data_nef_c15931_2k7v save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 MET start . . 2 A 2 VAL middle . . 3 A 3 LYS middle . . 4 A 4 GLU middle . . 5 A 5 VAL middle . . 6 A 6 ASN middle . . 7 A 7 VAL middle . . 8 A 8 PRO middle . false 9 A 9 ASP middle . . 10 A 10 ILE middle . . 11 A 15 VAL middle . . 12 A 16 GLU middle . . 13 A 17 VAL middle . . 14 A 18 THR middle . . 15 A 19 GLU middle . . 16 A 20 VAL middle . . 17 A 21 MET middle . . 18 A 22 VAL middle . . 19 A 23 LYS middle . . 20 A 24 VAL middle . . 21 A 25 GLY middle . false 22 A 26 ASP middle . . 23 A 27 LYS middle . . 24 A 28 VAL middle . . 25 A 29 ALA middle . . 26 A 30 ALA middle . . 27 A 31 GLU middle . . 28 A 32 GLN middle . . 29 A 33 SER middle . . 30 A 34 LEU middle . . 31 A 35 ILE middle . . 32 A 36 THR middle . . 33 A 37 VAL middle . . 34 A 38 GLU middle . . 35 A 39 GLY middle . false 36 A 40 ASP middle . . 37 A 41 LYS middle . . 38 A 42 ALA middle . . 39 A 43 SER middle . . 40 A 44 MET middle . . 41 A 45 GLU middle . . 42 A 46 VAL middle . . 43 A 47 PRO middle . false 44 A 48 ALA middle . . 45 A 49 PRO middle . false 46 A 50 PHE middle . . 47 A 51 ALA middle . . 48 A 52 GLY middle . false 49 A 53 VAL middle . . 50 A 54 VAL middle . . 51 A 55 LYS middle . . 52 A 56 GLU middle . . 53 A 57 LEU middle . . 54 A 58 LYS middle . . 55 A 59 VAL middle . . 56 A 60 ASN middle . . 57 A 61 VAL middle . . 58 A 62 GLY middle . false 59 A 63 ASP middle . . 60 A 64 LYS middle . . 61 A 65 VAL middle . . 62 A 66 LYS middle . . 63 A 67 THR middle . . 64 A 68 GLY middle . false 65 A 69 SER middle . . 66 A 70 LEU middle . . 67 A 71 ILE middle . . 68 A 72 MET middle . . 69 A 73 ILE middle . . 70 A 74 PHE middle . . 71 A 75 GLU middle . . 72 A 76 VAL middle . . 73 A 77 GLU middle . . 74 A 78 GLY middle . false 75 A 79 ALA middle . . 76 A 80 ALA middle . . 77 A 81 PRO middle . false 78 A 82 ALA middle . . 79 A 83 ALA middle . . 80 A 84 ALA middle . . 81 A 85 PRO middle . false 82 A 86 ALA middle . . 83 A 87 LYS middle . . 84 A 88 GLN middle . . 85 A 89 GLU end . . 86 B 1 MET start . . 87 B 2 VAL middle . . 88 B 3 LYS middle . . 89 B 4 GLU middle . . 90 B 5 VAL middle . . 91 B 6 ASN middle . . 92 B 7 VAL middle . . 93 B 8 PRO middle . false 94 B 9 ASP middle . . 95 B 10 ILE middle . . 96 B 15 VAL middle . . 97 B 16 GLU middle . . 98 B 17 VAL middle . . 99 B 18 THR middle . . 100 B 19 GLU middle . . 101 B 20 VAL middle . . 102 B 21 MET middle . . 103 B 22 VAL middle . . 104 B 23 LYS middle . . 105 B 24 VAL middle . . 106 B 25 GLY middle . false 107 B 26 ASP middle . . 108 B 27 LYS middle . . 109 B 28 VAL middle . . 110 B 29 ALA middle . . 111 B 30 ALA middle . . 112 B 31 GLU middle . . 113 B 32 GLN middle . . 114 B 33 SER middle . . 115 B 34 LEU middle . . 116 B 35 ILE middle . . 117 B 36 THR middle . . 118 B 37 VAL middle . . 119 B 38 GLU middle . . 120 B 39 GLY middle . false 121 B 40 ASP middle . . 122 B 41 LYS middle . . 123 B 42 ALA middle . . 124 B 43 SER middle . . 125 B 44 MET middle . . 126 B 45 GLU middle . . 127 B 46 VAL middle . . 128 B 47 PRO middle . false 129 B 48 ALA middle . . 130 B 49 PRO middle . false 131 B 50 PHE middle . . 132 B 51 ALA middle . . 133 B 52 GLY middle . false 134 B 53 VAL middle . . 135 B 54 VAL middle . . 136 B 55 LYS middle . . 137 B 56 GLU middle . . 138 B 57 LEU middle . . 139 B 58 LYS middle . . 140 B 59 VAL middle . . 141 B 60 ASN middle . . 142 B 61 VAL middle . . 143 B 62 GLY middle . false 144 B 63 ASP middle . . 145 B 64 LYS middle . . 146 B 65 VAL middle . . 147 B 66 LYS middle . . 148 B 67 THR middle . . 149 B 68 GLY middle . false 150 B 69 SER middle . . 151 B 70 LEU middle . . 152 B 71 ILE middle . . 153 B 72 MET middle . . 154 B 73 ILE middle . . 155 B 74 PHE middle . . 156 B 75 GLU middle . . 157 B 76 VAL middle . . 158 B 77 GLU middle . . 159 B 78 GLY middle . false 160 B 79 ALA middle . . 161 B 80 ALA middle . . 162 B 81 PRO middle . false 163 B 82 ALA middle . . 164 B 83 ALA middle . . 165 B 84 ALA middle . . 166 B 85 PRO middle . false 167 B 86 ALA middle . . 168 B 87 LYS middle . . 169 B 88 GLN middle . . 170 B 89 GLU end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 4 GLU H H 1 8.653 0.004 A 4 GLU HA H 1 4.327 0.007 A 4 GLU HB2 H 1 1.968 0.002 A 4 GLU HB3 H 1 1.968 0.002 A 4 GLU HG2 H 1 2.289 0.002 A 4 GLU HG3 H 1 2.289 0.002 A 4 GLU N N 15 123.651 0.011 A 5 VAL H H 1 8.248 0.003 A 5 VAL HA H 1 4.140 0.002 A 5 VAL HB H 1 2.078 0.007 A 5 VAL HG1% H 1 0.942 0.003 A 5 VAL HG2% H 1 0.942 0.003 A 5 VAL N N 15 120.477 0.054 A 6 ASN H H 1 8.569 0.003 A 6 ASN HA H 1 4.757 0.017 A 6 ASN HBx H 1 2.743 0.005 A 6 ASN HBy H 1 2.812 0.002 A 6 ASN N N 15 121.940 0.014 A 7 VAL H H 1 8.105 0.005 A 7 VAL HA H 1 4.449 0.002 A 7 VAL HB H 1 2.107 0.002 A 7 VAL HG1% H 1 0.940 0.002 A 7 VAL HG2% H 1 0.968 0.026 A 7 VAL N N 15 121.599 0.025 A 8 PRO HD2 H 1 3.847 0.002 A 9 ASP H H 1 8.358 0.003 A 9 ASP HA H 1 4.568 0.002 A 9 ASP HBx H 1 2.598 0.002 A 9 ASP HBy H 1 2.671 0.005 A 9 ASP N N 15 120.191 0.025 A 10 ILE H H 1 8.069 0.005 A 10 ILE HA H 1 4.197 0.002 A 10 ILE HB H 1 1.866 0.002 A 10 ILE HD1% H 1 0.892 0.001 A 10 ILE HG12 H 1 1.477 0.002 A 10 ILE HG13 H 1 1.477 0.002 A 10 ILE HG2% H 1 1.186 0.002 A 10 ILE N N 15 120.596 0.016 A 15 VAL HA H 1 4.122 0.002 A 15 VAL HB H 1 2.051 0.002 A 15 VAL HG1% H 1 0.931 0.006 A 15 VAL HG2% H 1 0.931 0.006 A 15 VAL N N 15 124.719 0.042 A 16 GLU H H 1 8.488 0.004 A 16 GLU HA H 1 4.343 0.004 A 16 GLU HB2 H 1 1.965 0.002 A 16 GLU HB3 H 1 1.965 0.002 A 16 GLU HG2 H 1 2.239 0.002 A 16 GLU HG3 H 1 2.239 0.002 A 16 GLU N N 15 125.293 0.051 A 17 VAL H H 1 8.341 0.005 A 17 VAL HA H 1 4.198 0.003 A 17 VAL HB H 1 2.098 0.014 A 17 VAL HG1% H 1 0.961 0.006 A 17 VAL HG2% H 1 0.961 0.006 A 17 VAL N N 15 122.136 0.049 A 18 THR H H 1 8.253 0.004 A 18 THR HA H 1 4.370 0.001 A 18 THR HB H 1 4.205 0.005 A 18 THR HG2% H 1 1.214 0.007 A 18 THR N N 15 118.197 0.053 A 19 GLU H H 1 8.418 0.004 A 19 GLU HA H 1 4.336 0.002 A 19 GLU HB2 H 1 1.988 0.002 A 19 GLU HB3 H 1 1.988 0.002 A 19 GLU HG2 H 1 2.255 0.002 A 19 GLU HG3 H 1 2.255 0.002 A 19 GLU N N 15 123.422 0.016 A 20 VAL H H 1 8.199 0.005 A 20 VAL HA H 1 4.079 0.004 A 20 VAL HB H 1 2.071 0.002 A 20 VAL HG1% H 1 0.952 0.007 A 20 VAL HG2% H 1 0.952 0.007 A 20 VAL N N 15 121.212 0.046 A 21 MET H H 1 8.406 0.004 A 21 MET HA H 1 4.519 0.003 A 21 MET HB2 H 1 2.047 0.002 A 21 MET HB3 H 1 2.047 0.002 A 21 MET HG2 H 1 2.575 0.002 A 21 MET HG3 H 1 2.575 0.002 A 21 MET N N 15 124.123 0.050 A 22 VAL H H 1 8.172 0.004 A 22 VAL HA H 1 4.091 0.001 A 22 VAL HB H 1 2.050 0.002 A 22 VAL HG1% H 1 0.937 0.004 A 22 VAL HG2% H 1 0.937 0.004 A 22 VAL N N 15 122.154 0.052 A 23 LYS H H 1 8.454 0.004 A 23 LYS HA H 1 4.412 0.001 A 23 LYS HB2 H 1 1.781 0.002 A 23 LYS HB3 H 1 1.781 0.002 A 23 LYS HG2 H 1 1.425 0.002 A 23 LYS HG3 H 1 1.425 0.002 A 23 LYS N N 15 125.694 0.016 A 24 VAL H H 1 8.293 0.005 A 24 VAL HA H 1 4.105 0.006 A 24 VAL HB H 1 2.084 0.008 A 24 VAL HG1% H 1 0.977 0.005 A 24 VAL HG2% H 1 0.977 0.005 A 24 VAL N N 15 122.063 0.038 A 25 GLY H H 1 8.519 0.003 A 25 GLY HA2 H 1 4.019 0.052 A 25 GLY HA3 H 1 4.019 0.052 A 25 GLY N N 15 112.272 0.011 A 26 ASP H H 1 8.319 0.003 A 26 ASP HA H 1 4.627 0.003 A 26 ASP HB2 H 1 2.674 0.002 A 26 ASP HB3 H 1 2.674 0.002 A 26 ASP N N 15 120.284 0.005 A 28 VAL H H 1 8.141 0.004 A 28 VAL HA H 1 4.077 0.002 A 28 VAL HB H 1 2.082 0.002 A 28 VAL HG1% H 1 0.952 0.003 A 28 VAL HG2% H 1 0.952 0.003 A 28 VAL N N 15 121.156 0.028 A 29 ALA H H 1 8.376 0.004 A 29 ALA HA H 1 4.314 0.017 A 29 ALA HB% H 1 1.413 0.004 A 29 ALA N N 15 127.378 0.017 A 30 ALA H H 1 8.260 0.001 A 30 ALA HA H 1 4.302 0.002 A 30 ALA HB% H 1 1.391 0.002 A 30 ALA N N 15 123.214 0.066 A 31 GLU H H 1 8.387 0.003 A 31 GLU HA H 1 4.253 0.002 A 31 GLU HB2 H 1 2.018 0.002 A 31 GLU HB3 H 1 2.018 0.002 A 31 GLU HG2 H 1 2.300 0.002 A 31 GLU HG3 H 1 2.300 0.002 A 31 GLU N N 15 119.491 0.026 A 32 GLN H H 1 8.359 0.003 A 32 GLN HA H 1 4.343 0.002 A 32 GLN HBx H 1 2.040 0.002 A 32 GLN HBy H 1 2.135 0.002 A 32 GLN HG2 H 1 2.398 0.002 A 32 GLN HG3 H 1 2.398 0.002 A 32 GLN N N 15 120.668 0.039 A 33 SER H H 1 8.338 0.004 A 33 SER HA H 1 4.444 0.002 A 33 SER HB2 H 1 3.880 0.003 A 33 SER HB3 H 1 3.880 0.003 A 33 SER N N 15 116.599 0.021 A 34 LEU H H 1 8.242 0.005 A 34 LEU HA H 1 4.407 0.001 A 34 LEU HB2 H 1 1.634 0.006 A 34 LEU HB3 H 1 1.634 0.006 A 34 LEU HD1% H 1 0.884 0.014 A 34 LEU HD2% H 1 0.924 0.015 A 34 LEU N N 15 123.757 0.019 A 35 ILE H H 1 8.099 0.003 A 35 ILE HA H 1 4.264 0.001 A 35 ILE HB H 1 1.880 0.002 A 35 ILE HD1% H 1 0.900 0.005 A 35 ILE HG12 H 1 1.492 0.002 A 35 ILE HG13 H 1 1.492 0.002 A 35 ILE HG2% H 1 1.193 0.002 A 35 ILE N N 15 121.487 0.012 A 36 THR H H 1 8.295 0.004 A 36 THR HA H 1 4.420 0.001 A 36 THR HB H 1 4.184 0.004 A 36 THR HG2% H 1 1.193 0.004 A 36 THR N N 15 119.296 0.042 A 37 VAL H H 1 8.291 0.004 A 37 VAL HA H 1 4.188 0.001 A 37 VAL HB H 1 2.095 0.002 A 37 VAL HG1% H 1 0.937 0.004 A 37 VAL HG2% H 1 0.937 0.004 A 37 VAL N N 15 122.829 0.002 A 38 GLU H H 1 8.548 0.004 A 38 GLU HA H 1 4.316 0.003 A 38 GLU HB2 H 1 1.979 0.002 A 38 GLU HB3 H 1 1.979 0.002 A 38 GLU HG2 H 1 2.276 0.002 A 38 GLU HG3 H 1 2.276 0.002 A 38 GLU N N 15 124.786 0.033 A 39 GLY H H 1 8.460 0.003 A 39 GLY HA2 H 1 3.978 0.005 A 39 GLY HA3 H 1 3.978 0.005 A 39 GLY N N 15 110.109 0.021 A 40 ASP H H 1 8.210 0.004 A 40 ASP HA H 1 4.603 0.002 A 40 ASP HB2 H 1 2.672 0.007 A 40 ASP HB3 H 1 2.672 0.007 A 40 ASP N N 15 120.341 0.020 A 41 LYS H H 1 8.282 0.003 A 41 LYS HA H 1 4.347 0.012 A 41 LYS HB2 H 1 1.812 0.007 A 41 LYS HB3 H 1 1.812 0.007 A 41 LYS HG2 H 1 1.443 0.008 A 41 LYS HG3 H 1 1.443 0.008 A 41 LYS N N 15 121.069 0.017 A 42 ALA H H 1 8.506 0.004 A 42 ALA HA H 1 4.556 0.019 A 42 ALA HB% H 1 1.359 0.002 A 42 ALA N N 15 124.365 0.030 A 43 SER H H 1 8.313 0.005 A 43 SER HA H 1 5.286 0.007 A 43 SER HB2 H 1 3.755 0.008 A 43 SER HB3 H 1 3.755 0.008 A 43 SER N N 15 114.897 0.021 A 44 MET H H 1 9.298 0.005 A 44 MET HA H 1 4.811 0.028 A 44 MET HB2 H 1 1.733 0.004 A 44 MET HB3 H 1 1.733 0.004 A 44 MET HE% H 1 1.942 0.016 A 44 MET HG2 H 1 2.324 0.008 A 44 MET HG3 H 1 2.324 0.008 A 44 MET N N 15 121.658 0.044 A 45 GLU H H 1 8.724 0.007 A 45 GLU HA H 1 4.150 0.006 A 45 GLU HBx H 1 1.922 0.008 A 45 GLU HBy H 1 2.102 0.002 A 45 GLU HG2 H 1 2.456 0.009 A 45 GLU HG3 H 1 2.456 0.009 A 45 GLU N N 15 123.119 0.028 A 46 VAL H H 1 8.274 0.006 A 46 VAL HA H 1 4.350 0.003 A 46 VAL HB H 1 1.635 0.003 A 46 VAL HGx% H 1 -0.261 0.003 A 46 VAL HGy% H 1 0.347 0.004 A 46 VAL N N 15 121.303 0.029 A 47 PRO HA H 1 5.103 0.007 A 47 PRO HBx H 1 1.901 0.002 A 47 PRO HBy H 1 2.049 0.019 A 47 PRO HD2 H 1 3.905 0.002 A 47 PRO HD3 H 1 3.905 0.002 A 48 ALA H H 1 9.279 0.005 A 48 ALA HA H 1 4.286 0.014 A 48 ALA HB% H 1 1.598 0.004 A 48 ALA N N 15 122.132 0.042 A 49 PRO HA H 1 4.429 0.006 A 49 PRO HBx H 1 1.873 0.002 A 49 PRO HBy H 1 2.068 0.002 A 49 PRO HDx H 1 3.043 0.009 A 49 PRO HDy H 1 3.603 0.006 A 49 PRO HGx H 1 0.631 0.006 A 49 PRO HGy H 1 1.788 0.005 A 50 PHE H H 1 7.058 0.005 A 50 PHE HA H 1 4.931 0.007 A 50 PHE HBx H 1 3.331 0.018 A 50 PHE HBy H 1 3.458 0.005 A 50 PHE HDx H 1 7.053 0.008 A 50 PHE HDy H 1 7.053 0.008 A 50 PHE HEx H 1 7.119 0.005 A 50 PHE HEy H 1 7.119 0.005 A 50 PHE HZ H 1 6.952 0.002 A 50 PHE N N 15 113.563 0.033 A 51 ALA H H 1 8.068 0.006 A 51 ALA HA H 1 4.545 0.012 A 51 ALA HB% H 1 1.625 0.011 A 51 ALA N N 15 118.533 0.018 A 52 GLY H H 1 7.946 0.005 A 52 GLY HAx H 1 4.008 0.014 A 52 GLY HAy H 1 4.158 0.006 A 52 GLY N N 15 104.283 0.024 A 53 VAL H H 1 8.524 0.007 A 53 VAL HA H 1 4.758 0.004 A 53 VAL HB H 1 1.841 0.006 A 53 VAL HGx% H 1 0.732 0.002 A 53 VAL HGy% H 1 0.918 0.017 A 53 VAL N N 15 119.387 0.020 A 54 VAL H H 1 8.812 0.005 A 54 VAL HA H 1 3.672 0.005 A 54 VAL HB H 1 2.400 0.019 A 54 VAL HGx% H 1 0.865 0.017 A 54 VAL HGy% H 1 0.916 0.030 A 54 VAL N N 15 126.035 0.033 A 55 LYS H H 1 9.404 0.010 A 55 LYS HA H 1 4.617 0.013 A 55 LYS HB2 H 1 1.750 0.011 A 55 LYS HB3 H 1 1.750 0.011 A 55 LYS N N 15 132.567 0.030 A 56 GLU H H 1 7.835 0.006 A 56 GLU HA H 1 4.548 0.014 A 56 GLU HB2 H 1 1.831 0.034 A 56 GLU HB3 H 1 1.831 0.034 A 56 GLU HG2 H 1 2.192 0.013 A 56 GLU HG3 H 1 2.192 0.013 A 56 GLU N N 15 114.290 0.017 A 57 LEU H H 1 9.245 0.004 A 57 LEU HA H 1 4.671 0.010 A 57 LEU HB2 H 1 1.934 0.018 A 57 LEU HB3 H 1 1.944 0.016 A 57 LEU HDx% H 1 1.017 0.010 A 57 LEU HDy% H 1 1.139 0.015 A 57 LEU HG H 1 1.751 0.024 A 57 LEU N N 15 126.224 0.047 A 58 LYS H H 1 7.816 0.005 A 58 LYS HA H 1 4.632 0.029 A 58 LYS HBx H 1 1.153 0.002 A 58 LYS HBy H 1 1.948 0.002 A 58 LYS HDx H 1 1.615 0.003 A 58 LYS HDy H 1 1.746 0.002 A 58 LYS HGx H 1 0.915 0.002 A 58 LYS HGy H 1 1.153 0.002 A 58 LYS N N 15 118.189 0.030 A 59 VAL H H 1 7.145 0.004 A 59 VAL HA H 1 4.740 0.018 A 59 VAL HB H 1 2.331 0.016 A 59 VAL HGx% H 1 0.909 0.012 A 59 VAL HGy% H 1 1.045 0.012 A 59 VAL N N 15 108.573 0.015 A 60 ASN H H 1 8.970 0.006 A 60 ASN HA H 1 5.003 0.006 A 60 ASN HBx H 1 2.580 0.007 A 60 ASN HBy H 1 2.783 0.006 A 60 ASN HD21 H 1 6.973 0.004 A 60 ASN HD22 H 1 7.978 0.006 A 60 ASN N N 15 118.276 0.013 A 60 ASN ND2 N 15 114.588 0.038 A 61 VAL H H 1 8.721 0.011 A 61 VAL HA H 1 3.277 0.006 A 61 VAL HB H 1 1.917 0.007 A 61 VAL HGx% H 1 0.979 0.014 A 61 VAL HGy% H 1 1.019 0.011 A 61 VAL N N 15 119.437 0.018 A 62 GLY H H 1 9.282 0.006 A 62 GLY HAx H 1 3.491 0.004 A 62 GLY HAy H 1 4.485 0.007 A 62 GLY N N 15 116.296 0.011 A 63 ASP H H 1 8.035 0.008 A 63 ASP HA H 1 4.600 0.004 A 63 ASP HBx H 1 2.537 0.011 A 63 ASP HBy H 1 2.849 0.009 A 63 ASP N N 15 121.238 0.022 A 64 LYS H H 1 8.577 0.007 A 64 LYS HA H 1 4.648 0.010 A 64 LYS HB2 H 1 1.760 0.023 A 64 LYS HB3 H 1 1.760 0.023 A 64 LYS HD2 H 1 1.679 0.002 A 64 LYS HD3 H 1 1.679 0.002 A 64 LYS HE2 H 1 2.949 0.002 A 64 LYS HE3 H 1 2.949 0.002 A 64 LYS HG2 H 1 1.409 0.009 A 64 LYS HG3 H 1 1.409 0.009 A 64 LYS N N 15 121.491 0.035 A 65 VAL H H 1 8.939 0.007 A 65 VAL HA H 1 4.461 0.003 A 65 VAL HB H 1 1.866 0.011 A 65 VAL HGx% H 1 0.531 0.005 A 65 VAL HGy% H 1 0.778 0.006 A 65 VAL N N 15 121.545 0.041 A 66 LYS H H 1 8.182 0.008 A 66 LYS HA H 1 4.569 0.006 A 66 LYS HB2 H 1 1.882 0.007 A 66 LYS HB3 H 1 1.880 0.007 A 66 LYS HD2 H 1 1.656 0.002 A 66 LYS HD3 H 1 1.656 0.002 A 66 LYS HG2 H 1 1.451 0.004 A 66 LYS HG3 H 1 1.451 0.004 A 66 LYS N N 15 122.901 0.026 A 67 THR H H 1 8.399 0.004 A 67 THR HA H 1 3.932 0.008 A 67 THR HB H 1 3.288 0.003 A 67 THR HG2% H 1 1.139 0.007 A 67 THR N N 15 118.278 0.015 A 68 GLY H H 1 9.075 0.005 A 68 GLY HAx H 1 3.289 0.005 A 68 GLY HAy H 1 3.618 0.002 A 68 GLY N N 15 115.336 0.021 A 69 SER H H 1 8.207 0.005 A 69 SER HA H 1 4.339 0.006 A 69 SER HB2 H 1 3.907 0.012 A 69 SER HB3 H 1 3.906 0.011 A 69 SER N N 15 117.597 0.052 A 70 LEU H H 1 8.666 0.005 A 70 LEU HA H 1 4.213 0.009 A 70 LEU HB2 H 1 1.590 0.004 A 70 LEU HB3 H 1 1.590 0.004 A 70 LEU HD1% H 1 0.848 0.002 A 70 LEU HD2% H 1 0.848 0.002 A 70 LEU HG H 1 1.588 0.003 A 70 LEU N N 15 124.519 0.014 A 71 ILE H H 1 8.663 0.008 A 71 ILE HA H 1 4.853 0.007 A 71 ILE HB H 1 1.938 0.010 A 71 ILE HD1% H 1 0.766 0.006 A 71 ILE HG1x H 1 1.194 0.006 A 71 ILE HG1y H 1 1.598 0.004 A 71 ILE HG2% H 1 0.906 0.005 A 71 ILE N N 15 115.104 0.021 A 72 MET H H 1 7.736 0.004 A 72 MET HA H 1 4.877 0.015 A 72 MET HB2 H 1 1.939 0.013 A 72 MET HB3 H 1 1.942 0.014 A 72 MET HG2 H 1 2.392 0.021 A 72 MET HG3 H 1 2.392 0.021 A 72 MET N N 15 118.031 0.028 A 73 ILE H H 1 8.735 0.007 A 73 ILE HA H 1 4.853 0.010 A 73 ILE HB H 1 1.791 0.011 A 73 ILE HD1% H 1 1.016 0.011 A 73 ILE HG12 H 1 1.152 0.008 A 73 ILE HG13 H 1 1.152 0.008 A 73 ILE HG2% H 1 0.921 0.045 A 73 ILE N N 15 118.189 0.012 A 74 PHE H H 1 9.447 0.009 A 74 PHE HA H 1 5.895 0.006 A 74 PHE HB2 H 1 3.144 0.009 A 74 PHE HB3 H 1 3.144 0.009 A 74 PHE HDx H 1 6.954 0.004 A 74 PHE HDy H 1 6.954 0.004 A 74 PHE HEx H 1 7.393 0.004 A 74 PHE HEy H 1 7.393 0.004 A 74 PHE HZ H 1 6.899 0.003 A 74 PHE N N 15 127.483 0.015 A 75 GLU H H 1 9.633 0.008 A 75 GLU HA H 1 5.109 0.008 A 75 GLU HBx H 1 1.750 0.006 A 75 GLU HBy H 1 1.942 0.017 A 75 GLU HGx H 1 1.949 0.014 A 75 GLU HGy H 1 2.196 0.004 A 75 GLU N N 15 121.073 0.031 A 76 VAL H H 1 8.756 0.005 A 76 VAL HA H 1 4.669 0.006 A 76 VAL HB H 1 2.209 0.009 A 76 VAL HGx% H 1 0.839 0.005 A 76 VAL HGy% H 1 1.053 0.008 A 76 VAL N N 15 121.923 0.028 A 77 GLU H H 1 8.495 0.004 A 77 GLU HA H 1 4.374 0.004 A 77 GLU HBx H 1 1.940 0.005 A 77 GLU HBy H 1 2.039 0.002 A 77 GLU HG2 H 1 2.256 0.022 A 77 GLU HG3 H 1 2.256 0.022 A 77 GLU N N 15 122.566 0.018 A 78 GLY H H 1 8.462 0.003 A 78 GLY HA2 H 1 3.929 0.016 A 78 GLY HA3 H 1 3.929 0.016 A 78 GLY N N 15 110.596 0.033 A 79 ALA H H 1 8.168 0.006 A 79 ALA HA H 1 4.320 0.001 A 79 ALA HB% H 1 1.350 0.002 A 79 ALA N N 15 123.148 0.008 A 87 LYS H H 1 8.334 0.004 A 87 LYS HA H 1 4.318 0.002 A 87 LYS HB2 H 1 1.796 0.002 A 87 LYS HB3 H 1 1.796 0.002 A 87 LYS HG2 H 1 1.432 0.002 A 87 LYS HG3 H 1 1.432 0.002 A 87 LYS N N 15 120.883 0.022 A 88 GLN H H 1 8.533 0.004 A 88 GLN HA H 1 4.381 0.004 A 88 GLN HBx H 1 1.996 0.002 A 88 GLN HBy H 1 2.125 0.002 A 88 GLN HG2 H 1 2.382 0.002 A 88 GLN HG3 H 1 2.382 0.002 A 88 GLN N N 15 123.135 0.007 A 89 GLU H H 1 8.110 0.003 A 89 GLU HA H 1 4.161 0.002 A 89 GLU HBx H 1 1.899 0.002 A 89 GLU HBy H 1 2.071 0.002 A 89 GLU HG2 H 1 2.203 0.002 A 89 GLU HG3 H 1 2.203 0.002 A 89 GLU N N 15 127.797 0.025 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 45 GLU H B 73 ILE HG21 1.0 1.7 3.1 2 2 A 63 ASP H B 54 VAL H 1.0 2.0 6.0 3 3 A 65 VAL H B 52 GLY H 1.0 1.9 4.3 4 4 A 52 GLY H B 65 VAL H 1.0 1.8 3.8 5 5 A 76 VAL H B 44 MET H 1.0 2.0 5.8 6 6 A 72 MET H B 46 VAL HG11 1.0 2.0 5.0 7 7 A 72 MET H B 46 VAL H 1.0 1.9 4.1 8 8 A 69 SER H B 48 ALA H 1.0 1.9 4.5 9 9 A 48 ALA H B 69 SER H 1.0 1.9 4.1 10 10 A 42 ALA H B 76 VAL H 1.0 2.0 6.0 11 11 A 46 VAL H B 72 MET H 1.0 1.9 5.1 12 12 A 44 MET H B 74 PHE H 1.0 1.7 3.1 13 13 B 73 ILE HG21 A 46 VAL H 1.0 1.9 4.7 14 14 B 42 ALA H B 41 LYS H 1.0 1.7 3.3 15 15 A 51 ALA H B 67 THR HG21 1.0 1.9 4.1 16 16 A 51 ALA H B 67 THR HA 1.0 2.0 5.0 17 17 B 44 MET H A 74 PHE H 1.0 1.8 4.2 18 18 A 76 VAL H B 43 SER HA 1.0 1.7 3.1 19 19 A 42 ALA H B 76 VAL HG11 1.0 2.0 6.0 20 20 A 42 ALA H B 76 VAL HG21 1.0 1.9 6.0 21 21 A 42 ALA H B 75 GLU HGx 1.0 1.9 6.0 22 22 A 42 ALA H B 75 GLU HA 1.0 1.9 6.0 23 23 B 76 VAL HG21 A 43 SER H 1.0 0.0 6.0 24 24 B 76 VAL HG11 A 43 SER H 1.0 1.9 4.7 25 25 A 43 SER H B 77 GLU HA 1.0 0.0 6.0 26 26 B 75 GLU HA A 43 SER H 1.0 2.0 4.6 27 27 A 44 MET H B 74 PHE HBy 1.0 1.9 3.9 28 27 A 44 MET H B 74 PHE HBx 1.0 1.9 3.9 29 28 B 44 MET H A 50 PHE HD% 1.0 2.0 6.0 30 29 A 78 GLY H B 42 ALA HA 1.0 2.0 5.2 31 30 A 77 GLU H B 42 ALA HB1 1.0 2.0 5.4 32 31 A 76 VAL H B 42 ALA HB1 1.0 1.8 3.8 33 32 A 72 MET H B 46 VAL HG21 1.0 1.8 3.8 34 33 A 72 MET H A 71 ILE HG1x 1.0 1.4 2.4 35 34 A 71 ILE HG1x A 71 ILE H 1.0 1.9 4.1 36 35 A 69 SER H B 48 ALA HB1 1.0 1.8 3.6 37 36 A 69 SER H A 67 THR HG2% 1.0 2.0 5.2 38 37 A 68 GLY H B 49 PRO HA 1.0 0.0 6.0 39 38 B 48 ALA HB1 A 68 GLY H 1.0 1.8 4.2 40 39 A 67 THR H B 51 ALA HB1 1.0 1.7 3.1 41 40 A 68 GLY H B 47 PRO HBy 1.0 2.0 6.0 42 41 A 65 VAL H A 65 VAL HB 1.0 1.7 3.3 43 42 A 64 LYS H B 53 VAL HG21 1.0 1.9 5.3 44 43 A 64 LYS H B 54 VAL HB 1.0 2.0 4.8 45 44 A 63 ASP H B 54 VAL HB 1.0 1.7 3.3 46 45 A 63 ASP H B 54 VAL HG21 1.0 1.9 3.9 47 45 A 63 ASP H B 54 VAL HG11 1.0 1.9 3.9 48 46 B 54 VAL HB A 62 GLY H 1.0 1.7 3.1 49 47 A 52 GLY H B 66 LYS HGy 1.0 1.9 4.1 50 47 A 52 GLY H B 66 LYS HGx 1.0 1.9 4.1 51 48 A 52 GLY H B 65 VAL HG21 1.0 2.0 5.4 52 49 B 46 VAL HG11 A 50 PHE H 1.0 2.0 6.0 53 50 B 50 PHE H B 48 ALA HA 1.0 2.0 5.6 54 51 B 50 PHE H B 49 PRO HDx 1.0 1.8 3.6 55 52 A 50 PHE H A 50 PHE HBx 1.0 1.7 3.5 56 53 B 50 PHE H B 74 PHE HZ 1.0 0.0 6.0 57 54 B 76 VAL H A 43 SER H 1.0 2.0 5.2 58 55 A 73 ILE H A 72 MET HG2 1.0 1.9 4.9 59 55 A 73 ILE H A 72 MET HG3 1.0 1.9 4.9 60 56 A 48 ALA H B 71 ILE HG21 1.0 1.8 3.6 61 57 B 46 VAL HG11 A 74 PHE H 1.0 1.9 4.9 62 58 B 46 VAL HG11 A 74 PHE HE% 1.0 1.8 3.6 63 59 A 74 PHE HE% A 50 PHE HE% 1.0 0.0 6.0 64 60 A 74 PHE HE% A 54 VAL HB 1.0 2.0 5.4 65 61 A 74 PHE HE% B 59 VAL HG11 1.0 0.0 6.0 66 62 A 74 PHE HZ B 71 ILE HG21 1.0 1.8 3.6 67 63 B 65 VAL HG21 A 74 PHE HE% 1.0 1.8 3.6 68 64 B 65 VAL HG21 A 74 PHE HZ 1.0 1.6 3.0 69 65 B 74 PHE HE% A 65 VAL HGx% 1.0 1.7 3.1 70 66 A 74 PHE HZ B 65 VAL HG11 1.0 1.7 3.3 71 67 B 46 VAL HG21 A 74 PHE HZ 1.0 1.9 4.3 72 68 B 50 PHE HE% B 51 ALA H 1.0 0.0 6.0 73 69 A 74 PHE H A 74 PHE HE% 1.0 1.9 4.7 74 70 A 52 GLY H A 74 PHE HE% 1.0 2.0 5.6 75 71 A 74 PHE HE% A 51 ALA HA 1.0 0.0 6.0 76 72 A 74 PHE HE% A 52 GLY HAy 1.0 2.0 5.8 77 73 A 74 PHE HE% A 52 GLY HAx 1.0 2.0 5.4 78 74 B 46 VAL HG21 A 74 PHE HE% 1.0 1.9 4.1 79 75 A 54 VAL H B 63 ASP H 1.0 1.9 5.7 80 76 B 65 VAL HG11 A 74 PHE HD% 1.0 1.8 3.8 81 77 B 74 PHE H A 46 VAL HGx% 1.0 1.9 4.3 82 78 B 72 MET H A 46 VAL HGx% 1.0 2.0 5.6 83 79 B 74 PHE HE% A 46 VAL HGx% 1.0 1.8 3.6 84 80 B 50 PHE H A 46 VAL HGx% 1.0 1.8 4.2 85 80 A 46 VAL HGx% B 50 PHE HD% 1.0 1.8 4.2 86 81 B 74 PHE HZ A 46 VAL HGx% 1.0 2.0 5.6 87 82 B 74 PHE HBy A 46 VAL HGx% 1.0 2.0 6.0 88 82 B 74 PHE HBx A 46 VAL HGx% 1.0 2.0 6.0 89 83 B 49 PRO HDx A 46 VAL HGy% 1.0 1.9 4.1 90 84 A 46 VAL HGy% B 49 PRO HDy 1.0 1.9 4.3 91 85 B 72 MET H A 46 VAL HGy% 1.0 1.9 4.1 92 86 B 74 PHE HE% A 46 VAL HGy% 1.0 1.9 3.9 93 87 B 50 PHE H A 46 VAL HGy% 1.0 2.0 5.6 94 87 B 50 PHE HD% A 46 VAL HGy% 1.0 2.0 5.6 95 88 B 74 PHE HZ A 46 VAL HGy% 1.0 1.9 4.3 96 89 A 74 PHE HE% A 53 VAL H 1.0 2.0 5.8 97 90 A 46 VAL HGx% B 49 PRO HGy 1.0 1.8 3.6 98 91 A 46 VAL HGy% B 73 ILE HA 1.0 1.9 4.5 99 92 A 46 VAL HGx% B 73 ILE HA 1.0 1.9 4.3 100 93 A 46 VAL HGx% B 71 ILE H 1.0 2.0 6.0 101 94 A 46 VAL HGy% B 71 ILE H 1.0 2.0 5.6 102 95 B 46 VAL HG11 A 50 PHE H 1.0 1.8 3.8 103 95 B 46 VAL HG11 A 50 PHE HD% 1.0 1.8 3.8 104 96 B 46 VAL HG11 A 74 PHE HZ 1.0 2.0 5.2 105 97 B 49 PRO HDx A 46 VAL HGx% 1.0 2.0 5.6 106 98 A 46 VAL HGx% B 49 PRO HDy 1.0 2.0 6.0 107 99 B 50 PHE HE% A 46 VAL HGx% 1.0 1.7 2.9 108 100 B 50 PHE HE% A 46 VAL HGy% 1.0 2.0 5.4 109 101 A 57 LEU H A 58 LYS H 1.0 2.0 5.4 110 101 B 57 LEU H B 56 GLU H 1.0 2.0 5.4 111 101 A 57 LEU H A 56 GLU H 1.0 2.0 5.4 112 102 A 56 GLU H A 55 LYS H 1.0 1.7 3.1 113 102 B 56 GLU H B 55 LYS H 1.0 1.7 3.1 114 103 B 55 LYS H B 74 PHE HA 1.0 1.8 3.4 115 103 A 55 LYS H A 74 PHE HA 1.0 1.8 3.4 116 104 A 55 LYS H A 75 GLU H 1.0 2.0 5.6 117 104 A 74 PHE H A 75 GLU H 1.0 2.0 5.6 118 104 B 74 PHE H B 75 GLU H 1.0 2.0 5.6 119 105 B 55 LYS H B 75 GLU H 1.0 1.9 4.3 120 105 A 55 LYS H A 75 GLU H 1.0 1.9 4.3 121 106 B 60 ASN H B 60 ASN HD2x 1.0 1.8 3.6 122 106 A 60 ASN H A 60 ASN HD21 1.0 1.8 3.6 123 107 B 65 VAL H B 63 ASP H 1.0 2.0 4.4 124 107 A 63 ASP H A 60 ASN H 1.0 2.0 4.4 125 107 B 63 ASP H B 60 ASN H 1.0 2.0 4.4 126 108 B 60 ASN H B 61 VAL H 1.0 1.9 5.1 127 108 A 60 ASN H A 61 VAL H 1.0 1.9 5.1 128 109 A 60 ASN HD21 A 61 VAL H 1.0 2.0 5.8 129 109 B 60 ASN HD2x B 61 VAL H 1.0 2.0 5.8 130 110 A 89 GLU H A 88 GLN HA 1.0 1.7 3.1 131 110 B 89 GLU H B 88 GLN HA 1.0 1.7 3.1 132 111 B 63 ASP H B 62 GLY H 1.0 1.7 3.3 133 111 A 63 ASP H A 62 GLY H 1.0 1.7 3.3 134 112 B 65 VAL H B 64 LYS H 1.0 1.9 5.7 135 112 A 65 VAL H A 64 LYS H 1.0 1.9 5.7 136 113 A 65 VAL H B 53 VAL H 1.0 1.9 5.5 137 113 A 65 VAL H A 64 LYS H 1.0 1.9 5.5 138 114 B 65 VAL H B 66 LYS H 1.0 2.0 5.0 139 114 A 65 VAL H A 66 LYS H 1.0 2.0 5.0 140 115 B 52 GLY H B 53 VAL H 1.0 1.9 4.9 141 115 A 52 GLY H A 53 VAL H 1.0 1.9 4.9 142 116 B 52 GLY H B 74 PHE HD% 1.0 2.0 5.8 143 116 A 52 GLY H A 74 PHE HD% 1.0 2.0 5.8 144 117 B 54 VAL H A 62 GLY H 1.0 2.0 6.0 145 117 A 62 GLY H A 61 VAL H 1.0 2.0 6.0 146 117 B 61 VAL H B 62 GLY H 1.0 2.0 6.0 147 118 A 72 MET H A 71 ILE H 1.0 1.5 2.5 148 118 B 72 MET H B 71 ILE H 1.0 1.5 2.5 149 119 B 69 SER H B 70 LEU H 1.0 2.0 5.2 150 119 A 69 SER H A 70 LEU H 1.0 2.0 5.2 151 120 B 69 SER H B 68 GLY H 1.0 1.8 3.8 152 120 A 69 SER H A 68 GLY H 1.0 1.8 3.8 153 121 A 48 ALA H B 70 LEU H 1.0 1.9 4.3 154 121 A 48 ALA H B 71 ILE H 1.0 1.9 4.3 155 122 A 62 GLY H A 61 VAL H 1.0 2.0 4.8 156 122 B 61 VAL H B 62 GLY H 1.0 2.0 4.8 157 123 B 76 VAL H B 77 GLU H 1.0 1.9 4.1 158 123 A 76 VAL H A 77 GLU H 1.0 1.9 4.1 159 124 B 59 VAL H B 58 LYS H 1.0 1.7 2.9 160 124 A 58 LYS H A 59 VAL H 1.0 1.7 2.9 161 125 A 60 ASN H A 59 VAL H 1.0 1.9 4.7 162 125 B 60 ASN H B 59 VAL H 1.0 1.9 4.7 163 126 A 45 GLU H A 46 VAL H 1.0 2.0 5.6 164 126 A 46 VAL H B 71 ILE H 1.0 2.0 5.6 165 127 A 45 GLU H A 46 VAL H 1.0 2.0 5.2 166 127 B 46 VAL H B 45 GLU H 1.0 2.0 5.2 167 128 A 44 MET H A 43 SER H 1.0 1.9 4.9 168 128 B 44 MET H B 43 SER H 1.0 1.9 4.9 169 129 B 44 MET H B 45 GLU H 1.0 2.0 5.6 170 129 A 45 GLU H A 44 MET H 1.0 2.0 5.6 171 129 B 76 VAL H A 44 MET H 1.0 2.0 5.6 172 130 B 42 ALA H B 43 SER H 1.0 1.7 3.5 173 130 A 42 ALA H A 43 SER H 1.0 1.7 3.5 174 131 B 77 GLU HA B 78 GLY H 1.0 1.6 3.0 175 131 A 78 GLY H A 77 GLU HA 1.0 1.6 3.0 176 132 A 60 ASN H A 59 VAL HA 1.0 1.4 2.4 177 132 B 60 ASN H B 59 VAL HA 1.0 1.4 2.4 178 133 A 61 VAL H A 60 ASN HBx 1.0 1.7 3.3 179 133 B 61 VAL H B 60 ASN HBx 1.0 1.7 3.3 180 134 A 61 VAL H A 60 ASN HBy 1.0 1.7 2.9 181 134 B 61 VAL H B 60 ASN HBy 1.0 1.7 2.9 182 135 B 60 ASN HD2x B 60 ASN HBx 1.0 0.0 6.0 183 135 A 60 ASN HD21 A 60 ASN HBx 1.0 0.0 6.0 184 136 A 60 ASN HD21 A 60 ASN HBy 1.0 1.8 3.8 185 136 B 60 ASN HD2x B 60 ASN HBy 1.0 1.8 3.8 186 137 B 60 ASN H B 59 VAL HG11 1.0 1.8 4.0 187 137 A 60 ASN H A 59 VAL HGx% 1.0 1.8 4.0 188 138 B 60 ASN H B 59 VAL HG21 1.0 1.8 3.6 189 138 A 60 ASN H A 59 VAL HGy% 1.0 1.8 3.6 190 139 B 60 ASN H B 59 VAL HB 1.0 1.6 2.8 191 139 A 60 ASN H A 59 VAL HB 1.0 1.6 2.8 192 140 B 61 VAL H B 61 VAL HA 1.0 1.7 3.1 193 140 A 61 VAL H A 61 VAL HA 1.0 1.7 3.1 194 141 B 57 LEU H B 58 LYS H 1.0 2.0 5.4 195 141 A 57 LEU H A 58 LYS H 1.0 2.0 5.4 196 142 B 44 MET H B 43 SER HBy 1.0 1.7 3.3 197 142 A 44 MET H A 43 SER HB3 1.0 1.7 3.3 198 142 B 44 MET H B 43 SER HBx 1.0 1.7 3.3 199 142 A 44 MET H A 43 SER HB2 1.0 1.7 3.3 200 143 B 76 VAL HG11 B 77 GLU H 1.0 1.9 4.7 201 143 A 77 GLU H A 76 VAL HGx% 1.0 1.9 4.7 202 144 B 76 VAL HG21 B 77 GLU H 1.0 1.7 3.5 203 144 A 77 GLU H A 76 VAL HGy% 1.0 1.7 3.5 204 145 B 65 VAL H B 65 VAL HG11 1.0 1.6 3.0 205 145 A 65 VAL H A 65 VAL HGx% 1.0 1.6 3.0 206 146 B 65 VAL H B 65 VAL HG21 1.0 1.9 4.5 207 146 A 65 VAL H A 65 VAL HGy% 1.0 1.9 4.5 208 147 B 61 VAL H B 60 ASN HA 1.0 1.4 2.2 209 147 A 61 VAL H A 60 ASN HA 1.0 1.4 2.2 210 148 A 61 VAL H A 61 VAL HB 1.0 1.5 2.5 211 148 B 61 VAL H B 61 VAL HB 1.0 1.5 2.5 212 149 A 69 SER H A 67 THR H 1.0 2.0 5.4 213 149 A 67 THR H A 66 LYS H 1.0 2.0 5.4 214 149 B 66 LYS H B 67 THR H 1.0 2.0 5.4 215 150 A 76 VAL H A 75 GLU HA 1.0 1.5 2.3 216 150 B 76 VAL H B 75 GLU HA 1.0 1.5 2.3 217 151 B 48 ALA H B 47 PRO HA 1.0 1.6 2.6 218 151 A 48 ALA H A 47 PRO HA 1.0 1.6 2.6 219 152 A 54 VAL H B 62 GLY H 1.0 2.0 6.0 220 152 B 54 VAL H B 55 LYS H 1.0 2.0 6.0 221 152 A 54 VAL H A 55 LYS H 1.0 2.0 6.0 222 153 B 68 GLY H B 67 THR H 1.0 2.0 6.0 223 153 A 68 GLY H A 67 THR H 1.0 2.0 6.0 224 154 B 50 PHE H B 51 ALA H 1.0 1.8 3.8 225 154 A 51 ALA H A 50 PHE HD% 1.0 1.8 3.8 226 154 B 51 ALA H B 50 PHE HD% 1.0 1.8 3.8 227 155 B 52 GLY H B 51 ALA H 1.0 2.0 5.2 228 155 A 52 GLY H A 51 ALA H 1.0 2.0 5.2 229 156 B 67 THR HG21 B 67 THR H 1.0 1.9 3.9 230 156 A 67 THR HG2% A 67 THR H 1.0 1.9 3.9 231 157 A 67 THR H A 67 THR HA 1.0 1.7 3.1 232 157 B 67 THR HA B 67 THR H 1.0 1.7 3.1 233 158 B 74 PHE H B 73 ILE H 1.0 2.0 6.0 234 158 A 74 PHE H A 73 ILE H 1.0 2.0 6.0 235 159 A 44 MET H A 43 SER HA 1.0 1.3 2.2 236 159 B 44 MET H B 43 SER HA 1.0 1.3 2.2 237 160 A 76 VAL H A 75 GLU H 1.0 1.9 4.9 238 160 B 76 VAL H B 75 GLU H 1.0 1.9 4.9 239 161 A 41 LYS H A 41 LYS HG2 1.0 1.9 4.3 240 161 A 41 LYS H A 41 LYS HG3 1.0 1.9 4.3 241 161 B 41 LYS H B 41 LYS HGy 1.0 1.9 4.3 242 161 B 41 LYS H B 41 LYS HGx 1.0 1.9 4.3 243 162 A 41 LYS H A 41 LYS HB3 1.0 1.7 3.1 244 162 B 41 LYS H B 41 LYS HBy 1.0 1.7 3.1 245 162 B 41 LYS H B 41 LYS HBx 1.0 1.7 3.1 246 162 A 41 LYS H A 41 LYS HB2 1.0 1.7 3.1 247 163 B 41 LYS H B 41 LYS HA 1.0 1.7 3.3 248 163 A 41 LYS H A 41 LYS HA 1.0 1.7 3.3 249 164 B 42 ALA H B 42 ALA HB1 1.0 1.6 2.8 250 164 A 42 ALA H A 42 ALA HB% 1.0 1.6 2.8 251 165 B 42 ALA H B 41 LYS HBy 1.0 1.8 3.6 252 165 A 42 ALA H A 41 LYS HB2 1.0 1.8 3.6 253 165 A 42 ALA H A 41 LYS HB3 1.0 1.8 3.6 254 166 B 42 ALA H B 41 LYS HA 1.0 2.0 5.6 255 166 A 42 ALA H A 41 LYS HA 1.0 2.0 5.6 256 167 B 42 ALA H B 43 SER HBx 1.0 1.7 6.0 257 167 B 42 ALA H B 43 SER HBy 1.0 1.7 6.0 258 167 A 42 ALA H A 43 SER HB3 1.0 1.7 6.0 259 167 A 42 ALA H A 43 SER HB2 1.0 1.7 6.0 260 168 A 43 SER H A 44 MET HB3 1.0 2.0 5.4 261 168 A 43 SER H B 75 GLU HBy 1.0 2.0 5.4 262 169 B 42 ALA HB1 B 43 SER H 1.0 1.6 2.8 263 169 A 43 SER H A 42 ALA HB% 1.0 1.6 2.8 264 170 B 43 SER H B 43 SER HBx 1.0 1.7 3.1 265 170 A 43 SER H A 43 SER HB2 1.0 1.7 3.1 266 170 B 43 SER H B 43 SER HBy 1.0 1.7 3.1 267 170 A 43 SER H A 43 SER HB3 1.0 1.7 3.1 268 171 B 42 ALA HA B 43 SER H 1.0 0.0 6.0 269 171 A 43 SER H A 42 ALA HA 1.0 0.0 6.0 270 172 B 43 SER HA B 43 SER H 1.0 1.7 3.1 271 172 A 43 SER H A 43 SER HA 1.0 1.7 3.1 272 173 A 44 MET H A 44 MET HG2 1.0 2.0 4.8 273 173 B 44 MET H B 44 MET HGx 1.0 2.0 4.8 274 173 A 44 MET H A 44 MET HG3 1.0 2.0 4.8 275 173 B 44 MET H B 44 MET HGy 1.0 2.0 4.8 276 174 B 44 MET H B 44 MET HE1 1.0 2.0 5.2 277 174 A 44 MET H A 44 MET HE% 1.0 2.0 5.2 278 175 A 44 MET H A 44 MET HB3 1.0 1.9 3.9 279 175 B 44 MET H B 44 MET HBy 1.0 1.9 3.9 280 175 A 44 MET H A 44 MET HB2 1.0 1.9 3.9 281 175 B 44 MET H B 44 MET HBx 1.0 1.9 3.9 282 176 A 44 MET H B 73 ILE HD11 1.0 0.0 6.0 283 176 A 44 MET H B 76 VAL HG21 1.0 0.0 6.0 284 177 A 44 MET H B 76 VAL HG11 1.0 1.7 3.5 285 177 B 73 ILE HG21 A 44 MET H 1.0 1.7 3.5 286 178 B 44 MET H B 44 MET HA 1.0 1.7 3.1 287 178 A 44 MET H A 44 MET HA 1.0 1.7 3.1 288 179 B 45 GLU H B 45 GLU HGx 1.0 1.7 3.1 289 179 A 45 GLU H A 45 GLU HG2 1.0 1.7 3.1 290 179 B 45 GLU H B 45 GLU HGy 1.0 1.7 3.1 291 179 A 45 GLU H A 45 GLU HG3 1.0 1.7 3.1 292 180 A 45 GLU H A 44 MET HG2 1.0 2.0 5.0 293 180 B 45 GLU H B 44 MET HGx 1.0 2.0 5.0 294 180 A 45 GLU H A 44 MET HG3 1.0 2.0 5.0 295 180 B 45 GLU H B 44 MET HGy 1.0 2.0 5.0 296 181 A 45 GLU H A 45 GLU HBx 1.0 1.8 3.4 297 181 B 45 GLU H B 45 GLU HBy 1.0 1.8 3.4 298 182 B 45 GLU H B 45 GLU HBx 1.0 1.5 2.5 299 182 A 45 GLU H A 45 GLU HBy 1.0 1.5 2.5 300 183 B 45 GLU H B 44 MET HA 1.0 1.6 2.6 301 183 A 45 GLU H A 44 MET HA 1.0 1.6 2.6 302 184 A 79 ALA H A 78 GLY HA2 1.0 1.7 2.9 303 184 B 79 ALA H B 78 GLY HAy 1.0 1.7 2.9 304 184 B 79 ALA H B 78 GLY HAx 1.0 1.7 2.9 305 184 A 79 ALA H A 78 GLY HA3 1.0 1.7 2.9 306 185 A 79 ALA H A 79 ALA HA 1.0 1.8 3.4 307 185 B 79 ALA H B 79 ALA HA 1.0 1.8 3.4 308 186 A 78 GLY H A 77 GLU HG2 1.0 2.0 5.4 309 186 B 78 GLY H B 77 GLU HGx 1.0 2.0 5.4 310 186 A 78 GLY H A 77 GLU HG3 1.0 2.0 5.4 311 186 B 78 GLY H B 77 GLU HGy 1.0 2.0 5.4 312 187 B 78 GLY H B 77 GLU HBx 1.0 1.9 4.3 313 187 A 78 GLY H A 77 GLU HBy 1.0 1.9 4.3 314 188 A 78 GLY H A 77 GLU HBx 1.0 1.9 4.3 315 188 B 78 GLY H B 77 GLU HBy 1.0 1.9 4.3 316 189 B 78 GLY H A 42 ALA HB% 1.0 1.9 4.3 317 189 A 78 GLY H B 42 ALA HB1 1.0 1.9 4.3 318 190 B 76 VAL HG21 B 78 GLY H 1.0 2.0 4.8 319 190 A 78 GLY H A 76 VAL HGy% 1.0 2.0 4.8 320 191 B 78 GLY H B 78 GLY HAy 1.0 1.8 3.4 321 191 A 78 GLY H A 78 GLY HA3 1.0 1.8 3.4 322 191 A 78 GLY H A 78 GLY HA2 1.0 1.8 3.4 323 191 B 78 GLY H B 78 GLY HAx 1.0 1.8 3.4 324 192 A 77 GLU H A 77 GLU HG2 1.0 1.9 4.1 325 192 B 77 GLU H B 77 GLU HGx 1.0 1.9 4.1 326 192 B 77 GLU H B 77 GLU HGy 1.0 1.9 4.1 327 192 A 77 GLU H A 77 GLU HG3 1.0 1.9 4.1 328 193 B 77 GLU H B 77 GLU HBy 1.0 1.7 3.3 329 193 A 77 GLU H A 77 GLU HBx 1.0 1.7 3.3 330 194 A 77 GLU H A 52 GLY HAy 1.0 0.0 6.0 331 194 B 77 GLU H B 52 GLY HAx 1.0 0.0 6.0 332 195 B 77 GLU H B 52 GLY HAy 1.0 0.0 6.0 333 195 A 77 GLU H A 52 GLY HAx 1.0 0.0 6.0 334 196 B 77 GLU HA B 77 GLU H 1.0 1.7 3.3 335 196 A 77 GLU H A 77 GLU HA 1.0 1.7 3.3 336 197 B 76 VAL H B 76 VAL HG21 1.0 1.9 4.3 337 197 A 76 VAL H A 76 VAL HGy% 1.0 1.9 4.3 338 198 B 76 VAL H B 76 VAL HG11 1.0 1.6 2.8 339 198 A 76 VAL H A 76 VAL HGx% 1.0 1.6 2.8 340 199 B 76 VAL H B 75 GLU HGx 1.0 1.7 3.3 341 199 B 76 VAL H B 76 VAL HB 1.0 1.7 3.3 342 199 A 76 VAL H A 76 VAL HB 1.0 1.7 3.3 343 200 A 76 VAL H A 75 GLU HBx 1.0 1.9 4.3 344 200 B 76 VAL H B 75 GLU HBx 1.0 1.9 4.3 345 200 B 76 VAL H B 75 GLU HGy 1.0 1.9 4.3 346 200 A 76 VAL H A 75 GLU HGx 1.0 1.9 4.3 347 201 A 76 VAL H A 75 GLU HBy 1.0 1.9 5.5 348 201 B 76 VAL H B 75 GLU HBy 1.0 1.9 5.5 349 202 B 75 GLU H B 53 VAL HG11 1.0 0.0 6.0 350 202 A 75 GLU H A 73 ILE HG2% 1.0 0.0 6.0 351 202 A 75 GLU H A 53 VAL HGx% 1.0 0.0 6.0 352 202 A 75 GLU H A 54 VAL HGy% 1.0 0.0 6.0 353 203 B 75 GLU H B 75 GLU HGy 1.0 1.8 3.6 354 203 A 75 GLU H A 75 GLU HBx 1.0 1.8 3.6 355 203 B 75 GLU H B 75 GLU HBx 1.0 1.8 3.6 356 204 B 75 GLU H B 75 GLU HBy 1.0 1.9 4.1 357 204 A 75 GLU H A 75 GLU HBy 1.0 1.9 4.1 358 205 A 75 GLU H A 75 GLU HGy 1.0 1.9 6.0 359 205 B 75 GLU HGx B 75 GLU H 1.0 1.9 6.0 360 206 A 75 GLU H A 75 GLU HA 1.0 1.7 3.1 361 206 B 75 GLU HA B 75 GLU H 1.0 1.7 3.1 362 207 B 73 ILE HG21 B 74 PHE H 1.0 1.8 3.8 363 207 A 74 PHE H A 73 ILE HG2% 1.0 1.8 3.8 364 208 A 74 PHE H B 45 GLU HBx 1.0 2.0 5.6 365 208 B 74 PHE H B 72 MET HBx 1.0 2.0 5.6 366 208 B 74 PHE H B 75 GLU HBx 1.0 2.0 5.6 367 208 B 74 PHE H B 75 GLU HGy 1.0 2.0 5.6 368 208 A 74 PHE H A 75 GLU HBx 1.0 2.0 5.6 369 208 A 74 PHE H A 72 MET HB3 1.0 2.0 5.6 370 209 A 74 PHE H A 73 ILE HB 1.0 1.9 4.5 371 209 B 74 PHE H B 73 ILE HB 1.0 1.9 4.5 372 210 A 74 PHE H A 74 PHE HB3 1.0 1.8 3.8 373 210 B 74 PHE H B 74 PHE HBx 1.0 1.8 3.8 374 210 A 74 PHE H A 74 PHE HB2 1.0 1.8 3.8 375 211 B 74 PHE H B 73 ILE HA 1.0 1.7 3.1 376 211 A 74 PHE H A 73 ILE HA 1.0 1.7 3.1 377 212 B 73 ILE H B 57 LEU HA 1.0 1.9 4.9 378 212 A 73 ILE H A 57 LEU HA 1.0 1.9 4.9 379 213 A 73 ILE H A 72 MET HB3 1.0 1.9 4.1 380 213 B 73 ILE H B 72 MET HBy 1.0 1.9 4.1 381 213 B 73 ILE H B 72 MET HBx 1.0 1.9 4.1 382 213 A 73 ILE H A 72 MET HB2 1.0 1.9 4.1 383 214 B 73 ILE H B 73 ILE HB 1.0 1.8 3.6 384 214 A 73 ILE H A 73 ILE HB 1.0 1.8 3.6 385 215 B 73 ILE H B 73 ILE HD11 1.0 2.0 5.4 386 215 A 73 ILE H A 73 ILE HD1% 1.0 2.0 5.4 387 216 B 73 ILE H B 73 ILE HG1x 1.0 1.8 3.8 388 216 A 73 ILE H A 73 ILE HG12 1.0 1.8 3.8 389 216 A 73 ILE H A 73 ILE HG13 1.0 1.8 3.8 390 216 B 73 ILE H B 73 ILE HG1y 1.0 1.8 3.8 391 217 B 70 LEU H B 69 SER HBx 1.0 1.8 3.6 392 217 B 70 LEU H B 69 SER HBy 1.0 1.8 3.6 393 217 A 70 LEU H A 69 SER HB3 1.0 1.8 3.6 394 217 A 70 LEU H A 69 SER HB2 1.0 1.8 3.6 395 218 A 72 MET H A 72 MET HG2 1.0 1.8 3.8 396 218 A 72 MET H A 72 MET HG3 1.0 1.8 3.8 397 218 B 72 MET H B 72 MET HGy 1.0 1.8 3.8 398 218 B 72 MET H B 72 MET HGx 1.0 1.8 3.8 399 219 B 72 MET H B 72 MET HBy 1.0 1.8 3.6 400 219 A 72 MET H A 72 MET HB3 1.0 1.8 3.6 401 219 A 72 MET H A 72 MET HB2 1.0 1.8 3.6 402 219 B 72 MET H B 71 ILE HB 1.0 1.8 3.6 403 219 A 72 MET H A 71 ILE HB 1.0 1.8 3.6 404 220 B 72 MET H B 71 ILE HG1x 1.0 1.6 2.8 405 220 A 72 MET H A 71 ILE HG1y 1.0 1.6 2.8 406 220 B 72 MET H B 71 ILE HG1y 1.0 1.6 2.8 407 221 B 72 MET H B 71 ILE HG21 1.0 2.0 4.8 408 221 A 72 MET H A 71 ILE HG2% 1.0 2.0 4.8 409 222 B 72 MET H B 71 ILE HD11 1.0 2.0 4.8 410 222 A 72 MET H A 71 ILE HD1% 1.0 2.0 4.8 411 223 A 72 MET H A 70 LEU HA 1.0 2.0 5.2 412 223 B 72 MET H B 70 LEU HA 1.0 2.0 5.2 413 224 B 73 ILE H B 72 MET HA 1.0 1.7 3.3 414 224 A 73 ILE H A 72 MET HA 1.0 1.7 3.3 415 225 A 72 MET H A 71 ILE HA 1.0 1.7 3.1 416 225 B 72 MET H B 71 ILE HA 1.0 1.7 3.1 417 225 A 72 MET H A 72 MET HA 1.0 1.7 3.1 418 225 B 72 MET H B 72 MET HA 1.0 1.7 3.1 419 226 A 71 ILE H A 72 MET HB2 1.0 2.0 5.2 420 226 A 71 ILE H A 71 ILE HB 1.0 2.0 5.2 421 227 A 71 ILE H A 70 LEU HB2 1.0 1.7 3.5 422 227 A 71 ILE H A 70 LEU HB3 1.0 1.7 3.5 423 227 A 71 ILE H A 71 ILE HG1y 1.0 1.7 3.5 424 228 B 71 ILE H B 71 ILE HG21 1.0 1.8 4.2 425 228 A 71 ILE H A 71 ILE HG2% 1.0 1.8 4.2 426 229 A 70 LEU H B 45 GLU HBx 1.0 2.0 6.0 427 229 A 70 LEU H B 47 PRO HBx 1.0 2.0 6.0 428 230 A 70 LEU H A 70 LEU HG 1.0 1.6 2.8 429 230 A 70 LEU H A 70 LEU HB2 1.0 1.6 2.8 430 230 B 70 LEU H B 70 LEU HG 1.0 1.6 2.8 431 230 B 70 LEU H B 70 LEU HBx 1.0 1.6 2.8 432 230 A 70 LEU H A 70 LEU HB3 1.0 1.6 2.8 433 231 B 70 LEU H B 70 LEU HD21 1.0 1.8 3.8 434 231 B 70 LEU H B 70 LEU HD11 1.0 1.8 3.8 435 231 A 70 LEU H A 70 LEU HD1% 1.0 1.8 3.8 436 231 A 70 LEU H A 70 LEU HD2% 1.0 1.8 3.8 437 232 A 69 SER H A 65 VAL HGy% 1.0 2.0 4.8 438 232 B 69 SER H B 65 VAL HG21 1.0 2.0 4.8 439 233 A 69 SER H A 66 LYS HB3 1.0 1.8 3.8 440 233 B 69 SER H B 66 LYS HBy 1.0 1.8 3.8 441 233 A 69 SER H A 66 LYS HB2 1.0 1.8 3.8 442 234 A 69 SER H A 69 SER HA 1.0 1.7 3.3 443 234 B 69 SER H B 69 SER HA 1.0 1.7 3.3 444 235 B 69 SER H B 69 SER HBy 1.0 1.7 3.3 445 235 A 69 SER H A 69 SER HB2 1.0 1.7 3.3 446 235 B 69 SER H B 69 SER HBx 1.0 1.7 3.3 447 235 A 69 SER H A 69 SER HB3 1.0 1.7 3.3 448 236 B 69 SER H B 68 GLY HAx 1.0 1.9 4.5 449 236 A 69 SER H A 68 GLY HAx 1.0 1.9 4.5 450 237 A 69 SER H A 68 GLY HAy 1.0 1.9 4.5 451 237 B 69 SER H B 68 GLY HAy 1.0 1.9 4.5 452 238 B 67 THR HA B 68 GLY H 1.0 1.8 3.6 453 238 A 68 GLY H A 67 THR HA 1.0 1.8 3.6 454 239 B 68 GLY H B 68 GLY HAx 1.0 1.7 3.3 455 239 A 68 GLY H A 68 GLY HAx 1.0 1.7 3.3 456 240 A 68 GLY H A 67 THR HB 1.0 1.7 3.3 457 240 B 68 GLY H B 68 GLY HAy 1.0 1.7 3.3 458 240 A 68 GLY H A 68 GLY HAy 1.0 1.7 3.3 459 241 B 67 THR HG21 B 68 GLY H 1.0 1.9 4.1 460 241 A 67 THR HG2% A 68 GLY H 1.0 1.9 4.1 461 242 B 67 THR H B 67 THR HB 1.0 1.8 3.8 462 242 A 67 THR H A 67 THR HB 1.0 1.8 3.8 463 243 B 67 THR H B 66 LYS HBx 1.0 1.8 3.8 464 243 A 67 THR H A 66 LYS HB2 1.0 1.8 3.8 465 243 B 67 THR H B 66 LYS HBy 1.0 1.8 3.8 466 243 A 67 THR H A 66 LYS HB3 1.0 1.8 3.8 467 244 B 66 LYS HGy B 67 THR H 1.0 2.0 5.4 468 244 A 67 THR H A 66 LYS HG3 1.0 2.0 5.4 469 244 A 67 THR H A 66 LYS HG2 1.0 2.0 5.4 470 244 B 66 LYS HGx B 67 THR H 1.0 2.0 5.4 471 245 A 67 THR H A 66 LYS HA 1.0 1.6 2.8 472 245 B 67 THR H B 66 LYS HA 1.0 1.6 2.8 473 246 B 66 LYS H B 65 VAL HB 1.0 1.7 3.3 474 246 A 65 VAL HB A 66 LYS H 1.0 1.7 3.3 475 246 B 66 LYS H B 66 LYS HBy 1.0 1.7 3.3 476 246 A 66 LYS H A 66 LYS HB3 1.0 1.7 3.3 477 246 B 66 LYS H B 66 LYS HBx 1.0 1.7 3.3 478 247 A 66 LYS H A 66 LYS HD3 1.0 1.9 4.3 479 247 B 66 LYS H B 66 LYS HDy 1.0 1.9 4.3 480 247 B 66 LYS H A 51 ALA HB% 1.0 1.9 4.3 481 247 B 66 LYS H B 66 LYS HDx 1.0 1.9 4.3 482 247 A 66 LYS H A 66 LYS HD2 1.0 1.9 4.3 483 248 B 65 VAL HG21 B 66 LYS H 1.0 1.6 3.0 484 248 A 66 LYS H A 65 VAL HGy% 1.0 1.6 3.0 485 249 B 65 VAL HG11 B 66 LYS H 1.0 1.9 4.3 486 249 A 65 VAL HGx% A 66 LYS H 1.0 1.9 4.3 487 250 A 65 VAL H A 64 LYS HG3 1.0 2.0 5.0 488 250 B 65 VAL H B 64 LYS HGy 1.0 2.0 5.0 489 250 A 65 VAL H A 64 LYS HG2 1.0 2.0 5.0 490 250 B 65 VAL H B 64 LYS HGx 1.0 2.0 5.0 491 251 A 65 VAL H B 54 VAL HG21 1.0 1.8 4.0 492 251 A 65 VAL H B 53 VAL HG11 1.0 1.8 4.0 493 252 B 65 VAL H B 64 LYS HA 1.0 1.5 2.5 494 252 A 65 VAL H A 64 LYS HA 1.0 1.5 2.5 495 253 A 65 VAL H A 65 VAL HA 1.0 1.7 3.1 496 253 B 65 VAL H B 65 VAL HA 1.0 1.7 3.1 497 254 B 66 LYS H B 65 VAL HA 1.0 1.4 2.4 498 254 A 66 LYS H A 65 VAL HA 1.0 1.4 2.4 499 255 B 65 VAL H B 64 LYS HBx 1.0 1.8 4.0 500 255 A 65 VAL H A 64 LYS HB2 1.0 1.8 4.0 501 255 A 65 VAL H A 64 LYS HB3 1.0 1.8 4.0 502 255 B 65 VAL H B 64 LYS HBy 1.0 1.8 4.0 503 256 A 64 LYS H B 54 VAL HG11 1.0 1.9 4.5 504 256 A 64 LYS H B 53 VAL HG11 1.0 1.9 4.5 505 257 A 64 LYS H A 64 LYS HG2 1.0 1.8 3.4 506 257 B 64 LYS H B 64 LYS HGx 1.0 1.8 3.4 507 257 B 64 LYS H B 64 LYS HGy 1.0 1.8 3.4 508 257 A 64 LYS H A 64 LYS HG3 1.0 1.8 3.4 509 258 A 64 LYS H A 63 ASP HBx 1.0 2.0 4.4 510 258 B 64 LYS H B 63 ASP HBy 1.0 2.0 4.4 511 259 A 64 LYS H A 64 LYS HB3 1.0 1.7 3.1 512 259 B 64 LYS H B 64 LYS HBy 1.0 1.7 3.1 513 259 A 64 LYS H A 64 LYS HB2 1.0 1.7 3.1 514 259 B 64 LYS H B 64 LYS HBx 1.0 1.7 3.1 515 260 B 64 LYS H B 63 ASP HA 1.0 1.5 2.5 516 260 A 64 LYS H A 63 ASP HA 1.0 1.5 2.5 517 261 B 63 ASP H B 62 GLY HAx 1.0 1.9 4.3 518 261 A 63 ASP H A 62 GLY HAx 1.0 1.9 4.3 519 262 A 63 ASP H A 61 VAL HA 1.0 1.9 4.7 520 262 B 63 ASP H B 61 VAL HA 1.0 1.9 4.7 521 263 A 63 ASP H A 63 ASP HBy 1.0 1.7 3.5 522 263 B 63 ASP H B 63 ASP HBx 1.0 1.7 3.5 523 264 B 63 ASP H B 63 ASP HBy 1.0 1.7 3.3 524 264 A 63 ASP H A 63 ASP HBx 1.0 1.7 3.3 525 265 B 64 LYS H B 63 ASP HBx 1.0 1.9 4.9 526 265 A 64 LYS H A 63 ASP HBy 1.0 1.9 4.9 527 266 B 62 GLY H B 62 GLY HAy 1.0 1.7 3.1 528 266 A 62 GLY H A 62 GLY HAy 1.0 1.7 3.1 529 267 A 62 GLY H A 62 GLY HAx 1.0 1.7 3.1 530 267 B 62 GLY H B 62 GLY HAx 1.0 1.7 3.1 531 268 A 62 GLY H A 61 VAL HA 1.0 1.6 2.8 532 268 B 62 GLY H B 61 VAL HA 1.0 1.6 2.8 533 269 A 62 GLY H A 61 VAL HB 1.0 2.0 5.4 534 269 B 62 GLY H B 61 VAL HB 1.0 2.0 5.4 535 270 B 62 GLY H B 61 VAL HG11 1.0 1.7 3.1 536 270 A 62 GLY H A 61 VAL HGx% 1.0 1.7 3.1 537 271 B 61 VAL H B 61 VAL HG21 1.0 1.6 2.8 538 271 A 61 VAL H A 61 VAL HGx% 1.0 1.6 2.8 539 271 A 61 VAL H A 61 VAL HGy% 1.0 1.6 2.8 540 272 A 66 LYS H A 66 LYS HA 1.0 1.7 3.1 541 272 B 66 LYS H B 66 LYS HA 1.0 1.7 3.1 542 273 A 60 ASN HD21 A 60 ASN HA 1.0 1.9 3.9 543 273 B 60 ASN HD2x B 60 ASN HA 1.0 1.9 3.9 544 274 B 60 ASN HD2x B 59 VAL HB 1.0 2.0 5.8 545 274 A 60 ASN HD21 A 59 VAL HB 1.0 2.0 5.8 546 275 B 60 ASN HD2x B 61 VAL HG21 1.0 2.0 5.4 547 275 A 60 ASN HD21 A 61 VAL HGy% 1.0 2.0 5.4 548 276 B 60 ASN HD2x A 54 VAL HGy% 1.0 0.0 6.0 549 276 B 60 ASN HD2x B 59 VAL HG21 1.0 0.0 6.0 550 276 A 60 ASN HD21 A 59 VAL HGy% 1.0 0.0 6.0 551 277 B 60 ASN HD2y B 57 LEU HD21 1.0 1.8 4.0 552 277 A 60 ASN HD22 A 57 LEU HDy% 1.0 1.8 4.0 553 278 B 60 ASN HD2y B 57 LEU HD11 1.0 1.9 3.9 554 278 A 61 VAL HGy% B 60 ASN HD2y 1.0 1.9 3.9 555 278 B 61 VAL HG21 B 60 ASN HD2y 1.0 1.9 3.9 556 278 B 61 VAL HG21 A 60 ASN HD22 1.0 1.9 3.9 557 278 A 60 ASN HD22 A 57 LEU HDx% 1.0 1.9 3.9 558 278 A 61 VAL HGy% A 60 ASN HD22 1.0 1.9 3.9 559 279 A 60 ASN HBy A 60 ASN HD22 1.0 2.0 5.0 560 279 B 60 ASN HBy B 60 ASN HD2y 1.0 2.0 5.0 561 280 B 60 ASN HBx B 60 ASN HD2y 1.0 1.9 4.3 562 280 A 60 ASN HBx A 60 ASN HD22 1.0 1.9 4.3 563 281 B 60 ASN HA B 60 ASN HD2y 1.0 0.0 6.0 564 281 A 60 ASN HA A 60 ASN HD22 1.0 0.0 6.0 565 282 B 60 ASN HD2x B 60 ASN HD2y 1.0 1.2 2.2 566 282 A 60 ASN HD21 A 60 ASN HD22 1.0 1.2 2.2 567 283 A 60 ASN H A 60 ASN HD22 1.0 2.0 6.0 568 283 B 60 ASN H B 60 ASN HD2y 1.0 2.0 6.0 569 284 B 60 ASN H B 60 ASN HBy 1.0 1.7 3.1 570 284 A 60 ASN H A 60 ASN HBy 1.0 1.7 3.1 571 285 B 60 ASN H B 60 ASN HBx 1.0 1.7 2.9 572 285 A 60 ASN H A 60 ASN HBx 1.0 1.7 2.9 573 286 B 60 ASN H B 60 ASN HA 1.0 1.7 3.3 574 286 A 60 ASN H A 60 ASN HA 1.0 1.7 3.3 575 287 B 59 VAL H B 58 LYS HA 1.0 1.7 3.3 576 287 A 59 VAL H A 58 LYS HA 1.0 1.7 3.3 577 287 B 59 VAL H B 59 VAL HA 1.0 1.7 3.3 578 287 A 59 VAL H A 59 VAL HA 1.0 1.7 3.3 579 288 A 59 VAL H A 59 VAL HB 1.0 2.0 5.0 580 288 B 59 VAL H B 59 VAL HB 1.0 2.0 5.0 581 289 B 59 VAL H B 57 LEU HBx 1.0 1.9 4.3 582 289 A 59 VAL H A 57 LEU HB2 1.0 1.9 4.3 583 289 B 59 VAL H B 57 LEU HBy 1.0 1.9 4.3 584 289 A 59 VAL H A 57 LEU HB3 1.0 1.9 4.3 585 290 B 59 VAL H B 57 LEU HG 1.0 1.9 4.3 586 290 A 59 VAL H A 57 LEU HG 1.0 1.9 4.3 587 291 A 59 VAL H A 58 LYS HDx 1.0 2.0 4.8 588 291 B 59 VAL H B 58 LYS HDx 1.0 2.0 4.8 589 292 B 59 VAL H B 59 VAL HG11 1.0 1.8 3.4 590 292 A 59 VAL H A 59 VAL HGx% 1.0 1.8 3.4 591 293 B 59 VAL H B 59 VAL HG21 1.0 1.7 2.9 592 293 A 59 VAL H A 59 VAL HGy% 1.0 1.7 2.9 593 294 B 58 LYS H B 72 MET HGx 1.0 2.0 5.8 594 294 B 58 LYS H B 59 VAL HB 1.0 2.0 5.8 595 294 A 58 LYS H A 59 VAL HB 1.0 2.0 5.8 596 295 B 58 LYS H B 57 LEU HBx 1.0 1.8 3.6 597 295 A 58 LYS H A 57 LEU HB2 1.0 1.8 3.6 598 295 A 58 LYS H A 57 LEU HB3 1.0 1.8 3.6 599 295 B 58 LYS H B 57 LEU HBy 1.0 1.8 3.6 600 295 B 58 LYS H B 58 LYS HBx 1.0 1.8 3.6 601 296 B 58 LYS H B 57 LEU HG 1.0 1.8 3.8 602 296 A 58 LYS H A 57 LEU HG 1.0 1.8 3.8 603 297 A 58 LYS H A 58 LYS HDx 1.0 2.0 4.6 604 297 B 58 LYS H B 58 LYS HDx 1.0 2.0 4.6 605 298 B 58 LYS H B 58 LYS HGy 1.0 1.9 4.3 606 298 A 58 LYS H A 58 LYS HGy 1.0 1.9 4.3 607 298 B 58 LYS H B 58 LYS HBy 1.0 1.9 4.3 608 298 B 58 LYS H B 57 LEU HD21 1.0 1.9 4.3 609 298 A 58 LYS H A 58 LYS HBy 1.0 1.9 4.3 610 298 A 58 LYS H A 57 LEU HDy% 1.0 1.9 4.3 611 299 A 58 LYS H A 59 VAL HGx% 1.0 1.8 4.2 612 299 B 58 LYS H B 57 LEU HD11 1.0 1.8 4.2 613 299 A 58 LYS H A 57 LEU HDx% 1.0 1.8 4.2 614 299 B 58 LYS H B 59 VAL HG11 1.0 1.8 4.2 615 300 A 58 LYS H A 58 LYS HA 1.0 1.7 3.1 616 300 B 58 LYS H B 58 LYS HA 1.0 1.7 3.1 617 300 A 58 LYS H A 57 LEU HA 1.0 1.7 3.1 618 300 B 58 LYS H B 57 LEU HA 1.0 1.7 3.1 619 301 A 58 LYS H A 71 ILE HA 1.0 0.0 6.0 620 301 B 58 LYS H B 71 ILE HA 1.0 0.0 6.0 621 302 A 57 LEU H A 56 GLU HG2 1.0 1.9 4.5 622 302 B 57 LEU H B 56 GLU HGx 1.0 1.9 4.5 623 302 B 57 LEU H B 56 GLU HGy 1.0 1.9 4.5 624 302 A 57 LEU H A 56 GLU HG3 1.0 1.9 4.5 625 303 B 57 LEU H B 57 LEU HBx 1.0 1.7 3.5 626 303 A 57 LEU H A 57 LEU HB2 1.0 1.7 3.5 627 303 B 57 LEU H B 57 LEU HBy 1.0 1.7 3.5 628 303 A 57 LEU H A 57 LEU HB3 1.0 1.7 3.5 629 304 A 57 LEU H A 56 GLU HB2 1.0 1.8 4.0 630 304 A 57 LEU H A 56 GLU HB3 1.0 1.8 4.0 631 304 B 57 LEU H B 56 GLU HBy 1.0 1.8 4.0 632 304 A 57 LEU H A 57 LEU HG 1.0 1.8 4.0 633 304 B 57 LEU H B 56 GLU HBx 1.0 1.8 4.0 634 305 B 57 LEU H B 57 LEU HD11 1.0 1.8 4.0 635 305 A 57 LEU H A 57 LEU HDx% 1.0 1.8 4.0 636 306 B 54 VAL HG21 B 57 LEU H 1.0 0.0 6.0 637 306 A 57 LEU H A 54 VAL HGy% 1.0 0.0 6.0 638 307 A 74 PHE HD% A 56 GLU H 1.0 2.0 6.0 639 307 B 56 GLU H B 74 PHE HD% 1.0 2.0 6.0 640 308 A 56 GLU H A 73 ILE HA 1.0 2.0 5.0 641 308 A 56 GLU H A 72 MET HA 1.0 2.0 5.0 642 308 B 56 GLU H B 72 MET HA 1.0 2.0 5.0 643 309 B 56 GLU H B 54 VAL HA 1.0 2.0 6.0 644 309 A 56 GLU H A 54 VAL HA 1.0 2.0 6.0 645 310 B 54 VAL HG11 B 56 GLU H 1.0 1.9 3.7 646 310 A 56 GLU H A 54 VAL HGx% 1.0 1.9 3.7 647 311 B 54 VAL HG21 B 56 GLU H 1.0 2.0 5.0 648 311 A 56 GLU H A 54 VAL HGy% 1.0 2.0 5.0 649 312 B 56 GLU H B 56 GLU HGy 1.0 2.0 6.0 650 312 B 56 GLU H B 56 GLU HGx 1.0 2.0 6.0 651 312 A 56 GLU H A 56 GLU HG2 1.0 2.0 6.0 652 312 A 56 GLU H A 56 GLU HG3 1.0 2.0 6.0 653 313 B 56 GLU H B 55 LYS HBx 1.0 1.6 3.0 654 313 A 56 GLU H A 55 LYS HB2 1.0 1.6 3.0 655 313 B 56 GLU H B 55 LYS HBy 1.0 1.6 3.0 656 313 A 56 GLU H A 55 LYS HB3 1.0 1.6 3.0 657 314 B 54 VAL HB B 55 LYS H 1.0 1.9 4.9 658 314 A 54 VAL HB A 55 LYS H 1.0 1.9 4.9 659 315 A 55 LYS H A 72 MET HB3 1.0 2.0 5.6 660 315 B 55 LYS H B 72 MET HBx 1.0 2.0 5.6 661 315 B 55 LYS H B 75 GLU HBx 1.0 2.0 5.6 662 315 A 55 LYS H A 75 GLU HBx 1.0 2.0 5.6 663 316 A 55 LYS H A 55 LYS HB3 1.0 1.8 3.4 664 316 B 55 LYS H B 55 LYS HBy 1.0 1.8 3.4 665 316 A 55 LYS H A 55 LYS HB2 1.0 1.8 3.4 666 316 B 55 LYS H B 55 LYS HBx 1.0 1.8 3.4 667 317 A 55 LYS H A 54 VAL HGy% 1.0 1.7 3.5 668 317 B 54 VAL HG11 B 55 LYS H 1.0 1.7 3.5 669 317 A 55 LYS H A 54 VAL HGx% 1.0 1.7 3.5 670 318 B 55 LYS H B 55 LYS HA 1.0 1.7 3.3 671 318 A 55 LYS H A 55 LYS HA 1.0 1.7 3.3 672 319 B 55 LYS H B 54 VAL HA 1.0 1.6 2.8 673 319 A 55 LYS H A 54 VAL HA 1.0 1.6 2.8 674 320 A 56 GLU H A 55 LYS HA 1.0 1.8 3.6 675 320 A 56 GLU H A 56 GLU HA 1.0 1.8 3.6 676 320 B 56 GLU H B 56 GLU HA 1.0 1.8 3.6 677 321 B 54 VAL H B 53 VAL HA 1.0 1.7 3.1 678 321 A 54 VAL H A 53 VAL HA 1.0 1.7 3.1 679 322 A 54 VAL H B 64 LYS HA 1.0 1.8 4.0 680 322 B 54 VAL H A 64 LYS HA 1.0 1.8 4.0 681 323 B 54 VAL H B 54 VAL HA 1.0 1.9 4.1 682 323 A 54 VAL H A 54 VAL HA 1.0 1.9 4.1 683 324 B 54 VAL H A 61 VAL HA 1.0 1.9 6.0 684 324 A 54 VAL H B 61 VAL HA 1.0 1.9 6.0 685 325 A 54 VAL HB A 54 VAL H 1.0 1.7 3.5 686 325 B 54 VAL H B 54 VAL HB 1.0 1.7 3.5 687 326 A 54 VAL H A 53 VAL HB 1.0 2.0 4.8 688 326 B 54 VAL H B 53 VAL HB 1.0 2.0 4.8 689 327 A 54 VAL H A 54 VAL HGx% 1.0 1.6 3.0 690 327 B 54 VAL H B 54 VAL HG21 1.0 1.6 3.0 691 327 A 54 VAL H A 54 VAL HGy% 1.0 1.6 3.0 692 328 B 54 VAL H B 53 VAL HG21 1.0 1.9 4.5 693 328 A 54 VAL H A 53 VAL HGy% 1.0 1.9 4.5 694 329 B 54 VAL H A 65 VAL HGx% 1.0 2.0 5.8 695 329 B 65 VAL HG11 A 54 VAL H 1.0 2.0 5.8 696 330 A 53 VAL H A 76 VAL HA 1.0 1.9 4.3 697 330 B 53 VAL H B 76 VAL HA 1.0 1.9 4.3 698 331 B 53 VAL H B 52 GLY HAx 1.0 1.9 3.9 699 331 A 52 GLY HAy A 53 VAL H 1.0 1.9 3.9 700 332 A 53 VAL H A 74 PHE HB2 1.0 1.9 4.1 701 332 B 74 PHE HBy B 53 VAL H 1.0 1.9 4.1 702 332 A 53 VAL H A 74 PHE HB3 1.0 1.9 4.1 703 333 A 53 VAL H A 75 GLU HGy 1.0 2.0 5.6 704 333 B 53 VAL H B 76 VAL HB 1.0 2.0 5.6 705 333 A 53 VAL H A 76 VAL HB 1.0 2.0 5.6 706 334 B 53 VAL H B 53 VAL HB 1.0 1.7 3.1 707 334 A 53 VAL H A 53 VAL HB 1.0 1.7 3.1 708 335 B 53 VAL H B 53 VAL HG11 1.0 1.8 4.0 709 335 A 53 VAL H A 53 VAL HGx% 1.0 1.8 4.0 710 336 B 53 VAL HG21 B 53 VAL H 1.0 1.9 3.9 711 336 A 53 VAL H A 53 VAL HGy% 1.0 1.9 3.9 712 337 B 76 VAL H B 53 VAL H 1.0 2.0 5.6 713 337 A 76 VAL H A 53 VAL H 1.0 2.0 5.6 714 338 B 52 GLY H B 51 ALA HA 1.0 1.5 2.3 715 338 A 52 GLY H A 51 ALA HA 1.0 1.5 2.3 716 339 B 52 GLY H B 52 GLY HAx 1.0 1.7 3.1 717 339 A 52 GLY H A 52 GLY HAy 1.0 1.7 3.1 718 340 A 52 GLY H A 52 GLY HAx 1.0 1.6 3.0 719 340 B 52 GLY H B 52 GLY HAy 1.0 1.6 3.0 720 341 B 52 GLY H A 65 VAL HB 1.0 2.0 5.4 721 341 A 52 GLY H B 65 VAL HB 1.0 2.0 5.4 722 342 B 52 GLY H B 51 ALA HB1 1.0 1.7 3.1 723 342 A 52 GLY H A 51 ALA HB% 1.0 1.7 3.1 724 343 B 52 GLY H B 53 VAL HG11 1.0 2.0 5.6 725 343 A 52 GLY H A 53 VAL HGx% 1.0 2.0 5.6 726 344 A 52 GLY H B 65 VAL HG11 1.0 1.6 2.8 727 344 B 52 GLY H A 65 VAL HGx% 1.0 1.6 2.8 728 345 A 51 ALA H A 50 PHE HBx 1.0 1.8 3.4 729 345 B 51 ALA H B 50 PHE HBx 1.0 1.8 3.4 730 346 B 51 ALA HB1 B 51 ALA H 1.0 1.5 2.7 731 346 A 51 ALA H A 51 ALA HB% 1.0 1.5 2.7 732 347 B 51 ALA H B 50 PHE HA 1.0 1.6 2.6 733 347 A 51 ALA H A 50 PHE HA 1.0 1.6 2.6 734 348 B 51 ALA H B 51 ALA HA 1.0 1.7 3.1 735 348 A 51 ALA H A 51 ALA HA 1.0 1.7 3.1 736 349 B 50 PHE H B 50 PHE HBy 1.0 2.0 4.6 737 349 A 50 PHE H A 50 PHE HBy 1.0 2.0 4.6 738 350 B 67 THR HG21 A 50 PHE H 1.0 1.9 4.1 739 350 A 67 THR HG2% B 50 PHE H 1.0 1.9 4.1 740 351 B 50 PHE H B 49 PRO HGy 1.0 1.6 2.6 741 351 A 50 PHE H A 49 PRO HGx 1.0 1.6 2.6 742 352 B 46 VAL HG21 A 50 PHE H 1.0 2.0 6.0 743 352 B 50 PHE H A 46 VAL HGy% 1.0 2.0 6.0 744 353 A 50 PHE H A 50 PHE HA 1.0 1.6 3.0 745 353 B 50 PHE H B 50 PHE HA 1.0 1.6 3.0 746 354 A 50 PHE H A 49 PRO HA 1.0 1.8 3.8 747 354 B 49 PRO HA B 50 PHE H 1.0 1.8 3.8 748 355 B 50 PHE H B 49 PRO HBx 1.0 2.0 6.0 749 355 A 50 PHE H A 49 PRO HBx 1.0 2.0 6.0 750 356 A 50 PHE H A 49 PRO HGy 1.0 2.0 5.0 751 356 B 50 PHE H B 49 PRO HGx 1.0 2.0 5.0 752 357 B 48 ALA HB1 B 50 PHE H 1.0 1.8 3.4 753 357 A 50 PHE H A 48 ALA HB% 1.0 1.8 3.4 754 358 A 48 ALA H A 49 PRO HDy 1.0 2.0 5.2 755 358 B 48 ALA H B 49 PRO HDx 1.0 2.0 5.2 756 359 A 48 ALA H A 47 PRO HD3 1.0 0.0 6.0 757 359 B 48 ALA H A 69 SER HB3 1.0 0.0 6.0 758 359 A 48 ALA H B 69 SER HBy 1.0 0.0 6.0 759 359 B 48 ALA H B 47 PRO HDx 1.0 0.0 6.0 760 360 A 48 ALA H A 47 PRO HBy 1.0 1.8 3.4 761 360 B 48 ALA H B 47 PRO HBy 1.0 1.8 3.4 762 361 A 48 ALA H A 47 PRO HBx 1.0 1.8 3.6 763 361 B 48 ALA H B 47 PRO HBx 1.0 1.8 3.6 764 362 B 48 ALA H B 48 ALA HB1 1.0 1.5 2.5 765 362 A 48 ALA H A 48 ALA HB% 1.0 1.5 2.5 766 363 A 48 ALA H B 65 VAL HG21 1.0 1.9 4.3 767 363 A 48 ALA H B 71 ILE HD11 1.0 1.9 4.3 768 364 B 48 ALA H B 48 ALA HA 1.0 1.7 3.3 769 364 A 48 ALA H A 48 ALA HA 1.0 1.7 3.3 770 365 B 46 VAL H B 45 GLU HA 1.0 1.7 3.1 771 365 A 46 VAL H A 45 GLU HA 1.0 1.7 3.1 772 366 B 46 VAL H B 46 VAL HB 1.0 2.0 4.8 773 366 A 46 VAL H A 46 VAL HB 1.0 2.0 4.8 774 367 B 46 VAL H B 45 GLU HGy 1.0 2.0 5.8 775 367 A 46 VAL H A 45 GLU HG3 1.0 2.0 5.8 776 367 A 46 VAL H A 45 GLU HG2 1.0 2.0 5.8 777 367 B 46 VAL H B 45 GLU HGx 1.0 2.0 5.8 778 368 B 45 GLU H B 45 GLU HA 1.0 1.7 3.1 779 368 A 45 GLU H A 45 GLU HA 1.0 1.7 3.1 780 369 B 73 ILE HG21 B 73 ILE H 1.0 2.0 5.2 781 369 A 73 ILE H A 73 ILE HG2% 1.0 2.0 5.2 782 370 B 71 ILE H A 47 PRO HA 1.0 2.0 5.6 783 370 A 71 ILE H B 47 PRO HA 1.0 2.0 5.6 784 371 A 76 VAL H A 76 VAL HA 1.0 1.7 3.1 785 371 B 76 VAL H B 76 VAL HA 1.0 1.7 3.1 786 372 A 77 GLU H A 77 GLU HBy 1.0 1.7 3.5 787 372 B 77 GLU H B 77 GLU HBx 1.0 1.7 3.5 788 373 B 71 ILE H B 71 ILE HD11 1.0 2.0 6.0 789 373 A 71 ILE H A 71 ILE HD1% 1.0 2.0 6.0 790 374 A 66 LYS H A 66 LYS HG2 1.0 1.7 3.1 791 374 B 66 LYS HGx B 66 LYS H 1.0 1.7 3.1 792 374 B 66 LYS HGy B 66 LYS H 1.0 1.7 3.1 793 374 A 66 LYS H A 66 LYS HG3 1.0 1.7 3.1 794 375 A 57 LEU H A 57 LEU HDy% 1.0 1.9 4.7 795 375 B 57 LEU H B 57 LEU HD21 1.0 1.9 4.7 796 376 B 58 LYS H B 58 LYS HGx 1.0 1.9 3.9 797 376 A 58 LYS H A 58 LYS HGx 1.0 1.9 3.9 798 377 B 44 MET H B 46 VAL HG11 1.0 2.0 5.8 799 377 A 44 MET H A 46 VAL HGx% 1.0 2.0 5.8 800 378 B 46 VAL HG11 B 46 VAL H 1.0 1.8 3.8 801 378 A 46 VAL H A 46 VAL HGx% 1.0 1.8 3.8 802 379 B 74 PHE HA B 75 GLU H 1.0 1.7 3.1 803 379 A 74 PHE HA A 75 GLU H 1.0 1.7 3.1 804 380 B 74 PHE H B 74 PHE HA 1.0 1.8 4.0 805 380 A 74 PHE H A 74 PHE HA 1.0 1.8 4.0 806 381 B 74 PHE HA B 53 VAL H 1.0 1.9 4.9 807 381 A 53 VAL H A 74 PHE HA 1.0 1.9 4.9 808 382 B 56 GLU H B 74 PHE HA 1.0 2.0 5.8 809 382 A 56 GLU H A 74 PHE HA 1.0 2.0 5.8 810 383 B 77 GLU H B 76 VAL HA 1.0 1.4 2.4 811 383 A 77 GLU H A 76 VAL HA 1.0 1.4 2.4 812 384 B 75 GLU H B 74 PHE HD% 1.0 1.9 4.9 813 384 A 74 PHE HD% A 75 GLU H 1.0 1.9 4.9 814 385 B 74 PHE HE% B 74 PHE HD% 1.0 1.3 2.2 815 385 A 74 PHE HE% A 74 PHE HD% 1.0 1.3 2.2 816 386 A 50 PHE HE% A 50 PHE HZ 1.0 1.6 3.0 817 386 B 50 PHE HE% B 50 PHE HZ 1.0 1.6 3.0 818 387 B 74 PHE HA B 74 PHE HD% 1.0 1.5 2.7 819 387 A 74 PHE HD% A 74 PHE HA 1.0 1.5 2.7 820 388 B 74 PHE HE% B 74 PHE HA 1.0 0.0 6.0 821 388 A 74 PHE HE% A 74 PHE HA 1.0 0.0 6.0 822 389 B 74 PHE HBy B 74 PHE HD% 1.0 1.7 3.1 823 389 A 74 PHE HD% A 74 PHE HB3 1.0 1.7 3.1 824 389 B 74 PHE HBx B 74 PHE HD% 1.0 1.7 3.1 825 389 A 74 PHE HD% A 74 PHE HB2 1.0 1.7 3.1 826 389 B 74 PHE HBx B 50 PHE HZ 1.0 1.7 3.1 827 390 B 46 VAL HG11 A 50 PHE HZ 1.0 1.9 3.9 828 390 B 46 VAL HG11 A 74 PHE HD% 1.0 1.9 3.9 829 391 B 46 VAL HG11 A 50 PHE HE% 1.0 1.6 3.0 830 391 B 50 PHE HE% A 46 VAL HGx% 1.0 1.6 3.0 831 392 A 74 PHE HE% A 74 PHE HB3 1.0 2.0 5.2 832 392 B 74 PHE HBx B 74 PHE HE% 1.0 2.0 5.2 833 392 A 74 PHE HE% A 74 PHE HB2 1.0 2.0 5.2 834 393 A 74 PHE HE% A 74 PHE HZ 1.0 1.7 2.9 835 393 B 74 PHE HZ B 74 PHE HE% 1.0 1.7 2.9 836 394 B 50 PHE H B 74 PHE HE% 1.0 1.9 4.3 837 394 A 50 PHE H A 74 PHE HE% 1.0 1.9 4.3 838 395 B 50 PHE HE% B 50 PHE HA 1.0 0.0 6.0 839 395 A 50 PHE HE% A 50 PHE HA 1.0 0.0 6.0 840 396 A 63 ASP H A 63 ASP HA 1.0 1.7 3.1 841 396 B 63 ASP H B 63 ASP HA 1.0 1.7 3.1 842 397 B 42 ALA H B 42 ALA HA 1.0 1.5 2.5 843 397 A 42 ALA H A 42 ALA HA 1.0 1.5 2.5 844 398 A 57 LEU H A 56 GLU HA 1.0 1.6 2.8 845 398 B 57 LEU H B 56 GLU HA 1.0 1.6 2.8 846 399 A 63 ASP H A 62 GLY HAy 1.0 1.9 3.9 847 399 B 63 ASP H B 62 GLY HAy 1.0 1.9 3.9 848 400 B 49 PRO HA B 50 PHE HE% 1.0 0.0 6.0 849 400 A 50 PHE HE% A 49 PRO HA 1.0 0.0 6.0 850 401 A 50 PHE HD% A 49 PRO HA 1.0 1.9 4.1 851 401 B 49 PRO HA B 50 PHE HD% 1.0 1.9 4.1 852 401 A 50 PHE H A 49 PRO HA 1.0 1.9 4.1 853 401 B 49 PRO HA B 50 PHE H 1.0 1.9 4.1 854 402 A 70 LEU H A 69 SER HA 1.0 1.6 2.6 855 402 B 70 LEU H B 69 SER HA 1.0 1.6 2.6 856 403 B 48 ALA HA B 74 PHE HZ 1.0 1.9 4.5 857 403 A 74 PHE HZ A 48 ALA HA 1.0 1.9 4.5 858 404 B 71 ILE H B 70 LEU HA 1.0 1.6 2.8 859 404 A 71 ILE H A 70 LEU HA 1.0 1.6 2.8 860 405 B 74 PHE HD% B 52 GLY HAx 1.0 2.0 5.4 861 405 A 52 GLY HAy A 74 PHE HD% 1.0 2.0 5.4 862 406 A 52 GLY HAx A 74 PHE HD% 1.0 2.0 5.4 863 406 B 74 PHE HD% B 52 GLY HAy 1.0 2.0 5.4 864 407 A 52 GLY HAx A 53 VAL H 1.0 1.6 2.8 865 407 B 53 VAL H B 52 GLY HAy 1.0 1.6 2.8 866 408 A 74 PHE HE% A 54 VAL HA 1.0 1.8 3.8 867 408 B 74 PHE HE% B 54 VAL HA 1.0 1.8 3.8 868 409 A 74 PHE HD% A 54 VAL HA 1.0 1.6 2.8 869 409 B 74 PHE HD% B 54 VAL HA 1.0 1.6 2.8 870 410 B 74 PHE HA B 54 VAL HA 1.0 1.8 3.8 871 410 A 74 PHE HA A 54 VAL HA 1.0 1.8 3.8 872 411 A 50 PHE H A 49 PRO HDy 1.0 1.8 3.4 873 411 B 50 PHE H B 49 PRO HDx 1.0 1.8 3.4 874 412 A 50 PHE HE% A 50 PHE HBy 1.0 0.0 6.0 875 412 B 50 PHE HE% B 50 PHE HBy 1.0 0.0 6.0 876 413 B 50 PHE HE% B 50 PHE HBx 1.0 1.8 4.0 877 413 A 50 PHE HBx A 50 PHE HE% 1.0 1.8 4.0 878 414 B 68 GLY H B 68 GLY HAy 1.0 1.8 3.8 879 414 A 68 GLY H A 68 GLY HAx 1.0 1.8 3.8 880 415 A 69 SER H A 68 GLY HAx 1.0 2.0 4.4 881 415 B 69 SER H B 68 GLY HAy 1.0 2.0 4.4 882 416 B 74 PHE HBy B 50 PHE HD% 1.0 1.9 4.3 883 416 A 50 PHE HD% A 74 PHE HB3 1.0 1.9 4.3 884 416 B 74 PHE HBx B 50 PHE HD% 1.0 1.9 4.3 885 417 A 50 PHE HE% A 74 PHE HB3 1.0 1.8 3.8 886 417 B 74 PHE HBy B 50 PHE HE% 1.0 1.8 3.8 887 417 B 74 PHE HBx B 50 PHE HE% 1.0 1.8 3.8 888 418 B 74 PHE HBx B 74 PHE HA 1.0 1.8 3.6 889 418 A 74 PHE HA A 74 PHE HB2 1.0 1.8 3.6 890 418 A 74 PHE HA A 74 PHE HB3 1.0 1.8 3.6 891 418 B 74 PHE HBy B 74 PHE HA 1.0 1.8 3.6 892 419 B 50 PHE H B 49 PRO HDy 1.0 2.0 5.2 893 419 A 50 PHE H A 49 PRO HDx 1.0 2.0 5.2 894 420 B 60 ASN H B 60 ASN HBy 1.0 1.9 5.1 895 420 A 60 ASN H A 60 ASN HBx 1.0 1.9 5.1 896 421 A 61 VAL H A 60 ASN HBx 1.0 1.7 3.1 897 421 B 61 VAL H B 60 ASN HBy 1.0 1.7 3.1 898 422 A 60 ASN HBx A 60 ASN HD22 1.0 1.8 4.0 899 422 B 60 ASN HD2x B 60 ASN HBy 1.0 1.8 4.0 900 423 B 60 ASN HBy B 60 ASN HD2y 1.0 1.9 4.5 901 423 A 60 ASN HD21 A 60 ASN HBx 1.0 1.9 4.5 902 424 A 60 ASN H A 60 ASN HBy 1.0 1.7 3.1 903 424 B 60 ASN H B 60 ASN HBx 1.0 1.7 3.1 904 425 B 61 VAL H B 60 ASN HBx 1.0 1.9 4.7 905 425 A 61 VAL H A 60 ASN HBy 1.0 1.9 4.7 906 426 A 60 ASN HBy A 60 ASN HD22 1.0 1.7 3.5 907 426 B 60 ASN HD2x B 60 ASN HBx 1.0 1.7 3.5 908 427 B 60 ASN HBx B 60 ASN HD2y 1.0 1.8 3.8 909 427 A 60 ASN HD21 A 60 ASN HBy 1.0 1.8 3.8 910 428 B 50 PHE HD% A 44 MET HG2 1.0 0.0 6.0 911 428 A 50 PHE HD% B 44 MET HGx 1.0 0.0 6.0 912 428 B 50 PHE HD% A 44 MET HG3 1.0 0.0 6.0 913 428 A 50 PHE HD% B 44 MET HGy 1.0 0.0 6.0 914 429 B 76 VAL H B 76 VAL HB 1.0 1.8 3.4 915 429 A 76 VAL H A 76 VAL HB 1.0 1.8 3.4 916 430 B 74 PHE HE% B 72 MET HBy 1.0 1.7 3.3 917 430 A 74 PHE HE% A 72 MET HB3 1.0 1.7 3.3 918 430 A 74 PHE HE% A 72 MET HB2 1.0 1.7 3.3 919 430 B 74 PHE HE% B 72 MET HBx 1.0 1.7 3.3 920 431 A 74 PHE HZ A 72 MET HB3 1.0 1.8 3.8 921 431 A 74 PHE HZ A 72 MET HB2 1.0 1.8 3.8 922 431 B 74 PHE HZ B 72 MET HBy 1.0 1.8 3.8 923 431 B 74 PHE HZ B 72 MET HBx 1.0 1.8 3.8 924 432 A 65 VAL HB B 74 PHE HE% 1.0 1.8 3.8 925 432 A 74 PHE HE% B 65 VAL HB 1.0 1.8 3.8 926 433 A 74 PHE HE% A 49 PRO HGx 1.0 1.8 3.6 927 433 B 74 PHE HE% B 49 PRO HGx 1.0 1.8 3.6 928 434 B 48 ALA H B 48 ALA HB1 1.0 1.7 2.9 929 434 A 48 ALA H A 48 ALA HB% 1.0 1.7 2.9 930 435 B 48 ALA HB1 B 74 PHE HE% 1.0 1.7 3.3 931 435 A 74 PHE HE% A 48 ALA HB% 1.0 1.7 3.3 932 436 B 48 ALA HB1 B 74 PHE HZ 1.0 1.7 3.3 933 436 A 74 PHE HZ A 48 ALA HB% 1.0 1.7 3.3 934 437 A 50 PHE HD% A 76 VAL HGy% 1.0 1.7 3.3 935 437 B 76 VAL HG21 B 50 PHE HD% 1.0 1.7 3.3 936 438 B 54 VAL HG11 B 74 PHE HE% 1.0 0.0 6.0 937 438 A 74 PHE HE% A 54 VAL HGx% 1.0 0.0 6.0 938 439 B 54 VAL HG21 B 74 PHE HE% 1.0 1.7 3.1 939 439 A 74 PHE HE% A 54 VAL HGy% 1.0 1.7 3.1 940 440 B 76 VAL HG11 B 50 PHE HE% 1.0 1.7 3.1 941 440 A 50 PHE HE% A 76 VAL HGx% 1.0 1.7 3.1 942 441 B 76 VAL HG11 B 50 PHE HD% 1.0 1.7 3.5 943 441 A 50 PHE HD% A 76 VAL HGx% 1.0 1.7 3.5 944 442 B 50 PHE HE% B 49 PRO HGy 1.0 1.9 4.3 945 442 A 50 PHE HE% A 49 PRO HGy 1.0 1.9 4.3 946 443 B 50 PHE H B 49 PRO HGy 1.0 2.0 4.8 947 443 A 50 PHE H A 49 PRO HGy 1.0 2.0 4.8 948 443 B 50 PHE HD% B 49 PRO HGy 1.0 2.0 4.8 949 443 A 50 PHE HD% A 49 PRO HGy 1.0 2.0 4.8 950 444 B 46 VAL H B 46 VAL HG21 1.0 1.8 3.8 951 444 A 46 VAL H A 46 VAL HGy% 1.0 1.8 3.8 952 445 A 50 PHE HD% B 46 VAL HG21 1.0 2.0 5.0 953 445 B 50 PHE HD% A 46 VAL HGy% 1.0 2.0 5.0 954 445 B 50 PHE H A 46 VAL HGy% 1.0 2.0 5.0 955 445 B 46 VAL HG21 A 50 PHE H 1.0 2.0 5.0 956 446 B 50 PHE H B 51 ALA H 1.0 1.9 4.5 957 446 A 51 ALA H A 50 PHE H 1.0 1.9 4.5 958 447 A 73 ILE H A 56 GLU H 1.0 1.8 3.8 959 447 B 56 GLU H B 73 ILE H 1.0 1.8 3.8 960 448 B 63 ASP H B 64 LYS H 1.0 2.0 4.8 961 448 A 63 ASP H A 64 LYS H 1.0 2.0 4.8 962 449 A 78 GLY H A 79 ALA H 1.0 1.8 3.8 963 449 B 78 GLY H B 79 ALA H 1.0 1.8 3.8 964 450 B 44 MET H B 45 GLU H 1.0 1.9 4.7 965 450 A 45 GLU H A 44 MET H 1.0 1.9 4.7 966 451 B 74 PHE HBx B 75 GLU H 1.0 1.9 4.5 967 451 A 75 GLU H A 74 PHE HB2 1.0 1.9 4.5 968 451 B 74 PHE HBy B 75 GLU H 1.0 1.9 4.5 969 451 A 75 GLU H A 74 PHE HB3 1.0 1.9 4.5 970 452 B 75 GLU H B 53 VAL H 1.0 1.9 3.9 971 452 A 53 VAL H A 75 GLU H 1.0 1.9 3.9 972 453 B 74 PHE HE% B 75 GLU H 1.0 0.0 6.0 973 453 A 74 PHE HE% A 75 GLU H 1.0 0.0 6.0 974 454 A 44 MET H B 50 PHE HD% 1.0 2.0 5.8 975 454 B 44 MET H A 50 PHE HD% 1.0 2.0 5.8 976 455 B 42 ALA H B 43 SER HA 1.0 2.0 6.0 977 455 A 42 ALA H A 43 SER HA 1.0 2.0 6.0 978 456 A 60 ASN HA A 60 ASN HD22 1.0 1.9 4.1 979 456 B 60 ASN HD2x B 60 ASN HA 1.0 1.9 4.1 980 457 A 74 PHE HE% A 73 ILE HA 1.0 1.9 4.5 981 457 B 74 PHE HE% B 73 ILE HA 1.0 1.9 4.5 982 458 B 48 ALA HA B 74 PHE HE% 1.0 2.0 5.6 983 458 A 74 PHE HE% A 48 ALA HA 1.0 2.0 5.6 984 459 B 74 PHE HE% B 49 PRO HDy 1.0 2.0 5.8 985 459 A 74 PHE HE% A 49 PRO HDx 1.0 2.0 5.8 986 460 B 46 VAL HG21 A 50 PHE HZ 1.0 1.9 5.1 987 460 B 46 VAL HG21 A 74 PHE HD% 1.0 1.9 5.1 988 461 A 46 VAL HGx% B 50 PHE HZ 1.0 1.8 3.8 989 461 A 46 VAL HGx% B 74 PHE HD% 1.0 1.8 3.8 990 462 B 46 VAL HG11 B 46 VAL HA 1.0 1.6 3.0 991 462 A 46 VAL HGx% A 46 VAL HA 1.0 1.6 3.0 992 463 B 46 VAL HG11 B 45 GLU HA 1.0 1.9 4.3 993 463 A 46 VAL HGx% A 45 GLU HA 1.0 1.9 4.3 994 464 A 46 VAL HGx% B 71 ILE HB 1.0 0.0 6.0 995 464 A 46 VAL HGx% B 72 MET HBy 1.0 0.0 6.0 996 464 A 46 VAL HGx% B 72 MET HBx 1.0 0.0 6.0 997 465 B 46 VAL HG11 B 46 VAL HB 1.0 1.6 2.8 998 465 A 46 VAL HGx% A 46 VAL HB 1.0 1.6 2.8 999 466 B 46 VAL HG11 A 71 ILE HD1% 1.0 1.9 4.3 1000 466 A 46 VAL HGx% B 71 ILE HD11 1.0 1.9 4.3 1001 467 A 46 VAL HGx% A 46 VAL HGy% 1.0 1.5 2.5 1002 467 B 46 VAL HG11 B 46 VAL HG21 1.0 1.5 2.5 1003 468 B 65 VAL HG21 B 65 VAL HG11 1.0 1.5 2.5 1004 468 A 65 VAL HGx% A 65 VAL HGy% 1.0 1.5 2.5 1005 469 B 46 VAL HG21 B 46 VAL HA 1.0 1.9 3.7 1006 469 A 46 VAL HGy% A 46 VAL HA 1.0 1.9 3.7 1007 470 B 46 VAL HG21 B 47 PRO HDx 1.0 2.0 5.4 1008 470 A 46 VAL HGy% A 47 PRO HD2 1.0 2.0 5.4 1009 470 A 46 VAL HGy% A 47 PRO HD3 1.0 2.0 5.4 1010 470 B 46 VAL HG21 B 47 PRO HDy 1.0 2.0 5.4 1011 471 A 46 VAL HGy% B 71 ILE HB 1.0 1.8 4.0 1012 471 A 46 VAL HGy% B 72 MET HBy 1.0 1.8 4.0 1013 471 A 46 VAL HGy% B 72 MET HBx 1.0 1.8 4.0 1014 472 B 46 VAL HG21 B 46 VAL HB 1.0 1.7 2.9 1015 472 A 46 VAL HGy% A 46 VAL HB 1.0 1.7 2.9 1016 473 A 46 VAL HGy% B 71 ILE HD11 1.0 1.6 2.8 1017 473 B 46 VAL HG21 A 71 ILE HD1% 1.0 1.6 2.8 1018 474 A 65 VAL HB A 65 VAL HGx% 1.0 1.5 2.7 1019 474 B 65 VAL HG11 B 65 VAL HB 1.0 1.5 2.7 1020 475 B 50 PHE HE% B 53 VAL H 1.0 2.0 6.0 1021 475 A 50 PHE HE% A 53 VAL H 1.0 2.0 6.0 1022 476 A 73 ILE H A 74 PHE HE% 1.0 0.0 6.0 1023 476 B 74 PHE HE% B 73 ILE H 1.0 0.0 6.0 1024 477 A 63 ASP H A 60 ASN H 1.0 0.0 6.0 1025 477 B 63 ASP H B 60 ASN H 1.0 0.0 6.0 1026 478 A 60 ASN H A 60 ASN HD22 1.0 2.0 4.6 1027 478 B 60 ASN H B 60 ASN HD2x 1.0 2.0 4.6 1028 479 B 57 LEU H B 56 GLU H 1.0 2.0 4.8 1029 479 A 57 LEU H A 56 GLU H 1.0 2.0 4.8 1030 480 A 62 GLY H B 74 PHE HE% 1.0 0.0 6.0 1031 480 A 74 PHE HE% B 62 GLY H 1.0 0.0 6.0 1032 481 B 50 PHE HE% A 44 MET HG2 1.0 1.8 3.8 1033 481 B 50 PHE HE% A 44 MET HG3 1.0 1.8 3.8 1034 481 A 50 PHE HE% B 44 MET HGy 1.0 1.8 3.8 1035 481 A 50 PHE HE% B 44 MET HGx 1.0 1.8 3.8 1036 482 B 50 PHE HE% B 49 PRO HDy 1.0 2.0 6.0 1037 482 A 50 PHE HE% A 49 PRO HDx 1.0 2.0 6.0 1038 483 A 50 PHE HD% A 51 ALA HA 1.0 1.9 4.9 1039 483 B 50 PHE HD% B 51 ALA HA 1.0 1.9 4.9 1040 484 A 50 PHE HD% A 76 VAL HA 1.0 2.0 5.8 1041 484 B 50 PHE HD% B 76 VAL HA 1.0 2.0 5.8 1042 485 B 65 VAL HG11 A 54 VAL HA 1.0 2.0 5.4 1043 485 A 65 VAL HGx% B 54 VAL HA 1.0 2.0 5.4 1044 486 B 49 PRO HDx B 49 PRO HGy 1.0 1.9 4.3 1045 486 A 49 PRO HGy A 49 PRO HDy 1.0 1.9 4.3 1046 487 A 49 PRO HGy A 49 PRO HDx 1.0 1.8 3.4 1047 487 B 49 PRO HDy B 49 PRO HGy 1.0 1.8 3.4 1048 488 A 46 VAL HGx% A 47 PRO HD2 1.0 2.0 6.0 1049 488 B 46 VAL HG11 B 47 PRO HDx 1.0 2.0 6.0 1050 488 A 46 VAL HGx% A 47 PRO HD3 1.0 2.0 6.0 1051 488 B 46 VAL HG11 B 47 PRO HDy 1.0 2.0 6.0 1052 489 A 46 VAL HGy% B 50 PHE HZ 1.0 2.0 5.0 1053 489 A 46 VAL HGy% B 74 PHE HD% 1.0 2.0 5.0 1054 490 A 49 PRO HGx A 49 PRO HDy 1.0 1.7 3.1 1055 490 B 49 PRO HDx B 49 PRO HGx 1.0 1.7 3.1 1056 491 B 63 ASP HBy B 63 ASP HBx 1.0 0.0 6.0 1057 491 A 63 ASP HBx A 63 ASP HBy 1.0 0.0 6.0 1058 492 B 59 VAL HG11 B 59 VAL HB 1.0 1.5 2.5 1059 492 A 59 VAL HGx% A 59 VAL HB 1.0 1.5 2.5 1060 493 A 45 GLU HG3 A 45 GLU HA 1.0 2.0 5.0 1061 493 A 45 GLU HG2 A 45 GLU HA 1.0 2.0 5.0 1062 493 B 45 GLU HGx B 45 GLU HA 1.0 2.0 5.0 1063 493 B 45 GLU HGy B 45 GLU HA 1.0 2.0 5.0 1064 494 A 49 PRO HDy A 49 PRO HDx 1.0 0.0 6.0 1065 494 B 49 PRO HDx B 49 PRO HDy 1.0 0.0 6.0 1066 495 B 46 VAL HG21 A 50 PHE HE% 1.0 1.9 5.3 1067 495 B 50 PHE HE% A 46 VAL HGy% 1.0 1.9 5.3 1068 496 B 53 VAL H B 74 PHE HD% 1.0 1.9 4.7 1069 496 A 74 PHE HD% A 53 VAL H 1.0 1.9 4.7 1070 497 B 49 PRO HDx B 49 PRO HBx 1.0 2.0 5.2 1071 497 A 49 PRO HDy A 49 PRO HBy 1.0 2.0 5.2 1072 498 A 65 VAL HGx% B 50 PHE HE% 1.0 2.0 5.8 1073 498 A 50 PHE HE% B 65 VAL HG11 1.0 2.0 5.8 1074 499 A 50 PHE HE% A 71 ILE HD1% 1.0 2.0 5.4 1075 499 B 50 PHE HE% A 65 VAL HGy% 1.0 2.0 5.4 1076 499 B 50 PHE HE% A 71 ILE HD1% 1.0 2.0 5.4 1077 499 B 65 VAL HG21 A 50 PHE HE% 1.0 2.0 5.4 1078 500 A 74 PHE HD% A 55 LYS H 1.0 1.9 4.5 1079 500 B 55 LYS H B 74 PHE HD% 1.0 1.9 4.5 1080 501 B 74 PHE H B 74 PHE HD% 1.0 1.9 3.9 1081 501 A 74 PHE H A 74 PHE HD% 1.0 1.9 3.9 1082 502 B 71 ILE HD11 A 71 ILE HG2% 1.0 2.0 4.0 1083 502 B 71 ILE HG21 A 71 ILE HG2% 1.0 2.0 4.0 1084 502 A 71 ILE HD1% B 71 ILE HG21 1.0 2.0 4.0 1085 502 A 71 ILE HD1% B 71 ILE HD11 1.0 2.0 4.0 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 2 VAL C A 3 LYS N A 3 LYS CA A 3 LYS C 1.0 -142.0 -54.0 PHI 2 2 B 2 VAL C B 3 LYS N B 3 LYS CA B 3 LYS C 1.0 -142.0 -54.0 PHI 3 3 A 3 LYS N A 3 LYS CA A 3 LYS C A 4 GLU N 1.0 123.0 163.0 PSI 4 4 B 3 LYS N B 3 LYS CA B 3 LYS C B 4 GLU N 1.0 123.0 163.0 PSI 5 5 A 3 LYS C A 4 GLU N A 4 GLU CA A 4 GLU C 1.0 -85.5 -45.5 PHI 6 6 B 3 LYS C B 4 GLU N B 4 GLU CA B 4 GLU C 1.0 -85.5 -45.5 PHI 7 7 A 4 GLU N A 4 GLU CA A 4 GLU C A 5 VAL N 1.0 125.8 165.8 PSI 8 8 B 4 GLU N B 4 GLU CA B 4 GLU C B 5 VAL N 1.0 125.8 165.8 PSI 9 9 A 25 GLY C A 26 ASP N A 26 ASP CA A 26 ASP C 1.0 -145.3 -44.1 PHI 10 10 B 25 GLY C B 26 ASP N B 26 ASP CA B 26 ASP C 1.0 -145.3 -44.1 PHI 11 11 A 26 ASP N A 26 ASP CA A 26 ASP C A 27 LYS N 1.0 80.4 188.6 PSI 12 12 B 26 ASP N B 26 ASP CA B 26 ASP C B 27 LYS N 1.0 80.4 188.6 PSI 13 13 A 39 GLY C A 40 ASP N A 40 ASP CA A 40 ASP C 1.0 -180.1 -24.9 PHI 14 14 B 39 GLY C B 40 ASP N B 40 ASP CA B 40 ASP C 1.0 -180.1 -24.9 PHI 15 15 A 40 ASP N A 40 ASP CA A 40 ASP C A 41 LYS N 1.0 112.9 152.9 PSI 16 16 B 40 ASP N B 40 ASP CA B 40 ASP C B 41 LYS N 1.0 112.9 152.9 PSI 17 17 A 42 ALA C A 43 SER N A 43 SER CA A 43 SER C 1.0 -143.0 -59.0 PHI 18 18 B 42 ALA C B 43 SER N B 43 SER CA B 43 SER C 1.0 -143.0 -59.0 PHI 19 19 A 43 SER N A 43 SER CA A 43 SER C A 44 MET N 1.0 106.0 146.0 PSI 20 20 B 43 SER N B 43 SER CA B 43 SER C B 44 MET N 1.0 106.0 146.0 PSI 21 21 A 43 SER C A 44 MET N A 44 MET CA A 44 MET C 1.0 -178.0 -50.0 PHI 22 22 B 43 SER C B 44 MET N B 44 MET CA B 44 MET C 1.0 -178.0 -50.0 PHI 23 23 A 44 MET N A 44 MET CA A 44 MET C A 45 GLU N 1.0 120.0 160.0 PSI 24 24 B 44 MET N B 44 MET CA B 44 MET C B 45 GLU N 1.0 120.0 160.0 PSI 25 25 A 46 VAL C A 47 PRO N A 47 PRO CA A 47 PRO C 1.0 -144.0 -104.0 PHI 26 26 B 46 VAL C B 47 PRO N B 47 PRO CA B 47 PRO C 1.0 -144.0 -104.0 PHI 27 27 A 47 PRO N A 47 PRO CA A 47 PRO C A 48 ALA N 1.0 135.0 175.0 PSI 28 28 B 47 PRO N B 47 PRO CA B 47 PRO C B 48 ALA N 1.0 135.0 175.0 PSI 29 29 A 47 PRO C A 48 ALA N A 48 ALA CA A 48 ALA C 1.0 -179.0 -47.0 PHI 30 30 B 47 PRO C B 48 ALA N B 48 ALA CA B 48 ALA C 1.0 -179.0 -47.0 PHI 31 31 A 48 ALA N A 48 ALA CA A 48 ALA C A 49 PRO N 1.0 119.0 159.0 PSI 32 32 B 48 ALA N B 48 ALA CA B 48 ALA C B 49 PRO N 1.0 119.0 159.0 PSI 33 33 A 49 PRO C A 50 PHE N A 50 PHE CA A 50 PHE C 1.0 -150.0 -110.0 PHI 34 34 B 49 PRO C B 50 PHE N B 50 PHE CA B 50 PHE C 1.0 -150.0 -110.0 PHI 35 35 A 50 PHE N A 50 PHE CA A 50 PHE C A 51 ALA N 1.0 140.0 180.0 PSI 36 36 B 50 PHE N B 50 PHE CA B 50 PHE C B 51 ALA N 1.0 140.0 180.0 PSI 37 37 A 52 GLY C A 53 VAL N A 53 VAL CA A 53 VAL C 1.0 -138.0 -98.0 PHI 38 38 B 52 GLY C B 53 VAL N B 53 VAL CA B 53 VAL C 1.0 -138.0 -98.0 PHI 39 39 A 53 VAL N A 53 VAL CA A 53 VAL C A 54 VAL N 1.0 113.0 153.0 PSI 40 40 B 53 VAL N B 53 VAL CA B 53 VAL C B 54 VAL N 1.0 113.0 153.0 PSI 41 41 A 53 VAL C A 54 VAL N A 54 VAL CA A 54 VAL C 1.0 -160.0 -72.0 PHI 42 42 B 53 VAL C B 54 VAL N B 54 VAL CA B 54 VAL C 1.0 -160.0 -72.0 PHI 43 43 A 54 VAL N A 54 VAL CA A 54 VAL C A 55 LYS N 1.0 100.0 140.0 PSI 44 44 B 54 VAL N B 54 VAL CA B 54 VAL C B 55 LYS N 1.0 100.0 140.0 PSI 45 45 A 58 LYS C A 59 VAL N A 59 VAL CA A 59 VAL C 1.0 -159.0 -119.0 PHI 46 46 B 58 LYS C B 59 VAL N B 59 VAL CA B 59 VAL C 1.0 -159.0 -119.0 PHI 47 47 A 59 VAL N A 59 VAL CA A 59 VAL C A 60 ASN N 1.0 140.0 180.0 PSI 48 48 B 59 VAL N B 59 VAL CA B 59 VAL C B 60 ASN N 1.0 140.0 180.0 PSI 49 49 A 59 VAL C A 60 ASN N A 60 ASN CA A 60 ASN C 1.0 -128.0 -88.0 PHI 50 50 B 59 VAL C B 60 ASN N B 60 ASN CA B 60 ASN C 1.0 -128.0 -88.0 PHI 51 51 A 60 ASN N A 60 ASN CA A 60 ASN C A 61 VAL N 1.0 111.0 151.0 PSI 52 52 B 60 ASN N B 60 ASN CA B 60 ASN C B 61 VAL N 1.0 111.0 151.0 PSI 53 53 A 60 ASN C A 61 VAL N A 61 VAL CA A 61 VAL C 1.0 -151.0 -19.0 PHI 54 54 B 60 ASN C B 61 VAL N B 61 VAL CA B 61 VAL C 1.0 -151.0 -19.0 PHI 55 55 A 61 VAL N A 61 VAL CA A 61 VAL C A 62 GLY N 1.0 120.0 160.0 PSI 56 56 B 61 VAL N B 61 VAL CA B 61 VAL C B 62 GLY N 1.0 120.0 160.0 PSI 57 57 A 63 ASP C A 64 LYS N A 64 LYS CA A 64 LYS C 1.0 -155.0 -39.0 PHI 58 58 B 63 ASP C B 64 LYS N B 64 LYS CA B 64 LYS C 1.0 -155.0 -39.0 PHI 59 59 A 64 LYS N A 64 LYS CA A 64 LYS C A 65 VAL N 1.0 82.0 186.0 PSI 60 60 B 64 LYS N B 64 LYS CA B 64 LYS C B 65 VAL N 1.0 82.0 186.0 PSI 61 61 A 64 LYS C A 65 VAL N A 65 VAL CA A 65 VAL C 1.0 -149.0 -109.0 PHI 62 62 B 64 LYS C B 65 VAL N B 65 VAL CA B 65 VAL C 1.0 -149.0 -109.0 PHI 63 63 A 65 VAL N A 65 VAL CA A 65 VAL C A 66 LYS N 1.0 136.0 176.0 PSI 64 64 B 65 VAL N B 65 VAL CA B 65 VAL C B 66 LYS N 1.0 136.0 176.0 PSI 65 65 A 65 VAL C A 66 LYS N A 66 LYS CA A 66 LYS C 1.0 -144.0 -104.0 PHI 66 66 B 65 VAL C B 66 LYS N B 66 LYS CA B 66 LYS C 1.0 -144.0 -104.0 PHI 67 67 A 66 LYS N A 66 LYS CA A 66 LYS C A 67 THR N 1.0 122.0 162.0 PSI 68 68 B 66 LYS N B 66 LYS CA B 66 LYS C B 67 THR N 1.0 122.0 162.0 PSI 69 69 A 66 LYS C A 67 THR N A 67 THR CA A 67 THR C 1.0 -109.0 -21.0 PHI 70 70 B 66 LYS C B 67 THR N B 67 THR CA B 67 THR C 1.0 -109.0 -21.0 PHI 71 71 A 67 THR N A 67 THR CA A 67 THR C A 68 GLY N 1.0 113.0 153.0 PSI 72 72 B 67 THR N B 67 THR CA B 67 THR C B 68 GLY N 1.0 113.0 153.0 PSI 73 73 A 67 THR C A 68 GLY N A 68 GLY CA A 68 GLY C 1.0 74.0 114.0 PHI 74 74 B 67 THR C B 68 GLY N B 68 GLY CA B 68 GLY C 1.0 74.0 114.0 PHI 75 75 A 68 GLY N A 68 GLY CA A 68 GLY C A 69 SER N 1.0 -35.0 5.0 PSI 76 76 B 68 GLY N B 68 GLY CA B 68 GLY C B 69 SER N 1.0 -35.0 5.0 PSI 77 77 A 68 GLY C A 69 SER N A 69 SER CA A 69 SER C 1.0 -142.0 -34.0 PHI 78 78 B 68 GLY C B 69 SER N B 69 SER CA B 69 SER C 1.0 -142.0 -34.0 PHI 79 79 A 69 SER N A 69 SER CA A 69 SER C A 70 LEU N 1.0 103.0 191.0 PSI 80 80 B 69 SER N B 69 SER CA B 69 SER C B 70 LEU N 1.0 103.0 191.0 PSI 81 81 A 71 ILE C A 72 MET N A 72 MET CA A 72 MET C 1.0 -168.0 -128.0 PHI 82 82 B 71 ILE C B 72 MET N B 72 MET CA B 72 MET C 1.0 -168.0 -128.0 PHI 83 83 A 72 MET N A 72 MET CA A 72 MET C A 73 ILE N 1.0 134.0 174.0 PSI 84 84 B 72 MET N B 72 MET CA B 72 MET C B 73 ILE N 1.0 134.0 174.0 PSI 85 85 A 72 MET C A 73 ILE N A 73 ILE CA A 73 ILE C 1.0 -137.0 -97.0 PHI 86 86 B 72 MET C B 73 ILE N B 73 ILE CA B 73 ILE C 1.0 -137.0 -97.0 PHI 87 87 A 73 ILE N A 73 ILE CA A 73 ILE C A 74 PHE N 1.0 109.0 149.0 PSI 88 88 B 73 ILE N B 73 ILE CA B 73 ILE C B 74 PHE N 1.0 109.0 149.0 PSI 89 89 A 73 ILE C A 74 PHE N A 74 PHE CA A 74 PHE C 1.0 -127.0 -87.0 PHI 90 90 B 73 ILE C B 74 PHE N B 74 PHE CA B 74 PHE C 1.0 -127.0 -87.0 PHI 91 91 A 74 PHE N A 74 PHE CA A 74 PHE C A 75 GLU N 1.0 121.0 161.0 PSI 92 92 B 74 PHE N B 74 PHE CA B 74 PHE C B 75 GLU N 1.0 121.0 161.0 PSI 93 93 A 74 PHE C A 75 GLU N A 75 GLU CA A 75 GLU C 1.0 -161.0 -77.0 PHI 94 94 B 74 PHE C B 75 GLU N B 75 GLU CA B 75 GLU C 1.0 -161.0 -77.0 PHI 95 95 A 75 GLU N A 75 GLU CA A 75 GLU C A 76 VAL N 1.0 93.0 177.0 PSI 96 96 B 75 GLU N B 75 GLU CA B 75 GLU C B 76 VAL N 1.0 93.0 177.0 PSI 97 97 A 75 GLU C A 76 VAL N A 76 VAL CA A 76 VAL C 1.0 -159.0 -75.0 PHI 98 98 B 75 GLU C B 76 VAL N B 76 VAL CA B 76 VAL C 1.0 -159.0 -75.0 PHI 99 99 A 76 VAL N A 76 VAL CA A 76 VAL C A 77 GLU N 1.0 118.0 158.0 PSI 100 100 B 76 VAL N B 76 VAL CA B 76 VAL C B 77 GLU N 1.0 118.0 158.0 PSI 101 101 A 78 GLY C A 79 ALA N A 79 ALA CA A 79 ALA C 1.0 -156.0 -28.0 PHI 102 102 B 78 GLY C B 79 ALA N B 79 ALA CA B 79 ALA C 1.0 -156.0 -28.0 PHI 103 103 A 79 ALA N A 79 ALA CA A 79 ALA C A 80 ALA N 1.0 117.0 157.0 PSI 104 104 B 79 ALA N B 79 ALA CA B 79 ALA C B 80 ALA N 1.0 117.0 157.0 PSI 105 105 A 79 ALA C A 80 ALA N A 80 ALA CA A 80 ALA C 1.0 -98.0 -58.0 PHI 106 106 B 79 ALA C B 80 ALA N B 80 ALA CA B 80 ALA C 1.0 -98.0 -58.0 PHI 107 107 A 80 ALA N A 80 ALA CA A 80 ALA C A 81 PRO N 1.0 125.0 165.0 PSI 108 108 B 80 ALA N B 80 ALA CA B 80 ALA C B 81 PRO N 1.0 125.0 165.0 PSI stop_ save_