data_nef_c19939_2moe 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 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 2MOE stop_ 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 2 4 DT O3' 2 5 5CM P 2 5 5CM O3' 2 6 DG P 3 4 DC O3' 3 5 5CM P 3 5 5CM O3' 3 6 DG P 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 78 GLY start . false 2 A 79 SER middle . . 3 A 80 THR middle . . 4 A 81 GLU middle . . 5 A 82 CYS middle . . 6 A 83 ARG middle . . 7 A 84 LYS middle . . 8 A 85 SER middle . . 9 A 86 VAL middle . . 10 A 87 PRO middle . false 11 A 88 CYS middle . . 12 A 89 GLY middle . false 13 A 90 TRP middle . . 14 A 91 GLU middle . . 15 A 92 ARG middle . . 16 A 93 VAL middle . . 17 A 94 VAL middle . . 18 A 95 LYS middle . . 19 A 96 GLN middle . . 20 A 97 ARG middle . . 21 A 98 LEU middle . . 22 A 99 PHE middle . . 23 A 100 GLY middle . false 24 A 101 LYS middle . . 25 A 102 THR middle . . 26 A 103 ALA middle . . 27 A 104 GLY middle . false 28 A 105 ARG middle . . 29 A 106 PHE middle . . 30 A 107 ASP middle . . 31 A 108 VAL middle . . 32 A 109 TYR middle . . 33 A 110 PHE middle . . 34 A 111 ILE middle . . 35 A 112 SER middle . . 36 A 113 PRO middle . false 37 A 114 GLN middle . . 38 A 115 GLY middle . false 39 A 116 LEU middle . . 40 A 117 LYS middle . . 41 A 118 PHE middle . . 42 A 119 ARG middle . . 43 A 120 SER middle . . 44 A 121 LYS middle . . 45 A 122 SER middle . . 46 A 123 SER middle . . 47 A 124 LEU middle . . 48 A 125 ALA middle . . 49 A 126 ASN middle . . 50 A 127 TYR middle . . 51 A 128 LEU middle . . 52 A 129 HIS middle . . 53 A 130 LYS middle . . 54 A 131 ASN middle . . 55 A 132 GLY middle . false 56 A 133 GLU middle . . 57 A 134 THR middle . . 58 A 135 SER middle . . 59 A 136 LEU middle . . 60 A 137 LYS middle . . 61 A 138 PRO middle . false 62 A 139 GLU middle . . 63 A 140 ASP middle . . 64 A 141 PHE middle . . 65 A 142 ASP middle . . 66 A 143 PHE middle . . 67 A 144 THR middle . . 68 A 145 VAL middle . . 69 A 146 LEU middle . . 70 A 147 SER middle . . 71 A 148 LYS end . . 72 B 201 DG start . . 73 B 202 DG middle . . 74 B 203 DA middle . . 75 B 204 DT middle . . 76 B 205 5CM middle . . 77 B 206 DG middle . . 78 B 207 DG middle . . 79 B 208 DC middle . . 80 B 209 DT middle . . 81 B 210 DC end . . 82 C 211 DG start . . 83 C 212 DA middle . . 84 C 213 DG middle . . 85 C 214 DC middle . . 86 C 215 5CM middle . . 87 C 216 DG middle . . 88 C 217 DA middle . . 89 C 218 DT middle . . 90 C 219 DC middle . . 91 C 220 DC end . . stop_ save_ save_MBD4mbd_chemshift _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode MBD4mbd_chemshift 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 79 SER C C 13 174.960 0.000 A 79 SER CA C 13 58.539 0.000 A 79 SER CB C 13 64.005 0.000 A 80 THR H H 1 8.340 0.009 A 80 THR HA H 1 4.389 0.001 A 80 THR HB H 1 4.271 0.014 A 80 THR HG2% H 1 1.215 0.002 A 80 THR C C 13 174.574 0.000 A 80 THR CA C 13 62.123 0.054 A 80 THR CB C 13 69.660 0.088 A 80 THR CG2 C 13 21.652 0.032 A 80 THR N N 15 115.664 0.139 A 81 GLU H H 1 8.434 0.013 A 81 GLU HA H 1 4.315 0.014 A 81 GLU HBx H 1 1.975 0.009 A 81 GLU HBy H 1 2.055 0.000 A 81 GLU HGy H 1 2.328 0.000 A 81 GLU HGx H 1 2.252 0.017 A 81 GLU C C 13 176.123 0.000 A 81 GLU CA C 13 56.672 0.000 A 81 GLU CB C 13 30.260 0.000 A 81 GLU CG C 13 36.338 0.000 A 81 GLU N N 15 123.120 0.167 A 82 CYS H H 1 8.392 0.001 A 82 CYS HA H 1 4.485 0.005 A 82 CYS HB3 H 1 2.897 0.014 A 82 CYS C C 13 174.341 0.000 A 82 CYS CA C 13 58.456 0.092 A 82 CYS CB C 13 27.989 0.067 A 82 CYS N N 15 120.924 0.040 A 83 ARG H H 1 8.478 0.001 A 83 ARG HA H 1 4.367 0.019 A 83 ARG HBy H 1 1.901 0.000 A 83 ARG HBx H 1 1.788 0.024 A 83 ARG HD2 H 1 3.213 0.002 A 83 ARG HE H 1 7.277 0.000 A 83 ARG HG3 H 1 1.643 0.023 A 83 ARG C C 13 176.140 0.000 A 83 ARG CA C 13 56.268 0.053 A 83 ARG CB C 13 30.862 0.000 A 83 ARG CD C 13 43.310 0.041 A 83 ARG CG C 13 27.099 0.018 A 83 ARG N N 15 124.156 0.018 A 83 ARG NE N 15 84.747 0.000 A 84 LYS H H 1 8.413 0.006 A 84 LYS C C 13 176.555 0.000 A 84 LYS CA C 13 55.975 0.080 A 84 LYS CB C 13 33.334 0.005 A 84 LYS N N 15 122.766 0.010 A 85 SER H H 1 8.440 0.002 A 85 SER HA H 1 4.408 0.008 A 85 SER HB3 H 1 3.810 0.006 A 85 SER C C 13 173.669 0.000 A 85 SER CA C 13 58.288 0.094 A 85 SER CB C 13 63.932 0.070 A 85 SER N N 15 118.305 0.039 A 86 VAL H H 1 8.279 0.005 A 86 VAL HA H 1 4.285 0.008 A 86 VAL HB H 1 2.103 0.005 A 86 VAL HG1% H 1 1.093 0.011 A 86 VAL HG2% H 1 1.088 0.011 A 86 VAL CA C 13 60.169 0.061 A 86 VAL CB C 13 33.380 0.042 A 86 VAL CG1 C 13 21.489 0.002 A 86 VAL CG2 C 13 22.062 0.002 A 86 VAL N N 15 123.628 0.015 A 87 PRO HA H 1 4.201 0.000 A 87 PRO HBy H 1 2.044 0.000 A 87 PRO HBx H 1 1.478 0.004 A 87 PRO HDx H 1 2.684 0.007 A 87 PRO HDy H 1 3.449 0.005 A 87 PRO HGy H 1 1.164 0.000 A 87 PRO HGx H 1 0.591 0.000 A 87 PRO C C 13 175.673 0.000 A 87 PRO CA C 13 63.622 0.000 A 87 PRO CB C 13 32.040 0.000 A 87 PRO CD C 13 51.058 0.062 A 87 PRO CG C 13 27.249 0.025 A 88 CYS H H 1 8.393 0.001 A 88 CYS HA H 1 4.244 0.010 A 88 CYS HB3 H 1 2.979 0.005 A 88 CYS C C 13 176.345 0.000 A 88 CYS CA C 13 61.162 0.016 A 88 CYS CB C 13 26.920 0.060 A 88 CYS N N 15 120.983 0.013 A 89 GLY H H 1 9.011 0.007 A 89 GLY HAx H 1 3.777 0.010 A 89 GLY HAy H 1 4.415 0.005 A 89 GLY C C 13 174.168 0.000 A 89 GLY CA C 13 45.450 0.056 A 89 GLY N N 15 115.997 0.014 A 90 TRP H H 1 8.406 0.006 A 90 TRP HA H 1 4.972 0.015 A 90 TRP HBx H 1 3.279 0.006 A 90 TRP HBy H 1 3.445 0.008 A 90 TRP HD1 H 1 7.269 0.018 A 90 TRP HE1 H 1 10.486 0.009 A 90 TRP HH2 H 1 6.627 0.005 A 90 TRP HZ2 H 1 7.556 0.005 A 90 TRP HZ3 H 1 6.819 0.000 A 90 TRP C C 13 175.327 0.000 A 90 TRP CA C 13 57.469 0.042 A 90 TRP CB C 13 29.505 0.041 A 90 TRP CD1 C 13 127.192 0.000 A 90 TRP CH2 C 13 124.264 0.006 A 90 TRP CZ2 C 13 114.402 0.000 A 90 TRP CZ3 C 13 121.602 0.000 A 90 TRP N N 15 121.603 0.031 A 90 TRP NE1 N 15 131.308 0.024 A 91 GLU H H 1 8.963 0.010 A 91 GLU HA H 1 4.851 0.005 A 91 GLU HBy H 1 1.969 0.009 A 91 GLU HBx H 1 1.883 0.013 A 91 GLU HGx H 1 2.092 0.013 A 91 GLU HGy H 1 2.254 0.013 A 91 GLU C C 13 174.309 0.000 A 91 GLU CA C 13 55.065 0.002 A 91 GLU CB C 13 33.413 0.010 A 91 GLU CG C 13 36.002 0.072 A 91 GLU N N 15 119.691 0.034 A 92 ARG H H 1 8.944 0.001 A 92 ARG HA H 1 4.435 0.004 A 92 ARG HBx H 1 1.190 0.017 A 92 ARG HBy H 1 1.697 0.001 A 92 ARG HD2 H 1 3.002 0.010 A 92 ARG HE H 1 7.130 0.003 A 92 ARG HGy H 1 0.858 0.009 A 92 ARG HGx H 1 0.334 0.007 A 92 ARG C C 13 174.635 0.000 A 92 ARG CA C 13 54.831 0.080 A 92 ARG CB C 13 33.153 0.103 A 92 ARG CD C 13 43.424 0.069 A 92 ARG CG C 13 28.006 0.059 A 92 ARG N N 15 126.749 0.027 A 92 ARG NE N 15 83.817 0.141 A 93 VAL H H 1 9.096 0.013 A 93 VAL HA H 1 4.129 0.005 A 93 VAL HB H 1 1.178 0.009 A 93 VAL HG1% H 1 0.811 0.014 A 93 VAL HG2% H 1 0.732 0.007 A 93 VAL C C 13 173.391 0.000 A 93 VAL CA C 13 61.554 0.050 A 93 VAL CB C 13 34.326 0.039 A 93 VAL CG1 C 13 21.245 0.065 A 93 VAL CG2 C 13 20.828 0.001 A 93 VAL N N 15 130.450 0.026 A 94 VAL H H 1 8.341 0.013 A 94 VAL HA H 1 4.655 0.000 A 94 VAL HB H 1 1.940 0.007 A 94 VAL HG2% H 1 1.430 0.002 A 94 VAL C C 13 175.830 0.000 A 94 VAL CA C 13 61.295 0.000 A 94 VAL CB C 13 33.064 0.037 A 94 VAL CG2 C 13 21.429 0.000 A 94 VAL N N 15 125.534 0.016 A 95 LYS H H 1 9.158 0.003 A 95 LYS HA H 1 4.884 0.006 A 95 LYS HBx H 1 1.832 0.008 A 95 LYS HBy H 1 1.996 0.010 A 95 LYS HD3 H 1 1.820 0.010 A 95 LYS HEx H 1 3.089 0.002 A 95 LYS HEy H 1 3.157 0.000 A 95 LYS HGx H 1 1.420 0.008 A 95 LYS HGy H 1 1.510 0.009 A 95 LYS C C 13 175.169 0.000 A 95 LYS CA C 13 54.736 0.023 A 95 LYS CB C 13 36.190 0.027 A 95 LYS CD C 13 28.944 0.000 A 95 LYS CE C 13 42.212 0.000 A 95 LYS CG C 13 25.301 0.033 A 95 LYS N N 15 128.357 0.053 A 96 GLN H H 1 8.943 0.011 A 96 GLN HA H 1 4.470 0.015 A 96 GLN HB3 H 1 1.831 0.006 A 96 GLN HE21 H 1 6.833 0.002 A 96 GLN HE22 H 1 7.169 0.004 A 96 GLN HGx H 1 1.187 0.006 A 96 GLN HGy H 1 1.990 0.007 A 96 GLN C C 13 175.665 0.000 A 96 GLN CA C 13 54.807 0.028 A 96 GLN CB C 13 30.119 0.054 A 96 GLN CG C 13 33.467 0.072 A 96 GLN N N 15 128.341 0.065 A 96 GLN NE2 N 15 112.486 0.071 A 97 ARG H H 1 9.117 0.005 A 97 ARG HA H 1 4.439 0.008 A 97 ARG HBx H 1 1.836 0.007 A 97 ARG HBy H 1 1.847 0.012 A 97 ARG HDx H 1 2.831 0.007 A 97 ARG HDy H 1 3.002 0.012 A 97 ARG HE H 1 9.596 0.005 A 97 ARG HG3 H 1 1.624 0.019 A 97 ARG C C 13 178.214 0.000 A 97 ARG CA C 13 57.719 0.038 A 97 ARG CB C 13 30.325 0.069 A 97 ARG CD C 13 44.377 0.046 A 97 ARG CG C 13 26.965 0.023 A 97 ARG N N 15 127.147 0.033 A 97 ARG NE N 15 84.100 0.046 A 98 LEU H H 1 9.054 0.006 A 98 LEU HA H 1 4.342 0.008 A 98 LEU HBy H 1 1.457 0.007 A 98 LEU HBx H 1 0.954 0.012 A 98 LEU HD1% H 1 0.679 0.008 A 98 LEU HG H 1 0.900 0.008 A 98 LEU C C 13 176.647 0.000 A 98 LEU CA C 13 55.683 0.042 A 98 LEU CB C 13 44.063 0.021 A 98 LEU CD1 C 13 22.496 0.019 A 98 LEU CG C 13 25.094 0.028 A 98 LEU N N 15 125.934 0.018 A 99 PHE H H 1 8.245 0.004 A 99 PHE HA H 1 4.951 0.006 A 99 PHE HBy H 1 3.226 0.007 A 99 PHE HBx H 1 3.001 0.009 A 99 PHE HDx H 1 7.336 0.018 A 99 PHE HDy H 1 7.336 0.018 A 99 PHE C C 13 173.854 0.000 A 99 PHE CA C 13 56.704 0.049 A 99 PHE CB C 13 42.755 0.023 A 99 PHE CDx C 13 132.583 0.031 A 99 PHE CDy C 13 132.583 0.031 A 99 PHE N N 15 119.325 0.037 A 100 GLY H H 1 8.111 0.002 A 100 GLY HAx H 1 3.760 0.008 A 100 GLY HAy H 1 4.541 0.011 A 100 GLY C C 13 176.173 0.000 A 100 GLY CA C 13 44.124 0.038 A 100 GLY N N 15 104.714 0.021 A 101 LYS H H 1 9.134 0.003 A 101 LYS HA H 1 4.112 0.006 A 101 LYS HB3 H 1 2.000 0.011 A 101 LYS HD3 H 1 1.821 0.013 A 101 LYS HE3 H 1 3.079 0.013 A 101 LYS HGx H 1 1.595 0.010 A 101 LYS HGy H 1 1.663 0.013 A 101 LYS C C 13 179.615 0.000 A 101 LYS CA C 13 59.670 0.037 A 101 LYS CB C 13 32.774 0.026 A 101 LYS CD C 13 29.842 0.034 A 101 LYS CE C 13 41.760 0.000 A 101 LYS CG C 13 25.351 0.019 A 101 LYS N N 15 122.597 0.016 A 102 THR H H 1 8.982 0.011 A 102 THR HA H 1 4.339 0.005 A 102 THR HB H 1 4.462 0.011 A 102 THR HG2% H 1 1.374 0.014 A 102 THR C C 13 172.966 0.000 A 102 THR CA C 13 61.304 0.039 A 102 THR CB C 13 68.948 0.064 A 102 THR CG2 C 13 21.657 0.069 A 102 THR N N 15 108.650 0.022 A 103 ALA H H 1 6.932 0.005 A 103 ALA HA H 1 3.367 0.008 A 103 ALA HB% H 1 1.066 0.007 A 103 ALA C C 13 178.082 0.000 A 103 ALA CA C 13 54.115 0.021 A 103 ALA CB C 13 17.941 0.027 A 103 ALA N N 15 123.171 0.023 A 104 GLY H H 1 8.545 0.003 A 104 GLY HAy H 1 4.482 0.014 A 104 GLY HAx H 1 3.418 0.014 A 104 GLY C C 13 175.274 0.000 A 104 GLY CA C 13 44.484 0.029 A 104 GLY N N 15 111.443 0.032 A 105 ARG H H 1 7.646 0.004 A 105 ARG HA H 1 4.417 0.008 A 105 ARG HBx H 1 1.916 0.004 A 105 ARG HBy H 1 1.969 0.010 A 105 ARG HDx H 1 3.064 0.006 A 105 ARG HDy H 1 3.216 0.002 A 105 ARG HE H 1 6.977 0.008 A 105 ARG HGy H 1 1.903 0.004 A 105 ARG HGx H 1 1.803 0.002 A 105 ARG C C 13 174.184 0.000 A 105 ARG CA C 13 56.744 0.047 A 105 ARG CB C 13 30.741 0.069 A 105 ARG CD C 13 43.207 0.035 A 105 ARG CG C 13 26.793 0.060 A 105 ARG N N 15 119.647 0.055 A 105 ARG NE N 15 82.056 0.056 A 106 PHE H H 1 8.745 0.003 A 106 PHE HA H 1 5.423 0.009 A 106 PHE HBy H 1 2.899 0.008 A 106 PHE HBx H 1 2.753 0.013 A 106 PHE HDx H 1 7.149 0.005 A 106 PHE HDy H 1 7.149 0.005 A 106 PHE C C 13 175.443 0.000 A 106 PHE CA C 13 57.188 0.074 A 106 PHE CB C 13 42.528 0.051 A 106 PHE N N 15 117.619 0.016 A 107 ASP H H 1 8.858 0.007 A 107 ASP HA H 1 5.178 0.013 A 107 ASP HBx H 1 2.461 0.010 A 107 ASP HBy H 1 2.521 0.000 A 107 ASP C C 13 173.615 0.000 A 107 ASP CA C 13 53.703 0.085 A 107 ASP CB C 13 45.290 0.000 A 107 ASP N N 15 119.340 0.033 A 108 VAL H H 1 8.550 0.005 A 108 VAL HA H 1 4.913 0.014 A 108 VAL HB H 1 1.971 0.008 A 108 VAL HGx% H 1 0.838 0.010 A 108 VAL HGy% H 1 0.533 0.008 A 108 VAL C C 13 174.762 0.000 A 108 VAL CA C 13 60.832 0.016 A 108 VAL CB C 13 33.939 0.022 A 108 VAL CGy C 13 22.444 0.006 A 108 VAL CGx C 13 21.783 0.010 A 108 VAL N N 15 121.639 0.013 A 109 TYR H H 1 8.894 0.005 A 109 TYR HA H 1 5.419 0.015 A 109 TYR HBx H 1 2.899 0.000 A 109 TYR HBy H 1 3.018 0.021 A 109 TYR HDx H 1 6.891 0.018 A 109 TYR HDy H 1 6.891 0.018 A 109 TYR HEx H 1 6.657 0.008 A 109 TYR HEy H 1 6.657 0.008 A 109 TYR C C 13 173.430 0.000 A 109 TYR CA C 13 55.460 0.079 A 109 TYR CB C 13 42.041 0.000 A 109 TYR CDx C 13 133.359 0.044 A 109 TYR CDy C 13 133.359 0.044 A 109 TYR CEx C 13 118.026 0.020 A 109 TYR CEy C 13 118.026 0.020 A 109 TYR N N 15 121.685 0.060 A 110 PHE H H 1 8.898 0.008 A 110 PHE HA H 1 5.845 0.009 A 110 PHE HBx H 1 2.985 0.014 A 110 PHE HBy H 1 3.443 0.011 A 110 PHE C C 13 175.425 0.000 A 110 PHE CA C 13 56.697 0.046 A 110 PHE CB C 13 44.118 0.052 A 110 PHE N N 15 117.355 0.036 A 111 ILE H H 1 9.660 0.009 A 111 ILE HA H 1 5.230 0.009 A 111 ILE HB H 1 1.830 0.011 A 111 ILE HD1% H 1 0.874 0.014 A 111 ILE HG1y H 1 1.575 0.014 A 111 ILE HG1x H 1 1.052 0.012 A 111 ILE HG2% H 1 0.953 0.011 A 111 ILE C C 13 176.355 0.000 A 111 ILE CA C 13 59.979 0.079 A 111 ILE CB C 13 39.901 0.025 A 111 ILE CD1 C 13 13.648 0.000 A 111 ILE CG1 C 13 27.927 0.038 A 111 ILE CG2 C 13 17.643 0.037 A 111 ILE N N 15 121.807 0.017 A 112 SER H H 1 9.416 0.006 A 112 SER HA H 1 3.051 0.011 A 112 SER HBx H 1 3.253 0.009 A 112 SER HBy H 1 3.428 0.006 A 112 SER CA C 13 56.697 0.073 A 112 SER CB C 13 63.153 0.064 A 112 SER N N 15 126.063 0.027 A 113 PRO HA H 1 4.259 0.006 A 113 PRO HBx H 1 1.772 0.012 A 113 PRO HBy H 1 2.391 0.013 A 113 PRO HDx H 1 1.608 0.008 A 113 PRO HDy H 1 2.900 0.007 A 113 PRO HGy H 1 2.006 0.011 A 113 PRO HGx H 1 1.649 0.015 A 113 PRO C C 13 177.214 0.000 A 113 PRO CA C 13 64.914 0.058 A 113 PRO CB C 13 31.428 0.002 A 113 PRO CD C 13 49.052 0.062 A 113 PRO CG C 13 27.495 0.037 A 114 GLN H H 1 7.175 0.008 A 114 GLN HA H 1 4.383 0.004 A 114 GLN HBx H 1 1.807 0.014 A 114 GLN HBy H 1 2.257 0.011 A 114 GLN HE21 H 1 6.995 0.004 A 114 GLN HE22 H 1 7.656 0.009 A 114 GLN HGx H 1 2.359 0.010 A 114 GLN HGy H 1 2.455 0.013 A 114 GLN C C 13 175.990 0.000 A 114 GLN CA C 13 55.814 0.032 A 114 GLN CB C 13 28.649 0.052 A 114 GLN CG C 13 34.588 0.029 A 114 GLN N N 15 112.298 0.054 A 114 GLN NE2 N 15 113.166 0.039 A 115 GLY H H 1 8.150 0.007 A 115 GLY HAx H 1 3.428 0.012 A 115 GLY HAy H 1 4.156 0.007 A 115 GLY C C 13 174.162 0.000 A 115 GLY CA C 13 45.319 0.013 A 115 GLY N N 15 108.911 0.021 A 116 LEU H H 1 7.166 0.012 A 116 LEU HA H 1 4.182 0.009 A 116 LEU HBx H 1 1.081 0.013 A 116 LEU HBy H 1 1.424 0.008 A 116 LEU HDx% H 1 0.745 0.001 A 116 LEU HDy% H 1 0.879 0.005 A 116 LEU HG H 1 1.289 0.007 A 116 LEU C C 13 175.187 0.000 A 116 LEU CA C 13 54.772 0.039 A 116 LEU CB C 13 42.543 0.049 A 116 LEU CDx C 13 23.309 0.019 A 116 LEU CDy C 13 25.213 0.041 A 116 LEU CG C 13 27.549 0.042 A 116 LEU N N 15 121.038 0.028 A 117 LYS H H 1 8.238 0.004 A 117 LYS HA H 1 5.269 0.012 A 117 LYS HBy H 1 1.656 0.005 A 117 LYS HBx H 1 1.517 0.018 A 117 LYS HDy H 1 1.557 0.015 A 117 LYS HDx H 1 1.404 0.005 A 117 LYS HE3 H 1 2.735 0.008 A 117 LYS HGx H 1 1.226 0.010 A 117 LYS HGy H 1 1.417 0.013 A 117 LYS C C 13 175.984 0.000 A 117 LYS CA C 13 55.433 0.032 A 117 LYS CB C 13 34.563 0.063 A 117 LYS CD C 13 29.485 0.030 A 117 LYS CE C 13 41.729 0.062 A 117 LYS CG C 13 26.136 0.067 A 117 LYS N N 15 121.584 0.061 A 118 PHE H H 1 9.639 0.007 A 118 PHE HA H 1 4.912 0.007 A 118 PHE HBx H 1 3.087 0.013 A 118 PHE HBy H 1 3.272 0.015 A 118 PHE HDx H 1 7.249 0.000 A 118 PHE HDy H 1 7.249 0.000 A 118 PHE C C 13 176.449 0.000 A 118 PHE CA C 13 58.006 0.032 A 118 PHE CB C 13 42.968 0.050 A 118 PHE N N 15 121.828 0.043 A 119 ARG H H 1 9.589 0.005 A 119 ARG HA H 1 5.111 0.010 A 119 ARG HBy H 1 2.120 0.015 A 119 ARG HBx H 1 2.011 0.012 A 119 ARG HD2 H 1 3.146 0.021 A 119 ARG HE H 1 7.122 0.006 A 119 ARG HG3 H 1 1.569 0.013 A 119 ARG C C 13 174.704 0.000 A 119 ARG CA C 13 55.171 0.096 A 119 ARG CB C 13 31.820 0.013 A 119 ARG CD C 13 43.952 0.060 A 119 ARG CG C 13 27.429 0.076 A 119 ARG N N 15 119.546 0.061 A 119 ARG NE N 15 83.081 0.040 A 120 SER H H 1 7.625 0.002 A 120 SER HA H 1 4.341 0.004 A 120 SER HBx H 1 3.439 0.000 A 120 SER HBy H 1 3.942 0.017 A 120 SER C C 13 172.793 0.000 A 120 SER CA C 13 56.032 0.000 A 120 SER CB C 13 66.492 0.000 A 120 SER N N 15 110.737 0.037 A 121 LYS H H 1 8.816 0.006 A 121 LYS HA H 1 3.634 0.005 A 121 LYS HBy H 1 1.799 0.016 A 121 LYS HBx H 1 1.621 0.010 A 121 LYS HD3 H 1 1.773 0.000 A 121 LYS HGx H 1 1.388 0.009 A 121 LYS HGy H 1 1.446 0.000 A 121 LYS C C 13 178.826 0.000 A 121 LYS CA C 13 59.635 0.034 A 121 LYS CB C 13 31.154 0.024 A 121 LYS CD C 13 29.216 0.000 A 121 LYS CG C 13 25.056 0.084 A 121 LYS N N 15 125.451 0.045 A 122 SER H H 1 8.834 0.005 A 122 SER HA H 1 4.136 0.008 A 122 SER HB3 H 1 3.921 0.004 A 122 SER C C 13 177.427 0.000 A 122 SER CA C 13 61.492 0.105 A 122 SER CB C 13 62.342 0.000 A 122 SER N N 15 115.374 0.037 A 123 SER H H 1 8.043 0.005 A 123 SER HA H 1 4.418 0.006 A 123 SER HBy H 1 4.232 0.011 A 123 SER HBx H 1 4.199 0.011 A 123 SER C C 13 178.017 0.000 A 123 SER CA C 13 61.540 0.052 A 123 SER CB C 13 62.967 0.074 A 123 SER N N 15 118.263 0.023 A 124 LEU H H 1 7.686 0.006 A 124 LEU HA H 1 3.648 0.008 A 124 LEU HBy H 1 1.622 0.013 A 124 LEU HBx H 1 1.407 0.010 A 124 LEU HDx% H 1 -0.357 0.009 A 124 LEU HDy% H 1 -0.114 0.010 A 124 LEU HG H 1 0.815 0.007 A 124 LEU C C 13 177.987 0.000 A 124 LEU CA C 13 58.263 0.041 A 124 LEU CB C 13 42.301 0.030 A 124 LEU CDy C 13 24.331 0.011 A 124 LEU CDx C 13 23.967 0.012 A 124 LEU CG C 13 27.185 0.012 A 124 LEU N N 15 126.780 0.023 A 125 ALA H H 1 8.912 0.009 A 125 ALA HA H 1 3.690 0.008 A 125 ALA HB% H 1 1.440 0.008 A 125 ALA C C 13 180.032 0.000 A 125 ALA CA C 13 55.687 0.016 A 125 ALA CB C 13 17.880 0.031 A 125 ALA N N 15 121.665 0.040 A 126 ASN H H 1 7.963 0.004 A 126 ASN HA H 1 4.493 0.009 A 126 ASN HBx H 1 2.960 0.009 A 126 ASN HBy H 1 2.977 0.014 A 126 ASN HD21 H 1 7.047 0.012 A 126 ASN HD22 H 1 7.804 0.001 A 126 ASN C C 13 177.174 0.000 A 126 ASN CA C 13 56.371 0.044 A 126 ASN CB C 13 38.523 0.025 A 126 ASN N N 15 115.720 0.026 A 126 ASN ND2 N 15 113.219 0.031 A 127 TYR H H 1 7.746 0.009 A 127 TYR HA H 1 4.289 0.005 A 127 TYR HBy H 1 3.411 0.013 A 127 TYR HBx H 1 3.069 0.012 A 127 TYR HDx H 1 7.081 0.012 A 127 TYR HDy H 1 7.081 0.012 A 127 TYR HEx H 1 6.960 0.020 A 127 TYR HEy H 1 6.960 0.020 A 127 TYR C C 13 177.895 0.000 A 127 TYR CA C 13 61.576 0.054 A 127 TYR CB C 13 39.051 0.046 A 127 TYR CDx C 13 133.713 0.068 A 127 TYR CDy C 13 133.713 0.068 A 127 TYR CEx C 13 118.192 0.026 A 127 TYR CEy C 13 118.192 0.026 A 127 TYR N N 15 121.605 0.022 A 128 LEU H H 1 8.600 0.003 A 128 LEU HA H 1 3.798 0.008 A 128 LEU HBy H 1 1.732 0.013 A 128 LEU HBx H 1 1.428 0.008 A 128 LEU HDx% H 1 0.424 0.006 A 128 LEU HDy% H 1 0.823 0.008 A 128 LEU HG H 1 1.833 0.016 A 128 LEU C C 13 179.418 0.000 A 128 LEU CA C 13 57.736 0.086 A 128 LEU CB C 13 40.893 0.045 A 128 LEU CDx C 13 21.936 0.000 A 128 LEU CDy C 13 25.386 0.042 A 128 LEU CG C 13 26.309 0.029 A 128 LEU N N 15 119.365 0.031 A 129 HIS H H 1 8.041 0.003 A 129 HIS HA H 1 4.514 0.008 A 129 HIS HB2 H 1 3.313 0.002 A 129 HIS C C 13 178.014 0.000 A 129 HIS CA C 13 58.078 0.038 A 129 HIS CB C 13 29.346 0.039 A 129 HIS N N 15 115.982 0.014 A 130 LYS H H 1 8.136 0.005 A 130 LYS HA H 1 4.082 0.003 A 130 LYS HBx H 1 1.882 0.012 A 130 LYS HBy H 1 1.915 0.010 A 130 LYS HD3 H 1 1.716 0.006 A 130 LYS HE3 H 1 3.041 0.011 A 130 LYS HGx H 1 1.501 0.013 A 130 LYS HGy H 1 1.546 0.010 A 130 LYS C C 13 177.320 0.000 A 130 LYS CA C 13 58.361 0.049 A 130 LYS CB C 13 32.570 0.045 A 130 LYS CD C 13 29.192 0.045 A 130 LYS CE C 13 42.019 0.000 A 130 LYS CG C 13 25.014 0.028 A 130 LYS N N 15 119.804 0.037 A 131 ASN H H 1 7.663 0.004 A 131 ASN HA H 1 4.656 0.006 A 131 ASN HBx H 1 2.272 0.007 A 131 ASN HBy H 1 2.674 0.008 A 131 ASN HD21 H 1 6.680 0.005 A 131 ASN HD22 H 1 6.991 0.002 A 131 ASN C C 13 175.335 0.000 A 131 ASN CA C 13 53.590 0.053 A 131 ASN CB C 13 39.280 0.059 A 131 ASN N N 15 115.918 0.025 A 131 ASN ND2 N 15 114.267 0.070 A 132 GLY H H 1 7.854 0.004 A 132 GLY HA3 H 1 3.911 0.011 A 132 GLY C C 13 174.647 0.000 A 132 GLY CA C 13 46.329 0.015 A 132 GLY N N 15 108.472 0.029 A 133 GLU H H 1 8.142 0.007 A 133 GLU HA H 1 4.360 0.010 A 133 GLU HBx H 1 2.048 0.025 A 133 GLU HBy H 1 2.097 0.013 A 133 GLU HG3 H 1 2.306 0.017 A 133 GLU C C 13 177.324 0.000 A 133 GLU CA C 13 56.712 0.000 A 133 GLU CB C 13 29.889 0.048 A 133 GLU CG C 13 36.541 0.100 A 133 GLU N N 15 120.028 0.057 A 134 THR H H 1 8.363 0.013 A 134 THR HA H 1 4.362 0.012 A 134 THR HB H 1 4.382 0.002 A 134 THR HG2% H 1 1.244 0.020 A 134 THR C C 13 174.926 0.000 A 134 THR CA C 13 62.028 0.074 A 134 THR CB C 13 69.927 0.074 A 134 THR CG2 C 13 21.197 0.034 A 134 THR N N 15 114.986 0.011 A 135 SER H H 1 8.580 0.004 A 135 SER HA H 1 4.530 0.002 A 135 SER HB3 H 1 3.956 0.003 A 135 SER C C 13 174.284 0.000 A 135 SER CA C 13 59.506 0.007 A 135 SER CB C 13 63.812 0.000 A 135 SER N N 15 118.353 0.078 A 136 LEU H H 1 8.048 0.007 A 136 LEU HA H 1 4.456 0.009 A 136 LEU HBx H 1 1.343 0.013 A 136 LEU HBy H 1 1.662 0.017 A 136 LEU HD1% H 1 0.782 0.007 A 136 LEU HG H 1 0.930 0.012 A 136 LEU C C 13 175.105 0.000 A 136 LEU CA C 13 54.521 0.047 A 136 LEU CB C 13 44.476 0.026 A 136 LEU CD1 C 13 23.503 0.010 A 136 LEU CG C 13 25.751 0.048 A 136 LEU N N 15 122.995 0.013 A 137 LYS H H 1 8.786 0.006 A 137 LYS HBy H 1 1.981 0.000 A 137 LYS HBx H 1 1.597 0.005 A 137 LYS HD3 H 1 1.675 0.005 A 137 LYS HEx H 1 2.965 0.006 A 137 LYS HEy H 1 2.979 0.007 A 137 LYS HGx H 1 1.406 0.009 A 137 LYS HGy H 1 1.451 0.003 A 137 LYS CA C 13 53.066 0.047 A 137 LYS CB C 13 33.201 0.060 A 137 LYS CD C 13 28.844 0.065 A 137 LYS CE C 13 41.928 0.039 A 137 LYS CG C 13 24.266 0.073 A 137 LYS N N 15 121.086 0.055 A 138 PRO HA H 1 3.956 0.009 A 138 PRO HBx H 1 1.990 0.009 A 138 PRO HBy H 1 2.102 0.005 A 138 PRO HDx H 1 3.705 0.013 A 138 PRO HDy H 1 3.877 0.012 A 138 PRO HGy H 1 2.313 0.009 A 138 PRO HGx H 1 1.760 0.011 A 138 PRO C C 13 177.652 0.000 A 138 PRO CA C 13 66.037 0.000 A 138 PRO CB C 13 31.469 0.017 A 138 PRO CD C 13 49.979 0.053 A 138 PRO CG C 13 28.315 0.054 A 139 GLU H H 1 8.889 0.006 A 139 GLU HA H 1 4.145 0.006 A 139 GLU HBy H 1 2.036 0.004 A 139 GLU HBx H 1 1.965 0.013 A 139 GLU HGx H 1 2.258 0.013 A 139 GLU HGy H 1 2.320 0.000 A 139 GLU C C 13 176.688 0.000 A 139 GLU CA C 13 58.771 0.082 A 139 GLU CB C 13 28.534 0.035 A 139 GLU CG C 13 36.894 0.000 A 139 GLU N N 15 113.380 0.020 A 140 ASP H H 1 8.027 0.004 A 140 ASP HA H 1 4.304 0.003 A 140 ASP HBy H 1 2.542 0.007 A 140 ASP HBx H 1 2.214 0.013 A 140 ASP C C 13 174.537 0.000 A 140 ASP CA C 13 55.908 0.048 A 140 ASP CB C 13 40.873 0.019 A 140 ASP N N 15 119.519 0.028 A 141 PHE H H 1 7.539 0.009 A 141 PHE HA H 1 3.867 0.007 A 141 PHE HBx H 1 1.748 0.019 A 141 PHE HBy H 1 2.752 0.014 A 141 PHE HDx H 1 6.045 0.008 A 141 PHE HDy H 1 6.045 0.008 A 141 PHE C C 13 173.522 0.000 A 141 PHE CA C 13 57.268 0.000 A 141 PHE CB C 13 39.479 0.042 A 141 PHE CDx C 13 132.011 0.016 A 141 PHE CDy C 13 132.011 0.016 A 141 PHE N N 15 118.825 0.063 A 142 ASP H H 1 8.546 0.003 A 142 ASP HA H 1 4.882 0.005 A 142 ASP HBx H 1 2.537 0.006 A 142 ASP HBy H 1 2.938 0.003 A 142 ASP C C 13 176.424 0.000 A 142 ASP CA C 13 53.623 0.099 A 142 ASP CB C 13 41.683 0.000 A 142 ASP N N 15 122.733 0.027 A 143 PHE H H 1 9.406 0.004 A 143 PHE HA H 1 4.508 0.005 A 143 PHE HBx H 1 3.098 0.014 A 143 PHE HBy H 1 3.575 0.010 A 143 PHE HDx H 1 7.414 0.008 A 143 PHE HDy H 1 7.414 0.008 A 143 PHE HEx H 1 7.150 0.000 A 143 PHE HEy H 1 7.150 0.000 A 143 PHE C C 13 174.878 0.000 A 143 PHE CA C 13 59.002 0.035 A 143 PHE CB C 13 39.504 0.062 A 143 PHE CDx C 13 132.592 0.032 A 143 PHE CDy C 13 132.592 0.032 A 143 PHE N N 15 127.545 0.061 A 144 THR H H 1 8.360 0.010 A 144 THR HA H 1 4.581 0.020 A 144 THR HB H 1 4.268 0.008 A 144 THR HG2% H 1 1.304 0.010 A 144 THR CA C 13 62.519 0.000 A 144 THR CB C 13 70.241 0.048 A 144 THR CG2 C 13 21.731 0.018 A 144 THR N N 15 114.719 0.121 A 145 VAL H H 1 8.856 0.013 A 145 VAL HA H 1 3.992 0.015 A 145 VAL HB H 1 1.975 0.009 A 145 VAL HG2% H 1 0.647 0.008 A 145 VAL C C 13 176.097 0.000 A 145 VAL CA C 13 62.742 0.068 A 145 VAL CB C 13 32.515 0.092 A 145 VAL CG2 C 13 21.243 0.018 A 146 LEU H H 1 8.082 0.005 A 146 LEU HA H 1 4.366 0.007 A 146 LEU HBy H 1 1.617 0.005 A 146 LEU HBx H 1 1.566 0.009 A 146 LEU HDx% H 1 0.853 0.006 A 146 LEU HDy% H 1 0.919 0.014 A 146 LEU HG H 1 1.584 0.007 A 146 LEU C C 13 176.924 0.000 A 146 LEU CA C 13 54.963 0.017 A 146 LEU CB C 13 42.438 0.007 A 146 LEU CDx C 13 23.649 0.011 A 146 LEU CDy C 13 24.700 0.000 A 146 LEU CG C 13 27.022 0.022 A 146 LEU N N 15 124.454 0.024 A 147 SER H H 1 8.216 0.012 A 147 SER HA H 1 4.589 0.005 A 147 SER HB3 H 1 3.927 0.000 A 147 SER C C 13 173.419 0.000 A 147 SER CA C 13 58.281 0.039 A 147 SER CB C 13 63.886 0.072 A 147 SER N N 15 117.581 0.044 A 148 LYS H H 1 7.961 0.002 A 148 LYS HA H 1 4.156 0.006 A 148 LYS HBx H 1 1.689 0.011 A 148 LYS HBy H 1 1.814 0.006 A 148 LYS HD3 H 1 1.678 0.012 A 148 LYS HEx H 1 2.957 0.000 A 148 LYS HEy H 1 2.993 0.000 A 148 LYS HGx H 1 1.355 0.008 A 148 LYS HGy H 1 1.385 0.008 A 148 LYS CA C 13 57.722 0.069 A 148 LYS CB C 13 33.725 0.055 A 148 LYS CD C 13 29.056 0.001 A 148 LYS CE C 13 41.926 0.000 A 148 LYS CG C 13 24.717 0.046 A 148 LYS N N 15 128.361 0.024 stop_ save_ save_DNAfor_chemshift _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode DNAfor_chemshift 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 B 202 DG H1 H 1 12.743 0.001 B 203 DA H1' H 1 6.267 0.002 B 203 DA H2 H 1 7.862 0.001 B 203 DA H2' H 1 2.519 0.000 B 203 DA H4' H 1 4.168 0.000 B 203 DA H8 H 1 8.004 0.004 B 204 DT H1' H 1 5.937 0.000 B 204 DT H2' H 1 1.937 0.002 B 204 DT H2'' H 1 2.583 0.001 B 204 DT H3 H 1 13.660 0.004 B 204 DT H5'' H 1 4.184 0.000 B 204 DT H6 H 1 7.154 0.001 B 204 DT H7% H 1 1.252 0.006 B 205 5CM H2' H 1 2.074 0.000 B 205 5CM H2'' H 1 2.432 0.002 B 205 5CM H5A% H 1 1.604 0.009 B 205 5CM H6 H 1 7.303 0.003 B 205 5CM HN41 H 1 6.616 0.009 B 205 5CM HN42 H 1 8.860 0.006 B 206 DG H1 H 1 13.038 0.002 B 206 DG H2' H 1 2.423 0.008 B 206 DG H2'' H 1 2.948 0.001 B 206 DG H3' H 1 5.106 0.002 B 206 DG H8 H 1 6.633 0.003 B 207 DG H1 H 1 12.797 0.000 B 207 DG H2' H 1 2.513 0.000 B 207 DG H2'' H 1 2.602 0.000 B 207 DG H8 H 1 7.676 0.003 B 208 DC H41 H 1 8.073 0.002 B 208 DC H42 H 1 6.300 0.003 B 208 DC H5 H 1 5.279 0.001 B 208 DC H6 H 1 7.527 0.000 B 209 DT H1' H 1 6.141 0.002 B 209 DT H2' H 1 2.199 0.004 B 209 DT H2'' H 1 2.523 0.000 B 209 DT H3 H 1 13.514 0.004 B 209 DT H4' H 1 4.165 0.000 B 209 DT H6 H 1 7.537 0.001 B 209 DT H7% H 1 1.738 0.003 B 210 DC H1' H 1 6.282 0.001 B 210 DC H2'' H 1 2.276 0.001 B 210 DC H4' H 1 4.030 0.001 B 210 DC H5 H 1 5.880 0.000 B 210 DC H6 H 1 7.690 0.003 stop_ save_ save_DNArev_chemshift _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode DNArev_chemshift 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 C 211 DG H1' H 1 5.579 0.000 C 212 DA H1' H 1 6.024 0.001 C 212 DA H2 H 1 7.859 0.003 C 212 DA H2' H 1 2.802 0.000 C 212 DA H2'' H 1 2.968 0.000 C 212 DA H3' H 1 5.075 0.000 C 212 DA H8 H 1 8.194 0.000 C 213 DG H1 H 1 13.073 0.003 C 214 DC H41 H 1 6.994 0.012 C 214 DC H42 H 1 8.222 0.004 C 214 DC H5 H 1 5.408 0.000 C 215 5CM H2' H 1 2.212 0.000 C 215 5CM H5A% H 1 1.625 0.002 C 215 5CM H6 H 1 7.183 0.000 C 215 5CM HN41 H 1 6.717 0.003 C 215 5CM HN42 H 1 8.776 0.002 C 216 DG H1 H 1 12.744 0.002 C 216 DG H2' H 1 2.632 0.000 C 216 DG H2'' H 1 2.834 0.000 C 217 DA H1' H 1 6.265 0.001 C 217 DA H2 H 1 7.846 0.007 C 217 DA H2' H 1 2.680 0.002 C 217 DA H2'' H 1 2.935 0.001 C 217 DA H3' H 1 5.057 0.003 C 217 DA H4' H 1 4.304 0.000 C 217 DA H5' H 1 4.499 0.000 C 217 DA H5'' H 1 4.227 0.000 C 217 DA H8 H 1 8.320 0.001 C 218 DT H1' H 1 5.939 0.000 C 218 DT H2' H 1 2.438 0.007 C 218 DT H2'' H 1 2.038 0.001 C 218 DT H3 H 1 13.394 0.001 C 218 DT H6 H 1 7.178 0.016 C 218 DT H7% H 1 1.433 0.002 C 219 DC H2' H 1 2.218 0.000 C 219 DC H2'' H 1 2.445 0.000 C 219 DC H41 H 1 6.856 0.002 C 219 DC H42 H 1 8.326 0.003 C 219 DC H5 H 1 5.696 0.003 C 219 DC H6 H 1 7.566 0.001 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 80 THR HA A 80 THR HG2% 1.0 1.8 5.0 2 2 A 80 THR HA A 81 GLU H 1.0 1.8 6.0 3 3 A 80 THR HG2% A 80 THR HB 1.0 1.8 5.0 4 4 A 81 GLU H A 81 GLU HGy 1.0 1.8 6.5 5 4 A 81 GLU H A 81 GLU HGx 1.0 1.8 6.5 6 5 A 82 CYS HA A 82 CYS HBx 1.0 1.8 5.0 7 5 A 82 CYS HA A 82 CYS HB3 1.0 1.8 5.0 8 6 A 82 CYS HA A 83 ARG H 1.0 1.8 5.0 9 7 A 82 CYS H A 81 GLU HA 1.0 1.8 5.0 10 8 A 82 CYS H A 81 GLU HBx 1.0 1.8 6.5 11 8 A 82 CYS H A 81 GLU HBy 1.0 1.8 6.5 12 9 A 83 ARG HA A 84 LYS H 1.0 1.8 6.0 13 10 A 83 ARG H A 81 GLU HA 1.0 1.8 6.5 14 11 A 83 ARG H A 82 CYS HBx 1.0 1.8 6.5 15 11 A 82 CYS HB3 A 83 ARG H 1.0 1.8 6.5 16 12 A 83 ARG H A 83 ARG HBy 1.0 1.8 6.5 17 12 A 83 ARG H A 83 ARG HBx 1.0 1.8 6.5 18 13 A 83 ARG H A 83 ARG HGx 1.0 1.8 6.5 19 13 A 83 ARG H A 83 ARG HG3 1.0 1.8 6.5 20 14 A 85 SER HA A 148 LYS HGx 1.0 1.8 6.0 21 14 A 85 SER HA A 148 LYS HGy 1.0 1.8 6.0 22 15 A 85 SER HA A 148 LYS H 1.0 1.8 3.8 23 16 A 85 SER HA A 85 SER HBx 1.0 1.8 3.8 24 16 A 85 SER HA A 85 SER HB3 1.0 1.8 3.8 25 17 A 85 SER HA A 86 VAL HG2% 1.0 1.8 6.0 26 17 A 85 SER HA A 86 VAL HG1% 1.0 1.8 6.0 27 18 A 85 SER HA A 86 VAL H 1.0 1.8 4.0 28 19 A 147 SER H A 85 SER HBx 1.0 1.8 5.0 29 19 A 85 SER HB3 A 147 SER H 1.0 1.8 5.0 30 20 A 148 LYS H A 85 SER HBx 1.0 1.8 5.0 31 20 A 148 LYS H A 85 SER HB3 1.0 1.8 5.0 32 21 A 85 SER H A 83 ARG HBy 1.0 1.8 6.5 33 21 A 83 ARG HBx A 85 SER H 1.0 1.8 6.5 34 22 A 85 SER H A 83 ARG HGx 1.0 1.8 6.5 35 22 A 83 ARG HG3 A 85 SER H 1.0 1.8 6.5 36 23 A 85 SER HA A 85 SER H 1.0 1.8 4.0 37 24 A 85 SER H A 85 SER HBx 1.0 1.8 6.5 38 24 A 85 SER HB3 A 85 SER H 1.0 1.8 6.5 39 25 A 85 SER H A 87 PRO HBy 1.0 1.8 6.5 40 25 A 85 SER H A 87 PRO HBx 1.0 1.8 6.5 41 26 A 86 VAL HA A 86 VAL HB 1.0 1.8 6.0 42 27 A 86 VAL H A 86 VAL HB 1.0 1.8 5.0 43 28 A 86 VAL HG1% A 86 VAL HA 1.0 1.8 5.0 44 29 A 86 VAL HG1% A 86 VAL HB 1.0 1.8 3.8 45 30 A 86 VAL H A 85 SER HBx 1.0 1.8 6.5 46 30 A 85 SER HB3 A 86 VAL H 1.0 1.8 6.5 47 31 A 86 VAL H A 86 VAL HA 1.0 1.8 6.0 48 32 A 86 VAL HG1% A 86 VAL H 1.0 1.8 4.0 49 33 A 86 VAL HA A 87 PRO HDx 1.0 1.8 6.0 50 33 A 86 VAL HA A 87 PRO HDy 1.0 1.8 6.0 51 34 A 86 VAL HB A 87 PRO HDx 1.0 1.8 6.0 52 34 A 86 VAL HB A 87 PRO HDy 1.0 1.8 6.0 53 35 A 86 VAL HG1% A 87 PRO HDx 1.0 1.8 6.0 54 35 A 86 VAL HG1% A 87 PRO HDy 1.0 1.8 6.0 55 36 A 88 CYS HA A 88 CYS H 1.0 1.8 6.0 56 37 A 88 CYS HA A 88 CYS HBx 1.0 1.8 5.0 57 37 A 88 CYS HA A 88 CYS HB3 1.0 1.8 5.0 58 38 A 88 CYS H A 88 CYS HBx 1.0 1.8 4.0 59 38 A 88 CYS H A 88 CYS HB3 1.0 1.8 4.0 60 39 A 89 GLY HAy A 113 PRO HGy 1.0 1.8 6.0 61 39 A 89 GLY HAx A 113 PRO HGy 1.0 1.8 6.0 62 39 A 113 PRO HGx A 89 GLY HAx 1.0 1.8 6.0 63 39 A 89 GLY HAy A 113 PRO HGx 1.0 1.8 6.0 64 40 A 90 TRP H A 89 GLY HAx 1.0 1.8 6.0 65 40 A 89 GLY HAy A 90 TRP H 1.0 1.8 6.0 66 41 A 88 CYS HA A 89 GLY H 1.0 1.8 5.0 67 42 A 89 GLY H A 88 CYS HBx 1.0 1.8 6.5 68 42 A 88 CYS HB3 A 89 GLY H 1.0 1.8 6.5 69 43 A 89 GLY H A 89 GLY HAx 1.0 1.8 6.5 70 43 A 89 GLY HAy A 89 GLY H 1.0 1.8 6.5 71 44 A 90 TRP HA A 90 TRP HBx 1.0 1.8 6.0 72 44 A 90 TRP HA A 90 TRP HBy 1.0 1.8 6.0 73 45 A 86 VAL HG1% A 90 TRP HBx 1.0 1.8 6.0 74 45 A 86 VAL HG1% A 90 TRP HBy 1.0 1.8 6.0 75 46 A 90 TRP HA A 90 TRP HBx 1.0 1.8 6.0 76 46 A 90 TRP HA A 90 TRP HBy 1.0 1.8 6.0 77 47 A 90 TRP H A 90 TRP HBx 1.0 1.8 5.0 78 47 A 90 TRP H A 90 TRP HBy 1.0 1.8 5.0 79 48 A 90 TRP H A 90 TRP HBx 1.0 1.8 6.0 80 48 A 90 TRP H A 90 TRP HBy 1.0 1.8 6.0 81 49 A 90 TRP HZ2 A 90 TRP HBx 1.0 1.8 6.0 82 49 A 90 TRP HBy A 90 TRP HZ2 1.0 1.8 6.0 83 50 A 91 GLU H A 90 TRP HBx 1.0 1.8 6.0 84 50 A 90 TRP HBy A 91 GLU H 1.0 1.8 6.0 85 51 A 90 TRP HD1 A 90 TRP HE1 1.0 1.8 4.0 86 52 A 90 TRP HE1 A 113 PRO HGy 1.0 1.8 6.0 87 52 A 113 PRO HGx A 90 TRP HE1 1.0 1.8 6.0 88 53 A 90 TRP HZ2 A 90 TRP HE1 1.0 1.8 5.0 89 54 A 90 TRP HH2 A 124 LEU HG 1.0 1.8 6.0 90 55 A 86 VAL HG1% A 90 TRP H 1.0 1.8 6.5 91 56 A 90 TRP H A 89 GLY HAx 1.0 1.8 6.5 92 56 A 89 GLY HAy A 90 TRP H 1.0 1.8 6.5 93 57 A 90 TRP H A 89 GLY H 1.0 1.8 6.5 94 58 A 90 TRP H A 90 TRP HA 1.0 1.8 6.0 95 59 A 90 TRP H A 90 TRP HD1 1.0 1.8 6.5 96 60 A 90 TRP H A 90 TRP HE1 1.0 1.8 6.5 97 61 A 90 TRP HZ3 A 124 LEU HDx% 1.0 1.8 6.0 98 62 A 86 VAL HG1% A 91 GLU HA 1.0 1.8 6.0 99 63 A 91 GLU HBy A 111 ILE HG1y 1.0 1.8 3.8 100 63 A 91 GLU HBx A 111 ILE HG1y 1.0 1.8 3.8 101 63 A 111 ILE HG1x A 91 GLU HBy 1.0 1.8 3.8 102 63 A 91 GLU HBx A 111 ILE HG1x 1.0 1.8 3.8 103 64 A 91 GLU HA A 91 GLU HBy 1.0 1.8 6.0 104 64 A 91 GLU HA A 91 GLU HBx 1.0 1.8 6.0 105 65 A 91 GLU HBx A 91 GLU HGx 1.0 1.8 3.8 106 65 A 91 GLU HGy A 91 GLU HBy 1.0 1.8 3.8 107 65 A 91 GLU HBx A 91 GLU HGy 1.0 1.8 3.8 108 65 A 91 GLU HBy A 91 GLU HGx 1.0 1.8 3.8 109 66 A 91 GLU HBx A 91 GLU HGx 1.0 1.8 5.0 110 66 A 91 GLU HGy A 91 GLU HBy 1.0 1.8 5.0 111 66 A 91 GLU HBx A 91 GLU HGy 1.0 1.8 5.0 112 66 A 91 GLU HBy A 91 GLU HGx 1.0 1.8 5.0 113 67 A 91 GLU HBx A 91 GLU HGx 1.0 1.8 6.0 114 67 A 91 GLU HGy A 91 GLU HBy 1.0 1.8 6.0 115 67 A 91 GLU HBx A 91 GLU HGy 1.0 1.8 6.0 116 67 A 91 GLU HBy A 91 GLU HGx 1.0 1.8 6.0 117 68 A 91 GLU H A 91 GLU HBy 1.0 1.8 6.0 118 68 A 91 GLU H A 91 GLU HBx 1.0 1.8 6.0 119 69 A 91 GLU HA A 91 GLU HGx 1.0 1.8 6.0 120 69 A 91 GLU HA A 91 GLU HGy 1.0 1.8 6.0 121 70 A 91 GLU H A 91 GLU HGx 1.0 1.8 6.0 122 70 A 91 GLU H A 91 GLU HGy 1.0 1.8 6.0 123 71 A 93 VAL HG2% A 91 GLU HGx 1.0 1.8 6.0 124 71 A 91 GLU HGy A 93 VAL HG2% 1.0 1.8 6.0 125 72 A 91 GLU H A 110 PHE HA 1.0 1.8 6.5 126 73 A 91 GLU H A 111 ILE HB 1.0 1.8 5.0 127 74 A 91 GLU H A 111 ILE HG2% 1.0 1.8 6.5 128 75 A 91 GLU H A 113 PRO HDx 1.0 1.8 6.5 129 75 A 91 GLU H A 113 PRO HDy 1.0 1.8 6.5 130 76 A 86 VAL HG1% A 91 GLU H 1.0 1.8 6.0 131 77 A 90 TRP HA A 91 GLU H 1.0 1.8 4.0 132 78 A 90 TRP H A 91 GLU H 1.0 1.8 6.5 133 79 A 91 GLU H A 91 GLU HGx 1.0 1.8 6.5 134 79 A 91 GLU H A 91 GLU HGy 1.0 1.8 6.5 135 80 A 92 ARG HE A 108 VAL HGy% 1.0 1.8 6.5 136 81 A 92 ARG HE A 92 ARG HBx 1.0 1.8 6.5 137 81 A 92 ARG HE A 92 ARG HBy 1.0 1.8 6.5 138 82 A 92 ARG HE A 92 ARG HD2 1.0 1.8 4.0 139 82 A 92 ARG HE A 92 ARG HDy 1.0 1.8 4.0 140 83 A 92 ARG HE A 92 ARG HGy 1.0 1.8 5.0 141 83 A 92 ARG HE A 92 ARG HGx 1.0 1.8 5.0 142 84 A 92 ARG HE A 92 ARG HGy 1.0 1.8 6.5 143 84 A 92 ARG HE A 92 ARG HGx 1.0 1.8 6.5 144 85 A 86 VAL HG2% A 92 ARG H 1.0 1.8 6.5 145 85 A 86 VAL HG1% A 92 ARG H 1.0 1.8 6.5 146 86 A 91 GLU HA A 92 ARG H 1.0 1.8 4.0 147 87 A 92 ARG H A 91 GLU HBy 1.0 1.8 6.5 148 87 A 91 GLU HBx A 92 ARG H 1.0 1.8 6.5 149 88 A 92 ARG H A 91 GLU HGx 1.0 1.8 6.5 150 88 A 91 GLU HGy A 92 ARG H 1.0 1.8 6.5 151 89 A 92 ARG H A 92 ARG HA 1.0 1.8 6.5 152 90 A 92 ARG H A 92 ARG HBx 1.0 1.8 6.5 153 90 A 92 ARG HBy A 92 ARG H 1.0 1.8 6.5 154 91 A 92 ARG H A 92 ARG HD2 1.0 1.8 6.5 155 91 A 92 ARG HDy A 92 ARG H 1.0 1.8 6.5 156 92 A 92 ARG H A 92 ARG HGy 1.0 1.8 6.5 157 92 A 92 ARG HGx A 92 ARG H 1.0 1.8 6.5 158 93 A 93 VAL HA A 93 VAL HG1% 1.0 1.8 6.0 159 94 A 93 VAL HA A 94 VAL HG11 1.0 1.8 6.0 160 95 A 93 VAL HG2% A 93 VAL HB 1.0 1.8 6.0 161 96 A 93 VAL HB A 93 VAL H 1.0 1.8 6.0 162 97 A 93 VAL HB A 94 VAL H 1.0 1.8 6.0 163 98 A 108 VAL HGy% A 93 VAL HG1% 1.0 1.8 6.0 164 99 A 93 VAL HG1% A 94 VAL HB 1.0 1.8 6.0 165 100 A 108 VAL HGy% A 93 VAL H 1.0 1.8 6.5 166 101 A 93 VAL H A 109 TYR HD% 1.0 1.8 6.5 167 102 A 93 VAL H A 109 TYR H 1.0 1.8 6.5 168 103 A 110 PHE HA A 93 VAL H 1.0 1.8 6.5 169 104 A 93 VAL H A 92 ARG HD2 1.0 1.8 6.5 170 104 A 93 VAL H A 110 PHE HBx 1.0 1.8 6.5 171 104 A 93 VAL H A 110 PHE HBy 1.0 1.8 6.5 172 104 A 92 ARG HDy A 93 VAL H 1.0 1.8 6.5 173 105 A 93 VAL H A 92 ARG HGy 1.0 1.8 6.5 174 105 A 92 ARG HGx A 93 VAL H 1.0 1.8 6.5 175 106 A 93 VAL HA A 93 VAL H 1.0 1.8 6.5 176 107 A 93 VAL HG2% A 93 VAL H 1.0 1.8 5.0 177 108 A 94 VAL H A 94 VAL HB 1.0 1.8 4.0 178 109 A 93 VAL HA A 94 VAL H 1.0 1.8 2.9 179 110 A 93 VAL HG1% A 94 VAL H 1.0 1.8 2.9 180 111 A 93 VAL H A 94 VAL H 1.0 1.8 6.5 181 112 A 95 LYS HA A 95 LYS H 1.0 1.8 6.0 182 113 A 95 LYS HA A 96 GLN H 1.0 1.8 3.8 183 114 A 109 TYR HE% A 95 LYS HBx 1.0 1.8 6.0 184 114 A 95 LYS HBy A 109 TYR HE% 1.0 1.8 6.0 185 115 A 95 LYS HA A 95 LYS HBx 1.0 1.8 5.0 186 115 A 95 LYS HA A 95 LYS HBy 1.0 1.8 5.0 187 116 A 95 LYS HA A 95 LYS HBx 1.0 1.8 6.0 188 116 A 95 LYS HA A 95 LYS HBy 1.0 1.8 6.0 189 117 A 95 LYS HBx A 95 LYS HGx 1.0 1.8 5.0 190 117 A 95 LYS HBy A 95 LYS HGx 1.0 1.8 5.0 191 117 A 95 LYS HGy A 95 LYS HBx 1.0 1.8 5.0 192 117 A 95 LYS HBy A 95 LYS HGy 1.0 1.8 5.0 193 118 A 95 LYS HBx A 95 LYS HGx 1.0 1.8 6.0 194 118 A 95 LYS HBy A 95 LYS HGx 1.0 1.8 6.0 195 118 A 95 LYS HGy A 95 LYS HBx 1.0 1.8 6.0 196 118 A 95 LYS HBy A 95 LYS HGy 1.0 1.8 6.0 197 119 A 95 LYS H A 95 LYS HBx 1.0 1.8 5.0 198 119 A 95 LYS H A 95 LYS HBy 1.0 1.8 5.0 199 120 A 96 GLN H A 95 LYS HBx 1.0 1.8 6.0 200 120 A 96 GLN H A 95 LYS HBy 1.0 1.8 6.0 201 121 A 109 TYR HD% A 95 LYS HGx 1.0 1.8 6.0 202 121 A 109 TYR HD% A 95 LYS HGy 1.0 1.8 6.0 203 122 A 109 TYR HE% A 95 LYS HGx 1.0 1.8 6.0 204 122 A 109 TYR HE% A 95 LYS HGy 1.0 1.8 6.0 205 123 A 95 LYS HA A 95 LYS HGx 1.0 1.8 6.0 206 123 A 95 LYS HA A 95 LYS HGy 1.0 1.8 6.0 207 124 A 95 LYS HBx A 95 LYS HGx 1.0 1.8 5.0 208 124 A 95 LYS HBy A 95 LYS HGx 1.0 1.8 5.0 209 124 A 95 LYS HGy A 95 LYS HBx 1.0 1.8 5.0 210 124 A 95 LYS HBy A 95 LYS HGy 1.0 1.8 5.0 211 125 A 95 LYS HEy A 95 LYS HGx 1.0 1.8 5.0 212 125 A 95 LYS HEx A 95 LYS HGx 1.0 1.8 5.0 213 125 A 95 LYS HGy A 95 LYS HEx 1.0 1.8 5.0 214 125 A 95 LYS HGy A 95 LYS HEy 1.0 1.8 5.0 215 126 A 95 LYS H A 95 LYS HGx 1.0 1.8 6.0 216 126 A 95 LYS H A 95 LYS HGy 1.0 1.8 6.0 217 127 A 96 GLN H A 95 LYS HGx 1.0 1.8 6.0 218 127 A 96 GLN H A 95 LYS HGy 1.0 1.8 6.0 219 128 A 95 LYS H A 106 PHE HA 1.0 1.8 6.5 220 129 A 95 LYS H A 107 ASP H 1.0 1.8 6.5 221 130 A 95 LYS H A 108 VAL HGx% 1.0 1.8 4.0 222 131 A 94 VAL H A 95 LYS H 1.0 1.8 6.5 223 132 A 95 LYS H A 95 LYS HGx 1.0 1.8 6.0 224 132 A 95 LYS H A 95 LYS HGy 1.0 1.8 6.0 225 133 A 106 PHE HA A 96 GLN HA 1.0 1.8 6.0 226 134 A 96 GLN HA A 95 LYS HBx 1.0 1.8 6.0 227 134 A 95 LYS HBy A 96 GLN HA 1.0 1.8 6.0 228 135 A 96 GLN HA A 96 GLN HBx 1.0 1.8 5.0 229 135 A 96 GLN HA A 96 GLN HB3 1.0 1.8 5.0 230 136 A 96 GLN HA A 97 ARG HGx 1.0 1.8 5.0 231 136 A 96 GLN HA A 97 ARG HG3 1.0 1.8 5.0 232 137 A 96 GLN HE22 A 104 GLY HAy 1.0 1.8 6.5 233 137 A 104 GLY HAx A 96 GLN HE21 1.0 1.8 6.5 234 137 A 104 GLY HAx A 96 GLN HE22 1.0 1.8 6.5 235 137 A 96 GLN HE21 A 104 GLY HAy 1.0 1.8 6.5 236 138 A 104 GLY HAx A 96 GLN HE22 1.0 1.8 6.5 237 138 A 96 GLN HE22 A 104 GLY HAy 1.0 1.8 6.5 238 138 A 96 GLN HA A 96 GLN HE22 1.0 1.8 6.5 239 138 A 96 GLN HE21 A 104 GLY HAy 1.0 1.8 6.5 240 138 A 104 GLY HAx A 96 GLN HE21 1.0 1.8 6.5 241 138 A 96 GLN HA A 96 GLN HE21 1.0 1.8 6.5 242 139 A 96 GLN HE21 A 96 GLN HGx 1.0 1.8 6.5 243 139 A 96 GLN HGy A 96 GLN HE21 1.0 1.8 6.5 244 139 A 96 GLN HGy A 96 GLN HE22 1.0 1.8 6.5 245 139 A 96 GLN HE22 A 96 GLN HGx 1.0 1.8 6.5 246 140 A 96 GLN HE21 A 96 GLN HGx 1.0 1.8 6.5 247 140 A 96 GLN HGy A 96 GLN HE21 1.0 1.8 6.5 248 141 A 96 GLN HE21 A 97 ARG H 1.0 1.8 6.5 249 142 A 96 GLN HE21 A 98 LEU HD1% 1.0 1.8 6.5 250 143 A 96 GLN HA A 96 GLN HGx 1.0 1.8 6.0 251 143 A 96 GLN HA A 96 GLN HGy 1.0 1.8 6.0 252 144 A 96 GLN HB3 A 96 GLN HGx 1.0 1.8 6.0 253 144 A 96 GLN HGy A 96 GLN HBx 1.0 1.8 6.0 254 144 A 96 GLN HB3 A 96 GLN HGy 1.0 1.8 6.0 255 144 A 96 GLN HBx A 96 GLN HGx 1.0 1.8 6.0 256 145 A 96 GLN H A 96 GLN HA 1.0 1.8 6.0 257 146 A 96 GLN H A 96 GLN HBx 1.0 1.8 6.5 258 146 A 96 GLN H A 96 GLN HB3 1.0 1.8 6.5 259 147 A 96 GLN H A 97 ARG HGx 1.0 1.8 6.5 260 147 A 96 GLN H A 97 ARG HG3 1.0 1.8 6.5 261 148 A 97 ARG HA A 97 ARG HBx 1.0 1.8 3.8 262 148 A 97 ARG HA A 97 ARG HBy 1.0 1.8 3.8 263 149 A 97 ARG HA A 97 ARG HDx 1.0 1.8 6.0 264 149 A 97 ARG HA A 97 ARG HDy 1.0 1.8 6.0 265 150 A 98 LEU HD1% A 97 ARG HA 1.0 1.8 6.0 266 151 A 97 ARG HA A 99 PHE H 1.0 1.8 6.0 267 152 A 102 THR H A 97 ARG HBx 1.0 1.8 6.0 268 152 A 97 ARG HBy A 102 THR H 1.0 1.8 6.0 269 153 A 97 ARG H A 97 ARG HBx 1.0 1.8 4.0 270 153 A 97 ARG H A 97 ARG HBy 1.0 1.8 4.0 271 154 A 102 THR HB A 97 ARG HDx 1.0 1.8 6.0 272 154 A 97 ARG HDy A 102 THR HB 1.0 1.8 6.0 273 155 A 102 THR HG2% A 97 ARG HDx 1.0 1.8 6.0 274 155 A 97 ARG HDy A 102 THR HG2% 1.0 1.8 6.0 275 156 A 97 ARG HBy A 97 ARG HDx 1.0 1.8 5.0 276 156 A 97 ARG HDy A 97 ARG HBx 1.0 1.8 5.0 277 156 A 97 ARG HBy A 97 ARG HDy 1.0 1.8 5.0 278 156 A 97 ARG HBx A 97 ARG HDx 1.0 1.8 5.0 279 157 A 97 ARG HDx A 97 ARG HGx 1.0 1.8 6.0 280 157 A 97 ARG HDy A 97 ARG HGx 1.0 1.8 6.0 281 157 A 97 ARG HG3 A 97 ARG HDx 1.0 1.8 6.0 282 157 A 97 ARG HG3 A 97 ARG HDy 1.0 1.8 6.0 283 158 A 99 PHE HD% A 97 ARG HDx 1.0 1.8 6.0 284 158 A 97 ARG HDy A 99 PHE HD% 1.0 1.8 6.0 285 159 A 97 ARG HE A 107 ASP HBx 1.0 1.8 6.5 286 159 A 97 ARG HE A 107 ASP HBy 1.0 1.8 6.5 287 160 A 97 ARG HE A 97 ARG HBx 1.0 1.8 6.5 288 160 A 97 ARG HBy A 97 ARG HE 1.0 1.8 6.5 289 160 A 95 LYS HBy A 97 ARG HE 1.0 1.8 6.5 290 160 A 97 ARG HE A 95 LYS HBx 1.0 1.8 6.5 291 161 A 97 ARG HA A 97 ARG HE 1.0 1.8 6.5 292 162 A 102 THR HB A 97 ARG HE 1.0 1.8 6.5 293 162 A 97 ARG HA A 97 ARG HE 1.0 1.8 6.5 294 163 A 97 ARG HE A 97 ARG HBx 1.0 1.8 5.0 295 163 A 97 ARG HBy A 97 ARG HE 1.0 1.8 5.0 296 164 A 97 ARG HE A 97 ARG HDx 1.0 1.8 6.5 297 164 A 97 ARG HDy A 97 ARG HE 1.0 1.8 6.5 298 165 A 97 ARG HE A 97 ARG HGx 1.0 1.8 4.0 299 165 A 97 ARG HG3 A 97 ARG HE 1.0 1.8 4.0 300 166 A 97 ARG HA A 97 ARG HGx 1.0 1.8 6.0 301 166 A 97 ARG HG3 A 97 ARG HA 1.0 1.8 6.0 302 167 A 97 ARG H A 103 ALA HA 1.0 1.8 6.0 303 168 A 97 ARG H A 104 GLY H 1.0 1.8 6.5 304 169 A 97 ARG H A 105 ARG H 1.0 1.8 6.5 305 170 A 106 PHE HA A 97 ARG H 1.0 1.8 6.5 306 171 A 97 ARG H A 106 PHE HD% 1.0 1.8 6.5 307 172 A 96 GLN HA A 97 ARG H 1.0 1.8 4.0 308 173 A 97 ARG H A 96 GLN HGx 1.0 1.8 6.0 309 173 A 96 GLN HGy A 97 ARG H 1.0 1.8 6.0 310 174 A 97 ARG H A 96 GLN HGx 1.0 1.8 6.5 311 174 A 97 ARG H A 105 ARG HBx 1.0 1.8 6.5 312 174 A 97 ARG H A 105 ARG HBy 1.0 1.8 6.5 313 174 A 96 GLN HGy A 97 ARG H 1.0 1.8 6.5 314 175 A 97 ARG H A 97 ARG HDx 1.0 1.8 6.5 315 175 A 97 ARG H A 97 ARG HDy 1.0 1.8 6.5 316 176 A 97 ARG H A 97 ARG HE 1.0 1.8 6.5 317 177 A 97 ARG H A 97 ARG HGx 1.0 1.8 5.0 318 177 A 97 ARG HG3 A 97 ARG H 1.0 1.8 5.0 319 178 A 98 LEU HA A 103 ALA HB% 1.0 1.8 6.0 320 179 A 98 LEU HA A 98 LEU HBy 1.0 1.8 5.0 321 179 A 98 LEU HA A 98 LEU HBx 1.0 1.8 5.0 322 180 A 98 LEU HD1% A 98 LEU HA 1.0 1.8 2.7 323 181 A 98 LEU HA A 98 LEU H 1.0 1.8 6.0 324 182 A 99 PHE H A 98 LEU HA 1.0 1.8 6.0 325 183 A 98 LEU HA A 98 LEU HBy 1.0 1.8 5.0 326 183 A 98 LEU HA A 98 LEU HBx 1.0 1.8 5.0 327 184 A 98 LEU HD1% A 98 LEU HBy 1.0 1.8 5.0 328 184 A 98 LEU HD1% A 98 LEU HBx 1.0 1.8 5.0 329 185 A 98 LEU H A 98 LEU HBy 1.0 1.8 6.0 330 185 A 98 LEU HBx A 98 LEU H 1.0 1.8 6.0 331 186 A 99 PHE HD% A 98 LEU HBy 1.0 1.8 6.0 332 186 A 99 PHE HD% A 98 LEU HBx 1.0 1.8 6.0 333 187 A 99 PHE H A 98 LEU HBy 1.0 1.8 6.0 334 187 A 99 PHE H A 98 LEU HBx 1.0 1.8 6.0 335 188 A 98 LEU HA A 98 LEU HG 1.0 1.8 6.0 336 189 A 98 LEU HD1% A 98 LEU HG 1.0 1.8 3.8 337 190 A 97 ARG HA A 98 LEU H 1.0 1.8 3.8 338 191 A 98 LEU H A 97 ARG HBx 1.0 1.8 6.5 339 191 A 97 ARG HBy A 98 LEU H 1.0 1.8 6.5 340 192 A 98 LEU H A 97 ARG HGx 1.0 1.8 6.5 341 192 A 97 ARG HG3 A 98 LEU H 1.0 1.8 6.5 342 193 A 98 LEU HD1% A 98 LEU H 1.0 1.8 6.5 343 194 A 98 LEU H A 98 LEU HG 1.0 1.8 6.5 344 195 A 99 PHE HA A 100 GLY H 1.0 1.8 3.8 345 196 A 103 ALA HB% A 99 PHE HA 1.0 1.8 5.0 346 197 A 99 PHE HA A 99 PHE HBy 1.0 1.8 5.0 347 197 A 99 PHE HA A 99 PHE HBx 1.0 1.8 5.0 348 198 A 99 PHE HA A 99 PHE HBy 1.0 1.8 3.8 349 198 A 99 PHE HA A 99 PHE HBx 1.0 1.8 3.8 350 199 A 99 PHE HD% A 99 PHE HBy 1.0 1.8 3.8 351 199 A 99 PHE HD% A 99 PHE HBx 1.0 1.8 3.8 352 200 A 99 PHE H A 99 PHE HBy 1.0 1.8 5.0 353 200 A 99 PHE H A 99 PHE HBx 1.0 1.8 5.0 354 201 A 99 PHE HD% A 99 PHE HA 1.0 1.8 5.0 355 202 A 99 PHE H A 103 ALA HB% 1.0 1.8 6.0 356 203 A 99 PHE H A 97 ARG HBx 1.0 1.8 6.5 357 203 A 97 ARG HBy A 99 PHE H 1.0 1.8 6.5 358 204 A 99 PHE H A 97 ARG HGx 1.0 1.8 6.5 359 204 A 97 ARG HG3 A 99 PHE H 1.0 1.8 6.5 360 205 A 98 LEU HD1% A 99 PHE H 1.0 1.8 6.5 361 206 A 99 PHE H A 98 LEU H 1.0 1.8 4.0 362 207 A 99 PHE H A 99 PHE HA 1.0 1.8 5.0 363 208 A 99 PHE H A 99 PHE HD% 1.0 1.8 6.5 364 209 A 100 GLY H A 100 GLY HAx 1.0 1.8 4.0 365 209 A 100 GLY H A 100 GLY HAy 1.0 1.8 4.0 366 210 A 102 THR H A 100 GLY HAx 1.0 1.8 6.0 367 210 A 102 THR H A 100 GLY HAy 1.0 1.8 6.0 368 211 A 100 GLY H A 100 GLY HAx 1.0 1.8 5.0 369 211 A 100 GLY H A 100 GLY HAy 1.0 1.8 5.0 370 212 A 100 GLY H A 101 LYS HBx 1.0 1.8 6.5 371 212 A 100 GLY H A 101 LYS HB3 1.0 1.8 6.5 372 213 A 100 GLY H A 101 LYS HGx 1.0 1.8 6.5 373 213 A 100 GLY H A 101 LYS HGy 1.0 1.8 6.5 374 214 A 100 GLY H A 101 LYS H 1.0 1.8 6.5 375 215 A 103 ALA HB% A 100 GLY H 1.0 1.8 6.0 376 216 A 100 GLY H A 99 PHE HBy 1.0 1.8 5.0 377 216 A 100 GLY H A 99 PHE HBx 1.0 1.8 5.0 378 217 A 100 GLY H A 99 PHE HBy 1.0 1.8 6.0 379 217 A 100 GLY H A 99 PHE HBx 1.0 1.8 6.0 380 218 A 99 PHE HD% A 100 GLY H 1.0 1.8 6.5 381 219 A 101 LYS HA A 101 LYS HBx 1.0 1.8 5.0 382 219 A 101 LYS HB3 A 101 LYS HA 1.0 1.8 5.0 383 220 A 101 LYS HA A 101 LYS HGx 1.0 1.8 6.0 384 220 A 101 LYS HGy A 101 LYS HA 1.0 1.8 6.0 385 221 A 101 LYS H A 101 LYS HA 1.0 1.8 5.0 386 222 A 101 LYS HB3 A 101 LYS HEx 1.0 1.8 6.0 387 222 A 101 LYS HBx A 101 LYS HEx 1.0 1.8 6.0 388 222 A 101 LYS HE3 A 101 LYS HBx 1.0 1.8 6.0 389 222 A 101 LYS HB3 A 101 LYS HE3 1.0 1.8 6.0 390 223 A 102 THR H A 101 LYS HBx 1.0 1.8 6.0 391 223 A 102 THR H A 101 LYS HB3 1.0 1.8 6.0 392 224 A 101 LYS HA A 101 LYS HDx 1.0 1.8 6.0 393 224 A 101 LYS HA A 101 LYS HD3 1.0 1.8 6.0 394 225 A 101 LYS HBx A 101 LYS HDx 1.0 1.8 2.7 395 225 A 101 LYS HB3 A 101 LYS HDx 1.0 1.8 2.7 396 225 A 101 LYS HD3 A 101 LYS HBx 1.0 1.8 2.7 397 225 A 101 LYS HB3 A 101 LYS HD3 1.0 1.8 2.7 398 226 A 101 LYS HD3 A 101 LYS HEx 1.0 1.8 2.7 399 226 A 101 LYS HDx A 101 LYS HEx 1.0 1.8 2.7 400 226 A 101 LYS HE3 A 101 LYS HDx 1.0 1.8 2.7 401 226 A 101 LYS HE3 A 101 LYS HD3 1.0 1.8 2.7 402 227 A 101 LYS HDx A 101 LYS HGx 1.0 1.8 2.7 403 227 A 101 LYS HD3 A 101 LYS HGx 1.0 1.8 2.7 404 227 A 101 LYS HGy A 101 LYS HDx 1.0 1.8 2.7 405 227 A 101 LYS HGy A 101 LYS HD3 1.0 1.8 2.7 406 228 A 101 LYS HD3 A 102 THR HG2% 1.0 1.8 6.0 407 228 A 102 THR HG2% A 101 LYS HDx 1.0 1.8 6.0 408 229 A 101 LYS HA A 101 LYS HGx 1.0 1.8 6.0 409 229 A 101 LYS HGy A 101 LYS HA 1.0 1.8 6.0 410 230 A 101 LYS HB3 A 101 LYS HGx 1.0 1.8 3.8 411 230 A 101 LYS HBx A 101 LYS HGx 1.0 1.8 3.8 412 230 A 101 LYS HGy A 101 LYS HBx 1.0 1.8 3.8 413 230 A 101 LYS HB3 A 101 LYS HGy 1.0 1.8 3.8 414 231 A 101 LYS HE3 A 101 LYS HGx 1.0 1.8 5.0 415 231 A 101 LYS HEx A 101 LYS HGx 1.0 1.8 5.0 416 231 A 101 LYS HGy A 101 LYS HEx 1.0 1.8 5.0 417 231 A 101 LYS HGy A 101 LYS HE3 1.0 1.8 5.0 418 232 A 101 LYS H A 101 LYS HGx 1.0 1.8 5.0 419 232 A 101 LYS HGy A 101 LYS H 1.0 1.8 5.0 420 233 A 101 LYS H A 101 LYS HGx 1.0 1.8 6.0 421 233 A 101 LYS HGy A 101 LYS H 1.0 1.8 6.0 422 234 A 101 LYS H A 100 GLY HAx 1.0 1.8 4.0 423 234 A 100 GLY HAy A 101 LYS H 1.0 1.8 4.0 424 235 A 101 LYS H A 101 LYS HBx 1.0 1.8 2.9 425 235 A 101 LYS HB3 A 101 LYS H 1.0 1.8 2.9 426 236 A 101 LYS H A 101 LYS HDx 1.0 1.8 6.5 427 236 A 101 LYS H A 101 LYS HD3 1.0 1.8 6.5 428 237 A 101 LYS H A 102 THR HG2% 1.0 1.8 6.5 429 238 A 102 THR H A 101 LYS H 1.0 1.8 5.0 430 239 A 102 THR HA A 101 LYS HBx 1.0 1.8 6.0 431 239 A 101 LYS HB3 A 102 THR HA 1.0 1.8 6.0 432 240 A 102 THR HB A 102 THR HA 1.0 1.8 5.0 433 241 A 102 THR HA A 102 THR HG2% 1.0 1.8 3.8 434 242 A 102 THR HA A 103 ALA H 1.0 1.8 5.0 435 243 A 102 THR HB A 101 LYS HEx 1.0 1.8 6.0 436 243 A 102 THR HB A 101 LYS HE3 1.0 1.8 6.0 437 244 A 102 THR HB A 102 THR HG2% 1.0 1.8 3.8 438 245 A 102 THR HB A 105 ARG H 1.0 1.8 6.0 439 246 A 101 LYS HB3 A 102 THR HG2% 1.0 1.8 3.8 440 246 A 102 THR HG2% A 101 LYS HBx 1.0 1.8 3.8 441 247 A 102 THR H A 101 LYS HA 1.0 1.8 6.5 442 248 A 102 THR H A 102 THR HA 1.0 1.8 6.0 443 249 A 102 THR H A 102 THR HG2% 1.0 1.8 3.8 444 250 A 103 ALA HA A 103 ALA HB% 1.0 1.8 2.7 445 251 A 103 ALA HA A 104 GLY HAy 1.0 1.8 6.0 446 251 A 104 GLY HAx A 103 ALA HA 1.0 1.8 6.0 447 252 A 103 ALA HA A 105 ARG H 1.0 1.8 6.0 448 253 A 103 ALA HA A 97 ARG HBx 1.0 1.8 5.0 449 253 A 97 ARG HBy A 103 ALA HA 1.0 1.8 5.0 450 254 A 103 ALA HA A 98 LEU HA 1.0 1.8 6.0 451 255 A 99 PHE H A 103 ALA HA 1.0 1.8 6.0 452 256 A 103 ALA HB% A 102 THR HA 1.0 1.8 6.0 453 257 A 103 ALA HB% A 104 GLY HAy 1.0 1.8 6.0 454 257 A 104 GLY HAx A 103 ALA HB% 1.0 1.8 6.0 455 258 A 103 ALA HB% A 97 ARG HBx 1.0 1.8 6.0 456 258 A 97 ARG HBy A 103 ALA HB% 1.0 1.8 6.0 457 259 A 101 LYS HA A 103 ALA H 1.0 1.8 6.5 458 260 A 103 ALA H A 101 LYS HBx 1.0 1.8 6.5 459 260 A 101 LYS HB3 A 103 ALA H 1.0 1.8 6.5 460 261 A 103 ALA H A 101 LYS HGx 1.0 1.8 6.5 461 261 A 101 LYS HGy A 103 ALA H 1.0 1.8 6.5 462 262 A 101 LYS H A 103 ALA H 1.0 1.8 6.5 463 263 A 102 THR HB A 103 ALA H 1.0 1.8 6.5 464 264 A 103 ALA H A 102 THR HG2% 1.0 1.8 6.0 465 265 A 102 THR H A 103 ALA H 1.0 1.8 4.0 466 266 A 103 ALA HA A 103 ALA H 1.0 1.8 4.0 467 267 A 103 ALA HB% A 103 ALA H 1.0 1.8 2.7 468 268 A 104 GLY H A 104 GLY HAy 1.0 1.8 6.0 469 268 A 104 GLY HAx A 104 GLY H 1.0 1.8 6.0 470 269 A 105 ARG H A 104 GLY HAy 1.0 1.8 6.0 471 269 A 104 GLY HAx A 105 ARG H 1.0 1.8 6.0 472 270 A 96 GLN HGy A 104 GLY HAy 1.0 1.8 6.0 473 270 A 96 GLN HGx A 104 GLY HAy 1.0 1.8 6.0 474 270 A 104 GLY HAx A 96 GLN HGx 1.0 1.8 6.0 475 270 A 104 GLY HAx A 96 GLN HGy 1.0 1.8 6.0 476 271 A 103 ALA HA A 104 GLY H 1.0 1.8 3.8 477 272 A 104 GLY H A 103 ALA HB% 1.0 1.8 5.0 478 273 A 104 GLY H A 103 ALA H 1.0 1.8 6.5 479 274 A 104 GLY H A 104 GLY HAy 1.0 1.8 5.0 480 274 A 104 GLY HAx A 104 GLY H 1.0 1.8 5.0 481 275 A 104 GLY H A 97 ARG HBx 1.0 1.8 5.0 482 275 A 97 ARG HBy A 104 GLY H 1.0 1.8 5.0 483 276 A 105 ARG HA A 105 ARG HBx 1.0 1.8 6.0 484 276 A 105 ARG HBy A 105 ARG HA 1.0 1.8 6.0 485 277 A 105 ARG H A 105 ARG HBx 1.0 1.8 6.0 486 277 A 105 ARG H A 105 ARG HBy 1.0 1.8 6.0 487 278 A 106 PHE H A 105 ARG HBx 1.0 1.8 6.0 488 278 A 105 ARG HBy A 106 PHE H 1.0 1.8 6.0 489 279 A 105 ARG HA A 105 ARG HE 1.0 1.8 6.5 490 280 A 105 ARG HE A 105 ARG HBx 1.0 1.8 5.0 491 280 A 105 ARG HBy A 105 ARG HE 1.0 1.8 5.0 492 281 A 105 ARG HE A 105 ARG HDx 1.0 1.8 6.5 493 281 A 105 ARG HE A 105 ARG HDy 1.0 1.8 6.5 494 282 A 105 ARG HA A 105 ARG HGy 1.0 1.8 6.0 495 282 A 105 ARG HA A 105 ARG HGx 1.0 1.8 6.0 496 283 A 105 ARG HDx A 105 ARG HGy 1.0 1.8 6.0 497 283 A 105 ARG HDy A 105 ARG HGy 1.0 1.8 6.0 498 283 A 105 ARG HGx A 105 ARG HDx 1.0 1.8 6.0 499 283 A 105 ARG HDy A 105 ARG HGx 1.0 1.8 6.0 500 284 A 105 ARG H A 105 ARG HGy 1.0 1.8 6.0 501 284 A 105 ARG H A 105 ARG HGx 1.0 1.8 6.0 502 285 A 105 ARG H A 102 THR HG2% 1.0 1.8 6.5 503 286 A 105 ARG H A 103 ALA HB% 1.0 1.8 6.5 504 287 A 104 GLY H A 105 ARG H 1.0 1.8 5.0 505 288 A 105 ARG H A 105 ARG HA 1.0 1.8 5.0 506 289 A 105 ARG H A 105 ARG HBx 1.0 1.8 4.0 507 289 A 105 ARG H A 105 ARG HBy 1.0 1.8 4.0 508 290 A 105 ARG H A 105 ARG HE 1.0 1.8 6.5 509 291 A 105 ARG H A 106 PHE H 1.0 1.8 6.5 510 292 A 105 ARG H A 97 ARG HDx 1.0 1.8 6.5 511 292 A 97 ARG HDy A 105 ARG H 1.0 1.8 6.5 512 293 A 105 ARG H A 97 ARG HGx 1.0 1.8 6.5 513 293 A 97 ARG HG3 A 105 ARG H 1.0 1.8 6.5 514 294 A 106 PHE HA A 106 PHE HBy 1.0 1.8 6.0 515 294 A 106 PHE HA A 106 PHE HBx 1.0 1.8 6.0 516 295 A 106 PHE H A 106 PHE HBy 1.0 1.8 6.0 517 295 A 106 PHE H A 106 PHE HBx 1.0 1.8 6.0 518 296 A 107 ASP H A 106 PHE HBy 1.0 1.8 6.0 519 296 A 107 ASP H A 106 PHE HBx 1.0 1.8 6.0 520 297 A 108 VAL HGx% A 106 PHE HBy 1.0 1.8 5.0 521 297 A 108 VAL HGx% A 106 PHE HBx 1.0 1.8 5.0 522 298 A 145 VAL HG11 A 106 PHE HBy 1.0 1.8 6.0 523 298 A 106 PHE HBx A 145 VAL HG11 1.0 1.8 6.0 524 299 A 105 ARG HA A 106 PHE H 1.0 1.8 4.0 525 300 A 106 PHE HA A 106 PHE H 1.0 1.8 6.5 526 301 A 106 PHE H A 106 PHE HBy 1.0 1.8 5.0 527 301 A 106 PHE H A 106 PHE HBx 1.0 1.8 5.0 528 302 A 106 PHE HD% A 106 PHE H 1.0 1.8 6.5 529 303 A 108 VAL HGx% A 106 PHE H 1.0 1.8 6.5 530 304 A 107 ASP HA A 107 ASP HBx 1.0 1.8 6.0 531 304 A 107 ASP HBy A 107 ASP HA 1.0 1.8 6.0 532 305 A 108 VAL HGx% A 107 ASP HA 1.0 1.8 6.0 533 306 A 107 ASP HA A 108 VAL H 1.0 1.8 4.0 534 307 A 106 PHE HA A 107 ASP H 1.0 1.8 5.0 535 308 A 107 ASP H A 106 PHE HD% 1.0 1.8 6.5 536 309 A 107 ASP H A 107 ASP HA 1.0 1.8 6.0 537 310 A 107 ASP H A 107 ASP HBx 1.0 1.8 6.5 538 310 A 107 ASP H A 107 ASP HBy 1.0 1.8 6.5 539 311 A 107 ASP H A 108 VAL HGx% 1.0 1.8 6.5 540 312 A 107 ASP H A 95 LYS HBx 1.0 1.8 6.5 541 312 A 95 LYS HBy A 107 ASP H 1.0 1.8 6.5 542 313 A 107 ASP H A 96 GLN HA 1.0 1.8 6.5 543 314 A 108 VAL HGx% A 108 VAL HA 1.0 1.8 5.0 544 315 A 108 VAL HGx% A 108 VAL HB 1.0 1.8 5.0 545 316 A 108 VAL H A 108 VAL HB 1.0 1.8 5.0 546 317 A 108 VAL HGx% A 108 VAL H 1.0 1.8 5.0 547 318 A 108 VAL HGy% A 108 VAL HA 1.0 1.8 6.0 548 319 A 108 VAL HGy% A 108 VAL HB 1.0 1.8 5.0 549 320 A 108 VAL HGy% A 108 VAL HGx% 1.0 1.8 3.8 550 321 A 108 VAL H A 107 ASP HBx 1.0 1.8 6.5 551 321 A 107 ASP HBy A 108 VAL H 1.0 1.8 6.5 552 322 A 108 VAL HGy% A 108 VAL H 1.0 1.8 6.5 553 323 A 109 TYR HA A 109 TYR HBx 1.0 1.8 6.0 554 323 A 109 TYR HA A 109 TYR HBy 1.0 1.8 6.0 555 324 A 109 TYR HD% A 109 TYR HA 1.0 1.8 6.0 556 325 A 109 TYR HA A 110 PHE H 1.0 1.8 5.0 557 326 A 109 TYR HD% A 109 TYR HBx 1.0 1.8 6.0 558 326 A 109 TYR HD% A 109 TYR HBy 1.0 1.8 6.0 559 327 A 109 TYR HD% A 109 TYR HE% 1.0 1.8 3.8 560 328 A 109 TYR HD% A 109 TYR H 1.0 1.8 6.0 561 329 A 109 TYR HD% A 119 ARG HGx 1.0 1.8 6.0 562 329 A 109 TYR HD% A 119 ARG HG3 1.0 1.8 6.0 563 330 A 109 TYR HE% A 111 ILE HG1y 1.0 1.8 6.0 564 330 A 111 ILE HG1x A 109 TYR HE% 1.0 1.8 6.0 565 331 A 93 VAL HG1% A 109 TYR HE% 1.0 1.8 6.0 566 332 A 109 TYR HE% A 95 LYS HBx 1.0 1.8 6.0 567 332 A 95 LYS HBy A 109 TYR HE% 1.0 1.8 6.0 568 333 A 109 TYR H A 108 VAL HA 1.0 1.8 4.0 569 334 A 109 TYR H A 108 VAL HB 1.0 1.8 6.5 570 335 A 109 TYR H A 108 VAL HGx% 1.0 1.8 5.0 571 336 A 108 VAL HGy% A 109 TYR H 1.0 1.8 5.0 572 337 A 109 TYR H A 109 TYR HA 1.0 1.8 6.5 573 338 A 109 TYR H A 109 TYR HBx 1.0 1.8 6.5 574 338 A 109 TYR H A 109 TYR HBy 1.0 1.8 6.5 575 339 A 109 TYR H A 109 TYR HE% 1.0 1.8 6.0 576 340 A 94 VAL HG11 A 109 TYR H 1.0 1.8 4.0 577 341 A 110 PHE HA A 109 TYR HD% 1.0 1.8 6.0 578 342 A 110 PHE HA A 110 PHE HBx 1.0 1.8 6.0 579 342 A 110 PHE HA A 110 PHE HBy 1.0 1.8 6.0 580 343 A 110 PHE HA A 111 ILE H 1.0 1.8 5.0 581 344 A 109 TYR HD% A 110 PHE HBx 1.0 1.8 6.0 582 344 A 109 TYR HD% A 110 PHE HBy 1.0 1.8 6.0 583 345 A 110 PHE HA A 110 PHE HBx 1.0 1.8 6.0 584 345 A 110 PHE HA A 110 PHE HBy 1.0 1.8 6.0 585 346 A 110 PHE H A 110 PHE HBx 1.0 1.8 5.0 586 346 A 110 PHE HBy A 110 PHE H 1.0 1.8 5.0 587 347 A 111 ILE H A 110 PHE HBx 1.0 1.8 6.0 588 347 A 110 PHE HBy A 111 ILE H 1.0 1.8 6.0 589 348 A 124 LEU HDx% A 110 PHE HBx 1.0 1.8 6.0 590 348 A 124 LEU HDx% A 110 PHE HBy 1.0 1.8 6.0 591 349 A 124 LEU HDy% A 110 PHE HBx 1.0 1.8 6.0 592 349 A 110 PHE HBy A 124 LEU HDy% 1.0 1.8 6.0 593 350 A 109 TYR HD% A 110 PHE H 1.0 1.8 6.5 594 351 A 110 PHE HA A 110 PHE H 1.0 1.8 6.0 595 352 A 110 PHE H A 110 PHE HBx 1.0 1.8 6.0 596 352 A 110 PHE HBy A 110 PHE H 1.0 1.8 6.0 597 353 A 110 PHE H A 118 PHE H 1.0 1.8 6.5 598 354 A 111 ILE HB A 111 ILE HA 1.0 1.8 6.0 599 355 A 111 ILE H A 111 ILE HA 1.0 1.8 6.0 600 356 A 111 ILE HA A 112 SER H 1.0 1.8 4.0 601 357 A 111 ILE HB A 111 ILE HG1y 1.0 1.8 5.0 602 357 A 111 ILE HG1x A 111 ILE HB 1.0 1.8 5.0 603 358 A 111 ILE HB A 111 ILE HG2% 1.0 1.8 3.8 604 359 A 111 ILE HB A 91 GLU HBy 1.0 1.8 5.0 605 359 A 91 GLU HBx A 111 ILE HB 1.0 1.8 5.0 606 360 A 111 ILE HB A 91 GLU HGx 1.0 1.8 6.0 607 360 A 91 GLU HGy A 111 ILE HB 1.0 1.8 6.0 608 361 A 109 TYR HE% A 111 ILE HG1y 1.0 1.8 6.0 609 361 A 111 ILE HG1x A 109 TYR HE% 1.0 1.8 6.0 610 362 A 111 ILE HA A 111 ILE HG1y 1.0 1.8 6.0 611 362 A 111 ILE HG1x A 111 ILE HA 1.0 1.8 6.0 612 363 A 111 ILE HD1% A 111 ILE HG1y 1.0 1.8 2.7 613 363 A 111 ILE HG1x A 111 ILE HD1% 1.0 1.8 2.7 614 364 A 111 ILE HD1% A 111 ILE HG1y 1.0 1.8 3.8 615 364 A 111 ILE HG1x A 111 ILE HD1% 1.0 1.8 3.8 616 365 A 111 ILE H A 111 ILE HG1y 1.0 1.8 6.0 617 365 A 111 ILE HG1x A 111 ILE H 1.0 1.8 6.0 618 366 A 111 ILE HG2% A 111 ILE HA 1.0 1.8 5.0 619 367 A 111 ILE HG2% A 111 ILE HG1y 1.0 1.8 3.8 620 367 A 111 ILE HG1x A 111 ILE HG2% 1.0 1.8 3.8 621 368 A 111 ILE HG2% A 111 ILE HG1y 1.0 1.8 5.0 622 368 A 111 ILE HG1x A 111 ILE HG2% 1.0 1.8 5.0 623 369 A 111 ILE HG2% A 111 ILE H 1.0 1.8 6.0 624 370 A 111 ILE HG2% A 115 GLY HAx 1.0 1.8 6.0 625 370 A 111 ILE HG2% A 115 GLY HAy 1.0 1.8 6.0 626 371 A 111 ILE HG2% A 116 LEU H 1.0 1.8 6.0 627 372 A 111 ILE HG2% A 117 LYS HEx 1.0 1.8 6.0 628 372 A 111 ILE HG2% A 117 LYS HE3 1.0 1.8 6.0 629 373 A 111 ILE HG2% A 117 LYS HGx 1.0 1.8 6.0 630 373 A 111 ILE HG2% A 117 LYS HGy 1.0 1.8 6.0 631 374 A 111 ILE HG2% A 91 GLU HBy 1.0 1.8 6.0 632 374 A 91 GLU HBx A 111 ILE HG2% 1.0 1.8 6.0 633 375 A 111 ILE HG2% A 93 VAL HB 1.0 1.8 6.0 634 376 A 93 VAL HG2% A 111 ILE HG2% 1.0 1.8 6.0 635 377 A 111 ILE HB A 111 ILE H 1.0 1.8 6.0 636 378 A 111 ILE H A 111 ILE HD1% 1.0 1.8 6.5 637 379 A 91 GLU H A 111 ILE H 1.0 1.8 6.5 638 380 A 93 VAL HG2% A 111 ILE H 1.0 1.8 6.5 639 381 A 112 SER HA A 112 SER HBx 1.0 1.8 6.0 640 381 A 112 SER HA A 112 SER HBy 1.0 1.8 6.0 641 382 A 112 SER HA A 113 PRO HDx 1.0 1.8 5.0 642 382 A 113 PRO HDy A 112 SER HA 1.0 1.8 5.0 643 383 A 112 SER HA A 112 SER HBx 1.0 1.8 6.0 644 383 A 112 SER HA A 112 SER HBy 1.0 1.8 6.0 645 384 A 112 SER HBx A 113 PRO HDx 1.0 1.8 6.0 646 384 A 112 SER HBy A 113 PRO HDx 1.0 1.8 6.0 647 384 A 113 PRO HDy A 112 SER HBx 1.0 1.8 6.0 648 384 A 113 PRO HDy A 112 SER HBy 1.0 1.8 6.0 649 385 A 127 TYR HE% A 112 SER HBx 1.0 1.8 6.0 650 385 A 112 SER HBy A 127 TYR HE% 1.0 1.8 6.0 651 386 A 111 ILE HG2% A 112 SER H 1.0 1.8 5.0 652 387 A 112 SER H A 112 SER HA 1.0 1.8 6.0 653 388 A 112 SER H A 112 SER HBx 1.0 1.8 5.0 654 388 A 112 SER H A 112 SER HBy 1.0 1.8 5.0 655 389 A 112 SER H A 112 SER HBx 1.0 1.8 6.0 656 389 A 112 SER H A 112 SER HBy 1.0 1.8 6.0 657 390 A 112 SER H A 115 GLY HAx 1.0 1.8 6.5 658 390 A 112 SER H A 115 GLY HAy 1.0 1.8 6.5 659 391 A 118 PHE H A 112 SER H 1.0 1.8 6.5 660 392 A 113 PRO HA A 113 PRO HBx 1.0 1.8 5.0 661 392 A 113 PRO HA A 113 PRO HBy 1.0 1.8 5.0 662 393 A 113 PRO HA A 113 PRO HGy 1.0 1.8 6.0 663 393 A 113 PRO HGx A 113 PRO HA 1.0 1.8 6.0 664 394 A 113 PRO HA A 113 PRO HBx 1.0 1.8 6.0 665 394 A 113 PRO HA A 113 PRO HBy 1.0 1.8 6.0 666 395 A 112 SER HA A 113 PRO HDx 1.0 1.8 5.0 667 395 A 113 PRO HDy A 112 SER HA 1.0 1.8 5.0 668 396 A 112 SER HBx A 113 PRO HDx 1.0 1.8 6.0 669 396 A 112 SER HBy A 113 PRO HDx 1.0 1.8 6.0 670 396 A 113 PRO HDy A 112 SER HBx 1.0 1.8 6.0 671 396 A 113 PRO HDy A 112 SER HBy 1.0 1.8 6.0 672 397 A 113 PRO HBx A 113 PRO HDx 1.0 1.8 6.0 673 397 A 113 PRO HBy A 113 PRO HDx 1.0 1.8 6.0 674 397 A 113 PRO HDy A 113 PRO HBx 1.0 1.8 6.0 675 397 A 113 PRO HDy A 113 PRO HBy 1.0 1.8 6.0 676 398 A 113 PRO HDx A 113 PRO HGy 1.0 1.8 6.0 677 398 A 113 PRO HDy A 113 PRO HGy 1.0 1.8 6.0 678 398 A 113 PRO HGx A 113 PRO HDx 1.0 1.8 6.0 679 398 A 113 PRO HGx A 113 PRO HDy 1.0 1.8 6.0 680 399 A 90 TRP HE1 A 113 PRO HDx 1.0 1.8 6.0 681 399 A 90 TRP HE1 A 113 PRO HDy 1.0 1.8 6.0 682 400 A 113 PRO HA A 113 PRO HGy 1.0 1.8 6.0 683 400 A 113 PRO HGx A 113 PRO HA 1.0 1.8 6.0 684 401 A 113 PRO HBy A 113 PRO HGy 1.0 1.8 5.0 685 401 A 113 PRO HBx A 113 PRO HGy 1.0 1.8 5.0 686 401 A 113 PRO HGx A 113 PRO HBx 1.0 1.8 5.0 687 401 A 113 PRO HGx A 113 PRO HBy 1.0 1.8 5.0 688 402 A 113 PRO HBy A 113 PRO HGy 1.0 1.8 6.0 689 402 A 113 PRO HBx A 113 PRO HGy 1.0 1.8 6.0 690 402 A 113 PRO HGx A 113 PRO HBx 1.0 1.8 6.0 691 402 A 113 PRO HGx A 113 PRO HBy 1.0 1.8 6.0 692 403 A 113 PRO HDx A 113 PRO HGy 1.0 1.8 6.0 693 403 A 113 PRO HDy A 113 PRO HGy 1.0 1.8 6.0 694 403 A 113 PRO HGx A 113 PRO HDx 1.0 1.8 6.0 695 403 A 113 PRO HGx A 113 PRO HDy 1.0 1.8 6.0 696 404 A 90 TRP HE1 A 113 PRO HGy 1.0 1.8 6.0 697 404 A 113 PRO HGx A 90 TRP HE1 1.0 1.8 6.0 698 405 A 114 GLN HA A 114 GLN HBx 1.0 1.8 3.8 699 405 A 114 GLN HA A 114 GLN HBy 1.0 1.8 3.8 700 406 A 114 GLN HA A 114 GLN HGx 1.0 1.8 5.0 701 406 A 114 GLN HA A 114 GLN HGy 1.0 1.8 5.0 702 407 A 114 GLN HA A 114 GLN H 1.0 1.8 6.0 703 408 A 114 GLN HA A 114 GLN HBx 1.0 1.8 3.8 704 408 A 114 GLN HA A 114 GLN HBy 1.0 1.8 3.8 705 409 A 114 GLN HBx A 114 GLN HGx 1.0 1.8 3.8 706 409 A 114 GLN HBy A 114 GLN HGx 1.0 1.8 3.8 707 409 A 114 GLN HGy A 114 GLN HBx 1.0 1.8 3.8 708 409 A 114 GLN HBy A 114 GLN HGy 1.0 1.8 3.8 709 410 A 114 GLN H A 114 GLN HBx 1.0 1.8 6.0 710 410 A 114 GLN HBy A 114 GLN H 1.0 1.8 6.0 711 411 A 114 GLN HE21 A 113 PRO HBx 1.0 1.8 6.5 712 411 A 113 PRO HBy A 114 GLN HE22 1.0 1.8 6.5 713 411 A 113 PRO HBy A 114 GLN HE21 1.0 1.8 6.5 714 411 A 113 PRO HBx A 114 GLN HE22 1.0 1.8 6.5 715 412 A 114 GLN HGy A 114 GLN HE21 1.0 1.8 6.5 716 412 A 114 GLN HE21 A 114 GLN HGx 1.0 1.8 6.5 717 412 A 114 GLN HGy A 114 GLN HE22 1.0 1.8 6.5 718 412 A 114 GLN HE22 A 114 GLN HGx 1.0 1.8 6.5 719 413 A 114 GLN HE21 A 113 PRO HBx 1.0 1.8 6.5 720 413 A 113 PRO HBy A 114 GLN HE21 1.0 1.8 6.5 721 414 A 114 GLN HE21 A 114 GLN HGx 1.0 1.8 5.0 722 414 A 114 GLN HGy A 114 GLN HE21 1.0 1.8 5.0 723 415 A 114 GLN HBx A 114 GLN HGx 1.0 1.8 5.0 724 415 A 114 GLN HBy A 114 GLN HGx 1.0 1.8 5.0 725 415 A 114 GLN HGy A 114 GLN HBx 1.0 1.8 5.0 726 415 A 114 GLN HBy A 114 GLN HGy 1.0 1.8 5.0 727 416 A 114 GLN H A 113 PRO HDx 1.0 1.8 6.5 728 416 A 113 PRO HDy A 114 GLN H 1.0 1.8 6.5 729 417 A 114 GLN H A 114 GLN HBx 1.0 1.8 6.5 730 417 A 114 GLN HBy A 114 GLN H 1.0 1.8 6.5 731 418 A 114 GLN H A 115 GLY HAx 1.0 1.8 6.0 732 418 A 115 GLY HAy A 114 GLN H 1.0 1.8 6.0 733 419 A 114 GLN H A 115 GLY H 1.0 1.8 4.0 734 420 A 111 ILE HG2% A 115 GLY HAx 1.0 1.8 5.0 735 420 A 111 ILE HG2% A 115 GLY HAy 1.0 1.8 5.0 736 421 A 115 GLY H A 115 GLY HAx 1.0 1.8 4.0 737 421 A 115 GLY HAy A 115 GLY H 1.0 1.8 4.0 738 422 A 111 ILE HG2% A 115 GLY H 1.0 1.8 5.0 739 423 A 112 SER H A 115 GLY H 1.0 1.8 6.5 740 424 A 115 GLY H A 113 PRO HDx 1.0 1.8 6.5 741 424 A 113 PRO HDy A 115 GLY H 1.0 1.8 6.5 742 425 A 114 GLN HA A 115 GLY H 1.0 1.8 6.5 743 426 A 115 GLY H A 114 GLN HBx 1.0 1.8 6.5 744 426 A 114 GLN HBy A 115 GLY H 1.0 1.8 6.5 745 427 A 115 GLY H A 114 GLN HGx 1.0 1.8 6.5 746 427 A 114 GLN HGy A 115 GLY H 1.0 1.8 6.5 747 428 A 115 GLY H A 115 GLY HAx 1.0 1.8 4.0 748 428 A 115 GLY HAy A 115 GLY H 1.0 1.8 4.0 749 429 A 115 GLY H A 116 LEU HBx 1.0 1.8 6.5 750 429 A 115 GLY H A 116 LEU HBy 1.0 1.8 6.5 751 430 A 115 GLY H A 116 LEU HG 1.0 1.8 6.5 752 431 A 116 LEU HG A 116 LEU HA 1.0 1.8 6.0 753 432 A 116 LEU H A 116 LEU HA 1.0 1.8 5.0 754 433 A 116 LEU HA A 116 LEU HBx 1.0 1.8 6.0 755 433 A 116 LEU HBy A 116 LEU HA 1.0 1.8 6.0 756 434 A 116 LEU HDy% A 116 LEU HBx 1.0 1.8 3.8 757 434 A 116 LEU HBy A 116 LEU HDy% 1.0 1.8 3.8 758 435 A 117 LYS H A 116 LEU HBx 1.0 1.8 6.0 759 435 A 116 LEU HBy A 117 LYS H 1.0 1.8 6.0 760 436 A 116 LEU HDx% A 114 GLN HBx 1.0 1.8 6.0 761 436 A 114 GLN HBy A 116 LEU HDx% 1.0 1.8 6.0 762 437 A 116 LEU HG A 114 GLN HBx 1.0 1.8 6.0 763 437 A 114 GLN HBy A 116 LEU HG 1.0 1.8 6.0 764 438 A 116 LEU HG A 114 GLN HGx 1.0 1.8 6.0 765 438 A 114 GLN HGy A 116 LEU HG 1.0 1.8 6.0 766 439 A 116 LEU HG A 116 LEU HBx 1.0 1.8 3.8 767 439 A 116 LEU HBy A 116 LEU HG 1.0 1.8 3.8 768 440 A 116 LEU H A 116 LEU HG 1.0 1.8 5.0 769 441 A 116 LEU HG A 117 LYS H 1.0 1.8 6.0 770 442 A 127 TYR HE% A 116 LEU HG 1.0 1.8 6.0 771 443 A 112 SER H A 116 LEU H 1.0 1.8 6.5 772 444 A 116 LEU H A 114 GLN HBx 1.0 1.8 6.5 773 444 A 116 LEU H A 114 GLN HBy 1.0 1.8 6.5 774 445 A 116 LEU H A 115 GLY HAx 1.0 1.8 6.5 775 445 A 115 GLY HAy A 116 LEU H 1.0 1.8 6.5 776 446 A 116 LEU H A 115 GLY H 1.0 1.8 5.0 777 447 A 116 LEU H A 116 LEU HBx 1.0 1.8 5.0 778 447 A 116 LEU H A 116 LEU HBy 1.0 1.8 5.0 779 448 A 116 LEU H A 116 LEU HBx 1.0 1.8 6.0 780 448 A 116 LEU H A 116 LEU HBy 1.0 1.8 6.0 781 449 A 111 ILE HG2% A 117 LYS HA 1.0 1.8 6.0 782 450 A 117 LYS HA A 117 LYS HGx 1.0 1.8 6.0 783 450 A 117 LYS HGy A 117 LYS HA 1.0 1.8 6.0 784 451 A 117 LYS H A 117 LYS HA 1.0 1.8 6.0 785 452 A 109 TYR HD% A 117 LYS HBy 1.0 1.8 6.0 786 452 A 109 TYR HD% A 117 LYS HBx 1.0 1.8 6.0 787 453 A 111 ILE HD1% A 117 LYS HBy 1.0 1.8 6.0 788 453 A 111 ILE HD1% A 117 LYS HBx 1.0 1.8 6.0 789 454 A 117 LYS HA A 117 LYS HBy 1.0 1.8 6.0 790 454 A 117 LYS HA A 117 LYS HBx 1.0 1.8 6.0 791 455 A 117 LYS HBx A 117 LYS HEx 1.0 1.8 6.0 792 455 A 117 LYS HBy A 117 LYS HEx 1.0 1.8 6.0 793 455 A 117 LYS HE3 A 117 LYS HBy 1.0 1.8 6.0 794 455 A 117 LYS HE3 A 117 LYS HBx 1.0 1.8 6.0 795 456 A 117 LYS HBy A 117 LYS HGx 1.0 1.8 3.8 796 456 A 117 LYS HGy A 117 LYS HBy 1.0 1.8 3.8 797 456 A 117 LYS HGy A 117 LYS HBx 1.0 1.8 3.8 798 456 A 117 LYS HBx A 117 LYS HGx 1.0 1.8 3.8 799 457 A 117 LYS HBx A 117 LYS HGx 1.0 1.8 5.0 800 457 A 117 LYS HBy A 117 LYS HGx 1.0 1.8 5.0 801 457 A 117 LYS HGy A 117 LYS HBy 1.0 1.8 5.0 802 457 A 117 LYS HGy A 117 LYS HBx 1.0 1.8 5.0 803 458 A 117 LYS HBy A 117 LYS HGx 1.0 1.8 6.0 804 458 A 117 LYS HGy A 117 LYS HBy 1.0 1.8 6.0 805 458 A 117 LYS HGy A 117 LYS HBx 1.0 1.8 6.0 806 458 A 117 LYS HBx A 117 LYS HGx 1.0 1.8 6.0 807 459 A 117 LYS H A 117 LYS HBy 1.0 1.8 5.0 808 459 A 117 LYS H A 117 LYS HBx 1.0 1.8 5.0 809 460 A 117 LYS H A 117 LYS HBy 1.0 1.8 6.0 810 460 A 117 LYS H A 117 LYS HBx 1.0 1.8 6.0 811 461 A 118 PHE H A 117 LYS HBy 1.0 1.8 6.0 812 461 A 118 PHE H A 117 LYS HBx 1.0 1.8 6.0 813 462 A 109 TYR HD% A 117 LYS HDy 1.0 1.8 6.0 814 462 A 109 TYR HD% A 117 LYS HDx 1.0 1.8 6.0 815 463 A 109 TYR HE% A 117 LYS HDy 1.0 1.8 6.0 816 463 A 109 TYR HE% A 117 LYS HDx 1.0 1.8 6.0 817 464 A 111 ILE HD1% A 117 LYS HDy 1.0 1.8 6.0 818 464 A 111 ILE HD1% A 117 LYS HDx 1.0 1.8 6.0 819 465 A 117 LYS HDx A 117 LYS HEx 1.0 1.8 5.0 820 465 A 117 LYS HDy A 117 LYS HEx 1.0 1.8 5.0 821 465 A 117 LYS HE3 A 117 LYS HDy 1.0 1.8 5.0 822 465 A 117 LYS HE3 A 117 LYS HDx 1.0 1.8 5.0 823 466 A 117 LYS HDy A 117 LYS HGx 1.0 1.8 3.8 824 466 A 117 LYS HDx A 117 LYS HGx 1.0 1.8 3.8 825 466 A 117 LYS HGy A 117 LYS HDy 1.0 1.8 3.8 826 466 A 117 LYS HGy A 117 LYS HDx 1.0 1.8 3.8 827 467 A 117 LYS H A 117 LYS HDy 1.0 1.8 6.0 828 467 A 117 LYS H A 117 LYS HDx 1.0 1.8 6.0 829 468 A 109 TYR HD% A 117 LYS HEx 1.0 1.8 6.0 830 468 A 109 TYR HD% A 117 LYS HE3 1.0 1.8 6.0 831 469 A 117 LYS HDx A 117 LYS HEx 1.0 1.8 5.0 832 469 A 117 LYS HDy A 117 LYS HEx 1.0 1.8 5.0 833 469 A 117 LYS HE3 A 117 LYS HDy 1.0 1.8 5.0 834 469 A 117 LYS HE3 A 117 LYS HDx 1.0 1.8 5.0 835 470 A 117 LYS HE3 A 117 LYS HGx 1.0 1.8 5.0 836 470 A 117 LYS HEx A 117 LYS HGx 1.0 1.8 5.0 837 470 A 117 LYS HGy A 117 LYS HEx 1.0 1.8 5.0 838 470 A 117 LYS HE3 A 117 LYS HGy 1.0 1.8 5.0 839 471 A 117 LYS HE3 A 117 LYS HGx 1.0 1.8 6.0 840 471 A 117 LYS HEx A 117 LYS HGx 1.0 1.8 6.0 841 471 A 117 LYS HGy A 117 LYS HEx 1.0 1.8 6.0 842 471 A 117 LYS HE3 A 117 LYS HGy 1.0 1.8 6.0 843 472 A 109 TYR HD% A 117 LYS HGx 1.0 1.8 6.0 844 472 A 109 TYR HD% A 117 LYS HGy 1.0 1.8 6.0 845 473 A 109 TYR HE% A 117 LYS HGx 1.0 1.8 6.0 846 473 A 109 TYR HE% A 117 LYS HGy 1.0 1.8 6.0 847 474 A 117 LYS HA A 117 LYS HGx 1.0 1.8 6.0 848 474 A 117 LYS HGy A 117 LYS HA 1.0 1.8 6.0 849 475 A 117 LYS HDy A 117 LYS HGx 1.0 1.8 3.8 850 475 A 117 LYS HDx A 117 LYS HGx 1.0 1.8 3.8 851 475 A 117 LYS HGy A 117 LYS HDy 1.0 1.8 3.8 852 475 A 117 LYS HGy A 117 LYS HDx 1.0 1.8 3.8 853 476 A 117 LYS H A 117 LYS HGx 1.0 1.8 5.0 854 476 A 117 LYS HGy A 117 LYS H 1.0 1.8 5.0 855 477 A 118 PHE H A 117 LYS HGx 1.0 1.8 6.0 856 477 A 118 PHE H A 117 LYS HGy 1.0 1.8 6.0 857 478 A 116 LEU HA A 117 LYS H 1.0 1.8 2.9 858 479 A 117 LYS H A 116 LEU HBx 1.0 1.8 6.0 859 479 A 116 LEU HBy A 117 LYS H 1.0 1.8 6.0 860 480 A 117 LYS H A 116 LEU HDx% 1.0 1.8 6.5 861 481 A 116 LEU HDy% A 117 LYS H 1.0 1.8 6.5 862 482 A 116 LEU H A 117 LYS H 1.0 1.8 6.5 863 483 A 117 LYS H A 117 LYS HGx 1.0 1.8 6.0 864 483 A 117 LYS HGy A 117 LYS H 1.0 1.8 6.0 865 484 A 118 PHE H A 117 LYS H 1.0 1.8 6.5 866 485 A 118 PHE HA A 118 PHE HBx 1.0 1.8 5.0 867 485 A 118 PHE HA A 118 PHE HBy 1.0 1.8 5.0 868 486 A 118 PHE HA A 119 ARG H 1.0 1.8 5.0 869 487 A 118 PHE HA A 118 PHE HBx 1.0 1.8 6.0 870 487 A 118 PHE HA A 118 PHE HBy 1.0 1.8 6.0 871 488 A 118 PHE H A 118 PHE HBx 1.0 1.8 6.0 872 488 A 118 PHE H A 118 PHE HBy 1.0 1.8 6.0 873 489 A 124 LEU HDx% A 118 PHE HBx 1.0 1.8 5.0 874 489 A 124 LEU HDx% A 118 PHE HBy 1.0 1.8 5.0 875 490 A 124 LEU HDx% A 118 PHE HBx 1.0 1.8 6.0 876 490 A 124 LEU HDx% A 118 PHE HBy 1.0 1.8 6.0 877 491 A 124 LEU HDy% A 118 PHE HBx 1.0 1.8 6.0 878 491 A 124 LEU HDy% A 118 PHE HBy 1.0 1.8 6.0 879 492 A 109 TYR HD% A 118 PHE H 1.0 1.8 6.5 880 493 A 118 PHE H A 110 PHE HBx 1.0 1.8 6.5 881 493 A 110 PHE HBy A 118 PHE H 1.0 1.8 6.5 882 494 A 118 PHE H A 117 LYS HA 1.0 1.8 4.0 883 495 A 118 PHE H A 117 LYS HGx 1.0 1.8 6.5 884 495 A 118 PHE H A 117 LYS HGy 1.0 1.8 6.5 885 496 A 118 PHE H A 118 PHE HA 1.0 1.8 6.5 886 497 A 118 PHE H A 118 PHE HD% 1.0 1.8 6.5 887 498 A 118 PHE H A 119 ARG HBy 1.0 1.8 6.5 888 498 A 118 PHE H A 119 ARG HBx 1.0 1.8 6.5 889 499 A 109 TYR HA A 119 ARG HA 1.0 1.8 6.0 890 500 A 109 TYR HD% A 119 ARG HA 1.0 1.8 6.0 891 501 A 119 ARG HA A 119 ARG HGx 1.0 1.8 6.0 892 501 A 119 ARG HG3 A 119 ARG HA 1.0 1.8 6.0 893 502 A 119 ARG H A 119 ARG HA 1.0 1.8 6.0 894 503 A 119 ARG HA A 119 ARG HBy 1.0 1.8 6.0 895 503 A 119 ARG HBx A 119 ARG HA 1.0 1.8 6.0 896 504 A 119 ARG H A 119 ARG HGx 1.0 1.8 6.0 897 504 A 119 ARG HG3 A 119 ARG H 1.0 1.8 6.0 898 505 A 109 TYR HD% A 119 ARG H 1.0 1.8 6.5 899 506 A 119 ARG H A 118 PHE HBx 1.0 1.8 6.5 900 506 A 118 PHE HBy A 119 ARG H 1.0 1.8 6.5 901 507 A 119 ARG H A 119 ARG HBy 1.0 1.8 6.5 902 507 A 119 ARG H A 119 ARG HBx 1.0 1.8 6.5 903 508 A 119 ARG H A 119 ARG HD2 1.0 1.8 6.5 904 508 A 119 ARG H A 119 ARG HDy 1.0 1.8 6.5 905 509 A 119 ARG H A 120 SER H 1.0 1.8 4.0 906 510 A 110 PHE H A 120 SER H 1.0 1.8 6.5 907 511 A 118 PHE HA A 120 SER H 1.0 1.8 6.5 908 512 A 120 SER H A 118 PHE HBx 1.0 1.8 6.5 909 512 A 118 PHE HBy A 120 SER H 1.0 1.8 6.5 910 513 A 119 ARG HA A 120 SER H 1.0 1.8 6.5 911 514 A 120 SER H A 119 ARG HBy 1.0 1.8 6.5 912 514 A 119 ARG HBx A 120 SER H 1.0 1.8 6.5 913 515 A 120 SER H A 119 ARG HGx 1.0 1.8 6.5 914 515 A 119 ARG HG3 A 120 SER H 1.0 1.8 6.5 915 516 A 120 SER H A 120 SER HBx 1.0 1.8 6.5 916 516 A 120 SER H A 120 SER HBy 1.0 1.8 6.5 917 517 A 120 SER H A 121 LYS HA 1.0 1.8 6.5 918 518 A 120 SER H A 121 LYS H 1.0 1.8 6.5 919 519 A 120 SER H A 123 SER HA 1.0 1.8 6.5 920 520 A 120 SER H A 123 SER HBy 1.0 1.8 6.5 921 520 A 120 SER H A 123 SER HBx 1.0 1.8 6.5 922 521 A 120 SER H A 123 SER H 1.0 1.8 6.5 923 522 A 120 SER H A 124 LEU HBy 1.0 1.8 6.5 924 522 A 120 SER H A 124 LEU HBx 1.0 1.8 6.5 925 523 A 124 LEU HDy% A 120 SER H 1.0 1.8 6.5 926 524 A 121 LYS HA A 121 LYS HBy 1.0 1.8 5.0 927 524 A 121 LYS HA A 121 LYS HBx 1.0 1.8 5.0 928 525 A 121 LYS HA A 121 LYS HGx 1.0 1.8 5.0 929 525 A 121 LYS HA A 121 LYS HGy 1.0 1.8 5.0 930 526 A 124 LEU HDx% A 121 LYS HA 1.0 1.8 6.0 931 527 A 124 LEU HDy% A 121 LYS HA 1.0 1.8 6.0 932 528 A 124 LEU HG A 121 LYS HA 1.0 1.8 6.0 933 529 A 121 LYS HA A 124 LEU H 1.0 1.8 6.0 934 530 A 121 LYS HA A 121 LYS HBy 1.0 1.8 6.0 935 530 A 121 LYS HA A 121 LYS HBx 1.0 1.8 6.0 936 531 A 121 LYS HBy A 121 LYS HGx 1.0 1.8 5.0 937 531 A 121 LYS HBx A 121 LYS HGx 1.0 1.8 5.0 938 531 A 121 LYS HGy A 121 LYS HBy 1.0 1.8 5.0 939 531 A 121 LYS HBx A 121 LYS HGy 1.0 1.8 5.0 940 532 A 121 LYS H A 121 LYS HBy 1.0 1.8 6.0 941 532 A 121 LYS H A 121 LYS HBx 1.0 1.8 6.0 942 533 A 121 LYS H A 120 SER HA 1.0 1.8 6.5 943 534 A 121 LYS HA A 121 LYS H 1.0 1.8 6.0 944 535 A 121 LYS H A 121 LYS HBy 1.0 1.8 6.0 945 535 A 121 LYS H A 121 LYS HBx 1.0 1.8 6.0 946 536 A 121 LYS H A 121 LYS HGx 1.0 1.8 6.5 947 536 A 121 LYS H A 121 LYS HGy 1.0 1.8 6.5 948 537 A 122 SER HA A 122 SER HBx 1.0 1.8 6.0 949 537 A 122 SER HA A 122 SER HB3 1.0 1.8 6.0 950 538 A 122 SER H A 120 SER HBx 1.0 1.8 4.0 951 538 A 120 SER HBy A 122 SER H 1.0 1.8 4.0 952 539 A 122 SER H A 121 LYS HBy 1.0 1.8 6.5 953 539 A 121 LYS HBx A 122 SER H 1.0 1.8 6.5 954 540 A 122 SER H A 121 LYS HGx 1.0 1.8 6.5 955 540 A 121 LYS HGy A 122 SER H 1.0 1.8 6.5 956 541 A 122 SER HA A 122 SER H 1.0 1.8 5.0 957 542 A 123 SER HA A 123 SER HBy 1.0 1.8 5.0 958 542 A 123 SER HA A 123 SER HBx 1.0 1.8 5.0 959 543 A 123 SER HA A 126 ASN HBx 1.0 1.8 5.0 960 543 A 123 SER HA A 126 ASN HBy 1.0 1.8 5.0 961 544 A 123 SER H A 124 LEU HBy 1.0 1.8 6.5 962 544 A 123 SER H A 121 LYS HBy 1.0 1.8 6.5 963 544 A 123 SER H A 124 LEU HBx 1.0 1.8 6.5 964 544 A 123 SER H A 121 LYS HBx 1.0 1.8 6.5 965 545 A 123 SER H A 122 SER HBx 1.0 1.8 6.5 966 545 A 123 SER H A 122 SER HB3 1.0 1.8 6.5 967 546 A 123 SER H A 122 SER H 1.0 1.8 6.5 968 547 A 123 SER HA A 123 SER H 1.0 1.8 5.0 969 548 A 123 SER H A 123 SER HBy 1.0 1.8 5.0 970 548 A 123 SER HBx A 123 SER H 1.0 1.8 5.0 971 549 A 123 SER H A 124 LEU HBy 1.0 1.8 6.5 972 549 A 123 SER H A 124 LEU HBx 1.0 1.8 6.5 973 550 A 123 SER H A 124 LEU H 1.0 1.8 6.5 974 551 A 124 LEU HA A 124 LEU HBy 1.0 1.8 6.0 975 551 A 124 LEU HBx A 124 LEU HA 1.0 1.8 6.0 976 552 A 124 LEU HG A 124 LEU HA 1.0 1.8 6.0 977 553 A 124 LEU HA A 127 TYR HBy 1.0 1.8 6.0 978 553 A 124 LEU HA A 127 TYR HBx 1.0 1.8 6.0 979 554 A 124 LEU HA A 124 LEU HBy 1.0 1.8 5.0 980 554 A 124 LEU HBx A 124 LEU HA 1.0 1.8 5.0 981 555 A 124 LEU HDx% A 124 LEU HBy 1.0 1.8 3.8 982 555 A 124 LEU HDx% A 124 LEU HBx 1.0 1.8 3.8 983 556 A 124 LEU HDy% A 124 LEU HBy 1.0 1.8 5.0 984 556 A 124 LEU HDy% A 124 LEU HBx 1.0 1.8 5.0 985 557 A 125 ALA H A 124 LEU HBy 1.0 1.8 6.0 986 557 A 124 LEU HBx A 125 ALA H 1.0 1.8 6.0 987 558 A 124 LEU HDx% A 124 LEU HA 1.0 1.8 3.8 988 559 A 124 LEU HDx% A 124 LEU HBy 1.0 1.8 5.0 989 559 A 124 LEU HDx% A 124 LEU HBx 1.0 1.8 5.0 990 560 A 124 LEU HDx% A 124 LEU HDy% 1.0 1.8 2.7 991 561 A 124 LEU HG A 124 LEU HDx% 1.0 1.8 2.7 992 562 A 124 LEU HDx% A 124 LEU H 1.0 1.8 6.0 993 563 A 124 LEU HDx% A 125 ALA H 1.0 1.8 6.0 994 564 A 124 LEU HDx% A 127 TYR HBy 1.0 1.8 6.0 995 564 A 124 LEU HDx% A 127 TYR HBx 1.0 1.8 6.0 996 565 A 124 LEU HDx% A 127 TYR HD% 1.0 1.8 5.0 997 566 A 124 LEU HDx% A 127 TYR HE% 1.0 1.8 3.8 998 567 A 124 LEU HDx% A 128 LEU HG 1.0 1.8 5.0 999 568 A 124 LEU HDx% A 141 PHE HBx 1.0 1.8 6.0 1000 568 A 124 LEU HDx% A 141 PHE HBy 1.0 1.8 6.0 1001 569 A 124 LEU HDx% A 141 PHE HD% 1.0 1.8 6.0 1002 570 A 124 LEU HDx% A 141 PHE H 1.0 1.8 6.0 1003 571 A 90 TRP HH2 A 124 LEU HDx% 1.0 1.8 5.0 1004 572 A 124 LEU HDy% A 118 PHE HBx 1.0 1.8 6.0 1005 572 A 124 LEU HDy% A 118 PHE HBy 1.0 1.8 6.0 1006 573 A 124 LEU HDy% A 124 LEU HA 1.0 1.8 5.0 1007 574 A 124 LEU HDy% A 124 LEU HBy 1.0 1.8 3.8 1008 574 A 124 LEU HDy% A 124 LEU HBx 1.0 1.8 3.8 1009 575 A 124 LEU HDy% A 124 LEU H 1.0 1.8 6.0 1010 576 A 124 LEU HDy% A 125 ALA H 1.0 1.8 6.0 1011 577 A 124 LEU HDy% A 127 TYR HBy 1.0 1.8 6.0 1012 577 A 124 LEU HDy% A 127 TYR HBx 1.0 1.8 6.0 1013 578 A 124 LEU HDy% A 128 LEU HG 1.0 1.8 6.0 1014 579 A 124 LEU HDy% A 141 PHE HBx 1.0 1.8 6.0 1015 579 A 124 LEU HDy% A 141 PHE HBy 1.0 1.8 6.0 1016 580 A 124 LEU HDy% A 141 PHE HD% 1.0 1.8 6.0 1017 581 A 124 LEU HG A 124 LEU HDy% 1.0 1.8 3.8 1018 582 A 123 SER HA A 124 LEU H 1.0 1.8 6.5 1019 583 A 124 LEU H A 123 SER HBy 1.0 1.8 6.5 1020 583 A 123 SER HBx A 124 LEU H 1.0 1.8 6.5 1021 584 A 124 LEU H A 124 LEU HA 1.0 1.8 5.0 1022 585 A 124 LEU H A 124 LEU HBy 1.0 1.8 5.0 1023 585 A 124 LEU HBx A 124 LEU H 1.0 1.8 5.0 1024 586 A 124 LEU HG A 124 LEU H 1.0 1.8 6.5 1025 587 A 124 LEU H A 125 ALA H 1.0 1.8 5.0 1026 588 A 125 ALA HA A 125 ALA HB% 1.0 1.8 2.7 1027 589 A 125 ALA HA A 128 LEU HDy% 1.0 1.8 6.0 1028 590 A 125 ALA HA A 128 LEU H 1.0 1.8 6.0 1029 591 A 125 ALA HA A 138 PRO HBx 1.0 1.8 6.0 1030 591 A 125 ALA HA A 138 PRO HBy 1.0 1.8 6.0 1031 592 A 125 ALA HA A 138 PRO HGy 1.0 1.8 6.0 1032 592 A 125 ALA HA A 138 PRO HGx 1.0 1.8 6.0 1033 593 A 124 LEU H A 125 ALA HB% 1.0 1.8 6.0 1034 594 A 125 ALA H A 125 ALA HB% 1.0 1.8 2.7 1035 595 A 125 ALA HB% A 126 ASN H 1.0 1.8 3.8 1036 596 A 125 ALA HB% A 128 LEU HDx% 1.0 1.8 6.0 1037 597 A 125 ALA HB% A 128 LEU HDy% 1.0 1.8 6.0 1038 598 A 125 ALA HB% A 138 PRO HBx 1.0 1.8 5.0 1039 598 A 125 ALA HB% A 138 PRO HBy 1.0 1.8 5.0 1040 599 A 125 ALA HB% A 138 PRO HGy 1.0 1.8 3.8 1041 599 A 125 ALA HB% A 138 PRO HGx 1.0 1.8 3.8 1042 600 A 125 ALA HB% A 138 PRO HGy 1.0 1.8 5.0 1043 600 A 125 ALA HB% A 138 PRO HGx 1.0 1.8 5.0 1044 601 A 125 ALA H A 128 LEU HBy 1.0 1.8 6.5 1045 601 A 125 ALA H A 121 LYS HBy 1.0 1.8 6.5 1046 601 A 125 ALA H A 128 LEU HBx 1.0 1.8 6.5 1047 601 A 125 ALA H A 138 PRO HGx 1.0 1.8 6.5 1048 601 A 121 LYS HBx A 125 ALA H 1.0 1.8 6.5 1049 601 A 125 ALA H A 138 PRO HGy 1.0 1.8 6.5 1050 602 A 122 SER HA A 125 ALA H 1.0 1.8 6.5 1051 603 A 125 ALA H A 124 LEU HBy 1.0 1.8 6.0 1052 603 A 124 LEU HBx A 125 ALA H 1.0 1.8 6.0 1053 604 A 125 ALA H A 125 ALA HA 1.0 1.8 5.0 1054 605 A 125 ALA HB% A 126 ASN HA 1.0 1.8 6.0 1055 606 A 126 ASN HA A 126 ASN HBx 1.0 1.8 3.8 1056 606 A 126 ASN HBy A 126 ASN HA 1.0 1.8 3.8 1057 607 A 126 ASN H A 126 ASN HA 1.0 1.8 4.0 1058 608 A 126 ASN HA A 129 HIS HB2 1.0 1.8 5.0 1059 608 A 126 ASN HA A 129 HIS HBy 1.0 1.8 5.0 1060 609 A 125 ALA HB% A 126 ASN HBx 1.0 1.8 6.0 1061 609 A 126 ASN HBy A 125 ALA HB% 1.0 1.8 6.0 1062 610 A 126 ASN HA A 126 ASN HBx 1.0 1.8 5.0 1063 610 A 126 ASN HBy A 126 ASN HA 1.0 1.8 5.0 1064 611 A 126 ASN H A 126 ASN HBx 1.0 1.8 3.8 1065 611 A 126 ASN HBy A 126 ASN H 1.0 1.8 3.8 1066 612 A 126 ASN HBy A 126 ASN HD21 1.0 1.8 5.0 1067 612 A 126 ASN HBx A 126 ASN HD22 1.0 1.8 5.0 1068 612 A 126 ASN HBy A 126 ASN HD22 1.0 1.8 5.0 1069 612 A 126 ASN HD21 A 126 ASN HBx 1.0 1.8 5.0 1070 613 A 126 ASN HD21 A 126 ASN HBx 1.0 1.8 5.0 1071 613 A 126 ASN HBy A 126 ASN HD21 1.0 1.8 5.0 1072 614 A 122 SER HA A 126 ASN H 1.0 1.8 6.5 1073 615 A 128 LEU HDy% A 126 ASN H 1.0 1.8 6.5 1074 615 A 124 LEU HG A 126 ASN H 1.0 1.8 6.5 1075 616 A 125 ALA HA A 126 ASN H 1.0 1.8 6.0 1076 617 A 125 ALA H A 126 ASN H 1.0 1.8 5.0 1077 618 A 126 ASN H A 126 ASN HBx 1.0 1.8 2.9 1078 618 A 126 ASN HBy A 126 ASN H 1.0 1.8 2.9 1079 619 A 126 ASN H A 126 ASN HD21 1.0 1.8 6.5 1080 620 A 126 ASN H A 128 LEU HDx% 1.0 1.8 6.5 1081 621 A 128 LEU H A 126 ASN H 1.0 1.8 6.5 1082 622 A 127 TYR HA A 127 TYR HBy 1.0 1.8 5.0 1083 622 A 127 TYR HBx A 127 TYR HA 1.0 1.8 5.0 1084 623 A 127 TYR HA A 127 TYR HBy 1.0 1.8 6.0 1085 623 A 127 TYR HBx A 127 TYR HA 1.0 1.8 6.0 1086 624 A 127 TYR HD% A 127 TYR HA 1.0 1.8 6.0 1087 625 A 127 TYR HE% A 127 TYR HA 1.0 1.8 6.0 1088 626 A 127 TYR HA A 127 TYR H 1.0 1.8 5.0 1089 627 A 127 TYR HA A 130 LYS HBx 1.0 1.8 6.0 1090 627 A 127 TYR HA A 130 LYS HBy 1.0 1.8 6.0 1091 628 A 127 TYR HA A 130 LYS HDx 1.0 1.8 6.0 1092 628 A 127 TYR HA A 130 LYS HD3 1.0 1.8 6.0 1093 629 A 127 TYR HA A 130 LYS H 1.0 1.8 6.0 1094 630 A 124 LEU HA A 127 TYR HBy 1.0 1.8 6.0 1095 630 A 124 LEU HA A 127 TYR HBx 1.0 1.8 6.0 1096 631 A 124 LEU HDx% A 127 TYR HBy 1.0 1.8 6.0 1097 631 A 124 LEU HDx% A 127 TYR HBx 1.0 1.8 6.0 1098 632 A 127 TYR HD% A 127 TYR HBy 1.0 1.8 5.0 1099 632 A 127 TYR HBx A 127 TYR HD% 1.0 1.8 5.0 1100 633 A 127 TYR HE% A 127 TYR HBy 1.0 1.8 6.0 1101 633 A 127 TYR HE% A 127 TYR HBx 1.0 1.8 6.0 1102 634 A 127 TYR H A 127 TYR HBy 1.0 1.8 5.0 1103 634 A 127 TYR HBx A 127 TYR H 1.0 1.8 5.0 1104 635 A 128 LEU HDy% A 127 TYR HBy 1.0 1.8 6.0 1105 635 A 127 TYR HBx A 128 LEU HDy% 1.0 1.8 6.0 1106 636 A 128 LEU H A 127 TYR HBy 1.0 1.8 6.0 1107 636 A 127 TYR HBx A 128 LEU H 1.0 1.8 6.0 1108 637 A 127 TYR HD% A 127 TYR HBy 1.0 1.8 5.0 1109 637 A 127 TYR HBx A 127 TYR HD% 1.0 1.8 5.0 1110 638 A 127 TYR HE% A 127 TYR HD% 1.0 1.8 5.0 1111 639 A 127 TYR HD% A 128 LEU HDy% 1.0 1.8 6.0 1112 640 A 127 TYR HE% A 128 LEU HDy% 1.0 1.8 6.0 1113 641 A 124 LEU HA A 127 TYR H 1.0 1.8 6.5 1114 642 A 124 LEU HDx% A 127 TYR H 1.0 1.8 6.5 1115 643 A 124 LEU HDy% A 127 TYR H 1.0 1.8 6.5 1116 644 A 125 ALA HB% A 127 TYR H 1.0 1.8 6.5 1117 645 A 126 ASN HA A 127 TYR H 1.0 1.8 6.0 1118 646 A 127 TYR H A 126 ASN HBx 1.0 1.8 5.0 1119 646 A 126 ASN HBy A 127 TYR H 1.0 1.8 5.0 1120 647 A 126 ASN H A 127 TYR H 1.0 1.8 5.0 1121 648 A 127 TYR H A 127 TYR HBy 1.0 1.8 5.0 1122 648 A 127 TYR HBx A 127 TYR H 1.0 1.8 5.0 1123 649 A 127 TYR HD% A 127 TYR H 1.0 1.8 6.5 1124 650 A 128 LEU HDx% A 127 TYR H 1.0 1.8 6.5 1125 651 A 128 LEU HG A 127 TYR H 1.0 1.8 6.5 1126 652 A 128 LEU H A 127 TYR H 1.0 1.8 5.0 1127 653 A 127 TYR HD% A 128 LEU HA 1.0 1.8 6.0 1128 654 A 128 LEU HA A 128 LEU HBy 1.0 1.8 6.0 1129 654 A 128 LEU HBx A 128 LEU HA 1.0 1.8 6.0 1130 655 A 128 LEU HDy% A 128 LEU HA 1.0 1.8 5.0 1131 656 A 128 LEU HA A 131 ASN HBx 1.0 1.8 6.0 1132 656 A 128 LEU HA A 131 ASN HBy 1.0 1.8 6.0 1133 657 A 125 ALA HA A 128 LEU HBy 1.0 1.8 6.0 1134 657 A 125 ALA HA A 128 LEU HBx 1.0 1.8 6.0 1135 658 A 128 LEU HDy% A 128 LEU HBy 1.0 1.8 5.0 1136 658 A 128 LEU HDy% A 128 LEU HBx 1.0 1.8 5.0 1137 659 A 128 LEU HDy% A 128 LEU HBy 1.0 1.8 6.0 1138 659 A 128 LEU HDy% A 128 LEU HBx 1.0 1.8 6.0 1139 660 A 128 LEU H A 128 LEU HBy 1.0 1.8 5.0 1140 660 A 128 LEU H A 128 LEU HBx 1.0 1.8 5.0 1141 661 A 129 HIS H A 128 LEU HBy 1.0 1.8 5.0 1142 661 A 128 LEU HBx A 129 HIS H 1.0 1.8 5.0 1143 662 A 128 LEU HBy A 133 GLU HBx 1.0 1.8 6.0 1144 662 A 128 LEU HBx A 133 GLU HBx 1.0 1.8 6.0 1145 662 A 133 GLU HBy A 128 LEU HBy 1.0 1.8 6.0 1146 662 A 128 LEU HBx A 133 GLU HBy 1.0 1.8 6.0 1147 663 A 128 LEU HBy A 138 PRO HGy 1.0 1.8 6.0 1148 663 A 128 LEU HBx A 138 PRO HGy 1.0 1.8 6.0 1149 663 A 138 PRO HGx A 128 LEU HBy 1.0 1.8 6.0 1150 663 A 138 PRO HGx A 128 LEU HBx 1.0 1.8 6.0 1151 664 A 124 LEU HDx% A 128 LEU HDx% 1.0 1.8 3.8 1152 665 A 124 LEU HDy% A 128 LEU HDx% 1.0 1.8 3.8 1153 666 A 125 ALA HA A 128 LEU HDx% 1.0 1.8 5.0 1154 667 A 128 LEU HDx% A 128 LEU HA 1.0 1.8 6.0 1155 668 A 128 LEU HDx% A 128 LEU HBy 1.0 1.8 5.0 1156 668 A 128 LEU HDx% A 128 LEU HBx 1.0 1.8 5.0 1157 669 A 128 LEU HDy% A 128 LEU HDx% 1.0 1.8 2.7 1158 670 A 128 LEU H A 128 LEU HDx% 1.0 1.8 6.0 1159 671 A 128 LEU HDx% A 133 GLU HBx 1.0 1.8 6.0 1160 671 A 128 LEU HDx% A 133 GLU HBy 1.0 1.8 6.0 1161 672 A 128 LEU HDx% A 138 PRO HA 1.0 1.8 6.0 1162 673 A 128 LEU HDx% A 138 PRO HBx 1.0 1.8 6.0 1163 673 A 138 PRO HBy A 128 LEU HDx% 1.0 1.8 6.0 1164 674 A 128 LEU HDx% A 138 PRO HGy 1.0 1.8 6.0 1165 674 A 138 PRO HGx A 128 LEU HDx% 1.0 1.8 6.0 1166 675 A 128 LEU HG A 125 ALA HA 1.0 1.8 6.0 1167 676 A 127 TYR HD% A 128 LEU HG 1.0 1.8 6.0 1168 677 A 128 LEU HG A 128 LEU HA 1.0 1.8 6.0 1169 678 A 128 LEU HG A 128 LEU HBy 1.0 1.8 6.0 1170 678 A 128 LEU HG A 128 LEU HBx 1.0 1.8 6.0 1171 679 A 128 LEU HG A 128 LEU HDx% 1.0 1.8 5.0 1172 680 A 128 LEU HG A 128 LEU HDy% 1.0 1.8 5.0 1173 681 A 128 LEU HG A 128 LEU H 1.0 1.8 5.0 1174 682 A 124 LEU HDx% A 128 LEU H 1.0 1.8 6.0 1175 683 A 124 LEU HDy% A 128 LEU H 1.0 1.8 6.5 1176 684 A 128 LEU H A 127 TYR HA 1.0 1.8 6.0 1177 685 A 128 LEU H A 127 TYR HBy 1.0 1.8 6.0 1178 685 A 127 TYR HBx A 128 LEU H 1.0 1.8 6.0 1179 686 A 127 TYR HD% A 128 LEU H 1.0 1.8 6.5 1180 687 A 128 LEU H A 128 LEU HA 1.0 1.8 5.0 1181 688 A 128 LEU HDy% A 128 LEU H 1.0 1.8 5.0 1182 689 A 129 HIS HA A 128 LEU HBy 1.0 1.8 6.0 1183 689 A 128 LEU HBx A 129 HIS HA 1.0 1.8 6.0 1184 690 A 129 HIS HA A 129 HIS HB2 1.0 1.8 3.8 1185 690 A 129 HIS HBy A 129 HIS HA 1.0 1.8 3.8 1186 691 A 129 HIS H A 129 HIS HA 1.0 1.8 4.0 1187 692 A 128 LEU H A 129 HIS HB2 1.0 1.8 6.0 1188 692 A 128 LEU H A 129 HIS HBy 1.0 1.8 6.0 1189 693 A 130 LYS H A 129 HIS HB2 1.0 1.8 4.0 1190 693 A 129 HIS HBy A 130 LYS H 1.0 1.8 4.0 1191 694 A 127 TYR H A 129 HIS H 1.0 1.8 6.5 1192 695 A 128 LEU HA A 129 HIS H 1.0 1.8 6.0 1193 696 A 129 HIS H A 128 LEU HBy 1.0 1.8 5.0 1194 696 A 128 LEU HBx A 129 HIS H 1.0 1.8 5.0 1195 697 A 128 LEU HDx% A 129 HIS H 1.0 1.8 6.5 1196 698 A 128 LEU HDy% A 129 HIS H 1.0 1.8 6.5 1197 699 A 128 LEU HG A 129 HIS H 1.0 1.8 6.5 1198 700 A 128 LEU H A 129 HIS H 1.0 1.8 5.0 1199 701 A 129 HIS H A 129 HIS HB2 1.0 1.8 2.9 1200 701 A 129 HIS HBy A 129 HIS H 1.0 1.8 2.9 1201 702 A 129 HIS H A 131 ASN H 1.0 1.8 6.5 1202 703 A 130 LYS HA A 130 LYS HBx 1.0 1.8 6.0 1203 703 A 130 LYS HBy A 130 LYS HA 1.0 1.8 6.0 1204 704 A 130 LYS HA A 130 LYS HDx 1.0 1.8 6.0 1205 704 A 130 LYS HD3 A 130 LYS HA 1.0 1.8 6.0 1206 705 A 130 LYS HA A 130 LYS HGx 1.0 1.8 6.0 1207 705 A 130 LYS HA A 130 LYS HGy 1.0 1.8 6.0 1208 706 A 131 ASN H A 130 LYS HA 1.0 1.8 6.0 1209 707 A 127 TYR HA A 130 LYS HBx 1.0 1.8 6.0 1210 707 A 127 TYR HA A 130 LYS HBy 1.0 1.8 6.0 1211 708 A 130 LYS HA A 130 LYS HBx 1.0 1.8 6.0 1212 708 A 130 LYS HBy A 130 LYS HA 1.0 1.8 6.0 1213 709 A 130 LYS HBx A 130 LYS HDx 1.0 1.8 5.0 1214 709 A 130 LYS HD3 A 130 LYS HBx 1.0 1.8 5.0 1215 709 A 130 LYS HBy A 130 LYS HD3 1.0 1.8 5.0 1216 709 A 130 LYS HBy A 130 LYS HDx 1.0 1.8 5.0 1217 710 A 130 LYS HBy A 130 LYS HEx 1.0 1.8 6.0 1218 710 A 130 LYS HBx A 130 LYS HEx 1.0 1.8 6.0 1219 710 A 130 LYS HE3 A 130 LYS HBx 1.0 1.8 6.0 1220 710 A 130 LYS HBy A 130 LYS HE3 1.0 1.8 6.0 1221 711 A 130 LYS H A 130 LYS HBx 1.0 1.8 5.0 1222 711 A 130 LYS HBy A 130 LYS H 1.0 1.8 5.0 1223 712 A 131 ASN H A 130 LYS HBx 1.0 1.8 6.0 1224 712 A 130 LYS HBy A 131 ASN H 1.0 1.8 6.0 1225 713 A 127 TYR HD% A 130 LYS HDx 1.0 1.8 6.0 1226 713 A 127 TYR HD% A 130 LYS HD3 1.0 1.8 6.0 1227 714 A 127 TYR HE% A 130 LYS HDx 1.0 1.8 6.0 1228 714 A 127 TYR HE% A 130 LYS HD3 1.0 1.8 6.0 1229 715 A 130 LYS HBx A 130 LYS HDx 1.0 1.8 2.7 1230 715 A 130 LYS HD3 A 130 LYS HBx 1.0 1.8 2.7 1231 715 A 130 LYS HBy A 130 LYS HD3 1.0 1.8 2.7 1232 715 A 130 LYS HBy A 130 LYS HDx 1.0 1.8 2.7 1233 716 A 130 LYS HD3 A 130 LYS HGx 1.0 1.8 2.7 1234 716 A 130 LYS HDx A 130 LYS HGx 1.0 1.8 2.7 1235 716 A 130 LYS HGy A 130 LYS HDx 1.0 1.8 2.7 1236 716 A 130 LYS HD3 A 130 LYS HGy 1.0 1.8 2.7 1237 717 A 130 LYS H A 130 LYS HDx 1.0 1.8 6.0 1238 717 A 130 LYS HD3 A 130 LYS H 1.0 1.8 6.0 1239 718 A 130 LYS HDx A 130 LYS HEx 1.0 1.8 2.7 1240 718 A 130 LYS HD3 A 130 LYS HEx 1.0 1.8 2.7 1241 718 A 130 LYS HE3 A 130 LYS HDx 1.0 1.8 2.7 1242 718 A 130 LYS HD3 A 130 LYS HE3 1.0 1.8 2.7 1243 719 A 130 LYS HE3 A 130 LYS HGx 1.0 1.8 3.8 1244 719 A 130 LYS HEx A 130 LYS HGx 1.0 1.8 3.8 1245 719 A 130 LYS HGy A 130 LYS HEx 1.0 1.8 3.8 1246 719 A 130 LYS HGy A 130 LYS HE3 1.0 1.8 3.8 1247 720 A 129 HIS HB2 A 130 LYS HGx 1.0 1.8 6.0 1248 720 A 129 HIS HBy A 130 LYS HGx 1.0 1.8 6.0 1249 720 A 130 LYS HGy A 129 HIS HB2 1.0 1.8 6.0 1250 720 A 129 HIS HBy A 130 LYS HGy 1.0 1.8 6.0 1251 721 A 130 LYS HA A 130 LYS HGx 1.0 1.8 6.0 1252 721 A 130 LYS HA A 130 LYS HGy 1.0 1.8 6.0 1253 722 A 130 LYS HD3 A 130 LYS HGx 1.0 1.8 2.7 1254 722 A 130 LYS HDx A 130 LYS HGx 1.0 1.8 2.7 1255 722 A 130 LYS HGy A 130 LYS HDx 1.0 1.8 2.7 1256 722 A 130 LYS HD3 A 130 LYS HGy 1.0 1.8 2.7 1257 723 A 130 LYS H A 130 LYS HGx 1.0 1.8 6.0 1258 723 A 130 LYS H A 130 LYS HGy 1.0 1.8 6.0 1259 724 A 131 ASN H A 130 LYS HGx 1.0 1.8 6.0 1260 724 A 131 ASN H A 130 LYS HGy 1.0 1.8 6.0 1261 725 A 130 LYS H A 126 ASN HBx 1.0 1.8 6.5 1262 725 A 126 ASN HBy A 130 LYS H 1.0 1.8 6.5 1263 726 A 130 LYS H A 130 LYS HA 1.0 1.8 5.0 1264 727 A 130 LYS H A 130 LYS HBx 1.0 1.8 2.9 1265 727 A 130 LYS HBy A 130 LYS H 1.0 1.8 2.9 1266 728 A 130 LYS H A 130 LYS HGx 1.0 1.8 5.0 1267 728 A 130 LYS H A 130 LYS HGy 1.0 1.8 5.0 1268 729 A 130 LYS H A 131 ASN H 1.0 1.8 4.0 1269 730 A 131 ASN HA A 130 LYS HBx 1.0 1.8 6.0 1270 730 A 130 LYS HBy A 131 ASN HA 1.0 1.8 6.0 1271 731 A 131 ASN HA A 131 ASN HBx 1.0 1.8 3.8 1272 731 A 131 ASN HBy A 131 ASN HA 1.0 1.8 3.8 1273 732 A 131 ASN H A 131 ASN HA 1.0 1.8 5.0 1274 733 A 131 ASN HA A 132 GLY H 1.0 1.8 5.0 1275 734 A 127 TYR HE% A 131 ASN HBx 1.0 1.8 6.0 1276 734 A 127 TYR HE% A 131 ASN HBy 1.0 1.8 6.0 1277 735 A 131 ASN H A 131 ASN HBx 1.0 1.8 5.0 1278 735 A 131 ASN HBy A 131 ASN H 1.0 1.8 5.0 1279 736 A 130 LYS HBx A 131 ASN HD22 1.0 1.8 6.5 1280 736 A 130 LYS HBy A 131 ASN HD21 1.0 1.8 6.5 1281 736 A 131 ASN HD21 A 130 LYS HBx 1.0 1.8 6.5 1282 736 A 130 LYS HBy A 131 ASN HD22 1.0 1.8 6.5 1283 737 A 131 ASN HD21 A 131 ASN HBx 1.0 1.8 6.5 1284 737 A 131 ASN HBx A 131 ASN HD22 1.0 1.8 6.5 1285 737 A 131 ASN HBy A 131 ASN HD21 1.0 1.8 6.5 1286 737 A 131 ASN HBy A 131 ASN HD22 1.0 1.8 6.5 1287 738 A 131 ASN HD21 A 130 LYS HBx 1.0 1.8 6.5 1288 738 A 130 LYS HBy A 131 ASN HD21 1.0 1.8 6.5 1289 739 A 131 ASN HA A 131 ASN HD21 1.0 1.8 6.5 1290 740 A 131 ASN HD21 A 131 ASN HBx 1.0 1.8 6.5 1291 740 A 131 ASN HBy A 131 ASN HD21 1.0 1.8 6.5 1292 741 A 131 ASN H A 130 LYS HBx 1.0 1.8 5.0 1293 741 A 130 LYS HBy A 131 ASN H 1.0 1.8 5.0 1294 742 A 131 ASN H A 130 LYS HGx 1.0 1.8 6.0 1295 742 A 131 ASN H A 130 LYS HGy 1.0 1.8 6.0 1296 743 A 131 ASN H A 131 ASN HBx 1.0 1.8 4.0 1297 743 A 131 ASN HBy A 131 ASN H 1.0 1.8 4.0 1298 744 A 131 ASN H A 131 ASN HD21 1.0 1.8 6.5 1299 745 A 131 ASN H A 132 GLY H 1.0 1.8 4.0 1300 746 A 128 LEU HDy% A 132 GLY H 1.0 1.8 6.5 1301 747 A 132 GLY H A 130 LYS HBx 1.0 1.8 6.5 1302 747 A 130 LYS HBy A 132 GLY H 1.0 1.8 6.5 1303 748 A 132 GLY H A 130 LYS HGx 1.0 1.8 6.5 1304 748 A 130 LYS HGy A 132 GLY H 1.0 1.8 6.5 1305 749 A 132 GLY H A 131 ASN HBx 1.0 1.8 6.5 1306 749 A 131 ASN HBy A 132 GLY H 1.0 1.8 6.5 1307 750 A 132 GLY H A 132 GLY HAx 1.0 1.8 2.9 1308 750 A 132 GLY H A 132 GLY HA3 1.0 1.8 2.9 1309 751 A 132 GLY H A 133 GLU HBx 1.0 1.8 6.5 1310 751 A 133 GLU HBy A 132 GLY H 1.0 1.8 6.5 1311 752 A 132 GLY H A 133 GLU H 1.0 1.8 4.0 1312 753 A 132 GLY H A 134 THR HG2% 1.0 1.8 6.5 1313 754 A 133 GLU H A 133 GLU HA 1.0 1.8 4.0 1314 755 A 128 LEU HA A 133 GLU HBx 1.0 1.8 6.0 1315 755 A 128 LEU HA A 133 GLU HBy 1.0 1.8 6.0 1316 756 A 128 LEU HDy% A 133 GLU HBx 1.0 1.8 6.0 1317 756 A 128 LEU HDy% A 133 GLU HBy 1.0 1.8 6.0 1318 757 A 133 GLU HA A 133 GLU HBx 1.0 1.8 6.0 1319 757 A 133 GLU HBy A 133 GLU HA 1.0 1.8 6.0 1320 758 A 133 GLU HBx A 133 GLU HGx 1.0 1.8 3.8 1321 758 A 133 GLU HBy A 133 GLU HGx 1.0 1.8 3.8 1322 758 A 133 GLU HG3 A 133 GLU HBx 1.0 1.8 3.8 1323 758 A 133 GLU HBy A 133 GLU HG3 1.0 1.8 3.8 1324 759 A 133 GLU H A 133 GLU HBx 1.0 1.8 4.0 1325 759 A 133 GLU HBy A 133 GLU H 1.0 1.8 4.0 1326 760 A 133 GLU H A 133 GLU HBx 1.0 1.8 6.0 1327 760 A 133 GLU HBy A 133 GLU H 1.0 1.8 6.0 1328 761 A 133 GLU HBx A 133 GLU HGx 1.0 1.8 3.8 1329 761 A 133 GLU HBy A 133 GLU HGx 1.0 1.8 3.8 1330 761 A 133 GLU HG3 A 133 GLU HBx 1.0 1.8 3.8 1331 761 A 133 GLU HBy A 133 GLU HG3 1.0 1.8 3.8 1332 762 A 128 LEU HDx% A 133 GLU H 1.0 1.8 6.5 1333 763 A 128 LEU HDy% A 133 GLU H 1.0 1.8 6.5 1334 764 A 129 HIS HA A 133 GLU H 1.0 1.8 5.0 1335 765 A 133 GLU H A 131 ASN HBx 1.0 1.8 6.5 1336 765 A 131 ASN HBy A 133 GLU H 1.0 1.8 6.5 1337 766 A 133 GLU H A 132 GLY HAx 1.0 1.8 4.0 1338 766 A 132 GLY HA3 A 133 GLU H 1.0 1.8 4.0 1339 767 A 133 GLU H A 133 GLU HGx 1.0 1.8 5.0 1340 767 A 133 GLU H A 133 GLU HG3 1.0 1.8 5.0 1341 768 A 133 GLU H A 134 THR HG2% 1.0 1.8 6.5 1342 769 A 133 GLU H A 134 THR H 1.0 1.8 6.5 1343 770 A 134 THR HG2% A 134 THR HA 1.0 1.8 6.0 1344 771 A 129 HIS HA A 134 THR HB 1.0 1.8 5.0 1345 772 A 134 THR HG2% A 134 THR HB 1.0 1.8 2.7 1346 773 A 134 THR H A 134 THR HA 1.0 1.8 5.0 1347 773 A 133 GLU HA A 134 THR H 1.0 1.8 5.0 1348 774 A 134 THR H A 135 SER H 1.0 1.8 6.5 1349 775 A 135 SER HA A 135 SER HBx 1.0 1.8 5.0 1350 775 A 135 SER HA A 135 SER HB3 1.0 1.8 5.0 1351 776 A 135 SER HA A 136 LEU H 1.0 1.8 5.0 1352 777 A 135 SER H A 133 GLU HGx 1.0 1.8 6.5 1353 777 A 133 GLU HG3 A 135 SER H 1.0 1.8 6.5 1354 778 A 134 THR HA A 135 SER H 1.0 1.8 6.5 1355 779 A 134 THR HG2% A 135 SER H 1.0 1.8 6.5 1356 780 A 135 SER H A 135 SER HBx 1.0 1.8 6.5 1357 780 A 135 SER H A 135 SER HB3 1.0 1.8 6.5 1358 781 A 135 SER H A 136 LEU HBx 1.0 1.8 6.5 1359 781 A 135 SER H A 136 LEU HBy 1.0 1.8 6.5 1360 782 A 136 LEU HA A 136 LEU HBx 1.0 1.8 5.0 1361 782 A 136 LEU HBy A 136 LEU HA 1.0 1.8 5.0 1362 783 A 136 LEU HA A 136 LEU HD1% 1.0 1.8 3.8 1363 784 A 136 LEU HA A 136 LEU HG 1.0 1.8 6.0 1364 785 A 128 LEU HDx% A 136 LEU HBx 1.0 1.8 6.0 1365 785 A 128 LEU HDx% A 136 LEU HBy 1.0 1.8 6.0 1366 786 A 136 LEU HA A 136 LEU HBx 1.0 1.8 6.0 1367 786 A 136 LEU HBy A 136 LEU HA 1.0 1.8 6.0 1368 787 A 136 LEU HD1% A 136 LEU HBx 1.0 1.8 5.0 1369 787 A 136 LEU HBy A 136 LEU HD1% 1.0 1.8 5.0 1370 788 A 136 LEU HG A 136 LEU HBx 1.0 1.8 5.0 1371 788 A 136 LEU HBy A 136 LEU HG 1.0 1.8 5.0 1372 789 A 136 LEU H A 136 LEU HBx 1.0 1.8 4.0 1373 789 A 136 LEU H A 136 LEU HBy 1.0 1.8 4.0 1374 790 A 136 LEU H A 136 LEU HBx 1.0 1.8 6.0 1375 790 A 136 LEU H A 136 LEU HBy 1.0 1.8 6.0 1376 791 A 137 LYS H A 136 LEU HBx 1.0 1.8 5.0 1377 791 A 136 LEU HBy A 137 LYS H 1.0 1.8 5.0 1378 792 A 136 LEU HD1% A 136 LEU HG 1.0 1.8 5.0 1379 793 A 90 TRP HE1 A 136 LEU HG 1.0 1.8 5.0 1380 794 A 90 TRP HZ2 A 136 LEU HG 1.0 1.8 6.0 1381 795 A 128 LEU HDx% A 136 LEU H 1.0 1.8 6.0 1382 796 A 136 LEU H A 133 GLU HGx 1.0 1.8 6.5 1383 796 A 133 GLU HG3 A 136 LEU H 1.0 1.8 6.5 1384 797 A 136 LEU H A 135 SER HBx 1.0 1.8 6.5 1385 797 A 135 SER HB3 A 136 LEU H 1.0 1.8 6.5 1386 798 A 135 SER H A 136 LEU H 1.0 1.8 5.0 1387 799 A 136 LEU H A 136 LEU HA 1.0 1.8 5.0 1388 800 A 136 LEU H A 136 LEU HD1% 1.0 1.8 6.5 1389 801 A 136 LEU H A 136 LEU HG 1.0 1.8 6.0 1390 802 A 136 LEU H A 137 LYS H 1.0 1.8 6.5 1391 803 A 137 LYS HDx A 137 LYS HEx 1.0 1.8 2.7 1392 803 A 137 LYS HD3 A 137 LYS HEx 1.0 1.8 2.7 1393 803 A 137 LYS HEy A 137 LYS HDx 1.0 1.8 2.7 1394 803 A 137 LYS HD3 A 137 LYS HEy 1.0 1.8 2.7 1395 804 A 137 LYS H A 137 LYS HDx 1.0 1.8 6.0 1396 804 A 137 LYS H A 137 LYS HD3 1.0 1.8 6.0 1397 805 A 137 LYS HDx A 138 PRO HDx 1.0 1.8 6.0 1398 805 A 138 PRO HDy A 137 LYS HDx 1.0 1.8 6.0 1399 805 A 137 LYS HD3 A 138 PRO HDy 1.0 1.8 6.0 1400 805 A 137 LYS HD3 A 138 PRO HDx 1.0 1.8 6.0 1401 806 A 137 LYS HDx A 139 GLU HBy 1.0 1.8 3.8 1402 806 A 137 LYS HD3 A 139 GLU HBy 1.0 1.8 3.8 1403 806 A 139 GLU HBx A 137 LYS HDx 1.0 1.8 3.8 1404 806 A 137 LYS HD3 A 139 GLU HBx 1.0 1.8 3.8 1405 807 A 140 ASP H A 137 LYS HDx 1.0 1.8 6.0 1406 807 A 137 LYS HD3 A 140 ASP H 1.0 1.8 6.0 1407 808 A 128 LEU HDx% A 137 LYS H 1.0 1.8 6.5 1408 809 A 136 LEU HA A 137 LYS H 1.0 1.8 2.9 1409 810 A 136 LEU HG A 137 LYS H 1.0 1.8 6.5 1410 811 A 137 LYS H A 138 PRO HDx 1.0 1.8 6.5 1411 811 A 137 LYS H A 138 PRO HDy 1.0 1.8 6.5 1412 812 A 137 LYS H A 140 ASP HBy 1.0 1.8 6.5 1413 812 A 137 LYS H A 140 ASP HBx 1.0 1.8 6.5 1414 813 A 141 PHE HD% A 137 LYS H 1.0 1.8 6.5 1415 814 A 138 PRO HA A 138 PRO HBx 1.0 1.8 6.0 1416 814 A 138 PRO HBy A 138 PRO HA 1.0 1.8 6.0 1417 815 A 138 PRO HBx A 138 PRO HDx 1.0 1.8 6.0 1418 815 A 138 PRO HBy A 138 PRO HDx 1.0 1.8 6.0 1419 815 A 138 PRO HDy A 138 PRO HBx 1.0 1.8 6.0 1420 815 A 138 PRO HBy A 138 PRO HDy 1.0 1.8 6.0 1421 816 A 138 PRO HBy A 138 PRO HGy 1.0 1.8 5.0 1422 816 A 138 PRO HBx A 138 PRO HGy 1.0 1.8 5.0 1423 816 A 138 PRO HGx A 138 PRO HBx 1.0 1.8 5.0 1424 816 A 138 PRO HBy A 138 PRO HGx 1.0 1.8 5.0 1425 817 A 138 PRO HBy A 138 PRO HGy 1.0 1.8 6.0 1426 817 A 138 PRO HBx A 138 PRO HGy 1.0 1.8 6.0 1427 817 A 138 PRO HGx A 138 PRO HBx 1.0 1.8 6.0 1428 817 A 138 PRO HBy A 138 PRO HGx 1.0 1.8 6.0 1429 818 A 139 GLU H A 138 PRO HBx 1.0 1.8 6.0 1430 818 A 138 PRO HBy A 139 GLU H 1.0 1.8 6.0 1431 819 A 125 ALA HB% A 138 PRO HDx 1.0 1.8 6.0 1432 819 A 125 ALA HB% A 138 PRO HDy 1.0 1.8 6.0 1433 820 A 128 LEU HDx% A 138 PRO HDx 1.0 1.8 6.0 1434 820 A 128 LEU HDx% A 138 PRO HDy 1.0 1.8 6.0 1435 821 A 138 PRO HBx A 138 PRO HDx 1.0 1.8 6.0 1436 821 A 138 PRO HBy A 138 PRO HDx 1.0 1.8 6.0 1437 821 A 138 PRO HDy A 138 PRO HBx 1.0 1.8 6.0 1438 821 A 138 PRO HBy A 138 PRO HDy 1.0 1.8 6.0 1439 822 A 138 PRO HDy A 138 PRO HGy 1.0 1.8 6.0 1440 822 A 138 PRO HDx A 138 PRO HGy 1.0 1.8 6.0 1441 822 A 138 PRO HGx A 138 PRO HDx 1.0 1.8 6.0 1442 822 A 138 PRO HGx A 138 PRO HDy 1.0 1.8 6.0 1443 823 A 128 LEU HDx% A 138 PRO HGy 1.0 1.8 6.0 1444 823 A 138 PRO HGx A 128 LEU HDx% 1.0 1.8 6.0 1445 824 A 138 PRO HBy A 138 PRO HGy 1.0 1.8 5.0 1446 824 A 138 PRO HBx A 138 PRO HGy 1.0 1.8 5.0 1447 824 A 138 PRO HGx A 138 PRO HBx 1.0 1.8 5.0 1448 824 A 138 PRO HBy A 138 PRO HGx 1.0 1.8 5.0 1449 825 A 138 PRO HDy A 138 PRO HGy 1.0 1.8 5.0 1450 825 A 138 PRO HDx A 138 PRO HGy 1.0 1.8 5.0 1451 825 A 138 PRO HGx A 138 PRO HDx 1.0 1.8 5.0 1452 825 A 138 PRO HGx A 138 PRO HDy 1.0 1.8 5.0 1453 826 A 138 PRO HDy A 138 PRO HGy 1.0 1.8 6.0 1454 826 A 138 PRO HDx A 138 PRO HGy 1.0 1.8 6.0 1455 826 A 138 PRO HGx A 138 PRO HDx 1.0 1.8 6.0 1456 826 A 138 PRO HGx A 138 PRO HDy 1.0 1.8 6.0 1457 827 A 139 GLU HA A 139 GLU HBy 1.0 1.8 6.0 1458 827 A 139 GLU HBx A 139 GLU HA 1.0 1.8 6.0 1459 828 A 139 GLU HA A 139 GLU HGx 1.0 1.8 6.0 1460 828 A 139 GLU HA A 139 GLU HGy 1.0 1.8 6.0 1461 829 A 139 GLU H A 139 GLU HA 1.0 1.8 6.0 1462 830 A 139 GLU HBx A 139 GLU HGx 1.0 1.8 3.8 1463 830 A 139 GLU HBy A 139 GLU HGx 1.0 1.8 3.8 1464 830 A 139 GLU HGy A 139 GLU HBy 1.0 1.8 3.8 1465 830 A 139 GLU HBx A 139 GLU HGy 1.0 1.8 3.8 1466 831 A 139 GLU H A 139 GLU HBy 1.0 1.8 4.0 1467 831 A 139 GLU HBx A 139 GLU H 1.0 1.8 4.0 1468 832 A 139 GLU H A 139 GLU HBy 1.0 1.8 6.0 1469 832 A 139 GLU HBx A 139 GLU H 1.0 1.8 6.0 1470 833 A 140 ASP H A 139 GLU HBy 1.0 1.8 5.0 1471 833 A 139 GLU HBx A 140 ASP H 1.0 1.8 5.0 1472 834 A 140 ASP H A 139 GLU HBy 1.0 1.8 6.0 1473 834 A 139 GLU HBx A 140 ASP H 1.0 1.8 6.0 1474 835 A 139 GLU H A 137 LYS HBy 1.0 1.8 6.5 1475 835 A 139 GLU H A 137 LYS HBx 1.0 1.8 6.5 1476 836 A 139 GLU H A 137 LYS HGx 1.0 1.8 6.5 1477 836 A 139 GLU H A 137 LYS HGy 1.0 1.8 6.5 1478 837 A 138 PRO HA A 139 GLU H 1.0 1.8 6.5 1479 838 A 139 GLU H A 138 PRO HDx 1.0 1.8 6.5 1480 838 A 138 PRO HDy A 139 GLU H 1.0 1.8 6.5 1481 839 A 139 GLU H A 138 PRO HGy 1.0 1.8 6.0 1482 839 A 138 PRO HGx A 139 GLU H 1.0 1.8 6.0 1483 840 A 139 GLU H A 139 GLU HGx 1.0 1.8 6.5 1484 840 A 139 GLU H A 139 GLU HGy 1.0 1.8 6.5 1485 841 A 140 ASP H A 139 GLU H 1.0 1.8 6.5 1486 842 A 140 ASP HA A 140 ASP HBy 1.0 1.8 6.0 1487 842 A 140 ASP HBx A 140 ASP HA 1.0 1.8 6.0 1488 843 A 141 PHE H A 140 ASP HA 1.0 1.8 6.0 1489 844 A 140 ASP H A 140 ASP HBy 1.0 1.8 4.0 1490 844 A 140 ASP H A 140 ASP HBx 1.0 1.8 4.0 1491 845 A 136 LEU HD1% A 140 ASP H 1.0 1.8 6.5 1492 846 A 140 ASP H A 137 LYS HBy 1.0 1.8 6.5 1493 846 A 140 ASP H A 137 LYS HBx 1.0 1.8 6.5 1494 847 A 140 ASP H A 137 LYS HGx 1.0 1.8 6.5 1495 847 A 140 ASP H A 137 LYS HGy 1.0 1.8 6.5 1496 848 A 138 PRO HA A 140 ASP H 1.0 1.8 6.5 1497 849 A 140 ASP H A 138 PRO HGy 1.0 1.8 6.5 1498 849 A 140 ASP H A 141 PHE HBx 1.0 1.8 6.5 1499 849 A 141 PHE HBy A 140 ASP H 1.0 1.8 6.5 1500 849 A 138 PRO HGx A 140 ASP H 1.0 1.8 6.5 1501 850 A 140 ASP H A 139 GLU HA 1.0 1.8 5.0 1502 851 A 140 ASP H A 140 ASP HA 1.0 1.8 4.0 1503 852 A 140 ASP H A 140 ASP HBy 1.0 1.8 4.0 1504 852 A 140 ASP H A 140 ASP HBx 1.0 1.8 4.0 1505 853 A 140 ASP H A 141 PHE HBx 1.0 1.8 6.5 1506 853 A 141 PHE HBy A 140 ASP H 1.0 1.8 6.5 1507 854 A 141 PHE HD% A 140 ASP H 1.0 1.8 6.5 1508 855 A 141 PHE H A 140 ASP H 1.0 1.8 4.0 1509 856 A 141 PHE HA A 141 PHE HBx 1.0 1.8 6.0 1510 856 A 141 PHE HBy A 141 PHE HA 1.0 1.8 6.0 1511 857 A 141 PHE HD% A 141 PHE HBx 1.0 1.8 6.0 1512 857 A 141 PHE HBy A 141 PHE HD% 1.0 1.8 6.0 1513 858 A 141 PHE H A 141 PHE HBx 1.0 1.8 5.0 1514 858 A 141 PHE HBy A 141 PHE H 1.0 1.8 5.0 1515 859 A 141 PHE H A 141 PHE HBx 1.0 1.8 6.0 1516 859 A 141 PHE HBy A 141 PHE H 1.0 1.8 6.0 1517 860 A 141 PHE HD% A 141 PHE HBx 1.0 1.8 6.0 1518 860 A 141 PHE HBy A 141 PHE HD% 1.0 1.8 6.0 1519 861 A 141 PHE HD% A 141 PHE H 1.0 1.8 5.0 1520 862 A 124 LEU HDy% A 141 PHE H 1.0 1.8 6.0 1521 863 A 141 PHE H A 138 PRO HA 1.0 1.8 6.5 1522 864 A 141 PHE H A 139 GLU HA 1.0 1.8 6.5 1523 865 A 141 PHE H A 140 ASP HBy 1.0 1.8 6.5 1524 865 A 141 PHE H A 140 ASP HBx 1.0 1.8 6.5 1525 866 A 142 ASP HA A 142 ASP HBx 1.0 1.8 6.0 1526 866 A 142 ASP HA A 142 ASP HBy 1.0 1.8 6.0 1527 867 A 141 PHE HA A 142 ASP H 1.0 1.8 6.5 1528 868 A 142 ASP HA A 142 ASP H 1.0 1.8 6.5 1529 869 A 142 ASP H A 142 ASP HBx 1.0 1.8 6.5 1530 869 A 142 ASP HBy A 142 ASP H 1.0 1.8 6.5 1531 870 A 108 VAL HB A 143 PHE HA 1.0 1.8 6.0 1532 871 A 108 VAL HGx% A 143 PHE HA 1.0 1.8 6.0 1533 872 A 108 VAL HGy% A 143 PHE HA 1.0 1.8 5.0 1534 873 A 143 PHE HA A 143 PHE HBx 1.0 1.8 6.0 1535 873 A 143 PHE HA A 143 PHE HBy 1.0 1.8 6.0 1536 874 A 143 PHE HA A 143 PHE HD% 1.0 1.8 6.0 1537 875 A 143 PHE HA A 144 THR H 1.0 1.8 6.0 1538 876 A 108 VAL HGy% A 143 PHE HBx 1.0 1.8 6.0 1539 876 A 108 VAL HGy% A 143 PHE HBy 1.0 1.8 6.0 1540 877 A 143 PHE HA A 143 PHE HBx 1.0 1.8 6.0 1541 877 A 143 PHE HA A 143 PHE HBy 1.0 1.8 6.0 1542 878 A 143 PHE HD% A 143 PHE HBx 1.0 1.8 6.0 1543 878 A 143 PHE HBy A 143 PHE HD% 1.0 1.8 6.0 1544 879 A 108 VAL HB A 143 PHE HD% 1.0 1.8 6.0 1545 880 A 108 VAL HGy% A 143 PHE HD% 1.0 1.8 6.0 1546 881 A 143 PHE HD% A 143 PHE HBx 1.0 1.8 5.0 1547 881 A 143 PHE HBy A 143 PHE HD% 1.0 1.8 5.0 1548 882 A 143 PHE HD% A 143 PHE HE% 1.0 1.8 5.0 1549 883 A 142 ASP HA A 143 PHE H 1.0 1.8 6.5 1550 884 A 143 PHE HA A 143 PHE H 1.0 1.8 6.0 1551 885 A 143 PHE H A 143 PHE HBx 1.0 1.8 6.0 1552 885 A 143 PHE HBy A 143 PHE H 1.0 1.8 6.0 1553 886 A 143 PHE H A 143 PHE HBx 1.0 1.8 6.5 1554 886 A 143 PHE HBy A 143 PHE H 1.0 1.8 6.5 1555 887 A 143 PHE HD% A 143 PHE H 1.0 1.8 6.5 1556 888 A 144 THR HB A 144 THR HA 1.0 1.8 6.0 1557 889 A 144 THR HB A 144 THR HG2% 1.0 1.8 3.8 1558 890 A 144 THR H A 144 THR HB 1.0 1.8 6.0 1559 891 A 144 THR HA A 144 THR HG2% 1.0 1.8 6.0 1560 892 A 144 THR H A 144 THR HG2% 1.0 1.8 5.0 1561 893 A 144 THR HG2% A 146 LEU H 1.0 1.8 6.0 1562 894 A 108 VAL HGx% A 144 THR H 1.0 1.8 6.5 1563 895 A 108 VAL HGy% A 144 THR H 1.0 1.8 6.5 1564 896 A 143 PHE HD% A 144 THR H 1.0 1.8 6.5 1565 897 A 144 THR H A 143 PHE H 1.0 1.8 6.5 1566 898 A 108 VAL HGx% A 145 VAL HA 1.0 1.8 6.0 1567 899 A 146 LEU H A 145 VAL HA 1.0 1.8 4.0 1568 900 A 145 VAL HG11 A 145 VAL HB 1.0 1.8 5.0 1569 901 A 145 VAL HB A 145 VAL H 1.0 1.8 6.0 1570 902 A 145 VAL HG11 A 145 VAL HA 1.0 1.8 6.0 1571 903 A 146 LEU HA A 146 LEU HBy 1.0 1.8 3.8 1572 903 A 146 LEU HA A 146 LEU HBx 1.0 1.8 3.8 1573 904 A 146 LEU HA A 146 LEU HDx% 1.0 1.8 3.8 1574 905 A 146 LEU H A 146 LEU HA 1.0 1.8 5.0 1575 906 A 147 SER H A 146 LEU HA 1.0 1.8 4.0 1576 907 A 146 LEU HA A 146 LEU HBy 1.0 1.8 6.0 1577 907 A 146 LEU HA A 146 LEU HBx 1.0 1.8 6.0 1578 908 A 146 LEU HDx% A 146 LEU HBy 1.0 1.8 3.8 1579 908 A 146 LEU HBx A 146 LEU HDx% 1.0 1.8 3.8 1580 909 A 146 LEU HDy% A 146 LEU HBy 1.0 1.8 3.8 1581 909 A 146 LEU HBx A 146 LEU HDy% 1.0 1.8 3.8 1582 910 A 146 LEU H A 146 LEU HBy 1.0 1.8 5.0 1583 910 A 146 LEU H A 146 LEU HBx 1.0 1.8 5.0 1584 911 A 147 SER H A 146 LEU HBy 1.0 1.8 6.0 1585 911 A 147 SER H A 146 LEU HBx 1.0 1.8 6.0 1586 912 A 146 LEU HDx% A 146 LEU HG 1.0 1.8 5.0 1587 913 A 146 LEU HA A 146 LEU HG 1.0 1.8 6.0 1588 914 A 147 SER H A 146 LEU HG 1.0 1.8 6.0 1589 915 A 144 THR HA A 146 LEU H 1.0 1.8 6.5 1590 916 A 146 LEU H A 145 VAL HB 1.0 1.8 5.0 1591 917 A 145 VAL HG11 A 146 LEU H 1.0 1.8 6.5 1592 918 A 146 LEU H A 145 VAL H 1.0 1.8 6.5 1593 919 A 146 LEU H A 146 LEU HDx% 1.0 1.8 5.0 1594 920 A 146 LEU H A 146 LEU HG 1.0 1.8 2.9 1595 921 A 147 SER H A 145 VAL HA 1.0 1.8 6.5 1596 922 A 147 SER H A 145 VAL HG11 1.0 1.8 6.5 1597 923 A 147 SER H A 146 LEU HDx% 1.0 1.8 6.5 1598 924 A 147 SER H A 147 SER HA 1.0 1.8 6.5 1599 925 A 147 SER H A 148 LYS HA 1.0 1.8 6.5 1600 926 A 148 LYS HA A 148 LYS HBx 1.0 1.8 6.0 1601 926 A 148 LYS HA A 148 LYS HBy 1.0 1.8 6.0 1602 927 A 148 LYS HA A 148 LYS HDx 1.0 1.8 6.0 1603 927 A 148 LYS HA A 148 LYS HD3 1.0 1.8 6.0 1604 928 A 148 LYS HA A 148 LYS HGx 1.0 1.8 6.0 1605 928 A 148 LYS HGy A 148 LYS HA 1.0 1.8 6.0 1606 929 A 148 LYS HA A 148 LYS HBx 1.0 1.8 6.0 1607 929 A 148 LYS HA A 148 LYS HBy 1.0 1.8 6.0 1608 930 A 148 LYS HBx A 148 LYS HGx 1.0 1.8 6.0 1609 930 A 148 LYS HBy A 148 LYS HGx 1.0 1.8 6.0 1610 930 A 148 LYS HGy A 148 LYS HBx 1.0 1.8 6.0 1611 930 A 148 LYS HGy A 148 LYS HBy 1.0 1.8 6.0 1612 931 A 148 LYS H A 148 LYS HBx 1.0 1.8 5.0 1613 931 A 148 LYS H A 148 LYS HBy 1.0 1.8 5.0 1614 932 A 148 LYS H A 148 LYS HBx 1.0 1.8 6.0 1615 932 A 148 LYS H A 148 LYS HBy 1.0 1.8 6.0 1616 933 A 148 LYS H A 148 LYS HGx 1.0 1.8 5.0 1617 933 A 148 LYS HGy A 148 LYS H 1.0 1.8 5.0 1618 934 A 148 LYS H A 146 LEU HDx% 1.0 1.8 6.5 1619 935 A 148 LYS H A 148 LYS HA 1.0 1.8 4.0 1620 936 A 97 ARG HDy B 205 5CM H6 1.0 1.8 6.0 1621 936 B 205 5CM H6 A 97 ARG HDx 1.0 1.8 6.0 1622 937 A 102 THR HG2% B 206 DG H2' 1.0 1.8 6.0 1623 938 A 102 THR HG2% B 206 DG H8 1.0 1.8 5.0 1624 939 A 102 THR HG2% B 206 DG H2'' 1.0 1.8 6.0 1625 940 A 102 THR HG2% B 207 DG H8 1.0 1.8 5.0 1626 941 A 101 LYS H B 206 DG H8 1.0 1.8 6.0 1627 942 A 102 THR H B 206 DG H8 1.0 1.8 5.0 1628 943 A 103 ALA H B 206 DG H8 1.0 1.8 6.0 1629 944 B 202 DG H1 C 219 DC H5 1.0 1.8 6.0 1630 945 B 203 DA H1' B 203 DA H2' 1.0 1.8 6.0 1631 946 B 203 DA H1' B 203 DA H4' 1.0 1.8 5.0 1632 947 B 204 DT H6 B 204 DT H2' 1.0 1.8 5.0 1633 948 B 204 DT H6 B 204 DT H5'' 1.0 1.8 6.0 1634 949 B 204 DT H6 B 204 DT H2'' 1.0 1.8 5.0 1635 950 B 204 DT H2'' B 204 DT H1' 1.0 1.8 6.0 1636 951 B 204 DT H2' B 204 DT H1' 1.0 1.8 6.0 1637 952 B 205 5CM H6 B 204 DT H2' 1.0 1.8 6.0 1638 953 B 205 5CM H6 B 204 DT H2'' 1.0 1.8 6.0 1639 954 B 205 5CM HN41 B 205 5CM HN42 1.0 1.8 6.0 1640 955 B 205 5CM H6 B 205 5CM H2'' 1.0 1.8 6.0 1641 956 B 205 5CM H6 B 205 5CM H2' 1.0 1.8 6.0 1642 957 B 206 DG H2' B 206 DG H8 1.0 1.8 6.0 1643 958 B 206 DG H8 B 206 DG H3' 1.0 1.8 6.0 1644 959 B 206 DG H2' B 206 DG H2'' 1.0 1.8 6.0 1645 960 B 206 DG H8 B 207 DG H8 1.0 1.8 6.0 1646 961 B 206 DG H2' B 207 DG H8 1.0 1.8 5.0 1647 962 B 206 DG H1 C 215 5CM HN42 1.0 1.8 6.0 1648 963 B 206 DG H1 C 215 5CM HN41 1.0 1.8 6.0 1649 964 B 207 DG H8 B 206 DG H3' 1.0 1.8 6.0 1650 965 B 207 DG H1 C 214 DC H41 1.0 1.8 6.0 1651 966 B 208 DC H5 B 207 DG H2' 1.0 1.8 6.0 1652 967 B 208 DC H5 B 207 DG H2'' 1.0 1.8 6.0 1653 968 B 208 DC H5 B 208 DC H6 1.0 1.8 3.8 1654 969 B 208 DC H5 B 208 DC H41 1.0 1.8 6.0 1655 970 B 208 DC H41 B 208 DC H42 1.0 1.8 6.0 1656 971 B 208 DC H41 C 213 DG H1 1.0 1.8 6.0 1657 972 B 209 DT H2'' B 209 DT H1' 1.0 1.8 3.8 1658 973 B 209 DT H1' B 209 DT H2' 1.0 1.8 5.0 1659 974 B 209 DT H2' B 209 DT H6 1.0 1.8 3.8 1660 975 B 209 DT H2'' B 209 DT H6 1.0 1.8 5.0 1661 976 B 209 DT H1' B 209 DT H4' 1.0 1.8 5.0 1662 977 B 209 DT H2'' B 210 DC H6 1.0 1.8 5.0 1663 978 B 209 DT H3 C 212 DA H2 1.0 1.8 6.0 1664 979 B 210 DC H6 B 210 DC H2'' 1.0 1.8 5.0 1665 980 B 210 DC H2'' B 210 DC H1' 1.0 1.8 2.7 1666 981 B 210 DC H1' B 210 DC H4' 1.0 1.8 5.0 1667 982 B 210 DC H6 B 210 DC H4' 1.0 1.8 5.0 1668 983 B 210 DC H6 B 210 DC H1' 1.0 1.8 6.0 1669 984 B 210 DC H6 B 210 DC H5 1.0 1.8 2.7 1670 985 C 212 DA H8 C 212 DA H1' 1.0 1.8 6.0 1671 986 C 212 DA H8 C 212 DA H3' 1.0 1.8 5.0 1672 987 C 212 DA H1' C 212 DA H2' 1.0 1.8 6.0 1673 988 C 212 DA H1' C 212 DA H2'' 1.0 1.8 6.0 1674 989 C 212 DA H8 C 212 DA H2'' 1.0 1.8 5.0 1675 990 C 212 DA H8 C 212 DA H2' 1.0 1.8 3.8 1676 991 B 208 DC H42 C 213 DG H1 1.0 1.8 6.0 1677 992 B 207 DG H1 C 214 DC H42 1.0 1.8 6.0 1678 993 C 214 DC H41 C 214 DC H42 1.0 1.8 6.0 1679 994 C 214 DC H42 C 214 DC H5 1.0 1.8 6.0 1680 995 C 215 5CM HN42 C 215 5CM HN41 1.0 1.8 6.0 1681 996 C 215 5CM H6 C 215 5CM H2' 1.0 1.8 6.0 1682 997 B 205 5CM HN42 C 216 DG H1 1.0 1.8 6.0 1683 998 B 205 5CM HN41 C 216 DG H1 1.0 1.8 6.0 1684 999 C 216 DG H1 C 217 DA H2 1.0 1.8 6.0 1685 1000 C 217 DA H2 B 204 DT H3 1.0 1.8 5.0 1686 1001 C 217 DA H8 C 216 DG H2'' 1.0 1.8 6.0 1687 1002 C 217 DA H8 C 216 DG H2' 1.0 1.8 6.0 1688 1003 C 217 DA H8 C 217 DA H1' 1.0 1.8 6.0 1689 1004 C 217 DA H8 C 217 DA H3' 1.0 1.8 6.0 1690 1005 C 217 DA H1' C 217 DA H2' 1.0 1.8 6.0 1691 1006 C 217 DA H1' C 217 DA H2'' 1.0 1.8 5.0 1692 1007 C 217 DA H8 C 217 DA H2'' 1.0 1.8 6.0 1693 1008 C 217 DA H1' C 217 DA H4' 1.0 1.8 5.0 1694 1009 C 217 DA H8 C 217 DA H5' 1.0 1.8 6.0 1695 1010 C 217 DA H8 C 217 DA H5'' 1.0 1.8 6.0 1696 1011 C 217 DA H8 C 217 DA H2' 1.0 1.8 5.0 1697 1012 C 217 DA H2 C 217 DA H1' 1.0 1.8 6.0 1698 1013 C 217 DA H8 C 218 DT H6 1.0 1.8 6.0 1699 1014 C 218 DT H3 B 203 DA H2 1.0 1.8 5.0 1700 1015 B 203 DA H2 C 218 DT H1' 1.0 1.8 6.0 1701 1016 C 217 DA H1' C 218 DT H6 1.0 1.8 6.0 1702 1017 C 218 DT H6 C 218 DT H2'' 1.0 1.8 5.0 1703 1018 C 218 DT H6 C 218 DT H1' 1.0 1.8 5.0 1704 1019 C 218 DT H1' C 218 DT H2'' 1.0 1.8 6.0 1705 1020 C 218 DT H2'' C 218 DT H2' 1.0 1.8 3.8 1706 1021 C 218 DT H2'' C 219 DC H6 1.0 1.8 6.0 1707 1022 C 218 DT H1' C 219 DC H6 1.0 1.8 6.0 1708 1023 C 218 DT H6 C 219 DC H42 1.0 1.8 6.0 1709 1024 B 202 DG H1 C 219 DC H41 1.0 1.8 6.0 1710 1025 B 202 DG H1 C 219 DC H42 1.0 1.8 6.0 1711 1026 C 219 DC H41 C 219 DC H42 1.0 1.8 5.0 1712 1027 C 219 DC H5 C 219 DC H6 1.0 1.8 2.7 1713 1028 C 219 DC H5 C 219 DC H41 1.0 1.8 5.0 1714 1029 C 219 DC H5 C 219 DC H42 1.0 1.8 6.0 1715 1030 C 219 DC H6 C 219 DC H2' 1.0 1.8 3.8 1716 1031 C 219 DC H6 C 219 DC H2'' 1.0 1.8 3.8 1717 1031 C 218 DT H2' C 219 DC H6 1.0 1.8 3.8 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 87 PRO C A 88 CYS N A 88 CYS CA A 88 CYS C 1.0 -85.6 -25.6 PHI 2 2 A 88 CYS N A 88 CYS CA A 88 CYS C A 89 GLY N 1.0 113.4 153.4 PSI 3 3 A 88 CYS C A 89 GLY N A 89 GLY CA A 89 GLY C 1.0 61.2 121.2 PHI 4 4 A 89 GLY N A 89 GLY CA A 89 GLY C A 90 TRP N 1.0 -24.9 15.1 PSI 5 5 A 89 GLY C A 90 TRP N A 90 TRP CA A 90 TRP C 1.0 -114.9 -54.9 PHI 6 6 A 90 TRP N A 90 TRP CA A 90 TRP C A 91 GLU N 1.0 127.7 168.9 PSI 7 7 A 90 TRP C A 91 GLU N A 91 GLU CA A 91 GLU C 1.0 -155.2 -95.2 PHI 8 8 A 91 GLU N A 91 GLU CA A 91 GLU C A 92 ARG N 1.0 115.5 155.5 PSI 9 9 A 91 GLU C A 92 ARG N A 92 ARG CA A 92 ARG C 1.0 -142.1 -82.1 PHI 10 10 A 92 ARG N A 92 ARG CA A 92 ARG C A 93 VAL N 1.0 109.3 149.3 PSI 11 11 A 92 ARG C A 93 VAL N A 93 VAL CA A 93 VAL C 1.0 -141.8 -81.8 PHI 12 12 A 93 VAL N A 93 VAL CA A 93 VAL C A 94 VAL N 1.0 107.9 147.9 PSI 13 13 A 93 VAL C A 94 VAL N A 94 VAL CA A 94 VAL C 1.0 -138.1 -78.1 PHI 14 14 A 94 VAL N A 94 VAL CA A 94 VAL C A 95 LYS N 1.0 106.0 146.0 PSI 15 15 A 94 VAL C A 95 LYS N A 95 LYS CA A 95 LYS C 1.0 -147.0 -87.0 PHI 16 16 A 95 LYS N A 95 LYS CA A 95 LYS C A 96 GLN N 1.0 108.9 148.9 PSI 17 17 A 95 LYS C A 96 GLN N A 96 GLN CA A 96 GLN C 1.0 -126.6 -66.6 PHI 18 18 A 96 GLN N A 96 GLN CA A 96 GLN C A 97 ARG N 1.0 103.3 143.3 PSI 19 19 A 96 GLN C A 97 ARG N A 97 ARG CA A 97 ARG C 1.0 -101.4 -41.4 PHI 20 20 A 97 ARG N A 97 ARG CA A 97 ARG C A 98 LEU N 1.0 103.4 163.4 PSI 21 21 A 98 LEU C A 99 PHE N A 99 PHE CA A 99 PHE C 1.0 -165.2 -105.2 PHI 22 22 A 100 GLY C A 101 LYS N A 101 LYS CA A 101 LYS C 1.0 -92.6 -32.6 PHI 23 23 A 101 LYS N A 101 LYS CA A 101 LYS C A 102 THR N 1.0 -56.8 3.2 PSI 24 24 A 101 LYS C A 102 THR N A 102 THR CA A 102 THR C 1.0 -129.1 -69.1 PHI 25 25 A 102 THR N A 102 THR CA A 102 THR C A 103 ALA N 1.0 -24.1 40.1 PSI 26 26 A 102 THR C A 103 ALA N A 103 ALA CA A 103 ALA C 1.0 -88.0 -28.0 PHI 27 27 A 103 ALA N A 103 ALA CA A 103 ALA C A 104 GLY N 1.0 101.7 161.7 PSI 28 28 A 103 ALA C A 104 GLY N A 104 GLY CA A 104 GLY C 1.0 64.9 124.9 PHI 29 29 A 104 GLY N A 104 GLY CA A 104 GLY C A 105 ARG N 1.0 -43.3 16.7 PSI 30 30 A 104 GLY C A 105 ARG N A 105 ARG CA A 105 ARG C 1.0 -105.1 -45.1 PHI 31 31 A 105 ARG N A 105 ARG CA A 105 ARG C A 106 PHE N 1.0 116.1 176.1 PSI 32 32 A 105 ARG C A 106 PHE N A 106 PHE CA A 106 PHE C 1.0 -146.2 -86.2 PHI 33 33 A 106 PHE N A 106 PHE CA A 106 PHE C A 107 ASP N 1.0 125.3 165.3 PSI 34 34 A 106 PHE C A 107 ASP N A 107 ASP CA A 107 ASP C 1.0 -173.4 -94.2 PHI 35 35 A 107 ASP N A 107 ASP CA A 107 ASP C A 108 VAL N 1.0 119.3 170.1 PSI 36 36 A 107 ASP C A 108 VAL N A 108 VAL CA A 108 VAL C 1.0 -141.2 -81.2 PHI 37 37 A 108 VAL N A 108 VAL CA A 108 VAL C A 109 TYR N 1.0 112.9 152.9 PSI 38 38 A 108 VAL C A 109 TYR N A 109 TYR CA A 109 TYR C 1.0 -156.4 -96.4 PHI 39 39 A 109 TYR N A 109 TYR CA A 109 TYR C A 110 PHE N 1.0 126.3 168.7 PSI 40 40 A 109 TYR C A 110 PHE N A 110 PHE CA A 110 PHE C 1.0 -155.8 -95.8 PHI 41 41 A 110 PHE N A 110 PHE CA A 110 PHE C A 111 ILE N 1.0 113.7 163.7 PSI 42 42 A 110 PHE C A 111 ILE N A 111 ILE CA A 111 ILE C 1.0 -143.7 -83.7 PHI 43 43 A 111 ILE N A 111 ILE CA A 111 ILE C A 112 SER N 1.0 111.3 151.3 PSI 44 44 A 111 ILE C A 112 SER N A 112 SER CA A 112 SER C 1.0 -103.7 -43.7 PHI 45 45 A 112 SER N A 112 SER CA A 112 SER C A 113 PRO N 1.0 144.1 184.1 PSI 46 46 A 112 SER C A 113 PRO N A 113 PRO CA A 113 PRO C 1.0 -89.6 -29.6 PHI 47 47 A 113 PRO N A 113 PRO CA A 113 PRO C A 114 GLN N 1.0 -43.8 -3.8 PSI 48 48 A 113 PRO C A 114 GLN N A 114 GLN CA A 114 GLN C 1.0 -116.4 -56.4 PHI 49 49 A 114 GLN N A 114 GLN CA A 114 GLN C A 115 GLY N 1.0 -19.5 20.5 PSI 50 50 A 114 GLN C A 115 GLY N A 115 GLY CA A 115 GLY C 1.0 59.9 119.9 PHI 51 51 A 115 GLY N A 115 GLY CA A 115 GLY C A 116 LEU N 1.0 -17.2 22.8 PSI 52 52 A 115 GLY C A 116 LEU N A 116 LEU CA A 116 LEU C 1.0 -109.0 -49.0 PHI 53 53 A 116 LEU N A 116 LEU CA A 116 LEU C A 117 LYS N 1.0 113.9 153.9 PSI 54 54 A 116 LEU C A 117 LYS N A 117 LYS CA A 117 LYS C 1.0 -132.5 -72.5 PHI 55 55 A 117 LYS N A 117 LYS CA A 117 LYS C A 118 PHE N 1.0 113.0 153.0 PSI 56 56 A 117 LYS C A 118 PHE N A 118 PHE CA A 118 PHE C 1.0 -151.4 -91.4 PHI 57 57 A 118 PHE N A 118 PHE CA A 118 PHE C A 119 ARG N 1.0 120.2 167.0 PSI 58 58 A 119 ARG C A 120 SER N A 120 SER CA A 120 SER C 1.0 -176.8 -116.8 PHI 59 59 A 120 SER N A 120 SER CA A 120 SER C A 121 LYS N 1.0 140.7 180.7 PSI 60 60 A 120 SER C A 121 LYS N A 121 LYS CA A 121 LYS C 1.0 -93.1 -33.1 PHI 61 61 A 121 LYS N A 121 LYS CA A 121 LYS C A 122 SER N 1.0 -57.7 -17.7 PSI 62 62 A 121 LYS C A 122 SER N A 122 SER CA A 122 SER C 1.0 -91.5 -31.5 PHI 63 63 A 122 SER N A 122 SER CA A 122 SER C A 123 SER N 1.0 -59.4 -19.4 PSI 64 64 A 122 SER C A 123 SER N A 123 SER CA A 123 SER C 1.0 -96.5 -36.5 PHI 65 65 A 123 SER N A 123 SER CA A 123 SER C A 124 LEU N 1.0 -56.7 -16.7 PSI 66 66 A 123 SER C A 124 LEU N A 124 LEU CA A 124 LEU C 1.0 -95.8 -35.8 PHI 67 67 A 124 LEU N A 124 LEU CA A 124 LEU C A 125 ALA N 1.0 -63.6 -23.6 PSI 68 68 A 124 LEU C A 125 ALA N A 125 ALA CA A 125 ALA C 1.0 -93.2 -33.2 PHI 69 69 A 125 ALA N A 125 ALA CA A 125 ALA C A 126 ASN N 1.0 -60.5 -20.5 PSI 70 70 A 125 ALA C A 126 ASN N A 126 ASN CA A 126 ASN C 1.0 -95.7 -35.7 PHI 71 71 A 126 ASN N A 126 ASN CA A 126 ASN C A 127 TYR N 1.0 -59.5 -19.5 PSI 72 72 A 126 ASN C A 127 TYR N A 127 TYR CA A 127 TYR C 1.0 -95.8 -35.8 PHI 73 73 A 127 TYR N A 127 TYR CA A 127 TYR C A 128 LEU N 1.0 -63.9 -23.9 PSI 74 74 A 127 TYR C A 128 LEU N A 128 LEU CA A 128 LEU C 1.0 -93.4 -33.4 PHI 75 75 A 128 LEU N A 128 LEU CA A 128 LEU C A 129 HIS N 1.0 -61.1 -21.1 PSI 76 76 A 128 LEU C A 129 HIS N A 129 HIS CA A 129 HIS C 1.0 -95.4 -35.4 PHI 77 77 A 129 HIS N A 129 HIS CA A 129 HIS C A 130 LYS N 1.0 -54.0 -14.0 PSI 78 78 A 129 HIS C A 130 LYS N A 130 LYS CA A 130 LYS C 1.0 -97.7 -37.7 PHI 79 79 A 130 LYS N A 130 LYS CA A 130 LYS C A 131 ASN N 1.0 -45.4 -5.4 PSI 80 80 A 130 LYS C A 131 ASN N A 131 ASN CA A 131 ASN C 1.0 -119.9 -59.9 PHI 81 81 A 131 ASN N A 131 ASN CA A 131 ASN C A 132 GLY N 1.0 -21.1 18.9 PSI 82 82 A 135 SER C A 136 LEU N A 136 LEU CA A 136 LEU C 1.0 -144.4 -57.2 PHI 83 83 A 136 LEU N A 136 LEU CA A 136 LEU C A 137 LYS N 1.0 114.4 154.4 PSI 84 84 A 136 LEU C A 137 LYS N A 137 LYS CA A 137 LYS C 1.0 -138.8 -53.2 PHI 85 85 A 137 LYS N A 137 LYS CA A 137 LYS C A 138 PRO N 1.0 128.7 173.7 PSI 86 86 A 137 LYS C A 138 PRO N A 138 PRO CA A 138 PRO C 1.0 -83.8 -23.8 PHI 87 87 A 138 PRO N A 138 PRO CA A 138 PRO C A 139 GLU N 1.0 -56.0 -16.0 PSI 88 88 A 138 PRO C A 139 GLU N A 139 GLU CA A 139 GLU C 1.0 -100.6 -40.6 PHI 89 89 A 139 GLU N A 139 GLU CA A 139 GLU C A 140 ASP N 1.0 -35.4 4.6 PSI 90 90 A 139 GLU C A 140 ASP N A 140 ASP CA A 140 ASP C 1.0 -113.6 -53.6 PHI 91 91 A 140 ASP N A 140 ASP CA A 140 ASP C A 141 PHE N 1.0 -31.1 8.9 PSI 92 92 A 140 ASP C A 141 PHE N A 141 PHE CA A 141 PHE C 1.0 -115.3 -55.1 PHI 93 93 A 141 PHE N A 141 PHE CA A 141 PHE C A 142 ASP N 1.0 110.9 151.5 PSI 94 94 A 141 PHE C A 142 ASP N A 142 ASP CA A 142 ASP C 1.0 -121.3 -61.3 PHI 95 95 A 142 ASP N A 142 ASP CA A 142 ASP C A 143 PHE N 1.0 91.0 134.4 PSI 96 96 A 86 VAL N A 86 VAL CA A 86 VAL CB A 86 VAL CG1 1.0 160.0 200.0 CHI1 97 97 A 90 TRP N A 90 TRP CA A 90 TRP CB A 90 TRP CG 1.0 -80.0 -40.0 CHI1 98 98 A 93 VAL N A 93 VAL CA A 93 VAL CB A 93 VAL CG1 1.0 160.0 200.0 CHI1 99 99 A 98 LEU N A 98 LEU CA A 98 LEU CB A 98 LEU CG 1.0 -80.0 -40.0 CHI1 100 100 A 99 PHE N A 99 PHE CA A 99 PHE CB A 99 PHE CG 1.0 -80.0 -40.0 CHI1 101 101 A 102 THR N A 102 THR CA A 102 THR CB A 102 THR OG1 1.0 40.0 80.0 CHI1 102 102 A 106 PHE N A 106 PHE CA A 106 PHE CB A 106 PHE CG 1.0 -80.0 -40.0 CHI1 103 103 A 109 TYR N A 109 TYR CA A 109 TYR CB A 109 TYR CG 1.0 40.0 200.0 CHI1 104 104 A 110 PHE N A 110 PHE CA A 110 PHE CB A 110 PHE CG 1.0 -90.0 90.0 CHI1 105 105 A 111 ILE N A 111 ILE CA A 111 ILE CB A 111 ILE CG1 1.0 -80.0 -40.0 CHI1 106 106 A 118 PHE N A 118 PHE CA A 118 PHE CB A 118 PHE CG 1.0 -80.0 -40.0 CHI1 107 107 A 127 TYR N A 127 TYR CA A 127 TYR CB A 127 TYR CG 1.0 160.0 200.0 CHI1 108 108 A 129 HIS N A 129 HIS CA A 129 HIS CB A 129 HIS CG 1.0 160.0 200.0 CHI1 109 109 A 134 THR N A 134 THR CA A 134 THR CB A 134 THR OG1 1.0 40.0 80.0 CHI1 110 110 A 141 PHE N A 141 PHE CA A 141 PHE CB A 141 PHE CG 1.0 40.0 80.0 CHI1 111 111 A 143 PHE N A 143 PHE CA A 143 PHE CB A 143 PHE CG 1.0 -90.0 90.0 CHI1 stop_ save_