H A 124 TYR HE% 1.0 1.8 6.5 530 458 A 125 GLU H A 124 TYR HBy 1.0 1.8 6.0 531 459 A 125 GLU H A 124 TYR HBx 1.0 1.8 6.0 532 460 A 79 LYS H A 74 GLU HGx 1.0 1.8 6.5 533 461 A 111 VAL HA A 114 ARG H 1.0 1.8 6.0 534 462 A 114 ARG H A 113 CYS HBy 1.0 1.8 6.0 535 463 A 114 ARG H A 114 ARG HB2 1.0 1.8 6.0 536 463 A 114 ARG H A 114 ARG HB3 1.0 1.8 6.0 537 464 A 117 ALA H A 114 ARG H 1.0 1.8 6.5 538 465 A 116 ASP H A 114 ARG H 1.0 1.8 6.5 539 466 A 120 CYS H A 121 ASP HA 1.0 1.8 6.5 540 467 A 120 CYS H A 118 GLN HE2y 1.0 1.8 6.5 541 468 A 120 CYS H A 119 THR HB 1.0 1.8 6.0 542 469 A 120 CYS H A 118 GLN HA 1.0 1.8 6.0 543 470 A 120 CYS H A 120 CYS HBy 1.0 1.8 6.0 544 471 A 120 CYS H A 120 CYS HBx 1.0 1.8 6.0 545 472 A 120 CYS H A 118 GLN HB2 1.0 1.8 6.5 546 472 A 120 CYS H A 118 GLN HB3 1.0 1.8 6.5 547 473 A 120 CYS H A 119 THR HG2% 1.0 1.8 6.0 548 474 A 120 CYS H A 118 GLN HGx 1.0 1.8 6.5 549 475 A 51 GLY H A 55 LYS H 1.0 1.8 6.0 550 476 A 54 GLU H A 55 LYS H 1.0 1.8 6.0 551 477 A 56 ASP H A 55 LYS H 1.0 1.8 4.5 552 478 A 53 ARG HA A 55 LYS H 1.0 1.8 6.5 553 479 A 56 ASP HA A 55 LYS H 1.0 1.8 6.5 554 480 A 55 LYS H A 55 LYS HE2 1.0 1.8 6.5 555 480 A 55 LYS H A 55 LYS HE3 1.0 1.8 6.5 556 481 A 56 ASP HBx A 55 LYS H 1.0 1.8 6.0 557 482 A 54 GLU HBx A 55 LYS H 1.0 1.8 6.0 558 483 A 55 LYS H A 55 LYS HD2 1.0 1.8 6.5 559 483 A 55 LYS H A 55 LYS HD3 1.0 1.8 6.5 560 484 A 125 GLU H A 127 ASP H 1.0 1.8 6.0 561 485 A 69 ASP H A 71 GLN H 1.0 1.8 6.0 562 486 A 73 ARG H A 71 GLN H 1.0 1.8 6.0 563 487 A 71 GLN H A 70 ASP H 1.0 1.8 6.0 564 488 A 71 GLN H A 71 GLN HE2y 1.0 1.8 6.5 565 489 A 71 GLN H A 70 ASP HB2 1.0 1.8 6.0 566 489 A 71 GLN H A 70 ASP HB3 1.0 1.8 6.0 567 490 A 69 ASP HBx A 71 GLN H 1.0 1.8 6.5 568 491 A 71 GLN H A 71 GLN HBx 1.0 1.8 4.5 569 492 A 71 GLN H A 73 ARG HG2 1.0 1.8 6.0 570 492 A 73 ARG HG3 A 71 GLN H 1.0 1.8 6.0 571 493 A 69 ASP HBy A 71 GLN H 1.0 1.8 6.0 572 494 A 80 GLY H A 82 ARG H 1.0 1.8 6.5 573 495 A 82 ARG H A 82 ARG HGx 1.0 1.8 6.0 574 496 A 81 ILE HD1% A 82 ARG H 1.0 1.8 6.5 575 497 A 82 ARG H A 42 LEU HD2% 1.0 1.8 6.5 576 498 A 71 GLN H A 69 ASP HA 1.0 1.8 6.5 577 499 A 102 PHE H A 93 TYR H 1.0 1.8 6.5 578 500 A 102 PHE H A 103 CYS H 1.0 1.8 6.0 579 501 A 102 PHE H A 102 PHE HBx 1.0 1.8 6.0 580 502 A 102 PHE H A 100 LEU HD2% 1.0 1.8 6.5 581 503 A 102 PHE H A 102 PHE HBy 1.0 1.8 6.0 582 504 A 112 ASP HBx A 111 VAL H 1.0 1.8 6.5 583 505 A 110 GLU H A 111 VAL H 1.0 1.8 6.0 584 506 A 113 CYS H A 111 VAL H 1.0 1.8 6.5 585 507 A 112 ASP H A 111 VAL H 1.0 1.8 6.0 586 508 A 108 ILE HA A 111 VAL H 1.0 1.8 6.5 587 509 A 111 VAL H A 110 GLU HB2 1.0 1.8 6.0 588 509 A 110 GLU HB3 A 111 VAL H 1.0 1.8 6.0 589 510 A 111 VAL H A 108 ILE HG2% 1.0 1.8 6.5 590 511 A 69 ASP H A 70 ASP H 1.0 1.8 6.0 591 512 A 70 ASP H A 72 GLY H 1.0 1.8 6.0 592 513 A 70 ASP H A 71 GLN HG2 1.0 1.8 6.5 593 513 A 70 ASP H A 71 GLN HG3 1.0 1.8 6.5 594 514 A 75 THR HG2% A 70 ASP H 1.0 1.8 6.5 595 515 A 73 ARG H A 70 ASP H 1.0 1.8 6.0 596 516 A 69 ASP HBy A 70 ASP H 1.0 1.8 4.5 597 517 A 70 ASP H A 70 ASP HB2 1.0 1.8 4.5 598 517 A 70 ASP H A 70 ASP HB3 1.0 1.8 4.5 599 518 A 69 ASP HBx A 70 ASP H 1.0 1.8 6.0 600 519 A 70 ASP H A 71 GLN HBx 1.0 1.8 6.5 601 520 A 70 ASP H A 71 GLN HE2y 1.0 1.8 6.5 602 521 A 126 SER H A 122 LYS HA 1.0 1.8 6.5 603 522 A 126 SER H A 125 GLU HG2 1.0 1.8 6.5 604 522 A 125 GLU HG3 A 126 SER H 1.0 1.8 6.5 605 523 A 127 ASP H A 126 SER H 1.0 1.8 6.0 606 524 A 129 CYS HBy A 126 SER H 1.0 1.8 6.0 607 525 A 126 SER H A 123 LYS HGx 1.0 1.8 6.5 608 526 A 134 LYS H A 135 GLU H 1.0 1.8 6.0 609 527 A 132 ALA HA A 135 GLU H 1.0 1.8 6.0 610 528 A 133 ILE HB A 135 GLU H 1.0 1.8 6.5 611 529 A 132 ALA HB% A 135 GLU H 1.0 1.8 6.0 612 530 A 134 LYS HBy A 135 GLU H 1.0 1.8 6.0 613 531 A 135 GLU H A 134 LYS HD2 1.0 1.8 6.0 614 531 A 134 LYS HD3 A 135 GLU H 1.0 1.8 6.0 615 532 A 134 LYS HGy A 135 GLU H 1.0 1.8 6.5 616 533 A 135 GLU H A 134 LYS HGx 1.0 1.8 6.5 617 534 A 126 SER H A 124 TYR HBx 1.0 1.8 6.5 618 535 A 126 SER H A 128 LYS HE2 1.0 1.8 6.5 619 535 A 128 LYS HE3 A 126 SER H 1.0 1.8 6.5 620 536 A 125 GLU H A 126 SER H 1.0 1.8 6.0 621 537 A 126 SER H A 123 LYS HA 1.0 1.8 6.0 622 538 A 126 SER H A 123 LYS HBx 1.0 1.8 6.5 623 539 A 123 LYS HBy A 126 SER H 1.0 1.8 6.5 624 540 A 77 CYS H A 79 LYS H 1.0 1.8 6.5 625 541 A 93 TYR H A 94 ASP H 1.0 1.8 6.0 626 542 A 96 LYS H A 94 ASP H 1.0 1.8 6.0 627 543 A 93 TYR HD% A 94 ASP H 1.0 1.8 6.0 628 544 A 92 GLY HAx A 94 ASP H 1.0 1.8 6.0 629 545 A 94 ASP H A 95 GLY HAx 1.0 1.8 6.5 630 546 A 93 TYR HBx A 94 ASP H 1.0 1.8 6.0 631 547 A 94 ASP HBy A 94 ASP H 1.0 1.8 6.0 632 548 A 94 ASP H A 94 ASP HBx 1.0 1.8 6.0 633 549 A 93 TYR HE% A 94 ASP H 1.0 1.8 6.5 634 550 A 118 GLN H A 114 ARG HA 1.0 1.8 6.5 635 551 A 116 ASP H A 118 GLN H 1.0 1.8 6.0 636 552 A 118 GLN H A 117 ALA HB% 1.0 1.8 6.0 637 553 A 90 VAL HG1% A 118 GLN H 1.0 1.8 6.5 638 554 A 90 VAL HG2% A 118 GLN H 1.0 1.8 6.0 639 555 A 78 ALA H A 77 CYS H 1.0 1.8 6.0 640 556 A 77 CYS H A 75 THR HA 1.0 1.8 6.5 641 557 A 77 CYS H A 76 ALA HB% 1.0 1.8 6.0 642 558 A 75 THR HG2% A 77 CYS H 1.0 1.8 6.5 643 559 A 118 GLN H A 116 ASP HA 1.0 1.8 6.5 644 560 A 45 SER H A 44 ALA H 1.0 1.8 6.0 645 561 A 45 SER H A 43 ASP HA 1.0 1.8 6.5 646 562 A 45 SER H A 46 PHE HBy 1.0 1.8 6.5 647 563 A 45 SER H A 43 ASP HBy 1.0 1.8 6.0 648 564 A 45 SER H A 45 SER HB2 1.0 1.8 4.5 649 564 A 45 SER H A 45 SER HB3 1.0 1.8 4.5 650 565 A 45 SER H A 43 ASP HBx 1.0 1.8 6.5 651 566 A 45 SER H A 44 ALA HB% 1.0 1.8 6.0 652 567 A 81 ILE HG2% A 83 GLU H 1.0 1.8 6.5 653 568 A 83 GLU H A 82 ARG H 1.0 1.8 6.0 654 569 A 83 GLU H A 80 GLY HA2 1.0 1.8 6.0 655 569 A 83 GLU H A 80 GLY HA3 1.0 1.8 6.0 656 570 A 83 GLU H A 82 ARG HB2 1.0 1.8 6.0 657 570 A 83 GLU H A 82 ARG HB3 1.0 1.8 6.0 658 571 A 83 GLU H A 82 ARG HGx 1.0 1.8 6.5 659 572 A 75 THR H A 68 TYR HD% 1.0 1.8 6.0 660 573 A 137 TYR H A 137 TYR HBy 1.0 1.8 6.0 661 574 A 137 TYR H A 136 LYS HGx 1.0 1.8 6.5 662 575 A 137 TYR H A 134 LYS HA 1.0 1.8 6.0 663 576 A 137 TYR H A 137 TYR HBx 1.0 1.8 6.0 664 577 A 137 TYR H A 136 LYS HBy 1.0 1.8 6.0 665 578 A 137 TYR H A 133 ILE HG2% 1.0 1.8 6.5 666 579 A 75 THR H A 67 LYS HA 1.0 1.8 6.5 667 580 A 75 THR H A 74 GLU HGy 1.0 1.8 6.0 668 581 A 137 TYR H A 134 LYS H 1.0 1.8 6.5 669 582 A 137 TYR H A 135 GLU HG2 1.0 1.8 6.5 670 582 A 137 TYR H A 135 GLU HG3 1.0 1.8 6.5 671 583 A 137 TYR H A 135 GLU HB2 1.0 1.8 6.0 672 583 A 137 TYR H A 135 GLU HB3 1.0 1.8 6.0 673 584 A 75 THR H A 68 TYR HE% 1.0 1.8 6.5 674 585 A 75 THR H A 68 TYR H 1.0 1.8 6.5 675 586 A 34 GLN H A 33 THR H 1.0 1.8 6.0 676 587 A 35 TYR HD% A 33 THR H 1.0 1.8 6.5 677 588 A 35 TYR HE% A 33 THR H 1.0 1.8 6.5 678 589 A 33 THR H A 32 PRO HA 1.0 1.8 4.5 679 590 A 33 THR HB A 33 THR H 1.0 1.8 6.0 680 591 A 33 THR H A 32 PRO HBy 1.0 1.8 6.0 681 592 A 33 THR H A 32 PRO HG2 1.0 1.8 6.0 682 592 A 33 THR H A 32 PRO HG3 1.0 1.8 6.0 683 593 A 33 THR H A 32 PRO HBx 1.0 1.8 6.0 684 594 A 33 THR H A 33 THR HG2% 1.0 1.8 6.0 685 595 A 47 CYS H A 45 SER HA 1.0 1.8 6.5 686 596 A 68 TYR H A 67 LYS H 1.0 1.8 6.0 687 597 A 68 TYR HD% A 68 TYR H 1.0 1.8 6.0 688 598 A 68 TYR H A 69 ASP HA 1.0 1.8 6.5 689 599 A 68 TYR H A 66 LYS HGx 1.0 1.8 6.5 690 600 A 68 TYR H A 66 LYS HA 1.0 1.8 6.0 691 601 A 68 TYR H A 68 TYR HBy 1.0 1.8 6.0 692 602 A 68 TYR H A 67 LYS HGy 1.0 1.8 6.0 693 603 A 47 CYS H A 46 PHE HBy 1.0 1.8 6.5 694 604 A 47 CYS H A 46 PHE HBx 1.0 1.8 6.0 695 605 A 45 SER H A 47 CYS H 1.0 1.8 6.5 696 606 A 85 TYR H A 86 LYS HB2 1.0 1.8 6.0 697 606 A 85 TYR H A 86 LYS HB3 1.0 1.8 6.0 698 607 A 83 GLU H A 85 TYR H 1.0 1.8 6.5 699 608 A 85 TYR H A 83 GLU HA 1.0 1.8 6.5 700 609 A 85 TYR H A 85 TYR HBy 1.0 1.8 6.0 701 610 A 85 TYR HD% A 85 TYR H 1.0 1.8 6.0 702 611 A 85 TYR H A 82 ARG HA 1.0 1.8 6.5 703 612 A 85 TYR H A 85 TYR HBx 1.0 1.8 6.0 704 613 A 85 TYR H A 84 LYS HBx 1.0 1.8 6.0 705 614 A 81 ILE HG2% A 85 TYR H 1.0 1.8 6.0 706 615 A 85 TYR H A 84 LYS HGx 1.0 1.8 6.5 707 616 A 71 GLN HE2y A 71 GLN HG2 1.0 1.8 6.0 708 616 A 71 GLN HE2y A 71 GLN HG3 1.0 1.8 6.0 709 617 A 71 GLN HE2x A 71 GLN H 1.0 1.8 6.0 710 618 A 131 ASN H A 131 ASN HD2y 1.0 1.8 6.5 711 619 A 128 LYS H A 131 ASN HD2y 1.0 1.8 6.5 712 620 A 131 ASN HA A 131 ASN HD2y 1.0 1.8 6.5 713 621 A 128 LYS HA A 131 ASN HD2y 1.0 1.8 6.0 714 622 A 131 ASN HD2y A 127 ASP HB2 1.0 1.8 6.5 715 622 A 127 ASP HB3 A 131 ASN HD2y 1.0 1.8 6.5 716 623 A 131 ASN HD2x A 131 ASN HA 1.0 1.8 6.5 717 624 A 131 ASN HD2x A 127 ASP HB2 1.0 1.8 6.5 718 624 A 131 ASN HD2x A 127 ASP HB3 1.0 1.8 6.5 719 625 A 62 GLN HE2y A 62 GLN HB2 1.0 1.8 6.5 720 625 A 62 GLN HB3 A 62 GLN HE2y 1.0 1.8 6.5 721 626 A 118 GLN HE2y A 119 THR HA 1.0 1.8 6.5 722 627 A 62 GLN HE2x A 62 GLN HB2 1.0 1.8 6.5 723 627 A 62 GLN HB3 A 62 GLN HE2x 1.0 1.8 6.5 724 628 A 119 THR HA A 118 GLN HE2x 1.0 1.8 6.5 725 629 A 118 GLN HE2y A 118 GLN HB2 1.0 1.8 6.5 726 629 A 118 GLN HE2y A 118 GLN HB3 1.0 1.8 6.5 727 630 A 90 VAL HG2% A 118 GLN HE2y 1.0 1.8 6.5 728 631 A 62 GLN H A 62 GLN HE2x 1.0 1.8 6.0 729 632 A 90 VAL HG1% A 118 GLN HE2x 1.0 1.8 6.5 730 633 A 100 LEU H A 101 GLY H 1.0 1.8 4.5 731 634 A 102 PHE H A 101 GLY H 1.0 1.8 6.0 732 635 A 101 GLY H A 99 ASP HA 1.0 1.8 6.0 733 636 A 100 LEU HD1% A 101 GLY H 1.0 1.8 6.5 734 637 A 51 GLY H A 50 ALA H 1.0 1.8 4.5 735 638 A 51 GLY H A 49 THR H 1.0 1.8 6.0 736 639 A 51 GLY H A 54 GLU HBy 1.0 1.8 6.5 737 640 A 51 GLY H A 54 GLU HBx 1.0 1.8 6.5 738 641 A 51 GLY H A 50 ALA HB% 1.0 1.8 6.0 739 642 A 51 GLY H A 53 ARG H 1.0 1.8 6.0 740 643 A 99 ASP HBy A 101 GLY H 1.0 1.8 6.5 741 644 A 100 LEU HD2% A 101 GLY H 1.0 1.8 6.5 742 645 A 117 ALA H A 119 THR H 1.0 1.8 6.0 743 646 A 116 ASP HA A 119 THR H 1.0 1.8 6.5 744 647 A 120 CYS HBx A 119 THR H 1.0 1.8 6.5 745 648 A 118 GLN HGx A 119 THR H 1.0 1.8 6.5 746 649 A 119 THR H A 118 GLN HGy 1.0 1.8 6.5 747 650 A 119 THR H A 118 GLN HB2 1.0 1.8 6.0 748 650 A 118 GLN HB3 A 119 THR H 1.0 1.8 6.0 749 651 A 119 THR H A 115 LYS HB2 1.0 1.8 6.5 750 651 A 115 LYS HB3 A 119 THR H 1.0 1.8 6.5 751 652 A 119 THR HG2% A 119 THR H 1.0 1.8 4.5 752 653 A 110 GLU H A 107 GLY H 1.0 1.8 6.5 753 654 A 37 TYR H A 36 GLY H 1.0 1.8 6.0 754 655 A 37 TYR HE% A 36 GLY H 1.0 1.8 6.5 755 656 A 35 TYR HD% A 36 GLY H 1.0 1.8 6.0 756 657 A 35 TYR HBy A 36 GLY H 1.0 1.8 6.0 757 658 A 106 ALA H A 107 GLY H 1.0 1.8 6.0 758 659 A 106 ALA HB% A 107 GLY H 1.0 1.8 6.5 759 660 A 69 ASP H A 72 GLY H 1.0 1.8 6.0 760 661 A 73 ARG H A 72 GLY H 1.0 1.8 4.5 761 662 A 71 GLN H A 72 GLY H 1.0 1.8 4.5 762 663 A 68 TYR HD% A 72 GLY H 1.0 1.8 6.5 763 664 A 72 GLY H A 71 GLN HA 1.0 1.8 6.0 764 665 A 71 GLN HBy A 72 GLY H 1.0 1.8 6.0 765 666 A 71 GLN HBx A 72 GLY H 1.0 1.8 6.0 766 667 A 72 GLY H A 73 ARG HG2 1.0 1.8 6.0 767 667 A 73 ARG HG3 A 72 GLY H 1.0 1.8 6.0 768 668 A 72 GLY H A 70 ASP HB2 1.0 1.8 6.0 769 668 A 70 ASP HB3 A 72 GLY H 1.0 1.8 6.0 770 669 A 68 TYR HBy A 72 GLY H 1.0 1.8 6.0 771 670 A 35 TYR HBx A 39 GLY H 1.0 1.8 6.5 772 671 A 38 ASP H A 39 GLY H 1.0 1.8 4.5 773 672 A 37 TYR H A 39 GLY H 1.0 1.8 6.0 774 673 A 40 LYS H A 39 GLY H 1.0 1.8 4.5 775 674 A 38 ASP HA A 39 GLY H 1.0 1.8 4.5 776 675 A 39 GLY H A 38 ASP HBx 1.0 1.8 6.0 777 676 A 39 GLY H A 40 LYS HG2 1.0 1.8 6.5 778 676 A 40 LYS HG3 A 39 GLY H 1.0 1.8 6.5 779 677 A 93 TYR H A 95 GLY H 1.0 1.8 6.0 780 678 A 95 GLY H A 93 TYR HA 1.0 1.8 6.5 781 679 A 95 GLY H A 94 ASP HBy 1.0 1.8 6.0 782 680 A 95 GLY H A 91 TYR HB2 1.0 1.8 6.0 783 680 A 95 GLY H A 91 TYR HB3 1.0 1.8 6.0 784 681 A 95 GLY H A 96 LYS HB2 1.0 1.8 6.0 785 681 A 95 GLY H A 96 LYS HB3 1.0 1.8 6.0 786 682 A 95 GLY H A 96 LYS HG2 1.0 1.8 6.5 787 682 A 95 GLY H A 96 LYS HG3 1.0 1.8 6.5 788 683 A 91 TYR HD% A 95 GLY H 1.0 1.8 6.5 789 684 A 95 GLY H A 94 ASP HBx 1.0 1.8 6.5 790 685 A 92 GLY H A 95 GLY H 1.0 1.8 6.0 791 686 A 91 TYR HD% A 92 GLY H 1.0 1.8 6.0 792 687 A 92 GLY H A 91 TYR HB2 1.0 1.8 6.0 793 687 A 92 GLY H A 91 TYR HB3 1.0 1.8 6.0 794 688 A 98 LEU HD1% A 92 GLY H 1.0 1.8 6.0 795 689 A 92 GLY H A 96 LYS H 1.0 1.8 6.0 796 690 A 50 ALA H A 49 THR H 1.0 1.8 6.0 797 691 A 49 THR H A 48 ARG HB2 1.0 1.8 6.0 798 691 A 49 THR H A 48 ARG HB3 1.0 1.8 6.0 799 692 A 49 THR H A 50 ALA HB% 1.0 1.8 6.5 800 693 A 49 THR H A 48 ARG HG2 1.0 1.8 6.5 801 693 A 49 THR H A 48 ARG HG3 1.0 1.8 6.5 802 694 A 80 GLY H A 82 ARG HD2 1.0 1.8 6.5 803 694 A 80 GLY H A 82 ARG HD3 1.0 1.8 6.5 804 695 A 80 GLY H A 77 CYS H 1.0 1.8 6.5 805 696 A 80 GLY H A 80 GLY HA2 1.0 1.8 4.5 806 696 A 80 GLY H A 80 GLY HA3 1.0 1.8 4.5 807 697 A 80 GLY H A 79 LYS H 1.0 1.8 4.5 808 698 A 80 GLY H A 83 GLU H 1.0 1.8 6.5 809 699 A 78 ALA H A 80 GLY H 1.0 1.8 6.0 810 700 A 80 GLY H A 81 ILE HG1y 1.0 1.8 6.5 811 701 A 80 GLY H A 79 LYS HGy 1.0 1.8 6.0 812 702 A 76 ALA H A 75 THR HB 1.0 1.8 6.0 813 703 A 76 ALA HB% A 75 THR HB 1.0 1.8 6.0 814 704 A 119 THR HB A 119 THR H 1.0 1.8 6.0 815 705 A 104 THR H A 104 THR HB 1.0 1.8 4.5 816 706 A 104 THR HB A 105 LEU HD2% 1.0 1.8 6.0 817 707 A 60 ASP HBy A 61 VAL HA 1.0 1.8 6.5 818 708 A 61 VAL HG1% A 61 VAL HA 1.0 1.8 4.5 819 709 A 111 VAL HA A 111 VAL HG2% 1.0 1.8 4.5 820 710 A 111 VAL HA A 113 CYS H 1.0 1.8 6.0 821 711 A 104 THR HA A 110 GLU HG2 1.0 1.8 6.0 822 711 A 110 GLU HG3 A 104 THR HA 1.0 1.8 6.0 823 712 A 104 THR HA A 110 GLU HB2 1.0 1.8 6.0 824 712 A 110 GLU HB3 A 104 THR HA 1.0 1.8 6.0 825 713 A 85 TYR HD% A 81 ILE HA 1.0 1.8 6.0 826 714 A 81 ILE HD1% A 81 ILE HA 1.0 1.8 6.0 827 715 A 84 LYS H A 81 ILE HA 1.0 1.8 6.0 828 716 A 119 THR HG2% A 119 THR HA 1.0 1.8 4.5 829 717 A 133 ILE HG2% A 133 ILE HA 1.0 1.8 6.0 830 718 A 133 ILE HA A 133 ILE HG1x 1.0 1.8 6.0 831 719 A 140 VAL H A 139 PRO HA 1.0 1.8 3.0 832 720 A 146 PRO HA A 147 ALA H 1.0 1.8 4.5 833 721 A 88 ALA H A 87 PRO HA 1.0 1.8 4.5 834 722 A 89 VAL HG2% A 87 PRO HA 1.0 1.8 6.0 835 723 A 108 ILE HA A 108 ILE HD1% 1.0 1.8 6.0 836 724 A 52 SER HBx A 53 ARG HD2 1.0 1.8 6.0 837 724 A 53 ARG HD3 A 52 SER HBx 1.0 1.8 6.0 838 725 A 123 LYS HGx A 52 SER HBx 1.0 1.8 6.0 839 726 A 45 SER HB2 A 48 ARG HD2 1.0 1.8 6.0 840 726 A 45 SER HB3 A 48 ARG HD2 1.0 1.8 6.0 841 726 A 48 ARG HD3 A 45 SER HB2 1.0 1.8 6.0 842 726 A 45 SER HB3 A 48 ARG HD3 1.0 1.8 6.0 843 727 A 129 CYS HBy A 126 SER HA 1.0 1.8 6.0 844 728 A 35 TYR HD% A 35 TYR HA 1.0 1.8 6.5 845 729 A 35 TYR HD% A 38 ASP HA 1.0 1.8 6.0 846 730 A 140 VAL HA A 140 VAL HG2% 1.0 1.8 4.5 847 731 A 28 VAL HA A 28 VAL HG1% 1.0 1.8 4.5 848 731 A 28 VAL HA A 28 VAL HG2% 1.0 1.8 4.5 849 732 A 33 THR HA A 33 THR HG2% 1.0 1.8 4.5 850 733 A 90 VAL H A 89 VAL HA 1.0 1.8 4.5 851 734 A 145 PRO HA A 146 PRO HDy 1.0 1.8 4.5 852 735 A 31 PRO HA A 32 PRO HDx 1.0 1.8 4.5 853 736 A 51 GLY H A 49 THR HA 1.0 1.8 6.0 854 737 A 45 SER HA A 48 ARG HG2 1.0 1.8 6.0 855 737 A 48 ARG HG3 A 45 SER HA 1.0 1.8 6.0 856 738 A 141 VAL HA A 141 VAL HG1% 1.0 1.8 4.5 857 738 A 141 VAL HG2% A 141 VAL HA 1.0 1.8 4.5 858 739 A 145 PRO HA A 146 PRO HDx 1.0 1.8 6.0 859 740 A 45 SER HA A 48 ARG HD2 1.0 1.8 6.0 860 740 A 45 SER HA A 48 ARG HD3 1.0 1.8 6.0 861 741 A 90 VAL HA A 91 TYR HB2 1.0 1.8 6.0 862 741 A 90 VAL HA A 91 TYR HB3 1.0 1.8 6.0 863 742 A 90 VAL HG2% A 90 VAL HA 1.0 1.8 6.0 864 743 A 57 CYS HBx A 54 GLU HA 1.0 1.8 6.0 865 744 A 93 TYR HD% A 93 TYR HA 1.0 1.8 6.0 866 745 A 54 GLU HA A 58 ARG H 1.0 1.8 6.0 867 746 A 110 GLU HA A 113 CYS HBy 1.0 1.8 4.5 868 747 A 69 ASP H A 75 THR HA 1.0 1.8 6.0 869 748 A 76 ALA H A 75 THR HA 1.0 1.8 4.5 870 749 A 78 ALA H A 75 THR HA 1.0 1.8 6.0 871 750 A 61 VAL H A 58 ARG HA 1.0 1.8 6.0 872 751 A 114 ARG HA A 117 ALA HB% 1.0 1.8 6.0 873 752 A 114 ARG HA A 114 ARG HG2 1.0 1.8 6.0 874 752 A 114 ARG HA A 114 ARG HG3 1.0 1.8 6.0 875 753 A 134 LYS HGy A 134 LYS HA 1.0 1.8 6.0 876 754 A 134 LYS HA A 136 LYS HBx 1.0 1.8 6.5 877 755 A 124 TYR HA A 123 LYS HE2 1.0 1.8 6.5 878 755 A 124 TYR HA A 123 LYS HE3 1.0 1.8 6.5 879 756 A 124 TYR HA A 125 GLU HB2 1.0 1.8 6.5 880 756 A 124 TYR HA A 125 GLU HB3 1.0 1.8 6.5 881 757 A 79 LYS HA A 79 LYS HB2 1.0 1.8 4.5 882 757 A 79 LYS HB3 A 79 LYS HA 1.0 1.8 4.5 883 758 A 60 ASP H A 57 CYS HA 1.0 1.8 6.0 884 759 A 134 LYS HA A 134 LYS HGx 1.0 1.8 6.0 885 760 A 110 GLU HA A 113 CYS HA 1.0 1.8 6.0 886 761 A 132 ALA H A 129 CYS HA 1.0 1.8 6.0 887 762 A 82 ARG HA A 82 ARG HGy 1.0 1.8 6.0 888 763 A 81 ILE HG2% A 82 ARG HA 1.0 1.8 6.0 889 764 A 79 LYS HA A 79 LYS HGx 1.0 1.8 6.0 890 765 A 79 LYS HGy A 79 LYS HA 1.0 1.8 6.0 891 766 A 79 LYS HA A 82 ARG HGy 1.0 1.8 6.0 892 767 A 117 ALA H A 115 LYS HA 1.0 1.8 6.0 893 768 A 59 LYS HA A 63 ALA H 1.0 1.8 6.0 894 769 A 59 LYS HA A 62 GLN HB2 1.0 1.8 4.5 895 769 A 59 LYS HA A 62 GLN HB3 1.0 1.8 4.5 896 770 A 59 LYS HA A 59 LYS HB2 1.0 1.8 3.0 897 770 A 59 LYS HB3 A 59 LYS HA 1.0 1.8 3.0 898 771 A 59 LYS HA A 59 LYS HD2 1.0 1.8 6.0 899 771 A 59 LYS HD3 A 59 LYS HA 1.0 1.8 6.0 900 772 A 115 LYS HA A 115 LYS HGy 1.0 1.8 6.0 901 773 A 115 LYS HGx A 115 LYS HA 1.0 1.8 4.5 902 774 A 128 LYS HA A 128 LYS HB2 1.0 1.8 4.5 903 774 A 128 LYS HB3 A 128 LYS HA 1.0 1.8 4.5 904 775 A 130 LEU H A 128 LYS HA 1.0 1.8 6.0 905 776 A 131 ASN HD2x A 128 LYS HA 1.0 1.8 6.0 906 777 A 128 LYS HA A 131 ASN H 1.0 1.8 6.0 907 778 A 83 GLU H A 79 LYS HA 1.0 1.8 6.0 908 779 A 116 ASP H A 113 CYS HA 1.0 1.8 6.0 909 780 A 105 LEU HD1% A 102 PHE HA 1.0 1.8 6.0 910 781 A 48 ARG HA A 48 ARG HG2 1.0 1.8 4.5 911 781 A 48 ARG HA A 48 ARG HG3 1.0 1.8 4.5 912 782 A 48 ARG HA A 48 ARG HD2 1.0 1.8 6.0 913 782 A 48 ARG HA A 48 ARG HD3 1.0 1.8 6.0 914 783 A 84 LYS HGx A 84 LYS HA 1.0 1.8 6.0 915 784 A 118 GLN HA A 118 GLN HB2 1.0 1.8 4.5 916 784 A 118 GLN HA A 118 GLN HB3 1.0 1.8 4.5 917 785 A 135 GLU HA A 138 LYS HE2 1.0 1.8 6.0 918 785 A 138 LYS HE3 A 135 GLU HA 1.0 1.8 6.0 919 786 A 136 LYS HGx A 136 LYS HA 1.0 1.8 6.0 920 787 A 136 LYS HA A 136 LYS HGy 1.0 1.8 6.0 921 788 A 38 ASP H A 37 TYR HA 1.0 1.8 4.5 922 789 A 37 TYR HD% A 37 TYR HA 1.0 1.8 6.0 923 790 A 37 TYR HBy A 37 TYR HA 1.0 1.8 4.5 924 791 A 86 LYS H A 83 GLU HA 1.0 1.8 6.0 925 792 A 83 GLU HGx A 83 GLU HA 1.0 1.8 4.5 926 793 A 117 ALA HB% A 118 GLN HA 1.0 1.8 6.0 927 794 A 83 GLU HA A 83 GLU HB2 1.0 1.8 4.5 928 794 A 83 GLU HB3 A 83 GLU HA 1.0 1.8 4.5 929 795 A 83 GLU HA A 86 LYS HE2 1.0 1.8 6.0 930 795 A 83 GLU HA A 86 LYS HE3 1.0 1.8 6.0 931 796 A 62 GLN HA A 62 GLN HB2 1.0 1.8 4.5 932 796 A 62 GLN HB3 A 62 GLN HA 1.0 1.8 4.5 933 797 A 35 TYR HA A 36 GLY HA2 1.0 1.8 6.0 934 797 A 36 GLY HA3 A 35 TYR HA 1.0 1.8 6.0 935 798 A 80 GLY H A 77 CYS HA 1.0 1.8 6.0 936 799 A 77 CYS HA A 80 GLY HA2 1.0 1.8 6.0 937 799 A 77 CYS HA A 80 GLY HA3 1.0 1.8 6.0 938 800 A 63 ALA H A 60 ASP HA 1.0 1.8 6.0 939 801 A 78 ALA HB% A 67 LYS HA 1.0 1.8 6.0 940 802 A 77 CYS HA A 77 CYS HBx 1.0 1.8 4.5 941 803 A 127 ASP HA A 131 ASN HD2y 1.0 1.8 6.0 942 804 A 133 ILE HD1% A 130 LEU HA 1.0 1.8 6.0 943 805 A 84 LYS HA A 85 TYR HA 1.0 1.8 6.0 944 806 A 119 THR HG2% A 116 ASP HA 1.0 1.8 6.0 945 807 A 69 ASP H A 74 GLU HA 1.0 1.8 6.0 946 808 A 75 THR H A 74 GLU HA 1.0 1.8 4.5 947 809 A 78 ALA HB% A 74 GLU HA 1.0 1.8 6.0 948 810 A 62 GLN H A 60 ASP HA 1.0 1.8 6.0 949 811 A 127 ASP HA A 130 LEU HBy 1.0 1.8 6.0 950 812 A 127 ASP HA A 130 LEU HD2% 1.0 1.8 6.0 951 813 A 127 ASP HA A 127 ASP HB2 1.0 1.8 4.5 952 813 A 127 ASP HA A 127 ASP HB3 1.0 1.8 4.5 953 814 A 127 ASP HA A 130 LEU HBx 1.0 1.8 6.0 954 815 A 112 ASP HBy A 112 ASP HA 1.0 1.8 4.5 955 816 A 112 ASP HA A 115 LYS HD2 1.0 1.8 6.0 956 816 A 112 ASP HA A 115 LYS HD3 1.0 1.8 6.0 957 817 A 56 ASP HA A 59 LYS HB2 1.0 1.8 4.5 958 817 A 59 LYS HB3 A 56 ASP HA 1.0 1.8 4.5 959 818 A 133 ILE H A 130 LEU HA 1.0 1.8 6.0 960 819 A 130 LEU HA A 133 ILE HB 1.0 1.8 6.0 961 820 A 130 LEU HA A 133 ILE HG2% 1.0 1.8 6.0 962 821 A 130 LEU HD2% A 130 LEU HA 1.0 1.8 6.0 963 822 A 30 ASP H A 29 PHE HA 1.0 1.8 4.5 964 823 A 75 THR HG2% A 74 GLU HA 1.0 1.8 6.0 965 824 A 65 ASP HBx A 65 ASP HA 1.0 1.8 3.0 966 825 A 71 GLN HE2x A 70 ASP HA 1.0 1.8 6.0 967 826 A 70 ASP HA A 70 ASP HB2 1.0 1.8 3.0 968 826 A 70 ASP HB3 A 70 ASP HA 1.0 1.8 3.0 969 827 A 131 ASN HA A 134 LYS HD2 1.0 1.8 4.5 970 827 A 131 ASN HA A 134 LYS HD3 1.0 1.8 4.5 971 828 A 131 ASN HA A 134 LYS HGy 1.0 1.8 6.0 972 829 A 131 ASN HA A 134 LYS HGx 1.0 1.8 6.0 973 830 A 68 TYR HA A 73 ARG H 1.0 1.8 6.0 974 831 A 68 TYR HA A 74 GLU HA 1.0 1.8 6.0 975 832 A 75 THR H A 68 TYR HA 1.0 1.8 6.0 976 833 A 125 GLU HA A 125 GLU HG2 1.0 1.8 6.0 977 833 A 125 GLU HA A 125 GLU HG3 1.0 1.8 6.0 978 834 A 35 TYR HD% A 34 GLN HA 1.0 1.8 6.0 979 835 A 53 ARG HA A 53 ARG HGx 1.0 1.8 6.0 980 836 A 105 LEU HBy A 105 LEU HA 1.0 1.8 4.5 981 837 A 125 GLU HA A 128 LYS HE2 1.0 1.8 6.0 982 837 A 128 LYS HE3 A 125 GLU HA 1.0 1.8 6.0 983 838 A 35 TYR H A 34 GLN HA 1.0 1.8 4.5 984 839 A 76 ALA HA A 79 LYS HB2 1.0 1.8 4.5 985 839 A 79 LYS HB3 A 76 ALA HA 1.0 1.8 4.5 986 840 A 79 LYS H A 76 ALA HA 1.0 1.8 6.0 987 841 A 80 GLY H A 76 ALA HA 1.0 1.8 6.0 988 842 A 42 LEU HA A 67 LYS HDx 1.0 1.8 6.0 989 842 A 42 LEU HA A 67 LYS HDy 1.0 1.8 6.0 990 843 A 81 ILE H A 78 ALA HA 1.0 1.8 6.0 991 844 A 81 ILE HD1% A 78 ALA HA 1.0 1.8 6.0 992 845 A 81 ILE HB A 78 ALA HA 1.0 1.8 6.0 993 846 A 78 ALA HA A 42 LEU HD2% 1.0 1.8 6.0 994 846 A 78 ALA HA A 42 LEU HD1% 1.0 1.8 6.0 995 847 A 86 LYS HGx A 86 LYS HA 1.0 1.8 6.0 996 848 A 138 LYS HA A 139 PRO HDy 1.0 1.8 4.5 997 849 A 73 ARG HA A 73 ARG HDx 1.0 1.8 6.5 998 850 A 71 GLN HA A 71 GLN HG2 1.0 1.8 3.0 999 850 A 71 GLN HG3 A 71 GLN HA 1.0 1.8 3.0 1000 851 A 105 LEU HD1% A 105 LEU HA 1.0 1.8 6.0 1001 852 A 43 ASP H A 42 LEU HA 1.0 1.8 4.5 1002 853 A 43 ASP HBx A 42 LEU HA 1.0 1.8 6.0 1003 854 A 42 LEU HA A 42 LEU HD2% 1.0 1.8 6.0 1004 854 A 42 LEU HA A 42 LEU HD1% 1.0 1.8 6.0 1005 855 A 47 CYS H A 44 ALA HA 1.0 1.8 6.0 1006 856 A 138 LYS HA A 138 LYS HB2 1.0 1.8 4.5 1007 856 A 138 LYS HB3 A 138 LYS HA 1.0 1.8 4.5 1008 857 A 132 ALA HA A 135 GLU HB2 1.0 1.8 4.5 1009 857 A 135 GLU HB3 A 132 ALA HA 1.0 1.8 4.5 1010 858 A 133 ILE HD1% A 117 ALA HA 1.0 1.8 6.0 1011 859 A 61 VAL HG1% A 44 ALA HA 1.0 1.8 6.0 1012 860 A 61 VAL HB A 44 ALA HA 1.0 1.8 6.0 1013 861 A 46 PHE H A 44 ALA HA 1.0 1.8 6.0 1014 862 A 43 ASP HBy A 44 ALA HA 1.0 1.8 6.0 1015 863 A 91 TYR HE% A 96 LYS HA 1.0 1.8 4.5 1016 864 A 136 LYS HGx A 132 ALA HA 1.0 1.8 6.0 1017 865 A 28 VAL H A 27 ASP HA 1.0 1.8 4.5 1018 866 A 40 LYS HA A 41 PRO HDx 1.0 1.8 4.5 1019 867 A 38 ASP HA A 37 TYR HD% 1.0 1.8 6.0 1020 868 A 38 ASP HA A 38 ASP HBy 1.0 1.8 4.5 1021 868 A 38 ASP HA A 38 ASP HBx 1.0 1.8 4.5 1022 869 A 100 LEU H A 99 ASP HA 1.0 1.8 4.5 1023 870 A 35 TYR HBx A 40 LYS HA 1.0 1.8 6.0 1024 871 A 37 TYR HE% A 40 LYS HA 1.0 1.8 6.0 1025 872 A 40 LYS HA A 41 PRO HDy 1.0 1.8 4.5 1026 873 A 40 LYS HA A 40 LYS HG2 1.0 1.8 6.0 1027 873 A 40 LYS HG3 A 40 LYS HA 1.0 1.8 6.0 1028 874 A 98 LEU HD1% A 98 LEU HA 1.0 1.8 6.0 1029 875 A 95 GLY HAx A 94 ASP HA 1.0 1.8 6.0 1030 876 A 43 ASP HA A 44 ALA HA 1.0 1.8 6.0 1031 877 A 30 ASP HA A 31 PRO HDx 1.0 1.8 3.0 1032 877 A 30 ASP HA A 31 PRO HDy 1.0 1.8 3.0 1033 878 A 89 VAL H A 88 ALA HA 1.0 1.8 4.5 1034 879 A 65 ASP H A 64 CYS HA 1.0 1.8 4.5 1035 880 A 81 ILE HD1% A 64 CYS HA 1.0 1.8 6.5 1036 881 A 142 ASP HA A 143 PRO HD2 1.0 1.8 4.5 1037 881 A 143 PRO HD3 A 142 ASP HA 1.0 1.8 4.5 1038 882 A 75 THR HG2% A 69 ASP HA 1.0 1.8 6.0 1039 883 A 139 PRO HDy A 138 LYS HB2 1.0 1.8 6.0 1040 883 A 138 LYS HB3 A 139 PRO HDy 1.0 1.8 6.0 1041 884 A 139 PRO HDy A 140 VAL HG1% 1.0 1.8 6.5 1042 885 A 139 PRO HDy A 138 LYS HG2 1.0 1.8 6.0 1043 885 A 139 PRO HDy A 138 LYS HG3 1.0 1.8 6.0 1044 886 A 142 ASP HBy A 143 PRO HD2 1.0 1.8 6.0 1045 886 A 143 PRO HD3 A 142 ASP HBy 1.0 1.8 6.0 1046 887 A 31 PRO HA A 32 PRO HDy 1.0 1.8 3.0 1047 888 A 32 PRO HDy A 31 PRO HBx 1.0 1.8 4.5 1048 889 A 41 PRO HDy A 40 LYS HG2 1.0 1.8 6.0 1049 889 A 40 LYS HG3 A 41 PRO HDy 1.0 1.8 6.0 1050 890 A 40 LYS H A 41 PRO HDy 1.0 1.8 6.0 1051 891 A 138 LYS HA A 139 PRO HDx 1.0 1.8 4.5 1052 892 A 40 LYS H A 41 PRO HDx 1.0 1.8 6.0 1053 893 A 41 PRO HDx A 40 LYS HG2 1.0 1.8 6.0 1054 893 A 40 LYS HG3 A 41 PRO HDx 1.0 1.8 6.0 1055 894 A 144 ASN HA A 145 PRO HDy 1.0 1.8 6.0 1056 895 A 144 ASN H A 145 PRO HDx 1.0 1.8 6.0 1057 896 A 93 TYR H A 101 GLY HAy 1.0 1.8 6.0 1058 897 A 101 GLY HAx A 93 TYR H 1.0 1.8 6.0 1059 898 A 37 TYR HE% A 41 PRO HDx 1.0 1.8 6.5 1060 899 A 108 ILE HG2% A 107 GLY HAy 1.0 1.8 6.5 1061 900 A 106 ALA HB% A 107 GLY HAy 1.0 1.8 6.5 1062 901 A 106 ALA HB% A 107 GLY HAx 1.0 1.8 6.0 1063 902 A 54 GLU H A 51 GLY HAx 1.0 1.8 6.5 1064 903 A 137 TYR HA A 137 TYR HE% 1.0 1.8 6.0 1065 904 A 51 GLY HAx A 50 ALA HB% 1.0 1.8 6.5 1066 905 A 71 GLN HA A 72 GLY HAy 1.0 1.8 6.0 1067 906 A 68 TYR HD% A 72 GLY HAy 1.0 1.8 6.0 1068 907 A 68 TYR HD% A 72 GLY HAx 1.0 1.8 6.0 1069 908 A 91 TYR HD% A 95 GLY HAy 1.0 1.8 6.0 1070 909 A 39 GLY HAx A 38 ASP HA 1.0 1.8 6.0 1071 910 A 72 GLY HAx A 68 TYR HBy 1.0 1.8 6.0 1072 911 A 35 TYR HD% A 36 GLY HA2 1.0 1.8 6.0 1073 911 A 35 TYR HD% A 36 GLY HA3 1.0 1.8 6.0 1074 912 A 37 TYR HBx A 36 GLY HA2 1.0 1.8 6.0 1075 912 A 36 GLY HA3 A 37 TYR HBx 1.0 1.8 6.0 1076 913 A 40 LYS HE3 A 39 GLY HAy 1.0 1.8 6.0 1077 913 A 39 GLY HAy A 40 LYS HE2 1.0 1.8 6.0 1078 914 A 40 LYS HD3 A 39 GLY HAy 1.0 1.8 6.0 1079 914 A 39 GLY HAy A 40 LYS HD2 1.0 1.8 6.0 1080 915 A 35 TYR HD% A 39 GLY HAx 1.0 1.8 6.0 1081 916 A 98 LEU HD1% A 92 GLY HAx 1.0 1.8 6.0 1082 917 A 53 ARG H A 53 ARG HD2 1.0 1.8 6.0 1083 917 A 53 ARG H A 53 ARG HD3 1.0 1.8 6.0 1084 918 A 85 TYR HD% A 53 ARG HD2 1.0 1.8 6.0 1085 918 A 85 TYR HD% A 53 ARG HD3 1.0 1.8 6.0 1086 919 A 85 TYR HE% A 53 ARG HD2 1.0 1.8 6.0 1087 919 A 85 TYR HE% A 53 ARG HD3 1.0 1.8 6.0 1088 920 A 53 ARG HA A 53 ARG HD2 1.0 1.8 6.0 1089 920 A 53 ARG HA A 53 ARG HD3 1.0 1.8 6.0 1090 921 A 53 ARG HBy A 53 ARG HD2 1.0 1.8 6.0 1091 921 A 53 ARG HBy A 53 ARG HD3 1.0 1.8 6.0 1092 922 A 109 ARG HA A 109 ARG HD2 1.0 1.8 6.0 1093 922 A 109 ARG HA A 109 ARG HD3 1.0 1.8 6.0 1094 923 A 48 ARG HD2 A 48 ARG HG2 1.0 1.8 4.5 1095 923 A 48 ARG HG3 A 48 ARG HD2 1.0 1.8 4.5 1096 923 A 48 ARG HG3 A 48 ARG HD3 1.0 1.8 4.5 1097 923 A 48 ARG HD3 A 48 ARG HG2 1.0 1.8 4.5 1098 924 A 48 ARG H A 48 ARG HD2 1.0 1.8 6.0 1099 924 A 48 ARG H A 48 ARG HD3 1.0 1.8 6.0 1100 925 A 72 GLY HAy A 73 ARG HDy 1.0 1.8 6.0 1101 926 A 48 ARG HB3 A 48 ARG HD2 1.0 1.8 4.5 1102 926 A 48 ARG HB2 A 48 ARG HD2 1.0 1.8 4.5 1103 926 A 48 ARG HD3 A 48 ARG HB2 1.0 1.8 4.5 1104 926 A 48 ARG HB3 A 48 ARG HD3 1.0 1.8 4.5 1105 927 A 73 ARG H A 73 ARG HDy 1.0 1.8 6.0 1106 928 A 71 GLN HBy A 73 ARG HDx 1.0 1.8 6.0 1107 929 A 73 ARG H A 73 ARG HDx 1.0 1.8 6.0 1108 930 A 114 ARG HB3 A 114 ARG HD2 1.0 1.8 4.5 1109 930 A 114 ARG HB2 A 114 ARG HD2 1.0 1.8 4.5 1110 930 A 114 ARG HD3 A 114 ARG HB2 1.0 1.8 4.5 1111 930 A 114 ARG HB3 A 114 ARG HD3 1.0 1.8 4.5 1112 931 A 59 LYS H A 58 ARG HDy 1.0 1.8 6.5 1113 932 A 55 LYS HA A 58 ARG HDy 1.0 1.8 6.0 1114 933 A 58 ARG HDy A 58 ARG HB2 1.0 1.8 4.5 1115 933 A 58 ARG HB3 A 58 ARG HDy 1.0 1.8 4.5 1116 934 A 58 ARG H A 58 ARG HDx 1.0 1.8 6.0 1117 935 A 58 ARG HDx A 58 ARG HB2 1.0 1.8 4.5 1118 935 A 58 ARG HB3 A 58 ARG HDx 1.0 1.8 4.5 1119 936 A 59 LYS H A 58 ARG HDx 1.0 1.8 6.5 1120 937 A 55 LYS HA A 58 ARG HDx 1.0 1.8 6.0 1121 938 A 82 ARG H A 82 ARG HD2 1.0 1.8 6.5 1122 938 A 82 ARG H A 82 ARG HD3 1.0 1.8 6.5 1123 939 A 114 ARG HA A 114 ARG HD2 1.0 1.8 6.0 1124 939 A 114 ARG HA A 114 ARG HD3 1.0 1.8 6.0 1125 940 A 61 VAL HG1% A 67 LYS HEy 1.0 1.8 6.0 1126 941 A 123 LYS HGx A 123 LYS HE2 1.0 1.8 6.0 1127 941 A 123 LYS HGx A 123 LYS HE3 1.0 1.8 6.0 1128 942 A 121 ASP H A 121 ASP HBy 1.0 1.8 6.0 1129 943 A 75 THR HG2% A 68 TYR HBx 1.0 1.8 6.5 1130 944 A 121 ASP H A 121 ASP HBx 1.0 1.8 6.0 1131 945 A 66 LYS HD2 A 66 LYS HE2 1.0 1.8 4.5 1132 945 A 66 LYS HD3 A 66 LYS HE2 1.0 1.8 4.5 1133 945 A 66 LYS HE3 A 66 LYS HD2 1.0 1.8 4.5 1134 945 A 66 LYS HE3 A 66 LYS HD3 1.0 1.8 4.5 1135 946 A 91 TYR HD% A 86 LYS HE2 1.0 1.8 6.0 1136 946 A 91 TYR HD% A 86 LYS HE3 1.0 1.8 6.0 1137 947 A 68 TYR HBx A 72 GLY H 1.0 1.8 6.0 1138 948 A 69 ASP H A 68 TYR HBx 1.0 1.8 6.0 1139 949 A 68 TYR HBx A 74 GLU HA 1.0 1.8 6.0 1140 950 A 134 LYS HBy A 134 LYS HEy 1.0 1.8 6.5 1141 951 A 130 LEU HD2% A 134 LYS HEy 1.0 1.8 6.0 1142 952 A 131 ASN HA A 134 LYS HEx 1.0 1.8 6.0 1143 953 A 134 LYS HEx A 130 LEU HG 1.0 1.8 6.0 1144 954 A 134 LYS HGy A 134 LYS HEx 1.0 1.8 6.0 1145 955 A 130 LEU HD2% A 134 LYS HEx 1.0 1.8 6.0 1146 956 A 134 LYS H A 134 LYS HEx 1.0 1.8 6.5 1147 957 A 98 LEU H A 98 LEU HBy 1.0 1.8 6.0 1148 958 A 75 THR HG2% A 66 LYS HE2 1.0 1.8 6.0 1149 958 A 75 THR HG2% A 66 LYS HE3 1.0 1.8 6.0 1150 959 A 55 LYS HGy A 55 LYS HE2 1.0 1.8 4.5 1151 959 A 55 LYS HGy A 55 LYS HE3 1.0 1.8 4.5 1152 960 A 115 LYS HB2 A 115 LYS HE2 1.0 1.8 4.5 1153 960 A 115 LYS HB3 A 115 LYS HE2 1.0 1.8 4.5 1154 960 A 115 LYS HE3 A 115 LYS HB2 1.0 1.8 4.5 1155 960 A 115 LYS HB3 A 115 LYS HE3 1.0 1.8 4.5 1156 961 A 111 VAL HG2% A 115 LYS HE2 1.0 1.8 6.0 1157 961 A 115 LYS HE3 A 111 VAL HG2% 1.0 1.8 6.0 1158 962 A 79 LYS HGy A 79 LYS HEy 1.0 1.8 6.0 1159 963 A 136 LYS HGy A 136 LYS HEy 1.0 1.8 6.0 1160 964 A 136 LYS HGx A 136 LYS HEy 1.0 1.8 6.0 1161 965 A 84 LYS HGy A 84 LYS HE2 1.0 1.8 6.0 1162 965 A 84 LYS HGy A 84 LYS HE3 1.0 1.8 6.0 1163 966 A 84 LYS HGx A 84 LYS HE2 1.0 1.8 6.0 1164 966 A 84 LYS HGx A 84 LYS HE3 1.0 1.8 6.0 1165 967 A 136 LYS HEx A 136 LYS HGx 1.0 1.8 6.0 1166 968 A 136 LYS HEx A 136 LYS HGy 1.0 1.8 6.0 1167 969 A 130 LEU HBy A 130 LEU HD2% 1.0 1.8 6.0 1168 970 A 130 LEU HBx A 130 LEU HD2% 1.0 1.8 6.0 1169 971 A 99 ASP H A 98 LEU HBy 1.0 1.8 6.0 1170 972 A 84 LYS HA A 84 LYS HE2 1.0 1.8 6.0 1171 972 A 84 LYS HA A 84 LYS HE3 1.0 1.8 6.0 1172 973 A 130 LEU HBx A 129 CYS H 1.0 1.8 6.0 1173 974 A 69 ASP HBy A 70 ASP HA 1.0 1.8 6.0 1174 975 A 95 GLY HAy A 91 TYR HB2 1.0 1.8 6.0 1175 975 A 91 TYR HB3 A 95 GLY HAy 1.0 1.8 6.0 1176 976 A 142 ASP HBx A 143 PRO HD2 1.0 1.8 6.0 1177 976 A 143 PRO HD3 A 142 ASP HBx 1.0 1.8 6.0 1178 977 A 66 LYS HBx A 65 ASP HBy 1.0 1.8 6.0 1179 978 A 65 ASP H A 65 ASP HBy 1.0 1.8 4.5 1180 979 A 66 LYS H A 65 ASP HBy 1.0 1.8 6.0 1181 980 A 65 ASP HA A 65 ASP HBy 1.0 1.8 4.5 1182 981 A 105 LEU H A 105 LEU HBx 1.0 1.8 6.0 1183 982 A 105 LEU HBy A 105 LEU HD1% 1.0 1.8 6.0 1184 983 A 105 LEU HBy A 105 LEU HD2% 1.0 1.8 6.0 1185 984 A 38 ASP H A 38 ASP HBy 1.0 1.8 4.5 1186 984 A 38 ASP H A 38 ASP HBx 1.0 1.8 4.5 1187 985 A 37 TYR H A 38 ASP HBy 1.0 1.8 6.0 1188 985 A 37 TYR H A 38 ASP HBx 1.0 1.8 6.0 1189 986 A 30 ASP HBx A 31 PRO HDx 1.0 1.8 6.0 1190 986 A 30 ASP HBx A 31 PRO HDy 1.0 1.8 6.0 1191 987 A 116 ASP HBy A 133 ILE HD1% 1.0 1.8 6.0 1192 988 A 81 ILE HD1% A 60 ASP HBy 1.0 1.8 6.0 1193 989 A 112 ASP H A 112 ASP HBx 1.0 1.8 6.0 1194 990 A 81 ILE HD1% A 60 ASP HBx 1.0 1.8 6.0 1195 991 A 61 VAL H A 60 ASP HBx 1.0 1.8 6.0 1196 992 A 30 ASP HBy A 31 PRO HDx 1.0 1.8 6.0 1197 992 A 30 ASP HBy A 31 PRO HDy 1.0 1.8 6.0 1198 993 A 60 ASP H A 60 ASP HBx 1.0 1.8 4.5 1199 994 A 100 LEU HG A 99 ASP HBx 1.0 1.8 6.0 1200 995 A 101 GLY H A 100 LEU HB2 1.0 1.8 6.0 1201 995 A 100 LEU HB3 A 101 GLY H 1.0 1.8 6.0 1202 996 A 100 LEU HD1% A 100 LEU HB2 1.0 1.8 6.0 1203 996 A 100 LEU HB3 A 100 LEU HD1% 1.0 1.8 6.0 1204 997 A 85 TYR HE% A 56 ASP HBy 1.0 1.8 6.0 1205 998 A 94 ASP HBy A 96 LYS HD2 1.0 1.8 6.0 1206 998 A 94 ASP HBy A 96 LYS HD3 1.0 1.8 6.0 1207 999 A 112 ASP HBy A 115 LYS HB2 1.0 1.8 6.0 1208 999 A 112 ASP HBy A 115 LYS HB3 1.0 1.8 6.0 1209 1000 A 85 TYR HE% A 56 ASP HBx 1.0 1.8 6.0 1210 1001 A 85 TYR HE% A 60 ASP HBx 1.0 1.8 6.0 1211 1002 A 99 ASP HA A 100 LEU HB2 1.0 1.8 6.0 1212 1002 A 100 LEU HB3 A 99 ASP HA 1.0 1.8 6.0 1213 1003 A 71 GLN HE2x A 70 ASP HB2 1.0 1.8 6.0 1214 1003 A 71 GLN HE2x A 70 ASP HB3 1.0 1.8 6.0 1215 1004 A 30 ASP H A 29 PHE HBy 1.0 1.8 6.0 1216 1005 A 128 LYS H A 127 ASP HB2 1.0 1.8 6.0 1217 1005 A 128 LYS H A 127 ASP HB3 1.0 1.8 6.0 1218 1006 A 43 ASP H A 46 PHE HBx 1.0 1.8 6.0 1219 1007 A 35 TYR HBx A 36 GLY H 1.0 1.8 6.0 1220 1008 A 35 TYR HBx A 40 LYS HD2 1.0 1.8 6.0 1221 1008 A 35 TYR HBx A 40 LYS HD3 1.0 1.8 6.0 1222 1009 A 37 TYR H A 37 TYR HBx 1.0 1.8 6.0 1223 1010 A 37 TYR HE% A 35 TYR HBx 1.0 1.8 6.0 1224 1011 A 37 TYR HBy A 37 TYR H 1.0 1.8 6.0 1225 1012 A 37 TYR HE% A 35 TYR HBy 1.0 1.8 6.0 1226 1013 A 93 TYR H A 93 TYR HBy 1.0 1.8 6.0 1227 1014 A 81 ILE HB A 82 ARG H 1.0 1.8 4.5 1228 1015 A 81 ILE HD1% A 81 ILE HB 1.0 1.8 6.0 1229 1016 A 81 ILE HB A 78 ALA HB% 1.0 1.8 6.0 1230 1017 A 68 TYR HE% A 74 GLU HGy 1.0 1.8 6.0 1231 1018 A 78 ALA HB% A 74 GLU HGy 1.0 1.8 6.0 1232 1019 A 74 GLU H A 74 GLU HGy 1.0 1.8 6.0 1233 1020 A 74 GLU H A 74 GLU HGx 1.0 1.8 6.0 1234 1021 A 74 GLU HGx A 74 GLU HA 1.0 1.8 6.0 1235 1022 A 75 THR H A 74 GLU HGx 1.0 1.8 6.0 1236 1023 A 108 ILE HD1% A 108 ILE HB 1.0 1.8 6.0 1237 1024 A 81 ILE HG2% A 85 TYR HBx 1.0 1.8 6.5 1238 1025 A 131 ASN HBy A 131 ASN H 1.0 1.8 4.5 1239 1026 A 131 ASN HBy A 131 ASN HD2y 1.0 1.8 6.0 1240 1027 A 131 ASN HBy A 128 LYS HA 1.0 1.8 6.0 1241 1028 A 85 TYR HBy A 57 CYS HBx 1.0 1.8 6.0 1242 1029 A 131 ASN HBx A 134 LYS HD2 1.0 1.8 6.0 1243 1029 A 134 LYS HD3 A 131 ASN HBx 1.0 1.8 6.0 1244 1030 A 131 ASN HBx A 131 ASN H 1.0 1.8 4.5 1245 1031 A 131 ASN HBx A 131 ASN HD2y 1.0 1.8 4.5 1246 1032 A 131 ASN HD2x A 131 ASN HBx 1.0 1.8 6.0 1247 1033 A 131 ASN HBx A 128 LYS HA 1.0 1.8 6.0 1248 1034 A 130 LEU H A 131 ASN HBx 1.0 1.8 6.0 1249 1035 A 132 ALA HB% A 131 ASN HBx 1.0 1.8 6.5 1250 1036 A 73 ARG HA A 74 GLU HGy 1.0 1.8 6.0 1251 1037 A 68 TYR HD% A 74 GLU HGy 1.0 1.8 6.0 1252 1038 A 68 TYR HD% A 74 GLU HGx 1.0 1.8 6.0 1253 1039 A 78 ALA HB% A 74 GLU HGx 1.0 1.8 6.0 1254 1040 A 68 TYR HE% A 74 GLU HGx 1.0 1.8 6.0 1255 1041 A 128 LYS H A 129 CYS HBy 1.0 1.8 6.0 1256 1042 A 129 CYS HBx A 128 LYS HB2 1.0 1.8 6.0 1257 1042 A 129 CYS HBx A 128 LYS HB3 1.0 1.8 6.0 1258 1043 A 47 CYS HBy A 57 CYS HBx 1.0 1.8 6.0 1259 1044 A 47 CYS HBy A 54 GLU HGy 1.0 1.8 6.0 1260 1045 A 47 CYS HBy A 54 GLU HA 1.0 1.8 6.0 1261 1046 A 47 CYS H A 47 CYS HBx 1.0 1.8 6.0 1262 1047 A 47 CYS HBx A 57 CYS HBx 1.0 1.8 6.0 1263 1048 A 130 LEU HD2% A 133 ILE HB 1.0 1.8 6.0 1264 1049 A 124 TYR HD% A 125 GLU HG2 1.0 1.8 6.0 1265 1049 A 125 GLU HG3 A 124 TYR HD% 1.0 1.8 6.0 1266 1050 A 125 GLU H A 125 GLU HG2 1.0 1.8 6.0 1267 1050 A 125 GLU H A 125 GLU HG3 1.0 1.8 6.0 1268 1051 A 79 LYS HGy A 83 GLU HGy 1.0 1.8 6.5 1269 1052 A 83 GLU HA A 83 GLU HGy 1.0 1.8 6.0 1270 1053 A 84 LYS H A 83 GLU HGy 1.0 1.8 6.0 1271 1054 A 83 GLU H A 83 GLU HGy 1.0 1.8 6.0 1272 1055 A 83 GLU HGy A 80 GLY HA2 1.0 1.8 6.0 1273 1055 A 80 GLY HA3 A 83 GLU HGy 1.0 1.8 6.0 1274 1056 A 83 GLU H A 83 GLU HGx 1.0 1.8 6.0 1275 1057 A 103 CYS HBy A 110 GLU HG2 1.0 1.8 6.0 1276 1057 A 110 GLU HG3 A 103 CYS HBy 1.0 1.8 6.0 1277 1058 A 111 VAL H A 110 GLU HG2 1.0 1.8 6.0 1278 1058 A 110 GLU HG3 A 111 VAL H 1.0 1.8 6.0 1279 1059 A 76 ALA HB% A 77 CYS HBx 1.0 1.8 6.0 1280 1060 A 132 ALA HA A 135 GLU HG2 1.0 1.8 6.0 1281 1060 A 135 GLU HG3 A 132 ALA HA 1.0 1.8 6.0 1282 1061 A 135 GLU H A 135 GLU HG2 1.0 1.8 4.5 1283 1061 A 135 GLU HG3 A 135 GLU H 1.0 1.8 4.5 1284 1062 A 136 LYS HA A 135 GLU HG2 1.0 1.8 4.5 1285 1062 A 135 GLU HG3 A 136 LYS HA 1.0 1.8 4.5 1286 1063 A 136 LYS HEy A 135 GLU HG2 1.0 1.8 6.0 1287 1063 A 135 GLU HG3 A 136 LYS HEy 1.0 1.8 6.0 1288 1064 A 136 LYS HEx A 135 GLU HG2 1.0 1.8 6.0 1289 1064 A 135 GLU HG3 A 136 LYS HEx 1.0 1.8 6.0 1290 1065 A 54 GLU HGy A 55 LYS H 1.0 1.8 6.0 1291 1066 A 58 ARG HDy A 54 GLU HGy 1.0 1.8 6.0 1292 1067 A 47 CYS HBx A 54 GLU HGx 1.0 1.8 6.0 1293 1068 A 110 GLU H A 110 GLU HG2 1.0 1.8 6.0 1294 1068 A 110 GLU H A 110 GLU HG3 1.0 1.8 6.0 1295 1069 A 110 GLU HA A 110 GLU HG2 1.0 1.8 6.0 1296 1069 A 110 GLU HA A 110 GLU HG3 1.0 1.8 6.0 1297 1070 A 104 THR HG2% A 110 GLU HG2 1.0 1.8 6.5 1298 1070 A 110 GLU HG3 A 104 THR HG2% 1.0 1.8 6.5 1299 1071 A 81 ILE HD1% A 77 CYS HBy 1.0 1.8 6.5 1300 1072 A 78 ALA H A 77 CYS HBx 1.0 1.8 6.0 1301 1073 A 54 GLU HA A 54 GLU HGy 1.0 1.8 6.0 1302 1074 A 47 CYS HBx A 54 GLU HGy 1.0 1.8 6.0 1303 1075 A 58 ARG HDx A 54 GLU HGx 1.0 1.8 6.5 1304 1076 A 54 GLU HA A 54 GLU HGx 1.0 1.8 6.0 1305 1077 A 71 GLN H A 71 GLN HG2 1.0 1.8 4.5 1306 1077 A 71 GLN H A 71 GLN HG3 1.0 1.8 4.5 1307 1078 A 71 GLN HBx A 71 GLN HG2 1.0 1.8 3.0 1308 1078 A 71 GLN HBx A 71 GLN HG3 1.0 1.8 3.0 1309 1079 A 70 ASP HB3 A 71 GLN HG2 1.0 1.8 6.0 1310 1079 A 70 ASP HB2 A 71 GLN HG2 1.0 1.8 6.0 1311 1079 A 71 GLN HG3 A 70 ASP HB2 1.0 1.8 6.0 1312 1079 A 70 ASP HB3 A 71 GLN HG3 1.0 1.8 6.0 1313 1080 A 71 GLN HG2 A 73 ARG HG2 1.0 1.8 6.0 1314 1080 A 71 GLN HG3 A 73 ARG HG2 1.0 1.8 6.0 1315 1080 A 73 ARG HG3 A 71 GLN HG2 1.0 1.8 6.0 1316 1080 A 73 ARG HG3 A 71 GLN HG3 1.0 1.8 6.0 1317 1081 A 81 ILE HD1% A 64 CYS HBy 1.0 1.8 6.0 1318 1082 A 103 CYS HBy A 100 LEU HA 1.0 1.8 6.0 1319 1083 A 81 ILE HD1% A 64 CYS HBx 1.0 1.8 6.0 1320 1084 A 118 GLN H A 118 GLN HGy 1.0 1.8 6.0 1321 1085 A 90 VAL HG2% A 118 GLN HGy 1.0 1.8 6.0 1322 1086 A 103 CYS HBx A 100 LEU HA 1.0 1.8 6.0 1323 1087 A 103 CYS HBx A 104 THR HG2% 1.0 1.8 6.5 1324 1088 A 104 THR H A 103 CYS HBx 1.0 1.8 6.0 1325 1089 A 90 VAL HG2% A 118 GLN HGx 1.0 1.8 6.0 1326 1090 A 57 CYS HBy A 85 TYR HD% 1.0 1.8 6.0 1327 1091 A 57 CYS HBy A 54 GLU HA 1.0 1.8 6.0 1328 1092 A 118 GLN H A 118 GLN HGx 1.0 1.8 4.5 1329 1093 A 117 ALA HB% A 118 GLN HGx 1.0 1.8 6.0 1330 1094 A 62 GLN H A 62 GLN HGx 1.0 1.8 6.0 1331 1095 A 63 ALA H A 62 GLN HGx 1.0 1.8 6.0 1332 1096 A 62 GLN HA A 62 GLN HGx 1.0 1.8 6.0 1333 1097 A 61 VAL HG1% A 62 GLN HGx 1.0 1.8 6.5 1334 1098 A 68 TYR HE% A 67 LYS HB2 1.0 1.8 6.0 1335 1098 A 68 TYR HE% A 67 LYS HB3 1.0 1.8 6.0 1336 1099 A 78 ALA HB% A 67 LYS HB2 1.0 1.8 6.0 1337 1099 A 78 ALA HB% A 67 LYS HB3 1.0 1.8 6.0 1338 1100 A 68 TYR H A 67 LYS HB2 1.0 1.8 6.0 1339 1100 A 68 TYR H A 67 LYS HB3 1.0 1.8 6.0 1340 1101 A 114 ARG H A 113 CYS HBx 1.0 1.8 6.0 1341 1102 A 110 GLU HA A 113 CYS HBx 1.0 1.8 6.0 1342 1103 A 34 GLN HBy A 34 GLN HG2 1.0 1.8 3.0 1343 1103 A 34 GLN HG3 A 34 GLN HBy 1.0 1.8 3.0 1344 1104 A 34 GLN HA A 34 GLN HG2 1.0 1.8 6.0 1345 1104 A 34 GLN HG3 A 34 GLN HA 1.0 1.8 6.0 1346 1105 A 85 TYR H A 84 LYS HBy 1.0 1.8 6.0 1347 1106 A 84 LYS HBy A 84 LYS HE2 1.0 1.8 6.0 1348 1106 A 84 LYS HBy A 84 LYS HE3 1.0 1.8 6.0 1349 1107 A 136 LYS HBx A 136 LYS HEy 1.0 1.8 6.5 1350 1108 A 91 TYR HE% A 89 VAL HB 1.0 1.8 6.0 1351 1109 A 136 LYS H A 136 LYS HBy 1.0 1.8 6.0 1352 1110 A 136 LYS HBx A 137 TYR HE% 1.0 1.8 6.0 1353 1111 A 141 VAL H A 140 VAL HB 1.0 1.8 6.0 1354 1112 A 68 TYR HD% A 41 PRO HBy 1.0 1.8 6.0 1355 1113 A 66 LYS H A 66 LYS HBy 1.0 1.8 6.0 1356 1114 A 78 ALA H A 79 LYS HB2 1.0 1.8 6.0 1357 1114 A 78 ALA H A 79 LYS HB3 1.0 1.8 6.0 1358 1115 A 80 GLY H A 79 LYS HB2 1.0 1.8 4.5 1359 1115 A 80 GLY H A 79 LYS HB3 1.0 1.8 4.5 1360 1116 A 79 LYS HEy A 79 LYS HB2 1.0 1.8 6.0 1361 1116 A 79 LYS HB3 A 79 LYS HEy 1.0 1.8 6.0 1362 1117 A 79 LYS HGy A 79 LYS HB2 1.0 1.8 4.5 1363 1117 A 79 LYS HB3 A 79 LYS HGy 1.0 1.8 4.5 1364 1118 A 40 LYS HBy A 41 PRO HDx 1.0 1.8 6.0 1365 1119 A 40 LYS HBy A 40 LYS HE2 1.0 1.8 6.0 1366 1119 A 40 LYS HBy A 40 LYS HE3 1.0 1.8 6.0 1367 1120 A 68 TYR HE% A 41 PRO HBy 1.0 1.8 6.0 1368 1121 A 117 ALA H A 115 LYS HB2 1.0 1.8 6.0 1369 1121 A 117 ALA H A 115 LYS HB3 1.0 1.8 6.0 1370 1122 A 114 ARG H A 115 LYS HB2 1.0 1.8 6.0 1371 1122 A 115 LYS HB3 A 114 ARG H 1.0 1.8 6.0 1372 1123 A 68 TYR HE% A 41 PRO HBx 1.0 1.8 6.0 1373 1124 A 35 TYR HBx A 40 LYS HBx 1.0 1.8 6.0 1374 1125 A 134 LYS H A 134 LYS HBx 1.0 1.8 6.0 1375 1126 A 140 VAL H A 139 PRO HBy 1.0 1.8 6.0 1376 1127 A 87 PRO HDy A 86 LYS HB2 1.0 1.8 4.5 1377 1127 A 86 LYS HB3 A 87 PRO HDy 1.0 1.8 4.5 1378 1128 A 86 LYS HB2 A 86 LYS HE2 1.0 1.8 6.0 1379 1128 A 86 LYS HB3 A 86 LYS HE2 1.0 1.8 6.0 1380 1128 A 86 LYS HE3 A 86 LYS HB2 1.0 1.8 6.0 1381 1128 A 86 LYS HB3 A 86 LYS HE3 1.0 1.8 6.0 1382 1129 A 138 LYS HB3 A 138 LYS HE2 1.0 1.8 6.0 1383 1129 A 138 LYS HB2 A 138 LYS HE2 1.0 1.8 6.0 1384 1129 A 138 LYS HE3 A 138 LYS HB2 1.0 1.8 6.0 1385 1129 A 138 LYS HE3 A 138 LYS HB3 1.0 1.8 6.0 1386 1130 A 131 ASN HA A 134 LYS HBy 1.0 1.8 6.0 1387 1131 A 135 GLU H A 134 LYS HBx 1.0 1.8 6.0 1388 1132 A 56 ASP H A 55 LYS HBy 1.0 1.8 6.0 1389 1133 A 96 LYS HB3 A 96 LYS HE2 1.0 1.8 6.0 1390 1133 A 96 LYS HB2 A 96 LYS HE2 1.0 1.8 6.0 1391 1133 A 96 LYS HE3 A 96 LYS HB2 1.0 1.8 6.0 1392 1133 A 96 LYS HB3 A 96 LYS HE3 1.0 1.8 6.0 1393 1134 A 61 VAL HB A 62 GLN H 1.0 1.8 6.0 1394 1135 A 61 VAL HB A 58 ARG HA 1.0 1.8 6.0 1395 1136 A 44 ALA HB% A 61 VAL HB 1.0 1.8 6.5 1396 1137 A 55 LYS HBx A 55 LYS H 1.0 1.8 4.5 1397 1138 A 111 VAL H A 111 VAL HB 1.0 1.8 4.5 1398 1139 A 112 ASP H A 111 VAL HB 1.0 1.8 6.0 1399 1140 A 77 CYS HA A 81 ILE HG1y 1.0 1.8 6.0 1400 1141 A 79 LYS H A 81 ILE HG1y 1.0 1.8 6.5 1401 1142 A 74 GLU H A 74 GLU HBy 1.0 1.8 6.0 1402 1143 A 74 GLU H A 74 GLU HBx 1.0 1.8 4.5 1403 1144 A 60 ASP HBx A 81 ILE HG1x 1.0 1.8 6.0 1404 1145 A 146 PRO HDy A 145 PRO HBy 1.0 1.8 6.0 1405 1146 A 68 TYR HD% A 74 GLU HBy 1.0 1.8 6.0 1406 1147 A 81 ILE H A 81 ILE HG1x 1.0 1.8 6.0 1407 1148 A 85 TYR HE% A 81 ILE HG1x 1.0 1.8 6.5 1408 1149 A 53 ARG HBy A 85 TYR HD% 1.0 1.8 6.0 1409 1150 A 74 GLU H A 73 ARG HBy 1.0 1.8 6.0 1410 1151 A 80 GLY HA3 A 83 GLU HB2 1.0 1.8 6.0 1411 1151 A 80 GLY HA2 A 83 GLU HB2 1.0 1.8 6.0 1412 1151 A 83 GLU HB3 A 80 GLY HA2 1.0 1.8 6.0 1413 1151 A 83 GLU HB3 A 80 GLY HA3 1.0 1.8 6.0 1414 1152 A 109 ARG HBx A 109 ARG HD2 1.0 1.8 6.0 1415 1152 A 109 ARG HD3 A 109 ARG HBx 1.0 1.8 6.0 1416 1153 A 78 ALA HB% A 81 ILE HG1y 1.0 1.8 6.0 1417 1154 A 53 ARG HBy A 57 CYS HBx 1.0 1.8 6.0 1418 1155 A 83 GLU H A 83 GLU HB2 1.0 1.8 4.5 1419 1155 A 83 GLU H A 83 GLU HB3 1.0 1.8 4.5 1420 1156 A 133 ILE HD1% A 136 LYS HDy 1.0 1.8 6.5 1421 1156 A 133 ILE HD1% A 136 LYS HDx 1.0 1.8 6.5 1422 1157 A 84 LYS H A 84 LYS HD2 1.0 1.8 6.0 1423 1157 A 84 LYS H A 84 LYS HD3 1.0 1.8 6.0 1424 1158 A 85 TYR HD% A 84 LYS HD2 1.0 1.8 6.5 1425 1158 A 85 TYR HD% A 84 LYS HD3 1.0 1.8 6.5 1426 1159 A 81 ILE HA A 84 LYS HD2 1.0 1.8 6.0 1427 1159 A 81 ILE HA A 84 LYS HD3 1.0 1.8 6.0 1428 1160 A 82 ARG H A 82 ARG HB2 1.0 1.8 6.0 1429 1160 A 82 ARG HB3 A 82 ARG H 1.0 1.8 6.0 1430 1161 A 41 PRO HBx A 67 LYS HDx 1.0 1.8 6.0 1431 1161 A 41 PRO HBx A 67 LYS HDy 1.0 1.8 6.0 1432 1162 A 58 ARG HA A 58 ARG HG2 1.0 1.8 6.0 1433 1162 A 58 ARG HG3 A 58 ARG HA 1.0 1.8 6.0 1434 1163 A 135 GLU H A 135 GLU HB2 1.0 1.8 4.5 1435 1163 A 135 GLU HB3 A 135 GLU H 1.0 1.8 4.5 1436 1164 A 135 GLU HA A 135 GLU HB2 1.0 1.8 4.5 1437 1164 A 135 GLU HB3 A 135 GLU HA 1.0 1.8 4.5 1438 1165 A 135 GLU HB2 A 135 GLU HG2 1.0 1.8 3.0 1439 1165 A 135 GLU HB3 A 135 GLU HG2 1.0 1.8 3.0 1440 1165 A 135 GLU HG3 A 135 GLU HB2 1.0 1.8 3.0 1441 1165 A 135 GLU HB3 A 135 GLU HG3 1.0 1.8 3.0 1442 1166 A 115 LYS HB2 A 115 LYS HD2 1.0 1.8 4.5 1443 1166 A 115 LYS HB3 A 115 LYS HD2 1.0 1.8 4.5 1444 1166 A 115 LYS HD3 A 115 LYS HB2 1.0 1.8 4.5 1445 1166 A 115 LYS HB3 A 115 LYS HD3 1.0 1.8 4.5 1446 1167 A 138 LYS HB2 A 138 LYS HD2 1.0 1.8 4.5 1447 1167 A 138 LYS HB3 A 138 LYS HD2 1.0 1.8 4.5 1448 1167 A 138 LYS HD3 A 138 LYS HB2 1.0 1.8 4.5 1449 1167 A 138 LYS HB3 A 138 LYS HD3 1.0 1.8 4.5 1450 1168 A 131 ASN HBx A 128 LYS HD2 1.0 1.8 6.0 1451 1168 A 131 ASN HBx A 128 LYS HD3 1.0 1.8 6.0 1452 1169 A 128 LYS HA A 128 LYS HD2 1.0 1.8 6.0 1453 1169 A 128 LYS HA A 128 LYS HD3 1.0 1.8 6.0 1454 1170 A 42 LEU HD2% A 67 LYS HDx 1.0 1.8 6.0 1455 1170 A 67 LYS HDy A 42 LEU HD2% 1.0 1.8 6.0 1456 1170 A 67 LYS HDy A 42 LEU HD1% 1.0 1.8 6.0 1457 1170 A 42 LEU HD1% A 67 LYS HDx 1.0 1.8 6.0 1458 1171 A 80 GLY H A 79 LYS HD2 1.0 1.8 6.0 1459 1171 A 80 GLY H A 79 LYS HD3 1.0 1.8 6.0 1460 1172 A 134 LYS HA A 134 LYS HD2 1.0 1.8 6.0 1461 1172 A 134 LYS HD3 A 134 LYS HA 1.0 1.8 6.0 1462 1173 A 71 GLN HBy A 73 ARG HG2 1.0 1.8 6.0 1463 1173 A 73 ARG HG3 A 71 GLN HBy 1.0 1.8 6.0 1464 1174 A 71 GLN HBy A 71 GLN H 1.0 1.8 6.0 1465 1175 A 71 GLN HBy A 73 ARG HDy 1.0 1.8 6.0 1466 1176 A 71 GLN HBy A 71 GLN HG2 1.0 1.8 3.0 1467 1176 A 71 GLN HBy A 71 GLN HG3 1.0 1.8 3.0 1468 1177 A 123 LYS HA A 123 LYS HD2 1.0 1.8 6.0 1469 1177 A 123 LYS HD3 A 123 LYS HA 1.0 1.8 6.0 1470 1178 A 122 LYS HBy A 123 LYS HD2 1.0 1.8 4.5 1471 1178 A 123 LYS HD3 A 122 LYS HBy 1.0 1.8 4.5 1472 1179 A 122 LYS HA A 123 LYS HD2 1.0 1.8 6.0 1473 1179 A 123 LYS HD3 A 122 LYS HA 1.0 1.8 6.0 1474 1180 A 40 LYS HA A 40 LYS HD2 1.0 1.8 6.0 1475 1180 A 40 LYS HA A 40 LYS HD3 1.0 1.8 6.0 1476 1181 A 40 LYS HD2 A 40 LYS HG2 1.0 1.8 3.0 1477 1181 A 40 LYS HD3 A 40 LYS HG2 1.0 1.8 3.0 1478 1181 A 40 LYS HG3 A 40 LYS HD2 1.0 1.8 3.0 1479 1181 A 40 LYS HG3 A 40 LYS HD3 1.0 1.8 3.0 1480 1182 A 40 LYS H A 40 LYS HD2 1.0 1.8 6.0 1481 1182 A 40 LYS H A 40 LYS HD3 1.0 1.8 6.0 1482 1183 A 128 LYS H A 128 LYS HD2 1.0 1.8 6.0 1483 1183 A 128 LYS H A 128 LYS HD3 1.0 1.8 6.0 1484 1184 A 41 PRO HGy A 67 LYS HDx 1.0 1.8 6.0 1485 1184 A 67 LYS HDy A 41 PRO HGy 1.0 1.8 6.0 1486 1185 A 41 PRO HGx A 67 LYS HDx 1.0 1.8 6.0 1487 1185 A 67 LYS HDy A 41 PRO HGx 1.0 1.8 6.0 1488 1186 A 47 CYS HBy A 54 GLU HBy 1.0 1.8 6.0 1489 1187 A 54 GLU HBy A 55 LYS H 1.0 1.8 6.0 1490 1188 A 47 CYS HBx A 54 GLU HBx 1.0 1.8 6.5 1491 1189 A 118 GLN H A 118 GLN HB2 1.0 1.8 4.5 1492 1189 A 118 GLN H A 118 GLN HB3 1.0 1.8 4.5 1493 1190 A 117 ALA H A 118 GLN HB2 1.0 1.8 6.0 1494 1190 A 117 ALA H A 118 GLN HB3 1.0 1.8 6.0 1495 1191 A 90 VAL HG2% A 118 GLN HB2 1.0 1.8 6.0 1496 1191 A 90 VAL HG2% A 118 GLN HB3 1.0 1.8 6.0 1497 1192 A 90 VAL HG1% A 118 GLN HB2 1.0 1.8 6.0 1498 1192 A 90 VAL HG1% A 118 GLN HB3 1.0 1.8 6.0 1499 1193 A 61 VAL HG1% A 62 GLN HB2 1.0 1.8 6.5 1500 1193 A 61 VAL HG1% A 62 GLN HB3 1.0 1.8 6.5 1501 1194 A 63 ALA HB% A 62 GLN HB2 1.0 1.8 6.5 1502 1194 A 63 ALA HB% A 62 GLN HB3 1.0 1.8 6.5 1503 1195 A 133 ILE H A 133 ILE HG1x 1.0 1.8 6.0 1504 1196 A 82 ARG H A 82 ARG HGy 1.0 1.8 6.0 1505 1197 A 89 VAL HG1% A 87 PRO HGy 1.0 1.8 6.5 1506 1198 A 140 VAL H A 139 PRO HG2 1.0 1.8 6.5 1507 1198 A 140 VAL H A 139 PRO HG3 1.0 1.8 6.5 1508 1199 A 91 TYR HE% A 87 PRO HGx 1.0 1.8 6.0 1509 1200 A 48 ARG HB3 A 48 ARG HG2 1.0 1.8 3.0 1510 1200 A 48 ARG HB2 A 48 ARG HG2 1.0 1.8 3.0 1511 1200 A 48 ARG HG3 A 48 ARG HB2 1.0 1.8 3.0 1512 1200 A 48 ARG HB3 A 48 ARG HG3 1.0 1.8 3.0 1513 1201 A 108 ILE HA A 108 ILE HG1y 1.0 1.8 6.0 1514 1201 A 108 ILE HA A 108 ILE HG1x 1.0 1.8 6.0 1515 1202 A 42 LEU H A 41 PRO HGx 1.0 1.8 6.0 1516 1203 A 85 TYR HE% A 53 ARG HGy 1.0 1.8 6.0 1517 1204 A 105 LEU HG A 105 LEU H 1.0 1.8 6.0 1518 1205 A 105 LEU HG A 105 LEU HA 1.0 1.8 6.0 1519 1206 A 73 ARG HA A 73 ARG HG2 1.0 1.8 6.0 1520 1206 A 73 ARG HA A 73 ARG HG3 1.0 1.8 6.0 1521 1207 A 100 LEU HG A 98 LEU HD1% 1.0 1.8 6.0 1522 1208 A 53 ARG H A 53 ARG HGy 1.0 1.8 6.0 1523 1209 A 130 LEU H A 130 LEU HG 1.0 1.8 6.0 1524 1210 A 85 TYR HE% A 53 ARG HGx 1.0 1.8 6.5 1525 1211 A 42 LEU H A 42 LEU HG 1.0 1.8 6.0 1526 1212 A 85 TYR HD% A 53 ARG HGx 1.0 1.8 6.5 1527 1213 A 98 LEU H A 98 LEU HG 1.0 1.8 6.0 1528 1214 A 43 ASP H A 42 LEU HG 1.0 1.8 6.5 1529 1215 A 67 LYS HGx A 42 LEU HD2% 1.0 1.8 6.5 1530 1215 A 42 LEU HD1% A 67 LYS HGx 1.0 1.8 6.5 1531 1216 A 123 LYS H A 122 LYS HGx 1.0 1.8 6.0 1532 1217 A 98 LEU HA A 98 LEU HD2% 1.0 1.8 6.0 1533 1218 A 98 LEU HBy A 98 LEU HD2% 1.0 1.8 4.5 1534 1219 A 98 LEU H A 98 LEU HD2% 1.0 1.8 6.0 1535 1220 A 92 GLY H A 98 LEU HD2% 1.0 1.8 6.0 1536 1221 A 99 ASP H A 98 LEU HD2% 1.0 1.8 6.0 1537 1222 A 55 LYS HGy A 55 LYS H 1.0 1.8 6.0 1538 1223 A 128 LYS HGy A 128 LYS HA 1.0 1.8 6.0 1539 1224 A 55 LYS HGy A 56 ASP H 1.0 1.8 6.0 1540 1225 A 128 LYS HGy A 128 LYS HD2 1.0 1.8 4.5 1541 1225 A 128 LYS HGy A 128 LYS HD3 1.0 1.8 4.5 1542 1226 A 55 LYS HGy A 55 LYS HA 1.0 1.8 6.0 1543 1227 A 128 LYS HA A 128 LYS HGx 1.0 1.8 6.0 1544 1228 A 55 LYS HGx A 55 LYS H 1.0 1.8 6.0 1545 1229 A 55 LYS HGx A 55 LYS HA 1.0 1.8 6.0 1546 1230 A 105 LEU HD1% A 105 LEU HBx 1.0 1.8 4.5 1547 1231 A 124 TYR H A 123 LYS HGy 1.0 1.8 6.5 1548 1232 A 115 LYS H A 115 LYS HGy 1.0 1.8 6.0 1549 1233 A 52 SER HBx A 123 LYS HGy 1.0 1.8 6.0 1550 1234 A 59 LYS HGy A 59 LYS HE2 1.0 1.8 6.0 1551 1234 A 59 LYS HGy A 59 LYS HE3 1.0 1.8 6.0 1552 1235 A 123 LYS HGx A 123 LYS HA 1.0 1.8 6.0 1553 1236 A 124 TYR H A 123 LYS HGx 1.0 1.8 6.0 1554 1237 A 128 LYS H A 128 LYS HGx 1.0 1.8 6.0 1555 1238 A 96 LYS HA A 96 LYS HG2 1.0 1.8 6.0 1556 1238 A 96 LYS HG3 A 96 LYS HA 1.0 1.8 6.0 1557 1239 A 79 LYS H A 79 LYS HGx 1.0 1.8 6.0 1558 1240 A 85 TYR H A 84 LYS HGy 1.0 1.8 6.0 1559 1241 A 100 LEU H A 100 LEU HD2% 1.0 1.8 6.0 1560 1242 A 100 LEU HD2% A 100 LEU HA 1.0 1.8 4.5 1561 1243 A 59 LYS H A 59 LYS HGx 1.0 1.8 6.0 1562 1244 A 59 LYS HGx A 59 LYS HD2 1.0 1.8 3.0 1563 1244 A 59 LYS HD3 A 59 LYS HGx 1.0 1.8 3.0 1564 1245 A 102 PHE H A 105 LEU HD1% 1.0 1.8 6.0 1565 1246 A 84 LYS HGy A 84 LYS HA 1.0 1.8 6.0 1566 1247 A 100 LEU HD2% A 99 ASP HA 1.0 1.8 6.5 1567 1248 A 67 LYS HEx A 42 LEU HD2% 1.0 1.8 6.0 1568 1248 A 42 LEU HD1% A 67 LYS HEx 1.0 1.8 6.0 1569 1249 A 82 ARG H A 42 LEU HD2% 1.0 1.8 6.0 1570 1249 A 82 ARG H A 42 LEU HD1% 1.0 1.8 6.0 1571 1250 A 42 LEU HB3 A 42 LEU HD2% 1.0 1.8 4.5 1572 1250 A 42 LEU HB2 A 42 LEU HD2% 1.0 1.8 4.5 1573 1250 A 42 LEU HD1% A 42 LEU HB2 1.0 1.8 4.5 1574 1250 A 42 LEU HB3 A 42 LEU HD1% 1.0 1.8 4.5 1575 1251 A 81 ILE HG2% A 42 LEU HD2% 1.0 1.8 6.0 1576 1251 A 81 ILE HG2% A 42 LEU HD1% 1.0 1.8 6.0 1577 1252 A 42 LEU H A 42 LEU HD2% 1.0 1.8 6.0 1578 1252 A 42 LEU H A 42 LEU HD1% 1.0 1.8 6.0 1579 1253 A 43 ASP H A 42 LEU HD2% 1.0 1.8 6.0 1580 1253 A 43 ASP H A 42 LEU HD1% 1.0 1.8 6.0 1581 1254 A 42 LEU HD2% A 82 ARG HD2 1.0 1.8 6.0 1582 1254 A 42 LEU HD1% A 82 ARG HD2 1.0 1.8 6.0 1583 1254 A 82 ARG HD3 A 42 LEU HD2% 1.0 1.8 6.0 1584 1254 A 82 ARG HD3 A 42 LEU HD1% 1.0 1.8 6.0 1585 1255 A 42 LEU HD1% A 67 LYS HB2 1.0 1.8 6.0 1586 1255 A 42 LEU HD2% A 67 LYS HB2 1.0 1.8 6.0 1587 1255 A 67 LYS HB3 A 42 LEU HD2% 1.0 1.8 6.0 1588 1255 A 42 LEU HD1% A 67 LYS HB3 1.0 1.8 6.0 1589 1256 A 61 VAL HG1% A 42 LEU HD2% 1.0 1.8 6.0 1590 1256 A 61 VAL HG1% A 42 LEU HD1% 1.0 1.8 6.0 1591 1257 A 66 LYS HGy A 66 LYS HA 1.0 1.8 6.0 1592 1258 A 66 LYS HGx A 67 LYS H 1.0 1.8 6.0 1593 1259 A 136 LYS H A 136 LYS HGy 1.0 1.8 6.0 1594 1260 A 61 VAL H A 61 VAL HG2% 1.0 1.8 4.5 1595 1261 A 60 ASP H A 61 VAL HG2% 1.0 1.8 6.0 1596 1262 A 61 VAL HG2% A 62 GLN H 1.0 1.8 6.0 1597 1263 A 61 VAL HG2% A 44 ALA HA 1.0 1.8 6.0 1598 1264 A 61 VAL HG2% A 58 ARG HA 1.0 1.8 6.0 1599 1265 A 61 VAL HG2% A 61 VAL HA 1.0 1.8 4.5 1600 1266 A 134 LYS H A 134 LYS HGx 1.0 1.8 6.0 1601 1267 A 138 LYS H A 138 LYS HG2 1.0 1.8 6.0 1602 1267 A 138 LYS H A 138 LYS HG3 1.0 1.8 6.0 1603 1268 A 138 LYS HA A 138 LYS HG2 1.0 1.8 6.0 1604 1268 A 138 LYS HA A 138 LYS HG3 1.0 1.8 6.0 1605 1269 A 138 LYS HE2 A 138 LYS HG2 1.0 1.8 4.5 1606 1269 A 138 LYS HE3 A 138 LYS HG2 1.0 1.8 4.5 1607 1269 A 138 LYS HG3 A 138 LYS HE2 1.0 1.8 4.5 1608 1269 A 138 LYS HE3 A 138 LYS HG3 1.0 1.8 4.5 1609 1270 A 98 LEU HD1% A 99 ASP H 1.0 1.8 6.0 1610 1271 A 98 LEU HD1% A 92 GLY HAy 1.0 1.8 6.0 1611 1272 A 105 LEU HD2% A 105 LEU HBx 1.0 1.8 4.5 1612 1273 A 75 THR HG2% A 76 ALA H 1.0 1.8 6.0 1613 1274 A 75 THR HG2% A 68 TYR H 1.0 1.8 6.0 1614 1275 A 75 THR HG2% A 68 TYR HA 1.0 1.8 6.0 1615 1276 A 75 THR HG2% A 75 THR HA 1.0 1.8 4.5 1616 1277 A 75 THR HG2% A 69 ASP HBx 1.0 1.8 6.0 1617 1278 A 75 THR HG2% A 69 ASP HBy 1.0 1.8 6.0 1618 1279 A 112 ASP H A 111 VAL HG2% 1.0 1.8 6.0 1619 1280 A 90 VAL HG1% A 118 GLN HA 1.0 1.8 6.0 1620 1281 A 106 ALA H A 105 LEU HD2% 1.0 1.8 6.0 1621 1282 A 105 LEU H A 105 LEU HD2% 1.0 1.8 6.0 1622 1283 A 105 LEU HD2% A 105 LEU HA 1.0 1.8 4.5 1623 1284 A 104 THR H A 104 THR HG2% 1.0 1.8 4.5 1624 1285 A 104 THR HG2% A 104 THR HA 1.0 1.8 4.5 1625 1286 A 105 LEU H A 104 THR HG2% 1.0 1.8 6.0 1626 1287 A 75 THR HG2% A 69 ASP H 1.0 1.8 6.0 1627 1288 A 75 THR H A 75 THR HG2% 1.0 1.8 4.5 1628 1289 A 90 VAL H A 90 VAL HG1% 1.0 1.8 6.0 1629 1290 A 49 THR HG2% A 48 ARG HB2 1.0 1.8 6.0 1630 1290 A 48 ARG HB3 A 49 THR HG2% 1.0 1.8 6.0 1631 1291 A 34 GLN H A 33 THR HG2% 1.0 1.8 6.0 1632 1292 A 33 THR HG2% A 34 GLN HG2 1.0 1.8 6.0 1633 1292 A 34 GLN HG3 A 33 THR HG2% 1.0 1.8 6.0 1634 1293 A 89 VAL HG1% A 89 VAL HA 1.0 1.8 4.5 1635 1294 A 61 VAL HG1% A 61 VAL H 1.0 1.8 6.0 1636 1295 A 61 VAL HG1% A 62 GLN H 1.0 1.8 6.0 1637 1296 A 43 ASP HA A 61 VAL HG1% 1.0 1.8 6.0 1638 1297 A 61 VAL HG1% A 62 GLN HA 1.0 1.8 4.5 1639 1298 A 61 VAL HG1% A 67 LYS HEx 1.0 1.8 6.0 1640 1299 A 61 VAL HG1% A 42 LEU HB2 1.0 1.8 6.0 1641 1299 A 42 LEU HB3 A 61 VAL HG1% 1.0 1.8 6.0 1642 1300 A 49 THR HA A 49 THR HG2% 1.0 1.8 4.5 1643 1301 A 49 THR HG2% A 48 ARG HG2 1.0 1.8 6.0 1644 1301 A 48 ARG HG3 A 49 THR HG2% 1.0 1.8 6.0 1645 1302 A 50 ALA H A 49 THR HG2% 1.0 1.8 6.0 1646 1303 A 142 ASP HA A 141 VAL HG1% 1.0 1.8 6.0 1647 1303 A 141 VAL HG2% A 142 ASP HA 1.0 1.8 6.0 1648 1304 A 27 ASP HA A 28 VAL HG1% 1.0 1.8 6.0 1649 1304 A 28 VAL HG2% A 27 ASP HA 1.0 1.8 6.0 1650 1305 A 89 VAL HG2% A 89 VAL H 1.0 1.8 6.0 1651 1306 A 89 VAL HG2% A 91 TYR HD% 1.0 1.8 6.0 1652 1307 A 89 VAL HG2% A 91 TYR HE% 1.0 1.8 6.0 1653 1308 A 89 VAL HG2% A 89 VAL HA 1.0 1.8 4.5 1654 1309 A 89 VAL HG2% A 87 PRO HGx 1.0 1.8 6.0 1655 1310 A 89 VAL HG2% A 91 TYR HA 1.0 1.8 6.0 1656 1311 A 89 VAL HG2% A 90 VAL HG1% 1.0 1.8 6.5 1657 1312 A 140 VAL HG1% A 138 LYS HE2 1.0 1.8 6.0 1658 1312 A 138 LYS HE3 A 140 VAL HG1% 1.0 1.8 6.0 1659 1313 A 140 VAL HG1% A 138 LYS HD2 1.0 1.8 6.0 1660 1313 A 138 LYS HD3 A 140 VAL HG1% 1.0 1.8 6.0 1661 1314 A 140 VAL H A 140 VAL HG1% 1.0 1.8 4.5 1662 1315 A 141 VAL H A 140 VAL HG1% 1.0 1.8 6.0 1663 1316 A 140 VAL HA A 140 VAL HG1% 1.0 1.8 4.5 1664 1317 A 140 VAL HG1% A 138 LYS HB2 1.0 1.8 6.0 1665 1317 A 138 LYS HB3 A 140 VAL HG1% 1.0 1.8 6.0 1666 1318 A 111 VAL HG1% A 111 VAL H 1.0 1.8 4.5 1667 1319 A 108 ILE HA A 111 VAL HG1% 1.0 1.8 6.0 1668 1320 A 117 ALA H A 117 ALA HB% 1.0 1.8 4.5 1669 1321 A 134 LYS H A 133 ILE HG2% 1.0 1.8 6.0 1670 1322 A 133 ILE HG2% A 137 TYR HE% 1.0 1.8 4.5 1671 1323 A 80 GLY H A 78 ALA HB% 1.0 1.8 6.0 1672 1324 A 78 ALA HB% A 79 LYS H 1.0 1.8 4.5 1673 1325 A 75 THR HG2% A 78 ALA HB% 1.0 1.8 6.0 1674 1326 A 88 ALA H A 88 ALA HB% 1.0 1.8 4.5 1675 1327 A 89 VAL HG1% A 88 ALA HB% 1.0 1.8 6.0 1676 1328 A 63 ALA HB% A 63 ALA H 1.0 1.8 3.0 1677 1329 A 63 ALA HB% A 64 CYS H 1.0 1.8 6.0 1678 1330 A 63 ALA HB% A 60 ASP HA 1.0 1.8 4.5 1679 1331 A 137 TYR HBx A 133 ILE HG2% 1.0 1.8 6.0 1680 1332 A 75 THR H A 78 ALA HB% 1.0 1.8 6.0 1681 1333 A 133 ILE HG1y A 133 ILE HG2% 1.0 1.8 6.0 1682 1334 A 78 ALA HB% A 42 LEU HD2% 1.0 1.8 6.0 1683 1334 A 78 ALA HB% A 42 LEU HD1% 1.0 1.8 6.0 1684 1335 A 78 ALA H A 78 ALA HB% 1.0 1.8 4.5 1685 1336 A 81 ILE HD1% A 78 ALA HB% 1.0 1.8 6.0 1686 1337 A 88 ALA HB% A 118 GLN HE2y 1.0 1.8 6.0 1687 1338 A 88 ALA HB% A 118 GLN HE2x 1.0 1.8 6.5 1688 1339 A 89 VAL HG2% A 88 ALA HB% 1.0 1.8 6.5 1689 1340 A 81 ILE HG2% A 84 LYS HD2 1.0 1.8 6.5 1690 1340 A 81 ILE HG2% A 84 LYS HD3 1.0 1.8 6.5 1691 1341 A 84 LYS H A 81 ILE HG2% 1.0 1.8 6.5 1692 1342 A 81 ILE HG2% A 82 ARG H 1.0 1.8 6.0 1693 1343 A 81 ILE HG2% A 60 ASP HBx 1.0 1.8 6.0 1694 1344 A 81 ILE HG2% A 61 VAL H 1.0 1.8 6.0 1695 1345 A 81 ILE HG2% A 85 TYR HD% 1.0 1.8 6.0 1696 1346 A 81 ILE HG2% A 81 ILE HA 1.0 1.8 4.5 1697 1347 A 81 ILE HG2% A 61 VAL HA 1.0 1.8 6.0 1698 1348 A 81 ILE HG2% A 60 ASP HBy 1.0 1.8 6.0 1699 1349 A 44 ALA HB% A 61 VAL HG1% 1.0 1.8 6.0 1700 1350 A 44 ALA HB% A 44 ALA H 1.0 1.8 4.5 1701 1351 A 54 GLU H A 50 ALA HB% 1.0 1.8 6.0 1702 1352 A 50 ALA HB% A 47 CYS HA 1.0 1.8 6.0 1703 1353 A 54 GLU HA A 50 ALA HB% 1.0 1.8 4.5 1704 1354 A 47 CYS HBy A 50 ALA HB% 1.0 1.8 6.0 1705 1355 A 53 ARG HBy A 50 ALA HB% 1.0 1.8 6.0 1706 1356 A 54 GLU HBx A 50 ALA HB% 1.0 1.8 6.0 1707 1357 A 50 ALA H A 50 ALA HB% 1.0 1.8 4.5 1708 1358 A 47 CYS HBx A 50 ALA HB% 1.0 1.8 6.0 1709 1359 A 132 ALA HB% A 132 ALA H 1.0 1.8 3.0 1710 1360 A 133 ILE HD1% A 132 ALA HB% 1.0 1.8 6.0 1711 1361 A 76 ALA H A 76 ALA HB% 1.0 1.8 4.5 1712 1362 A 108 ILE HG2% A 108 ILE HD1% 1.0 1.8 4.5 1713 1363 A 108 ILE HA A 108 ILE HG2% 1.0 1.8 4.5 1714 1364 A 109 ARG HGy A 108 ILE HG2% 1.0 1.8 6.0 1715 1365 A 108 ILE HG2% A 108 ILE HG1y 1.0 1.8 4.5 1716 1365 A 108 ILE HG2% A 108 ILE HG1x 1.0 1.8 4.5 1717 1366 A 81 ILE HD1% A 61 VAL H 1.0 1.8 6.0 1718 1367 A 81 ILE HD1% A 81 ILE H 1.0 1.8 6.0 1719 1368 A 81 ILE HD1% A 64 CYS H 1.0 1.8 6.0 1720 1369 A 81 ILE HD1% A 60 ASP HA 1.0 1.8 6.0 1721 1370 A 81 ILE HD1% A 61 VAL HA 1.0 1.8 4.5 1722 1371 A 81 ILE HD1% A 81 ILE HG2% 1.0 1.8 4.5 1723 1372 A 117 ALA H A 133 ILE HD1% 1.0 1.8 6.0 1724 1373 A 116 ASP HBx A 133 ILE HD1% 1.0 1.8 6.0 1725 1374 A 133 ILE HD1% A 133 ILE HG2% 1.0 1.8 4.5 1726 1375 A 116 ASP H A 133 ILE HD1% 1.0 1.8 6.0 1727 1376 A 133 ILE HD1% A 133 ILE H 1.0 1.8 6.0 1728 1377 A 133 ILE HD1% A 116 ASP HA 1.0 1.8 6.0 1729 1378 A 133 ILE HD1% A 133 ILE HA 1.0 1.8 4.5 1730 1379 A 133 ILE HG2% A 137 TYR HD% 1.0 1.8 4.5 1731 1380 A 68 TYR HD% A 67 LYS HB2 1.0 1.8 6.0 1732 1380 A 68 TYR HD% A 67 LYS HB3 1.0 1.8 6.0 1733 1381 A 68 TYR HD% A 68 TYR HA 1.0 1.8 6.0 1734 1382 A 68 TYR HD% A 74 GLU HA 1.0 1.8 6.0 1735 1383 A 137 TYR HA A 137 TYR HD% 1.0 1.8 6.0 1736 1384 A 136 LYS HBy A 137 TYR HD% 1.0 1.8 6.0 1737 1385 A 109 ARG HBx A 137 TYR HD% 1.0 1.8 6.0 1738 1386 A 109 ARG HBy A 137 TYR HD% 1.0 1.8 6.0 1739 1387 A 109 ARG HBy A 137 TYR HE% 1.0 1.8 6.0 1740 1388 A 109 ARG HA A 137 TYR HE% 1.0 1.8 6.0 1741 1389 A 133 ILE HA A 137 TYR HE% 1.0 1.8 6.0 1742 1390 A 124 TYR HA A 124 TYR HD% 1.0 1.8 6.0 1743 1391 A 124 TYR HD% A 125 GLU HB2 1.0 1.8 6.0 1744 1391 A 125 GLU HB3 A 124 TYR HD% 1.0 1.8 6.0 1745 1392 A 93 TYR HE% A 94 ASP HA 1.0 1.8 6.0 1746 1393 A 93 TYR HE% A 101 GLY HAy 1.0 1.8 6.0 1747 1394 A 91 TYR HE% A 87 PRO HDy 1.0 1.8 6.0 1748 1395 A 91 TYR HE% A 87 PRO HGy 1.0 1.8 6.0 1749 1396 A 91 TYR HD% A 91 TYR HA 1.0 1.8 6.0 1750 1397 A 91 TYR HD% A 89 VAL HB 1.0 1.8 6.0 1751 1398 A 81 ILE HG2% A 85 TYR HE% 1.0 1.8 6.0 1752 1399 A 85 TYR HE% A 53 ARG HBx 1.0 1.8 6.0 1753 1400 A 85 TYR HE% A 84 LYS HD2 1.0 1.8 6.0 1754 1400 A 85 TYR HE% A 84 LYS HD3 1.0 1.8 6.0 1755 1401 A 85 TYR HE% A 81 ILE HA 1.0 1.8 6.0 1756 1402 A 85 TYR HE% A 57 CYS HA 1.0 1.8 6.0 1757 1403 A 85 TYR HE% A 53 ARG HBy 1.0 1.8 6.0 1758 1404 A 85 TYR HE% A 60 ASP HBy 1.0 1.8 6.0 1759 1405 A 85 TYR HD% A 53 ARG HBx 1.0 1.8 6.0 1760 1406 A 85 TYR HD% A 84 LYS HBy 1.0 1.8 6.0 1761 1407 A 85 TYR HE% A 84 LYS HBy 1.0 1.8 6.0 1762 1408 A 38 ASP H A 37 TYR HD% 1.0 1.8 6.0 1763 1409 A 37 TYR HD% A 39 GLY H 1.0 1.8 6.0 1764 1410 A 37 TYR HE% A 39 GLY H 1.0 1.8 6.0 1765 1411 A 35 TYR HD% A 40 LYS HA 1.0 1.8 4.5 1766 1412 A 35 TYR HD% A 38 ASP H 1.0 1.8 6.0 1767 1413 A 35 TYR HE% A 38 ASP HA 1.0 1.8 6.0 1768 1414 A 35 TYR HE% A 40 LYS HD2 1.0 1.8 6.0 1769 1414 A 35 TYR HE% A 40 LYS HD3 1.0 1.8 6.0 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 28 VAL C A 29 PHE N A 29 PHE CA A 29 PHE C 1.0 -237.6 28.7 PHI 2 2 A 29 PHE N A 29 PHE CA A 29 PHE C A 30 ASP N 1.0 104.9 199.3 PSI 3 3 A 29 PHE C A 30 ASP N A 30 ASP CA A 30 ASP C 1.0 -107.7 -54.5 PHI 4 4 A 30 ASP N A 30 ASP CA A 30 ASP C A 31 PRO N 1.0 121.5 173.5 PSI 5 5 A 39 GLY C A 40 LYS N A 40 LYS CA A 40 LYS C 1.0 -138.1 -57.9 PHI 6 6 A 40 LYS N A 40 LYS CA A 40 LYS C A 41 PRO N 1.0 65.2 176.0 PSI 7 7 A 41 PRO C A 42 LEU N A 42 LEU CA A 42 LEU C 1.0 -146.3 -56.6 PHI 8 8 A 42 LEU N A 42 LEU CA A 42 LEU C A 43 ASP N 1.0 92.8 157.5 PSI 9 9 A 42 LEU C A 43 ASP N A 43 ASP CA A 43 ASP C 1.0 -144.8 -52.1 PHI 10 10 A 43 ASP N A 43 ASP CA A 43 ASP C A 44 ALA N 1.0 130.9 198.3 PSI 11 11 A 43 ASP C A 44 ALA N A 44 ALA CA A 44 ALA C 1.0 -70.0 -50.0 PHI 12 12 A 44 ALA N A 44 ALA CA A 44 ALA C A 45 SER N 1.0 -51.3 -24.7 PSI 13 13 A 44 ALA C A 45 SER N A 45 SER CA A 45 SER C 1.0 -86.9 -53.8 PHI 14 14 A 45 SER N A 45 SER CA A 45 SER C A 46 PHE N 1.0 -46.3 -22.2 PSI 15 15 A 45 SER C A 46 PHE N A 46 PHE CA A 46 PHE C 1.0 -71.9 -51.9 PHI 16 16 A 46 PHE N A 46 PHE CA A 46 PHE C A 47 CYS N 1.0 -59.7 -29.1 PSI 17 17 A 46 PHE C A 47 CYS N A 47 CYS CA A 47 CYS C 1.0 -91.2 -40.1 PHI 18 18 A 47 CYS N A 47 CYS CA A 47 CYS C A 48 ARG N 1.0 -67.4 3.7 PSI 19 19 A 47 CYS C A 48 ARG N A 48 ARG CA A 48 ARG C 1.0 -74.2 -43.8 PHI 20 20 A 48 ARG N A 48 ARG CA A 48 ARG C A 49 THR N 1.0 -57.5 -12.5 PSI 21 21 A 48 ARG C A 49 THR N A 49 THR CA A 49 THR C 1.0 -139.3 -37.6 PHI 22 22 A 49 THR N A 49 THR CA A 49 THR C A 50 ALA N 1.0 -42.6 13.9 PSI 23 23 A 51 GLY C A 52 SER N A 52 SER CA A 52 SER C 1.0 -74.8 -54.4 PHI 24 24 A 52 SER N A 52 SER CA A 52 SER C A 53 ARG N 1.0 -48.0 2.2 PSI 25 25 A 52 SER C A 53 ARG N A 53 ARG CA A 53 ARG C 1.0 -133.3 -51.3 PHI 26 26 A 53 ARG N A 53 ARG CA A 53 ARG C A 54 GLU N 1.0 -56.7 62.7 PSI 27 27 A 53 ARG C A 54 GLU N A 54 GLU CA A 54 GLU C 1.0 -69.2 -49.2 PHI 28 28 A 54 GLU N A 54 GLU CA A 54 GLU C A 55 LYS N 1.0 -64.4 -29.5 PSI 29 29 A 54 GLU C A 55 LYS N A 55 LYS CA A 55 LYS C 1.0 -74.0 -54.0 PHI 30 30 A 55 LYS N A 55 LYS CA A 55 LYS C A 56 ASP N 1.0 -47.8 -27.8 PSI 31 31 A 55 LYS C A 56 ASP N A 56 ASP CA A 56 ASP C 1.0 -83.9 -54.6 PHI 32 32 A 56 ASP N A 56 ASP CA A 56 ASP C A 57 CYS N 1.0 -52.0 -25.6 PSI 33 33 A 56 ASP C A 57 CYS N A 57 CYS CA A 57 CYS C 1.0 -73.3 -53.3 PHI 34 34 A 57 CYS N A 57 CYS CA A 57 CYS C A 58 ARG N 1.0 -54.6 -26.6 PSI 35 35 A 57 CYS C A 58 ARG N A 58 ARG CA A 58 ARG C 1.0 -73.5 -53.5 PHI 36 36 A 58 ARG N A 58 ARG CA A 58 ARG C A 59 LYS N 1.0 -52.5 -32.5 PSI 37 37 A 58 ARG C A 59 LYS N A 59 LYS CA A 59 LYS C 1.0 -75.0 -55.0 PHI 38 38 A 59 LYS N A 59 LYS CA A 59 LYS C A 60 ASP N 1.0 -53.1 -33.1 PSI 39 39 A 59 LYS C A 60 ASP N A 60 ASP CA A 60 ASP C 1.0 -76.5 -56.5 PHI 40 40 A 60 ASP N A 60 ASP CA A 60 ASP C A 61 VAL N 1.0 -51.6 -31.6 PSI 41 41 A 60 ASP C A 61 VAL N A 61 VAL CA A 61 VAL C 1.0 -75.2 -55.2 PHI 42 42 A 61 VAL N A 61 VAL CA A 61 VAL C A 62 GLN N 1.0 -52.3 -32.3 PSI 43 43 A 61 VAL C A 62 GLN N A 62 GLN CA A 62 GLN C 1.0 -80.9 -52.3 PHI 44 44 A 62 GLN N A 62 GLN CA A 62 GLN C A 63 ALA N 1.0 -52.0 3.3 PSI 45 45 A 62 GLN C A 63 ALA N A 63 ALA CA A 63 ALA C 1.0 -105.3 -68.5 PHI 46 46 A 63 ALA N A 63 ALA CA A 63 ALA C A 64 CYS N 1.0 -44.7 17.9 PSI 47 47 A 63 ALA C A 64 CYS N A 64 CYS CA A 64 CYS C 1.0 -156.8 -50.7 PHI 48 48 A 64 CYS N A 64 CYS CA A 64 CYS C A 65 ASP N 1.0 -55.8 243.9 PSI 49 49 A 64 CYS C A 65 ASP N A 65 ASP CA A 65 ASP C 1.0 -104.7 -39.7 PHI 50 50 A 65 ASP N A 65 ASP CA A 65 ASP C A 66 LYS N 1.0 -57.6 9.1 PSI 51 51 A 67 LYS C A 68 TYR N A 68 TYR CA A 68 TYR C 1.0 -159.7 -84.5 PHI 52 52 A 68 TYR N A 68 TYR CA A 68 TYR C A 69 ASP N 1.0 140.4 160.4 PSI 53 53 A 68 TYR C A 69 ASP N A 69 ASP CA A 69 ASP C 1.0 -113.8 -72.4 PHI 54 54 A 69 ASP N A 69 ASP CA A 69 ASP C A 70 ASP N 1.0 147.6 195.8 PSI 55 55 A 69 ASP C A 70 ASP N A 70 ASP CA A 70 ASP C 1.0 -78.9 -47.3 PHI 56 56 A 70 ASP N A 70 ASP CA A 70 ASP C A 71 GLN N 1.0 -44.8 14.2 PSI 57 57 A 70 ASP C A 71 GLN N A 71 GLN CA A 71 GLN C 1.0 -116.8 -73.1 PHI 58 58 A 71 GLN N A 71 GLN CA A 71 GLN C A 72 GLY N 1.0 -27.8 20.7 PSI 59 59 A 71 GLN C A 72 GLY N A 72 GLY CA A 72 GLY C 1.0 61.8 124.2 PHI 60 60 A 72 GLY N A 72 GLY CA A 72 GLY C A 73 ARG N 1.0 -23.2 45.8 PSI 61 61 A 72 GLY C A 73 ARG N A 73 ARG CA A 73 ARG C 1.0 -200.4 31.2 PHI 62 62 A 73 ARG N A 73 ARG CA A 73 ARG C A 74 GLU N 1.0 104.4 166.9 PSI 63 63 A 73 ARG C A 74 GLU N A 74 GLU CA A 74 GLU C 1.0 -131.5 -29.5 PHI 64 64 A 74 GLU N A 74 GLU CA A 74 GLU C A 75 THR N 1.0 99.2 164.6 PSI 65 65 A 75 THR C A 76 ALA N A 76 ALA CA A 76 ALA C 1.0 -68.0 -45.6 PHI 66 66 A 76 ALA N A 76 ALA CA A 76 ALA C A 77 CYS N 1.0 -51.0 -25.3 PSI 67 67 A 76 ALA C A 77 CYS N A 77 CYS CA A 77 CYS C 1.0 -75.6 -55.6 PHI 68 68 A 77 CYS N A 77 CYS CA A 77 CYS C A 78 ALA N 1.0 -47.5 -27.5 PSI 69 69 A 77 CYS C A 78 ALA N A 78 ALA CA A 78 ALA C 1.0 -75.2 -55.2 PHI 70 70 A 78 ALA N A 78 ALA CA A 78 ALA C A 79 LYS N 1.0 -51.0 -31.0 PSI 71 71 A 78 ALA C A 79 LYS N A 79 LYS CA A 79 LYS C 1.0 -79.1 -49.0 PHI 72 72 A 79 LYS N A 79 LYS CA A 79 LYS C A 80 GLY N 1.0 -55.5 -23.5 PSI 73 73 A 79 LYS C A 80 GLY N A 80 GLY CA A 80 GLY C 1.0 -74.4 -54.4 PHI 74 74 A 80 GLY N A 80 GLY CA A 80 GLY C A 81 ILE N 1.0 -50.9 -30.9 PSI 75 75 A 80 GLY C A 81 ILE N A 81 ILE CA A 81 ILE C 1.0 -72.4 -52.4 PHI 76 76 A 81 ILE N A 81 ILE CA A 81 ILE C A 82 ARG N 1.0 -58.1 -28.3 PSI 77 77 A 81 ILE C A 82 ARG N A 82 ARG CA A 82 ARG C 1.0 -71.7 -48.8 PHI 78 78 A 82 ARG N A 82 ARG CA A 82 ARG C A 83 GLU N 1.0 -57.1 -25.9 PSI 79 79 A 82 ARG C A 83 GLU N A 83 GLU CA A 83 GLU C 1.0 -91.6 -52.3 PHI 80 80 A 83 GLU N A 83 GLU CA A 83 GLU C A 84 LYS N 1.0 -56.4 -23.7 PSI 81 81 A 83 GLU C A 84 LYS N A 84 LYS CA A 84 LYS C 1.0 -85.9 -45.6 PHI 82 82 A 84 LYS N A 84 LYS CA A 84 LYS C A 85 TYR N 1.0 -53.9 -18.5 PSI 83 83 A 84 LYS C A 85 TYR N A 85 TYR CA A 85 TYR C 1.0 -125.8 -71.2 PHI 84 84 A 85 TYR N A 85 TYR CA A 85 TYR C A 86 LYS N 1.0 -37.1 31.1 PSI 85 85 A 85 TYR C A 86 LYS N A 86 LYS CA A 86 LYS C 1.0 -126.1 -19.1 PHI 86 86 A 86 LYS N A 86 LYS CA A 86 LYS C A 87 PRO N 1.0 83.7 181.6 PSI 87 87 A 87 PRO C A 88 ALA N A 88 ALA CA A 88 ALA C 1.0 -144.1 -50.8 PHI 88 88 A 88 ALA N A 88 ALA CA A 88 ALA C A 89 VAL N 1.0 95.1 160.6 PSI 89 89 A 88 ALA C A 89 VAL N A 89 VAL CA A 89 VAL C 1.0 -162.9 -65.9 PHI 90 90 A 89 VAL N A 89 VAL CA A 89 VAL C A 90 VAL N 1.0 108.1 155.9 PSI 91 91 A 89 VAL C A 90 VAL N A 90 VAL CA A 90 VAL C 1.0 -141.2 -71.5 PHI 92 92 A 90 VAL N A 90 VAL CA A 90 VAL C A 91 TYR N 1.0 106.9 154.2 PSI 93 93 A 90 VAL C A 91 TYR N A 91 TYR CA A 91 TYR C 1.0 -141.2 -80.1 PHI 94 94 A 91 TYR N A 91 TYR CA A 91 TYR C A 92 GLY N 1.0 106.9 188.3 PSI 95 95 A 91 TYR C A 92 GLY N A 92 GLY CA A 92 GLY C 1.0 -116.8 -51.3 PHI 96 96 A 92 GLY N A 92 GLY CA A 92 GLY C A 93 TYR N 1.0 136.2 191.5 PSI 97 97 A 92 GLY C A 93 TYR N A 93 TYR CA A 93 TYR C 1.0 -78.2 -28.0 PHI 98 98 A 93 TYR N A 93 TYR CA A 93 TYR C A 94 ASP N 1.0 -64.4 -6.4 PSI 99 99 A 93 TYR C A 94 ASP N A 94 ASP CA A 94 ASP C 1.0 -105.9 -67.6 PHI 100 100 A 94 ASP N A 94 ASP CA A 94 ASP C A 95 GLY N 1.0 -16.0 33.3 PSI 101 101 A 94 ASP C A 95 GLY N A 95 GLY CA A 95 GLY C 1.0 68.0 102.6 PHI 102 102 A 95 GLY N A 95 GLY CA A 95 GLY C A 96 LYS N 1.0 -17.0 37.9 PSI 103 103 A 95 GLY C A 96 LYS N A 96 LYS CA A 96 LYS C 1.0 -141.4 -59.3 PHI 104 104 A 96 LYS N A 96 LYS CA A 96 LYS C A 97 PRO N 1.0 65.7 174.5 PSI 105 105 A 97 PRO C A 98 LEU N A 98 LEU CA A 98 LEU C 1.0 -145.4 -56.5 PHI 106 106 A 98 LEU N A 98 LEU CA A 98 LEU C A 99 ASP N 1.0 93.9 164.8 PSI 107 107 A 98 LEU C A 99 ASP N A 99 ASP CA A 99 ASP C 1.0 -128.3 -41.7 PHI 108 108 A 99 ASP N A 99 ASP CA A 99 ASP C A 100 LEU N 1.0 78.0 176.1 PSI 109 109 A 100 LEU C A 101 GLY N A 101 GLY CA A 101 GLY C 1.0 -75.5 -51.5 PHI 110 110 A 101 GLY N A 101 GLY CA A 101 GLY C A 102 PHE N 1.0 -49.6 -14.4 PSI 111 111 A 101 GLY C A 102 PHE N A 102 PHE CA A 102 PHE C 1.0 -101.3 -55.7 PHI 112 112 A 102 PHE N A 102 PHE CA A 102 PHE C A 103 CYS N 1.0 -37.9 16.3 PSI 113 113 A 102 PHE C A 103 CYS N A 103 CYS CA A 103 CYS C 1.0 -112.7 -42.8 PHI 114 114 A 103 CYS N A 103 CYS CA A 103 CYS C A 104 THR N 1.0 -64.3 41.9 PSI 115 115 A 103 CYS C A 104 THR N A 104 THR CA A 104 THR C 1.0 -82.7 -42.7 PHI 116 116 A 104 THR N A 104 THR CA A 104 THR C A 105 LEU N 1.0 -65.9 8.3 PSI 117 117 A 104 THR C A 105 LEU N A 105 LEU CA A 105 LEU C 1.0 -82.9 -58.6 PHI 118 118 A 105 LEU N A 105 LEU CA A 105 LEU C A 106 ALA N 1.0 -39.6 3.2 PSI 119 119 A 107 GLY C A 108 ILE N A 108 ILE CA A 108 ILE C 1.0 -79.7 -42.2 PHI 120 120 A 108 ILE N A 108 ILE CA A 108 ILE C A 109 ARG N 1.0 -52.9 -30.0 PSI 121 121 A 108 ILE C A 109 ARG N A 109 ARG CA A 109 ARG C 1.0 -110.5 -55.8 PHI 122 122 A 109 ARG N A 109 ARG CA A 109 ARG C A 110 GLU N 1.0 -59.6 1.1 PSI 123 123 A 109 ARG C A 110 GLU N A 110 GLU CA A 110 GLU C 1.0 -73.9 -48.6 PHI 124 124 A 110 GLU N A 110 GLU CA A 110 GLU C A 111 VAL N 1.0 -58.4 -33.6 PSI 125 125 A 110 GLU C A 111 VAL N A 111 VAL CA A 111 VAL C 1.0 -72.7 -49.0 PHI 126 126 A 111 VAL N A 111 VAL CA A 111 VAL C A 112 ASP N 1.0 -53.1 -27.7 PSI 127 127 A 111 VAL C A 112 ASP N A 112 ASP CA A 112 ASP C 1.0 -73.9 -53.9 PHI 128 128 A 112 ASP N A 112 ASP CA A 112 ASP C A 113 CYS N 1.0 -51.0 -31.0 PSI 129 129 A 112 ASP C A 113 CYS N A 113 CYS CA A 113 CYS C 1.0 -74.8 -54.8 PHI 130 130 A 113 CYS N A 113 CYS CA A 113 CYS C A 114 ARG N 1.0 -51.6 -31.6 PSI 131 131 A 113 CYS C A 114 ARG N A 114 ARG CA A 114 ARG C 1.0 -71.5 -50.9 PHI 132 132 A 114 ARG N A 114 ARG CA A 114 ARG C A 115 LYS N 1.0 -51.7 -31.7 PSI 133 133 A 114 ARG C A 115 LYS N A 115 LYS CA A 115 LYS C 1.0 -73.7 -53.7 PHI 134 134 A 115 LYS N A 115 LYS CA A 115 LYS C A 116 ASP N 1.0 -52.0 -32.0 PSI 135 135 A 115 LYS C A 116 ASP N A 116 ASP CA A 116 ASP C 1.0 -77.0 -54.3 PHI 136 136 A 116 ASP N A 116 ASP CA A 116 ASP C A 117 ALA N 1.0 -59.7 -18.2 PSI 137 137 A 116 ASP C A 117 ALA N A 117 ALA CA A 117 ALA C 1.0 -72.8 -52.8 PHI 138 138 A 117 ALA N A 117 ALA CA A 117 ALA C A 118 GLN N 1.0 -50.2 -30.2 PSI 139 139 A 117 ALA C A 118 GLN N A 118 GLN CA A 118 GLN C 1.0 -77.7 -53.7 PHI 140 140 A 118 GLN N A 118 GLN CA A 118 GLN C A 119 THR N 1.0 -57.3 -12.2 PSI 141 141 A 118 GLN C A 119 THR N A 119 THR CA A 119 THR C 1.0 -105.1 -39.8 PHI 142 142 A 119 THR N A 119 THR CA A 119 THR C A 120 CYS N 1.0 -62.1 -15.0 PSI 143 143 A 119 THR C A 120 CYS N A 120 CYS CA A 120 CYS C 1.0 -115.2 -41.4 PHI 144 144 A 120 CYS N A 120 CYS CA A 120 CYS C A 121 ASP N 1.0 -75.1 40.9 PSI 145 145 A 120 CYS C A 121 ASP N A 121 ASP CA A 121 ASP C 1.0 -81.9 -46.3 PHI 146 146 A 121 ASP N A 121 ASP CA A 121 ASP C A 122 LYS N 1.0 -53.9 -17.3 PSI 147 147 A 121 ASP C A 122 LYS N A 122 LYS CA A 122 LYS C 1.0 -121.2 -37.9 PHI 148 148 A 122 LYS N A 122 LYS CA A 122 LYS C A 123 LYS N 1.0 -63.2 21.2 PSI 149 149 A 122 LYS C A 123 LYS N A 123 LYS CA A 123 LYS C 1.0 -126.8 -37.6 PHI 150 150 A 123 LYS N A 123 LYS CA A 123 LYS C A 124 TYR N 1.0 -68.5 34.1 PSI 151 151 A 123 LYS C A 124 TYR N A 124 TYR CA A 124 TYR C 1.0 -89.1 -41.8 PHI 152 152 A 124 TYR N A 124 TYR CA A 124 TYR C A 125 GLU N 1.0 -81.0 13.8 PSI 153 153 A 124 TYR C A 125 GLU N A 125 GLU CA A 125 GLU C 1.0 -120.6 -34.0 PHI 154 154 A 125 GLU N A 125 GLU CA A 125 GLU C A 126 SER N 1.0 -75.9 43.4 PSI 155 155 A 125 GLU C A 126 SER N A 126 SER CA A 126 SER C 1.0 -78.4 -50.1 PHI 156 156 A 126 SER N A 126 SER CA A 126 SER C A 127 ASP N 1.0 -58.1 -20.3 PSI 157 157 A 126 SER C A 127 ASP N A 127 ASP CA A 127 ASP C 1.0 -73.9 -53.9 PHI 158 158 A 127 ASP N A 127 ASP CA A 127 ASP C A 128 LYS N 1.0 -51.0 -25.5 PSI 159 159 A 127 ASP C A 128 LYS N A 128 LYS CA A 128 LYS C 1.0 -74.6 -53.0 PHI 160 160 A 128 LYS N A 128 LYS CA A 128 LYS C A 129 CYS N 1.0 -57.5 -31.3 PSI 161 161 A 128 LYS C A 129 CYS N A 129 CYS CA A 129 CYS C 1.0 -77.3 -49.5 PHI 162 162 A 129 CYS N A 129 CYS CA A 129 CYS C A 130 LEU N 1.0 -50.6 -30.6 PSI 163 163 A 129 CYS C A 130 LEU N A 130 LEU CA A 130 LEU C 1.0 -75.2 -55.2 PHI 164 164 A 130 LEU N A 130 LEU CA A 130 LEU C A 131 ASN N 1.0 -49.4 -29.4 PSI 165 165 A 130 LEU C A 131 ASN N A 131 ASN CA A 131 ASN C 1.0 -73.5 -53.5 PHI 166 166 A 131 ASN N A 131 ASN CA A 131 ASN C A 132 ALA N 1.0 -56.8 -26.5 PSI 167 167 A 131 ASN C A 132 ALA N A 132 ALA CA A 132 ALA C 1.0 -75.7 -54.5 PHI 168 168 A 132 ALA N A 132 ALA CA A 132 ALA C A 133 ILE N 1.0 -51.3 -27.0 PSI 169 169 A 132 ALA C A 133 ILE N A 133 ILE CA A 133 ILE C 1.0 -86.3 -49.2 PHI 170 170 A 133 ILE N A 133 ILE CA A 133 ILE C A 134 LYS N 1.0 -49.5 -29.5 PSI 171 171 A 133 ILE C A 134 LYS N A 134 LYS CA A 134 LYS C 1.0 -74.5 -48.8 PHI 172 172 A 134 LYS N A 134 LYS CA A 134 LYS C A 135 GLU N 1.0 -54.7 -27.3 PSI 173 173 A 134 LYS C A 135 GLU N A 135 GLU CA A 135 GLU C 1.0 -75.5 -55.5 PHI 174 174 A 135 GLU N A 135 GLU CA A 135 GLU C A 136 LYS N 1.0 -65.0 -10.5 PSI 175 175 A 135 GLU C A 136 LYS N A 136 LYS CA A 136 LYS C 1.0 -79.0 -54.2 PHI 176 176 A 136 LYS N A 136 LYS CA A 136 LYS C A 137 TYR N 1.0 -52.6 -15.6 PSI 177 177 A 136 LYS C A 137 TYR N A 137 TYR CA A 137 TYR C 1.0 -115.1 -73.2 PHI 178 178 A 137 TYR N A 137 TYR CA A 137 TYR C A 138 LYS N 1.0 -33.0 32.0 PSI 179 179 A 137 TYR C A 138 LYS N A 138 LYS CA A 138 LYS C 1.0 -99.0 -34.2 PHI 180 180 A 138 LYS N A 138 LYS CA A 138 LYS C A 139 PRO N 1.0 110.3 168.5 PSI 181 181 A 140 VAL C A 141 VAL N A 141 VAL CA A 141 VAL C 1.0 -159.8 -41.1 PHI 182 182 A 141 VAL N A 141 VAL CA A 141 VAL C A 142 ASP N 1.0 97.5 184.8 PSI 183 183 A 141 VAL C A 142 ASP N A 142 ASP CA A 142 ASP C 1.0 -101.8 -51.8 PHI 184 184 A 142 ASP N A 142 ASP CA A 142 ASP C A 143 PRO N 1.0 105.2 174.4 PSI 185 185 A 143 PRO C A 144 ASN N A 144 ASN CA A 144 ASN C 1.0 -133.1 -46.1 PHI 186 186 A 144 ASN N A 144 ASN CA A 144 ASN C A 145 PRO N 1.0 97.5 183.2 PSI stop_ save_ save_CNS/XPLOR_dipolar_coupling_4 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_4 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 58 ARG N A 58 ARG H 1.0 . . . 2 2 A 59 LYS N A 59 LYS H 1.0 . . . 3 3 A 60 ASP N A 60 ASP H 1.0 . . . 4 4 A 61 VAL N A 61 VAL H 1.0 . . . 5 5 A 62 GLN N A 62 GLN H 1.0 . . . 6 6 A 63 ALA N A 63 ALA H 1.0 . . . 7 7 A 66 LYS N A 66 LYS H 1.0 . . . 8 8 A 67 LYS N A 67 LYS H 1.0 . . . 9 9 A 68 TYR N A 68 TYR H 1.0 . . . 10 10 A 69 ASP N A 69 ASP H 1.0 . . . 11 11 A 70 ASP N A 70 ASP H 1.0 . . . 12 12 A 71 GLN N A 71 GLN H 1.0 . . . 13 13 A 73 ARG N A 73 ARG H 1.0 . . . 14 14 A 76 ALA N A 76 ALA H 1.0 . . . 15 15 A 77 CYS N A 77 CYS H 1.0 . . . 16 16 A 78 ALA N A 78 ALA H 1.0 . . . 17 17 A 79 LYS N A 79 LYS H 1.0 . . . 18 18 A 80 GLY N A 80 GLY H 1.0 . . . 19 19 A 81 ILE N A 81 ILE H 1.0 . . . 20 20 A 82 ARG N A 82 ARG H 1.0 . . . 21 21 A 111 VAL N A 111 VAL H 1.0 . . . 22 22 A 113 CYS N A 113 CYS H 1.0 . . . 23 23 A 114 ARG N A 114 ARG H 1.0 . . . 24 24 A 115 LYS N A 115 LYS H 1.0 . . . 25 25 A 116 ASP N A 116 ASP H 1.0 . . . 26 26 A 118 GLN N A 118 GLN H 1.0 . . . 27 27 A 119 THR N A 119 THR H 1.0 . . . 28 28 A 120 CYS N A 120 CYS H 1.0 . . . 29 29 A 123 LYS N A 123 LYS H 1.0 . . . 30 30 A 126 SER N A 126 SER H 1.0 . . . 31 31 A 127 ASP N A 127 ASP H 1.0 . . . 32 32 A 128 LYS N A 128 LYS H 1.0 . . . 33 33 A 129 CYS N A 129 CYS H 1.0 . . . 34 34 A 130 LEU N A 130 LEU H 1.0 . . . 35 35 A 131 ASN N A 131 ASN H 1.0 . . . 36 36 A 132 ALA N A 132 ALA H 1.0 . . . 37 37 A 133 ILE N A 133 ILE H 1.0 . . . 38 38 A 134 LYS N A 134 LYS H 1.0 . . . 39 39 A 135 GLU N A 135 GLU H 1.0 . . . 40 40 A 136 LYS N A 136 LYS H 1.0 . . . 41 41 A 137 TYR N A 137 TYR H 1.0 . . . stop_ save_