data_nef_c18112_2lmd 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 GLY middle . false 3 A 3 HIS middle . . 4 A 4 HIS middle . . 5 A 5 HIS middle . . 6 A 6 HIS middle . . 7 A 7 HIS middle . . 8 A 8 HIS middle . . 9 A 9 SER middle . . 10 A 10 HIS middle . . 11 A 11 MET middle . . 12 A 12 ALA middle . . 13 A 13 MET middle . . 14 A 14 GLN middle . . 15 A 15 GLU middle . . 16 A 16 GLY middle . false 17 A 17 LEU middle . . 18 A 18 SER middle . . 19 A 19 PRO middle . false 20 A 20 ASN middle . . 21 A 21 HIS middle . . 22 A 22 LEU middle . . 23 A 23 LYS middle . . 24 A 24 LYS middle . . 25 A 25 ALA middle . . 26 A 26 LYS middle . . 27 A 27 LEU middle . . 28 A 28 MET middle . . 29 A 29 PHE middle . . 30 A 30 PHE middle . . 31 A 31 TYR middle . . 32 A 32 THR middle . . 33 A 33 ARG middle . . 34 A 34 TYR middle . . 35 A 35 PRO middle . false 36 A 36 SER middle . . 37 A 37 SER middle . . 38 A 38 ASN middle . . 39 A 39 MET middle . . 40 A 40 LEU middle . . 41 A 41 LYS middle . . 42 A 42 THR middle . . 43 A 43 TYR middle . . 44 A 44 PHE middle . . 45 A 45 SER middle . . 46 A 46 ASP middle . . 47 A 47 VAL middle . . 48 A 48 LYS middle . . 49 A 49 PHE middle . . 50 A 50 ASN middle . . 51 A 51 ARG middle . . 52 A 52 CYS middle . . 53 A 53 ILE middle . . 54 A 54 THR middle . . 55 A 55 SER middle . . 56 A 56 GLN middle . . 57 A 57 LEU middle . . 58 A 58 ILE middle . . 59 A 59 LYS middle . . 60 A 60 TRP middle . . 61 A 61 PHE middle . . 62 A 62 SER middle . . 63 A 63 ASN middle . . 64 A 64 PHE middle . . 65 A 65 ARG middle . . 66 A 66 GLU middle . . 67 A 67 PHE middle . . 68 A 68 TYR middle . . 69 A 69 TYR middle . . 70 A 70 ILE middle . . 71 A 71 GLN middle . . 72 A 72 MET middle . . 73 A 73 GLU middle . . 74 A 74 LYS middle . . 75 A 75 TYR middle . . 76 A 76 ALA middle . . 77 A 77 ARG middle . . 78 A 78 GLN middle . . 79 A 79 ALA middle . . 80 A 80 ILE middle . . 81 A 81 ASN middle . . 82 A 82 ASP middle . . 83 A 83 GLY middle . false 84 A 84 VAL middle . . 85 A 85 THR middle . . 86 A 86 SER middle . . 87 A 87 THR middle . . 88 A 88 GLU middle . . 89 A 89 GLU middle . . 90 A 90 LEU middle . . 91 A 91 SER middle . . 92 A 92 ILE middle . . 93 A 93 THR middle . . 94 A 94 ARG middle . . 95 A 95 ASP middle . . 96 A 96 CYS middle . . 97 A 97 GLU middle . . 98 A 98 LEU middle . . 99 A 99 TYR middle . . 100 A 100 ARG middle . . 101 A 101 ALA middle . . 102 A 102 LEU middle . . 103 A 103 ASN middle . . 104 A 104 MET middle . . 105 A 105 HIS middle . . 106 A 106 TYR middle . . 107 A 107 ASN middle . . 108 A 108 LYS middle . . 109 A 109 ALA middle . . 110 A 110 ASN middle . . 111 A 111 ASP middle . . 112 A 112 PHE middle . . 113 A 113 GLU middle . . 114 A 114 VAL middle . . 115 A 115 PRO middle . false 116 A 116 GLU middle . . 117 A 117 ARG middle . . 118 A 118 PHE middle . . 119 A 119 LEU middle . . 120 A 120 GLU middle . . 121 A 121 VAL middle . . 122 A 122 ALA middle . . 123 A 123 GLN middle . . 124 A 124 ILE middle . . 125 A 125 THR middle . . 126 A 126 LEU middle . . 127 A 127 ARG middle . . 128 A 128 GLU middle . . 129 A 129 PHE middle . . 130 A 130 PHE middle . . 131 A 131 ASN middle . . 132 A 132 ALA middle . . 133 A 133 ILE middle . . 134 A 134 ILE middle . . 135 A 135 ALA middle . . 136 A 136 GLY middle . false 137 A 137 LYS middle . . 138 A 138 ASP middle . . 139 A 139 VAL middle . . 140 A 140 ASP middle . . 141 A 141 PRO middle . false 142 A 142 SER middle . . 143 A 143 TRP middle . . 144 A 144 LYS middle . . 145 A 145 LYS middle . . 146 A 146 ALA middle . . 147 A 147 ILE middle . . 148 A 148 TYR middle . . 149 A 149 LYS middle . . 150 A 150 VAL middle . . 151 A 151 ILE middle . . 152 A 152 CYS middle . . 153 A 153 LYS middle . . 154 A 154 LEU middle . . 155 A 155 ASP middle . . 156 A 156 SER middle . . 157 A 157 GLU middle . . 158 A 158 VAL middle . . 159 A 159 PRO middle . false 160 A 160 GLU middle . . 161 A 161 ILE middle . . 162 A 162 PHE middle . . 163 A 163 LYS middle . . 164 A 164 SER middle . . 165 A 165 PRO middle . false 166 A 166 ASN middle . . 167 A 167 CYS middle . . 168 A 168 LEU middle . . 169 A 169 GLN middle . . 170 A 170 GLU middle . . 171 A 171 LEU middle . . 172 A 172 LEU middle . . 173 A 173 HIS middle . . 174 A 174 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 12 ALA H H 1 8.311 0.020 A 12 ALA HB% H 1 1.349 0.020 A 12 ALA C C 13 177.566 0.400 A 12 ALA CA C 13 52.067 0.400 A 12 ALA CB C 13 18.456 0.400 A 12 ALA N N 15 125.167 0.400 A 13 MET H H 1 8.269 0.020 A 13 MET HE% H 1 2.018 0.020 A 13 MET C C 13 176.325 0.400 A 13 MET CA C 13 54.992 0.400 A 13 MET CB C 13 32.308 0.400 A 13 MET CE C 13 17.003 0.400 A 13 MET N N 15 119.278 0.400 A 14 GLN H H 1 8.501 0.020 A 14 GLN HA H 1 4.399 0.020 A 14 GLN HBy H 1 2.181 0.020 A 14 GLN HBx H 1 2.002 0.020 A 14 GLN C C 13 175.644 0.400 A 14 GLN CA C 13 55.139 0.400 A 14 GLN CB C 13 29.051 0.400 A 14 GLN N N 15 120.869 0.400 A 15 GLU H H 1 8.547 0.020 A 15 GLU C C 13 176.242 0.400 A 15 GLU CA C 13 56.064 0.400 A 15 GLU CB C 13 29.302 0.400 A 15 GLU N N 15 122.042 0.400 A 16 GLY H H 1 8.100 0.020 A 16 GLY C C 13 172.949 0.400 A 16 GLY CA C 13 44.227 0.400 A 16 GLY N N 15 108.821 0.400 A 17 LEU H H 1 8.222 0.020 A 17 LEU HD1% H 1 0.094 0.020 A 17 LEU HD2% H 1 0.278 0.020 A 17 LEU C C 13 177.334 0.400 A 17 LEU CA C 13 53.544 0.400 A 17 LEU CB C 13 42.140 0.400 A 17 LEU CD1 C 13 25.201 0.400 A 17 LEU CD2 C 13 22.934 0.400 A 17 LEU N N 15 120.315 0.400 A 18 SER H H 1 11.627 0.020 A 18 SER CA C 13 56.851 0.400 A 18 SER CB C 13 64.636 0.400 A 18 SER N N 15 126.547 0.400 A 19 PRO C C 13 175.118 0.400 A 20 ASN H H 1 8.172 0.020 A 20 ASN N N 15 121.372 0.400 A 21 HIS HD2 H 1 7.649 0.020 A 21 HIS HE1 H 1 7.771 0.020 A 21 HIS CD2 C 13 116.511 0.400 A 21 HIS CE1 C 13 138.137 0.400 A 22 LEU HD1% H 1 -0.350 0.020 A 22 LEU HD2% H 1 0.474 0.020 A 22 LEU CD1 C 13 20.649 0.400 A 22 LEU CD2 C 13 25.182 0.400 A 25 ALA HB% H 1 1.976 0.020 A 25 ALA CB C 13 18.020 0.400 A 26 LYS H H 1 6.794 0.020 A 26 LYS CA C 13 56.146 0.400 A 26 LYS N N 15 118.490 0.400 A 27 LEU HD1% H 1 0.815 0.020 A 27 LEU HD2% H 1 0.875 0.020 A 27 LEU CD1 C 13 23.410 0.400 A 27 LEU CD2 C 13 24.920 0.400 A 28 MET HE% H 1 1.662 0.020 A 28 MET CE C 13 15.658 0.400 A 31 TYR HA H 1 4.398 0.020 A 31 TYR HB2 H 1 2.755 0.020 A 31 TYR HB3 H 1 2.755 0.020 A 31 TYR C C 13 173.714 0.400 A 31 TYR CA C 13 59.757 0.400 A 32 THR H H 1 8.237 0.020 A 32 THR HA H 1 4.209 0.020 A 32 THR HB H 1 4.222 0.020 A 32 THR HG2% H 1 0.887 0.020 A 32 THR C C 13 171.061 0.400 A 32 THR CA C 13 56.905 0.400 A 32 THR CB C 13 69.707 0.400 A 32 THR CG2 C 13 21.463 0.400 A 32 THR N N 15 111.928 0.400 A 33 ARG H H 1 9.159 0.020 A 33 ARG C C 13 176.451 0.400 A 33 ARG CA C 13 55.627 0.400 A 33 ARG CB C 13 29.861 0.400 A 33 ARG N N 15 124.856 0.400 A 34 TYR H H 1 8.995 0.020 A 34 TYR CA C 13 55.320 0.400 A 34 TYR N N 15 117.908 0.400 A 35 PRO C C 13 177.280 0.400 A 36 SER H H 1 8.106 0.020 A 36 SER C C 13 178.938 0.400 A 36 SER CA C 13 64.815 0.400 A 36 SER N N 15 116.410 0.400 A 37 SER H H 1 8.169 0.020 A 37 SER C C 13 177.698 0.400 A 37 SER CA C 13 61.357 0.400 A 37 SER CB C 13 68.118 0.400 A 37 SER N N 15 117.488 0.400 A 38 ASN H H 1 8.284 0.020 A 38 ASN HA H 1 4.259 0.020 A 38 ASN HB2 H 1 2.679 0.020 A 38 ASN HB3 H 1 2.679 0.020 A 38 ASN C C 13 177.868 0.400 A 38 ASN CA C 13 55.907 0.400 A 38 ASN CB C 13 37.230 0.400 A 38 ASN N N 15 115.638 0.400 A 39 MET H H 1 7.857 0.020 A 39 MET HA H 1 4.170 0.020 A 39 MET HE% H 1 1.851 0.020 A 39 MET C C 13 179.068 0.400 A 39 MET CA C 13 58.751 0.400 A 39 MET CB C 13 31.850 0.400 A 39 MET CE C 13 17.796 0.400 A 39 MET N N 15 121.352 0.400 A 40 LEU H H 1 8.167 0.020 A 40 LEU HA H 1 4.139 0.020 A 40 LEU HD1% H 1 0.633 0.020 A 40 LEU HD2% H 1 0.737 0.020 A 40 LEU C C 13 178.700 0.400 A 40 LEU CA C 13 58.455 0.400 A 40 LEU CB C 13 40.304 0.400 A 40 LEU CD1 C 13 25.467 0.400 A 40 LEU CD2 C 13 22.779 0.400 A 40 LEU N N 15 118.936 0.400 A 41 LYS H H 1 7.632 0.020 A 41 LYS HA H 1 3.475 0.020 A 41 LYS HB2 H 1 1.439 0.020 A 41 LYS HB3 H 1 1.439 0.020 A 41 LYS C C 13 178.793 0.400 A 41 LYS CA C 13 59.161 0.400 A 41 LYS CB C 13 30.992 0.400 A 41 LYS N N 15 116.791 0.400 A 42 THR H H 1 7.469 0.020 A 42 THR HA H 1 4.230 0.020 A 42 THR HB H 1 3.884 0.020 A 42 THR C C 13 176.142 0.400 A 42 THR CA C 13 65.107 0.400 A 42 THR CB C 13 68.306 0.400 A 42 THR N N 15 112.819 0.400 A 43 TYR H H 1 7.978 0.020 A 43 TYR HA H 1 4.204 0.020 A 43 TYR HB2 H 1 2.937 0.020 A 43 TYR HB3 H 1 2.937 0.020 A 43 TYR HD1 H 1 7.095 0.020 A 43 TYR HD2 H 1 7.095 0.020 A 43 TYR HE1 H 1 6.700 0.020 A 43 TYR HE2 H 1 6.700 0.020 A 43 TYR C C 13 174.240 0.400 A 43 TYR CA C 13 60.886 0.400 A 43 TYR CB C 13 38.165 0.400 A 43 TYR CD1 C 13 132.980 0.400 A 43 TYR CD2 C 13 132.980 0.400 A 43 TYR CE1 C 13 118.868 0.400 A 43 TYR CE2 C 13 118.868 0.400 A 43 TYR N N 15 118.565 0.400 A 44 PHE H H 1 7.955 0.020 A 44 PHE HA H 1 4.920 0.020 A 44 PHE HB2 H 1 3.209 0.020 A 44 PHE HB3 H 1 3.209 0.020 A 44 PHE HD1 H 1 7.722 0.020 A 44 PHE HD2 H 1 7.722 0.020 A 44 PHE HE1 H 1 7.613 0.020 A 44 PHE HE2 H 1 7.613 0.020 A 44 PHE HZ H 1 7.431 0.020 A 44 PHE C C 13 176.436 0.400 A 44 PHE CA C 13 56.672 0.400 A 44 PHE CB C 13 36.570 0.400 A 44 PHE CD1 C 13 132.698 0.400 A 44 PHE CD2 C 13 132.698 0.400 A 44 PHE CE1 C 13 130.500 0.400 A 44 PHE CE2 C 13 130.500 0.400 A 44 PHE CZ C 13 129.100 0.400 A 44 PHE N N 15 120.980 0.400 A 45 SER H H 1 7.932 0.020 A 45 SER HA H 1 4.373 0.020 A 45 SER HB2 H 1 4.116 0.020 A 45 SER HB3 H 1 4.116 0.020 A 45 SER C C 13 174.424 0.400 A 45 SER CA C 13 61.037 0.400 A 45 SER CB C 13 62.711 0.400 A 45 SER N N 15 113.407 0.400 A 46 ASP H H 1 9.889 0.020 A 46 ASP HA H 1 4.572 0.020 A 46 ASP HBy H 1 2.903 0.020 A 46 ASP HBx H 1 2.631 0.020 A 46 ASP C C 13 174.866 0.400 A 46 ASP CA C 13 53.602 0.400 A 46 ASP CB C 13 38.992 0.400 A 46 ASP N N 15 118.099 0.400 A 47 VAL H H 1 7.781 0.020 A 47 VAL HA H 1 4.058 0.020 A 47 VAL HB H 1 1.962 0.020 A 47 VAL HG1% H 1 0.148 0.020 A 47 VAL HG2% H 1 0.470 0.020 A 47 VAL C C 13 174.676 0.400 A 47 VAL CA C 13 61.006 0.400 A 47 VAL CB C 13 32.110 0.400 A 47 VAL CG1 C 13 21.275 0.400 A 47 VAL CG2 C 13 21.473 0.400 A 47 VAL N N 15 121.496 0.400 A 48 LYS H H 1 8.245 0.020 A 48 LYS HA H 1 4.402 0.020 A 48 LYS HBy H 1 1.759 0.020 A 48 LYS HBx H 1 1.671 0.020 A 48 LYS C C 13 175.564 0.400 A 48 LYS CA C 13 54.874 0.400 A 48 LYS CB C 13 30.189 0.400 A 48 LYS N N 15 126.100 0.400 A 49 PHE H H 1 8.626 0.020 A 49 PHE HA H 1 3.813 0.020 A 49 PHE HBy H 1 3.023 0.020 A 49 PHE HBx H 1 2.867 0.020 A 49 PHE HD1 H 1 7.367 0.020 A 49 PHE HD2 H 1 7.367 0.020 A 49 PHE HE1 H 1 7.281 0.020 A 49 PHE HE2 H 1 7.281 0.020 A 49 PHE HZ H 1 6.858 0.020 A 49 PHE C C 13 175.708 0.400 A 49 PHE CA C 13 60.861 0.400 A 49 PHE CB C 13 38.616 0.400 A 49 PHE CD1 C 13 131.698 0.400 A 49 PHE CD2 C 13 131.698 0.400 A 49 PHE CE1 C 13 131.407 0.400 A 49 PHE CE2 C 13 131.407 0.400 A 49 PHE CZ C 13 129.307 0.400 A 49 PHE N N 15 125.341 0.400 A 50 ASN H H 1 7.030 0.020 A 50 ASN C C 13 176.072 0.400 A 50 ASN CA C 13 51.730 0.400 A 50 ASN N N 15 115.408 0.400 A 51 ARG H H 1 7.790 0.020 A 51 ARG CA C 13 59.534 0.400 A 51 ARG N N 15 122.706 0.400 A 52 CYS H H 1 7.681 0.020 A 52 CYS HA H 1 4.108 0.020 A 52 CYS HB2 H 1 2.957 0.020 A 52 CYS HB3 H 1 2.957 0.020 A 52 CYS C C 13 178.200 0.400 A 52 CYS CA C 13 61.143 0.400 A 52 CYS N N 15 117.340 0.400 A 53 ILE H H 1 8.035 0.020 A 53 ILE HA H 1 3.588 0.020 A 53 ILE HB H 1 1.621 0.020 A 53 ILE HD1% H 1 0.382 0.020 A 53 ILE HG1y H 1 1.564 0.020 A 53 ILE HG1x H 1 1.131 0.020 A 53 ILE HG2% H 1 0.356 0.020 A 53 ILE C C 13 177.492 0.400 A 53 ILE CA C 13 64.109 0.400 A 53 ILE CB C 13 37.603 0.400 A 53 ILE CD1 C 13 11.583 0.400 A 53 ILE CG1 C 13 28.320 0.400 A 53 ILE CG2 C 13 16.879 0.400 A 53 ILE N N 15 122.321 0.400 A 54 THR HG2% H 1 1.123 0.020 A 54 THR C C 13 175.903 0.400 A 54 THR CA C 13 67.308 0.400 A 54 THR CG2 C 13 22.181 0.400 A 55 SER H H 1 7.844 0.020 A 55 SER N N 15 113.819 0.400 A 56 GLN C C 13 179.792 0.400 A 57 LEU H H 1 8.267 0.020 A 57 LEU HA H 1 4.519 0.020 A 57 LEU HB2 H 1 2.587 0.020 A 57 LEU HB3 H 1 2.587 0.020 A 57 LEU HD1% H 1 0.396 0.020 A 57 LEU HD2% H 1 0.286 0.020 A 57 LEU HG H 1 1.236 0.020 A 57 LEU C C 13 178.775 0.400 A 57 LEU CA C 13 55.232 0.400 A 57 LEU CB C 13 37.131 0.400 A 57 LEU CD1 C 13 25.963 0.400 A 57 LEU CD2 C 13 24.855 0.400 A 57 LEU N N 15 116.701 0.400 A 58 ILE H H 1 8.111 0.020 A 58 ILE HA H 1 4.640 0.020 A 58 ILE HB H 1 1.908 0.020 A 58 ILE HD1% H 1 0.706 0.020 A 58 ILE HG1x H 1 1.191 0.020 A 58 ILE HG1y H 1 1.572 0.020 A 58 ILE HG2% H 1 0.883 0.020 A 58 ILE C C 13 177.380 0.400 A 58 ILE CA C 13 62.163 0.400 A 58 ILE CB C 13 30.657 0.400 A 58 ILE CD1 C 13 12.423 0.400 A 58 ILE CG2 C 13 16.976 0.400 A 58 ILE N N 15 122.522 0.400 A 59 LYS H H 1 7.432 0.020 A 59 LYS C C 13 177.600 0.400 A 59 LYS CA C 13 57.570 0.400 A 59 LYS CB C 13 39.101 0.400 A 59 LYS N N 15 121.002 0.400 A 60 TRP H H 1 7.565 0.020 A 60 TRP HA H 1 3.739 0.020 A 60 TRP HD1 H 1 6.768 0.020 A 60 TRP HE1 H 1 9.992 0.020 A 60 TRP HE3 H 1 6.539 0.020 A 60 TRP HH2 H 1 7.015 0.020 A 60 TRP HZ2 H 1 7.333 0.020 A 60 TRP C C 13 178.246 0.400 A 60 TRP CA C 13 59.818 0.400 A 60 TRP CB C 13 31.851 0.400 A 60 TRP CD1 C 13 123.216 0.400 A 60 TRP CE3 C 13 128.400 0.400 A 60 TRP CH2 C 13 124.955 0.400 A 60 TRP CZ2 C 13 114.405 0.400 A 60 TRP N N 15 118.679 0.400 A 60 TRP NE1 N 15 126.079 0.400 A 61 PHE H H 1 7.819 0.020 A 61 PHE HA H 1 3.882 0.020 A 61 PHE CA C 13 60.054 0.400 A 61 PHE N N 15 118.005 0.400 A 62 SER H H 1 8.878 0.020 A 62 SER C C 13 177.840 0.400 A 62 SER CA C 13 55.892 0.400 A 62 SER N N 15 121.144 0.400 A 63 ASN H H 1 8.001 0.020 A 63 ASN C C 13 177.222 0.400 A 63 ASN CA C 13 60.467 0.400 A 63 ASN N N 15 115.303 0.400 A 64 PHE H H 1 7.082 0.020 A 64 PHE CA C 13 56.453 0.400 A 64 PHE N N 15 112.571 0.400 A 65 ARG H H 1 8.091 0.020 A 65 ARG CA C 13 59.590 0.400 A 65 ARG N N 15 116.695 0.400 A 66 GLU H H 1 7.597 0.020 A 66 GLU HA H 1 4.739 0.020 A 66 GLU C C 13 174.621 0.400 A 66 GLU CA C 13 59.583 0.400 A 66 GLU N N 15 121.653 0.400 A 67 PHE H H 1 7.067 0.020 A 67 PHE HD1 H 1 6.978 0.020 A 67 PHE HD2 H 1 6.978 0.020 A 67 PHE C C 13 176.164 0.400 A 67 PHE CA C 13 61.156 0.400 A 67 PHE CD1 C 13 132.276 0.400 A 67 PHE CD2 C 13 132.276 0.400 A 67 PHE N N 15 111.578 0.400 A 68 TYR H H 1 7.442 0.020 A 68 TYR C C 13 176.844 0.400 A 68 TYR CA C 13 61.758 0.400 A 68 TYR N N 15 119.370 0.400 A 69 TYR H H 1 9.127 0.020 A 69 TYR HA H 1 4.086 0.020 A 69 TYR C C 13 180.328 0.400 A 69 TYR CA C 13 61.528 0.400 A 69 TYR N N 15 116.047 0.400 A 70 ILE H H 1 8.631 0.020 A 70 ILE HA H 1 3.828 0.020 A 70 ILE HD1% H 1 0.839 0.020 A 70 ILE HG2% H 1 0.730 0.020 A 70 ILE C C 13 179.585 0.400 A 70 ILE CA C 13 65.787 0.400 A 70 ILE CB C 13 36.435 0.400 A 70 ILE CD1 C 13 13.682 0.400 A 70 ILE CG2 C 13 16.960 0.400 A 70 ILE N N 15 124.738 0.400 A 71 GLN H H 1 7.738 0.020 A 71 GLN HA H 1 3.826 0.020 A 71 GLN C C 13 178.192 0.400 A 71 GLN CA C 13 57.779 0.400 A 71 GLN N N 15 117.940 0.400 A 72 MET H H 1 7.844 0.020 A 72 MET HA H 1 4.112 0.020 A 72 MET HE% H 1 1.641 0.020 A 72 MET C C 13 177.203 0.400 A 72 MET CA C 13 57.272 0.400 A 72 MET CE C 13 19.470 0.400 A 72 MET N N 15 117.353 0.400 A 73 GLU H H 1 7.503 0.020 A 73 GLU HA H 1 3.572 0.020 A 73 GLU C C 13 177.344 0.400 A 73 GLU CA C 13 60.324 0.400 A 73 GLU N N 15 117.858 0.400 A 74 LYS H H 1 7.912 0.020 A 74 LYS HA H 1 3.867 0.020 A 74 LYS HB2 H 1 1.824 0.020 A 74 LYS C C 13 180.077 0.400 A 74 LYS CA C 13 59.754 0.400 A 74 LYS N N 15 118.716 0.400 A 75 TYR H H 1 8.421 0.020 A 75 TYR HA H 1 4.085 0.020 A 75 TYR HB2 H 1 2.873 0.020 A 75 TYR HD1 H 1 7.532 0.020 A 75 TYR HD2 H 1 7.532 0.020 A 75 TYR HE1 H 1 6.927 0.020 A 75 TYR HE2 H 1 6.927 0.020 A 75 TYR C C 13 178.874 0.400 A 75 TYR CA C 13 63.306 0.400 A 75 TYR CD1 C 13 133.976 0.400 A 75 TYR CD2 C 13 133.976 0.400 A 75 TYR CE1 C 13 117.724 0.400 A 75 TYR CE2 C 13 117.724 0.400 A 75 TYR N N 15 117.309 0.400 A 76 ALA H H 1 8.553 0.020 A 76 ALA HA H 1 4.221 0.020 A 76 ALA HB% H 1 1.666 0.020 A 76 ALA C C 13 178.850 0.400 A 76 ALA CA C 13 56.280 0.400 A 76 ALA CB C 13 18.687 0.400 A 76 ALA N N 15 125.392 0.400 A 77 ARG H H 1 8.471 0.020 A 77 ARG HA H 1 3.935 0.020 A 77 ARG HB2 H 1 1.892 0.020 A 77 ARG HB3 H 1 1.892 0.020 A 77 ARG C C 13 179.341 0.400 A 77 ARG CA C 13 60.499 0.400 A 77 ARG N N 15 115.067 0.400 A 78 GLN H H 1 8.142 0.020 A 78 GLN HA H 1 3.921 0.020 A 78 GLN HB2 H 1 2.055 0.020 A 78 GLN C C 13 177.289 0.400 A 78 GLN CA C 13 58.619 0.400 A 78 GLN CB C 13 27.752 0.400 A 78 GLN N N 15 120.107 0.400 A 79 ALA H H 1 7.811 0.020 A 79 ALA HA H 1 4.308 0.020 A 79 ALA HB% H 1 1.589 0.020 A 79 ALA C C 13 179.924 0.400 A 79 ALA CA C 13 54.970 0.400 A 79 ALA CB C 13 17.064 0.400 A 79 ALA N N 15 120.809 0.400 A 80 ILE H H 1 7.837 0.020 A 80 ILE HA H 1 3.894 0.020 A 80 ILE HD1% H 1 0.537 0.020 A 80 ILE HG2% H 1 0.822 0.020 A 80 ILE C C 13 181.268 0.400 A 80 ILE CA C 13 64.841 0.400 A 80 ILE CB C 13 37.125 0.400 A 80 ILE CD1 C 13 13.996 0.400 A 80 ILE CG2 C 13 16.410 0.400 A 80 ILE N N 15 118.524 0.400 A 81 ASN H H 1 8.262 0.020 A 81 ASN HA H 1 4.398 0.020 A 81 ASN HB2 H 1 2.883 0.020 A 81 ASN HB3 H 1 2.883 0.020 A 81 ASN C C 13 176.546 0.400 A 81 ASN CA C 13 55.892 0.400 A 81 ASN CB C 13 37.603 0.400 A 81 ASN N N 15 121.233 0.400 A 82 ASP H H 1 8.316 0.020 A 82 ASP HA H 1 4.666 0.020 A 82 ASP HB2 H 1 2.907 0.020 A 82 ASP HB3 H 1 2.907 0.020 A 82 ASP C C 13 176.767 0.400 A 82 ASP CA C 13 54.771 0.400 A 82 ASP CB C 13 40.121 0.400 A 82 ASP N N 15 119.240 0.400 A 83 GLY H H 1 7.810 0.020 A 83 GLY HAy H 1 4.284 0.020 A 83 GLY HAx H 1 3.731 0.020 A 83 GLY C C 13 174.601 0.400 A 83 GLY CA C 13 45.214 0.400 A 83 GLY N N 15 106.913 0.400 A 84 VAL H H 1 8.157 0.020 A 84 VAL HA H 1 3.850 0.020 A 84 VAL HG1% H 1 0.736 0.020 A 84 VAL HG2% H 1 0.988 0.020 A 84 VAL C C 13 177.265 0.400 A 84 VAL CA C 13 64.270 0.400 A 84 VAL CB C 13 30.471 0.400 A 84 VAL CG1 C 13 22.397 0.400 A 84 VAL CG2 C 13 22.117 0.400 A 84 VAL N N 15 122.981 0.400 A 85 THR H H 1 8.890 0.020 A 85 THR HA H 1 4.716 0.020 A 85 THR HB H 1 4.421 0.020 A 85 THR HG2% H 1 1.164 0.020 A 85 THR C C 13 174.489 0.400 A 85 THR CA C 13 61.618 0.400 A 85 THR CB C 13 70.081 0.400 A 85 THR CG2 C 13 21.614 0.400 A 85 THR N N 15 115.232 0.400 A 86 SER H H 1 7.704 0.020 A 86 SER HA H 1 5.046 0.020 A 86 SER HBy H 1 3.886 0.020 A 86 SER HBx H 1 3.790 0.020 A 86 SER C C 13 174.473 0.400 A 86 SER CA C 13 55.922 0.400 A 86 SER CB C 13 64.385 0.400 A 86 SER N N 15 117.009 0.400 A 87 THR H H 1 8.711 0.020 A 87 THR HA H 1 4.065 0.020 A 87 THR HB H 1 3.380 0.020 A 87 THR HG2% H 1 1.373 0.020 A 87 THR C C 13 176.047 0.400 A 87 THR CA C 13 64.983 0.400 A 87 THR CB C 13 68.045 0.400 A 87 THR CG2 C 13 23.406 0.400 A 87 THR N N 15 118.634 0.400 A 88 GLU H H 1 8.152 0.020 A 88 GLU HA H 1 3.881 0.020 A 88 GLU HBy H 1 2.042 0.020 A 88 GLU HBx H 1 1.838 0.020 A 88 GLU C C 13 177.146 0.400 A 88 GLU CA C 13 57.814 0.400 A 88 GLU CB C 13 28.050 0.400 A 88 GLU N N 15 117.889 0.400 A 89 GLU H H 1 7.311 0.020 A 89 GLU HA H 1 4.149 0.020 A 89 GLU HBy H 1 2.212 0.020 A 89 GLU HBx H 1 2.003 0.020 A 89 GLU C C 13 176.192 0.400 A 89 GLU CA C 13 56.133 0.400 A 89 GLU CB C 13 29.415 0.400 A 89 GLU N N 15 115.617 0.400 A 90 LEU H H 1 7.311 0.020 A 90 LEU HA H 1 4.439 0.020 A 90 LEU HBy H 1 1.674 0.020 A 90 LEU HBx H 1 1.170 0.020 A 90 LEU HD1% H 1 0.373 0.020 A 90 LEU HD2% H 1 0.528 0.020 A 90 LEU C C 13 175.267 0.400 A 90 LEU CA C 13 53.504 0.400 A 90 LEU CB C 13 40.479 0.400 A 90 LEU CD1 C 13 25.790 0.400 A 90 LEU CD2 C 13 23.914 0.400 A 90 LEU N N 15 120.870 0.400 A 91 SER H H 1 8.221 0.020 A 91 SER HA H 1 4.747 0.020 A 91 SER HB2 H 1 3.622 0.020 A 91 SER HB3 H 1 3.622 0.020 A 91 SER C C 13 173.332 0.400 A 91 SER CA C 13 56.314 0.400 A 91 SER CB C 13 64.615 0.400 A 91 SER N N 15 118.376 0.400 A 92 ILE H H 1 8.570 0.020 A 92 ILE HA H 1 4.537 0.020 A 92 ILE HB H 1 1.826 0.020 A 92 ILE HD1% H 1 0.661 0.020 A 92 ILE HG2% H 1 0.765 0.020 A 92 ILE C C 13 174.059 0.400 A 92 ILE CA C 13 59.881 0.400 A 92 ILE CB C 13 37.820 0.400 A 92 ILE CD1 C 13 12.901 0.400 A 92 ILE CG1 C 13 26.721 0.400 A 92 ILE CG2 C 13 17.342 0.400 A 92 ILE N N 15 122.247 0.400 A 93 THR H H 1 7.224 0.020 A 93 THR HA H 1 4.580 0.020 A 93 THR HB H 1 4.446 0.020 A 93 THR HG2% H 1 1.113 0.020 A 93 THR C C 13 175.049 0.400 A 93 THR CA C 13 58.988 0.400 A 93 THR CB C 13 71.362 0.400 A 93 THR CG2 C 13 21.452 0.400 A 93 THR N N 15 116.069 0.400 A 94 ARG H H 1 8.596 0.020 A 94 ARG HA H 1 3.077 0.020 A 94 ARG C C 13 175.076 0.400 A 94 ARG CA C 13 57.119 0.400 A 94 ARG CB C 13 27.838 0.400 A 94 ARG N N 15 116.595 0.400 A 95 ASP H H 1 7.607 0.020 A 95 ASP HA H 1 4.765 0.020 A 95 ASP HBy H 1 2.614 0.020 A 95 ASP HBx H 1 2.508 0.020 A 95 ASP C C 13 175.876 0.400 A 95 ASP CA C 13 53.156 0.400 A 95 ASP CB C 13 41.166 0.400 A 95 ASP N N 15 113.735 0.400 A 96 CYS H H 1 7.094 0.020 A 96 CYS C C 13 174.361 0.400 A 96 CYS CA C 13 56.562 0.400 A 96 CYS CB C 13 29.416 0.400 A 96 CYS N N 15 116.012 0.400 A 97 GLU H H 1 9.003 0.020 A 97 GLU C C 13 178.748 0.400 A 97 GLU CA C 13 59.912 0.400 A 97 GLU CB C 13 29.195 0.400 A 97 GLU N N 15 123.087 0.400 A 98 LEU H H 1 8.656 0.020 A 98 LEU HA H 1 3.614 0.020 A 98 LEU HD1% H 1 0.695 0.020 A 98 LEU HD2% H 1 0.764 0.020 A 98 LEU HG H 1 1.158 0.020 A 98 LEU C C 13 177.796 0.400 A 98 LEU CA C 13 58.090 0.400 A 98 LEU CB C 13 39.778 0.400 A 98 LEU CD1 C 13 22.524 0.400 A 98 LEU CD2 C 13 27.148 0.400 A 98 LEU N N 15 120.942 0.400 A 99 TYR H H 1 7.522 0.020 A 99 TYR HD1 H 1 6.913 0.020 A 99 TYR HD2 H 1 6.913 0.020 A 99 TYR HE1 H 1 6.773 0.020 A 99 TYR HE2 H 1 6.773 0.020 A 99 TYR C C 13 177.077 0.400 A 99 TYR CA C 13 62.622 0.400 A 99 TYR CB C 13 38.742 0.400 A 99 TYR CD1 C 13 133.214 0.400 A 99 TYR CD2 C 13 133.214 0.400 A 99 TYR CE1 C 13 117.307 0.400 A 99 TYR CE2 C 13 117.307 0.400 A 99 TYR N N 15 118.313 0.400 A 100 ARG H H 1 8.243 0.020 A 100 ARG C C 13 178.616 0.400 A 100 ARG CA C 13 59.915 0.400 A 100 ARG CB C 13 29.100 0.400 A 100 ARG N N 15 118.101 0.400 A 101 ALA H H 1 8.352 0.020 A 101 ALA HA H 1 4.145 0.020 A 101 ALA HB% H 1 1.569 0.020 A 101 ALA C C 13 181.359 0.400 A 101 ALA CA C 13 55.057 0.400 A 101 ALA CB C 13 17.543 0.400 A 101 ALA N N 15 120.972 0.400 A 102 LEU H H 1 7.960 0.020 A 102 LEU HA H 1 4.333 0.020 A 102 LEU HBx H 1 2.330 0.020 A 102 LEU HBy H 1 2.370 0.020 A 102 LEU HD1% H 1 1.013 0.020 A 102 LEU HD2% H 1 1.255 0.020 A 102 LEU C C 13 178.583 0.400 A 102 LEU CA C 13 57.634 0.400 A 102 LEU CB C 13 41.716 0.400 A 102 LEU CD1 C 13 25.992 0.400 A 102 LEU CD2 C 13 23.261 0.400 A 102 LEU N N 15 115.683 0.400 A 103 ASN H H 1 9.301 0.020 A 103 ASN C C 13 177.470 0.400 A 103 ASN CA C 13 56.974 0.400 A 103 ASN CB C 13 38.140 0.400 A 103 ASN N N 15 118.957 0.400 A 104 MET H H 1 8.332 0.020 A 104 MET CA C 13 57.362 0.400 A 104 MET CB C 13 31.895 0.400 A 104 MET N N 15 113.763 0.400 A 105 HIS H H 1 7.156 0.020 A 105 HIS HA H 1 3.764 0.020 A 105 HIS HB2 H 1 2.369 0.020 A 105 HIS HE1 H 1 7.446 0.020 A 105 HIS C C 13 176.939 0.400 A 105 HIS CA C 13 59.069 0.400 A 105 HIS CE1 C 13 137.467 0.400 A 105 HIS N N 15 116.024 0.400 A 106 TYR H H 1 7.204 0.020 A 106 TYR HD1 H 1 6.549 0.020 A 106 TYR HD2 H 1 6.549 0.020 A 106 TYR HE1 H 1 6.453 0.020 A 106 TYR HE2 H 1 6.453 0.020 A 106 TYR C C 13 173.767 0.400 A 106 TYR CA C 13 58.488 0.400 A 106 TYR CB C 13 38.225 0.400 A 106 TYR CD1 C 13 132.922 0.400 A 106 TYR CD2 C 13 132.922 0.400 A 106 TYR CE1 C 13 117.736 0.400 A 106 TYR CE2 C 13 117.736 0.400 A 106 TYR N N 15 113.161 0.400 A 107 ASN H H 1 8.127 0.020 A 107 ASN HA H 1 3.922 0.020 A 107 ASN C C 13 175.815 0.400 A 107 ASN CA C 13 51.233 0.400 A 107 ASN CB C 13 38.142 0.400 A 107 ASN N N 15 118.875 0.400 A 108 LYS H H 1 7.772 0.020 A 108 LYS HA H 1 3.954 0.020 A 108 LYS HB2 H 1 1.607 0.020 A 108 LYS C C 13 177.586 0.400 A 108 LYS CA C 13 59.749 0.400 A 108 LYS CB C 13 31.498 0.400 A 108 LYS N N 15 122.850 0.400 A 109 ALA H H 1 8.307 0.020 A 109 ALA HA H 1 4.137 0.020 A 109 ALA HB% H 1 1.329 0.020 A 109 ALA C C 13 177.889 0.400 A 109 ALA CA C 13 52.299 0.400 A 109 ALA CB C 13 17.787 0.400 A 109 ALA N N 15 118.054 0.400 A 110 ASN H H 1 8.353 0.020 A 110 ASN HA H 1 4.480 0.020 A 110 ASN HBy H 1 3.199 0.020 A 110 ASN HBx H 1 2.441 0.020 A 110 ASN C C 13 174.277 0.400 A 110 ASN CA C 13 53.504 0.400 A 110 ASN CB C 13 37.283 0.400 A 110 ASN N N 15 115.542 0.400 A 111 ASP H H 1 8.297 0.020 A 111 ASP HA H 1 4.485 0.020 A 111 ASP HBy H 1 2.851 0.020 A 111 ASP HBx H 1 2.387 0.020 A 111 ASP C C 13 174.868 0.400 A 111 ASP CA C 13 53.227 0.400 A 111 ASP CB C 13 39.228 0.400 A 111 ASP N N 15 114.692 0.400 A 112 PHE H H 1 7.784 0.020 A 112 PHE HA H 1 4.752 0.020 A 112 PHE HB2 H 1 2.776 0.020 A 112 PHE C C 13 174.633 0.400 A 112 PHE CA C 13 56.346 0.400 A 112 PHE N N 15 120.927 0.400 A 113 GLU H H 1 7.752 0.020 A 113 GLU HA H 1 4.011 0.020 A 113 GLU HB2 H 1 1.606 0.020 A 113 GLU HB3 H 1 1.606 0.020 A 113 GLU C C 13 173.502 0.400 A 113 GLU CA C 13 55.100 0.400 A 113 GLU N N 15 128.111 0.400 A 114 VAL H H 1 8.008 0.020 A 114 VAL HA H 1 3.241 0.020 A 114 VAL HB H 1 1.659 0.020 A 114 VAL HG1% H 1 0.576 0.020 A 114 VAL HG2% H 1 0.463 0.020 A 114 VAL CA C 13 60.838 0.400 A 114 VAL CB C 13 32.609 0.400 A 114 VAL CG1 C 13 20.218 0.400 A 114 VAL CG2 C 13 22.462 0.400 A 114 VAL N N 15 129.326 0.400 A 115 PRO HA H 1 4.429 0.020 A 115 PRO HBy H 1 2.355 0.020 A 115 PRO HBx H 1 2.053 0.020 A 115 PRO C C 13 177.421 0.400 A 115 PRO CA C 13 61.882 0.400 A 115 PRO CB C 13 30.974 0.400 A 116 GLU H H 1 8.757 0.020 A 116 GLU C C 13 179.034 0.400 A 116 GLU CA C 13 58.913 0.400 A 116 GLU CB C 13 28.378 0.400 A 116 GLU N N 15 123.936 0.400 A 117 ARG H H 1 8.733 0.020 A 117 ARG C C 13 177.570 0.400 A 117 ARG CA C 13 57.033 0.400 A 117 ARG CB C 13 28.172 0.400 A 117 ARG N N 15 116.943 0.400 A 118 PHE H H 1 7.606 0.020 A 118 PHE HA H 1 4.137 0.020 A 118 PHE HBy H 1 2.974 0.020 A 118 PHE HBx H 1 1.873 0.020 A 118 PHE C C 13 176.992 0.400 A 118 PHE CA C 13 61.627 0.400 A 118 PHE CB C 13 37.386 0.400 A 118 PHE N N 15 117.528 0.400 A 119 LEU H H 1 7.248 0.020 A 119 LEU HA H 1 3.684 0.020 A 119 LEU HBx H 1 1.954 0.020 A 119 LEU HBy H 1 1.958 0.020 A 119 LEU HD1% H 1 0.831 0.020 A 119 LEU HD2% H 1 0.616 0.020 A 119 LEU HG H 1 1.504 0.020 A 119 LEU C C 13 178.802 0.400 A 119 LEU CA C 13 59.875 0.400 A 119 LEU CB C 13 39.453 0.400 A 119 LEU CD1 C 13 25.682 0.400 A 119 LEU CD2 C 13 25.431 0.400 A 119 LEU N N 15 118.483 0.400 A 120 GLU H H 1 7.423 0.020 A 120 GLU C C 13 179.932 0.400 A 120 GLU CA C 13 59.150 0.400 A 120 GLU CB C 13 28.878 0.400 A 120 GLU N N 15 117.870 0.400 A 121 VAL H H 1 8.313 0.020 A 121 VAL HA H 1 3.545 0.020 A 121 VAL HB H 1 1.927 0.020 A 121 VAL HG1% H 1 0.827 0.020 A 121 VAL HG2% H 1 1.111 0.020 A 121 VAL C C 13 179.302 0.400 A 121 VAL CA C 13 66.875 0.400 A 121 VAL CB C 13 30.823 0.400 A 121 VAL CG1 C 13 19.770 0.400 A 121 VAL CG2 C 13 23.166 0.400 A 121 VAL N N 15 120.777 0.400 A 122 ALA H H 1 8.896 0.020 A 122 ALA HA H 1 4.251 0.020 A 122 ALA HB% H 1 1.012 0.020 A 122 ALA C C 13 178.366 0.400 A 122 ALA CA C 13 54.748 0.400 A 122 ALA CB C 13 16.565 0.400 A 122 ALA N N 15 127.029 0.400 A 123 GLN H H 1 8.349 0.020 A 123 GLN C C 13 177.908 0.400 A 123 GLN CA C 13 60.671 0.400 A 123 GLN N N 15 119.887 0.400 A 124 ILE H H 1 8.204 0.020 A 124 ILE HA H 1 3.651 0.020 A 124 ILE HB H 1 1.909 0.020 A 124 ILE HD1% H 1 0.877 0.020 A 124 ILE HG1x H 1 0.887 0.020 A 124 ILE HG1y H 1 0.914 0.020 A 124 ILE HG2% H 1 0.897 0.020 A 124 ILE C C 13 178.703 0.400 A 124 ILE CA C 13 65.945 0.400 A 124 ILE CD1 C 13 13.971 0.400 A 124 ILE CG2 C 13 16.711 0.400 A 124 ILE N N 15 120.632 0.400 A 125 THR H H 1 8.399 0.020 A 125 THR HG2% H 1 1.630 0.020 A 125 THR C C 13 175.568 0.400 A 125 THR CA C 13 67.872 0.400 A 125 THR CG2 C 13 23.266 0.400 A 125 THR N N 15 115.084 0.400 A 126 LEU H H 1 8.728 0.020 A 126 LEU HA H 1 4.085 0.020 A 126 LEU HD1% H 1 0.999 0.020 A 126 LEU HD2% H 1 0.781 0.020 A 126 LEU HG H 1 1.542 0.020 A 126 LEU C C 13 178.559 0.400 A 126 LEU CA C 13 58.843 0.400 A 126 LEU CB C 13 41.421 0.400 A 126 LEU CD1 C 13 22.885 0.400 A 126 LEU CD2 C 13 26.863 0.400 A 126 LEU N N 15 125.011 0.400 A 127 ARG H H 1 8.213 0.020 A 127 ARG HA H 1 3.929 0.020 A 127 ARG C C 13 177.984 0.400 A 127 ARG CA C 13 60.685 0.400 A 127 ARG CB C 13 28.079 0.400 A 127 ARG N N 15 117.076 0.400 A 128 GLU H H 1 8.478 0.020 A 128 GLU HA H 1 4.147 0.020 A 128 GLU C C 13 181.150 0.400 A 128 GLU CA C 13 59.508 0.400 A 128 GLU N N 15 118.617 0.400 A 129 PHE H H 1 8.570 0.020 A 129 PHE HA H 1 4.104 0.020 A 129 PHE HD1 H 1 7.233 0.020 A 129 PHE HD2 H 1 7.233 0.020 A 129 PHE HE1 H 1 7.586 0.020 A 129 PHE HE2 H 1 7.586 0.020 A 129 PHE C C 13 177.170 0.400 A 129 PHE CA C 13 63.694 0.400 A 129 PHE CD1 C 13 131.800 0.400 A 129 PHE CD2 C 13 131.800 0.400 A 129 PHE CE1 C 13 131.100 0.400 A 129 PHE CE2 C 13 131.100 0.400 A 129 PHE N N 15 119.267 0.400 A 130 PHE H H 1 8.740 0.020 A 130 PHE HA H 1 3.884 0.020 A 130 PHE HBy H 1 3.234 0.020 A 130 PHE HBx H 1 2.884 0.020 A 130 PHE C C 13 175.860 0.400 A 130 PHE CA C 13 62.819 0.400 A 130 PHE N N 15 118.739 0.400 A 131 ASN H H 1 8.864 0.020 A 131 ASN HA H 1 4.373 0.020 A 131 ASN HBy H 1 2.900 0.020 A 131 ASN HBx H 1 2.746 0.020 A 131 ASN C C 13 178.228 0.400 A 131 ASN CA C 13 55.150 0.400 A 131 ASN N N 15 116.028 0.400 A 132 ALA H H 1 7.745 0.020 A 132 ALA HA H 1 4.020 0.020 A 132 ALA HB% H 1 1.579 0.020 A 132 ALA C C 13 178.515 0.400 A 132 ALA CA C 13 54.924 0.400 A 132 ALA CB C 13 18.441 0.400 A 132 ALA N N 15 120.922 0.400 A 133 ILE H H 1 7.999 0.020 A 133 ILE HA H 1 3.235 0.020 A 133 ILE HB H 1 1.382 0.020 A 133 ILE HD1% H 1 0.946 0.020 A 133 ILE HG2% H 1 0.651 0.020 A 133 ILE C C 13 180.606 0.400 A 133 ILE CA C 13 65.215 0.400 A 133 ILE CB C 13 38.291 0.400 A 133 ILE CD1 C 13 15.174 0.400 A 133 ILE CG1 C 13 29.762 0.400 A 133 ILE CG2 C 13 18.905 0.400 A 133 ILE N N 15 118.200 0.400 A 134 ILE H H 1 8.670 0.020 A 134 ILE HA H 1 3.788 0.020 A 134 ILE HB H 1 1.272 0.020 A 134 ILE HD1% H 1 0.662 0.020 A 134 ILE HG2% H 1 0.687 0.020 A 134 ILE C C 13 177.215 0.400 A 134 ILE CA C 13 63.584 0.400 A 134 ILE CB C 13 35.636 0.400 A 134 ILE CD1 C 13 13.237 0.400 A 134 ILE CG2 C 13 17.424 0.400 A 134 ILE N N 15 122.564 0.400 A 135 ALA H H 1 6.898 0.020 A 135 ALA HA H 1 4.357 0.020 A 135 ALA HB% H 1 1.469 0.020 A 135 ALA C C 13 177.786 0.400 A 135 ALA CA C 13 51.521 0.400 A 135 ALA CB C 13 18.839 0.400 A 135 ALA N N 15 119.989 0.400 A 136 GLY H H 1 7.913 0.020 A 136 GLY HA2 H 1 4.595 0.020 A 136 GLY C C 13 176.324 0.400 A 136 GLY CA C 13 45.469 0.400 A 136 GLY N N 15 107.682 0.400 A 137 LYS H H 1 8.312 0.020 A 137 LYS HA H 1 4.004 0.020 A 137 LYS C C 13 176.616 0.400 A 137 LYS CA C 13 57.499 0.400 A 137 LYS CB C 13 30.927 0.400 A 137 LYS N N 15 117.213 0.400 A 138 ASP H H 1 8.465 0.020 A 138 ASP HA H 1 3.061 0.020 A 138 ASP HBy H 1 1.515 0.020 A 138 ASP HBx H 1 0.157 0.020 A 138 ASP C C 13 174.698 0.400 A 138 ASP CA C 13 53.694 0.400 A 138 ASP CB C 13 36.008 0.400 A 138 ASP N N 15 113.545 0.400 A 139 VAL H H 1 6.610 0.020 A 139 VAL HA H 1 3.886 0.020 A 139 VAL HB H 1 2.077 0.020 A 139 VAL HG1% H 1 0.846 0.020 A 139 VAL HG2% H 1 0.886 0.020 A 139 VAL C C 13 175.889 0.400 A 139 VAL CA C 13 62.793 0.400 A 139 VAL CB C 13 30.662 0.400 A 139 VAL CG1 C 13 20.532 0.400 A 139 VAL CG2 C 13 19.906 0.400 A 139 VAL N N 15 115.191 0.400 A 140 ASP H H 1 7.553 0.020 A 140 ASP C C 13 175.234 0.400 A 140 ASP CA C 13 50.221 0.400 A 140 ASP CB C 13 42.254 0.400 A 140 ASP N N 15 123.363 0.400 A 141 PRO HA H 1 4.682 0.020 A 141 PRO HBy H 1 2.469 0.020 A 141 PRO HBx H 1 2.074 0.020 A 141 PRO C C 13 178.678 0.400 A 141 PRO CA C 13 64.532 0.400 A 141 PRO CB C 13 31.331 0.400 A 142 SER H H 1 8.703 0.020 A 142 SER HA H 1 4.565 0.020 A 142 SER HB2 H 1 3.979 0.020 A 142 SER HB3 H 1 3.979 0.020 A 142 SER C C 13 176.524 0.400 A 142 SER CA C 13 58.711 0.400 A 142 SER CB C 13 62.783 0.400 A 142 SER N N 15 114.421 0.400 A 143 TRP H H 1 8.374 0.020 A 143 TRP HA H 1 4.136 0.020 A 143 TRP HD1 H 1 7.771 0.020 A 143 TRP HE1 H 1 10.404 0.020 A 143 TRP HE3 H 1 6.945 0.020 A 143 TRP HH2 H 1 7.022 0.020 A 143 TRP HZ2 H 1 7.501 0.020 A 143 TRP HZ3 H 1 6.569 0.020 A 143 TRP C C 13 177.113 0.400 A 143 TRP CA C 13 59.803 0.400 A 143 TRP CB C 13 26.364 0.400 A 143 TRP CD1 C 13 128.937 0.400 A 143 TRP CE3 C 13 122.326 0.400 A 143 TRP CH2 C 13 123.218 0.400 A 143 TRP CZ2 C 13 114.051 0.400 A 143 TRP CZ3 C 13 121.706 0.400 A 143 TRP N N 15 123.598 0.400 A 143 TRP NE1 N 15 131.019 0.400 A 144 LYS H H 1 7.196 0.020 A 144 LYS HA H 1 2.719 0.020 A 144 LYS C C 13 177.243 0.400 A 144 LYS CA C 13 58.851 0.400 A 144 LYS CB C 13 29.373 0.400 A 144 LYS N N 15 119.293 0.400 A 145 LYS H H 1 7.389 0.020 A 145 LYS HA H 1 3.490 0.020 A 145 LYS HB2 H 1 1.761 0.020 A 145 LYS HB3 H 1 1.761 0.020 A 145 LYS C C 13 179.149 0.400 A 145 LYS CA C 13 59.271 0.400 A 145 LYS CB C 13 30.521 0.400 A 145 LYS N N 15 116.440 0.400 A 146 ALA H H 1 7.112 0.020 A 146 ALA HA H 1 3.932 0.020 A 146 ALA HB% H 1 1.355 0.020 A 146 ALA C C 13 179.968 0.400 A 146 ALA CA C 13 54.241 0.400 A 146 ALA CB C 13 17.689 0.400 A 146 ALA N N 15 118.582 0.400 A 147 ILE H H 1 6.734 0.020 A 147 ILE HA H 1 3.642 0.020 A 147 ILE HB H 1 1.406 0.020 A 147 ILE HD1% H 1 -0.090 0.020 A 147 ILE HG1y H 1 1.356 0.020 A 147 ILE HG1x H 1 0.721 0.020 A 147 ILE HG2% H 1 0.737 0.020 A 147 ILE C C 13 178.919 0.400 A 147 ILE CA C 13 64.418 0.400 A 147 ILE CB C 13 36.519 0.400 A 147 ILE CD1 C 13 13.086 0.400 A 147 ILE CG2 C 13 17.249 0.400 A 147 ILE N N 15 118.537 0.400 A 148 TYR H H 1 8.126 0.020 A 148 TYR HA H 1 4.489 0.020 A 148 TYR HD1 H 1 6.713 0.020 A 148 TYR HD2 H 1 6.699 0.020 A 148 TYR HE1 H 1 5.945 0.020 A 148 TYR HE2 H 1 5.945 0.020 A 148 TYR C C 13 178.348 0.400 A 148 TYR CA C 13 57.389 0.400 A 148 TYR CB C 13 35.280 0.400 A 148 TYR CD1 C 13 131.333 0.400 A 148 TYR CD2 C 13 131.333 0.400 A 148 TYR CE1 C 13 117.938 0.400 A 148 TYR CE2 C 13 117.938 0.400 A 148 TYR N N 15 121.033 0.400 A 149 LYS H H 1 7.364 0.020 A 149 LYS C C 13 178.051 0.400 A 149 LYS CA C 13 59.036 0.400 A 149 LYS CB C 13 31.575 0.400 A 149 LYS N N 15 114.484 0.400 A 150 VAL H H 1 7.254 0.020 A 150 VAL HA H 1 3.770 0.020 A 150 VAL HB H 1 2.303 0.020 A 150 VAL HG1% H 1 1.023 0.020 A 150 VAL HG2% H 1 0.970 0.020 A 150 VAL C C 13 178.786 0.400 A 150 VAL CA C 13 65.070 0.400 A 150 VAL CB C 13 29.515 0.400 A 150 VAL CG1 C 13 20.809 0.400 A 150 VAL CG2 C 13 21.547 0.400 A 150 VAL N N 15 117.812 0.400 A 151 ILE H H 1 8.154 0.020 A 151 ILE HB H 1 2.647 0.020 A 151 ILE HD1% H 1 0.864 0.020 A 151 ILE HG2% H 1 1.210 0.020 A 151 ILE C C 13 180.539 0.400 A 151 ILE CA C 13 61.490 0.400 A 151 ILE CB C 13 33.994 0.400 A 151 ILE CD1 C 13 10.153 0.400 A 151 ILE CG2 C 13 18.368 0.400 A 151 ILE N N 15 117.884 0.400 A 152 CYS H H 1 8.711 0.020 A 152 CYS HA H 1 4.153 0.020 A 152 CYS HBy H 1 2.147 0.020 A 152 CYS HBx H 1 1.897 0.020 A 152 CYS C C 13 174.888 0.400 A 152 CYS CA C 13 61.052 0.400 A 152 CYS CB C 13 36.364 0.400 A 152 CYS N N 15 118.649 0.400 A 153 LYS H H 1 6.782 0.020 A 153 LYS C C 13 177.389 0.400 A 153 LYS CA C 13 56.243 0.400 A 153 LYS CB C 13 31.343 0.400 A 153 LYS N N 15 118.498 0.400 A 154 LEU H H 1 7.616 0.020 A 154 LEU HA H 1 4.576 0.020 A 154 LEU HD1% H 1 1.019 0.020 A 154 LEU HD2% H 1 0.778 0.020 A 154 LEU HG H 1 1.804 0.020 A 154 LEU C C 13 177.161 0.400 A 154 LEU CA C 13 53.782 0.400 A 154 LEU CB C 13 40.881 0.400 A 154 LEU CD1 C 13 27.613 0.400 A 154 LEU CD2 C 13 22.133 0.400 A 154 LEU N N 15 117.318 0.400 A 155 ASP H H 1 7.582 0.020 A 155 ASP C C 13 177.094 0.400 A 155 ASP CA C 13 55.732 0.400 A 155 ASP CB C 13 40.139 0.400 A 155 ASP N N 15 121.564 0.400 A 156 SER H H 1 8.846 0.020 A 156 SER HA H 1 4.818 0.020 A 156 SER HBy H 1 4.220 0.020 A 156 SER HBx H 1 3.988 0.020 A 156 SER C C 13 173.409 0.400 A 156 SER CA C 13 57.073 0.400 A 156 SER CB C 13 65.150 0.400 A 156 SER N N 15 117.352 0.400 A 157 GLU H H 1 8.356 0.020 A 157 GLU HA H 1 4.038 0.020 A 157 GLU HB2 H 1 1.870 0.020 A 157 GLU HB3 H 1 1.870 0.020 A 157 GLU C C 13 176.332 0.400 A 157 GLU CA C 13 56.464 0.400 A 157 GLU CB C 13 29.206 0.400 A 157 GLU N N 15 120.688 0.400 A 158 VAL H H 1 8.561 0.020 A 158 VAL HA H 1 3.449 0.020 A 158 VAL HB H 1 1.372 0.020 A 158 VAL HG1% H 1 0.177 0.020 A 158 VAL HG2% H 1 0.511 0.020 A 158 VAL C C 13 176.382 0.400 A 158 VAL CA C 13 59.584 0.400 A 158 VAL CB C 13 31.160 0.400 A 158 VAL CG1 C 13 22.794 0.400 A 158 VAL CG2 C 13 22.614 0.400 A 158 VAL N N 15 126.906 0.400 A 159 PRO HA H 1 4.403 0.020 A 159 PRO HBy H 1 2.202 0.020 A 159 PRO HBx H 1 1.986 0.020 A 159 PRO C C 13 176.757 0.400 A 159 PRO CA C 13 63.845 0.400 A 159 PRO CB C 13 32.106 0.400 A 159 PRO CD C 13 51.267 0.400 A 159 PRO CG C 13 27.458 0.400 A 160 GLU H H 1 8.650 0.020 A 160 GLU HA H 1 4.008 0.020 A 160 GLU HB2 H 1 2.074 0.020 A 160 GLU HB3 H 1 2.074 0.020 A 160 GLU C C 13 179.132 0.400 A 160 GLU CA C 13 59.407 0.400 A 160 GLU CB C 13 28.991 0.400 A 160 GLU N N 15 122.904 0.400 A 161 ILE H H 1 8.448 0.020 A 161 ILE HA H 1 4.146 0.020 A 161 ILE HB H 1 1.865 0.020 A 161 ILE HD1% H 1 0.825 0.020 A 161 ILE HG1y H 1 1.252 0.020 A 161 ILE HG1x H 1 1.102 0.020 A 161 ILE HG2% H 1 0.722 0.020 A 161 ILE C C 13 176.176 0.400 A 161 ILE CA C 13 62.034 0.400 A 161 ILE CB C 13 37.113 0.400 A 161 ILE CD1 C 13 13.982 0.400 A 161 ILE CG1 C 13 28.796 0.400 A 161 ILE CG2 C 13 18.464 0.400 A 161 ILE N N 15 119.782 0.400 A 162 PHE H H 1 8.145 0.020 A 162 PHE C C 13 176.115 0.400 A 162 PHE CA C 13 61.009 0.400 A 162 PHE CB C 13 38.394 0.400 A 162 PHE N N 15 117.594 0.400 A 163 LYS H H 1 8.232 0.020 A 163 LYS C C 13 178.196 0.400 A 163 LYS CA C 13 58.136 0.400 A 163 LYS CB C 13 31.694 0.400 A 163 LYS N N 15 116.083 0.400 A 164 SER H H 1 7.708 0.020 A 164 SER CA C 13 55.205 0.400 A 164 SER CB C 13 63.265 0.400 A 164 SER N N 15 113.680 0.400 A 165 PRO HA H 1 4.580 0.020 A 165 PRO HBy H 1 2.252 0.020 A 165 PRO HBx H 1 1.965 0.020 A 165 PRO C C 13 177.541 0.400 A 165 PRO CA C 13 63.950 0.400 A 165 PRO CB C 13 30.686 0.400 A 166 ASN H H 1 8.216 0.020 A 166 ASN HA H 1 5.029 0.020 A 166 ASN HBy H 1 2.943 0.020 A 166 ASN HBx H 1 2.499 0.020 A 166 ASN C C 13 175.811 0.400 A 166 ASN CA C 13 51.962 0.400 A 166 ASN CB C 13 37.915 0.400 A 166 ASN N N 15 116.304 0.400 A 167 CYS H H 1 7.246 0.020 A 167 CYS HA H 1 4.011 0.020 A 167 CYS HBy H 1 3.329 0.020 A 167 CYS HBx H 1 2.530 0.020 A 167 CYS C C 13 175.057 0.400 A 167 CYS CA C 13 59.816 0.400 A 167 CYS CB C 13 27.446 0.400 A 167 CYS N N 15 116.078 0.400 A 168 LEU H H 1 8.451 0.020 A 168 LEU HA H 1 3.880 0.020 A 168 LEU HBy H 1 1.735 0.020 A 168 LEU HBx H 1 1.432 0.020 A 168 LEU HD1% H 1 0.307 0.020 A 168 LEU HD2% H 1 0.792 0.020 A 168 LEU C C 13 178.541 0.400 A 168 LEU CA C 13 57.734 0.400 A 168 LEU CB C 13 38.825 0.400 A 168 LEU CD1 C 13 25.677 0.400 A 168 LEU CD2 C 13 23.468 0.400 A 168 LEU N N 15 120.082 0.400 A 169 GLN H H 1 7.665 0.020 A 169 GLN HA H 1 4.064 0.020 A 169 GLN HB2 H 1 2.081 0.020 A 169 GLN HB3 H 1 2.081 0.020 A 169 GLN C C 13 177.378 0.400 A 169 GLN CA C 13 57.675 0.400 A 169 GLN CB C 13 27.710 0.400 A 169 GLN N N 15 116.700 0.400 A 170 GLU H H 1 7.405 0.020 A 170 GLU HA H 1 4.214 0.020 A 170 GLU HBy H 1 2.033 0.020 A 170 GLU HBx H 1 1.826 0.020 A 170 GLU C C 13 177.730 0.400 A 170 GLU CA C 13 56.899 0.400 A 170 GLU N N 15 116.701 0.400 A 171 LEU H H 1 7.823 0.020 A 171 LEU HA H 1 4.209 0.020 A 171 LEU HBy H 1 1.602 0.020 A 171 LEU HBx H 1 1.548 0.020 A 171 LEU HD1% H 1 0.882 0.020 A 171 LEU HD2% H 1 0.661 0.020 A 171 LEU HG H 1 1.503 0.020 A 171 LEU C C 13 177.005 0.400 A 171 LEU CA C 13 55.870 0.400 A 171 LEU CB C 13 43.680 0.400 A 171 LEU CD1 C 13 25.906 0.400 A 171 LEU CD2 C 13 22.670 0.400 A 171 LEU N N 15 118.021 0.400 A 172 LEU H H 1 7.306 0.020 A 172 LEU HA H 1 4.571 0.020 A 172 LEU HBy H 1 1.694 0.020 A 172 LEU HBx H 1 1.367 0.020 A 172 LEU HD1% H 1 0.756 0.020 A 172 LEU HD2% H 1 0.844 0.020 A 172 LEU HG H 1 1.029 0.020 A 172 LEU C C 13 176.411 0.400 A 172 LEU CA C 13 53.972 0.400 A 172 LEU CB C 13 40.483 0.400 A 172 LEU CD1 C 13 22.477 0.400 A 172 LEU CD2 C 13 25.711 0.400 A 172 LEU CG C 13 25.690 0.400 A 172 LEU N N 15 117.580 0.400 A 173 HIS H H 1 8.028 0.020 A 173 HIS C C 13 179.022 0.400 A 173 HIS CA C 13 56.693 0.400 A 173 HIS CB C 13 29.371 0.400 A 173 HIS N N 15 123.310 0.400 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 28 MET HE% A 44 PHE HE2 1.0 1.8 3.98 2 2 A 86 SER HA A 87 THR HG2% 1.0 1.8 5.16 3 3 A 87 THR HG2% A 127 ARG HA 1.0 1.8 3.91 4 4 A 72 MET HE% A 126 LEU HD2% 1.0 1.8 4.08 5 5 A 75 TYR HE2 A 102 LEU HD2% 1.0 1.8 4.13 6 6 A 85 THR HG2% A 86 SER H 1.0 1.8 5.06 7 7 A 79 ALA HB% A 84 VAL HG2% 1.0 1.8 3.66 8 8 A 84 VAL HG2% A 84 VAL HA 1.0 1.8 3.78 9 9 A 84 VAL HG2% A 85 THR H 1.0 1.8 4.90 10 10 A 84 VAL HG2% A 82 ASP H 1.0 1.8 4.93 11 11 A 86 SER H A 84 VAL HG2% 1.0 1.8 5.37 12 12 A 125 THR H A 151 ILE HD1% 1.0 1.8 6.10 13 13 A 151 ILE HD1% A 150 VAL H 1.0 1.8 4.93 14 14 A 80 ILE HG2% A 80 ILE HD1% 1.0 1.8 3.70 15 15 A 80 ILE HD1% A 134 ILE H 1.0 1.8 4.49 16 16 A 80 ILE HD1% A 81 ASN H 1.0 1.8 4.99 17 17 A 80 ILE HD1% A 135 ALA H 1.0 1.8 5.90 18 18 A 168 LEU HD1% A 171 LEU H 1.0 1.8 5.39 19 19 A 168 LEU HD1% A 168 LEU HBx 1.0 1.8 4.67 20 20 A 171 LEU H A 168 LEU HD2% 1.0 1.8 4.22 21 21 A 160 GLU H A 161 ILE HG2% 1.0 1.8 6.27 22 22 A 161 ILE HG2% A 161 ILE HA 1.0 1.8 4.11 23 23 A 17 LEU HD1% A 57 LEU H 1.0 1.8 5.51 24 24 A 17 LEU HD1% A 21 HIS HE1 1.0 1.8 6.33 25 25 A 17 LEU HD2% A 49 PHE HE1 1.0 1.8 6.03 26 26 A 161 ILE HB A 161 ILE HD1% 1.0 1.8 3.35 27 27 A 58 ILE HB A 58 ILE HD1% 1.0 1.8 4.03 28 28 A 124 ILE H A 124 ILE HG2% 1.0 1.8 4.36 29 29 A 124 ILE HB A 154 LEU HD1% 1.0 1.8 4.03 30 30 A 125 THR H A 154 LEU HD1% 1.0 1.8 5.74 31 31 A 124 ILE H A 154 LEU HD1% 1.0 1.8 5.88 32 32 A 154 LEU HD1% A 151 ILE H 1.0 1.8 6.30 33 33 A 92 ILE HG2% A 92 ILE HD1% 1.0 1.8 3.61 34 34 A 134 ILE H A 134 ILE HD1% 1.0 1.8 4.65 35 35 A 92 ILE HD1% A 92 ILE H 1.0 1.8 4.83 36 36 A 131 ASN HA A 134 ILE HG2% 1.0 1.8 3.67 37 37 A 133 ILE HD1% A 143 TRP HE3 1.0 1.8 4.92 38 38 A 124 ILE H A 124 ILE HD1% 1.0 1.8 4.22 39 39 A 125 THR H A 124 ILE HD1% 1.0 1.8 5.16 40 40 A 124 ILE HB A 124 ILE HD1% 1.0 1.8 3.58 41 41 A 22 LEU HD2% A 25 ALA HB% 1.0 1.8 5.65 42 42 A 89 GLU H A 90 LEU HD2% 1.0 1.8 4.61 43 43 A 95 ASP H A 119 LEU HD1% 1.0 1.8 5.50 44 44 A 92 ILE H A 119 LEU HD1% 1.0 1.8 5.95 45 45 A 169 GLN H A 171 LEU HD2% 1.0 1.8 5.36 46 46 A 44 PHE HD1 A 57 LEU HD1% 1.0 1.8 4.68 47 47 A 49 PHE HE1 A 57 LEU HD1% 1.0 1.8 4.27 48 48 A 75 TYR HE2 A 98 LEU HD1% 1.0 1.8 4.37 49 49 A 98 LEU HD1% A 98 LEU H 1.0 1.8 5.11 50 50 A 126 LEU HD2% A 87 THR H 1.0 1.8 6.23 51 51 A 98 LEU H A 98 LEU HD2% 1.0 1.8 4.99 52 52 A 75 TYR HE2 A 98 LEU HD2% 1.0 1.8 6.33 53 53 A 98 LEU HD2% A 99 TYR HD1 1.0 1.8 6.33 54 54 A 143 TRP HZ3 A 147 ILE HD1% 1.0 1.8 4.60 55 55 A 147 ILE HD1% A 148 TYR H 1.0 1.8 5.36 56 56 A 147 ILE HD1% A 133 ILE H 1.0 1.8 6.33 57 57 A 49 PHE HD1 A 57 LEU HD2% 1.0 1.8 5.75 58 58 A 114 VAL HA A 114 VAL HG1% 1.0 1.8 4.37 59 59 A 114 VAL HG1% A 113 GLU HA 1.0 1.8 5.55 60 60 A 139 VAL HA A 139 VAL HG1% 1.0 1.8 3.37 61 61 A 125 THR HG2% A 151 ILE HG2% 1.0 1.8 4.55 62 62 A 151 ILE HG2% A 129 PHE HE1 1.0 1.8 5.89 63 63 A 151 ILE HG2% A 126 LEU H 1.0 1.8 6.22 64 64 A 151 ILE HG2% A 154 LEU HG 1.0 1.8 4.68 65 65 A 93 THR H A 122 ALA HB% 1.0 1.8 5.44 66 66 A 13 MET H A 13 MET HE% 1.0 1.8 4.34 67 67 A 124 ILE H A 125 THR HG2% 1.0 1.8 5.75 68 68 A 85 THR HG2% A 85 THR HA 1.0 1.8 3.43 69 69 A 121 VAL HG2% A 122 ALA H 1.0 1.8 5.15 70 70 A 75 TYR H A 126 LEU HD1% 1.0 1.8 4.82 71 71 A 79 ALA HB% A 90 LEU HD1% 1.0 1.8 3.73 72 72 A 57 LEU HD1% A 60 TRP HH2 1.0 1.8 5.52 73 73 A 32 THR HG2% A 43 TYR HD1 1.0 1.8 4.63 74 74 A 135 ALA H A 133 ILE HG2% 1.0 1.8 5.58 75 75 A 92 ILE HD1% A 122 ALA HB% 1.0 1.8 3.89 76 76 A 124 ILE HD1% A 154 LEU HD2% 1.0 1.8 3.46 77 77 A 151 ILE HG2% A 149 LYS H 1.0 1.8 6.30 78 78 A 58 ILE HG2% A 58 ILE HG1x 1.0 1.8 3.75 79 79 A 58 ILE HG2% A 58 ILE HG1y 1.0 1.8 3.91 80 80 A 25 ALA HB% A 44 PHE HE1 1.0 1.8 4.42 81 81 A 44 PHE HE2 A 25 ALA HB% 1.0 1.8 4.93 82 82 A 39 MET HE% A 40 LEU HA 1.0 1.8 3.77 83 83 A 45 SER HA A 47 VAL HG2% 1.0 1.8 6.33 84 84 A 47 VAL HG2% A 48 LYS HA 1.0 1.8 6.33 85 85 A 47 VAL HG2% A 49 PHE HA 1.0 1.8 6.04 86 86 A 17 LEU HD2% A 49 PHE HA 1.0 1.8 5.44 87 87 A 17 LEU HD2% A 25 ALA HB% 1.0 1.8 5.54 88 88 A 17 LEU HD2% A 47 VAL HB 1.0 1.8 5.87 89 89 A 17 LEU HD2% A 53 ILE HB 1.0 1.8 4.93 90 90 A 43 TYR HD1 A 158 VAL HG1% 1.0 1.8 4.54 91 91 A 158 VAL HG1% A 39 MET HA 1.0 1.8 6.33 92 92 A 158 VAL HG1% A 158 VAL HA 1.0 1.8 4.63 93 93 A 157 GLU HA A 158 VAL HG2% 1.0 1.8 5.04 94 94 A 158 VAL HA A 158 VAL HG2% 1.0 1.8 4.51 95 95 A 57 LEU HD1% A 44 PHE H 1.0 1.8 6.33 96 96 A 90 LEU HD1% A 76 ALA HA 1.0 1.8 4.96 97 97 A 90 LEU HD1% A 87 THR HB 1.0 1.8 4.23 98 98 A 57 LEU HD1% A 39 MET HE% 1.0 1.8 5.91 99 99 A 57 LEU HD2% A 40 LEU HA 1.0 1.8 5.72 100 100 A 57 LEU HD2% A 58 ILE HG1y 1.0 1.8 5.11 101 101 A 57 LEU HD2% A 58 ILE HG1x 1.0 1.8 4.42 102 102 A 17 LEU HD1% A 57 LEU HG 1.0 1.8 4.11 103 103 A 90 LEU HD2% A 87 THR HA 1.0 1.8 4.73 104 104 A 44 PHE HE1 A 47 VAL HG1% 1.0 1.8 6.33 105 105 A 48 LYS HA A 47 VAL HG1% 1.0 1.8 4.78 106 106 A 118 PHE H A 119 LEU HD2% 1.0 1.8 4.91 107 107 A 98 LEU HD1% A 102 LEU HBx 1.0 1.8 5.61 108 108 A 98 LEU HD1% A 102 LEU HBy 1.0 1.8 5.61 109 109 A 172 LEU HD1% A 173 HIS H 1.0 1.8 5.18 110 110 A 119 LEU HD1% A 93 THR HA 1.0 1.8 4.11 111 111 A 119 LEU HD1% A 119 LEU HBy 1.0 1.8 3.83 112 112 A 168 LEU HD2% A 169 GLN H 1.0 1.8 5.50 113 113 A 121 VAL HA A 121 VAL HG1% 1.0 1.8 4.29 114 114 A 92 ILE HG2% A 119 LEU HBy 1.0 1.8 5.53 115 115 A 121 VAL HG2% A 152 CYS H 1.0 1.8 5.70 116 116 A 121 VAL HG2% A 154 LEU HA 1.0 1.8 5.78 117 117 A 121 VAL HG2% A 152 CYS HA 1.0 1.8 5.38 118 118 A 102 LEU HD2% A 101 ALA HA 1.0 1.8 6.06 119 119 A 76 ALA HB% A 129 PHE HA 1.0 1.8 5.08 120 120 A 76 ALA HB% A 73 GLU HA 1.0 1.8 4.74 121 121 A 39 MET HE% A 44 PHE H 1.0 1.8 4.97 122 122 A 25 ALA HB% A 61 PHE H 1.0 1.8 6.33 123 123 A 25 ALA HB% A 57 LEU HA 1.0 1.8 5.50 124 124 A 126 LEU H A 122 ALA HB% 1.0 1.8 5.45 125 125 A 58 ILE HG2% A 57 LEU HB3 1.0 1.8 6.20 126 126 A 124 ILE HG2% A 150 VAL HB 1.0 1.8 4.85 127 127 A 168 LEU HBy A 171 LEU HD1% 1.0 1.8 4.11 128 128 A 32 THR HG2% A 158 VAL HB 1.0 1.8 5.39 129 129 A 80 ILE HD1% A 131 ASN HA 1.0 1.8 5.22 130 130 A 80 ILE HD1% A 133 ILE HB 1.0 1.8 4.36 131 131 A 124 ILE HD1% A 121 VAL HA 1.0 1.8 4.09 132 132 A 80 ILE HG2% A 81 ASN HA 1.0 1.8 4.76 133 133 A 147 ILE HD1% A 132 ALA HB% 1.0 1.8 4.24 134 134 A 147 ILE HD1% A 147 ILE HG2% 1.0 1.8 3.85 135 135 A 154 LEU HD1% A 121 VAL HA 1.0 1.8 5.21 136 136 A 161 ILE HD1% A 167 CYS H 1.0 1.8 4.86 137 137 A 60 TRP HH2 A 22 LEU HD1% 1.0 1.8 5.40 138 138 A 22 LEU HD1% A 60 TRP HE3 1.0 1.8 4.53 139 139 A 25 ALA HB% A 22 LEU HD1% 1.0 1.8 4.27 140 140 A 28 MET HE% A 44 PHE HZ 1.0 1.8 4.43 141 141 A 28 MET HE% A 44 PHE H 1.0 1.8 5.58 142 142 A 28 MET HE% A 43 TYR HE1 1.0 1.8 5.01 143 143 A 87 THR HG2% A 90 LEU HD1% 1.0 1.8 3.89 144 144 A 87 THR HG2% A 131 ASN H 1.0 1.8 5.12 145 145 A 87 THR HG2% A 128 GLU H 1.0 1.8 5.64 146 146 A 87 THR HG2% A 127 ARG H 1.0 1.8 4.30 147 147 A 87 THR HG2% A 86 SER H 1.0 1.8 5.91 148 148 A 87 THR HG2% A 87 THR HA 1.0 1.8 3.66 149 149 A 87 THR HG2% A 79 ALA HB% 1.0 1.8 4.82 150 150 A 87 THR HG2% A 126 LEU HG 1.0 1.8 4.00 151 151 A 87 THR HG2% A 84 VAL HG1% 1.0 1.8 5.29 152 152 A 72 MET HE% A 102 LEU HD1% 1.0 1.8 3.60 153 153 A 72 MET HE% A 126 LEU HD1% 1.0 1.8 3.70 154 154 A 72 MET HE% A 102 LEU HD2% 1.0 1.8 3.99 155 155 A 72 MET HE% A 106 TYR HE2 1.0 1.8 5.07 156 156 A 72 MET HE% A 91 SER H 1.0 1.8 6.33 157 157 A 72 MET HE% A 126 LEU HA 1.0 1.8 6.33 158 158 A 72 MET HE% A 75 TYR HD2 1.0 1.8 4.70 159 159 A 102 LEU HD2% A 105 HIS H 1.0 1.8 6.22 160 160 A 102 LEU HD2% A 106 TYR HD2 1.0 1.8 4.52 161 161 A 58 ILE HG1y A 54 THR HG2% 1.0 1.8 4.32 162 162 A 47 VAL HG1% A 54 THR HG2% 1.0 1.8 6.33 163 163 A 57 LEU H A 54 THR HG2% 1.0 1.8 5.85 164 164 A 84 VAL HG2% A 82 ASP HB3 1.0 1.8 4.30 165 165 A 151 ILE HD1% A 151 ILE H 1.0 1.8 4.89 166 166 A 80 ILE HD1% A 133 ILE HG2% 1.0 1.8 3.81 167 167 A 80 ILE HD1% A 133 ILE H 1.0 1.8 5.32 168 168 A 80 ILE HD1% A 77 ARG H 1.0 1.8 6.14 169 169 A 80 ILE HD1% A 78 GLN H 1.0 1.8 6.33 170 170 A 80 ILE HD1% A 84 VAL H 1.0 1.8 6.33 171 171 A 168 LEU HD1% A 167 CYS H 1.0 1.8 4.39 172 172 A 168 LEU HD1% A 167 CYS HA 1.0 1.8 5.55 173 173 A 168 LEU HD1% A 168 LEU HA 1.0 1.8 4.76 174 174 A 168 LEU HD2% A 171 LEU HG 1.0 1.8 3.36 175 175 A 161 ILE HG2% A 163 LYS H 1.0 1.8 4.73 176 176 A 17 LEU HD2% A 57 LEU HG 1.0 1.8 4.12 177 177 A 21 HIS HE1 A 47 VAL HG2% 1.0 1.8 3.81 178 178 A 17 LEU HD1% A 22 LEU HD1% 1.0 1.8 5.95 179 179 A 17 LEU HD2% A 17 LEU H 1.0 1.8 4.65 180 180 A 17 LEU HD2% A 60 TRP HH2 1.0 1.8 4.82 181 181 A 17 LEU HD1% A 60 TRP HH2 1.0 1.8 4.95 182 182 A 80 ILE HG2% A 133 ILE HG2% 1.0 1.8 3.66 183 183 A 80 ILE HG2% A 80 ILE H 1.0 1.8 4.53 184 184 A 58 ILE HD1% A 54 THR HG2% 1.0 1.8 3.58 185 185 A 124 ILE HG2% A 124 ILE HA 1.0 1.8 4.03 186 186 A 70 ILE HG2% A 70 ILE HD1% 1.0 1.8 3.68 187 187 A 151 ILE HD1% A 147 ILE HG2% 1.0 1.8 3.84 188 188 A 151 ILE H A 147 ILE HG2% 1.0 1.8 5.55 189 189 A 147 ILE HG2% A 147 ILE H 1.0 1.8 4.70 190 190 A 154 LEU HD1% A 121 VAL H 1.0 1.8 5.80 191 191 A 92 ILE HG2% A 92 ILE H 1.0 1.8 4.58 192 192 A 134 ILE HD1% A 134 ILE HA 1.0 1.8 4.22 193 193 A 134 ILE HG2% A 134 ILE HA 1.0 1.8 3.89 194 194 A 147 ILE HG2% A 148 TYR HD2 1.0 1.8 4.66 195 195 A 133 ILE HD1% A 133 ILE HG2% 1.0 1.8 3.76 196 196 A 133 ILE HD1% A 143 TRP HZ3 1.0 1.8 5.16 197 197 A 133 ILE HD1% A 133 ILE H 1.0 1.8 4.70 198 198 A 134 ILE H A 133 ILE HG2% 1.0 1.8 4.90 199 199 A 22 LEU HD2% A 60 TRP HH2 1.0 1.8 5.62 200 200 A 22 LEU HD2% A 60 TRP HE3 1.0 1.8 5.47 201 201 A 114 VAL HG1% A 119 LEU H 1.0 1.8 5.43 202 202 A 79 ALA HB% A 90 LEU HD2% 1.0 1.8 3.36 203 203 A 87 THR HG2% A 90 LEU HD2% 1.0 1.8 4.37 204 204 A 90 LEU HD2% A 90 LEU HBx 1.0 1.8 4.11 205 205 A 84 VAL HG2% A 90 LEU HD2% 1.0 1.8 3.60 206 206 A 90 LEU HD2% A 91 SER H 1.0 1.8 4.36 207 207 A 90 LEU HD2% A 87 THR H 1.0 1.8 4.78 208 208 A 173 HIS H A 172 LEU HD2% 1.0 1.8 6.33 209 209 A 119 LEU HD1% A 123 GLN H 1.0 1.8 5.60 210 210 A 119 LEU HD1% A 93 THR H 1.0 1.8 4.24 211 211 A 171 LEU H A 172 LEU HD2% 1.0 1.8 6.23 212 212 A 119 LEU HD2% A 99 TYR HD2 1.0 1.8 6.16 213 213 A 119 LEU HD2% A 119 LEU H 1.0 1.8 4.05 214 214 A 171 LEU HD2% A 168 LEU H 1.0 1.8 5.60 215 215 A 171 LEU H A 171 LEU HD2% 1.0 1.8 4.59 216 216 A 171 LEU HD1% A 168 LEU H 1.0 1.8 5.81 217 217 A 57 LEU HD1% A 49 PHE HZ 1.0 1.8 5.62 218 218 A 57 LEU HD1% A 44 PHE HE1 1.0 1.8 4.19 219 219 A 57 LEU HD2% A 44 PHE HE1 1.0 1.8 3.88 220 220 A 98 LEU HD1% A 75 TYR HD2 1.0 1.8 4.88 221 221 A 119 LEU HD2% A 93 THR HG2% 1.0 1.8 4.36 222 222 A 147 ILE HD1% A 129 PHE HD2 1.0 1.8 4.59 223 223 A 143 TRP HE3 A 147 ILE HD1% 1.0 1.8 4.39 224 224 A 147 ILE HD1% A 143 TRP HD1 1.0 1.8 6.33 225 225 A 147 ILE HD1% A 129 PHE HE2 1.0 1.8 4.78 226 226 A 147 ILE HD1% A 128 GLU H 1.0 1.8 6.33 227 227 A 21 HIS HE1 A 47 VAL HG1% 1.0 1.8 4.92 228 228 A 49 PHE HD1 A 47 VAL HG1% 1.0 1.8 4.66 229 229 A 32 THR HG2% A 158 VAL HG2% 1.0 1.8 4.45 230 230 A 80 ILE HD1% A 133 ILE HD1% 1.0 1.8 4.60 231 231 A 119 LEU HD1% A 114 VAL HG2% 1.0 1.8 4.61 232 232 A 114 VAL HG1% A 118 PHE H 1.0 1.8 5.95 233 233 A 139 VAL HG1% A 139 VAL H 1.0 1.8 3.97 234 234 A 151 ILE HD1% A 151 ILE HG2% 1.0 1.8 3.82 235 235 A 154 LEU HD1% A 151 ILE HG2% 1.0 1.8 4.32 236 236 A 151 ILE H A 151 ILE HG2% 1.0 1.8 4.96 237 237 A 151 ILE HG2% A 153 LYS H 1.0 1.8 6.15 238 238 A 151 ILE HG2% A 152 CYS HA 1.0 1.8 6.33 239 239 A 25 ALA HB% A 44 PHE HZ 1.0 1.8 4.54 240 240 A 32 THR HG2% A 39 MET HE% 1.0 1.8 3.89 241 241 A 39 MET HE% A 158 VAL HG1% 1.0 1.8 4.38 242 242 A 44 PHE HE1 A 39 MET HE% 1.0 1.8 4.40 243 243 A 43 TYR HD1 A 39 MET HE% 1.0 1.8 4.14 244 244 A 39 MET HE% A 43 TYR HE1 1.0 1.8 4.07 245 245 A 125 THR HG2% A 126 LEU HD1% 1.0 1.8 5.19 246 246 A 151 ILE HD1% A 125 THR HG2% 1.0 1.8 4.57 247 247 A 125 THR HG2% A 147 ILE HG2% 1.0 1.8 4.60 248 248 A 125 THR HG2% A 129 PHE HE1 1.0 1.8 4.63 249 249 A 125 THR HG2% A 129 PHE H 1.0 1.8 5.51 250 250 A 125 THR HG2% A 72 MET H 1.0 1.8 6.33 251 251 A 125 THR HG2% A 72 MET HA 1.0 1.8 5.70 252 252 A 93 THR HA A 93 THR HG2% 1.0 1.8 3.65 253 253 A 85 THR HG2% A 84 VAL HA 1.0 1.8 4.47 254 254 A 121 VAL HG2% A 155 ASP H 1.0 1.8 4.90 255 255 A 121 VAL HG2% A 121 VAL HA 1.0 1.8 4.26 256 256 A 126 LEU HD1% A 126 LEU HA 1.0 1.8 5.03 257 257 A 126 LEU HD1% A 76 ALA HA 1.0 1.8 4.80 258 258 A 90 LEU HD2% A 89 GLU HBy 1.0 1.8 4.51 259 259 A 90 LEU HD2% A 89 GLU HBx 1.0 1.8 4.51 260 260 A 90 LEU HD2% A 90 LEU HBy 1.0 1.8 4.11 261 261 A 133 ILE HD1% A 76 ALA HB% 1.0 1.8 3.93 262 262 A 125 THR HG2% A 122 ALA HB% 1.0 1.8 4.08 263 263 A 122 ALA HB% A 119 LEU HA 1.0 1.8 4.32 264 264 A 122 ALA HB% A 121 VAL HG1% 1.0 1.8 4.29 265 265 A 124 ILE HD1% A 121 VAL HG2% 1.0 1.8 4.34 266 266 A 126 LEU HD2% A 87 THR HA 1.0 1.8 4.84 267 267 A 102 LEU HD2% A 98 LEU HD2% 1.0 1.8 4.89 268 268 A 126 LEU HD1% A 72 MET H 1.0 1.8 5.42 269 269 A 75 TYR HE2 A 102 LEU HD1% 1.0 1.8 5.51 270 270 A 139 VAL HG2% A 140 ASP H 1.0 1.8 4.12 271 271 A 58 ILE HB A 54 THR HG2% 1.0 1.8 4.72 272 272 A 49 PHE HA A 54 THR HG2% 1.0 1.8 5.06 273 273 A 124 ILE HG2% A 154 LEU HD1% 1.0 1.8 3.58 274 274 A 28 MET HE% A 39 MET HE% 1.0 1.8 3.83 275 275 A 39 MET HE% A 40 LEU H 1.0 1.8 4.70 276 276 A 58 ILE HG2% A 54 THR HG2% 1.0 1.8 4.97 277 277 A 57 LEU HA A 22 LEU HD1% 1.0 1.8 5.55 278 278 A 57 LEU HD2% A 22 LEU HD1% 1.0 1.8 6.33 279 279 A 47 VAL HG2% A 49 PHE H 1.0 1.8 5.39 280 280 A 47 VAL HG2% A 44 PHE HA 1.0 1.8 4.69 281 281 A 47 VAL HG2% A 47 VAL HA 1.0 1.8 3.99 282 282 A 47 VAL HG2% A 44 PHE HB2 1.0 1.8 5.20 283 283 A 47 VAL HG2% A 44 PHE HB3 1.0 1.8 5.20 284 284 A 47 VAL HG2% A 57 LEU HG 1.0 1.8 5.89 285 285 A 158 VAL HG1% A 157 GLU HA 1.0 1.8 5.22 286 286 A 32 THR HG2% A 158 VAL HG1% 1.0 1.8 4.95 287 287 A 158 VAL HG2% A 159 PRO HA 1.0 1.8 4.93 288 288 A 158 VAL HG2% A 32 THR HB 1.0 1.8 6.01 289 289 A 158 VAL HG2% A 43 TYR HA 1.0 1.8 6.27 290 290 A 158 VAL HG2% A 159 PRO HBy 1.0 1.8 6.33 291 291 A 158 VAL HG2% A 159 PRO HBx 1.0 1.8 6.33 292 292 A 39 MET HE% A 158 VAL HG2% 1.0 1.8 4.54 293 293 A 114 VAL HG2% A 113 GLU H 1.0 1.8 5.13 294 294 A 113 GLU HA A 114 VAL HG2% 1.0 1.8 4.49 295 295 A 114 VAL HA A 114 VAL HG2% 1.0 1.8 4.42 296 296 A 114 VAL HG1% A 113 GLU H 1.0 1.8 6.33 297 297 A 114 VAL HG1% A 118 PHE HA 1.0 1.8 5.87 298 298 A 90 LEU HD1% A 90 LEU HA 1.0 1.8 5.00 299 299 A 90 LEU HD1% A 87 THR HA 1.0 1.8 4.58 300 300 A 25 ALA HB% A 57 LEU HD1% 1.0 1.8 5.19 301 301 A 57 LEU HD1% A 47 VAL HB 1.0 1.8 5.53 302 302 A 57 LEU HD1% A 47 VAL HG1% 1.0 1.8 3.80 303 303 A 168 LEU HD1% A 161 ILE HB 1.0 1.8 4.99 304 304 A 57 LEU HD2% A 61 PHE HA 1.0 1.8 6.21 305 305 A 25 ALA HB% A 57 LEU HD2% 1.0 1.8 4.17 306 306 A 57 LEU HD2% A 39 MET HE% 1.0 1.8 5.12 307 307 A 17 LEU HD1% A 25 ALA HB% 1.0 1.8 6.04 308 308 A 85 THR H A 90 LEU HD2% 1.0 1.8 6.23 309 309 A 90 LEU HD2% A 90 LEU HA 1.0 1.8 4.03 310 310 A 90 LEU HD2% A 79 ALA HA 1.0 1.8 4.86 311 311 A 90 LEU HD2% A 87 THR HB 1.0 1.8 5.06 312 312 A 47 VAL HG1% A 44 PHE HA 1.0 1.8 6.33 313 313 A 47 VAL HG1% A 47 VAL HA 1.0 1.8 4.14 314 314 A 49 PHE HA A 47 VAL HG1% 1.0 1.8 4.76 315 315 A 47 VAL HG1% A 41 LYS HA 1.0 1.8 6.33 316 316 A 47 VAL HG1% A 44 PHE HB2 1.0 1.8 6.15 317 317 A 47 VAL HG1% A 44 PHE HB3 1.0 1.8 6.15 318 318 A 53 ILE HB A 47 VAL HG1% 1.0 1.8 5.40 319 319 A 119 LEU HD2% A 114 VAL H 1.0 1.8 6.33 320 320 A 119 LEU HD2% A 120 GLU H 1.0 1.8 5.01 321 321 A 119 LEU HD2% A 93 THR HA 1.0 1.8 4.54 322 322 A 119 LEU HD2% A 118 PHE HA 1.0 1.8 5.78 323 323 A 119 LEU HD2% A 119 LEU HA 1.0 1.8 4.00 324 324 A 114 VAL HA A 119 LEU HD2% 1.0 1.8 5.22 325 325 A 119 LEU HD2% A 119 LEU HBx 1.0 1.8 3.90 326 326 A 98 LEU HD1% A 91 SER HA 1.0 1.8 4.68 327 327 A 171 LEU HD2% A 168 LEU HA 1.0 1.8 3.81 328 328 A 72 MET HE% A 98 LEU HD1% 1.0 1.8 3.94 329 329 A 171 LEU HD2% A 168 LEU HBy 1.0 1.8 4.26 330 330 A 84 VAL HG1% A 84 VAL H 1.0 1.8 4.42 331 331 A 172 LEU HD1% A 172 LEU H 1.0 1.8 5.75 332 332 A 85 THR HA A 84 VAL HG1% 1.0 1.8 4.86 333 333 A 172 LEU HD1% A 172 LEU HA 1.0 1.8 3.74 334 334 A 84 VAL HA A 84 VAL HG1% 1.0 1.8 3.94 335 335 A 84 VAL HG1% A 89 GLU HBy 1.0 1.8 4.44 336 336 A 172 LEU HD1% A 172 LEU HBy 1.0 1.8 3.70 337 337 A 172 LEU HD1% A 172 LEU HBx 1.0 1.8 3.70 338 338 A 85 THR HG2% A 84 VAL HG1% 1.0 1.8 5.40 339 339 A 168 LEU HD1% A 172 LEU HD1% 1.0 1.8 4.93 340 340 A 119 LEU HD1% A 122 ALA HA 1.0 1.8 6.33 341 341 A 172 LEU HD2% A 169 GLN HA 1.0 1.8 4.69 342 342 A 119 LEU HD1% A 119 LEU HA 1.0 1.8 4.04 343 343 A 172 LEU HD2% A 172 LEU HBy 1.0 1.8 3.61 344 344 A 172 LEU HD2% A 172 LEU HBx 1.0 1.8 3.61 345 345 A 126 LEU HD2% A 75 TYR H 1.0 1.8 6.33 346 346 A 98 LEU HD2% A 91 SER HA 1.0 1.8 5.31 347 347 A 168 LEU HD2% A 168 LEU H 1.0 1.8 5.01 348 348 A 168 LEU HD2% A 161 ILE HB 1.0 1.8 4.90 349 349 A 168 LEU HBx A 168 LEU HD2% 1.0 1.8 4.47 350 350 A 168 LEU HD2% A 161 ILE HG1x 1.0 1.8 5.27 351 351 A 125 THR HG2% A 121 VAL HG1% 1.0 1.8 4.70 352 352 A 161 ILE HG2% A 167 CYS HA 1.0 1.8 5.68 353 353 A 161 ILE HG2% A 161 ILE HG1y 1.0 1.8 4.00 354 354 A 161 ILE HG2% A 161 ILE HG1x 1.0 1.8 3.88 355 355 A 168 LEU HD1% A 161 ILE HG2% 1.0 1.8 4.65 356 356 A 134 ILE HG2% A 130 PHE HBy 1.0 1.8 5.85 357 357 A 134 ILE HG2% A 130 PHE HBx 1.0 1.8 5.85 358 358 A 134 ILE HG2% A 131 ASN HBy 1.0 1.8 5.52 359 359 A 134 ILE HG2% A 131 ASN HBx 1.0 1.8 5.52 360 360 A 134 ILE HG2% A 135 ALA HB% 1.0 1.8 4.05 361 361 A 129 PHE HA A 147 ILE HG2% 1.0 1.8 4.90 362 362 A 70 ILE HG2% A 70 ILE HA 1.0 1.8 3.97 363 363 A 151 ILE HG2% A 147 ILE HG2% 1.0 1.8 4.37 364 364 A 147 ILE HG2% A 148 TYR HE2 1.0 1.8 5.59 365 365 A 92 ILE HG2% A 92 ILE HA 1.0 1.8 4.03 366 366 A 147 ILE HG2% A 147 ILE HA 1.0 1.8 4.23 367 367 A 126 LEU HD1% A 91 SER HB2 1.0 1.8 6.04 368 368 A 126 LEU HD1% A 91 SER HB3 1.0 1.8 6.04 369 369 A 57 LEU HB3 A 54 THR HG2% 1.0 1.8 4.95 370 370 A 57 LEU HD1% A 54 THR HG2% 1.0 1.8 5.29 371 371 A 84 VAL HG2% A 82 ASP HA 1.0 1.8 5.58 372 372 A 84 VAL HG2% A 79 ALA HA 1.0 1.8 4.23 373 373 A 85 THR HG2% A 79 ALA HB% 1.0 1.8 6.33 374 374 A 119 LEU HD1% A 93 THR HG2% 1.0 1.8 4.76 375 375 A 102 LEU HD2% A 91 SER HA 1.0 1.8 5.78 376 376 A 102 LEU HD2% A 102 LEU HA 1.0 1.8 4.51 377 377 A 151 ILE HG2% A 121 VAL HA 1.0 1.8 5.67 378 378 A 13 MET HE% A 12 ALA HB% 1.0 1.8 4.81 379 379 A 28 MET HE% A 158 VAL HB 1.0 1.8 4.83 380 380 A 28 MET HE% A 158 VAL HG2% 1.0 1.8 3.68 381 381 A 28 MET HE% A 158 VAL HG1% 1.0 1.8 4.34 382 382 A 76 ALA HB% A 79 ALA H 1.0 1.8 5.84 383 383 A 76 ALA HB% A 80 ILE H 1.0 1.8 6.33 384 384 A 76 ALA HB% A 73 GLU H 1.0 1.8 5.62 385 385 A 76 ALA HB% A 143 TRP HH2 1.0 1.8 5.85 386 386 A 76 ALA HB% A 130 PHE HA 1.0 1.8 4.28 387 387 A 90 LEU HD1% A 76 ALA HB% 1.0 1.8 4.89 388 388 A 147 ILE HD1% A 76 ALA HB% 1.0 1.8 6.33 389 389 A 87 THR HG2% A 125 THR HG2% 1.0 1.8 6.33 390 390 A 39 MET HE% A 42 THR HB 1.0 1.8 6.18 391 391 A 122 ALA HB% A 119 LEU HBy 1.0 1.8 4.93 392 392 A 133 ILE HD1% A 130 PHE HA 1.0 1.8 4.62 393 393 A 133 ILE HD1% A 73 GLU HA 1.0 1.8 5.49 394 394 A 133 ILE HD1% A 133 ILE HA 1.0 1.8 4.43 395 395 A 58 ILE HG2% A 60 TRP H 1.0 1.8 5.93 396 396 A 124 ILE HG2% A 128 GLU HA 1.0 1.8 6.33 397 397 A 171 LEU H A 171 LEU HD1% 1.0 1.8 4.84 398 398 A 169 GLN H A 171 LEU HD1% 1.0 1.8 6.33 399 399 A 171 LEU HD1% A 168 LEU HA 1.0 1.8 4.39 400 400 A 168 LEU HBx A 171 LEU HD1% 1.0 1.8 4.26 401 401 A 139 VAL HG2% A 137 LYS H 1.0 1.8 5.65 402 402 A 139 VAL HA A 139 VAL HG2% 1.0 1.8 3.80 403 403 A 139 VAL HG2% A 133 ILE HA 1.0 1.8 5.27 404 404 A 151 ILE HD1% A 148 TYR HA 1.0 1.8 5.49 405 405 A 151 ILE HD1% A 152 CYS HA 1.0 1.8 6.10 406 406 A 151 ILE HD1% A 147 ILE HA 1.0 1.8 5.26 407 407 A 80 ILE HD1% A 76 ALA HA 1.0 1.8 5.50 408 408 A 80 ILE HD1% A 80 ILE HA 1.0 1.8 4.17 409 409 A 80 ILE HD1% A 130 PHE HA 1.0 1.8 4.46 410 410 A 80 ILE HD1% A 130 PHE HBy 1.0 1.8 5.12 411 411 A 80 ILE HD1% A 130 PHE HBx 1.0 1.8 5.12 412 412 A 80 ILE HD1% A 76 ALA HB% 1.0 1.8 4.51 413 413 A 80 ILE HD1% A 134 ILE HB 1.0 1.8 4.32 414 414 A 134 ILE HD1% A 136 GLY H 1.0 1.8 5.78 415 415 A 134 ILE HD1% A 132 ALA H 1.0 1.8 6.33 416 416 A 92 ILE HD1% A 92 ILE HA 1.0 1.8 4.82 417 417 A 134 ILE HD1% A 135 ALA HA 1.0 1.8 4.24 418 418 A 124 ILE H A 92 ILE HD1% 1.0 1.8 6.29 419 419 A 92 ILE HD1% A 122 ALA HA 1.0 1.8 5.93 420 420 A 92 ILE HD1% A 87 THR HA 1.0 1.8 5.45 421 421 A 92 ILE HD1% A 92 ILE HB 1.0 1.8 4.12 422 422 A 161 ILE HD1% A 162 PHE H 1.0 1.8 5.68 423 423 A 161 ILE HA A 161 ILE HD1% 1.0 1.8 4.29 424 424 A 70 ILE HD1% A 70 ILE HA 1.0 1.8 4.27 425 425 A 161 ILE HD1% A 168 LEU HA 1.0 1.8 4.55 426 426 A 161 ILE HD1% A 167 CYS HBy 1.0 1.8 5.08 427 427 A 161 ILE HD1% A 167 CYS HBx 1.0 1.8 5.08 428 428 A 161 ILE HD1% A 171 LEU HG 1.0 1.8 5.01 429 429 A 80 ILE HG2% A 135 ALA H 1.0 1.8 6.33 430 430 A 80 ILE HG2% A 83 GLY HAy 1.0 1.8 5.89 431 431 A 80 ILE HG2% A 80 ILE HA 1.0 1.8 3.86 432 432 A 79 ALA HB% A 80 ILE HG2% 1.0 1.8 5.78 433 433 A 80 ILE HG2% A 133 ILE HB 1.0 1.8 5.09 434 434 A 80 ILE HG2% A 134 ILE HB 1.0 1.8 4.93 435 435 A 133 ILE HG2% A 132 ALA H 1.0 1.8 6.33 436 436 A 133 ILE HG2% A 77 ARG HA 1.0 1.8 4.70 437 437 A 133 ILE HG2% A 133 ILE HA 1.0 1.8 4.35 438 438 A 133 ILE HG2% A 76 ALA HB% 1.0 1.8 4.60 439 439 A 102 LEU HD1% A 102 LEU HA 1.0 1.8 5.14 440 440 A 147 ILE HD1% A 149 LYS H 1.0 1.8 6.33 441 441 A 147 ILE HD1% A 129 PHE HA 1.0 1.8 4.09 442 442 A 147 ILE HD1% A 147 ILE HA 1.0 1.8 4.53 443 443 A 151 ILE HD1% A 147 ILE HD1% 1.0 1.8 5.72 444 444 A 154 LEU HD1% A 154 LEU HA 1.0 1.8 4.88 445 445 A 154 LEU HD1% A 150 VAL HB 1.0 1.8 5.68 446 446 A 13 MET HE% A 14 GLN H 1.0 1.8 6.22 447 447 A 72 MET HE% A 91 SER HA 1.0 1.8 5.36 448 448 A 72 MET HE% A 71 GLN HA 1.0 1.8 5.66 449 449 A 72 MET HE% A 91 SER HB2 1.0 1.8 5.57 450 450 A 72 MET HE% A 91 SER HB3 1.0 1.8 5.57 451 451 A 58 ILE HG2% A 59 LYS H 1.0 1.8 5.51 452 452 A 139 VAL HG2% A 137 LYS HA 1.0 1.8 4.06 453 453 A 57 LEU H A 57 LEU HD1% 1.0 1.8 5.36 454 454 A 92 ILE HD1% A 91 SER H 1.0 1.8 5.14 455 455 A 92 ILE HD1% A 127 ARG H 1.0 1.8 5.61 456 456 A 92 ILE HD1% A 93 THR H 1.0 1.8 4.90 457 457 A 84 VAL HG1% A 89 GLU HBx 1.0 1.8 4.44 458 458 A 28 MET HE% A 43 TYR HD1 1.0 1.8 4.00 459 459 A 133 ILE HD1% A 132 ALA HA 1.0 1.8 6.33 460 460 A 134 ILE H A 135 ALA H 1.0 1.8 4.11 461 461 A 98 LEU H A 99 TYR H 1.0 1.8 4.63 462 462 A 102 LEU HD2% A 101 ALA H 1.0 1.8 6.23 463 463 A 130 PHE H A 130 PHE HBy 1.0 1.8 4.81 464 464 A 102 LEU H A 103 ASN H 1.0 1.8 4.81 465 465 A 46 ASP H A 47 VAL H 1.0 1.8 3.85 466 466 A 70 ILE H A 71 GLN H 1.0 1.8 4.59 467 467 A 75 TYR H A 74 LYS H 1.0 1.8 4.49 468 468 A 73 GLU H A 74 LYS H 1.0 1.8 4.30 469 469 A 77 ARG H A 78 GLN H 1.0 1.8 4.19 470 470 A 78 GLN H A 79 ALA H 1.0 1.8 3.92 471 471 A 78 GLN H A 75 TYR HD1 1.0 1.8 6.16 472 472 A 126 LEU H A 128 GLU H 1.0 1.8 5.13 473 473 A 77 ARG H A 79 ALA H 1.0 1.8 4.92 474 474 A 133 ILE H A 132 ALA H 1.0 1.8 4.06 475 475 A 135 ALA H A 132 ALA H 1.0 1.8 5.32 476 476 A 132 ALA H A 130 PHE H 1.0 1.8 5.28 477 477 A 135 ALA H A 133 ILE H 1.0 1.8 4.88 478 478 A 134 ILE H A 133 ILE H 1.0 1.8 4.14 479 479 A 81 ASN H A 80 ILE H 1.0 1.8 4.03 480 480 A 75 TYR H A 76 ALA H 1.0 1.8 4.39 481 481 A 73 GLU H A 76 ALA H 1.0 1.8 6.22 482 482 A 75 TYR HD1 A 76 ALA H 1.0 1.8 6.33 483 483 A 77 ARG H A 76 ALA H 1.0 1.8 4.05 484 484 A 72 MET H A 73 GLU H 1.0 1.8 4.38 485 485 A 72 MET H A 71 GLN H 1.0 1.8 4.52 486 486 A 70 ILE H A 69 TYR H 1.0 1.8 4.86 487 487 A 69 TYR H A 68 TYR H 1.0 1.8 4.80 488 488 A 160 GLU H A 161 ILE H 1.0 1.8 4.42 489 489 A 108 LYS H A 109 ALA H 1.0 1.8 3.84 490 490 A 148 TYR H A 149 LYS H 1.0 1.8 4.37 491 491 A 150 VAL H A 149 LYS H 1.0 1.8 4.30 492 492 A 149 LYS H A 147 ILE H 1.0 1.8 4.96 493 493 A 135 ALA H A 136 GLY H 1.0 1.8 3.92 494 494 A 63 ASN H A 64 PHE H 1.0 1.8 4.72 495 495 A 64 PHE H A 66 GLU H 1.0 1.8 5.36 496 496 A 85 THR H A 84 VAL H 1.0 1.8 5.30 497 497 A 84 VAL H A 83 GLY H 1.0 1.8 3.73 498 498 A 84 VAL HG2% A 84 VAL H 1.0 1.8 3.43 499 499 A 79 ALA HB% A 84 VAL H 1.0 1.8 4.50 500 500 A 82 ASP HB3 A 84 VAL H 1.0 1.8 4.46 501 501 A 70 ILE HD1% A 70 ILE H 1.0 1.8 4.06 502 502 A 70 ILE HG2% A 70 ILE H 1.0 1.8 4.49 503 503 A 60 TRP H A 58 ILE H 1.0 1.8 5.52 504 504 A 59 LYS H A 58 ILE H 1.0 1.8 4.59 505 505 A 66 GLU H A 67 PHE H 1.0 1.8 4.21 506 506 A 118 PHE H A 119 LEU H 1.0 1.8 4.11 507 507 A 171 LEU H A 170 GLU H 1.0 1.8 3.80 508 508 A 60 TRP H A 60 TRP HE1 1.0 1.8 4.82 509 509 A 40 LEU H A 39 MET H 1.0 1.8 4.52 510 510 A 40 LEU H A 38 ASN H 1.0 1.8 4.92 511 511 A 147 ILE HD1% A 147 ILE H 1.0 1.8 4.38 512 512 A 147 ILE HD1% A 146 ALA H 1.0 1.8 6.08 513 513 A 22 LEU HD1% A 60 TRP HE1 1.0 1.8 4.60 514 514 A 22 LEU HD2% A 60 TRP HE1 1.0 1.8 4.68 515 515 A 17 LEU HD1% A 60 TRP HE1 1.0 1.8 5.16 516 516 A 60 TRP H A 59 LYS H 1.0 1.8 4.74 517 517 A 143 TRP H A 143 TRP HE1 1.0 1.8 6.01 518 518 A 95 ASP H A 94 ARG H 1.0 1.8 4.29 519 519 A 169 GLN H A 167 CYS H 1.0 1.8 4.57 520 520 A 167 CYS H A 166 ASN H 1.0 1.8 4.22 521 521 A 167 CYS H A 168 LEU H 1.0 1.8 4.55 522 522 A 93 THR H A 94 ARG H 1.0 1.8 6.00 523 523 A 15 GLU H A 16 GLY H 1.0 1.8 4.81 524 524 A 92 ILE H A 93 THR H 1.0 1.8 5.14 525 525 A 92 ILE H A 91 SER H 1.0 1.8 4.68 526 526 A 91 SER H A 90 LEU H 1.0 1.8 4.16 527 527 A 89 GLU H A 88 GLU H 1.0 1.8 4.06 528 528 A 87 THR H A 88 GLU H 1.0 1.8 4.60 529 529 A 151 ILE H A 152 CYS H 1.0 1.8 4.74 530 530 A 86 SER H A 85 THR H 1.0 1.8 3.62 531 531 A 86 SER H A 87 THR H 1.0 1.8 4.85 532 532 A 86 SER H A 89 GLU H 1.0 1.8 6.33 533 533 A 169 GLN H A 172 LEU H 1.0 1.8 6.33 534 534 A 82 ASP H A 83 GLY H 1.0 1.8 3.80 535 535 A 82 ASP H A 84 VAL H 1.0 1.8 4.52 536 536 A 101 ALA H A 102 LEU H 1.0 1.8 4.44 537 537 A 102 LEU H A 101 ALA HB% 1.0 1.8 4.05 538 538 A 102 LEU HD2% A 102 LEU H 1.0 1.8 4.51 539 539 A 102 LEU HD1% A 102 LEU H 1.0 1.8 4.68 540 540 A 98 LEU HD1% A 102 LEU H 1.0 1.8 4.83 541 541 A 122 ALA HB% A 123 GLN H 1.0 1.8 4.03 542 542 A 123 GLN H A 119 LEU HA 1.0 1.8 4.93 543 543 A 122 ALA H A 121 VAL H 1.0 1.8 4.22 544 544 A 122 ALA H A 123 GLN H 1.0 1.8 4.54 545 545 A 121 VAL HG2% A 121 VAL H 1.0 1.8 4.04 546 546 A 121 VAL HG1% A 121 VAL H 1.0 1.8 4.13 547 547 A 80 ILE HD1% A 79 ALA H 1.0 1.8 5.05 548 548 A 60 TRP H A 62 SER H 1.0 1.8 4.78 549 549 A 131 ASN H A 130 PHE H 1.0 1.8 4.29 550 550 A 131 ASN H A 132 ALA H 1.0 1.8 4.22 551 551 A 63 ASN H A 62 SER H 1.0 1.8 4.73 552 552 A 129 PHE H A 130 PHE H 1.0 1.8 4.61 553 553 A 128 GLU H A 129 PHE H 1.0 1.8 4.45 554 554 A 126 LEU H A 127 ARG H 1.0 1.8 4.86 555 555 A 128 GLU H A 127 ARG H 1.0 1.8 4.62 556 556 A 125 THR H A 126 LEU H 1.0 1.8 4.90 557 557 A 124 ILE H A 123 GLN H 1.0 1.8 4.59 558 558 A 125 THR H A 124 ILE H 1.0 1.8 4.54 559 559 A 155 ASP H A 156 SER H 1.0 1.8 5.42 560 560 A 153 LYS H A 154 LEU H 1.0 1.8 4.05 561 561 A 152 CYS H A 153 LYS H 1.0 1.8 4.27 562 562 A 152 CYS H A 154 LEU H 1.0 1.8 5.00 563 563 A 150 VAL H A 152 CYS H 1.0 1.8 4.81 564 564 A 162 PHE H A 161 ILE H 1.0 1.8 5.15 565 565 A 150 VAL H A 151 ILE H 1.0 1.8 4.22 566 566 A 61 PHE H A 62 SER H 1.0 1.8 4.57 567 567 A 61 PHE H A 60 TRP H 1.0 1.8 4.29 568 568 A 173 HIS H A 172 LEU H 1.0 1.8 5.14 569 569 A 171 LEU H A 172 LEU H 1.0 1.8 3.83 570 570 A 157 GLU H A 158 VAL H 1.0 1.8 5.27 571 571 A 163 LYS H A 164 SER H 1.0 1.8 4.08 572 572 A 169 GLN H A 168 LEU H 1.0 1.8 4.00 573 573 A 169 GLN H A 170 GLU H 1.0 1.8 3.66 574 574 A 156 SER H A 157 GLU H 1.0 1.8 5.13 575 575 A 118 PHE H A 117 ARG H 1.0 1.8 4.73 576 576 A 163 LYS H A 162 PHE H 1.0 1.8 3.83 577 577 A 162 PHE H A 164 SER H 1.0 1.8 5.09 578 578 A 140 ASP H A 143 TRP H 1.0 1.8 6.28 579 579 A 143 TRP H A 142 SER H 1.0 1.8 4.06 580 580 A 143 TRP HD1 A 142 SER H 1.0 1.8 5.31 581 581 A 137 LYS H A 136 GLY H 1.0 1.8 3.96 582 582 A 134 ILE H A 136 GLY H 1.0 1.8 5.66 583 583 A 135 ALA H A 137 LYS H 1.0 1.8 5.06 584 584 A 108 LYS H A 110 ASN H 1.0 1.8 4.44 585 585 A 111 ASP H A 112 PHE H 1.0 1.8 3.62 586 586 A 113 GLU H A 114 VAL H 1.0 1.8 4.65 587 587 A 104 MET H A 107 ASN H 1.0 1.8 5.88 588 588 A 108 LYS H A 107 ASN H 1.0 1.8 5.16 589 589 A 107 ASN H A 106 TYR H 1.0 1.8 3.98 590 590 A 171 LEU H A 169 GLN H 1.0 1.8 5.05 591 591 A 104 MET H A 106 TYR H 1.0 1.8 5.32 592 592 A 103 ASN H A 104 MET H 1.0 1.8 4.60 593 593 A 105 HIS H A 107 ASN H 1.0 1.8 4.97 594 594 A 105 HIS H A 104 MET H 1.0 1.8 4.34 595 595 A 98 LEU H A 97 GLU H 1.0 1.8 5.04 596 596 A 98 LEU H A 99 TYR HD1 1.0 1.8 6.21 597 597 A 66 GLU H A 65 ARG H 1.0 1.8 4.45 598 598 A 64 PHE H A 65 ARG H 1.0 1.8 4.34 599 599 A 49 PHE H A 50 ASN H 1.0 1.8 4.99 600 600 A 47 VAL H A 48 LYS H 1.0 1.8 5.27 601 601 A 47 VAL H A 45 SER H 1.0 1.8 4.90 602 602 A 47 VAL H A 49 PHE HE2 1.0 1.8 5.13 603 603 A 49 PHE H A 48 LYS H 1.0 1.8 4.86 604 604 A 49 PHE HD1 A 49 PHE H 1.0 1.8 5.42 605 605 A 49 PHE H A 49 PHE HD2 1.0 1.8 5.77 606 606 A 17 LEU HD2% A 18 SER H 1.0 1.8 5.28 607 607 A 46 ASP H A 45 SER H 1.0 1.8 4.16 608 608 A 45 SER H A 44 PHE HD2 1.0 1.8 5.36 609 609 A 44 PHE H A 44 PHE HD2 1.0 1.8 5.58 610 610 A 44 PHE H A 42 THR H 1.0 1.8 5.18 611 611 A 44 PHE H A 49 PHE HZ 1.0 1.8 5.12 612 612 A 42 THR H A 41 LYS H 1.0 1.8 3.89 613 613 A 40 LEU H A 41 LYS H 1.0 1.8 4.53 614 614 A 44 PHE H A 41 LYS H 1.0 1.8 6.33 615 615 A 33 ARG H A 34 TYR H 1.0 1.8 5.29 616 616 A 32 THR HB A 33 ARG H 1.0 1.8 5.62 617 617 A 57 LEU H A 55 SER H 1.0 1.8 5.53 618 618 A 57 LEU HD2% A 58 ILE H 1.0 1.8 4.86 619 619 A 22 LEU HD1% A 60 TRP H 1.0 1.8 5.44 620 620 A 22 LEU HD2% A 60 TRP H 1.0 1.8 5.88 621 621 A 150 VAL H A 150 VAL HG1% 1.0 1.8 3.45 622 622 A 125 THR HG2% A 126 LEU H 1.0 1.8 4.08 623 623 A 126 LEU H A 126 LEU HD1% 1.0 1.8 4.36 624 624 A 126 LEU HD2% A 126 LEU H 1.0 1.8 5.05 625 625 A 125 THR H A 124 ILE HG2% 1.0 1.8 4.11 626 626 A 125 THR H A 122 ALA HB% 1.0 1.8 6.11 627 627 A 125 THR H A 125 THR HG2% 1.0 1.8 4.36 628 628 A 125 THR H A 124 ILE HB 1.0 1.8 4.68 629 629 A 114 VAL HG2% A 114 VAL H 1.0 1.8 3.80 630 630 A 114 VAL HG1% A 114 VAL H 1.0 1.8 4.39 631 631 A 60 TRP HE1 A 60 TRP HA 1.0 1.8 6.10 632 632 A 44 PHE HA A 46 ASP H 1.0 1.8 4.61 633 633 A 46 ASP H A 45 SER HB2 1.0 1.8 5.54 634 634 A 46 ASP H A 45 SER HB3 1.0 1.8 5.54 635 635 A 47 VAL HB A 46 ASP H 1.0 1.8 5.26 636 636 A 47 VAL HG2% A 46 ASP H 1.0 1.8 4.77 637 637 A 47 VAL HG1% A 46 ASP H 1.0 1.8 6.33 638 638 A 156 SER H A 156 SER HBy 1.0 1.8 4.46 639 639 A 156 SER H A 156 SER HBx 1.0 1.8 4.46 640 640 A 103 ASN H A 101 ALA HB% 1.0 1.8 5.11 641 641 A 102 LEU HD2% A 103 ASN H 1.0 1.8 5.34 642 642 A 84 VAL HA A 85 THR H 1.0 1.8 3.71 643 643 A 85 THR HG2% A 85 THR H 1.0 1.8 3.98 644 644 A 85 THR H A 84 VAL HG1% 1.0 1.8 3.70 645 645 A 142 SER H A 142 SER HB2 1.0 1.8 4.05 646 646 A 142 SER H A 142 SER HB3 1.0 1.8 4.05 647 647 A 142 SER H A 141 PRO HBx 1.0 1.8 4.77 648 648 A 142 SER H A 141 PRO HBy 1.0 1.8 3.80 649 649 A 117 ARG H A 115 PRO HA 1.0 1.8 5.43 650 650 A 117 ARG H A 115 PRO HBy 1.0 1.8 4.20 651 651 A 94 ARG H A 93 THR HB 1.0 1.8 5.11 652 652 A 93 THR HG2% A 94 ARG H 1.0 1.8 4.07 653 653 A 119 LEU HD1% A 94 ARG H 1.0 1.8 5.20 654 654 A 119 LEU HD2% A 94 ARG H 1.0 1.8 5.52 655 655 A 98 LEU H A 91 SER HA 1.0 1.8 6.33 656 656 A 98 LEU H A 101 ALA HB% 1.0 1.8 5.39 657 657 A 98 LEU H A 98 LEU HG 1.0 1.8 5.20 658 658 A 39 MET H A 38 ASN H 1.0 1.8 4.55 659 659 A 110 ASN H A 108 LYS HA 1.0 1.8 5.64 660 660 A 110 ASN H A 110 ASN HBy 1.0 1.8 4.77 661 661 A 110 ASN H A 110 ASN HBx 1.0 1.8 4.77 662 662 A 110 ASN H A 109 ALA HB% 1.0 1.8 4.32 663 663 A 111 ASP H A 110 ASN HA 1.0 1.8 3.82 664 664 A 111 ASP H A 109 ALA HA 1.0 1.8 5.85 665 665 A 111 ASP H A 111 ASP HBy 1.0 1.8 4.28 666 666 A 111 ASP H A 111 ASP HBx 1.0 1.8 4.28 667 667 A 111 ASP H A 109 ALA HB% 1.0 1.8 4.92 668 668 A 101 ALA HA A 104 MET H 1.0 1.8 4.84 669 669 A 101 ALA HB% A 104 MET H 1.0 1.8 5.90 670 670 A 137 LYS H A 138 ASP H 1.0 1.8 3.84 671 671 A 136 GLY H A 138 ASP H 1.0 1.8 4.55 672 672 A 139 VAL H A 138 ASP H 1.0 1.8 3.80 673 673 A 133 ILE HA A 138 ASP H 1.0 1.8 4.91 674 674 A 138 ASP H A 138 ASP HBy 1.0 1.8 4.22 675 675 A 139 VAL HG2% A 138 ASP H 1.0 1.8 4.68 676 676 A 138 ASP H A 138 ASP HBx 1.0 1.8 4.22 677 677 A 109 ALA H A 109 ALA HB% 1.0 1.8 3.34 678 678 A 91 SER H A 90 LEU HBy 1.0 1.8 4.83 679 679 A 91 SER H A 90 LEU HBx 1.0 1.8 4.83 680 680 A 126 LEU HD1% A 91 SER H 1.0 1.8 5.51 681 681 A 126 LEU HD2% A 91 SER H 1.0 1.8 4.07 682 682 A 90 LEU HD1% A 91 SER H 1.0 1.8 4.40 683 683 A 99 TYR H A 100 ARG H 1.0 1.8 4.58 684 684 A 86 SER HA A 88 GLU H 1.0 1.8 4.65 685 685 A 87 THR HB A 88 GLU H 1.0 1.8 4.63 686 686 A 88 GLU H A 88 GLU HBy 1.0 1.8 4.32 687 687 A 88 GLU H A 88 GLU HBx 1.0 1.8 4.32 688 688 A 87 THR HG2% A 88 GLU H 1.0 1.8 5.12 689 689 A 161 ILE HG1y A 162 PHE H 1.0 1.8 4.58 690 690 A 161 ILE HG2% A 162 PHE H 1.0 1.8 4.20 691 691 A 90 LEU HD2% A 88 GLU H 1.0 1.8 5.05 692 692 A 168 LEU H A 166 ASN HA 1.0 1.8 5.05 693 693 A 168 LEU H A 167 CYS HBy 1.0 1.8 4.52 694 694 A 168 LEU H A 167 CYS HBx 1.0 1.8 4.52 695 695 A 161 ILE H A 160 GLU HB2 1.0 1.8 4.96 696 696 A 161 ILE H A 160 GLU HB3 1.0 1.8 4.96 697 697 A 168 LEU HBx A 168 LEU H 1.0 1.8 3.54 698 698 A 168 LEU HBy A 168 LEU H 1.0 1.8 4.22 699 699 A 161 ILE HD1% A 168 LEU H 1.0 1.8 3.70 700 700 A 168 LEU HD1% A 168 LEU H 1.0 1.8 4.66 701 701 A 161 ILE HB A 161 ILE H 1.0 1.8 3.62 702 702 A 161 ILE HG1y A 161 ILE H 1.0 1.8 5.40 703 703 A 161 ILE HG1x A 161 ILE H 1.0 1.8 5.81 704 704 A 168 LEU H A 161 ILE HG1x 1.0 1.8 6.33 705 705 A 161 ILE HG2% A 168 LEU H 1.0 1.8 3.57 706 706 A 13 MET H A 14 GLN H 1.0 1.8 4.96 707 707 A 12 ALA HB% A 14 GLN H 1.0 1.8 5.67 708 708 A 92 ILE H A 91 SER HA 1.0 1.8 3.21 709 709 A 15 GLU H A 14 GLN HA 1.0 1.8 3.11 710 710 A 92 ILE H A 98 LEU HD2% 1.0 1.8 4.07 711 711 A 115 PRO HA A 116 GLU H 1.0 1.8 3.84 712 712 A 115 PRO HBy A 116 GLU H 1.0 1.8 3.77 713 713 A 116 GLU H A 115 PRO HBx 1.0 1.8 4.13 714 714 A 48 LYS HA A 49 PHE H 1.0 1.8 4.07 715 715 A 47 VAL HB A 49 PHE H 1.0 1.8 5.16 716 716 A 47 VAL HG1% A 49 PHE H 1.0 1.8 4.53 717 717 A 157 GLU HA A 158 VAL H 1.0 1.8 3.59 718 718 A 158 VAL H A 157 GLU HB2 1.0 1.8 5.11 719 719 A 158 VAL H A 157 GLU HB3 1.0 1.8 5.11 720 720 A 158 VAL HB A 158 VAL H 1.0 1.8 4.58 721 721 A 158 VAL HG2% A 158 VAL H 1.0 1.8 3.88 722 722 A 158 VAL HG1% A 158 VAL H 1.0 1.8 4.58 723 723 A 47 VAL HA A 48 LYS H 1.0 1.8 3.70 724 724 A 47 VAL HB A 48 LYS H 1.0 1.8 5.12 725 725 A 48 LYS H A 48 LYS HBy 1.0 1.8 4.36 726 726 A 48 LYS H A 48 LYS HBx 1.0 1.8 4.36 727 727 A 47 VAL HG2% A 48 LYS H 1.0 1.8 4.61 728 728 A 47 VAL HG1% A 48 LYS H 1.0 1.8 3.82 729 729 A 12 ALA HB% A 12 ALA H 1.0 1.8 3.24 730 730 A 143 TRP H A 141 PRO HA 1.0 1.8 4.77 731 731 A 143 TRP H A 142 SER HB2 1.0 1.8 5.80 732 732 A 143 TRP H A 142 SER HB3 1.0 1.8 5.80 733 733 A 143 TRP H A 141 PRO HBy 1.0 1.8 5.58 734 734 A 57 LEU HB3 A 58 ILE H 1.0 1.8 4.78 735 735 A 84 VAL H A 79 ALA HA 1.0 1.8 4.29 736 736 A 85 THR HG2% A 84 VAL H 1.0 1.8 5.59 737 737 A 173 HIS H A 172 LEU HA 1.0 1.8 2.97 738 738 A 44 PHE H A 41 LYS HA 1.0 1.8 5.22 739 739 A 47 VAL HG2% A 44 PHE H 1.0 1.8 5.92 740 740 A 148 TYR H A 147 ILE H 1.0 1.8 4.13 741 741 A 148 TYR H A 148 TYR HD2 1.0 1.8 4.52 742 742 A 148 TYR H A 148 TYR HE2 1.0 1.8 5.54 743 743 A 148 TYR H A 145 LYS HA 1.0 1.8 4.81 744 744 A 148 TYR H A 147 ILE HB 1.0 1.8 3.96 745 745 A 148 TYR H A 147 ILE HG2% 1.0 1.8 4.62 746 746 A 148 TYR H A 146 ALA HA 1.0 1.8 5.67 747 747 A 81 ASN H A 81 ASN HB2 1.0 1.8 4.11 748 748 A 81 ASN H A 81 ASN HB3 1.0 1.8 4.11 749 749 A 79 ALA HB% A 81 ASN H 1.0 1.8 5.67 750 750 A 80 ILE HG2% A 81 ASN H 1.0 1.8 4.15 751 751 A 81 ASN H A 133 ILE HG2% 1.0 1.8 5.92 752 752 A 60 TRP HH2 A 17 LEU H 1.0 1.8 6.28 753 753 A 17 LEU HD1% A 17 LEU H 1.0 1.8 4.24 754 754 A 76 ALA HA A 78 GLN H 1.0 1.8 5.40 755 755 A 101 ALA H A 98 LEU HA 1.0 1.8 4.65 756 756 A 101 ALA H A 101 ALA HB% 1.0 1.8 3.46 757 757 A 157 GLU H A 156 SER HA 1.0 1.8 3.45 758 758 A 13 MET H A 12 ALA HB% 1.0 1.8 3.61 759 759 A 82 ASP H A 80 ILE HA 1.0 1.8 4.74 760 760 A 82 ASP H A 82 ASP HB2 1.0 1.8 3.80 761 761 A 82 ASP H A 82 ASP HB3 1.0 1.8 3.93 762 762 A 79 ALA HB% A 82 ASP H 1.0 1.8 5.39 763 763 A 82 ASP H A 80 ILE HG2% 1.0 1.8 6.14 764 764 A 40 LEU H A 38 ASN HA 1.0 1.8 5.01 765 765 A 40 LEU H A 38 ASN HB2 1.0 1.8 6.33 766 766 A 40 LEU H A 38 ASN HB3 1.0 1.8 6.33 767 767 A 140 ASP H A 138 ASP H 1.0 1.8 5.83 768 768 A 143 TRP HD1 A 140 ASP H 1.0 1.8 5.72 769 769 A 139 VAL HA A 140 ASP H 1.0 1.8 4.06 770 770 A 140 ASP H A 138 ASP HA 1.0 1.8 4.30 771 771 A 108 LYS H A 107 ASN HA 1.0 1.8 3.75 772 772 A 44 PHE HA A 47 VAL H 1.0 1.8 5.27 773 773 A 45 SER HA A 47 VAL H 1.0 1.8 4.63 774 774 A 47 VAL HB A 47 VAL H 1.0 1.8 3.77 775 775 A 47 VAL HG2% A 47 VAL H 1.0 1.8 3.65 776 776 A 47 VAL HG1% A 47 VAL H 1.0 1.8 4.57 777 777 A 39 MET H A 41 LYS H 1.0 1.8 6.08 778 778 A 39 MET H A 38 ASN HB2 1.0 1.8 4.55 779 779 A 39 MET H A 38 ASN HB3 1.0 1.8 4.55 780 780 A 39 MET HE% A 39 MET H 1.0 1.8 6.26 781 781 A 112 PHE H A 110 ASN HA 1.0 1.8 4.73 782 782 A 79 ALA HB% A 79 ALA H 1.0 1.8 3.37 783 783 A 84 VAL HG2% A 79 ALA H 1.0 1.8 5.53 784 784 A 153 LYS H A 155 ASP H 1.0 1.8 5.80 785 785 A 152 CYS HA A 155 ASP H 1.0 1.8 4.89 786 786 A 154 LEU HD1% A 155 ASP H 1.0 1.8 5.14 787 787 A 154 LEU HD2% A 155 ASP H 1.0 1.8 5.12 788 788 A 58 ILE HB A 59 LYS H 1.0 1.8 5.12 789 789 A 87 THR HB A 90 LEU H 1.0 1.8 5.72 790 790 A 90 LEU H A 89 GLU HBy 1.0 1.8 4.84 791 791 A 90 LEU H A 89 GLU HBx 1.0 1.8 4.84 792 792 A 90 LEU H A 90 LEU HBy 1.0 1.8 4.17 793 793 A 87 THR HG2% A 90 LEU H 1.0 1.8 6.10 794 794 A 90 LEU H A 90 LEU HBx 1.0 1.8 4.17 795 795 A 126 LEU HD2% A 90 LEU H 1.0 1.8 4.58 796 796 A 90 LEU HD2% A 90 LEU H 1.0 1.8 4.12 797 797 A 90 LEU HD1% A 90 LEU H 1.0 1.8 4.38 798 798 A 41 LYS H A 43 TYR H 1.0 1.8 5.32 799 799 A 43 TYR H A 43 TYR HD2 1.0 1.8 4.51 800 800 A 80 ILE H A 81 ASN HB2 1.0 1.8 6.33 801 801 A 80 ILE H A 81 ASN HB3 1.0 1.8 6.33 802 802 A 80 ILE HD1% A 80 ILE H 1.0 1.8 4.16 803 803 A 61 PHE H A 63 ASN H 1.0 1.8 5.32 804 804 A 171 LEU H A 169 GLN HA 1.0 1.8 4.59 805 805 A 171 LEU H A 171 LEU HG 1.0 1.8 3.50 806 806 A 57 LEU HD2% A 61 PHE H 1.0 1.8 4.68 807 807 A 57 LEU HA A 60 TRP H 1.0 1.8 4.83 808 808 A 99 TYR H A 95 ASP HA 1.0 1.8 5.90 809 809 A 99 TYR H A 98 LEU HG 1.0 1.8 4.99 810 810 A 98 LEU HD2% A 99 TYR H 1.0 1.8 4.96 811 811 A 121 VAL H A 120 GLU H 1.0 1.8 4.65 812 812 A 119 LEU H A 120 GLU H 1.0 1.8 4.34 813 813 A 118 PHE HA A 120 GLU H 1.0 1.8 5.28 814 814 A 120 GLU H A 119 LEU HG 1.0 1.8 6.13 815 815 A 93 THR HG2% A 120 GLU H 1.0 1.8 6.31 816 816 A 121 VAL HG2% A 120 GLU H 1.0 1.8 6.33 817 817 A 119 LEU HD1% A 120 GLU H 1.0 1.8 5.32 818 818 A 143 TRP H A 144 LYS H 1.0 1.8 4.89 819 819 A 143 TRP HE3 A 144 LYS H 1.0 1.8 6.15 820 820 A 144 LYS H A 142 SER HA 1.0 1.8 4.98 821 821 A 148 TYR H A 146 ALA H 1.0 1.8 5.27 822 822 A 146 ALA H A 145 LYS H 1.0 1.8 3.84 823 823 A 147 ILE H A 146 ALA H 1.0 1.8 4.03 824 824 A 119 LEU H A 119 LEU HBx 1.0 1.8 4.12 825 825 A 119 LEU H A 114 VAL HB 1.0 1.8 4.68 826 826 A 119 LEU H A 119 LEU HG 1.0 1.8 4.95 827 827 A 122 ALA HB% A 119 LEU H 1.0 1.8 5.31 828 828 A 119 LEU HD1% A 119 LEU H 1.0 1.8 3.99 829 829 A 150 VAL H A 146 ALA HA 1.0 1.8 5.30 830 830 A 150 VAL H A 150 VAL HB 1.0 1.8 4.30 831 831 A 150 VAL H A 146 ALA HB% 1.0 1.8 5.62 832 832 A 150 VAL H A 151 ILE HG2% 1.0 1.8 5.23 833 833 A 172 LEU H A 169 GLN HA 1.0 1.8 4.58 834 834 A 168 LEU HA A 172 LEU H 1.0 1.8 6.00 835 835 A 171 LEU HG A 172 LEU H 1.0 1.8 4.23 836 836 A 168 LEU HD2% A 172 LEU H 1.0 1.8 4.08 837 837 A 168 LEU HD1% A 172 LEU H 1.0 1.8 5.43 838 838 A 144 LYS H A 145 LYS H 1.0 1.8 3.90 839 839 A 145 LYS H A 148 TYR HD1 1.0 1.8 4.89 840 840 A 142 SER HA A 145 LYS H 1.0 1.8 5.21 841 841 A 169 GLN HA A 170 GLU H 1.0 1.8 4.01 842 842 A 145 LYS H A 145 LYS HB2 1.0 1.8 3.91 843 843 A 145 LYS H A 145 LYS HB3 1.0 1.8 3.91 844 844 A 171 LEU HG A 170 GLU H 1.0 1.8 4.42 845 845 A 168 LEU HD2% A 170 GLU H 1.0 1.8 5.03 846 846 A 118 PHE H A 120 GLU H 1.0 1.8 5.00 847 847 A 118 PHE H A 115 PRO HBy 1.0 1.8 4.90 848 848 A 154 LEU HG A 154 LEU H 1.0 1.8 3.91 849 849 A 154 LEU HD1% A 154 LEU H 1.0 1.8 4.61 850 850 A 154 LEU HD2% A 154 LEU H 1.0 1.8 3.82 851 851 A 86 SER H A 88 GLU H 1.0 1.8 6.18 852 852 A 86 SER H A 85 THR HA 1.0 1.8 4.05 853 853 A 86 SER H A 85 THR HB 1.0 1.8 5.26 854 854 A 86 SER H A 84 VAL HG1% 1.0 1.8 3.42 855 855 A 86 SER H A 90 LEU HD2% 1.0 1.8 4.92 856 856 A 169 GLN H A 166 ASN HA 1.0 1.8 4.58 857 857 A 41 LYS H A 38 ASN HA 1.0 1.8 4.66 858 858 A 169 GLN H A 169 GLN HB2 1.0 1.8 3.62 859 859 A 169 GLN H A 169 GLN HB3 1.0 1.8 3.62 860 860 A 168 LEU HBx A 169 GLN H 1.0 1.8 4.77 861 861 A 41 LYS H A 41 LYS HB2 1.0 1.8 4.09 862 862 A 41 LYS H A 41 LYS HB3 1.0 1.8 4.09 863 863 A 168 LEU HD1% A 169 GLN H 1.0 1.8 5.19 864 864 A 166 ASN H A 166 ASN HBy 1.0 1.8 4.76 865 865 A 166 ASN H A 166 ASN HBx 1.0 1.8 4.76 866 866 A 161 ILE HA A 163 LYS H 1.0 1.8 4.57 867 867 A 163 LYS H A 161 ILE HG1y 1.0 1.8 4.62 868 868 A 161 ILE HD1% A 163 LYS H 1.0 1.8 5.22 869 869 A 139 VAL H A 137 LYS H 1.0 1.8 5.38 870 870 A 137 LYS H A 135 ALA HA 1.0 1.8 6.33 871 871 A 133 ILE HA A 137 LYS H 1.0 1.8 5.08 872 872 A 135 ALA HB% A 137 LYS H 1.0 1.8 3.65 873 873 A 133 ILE HG2% A 137 LYS H 1.0 1.8 5.08 874 874 A 44 PHE HA A 45 SER H 1.0 1.8 4.04 875 875 A 45 SER H A 45 SER HB2 1.0 1.8 4.76 876 876 A 45 SER H A 45 SER HB3 1.0 1.8 4.76 877 877 A 47 VAL HG2% A 45 SER H 1.0 1.8 5.90 878 878 A 58 ILE HG1y A 55 SER H 1.0 1.8 6.06 879 879 A 54 THR HG2% A 55 SER H 1.0 1.8 4.28 880 880 A 95 ASP H A 99 TYR HD1 1.0 1.8 5.20 881 881 A 95 ASP H A 93 THR HA 1.0 1.8 4.50 882 882 A 95 ASP H A 95 ASP HBy 1.0 1.8 4.72 883 883 A 95 ASP H A 95 ASP HBx 1.0 1.8 4.72 884 884 A 95 ASP H A 93 THR HG2% 1.0 1.8 5.03 885 885 A 95 ASP H A 119 LEU HD2% 1.0 1.8 6.33 886 886 A 161 ILE HG1y A 164 SER H 1.0 1.8 5.67 887 887 A 161 ILE HD1% A 164 SER H 1.0 1.8 4.74 888 888 A 89 GLU H A 87 THR HB 1.0 1.8 5.70 889 889 A 87 THR HG2% A 89 GLU H 1.0 1.8 5.95 890 890 A 89 GLU H A 84 VAL HG1% 1.0 1.8 4.68 891 891 A 89 GLU H A 90 LEU HD1% 1.0 1.8 5.51 892 892 A 149 LYS H A 146 ALA HA 1.0 1.8 4.60 893 893 A 149 LYS H A 147 ILE HA 1.0 1.8 5.22 894 894 A 149 LYS H A 145 LYS HA 1.0 1.8 5.14 895 895 A 149 LYS H A 150 VAL HG1% 1.0 1.8 4.59 896 896 A 151 ILE HD1% A 149 LYS H 1.0 1.8 5.05 897 897 A 167 CYS H A 166 ASN HA 1.0 1.8 4.03 898 898 A 93 THR H A 92 ILE HA 1.0 1.8 3.85 899 899 A 167 CYS H A 167 CYS HBy 1.0 1.8 4.06 900 900 A 167 CYS H A 167 CYS HBx 1.0 1.8 4.06 901 901 A 93 THR H A 119 LEU HG 1.0 1.8 5.24 902 902 A 93 THR H A 93 THR HG2% 1.0 1.8 4.26 903 903 A 92 ILE HG2% A 93 THR H 1.0 1.8 3.88 904 904 A 17 LEU H A 16 GLY H 1.0 1.8 3.78 905 905 A 53 ILE HB A 16 GLY H 1.0 1.8 5.57 906 906 A 17 LEU HD2% A 16 GLY H 1.0 1.8 6.33 907 907 A 133 ILE HA A 136 GLY H 1.0 1.8 5.16 908 908 A 135 ALA HB% A 136 GLY H 1.0 1.8 3.74 909 909 A 134 ILE HG2% A 136 GLY H 1.0 1.8 6.04 910 910 A 82 ASP HB3 A 83 GLY H 1.0 1.8 4.14 911 911 A 84 VAL HG2% A 83 GLY H 1.0 1.8 4.37 912 912 A 80 ILE HG2% A 83 GLY H 1.0 1.8 5.49 913 913 A 80 ILE HD1% A 83 GLY H 1.0 1.8 6.33 914 914 A 106 TYR HE2 A 106 TYR H 1.0 1.8 6.20 915 915 A 102 LEU HD2% A 106 TYR H 1.0 1.8 5.77 916 916 A 50 ASN H A 49 PHE HBy 1.0 1.8 5.23 917 917 A 50 ASN H A 49 PHE HBx 1.0 1.8 5.23 918 918 A 47 VAL HG1% A 50 ASN H 1.0 1.8 4.75 919 919 A 139 VAL H A 140 ASP H 1.0 1.8 3.50 920 920 A 139 VAL H A 138 ASP HA 1.0 1.8 3.99 921 921 A 139 VAL H A 139 VAL HB 1.0 1.8 4.19 922 922 A 139 VAL H A 138 ASP HBy 1.0 1.8 5.19 923 923 A 139 VAL H A 139 VAL HG2% 1.0 1.8 2.91 924 924 A 139 VAL H A 138 ASP HBx 1.0 1.8 5.19 925 925 A 42 THR H A 43 TYR H 1.0 1.8 4.01 926 926 A 42 THR HB A 42 THR H 1.0 1.8 4.01 927 927 A 39 MET HE% A 42 THR H 1.0 1.8 6.14 928 928 A 31 TYR HB2 A 32 THR H 1.0 1.8 5.99 929 929 A 32 THR H A 31 TYR HB3 1.0 1.8 5.99 930 930 A 32 THR HG2% A 32 THR H 1.0 1.8 4.15 931 931 A 147 ILE H A 144 LYS HA 1.0 1.8 4.96 932 932 A 147 ILE H A 146 ALA HB% 1.0 1.8 3.57 933 933 A 135 ALA H A 132 ALA HA 1.0 1.8 4.39 934 934 A 135 ALA H A 133 ILE HA 1.0 1.8 5.28 935 935 A 135 ALA H A 135 ALA HB% 1.0 1.8 3.24 936 936 A 135 ALA H A 134 ILE HB 1.0 1.8 4.97 937 937 A 135 ALA H A 134 ILE HG2% 1.0 1.8 3.58 938 938 A 86 SER HA A 87 THR H 1.0 1.8 3.53 939 939 A 87 THR H A 87 THR HB 1.0 1.8 4.39 940 940 A 152 CYS H A 151 ILE HB 1.0 1.8 5.01 941 941 A 76 ALA HB% A 130 PHE H 1.0 1.8 4.30 942 942 A 87 THR HG2% A 87 THR H 1.0 1.8 3.78 943 943 A 151 ILE HG2% A 152 CYS H 1.0 1.8 4.82 944 944 A 152 CYS H A 150 VAL HG1% 1.0 1.8 6.30 945 945 A 154 LEU HD1% A 152 CYS H 1.0 1.8 6.33 946 946 A 151 ILE HD1% A 152 CYS H 1.0 1.8 4.36 947 947 A 87 THR H A 84 VAL HG1% 1.0 1.8 5.36 948 948 A 80 ILE HD1% A 130 PHE H 1.0 1.8 5.84 949 949 A 87 THR H A 90 LEU HD1% 1.0 1.8 5.99 950 950 A 90 LEU HD1% A 130 PHE H 1.0 1.8 6.33 951 951 A 74 LYS H A 76 ALA H 1.0 1.8 5.12 952 952 A 72 MET HA A 74 LYS H 1.0 1.8 5.31 953 953 A 70 ILE HG2% A 74 LYS H 1.0 1.8 4.68 954 954 A 131 ASN H A 129 PHE H 1.0 1.8 5.22 955 955 A 131 ASN H A 128 GLU HA 1.0 1.8 4.61 956 956 A 127 ARG HA A 131 ASN H 1.0 1.8 4.93 957 957 A 131 ASN H A 131 ASN HBy 1.0 1.8 4.04 958 958 A 131 ASN H A 131 ASN HBx 1.0 1.8 4.04 959 959 A 132 ALA HB% A 131 ASN H 1.0 1.8 5.45 960 960 A 134 ILE HG2% A 131 ASN H 1.0 1.8 4.63 961 961 A 70 ILE HD1% A 69 TYR H 1.0 1.8 6.33 962 962 A 122 ALA H A 119 LEU HA 1.0 1.8 4.55 963 963 A 122 ALA H A 121 VAL HB 1.0 1.8 4.16 964 964 A 125 THR HG2% A 122 ALA H 1.0 1.8 5.15 965 965 A 122 ALA HB% A 122 ALA H 1.0 1.8 3.65 966 966 A 122 ALA H A 121 VAL HG1% 1.0 1.8 4.12 967 967 A 125 THR HG2% A 123 GLN H 1.0 1.8 5.34 968 968 A 121 VAL HG1% A 123 GLN H 1.0 1.8 6.33 969 969 A 124 ILE HD1% A 123 GLN H 1.0 1.8 6.33 970 970 A 92 ILE HD1% A 123 GLN H 1.0 1.8 4.43 971 971 A 78 GLN H A 76 ALA H 1.0 1.8 5.11 972 972 A 76 ALA H A 74 LYS HA 1.0 1.8 5.26 973 973 A 76 ALA HB% A 76 ALA H 1.0 1.8 3.63 974 974 A 126 LEU HD1% A 76 ALA H 1.0 1.8 4.12 975 975 A 125 THR HG2% A 128 GLU H 1.0 1.8 5.95 976 976 A 124 ILE HG2% A 128 GLU H 1.0 1.8 4.92 977 977 A 147 ILE HG2% A 128 GLU H 1.0 1.8 5.59 978 978 A 75 TYR H A 76 ALA HB% 1.0 1.8 5.19 979 979 A 134 ILE H A 132 ALA HB% 1.0 1.8 5.50 980 980 A 76 ALA HB% A 129 PHE H 1.0 1.8 5.77 981 981 A 126 LEU HD1% A 129 PHE H 1.0 1.8 5.98 982 982 A 147 ILE HG2% A 129 PHE H 1.0 1.8 4.77 983 983 A 147 ILE HD1% A 129 PHE H 1.0 1.8 4.90 984 984 A 124 ILE H A 124 ILE HB 1.0 1.8 4.00 985 985 A 76 ALA HB% A 77 ARG H 1.0 1.8 3.83 986 986 A 133 ILE HD1% A 77 ARG H 1.0 1.8 4.78 987 987 A 133 ILE HG2% A 77 ARG H 1.0 1.8 5.74 988 988 A 72 MET HE% A 72 MET H 1.0 1.8 4.14 989 989 A 125 THR HG2% A 127 ARG H 1.0 1.8 4.90 990 990 A 126 LEU HD1% A 127 ARG H 1.0 1.8 5.66 991 991 A 126 LEU HD2% A 127 ARG H 1.0 1.8 5.19 992 992 A 70 ILE HG2% A 71 GLN H 1.0 1.8 4.05 993 993 A 154 LEU HD1% A 153 LYS H 1.0 1.8 5.59 994 994 A 154 LEU HD2% A 153 LYS H 1.0 1.8 4.59 995 995 A 130 PHE H A 130 PHE HBx 1.0 1.8 4.81 996 996 A 132 ALA HB% A 132 ALA H 1.0 1.8 3.38 997 997 A 133 ILE HD1% A 132 ALA H 1.0 1.8 5.21 998 998 A 134 ILE HG2% A 132 ALA H 1.0 1.8 4.68 999 999 A 147 ILE HD1% A 132 ALA H 1.0 1.8 5.95 1000 1000 A 133 ILE H A 132 ALA HB% 1.0 1.8 4.01 1001 1001 A 133 ILE H A 133 ILE HB 1.0 1.8 4.27 1002 1002 A 133 ILE H A 133 ILE HG2% 1.0 1.8 4.70 1003 1003 A 134 ILE HG2% A 133 ILE H 1.0 1.8 5.08 1004 1004 A 134 ILE H A 132 ALA H 1.0 1.8 5.12 1005 1005 A 134 ILE H A 135 ALA HB% 1.0 1.8 5.26 1006 1006 A 134 ILE H A 134 ILE HB 1.0 1.8 3.98 1007 1007 A 134 ILE H A 133 ILE HD1% 1.0 1.8 4.99 1008 1008 A 80 ILE HG2% A 134 ILE H 1.0 1.8 4.81 1009 1009 A 134 ILE H A 134 ILE HG2% 1.0 1.8 3.40 1010 1010 A 59 LYS H A 62 SER H 1.0 1.8 5.70 1011 1011 A 62 SER H A 60 TRP HA 1.0 1.8 5.20 1012 1012 A 60 TRP H A 63 ASN H 1.0 1.8 6.30 1013 1013 A 63 ASN H A 66 GLU H 1.0 1.8 6.33 1014 1014 A 114 VAL H A 112 PHE HA 1.0 1.8 4.92 1015 1015 A 113 GLU H A 112 PHE HA 1.0 1.8 3.67 1016 1016 A 105 HIS H A 101 ALA HB% 1.0 1.8 5.59 1017 1017 A 75 TYR HD1 A 75 TYR HA 1.0 1.8 4.27 1018 1018 A 99 TYR H A 99 TYR HE1 1.0 1.8 6.10 1019 1019 A 22 LEU HD1% A 60 TRP HZ2 1.0 1.8 5.21 1020 1020 A 143 TRP HD1 A 143 TRP H 1.0 1.8 3.96 1021 1021 A 60 TRP H A 60 TRP HD1 1.0 1.8 4.99 1022 1022 A 17 LEU HD2% A 60 TRP HZ2 1.0 1.8 5.78 1023 1023 A 22 LEU HD2% A 60 TRP HZ2 1.0 1.8 4.80 1024 1024 A 99 TYR HD1 A 99 TYR H 1.0 1.8 4.66 1025 1025 A 99 TYR HD1 A 100 ARG H 1.0 1.8 6.12 1026 1026 A 99 TYR HD2 A 100 ARG H 1.0 1.8 6.33 1027 1027 A 119 LEU HD1% A 99 TYR HD1 1.0 1.8 4.04 1028 1028 A 99 TYR HD1 A 119 LEU HD2% 1.0 1.8 5.20 1029 1029 A 99 TYR HD1 A 102 LEU HD1% 1.0 1.8 5.36 1030 1030 A 129 PHE HD2 A 143 TRP HH2 1.0 1.8 4.65 1031 1031 A 148 TYR HD2 A 148 TYR HA 1.0 1.8 4.20 1032 1032 A 145 LYS HA A 148 TYR HD1 1.0 1.8 4.30 1033 1033 A 148 TYR HD2 A 147 ILE HB 1.0 1.8 4.60 1034 1034 A 148 TYR HE2 A 148 TYR HA 1.0 1.8 5.35 1035 1035 A 145 LYS HA A 148 TYR HE1 1.0 1.8 4.97 1036 1036 A 148 TYR HE2 A 147 ILE HB 1.0 1.8 5.24 1037 1037 A 102 LEU HD2% A 106 TYR HE2 1.0 1.8 4.46 1038 1038 A 102 LEU HD1% A 106 TYR HE2 1.0 1.8 4.01 1039 1039 A 98 LEU HD1% A 106 TYR HE2 1.0 1.8 6.05 1040 1040 A 106 TYR H A 106 TYR HD1 1.0 1.8 5.38 1041 1041 A 106 TYR HD2 A 106 TYR H 1.0 1.8 5.57 1042 1042 A 68 TYR H A 106 TYR HD1 1.0 1.8 5.92 1043 1043 A 102 LEU HD1% A 106 TYR HD2 1.0 1.8 4.81 1044 1044 A 143 TRP HZ3 A 132 ALA HB% 1.0 1.8 4.44 1045 1045 A 133 ILE HD1% A 143 TRP HH2 1.0 1.8 4.55 1046 1046 A 44 PHE HD1 A 44 PHE H 1.0 1.8 5.14 1047 1047 A 158 VAL HB A 43 TYR HE1 1.0 1.8 5.43 1048 1048 A 32 THR HG2% A 43 TYR HE1 1.0 1.8 4.13 1049 1049 A 158 VAL HG2% A 43 TYR HE1 1.0 1.8 4.21 1050 1050 A 158 VAL HG1% A 43 TYR HE1 1.0 1.8 3.98 1051 1051 A 43 TYR HE1 A 32 THR HB 1.0 1.8 4.55 1052 1052 A 157 GLU HA A 43 TYR HE1 1.0 1.8 5.58 1053 1053 A 43 TYR HA A 43 TYR HD2 1.0 1.8 4.29 1054 1054 A 47 VAL HG2% A 49 PHE HZ 1.0 1.8 4.88 1055 1055 A 47 VAL HG1% A 49 PHE HZ 1.0 1.8 4.42 1056 1056 A 44 PHE HE2 A 21 HIS HE1 1.0 1.8 4.76 1057 1057 A 21 HIS HE1 A 17 LEU HD2% 1.0 1.8 4.35 1058 1058 A 75 TYR H A 75 TYR HD1 1.0 1.8 4.11 1059 1059 A 126 LEU HD2% A 75 TYR HD2 1.0 1.8 3.74 1060 1060 A 143 TRP HD1 A 141 PRO HA 1.0 1.8 4.53 1061 1061 A 143 TRP HD1 A 143 TRP HA 1.0 1.8 5.11 1062 1062 A 133 ILE HD1% A 143 TRP HZ2 1.0 1.8 5.36 1063 1063 A 99 TYR HD1 A 95 ASP HA 1.0 1.8 4.37 1064 1064 A 75 TYR HD2 A 91 SER HB2 1.0 1.8 5.67 1065 1065 A 75 TYR HD2 A 91 SER HB3 1.0 1.8 5.67 1066 1066 A 102 LEU HD2% A 75 TYR HD2 1.0 1.8 5.67 1067 1067 A 49 PHE HE1 A 44 PHE HD1 1.0 1.8 4.28 1068 1068 A 44 PHE HD1 A 49 PHE HZ 1.0 1.8 4.65 1069 1069 A 44 PHE HA A 44 PHE HD2 1.0 1.8 4.35 1070 1070 A 44 PHE HD1 A 40 LEU HA 1.0 1.8 4.32 1071 1071 A 44 PHE HD1 A 47 VAL HB 1.0 1.8 5.60 1072 1072 A 47 VAL HB A 44 PHE HD2 1.0 1.8 6.19 1073 1073 A 44 PHE HD1 A 39 MET HE% 1.0 1.8 5.12 1074 1074 A 28 MET HE% A 44 PHE HD2 1.0 1.8 4.98 1075 1075 A 44 PHE HD1 A 47 VAL HG2% 1.0 1.8 4.78 1076 1076 A 47 VAL HG2% A 44 PHE HD2 1.0 1.8 4.93 1077 1077 A 44 PHE HD1 A 57 LEU HD2% 1.0 1.8 4.12 1078 1078 A 44 PHE HD1 A 47 VAL HG1% 1.0 1.8 4.95 1079 1079 A 129 PHE HA A 129 PHE HE2 1.0 1.8 5.05 1080 1080 A 129 PHE HE1 A 126 LEU HD1% 1.0 1.8 5.55 1081 1081 A 44 PHE HE1 A 40 LEU HA 1.0 1.8 5.66 1082 1082 A 44 PHE HE1 A 47 VAL HG2% 1.0 1.8 6.20 1083 1083 A 44 PHE HE2 A 47 VAL HG2% 1.0 1.8 6.33 1084 1084 A 48 LYS HA A 49 PHE HD2 1.0 1.8 4.53 1085 1085 A 49 PHE HD1 A 49 PHE HA 1.0 1.8 4.46 1086 1086 A 49 PHE HD1 A 47 VAL HB 1.0 1.8 5.75 1087 1087 A 47 VAL HB A 49 PHE HD2 1.0 1.8 6.33 1088 1088 A 45 SER HA A 49 PHE HE2 1.0 1.8 5.60 1089 1089 A 48 LYS HA A 49 PHE HE2 1.0 1.8 6.33 1090 1090 A 41 LYS HA A 49 PHE HE2 1.0 1.8 4.95 1091 1091 A 49 PHE HE1 A 47 VAL HG2% 1.0 1.8 4.60 1092 1092 A 49 PHE HE1 A 47 VAL HG1% 1.0 1.8 4.26 1093 1093 A 129 PHE HA A 129 PHE HD2 1.0 1.8 4.63 1094 1094 A 125 THR HG2% A 129 PHE HD1 1.0 1.8 4.13 1095 1095 A 133 ILE HD1% A 129 PHE HD2 1.0 1.8 4.58 1096 1096 A 147 ILE HG2% A 129 PHE HD1 1.0 1.8 5.53 1097 1097 A 147 ILE HG2% A 129 PHE HD2 1.0 1.8 5.82 1098 1098 A 42 THR H A 43 TYR HD2 1.0 1.8 5.52 1099 1099 A 68 TYR H A 106 TYR HE1 1.0 1.8 4.83 1100 1100 A 119 LEU HG A 99 TYR HE1 1.0 1.8 4.38 1101 1101 A 119 LEU HD1% A 99 TYR HE1 1.0 1.8 3.93 1102 1102 A 119 LEU HD2% A 99 TYR HE1 1.0 1.8 3.90 1103 1103 A 143 TRP HZ3 A 129 PHE HE2 1.0 1.8 4.90 1104 1104 A 75 TYR H A 75 TYR HE1 1.0 1.8 5.37 1105 1105 A 75 TYR HA A 75 TYR HE1 1.0 1.8 5.30 1106 1106 A 72 MET HE% A 75 TYR HE2 1.0 1.8 4.29 1107 1107 A 75 TYR HE2 A 126 LEU HD1% 1.0 1.8 6.24 1108 1108 A 49 PHE HZ A 47 VAL H 1.0 1.8 5.19 1109 1109 A 49 PHE HZ A 41 LYS HA 1.0 1.8 4.67 1110 1110 A 49 PHE HZ A 44 PHE HB2 1.0 1.8 5.28 1111 1111 A 49 PHE HZ A 44 PHE HB3 1.0 1.8 5.28 1112 1112 A 47 VAL HB A 49 PHE HZ 1.0 1.8 4.76 1113 1113 A 49 PHE HE1 A 57 LEU HD2% 1.0 1.8 5.07 1114 1114 A 21 HIS HE1 A 44 PHE HA 1.0 1.8 5.62 1115 1115 A 21 HIS HE1 A 47 VAL HB 1.0 1.8 5.38 1116 1116 A 126 LEU HD1% A 75 TYR HD2 1.0 1.8 4.21 1117 1117 A 143 TRP HE3 A 129 PHE HD2 1.0 1.8 4.51 1118 1118 A 25 ALA HB% A 60 TRP HE3 1.0 1.8 4.75 1119 1119 A 80 ILE HD1% A 134 ILE HD1% 1.0 1.8 4.60 1120 1120 A 17 LEU HD1% A 47 VAL HG2% 1.0 1.8 5.93 1121 1121 A 57 LEU HD2% A 47 VAL HG2% 1.0 1.8 6.33 1122 1122 A 119 LEU HD1% A 114 VAL HG1% 1.0 1.8 4.53 1123 1123 A 154 LEU HD2% A 121 VAL HG1% 1.0 1.8 6.33 1124 1124 A 154 LEU HD2% A 150 VAL HG1% 1.0 1.8 6.12 1125 1125 A 92 ILE HD1% A 98 LEU HD1% 1.0 1.8 6.13 1126 1126 A 114 VAL HG1% A 119 LEU HD2% 1.0 1.8 5.40 1127 1127 A 168 LEU HD1% A 172 LEU HD2% 1.0 1.8 3.90 1128 1128 A 126 LEU HD2% A 98 LEU HD2% 1.0 1.8 5.37 1129 1129 A 17 LEU HD1% A 47 VAL HG1% 1.0 1.8 5.92 1130 1130 A 58 ILE HD1% A 40 LEU HD1% 1.0 1.8 5.76 1131 1131 A 151 ILE HD1% A 154 LEU HD1% 1.0 1.8 5.66 1132 1132 A 58 ILE HD1% A 40 LEU HD2% 1.0 1.8 5.76 1133 1133 A 168 LEU HD2% A 172 LEU HD2% 1.0 1.8 4.49 1134 1134 A 90 LEU HD2% A 126 LEU HD1% 1.0 1.8 5.72 1135 1135 A 92 ILE HD1% A 126 LEU HD1% 1.0 1.8 5.50 1136 1136 A 154 LEU HD1% A 150 VAL HG2% 1.0 1.8 5.83 1137 1137 A 147 ILE HD1% A 150 VAL HG1% 1.0 1.8 5.82 1138 1138 A 151 ILE HD1% A 150 VAL HG1% 1.0 1.8 5.01 1139 1139 A 168 LEU HD2% A 161 ILE HD1% 1.0 1.8 5.01 1140 1140 A 154 LEU HD1% A 150 VAL HG1% 1.0 1.8 6.33 1141 1141 A 98 LEU HD2% A 126 LEU HD1% 1.0 1.8 6.33 1142 1142 A 17 LEU HD2% A 57 LEU HD2% 1.0 1.8 5.30 1143 1143 A 57 LEU HD1% A 47 VAL HG2% 1.0 1.8 5.73 1144 1144 A 151 ILE HD1% A 121 VAL HG1% 1.0 1.8 4.60 1145 1145 A 57 LEU HD1% A 40 LEU HD1% 1.0 1.8 4.11 1146 1146 A 168 LEU HD2% A 172 LEU HD1% 1.0 1.8 5.24 1147 1147 A 92 ILE HD1% A 119 LEU HD1% 1.0 1.8 5.96 1148 1148 A 17 LEU HD1% A 53 ILE HD1% 1.0 1.8 4.82 1149 1149 A 57 LEU HD2% A 40 LEU HD2% 1.0 1.8 4.27 1150 1150 A 57 LEU HD2% A 40 LEU HD1% 1.0 1.8 4.27 1151 1151 A 17 LEU HD2% A 57 LEU HD1% 1.0 1.8 3.57 1152 1152 A 17 LEU HD1% A 57 LEU HD1% 1.0 1.8 4.15 1153 1153 A 154 LEU HD1% A 121 VAL HG2% 1.0 1.8 3.67 1154 1154 A 154 LEU HD1% A 124 ILE HD1% 1.0 1.8 3.22 1155 1155 A 84 VAL HG2% A 90 LEU HD1% 1.0 1.8 5.45 1156 1156 A 90 LEU HD2% A 84 VAL HG1% 1.0 1.8 3.17 1157 1157 A 17 LEU HD2% A 47 VAL HG2% 1.0 1.8 3.52 1158 1158 A 114 VAL HG1% A 102 LEU HD1% 1.0 1.8 5.18 1159 1159 A 126 LEU HD1% A 90 LEU HD1% 1.0 1.8 4.03 1160 1160 A 126 LEU HD2% A 90 LEU HD1% 1.0 1.8 3.71 1161 1161 A 102 LEU HD2% A 98 LEU HD1% 1.0 1.8 3.59 1162 1162 A 98 LEU HD1% A 102 LEU HD1% 1.0 1.8 3.34 1163 1163 A 98 LEU HD2% A 102 LEU HD1% 1.0 1.8 3.70 1164 1164 A 126 LEU HD2% A 90 LEU HD2% 1.0 1.8 4.32 1165 1165 A 168 LEU HD2% A 171 LEU HD2% 1.0 1.8 4.72 1166 1166 A 168 LEU HD1% A 171 LEU HD1% 1.0 1.8 5.49 1167 1167 A 151 ILE HD1% A 150 VAL HG2% 1.0 1.8 3.61 1168 1168 A 57 LEU HD1% A 53 ILE HD1% 1.0 1.8 4.34 1169 1169 A 17 LEU HD2% A 53 ILE HD1% 1.0 1.8 4.13 1170 1170 A 47 VAL HG1% A 53 ILE HD1% 1.0 1.8 3.70 1171 1171 A 80 ILE HD1% A 90 LEU HD1% 1.0 1.8 6.05 1172 1172 A 92 ILE HD1% A 90 LEU HD1% 1.0 1.8 5.74 1173 1173 A 168 LEU HD1% A 161 ILE HD1% 1.0 1.8 4.80 1174 1174 A 17 LEU HD2% A 47 VAL HG1% 1.0 1.8 3.35 1175 1175 A 57 LEU HD1% A 40 LEU HD2% 1.0 1.8 4.11 1176 1176 A 102 LEU HD2% A 126 LEU HD1% 1.0 1.8 6.33 1177 1177 A 126 LEU HD2% A 92 ILE HD1% 1.0 1.8 3.37 1178 1178 A 121 VAL HG2% A 154 LEU HD2% 1.0 1.8 4.68 1179 1179 A 154 LEU HD1% A 121 VAL HG1% 1.0 1.8 4.08 1180 1180 A 119 LEU HD2% A 114 VAL HG2% 1.0 1.8 4.34 1181 1181 A 168 LEU HD1% A 171 LEU HD2% 1.0 1.8 5.23 1182 1182 A 14 GLN H A 14 GLN HBy 1.0 1.8 3.17 1183 1182 A 14 GLN H A 14 GLN HBx 1.0 1.8 3.17 1184 1183 A 15 GLU H A 14 GLN HBy 1.0 1.8 3.92 1185 1183 A 15 GLU H A 14 GLN HBx 1.0 1.8 3.92 1186 1184 A 17 LEU HD1% A 53 ILE HG1y 1.0 1.8 3.86 1187 1184 A 17 LEU HD1% A 53 ILE HG1x 1.0 1.8 3.86 1188 1185 A 39 MET H A 38 ASN HB3 1.0 1.8 3.89 1189 1185 A 39 MET H A 38 ASN HB2 1.0 1.8 3.89 1190 1186 A 47 VAL HG1% A 40 LEU HD1% 1.0 1.8 5.39 1191 1186 A 47 VAL HG1% A 40 LEU HD2% 1.0 1.8 5.39 1192 1187 A 57 LEU HD2% A 40 LEU HD1% 1.0 1.8 3.71 1193 1187 A 57 LEU HD2% A 40 LEU HD2% 1.0 1.8 3.71 1194 1188 A 58 ILE HD1% A 40 LEU HD1% 1.0 1.8 5.05 1195 1188 A 58 ILE HD1% A 40 LEU HD2% 1.0 1.8 5.05 1196 1189 A 41 LYS H A 41 LYS HB3 1.0 1.8 3.57 1197 1189 A 41 LYS H A 41 LYS HB2 1.0 1.8 3.57 1198 1190 A 42 THR H A 41 LYS HB3 1.0 1.8 3.91 1199 1190 A 42 THR H A 41 LYS HB2 1.0 1.8 3.91 1200 1191 A 49 PHE HZ A 41 LYS HB3 1.0 1.8 5.54 1201 1191 A 49 PHE HZ A 41 LYS HB2 1.0 1.8 5.54 1202 1192 A 49 PHE HE2 A 41 LYS HB3 1.0 1.8 5.14 1203 1192 A 49 PHE HE2 A 41 LYS HB2 1.0 1.8 5.14 1204 1193 A 43 TYR HE1 A 43 TYR HB2 1.0 1.8 5.45 1205 1193 A 43 TYR HE1 A 43 TYR HB3 1.0 1.8 5.45 1206 1194 A 44 PHE H A 44 PHE HB3 1.0 1.8 4.13 1207 1194 A 44 PHE H A 44 PHE HB2 1.0 1.8 4.13 1208 1195 A 45 SER H A 44 PHE HB3 1.0 1.8 4.83 1209 1195 A 45 SER H A 44 PHE HB2 1.0 1.8 4.83 1210 1196 A 47 VAL HG1% A 44 PHE HB3 1.0 1.8 5.27 1211 1196 A 47 VAL HG1% A 44 PHE HB2 1.0 1.8 5.27 1212 1197 A 47 VAL HG2% A 44 PHE HB3 1.0 1.8 4.52 1213 1197 A 47 VAL HG2% A 44 PHE HB2 1.0 1.8 4.52 1214 1198 A 49 PHE HZ A 44 PHE HB3 1.0 1.8 4.39 1215 1198 A 49 PHE HZ A 44 PHE HB2 1.0 1.8 4.39 1216 1199 A 45 SER H A 45 SER HB2 1.0 1.8 4.08 1217 1199 A 45 SER H A 45 SER HB3 1.0 1.8 4.08 1218 1200 A 46 ASP H A 45 SER HB2 1.0 1.8 4.75 1219 1200 A 46 ASP H A 45 SER HB3 1.0 1.8 4.75 1220 1201 A 46 ASP H A 46 ASP HBy 1.0 1.8 4.12 1221 1201 A 46 ASP H A 46 ASP HBx 1.0 1.8 4.12 1222 1202 A 47 VAL H A 46 ASP HBy 1.0 1.8 4.78 1223 1202 A 47 VAL H A 46 ASP HBx 1.0 1.8 4.78 1224 1203 A 47 VAL HG2% A 46 ASP HBy 1.0 1.8 5.27 1225 1203 A 47 VAL HG2% A 46 ASP HBx 1.0 1.8 5.27 1226 1204 A 47 VAL HG1% A 53 ILE HG1y 1.0 1.8 4.84 1227 1204 A 47 VAL HG1% A 53 ILE HG1x 1.0 1.8 4.84 1228 1205 A 48 LYS H A 48 LYS HBx 1.0 1.8 3.58 1229 1205 A 48 LYS H A 48 LYS HBy 1.0 1.8 3.58 1230 1206 A 49 PHE H A 48 LYS HBx 1.0 1.8 3.98 1231 1206 A 49 PHE H A 48 LYS HBy 1.0 1.8 3.98 1232 1207 A 49 PHE H A 49 PHE HBx 1.0 1.8 4.15 1233 1207 A 49 PHE H A 49 PHE HBy 1.0 1.8 4.15 1234 1208 A 50 ASN H A 53 ILE HG1y 1.0 1.8 4.86 1235 1208 A 50 ASN H A 53 ILE HG1x 1.0 1.8 4.86 1236 1209 A 72 MET HE% A 91 SER HB2 1.0 1.8 4.83 1237 1209 A 72 MET HE% A 91 SER HB3 1.0 1.8 4.83 1238 1210 A 74 LYS H A 74 LYS HB2 1.0 1.8 3.78 1239 1210 A 74 LYS H A 74 LYS HBy 1.0 1.8 3.78 1240 1211 A 75 TYR H A 74 LYS HB2 1.0 1.8 4.39 1241 1211 A 75 TYR H A 74 LYS HBy 1.0 1.8 4.39 1242 1212 A 75 TYR HD1 A 74 LYS HB2 1.0 1.8 4.49 1243 1212 A 75 TYR HD1 A 74 LYS HBy 1.0 1.8 4.49 1244 1213 A 75 TYR HE1 A 74 LYS HB2 1.0 1.8 4.78 1245 1213 A 75 TYR HE1 A 74 LYS HBy 1.0 1.8 4.78 1246 1214 A 75 TYR H A 75 TYR HB2 1.0 1.8 4.21 1247 1214 A 75 TYR H A 75 TYR HBy 1.0 1.8 4.21 1248 1215 A 75 TYR H A 78 GLN HB2 1.0 1.8 5.55 1249 1215 A 75 TYR H A 78 GLN HBy 1.0 1.8 5.55 1250 1216 A 75 TYR HE2 A 75 TYR HB2 1.0 1.8 5.26 1251 1216 A 75 TYR HE2 A 75 TYR HBy 1.0 1.8 5.26 1252 1217 A 76 ALA H A 75 TYR HB2 1.0 1.8 4.62 1253 1217 A 76 ALA H A 75 TYR HBy 1.0 1.8 4.62 1254 1218 A 76 ALA HB% A 75 TYR HB2 1.0 1.8 4.65 1255 1218 A 76 ALA HB% A 75 TYR HBy 1.0 1.8 4.65 1256 1219 A 90 LEU HD1% A 75 TYR HB2 1.0 1.8 4.73 1257 1219 A 90 LEU HD1% A 75 TYR HBy 1.0 1.8 4.73 1258 1220 A 126 LEU HD1% A 75 TYR HB2 1.0 1.8 4.62 1259 1220 A 126 LEU HD1% A 75 TYR HBy 1.0 1.8 4.62 1260 1221 A 126 LEU HD2% A 75 TYR HB2 1.0 1.8 5.07 1261 1221 A 126 LEU HD2% A 75 TYR HBy 1.0 1.8 5.07 1262 1222 A 75 TYR HD1 A 78 GLN HB2 1.0 1.8 4.88 1263 1222 A 75 TYR HD1 A 78 GLN HBy 1.0 1.8 4.88 1264 1223 A 75 TYR HE2 A 91 SER HB2 1.0 1.8 4.52 1265 1223 A 75 TYR HE2 A 91 SER HB3 1.0 1.8 4.52 1266 1224 A 75 TYR HD2 A 91 SER HB2 1.0 1.8 4.90 1267 1224 A 75 TYR HD2 A 91 SER HB3 1.0 1.8 4.90 1268 1225 A 76 ALA H A 78 GLN HB2 1.0 1.8 5.74 1269 1225 A 76 ALA H A 78 GLN HBy 1.0 1.8 5.74 1270 1226 A 78 GLN H A 78 GLN HB2 1.0 1.8 3.42 1271 1226 A 78 GLN H A 78 GLN HBy 1.0 1.8 3.42 1272 1227 A 79 ALA H A 78 GLN HB2 1.0 1.8 3.73 1273 1227 A 79 ALA H A 78 GLN HBy 1.0 1.8 3.73 1274 1228 A 80 ILE HG2% A 81 ASN HB3 1.0 1.8 5.51 1275 1228 A 80 ILE HG2% A 81 ASN HB2 1.0 1.8 5.51 1276 1229 A 80 ILE HD1% A 130 PHE HBx 1.0 1.8 4.42 1277 1229 A 80 ILE HD1% A 130 PHE HBy 1.0 1.8 4.42 1278 1230 A 81 ASN H A 81 ASN HB3 1.0 1.8 3.53 1279 1230 A 81 ASN H A 81 ASN HB2 1.0 1.8 3.53 1280 1231 A 84 VAL HG1% A 89 GLU HBx 1.0 1.8 3.71 1281 1231 A 84 VAL HG1% A 89 GLU HBy 1.0 1.8 3.71 1282 1232 A 84 VAL HG1% A 90 LEU HBy 1.0 1.8 5.58 1283 1232 A 84 VAL HG1% A 90 LEU HBx 1.0 1.8 5.58 1284 1233 A 84 VAL HG2% A 89 GLU HBx 1.0 1.8 5.20 1285 1233 A 84 VAL HG2% A 89 GLU HBy 1.0 1.8 5.20 1286 1234 A 86 SER H A 86 SER HBy 1.0 1.8 3.54 1287 1234 A 86 SER H A 86 SER HBx 1.0 1.8 3.54 1288 1235 A 89 GLU H A 86 SER HBy 1.0 1.8 4.77 1289 1235 A 89 GLU H A 86 SER HBx 1.0 1.8 4.77 1290 1236 A 90 LEU HD2% A 86 SER HBy 1.0 1.8 5.08 1291 1236 A 90 LEU HD2% A 86 SER HBx 1.0 1.8 5.08 1292 1237 A 87 THR HG2% A 130 PHE HBx 1.0 1.8 4.81 1293 1237 A 87 THR HG2% A 130 PHE HBy 1.0 1.8 4.81 1294 1238 A 88 GLU H A 88 GLU HBx 1.0 1.8 3.43 1295 1238 A 88 GLU H A 88 GLU HBy 1.0 1.8 3.43 1296 1239 A 89 GLU H A 88 GLU HBx 1.0 1.8 5.11 1297 1239 A 89 GLU H A 88 GLU HBy 1.0 1.8 5.11 1298 1240 A 89 GLU H A 89 GLU HBx 1.0 1.8 3.19 1299 1240 A 89 GLU H A 89 GLU HBy 1.0 1.8 3.19 1300 1241 A 90 LEU H A 89 GLU HBx 1.0 1.8 4.05 1301 1241 A 90 LEU H A 89 GLU HBy 1.0 1.8 4.05 1302 1242 A 90 LEU HD2% A 89 GLU HBx 1.0 1.8 3.96 1303 1242 A 90 LEU HD2% A 89 GLU HBy 1.0 1.8 3.96 1304 1243 A 90 LEU HD1% A 90 LEU HBy 1.0 1.8 3.54 1305 1243 A 90 LEU HD1% A 90 LEU HBx 1.0 1.8 3.54 1306 1244 A 90 LEU HD2% A 90 LEU HBy 1.0 1.8 3.32 1307 1244 A 90 LEU HD2% A 90 LEU HBx 1.0 1.8 3.32 1308 1245 A 91 SER H A 90 LEU HBy 1.0 1.8 4.00 1309 1245 A 91 SER H A 90 LEU HBx 1.0 1.8 4.00 1310 1246 A 126 LEU HD2% A 90 LEU HBy 1.0 1.8 4.72 1311 1246 A 126 LEU HD2% A 90 LEU HBx 1.0 1.8 4.72 1312 1247 A 98 LEU HD1% A 91 SER HB2 1.0 1.8 4.43 1313 1247 A 98 LEU HD1% A 91 SER HB3 1.0 1.8 4.43 1314 1248 A 126 LEU HD1% A 91 SER HB2 1.0 1.8 5.27 1315 1248 A 126 LEU HD1% A 91 SER HB3 1.0 1.8 5.27 1316 1249 A 126 LEU HD2% A 91 SER HB2 1.0 1.8 5.07 1317 1249 A 126 LEU HD2% A 91 SER HB3 1.0 1.8 5.07 1318 1250 A 95 ASP H A 95 ASP HBx 1.0 1.8 3.71 1319 1250 A 95 ASP H A 95 ASP HBy 1.0 1.8 3.71 1320 1251 A 98 LEU HD1% A 102 LEU HBx 1.0 1.8 4.73 1321 1251 A 98 LEU HD1% A 102 LEU HBy 1.0 1.8 4.73 1322 1252 A 102 LEU H A 102 LEU HBx 1.0 1.8 4.09 1323 1252 A 102 LEU H A 102 LEU HBy 1.0 1.8 4.09 1324 1253 A 103 ASN H A 102 LEU HBx 1.0 1.8 4.84 1325 1253 A 103 ASN H A 102 LEU HBy 1.0 1.8 4.84 1326 1254 A 104 MET H A 102 LEU HBx 1.0 1.8 6.14 1327 1254 A 104 MET H A 102 LEU HBy 1.0 1.8 6.14 1328 1255 A 106 TYR HD2 A 102 LEU HBx 1.0 1.8 4.84 1329 1255 A 106 TYR HD2 A 102 LEU HBy 1.0 1.8 4.84 1330 1256 A 106 TYR H A 105 HIS HB2 1.0 1.8 4.81 1331 1256 A 106 TYR H A 105 HIS HBy 1.0 1.8 4.81 1332 1257 A 108 LYS H A 108 LYS HB2 1.0 1.8 3.28 1333 1257 A 108 LYS H A 108 LYS HBy 1.0 1.8 3.28 1334 1258 A 109 ALA H A 108 LYS HB2 1.0 1.8 3.94 1335 1258 A 109 ALA H A 108 LYS HBy 1.0 1.8 3.94 1336 1259 A 110 ASN H A 108 LYS HB2 1.0 1.8 5.93 1337 1259 A 110 ASN H A 108 LYS HBy 1.0 1.8 5.93 1338 1260 A 109 ALA H A 110 ASN HBx 1.0 1.8 6.14 1339 1260 A 109 ALA H A 110 ASN HBy 1.0 1.8 6.14 1340 1261 A 110 ASN H A 110 ASN HBx 1.0 1.8 3.80 1341 1261 A 110 ASN H A 110 ASN HBy 1.0 1.8 3.80 1342 1262 A 110 ASN H A 111 ASP HBx 1.0 1.8 6.07 1343 1262 A 110 ASN H A 111 ASP HBy 1.0 1.8 6.07 1344 1263 A 111 ASP H A 110 ASN HBx 1.0 1.8 4.91 1345 1263 A 111 ASP H A 110 ASN HBy 1.0 1.8 4.91 1346 1264 A 111 ASP H A 111 ASP HBx 1.0 1.8 3.70 1347 1264 A 111 ASP H A 111 ASP HBy 1.0 1.8 3.70 1348 1265 A 112 PHE H A 111 ASP HBx 1.0 1.8 3.65 1349 1265 A 112 PHE H A 111 ASP HBy 1.0 1.8 3.65 1350 1266 A 113 GLU H A 112 PHE HB2 1.0 1.8 4.70 1351 1266 A 113 GLU H A 112 PHE HBy 1.0 1.8 4.70 1352 1267 A 113 GLU H A 113 GLU HB2 1.0 1.8 3.47 1353 1267 A 113 GLU H A 113 GLU HB3 1.0 1.8 3.47 1354 1268 A 114 VAL HG1% A 118 PHE HBy 1.0 1.8 4.89 1355 1268 A 114 VAL HG1% A 118 PHE HBx 1.0 1.8 4.89 1356 1269 A 118 PHE H A 118 PHE HBy 1.0 1.8 4.08 1357 1269 A 118 PHE H A 118 PHE HBx 1.0 1.8 4.08 1358 1270 A 119 LEU H A 118 PHE HBy 1.0 1.8 5.05 1359 1270 A 119 LEU H A 118 PHE HBx 1.0 1.8 5.05 1360 1271 A 119 LEU HD1% A 118 PHE HBy 1.0 1.8 4.72 1361 1271 A 119 LEU HD1% A 118 PHE HBx 1.0 1.8 4.72 1362 1272 A 119 LEU HD2% A 118 PHE HBy 1.0 1.8 3.94 1363 1272 A 119 LEU HD2% A 118 PHE HBx 1.0 1.8 3.94 1364 1273 A 124 ILE H A 124 ILE HG1x 1.0 1.8 3.70 1365 1273 A 124 ILE H A 124 ILE HG1y 1.0 1.8 3.70 1366 1274 A 130 PHE H A 130 PHE HBx 1.0 1.8 4.11 1367 1274 A 130 PHE H A 130 PHE HBy 1.0 1.8 4.11 1368 1275 A 131 ASN H A 130 PHE HBx 1.0 1.8 4.46 1369 1275 A 131 ASN H A 130 PHE HBy 1.0 1.8 4.46 1370 1276 A 134 ILE HG2% A 130 PHE HBx 1.0 1.8 4.88 1371 1276 A 134 ILE HG2% A 130 PHE HBy 1.0 1.8 4.88 1372 1277 A 131 ASN H A 131 ASN HBx 1.0 1.8 3.53 1373 1277 A 131 ASN H A 131 ASN HBy 1.0 1.8 3.53 1374 1278 A 132 ALA H A 131 ASN HBx 1.0 1.8 4.08 1375 1278 A 132 ALA H A 131 ASN HBy 1.0 1.8 4.08 1376 1279 A 134 ILE HD1% A 131 ASN HBx 1.0 1.8 6.00 1377 1279 A 134 ILE HD1% A 131 ASN HBy 1.0 1.8 6.00 1378 1280 A 138 ASP H A 138 ASP HBx 1.0 1.8 3.52 1379 1280 A 138 ASP H A 138 ASP HBy 1.0 1.8 3.52 1380 1281 A 139 VAL H A 138 ASP HBx 1.0 1.8 4.38 1381 1281 A 139 VAL H A 138 ASP HBy 1.0 1.8 4.38 1382 1282 A 140 ASP H A 138 ASP HBx 1.0 1.8 5.93 1383 1282 A 140 ASP H A 138 ASP HBy 1.0 1.8 5.93 1384 1283 A 142 SER H A 142 SER HB2 1.0 1.8 3.43 1385 1283 A 142 SER H A 142 SER HB3 1.0 1.8 3.43 1386 1284 A 143 TRP H A 142 SER HB2 1.0 1.8 4.96 1387 1284 A 143 TRP H A 142 SER HB3 1.0 1.8 4.96 1388 1285 A 145 LYS H A 145 LYS HB3 1.0 1.8 3.37 1389 1285 A 145 LYS H A 145 LYS HB2 1.0 1.8 3.37 1390 1286 A 146 ALA H A 145 LYS HB3 1.0 1.8 3.68 1391 1286 A 146 ALA H A 145 LYS HB2 1.0 1.8 3.68 1392 1287 A 148 TYR HD1 A 145 LYS HB3 1.0 1.8 4.90 1393 1287 A 148 TYR HD1 A 145 LYS HB2 1.0 1.8 4.90 1394 1288 A 147 ILE H A 147 ILE HG1y 1.0 1.8 3.85 1395 1288 A 147 ILE H A 147 ILE HG1x 1.0 1.8 3.85 1396 1289 A 148 TYR H A 147 ILE HG1y 1.0 1.8 5.13 1397 1289 A 148 TYR H A 147 ILE HG1x 1.0 1.8 5.13 1398 1290 A 151 ILE HD1% A 147 ILE HG1y 1.0 1.8 5.87 1399 1290 A 151 ILE HD1% A 147 ILE HG1x 1.0 1.8 5.87 1400 1291 A 150 VAL H A 152 CYS HBy 1.0 1.8 5.61 1401 1291 A 150 VAL H A 152 CYS HBx 1.0 1.8 5.61 1402 1292 A 151 ILE HD1% A 152 CYS HBy 1.0 1.8 5.73 1403 1292 A 151 ILE HD1% A 152 CYS HBx 1.0 1.8 5.73 1404 1293 A 152 CYS H A 152 CYS HBy 1.0 1.8 3.88 1405 1293 A 152 CYS H A 152 CYS HBx 1.0 1.8 3.88 1406 1294 A 153 LYS H A 152 CYS HBy 1.0 1.8 3.91 1407 1294 A 153 LYS H A 152 CYS HBx 1.0 1.8 3.91 1408 1295 A 156 SER H A 156 SER HBy 1.0 1.8 3.89 1409 1295 A 156 SER H A 156 SER HBx 1.0 1.8 3.89 1410 1296 A 157 GLU H A 156 SER HBy 1.0 1.8 3.86 1411 1296 A 157 GLU H A 156 SER HBx 1.0 1.8 3.86 1412 1297 A 158 VAL H A 157 GLU HB3 1.0 1.8 4.28 1413 1297 A 158 VAL H A 157 GLU HB2 1.0 1.8 4.28 1414 1298 A 158 VAL HG2% A 157 GLU HB3 1.0 1.8 5.11 1415 1298 A 158 VAL HG2% A 157 GLU HB2 1.0 1.8 5.11 1416 1299 A 158 VAL HG2% A 159 PRO HBx 1.0 1.8 5.53 1417 1299 A 158 VAL HG2% A 159 PRO HBy 1.0 1.8 5.53 1418 1300 A 160 GLU H A 160 GLU HB3 1.0 1.8 3.38 1419 1300 A 160 GLU H A 160 GLU HB2 1.0 1.8 3.38 1420 1301 A 161 ILE H A 160 GLU HB3 1.0 1.8 4.09 1421 1301 A 161 ILE H A 160 GLU HB2 1.0 1.8 4.09 1422 1302 A 161 ILE HG2% A 167 CYS HBx 1.0 1.8 4.57 1423 1302 A 161 ILE HG2% A 167 CYS HBy 1.0 1.8 4.57 1424 1303 A 161 ILE HD1% A 167 CYS HBx 1.0 1.8 4.42 1425 1303 A 161 ILE HD1% A 167 CYS HBy 1.0 1.8 4.42 1426 1304 A 164 SER H A 167 CYS HBx 1.0 1.8 4.77 1427 1304 A 164 SER H A 167 CYS HBy 1.0 1.8 4.77 1428 1305 A 166 ASN H A 165 PRO HBy 1.0 1.8 4.59 1429 1305 A 166 ASN H A 165 PRO HBx 1.0 1.8 4.59 1430 1306 A 166 ASN H A 166 ASN HBx 1.0 1.8 4.01 1431 1306 A 166 ASN H A 166 ASN HBy 1.0 1.8 4.01 1432 1307 A 167 CYS H A 166 ASN HBx 1.0 1.8 5.11 1433 1307 A 167 CYS H A 166 ASN HBy 1.0 1.8 5.11 1434 1308 A 169 GLN H A 166 ASN HBx 1.0 1.8 6.14 1435 1308 A 169 GLN H A 166 ASN HBy 1.0 1.8 6.14 1436 1309 A 168 LEU H A 167 CYS HBx 1.0 1.8 3.86 1437 1309 A 168 LEU H A 167 CYS HBy 1.0 1.8 3.86 1438 1310 A 168 LEU HD1% A 167 CYS HBx 1.0 1.8 5.26 1439 1310 A 168 LEU HD1% A 167 CYS HBy 1.0 1.8 5.26 1440 1311 A 169 GLN H A 167 CYS HBx 1.0 1.8 6.14 1441 1311 A 169 GLN H A 167 CYS HBy 1.0 1.8 6.14 1442 1312 A 171 LEU HD2% A 167 CYS HBx 1.0 1.8 6.03 1443 1312 A 171 LEU HD2% A 167 CYS HBy 1.0 1.8 6.03 1444 1313 A 169 GLN H A 169 GLN HB3 1.0 1.8 2.98 1445 1313 A 169 GLN H A 169 GLN HB2 1.0 1.8 2.98 1446 1314 A 171 LEU H A 170 GLU HBy 1.0 1.8 3.82 1447 1314 A 171 LEU H A 170 GLU HBx 1.0 1.8 3.82 1448 1315 A 172 LEU H A 172 LEU HBy 1.0 1.8 3.21 1449 1315 A 172 LEU H A 172 LEU HBx 1.0 1.8 3.21 1450 1316 A 172 LEU HD2% A 172 LEU HBy 1.0 1.8 3.05 1451 1316 A 172 LEU HD2% A 172 LEU HBx 1.0 1.8 3.05 1452 1317 A 72 MET HE% A 122 ALA HB% 1.0 1.8 4.60 1453 1318 A 72 MET HE% A 125 THR HG2% 1.0 1.8 4.60 1454 1319 A 151 ILE HD1% A 125 THR HG2% 1.0 1.8 4.60 1455 1320 A 147 ILE HD1% A 129 PHE HD1 1.0 1.8 4.60 1456 1320 A 147 ILE HD1% A 129 PHE HD2 1.0 1.8 4.60 1457 1321 A 147 ILE HD1% A 129 PHE HE1 1.0 1.8 4.60 1458 1321 A 147 ILE HD1% A 129 PHE HE2 1.0 1.8 4.60 1459 1322 A 25 ALA HB% A 60 TRP HE3 1.0 1.8 4.60 1460 1323 A 32 THR HG2% A 39 MET HE% 1.0 1.8 4.60 1461 1324 A 126 LEU HD1% A 75 TYR HD1 1.0 1.8 4.60 1462 1324 A 126 LEU HD1% A 75 TYR HD2 1.0 1.8 4.60 1463 1325 A 98 LEU HD1% A 75 TYR HD1 1.0 1.8 4.60 1464 1325 A 98 LEU HD1% A 75 TYR HD2 1.0 1.8 4.60 1465 1326 A 99 TYR HD1 A 119 LEU HD2% 1.0 1.8 4.60 1466 1326 A 119 LEU HD2% A 99 TYR HD2 1.0 1.8 4.60 1467 1327 A 119 LEU HD2% A 99 TYR HE1 1.0 1.8 4.60 1468 1327 A 119 LEU HD2% A 99 TYR HE2 1.0 1.8 4.60 1469 1328 A 126 LEU HD1% A 76 ALA HB% 1.0 1.8 4.60 1470 1329 A 90 LEU HD2% A 84 VAL HG1% 1.0 1.8 4.60 1471 1330 A 84 VAL HG2% A 90 LEU HD2% 1.0 1.8 4.60 1472 1331 A 47 VAL HG1% A 53 ILE HD1% 1.0 1.8 4.60 1473 1332 A 25 ALA HB% A 57 LEU HD2% 1.0 1.8 4.60 1474 1333 A 114 VAL HG1% A 27 LEU HD2% 1.0 1.8 5.75 1475 1334 A 106 TYR HE1 A 64 PHE HD% 1.0 1.8 4.60 1476 1334 A 106 TYR HE2 A 64 PHE HD% 1.0 1.8 4.60 1477 1335 A 106 TYR HE1 A 67 PHE HD% 1.0 1.8 4.60 1478 1335 A 106 TYR HE2 A 67 PHE HD% 1.0 1.8 4.60 1479 1336 A 118 PHE HD% A 30 PHE HD% 1.0 1.8 4.60 1480 1337 A 112 PHE HE% A 162 PHE HE% 1.0 1.8 4.60 1481 1338 A 61 PHE HD% A 29 PHE HD% 1.0 1.8 4.60 1482 1339 A 25 ALA HB% A 61 PHE HE% 1.0 1.8 4.60 1483 1340 A 49 PHE HE1 A 57 LEU HD1% 1.0 1.8 4.60 1484 1340 A 57 LEU HD1% A 49 PHE HE2 1.0 1.8 4.60 1485 1341 A 162 PHE HE% A 27 LEU HD1% 1.0 1.8 4.60 1486 1342 A 28 MET HE% A 162 PHE HE% 1.0 1.8 4.60 1487 1343 A 158 VAL HG2% A 43 TYR HE1 1.0 1.8 4.60 1488 1343 A 158 VAL HG2% A 43 TYR HE2 1.0 1.8 4.60 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 20 ASN O A 24 LYS H 1.0 1.81 1.99 2 2 A 20 ASN O A 24 LYS N 1.0 2.71 2.99 3 3 A 21 HIS O A 25 ALA H 1.0 1.81 1.99 4 4 A 21 HIS O A 25 ALA N 1.0 2.71 2.99 5 5 A 22 LEU O A 26 LYS H 1.0 1.81 1.99 6 6 A 22 LEU O A 26 LYS N 1.0 2.71 2.99 7 7 A 23 LYS O A 27 LEU H 1.0 1.81 1.99 8 8 A 23 LYS O A 27 LEU N 1.0 2.71 2.99 9 9 A 24 LYS O A 28 MET H 1.0 1.81 1.99 10 10 A 24 LYS O A 28 MET N 1.0 2.71 2.99 11 11 A 25 ALA O A 29 PHE H 1.0 1.81 1.99 12 12 A 25 ALA O A 29 PHE N 1.0 2.71 2.99 13 13 A 26 LYS O A 30 PHE H 1.0 1.81 1.99 14 14 A 26 LYS O A 30 PHE N 1.0 2.71 2.99 15 15 A 40 LEU H A 36 SER O 1.0 1.81 1.99 16 16 A 36 SER O A 40 LEU N 1.0 2.71 2.99 17 17 A 41 LYS H A 37 SER O 1.0 1.81 1.99 18 18 A 37 SER O A 41 LYS N 1.0 2.71 2.99 19 19 A 42 THR H A 38 ASN O 1.0 1.81 1.99 20 20 A 38 ASN O A 42 THR N 1.0 2.71 2.99 21 21 A 43 TYR H A 39 MET O 1.0 1.81 1.99 22 22 A 39 MET O A 43 TYR N 1.0 2.71 2.99 23 23 A 44 PHE H A 40 LEU O 1.0 1.81 1.99 24 24 A 40 LEU O A 44 PHE N 1.0 2.71 2.99 25 25 A 50 ASN O A 54 THR H 1.0 1.81 1.99 26 26 A 50 ASN O A 54 THR N 1.0 2.71 2.99 27 27 A 55 SER H A 51 ARG O 1.0 1.81 1.99 28 28 A 51 ARG O A 55 SER N 1.0 2.71 2.99 29 29 A 52 CYS O A 56 GLN H 1.0 1.81 1.99 30 30 A 52 CYS O A 56 GLN N 1.0 2.71 2.99 31 31 A 57 LEU H A 53 ILE O 1.0 1.81 1.99 32 32 A 53 ILE O A 57 LEU N 1.0 2.71 2.99 33 33 A 58 ILE H A 54 THR O 1.0 1.81 1.99 34 34 A 54 THR O A 58 ILE N 1.0 2.71 2.99 35 35 A 59 LYS H A 55 SER O 1.0 1.81 1.99 36 36 A 55 SER O A 59 LYS N 1.0 2.71 2.99 37 37 A 60 TRP H A 56 GLN O 1.0 1.81 1.99 38 38 A 56 GLN O A 60 TRP N 1.0 2.71 2.99 39 39 A 61 PHE H A 57 LEU O 1.0 1.81 1.99 40 40 A 57 LEU O A 61 PHE N 1.0 2.71 2.99 41 41 A 62 SER H A 58 ILE O 1.0 1.81 1.99 42 42 A 58 ILE O A 62 SER N 1.0 2.71 2.99 43 43 A 63 ASN H A 59 LYS O 1.0 1.81 1.99 44 44 A 59 LYS O A 63 ASN N 1.0 2.71 2.99 45 45 A 64 PHE H A 60 TRP O 1.0 1.81 1.99 46 46 A 60 TRP O A 64 PHE N 1.0 2.71 2.99 47 47 A 65 ARG H A 61 PHE O 1.0 1.81 1.99 48 48 A 61 PHE O A 65 ARG N 1.0 2.71 2.99 49 49 A 66 GLU H A 62 SER O 1.0 1.81 1.99 50 50 A 62 SER O A 66 GLU N 1.0 2.71 2.99 51 51 A 67 PHE H A 63 ASN O 1.0 1.81 1.99 52 52 A 63 ASN O A 67 PHE N 1.0 2.71 2.99 53 53 A 68 TYR H A 64 PHE O 1.0 1.81 1.99 54 54 A 64 PHE O A 68 TYR N 1.0 2.71 2.99 55 55 A 69 TYR H A 65 ARG O 1.0 1.81 1.99 56 56 A 65 ARG O A 69 TYR N 1.0 2.71 2.99 57 57 A 70 ILE H A 66 GLU O 1.0 1.81 1.99 58 58 A 66 GLU O A 70 ILE N 1.0 2.71 2.99 59 59 A 71 GLN H A 67 PHE O 1.0 1.81 1.99 60 60 A 67 PHE O A 71 GLN N 1.0 2.71 2.99 61 61 A 72 MET H A 68 TYR O 1.0 1.81 1.99 62 62 A 68 TYR O A 72 MET N 1.0 2.71 2.99 63 63 A 73 GLU H A 69 TYR O 1.0 1.81 1.99 64 64 A 69 TYR O A 73 GLU N 1.0 2.71 2.99 65 65 A 74 LYS H A 70 ILE O 1.0 1.81 1.99 66 66 A 70 ILE O A 74 LYS N 1.0 2.71 2.99 67 67 A 75 TYR H A 71 GLN O 1.0 1.81 1.99 68 68 A 71 GLN O A 75 TYR N 1.0 2.71 2.99 69 69 A 76 ALA H A 72 MET O 1.0 1.81 1.99 70 70 A 72 MET O A 76 ALA N 1.0 2.71 2.99 71 71 A 77 ARG H A 73 GLU O 1.0 1.81 1.99 72 72 A 73 GLU O A 77 ARG N 1.0 2.71 2.99 73 73 A 78 GLN H A 74 LYS O 1.0 1.81 1.99 74 74 A 74 LYS O A 78 GLN N 1.0 2.71 2.99 75 75 A 79 ALA H A 75 TYR O 1.0 1.81 1.99 76 76 A 75 TYR O A 79 ALA N 1.0 2.71 2.99 77 77 A 80 ILE H A 76 ALA O 1.0 1.81 1.99 78 78 A 76 ALA O A 80 ILE N 1.0 2.71 2.99 79 79 A 81 ASN H A 77 ARG O 1.0 1.81 1.99 80 80 A 77 ARG O A 81 ASN N 1.0 2.71 2.99 81 81 A 82 ASP H A 78 GLN O 1.0 1.81 1.99 82 82 A 78 GLN O A 82 ASP N 1.0 2.71 2.99 83 83 A 83 GLY H A 79 ALA O 1.0 1.81 1.99 84 84 A 79 ALA O A 83 GLY N 1.0 2.71 2.99 85 85 A 100 ARG H A 96 CYS O 1.0 1.81 1.99 86 86 A 96 CYS O A 100 ARG N 1.0 2.71 2.99 87 87 A 101 ALA H A 97 GLU O 1.0 1.81 1.99 88 88 A 97 GLU O A 101 ALA N 1.0 2.71 2.99 89 89 A 102 LEU H A 98 LEU O 1.0 1.81 1.99 90 90 A 98 LEU O A 102 LEU N 1.0 2.71 2.99 91 91 A 103 ASN H A 99 TYR O 1.0 1.81 1.99 92 92 A 99 TYR O A 103 ASN N 1.0 2.71 2.99 93 93 A 104 MET H A 100 ARG O 1.0 1.81 1.99 94 94 A 100 ARG O A 104 MET N 1.0 2.71 2.99 95 95 A 105 HIS H A 101 ALA O 1.0 1.81 1.99 96 96 A 101 ALA O A 105 HIS N 1.0 2.71 2.99 97 97 A 106 TYR H A 102 LEU O 1.0 1.81 1.99 98 98 A 102 LEU O A 106 TYR N 1.0 2.71 2.99 99 99 A 107 ASN H A 103 ASN O 1.0 1.81 1.99 100 100 A 103 ASN O A 107 ASN N 1.0 2.71 2.99 101 101 A 120 GLU H A 116 GLU O 1.0 1.81 1.99 102 102 A 116 GLU O A 120 GLU N 1.0 2.71 2.99 103 103 A 121 VAL H A 117 ARG O 1.0 1.81 1.99 104 104 A 117 ARG O A 121 VAL N 1.0 2.71 2.99 105 105 A 122 ALA H A 118 PHE O 1.0 1.81 1.99 106 106 A 118 PHE O A 122 ALA N 1.0 2.71 2.99 107 107 A 123 GLN H A 119 LEU O 1.0 1.81 1.99 108 108 A 119 LEU O A 123 GLN N 1.0 2.71 2.99 109 109 A 124 ILE H A 120 GLU O 1.0 1.81 1.99 110 110 A 120 GLU O A 124 ILE N 1.0 2.71 2.99 111 111 A 125 THR H A 121 VAL O 1.0 1.81 1.99 112 112 A 121 VAL O A 125 THR N 1.0 2.71 2.99 113 113 A 126 LEU H A 122 ALA O 1.0 1.81 1.99 114 114 A 122 ALA O A 126 LEU N 1.0 2.71 2.99 115 115 A 127 ARG H A 123 GLN O 1.0 1.81 1.99 116 116 A 123 GLN O A 127 ARG N 1.0 2.71 2.99 117 117 A 128 GLU H A 124 ILE O 1.0 1.81 1.99 118 118 A 124 ILE O A 128 GLU N 1.0 2.71 2.99 119 119 A 129 PHE H A 125 THR O 1.0 1.81 1.99 120 120 A 125 THR O A 129 PHE N 1.0 2.71 2.99 121 121 A 130 PHE H A 126 LEU O 1.0 1.81 1.99 122 122 A 126 LEU O A 130 PHE N 1.0 2.71 2.99 123 123 A 131 ASN H A 127 ARG O 1.0 1.81 1.99 124 124 A 127 ARG O A 131 ASN N 1.0 2.71 2.99 125 125 A 132 ALA H A 128 GLU O 1.0 1.81 1.99 126 126 A 128 GLU O A 132 ALA N 1.0 2.71 2.99 127 127 A 133 ILE H A 129 PHE O 1.0 1.81 1.99 128 128 A 129 PHE O A 133 ILE N 1.0 2.71 2.99 129 129 A 134 ILE H A 130 PHE O 1.0 1.81 1.99 130 130 A 130 PHE O A 134 ILE N 1.0 2.71 2.99 131 131 A 135 ALA H A 131 ASN O 1.0 1.81 1.99 132 132 A 131 ASN O A 135 ALA N 1.0 2.71 2.99 133 133 A 136 GLY H A 132 ALA O 1.0 1.81 1.99 134 134 A 132 ALA O A 136 GLY N 1.0 2.71 2.99 135 135 A 146 ALA H A 142 SER O 1.0 1.81 1.99 136 136 A 142 SER O A 146 ALA N 1.0 2.71 2.99 137 137 A 147 ILE H A 143 TRP O 1.0 1.81 1.99 138 138 A 143 TRP O A 147 ILE N 1.0 2.71 2.99 139 139 A 148 TYR H A 144 LYS O 1.0 1.81 1.99 140 140 A 144 LYS O A 148 TYR N 1.0 2.71 2.99 141 141 A 149 LYS H A 145 LYS O 1.0 1.81 1.99 142 142 A 145 LYS O A 149 LYS N 1.0 2.71 2.99 143 143 A 150 VAL H A 146 ALA O 1.0 1.81 1.99 144 144 A 146 ALA O A 150 VAL N 1.0 2.71 2.99 145 145 A 151 ILE H A 147 ILE O 1.0 1.81 1.99 146 146 A 147 ILE O A 151 ILE N 1.0 2.71 2.99 147 147 A 152 CYS H A 148 TYR O 1.0 1.81 1.99 148 148 A 148 TYR O A 152 CYS N 1.0 2.71 2.99 149 149 A 153 LYS H A 149 LYS O 1.0 1.81 1.99 150 150 A 149 LYS O A 153 LYS N 1.0 2.71 2.99 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 35 PRO C A 36 SER N A 36 SER CA A 36 SER C 1.0 -83.19 -43.19 PHI 2 2 A 36 SER N A 36 SER CA A 36 SER C A 37 SER N 1.0 -60.22 -20.22 PSI 3 3 A 36 SER C A 37 SER N A 37 SER CA A 37 SER C 1.0 -82.28 -42.28 PHI 4 4 A 37 SER N A 37 SER CA A 37 SER C A 38 ASN N 1.0 -64.61 -24.61 PSI 5 5 A 37 SER C A 38 ASN N A 38 ASN CA A 38 ASN C 1.0 -82.63 -42.63 PHI 6 6 A 38 ASN N A 38 ASN CA A 38 ASN C A 39 MET N 1.0 -62.45 -22.45 PSI 7 7 A 38 ASN C A 39 MET N A 39 MET CA A 39 MET C 1.0 -84.83 -44.83 PHI 8 8 A 39 MET N A 39 MET CA A 39 MET C A 40 LEU N 1.0 -61.49 -21.49 PSI 9 9 A 39 MET C A 40 LEU N A 40 LEU CA A 40 LEU C 1.0 -85.35 -45.35 PHI 10 10 A 40 LEU N A 40 LEU CA A 40 LEU C A 41 LYS N 1.0 -63.48 -23.48 PSI 11 11 A 40 LEU C A 41 LYS N A 41 LYS CA A 41 LYS C 1.0 -80.06 -40.06 PHI 12 12 A 41 LYS N A 41 LYS CA A 41 LYS C A 42 THR N 1.0 -64.88 -24.88 PSI 13 13 A 41 LYS C A 42 THR N A 42 THR CA A 42 THR C 1.0 -84.41 -44.41 PHI 14 14 A 42 THR N A 42 THR CA A 42 THR C A 43 TYR N 1.0 -55.28 -15.28 PSI 15 15 A 44 PHE C A 45 SER N A 45 SER CA A 45 SER C 1.0 -87.08 -47.08 PHI 16 16 A 45 SER N A 45 SER CA A 45 SER C A 46 ASP N 1.0 -42.88 -2.88 PSI 17 17 A 50 ASN C A 51 ARG N A 51 ARG CA A 51 ARG C 1.0 -89.99 -45.81 PHI 18 18 A 51 ARG N A 51 ARG CA A 51 ARG C A 52 CYS N 1.0 -59.03 -19.03 PSI 19 19 A 51 ARG C A 52 CYS N A 52 CYS CA A 52 CYS C 1.0 -90.00 -45.54 PHI 20 20 A 52 CYS N A 52 CYS CA A 52 CYS C A 53 ILE N 1.0 -62.53 -22.53 PSI 21 21 A 52 CYS C A 53 ILE N A 53 ILE CA A 53 ILE C 1.0 -90.00 -48.30 PHI 22 22 A 53 ILE N A 53 ILE CA A 53 ILE C A 54 THR N 1.0 -63.46 -23.46 PSI 23 23 A 53 ILE C A 54 THR N A 54 THR CA A 54 THR C 1.0 -90.00 -44.32 PHI 24 24 A 54 THR N A 54 THR CA A 54 THR C A 55 SER N 1.0 -62.55 -22.55 PSI 25 25 A 54 THR C A 55 SER N A 55 SER CA A 55 SER C 1.0 -89.99 -45.81 PHI 26 26 A 55 SER N A 55 SER CA A 55 SER C A 56 GLN N 1.0 -60.50 -20.50 PSI 27 27 A 55 SER C A 56 GLN N A 56 GLN CA A 56 GLN C 1.0 -90.00 -45.40 PHI 28 28 A 56 GLN N A 56 GLN CA A 56 GLN C A 57 LEU N 1.0 -58.05 -18.05 PSI 29 29 A 56 GLN C A 57 LEU N A 57 LEU CA A 57 LEU C 1.0 -93.37 -45.37 PHI 30 30 A 57 LEU N A 57 LEU CA A 57 LEU C A 58 ILE N 1.0 -60.26 -20.00 PSI 31 31 A 58 ILE C A 59 LYS N A 59 LYS CA A 59 LYS C 1.0 -92.34 -45.34 PHI 32 32 A 59 LYS N A 59 LYS CA A 59 LYS C A 60 TRP N 1.0 -57.27 -17.27 PSI 33 33 A 59 LYS C A 60 TRP N A 60 TRP CA A 60 TRP C 1.0 -90.00 -45.88 PHI 34 34 A 60 TRP N A 60 TRP CA A 60 TRP C A 61 PHE N 1.0 -57.19 -17.19 PSI 35 35 A 62 SER C A 63 ASN N A 63 ASN CA A 63 ASN C 1.0 -89.62 -49.62 PHI 36 36 A 63 ASN N A 63 ASN CA A 63 ASN C A 64 PHE N 1.0 -64.17 -20.17 PSI 37 37 A 63 ASN C A 64 PHE N A 64 PHE CA A 64 PHE C 1.0 -90.00 -45.16 PHI 38 38 A 64 PHE N A 64 PHE CA A 64 PHE C A 65 ARG N 1.0 -69.67 -20.33 PSI 39 39 A 65 ARG C A 66 GLU N A 66 GLU CA A 66 GLU C 1.0 -90.01 -44.07 PHI 40 40 A 66 GLU N A 66 GLU CA A 66 GLU C A 67 PHE N 1.0 -62.13 -22.13 PSI 41 41 A 67 PHE C A 68 TYR N A 68 TYR CA A 68 TYR C 1.0 -90.00 -42.72 PHI 42 42 A 68 TYR N A 68 TYR CA A 68 TYR C A 69 TYR N 1.0 -60.09 -26.09 PSI 43 43 A 68 TYR C A 69 TYR N A 69 TYR CA A 69 TYR C 1.0 -90.00 -42.62 PHI 44 44 A 69 TYR N A 69 TYR CA A 69 TYR C A 70 ILE N 1.0 -58.79 -18.79 PSI 45 45 A 69 TYR C A 70 ILE N A 70 ILE CA A 70 ILE C 1.0 -90.00 -47.22 PHI 46 46 A 70 ILE N A 70 ILE CA A 70 ILE C A 71 GLN N 1.0 -59.87 -19.87 PSI 47 47 A 70 ILE C A 71 GLN N A 71 GLN CA A 71 GLN C 1.0 -90.00 -43.98 PHI 48 48 A 71 GLN N A 71 GLN CA A 71 GLN C A 72 MET N 1.0 -54.98 -20.98 PSI 49 49 A 71 GLN C A 72 MET N A 72 MET CA A 72 MET C 1.0 -89.60 -45.60 PHI 50 50 A 72 MET N A 72 MET CA A 72 MET C A 73 GLU N 1.0 -60.41 -20.41 PSI 51 51 A 72 MET C A 73 GLU N A 73 GLU CA A 73 GLU C 1.0 -90.00 -45.80 PHI 52 52 A 73 GLU N A 73 GLU CA A 73 GLU C A 74 LYS N 1.0 -62.70 -22.70 PSI 53 53 A 73 GLU C A 74 LYS N A 74 LYS CA A 74 LYS C 1.0 -90.01 -42.91 PHI 54 54 A 74 LYS N A 74 LYS CA A 74 LYS C A 75 TYR N 1.0 -61.60 -21.60 PSI 55 55 A 74 LYS C A 75 TYR N A 75 TYR CA A 75 TYR C 1.0 -82.54 -42.54 PHI 56 56 A 75 TYR N A 75 TYR CA A 75 TYR C A 76 ALA N 1.0 -61.14 -21.14 PSI 57 57 A 75 TYR C A 76 ALA N A 76 ALA CA A 76 ALA C 1.0 -80.80 -45.80 PHI 58 58 A 76 ALA N A 76 ALA CA A 76 ALA C A 77 ARG N 1.0 -65.03 -20.03 PSI 59 59 A 76 ALA C A 77 ARG N A 77 ARG CA A 77 ARG C 1.0 -84.17 -44.17 PHI 60 60 A 77 ARG N A 77 ARG CA A 77 ARG C A 78 GLN N 1.0 -60.38 -20.38 PSI 61 61 A 77 ARG C A 78 GLN N A 78 GLN CA A 78 GLN C 1.0 -84.71 -44.71 PHI 62 62 A 78 GLN N A 78 GLN CA A 78 GLN C A 79 ALA N 1.0 -63.92 -23.92 PSI 63 63 A 78 GLN C A 79 ALA N A 79 ALA CA A 79 ALA C 1.0 -90.00 -40.00 PHI 64 64 A 79 ALA N A 79 ALA CA A 79 ALA C A 80 ILE N 1.0 -63.59 -23.59 PSI 65 65 A 79 ALA C A 80 ILE N A 80 ILE CA A 80 ILE C 1.0 -89.99 -43.09 PHI 66 66 A 80 ILE N A 80 ILE CA A 80 ILE C A 81 ASN N 1.0 -64.58 -24.58 PSI 67 67 A 80 ILE C A 81 ASN N A 81 ASN CA A 81 ASN C 1.0 -85.12 -45.12 PHI 68 68 A 81 ASN N A 81 ASN CA A 81 ASN C A 82 ASP N 1.0 -60.14 -20.14 PSI 69 69 A 81 ASN C A 82 ASP N A 82 ASP CA A 82 ASP C 1.0 -101.36 -61.36 PHI 70 70 A 82 ASP N A 82 ASP CA A 82 ASP C A 83 GLY N 1.0 -26.29 13.71 PSI 71 71 A 85 THR C A 86 SER N A 86 SER CA A 86 SER C 1.0 -141.50 -101.50 PHI 72 72 A 86 SER N A 86 SER CA A 86 SER C A 87 THR N 1.0 107.95 147.95 PSI 73 73 A 86 SER C A 87 THR N A 87 THR CA A 87 THR C 1.0 -77.67 -37.67 PHI 74 74 A 87 THR N A 87 THR CA A 87 THR C A 88 GLU N 1.0 -48.35 -8.35 PSI 75 75 A 87 THR C A 88 GLU N A 88 GLU CA A 88 GLU C 1.0 -88.48 -48.48 PHI 76 76 A 88 GLU N A 88 GLU CA A 88 GLU C A 89 GLU N 1.0 -39.41 0.57 PSI 77 77 A 96 CYS C A 97 GLU N A 97 GLU CA A 97 GLU C 1.0 -91.33 -41.33 PHI 78 78 A 97 GLU N A 97 GLU CA A 97 GLU C A 98 LEU N 1.0 -56.36 -20.36 PSI 79 79 A 97 GLU C A 98 LEU N A 98 LEU CA A 98 LEU C 1.0 -93.04 -43.04 PHI 80 80 A 98 LEU N A 98 LEU CA A 98 LEU C A 99 TYR N 1.0 -65.08 -25.08 PSI 81 81 A 98 LEU C A 99 TYR N A 99 TYR CA A 99 TYR C 1.0 -91.35 -41.35 PHI 82 82 A 99 TYR N A 99 TYR CA A 99 TYR C A 100 ARG N 1.0 -64.24 -24.24 PSI 83 83 A 99 TYR C A 100 ARG N A 100 ARG CA A 100 ARG C 1.0 -82.80 -42.80 PHI 84 84 A 100 ARG N A 100 ARG CA A 100 ARG C A 101 ALA N 1.0 -61.00 -21.00 PSI 85 85 A 100 ARG C A 101 ALA N A 101 ALA CA A 101 ALA C 1.0 -83.00 -43.00 PHI 86 86 A 101 ALA N A 101 ALA CA A 101 ALA C A 102 LEU N 1.0 -62.35 -22.35 PSI 87 87 A 101 ALA C A 102 LEU N A 102 LEU CA A 102 LEU C 1.0 -86.58 -46.58 PHI 88 88 A 102 LEU N A 102 LEU CA A 102 LEU C A 103 ASN N 1.0 -59.73 -19.73 PSI 89 89 A 102 LEU C A 103 ASN N A 103 ASN CA A 103 ASN C 1.0 -89.49 -40.49 PHI 90 90 A 103 ASN N A 103 ASN CA A 103 ASN C A 104 MET N 1.0 -62.88 -22.88 PSI 91 91 A 103 ASN C A 104 MET N A 104 MET CA A 104 MET C 1.0 -83.08 -43.08 PHI 92 92 A 104 MET N A 104 MET CA A 104 MET C A 105 HIS N 1.0 -52.68 -22.68 PSI 93 93 A 104 MET C A 105 HIS N A 105 HIS CA A 105 HIS C 1.0 -89.54 -49.54 PHI 94 94 A 105 HIS N A 105 HIS CA A 105 HIS C A 106 TYR N 1.0 -53.79 -13.79 PSI 95 95 A 105 HIS C A 106 TYR N A 106 TYR CA A 106 TYR C 1.0 -90.80 -45.80 PHI 96 96 A 106 TYR N A 106 TYR CA A 106 TYR C A 107 ASN N 1.0 -60.84 -20.16 PSI 97 97 A 115 PRO C A 116 GLU N A 116 GLU CA A 116 GLU C 1.0 -90.41 -40.41 PHI 98 98 A 116 GLU N A 116 GLU CA A 116 GLU C A 117 ARG N 1.0 -60.86 -20.86 PSI 99 99 A 116 GLU C A 117 ARG N A 117 ARG CA A 117 ARG C 1.0 -85.08 -45.08 PHI 100 100 A 117 ARG N A 117 ARG CA A 117 ARG C A 118 PHE N 1.0 -60.99 -20.99 PSI 101 101 A 117 ARG C A 118 PHE N A 118 PHE CA A 118 PHE C 1.0 -83.90 -43.90 PHI 102 102 A 118 PHE N A 118 PHE CA A 118 PHE C A 119 LEU N 1.0 -61.78 -21.78 PSI 103 103 A 118 PHE C A 119 LEU N A 119 LEU CA A 119 LEU C 1.0 -83.74 -43.74 PHI 104 104 A 119 LEU N A 119 LEU CA A 119 LEU C A 120 GLU N 1.0 -64.08 -20.08 PSI 105 105 A 119 LEU C A 120 GLU N A 120 GLU CA A 120 GLU C 1.0 -84.67 -44.67 PHI 106 106 A 120 GLU N A 120 GLU CA A 120 GLU C A 121 VAL N 1.0 -60.81 -20.81 PSI 107 107 A 120 GLU C A 121 VAL N A 121 VAL CA A 121 VAL C 1.0 -85.25 -45.25 PHI 108 108 A 121 VAL N A 121 VAL CA A 121 VAL C A 122 ALA N 1.0 -60.96 -20.96 PSI 109 109 A 121 VAL C A 122 ALA N A 122 ALA CA A 122 ALA C 1.0 -86.51 -46.51 PHI 110 110 A 122 ALA N A 122 ALA CA A 122 ALA C A 123 GLN N 1.0 -61.12 -21.12 PSI 111 111 A 122 ALA C A 123 GLN N A 123 GLN CA A 123 GLN C 1.0 -86.45 -43.45 PHI 112 112 A 123 GLN N A 123 GLN CA A 123 GLN C A 124 ILE N 1.0 -62.39 -22.39 PSI 113 113 A 123 GLN C A 124 ILE N A 124 ILE CA A 124 ILE C 1.0 -87.27 -40.27 PHI 114 114 A 124 ILE N A 124 ILE CA A 124 ILE C A 125 THR N 1.0 -60.21 -20.21 PSI 115 115 A 124 ILE C A 125 THR N A 125 THR CA A 125 THR C 1.0 -87.50 -43.50 PHI 116 116 A 125 THR N A 125 THR CA A 125 THR C A 126 LEU N 1.0 -59.07 -19.07 PSI 117 117 A 125 THR C A 126 LEU N A 126 LEU CA A 126 LEU C 1.0 -87.44 -42.44 PHI 118 118 A 126 LEU N A 126 LEU CA A 126 LEU C A 127 ARG N 1.0 -65.18 -20.18 PSI 119 119 A 126 LEU C A 127 ARG N A 127 ARG CA A 127 ARG C 1.0 -88.09 -39.09 PHI 120 120 A 127 ARG N A 127 ARG CA A 127 ARG C A 128 GLU N 1.0 -62.37 -22.37 PSI 121 121 A 127 ARG C A 128 GLU N A 128 GLU CA A 128 GLU C 1.0 -88.09 -44.09 PHI 122 122 A 128 GLU N A 128 GLU CA A 128 GLU C A 129 PHE N 1.0 -62.61 -22.61 PSI 123 123 A 128 GLU C A 129 PHE N A 129 PHE CA A 129 PHE C 1.0 -88.91 -45.91 PHI 124 124 A 129 PHE N A 129 PHE CA A 129 PHE C A 130 PHE N 1.0 -62.15 -22.15 PSI 125 125 A 129 PHE C A 130 PHE N A 130 PHE CA A 130 PHE C 1.0 -88.79 -42.79 PHI 126 126 A 130 PHE N A 130 PHE CA A 130 PHE C A 131 ASN N 1.0 -60.87 -20.87 PSI 127 127 A 130 PHE C A 131 ASN N A 131 ASN CA A 131 ASN C 1.0 -88.70 -41.70 PHI 128 128 A 131 ASN N A 131 ASN CA A 131 ASN C A 132 ALA N 1.0 -60.23 -20.23 PSI 129 129 A 131 ASN C A 132 ALA N A 132 ALA CA A 132 ALA C 1.0 -88.05 -46.05 PHI 130 130 A 132 ALA N A 132 ALA CA A 132 ALA C A 133 ILE N 1.0 -60.58 -20.58 PSI 131 131 A 132 ALA C A 133 ILE N A 133 ILE CA A 133 ILE C 1.0 -88.77 -44.77 PHI 132 132 A 133 ILE N A 133 ILE CA A 133 ILE C A 134 ILE N 1.0 -61.23 -21.23 PSI 133 133 A 133 ILE C A 134 ILE N A 134 ILE CA A 134 ILE C 1.0 -88.03 -44.03 PHI 134 134 A 134 ILE N A 134 ILE CA A 134 ILE C A 135 ALA N 1.0 -60.41 -20.41 PSI 135 135 A 141 PRO C A 142 SER N A 142 SER CA A 142 SER C 1.0 -92.45 -52.45 PHI 136 136 A 142 SER N A 142 SER CA A 142 SER C A 143 TRP N 1.0 -54.48 -14.48 PSI 137 137 A 142 SER C A 143 TRP N A 143 TRP CA A 143 TRP C 1.0 -85.96 -45.96 PHI 138 138 A 143 TRP N A 143 TRP CA A 143 TRP C A 144 LYS N 1.0 -55.12 -15.12 PSI 139 139 A 143 TRP C A 144 LYS N A 144 LYS CA A 144 LYS C 1.0 -83.31 -43.31 PHI 140 140 A 144 LYS N A 144 LYS CA A 144 LYS C A 145 LYS N 1.0 -62.83 -22.83 PSI 141 141 A 144 LYS C A 145 LYS N A 145 LYS CA A 145 LYS C 1.0 -92.43 -42.43 PHI 142 142 A 145 LYS N A 145 LYS CA A 145 LYS C A 146 ALA N 1.0 -63.00 -23.00 PSI 143 143 A 145 LYS C A 146 ALA N A 146 ALA CA A 146 ALA C 1.0 -92.39 -42.39 PHI 144 144 A 146 ALA N A 146 ALA CA A 146 ALA C A 147 ILE N 1.0 -61.90 -21.90 PSI 145 145 A 146 ALA C A 147 ILE N A 147 ILE CA A 147 ILE C 1.0 -91.36 -41.36 PHI 146 146 A 147 ILE N A 147 ILE CA A 147 ILE C A 148 TYR N 1.0 -66.54 -26.54 PSI 147 147 A 147 ILE C A 148 TYR N A 148 TYR CA A 148 TYR C 1.0 -90.78 -50.78 PHI 148 148 A 148 TYR N A 148 TYR CA A 148 TYR C A 149 LYS N 1.0 -52.02 -12.02 PSI 149 149 A 148 TYR C A 149 LYS N A 149 LYS CA A 149 LYS C 1.0 -92.08 -42.08 PHI 150 150 A 149 LYS N A 149 LYS CA A 149 LYS C A 150 VAL N 1.0 -63.01 -23.01 PSI 151 151 A 149 LYS C A 150 VAL N A 150 VAL CA A 150 VAL C 1.0 -94.68 -44.68 PHI 152 152 A 150 VAL N A 150 VAL CA A 150 VAL C A 151 ILE N 1.0 -62.34 -22.34 PSI 153 153 A 161 ILE C A 162 PHE N A 162 PHE CA A 162 PHE C 1.0 -88.71 -48.71 PHI 154 154 A 162 PHE N A 162 PHE CA A 162 PHE C A 163 LYS N 1.0 -58.32 -18.32 PSI 155 155 A 162 PHE C A 163 LYS N A 163 LYS CA A 163 LYS C 1.0 -93.80 -53.80 PHI 156 156 A 163 LYS N A 163 LYS CA A 163 LYS C A 164 SER N 1.0 -44.34 -20.34 PSI 157 157 A 167 CYS C A 168 LEU N A 168 LEU CA A 168 LEU C 1.0 -84.05 -44.05 PHI 158 158 A 168 LEU N A 168 LEU CA A 168 LEU C A 169 GLN N 1.0 -53.91 -13.91 PSI 159 159 A 168 LEU C A 169 GLN N A 169 GLN CA A 169 GLN C 1.0 -87.04 -47.04 PHI 160 160 A 169 GLN N A 169 GLN CA A 169 GLN C A 170 GLU N 1.0 -57.79 -17.79 PSI 161 161 A 169 GLN C A 170 GLU N A 170 GLU CA A 170 GLU C 1.0 -96.11 -56.11 PHI 162 162 A 170 GLU N A 170 GLU CA A 170 GLU C A 171 LEU N 1.0 -51.75 -11.75 PSI 163 163 A 171 LEU C A 172 LEU N A 172 LEU CA A 172 LEU C 1.0 -114.03 -74.03 PHI 164 164 A 172 LEU N A 172 LEU CA A 172 LEU C A 173 HIS N 1.0 67.39 107.39 PSI stop_ save_ save_CNS/XPLOR_dipolar_coupling_5 _nef_rdc_restraint_list.sf_category nef_rdc_restraint_list _nef_rdc_restraint_list.sf_framecode CNS/XPLOR_dipolar_coupling_5 _nef_rdc_restraint_list.potential_type parabolic _nef_rdc_restraint_list.restraint_origin . loop_ _nef_rdc_restraint.index _nef_rdc_restraint.restraint_id _nef_rdc_restraint.chain_code_1 _nef_rdc_restraint.sequence_code_1 _nef_rdc_restraint.residue_name_1 _nef_rdc_restraint.atom_name_1 _nef_rdc_restraint.chain_code_2 _nef_rdc_restraint.sequence_code_2 _nef_rdc_restraint.residue_name_2 _nef_rdc_restraint.atom_name_2 _nef_rdc_restraint.weight _nef_rdc_restraint.lower_limit _nef_rdc_restraint.upper_limit _nef_rdc_restraint.scale 1 1 A 12 ALA N A 12 ALA H 1.0 . . . 2 2 A 13 MET N A 13 MET H 1.0 . . . 3 3 A 17 LEU N A 17 LEU H 1.0 . . . 4 4 A 32 THR N A 32 THR H 1.0 . . . 5 5 A 34 TYR N A 34 TYR H 1.0 . . . 6 6 A 36 SER N A 36 SER H 1.0 . . . 7 7 A 39 MET N A 39 MET H 1.0 . . . 8 8 A 40 LEU N A 40 LEU H 1.0 . . . 9 9 A 44 PHE N A 44 PHE H 1.0 . . . 10 10 A 45 SER N A 45 SER H 1.0 . . . 11 11 A 46 ASP N A 46 ASP H 1.0 . . . 12 12 A 48 LYS N A 48 LYS H 1.0 . . . 13 13 A 49 PHE N A 49 PHE H 1.0 . . . 14 14 A 58 ILE N A 58 ILE H 1.0 . . . 15 15 A 61 PHE N A 61 PHE H 1.0 . . . 16 16 A 62 SER N A 62 SER H 1.0 . . . 17 17 A 65 ARG N A 65 ARG H 1.0 . . . 18 18 A 68 TYR N A 68 TYR H 1.0 . . . 19 19 A 69 TYR N A 69 TYR H 1.0 . . . 20 20 A 70 ILE N A 70 ILE H 1.0 . . . 21 21 A 71 GLN N A 71 GLN H 1.0 . . . 22 22 A 72 MET N A 72 MET H 1.0 . . . 23 23 A 73 GLU N A 73 GLU H 1.0 . . . 24 24 A 74 LYS N A 74 LYS H 1.0 . . . 25 25 A 75 TYR N A 75 TYR H 1.0 . . . 26 26 A 76 ALA N A 76 ALA H 1.0 . . . 27 27 A 77 ARG N A 77 ARG H 1.0 . . . 28 28 A 78 GLN N A 78 GLN H 1.0 . . . 29 29 A 80 ILE N A 80 ILE H 1.0 . . . 30 30 A 81 ASN N A 81 ASN H 1.0 . . . 31 31 A 82 ASP N A 82 ASP H 1.0 . . . 32 32 A 83 GLY N A 83 GLY H 1.0 . . . 33 33 A 84 VAL N A 84 VAL H 1.0 . . . 34 34 A 85 THR N A 85 THR H 1.0 . . . 35 35 A 86 SER N A 86 SER H 1.0 . . . 36 36 A 89 GLU N A 89 GLU H 1.0 . . . 37 37 A 90 LEU N A 90 LEU H 1.0 . . . 38 38 A 91 SER N A 91 SER H 1.0 . . . 39 39 A 94 ARG N A 94 ARG H 1.0 . . . 40 40 A 97 GLU N A 97 GLU H 1.0 . . . 41 41 A 99 TYR N A 99 TYR H 1.0 . . . 42 42 A 100 ARG N A 100 ARG H 1.0 . . . 43 43 A 101 ALA N A 101 ALA H 1.0 . . . 44 44 A 102 LEU N A 102 LEU H 1.0 . . . 45 45 A 104 MET N A 104 MET H 1.0 . . . 46 46 A 105 HIS N A 105 HIS H 1.0 . . . 47 47 A 107 ASN N A 107 ASN H 1.0 . . . 48 48 A 108 LYS N A 108 LYS H 1.0 . . . 49 49 A 109 ALA N A 109 ALA H 1.0 . . . 50 50 A 110 ASN N A 110 ASN H 1.0 . . . 51 51 A 111 ASP N A 111 ASP H 1.0 . . . 52 52 A 113 GLU N A 113 GLU H 1.0 . . . 53 53 A 114 VAL N A 114 VAL H 1.0 . . . 54 54 A 116 GLU N A 116 GLU H 1.0 . . . 55 55 A 117 ARG N A 117 ARG H 1.0 . . . 56 56 A 119 LEU N A 119 LEU H 1.0 . . . 57 57 A 120 GLU N A 120 GLU H 1.0 . . . 58 58 A 122 ALA N A 122 ALA H 1.0 . . . 59 59 A 123 GLN N A 123 GLN H 1.0 . . . 60 60 A 124 ILE N A 124 ILE H 1.0 . . . 61 61 A 125 THR N A 125 THR H 1.0 . . . 62 62 A 126 LEU N A 126 LEU H 1.0 . . . 63 63 A 127 ARG N A 127 ARG H 1.0 . . . 64 64 A 128 GLU N A 128 GLU H 1.0 . . . 65 65 A 129 PHE N A 129 PHE H 1.0 . . . 66 66 A 131 ASN N A 131 ASN H 1.0 . . . 67 67 A 132 ALA N A 132 ALA H 1.0 . . . 68 68 A 133 ILE N A 133 ILE H 1.0 . . . 69 69 A 134 ILE N A 134 ILE H 1.0 . . . 70 70 A 135 ALA N A 135 ALA H 1.0 . . . 71 71 A 136 GLY N A 136 GLY H 1.0 . . . 72 72 A 137 LYS N A 137 LYS H 1.0 . . . 73 73 A 138 ASP N A 138 ASP H 1.0 . . . 74 74 A 139 VAL N A 139 VAL H 1.0 . . . 75 75 A 140 ASP N A 140 ASP H 1.0 . . . 76 76 A 142 SER N A 142 SER H 1.0 . . . 77 77 A 143 TRP N A 143 TRP H 1.0 . . . 78 78 A 144 LYS N A 144 LYS H 1.0 . . . 79 79 A 145 LYS N A 145 LYS H 1.0 . . . 80 80 A 146 ALA N A 146 ALA H 1.0 . . . 81 81 A 147 ILE N A 147 ILE H 1.0 . . . 82 82 A 148 TYR N A 148 TYR H 1.0 . . . 83 83 A 149 LYS N A 149 LYS H 1.0 . . . 84 84 A 150 VAL N A 150 VAL H 1.0 . . . 85 85 A 153 LYS N A 153 LYS H 1.0 . . . 86 86 A 155 ASP N A 155 ASP H 1.0 . . . 87 87 A 156 SER N A 156 SER H 1.0 . . . 88 88 A 157 GLU N A 157 GLU H 1.0 . . . 89 89 A 158 VAL N A 158 VAL H 1.0 . . . 90 90 A 160 GLU N A 160 GLU H 1.0 . . . 91 91 A 163 LYS N A 163 LYS H 1.0 . . . 92 92 A 166 ASN N A 166 ASN H 1.0 . . . 93 93 A 167 CYS N A 167 CYS H 1.0 . . . 94 94 A 168 LEU N A 168 LEU H 1.0 . . . 95 95 A 169 GLN N A 169 GLN H 1.0 . . . 96 96 A 172 LEU N A 172 LEU H 1.0 . . . 97 97 A 173 HIS N A 173 HIS H 1.0 . . . stop_ save_