data_nef_c16248_2kfu save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 21 THR C 1 22 TPO N 1 22 TPO C 1 23 SER N stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 VAL start . . 2 A 2 THR middle . . 3 A 3 ASP middle . . 4 A 4 MET middle . . 5 A 5 ASN middle . . 6 A 6 PRO middle . false 7 A 7 ASP middle . . 8 A 8 ILE middle . . 9 A 9 GLU middle . . 10 A 10 LYS middle . . 11 A 11 ASP middle . . 12 A 12 GLN middle . . 13 A 13 THR middle . . 14 A 14 SER middle . . 15 A 15 ASP middle . . 16 A 16 GLU middle . . 17 A 17 VAL middle . . 18 A 18 THR middle . . 19 A 19 VAL middle . . 20 A 20 GLU middle . . 21 A 21 THR middle -OXT . 22 A 22 TPO middle -H2,-OXT . 23 A 23 SER middle -H2 . 24 A 24 VAL middle . . 25 A 25 PHE middle . . 26 A 26 ARG middle . . 27 A 27 ALA middle . . 28 A 28 ASP middle . . 29 A 29 PHE middle . . 30 A 30 LEU middle . . 31 A 31 SER middle . . 32 A 32 GLU middle . . 33 A 33 LEU middle . . 34 A 34 ASP middle . . 35 A 35 ALA middle . . 36 A 36 PRO middle . false 37 A 37 ALA middle . . 38 A 38 GLN middle . . 39 A 39 ALA middle . . 40 A 40 GLY middle . false 41 A 41 THR middle . . 42 A 42 GLU middle . . 43 A 43 SER middle . . 44 A 44 ALA middle . . 45 A 45 VAL middle . . 46 A 46 SER middle . . 47 A 47 GLY middle . false 48 A 48 VAL middle . . 49 A 49 GLU middle . . 50 A 50 GLY middle . false 51 A 51 LEU middle . . 52 A 52 PRO middle . false 53 A 53 PRO middle . false 54 A 54 GLY middle . false 55 A 55 SER middle . . 56 A 56 ALA middle . . 57 A 57 LEU middle . . 58 A 58 LEU middle . . 59 A 59 VAL middle . . 60 A 60 VAL middle . . 61 A 61 LYS middle . . 62 A 62 ARG middle . . 63 A 63 GLY middle . false 64 A 64 PRO middle . false 65 A 65 ASN middle . . 66 A 66 ALA middle . . 67 A 67 GLY middle . false 68 A 68 SER middle . . 69 A 69 ARG middle . . 70 A 70 PHE middle . . 71 A 71 LEU middle . . 72 A 72 LEU middle . . 73 A 73 ASP middle . . 74 A 74 GLN middle . . 75 A 75 ALA middle . . 76 A 76 ILE middle . . 77 A 77 THR middle . . 78 A 78 SER middle . . 79 A 79 ALA middle . . 80 A 80 GLY middle . false 81 A 81 ARG middle . . 82 A 82 HIS middle . . 83 A 83 PRO middle . false 84 A 84 ASP middle . . 85 A 85 SER middle . . 86 A 86 ASP middle . . 87 A 87 ILE middle . . 88 A 88 PHE middle . . 89 A 89 LEU middle . . 90 A 90 ASP middle . . 91 A 91 ASP middle . . 92 A 92 VAL middle . . 93 A 93 THR middle . . 94 A 94 VAL middle . . 95 A 95 SER middle . . 96 A 96 ARG middle . . 97 A 97 ARG middle . . 98 A 98 HIS middle . . 99 A 99 ALA middle . . 100 A 100 GLU middle . . 101 A 101 PHE middle . . 102 A 102 ARG middle . . 103 A 103 LEU middle . . 104 A 104 GLU middle . . 105 A 105 ASN middle . . 106 A 106 ASN middle . . 107 A 107 GLU middle . . 108 A 108 PHE middle . . 109 A 109 ASN middle . . 110 A 110 VAL middle . . 111 A 111 VAL middle . . 112 A 112 ASP middle . . 113 A 113 VAL middle . . 114 A 114 GLY middle . false 115 A 115 SER middle . . 116 A 116 LEU middle . . 117 A 117 ASN middle . . 118 A 118 GLY middle . false 119 A 119 THR middle . . 120 A 120 TYR middle . . 121 A 121 VAL middle . . 122 A 122 ASN middle . . 123 A 123 ARG middle . . 124 A 124 GLU middle . . 125 A 125 PRO middle . false 126 A 126 VAL middle . . 127 A 127 ASP middle . . 128 A 128 SER middle . . 129 A 129 ALA middle . . 130 A 130 VAL middle . . 131 A 131 LEU middle . . 132 A 132 ALA middle . . 133 A 133 ASN middle . . 134 A 134 GLY middle . false 135 A 135 ASP middle . . 136 A 136 GLU middle . . 137 A 137 VAL middle . . 138 A 138 GLN middle . . 139 A 139 ILE middle . . 140 A 140 GLY middle . false 141 A 141 LYS middle . . 142 A 142 PHE middle . . 143 A 143 ARG middle . . 144 A 144 LEU middle . . 145 A 145 VAL middle . . 146 A 146 PHE middle . . 147 A 147 LEU middle . . 148 A 148 THR middle . . 149 A 149 GLY middle . false 150 A 150 PRO middle . false 151 A 151 LYS middle . . 152 A 152 GLN middle . . 153 A 153 GLY middle . false 154 A 154 GLU middle . . 155 A 155 ASP middle . . 156 A 156 ASP middle . . 157 A 157 GLY middle . false 158 A 158 SER middle . . 159 A 159 THR middle . . 160 A 160 GLY middle . false 161 A 161 GLY middle . false 162 A 162 PRO end . false stop_ save_ save_chemical_shift_set _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode chemical_shift_set 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 1 VAL H1 H 1 8.226 0.0 A 1 VAL HA H 1 4.14 0.0 A 1 VAL HB H 1 2.018 0.0 A 1 VAL HGx% H 1 0.83 0.0 A 1 VAL HGy% H 1 0.83 0.0 A 1 VAL C C 13 176.479 0.0 A 1 VAL CA C 13 61.696 0.0 A 1 VAL CB C 13 32.447 0.0 A 1 VAL CGx C 13 21.476 0.0 A 1 VAL CGy C 13 21.476 0.0 A 1 VAL N N 15 121.661 0.0 A 2 THR H H 1 8.096 0.0 A 2 THR HA H 1 4.319 0.0 A 2 THR HB H 1 4.206 0.0 A 2 THR HG2% H 1 1.128 0.0 A 2 PRO C C 13 176.982 0.0 A 2 THR CA C 13 61.696 0.0 A 2 THR CB C 13 69.572 0.0 A 2 THR CG2 C 13 21.476 0.0 A 2 THR N N 15 116.618 0.0 A 3 LEU H H 1 8.482 0.0 A 3 ASP HA H 1 4.537 0.0 A 3 ASP HBy H 1 2.671 0.0 A 3 ASP HBx H 1 2.523 0.0 A 3 LEU C C 13 177.883 0.0 A 3 ASP CA C 13 54.101 0.0 A 3 ASP CB C 13 41.167 0.0 A 3 LEU N N 15 122.457 0.0 A 4 GLY H H 1 8.364 0.0 A 4 GLY HAx H 1 3.944 0.0 A 4 GLY HAy H 1 3.944 0.0 A 4 GLY C C 13 174.027 0.0 A 4 GLY CA C 13 45.106 0.0 A 4 GLY N N 15 110.018 0.0 A 5 SER H H 1 8.134 0.0 A 5 SER HA H 1 4.473 0.0 A 5 SER HBx H 1 3.814 0.0 A 5 SER HBy H 1 3.804 0.0 A 5 SER C C 13 174.818 0.0 A 5 SER CA C 13 58.039 0.0 A 5 SER CB C 13 63.665 0.0 A 5 SER N N 15 115.73 0.0 A 7 ASP H H 1 8.164 0.0 A 7 ASP HA H 1 4.58 0.0 A 7 ASP HBy H 1 2.667 0.0 A 7 ASP HBx H 1 2.612 0.0 A 7 ASP CA C 13 54.510 0.0 A 7 ASP CB C 13 41.167 0.0 A 7 ASP N N 15 122.7 0.0 A 8 ILE H H 1 7.721 0.0 A 8 ILE HA H 1 4.1 0.0 A 8 ILE HB H 1 1.833 0.0 A 8 ILE HD1% H 1 0.856 0.0 A 8 ILE HG1y H 1 1.377 0.0 A 8 ILE HG1x H 1 1.163 0.0 A 8 ILE HG2% H 1 0.856 0.0 A 8 ILE C C 13 176.251 0.0 A 8 ILE CA C 13 61.415 0.0 A 8 ILE CB C 13 38.749 0.0 A 8 ILE CD1 C 13 17.644 0.0 A 8 ILE CG1 C 13 27.024 0.0 A 8 ILE CG2 C 13 13.037 0.0 A 8 ILE N N 15 120.029 0.0 A 9 GLU H H 1 8.311 0.0 A 9 GLU HA H 1 4.238 0.0 A 9 GLU HBy H 1 1.987 0.0 A 9 GLU HBx H 1 1.937 0.0 A 9 GLU HGx H 1 2.205 0.0 A 9 GLU HGy H 1 2.205 0.0 A 9 GLU C C 13 176.203 0.0 A 9 GLU CA C 13 56.351 0.0 A 9 GLU CB C 13 29.955 0.0 A 9 GLU CG C 13 36.104 0.0 A 9 GLU N N 15 124.266 0.0 A 10 LYS H H 1 8.149 0.0 A 10 LYS HBy H 1 1.785 0.0 A 10 LYS HBx H 1 1.706 0.0 A 10 LYS HDx H 1 1.658 0.0 A 10 LYS HDy H 1 1.658 0.0 A 10 LYS HEx H 1 3.009 0.0 A 10 LYS HEy H 1 3.009 0.0 A 10 LYS HGy H 1 1.5 0.0 A 10 LYS HGx H 1 1.451 0.0 A 10 LYS C C 13 176.284 0.0 A 10 LYS CA C 13 56.329 0.0 A 10 LYS CB C 13 32.886 0.0 A 10 LYS CD C 13 29.072 0.0 A 10 LYS CE C 13 42.011 0.0 A 10 LYS CG C 13 24.852 0.0 A 10 LYS N N 15 122.307 0.0 A 11 ASP H H 1 8.319 0.0 A 11 ASP HA H 1 4.526 0.0 A 11 ASP HBx H 1 2.741 0.0 A 11 ASP HBy H 1 2.741 0.0 A 11 ASP C C 13 176.219 0.0 A 11 ASP CA C 13 54.382 0.0 A 11 ASP CB C 13 41.167 0.0 A 11 ASP N N 15 121.564 0.0 A 12 GLN H H 1 8.334 0.0 A 12 GLN HA H 1 4.383 0.0 A 12 GLN HBy H 1 2.128 0.0 A 12 GLN HBx H 1 1.94 0.0 A 12 GLN HGx H 1 2.328 0.0 A 12 GLN HGy H 1 2.328 0.0 A 12 GLN C C 13 176.284 0.0 A 12 GLN CA C 13 55.507 0.0 A 12 GLN CB C 13 29.353 0.0 A 12 GLN CG C 13 33.854 0.0 A 12 GLN N N 15 121.118 0.0 A 13 THR H H 1 8.263 0.0 A 13 THR HA H 1 4.362 0.0 A 13 THR HB H 1 4.266 0.0 A 13 THR HG2% H 1 1.149 0.0 A 13 THR C C 13 174.677 0.0 A 13 THR CA C 13 61.696 0.0 A 13 THR CB C 13 69.572 0.0 A 13 THR CG2 C 13 21.476 0.0 A 13 THR N N 15 115.284 0.0 A 14 SER H H 1 8.29 0.0 A 14 SER HA H 1 4.43 0.0 A 14 SER HBy H 1 3.891 0.0 A 14 SER HBx H 1 3.81 0.0 A 14 SER C C 13 174.877 0.0 A 14 SER CA C 13 58.039 0.0 A 14 SER CB C 13 63.665 0.0 A 14 SER N N 15 117.969 0.0 A 15 ASP H H 1 8.314 0.0 A 15 ASP HA H 1 4.594 0.0 A 15 ASP HBy H 1 2.676 0.0 A 15 ASP HBx H 1 2.589 0.0 A 15 ASP C C 13 176.176 0.0 A 15 ASP CA C 13 53.819 0.0 A 15 ASP CB C 13 40.886 0.0 A 15 ASP N N 15 122.693 0.0 A 16 GLU H H 1 8.227 0.0 A 16 GLU HA H 1 4.255 0.0 A 16 GLU HBy H 1 1.992 0.0 A 16 GLU HBx H 1 1.883 0.0 A 16 GLU HGy H 1 2.224 0.0 A 16 GLU HGx H 1 2.206 0.0 A 16 GLU C C 13 176.376 0.0 A 16 GLU CA C 13 56.351 0.0 A 16 GLU CB C 13 30.197 0.0 A 16 GLU CG C 13 36.104 0.0 A 16 GLU N N 15 121.056 0.0 A 17 VAL H H 1 8.15 0.0 A 17 VAL HA H 1 4.134 0.0 A 17 VAL HB H 1 1.996 0.0 A 17 VAL HGx% H 1 0.894 0.0 A 17 VAL HGy% H 1 0.894 0.0 A 17 VAL C C 13 176.316 0.0 A 17 VAL CA C 13 61.696 0.0 A 17 VAL CB C 13 33.01 0.0 A 17 VAL CGx C 13 21.476 0.0 A 17 VAL CGy C 13 21.476 0.0 A 17 VAL N N 15 121.837 0.0 A 18 THR H H 1 8.294 0.0 A 18 THR HA H 1 4.32 0.0 A 18 THR HB H 1 4.11 0.0 A 18 THR HG2% H 1 1.143 0.0 A 18 THR C C 13 174.311 0.0 A 18 THR CA C 13 61.696 0.0 A 18 THR CB C 13 69.572 0.0 A 18 THR CG2 C 13 21.476 0.0 A 18 THR N N 15 119.502 0.0 A 19 VAL H H 1 8.16 0.0 A 19 VAL HA H 1 4.127 0.0 A 19 VAL HB H 1 2.029 0.0 A 19 VAL HGx% H 1 0.885 0.0 A 19 VAL HGy% H 1 0.885 0.0 A 19 VAL C C 13 175.732 0.0 A 19 VAL CA C 13 61.696 0.0 A 19 VAL CB C 13 33.01 0.0 A 19 VAL CGx C 13 21.476 0.0 A 19 VAL CGy C 13 21.476 0.0 A 19 VAL N N 15 123.124 0.0 A 20 GLU H H 1 8.493 0.0 A 20 GLU C C 13 176.576 0.0 A 20 GLU N N 15 124.394 0.0 A 21 THR H H 1 8.042 0.0 A 21 THR HA H 1 4.062 0.0 A 21 THR HB H 1 4.038 0.0 A 21 THR HG2% H 1 1.337 0.0 A 21 THR C C 13 172.891 0.0 A 21 THR CA C 13 62.785 0.0 A 21 THR CB C 13 69.234 0.0 A 21 THR CG2 C 13 22.334 0.0 A 21 THR N N 15 117.718 0.0 A 22 TPO H H 1 9.772 0.0 A 22 TPO HA H 1 4.302 0.0 A 22 TPO HB H 1 4.25 0.0 A 22 TPO HG2% H 1 1.403 0.0 A 22 TPO C C 13 173.451 0.0 A 22 TPO CA C 13 63.371 0.0 A 22 TPO CB C 13 72.165 0.0 A 22 TPO CG2 C 13 21.747 0.0 A 22 TPO N N 15 124.552 0.0 A 23 SER H H 1 8.357 0.0 A 23 SER HA H 1 4.531 0.0 A 23 SER HBy H 1 3.605 0.0 A 23 SER HBx H 1 3.485 0.0 A 23 SER C C 13 174.068 0.0 A 23 SER CA C 13 57.509 0.0 A 23 SER CB C 13 65.13 0.0 A 23 SER N N 15 122.189 0.0 A 24 VAL H H 1 8.38 0.0 A 24 VAL HA H 1 4.191 0.0 A 24 VAL HB H 1 1.944 0.0 A 24 VAL HGx% H 1 1.052 0.0 A 24 VAL HGy% H 1 0.913 0.0 A 24 VAL C C 13 175.878 0.0 A 24 VAL CA C 13 63.371 0.0 A 24 VAL CB C 13 32.3 0.0 A 24 VAL CGy C 13 22.334 0.0 A 24 VAL CGx C 13 21.161 0.0 A 24 VAL N N 15 124.875 0.0 A 25 PHE H H 1 8.498 0.0 A 25 PHE HA H 1 4.567 0.0 A 25 PHE HBy H 1 3.056 0.0 A 25 PHE HBx H 1 2.75 0.0 A 25 PHE HDx H 1 7.021 0.0 A 25 PHE HDy H 1 7.021 0.0 A 25 PHE HEx H 1 6.889 0.0 A 25 PHE HEy H 1 6.889 0.0 A 25 PHE C C 13 172.997 0.0 A 25 PHE CA C 13 57.509 0.0 A 25 PHE CB C 13 42.266 0.0 A 25 PHE CDx C 13 131.745 0.0 A 25 PHE CDy C 13 131.745 0.0 A 25 PHE CEx C 13 132.307 0.0 A 25 PHE CEy C 13 132.307 0.0 A 25 PHE N N 15 126.984 0.0 A 26 ARG H H 1 7.815 0.0 A 26 ARG HA H 1 2.993 0.0 A 26 ARG HBy H 1 2.087 0.0 A 26 ARG HBx H 1 1.383 0.0 A 26 ARG HDy H 1 2.912 0.0 A 26 ARG HDx H 1 2.839 0.0 A 26 ARG HE H 1 7.153 0.0 A 26 ARG HGy H 1 1.215 0.0 A 26 ARG HGx H 1 0.882 0.0 A 26 ARG C C 13 174.198 0.0 A 26 ARG CA C 13 58.095 0.0 A 26 ARG CB C 13 26.77 0.0 A 26 ARG CD C 13 43.439 0.0 A 26 ARG CG C 13 27.61 0.0 A 26 ARG N N 15 127.844 0.0 A 26 ARG NE N 15 115.926 0.0 A 27 ALA H H 1 7.841 0.0 A 27 ALA HA H 1 3.479 0.0 A 27 ALA HB% H 1 0.574 0.0 A 27 ALA C C 13 176.52 0.0 A 27 ALA CA C 13 52.232 0.0 A 27 ALA CB C 13 18.23 0.0 A 27 ALA N N 15 126.56 0.0 A 28 ASP H H 1 7.924 0.0 A 28 ASP HA H 1 4.368 0.0 A 28 ASP HBy H 1 2.57 0.0 A 28 ASP HBx H 1 2.414 0.0 A 28 ASP C C 13 176.6 0.0 A 28 ASP CA C 13 52.819 0.0 A 28 ASP CB C 13 40.507 0.0 A 28 ASP N N 15 119.784 0.0 A 29 PHE H H 1 7.966 0.0 A 29 PHE HA H 1 4.418 0.0 A 29 PHE HBy H 1 3.092 0.0 A 29 PHE HBx H 1 2.81 0.0 A 29 PHE HDx H 1 6.996 0.0 A 29 PHE HDy H 1 6.996 0.0 A 29 PHE HEx H 1 6.909 0.0 A 29 PHE HEy H 1 6.909 0.0 A 29 PHE HZ H 1 6.454 0.0 A 29 PHE C C 13 176.535 0.0 A 29 PHE CA C 13 58.681 0.0 A 29 PHE CB C 13 38.749 0.0 A 29 PHE CDx C 13 131.745 0.0 A 29 PHE CDy C 13 131.745 0.0 A 29 PHE CEx C 13 131.745 0.0 A 29 PHE CEy C 13 131.745 0.0 A 29 PHE CZ C 13 129.164 0.0 A 29 PHE N N 15 121.013 0.0 A 30 LEU H H 1 7.954 0.0 A 30 LEU HA H 1 4.318 0.0 A 30 LEU HBy H 1 1.671 0.0 A 30 LEU HBx H 1 1.493 0.0 A 30 LEU HDx% H 1 0.89 0.0 A 30 LEU HDy% H 1 0.86 0.0 A 30 LEU HG H 1 1.623 0.0 A 30 LEU C C 13 178.11 0.0 A 30 LEU CA C 13 55.164 0.0 A 30 LEU CB C 13 42.266 0.0 A 30 LEU CDy C 13 24.092 0.0 A 30 LEU CDx C 13 23.506 0.0 A 30 LEU CG C 13 26.437 0.0 A 30 LEU N N 15 120.138 0.0 A 31 SER H H 1 7.858 0.0 A 31 SER HA H 1 4.304 0.0 A 31 SER HBy H 1 3.808 0.0 A 31 SER HBx H 1 3.796 0.0 A 31 SER C C 13 174.985 0.0 A 31 SER CA C 13 59.267 0.0 A 31 SER CB C 13 63.371 0.0 A 31 SER N N 15 114.928 0.0 A 32 GLU H H 1 8.022 0.0 A 32 GLU HA H 1 4.235 0.0 A 32 GLU HBy H 1 2.024 0.0 A 32 GLU HBx H 1 1.887 0.0 A 32 GLU HGy H 1 2.23 0.0 A 32 GLU HGx H 1 2.226 0.0 A 32 GLU C C 13 176.617 0.0 A 32 GLU CA C 13 56.336 0.0 A 32 GLU CB C 13 30.541 0.0 A 32 GLU CG C 13 35.817 0.0 A 32 GLU N N 15 121.986 0.0 A 33 LEU H H 1 7.955 0.0 A 33 LEU HA H 1 4.184 0.0 A 33 LEU HBy H 1 1.618 0.0 A 33 LEU HBx H 1 1.49 0.0 A 33 LEU HDx% H 1 0.845 0.0 A 33 LEU HDy% H 1 0.783 0.0 A 33 LEU HG H 1 1.559 0.0 A 33 LEU C C 13 177.234 0.0 A 33 LEU CA C 13 55.164 0.0 A 33 LEU CB C 13 42.266 0.0 A 33 LEU CDy C 13 24.679 0.0 A 33 LEU CDx C 13 23.506 0.0 A 33 LEU CG C 13 26.437 0.0 A 33 LEU N N 15 121.776 0.0 A 34 ASP H H 1 8.056 0.0 A 34 ASP HA H 1 4.547 0.0 A 34 ASP HBy H 1 2.678 0.0 A 34 ASP HBx H 1 2.59 0.0 A 34 ASP C C 13 175.375 0.0 A 34 ASP CA C 13 53.991 0.0 A 34 ASP CB C 13 40.507 0.0 A 34 ASP N N 15 119.741 0.0 A 35 ALA H H 1 7.859 0.0 A 35 ALA HA H 1 4.503 0.0 A 35 ALA HB% H 1 1.306 0.0 A 35 ALA C C 13 175.326 0.0 A 35 ALA CA C 13 50.474 0.0 A 35 ALA CB C 13 18.23 0.0 A 35 ALA N N 15 124.841 0.0 A 36 PRO HA H 1 4.363 0.0 A 36 PRO HBy H 1 2.256 0.0 A 36 PRO HBx H 1 1.849 0.0 A 36 PRO HDy H 1 3.732 0.0 A 36 PRO HDx H 1 3.575 0.0 A 36 PRO HGy H 1 1.961 0.0 A 36 PRO HGx H 1 1.957 0.0 A 36 PRO C C 13 176.82 0.0 A 36 PRO CA C 13 63.371 0.0 A 36 PRO CB C 13 31.714 0.0 A 36 PRO CD C 13 50.474 0.0 A 36 PRO CG C 13 27.024 0.0 A 37 ALA H H 1 8.351 0.0 A 37 ALA HA H 1 4.288 0.0 A 37 ALA HB% H 1 1.362 0.0 A 37 ALA C C 13 177.858 0.0 A 37 ALA CA C 13 52.819 0.0 A 37 ALA CB C 13 18.816 0.0 A 37 ALA N N 15 123.924 0.0 A 38 GLN H H 1 8.262 0.0 A 38 GLN HA H 1 4.276 0.0 A 38 GLN HBy H 1 2.056 0.0 A 38 GLN HBx H 1 1.941 0.0 A 38 GLN HE2y H 1 7.482 0.0 A 38 GLN HE2x H 1 6.788 0.0 A 38 GLN HGy H 1 2.336 0.0 A 38 GLN HGx H 1 2.332 0.0 A 38 GLN C C 13 175.821 0.0 A 38 GLN CA C 13 55.75 0.0 A 38 GLN CB C 13 29.369 0.0 A 38 GLN CG C 13 34.059 0.0 A 38 GLN N N 15 119.428 0.0 A 38 GLN NE2 N 15 112.527 0.0 A 39 ALA H H 1 8.356 0.0 A 39 ALA HA H 1 4.265 0.0 A 39 ALA HB% H 1 1.34 0.0 A 39 ALA C C 13 178.248 0.0 A 39 ALA CA C 13 52.819 0.0 A 39 ALA CB C 13 19.402 0.0 A 39 ALA N N 15 125.678 0.0 A 40 GLY H H 1 8.468 0.0 A 40 GLY HAy H 1 4.019 0.0 A 40 GLY HAx H 1 3.878 0.0 A 40 GLY C C 13 174.75 0.0 A 40 GLY CA C 13 45.197 0.0 A 40 GLY N N 15 108.575 0.0 A 41 THR H H 1 7.949 0.0 A 41 THR HA H 1 4.315 0.0 A 41 THR HB H 1 4.113 0.0 A 41 THR HG2% H 1 1.141 0.0 A 41 THR C C 13 174.945 0.0 A 41 THR CA C 13 61.612 0.0 A 41 THR CB C 13 69.82 0.0 A 41 THR CG2 C 13 21.161 0.0 A 41 THR N N 15 112.79 0.0 A 42 GLU H H 1 8.559 0.0 A 42 GLU HA H 1 4.293 0.0 A 42 GLU HBy H 1 2.023 0.0 A 42 GLU HBx H 1 1.893 0.0 A 42 GLU HGy H 1 2.236 0.0 A 42 GLU HGx H 1 2.231 0.0 A 42 GLU C C 13 176.698 0.0 A 42 GLU CA C 13 56.336 0.0 A 42 GLU CB C 13 29.955 0.0 A 42 GLU CG C 13 36.404 0.0 A 42 GLU N N 15 123.138 0.0 A 43 SER H H 1 8.263 0.0 A 43 SER HA H 1 4.368 0.0 A 43 SER HBy H 1 3.807 0.0 A 43 SER HBx H 1 3.805 0.0 A 43 SER C C 13 174.401 0.0 A 43 SER CA C 13 58.681 0.0 A 43 SER CB C 13 63.957 0.0 A 43 SER N N 15 116.704 0.0 A 44 ALA H H 1 8.212 0.0 A 44 ALA HA H 1 4.298 0.0 A 44 ALA HB% H 1 1.376 0.0 A 44 ALA C C 13 177.712 0.0 A 44 ALA CA C 13 52.819 0.0 A 44 ALA CB C 13 19.402 0.0 A 44 ALA N N 15 125.804 0.0 A 45 VAL H H 1 7.941 0.0 A 45 VAL HA H 1 3.985 0.0 A 45 VAL HB H 1 2.015 0.0 A 45 VAL HGx% H 1 0.742 0.0 A 45 VAL HGy% H 1 0.738 0.0 A 45 VAL C C 13 176.04 0.0 A 45 VAL CA C 13 62.199 0.0 A 45 VAL CB C 13 32.3 0.0 A 45 VAL CGx C 13 21.161 0.0 A 45 VAL CGy C 13 21.161 0.0 A 45 VAL N N 15 117.914 0.0 A 46 SER H H 1 8.208 0.0 A 46 SER HA H 1 4.446 0.0 A 46 SER HBy H 1 3.855 0.0 A 46 SER HBx H 1 3.852 0.0 A 46 SER C C 13 174.798 0.0 A 46 SER CA C 13 58.681 0.0 A 46 SER CB C 13 62.785 0.0 A 46 SER N N 15 119.18 0.0 A 47 GLY H H 1 8.364 0.0 A 47 GLY HAy H 1 3.951 0.0 A 47 GLY HAx H 1 3.95 0.0 A 47 GLY C C 13 174.523 0.0 A 47 GLY CA C 13 45.197 0.0 A 47 GLY N N 15 110.018 0.0 A 48 VAL H H 1 7.817 0.0 A 48 VAL HA H 1 4.09 0.0 A 48 VAL HB H 1 2.035 0.0 A 48 VAL HGx% H 1 0.866 0.0 A 48 VAL HGy% H 1 0.859 0.0 A 48 VAL C C 13 175.935 0.0 A 48 VAL CA C 13 62.199 0.0 A 48 VAL CB C 13 32.3 0.0 A 48 VAL CGx C 13 21.161 0.0 A 48 VAL CGy C 13 21.161 0.0 A 48 VAL N N 15 117.231 0.0 A 49 GLU H H 1 8.503 0.0 A 49 GLU HA H 1 4.118 0.0 A 49 GLU HBy H 1 1.97 0.0 A 49 GLU HBx H 1 1.885 0.0 A 49 GLU HGy H 1 2.225 0.0 A 49 GLU HGx H 1 2.222 0.0 A 49 GLU C C 13 177.006 0.0 A 49 GLU CA C 13 57.509 0.0 A 49 GLU CB C 13 29.369 0.0 A 49 GLU CG C 13 35.817 0.0 A 49 GLU N N 15 122.81 0.0 A 50 GLY H H 1 8.283 0.0 A 50 GLY HAy H 1 3.938 0.0 A 50 GLY HAx H 1 3.937 0.0 A 50 GLY C C 13 174.328 0.0 A 50 GLY CA C 13 45.197 0.0 A 50 GLY N N 15 109.043 0.0 A 51 LEU H H 1 7.563 0.0 A 51 LEU HA H 1 4.424 0.0 A 51 LEU HBy H 1 1.451 0.0 A 51 LEU HBx H 1 1.375 0.0 A 51 LEU HDx% H 1 0.636 0.0 A 51 LEU HDy% H 1 0.602 0.0 A 51 LEU HG H 1 1.507 0.0 A 51 LEU C C 13 174.855 0.0 A 51 LEU CA C 13 52.819 0.0 A 51 LEU CB C 13 41.68 0.0 A 51 LEU CDx C 13 23.506 0.0 A 51 LEU CDy C 13 25.265 0.0 A 51 LEU CG C 13 26.437 0.0 A 51 LEU N N 15 122.901 0.0 A 52 PRO HDy H 1 4.177 0.0 A 52 PRO HDx H 1 3.743 0.0 A 52 PRO CD C 13 44.488 0.0 A 53 PRO HA H 1 4.364 0.0 A 53 PRO HBy H 1 2.215 0.0 A 53 PRO HBx H 1 1.816 0.0 A 53 PRO HDy H 1 3.865 0.0 A 53 PRO HDx H 1 3.562 0.0 A 53 PRO HGy H 1 2.115 0.0 A 53 PRO HGx H 1 1.95 0.0 A 53 PRO C C 13 178.037 0.0 A 53 PRO CA C 13 63.957 0.0 A 53 PRO CB C 13 31.714 0.0 A 53 PRO CD C 13 50.474 0.0 A 53 PRO CG C 13 28.196 0.0 A 54 GLY H H 1 8.906 0.0 A 54 GLY HAy H 1 4.145 0.0 A 54 GLY HAx H 1 3.737 0.0 A 54 GLY C C 13 173.613 0.0 A 54 GLY CA C 13 45.197 0.0 A 54 GLY N N 15 112.268 0.0 A 55 SER H H 1 7.579 0.0 A 55 SER HA H 1 5.227 0.0 A 55 SER HBy H 1 3.851 0.0 A 55 SER HBx H 1 3.753 0.0 A 55 SER C C 13 172.842 0.0 A 55 SER CA C 13 57.509 0.0 A 55 SER CB C 13 66.302 0.0 A 55 SER N N 15 113.752 0.0 A 56 ALA H H 1 8.477 0.0 A 56 ALA HA H 1 4.464 0.0 A 56 ALA HB% H 1 0.592 0.0 A 56 ALA C C 13 173.76 0.0 A 56 ALA CA C 13 51.646 0.0 A 56 ALA CB C 13 24.092 0.0 A 56 ALA N N 15 122.467 0.0 A 57 LEU H H 1 8.695 0.0 A 57 LEU HA H 1 4.966 0.0 A 57 LEU HBy H 1 1.359 0.0 A 57 LEU HBx H 1 1.207 0.0 A 57 LEU HDx% H 1 0.628 0.0 A 57 LEU HDy% H 1 0.619 0.0 A 57 LEU HG H 1 0.638 0.0 A 57 LEU C C 13 174.676 0.0 A 57 LEU CA C 13 53.405 0.0 A 57 LEU CB C 13 47.542 0.0 A 57 LEU CDx C 13 25.265 0.0 A 57 LEU CDy C 13 25.265 0.0 A 57 LEU CG C 13 25.265 0.0 A 57 LEU N N 15 119.971 0.0 A 58 LEU H H 1 8.597 0.0 A 58 LEU HA H 1 5.441 0.0 A 58 LEU HBy H 1 1.632 0.0 A 58 LEU HBx H 1 1.194 0.0 A 58 LEU HDx% H 1 0.666 0.0 A 58 LEU HDy% H 1 -0.06 0.0 A 58 LEU HG H 1 1.299 0.0 A 58 LEU C C 13 176.26 0.0 A 58 LEU CA C 13 52.819 0.0 A 58 LEU CB C 13 45.784 0.0 A 58 LEU CDx C 13 23.506 0.0 A 58 LEU CDy C 13 26.437 0.0 A 58 LEU CG C 13 25.851 0.0 A 58 LEU N N 15 120.336 0.0 A 59 VAL H H 1 8.902 0.0 A 59 VAL HA H 1 4.83 0.0 A 59 VAL HB H 1 1.806 0.0 A 59 VAL HGx% H 1 0.758 0.0 A 59 VAL HGy% H 1 0.743 0.0 A 59 VAL C C 13 176.544 0.0 A 59 VAL CA C 13 59.854 0.0 A 59 VAL CB C 13 34.645 0.0 A 59 VAL CGx C 13 21.747 0.0 A 59 VAL CGy C 13 21.747 0.0 A 59 VAL N N 15 121.135 0.0 A 60 VAL H H 1 8.771 0.0 A 60 VAL HA H 1 4.118 0.0 A 60 VAL HB H 1 2.163 0.0 A 60 VAL HGx% H 1 0.996 0.0 A 60 VAL HGy% H 1 0.988 0.0 A 60 VAL C C 13 175.821 0.0 A 60 VAL CA C 13 63.957 0.0 A 60 VAL CB C 13 31.714 0.0 A 60 VAL CGy C 13 21.747 0.0 A 60 VAL CGx C 13 21.161 0.0 A 60 VAL N N 15 125.495 0.0 A 61 LYS H H 1 9.423 0.0 A 61 LYS HA H 1 4.438 0.0 A 61 LYS HBy H 1 1.74 0.0 A 61 LYS HBx H 1 1.668 0.0 A 61 LYS HDy H 1 1.516 0.0 A 61 LYS HDx H 1 1.368 0.0 A 61 LYS HEy H 1 2.871 0.0 A 61 LYS HEx H 1 2.863 0.0 A 61 LYS HGy H 1 1.572 0.0 A 61 LYS HGx H 1 1.571 0.0 A 61 LYS C C 13 176.17 0.0 A 61 LYS CA C 13 56.922 0.0 A 61 LYS CB C 13 34.645 0.0 A 61 LYS CD C 13 25.265 0.0 A 61 LYS CE C 13 41.68 0.0 A 61 LYS CG C 13 27.024 0.0 A 61 LYS N N 15 132.689 0.0 A 62 ARG H H 1 7.986 0.0 A 62 ARG HA H 1 4.082 0.0 A 62 ARG HDx H 1 3.074 0.0 A 62 ARG HDy H 1 3.074 0.0 A 62 ARG HGy H 1 1.434 0.0 A 62 ARG HGx H 1 1.358 0.0 A 62 ARG C C 13 173.394 0.0 A 62 ARG CA C 13 54.722 0.0 A 62 ARG CB C 13 34.003 0.0 A 62 ARG CD C 13 42.801 0.0 A 62 ARG CG C 13 26.77 0.0 A 62 ARG N N 15 116.766 0.0 A 63 GLY H H 1 8.331 0.0 A 63 GLY HAy H 1 4.175 0.0 A 63 GLY HAx H 1 3.429 0.0 A 63 GLY C C 13 171.446 0.0 A 63 GLY CA C 13 43.363 0.0 A 63 GLY N N 15 110.58 0.0 A 64 PRO HA H 1 4.187 0.0 A 64 PRO HBy H 1 2.235 0.0 A 64 PRO HBx H 1 1.846 0.0 A 64 PRO HDy H 1 2.872 0.0 A 64 PRO HDx H 1 2.316 0.0 A 64 PRO HGy H 1 1.781 0.0 A 64 PRO HGx H 1 1.678 0.0 A 64 PRO C C 13 175.683 0.0 A 64 PRO CA C 13 63.957 0.0 A 64 PRO CB C 13 31.127 0.0 A 64 PRO CD C 13 48.129 0.0 A 64 PRO CG C 13 27.024 0.0 A 65 ASN H H 1 8.218 0.0 A 65 ASN HA H 1 4.588 0.0 A 65 ASN HBy H 1 3.095 0.0 A 65 ASN HBx H 1 2.831 0.0 A 65 ASN HD2y H 1 7.659 0.0 A 65 ASN HD2x H 1 6.1 0.0 A 65 ASN C C 13 176.495 0.0 A 65 ASN CA C 13 52.232 0.0 A 65 ASN CB C 13 36.99 0.0 A 65 ASN N N 15 114.476 0.0 A 65 ASN ND2 N 15 108.399 0.0 A 66 ALA H H 1 7.417 0.0 A 66 ALA HA H 1 3.655 0.0 A 66 ALA HB% H 1 1.332 0.0 A 66 ALA C C 13 177.948 0.0 A 66 ALA CA C 13 53.991 0.0 A 66 ALA CB C 13 17.644 0.0 A 66 ALA N N 15 121.776 0.0 A 67 GLY H H 1 9.114 0.0 A 67 GLY HAy H 1 4.451 0.0 A 67 GLY HAx H 1 3.43 0.0 A 67 GLY C C 13 175.018 0.0 A 67 GLY CA C 13 44.611 0.0 A 67 GLY N N 15 111.888 0.0 A 68 SER H H 1 7.995 0.0 A 68 SER HA H 1 4.233 0.0 A 68 SER HBy H 1 3.74 0.0 A 68 SER HBx H 1 3.572 0.0 A 68 SER C C 13 171.324 0.0 A 68 SER CA C 13 60.44 0.0 A 68 SER CB C 13 63.957 0.0 A 68 SER N N 15 117.392 0.0 A 69 ARG H H 1 8.031 0.0 A 69 ARG HA H 1 5.135 0.0 A 69 ARG HBy H 1 1.554 0.0 A 69 ARG HBx H 1 1.549 0.0 A 69 ARG HDy H 1 3.109 0.0 A 69 ARG HDx H 1 3.013 0.0 A 69 ARG HE H 1 7.096 0.0 A 69 ARG HGy H 1 1.562 0.0 A 69 ARG HGx H 1 1.434 0.0 A 69 ARG C C 13 174.758 0.0 A 69 ARG CA C 13 53.991 0.0 A 69 ARG CB C 13 34.059 0.0 A 69 ARG CD C 13 44.025 0.0 A 69 ARG CG C 13 27.024 0.0 A 69 ARG N N 15 119.174 0.0 A 69 ARG NE N 15 113.984 0.0 A 70 PHE H H 1 9.127 0.0 A 70 PHE HA H 1 5.422 0.0 A 70 PHE HBy H 1 3.022 0.0 A 70 PHE HBx H 1 2.778 0.0 A 70 PHE HDx H 1 6.901 0.0 A 70 PHE HDy H 1 6.901 0.0 A 70 PHE HEx H 1 7.014 0.0 A 70 PHE HEy H 1 7.014 0.0 A 70 PHE C C 13 173.735 0.0 A 70 PHE CA C 13 56.922 0.0 A 70 PHE CB C 13 41.094 0.0 A 70 PHE CDx C 13 132.026 0.0 A 70 PHE CDy C 13 132.026 0.0 A 70 PHE CEx C 13 132.026 0.0 A 70 PHE CEy C 13 132.026 0.0 A 70 PHE N N 15 120.819 0.0 A 71 LEU H H 1 8.587 0.0 A 71 LEU HA H 1 4.486 0.0 A 71 LEU HBy H 1 1.681 0.0 A 71 LEU HBx H 1 1.385 0.0 A 71 LEU HDx% H 1 0.841 0.0 A 71 LEU HDy% H 1 0.846 0.0 A 71 LEU HG H 1 1.392 0.0 A 71 LEU C C 13 176.235 0.0 A 71 LEU CA C 13 54.577 0.0 A 71 LEU CB C 13 43.439 0.0 A 71 LEU CDy C 13 25.265 0.0 A 71 LEU CDx C 13 24.092 0.0 A 71 LEU CG C 13 27.61 0.0 A 71 LEU N N 15 125.701 0.0 A 72 LEU H H 1 8.829 0.0 A 72 LEU HA H 1 4.797 0.0 A 72 LEU HBy H 1 1.379 0.0 A 72 LEU HBx H 1 1.224 0.0 A 72 LEU HDx% H 1 0.552 0.0 A 72 LEU HDy% H 1 0.322 0.0 A 72 LEU HG H 1 1.217 0.0 A 72 LEU C C 13 175.115 0.0 A 72 LEU CA C 13 52.819 0.0 A 72 LEU CB C 13 41.68 0.0 A 72 LEU CDx C 13 23.506 0.0 A 72 LEU CDy C 13 24.679 0.0 A 72 LEU CG C 13 26.437 0.0 A 72 LEU N N 15 127.128 0.0 A 73 ASP H H 1 8.499 0.0 A 73 ASP HA H 1 4.811 0.0 A 73 ASP HBy H 1 2.851 0.0 A 73 ASP HBx H 1 2.489 0.0 A 73 ASP C C 13 175.537 0.0 A 73 ASP CA C 13 53.405 0.0 A 73 ASP CB C 13 40.507 0.0 A 73 ASP N N 15 120.758 0.0 A 74 GLN H H 1 7.59 0.0 A 74 GLN HA H 1 4.646 0.0 A 74 GLN HBy H 1 2.294 0.0 A 74 GLN HBx H 1 1.965 0.0 A 74 GLN HE2y H 1 7.629 0.0 A 74 GLN HE2x H 1 6.751 0.0 A 74 GLN HGy H 1 2.486 0.0 A 74 GLN HGx H 1 2.373 0.0 A 74 GLN C C 13 175.375 0.0 A 74 GLN CA C 13 53.405 0.0 A 74 GLN CB C 13 31.127 0.0 A 74 GLN CG C 13 32.886 0.0 A 74 GLN N N 15 116.358 0.0 A 74 GLN NE2 N 15 113.498 0.0 A 75 ALA H H 1 8.605 0.0 A 75 ALA HA H 1 4.188 0.0 A 75 ALA HB% H 1 1.527 0.0 A 75 ALA C C 13 178.54 0.0 A 75 ALA CA C 13 55.75 0.0 A 75 ALA CB C 13 18.23 0.0 A 75 ALA N N 15 122.792 0.0 A 76 ILE H H 1 7.953 0.0 A 76 ILE HA H 1 4.623 0.0 A 76 ILE HB H 1 1.789 0.0 A 76 ILE HD1% H 1 0.744 0.0 A 76 ILE HG1x H 1 1.519 0.0 A 76 ILE HG1y H 1 1.519 0.0 A 76 ILE HG2% H 1 0.832 0.0 A 76 ILE C C 13 175.074 0.0 A 76 ILE CA C 13 61.133 0.0 A 76 ILE CB C 13 40.605 0.0 A 76 ILE CD1 C 13 17.208 0.0 A 76 ILE CG1 C 13 27.052 0.0 A 76 ILE CG2 C 13 12.954 0.0 A 76 ILE N N 15 115.348 0.0 A 77 THR H H 1 8.761 0.0 A 77 THR HA H 1 4.937 0.0 A 77 THR HB H 1 4.115 0.0 A 77 THR HG2% H 1 1.24 0.0 A 77 THR C C 13 174.604 0.0 A 77 THR CA C 13 61.026 0.0 A 77 THR CB C 13 70.406 0.0 A 77 THR CG2 C 13 22.334 0.0 A 77 THR N N 15 125.129 0.0 A 78 SER H H 1 10.606 0.0 A 78 SER HA H 1 4.7 0.0 A 78 SER HBy H 1 4.3 0.0 A 78 SER HBx H 1 4.005 0.0 A 78 SER C C 13 172.623 0.0 A 78 SER CA C 13 58.095 0.0 A 78 SER CB C 13 65.13 0.0 A 78 SER N N 15 126.536 0.0 A 79 ALA H H 1 8.831 0.0 A 79 ALA HA H 1 5.695 0.0 A 79 ALA HB% H 1 1.194 0.0 A 79 ALA C C 13 175.756 0.0 A 79 ALA CA C 13 49.887 0.0 A 79 ALA CB C 13 21.747 0.0 A 79 ALA N N 15 123.006 0.0 A 80 GLY H H 1 8.41 0.0 A 80 GLY HAy H 1 4.424 0.0 A 80 GLY HAx H 1 3.926 0.0 A 80 GLY C C 13 170.399 0.0 A 80 GLY CA C 13 46.37 0.0 A 80 GLY N N 15 108.829 0.0 A 81 ARG H H 1 8.273 0.0 A 81 ARG HA H 1 4.653 0.0 A 81 ARG HBy H 1 1.788 0.0 A 81 ARG HBx H 1 1.696 0.0 A 81 ARG HDy H 1 3.201 0.0 A 81 ARG HDx H 1 3.103 0.0 A 81 ARG HE H 1 7.925 0.0 A 81 ARG HGy H 1 1.609 0.0 A 81 ARG HGx H 1 1.509 0.0 A 81 ARG C C 13 175.659 0.0 A 81 ARG CA C 13 55.164 0.0 A 81 ARG CB C 13 34.059 0.0 A 81 ARG CD C 13 42.852 0.0 A 81 ARG CG C 13 27.024 0.0 A 81 ARG N N 15 120.727 0.0 A 81 ARG NE N 15 114.227 0.0 A 82 HIS H H 1 9.126 0.0 A 82 HIS HA H 1 4.382 0.0 A 82 HIS HBy H 1 2.886 0.0 A 82 HIS HBx H 1 2.764 0.0 A 82 HIS HD1 H 1 9.239 0.0 A 82 HIS HD2 H 1 6.56 0.0 A 82 HIS HE1 H 1 6.986 0.0 A 82 HIS C C 13 176.56 0.0 A 82 HIS CA C 13 56.922 0.0 A 82 HIS CB C 13 31.127 0.0 A 82 HIS CD2 C 13 132.026 0.0 A 82 HIS CE1 C 13 117.399 0.0 A 82 HIS N N 15 125.047 0.0 A 82 HIS ND1 N 15 116.898 0.0 A 83 PRO HA H 1 3.745 0.0 A 83 PRO HBy H 1 1.954 0.0 A 83 PRO HBx H 1 1.706 0.0 A 83 PRO HDy H 1 3.49 0.0 A 83 PRO HDx H 1 2.331 0.0 A 83 PRO HGy H 1 1.753 0.0 A 83 PRO HGx H 1 1.648 0.0 A 83 PRO C C 13 176.901 0.0 A 83 PRO CA C 13 64.544 0.0 A 83 PRO CB C 13 32.3 0.0 A 83 PRO CD C 13 50.474 0.0 A 83 PRO CG C 13 27.024 0.0 A 84 ASP H H 1 10.807 0.0 A 84 ASP HA H 1 4.668 0.0 A 84 ASP HBy H 1 2.833 0.0 A 84 ASP HBx H 1 2.684 0.0 A 84 ASP C C 13 177.29 0.0 A 84 ASP CA C 13 53.405 0.0 A 84 ASP CB C 13 39.921 0.0 A 84 ASP N N 15 121.623 0.0 A 85 SER H H 1 8.124 0.0 A 85 SER HA H 1 4.062 0.0 A 85 SER HBy H 1 3.566 0.0 A 85 SER HBx H 1 3.561 0.0 A 85 SER HG H 1 6.024 0.0 A 85 SER C C 13 173.297 0.0 A 85 SER CA C 13 59.854 0.0 A 85 SER CB C 13 65.13 0.0 A 85 SER N N 15 118.014 0.0 A 86 ASP H H 1 8.272 0.0 A 86 ASP HA H 1 4.375 0.0 A 86 ASP HBy H 1 3.26 0.0 A 86 ASP HBx H 1 2.784 0.0 A 86 ASP C C 13 177.453 0.0 A 86 ASP CA C 13 58.681 0.0 A 86 ASP CB C 13 41.68 0.0 A 86 ASP N N 15 125.896 0.0 A 87 ILE H H 1 8.465 0.0 A 87 ILE HA H 1 3.572 0.0 A 87 ILE HB H 1 1.464 0.0 A 87 ILE HD1% H 1 -0.539 0.0 A 87 ILE HG1y H 1 1.095 0.0 A 87 ILE HG1x H 1 0.347 0.0 A 87 ILE HG2% H 1 0.277 0.0 A 87 ILE C C 13 172.85 0.0 A 87 ILE CA C 13 60.44 0.0 A 87 ILE CB C 13 37.576 0.0 A 87 ILE CD1 C 13 14.126 0.0 A 87 ILE CG1 C 13 25.851 0.0 A 87 ILE CG2 C 13 14.712 0.0 A 87 ILE N N 15 119.947 0.0 A 88 PHE H H 1 7.971 0.0 A 88 PHE HA H 1 5.008 0.0 A 88 PHE HBy H 1 3.027 0.0 A 88 PHE HBx H 1 2.958 0.0 A 88 PHE HDx H 1 7.137 0.0 A 88 PHE HDy H 1 7.137 0.0 A 88 PHE HEx H 1 6.876 0.0 A 88 PHE HEy H 1 6.876 0.0 A 88 PHE C C 13 173.938 0.0 A 88 PHE CA C 13 55.75 0.0 A 88 PHE CB C 13 38.749 0.0 A 88 PHE CDx C 13 132.026 0.0 A 88 PHE CDy C 13 132.026 0.0 A 88 PHE CEx C 13 131.745 0.0 A 88 PHE CEy C 13 131.745 0.0 A 88 PHE N N 15 127.282 0.0 A 89 LEU H H 1 7.65 0.0 A 89 LEU HA H 1 3.628 0.0 A 89 LEU HBy H 1 1.193 0.0 A 89 LEU HBx H 1 0.199 0.0 A 89 LEU HDx% H 1 1.006 0.0 A 89 LEU HDy% H 1 -0.382 0.0 A 89 LEU HG H 1 0.252 0.0 A 89 LEU C C 13 173.67 0.0 A 89 LEU CA C 13 52.232 0.0 A 89 LEU CB C 13 41.094 0.0 A 89 LEU CDy C 13 24.679 0.0 A 89 LEU CDx C 13 20.575 0.0 A 89 LEU CG C 13 26.437 0.0 A 89 LEU N N 15 131.615 0.0 A 90 ASP H H 1 7.93 0.0 A 90 ASP HA H 1 4.132 0.0 A 90 ASP HBy H 1 2.622 0.0 A 90 ASP HBx H 1 1.63 0.0 A 90 ASP C C 13 176.552 0.0 A 90 ASP CA C 13 52.819 0.0 A 90 ASP CB C 13 39.921 0.0 A 90 ASP N N 15 121.009 0.0 A 91 ASP H H 1 7.545 0.0 A 91 ASP HA H 1 4.816 0.0 A 91 ASP HBy H 1 2.579 0.0 A 91 ASP HBx H 1 2.38 0.0 A 91 ASP C C 13 176.625 0.0 A 91 ASP CA C 13 55.164 0.0 A 91 ASP CB C 13 48.129 0.0 A 91 ASP N N 15 121.314 0.0 A 92 VAL H H 1 8.301 0.0 A 92 VAL HA H 1 3.976 0.0 A 92 VAL HB H 1 2.378 0.0 A 92 VAL HGx% H 1 0.975 0.0 A 92 VAL HGy% H 1 0.966 0.0 A 92 VAL C C 13 174.693 0.0 A 92 VAL CA C 13 65.13 0.0 A 92 VAL CB C 13 31.714 0.0 A 92 VAL CGy C 13 21.161 0.0 A 92 VAL CGx C 13 19.402 0.0 A 92 VAL N N 15 122.229 0.0 A 93 THR H H 1 8.168 0.0 A 93 THR HA H 1 4.474 0.0 A 93 THR HB H 1 4.003 0.0 A 93 THR HG2% H 1 0.967 0.0 A 93 THR C C 13 175.212 0.0 A 93 THR CA C 13 63.957 0.0 A 93 THR CB C 13 70.406 0.0 A 93 THR CG2 C 13 22.334 0.0 A 93 THR N N 15 110.438 0.0 A 94 VAL H H 1 8.527 0.0 A 94 VAL HA H 1 4.26 0.0 A 94 VAL HB H 1 2.583 0.0 A 94 VAL HGx% H 1 1.154 0.0 A 94 VAL HGy% H 1 1.06 0.0 A 94 VAL C C 13 176.949 0.0 A 94 VAL CA C 13 61.612 0.0 A 94 VAL CB C 13 32.886 0.0 A 94 VAL CGx C 13 20.575 0.0 A 94 VAL CGy C 13 23.506 0.0 A 94 VAL N N 15 126.686 0.0 A 95 SER H H 1 11.637 0.0 A 95 SER HA H 1 5.181 0.0 A 95 SER HBy H 1 4.057 0.0 A 95 SER HBx H 1 3.482 0.0 A 95 SER C C 13 175.48 0.0 A 95 SER CA C 13 61.026 0.0 A 95 SER CB C 13 63.957 0.0 A 95 SER N N 15 128.635 0.0 A 96 ARG H H 1 10.867 0.0 A 96 ARG HA H 1 3.734 0.0 A 96 ARG HBy H 1 2.037 0.0 A 96 ARG HBx H 1 2.011 0.0 A 96 ARG HDy H 1 3.195 0.0 A 96 ARG HDx H 1 2.882 0.0 A 96 ARG HE H 1 6.778 0.0 A 96 ARG HGy H 1 1.825 0.0 A 96 ARG HGx H 1 1.757 0.0 A 96 ARG C C 13 177.063 0.0 A 96 ARG CA C 13 61.026 0.0 A 96 ARG CB C 13 28.782 0.0 A 96 ARG CD C 13 43.439 0.0 A 96 ARG CG C 13 28.196 0.0 A 96 ARG N N 15 126.787 0.0 A 96 ARG NE N 15 115.198 0.0 A 97 ARG H H 1 7.892 0.0 A 97 ARG HA H 1 4.077 0.0 A 97 ARG HBy H 1 1.488 0.0 A 97 ARG HBx H 1 1.359 0.0 A 97 ARG HDy H 1 3.061 0.0 A 97 ARG HDx H 1 3.059 0.0 A 97 ARG HE H 1 7.465 0.0 A 97 ARG HGy H 1 1.424 0.0 A 97 ARG HGx H 1 1.338 0.0 A 97 ARG C C 13 172.923 0.0 A 97 ARG CA C 13 53.991 0.0 A 97 ARG CB C 13 30.541 0.0 A 97 ARG CD C 13 42.852 0.0 A 97 ARG CG C 13 25.851 0.0 A 97 ARG N N 15 115.65 0.0 A 97 ARG NE N 15 114.955 0.0 A 98 HIS H H 1 7.587 0.0 A 98 HIS HA H 1 4.418 0.0 A 98 HIS HBy H 1 3.252 0.0 A 98 HIS HBx H 1 3.179 0.0 A 98 HIS HD1 H 1 10.86 0.0 A 98 HIS HD2 H 1 6.786 0.0 A 98 HIS HE1 H 1 6.747 0.0 A 98 HIS C C 13 173.551 0.0 A 98 HIS CA C 13 58.095 0.0 A 98 HIS CB C 13 34.645 0.0 A 98 HIS CD2 C 13 130.057 0.0 A 98 HIS CE1 C 13 117.399 0.0 A 98 HIS N N 15 124.084 0.0 A 98 HIS ND1 N 15 106.214 0.0 A 99 ALA H H 1 8.439 0.0 A 99 ALA HA H 1 5.556 0.0 A 99 ALA HB% H 1 1.122 0.0 A 99 ALA C C 13 176.398 0.0 A 99 ALA CA C 13 50.474 0.0 A 99 ALA CB C 13 22.92 0.0 A 99 ALA N N 15 116.58 0.0 A 100 GLU H H 1 9.009 0.0 A 100 GLU HA H 1 4.985 0.0 A 100 GLU HBy H 1 1.651 0.0 A 100 GLU HBx H 1 1.581 0.0 A 100 GLU HGy H 1 2.135 0.0 A 100 GLU HGx H 1 1.993 0.0 A 100 GLU C C 13 174.117 0.0 A 100 GLU CA C 13 54.577 0.0 A 100 GLU CB C 13 34.645 0.0 A 100 GLU CG C 13 36.99 0.0 A 100 GLU N N 15 117.981 0.0 A 101 PHE H H 1 9.365 0.0 A 101 PHE HA H 1 4.727 0.0 A 101 PHE HBy H 1 2.933 0.0 A 101 PHE HBx H 1 2.528 0.0 A 101 PHE HDx H 1 7.049 0.0 A 101 PHE HDy H 1 7.049 0.0 A 101 PHE C C 13 176.592 0.0 A 101 PHE CA C 13 56.336 0.0 A 101 PHE CB C 13 41.094 0.0 A 101 PHE CDx C 13 132.026 0.0 A 101 PHE CDy C 13 132.026 0.0 A 101 PHE N N 15 119.943 0.0 A 102 ARG H H 1 9.662 0.0 A 102 ARG HA H 1 5.401 0.0 A 102 ARG HBx H 1 1.7 0.0 A 102 ARG HBy H 1 1.7 0.0 A 102 ARG HDx H 1 3.02 0.0 A 102 ARG HDy H 1 3.02 0.0 A 102 ARG HE H 1 7.149 0.0 A 102 ARG HGx H 1 1.465 0.0 A 102 ARG HGy H 1 1.465 0.0 A 102 ARG C C 13 174.328 0.0 A 102 ARG N N 15 126.266 0.0 A 102 ARG NE N 15 114.955 0.0 A 103 LEU H H 1 8.926 0.0 A 103 LEU HA H 1 4.427 0.0 A 103 LEU HBy H 1 1.648 0.0 A 103 LEU HBx H 1 0.938 0.0 A 103 LEU HDx% H 1 0.479 0.0 A 103 LEU HDy% H 1 -0.185 0.0 A 103 LEU HG H 1 0.908 0.0 A 103 LEU C C 13 176.081 0.0 A 103 LEU CA C 13 53.991 0.0 A 103 LEU CB C 13 42.852 0.0 A 103 LEU CDy C 13 24.679 0.0 A 103 LEU CDx C 13 21.161 0.0 A 103 LEU CG C 13 27.024 0.0 A 103 LEU N N 15 128.257 0.0 A 104 GLU H H 1 8.755 0.0 A 104 GLU HA H 1 4.427 0.0 A 104 GLU HBy H 1 1.796 0.0 A 104 GLU HBx H 1 1.74 0.0 A 104 GLU HGy H 1 2.057 0.0 A 104 GLU HGx H 1 2.017 0.0 A 104 GLU C C 13 175.854 0.0 A 104 GLU CA C 13 55.75 0.0 A 104 GLU CB C 13 32.3 0.0 A 104 GLU CG C 13 35.817 0.0 A 104 GLU N N 15 128.222 0.0 A 105 ASN H H 1 9.347 0.0 A 105 ASN HA H 1 4.186 0.0 A 105 ASN HBy H 1 2.935 0.0 A 105 ASN HBx H 1 2.699 0.0 A 105 ASN HD2y H 1 7.641 0.0 A 105 ASN HD2x H 1 6.794 0.0 A 105 ASN C C 13 174.303 0.0 A 105 ASN CA C 13 54.577 0.0 A 105 ASN CB C 13 36.99 0.0 A 105 ASN N N 15 124.687 0.0 A 105 ASN ND2 N 15 113.984 0.0 A 106 ASN H H 1 8.578 0.0 A 106 ASN HA H 1 3.99 0.0 A 106 ASN HBy H 1 3.004 0.0 A 106 ASN HBx H 1 2.898 0.0 A 106 ASN HD2y H 1 7.461 0.0 A 106 ASN HD2x H 1 6.778 0.0 A 106 ASN C C 13 173.175 0.0 A 106 ASN CA C 13 54.577 0.0 A 106 ASN CB C 13 38.162 0.0 A 106 ASN N N 15 108.773 0.0 A 106 ASN ND2 N 15 113.012 0.0 A 107 GLU H H 1 7.607 0.0 A 107 GLU HA H 1 4.648 0.0 A 107 GLU HBy H 1 2.053 0.0 A 107 GLU HBx H 1 1.886 0.0 A 107 GLU HGy H 1 2.261 0.0 A 107 GLU HGx H 1 2.254 0.0 A 107 GLU C C 13 174.376 0.0 A 107 GLU CA C 13 54.577 0.0 A 107 GLU CB C 13 32.886 0.0 A 107 GLU CG C 13 35.231 0.0 A 107 GLU N N 15 118.478 0.0 A 108 PHE H H 1 9.625 0.0 A 108 PHE HA H 1 4.962 0.0 A 108 PHE HBy H 1 2.939 0.0 A 108 PHE HBx H 1 2.508 0.0 A 108 PHE HDx H 1 7.167 0.0 A 108 PHE HDy H 1 7.167 0.0 A 108 PHE HEx H 1 7.03 0.0 A 108 PHE HEy H 1 7.03 0.0 A 108 PHE C C 13 174.563 0.0 A 108 PHE CA C 13 58.681 0.0 A 108 PHE CB C 13 41.68 0.0 A 108 PHE CDx C 13 132.026 0.0 A 108 PHE CDy C 13 132.026 0.0 A 108 PHE CEx C 13 132.026 0.0 A 108 PHE CEy C 13 132.026 0.0 A 108 PHE N N 15 121.436 0.0 A 109 ASN H H 1 9.174 0.0 A 109 ASN HA H 1 5.563 0.0 A 109 ASN HBy H 1 2.534 0.0 A 109 ASN HBx H 1 2.253 0.0 A 109 ASN HD2y H 1 6.698 0.0 A 109 ASN HD2x H 1 6.609 0.0 A 109 ASN C C 13 174.936 0.0 A 109 ASN CA C 13 51.06 0.0 A 109 ASN CB C 13 42.266 0.0 A 109 ASN N N 15 119.558 0.0 A 109 ASN ND2 N 15 110.341 0.0 A 110 VAL H H 1 9.011 0.0 A 110 VAL HA H 1 4.88 0.0 A 110 VAL HB H 1 1.607 0.0 A 110 VAL HGx% H 1 0.728 0.0 A 110 VAL HGy% H 1 0.084 0.0 A 110 VAL C C 13 171.673 0.0 A 110 VAL CA C 13 58.681 0.0 A 110 VAL CB C 13 34.059 0.0 A 110 VAL CGx C 13 19.402 0.0 A 110 VAL CGy C 13 22.92 0.0 A 110 VAL N N 15 121.31 0.0 A 111 VAL H H 1 8.605 0.0 A 111 VAL HA H 1 4.575 0.0 A 111 VAL HB H 1 1.693 0.0 A 111 VAL HGx% H 1 0.737 0.0 A 111 VAL HGy% H 1 0.729 0.0 A 111 VAL C C 13 175.594 0.0 A 111 VAL CA C 13 59.854 0.0 A 111 VAL CB C 13 35.817 0.0 A 111 VAL CGx C 13 20.575 0.0 A 111 VAL CGy C 13 20.575 0.0 A 111 VAL N N 15 125.613 0.0 A 112 ASP H H 1 8.447 0.0 A 112 ASP HA H 1 4.819 0.0 A 112 ASP HBy H 1 2.991 0.0 A 112 ASP HBx H 1 2.37 0.0 A 112 ASP C C 13 177.274 0.0 A 112 ASP CA C 13 54.577 0.0 A 112 ASP CB C 13 43.439 0.0 A 112 ASP N N 15 126.881 0.0 A 113 VAL H H 1 7.941 0.0 A 113 VAL HA H 1 4.537 0.0 A 113 VAL HB H 1 2.325 0.0 A 113 VAL HGx% H 1 0.609 0.0 A 113 VAL HGy% H 1 0.383 0.0 A 113 VAL C C 13 174.328 0.0 A 113 VAL CA C 13 60.44 0.0 A 113 VAL CB C 13 29.369 0.0 A 113 VAL CGy C 13 21.161 0.0 A 113 VAL CGx C 13 18.23 0.0 A 113 VAL N N 15 119.783 0.0 A 114 GLY H H 1 8.615 0.0 A 114 GLY HAy H 1 4.264 0.0 A 114 GLY HAx H 1 3.688 0.0 A 114 GLY C C 13 175.505 0.0 A 114 GLY CA C 13 45.197 0.0 A 114 GLY N N 15 111.585 0.0 A 115 SER H H 1 9.214 0.0 A 115 SER HA H 1 3.885 0.0 A 115 SER HBy H 1 3.376 0.0 A 115 SER HBx H 1 2.943 0.0 A 115 SER C C 13 176.04 0.0 A 115 SER CA C 13 58.095 0.0 A 115 SER CB C 13 61.026 0.0 A 115 SER N N 15 121.641 0.0 A 116 LEU H H 1 8.014 0.0 A 116 LEU HA H 1 4.241 0.0 A 116 LEU HBy H 1 1.779 0.0 A 116 LEU HBx H 1 1.694 0.0 A 116 LEU HDx% H 1 0.896 0.0 A 116 LEU HDy% H 1 0.674 0.0 A 116 LEU C C 13 179.376 0.0 A 116 LEU CA C 13 57.509 0.0 A 116 LEU CB C 13 41.68 0.0 A 116 LEU CDx C 13 22.92 0.0 A 116 LEU CDy C 13 26.437 0.0 A 116 LEU N N 15 121.441 0.0 A 117 ASN H H 1 8.697 0.0 A 117 ASN HA H 1 4.977 0.0 A 117 ASN HBy H 1 3.369 0.0 A 117 ASN HBx H 1 2.993 0.0 A 117 ASN HD2x H 1 8.294 0.0 A 117 ASN HD2y H 1 8.294 0.0 A 117 ASN C C 13 175.902 0.0 A 117 ASN CA C 13 53.991 0.0 A 117 ASN CB C 13 40.507 0.0 A 117 ASN N N 15 111.777 0.0 A 117 ASN ND2 N 15 117.869 0.0 A 118 GLY H H 1 8.01 0.0 A 118 GLY HAy H 1 4.252 0.0 A 118 GLY HAx H 1 3.638 0.0 A 118 GLY C C 13 173.938 0.0 A 118 GLY CA C 13 44.025 0.0 A 118 GLY N N 15 110.77 0.0 A 119 THR H H 1 8.964 0.0 A 119 THR HA H 1 4.799 0.0 A 119 THR HB H 1 3.75 0.0 A 119 THR HG2% H 1 0.85 0.0 A 119 THR C C 13 172.355 0.0 A 119 THR CA C 13 63.957 0.0 A 119 THR CB C 13 69.82 0.0 A 119 THR CG2 C 13 21.161 0.0 A 119 THR N N 15 121.689 0.0 A 120 TYR H H 1 8.244 0.0 A 120 TYR HA H 1 5.342 0.0 A 120 TYR HBy H 1 3.133 0.0 A 120 TYR HBx H 1 2.371 0.0 A 120 TYR HDx H 1 6.784 0.0 A 120 TYR HDy H 1 6.784 0.0 A 120 TYR HEx H 1 6.95 0.0 A 120 TYR HEy H 1 6.95 0.0 A 120 TYR C C 13 175.943 0.0 A 120 TYR CA C 13 55.75 0.0 A 120 TYR CB C 13 41.094 0.0 A 120 TYR CDx C 13 133.151 0.0 A 120 TYR CDy C 13 133.151 0.0 A 120 TYR CEx C 13 118.524 0.0 A 120 TYR CEy C 13 118.524 0.0 A 120 TYR N N 15 123.35 0.0 A 121 VAL H H 1 8.927 0.0 A 121 VAL HA H 1 4.941 0.0 A 121 VAL HB H 1 1.732 0.0 A 121 VAL HGx% H 1 0.734 0.0 A 121 VAL HGy% H 1 0.75 0.0 A 121 VAL C C 13 176.658 0.0 A 121 VAL CA C 13 61.026 0.0 A 121 VAL CB C 13 32.886 0.0 A 121 VAL CGy C 13 22.92 0.0 A 121 VAL CGx C 13 21.161 0.0 A 121 VAL N N 15 121.527 0.0 A 122 ASN H H 1 10.018 0.0 A 122 ASN HA H 1 4.379 0.0 A 122 ASN HBy H 1 2.932 0.0 A 122 ASN HBx H 1 2.794 0.0 A 122 ASN HD2y H 1 7.755 0.0 A 122 ASN HD2x H 1 7.428 0.0 A 122 ASN C C 13 174.474 0.0 A 122 ASN CA C 13 54.577 0.0 A 122 ASN CB C 13 36.99 0.0 A 122 ASN N N 15 128.973 0.0 A 122 ASN ND2 N 15 117.14 0.0 A 123 ARG H H 1 9.259 0.0 A 123 ARG HA H 1 2.959 0.0 A 123 ARG HBy H 1 2.033 0.0 A 123 ARG HBx H 1 1.365 0.0 A 123 ARG HDx H 1 2.823 0.0 A 123 ARG HDy H 1 2.823 0.0 A 123 ARG HE H 1 7.426 0.0 A 123 ARG HGy H 1 1.2 0.0 A 123 ARG HGx H 1 0.849 0.0 A 123 ARG C C 13 174.449 0.0 A 123 ARG CA C 13 58.095 0.0 A 123 ARG CB C 13 27.052 0.0 A 123 ARG N N 15 106.343 0.0 A 123 ARG NE N 15 116.169 0.0 A 124 GLU H H 1 7.738 0.0 A 124 GLU HA H 1 5.092 0.0 A 124 GLU HBy H 1 2.074 0.0 A 124 GLU HBx H 1 1.852 0.0 A 124 GLU HGy H 1 2.354 0.0 A 124 GLU HGx H 1 2.238 0.0 A 124 GLU C C 13 173.427 0.0 A 124 GLU CA C 13 52.819 0.0 A 124 GLU CB C 13 31.127 0.0 A 124 GLU CG C 13 34.645 0.0 A 124 GLU N N 15 120.047 0.0 A 125 PRO HA H 1 4.066 0.0 A 125 PRO HBy H 1 1.741 0.0 A 125 PRO HBx H 1 1.622 0.0 A 125 PRO HDy H 1 3.952 0.0 A 125 PRO HDx H 1 3.859 0.0 A 125 PRO HGy H 1 2.207 0.0 A 125 PRO HGx H 1 2.055 0.0 A 125 PRO C C 13 177.534 0.0 A 125 PRO CA C 13 62.199 0.0 A 125 PRO CB C 13 31.127 0.0 A 125 PRO CD C 13 50.474 0.0 A 125 PRO CG C 13 27.024 0.0 A 126 VAL H H 1 8.313 0.0 A 126 VAL HA H 1 4.708 0.0 A 126 VAL HB H 1 1.898 0.0 A 126 VAL HGx% H 1 0.831 0.0 A 126 VAL HGy% H 1 0.45 0.0 A 126 VAL C C 13 175.683 0.0 A 126 VAL CA C 13 58.681 0.0 A 126 VAL CB C 13 35.231 0.0 A 126 VAL CGy C 13 21.747 0.0 A 126 VAL CGx C 13 18.23 0.0 A 126 VAL N N 15 114.933 0.0 A 127 ASP H H 1 8.45 0.0 A 127 ASP HA H 1 4.775 0.0 A 127 ASP HBy H 1 2.76 0.0 A 127 ASP HBx H 1 2.628 0.0 A 127 ASP C C 13 176.208 0.0 A 127 ASP CA C 13 55.75 0.0 A 127 ASP CB C 13 41.094 0.0 A 127 ASP N N 15 120.662 0.0 A 128 SER H H 1 7.62 0.0 A 128 SER HA H 1 5.431 0.0 A 128 SER HBy H 1 3.74 0.0 A 128 SER HBx H 1 3.733 0.0 A 128 SER C C 13 173.443 0.0 A 128 SER CA C 13 56.336 0.0 A 128 SER CB C 13 65.13 0.0 A 128 SER N N 15 111.689 0.0 A 129 ALA H H 1 8.737 0.0 A 129 ALA HA H 1 4.594 0.0 A 129 ALA HB% H 1 1.241 0.0 A 129 ALA C C 13 175.391 0.0 A 129 ALA CA C 13 52.232 0.0 A 129 ALA CB C 13 22.334 0.0 A 129 ALA N N 15 125.059 0.0 A 130 VAL H H 1 8.266 0.0 A 130 VAL HA H 1 4.098 0.0 A 130 VAL HB H 1 1.848 0.0 A 130 VAL HGx% H 1 0.912 0.0 A 130 VAL HGy% H 1 0.881 0.0 A 130 VAL C C 13 176.162 0.0 A 130 VAL CA C 13 62.785 0.0 A 130 VAL CB C 13 32.3 0.0 A 130 VAL CGx C 13 21.161 0.0 A 130 VAL CGy C 13 21.747 0.0 A 130 VAL N N 15 122.876 0.0 A 131 LEU H H 1 8.415 0.0 A 131 LEU HA H 1 4.354 0.0 A 131 LEU HBy H 1 0.623 0.0 A 131 LEU HBx H 1 0.048 0.0 A 131 LEU HDx% H 1 0.62 0.0 A 131 LEU HDy% H 1 0.615 0.0 A 131 LEU HG H 1 0.356 0.0 A 131 LEU C C 13 175.147 0.0 A 131 LEU CA C 13 53.991 0.0 A 131 LEU CB C 13 42.852 0.0 A 131 LEU CDx C 13 23.506 0.0 A 131 LEU CDy C 13 23.506 0.0 A 131 LEU CG C 13 26.437 0.0 A 131 LEU N N 15 128.99 0.0 A 132 ALA H H 1 9.077 0.0 A 132 ALA HA H 1 4.724 0.0 A 132 ALA HB% H 1 1.402 0.0 A 132 ALA C C 13 176.543 0.0 A 132 ALA CA C 13 49.301 0.0 A 132 ALA CB C 13 22.334 0.0 A 132 ALA N N 15 126.102 0.0 A 133 ASN H H 1 8.751 0.0 A 133 ASN HA H 1 4.427 0.0 A 133 ASN HBy H 1 2.932 0.0 A 133 ASN HBx H 1 2.705 0.0 A 133 ASN HD2y H 1 7.514 0.0 A 133 ASN HD2x H 1 6.711 0.0 A 133 ASN C C 13 176.479 0.0 A 133 ASN CA C 13 56.336 0.0 A 133 ASN CB C 13 39.921 0.0 A 133 ASN N N 15 117.55 0.0 A 133 ASN ND2 N 15 113.498 0.0 A 134 GLY H H 1 10.068 0.0 A 134 GLY HAy H 1 4.429 0.0 A 134 GLY HAx H 1 3.41 0.0 A 134 GLY C C 13 174.401 0.0 A 134 GLY CA C 13 45.197 0.0 A 134 GLY N N 15 117.502 0.0 A 135 ASP H H 1 8.592 0.0 A 135 ASP HA H 1 4.812 0.0 A 135 ASP HBy H 1 2.814 0.0 A 135 ASP HBx H 1 2.345 0.0 A 135 ASP C C 13 174.782 0.0 A 135 ASP CA C 13 55.75 0.0 A 135 ASP CB C 13 42.266 0.0 A 135 ASP N N 15 123.186 0.0 A 136 GLU H H 1 8.222 0.0 A 136 GLU HA H 1 5.273 0.0 A 136 GLU HBy H 1 2.049 0.0 A 136 GLU HBx H 1 1.967 0.0 A 136 GLU HGy H 1 2.392 0.0 A 136 GLU HGx H 1 2.031 0.0 A 136 GLU C C 13 176.138 0.0 A 136 GLU CA C 13 54.577 0.0 A 136 GLU CB C 13 32.3 0.0 A 136 GLU CG C 13 37.576 0.0 A 136 GLU N N 15 118.457 0.0 A 137 VAL H H 1 9.676 0.0 A 137 VAL HA H 1 5.235 0.0 A 137 VAL HB H 1 2.004 0.0 A 137 VAL HGx% H 1 0.952 0.0 A 137 VAL HGy% H 1 0.946 0.0 A 137 VAL C C 13 174.271 0.0 A 137 VAL CA C 13 60.44 0.0 A 137 VAL CB C 13 34.645 0.0 A 137 VAL CGx C 13 21.161 0.0 A 137 VAL CGy C 13 21.161 0.0 A 137 VAL N N 15 127.748 0.0 A 138 GLN H H 1 9.515 0.0 A 138 GLN HA H 1 5.438 0.0 A 138 GLN HBy H 1 2.228 0.0 A 138 GLN HBx H 1 2.226 0.0 A 138 GLN HE2y H 1 7.656 0.0 A 138 GLN HE2x H 1 6.6 0.0 A 138 GLN HGy H 1 2.513 0.0 A 138 GLN HGx H 1 2.198 0.0 A 138 GLN C C 13 175.034 0.0 A 138 GLN CA C 13 54.577 0.0 A 138 GLN CB C 13 29.955 0.0 A 138 GLN CG C 13 32.3 0.0 A 138 GLN N N 15 129.736 0.0 A 138 GLN NE2 N 15 110.099 0.0 A 139 ILE H H 1 8.547 0.0 A 139 ILE HA H 1 4.128 0.0 A 139 ILE HB H 1 1.279 0.0 A 139 ILE HD1% H 1 -0.144 0.0 A 139 ILE HG1y H 1 1.438 0.0 A 139 ILE HG1x H 1 0.852 0.0 A 139 ILE HG2% H 1 0.525 0.0 A 139 ILE C C 13 174.798 0.0 A 139 ILE CA C 13 60.44 0.0 A 139 ILE CB C 13 41.094 0.0 A 139 ILE CD1 C 13 14.712 0.0 A 139 ILE CG1 C 13 27.61 0.0 A 139 ILE CG2 C 13 12.954 0.0 A 139 ILE N N 15 128.956 0.0 A 140 GLY H H 1 9.937 0.0 A 140 GLY HAy H 1 3.752 0.0 A 140 GLY HAx H 1 3.374 0.0 A 140 GLY C C 13 174.758 0.0 A 140 GLY CA C 13 46.37 0.0 A 140 GLY N N 15 116.627 0.0 A 141 LYS H H 1 7.134 0.0 A 141 LYS HA H 1 3.65 0.0 A 141 LYS HBy H 1 1.349 0.0 A 141 LYS HBx H 1 0.824 0.0 A 141 LYS HDy H 1 1.273 0.0 A 141 LYS HDx H 1 1.268 0.0 A 141 LYS HEy H 1 2.552 0.0 A 141 LYS HEx H 1 2.442 0.0 A 141 LYS HGy H 1 0.652 0.0 A 141 LYS HGx H 1 0.646 0.0 A 141 LYS C C 13 175.699 0.0 A 141 LYS CA C 13 57.509 0.0 A 141 LYS CB C 13 32.886 0.0 A 141 LYS CD C 13 28.782 0.0 A 141 LYS CE C 13 41.094 0.0 A 141 LYS CG C 13 25.851 0.0 A 141 LYS N N 15 123.063 0.0 A 142 PHE H H 1 8.159 0.0 A 142 PHE HA H 1 4.55 0.0 A 142 PHE HBy H 1 3.471 0.0 A 142 PHE HBx H 1 2.541 0.0 A 142 PHE HDx H 1 7.011 0.0 A 142 PHE HDy H 1 7.011 0.0 A 142 PHE HEx H 1 7.258 0.0 A 142 PHE HEy H 1 7.258 0.0 A 142 PHE C C 13 174.296 0.0 A 142 PHE CA C 13 58.681 0.0 A 142 PHE CB C 13 39.921 0.0 A 142 PHE CDx C 13 131.745 0.0 A 142 PHE CDy C 13 131.745 0.0 A 142 PHE CEx C 13 132.026 0.0 A 142 PHE CEy C 13 132.026 0.0 A 142 PHE N N 15 122.7 0.0 A 143 ARG H H 1 8.663 0.0 A 143 ARG HA H 1 5.48 0.0 A 143 ARG HBy H 1 1.803 0.0 A 143 ARG HBx H 1 1.727 0.0 A 143 ARG HDy H 1 3.106 0.0 A 143 ARG HDx H 1 3.096 0.0 A 143 ARG HE H 1 7.341 0.0 A 143 ARG HGy H 1 1.548 0.0 A 143 ARG HGx H 1 1.447 0.0 A 143 ARG C C 13 174.92 0.0 A 143 ARG CA C 13 54.577 0.0 A 143 ARG CB C 13 32.886 0.0 A 143 ARG CD C 13 43.439 0.0 A 143 ARG CG C 13 28.196 0.0 A 143 ARG N N 15 122.198 0.0 A 143 ARG NE N 15 115.684 0.0 A 144 LEU H H 1 9.807 0.0 A 144 LEU HA H 1 5.512 0.0 A 144 LEU HBy H 1 1.769 0.0 A 144 LEU HBx H 1 1.442 0.0 A 144 LEU HDx% H 1 0.804 0.0 A 144 LEU HDy% H 1 0.798 0.0 A 144 LEU HG H 1 1.685 0.0 A 144 LEU C C 13 175.277 0.0 A 144 LEU CA C 13 53.405 0.0 A 144 LEU CB C 13 44.611 0.0 A 144 LEU CDx C 13 26.437 0.0 A 144 LEU CDy C 13 26.437 0.0 A 144 LEU CG C 13 28.196 0.0 A 144 LEU N N 15 127.394 0.0 A 145 VAL H H 1 9.269 0.0 A 145 VAL HA H 1 5.066 0.0 A 145 VAL HB H 1 1.81 0.0 A 145 VAL HGx% H 1 0.956 0.0 A 145 VAL HGy% H 1 0.905 0.0 A 145 VAL C C 13 173.418 0.0 A 145 VAL CA C 13 60.44 0.0 A 145 VAL CB C 13 34.645 0.0 A 145 VAL CGy C 13 22.334 0.0 A 145 VAL CGx C 13 20.575 0.0 A 145 VAL N N 15 121.478 0.0 A 146 PHE H H 1 8.764 0.0 A 146 PHE HA H 1 5.043 0.0 A 146 PHE HBy H 1 3.011 0.0 A 146 PHE HBx H 1 2.558 0.0 A 146 PHE HDx H 1 6.858 0.0 A 146 PHE HDy H 1 6.858 0.0 A 146 PHE C C 13 172.826 0.0 A 146 PHE CA C 13 56.922 0.0 A 146 PHE CB C 13 41.094 0.0 A 146 PHE CDx C 13 132.026 0.0 A 146 PHE CDy C 13 132.026 0.0 A 146 PHE N N 15 128.869 0.0 A 147 LEU H H 1 8.657 0.0 A 147 LEU HA H 1 5.014 0.0 A 147 LEU HBy H 1 1.392 0.0 A 147 LEU HBx H 1 1.272 0.0 A 147 LEU HDx% H 1 0.812 0.0 A 147 LEU HDy% H 1 0.694 0.0 A 147 LEU HG H 1 1.393 0.0 A 147 LEU C C 13 175.253 0.0 A 147 LEU CA C 13 52.819 0.0 A 147 LEU CB C 13 45.784 0.0 A 147 LEU CDx C 13 23.506 0.0 A 147 LEU CDy C 13 25.851 0.0 A 147 LEU CG C 13 27.024 0.0 A 147 LEU N N 15 128.096 0.0 A 148 THR H H 1 8.178 0.0 A 148 THR HA H 1 4.215 0.0 A 148 THR HB H 1 4.076 0.0 A 148 THR HG1 H 1 6.834 0.0 A 148 THR HG2% H 1 1.127 0.0 A 148 THR C C 13 174.352 0.0 A 148 THR CA C 13 60.44 0.0 A 148 THR CB C 13 70.406 0.0 A 148 THR CG2 C 13 21.161 0.0 A 148 THR N N 15 110.644 0.0 A 149 GLY H H 1 8.113 0.0 A 149 GLY HAx H 1 3.943 0.0 A 149 GLY HAy H 1 3.943 0.0 A 149 GLY C C 13 171.576 0.0 A 149 GLY CA C 13 44.543 0.0 A 149 GLY N N 15 109.387 0.0 A 150 PRO HA H 1 4.407 0.0 A 150 PRO HBy H 1 2.252 0.0 A 150 PRO HBx H 1 1.826 0.0 A 150 PRO HDy H 1 3.535 0.0 A 150 PRO HDx H 1 3.446 0.0 A 150 PRO HGy H 1 2.02 0.0 A 150 PRO HGx H 1 1.96 0.0 A 150 PRO C C 13 176.966 0.0 A 150 PRO CA C 13 63.102 0.0 A 150 PRO CB C 13 32.447 0.0 A 150 PRO CD C 13 49.881 0.0 A 150 PRO CG C 13 27.384 0.0 A 151 LYS H H 1 8.457 0.0 A 151 LYS C C 13 176.722 0.0 A 151 LYS N N 15 121.922 0.0 A 152 GLN H H 1 8.579 0.0 A 152 GLN HA H 1 4.251 0.0 A 152 GLN HBy H 1 2.043 0.0 A 152 GLN HBx H 1 1.908 0.0 A 152 GLN HGx H 1 2.3 0.0 A 152 GLN HGy H 1 2.3 0.0 A 152 GLN C C 13 176.292 0.0 A 152 GLN CA C 13 55.749 0.0 A 152 GLN CB C 13 29.634 0.0 A 152 GLN CG C 13 33.854 0.0 A 152 GLN N N 15 122.509 0.0 A 153 GLY H H 1 8.527 0.0 A 153 GLY HAx H 1 3.972 0.0 A 153 GLY HAy H 1 3.972 0.0 A 153 GLY C C 13 173.962 0.0 A 153 GLY CA C 13 45.106 0.0 A 153 GLY N N 15 111.357 0.0 A 154 GLU H H 1 8.238 0.0 A 154 GLU HA H 1 4.276 0.0 A 154 GLU HBy H 1 2.009 0.0 A 154 GLU HBx H 1 1.889 0.0 A 154 GLU HGx H 1 2.231 0.0 A 154 GLU HGy H 1 2.231 0.0 A 154 GLU C C 13 176.268 0.0 A 154 GLU CA C 13 56.351 0.0 A 154 GLU CB C 13 30.197 0.0 A 154 GLU CG C 13 36.385 0.0 A 154 GLU N N 15 120.36 0.0 A 155 ASP H H 1 8.419 0.0 A 155 ASP HA H 1 4.642 0.0 A 155 ASP HBx H 1 2.728 0.0 A 155 ASP HBy H 1 2.728 0.0 A 155 ASP C C 13 176.057 0.0 A 155 ASP CA C 13 53.405 0.0 A 155 ASP CB C 13 40.042 0.0 A 155 ASP N N 15 121.317 0.0 A 156 ASP H H 1 8.279 0.0 A 156 ASP HA H 1 4.539 0.0 A 156 ASP HBx H 1 2.671 0.0 A 156 ASP HBy H 1 2.677 0.0 A 156 ASP C C 13 177.217 0.0 A 156 ASP CA C 13 53.819 0.0 A 156 ASP CB C 13 41.167 0.0 A 156 ASP N N 15 121.738 0.0 A 157 GLY H H 1 8.491 0.0 A 157 GLY HAx H 1 3.98 0.0 A 157 GLY HAy H 1 3.98 0.0 A 157 GLY C C 13 174.888 0.0 A 157 GLY CA C 13 45.387 0.0 A 157 GLY N N 15 109.574 0.0 A 158 SER H H 1 8.232 0.0 A 158 SER HA H 1 4.435 0.0 A 158 SER HBx H 1 3.841 0.0 A 158 SER HBy H 1 3.841 0.0 A 158 SER C C 13 175.212 0.0 A 158 SER CA C 13 58.602 0.0 A 158 SER CB C 13 63.665 0.0 A 158 SER N N 15 115.977 0.0 A 159 THR H H 1 8.204 0.0 A 159 THR HA H 1 4.321 0.0 A 159 THR HB H 1 4.21 0.0 A 159 THR HG2% H 1 1.174 0.0 A 159 THR C C 13 175.22 0.0 A 159 THR CA C 13 61.696 0.0 A 159 THR CB C 13 69.572 0.0 A 159 THR CG2 C 13 21.476 0.0 A 159 THR N N 15 115.021 0.0 A 160 GLY H H 1 8.324 0.0 A 160 GLY C C 13 174.206 0.0 A 160 GLY N N 15 111.108 0.0 A 161 GLY H H 1 8.293 0.0 A 161 GLY C C 13 171.673 0.0 A 161 GLY N N 15 111.064 0.0 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 21 THR HB A 21 THR HG2% 1.0 1.5 2.7 2 2 A 21 THR HG2% A 21 THR HA 1.0 1.5 2.5 3 3 A 21 THR HG2% A 93 THR HA 1.0 2.0 5.8 4 4 A 21 THR HG2% A 24 VAL H 1.0 1.9 4.3 5 5 A 21 THR HG2% A 21 THR H 1.0 2.0 6.0 6 6 A 23 SER HBy A 23 SER HA 1.0 1.7 3.1 7 7 A 23 SER HBx A 23 SER HBy 1.0 1.3 2.2 8 8 A 23 SER HBx A 24 VAL HA 1.0 2.0 5.2 9 9 A 23 SER HBx A 23 SER HA 1.0 1.7 3.3 10 10 A 23 SER HBx A 24 VAL HB 1.0 2.0 6.0 11 11 A 23 SER HBy A 24 VAL HB 1.0 1.9 5.1 12 12 A 24 VAL HA A 24 VAL HGy% 1.0 1.7 3.1 13 13 A 24 VAL HB A 24 VAL HGy% 1.0 1.5 2.7 14 14 A 24 VAL HA A 24 VAL HB 1.0 1.7 3.3 15 15 A 24 VAL HB A 24 VAL HGx% 1.0 1.5 2.5 16 16 A 24 VAL HGy% A 24 VAL HGx% 1.0 1.4 2.2 17 17 A 24 VAL HA A 24 VAL HGx% 1.0 1.7 3.1 18 18 A 24 VAL H A 23 SER HA 1.0 1.6 2.8 19 19 A 24 VAL H A 24 VAL HA 1.0 1.8 3.8 20 20 A 24 VAL H A 23 SER HBy 1.0 2.0 5.4 21 21 A 24 VAL H A 24 VAL HB 1.0 1.7 2.9 22 22 A 24 VAL H A 24 VAL HGy% 1.0 1.9 4.5 23 23 A 24 VAL HA A 141 LYS HBy 1.0 2.0 6.0 24 24 A 116 LEU HDy% A 24 VAL HGx% 1.0 1.7 3.1 25 25 A 23 SER HBx A 24 VAL HGx% 1.0 2.0 5.8 26 26 A 24 VAL HGx% A 117 ASN HA 1.0 2.0 5.8 27 27 A 24 VAL H A 24 VAL HGx% 1.0 1.5 2.7 28 28 A 24 VAL HA A 25 PHE H 1.0 1.6 2.8 29 29 A 24 VAL HGx% A 25 PHE HBx 1.0 2.0 6.0 30 30 A 25 PHE HA A 25 PHE HBy 1.0 1.8 3.8 31 31 A 25 PHE HBx A 25 PHE HA 1.0 1.9 3.9 32 32 A 25 PHE HBx A 25 PHE HBy 1.0 1.6 2.6 33 33 A 24 VAL HB A 25 PHE H 1.0 2.0 5.4 34 34 A 25 PHE HA A 25 PHE HD% 1.0 1.7 3.5 35 35 A 25 PHE HBy A 93 THR HB 1.0 2.0 6.0 36 36 A 25 PHE HBx A 25 PHE HD% 1.0 1.6 3.0 37 37 A 25 PHE HA A 25 PHE HE% 1.0 1.9 6.0 38 38 A 25 PHE H A 25 PHE HBy 1.0 1.9 4.1 39 39 A 25 PHE HBy A 26 ARG H 1.0 2.0 6.0 40 40 A 25 PHE HBy A 25 PHE HD% 1.0 1.9 3.7 41 41 A 25 PHE HD% A 141 LYS HEx 1.0 1.9 4.7 42 42 A 25 PHE H A 25 PHE HA 1.0 1.8 3.4 43 43 A 25 PHE H A 25 PHE HBx 1.0 1.9 4.1 44 44 A 26 ARG HE A 26 ARG HA 1.0 0.0 6.0 45 45 A 25 PHE H A 26 ARG H 1.0 2.0 5.2 46 46 A 25 PHE HD% A 26 ARG H 1.0 1.8 3.8 47 47 A 25 PHE HA A 26 ARG H 1.0 1.7 3.1 48 48 A 26 ARG HBx A 26 ARG HGx 1.0 1.6 3.0 49 49 A 26 ARG HA A 26 ARG HBy 1.0 1.8 4.0 50 50 A 26 ARG HA A 26 ARG HBx 1.0 1.9 4.3 51 51 A 26 ARG HGy A 32 GLU HBy 1.0 1.9 4.5 52 52 A 26 ARG HBx A 26 ARG HGy 1.0 1.8 4.0 53 53 A 26 ARG HGx A 26 ARG HGy 1.0 1.5 2.7 54 54 A 26 ARG HGx A 26 ARG HBy 1.0 1.8 4.0 55 55 A 26 ARG HGx A 26 ARG HDy 1.0 1.7 3.3 56 56 A 26 ARG HGy A 26 ARG HDy 1.0 1.8 3.4 57 57 A 26 ARG HBx A 27 ALA H 1.0 1.7 3.5 58 58 A 27 ALA HB% A 27 ALA HA 1.0 1.5 2.3 59 59 A 27 ALA H A 27 ALA HA 1.0 1.7 3.1 60 60 A 26 ARG HA A 27 ALA H 1.0 1.9 4.7 61 61 A 27 ALA H A 27 ALA HB% 1.0 1.6 2.8 62 62 A 26 ARG HBx A 27 ALA HB% 1.0 1.9 4.9 63 63 A 27 ALA HB% A 138 GLN HGy 1.0 2.0 5.2 64 64 A 27 ALA HB% A 29 PHE HD% 1.0 1.7 3.1 65 65 A 27 ALA HB% A 141 LYS HBx 1.0 1.7 3.3 66 66 A 27 ALA HB% A 29 PHE HE% 1.0 1.6 3.0 67 67 A 27 ALA HB% A 138 GLN HE2y 1.0 1.9 4.5 68 68 A 27 ALA HB% A 29 PHE HBy 1.0 2.0 5.8 69 69 A 27 ALA HA A 28 ASP HA 1.0 1.9 4.7 70 70 A 28 ASP HA A 28 ASP HBx 1.0 1.6 3.0 71 71 A 28 ASP HBx A 28 ASP HBy 1.0 1.3 2.2 72 72 A 28 ASP HBx A 120 TYR HBx 1.0 0.0 6.0 73 73 A 28 ASP HA A 28 ASP HBy 1.0 1.6 2.8 74 74 A 28 ASP HA A 29 PHE H 1.0 1.4 2.4 75 75 A 28 ASP HBx A 28 ASP H 1.0 1.7 3.3 76 76 A 28 ASP HBy A 28 ASP H 1.0 1.6 2.8 77 77 A 27 ALA HA A 28 ASP H 1.0 1.5 2.3 78 78 A 27 ALA HB% A 28 ASP H 1.0 1.7 2.9 79 79 A 29 PHE HBy A 29 PHE HA 1.0 1.7 3.5 80 80 A 29 PHE HBy A 29 PHE HBx 1.0 1.4 2.2 81 81 A 29 PHE HD% A 29 PHE HBx 1.0 1.7 3.3 82 82 A 29 PHE HD% A 29 PHE HBy 1.0 1.7 3.3 83 83 A 29 PHE HBx A 30 LEU H 1.0 1.8 3.6 84 84 A 29 PHE HBy A 30 LEU H 1.0 1.5 2.7 85 85 A 29 PHE HBx A 30 LEU HBx 1.0 2.0 5.6 86 86 A 29 PHE HBy A 30 LEU HBx 1.0 1.9 6.0 87 87 A 29 PHE HD% A 29 PHE HZ 1.0 1.9 4.9 88 88 A 29 PHE HE% A 138 GLN HE2x 1.0 2.0 6.0 89 89 A 29 PHE H A 29 PHE HBx 1.0 1.9 4.1 90 90 A 29 PHE HD% A 29 PHE H 1.0 1.9 4.3 91 91 A 29 PHE HE% A 29 PHE HZ 1.0 1.6 3.0 92 92 A 29 PHE HZ A 117 ASN HBx 1.0 2.0 5.8 93 93 A 27 ALA HB% A 29 PHE HZ 1.0 2.0 6.0 94 94 A 29 PHE HD% A 29 PHE HA 1.0 1.7 3.5 95 95 A 30 LEU HBx A 30 LEU HA 1.0 1.9 4.1 96 96 A 30 LEU HBx A 30 LEU HBy 1.0 1.3 2.2 97 97 A 30 LEU HA A 30 LEU HBy 1.0 1.8 4.0 98 98 A 30 LEU HBx A 30 LEU HDx% 1.0 1.9 4.3 99 99 A 30 LEU HA A 30 LEU HDy% 1.0 2.0 5.4 100 100 A 30 LEU HBx A 30 LEU HDy% 1.0 1.8 3.4 101 101 A 30 LEU H A 30 LEU HBx 1.0 1.6 2.8 102 102 A 31 SER H A 31 SER HA 1.0 1.6 3.0 103 103 A 31 SER H A 30 LEU HG 1.0 1.8 4.0 104 104 A 30 LEU HBx A 31 SER H 1.0 1.9 4.3 105 105 A 31 SER H A 33 LEU HDy% 1.0 1.9 4.3 106 106 A 29 PHE HD% A 31 SER H 1.0 1.9 6.0 107 107 A 29 PHE HBy A 31 SER H 1.0 2.0 6.0 108 108 A 31 SER HA A 31 SER HBx 1.0 1.8 3.6 109 109 A 30 LEU H A 31 SER HA 1.0 0.0 6.0 110 110 A 31 SER HA A 32 GLU H 1.0 1.7 3.5 111 111 A 32 GLU H A 32 GLU HGx 1.0 0.0 6.0 112 112 A 32 GLU HBy A 143 ARG HE 1.0 1.9 4.7 113 113 A 143 ARG HE A 32 GLU HBx 1.0 2.0 5.0 114 114 A 33 LEU HBx A 33 LEU HBy 1.0 1.5 2.3 115 115 A 33 LEU HDy% A 33 LEU HA 1.0 1.9 4.1 116 116 A 33 LEU HBx A 33 LEU HA 1.0 1.6 3.0 117 117 A 33 LEU HBy A 33 LEU HA 1.0 1.6 3.0 118 118 A 33 LEU HBy A 33 LEU HG 1.0 0.0 6.0 119 119 A 33 LEU HA A 33 LEU HDx% 1.0 1.8 4.0 120 120 A 33 LEU HBy A 33 LEU HDx% 1.0 1.4 2.2 121 121 A 33 LEU HBx A 33 LEU HDx% 1.0 1.6 2.8 122 122 A 33 LEU HDy% A 33 LEU HDx% 1.0 1.5 2.5 123 123 A 33 LEU HDy% A 33 LEU HBy 1.0 1.6 3.0 124 124 A 33 LEU HDy% A 33 LEU HG 1.0 1.4 2.2 125 125 A 33 LEU HDy% A 33 LEU HBx 1.0 1.4 2.2 126 126 A 29 PHE HD% A 33 LEU HDx% 1.0 2.0 5.0 127 127 A 33 LEU HDy% A 123 ARG H 1.0 1.9 5.5 128 128 A 33 LEU HG A 33 LEU H 1.0 1.5 2.5 129 129 A 26 ARG HE A 33 LEU HG 1.0 2.0 5.8 130 130 A 33 LEU HDx% A 34 ASP H 1.0 1.9 3.9 131 131 A 31 SER HBx A 33 LEU HDx% 1.0 0.0 6.0 132 132 A 138 GLN HGy A 33 LEU HDx% 1.0 2.0 6.0 133 133 A 33 LEU HA A 33 LEU H 1.0 1.7 3.1 134 134 A 33 LEU HA A 34 ASP H 1.0 1.7 3.3 135 135 A 34 ASP H A 34 ASP HA 1.0 1.6 3.0 136 136 A 33 LEU HG A 34 ASP H 1.0 1.6 3.0 137 137 A 33 LEU HDy% A 34 ASP H 1.0 2.0 5.2 138 138 A 48 VAL H A 47 GLY H 1.0 1.7 3.1 139 139 A 48 VAL HB A 48 VAL HA 1.0 1.6 2.8 140 140 A 47 GLY H A 48 VAL HA 1.0 1.9 4.5 141 141 A 49 GLU H A 51 LEU HBy 1.0 2.0 5.4 142 142 A 49 GLU HA A 49 GLU HBy 1.0 1.7 3.1 143 143 A 49 GLU HA A 49 GLU HBx 1.0 1.6 2.6 144 144 A 48 VAL HA A 49 GLU H 1.0 1.7 2.9 145 145 A 48 VAL H A 49 GLU H 1.0 1.7 3.3 146 146 A 49 GLU H A 49 GLU HBx 1.0 0.0 6.0 147 147 A 49 GLU HA A 51 LEU H 1.0 2.0 5.2 148 148 A 49 GLU HA A 50 GLY H 1.0 0.0 6.0 149 149 A 49 GLU H A 50 GLY H 1.0 1.8 3.4 150 150 A 48 VAL HA A 50 GLY H 1.0 0.0 6.0 151 151 A 49 GLU HBx A 50 GLY H 1.0 1.8 3.8 152 152 A 51 LEU HA A 51 LEU HBx 1.0 1.6 3.0 153 153 A 51 LEU HBx A 51 LEU HG 1.0 1.7 3.3 154 154 A 51 LEU HG A 51 LEU HDx% 1.0 1.5 2.5 155 155 A 51 LEU HG A 51 LEU HDy% 1.0 1.6 2.8 156 156 A 49 GLU H A 51 LEU H 1.0 2.0 5.6 157 157 A 51 LEU H A 51 LEU HA 1.0 1.7 3.1 158 158 A 51 LEU H A 53 PRO HDy 1.0 0.0 6.0 159 159 A 51 LEU HBy A 51 LEU H 1.0 1.5 2.5 160 160 A 51 LEU HDx% A 53 PRO HDy 1.0 1.8 3.6 161 161 A 51 LEU HA A 53 PRO HDy 1.0 1.7 3.3 162 162 A 51 LEU HDy% A 53 PRO HDx 1.0 2.0 4.8 163 163 A 51 LEU HG A 148 THR HG1 1.0 2.0 5.4 164 164 A 51 LEU H A 51 LEU HG 1.0 1.8 3.4 165 165 A 50 GLY H A 51 LEU HG 1.0 2.0 6.0 166 166 A 51 LEU H A 51 LEU HDx% 1.0 0.0 6.0 167 167 A 51 LEU H A 51 LEU HDy% 1.0 1.8 4.0 168 168 A 52 PRO HDy A 52 PRO HDx 1.0 1.5 2.5 169 169 A 52 PRO HDy A 149 GLY H 1.0 1.8 3.8 170 170 A 51 LEU H A 52 PRO HDy 1.0 2.0 6.0 171 171 A 51 LEU H A 52 PRO HDx 1.0 1.9 5.5 172 172 A 53 PRO HDx A 53 PRO HA 1.0 1.8 4.0 173 173 A 53 PRO HA A 53 PRO HBy 1.0 1.8 3.6 174 174 A 53 PRO HA A 53 PRO HGy 1.0 2.0 5.4 175 175 A 53 PRO HA A 53 PRO HGx 1.0 1.8 4.0 176 176 A 53 PRO HA A 53 PRO HBx 1.0 1.7 3.1 177 177 A 53 PRO HGy A 53 PRO HBx 1.0 1.6 3.0 178 178 A 53 PRO HBy A 53 PRO HGy 1.0 1.6 2.8 179 179 A 53 PRO HDy A 53 PRO HBy 1.0 2.0 5.0 180 180 A 53 PRO HDy A 53 PRO HGx 1.0 1.9 3.9 181 181 A 53 PRO HDx A 53 PRO HGx 1.0 1.6 3.0 182 182 A 53 PRO HBy A 53 PRO HGx 1.0 1.7 3.5 183 183 A 53 PRO HGy A 53 PRO HGx 1.0 1.3 2.2 184 184 A 53 PRO HGx A 53 PRO HBx 1.0 1.5 2.5 185 185 A 53 PRO HDy A 53 PRO HGy 1.0 1.7 3.1 186 186 A 53 PRO HDx A 53 PRO HBy 1.0 1.9 4.5 187 187 A 53 PRO HDx A 53 PRO HGy 1.0 1.8 3.8 188 188 A 53 PRO HDy A 53 PRO HDx 1.0 1.4 2.2 189 189 A 53 PRO HDy A 53 PRO HBx 1.0 2.0 4.6 190 190 A 51 LEU HBy A 53 PRO HDy 1.0 1.9 4.3 191 191 A 51 LEU HBy A 53 PRO HDx 1.0 1.8 4.0 192 192 A 53 PRO HA A 54 GLY H 1.0 1.6 2.8 193 193 A 54 GLY H A 54 GLY HAx 1.0 1.7 3.3 194 194 A 54 GLY H A 54 GLY HAy 1.0 1.8 3.4 195 195 A 53 PRO HBy A 54 GLY H 1.0 1.9 4.5 196 196 A 53 PRO HBx A 54 GLY H 1.0 1.9 4.7 197 197 A 54 GLY HAx A 54 GLY HAy 1.0 1.5 2.3 198 198 A 54 GLY HAx A 55 SER H 1.0 1.9 5.1 199 199 A 54 GLY HAy A 55 SER H 1.0 1.9 4.1 200 200 A 54 GLY H A 55 SER H 1.0 1.7 3.1 201 201 A 55 SER H A 55 SER HA 1.0 1.7 3.5 202 202 A 55 SER HA A 55 SER HBy 1.0 1.9 4.1 203 203 A 55 SER HA A 73 ASP HA 1.0 2.0 4.6 204 204 A 55 SER HA A 108 PHE HD% 1.0 2.0 5.6 205 205 A 55 SER HBy A 73 ASP HA 1.0 2.0 6.0 206 206 A 73 ASP HA A 55 SER HBx 1.0 1.9 4.5 207 207 A 55 SER H A 55 SER HBy 1.0 2.0 4.6 208 208 A 54 GLY H A 55 SER HBy 1.0 2.0 6.0 209 209 A 55 SER HA A 73 ASP H 1.0 0.0 6.0 210 210 A 55 SER HA A 55 SER HBx 1.0 1.8 3.4 211 211 A 55 SER HBy A 55 SER HBx 1.0 1.5 2.3 212 212 A 56 ALA HB% A 56 ALA HA 1.0 1.7 2.9 213 213 A 108 PHE HD% A 56 ALA H 1.0 2.0 6.0 214 214 A 55 SER HA A 56 ALA H 1.0 1.7 3.1 215 215 A 55 SER HBx A 56 ALA H 1.0 1.8 3.8 216 216 A 56 ALA H A 72 LEU HBy 1.0 1.8 3.4 217 217 A 56 ALA H A 72 LEU HBx 1.0 1.9 5.5 218 218 A 56 ALA H A 72 LEU HDy% 1.0 2.0 6.0 219 219 A 108 PHE HD% A 56 ALA HB% 1.0 1.7 3.3 220 220 A 56 ALA HB% A 56 ALA H 1.0 1.8 3.4 221 221 A 56 ALA HB% A 148 THR H 1.0 2.0 5.2 222 222 A 57 LEU HA A 57 LEU HBy 1.0 1.8 3.6 223 223 A 57 LEU HBy A 57 LEU HBx 1.0 1.4 2.2 224 224 A 57 LEU HA A 57 LEU HBx 1.0 1.7 3.1 225 225 A 57 LEU HA A 72 LEU H 1.0 2.0 4.6 226 226 A 57 LEU HA A 71 LEU HA 1.0 2.0 5.4 227 227 A 57 LEU HBy A 57 LEU H 1.0 1.8 3.6 228 228 A 57 LEU HBx A 57 LEU H 1.0 1.9 4.1 229 229 A 57 LEU HBx A 71 LEU HA 1.0 1.9 4.3 230 230 A 57 LEU HA A 57 LEU H 1.0 1.8 3.8 231 231 A 56 ALA HB% A 57 LEU H 1.0 1.7 3.1 232 232 A 72 LEU HDy% A 57 LEU H 1.0 2.0 5.6 233 233 A 58 LEU HA A 58 LEU HBx 1.0 1.7 3.5 234 234 A 58 LEU HDy% A 87 ILE HG2% 1.0 0.0 6.0 235 235 A 58 LEU HDy% A 70 PHE HE% 1.0 1.9 4.1 236 236 A 58 LEU HDy% A 59 VAL H 1.0 2.0 5.8 237 237 A 58 LEU HBx A 58 LEU HBy 1.0 1.6 2.6 238 238 A 58 LEU HBy A 58 LEU HG 1.0 1.7 3.5 239 239 A 58 LEU HBx A 58 LEU HG 1.0 1.6 3.0 240 240 A 58 LEU HBx A 58 LEU HDx% 1.0 1.9 4.3 241 241 A 58 LEU HDy% A 58 LEU HBy 1.0 1.8 3.6 242 242 A 58 LEU HDy% A 58 LEU HG 1.0 1.5 2.5 243 243 A 58 LEU HBx A 58 LEU HDy% 1.0 1.6 2.8 244 244 A 58 LEU HDy% A 58 LEU HDx% 1.0 1.7 2.9 245 245 A 58 LEU HA A 58 LEU HDy% 1.0 1.9 4.9 246 246 A 58 LEU HBx A 58 LEU H 1.0 2.0 5.0 247 247 A 58 LEU HDy% A 58 LEU H 1.0 2.0 5.2 248 248 A 58 LEU HA A 145 VAL H 1.0 2.0 5.6 249 249 A 58 LEU HG A 58 LEU HDx% 1.0 1.5 2.7 250 250 A 58 LEU HBy A 146 PHE HBx 1.0 2.0 5.6 251 251 A 58 LEU HBy A 101 PHE HBy 1.0 2.0 6.0 252 252 A 57 LEU HA A 58 LEU HBy 1.0 2.0 6.0 253 253 A 58 LEU HA A 58 LEU HBy 1.0 1.9 4.3 254 254 A 70 PHE HE% A 58 LEU HBy 1.0 1.9 4.3 255 255 A 59 VAL H A 58 LEU HBy 1.0 2.0 6.0 256 256 A 58 LEU HBy A 70 PHE H 1.0 1.9 4.7 257 257 A 58 LEU HBx A 146 PHE HBx 1.0 1.9 4.7 258 258 A 57 LEU HA A 58 LEU HBx 1.0 1.9 6.0 259 259 A 58 LEU HBx A 70 PHE HE% 1.0 1.9 4.9 260 260 A 58 LEU HBy A 58 LEU HDx% 1.0 1.7 3.3 261 261 A 58 LEU HA A 58 LEU HG 1.0 2.0 5.2 262 262 A 58 LEU HG A 70 PHE HD% 1.0 2.0 6.0 263 263 A 58 LEU HDx% A 70 PHE HD% 1.0 1.7 3.5 264 264 A 58 LEU HA A 58 LEU H 1.0 1.9 4.1 265 265 A 57 LEU HA A 58 LEU H 1.0 1.6 2.8 266 266 A 58 LEU HBy A 58 LEU H 1.0 1.8 3.6 267 267 A 58 LEU HG A 58 LEU H 1.0 1.8 3.4 268 268 A 59 VAL H A 59 VAL HA 1.0 1.9 4.3 269 269 A 59 VAL H A 59 VAL HB 1.0 1.7 3.3 270 270 A 59 VAL H A 145 VAL H 1.0 1.8 3.8 271 271 A 58 LEU HA A 59 VAL H 1.0 1.7 2.9 272 272 A 59 VAL H A 146 PHE HA 1.0 2.0 4.8 273 273 A 58 LEU HBx A 59 VAL H 1.0 1.9 4.5 274 274 A 59 VAL HA A 59 VAL HB 1.0 1.8 3.8 275 275 A 60 VAL HA A 144 LEU HA 1.0 1.5 2.7 276 276 A 60 VAL HA A 60 VAL H 1.0 1.9 3.9 277 277 A 59 VAL HA A 60 VAL H 1.0 1.7 3.1 278 278 A 60 VAL H A 60 VAL HB 1.0 1.9 4.5 279 279 A 59 VAL HA A 60 VAL HGx% 1.0 2.0 5.8 280 280 A 60 VAL HGx% A 69 ARG HE 1.0 0.0 6.0 281 281 A 60 VAL H A 60 VAL HGx% 1.0 1.6 2.8 282 282 A 60 VAL H A 60 VAL HGy% 1.0 1.6 2.8 283 283 A 60 VAL HGy% A 89 LEU HDy% 1.0 1.9 4.5 284 284 A 60 VAL HA A 61 LYS H 1.0 1.6 3.0 285 285 A 60 VAL HGx% A 67 GLY H 1.0 2.0 5.8 286 286 A 60 VAL HGx% A 68 SER H 1.0 1.8 4.2 287 287 A 60 VAL HGy% A 65 ASN HD2x 1.0 2.0 5.4 288 288 A 60 VAL HA A 60 VAL HB 1.0 1.8 3.8 289 289 A 60 VAL HB A 60 VAL HGx% 1.0 1.7 2.9 290 290 A 60 VAL HA A 60 VAL HGx% 1.0 1.7 3.5 291 291 A 60 VAL HB A 60 VAL HGy% 1.0 1.5 2.5 292 292 A 61 LYS HBy A 61 LYS HBx 1.0 1.4 2.2 293 293 A 61 LYS HBx A 61 LYS HA 1.0 1.9 4.1 294 294 A 61 LYS HGy A 61 LYS HGx 1.0 1.3 2.2 295 295 A 60 VAL H A 61 LYS H 1.0 1.9 6.0 296 296 A 61 LYS HDy A 61 LYS HDx 1.0 1.4 2.2 297 297 A 61 LYS HBx A 61 LYS HDx 1.0 1.8 3.4 298 298 A 61 LYS HBy A 61 LYS HDx 1.0 1.7 3.3 299 299 A 61 LYS HA A 61 LYS HDx 1.0 2.0 5.0 300 300 A 61 LYS HEx A 61 LYS HEy 1.0 1.5 2.5 301 301 A 144 LEU HA A 61 LYS H 1.0 1.9 5.3 302 302 A 61 LYS HBx A 145 VAL HGx% 1.0 2.0 5.2 303 303 A 61 LYS HA A 145 VAL HGx% 1.0 1.7 3.5 304 304 A 61 LYS HBx A 62 ARG H 1.0 1.8 3.4 305 305 A 61 LYS H A 61 LYS HBx 1.0 1.9 3.9 306 306 A 61 LYS HBy A 62 ARG H 1.0 2.0 6.0 307 307 A 61 LYS H A 61 LYS HBy 1.0 1.9 4.5 308 308 A 61 LYS HDy A 62 ARG H 1.0 1.9 6.0 309 309 A 61 LYS H A 61 LYS HDy 1.0 1.9 6.0 310 310 A 61 LYS HA A 61 LYS HDy 1.0 2.0 4.8 311 311 A 61 LYS HA A 62 ARG H 1.0 1.9 4.5 312 312 A 61 LYS H A 61 LYS HA 1.0 1.8 3.6 313 313 A 61 LYS H A 62 ARG H 1.0 1.8 3.6 314 314 A 62 ARG H A 62 ARG HA 1.0 1.9 3.9 315 315 A 62 ARG H A 66 ALA HB% 1.0 2.0 6.0 316 316 A 62 ARG H A 143 ARG H 1.0 1.9 4.3 317 317 A 62 ARG H A 63 GLY H 1.0 1.9 4.1 318 318 A 62 ARG H A 66 ALA HA 1.0 2.0 5.6 319 319 A 62 ARG HA A 62 ARG HGx 1.0 2.0 4.4 320 320 A 67 GLY H A 62 ARG HGx 1.0 2.0 5.8 321 321 A 62 ARG HA A 62 ARG HGy 1.0 1.5 2.7 322 322 A 63 GLY H A 65 ASN HA 1.0 0.0 6.0 323 323 A 63 GLY H A 63 GLY HAy 1.0 1.7 3.1 324 324 A 63 GLY H A 64 PRO HDy 1.0 2.0 4.8 325 325 A 63 GLY H A 64 PRO HDx 1.0 1.9 5.7 326 326 A 66 ALA HB% A 63 GLY H 1.0 1.8 3.4 327 327 A 26 ARG HGx A 63 GLY H 1.0 2.0 6.0 328 328 A 62 ARG HA A 63 GLY H 1.0 1.7 3.1 329 329 A 63 GLY H A 63 GLY HAx 1.0 1.8 4.0 330 330 A 63 GLY HAy A 63 GLY HAx 1.0 1.5 2.7 331 331 A 64 PRO HDx A 64 PRO HA 1.0 1.9 4.1 332 332 A 64 PRO HA A 64 PRO HBy 1.0 1.7 3.1 333 333 A 64 PRO HA A 64 PRO HBx 1.0 1.6 2.6 334 334 A 64 PRO HA A 64 PRO HGy 1.0 1.8 4.0 335 335 A 64 PRO HA A 64 PRO HGx 1.0 1.8 3.8 336 336 A 64 PRO HBy A 64 PRO HBx 1.0 1.4 2.2 337 337 A 64 PRO HBx A 64 PRO HGx 1.0 1.6 2.8 338 338 A 64 PRO HBy A 64 PRO HGy 1.0 1.4 2.2 339 339 A 64 PRO HBx A 64 PRO HGy 1.0 1.7 3.1 340 340 A 64 PRO HGy A 64 PRO HGx 1.0 1.4 2.2 341 341 A 64 PRO HBy A 64 PRO HGx 1.0 1.7 3.5 342 342 A 64 PRO HDx A 64 PRO HBy 1.0 1.9 4.3 343 343 A 64 PRO HDx A 64 PRO HGy 1.0 1.9 4.1 344 344 A 64 PRO HDx A 64 PRO HGx 1.0 1.6 3.0 345 345 A 64 PRO HDy A 64 PRO HDx 1.0 1.5 2.3 346 346 A 64 PRO HDy A 64 PRO HBy 1.0 1.8 3.4 347 347 A 64 PRO HDy A 64 PRO HBx 1.0 1.9 4.5 348 348 A 64 PRO HDy A 64 PRO HGy 1.0 1.6 2.8 349 349 A 64 PRO HDy A 64 PRO HGx 1.0 1.8 4.0 350 350 A 26 ARG HGx A 64 PRO HBx 1.0 1.9 4.7 351 351 A 64 PRO HBx A 141 LYS HEy 1.0 1.7 3.3 352 352 A 26 ARG HGx A 64 PRO HA 1.0 1.9 4.3 353 353 A 64 PRO HA A 142 PHE HA 1.0 2.0 5.6 354 354 A 64 PRO HGx A 142 PHE HE% 1.0 1.9 6.0 355 355 A 63 GLY HAy A 64 PRO HDy 1.0 1.8 3.6 356 356 A 63 GLY HAy A 64 PRO HDx 1.0 1.6 2.8 357 357 A 64 PRO HDx A 63 GLY HAx 1.0 1.9 4.5 358 358 A 64 PRO HGy A 65 ASN H 1.0 2.0 5.2 359 359 A 64 PRO HDy A 142 PHE HE% 1.0 2.0 5.6 360 360 A 64 PRO HA A 66 ALA H 1.0 1.9 4.5 361 361 A 64 PRO HA A 65 ASN H 1.0 0.0 6.0 362 362 A 64 PRO HBx A 65 ASN H 1.0 2.0 5.2 363 363 A 64 PRO HDx A 64 PRO HBx 1.0 1.9 4.7 364 364 A 65 ASN H A 66 ALA H 1.0 1.5 2.5 365 365 A 65 ASN H A 141 LYS H 1.0 0.7 6.0 366 366 A 65 ASN H A 65 ASN HBy 1.0 1.7 3.3 367 367 A 65 ASN HD2x A 65 ASN HD2y 1.0 1.4 2.2 368 368 A 65 ASN HD2x A 142 PHE HD% 1.0 1.9 6.0 369 369 A 65 ASN HD2y A 142 PHE HD% 1.0 2.0 5.4 370 370 A 65 ASN HA A 65 ASN HD2y 1.0 2.0 6.0 371 371 A 65 ASN HD2y A 68 SER HBx 1.0 2.0 5.4 372 372 A 65 ASN HBy A 65 ASN HD2y 1.0 1.8 3.6 373 373 A 65 ASN HD2y A 65 ASN HBx 1.0 1.7 3.1 374 374 A 65 ASN HD2x A 88 PHE HBy 1.0 1.9 4.7 375 375 A 65 ASN HA A 65 ASN HBy 1.0 1.6 2.8 376 376 A 65 ASN HBy A 65 ASN HBx 1.0 1.3 2.2 377 377 A 66 ALA HA A 65 ASN HBx 1.0 2.0 5.2 378 378 A 65 ASN HD2x A 65 ASN HBy 1.0 1.9 5.3 379 379 A 65 ASN HD2x A 65 ASN HBx 1.0 2.0 5.8 380 380 A 66 ALA H A 65 ASN HBy 1.0 2.0 5.4 381 381 A 65 ASN HBx A 93 THR HG2% 1.0 1.8 6.0 382 382 A 66 ALA HB% A 66 ALA HA 1.0 1.5 2.5 383 383 A 60 VAL HB A 66 ALA HA 1.0 1.8 3.8 384 384 A 60 VAL HGy% A 66 ALA HA 1.0 0.0 6.0 385 385 A 60 VAL HB A 66 ALA HB% 1.0 2.0 5.2 386 386 A 66 ALA HB% A 64 PRO HDx 1.0 0.0 6.0 387 387 A 66 ALA HB% A 63 GLY HAx 1.0 1.8 4.0 388 388 A 66 ALA HB% A 65 ASN HA 1.0 0.0 6.0 389 389 A 66 ALA HB% A 67 GLY HAx 1.0 1.9 5.1 390 390 A 67 GLY H A 66 ALA H 1.0 2.0 5.4 391 391 A 66 ALA HA A 66 ALA H 1.0 1.6 2.8 392 392 A 66 ALA H A 65 ASN HBx 1.0 1.9 3.7 393 393 A 60 VAL HB A 66 ALA H 1.0 2.0 4.8 394 394 A 66 ALA H A 93 THR HG2% 1.0 2.0 5.8 395 395 A 68 SER H A 66 ALA HA 1.0 2.0 6.0 396 396 A 66 ALA HB% A 66 ALA H 1.0 1.6 2.8 397 397 A 67 GLY H A 67 GLY HAx 1.0 1.8 3.4 398 398 A 67 GLY H A 66 ALA HA 1.0 1.6 2.8 399 399 A 67 GLY H A 67 GLY HAy 1.0 1.9 4.3 400 400 A 60 VAL HB A 67 GLY H 1.0 2.0 5.0 401 401 A 67 GLY H A 66 ALA HB% 1.0 1.9 4.3 402 402 A 67 GLY HAx A 67 GLY HAy 1.0 1.5 2.5 403 403 A 67 GLY HAx A 59 VAL HGx% 1.0 1.9 4.7 404 404 A 68 SER H A 67 GLY HAy 1.0 2.0 4.6 405 405 A 67 GLY H A 68 SER H 1.0 1.8 3.8 406 406 A 68 SER H A 67 GLY HAx 1.0 1.9 4.1 407 407 A 68 SER H A 68 SER HA 1.0 1.7 3.1 408 408 A 68 SER H A 68 SER HBy 1.0 1.5 2.7 409 409 A 68 SER H A 142 PHE HBy 1.0 0.0 6.0 410 410 A 60 VAL HB A 68 SER H 1.0 1.9 5.3 411 411 A 60 VAL HGy% A 68 SER H 1.0 1.4 2.4 412 412 A 60 VAL H A 68 SER H 1.0 1.9 4.5 413 413 A 68 SER H A 66 ALA H 1.0 1.9 6.0 414 414 A 68 SER H A 142 PHE HD% 1.0 1.8 6.0 415 415 A 68 SER H A 65 ASN HBy 1.0 2.0 6.0 416 416 A 68 SER HBx A 68 SER HBy 1.0 1.5 2.3 417 417 A 68 SER HA A 68 SER HBy 1.0 1.8 3.4 418 418 A 68 SER HBx A 68 SER HA 1.0 1.7 3.3 419 419 A 68 SER HA A 69 ARG HA 1.0 1.9 4.7 420 420 A 59 VAL HA A 69 ARG H 1.0 1.9 6.0 421 421 A 69 ARG HE A 69 ARG HDx 1.0 1.8 4.0 422 422 A 69 ARG HE A 71 LEU HBy 1.0 0.0 6.0 423 423 A 69 ARG HE A 87 ILE HB 1.0 0.0 6.0 424 424 A 69 ARG HE A 70 PHE HA 1.0 2.0 6.0 425 425 A 69 ARG HBy A 69 ARG HBx 1.0 1.3 2.2 426 426 A 69 ARG HGx A 69 ARG HGy 1.0 1.4 2.2 427 427 A 69 ARG HDx A 69 ARG HGx 1.0 1.8 3.6 428 428 A 69 ARG HA A 69 ARG HDy 1.0 2.0 5.0 429 429 A 69 ARG HGx A 69 ARG HDy 1.0 1.6 2.8 430 430 A 59 VAL HA A 69 ARG HA 1.0 1.6 3.0 431 431 A 70 PHE HE% A 69 ARG HA 1.0 2.0 5.2 432 432 A 60 VAL H A 69 ARG HA 1.0 1.9 4.3 433 433 A 68 SER HBy A 69 ARG HDx 1.0 2.0 6.0 434 434 A 59 VAL HA A 69 ARG HDx 1.0 2.0 6.0 435 435 A 69 ARG HE A 69 ARG HDy 1.0 1.7 3.1 436 436 A 69 ARG H A 69 ARG HDy 1.0 1.9 4.3 437 437 A 69 ARG HA A 69 ARG HDx 1.0 2.0 6.0 438 438 A 69 ARG HDx A 88 PHE HD% 1.0 2.0 5.6 439 439 A 69 ARG H A 69 ARG HGx 1.0 1.9 4.3 440 440 A 70 PHE H A 69 ARG H 1.0 1.9 5.5 441 441 A 70 PHE HE% A 69 ARG H 1.0 2.0 6.0 442 442 A 69 ARG HA A 69 ARG H 1.0 1.8 3.6 443 443 A 68 SER HA A 69 ARG H 1.0 1.6 2.8 444 444 A 68 SER HBx A 69 ARG H 1.0 1.7 3.3 445 445 A 69 ARG H A 69 ARG HDx 1.0 2.0 6.0 446 446 A 69 ARG H A 87 ILE HB 1.0 0.0 6.0 447 447 A 70 PHE H A 70 PHE HA 1.0 2.0 5.2 448 448 A 87 ILE HG2% A 70 PHE H 1.0 1.9 6.0 449 449 A 58 LEU HDy% A 70 PHE H 1.0 1.9 6.0 450 450 A 70 PHE HA A 70 PHE HBx 1.0 1.8 4.0 451 451 A 70 PHE HBx A 70 PHE HBy 1.0 1.6 2.8 452 452 A 70 PHE HA A 79 ALA HB% 1.0 2.0 6.0 453 453 A 59 VAL HA A 70 PHE HA 1.0 2.0 6.0 454 454 A 70 PHE HA A 87 ILE H 1.0 2.0 5.4 455 455 A 70 PHE HD% A 70 PHE HA 1.0 1.9 4.5 456 456 A 101 PHE HBy A 70 PHE HD% 1.0 1.9 4.5 457 457 A 70 PHE HD% A 70 PHE HBx 1.0 1.8 3.8 458 458 A 58 LEU H A 70 PHE H 1.0 1.8 3.6 459 459 A 70 PHE HE% A 70 PHE H 1.0 2.0 5.4 460 460 A 70 PHE H A 69 ARG HA 1.0 1.7 2.9 461 461 A 101 PHE HBy A 70 PHE H 1.0 1.8 6.0 462 462 A 87 ILE HG2% A 71 LEU H 1.0 2.0 5.2 463 463 A 71 LEU HA A 71 LEU HBy 1.0 1.7 3.1 464 464 A 71 LEU HA A 71 LEU HBx 1.0 1.9 4.1 465 465 A 71 LEU HBy A 71 LEU HBx 1.0 1.4 2.2 466 466 A 71 LEU HA A 71 LEU HG 1.0 1.7 3.5 467 467 A 71 LEU HBy A 71 LEU HG 1.0 1.6 2.6 468 468 A 71 LEU HBy A 71 LEU HDx% 1.0 1.6 2.8 469 469 A 71 LEU HA A 71 LEU HDy% 1.0 1.8 3.6 470 470 A 72 LEU H A 71 LEU HBy 1.0 2.0 6.0 471 471 A 72 LEU H A 71 LEU HBx 1.0 2.0 6.0 472 472 A 70 PHE HA A 71 LEU H 1.0 1.8 3.4 473 473 A 71 LEU HA A 71 LEU H 1.0 1.8 3.6 474 474 A 71 LEU H A 71 LEU HBx 1.0 1.5 2.7 475 475 A 72 LEU H A 71 LEU HDx% 1.0 2.0 6.0 476 476 A 55 SER HBy A 71 LEU HDx% 1.0 1.9 5.1 477 477 A 71 LEU HDx% A 73 ASP HBy 1.0 1.9 4.3 478 478 A 71 LEU HDx% A 73 ASP HBx 1.0 1.9 4.3 479 479 A 71 LEU HDx% A 74 GLN HBx 1.0 2.0 5.4 480 480 A 72 LEU H A 71 LEU HDy% 1.0 1.9 4.1 481 481 A 71 LEU H A 71 LEU HDy% 1.0 1.9 4.1 482 482 A 55 SER HBy A 71 LEU HDy% 1.0 0.0 6.0 483 483 A 71 LEU HDy% A 77 THR HA 1.0 1.9 4.9 484 484 A 55 SER HA A 71 LEU HDy% 1.0 2.0 6.0 485 485 A 55 SER HBx A 71 LEU HDx% 1.0 2.0 5.6 486 486 A 71 LEU HBy A 71 LEU H 1.0 1.9 3.9 487 487 A 71 LEU HG A 73 ASP HBy 1.0 1.8 3.4 488 488 A 55 SER HBy A 71 LEU HG 1.0 2.0 5.6 489 489 A 71 LEU H A 71 LEU HDx% 1.0 2.0 5.2 490 490 A 71 LEU HDy% A 73 ASP HBy 1.0 2.0 5.0 491 491 A 72 LEU H A 72 LEU HA 1.0 1.9 4.5 492 492 A 72 LEU H A 71 LEU HA 1.0 1.7 3.1 493 493 A 72 LEU H A 87 ILE HG2% 1.0 2.0 6.0 494 494 A 72 LEU HBy A 72 LEU HA 1.0 1.9 5.3 495 495 A 72 LEU HBy A 72 LEU HBx 1.0 1.5 2.7 496 496 A 72 LEU HBy A 72 LEU HDx% 1.0 1.9 3.9 497 497 A 72 LEU HBy A 72 LEU HDy% 1.0 1.9 4.5 498 498 A 72 LEU HBx A 72 LEU HDy% 1.0 1.9 3.9 499 499 A 72 LEU HBx A 72 LEU HA 1.0 1.9 4.1 500 500 A 72 LEU HA A 72 LEU HG 1.0 2.0 4.6 501 501 A 72 LEU HBy A 72 LEU HG 1.0 1.7 3.3 502 502 A 72 LEU HDx% A 72 LEU HG 1.0 1.7 3.1 503 503 A 72 LEU HDy% A 72 LEU HG 1.0 1.8 3.4 504 504 A 72 LEU HDy% A 58 LEU HG 1.0 1.9 4.3 505 505 A 72 LEU HA A 72 LEU HDx% 1.0 1.7 3.1 506 506 A 72 LEU HDy% A 72 LEU HDx% 1.0 1.6 2.6 507 507 A 72 LEU H A 72 LEU HG 1.0 1.8 4.2 508 508 A 72 LEU HDy% A 70 PHE HE% 1.0 2.0 6.0 509 509 A 72 LEU HDy% A 58 LEU HDy% 1.0 1.9 4.3 510 510 A 70 PHE HBx A 72 LEU HDx% 1.0 1.9 4.7 511 511 A 70 PHE HBy A 72 LEU HDx% 1.0 1.8 3.6 512 512 A 108 PHE HD% A 72 LEU HDx% 1.0 2.0 4.6 513 513 A 58 LEU H A 72 LEU HDx% 1.0 1.8 3.8 514 514 A 72 LEU H A 72 LEU HDx% 1.0 1.8 3.8 515 515 A 72 LEU HDx% A 101 PHE H 1.0 2.0 6.0 516 516 A 58 LEU HDy% A 72 LEU HDx% 1.0 1.9 4.3 517 517 A 72 LEU HBy A 72 LEU H 1.0 1.9 4.3 518 518 A 73 ASP H A 72 LEU HBx 1.0 2.0 5.0 519 519 A 72 LEU HBx A 72 LEU H 1.0 2.0 6.0 520 520 A 58 LEU H A 72 LEU HG 1.0 2.0 5.4 521 521 A 108 PHE HD% A 72 LEU HG 1.0 2.0 6.0 522 522 A 72 LEU HDy% A 70 PHE HBy 1.0 1.8 4.0 523 523 A 72 LEU HDy% A 72 LEU HA 1.0 2.0 4.6 524 524 A 72 LEU HDy% A 57 LEU HA 1.0 1.9 4.3 525 525 A 108 PHE HD% A 72 LEU HDy% 1.0 1.9 4.3 526 526 A 72 LEU HDy% A 58 LEU H 1.0 1.9 4.5 527 527 A 72 LEU HDy% A 72 LEU H 1.0 1.9 4.1 528 528 A 73 ASP H A 72 LEU HDx% 1.0 1.9 4.3 529 529 A 72 LEU HDx% A 102 ARG H 1.0 2.0 5.8 530 530 A 73 ASP H A 74 GLN HBx 1.0 1.9 6.0 531 531 A 73 ASP H A 74 GLN HA 1.0 2.0 6.0 532 532 A 73 ASP HA A 73 ASP HBy 1.0 1.8 3.6 533 533 A 73 ASP HA A 73 ASP HBx 1.0 1.9 3.9 534 534 A 73 ASP HBy A 73 ASP HBx 1.0 1.5 2.3 535 535 A 71 LEU HG A 73 ASP HBx 1.0 1.9 5.3 536 536 A 73 ASP HA A 108 PHE HD% 1.0 2.0 5.6 537 537 A 73 ASP HA A 72 LEU H 1.0 1.9 5.7 538 538 A 73 ASP HBx A 74 GLN H 1.0 1.9 5.1 539 539 A 73 ASP H A 74 GLN H 1.0 1.7 3.3 540 540 A 73 ASP H A 73 ASP HBx 1.0 1.9 5.1 541 541 A 71 LEU H A 74 GLN H 1.0 0.0 6.0 542 542 A 108 PHE HD% A 74 GLN H 1.0 0.0 6.0 543 543 A 74 GLN HA A 74 GLN H 1.0 1.8 3.8 544 544 A 73 ASP HBy A 74 GLN H 1.0 2.0 5.8 545 545 A 74 GLN HBx A 74 GLN H 1.0 1.8 3.6 546 546 A 74 GLN H A 77 THR HG2% 1.0 2.0 5.4 547 547 A 74 GLN H A 103 LEU HDx% 1.0 0.0 6.0 548 548 A 71 LEU HDy% A 74 GLN H 1.0 1.9 5.1 549 549 A 74 GLN HE2y A 74 GLN HBy 1.0 1.9 4.1 550 550 A 74 GLN HE2y A 74 GLN HGy 1.0 1.7 2.9 551 551 A 77 THR HA A 74 GLN HE2y 1.0 1.9 4.7 552 552 A 77 THR HA A 74 GLN HE2x 1.0 1.9 4.7 553 553 A 74 GLN HGy A 74 GLN HE2x 1.0 2.0 5.2 554 554 A 74 GLN HBy A 74 GLN HE2x 1.0 1.9 4.5 555 555 A 77 THR HG2% A 74 GLN HE2x 1.0 2.0 6.0 556 556 A 74 GLN HE2x A 76 ILE HA 1.0 1.9 6.0 557 557 A 74 GLN HE2y A 76 ILE HA 1.0 1.9 6.0 558 558 A 74 GLN HA A 74 GLN HGx 1.0 1.9 4.1 559 559 A 74 GLN HA A 74 GLN HBy 1.0 1.7 3.3 560 560 A 74 GLN HBy A 74 GLN HGx 1.0 1.7 2.9 561 561 A 74 GLN HBx A 74 GLN HBy 1.0 1.4 2.2 562 562 A 74 GLN HBx A 74 GLN HGy 1.0 1.6 3.0 563 563 A 74 GLN HBx A 74 GLN HA 1.0 1.9 3.9 564 564 A 74 GLN HBx A 74 GLN HGx 1.0 1.7 3.3 565 565 A 74 GLN HGy A 74 GLN HGx 1.0 1.4 2.2 566 566 A 74 GLN HBy A 74 GLN HGy 1.0 1.7 3.3 567 567 A 74 GLN HA A 75 ALA HB% 1.0 2.0 4.8 568 568 A 74 GLN HGy A 76 ILE H 1.0 2.0 6.0 569 569 A 74 GLN HE2x A 74 GLN HGx 1.0 2.0 6.0 570 570 A 74 GLN HBy A 75 ALA H 1.0 1.8 3.6 571 571 A 74 GLN HBx A 75 ALA H 1.0 2.0 5.6 572 572 A 75 ALA H A 76 ILE HB 1.0 0.0 6.0 573 573 A 103 LEU HDx% A 75 ALA H 1.0 2.0 5.6 574 574 A 75 ALA HB% A 75 ALA HA 1.0 1.5 2.5 575 575 A 75 ALA HA A 103 LEU HBx 1.0 1.7 3.3 576 576 A 75 ALA HA A 103 LEU H 1.0 1.9 4.9 577 577 A 75 ALA HB% A 103 LEU HBx 1.0 1.8 3.8 578 578 A 75 ALA HB% A 76 ILE HG2% 1.0 1.8 3.8 579 579 A 103 LEU HDx% A 75 ALA HB% 1.0 2.0 5.0 580 580 A 75 ALA HB% A 103 LEU H 1.0 2.0 4.8 581 581 A 76 ILE HA A 75 ALA H 1.0 0.0 6.0 582 582 A 75 ALA H A 75 ALA HA 1.0 1.8 3.8 583 583 A 75 ALA HB% A 75 ALA H 1.0 1.6 2.8 584 584 A 75 ALA HA A 103 LEU HBy 1.0 1.8 3.4 585 585 A 74 GLN HBy A 75 ALA HB% 1.0 2.0 5.6 586 586 A 75 ALA HA A 103 LEU HDy% 1.0 2.0 5.2 587 587 A 76 ILE H A 75 ALA H 1.0 1.7 3.5 588 588 A 76 ILE HA A 76 ILE H 1.0 1.8 3.8 589 589 A 76 ILE H A 75 ALA HA 1.0 1.9 4.5 590 590 A 74 GLN HBy A 76 ILE H 1.0 1.8 3.8 591 591 A 74 GLN HBx A 76 ILE H 1.0 2.0 6.0 592 592 A 75 ALA HB% A 76 ILE H 1.0 1.6 3.0 593 593 A 76 ILE H A 103 LEU HBx 1.0 0.0 6.0 594 594 A 76 ILE H A 76 ILE HD1% 1.0 1.9 4.3 595 595 A 76 ILE H A 102 ARG HA 1.0 1.9 6.0 596 596 A 76 ILE HG2% A 102 ARG HA 1.0 2.0 5.2 597 597 A 76 ILE HG2% A 77 THR H 1.0 1.9 5.5 598 598 A 76 ILE HB A 76 ILE HG2% 1.0 1.6 2.6 599 599 A 76 ILE HA A 76 ILE HG2% 1.0 1.9 4.1 600 600 A 76 ILE HG2% A 102 ARG HE 1.0 1.9 5.1 601 601 A 76 ILE H A 76 ILE HG2% 1.0 1.8 3.6 602 602 A 103 LEU H A 76 ILE HG2% 1.0 1.9 5.5 603 603 A 102 ARG H A 76 ILE HG2% 1.0 1.9 6.0 604 604 A 76 ILE HA A 77 THR H 1.0 1.7 3.1 605 605 A 76 ILE H A 76 ILE HB 1.0 1.8 3.6 606 606 A 76 ILE HA A 76 ILE HB 1.0 1.9 3.9 607 607 A 76 ILE HB A 103 LEU HBx 1.0 1.9 4.7 608 608 A 76 ILE HD1% A 102 ARG HE 1.0 2.0 5.0 609 609 A 101 PHE H A 76 ILE HD1% 1.0 2.0 5.8 610 610 A 76 ILE HD1% A 77 THR H 1.0 1.8 3.6 611 611 A 77 THR HA A 76 ILE HD1% 1.0 1.8 4.0 612 612 A 76 ILE HA A 76 ILE HD1% 1.0 1.9 3.9 613 613 A 76 ILE HB A 76 ILE HD1% 1.0 1.7 3.3 614 614 A 76 ILE HD1% A 77 THR HB 1.0 2.0 5.0 615 615 A 76 ILE HD1% A 100 GLU HGx 1.0 2.0 4.6 616 616 A 77 THR H A 78 SER H 1.0 2.0 6.0 617 617 A 77 THR H A 77 THR HB 1.0 1.8 4.0 618 618 A 101 PHE H A 77 THR HB 1.0 2.0 4.8 619 619 A 70 PHE HBy A 77 THR HB 1.0 2.0 6.0 620 620 A 77 THR HB A 86 ASP HBx 1.0 1.9 3.9 621 621 A 77 THR HA A 77 THR H 1.0 1.9 3.9 622 622 A 77 THR HA A 77 THR HB 1.0 1.8 3.4 623 623 A 79 ALA HB% A 77 THR HB 1.0 1.9 4.5 624 624 A 77 THR HG2% A 77 THR HB 1.0 1.7 3.1 625 625 A 87 ILE H A 77 THR HG2% 1.0 2.0 5.4 626 626 A 77 THR HG2% A 86 ASP HBy 1.0 1.9 4.3 627 627 A 87 ILE HG2% A 77 THR HG2% 1.0 1.8 3.8 628 628 A 77 THR HG2% A 87 ILE HD1% 1.0 2.0 6.0 629 629 A 77 THR HG2% A 86 ASP HA 1.0 2.0 5.0 630 630 A 70 PHE HD% A 77 THR HG2% 1.0 2.0 5.4 631 631 A 77 THR HB A 86 ASP H 1.0 2.0 5.4 632 632 A 77 THR HG2% A 74 GLN HE2y 1.0 1.8 3.8 633 633 A 101 PHE H A 77 THR HG2% 1.0 2.0 6.0 634 634 A 77 THR HG2% A 78 SER H 1.0 2.0 5.4 635 635 A 74 GLN HE2y A 78 SER H 1.0 2.0 6.0 636 636 A 76 ILE HD1% A 78 SER H 1.0 2.0 5.4 637 637 A 77 THR HA A 78 SER H 1.0 1.7 3.1 638 638 A 78 SER H A 78 SER HA 1.0 1.9 4.5 639 639 A 78 SER H A 78 SER HBy 1.0 1.9 3.9 640 640 A 78 SER H A 78 SER HBx 1.0 1.9 5.5 641 641 A 78 SER H A 86 ASP HBx 1.0 2.0 5.0 642 642 A 79 ALA HB% A 78 SER H 1.0 0.0 6.0 643 643 A 78 SER HBx A 79 ALA H 1.0 1.9 4.5 644 644 A 78 SER HA A 78 SER HBy 1.0 1.7 3.1 645 645 A 78 SER HA A 78 SER HBx 1.0 1.8 3.6 646 646 A 78 SER HBy A 78 SER HBx 1.0 1.6 2.6 647 647 A 78 SER HBy A 80 GLY H 1.0 2.0 5.6 648 648 A 78 SER H A 79 ALA H 1.0 2.0 6.0 649 649 A 79 ALA HB% A 98 HIS HD2 1.0 1.5 2.7 650 650 A 70 PHE HD% A 79 ALA HB% 1.0 1.6 3.0 651 651 A 79 ALA HB% A 87 ILE HD1% 1.0 2.0 4.8 652 652 A 79 ALA HB% A 79 ALA HA 1.0 1.6 2.8 653 653 A 101 PHE H A 79 ALA H 1.0 2.0 6.0 654 654 A 79 ALA H A 79 ALA HA 1.0 1.9 3.7 655 655 A 78 SER HA A 79 ALA H 1.0 1.7 2.9 656 656 A 78 SER HBy A 79 ALA H 1.0 2.0 5.0 657 657 A 79 ALA HB% A 79 ALA H 1.0 1.7 2.9 658 658 A 87 ILE HG2% A 79 ALA H 1.0 2.0 5.0 659 659 A 79 ALA HB% A 82 HIS HD2 1.0 2.0 6.0 660 660 A 87 ILE HG2% A 79 ALA HA 1.0 1.7 3.3 661 661 A 80 GLY H A 79 ALA HA 1.0 1.6 2.8 662 662 A 80 GLY H A 80 GLY HAx 1.0 1.7 3.5 663 663 A 80 GLY H A 80 GLY HAy 1.0 1.8 3.6 664 664 A 79 ALA H A 80 GLY H 1.0 2.0 6.0 665 665 A 81 ARG H A 80 GLY HAx 1.0 1.9 4.3 666 666 A 81 ARG H A 80 GLY HAy 1.0 1.7 3.1 667 667 A 80 GLY HAx A 80 GLY HAy 1.0 1.5 2.3 668 668 A 81 ARG H A 82 HIS H 1.0 2.0 5.8 669 669 A 81 ARG HE A 81 ARG HBx 1.0 1.9 3.9 670 670 A 81 ARG HE A 94 VAL HGy% 1.0 1.9 6.0 671 671 A 92 VAL HA A 81 ARG HE 1.0 2.0 5.8 672 672 A 81 ARG H A 94 VAL HB 1.0 0.0 6.0 673 673 A 92 VAL HA A 81 ARG HGx 1.0 1.8 4.0 674 674 A 81 ARG HA A 96 ARG HGy 1.0 0.0 6.0 675 675 A 81 ARG HBx A 81 ARG HA 1.0 1.8 3.6 676 676 A 81 ARG HBx A 81 ARG HDy 1.0 1.8 3.4 677 677 A 81 ARG HBx A 81 ARG HDx 1.0 2.0 4.6 678 678 A 81 ARG HBx A 81 ARG HGy 1.0 0.0 6.0 679 679 A 81 ARG HBx A 81 ARG HGx 1.0 1.6 2.8 680 680 A 81 ARG HA A 81 ARG HBy 1.0 1.7 3.1 681 681 A 81 ARG HDy A 81 ARG HBy 1.0 2.0 5.0 682 682 A 81 ARG HDx A 81 ARG HBy 1.0 2.0 5.8 683 683 A 81 ARG HBx A 81 ARG HBy 1.0 1.3 2.2 684 684 A 81 ARG HGy A 81 ARG HBy 1.0 1.7 3.1 685 685 A 81 ARG HGx A 81 ARG HBy 1.0 1.4 2.4 686 686 A 81 ARG HGx A 81 ARG HGy 1.0 1.2 2.2 687 687 A 81 ARG HA A 81 ARG HGy 1.0 1.9 3.9 688 688 A 81 ARG HA A 81 ARG HDx 1.0 2.0 5.4 689 689 A 81 ARG HDy A 81 ARG HDx 1.0 1.3 2.2 690 690 A 81 ARG HA A 81 ARG HDy 1.0 1.9 4.5 691 691 A 81 ARG HDy A 81 ARG HGy 1.0 1.7 3.1 692 692 A 81 ARG HGx A 81 ARG HDy 1.0 1.8 3.6 693 693 A 81 ARG HE A 81 ARG HDy 1.0 1.9 4.5 694 694 A 81 ARG HDy A 96 ARG HE 1.0 2.0 5.0 695 695 A 81 ARG HDy A 82 HIS HA 1.0 1.9 4.3 696 696 A 81 ARG HDy A 96 ARG HA 1.0 1.8 3.6 697 697 A 81 ARG HBy A 88 PHE HA 1.0 0.0 6.0 698 698 A 81 ARG HBy A 97 ARG HA 1.0 2.0 6.0 699 699 A 116 LEU H A 81 ARG HBx 1.0 0.0 6.0 700 700 A 81 ARG HBx A 92 VAL H 1.0 2.0 6.0 701 701 A 81 ARG H A 96 ARG HA 1.0 1.9 4.1 702 702 A 81 ARG H A 81 ARG HBx 1.0 1.7 3.3 703 703 A 81 ARG H A 94 VAL HGx% 1.0 2.0 4.4 704 704 A 82 HIS H A 94 VAL HGy% 1.0 2.0 6.0 705 705 A 82 HIS HD2 A 82 HIS HD1 1.0 1.9 4.5 706 706 A 81 ARG HDx A 82 HIS HD1 1.0 0.0 6.0 707 707 A 82 HIS HD1 A 83 PRO HBy 1.0 1.9 6.0 708 708 A 82 HIS HBx A 82 HIS HE1 1.0 2.0 6.0 709 709 A 82 HIS H A 82 HIS HA 1.0 1.8 3.4 710 710 A 82 HIS H A 83 PRO HDy 1.0 2.0 6.0 711 711 A 82 HIS H A 81 ARG HDy 1.0 2.0 5.6 712 712 A 82 HIS H A 82 HIS HBx 1.0 1.9 4.5 713 713 A 82 HIS H A 81 ARG HBx 1.0 2.0 5.6 714 714 A 82 HIS HA A 83 PRO HDx 1.0 1.6 2.8 715 715 A 82 HIS HBx A 82 HIS HBy 1.0 1.6 2.8 716 716 A 82 HIS HA A 82 HIS HBx 1.0 1.7 3.5 717 717 A 82 HIS HE1 A 83 PRO HDx 1.0 2.0 6.0 718 718 A 82 HIS HA A 82 HIS HBy 1.0 1.9 4.1 719 719 A 82 HIS HE1 A 82 HIS HBy 1.0 2.0 5.8 720 720 A 82 HIS H A 82 HIS HBy 1.0 1.8 4.0 721 721 A 88 PHE HD% A 83 PRO HA 1.0 1.9 4.3 722 722 A 82 HIS HA A 83 PRO HDy 1.0 1.8 3.8 723 723 A 83 PRO HBy A 83 PRO HA 1.0 1.8 3.6 724 724 A 83 PRO HA A 83 PRO HGx 1.0 1.8 3.6 725 725 A 83 PRO HA A 83 PRO HBx 1.0 1.7 2.9 726 726 A 83 PRO HBy A 83 PRO HBx 1.0 1.5 2.5 727 727 A 83 PRO HGx A 83 PRO HBx 1.0 1.4 2.2 728 728 A 83 PRO HDy A 83 PRO HGx 1.0 1.9 3.9 729 729 A 83 PRO HBy A 83 PRO HGx 1.0 1.8 3.8 730 730 A 83 PRO HA A 83 PRO HGy 1.0 2.0 4.8 731 731 A 83 PRO HDy A 83 PRO HGy 1.0 1.6 3.0 732 732 A 83 PRO HBy A 83 PRO HGy 1.0 1.6 2.8 733 733 A 83 PRO HDy A 83 PRO HDx 1.0 1.5 2.5 734 734 A 83 PRO HDx A 83 PRO HBx 1.0 1.9 4.3 735 735 A 83 PRO HDx A 83 PRO HGx 1.0 1.7 3.1 736 736 A 83 PRO HBy A 83 PRO HDy 1.0 1.8 4.0 737 737 A 83 PRO HA A 85 SER H 1.0 0.0 6.0 738 738 A 83 PRO HA A 84 ASP H 1.0 2.0 5.4 739 739 A 82 HIS HBx A 83 PRO HA 1.0 1.9 4.9 740 740 A 83 PRO HGy A 84 ASP H 1.0 1.9 5.1 741 741 A 83 PRO HDx A 84 ASP H 1.0 2.0 6.0 742 742 A 85 SER H A 84 ASP HA 1.0 1.8 3.6 743 743 A 82 HIS HBx A 85 SER H 1.0 1.8 3.6 744 744 A 85 SER HBx A 85 SER HBy 1.0 1.5 2.5 745 745 A 88 PHE HD% A 85 SER H 1.0 2.0 6.0 746 746 A 85 SER H A 85 SER HA 1.0 1.9 4.1 747 747 A 87 ILE H A 85 SER HA 1.0 0.0 6.0 748 748 A 85 SER H A 85 SER HG 1.0 1.8 4.0 749 749 A 78 SER H A 86 ASP H 1.0 2.0 5.8 750 750 A 87 ILE HG2% A 86 ASP H 1.0 1.9 6.0 751 751 A 87 ILE H A 86 ASP H 1.0 1.9 4.1 752 752 A 86 ASP H A 85 SER H 1.0 1.9 4.9 753 753 A 86 ASP H A 85 SER HA 1.0 1.9 3.9 754 754 A 86 ASP HBy A 86 ASP H 1.0 1.9 4.3 755 755 A 77 THR HG2% A 86 ASP HBx 1.0 1.7 2.9 756 756 A 74 GLN HGx A 86 ASP HBx 1.0 2.0 6.0 757 757 A 72 LEU HA A 86 ASP HBx 1.0 2.0 6.0 758 758 A 87 ILE H A 86 ASP HBx 1.0 2.0 5.2 759 759 A 71 LEU H A 86 ASP HBx 1.0 1.9 4.7 760 760 A 86 ASP HBx A 86 ASP H 1.0 1.9 4.9 761 761 A 86 ASP HBy A 86 ASP HA 1.0 1.9 4.5 762 762 A 86 ASP HBx A 86 ASP HBy 1.0 1.6 2.6 763 763 A 77 THR HA A 86 ASP HBy 1.0 2.0 5.8 764 764 A 87 ILE H A 78 SER H 1.0 2.0 6.0 765 765 A 87 ILE HB A 79 ALA HA 1.0 2.0 5.2 766 766 A 98 HIS HD2 A 87 ILE HG1x 1.0 2.0 5.8 767 767 A 70 PHE HD% A 87 ILE HG1x 1.0 2.0 4.8 768 768 A 80 GLY H A 87 ILE HG1x 1.0 1.9 3.7 769 769 A 70 PHE HE% A 87 ILE HA 1.0 2.0 6.0 770 770 A 87 ILE HG2% A 89 LEU HDy% 1.0 2.0 6.0 771 771 A 87 ILE HG2% A 82 HIS HBy 1.0 1.9 4.9 772 772 A 87 ILE HG2% A 101 PHE HBx 1.0 2.0 5.0 773 773 A 87 ILE HG2% A 98 HIS HD2 1.0 2.0 5.0 774 774 A 87 ILE HG2% A 70 PHE HD% 1.0 1.9 4.3 775 775 A 58 LEU HDy% A 87 ILE HD1% 1.0 2.0 5.0 776 776 A 87 ILE HD1% A 79 ALA HA 1.0 2.0 5.8 777 777 A 70 PHE HE% A 87 ILE HD1% 1.0 1.8 3.4 778 778 A 87 ILE HB A 87 ILE HA 1.0 1.8 3.8 779 779 A 87 ILE HA A 87 ILE HG1y 1.0 2.0 4.6 780 780 A 87 ILE HG1x A 87 ILE HA 1.0 1.8 3.6 781 781 A 87 ILE HG2% A 87 ILE HA 1.0 1.9 4.1 782 782 A 87 ILE HD1% A 87 ILE HA 1.0 1.8 3.4 783 783 A 87 ILE HB A 87 ILE HG1y 1.0 1.7 3.1 784 784 A 87 ILE HB A 87 ILE HD1% 1.0 1.7 3.1 785 785 A 87 ILE HG1x A 87 ILE HG1y 1.0 1.4 2.2 786 786 A 87 ILE HG2% A 87 ILE HB 1.0 1.7 2.9 787 787 A 87 ILE HG2% A 87 ILE HG1x 1.0 1.7 3.1 788 788 A 87 ILE HG2% A 87 ILE HD1% 1.0 1.8 3.8 789 789 A 87 ILE HD1% A 87 ILE HG1y 1.0 1.5 2.5 790 790 A 87 ILE HD1% A 87 ILE HG1x 1.0 1.5 2.3 791 791 A 87 ILE HG2% A 79 ALA HB% 1.0 1.5 2.3 792 792 A 89 LEU HDy% A 87 ILE HD1% 1.0 1.5 2.5 793 793 A 82 HIS HD2 A 87 ILE HG1x 1.0 2.0 5.4 794 794 A 87 ILE HA A 88 PHE H 1.0 1.7 2.9 795 795 A 87 ILE HA A 88 PHE HBx 1.0 2.0 5.4 796 796 A 87 ILE HG2% A 77 THR HB 1.0 1.8 3.8 797 797 A 87 ILE HD1% A 88 PHE HE% 1.0 2.0 5.6 798 798 A 87 ILE HD1% A 79 ALA H 1.0 1.9 6.0 799 799 A 87 ILE H A 79 ALA HA 1.0 2.0 5.0 800 800 A 87 ILE H A 86 ASP HA 1.0 2.0 5.0 801 801 A 87 ILE H A 78 SER HBx 1.0 2.0 5.8 802 802 A 87 ILE H A 87 ILE HA 1.0 1.8 3.6 803 803 A 87 ILE H A 86 ASP HBy 1.0 1.7 3.5 804 804 A 87 ILE HB A 87 ILE H 1.0 1.9 4.1 805 805 A 79 ALA HB% A 87 ILE H 1.0 2.0 5.8 806 806 A 87 ILE HG2% A 87 ILE H 1.0 1.8 3.4 807 807 A 87 ILE H A 87 ILE HD1% 1.0 2.0 5.4 808 808 A 87 ILE HB A 88 PHE H 1.0 2.0 6.0 809 809 A 88 PHE HD% A 88 PHE H 1.0 1.8 3.8 810 810 A 88 PHE HA A 88 PHE H 1.0 1.9 3.9 811 811 A 88 PHE H A 88 PHE HBx 1.0 1.8 3.4 812 812 A 87 ILE HD1% A 88 PHE H 1.0 1.8 3.8 813 813 A 88 PHE HD% A 88 PHE HA 1.0 1.9 4.7 814 814 A 88 PHE HA A 89 LEU H 1.0 1.6 3.0 815 815 A 88 PHE HBy A 88 PHE HA 1.0 1.8 3.6 816 816 A 88 PHE HA A 88 PHE HBx 1.0 1.9 4.3 817 817 A 88 PHE HBy A 88 PHE HD% 1.0 1.9 3.9 818 818 A 82 HIS HA A 88 PHE HBx 1.0 2.0 6.0 819 819 A 88 PHE HD% A 88 PHE HBx 1.0 2.0 5.0 820 820 A 89 LEU HDy% A 88 PHE HD% 1.0 2.0 5.8 821 821 A 80 GLY H A 89 LEU H 1.0 1.9 4.5 822 822 A 88 PHE HD% A 89 LEU H 1.0 2.0 5.2 823 823 A 80 GLY HAx A 89 LEU H 1.0 1.9 4.1 824 824 A 89 LEU H A 89 LEU HA 1.0 1.8 3.6 825 825 A 88 PHE HBx A 89 LEU H 1.0 2.0 6.0 826 826 A 89 LEU H A 89 LEU HBy 1.0 1.8 3.6 827 827 A 89 LEU H A 89 LEU HBx 1.0 2.0 5.0 828 828 A 89 LEU HDy% A 89 LEU H 1.0 2.0 4.6 829 829 A 87 ILE HD1% A 89 LEU H 1.0 2.0 5.4 830 830 A 87 ILE HD1% A 89 LEU HDx% 1.0 1.8 4.0 831 831 A 69 ARG HE A 89 LEU HDy% 1.0 0.0 6.0 832 832 A 87 ILE HD1% A 89 LEU HG 1.0 1.7 3.3 833 833 A 89 LEU HA A 89 LEU HBy 1.0 1.9 4.5 834 834 A 89 LEU HG A 139 ILE HG2% 1.0 2.0 5.0 835 835 A 89 LEU HA A 89 LEU HG 1.0 1.9 4.3 836 836 A 89 LEU HDy% A 89 LEU HA 1.0 1.6 2.8 837 837 A 89 LEU HDy% A 89 LEU HDx% 1.0 1.5 2.7 838 838 A 89 LEU HBy A 89 LEU HBx 1.0 1.6 2.8 839 839 A 89 LEU HDy% A 89 LEU HBy 1.0 2.0 5.2 840 840 A 89 LEU HBx A 89 LEU HG 1.0 1.5 2.3 841 841 A 89 LEU HDy% A 89 LEU HG 1.0 1.7 2.9 842 842 A 89 LEU HDx% A 89 LEU HG 1.0 1.6 3.0 843 843 A 89 LEU HDy% A 89 LEU HBx 1.0 1.9 4.3 844 844 A 80 GLY H A 89 LEU HG 1.0 2.0 5.0 845 845 A 89 LEU HDy% A 65 ASN HD2x 1.0 2.0 6.0 846 846 A 89 LEU HDy% A 142 PHE HBx 1.0 2.0 5.2 847 847 A 142 PHE HE% A 89 LEU HA 1.0 2.0 5.4 848 848 A 90 ASP H A 90 ASP HA 1.0 1.8 3.6 849 849 A 90 ASP HA A 90 ASP HBy 1.0 1.7 3.3 850 850 A 90 ASP HA A 90 ASP HBx 1.0 1.8 3.6 851 851 A 90 ASP HBy A 90 ASP HBx 1.0 1.5 2.5 852 852 A 90 ASP H A 90 ASP HBy 1.0 1.8 4.0 853 853 A 90 ASP H A 90 ASP HBx 1.0 2.0 5.0 854 854 A 89 LEU HA A 90 ASP H 1.0 1.6 2.8 855 855 A 89 LEU HBx A 90 ASP H 1.0 2.0 5.2 856 856 A 89 LEU HDy% A 90 ASP H 1.0 2.0 5.4 857 857 A 94 VAL H A 91 ASP H 1.0 2.0 6.0 858 858 A 81 ARG H A 91 ASP HA 1.0 2.0 6.0 859 859 A 80 GLY H A 91 ASP HA 1.0 2.0 6.0 860 860 A 94 VAL HGy% A 91 ASP HBy 1.0 2.0 6.0 861 861 A 91 ASP HA A 91 ASP HBy 1.0 1.8 3.6 862 862 A 91 ASP HA A 91 ASP HBx 1.0 1.8 3.6 863 863 A 91 ASP HBy A 91 ASP HBx 1.0 1.6 3.0 864 864 A 90 ASP H A 91 ASP H 1.0 1.8 3.8 865 865 A 92 VAL H A 91 ASP H 1.0 1.9 4.1 866 866 A 88 PHE HD% A 91 ASP H 1.0 0.0 6.0 867 867 A 90 ASP HA A 91 ASP H 1.0 1.7 3.3 868 868 A 89 LEU HA A 91 ASP H 1.0 1.9 4.9 869 869 A 91 ASP H A 91 ASP HBy 1.0 2.0 4.8 870 870 A 91 ASP H A 91 ASP HBx 1.0 1.8 4.0 871 871 A 81 ARG HGx A 91 ASP H 1.0 2.0 6.0 872 872 A 89 LEU H A 91 ASP HBy 1.0 2.0 6.0 873 873 A 92 VAL H A 91 ASP HBy 1.0 1.9 5.3 874 874 A 92 VAL H A 91 ASP HA 1.0 1.8 3.6 875 875 A 92 VAL HA A 94 VAL H 1.0 2.0 6.0 876 876 A 23 SER HBx A 92 VAL HGy% 1.0 1.8 3.6 877 877 A 23 SER HBy A 92 VAL HGy% 1.0 1.7 3.3 878 878 A 93 THR HA A 92 VAL HGy% 1.0 2.0 4.8 879 879 A 92 VAL HGy% A 93 THR H 1.0 1.8 4.2 880 880 A 94 VAL H A 92 VAL HGy% 1.0 2.0 6.0 881 881 A 23 SER HBy A 92 VAL HB 1.0 2.0 6.0 882 882 A 23 SER HBx A 92 VAL HB 1.0 2.0 6.0 883 883 A 81 ARG HBy A 92 VAL H 1.0 2.0 4.8 884 884 A 92 VAL HA A 92 VAL HB 1.0 1.7 3.1 885 885 A 92 VAL HA A 92 VAL HGx% 1.0 1.8 3.6 886 886 A 92 VAL HA A 92 VAL HGy% 1.0 1.6 3.0 887 887 A 92 VAL HGy% A 92 VAL HB 1.0 1.5 2.5 888 888 A 91 ASP HA A 92 VAL HB 1.0 1.9 4.9 889 889 A 92 VAL H A 92 VAL HB 1.0 1.8 3.4 890 890 A 94 VAL H A 92 VAL HB 1.0 1.9 6.0 891 891 A 92 VAL HA A 81 ARG HBx 1.0 2.0 5.8 892 892 A 91 ASP HA A 92 VAL HGy% 1.0 0.0 6.0 893 893 A 23 SER H A 92 VAL HGy% 1.0 1.6 2.6 894 894 A 91 ASP H A 93 THR H 1.0 2.0 6.0 895 895 A 25 PHE HBx A 93 THR HB 1.0 1.9 6.0 896 896 A 93 THR HB A 142 PHE HD% 1.0 1.9 6.0 897 897 A 94 VAL H A 93 THR HB 1.0 1.9 4.7 898 898 A 142 PHE HD% A 93 THR HG2% 1.0 1.9 4.7 899 899 A 65 ASN H A 93 THR HG2% 1.0 2.0 5.0 900 900 A 25 PHE HBx A 93 THR HG2% 1.0 2.0 6.0 901 901 A 141 LYS HEy A 93 THR HG2% 1.0 1.8 3.8 902 902 A 93 THR HG2% A 90 ASP HBx 1.0 1.5 2.5 903 903 A 93 THR HB A 140 GLY HAx 1.0 2.0 4.8 904 904 A 93 THR HA A 93 THR HB 1.0 1.7 3.1 905 905 A 93 THR HB A 93 THR HG2% 1.0 1.6 2.8 906 906 A 94 VAL H A 93 THR H 1.0 1.6 2.8 907 907 A 94 VAL H A 81 ARG HE 1.0 2.0 5.6 908 908 A 94 VAL H A 94 VAL HB 1.0 1.8 3.6 909 909 A 94 VAL H A 94 VAL HGy% 1.0 1.7 2.9 910 910 A 94 VAL HGy% A 139 ILE HD1% 1.0 1.8 4.0 911 911 A 89 LEU HDy% A 94 VAL HGy% 1.0 2.0 5.8 912 912 A 94 VAL HGy% A 140 GLY HAy 1.0 1.8 3.4 913 913 A 94 VAL HGy% A 140 GLY HAx 1.0 1.9 4.1 914 914 A 142 PHE HE% A 94 VAL HGy% 1.0 1.7 3.3 915 915 A 81 ARG H A 94 VAL HGy% 1.0 1.8 3.6 916 916 A 94 VAL HGx% A 139 ILE HD1% 1.0 1.9 4.1 917 917 A 94 VAL HGx% A 98 HIS HBx 1.0 1.8 3.8 918 918 A 94 VAL HGx% A 140 GLY HAx 1.0 1.9 4.1 919 919 A 80 GLY HAy A 94 VAL HGx% 1.0 1.8 3.4 920 920 A 80 GLY HAx A 94 VAL HGx% 1.0 1.6 2.8 921 921 A 94 VAL HGx% A 98 HIS H 1.0 1.9 4.1 922 922 A 94 VAL HGx% A 95 SER H 1.0 1.9 4.1 923 923 A 95 SER H A 94 VAL HA 1.0 1.7 3.3 924 924 A 116 LEU H A 94 VAL HA 1.0 1.7 3.5 925 925 A 94 VAL HGy% A 98 HIS H 1.0 2.0 4.6 926 926 A 94 VAL HGy% A 95 SER H 1.0 2.0 5.2 927 927 A 93 THR HB A 94 VAL HGy% 1.0 2.0 4.8 928 928 A 94 VAL HGy% A 139 ILE HA 1.0 2.0 5.2 929 929 A 94 VAL HB A 94 VAL HA 1.0 1.9 4.3 930 930 A 94 VAL HGy% A 94 VAL HA 1.0 1.7 3.3 931 931 A 94 VAL HGy% A 94 VAL HB 1.0 1.7 2.9 932 932 A 94 VAL HGy% A 94 VAL HGx% 1.0 1.5 2.3 933 933 A 94 VAL HB A 94 VAL HGx% 1.0 1.7 3.1 934 934 A 94 VAL HGx% A 94 VAL HA 1.0 1.7 3.3 935 935 A 94 VAL HGy% A 140 GLY H 1.0 2.0 5.4 936 936 A 94 VAL HGx% A 98 HIS HBy 1.0 1.9 4.5 937 937 A 116 LEU H A 95 SER H 1.0 1.9 4.9 938 938 A 95 SER H A 96 ARG H 1.0 1.9 5.9 939 939 A 95 SER HA A 95 SER HBy 1.0 1.9 5.1 940 940 A 95 SER HBy A 95 SER HBx 1.0 1.8 3.6 941 941 A 95 SER HA A 96 ARG H 1.0 1.8 3.6 942 942 A 82 HIS HA A 96 ARG H 1.0 1.9 6.0 943 943 A 96 ARG HA A 96 ARG H 1.0 1.9 4.5 944 944 A 96 ARG H A 95 SER HBx 1.0 1.9 6.0 945 945 A 81 ARG HGy A 96 ARG H 1.0 2.0 6.0 946 946 A 78 SER HA A 96 ARG HE 1.0 2.0 6.0 947 947 A 96 ARG HE A 82 HIS HA 1.0 2.0 6.0 948 948 A 96 ARG HE A 96 ARG HDy 1.0 1.9 3.7 949 949 A 96 ARG HE A 97 ARG HBy 1.0 0.0 6.0 950 950 A 96 ARG HA A 96 ARG HGx 1.0 2.0 6.0 951 951 A 81 ARG HDx A 96 ARG HGx 1.0 1.9 6.0 952 952 A 96 ARG HGy A 96 ARG HGx 1.0 1.7 3.1 953 953 A 96 ARG HGy A 96 ARG HDx 1.0 1.9 4.1 954 954 A 96 ARG HGx A 96 ARG HDx 1.0 1.9 4.3 955 955 A 96 ARG HDy A 96 ARG HDx 1.0 1.4 2.2 956 956 A 96 ARG HDy A 96 ARG HBx 1.0 1.9 4.1 957 957 A 96 ARG HGy A 96 ARG HDy 1.0 1.8 3.4 958 958 A 96 ARG HDy A 96 ARG HGx 1.0 1.6 2.8 959 959 A 96 ARG HE A 82 HIS HE1 1.0 1.7 3.3 960 960 A 82 HIS HD1 A 96 ARG H 1.0 2.0 6.0 961 961 A 81 ARG HE A 96 ARG H 1.0 1.8 4.0 962 962 A 96 ARG H A 96 ARG HBx 1.0 1.9 5.1 963 963 A 81 ARG HBx A 96 ARG H 1.0 1.8 3.4 964 964 A 82 HIS HA A 96 ARG HDy 1.0 1.9 5.3 965 965 A 85 SER HG A 96 ARG HDy 1.0 0.0 6.0 966 966 A 96 ARG HDy A 97 ARG H 1.0 1.9 4.9 967 967 A 81 ARG H A 96 ARG HDy 1.0 0.0 6.0 968 968 A 82 HIS HD1 A 96 ARG HDy 1.0 2.0 5.2 969 969 A 96 ARG HDy A 100 GLU HBx 1.0 0.0 6.0 970 970 A 85 SER HG A 96 ARG HDx 1.0 0.0 6.0 971 971 A 96 ARG HE A 96 ARG HDx 1.0 1.7 2.9 972 972 A 82 HIS HE1 A 96 ARG HDx 1.0 1.8 3.6 973 973 A 82 HIS HE1 A 96 ARG HDy 1.0 1.8 3.6 974 974 A 82 HIS HD1 A 96 ARG HDx 1.0 2.0 4.8 975 975 A 96 ARG HDy A 113 VAL HGy% 1.0 2.0 6.0 976 976 A 96 ARG H A 97 ARG H 1.0 2.0 4.4 977 977 A 82 HIS HD1 A 97 ARG H 1.0 2.0 6.0 978 978 A 96 ARG HA A 97 ARG H 1.0 2.0 5.4 979 979 A 95 SER HBx A 97 ARG H 1.0 2.0 5.6 980 980 A 96 ARG HDx A 97 ARG H 1.0 2.0 5.4 981 981 A 96 ARG HBx A 97 ARG H 1.0 1.8 3.8 982 982 A 96 ARG HGx A 97 ARG H 1.0 2.0 4.6 983 983 A 94 VAL HGx% A 97 ARG H 1.0 2.0 6.0 984 984 A 97 ARG H A 113 VAL HGy% 1.0 2.0 5.8 985 985 A 82 HIS HE1 A 97 ARG HE 1.0 2.0 6.0 986 986 A 78 SER HA A 97 ARG HE 1.0 2.0 5.2 987 987 A 96 ARG HDy A 97 ARG HE 1.0 1.9 3.9 988 988 A 96 ARG HDx A 97 ARG HE 1.0 1.9 4.5 989 989 A 97 ARG HE A 100 GLU HBy 1.0 1.9 4.7 990 990 A 97 ARG HBy A 97 ARG HE 1.0 1.9 4.5 991 991 A 97 ARG HGx A 99 ALA H 1.0 2.0 5.0 992 992 A 97 ARG HA A 139 ILE HG1x 1.0 2.0 6.0 993 993 A 97 ARG HA A 139 ILE HG2% 1.0 2.0 6.0 994 994 A 97 ARG HA A 97 ARG HBy 1.0 0.0 6.0 995 995 A 97 ARG HDx A 97 ARG HDy 1.0 1.1 2.2 996 996 A 97 ARG HA A 97 ARG H 1.0 0.0 6.0 997 997 A 98 HIS H A 97 ARG H 1.0 2.0 6.0 998 998 A 98 HIS HD2 A 98 HIS H 1.0 1.8 6.0 999 999 A 79 ALA H A 98 HIS H 1.0 2.0 6.0 1000 1000 A 98 HIS HD1 A 98 HIS HE1 1.0 1.9 4.1 1001 1001 A 98 HIS HA A 115 SER HBx 1.0 1.9 4.7 1002 1002 A 80 GLY HAy A 98 HIS H 1.0 1.9 4.5 1003 1003 A 98 HIS HBx A 98 HIS H 1.0 1.6 2.8 1004 1004 A 98 HIS H A 97 ARG HBy 1.0 2.0 4.8 1005 1005 A 87 ILE HG1x A 98 HIS H 1.0 2.0 6.0 1006 1006 A 98 HIS HA A 115 SER HBy 1.0 1.9 4.3 1007 1007 A 98 HIS HE1 A 99 ALA HB% 1.0 1.9 3.9 1008 1008 A 98 HIS HBy A 98 HIS HE1 1.0 2.0 6.0 1009 1009 A 98 HIS HBx A 98 HIS HE1 1.0 2.0 6.0 1010 1010 A 98 HIS HBy A 99 ALA H 1.0 2.0 6.0 1011 1011 A 98 HIS HBx A 98 HIS HBy 1.0 1.7 2.9 1012 1012 A 98 HIS HBy A 98 HIS HA 1.0 1.8 3.8 1013 1013 A 98 HIS HBx A 98 HIS HA 1.0 1.9 3.9 1014 1014 A 98 HIS HD2 A 137 VAL HGx% 1.0 2.0 4.6 1015 1015 A 79 ALA H A 99 ALA H 1.0 2.0 4.8 1016 1016 A 99 ALA H A 100 GLU H 1.0 2.0 5.6 1017 1017 A 98 HIS H A 99 ALA H 1.0 1.7 3.1 1018 1018 A 99 ALA H A 98 HIS HE1 1.0 2.0 5.4 1019 1019 A 80 GLY HAy A 99 ALA H 1.0 1.9 6.0 1020 1020 A 98 HIS HBx A 99 ALA H 1.0 1.7 3.3 1021 1021 A 99 ALA H A 99 ALA HB% 1.0 1.7 3.3 1022 1022 A 99 ALA HB% A 112 ASP HA 1.0 1.8 3.6 1023 1023 A 99 ALA HB% A 113 VAL H 1.0 1.9 4.7 1024 1024 A 99 ALA HB% A 111 VAL H 1.0 1.8 3.4 1025 1025 A 99 ALA H A 99 ALA HA 1.0 1.9 3.9 1026 1026 A 100 GLU H A 99 ALA HA 1.0 1.7 3.1 1027 1027 A 139 ILE HG2% A 99 ALA HA 1.0 2.0 6.0 1028 1028 A 139 ILE HG2% A 99 ALA HB% 1.0 1.9 4.3 1029 1029 A 99 ALA HB% A 113 VAL HGx% 1.0 1.9 4.3 1030 1030 A 99 ALA HB% A 99 ALA HA 1.0 1.6 3.0 1031 1031 A 98 HIS HD1 A 99 ALA HB% 1.0 2.0 4.8 1032 1032 A 101 PHE H A 100 GLU H 1.0 2.0 5.8 1033 1033 A 100 GLU H A 113 VAL H 1.0 2.0 6.0 1034 1034 A 100 GLU H A 110 VAL HA 1.0 1.9 5.5 1035 1035 A 100 GLU HBx A 100 GLU H 1.0 1.8 3.8 1036 1036 A 99 ALA HB% A 100 GLU H 1.0 1.8 3.4 1037 1037 A 100 GLU H A 111 VAL HA 1.0 2.0 6.0 1038 1038 A 76 ILE HD1% A 100 GLU HBy 1.0 1.7 3.3 1039 1039 A 78 SER HA A 100 GLU HBy 1.0 2.0 5.2 1040 1040 A 102 ARG HA A 100 GLU HA 1.0 0.0 6.0 1041 1041 A 101 PHE H A 100 GLU HA 1.0 1.6 3.0 1042 1042 A 70 PHE HBx A 100 GLU HA 1.0 2.0 5.4 1043 1043 A 78 SER HA A 100 GLU HGy 1.0 2.0 6.0 1044 1044 A 100 GLU H A 100 GLU HGy 1.0 1.9 4.9 1045 1045 A 100 GLU HGx A 78 SER HA 1.0 1.9 6.0 1046 1046 A 100 GLU HGx A 100 GLU H 1.0 2.0 5.2 1047 1047 A 102 ARG HE A 100 GLU HBx 1.0 2.0 6.0 1048 1048 A 100 GLU HA A 100 GLU HGy 1.0 1.9 4.5 1049 1049 A 100 GLU HGx A 100 GLU HA 1.0 1.9 4.3 1050 1050 A 100 GLU HBy A 100 GLU HA 1.0 1.7 3.1 1051 1051 A 100 GLU HBx A 100 GLU HA 1.0 1.7 3.1 1052 1052 A 100 GLU HBx A 100 GLU HGy 1.0 1.7 3.5 1053 1053 A 100 GLU HBx A 100 GLU HBy 1.0 1.4 2.2 1054 1054 A 100 GLU HGx A 100 GLU HGy 1.0 1.5 2.5 1055 1055 A 100 GLU HGx A 100 GLU HBx 1.0 1.9 3.9 1056 1056 A 70 PHE HD% A 100 GLU HA 1.0 2.0 4.6 1057 1057 A 72 LEU HDy% A 101 PHE HBy 1.0 1.8 4.0 1058 1058 A 108 PHE HD% A 101 PHE HBy 1.0 2.0 6.0 1059 1059 A 101 PHE HA A 101 PHE HD% 1.0 1.8 3.6 1060 1060 A 72 LEU HBy A 101 PHE HA 1.0 0.0 6.0 1061 1061 A 101 PHE HBx A 101 PHE HD% 1.0 1.7 3.1 1062 1062 A 101 PHE HBy A 101 PHE HD% 1.0 1.8 3.6 1063 1063 A 58 LEU HDy% A 101 PHE HBy 1.0 2.0 5.4 1064 1064 A 101 PHE HBy A 101 PHE HA 1.0 1.6 2.8 1065 1065 A 101 PHE HBx A 101 PHE HA 1.0 1.7 3.3 1066 1066 A 101 PHE HBy A 101 PHE HBx 1.0 1.5 2.5 1067 1067 A 101 PHE HBy A 109 ASN H 1.0 1.9 4.9 1068 1068 A 101 PHE HBx A 109 ASN H 1.0 2.0 6.0 1069 1069 A 101 PHE H A 102 ARG H 1.0 2.0 6.0 1070 1070 A 101 PHE H A 77 THR H 1.0 1.9 4.1 1071 1071 A 70 PHE HD% A 101 PHE H 1.0 1.8 3.6 1072 1072 A 101 PHE H A 102 ARG HA 1.0 2.0 4.8 1073 1073 A 70 PHE HBy A 101 PHE H 1.0 2.0 6.0 1074 1074 A 102 ARG H A 110 VAL HGy% 1.0 1.9 6.0 1075 1075 A 102 ARG H A 111 VAL H 1.0 2.0 5.0 1076 1076 A 102 ARG HE A 101 PHE HA 1.0 1.9 5.5 1077 1077 A 102 ARG HE A 113 VAL HGx% 1.0 2.0 5.6 1078 1078 A 102 ARG H A 109 ASN H 1.0 1.9 3.9 1079 1079 A 102 ARG H A 102 ARG HA 1.0 1.7 3.1 1080 1080 A 102 ARG H A 110 VAL HA 1.0 1.9 4.5 1081 1081 A 102 ARG H A 109 ASN HBx 1.0 2.0 6.0 1082 1082 A 102 ARG H A 102 ARG HE 1.0 2.0 6.0 1083 1083 A 102 ARG H A 103 LEU H 1.0 2.0 6.0 1084 1084 A 76 ILE HA A 103 LEU H 1.0 2.0 5.6 1085 1085 A 103 LEU H A 103 LEU HA 1.0 1.9 4.3 1086 1086 A 103 LEU HBx A 103 LEU H 1.0 1.9 3.9 1087 1087 A 75 ALA HA A 103 LEU HG 1.0 2.0 5.4 1088 1088 A 103 LEU HDx% A 75 ALA HA 1.0 1.7 3.1 1089 1089 A 103 LEU HDx% A 106 ASN HA 1.0 1.9 4.5 1090 1090 A 108 PHE HD% A 103 LEU HDx% 1.0 1.7 3.1 1091 1091 A 103 LEU HDx% A 103 LEU H 1.0 1.9 5.1 1092 1092 A 103 LEU HDy% A 106 ASN HA 1.0 1.5 2.5 1093 1093 A 103 LEU HDy% A 106 ASN HBy 1.0 2.0 6.0 1094 1094 A 103 LEU HDy% A 108 PHE HA 1.0 2.0 5.2 1095 1095 A 108 PHE HD% A 103 LEU HDy% 1.0 1.9 4.5 1096 1096 A 103 LEU H A 103 LEU HDy% 1.0 2.0 5.0 1097 1097 A 103 LEU HDy% A 109 ASN H 1.0 2.0 6.0 1098 1098 A 103 LEU HDy% A 107 GLU HA 1.0 1.9 4.3 1099 1099 A 103 LEU HDy% A 104 GLU HGx 1.0 2.0 5.2 1100 1100 A 103 LEU H A 103 LEU HBy 1.0 1.8 3.8 1101 1101 A 103 LEU HBx A 104 GLU H 1.0 2.0 5.8 1102 1102 A 103 LEU HG A 106 ASN HBx 1.0 2.0 5.6 1103 1103 A 103 LEU HG A 106 ASN HBy 1.0 2.0 5.6 1104 1104 A 103 LEU H A 103 LEU HG 1.0 2.0 5.4 1105 1105 A 103 LEU HDx% A 107 GLU H 1.0 1.9 4.5 1106 1106 A 103 LEU HDx% A 108 PHE HBx 1.0 2.0 6.0 1107 1107 A 103 LEU HDx% A 107 GLU HA 1.0 1.9 4.5 1108 1108 A 103 LEU HDy% A 104 GLU H 1.0 1.7 3.1 1109 1109 A 103 LEU HDy% A 106 ASN H 1.0 1.7 3.5 1110 1110 A 103 LEU HDy% A 107 GLU H 1.0 1.7 3.5 1111 1111 A 103 LEU HA A 107 GLU H 1.0 1.9 4.9 1112 1112 A 103 LEU HDy% A 103 LEU HA 1.0 1.8 3.8 1113 1113 A 103 LEU HBy A 103 LEU HA 1.0 1.8 3.6 1114 1114 A 103 LEU HBx A 103 LEU HA 1.0 1.9 4.5 1115 1115 A 103 LEU HDx% A 103 LEU HBx 1.0 1.9 3.9 1116 1116 A 103 LEU HBx A 103 LEU HBy 1.0 1.6 2.6 1117 1117 A 103 LEU HDx% A 104 GLU H 1.0 2.0 5.6 1118 1118 A 103 LEU HDy% A 106 ASN HBx 1.0 2.0 5.6 1119 1119 A 103 LEU HBy A 103 LEU HDy% 1.0 2.0 5.4 1120 1120 A 103 LEU HA A 103 LEU HG 1.0 1.8 3.6 1121 1121 A 103 LEU HBy A 103 LEU HG 1.0 1.6 2.6 1122 1122 A 103 LEU HDx% A 103 LEU HA 1.0 1.9 4.5 1123 1123 A 103 LEU HDx% A 103 LEU HBy 1.0 1.5 2.7 1124 1124 A 103 LEU HDx% A 103 LEU HG 1.0 1.5 2.7 1125 1125 A 103 LEU HBx A 103 LEU HDy% 1.0 1.4 2.4 1126 1126 A 103 LEU HDx% A 103 LEU HDy% 1.0 1.5 2.5 1127 1127 A 104 GLU H A 105 ASN H 1.0 2.0 6.0 1128 1128 A 104 GLU H A 105 ASN HA 1.0 2.0 6.0 1129 1129 A 108 PHE HD% A 104 GLU H 1.0 1.9 6.0 1130 1130 A 104 GLU H A 107 GLU H 1.0 1.8 3.6 1131 1131 A 108 PHE HA A 104 GLU H 1.0 1.9 4.9 1132 1132 A 103 LEU HA A 104 GLU H 1.0 1.6 2.8 1133 1133 A 104 GLU H A 104 GLU HA 1.0 1.8 3.8 1134 1134 A 104 GLU HGx A 104 GLU HA 1.0 1.9 4.3 1135 1135 A 104 GLU HA A 104 GLU HBy 1.0 1.8 4.0 1136 1136 A 104 GLU HBy A 104 GLU HBx 1.0 1.3 2.2 1137 1137 A 104 GLU HGx A 104 GLU HGy 1.0 1.3 2.2 1138 1138 A 103 LEU HG A 105 ASN H 1.0 2.0 6.0 1139 1139 A 103 LEU HDy% A 105 ASN H 1.0 2.0 6.0 1140 1140 A 105 ASN HD2y A 105 ASN HBx 1.0 1.7 3.3 1141 1141 A 105 ASN HD2y A 105 ASN HBy 1.0 1.8 3.6 1142 1142 A 104 GLU HBx A 105 ASN HD2y 1.0 1.9 4.5 1143 1143 A 105 ASN HBx A 105 ASN HD2x 1.0 2.0 5.0 1144 1144 A 104 GLU HBx A 105 ASN HD2x 1.0 2.0 5.8 1145 1145 A 106 ASN HA A 105 ASN H 1.0 2.0 6.0 1146 1146 A 104 GLU HBy A 105 ASN HBy 1.0 2.0 6.0 1147 1147 A 106 ASN H A 105 ASN H 1.0 1.8 3.8 1148 1148 A 105 ASN H A 104 GLU HA 1.0 1.6 2.8 1149 1149 A 105 ASN H A 105 ASN HBy 1.0 1.9 4.9 1150 1150 A 104 GLU HGx A 105 ASN H 1.0 2.0 5.2 1151 1151 A 105 ASN H A 105 ASN HBx 1.0 1.9 4.5 1152 1152 A 105 ASN HBy A 105 ASN HD2x 1.0 2.0 5.2 1153 1153 A 106 ASN H A 105 ASN HBy 1.0 1.9 4.7 1154 1154 A 105 ASN H A 105 ASN HA 1.0 1.6 2.8 1155 1155 A 104 GLU HA A 105 ASN HBx 1.0 2.0 6.0 1156 1156 A 105 ASN HA A 105 ASN HBy 1.0 1.7 3.1 1157 1157 A 105 ASN HA A 105 ASN HBx 1.0 1.7 3.1 1158 1158 A 105 ASN HBx A 105 ASN HBy 1.0 1.4 2.2 1159 1159 A 106 ASN H A 104 GLU HA 1.0 2.0 4.6 1160 1160 A 106 ASN H A 105 ASN HA 1.0 1.7 3.3 1161 1161 A 106 ASN HA A 106 ASN H 1.0 1.6 2.6 1162 1162 A 106 ASN H A 105 ASN HBx 1.0 1.9 5.3 1163 1163 A 103 LEU HG A 106 ASN H 1.0 2.0 6.0 1164 1164 A 103 LEU HDx% A 106 ASN H 1.0 2.0 6.0 1165 1165 A 104 GLU HGx A 106 ASN H 1.0 0.0 6.0 1166 1166 A 107 GLU HA A 106 ASN H 1.0 2.0 6.0 1167 1167 A 106 ASN H A 106 ASN HD2x 1.0 2.0 6.0 1168 1168 A 106 ASN HA A 106 ASN HD2x 1.0 2.0 6.0 1169 1169 A 106 ASN HBx A 105 ASN HA 1.0 2.0 6.0 1170 1170 A 103 LEU HG A 106 ASN HA 1.0 2.0 5.4 1171 1171 A 106 ASN HBy A 106 ASN HD2x 1.0 2.0 5.4 1172 1172 A 106 ASN HBy A 106 ASN HD2y 1.0 1.8 3.8 1173 1173 A 106 ASN HBy A 107 GLU H 1.0 1.9 4.3 1174 1174 A 106 ASN HBy A 106 ASN H 1.0 1.9 4.3 1175 1175 A 106 ASN HBx A 106 ASN HD2x 1.0 2.0 5.4 1176 1176 A 106 ASN HBx A 106 ASN HD2y 1.0 1.9 4.3 1177 1177 A 106 ASN HBx A 107 GLU H 1.0 1.9 5.5 1178 1178 A 106 ASN HBx A 106 ASN H 1.0 1.9 4.9 1179 1179 A 106 ASN HA A 106 ASN HBx 1.0 1.6 2.8 1180 1180 A 106 ASN HA A 106 ASN HBy 1.0 1.8 3.4 1181 1181 A 106 ASN HBy A 106 ASN HBx 1.0 1.4 2.2 1182 1182 A 107 GLU HGy A 107 GLU HGx 1.0 1.3 2.2 1183 1183 A 107 GLU H A 109 ASN HD2y 1.0 2.0 6.0 1184 1184 A 107 GLU HA A 130 VAL HGy% 1.0 1.8 4.0 1185 1185 A 109 ASN HD2y A 107 GLU HBy 1.0 2.0 6.0 1186 1186 A 107 GLU HBy A 131 LEU H 1.0 2.0 4.8 1187 1187 A 107 GLU HBx A 109 ASN HD2x 1.0 2.0 6.0 1188 1188 A 105 ASN HD2y A 107 GLU HBx 1.0 1.9 5.5 1189 1189 A 107 GLU HA A 107 GLU HBy 1.0 1.8 3.8 1190 1190 A 107 GLU HA A 107 GLU HBx 1.0 1.8 3.6 1191 1191 A 107 GLU HBy A 107 GLU HBx 1.0 1.2 2.2 1192 1192 A 107 GLU H A 106 ASN H 1.0 1.7 3.3 1193 1193 A 107 GLU H A 105 ASN H 1.0 1.9 5.5 1194 1194 A 107 GLU H A 108 PHE H 1.0 2.0 6.0 1195 1195 A 107 GLU HA A 107 GLU H 1.0 1.8 4.0 1196 1196 A 106 ASN HA A 107 GLU H 1.0 1.8 3.6 1197 1197 A 107 GLU H A 105 ASN HBx 1.0 2.0 6.0 1198 1198 A 107 GLU H A 107 GLU HBy 1.0 1.8 3.6 1199 1199 A 107 GLU H A 107 GLU HBx 1.0 1.9 4.3 1200 1200 A 103 LEU HDy% A 108 PHE H 1.0 0.0 6.0 1201 1201 A 103 LEU HA A 108 PHE H 1.0 2.0 5.8 1202 1202 A 101 PHE HD% A 108 PHE HBy 1.0 1.9 4.5 1203 1203 A 108 PHE HD% A 108 PHE HBy 1.0 1.7 3.3 1204 1204 A 72 LEU HDy% A 108 PHE HBy 1.0 1.8 4.0 1205 1205 A 72 LEU HDy% A 108 PHE HBx 1.0 1.9 4.1 1206 1206 A 101 PHE HD% A 108 PHE HBx 1.0 1.8 3.4 1207 1207 A 103 LEU HG A 108 PHE HA 1.0 2.0 4.6 1208 1208 A 103 LEU HA A 108 PHE HA 1.0 1.5 2.5 1209 1209 A 108 PHE HD% A 108 PHE HA 1.0 1.8 4.0 1210 1210 A 108 PHE HD% A 108 PHE HBx 1.0 1.7 3.5 1211 1211 A 108 PHE HD% A 103 LEU HBy 1.0 2.0 4.8 1212 1212 A 108 PHE HD% A 103 LEU HG 1.0 1.9 4.3 1213 1213 A 109 ASN H A 108 PHE H 1.0 2.0 5.6 1214 1214 A 108 PHE HD% A 108 PHE H 1.0 1.7 3.5 1215 1215 A 108 PHE HA A 108 PHE H 1.0 1.8 4.0 1216 1216 A 108 PHE H A 108 PHE HBy 1.0 1.8 3.8 1217 1217 A 109 ASN HD2x A 108 PHE HBy 1.0 2.0 6.0 1218 1218 A 108 PHE HBx A 109 ASN HD2y 1.0 2.0 5.8 1219 1219 A 58 LEU H A 108 PHE HBy 1.0 0.0 6.0 1220 1220 A 109 ASN H A 108 PHE HBy 1.0 2.0 5.2 1221 1221 A 109 ASN H A 108 PHE HBx 1.0 1.9 4.9 1222 1222 A 108 PHE HBx A 108 PHE H 1.0 1.9 4.9 1223 1223 A 58 LEU HDy% A 108 PHE HBy 1.0 2.0 5.8 1224 1224 A 107 GLU HBy A 108 PHE H 1.0 2.0 4.6 1225 1225 A 107 GLU HBx A 108 PHE H 1.0 1.9 4.1 1226 1226 A 130 VAL HGy% A 108 PHE H 1.0 2.0 5.4 1227 1227 A 108 PHE HA A 108 PHE HBx 1.0 1.8 3.6 1228 1228 A 108 PHE HBx A 108 PHE HBy 1.0 1.5 2.5 1229 1229 A 108 PHE HA A 108 PHE HBy 1.0 2.0 4.8 1230 1230 A 109 ASN H A 130 VAL HA 1.0 2.0 6.0 1231 1231 A 108 PHE HD% A 109 ASN HD2y 1.0 2.0 6.0 1232 1232 A 109 ASN HD2y A 109 ASN HD2x 1.0 1.3 2.2 1233 1233 A 108 PHE HA A 109 ASN HD2y 1.0 2.0 4.6 1234 1234 A 103 LEU HA A 109 ASN HD2y 1.0 2.0 5.0 1235 1235 A 104 GLU H A 109 ASN HD2x 1.0 1.9 4.9 1236 1236 A 108 PHE HA A 109 ASN HD2x 1.0 2.0 6.0 1237 1237 A 103 LEU HA A 109 ASN HD2x 1.0 2.0 6.0 1238 1238 A 109 ASN HBx A 110 VAL H 1.0 1.8 3.6 1239 1239 A 109 ASN H A 109 ASN HBx 1.0 2.0 5.0 1240 1240 A 110 VAL H A 109 ASN HBy 1.0 1.9 5.3 1241 1241 A 109 ASN H A 109 ASN HBy 1.0 1.8 3.6 1242 1242 A 130 VAL HA A 109 ASN HA 1.0 1.8 3.4 1243 1243 A 109 ASN HBy A 129 ALA H 1.0 2.0 6.0 1244 1244 A 109 ASN HBx A 129 ALA H 1.0 1.9 4.7 1245 1245 A 109 ASN HBx A 131 LEU H 1.0 2.0 6.0 1246 1246 A 131 LEU H A 109 ASN HBy 1.0 2.0 6.0 1247 1247 A 109 ASN HD2y A 109 ASN HBy 1.0 1.8 3.4 1248 1248 A 109 ASN HBx A 109 ASN HD2y 1.0 1.9 4.9 1249 1249 A 110 VAL HA A 109 ASN HBx 1.0 2.0 5.6 1250 1250 A 111 VAL HA A 109 ASN HBx 1.0 2.0 6.0 1251 1251 A 109 ASN HBx A 130 VAL HA 1.0 1.9 4.3 1252 1252 A 108 PHE HA A 109 ASN HBy 1.0 2.0 6.0 1253 1253 A 130 VAL HA A 109 ASN HBy 1.0 2.0 5.8 1254 1254 A 102 ARG H A 109 ASN HBy 1.0 1.9 4.3 1255 1255 A 109 ASN HBy A 129 ALA HB% 1.0 2.0 6.0 1256 1256 A 109 ASN HBx A 109 ASN HA 1.0 1.8 3.4 1257 1257 A 109 ASN HBx A 109 ASN HBy 1.0 1.4 2.2 1258 1258 A 109 ASN HBy A 109 ASN HA 1.0 2.0 4.4 1259 1259 A 109 ASN H A 104 GLU H 1.0 2.0 6.0 1260 1260 A 108 PHE HD% A 109 ASN H 1.0 2.0 5.8 1261 1261 A 109 ASN H A 109 ASN HD2y 1.0 1.8 3.6 1262 1262 A 109 ASN H A 109 ASN HA 1.0 1.9 4.1 1263 1263 A 109 ASN H A 108 PHE HA 1.0 1.7 2.9 1264 1264 A 109 ASN H A 103 LEU HA 1.0 1.9 4.5 1265 1265 A 72 LEU HDy% A 109 ASN H 1.0 2.0 6.0 1266 1266 A 110 VAL HGy% A 128 SER HA 1.0 1.9 4.9 1267 1267 A 128 SER HA A 110 VAL HGx% 1.0 1.9 4.9 1268 1268 A 109 ASN HA A 110 VAL HGx% 1.0 1.9 4.5 1269 1269 A 98 HIS HD2 A 110 VAL HGx% 1.0 2.0 5.2 1270 1270 A 111 VAL H A 110 VAL HGx% 1.0 2.0 5.0 1271 1271 A 110 VAL H A 110 VAL HGx% 1.0 1.7 3.1 1272 1272 A 99 ALA HB% A 110 VAL HGy% 1.0 1.7 3.3 1273 1273 A 131 LEU H A 110 VAL H 1.0 2.0 5.8 1274 1274 A 110 VAL H A 109 ASN HA 1.0 1.7 3.3 1275 1275 A 110 VAL HA A 110 VAL H 1.0 2.0 4.4 1276 1276 A 98 HIS HD2 A 110 VAL HB 1.0 2.0 5.2 1277 1277 A 130 VAL HA A 110 VAL H 1.0 2.0 5.4 1278 1278 A 110 VAL HGy% A 110 VAL H 1.0 1.9 4.7 1279 1279 A 110 VAL HGx% A 126 VAL H 1.0 2.0 6.0 1280 1280 A 110 VAL HA A 110 VAL HB 1.0 1.9 4.5 1281 1281 A 110 VAL HA A 110 VAL HGy% 1.0 1.9 3.9 1282 1282 A 110 VAL HGy% A 110 VAL HB 1.0 1.7 3.1 1283 1283 A 110 VAL HGy% A 110 VAL HGx% 1.0 1.5 2.7 1284 1284 A 110 VAL HGx% A 110 VAL HB 1.0 1.6 3.0 1285 1285 A 111 VAL H A 111 VAL HB 1.0 1.7 3.1 1286 1286 A 100 GLU H A 111 VAL H 1.0 1.8 3.4 1287 1287 A 111 VAL H A 110 VAL HA 1.0 1.7 3.1 1288 1288 A 111 VAL H A 110 VAL HGy% 1.0 1.9 3.9 1289 1289 A 111 VAL H A 101 PHE HA 1.0 0.0 6.0 1290 1290 A 111 VAL H A 110 VAL HB 1.0 1.8 3.6 1291 1291 A 111 VAL HA A 112 ASP H 1.0 1.7 2.9 1292 1292 A 109 ASN HBx A 111 VAL HGy% 1.0 1.9 4.1 1293 1293 A 109 ASN HBy A 111 VAL HGy% 1.0 1.9 3.9 1294 1294 A 98 HIS HA A 111 VAL HGx% 1.0 0.0 6.0 1295 1295 A 100 GLU H A 111 VAL HB 1.0 1.9 4.1 1296 1296 A 110 VAL HA A 111 VAL HB 1.0 2.0 6.0 1297 1297 A 128 SER HA A 111 VAL HB 1.0 2.0 5.2 1298 1298 A 102 ARG HE A 111 VAL HB 1.0 2.0 4.8 1299 1299 A 99 ALA HB% A 111 VAL HB 1.0 2.0 6.0 1300 1300 A 102 ARG H A 111 VAL HGy% 1.0 2.0 5.2 1301 1301 A 111 VAL HA A 111 VAL HB 1.0 1.9 4.1 1302 1302 A 113 VAL H A 112 ASP H 1.0 1.9 6.0 1303 1303 A 98 HIS HE1 A 112 ASP H 1.0 2.0 6.0 1304 1304 A 128 SER HA A 112 ASP H 1.0 1.9 4.9 1305 1305 A 112 ASP H A 127 ASP HA 1.0 1.9 4.1 1306 1306 A 112 ASP H A 112 ASP HBy 1.0 1.9 4.3 1307 1307 A 112 ASP H A 112 ASP HBx 1.0 1.8 3.6 1308 1308 A 112 ASP HBy A 119 THR HB 1.0 2.0 4.8 1309 1309 A 137 VAL HGx% A 112 ASP HA 1.0 2.0 5.8 1310 1310 A 113 VAL HGy% A 112 ASP HA 1.0 1.9 4.9 1311 1311 A 112 ASP HA A 99 ALA HA 1.0 1.9 4.5 1312 1312 A 112 ASP HA A 113 VAL H 1.0 1.7 2.9 1313 1313 A 112 ASP HA A 112 ASP H 1.0 1.9 3.9 1314 1314 A 112 ASP HA A 113 VAL HGx% 1.0 2.0 4.6 1315 1315 A 113 VAL HGy% A 112 ASP HBx 1.0 1.9 6.0 1316 1316 A 98 HIS HE1 A 112 ASP HBx 1.0 2.0 6.0 1317 1317 A 113 VAL H A 112 ASP HBx 1.0 1.9 6.0 1318 1318 A 98 HIS HE1 A 112 ASP HBy 1.0 2.0 6.0 1319 1319 A 112 ASP HBy A 112 ASP HBx 1.0 1.6 2.8 1320 1320 A 112 ASP HA A 112 ASP HBy 1.0 1.7 3.3 1321 1321 A 112 ASP HA A 112 ASP HBx 1.0 1.9 3.9 1322 1322 A 113 VAL H A 114 GLY HAx 1.0 1.9 4.3 1323 1323 A 113 VAL H A 113 VAL HB 1.0 1.9 4.3 1324 1324 A 114 GLY HAx A 113 VAL HB 1.0 2.0 5.4 1325 1325 A 111 VAL HGx% A 113 VAL HA 1.0 2.0 4.8 1326 1326 A 113 VAL H A 113 VAL HA 1.0 1.9 3.9 1327 1327 A 113 VAL HGx% A 111 VAL HB 1.0 2.0 4.8 1328 1328 A 100 GLU HBx A 113 VAL HGx% 1.0 0.0 6.0 1329 1329 A 99 ALA HA A 113 VAL HGx% 1.0 1.9 4.3 1330 1330 A 113 VAL H A 113 VAL HGx% 1.0 1.8 3.8 1331 1331 A 100 GLU H A 113 VAL HGx% 1.0 1.9 4.5 1332 1332 A 113 VAL HGy% A 99 ALA HB% 1.0 2.0 4.6 1333 1333 A 98 HIS HBx A 113 VAL HGy% 1.0 2.0 5.4 1334 1334 A 113 VAL HGy% A 98 HIS HA 1.0 1.9 3.7 1335 1335 A 113 VAL HGy% A 99 ALA HA 1.0 1.7 3.1 1336 1336 A 98 HIS H A 113 VAL HGy% 1.0 2.0 5.2 1337 1337 A 113 VAL HGy% A 113 VAL H 1.0 1.7 3.3 1338 1338 A 113 VAL HGy% A 99 ALA H 1.0 1.9 4.3 1339 1339 A 113 VAL HGy% A 100 GLU H 1.0 2.0 5.2 1340 1340 A 113 VAL HGy% A 100 GLU HGy 1.0 1.9 4.3 1341 1341 A 113 VAL HGx% A 100 GLU HGy 1.0 1.8 3.6 1342 1342 A 100 GLU HGx A 113 VAL HGx% 1.0 1.9 4.9 1343 1343 A 113 VAL HGx% A 111 VAL HGx% 1.0 1.5 2.5 1344 1344 A 113 VAL HGx% A 97 ARG HGy 1.0 2.0 5.6 1345 1345 A 100 GLU HGx A 113 VAL HGy% 1.0 0.0 6.0 1346 1346 A 113 VAL HGx% A 114 GLY H 1.0 2.0 6.0 1347 1347 A 113 VAL HGy% A 115 SER HBx 1.0 2.0 6.0 1348 1348 A 113 VAL HGy% A 114 GLY H 1.0 1.8 3.6 1349 1349 A 113 VAL H A 99 ALA HA 1.0 1.9 4.1 1350 1350 A 113 VAL HGx% A 113 VAL HA 1.0 1.7 3.1 1351 1351 A 113 VAL HB A 113 VAL HA 1.0 1.7 3.1 1352 1352 A 113 VAL HGx% A 113 VAL HB 1.0 1.6 2.8 1353 1353 A 113 VAL HGy% A 113 VAL HA 1.0 1.9 4.1 1354 1354 A 113 VAL HGy% A 113 VAL HB 1.0 1.6 2.8 1355 1355 A 112 ASP HA A 114 GLY H 1.0 2.0 6.0 1356 1356 A 114 GLY HAx A 114 GLY H 1.0 1.8 3.4 1357 1357 A 115 SER HBy A 114 GLY H 1.0 2.0 6.0 1358 1358 A 113 VAL HB A 114 GLY H 1.0 2.0 5.8 1359 1359 A 114 GLY H A 114 GLY HAy 1.0 1.8 3.6 1360 1360 A 114 GLY HAy A 115 SER H 1.0 2.0 6.0 1361 1361 A 114 GLY HAx A 115 SER H 1.0 1.9 3.9 1362 1362 A 114 GLY HAx A 114 GLY HAy 1.0 1.5 2.5 1363 1363 A 114 GLY H A 115 SER H 1.0 1.8 3.4 1364 1364 A 113 VAL H A 115 SER H 1.0 2.0 5.6 1365 1365 A 115 SER H A 115 SER HA 1.0 1.9 4.3 1366 1366 A 115 SER HBy A 115 SER H 1.0 1.9 5.1 1367 1367 A 115 SER HBx A 115 SER H 1.0 1.9 4.3 1368 1368 A 116 LEU H A 115 SER HA 1.0 1.9 3.9 1369 1369 A 115 SER HBx A 115 SER HA 1.0 1.9 4.7 1370 1370 A 115 SER HBy A 115 SER HA 1.0 1.8 3.6 1371 1371 A 115 SER HBx A 115 SER HBy 1.0 1.7 3.3 1372 1372 A 116 LEU HDx% A 116 LEU HDy% 1.0 1.5 2.5 1373 1373 A 21 THR HG2% A 116 LEU HDx% 1.0 1.5 2.5 1374 1374 A 116 LEU HBx A 116 LEU HDx% 1.0 1.8 3.6 1375 1375 A 116 LEU H A 117 ASN H 1.0 2.0 5.0 1376 1376 A 116 LEU H A 140 GLY H 1.0 2.0 5.6 1377 1377 A 116 LEU HDy% A 117 ASN H 1.0 1.9 4.5 1378 1378 A 116 LEU HDy% A 93 THR HB 1.0 1.9 4.5 1379 1379 A 116 LEU HDy% A 24 VAL HB 1.0 1.8 3.6 1380 1380 A 116 LEU HBx A 116 LEU H 1.0 1.9 3.9 1381 1381 A 116 LEU HDy% A 117 ASN HA 1.0 1.9 4.7 1382 1382 A 116 LEU HDy% A 117 ASN HBx 1.0 2.0 6.0 1383 1383 A 21 THR H A 116 LEU HDy% 1.0 0.0 6.0 1384 1384 A 116 LEU HDx% A 117 ASN HA 1.0 2.0 5.8 1385 1385 A 116 LEU HDx% A 116 LEU H 1.0 2.0 5.0 1386 1386 A 116 LEU HDx% A 117 ASN H 1.0 2.0 6.0 1387 1387 A 116 LEU H A 116 LEU HA 1.0 1.8 3.6 1388 1388 A 116 LEU HDy% A 116 LEU HA 1.0 1.9 5.3 1389 1389 A 21 THR HG2% A 116 LEU HA 1.0 2.0 6.0 1390 1390 A 116 LEU HBx A 116 LEU HA 1.0 1.8 3.8 1391 1391 A 21 THR HG2% A 116 LEU HBx 1.0 2.0 6.0 1392 1392 A 116 LEU HBx A 116 LEU HBy 1.0 1.6 2.6 1393 1393 A 116 LEU HDy% A 116 LEU HBy 1.0 1.8 3.4 1394 1394 A 116 LEU HBx A 116 LEU HDy% 1.0 1.7 3.1 1395 1395 A 117 ASN HA A 117 ASN HBx 1.0 1.9 3.9 1396 1396 A 117 ASN HA A 117 ASN HBy 1.0 1.8 3.4 1397 1397 A 117 ASN HBx A 117 ASN HBy 1.0 1.7 2.9 1398 1398 A 117 ASN H A 118 GLY H 1.0 1.9 3.7 1399 1399 A 117 ASN HA A 117 ASN H 1.0 1.9 4.5 1400 1400 A 116 LEU HBx A 117 ASN H 1.0 1.8 3.6 1401 1401 A 141 LYS HBy A 117 ASN H 1.0 2.0 5.4 1402 1402 A 117 ASN HA A 25 PHE HA 1.0 0.0 6.0 1403 1403 A 141 LYS HBy A 117 ASN HA 1.0 1.9 6.0 1404 1404 A 117 ASN HBy A 118 GLY H 1.0 2.0 6.0 1405 1405 A 25 PHE H A 117 ASN HBy 1.0 1.9 4.7 1406 1406 A 117 ASN H A 117 ASN HBy 1.0 2.0 5.8 1407 1407 A 117 ASN HBx A 118 GLY H 1.0 2.0 6.0 1408 1408 A 117 ASN HBx A 117 ASN H 1.0 1.8 3.6 1409 1409 A 24 VAL HGy% A 117 ASN HA 1.0 1.9 4.7 1410 1410 A 118 GLY HAy A 118 GLY HAx 1.0 1.7 3.1 1411 1411 A 118 GLY H A 119 THR H 1.0 2.0 5.6 1412 1412 A 117 ASN HA A 118 GLY H 1.0 1.9 4.7 1413 1413 A 118 GLY H A 118 GLY HAx 1.0 1.7 3.5 1414 1414 A 118 GLY H A 118 GLY HAy 1.0 1.9 4.1 1415 1415 A 115 SER HBx A 118 GLY H 1.0 1.9 4.3 1416 1416 A 116 LEU HBx A 118 GLY H 1.0 1.9 6.0 1417 1417 A 119 THR HA A 119 THR HG2% 1.0 1.8 4.0 1418 1418 A 119 THR HB A 119 THR HA 1.0 1.9 4.7 1419 1419 A 119 THR HB A 119 THR HG2% 1.0 1.6 2.8 1420 1420 A 119 THR H A 119 THR HA 1.0 1.9 4.7 1421 1421 A 118 GLY HAx A 119 THR H 1.0 1.8 3.6 1422 1422 A 118 GLY HAy A 119 THR H 1.0 1.8 3.6 1423 1423 A 119 THR HB A 126 VAL HGy% 1.0 2.0 5.8 1424 1424 A 112 ASP HBx A 119 THR HB 1.0 2.0 5.8 1425 1425 A 98 HIS HE1 A 119 THR HA 1.0 1.9 4.3 1426 1426 A 98 HIS HE1 A 119 THR HG2% 1.0 1.5 2.7 1427 1427 A 99 ALA HB% A 119 THR HB 1.0 2.0 6.0 1428 1428 A 98 HIS HE1 A 119 THR HB 1.0 1.9 5.7 1429 1429 A 119 THR HB A 119 THR H 1.0 2.0 4.4 1430 1430 A 119 THR H A 119 THR HG2% 1.0 2.0 5.6 1431 1431 A 98 HIS HD1 A 119 THR HG2% 1.0 1.9 4.3 1432 1432 A 119 THR HG2% A 120 TYR HA 1.0 1.8 4.2 1433 1433 A 120 TYR HA A 120 TYR HBy 1.0 1.9 4.5 1434 1434 A 120 TYR HBx A 120 TYR HA 1.0 1.9 4.3 1435 1435 A 120 TYR HBx A 120 TYR HBy 1.0 1.7 3.1 1436 1436 A 98 HIS HD1 A 120 TYR H 1.0 1.9 6.0 1437 1437 A 119 THR HB A 120 TYR H 1.0 1.9 6.0 1438 1438 A 126 VAL HGy% A 120 TYR H 1.0 2.0 6.0 1439 1439 A 120 TYR H A 139 ILE H 1.0 2.0 6.0 1440 1440 A 120 TYR HBx A 120 TYR HD% 1.0 1.9 4.1 1441 1441 A 120 TYR HA A 125 PRO HA 1.0 1.8 3.8 1442 1442 A 120 TYR HA A 121 VAL H 1.0 1.7 3.3 1443 1443 A 120 TYR H A 138 GLN H 1.0 1.9 4.7 1444 1444 A 120 TYR HA A 120 TYR H 1.0 1.9 4.3 1445 1445 A 119 THR HA A 120 TYR H 1.0 1.7 3.3 1446 1446 A 120 TYR HBx A 120 TYR H 1.0 2.0 5.4 1447 1447 A 119 THR HG2% A 120 TYR H 1.0 1.8 3.6 1448 1448 A 120 TYR HBy A 120 TYR HD% 1.0 1.8 3.8 1449 1449 A 120 TYR HD% A 120 TYR HE% 1.0 1.6 2.8 1450 1450 A 120 TYR HE% A 124 GLU HA 1.0 1.9 4.9 1451 1451 A 120 TYR HE% A 125 PRO HDx 1.0 2.0 4.6 1452 1452 A 119 THR HA A 120 TYR HD% 1.0 1.9 5.1 1453 1453 A 120 TYR HE% A 125 PRO HBy 1.0 1.9 6.0 1454 1454 A 120 TYR HE% A 125 PRO HBx 1.0 2.0 5.6 1455 1455 A 120 TYR HD% A 125 PRO HDx 1.0 2.0 4.6 1456 1456 A 120 TYR HD% A 125 PRO HA 1.0 2.0 5.2 1457 1457 A 120 TYR HD% A 124 GLU HA 1.0 1.9 4.7 1458 1458 A 120 TYR HA A 120 TYR HD% 1.0 1.9 4.5 1459 1459 A 120 TYR HD% A 125 PRO HBx 1.0 2.0 5.0 1460 1460 A 29 PHE HZ A 120 TYR HD% 1.0 1.9 5.3 1461 1461 A 126 VAL HGy% A 120 TYR HA 1.0 2.0 6.0 1462 1462 A 121 VAL HB A 121 VAL HA 1.0 1.8 3.8 1463 1463 A 121 VAL HA A 121 VAL HGx% 1.0 1.8 3.8 1464 1464 A 121 VAL HB A 121 VAL HGx% 1.0 1.7 3.1 1465 1465 A 121 VAL HA A 121 VAL HGy% 1.0 1.6 2.8 1466 1466 A 121 VAL HB A 121 VAL HGy% 1.0 1.4 2.4 1467 1467 A 125 PRO HA A 121 VAL H 1.0 1.9 4.3 1468 1468 A 121 VAL H A 121 VAL HB 1.0 1.8 3.4 1469 1469 A 138 GLN H A 121 VAL HA 1.0 1.9 4.3 1470 1470 A 121 VAL H A 121 VAL HA 1.0 1.9 4.1 1471 1471 A 121 VAL H A 121 VAL HGx% 1.0 1.9 5.1 1472 1472 A 121 VAL H A 121 VAL HGy% 1.0 1.8 4.0 1473 1473 A 121 VAL HA A 137 VAL HA 1.0 1.8 3.6 1474 1474 A 121 VAL HB A 122 ASN HD2x 1.0 2.0 5.6 1475 1475 A 110 VAL H A 121 VAL HGx% 1.0 1.9 5.1 1476 1476 A 121 VAL HGx% A 122 ASN H 1.0 2.0 5.4 1477 1477 A 123 ARG H A 121 VAL HGy% 1.0 2.0 5.4 1478 1478 A 121 VAL HGy% A 122 ASN H 1.0 1.9 4.9 1479 1479 A 121 VAL HGy% A 122 ASN HD2x 1.0 1.9 4.7 1480 1480 A 98 HIS HE1 A 121 VAL HGy% 1.0 1.9 4.3 1481 1481 A 121 VAL HGx% A 137 VAL HA 1.0 1.9 5.1 1482 1482 A 112 ASP HBy A 121 VAL HGy% 1.0 0.0 6.0 1483 1483 A 110 VAL HGy% A 121 VAL HGy% 1.0 1.8 4.0 1484 1484 A 122 ASN HA A 122 ASN HBx 1.0 1.8 3.4 1485 1485 A 122 ASN HA A 122 ASN HBy 1.0 1.9 4.1 1486 1486 A 122 ASN HBx A 122 ASN HBy 1.0 1.4 2.2 1487 1487 A 121 VAL H A 122 ASN H 1.0 2.0 6.0 1488 1488 A 122 ASN H A 122 ASN HD2y 1.0 2.0 5.0 1489 1489 A 122 ASN HD2x A 122 ASN HD2y 1.0 1.7 2.9 1490 1490 A 122 ASN HBy A 122 ASN HD2y 1.0 1.9 4.5 1491 1491 A 122 ASN HD2x A 135 ASP HA 1.0 2.0 6.0 1492 1492 A 121 VAL HGx% A 122 ASN HD2x 1.0 1.9 4.5 1493 1493 A 137 VAL HA A 122 ASN H 1.0 1.9 4.7 1494 1494 A 121 VAL HA A 122 ASN H 1.0 1.7 3.1 1495 1495 A 122 ASN H A 122 ASN HA 1.0 1.8 3.4 1496 1496 A 122 ASN H A 122 ASN HBx 1.0 2.0 5.8 1497 1497 A 121 VAL HB A 122 ASN H 1.0 2.0 5.8 1498 1498 A 122 ASN HBy A 124 GLU H 1.0 1.8 3.6 1499 1499 A 122 ASN HBx A 122 ASN HD2y 1.0 1.8 3.6 1500 1500 A 122 ASN HD2x A 122 ASN HBy 1.0 2.0 5.2 1501 1501 A 122 ASN H A 122 ASN HBy 1.0 2.0 6.0 1502 1502 A 122 ASN HA A 122 ASN HD2y 1.0 1.9 3.9 1503 1503 A 123 ARG H A 122 ASN H 1.0 1.9 4.3 1504 1504 A 123 ARG H A 124 GLU H 1.0 1.9 4.3 1505 1505 A 123 ARG H A 121 VAL HA 1.0 2.0 6.0 1506 1506 A 123 ARG H A 123 ARG HGy 1.0 1.9 4.5 1507 1507 A 123 ARG H A 124 GLU HGx 1.0 2.0 6.0 1508 1508 A 120 TYR HE% A 123 ARG HE 1.0 0.0 6.0 1509 1509 A 123 ARG HE A 123 ARG HBx 1.0 1.9 4.1 1510 1510 A 123 ARG HGy A 123 ARG HE 1.0 1.9 4.1 1511 1511 A 123 ARG H A 123 ARG HE 1.0 0.0 6.0 1512 1512 A 120 TYR HE% A 123 ARG HA 1.0 2.0 5.2 1513 1513 A 124 GLU H A 123 ARG HA 1.0 1.9 4.5 1514 1514 A 124 GLU HA A 124 GLU HGy 1.0 1.9 4.5 1515 1515 A 124 GLU HA A 124 GLU HBx 1.0 1.9 3.9 1516 1516 A 124 GLU HBx A 124 GLU HBy 1.0 1.4 2.2 1517 1517 A 124 GLU HA A 124 GLU HBy 1.0 1.9 3.9 1518 1518 A 124 GLU HGx A 124 GLU HBy 1.0 1.6 2.6 1519 1519 A 124 GLU HGx A 124 GLU HBx 1.0 1.7 3.3 1520 1520 A 124 GLU HGx A 124 GLU HGy 1.0 1.3 2.2 1521 1521 A 124 GLU HGy A 124 GLU HBy 1.0 1.8 3.4 1522 1522 A 122 ASN H A 124 GLU H 1.0 2.0 6.0 1523 1523 A 120 TYR HD% A 124 GLU H 1.0 2.0 4.8 1524 1524 A 121 VAL H A 124 GLU H 1.0 1.8 3.8 1525 1525 A 124 GLU HGy A 124 GLU HBx 1.0 1.5 2.7 1526 1526 A 124 GLU H A 124 GLU HGy 1.0 1.8 3.4 1527 1527 A 124 GLU HGy A 126 VAL HGx% 1.0 2.0 6.0 1528 1528 A 124 GLU HGx A 126 VAL HGx% 1.0 1.9 3.9 1529 1529 A 125 PRO HDx A 124 GLU HGx 1.0 2.0 5.4 1530 1530 A 125 PRO HDx A 124 GLU HGy 1.0 2.0 5.6 1531 1531 A 124 GLU H A 124 GLU HBx 1.0 1.8 3.8 1532 1532 A 124 GLU HA A 125 PRO HDx 1.0 1.7 3.3 1533 1533 A 124 GLU HA A 125 PRO HDy 1.0 1.7 3.3 1534 1534 A 126 VAL H A 124 GLU HGy 1.0 2.0 6.0 1535 1535 A 122 ASN HBy A 124 GLU HGy 1.0 1.8 4.2 1536 1536 A 122 ASN HBy A 124 GLU HGx 1.0 2.0 5.8 1537 1537 A 124 GLU H A 124 GLU HBy 1.0 2.0 5.6 1538 1538 A 124 GLU HA A 124 GLU H 1.0 1.8 4.0 1539 1539 A 124 GLU H A 124 GLU HGx 1.0 1.9 4.5 1540 1540 A 125 PRO HA A 125 PRO HBx 1.0 1.8 3.4 1541 1541 A 125 PRO HA A 125 PRO HBy 1.0 1.9 3.9 1542 1542 A 125 PRO HA A 125 PRO HDx 1.0 1.8 3.6 1543 1543 A 125 PRO HBy A 125 PRO HBx 1.0 1.5 2.5 1544 1544 A 125 PRO HBy A 125 PRO HGx 1.0 1.9 4.1 1545 1545 A 125 PRO HBy A 125 PRO HGy 1.0 1.8 3.4 1546 1546 A 125 PRO HBx A 125 PRO HGy 1.0 2.0 4.8 1547 1547 A 125 PRO HDx A 125 PRO HGy 1.0 1.9 4.5 1548 1548 A 125 PRO HGx A 125 PRO HGy 1.0 1.5 2.5 1549 1549 A 125 PRO HBx A 125 PRO HGx 1.0 1.7 3.3 1550 1550 A 125 PRO HDx A 125 PRO HGx 1.0 1.7 3.1 1551 1551 A 125 PRO HDy A 125 PRO HGx 1.0 1.9 3.9 1552 1552 A 125 PRO HDx A 125 PRO HDy 1.0 1.5 2.5 1553 1553 A 125 PRO HDy A 125 PRO HGy 1.0 1.8 3.4 1554 1554 A 120 TYR HE% A 125 PRO HGx 1.0 2.0 5.2 1555 1555 A 126 VAL H A 125 PRO HBx 1.0 2.0 5.8 1556 1556 A 126 VAL H A 125 PRO HBy 1.0 2.0 4.8 1557 1557 A 124 GLU HA A 125 PRO HGy 1.0 1.9 6.0 1558 1558 A 124 GLU HA A 125 PRO HGx 1.0 2.0 6.0 1559 1559 A 124 GLU HBx A 125 PRO HDy 1.0 2.0 5.6 1560 1560 A 120 TYR HE% A 125 PRO HDy 1.0 2.0 6.0 1561 1561 A 126 VAL HA A 126 VAL HB 1.0 1.7 3.3 1562 1562 A 126 VAL HGx% A 126 VAL HB 1.0 1.6 3.0 1563 1563 A 126 VAL HGx% A 126 VAL HA 1.0 1.6 3.0 1564 1564 A 126 VAL HGy% A 126 VAL HGx% 1.0 1.6 2.6 1565 1565 A 126 VAL HGy% A 126 VAL HA 1.0 1.9 4.1 1566 1566 A 126 VAL HGy% A 126 VAL HB 1.0 1.6 2.8 1567 1567 A 126 VAL H A 121 VAL H 1.0 1.9 4.5 1568 1568 A 98 HIS HE1 A 126 VAL H 1.0 2.0 6.0 1569 1569 A 126 VAL H A 126 VAL HA 1.0 1.8 4.0 1570 1570 A 126 VAL H A 125 PRO HA 1.0 1.6 2.8 1571 1571 A 129 ALA HB% A 126 VAL H 1.0 1.8 6.0 1572 1572 A 126 VAL H A 126 VAL HGy% 1.0 1.7 2.9 1573 1573 A 126 VAL H A 126 VAL HB 1.0 1.9 5.3 1574 1574 A 121 VAL H A 126 VAL HGx% 1.0 1.9 3.7 1575 1575 A 110 VAL HGy% A 126 VAL HGy% 1.0 1.9 4.3 1576 1576 A 126 VAL HGy% A 121 VAL HB 1.0 1.7 3.3 1577 1577 A 126 VAL HGy% A 125 PRO HA 1.0 2.0 5.4 1578 1578 A 129 ALA HB% A 126 VAL HA 1.0 2.0 6.0 1579 1579 A 126 VAL HGx% A 128 SER H 1.0 1.9 4.9 1580 1580 A 120 TYR HA A 126 VAL HGx% 1.0 0.0 6.0 1581 1581 A 129 ALA H A 126 VAL HGy% 1.0 1.9 4.1 1582 1582 A 127 ASP HA A 127 ASP HBx 1.0 1.8 3.4 1583 1583 A 127 ASP HBx A 127 ASP HBy 1.0 1.5 2.3 1584 1584 A 127 ASP HA A 127 ASP HBy 1.0 1.7 3.5 1585 1585 A 126 VAL HA A 127 ASP H 1.0 1.7 3.3 1586 1586 A 126 VAL HB A 127 ASP H 1.0 1.7 3.1 1587 1587 A 126 VAL HGy% A 127 ASP H 1.0 1.9 4.9 1588 1588 A 128 SER HA A 127 ASP H 1.0 1.9 6.0 1589 1589 A 127 ASP HA A 112 ASP HBy 1.0 2.0 5.6 1590 1590 A 128 SER H A 127 ASP HBy 1.0 1.8 3.4 1591 1591 A 128 SER HBy A 128 SER HBx 1.0 1.2 2.2 1592 1592 A 128 SER H A 127 ASP H 1.0 1.7 2.9 1593 1593 A 129 ALA H A 128 SER H 1.0 2.0 5.4 1594 1594 A 128 SER HA A 128 SER H 1.0 1.8 3.8 1595 1595 A 126 VAL HA A 128 SER H 1.0 2.0 5.4 1596 1596 A 126 VAL HB A 128 SER H 1.0 1.9 3.9 1597 1597 A 129 ALA HB% A 128 SER H 1.0 2.0 5.2 1598 1598 A 126 VAL HGy% A 128 SER H 1.0 1.9 4.5 1599 1599 A 111 VAL HA A 128 SER HA 1.0 1.8 3.4 1600 1600 A 128 SER HA A 126 VAL HGy% 1.0 2.0 4.8 1601 1601 A 102 ARG H A 128 SER HA 1.0 0.0 6.0 1602 1602 A 112 ASP H A 128 SER HBx 1.0 1.9 4.3 1603 1603 A 110 VAL HA A 128 SER HA 1.0 2.0 4.8 1604 1604 A 129 ALA HB% A 129 ALA HA 1.0 1.7 2.9 1605 1605 A 110 VAL H A 129 ALA HB% 1.0 2.0 4.6 1606 1606 A 129 ALA HB% A 126 VAL HB 1.0 1.7 3.3 1607 1607 A 129 ALA HB% A 126 VAL HGy% 1.0 1.6 3.0 1608 1608 A 110 VAL H A 129 ALA H 1.0 1.8 3.4 1609 1609 A 129 ALA H A 130 VAL H 1.0 2.0 5.4 1610 1610 A 129 ALA H A 128 SER HA 1.0 1.6 3.0 1611 1611 A 126 VAL HGy% A 129 ALA HA 1.0 2.0 6.0 1612 1612 A 129 ALA HA A 130 VAL H 1.0 1.5 2.7 1613 1613 A 130 VAL HGx% A 130 VAL HB 1.0 1.6 2.6 1614 1614 A 130 VAL H A 130 VAL HB 1.0 1.7 2.9 1615 1615 A 129 ALA HB% A 130 VAL H 1.0 1.9 4.1 1616 1616 A 130 VAL HGy% A 130 VAL HA 1.0 1.6 2.8 1617 1617 A 109 ASN HA A 130 VAL HGx% 1.0 2.0 4.4 1618 1618 A 130 VAL HA A 130 VAL H 1.0 0.0 6.0 1619 1619 A 131 LEU HA A 131 LEU HBx 1.0 1.9 4.1 1620 1620 A 131 LEU HBx A 131 LEU HBy 1.0 1.6 2.8 1621 1621 A 131 LEU HBy A 131 LEU HG 1.0 1.8 3.8 1622 1622 A 131 LEU HA A 131 LEU HG 1.0 1.8 3.6 1623 1623 A 131 LEU HBx A 131 LEU HG 1.0 1.7 3.1 1624 1624 A 131 LEU H A 108 PHE HBy 1.0 2.0 5.4 1625 1625 A 131 LEU H A 129 ALA HA 1.0 0.0 6.0 1626 1626 A 131 LEU H A 108 PHE H 1.0 1.9 5.3 1627 1627 A 131 LEU H A 132 ALA H 1.0 2.0 5.0 1628 1628 A 131 LEU H A 109 ASN HA 1.0 1.9 4.1 1629 1629 A 131 LEU H A 131 LEU HA 1.0 1.9 4.1 1630 1630 A 131 LEU H A 130 VAL HA 1.0 1.6 3.0 1631 1631 A 108 PHE HBx A 131 LEU H 1.0 2.0 5.6 1632 1632 A 131 LEU H A 130 VAL HB 1.0 2.0 5.2 1633 1633 A 58 LEU HG A 131 LEU H 1.0 0.0 6.0 1634 1634 A 130 VAL HGy% A 131 LEU H 1.0 1.8 3.8 1635 1635 A 131 LEU H A 131 LEU HBx 1.0 1.9 5.3 1636 1636 A 131 LEU H A 131 LEU HBy 1.0 1.9 3.9 1637 1637 A 58 LEU HG A 131 LEU HG 1.0 1.6 2.8 1638 1638 A 58 LEU HBy A 131 LEU HG 1.0 2.0 5.0 1639 1639 A 146 PHE HBx A 131 LEU HG 1.0 0.0 6.0 1640 1640 A 108 PHE HBy A 131 LEU HG 1.0 1.9 4.1 1641 1641 A 131 LEU HG A 148 THR HB 1.0 0.0 6.0 1642 1642 A 109 ASN HA A 131 LEU HG 1.0 2.0 5.4 1643 1643 A 131 LEU HG A 146 PHE HD% 1.0 1.7 3.1 1644 1644 A 131 LEU H A 131 LEU HG 1.0 2.0 4.4 1645 1645 A 131 LEU HG A 132 ALA H 1.0 1.9 4.1 1646 1646 A 131 LEU HG A 148 THR HG2% 1.0 0.0 6.0 1647 1647 A 58 LEU HG A 131 LEU HA 1.0 2.0 5.4 1648 1648 A 131 LEU HBy A 132 ALA H 1.0 2.0 6.0 1649 1649 A 108 PHE HD% A 131 LEU HG 1.0 2.0 5.2 1650 1650 A 131 LEU HG A 132 ALA HA 1.0 2.0 6.0 1651 1651 A 57 LEU HA A 131 LEU HG 1.0 2.0 4.8 1652 1652 A 131 LEU HA A 131 LEU HBy 1.0 1.9 4.7 1653 1653 A 132 ALA HA A 132 ALA HB% 1.0 1.5 2.5 1654 1654 A 132 ALA H A 146 PHE HD% 1.0 2.0 5.2 1655 1655 A 132 ALA H A 147 LEU HDx% 1.0 2.0 5.4 1656 1656 A 132 ALA H A 132 ALA HA 1.0 1.9 4.1 1657 1657 A 131 LEU HA A 132 ALA H 1.0 1.7 3.1 1658 1658 A 132 ALA H A 135 ASP HBy 1.0 2.0 4.8 1659 1659 A 132 ALA H A 135 ASP HBx 1.0 2.0 5.8 1660 1660 A 131 LEU HBx A 132 ALA H 1.0 1.9 4.5 1661 1661 A 132 ALA H A 132 ALA HB% 1.0 1.5 2.7 1662 1662 A 132 ALA HB% A 133 ASN HBx 1.0 1.9 4.9 1663 1663 A 132 ALA HB% A 133 ASN HBy 1.0 2.0 6.0 1664 1664 A 146 PHE HD% A 132 ALA HB% 1.0 2.0 5.6 1665 1665 A 132 ALA HB% A 133 ASN H 1.0 1.7 3.1 1666 1666 A 132 ALA HB% A 135 ASP H 1.0 1.9 4.7 1667 1667 A 132 ALA HB% A 135 ASP HBx 1.0 2.0 6.0 1668 1668 A 132 ALA H A 133 ASN H 1.0 2.0 5.8 1669 1669 A 133 ASN H A 134 GLY H 1.0 2.0 6.0 1670 1670 A 133 ASN H A 133 ASN HD2y 1.0 2.0 5.2 1671 1671 A 146 PHE HD% A 133 ASN H 1.0 1.9 5.1 1672 1672 A 132 ALA HA A 133 ASN H 1.0 1.6 3.0 1673 1673 A 133 ASN HBy A 133 ASN H 1.0 1.8 3.8 1674 1674 A 133 ASN HBx A 133 ASN H 1.0 1.7 3.1 1675 1675 A 148 THR HG2% A 133 ASN H 1.0 1.9 4.5 1676 1676 A 133 ASN HBy A 133 ASN HA 1.0 1.7 3.3 1677 1677 A 133 ASN HBx A 133 ASN HA 1.0 1.9 4.1 1678 1678 A 133 ASN HBx A 133 ASN HBy 1.0 1.6 2.8 1679 1679 A 133 ASN HBx A 133 ASN HD2y 1.0 1.7 3.5 1680 1680 A 133 ASN HBx A 133 ASN HD2x 1.0 2.0 5.8 1681 1681 A 147 LEU HDx% A 133 ASN HD2y 1.0 2.0 5.6 1682 1682 A 133 ASN HD2y A 133 ASN HD2x 1.0 1.5 2.5 1683 1683 A 146 PHE HD% A 133 ASN HA 1.0 1.9 4.3 1684 1684 A 134 GLY H A 133 ASN HA 1.0 1.7 3.3 1685 1685 A 133 ASN HA A 147 LEU HA 1.0 1.8 4.0 1686 1686 A 133 ASN HBy A 133 ASN HD2x 1.0 2.0 6.0 1687 1687 A 133 ASN HBy A 133 ASN HD2y 1.0 1.9 5.3 1688 1688 A 148 THR HG2% A 133 ASN HBy 1.0 2.0 5.0 1689 1689 A 146 PHE HD% A 134 GLY H 1.0 1.9 4.7 1690 1690 A 134 GLY H A 147 LEU HA 1.0 2.0 5.4 1691 1691 A 134 GLY H A 134 GLY HAy 1.0 1.9 4.5 1692 1692 A 133 ASN HBy A 134 GLY H 1.0 2.0 6.0 1693 1693 A 133 ASN HBx A 134 GLY H 1.0 2.0 6.0 1694 1694 A 134 GLY HAy A 134 GLY HAx 1.0 1.6 2.8 1695 1695 A 134 GLY H A 133 ASN HD2y 1.0 2.0 6.0 1696 1696 A 147 LEU HDx% A 134 GLY HAx 1.0 2.0 4.8 1697 1697 A 135 ASP H A 134 GLY HAx 1.0 2.0 5.4 1698 1698 A 134 GLY H A 134 GLY HAx 1.0 1.9 4.1 1699 1699 A 135 ASP HBy A 135 ASP HBx 1.0 1.7 3.1 1700 1700 A 135 ASP HA A 135 ASP HBy 1.0 2.0 4.6 1701 1701 A 122 ASN HD2x A 135 ASP H 1.0 2.0 6.0 1702 1702 A 132 ALA H A 135 ASP H 1.0 2.0 5.0 1703 1703 A 135 ASP HBx A 135 ASP H 1.0 2.0 5.8 1704 1704 A 135 ASP HA A 135 ASP H 1.0 1.7 3.3 1705 1705 A 135 ASP H A 134 GLY H 1.0 1.7 3.3 1706 1706 A 146 PHE HD% A 135 ASP H 1.0 1.9 4.1 1707 1707 A 135 ASP H A 134 GLY HAy 1.0 1.9 4.1 1708 1708 A 135 ASP HBy A 135 ASP H 1.0 1.6 3.0 1709 1709 A 135 ASP H A 147 LEU HDy% 1.0 1.9 5.1 1710 1710 A 135 ASP HBx A 136 GLU H 1.0 1.9 4.9 1711 1711 A 135 ASP HA A 135 ASP HBx 1.0 2.0 4.8 1712 1712 A 135 ASP HBx A 145 VAL HGy% 1.0 2.0 5.8 1713 1713 A 135 ASP HBy A 136 GLU H 1.0 2.0 5.6 1714 1714 A 136 GLU HBx A 136 GLU HGy 1.0 1.8 3.6 1715 1715 A 136 GLU HGy A 136 GLU HBy 1.0 1.7 3.3 1716 1716 A 136 GLU HGx A 136 GLU HA 1.0 2.0 4.6 1717 1717 A 136 GLU HBx A 136 GLU HGx 1.0 1.5 2.7 1718 1718 A 136 GLU HGy A 136 GLU HA 1.0 1.9 4.7 1719 1719 A 136 GLU HGy A 136 GLU HGx 1.0 1.4 2.2 1720 1720 A 136 GLU HGy A 137 VAL H 1.0 2.0 5.6 1721 1721 A 136 GLU HGx A 144 LEU H 1.0 2.0 6.0 1722 1722 A 136 GLU HA A 137 VAL H 1.0 1.6 2.8 1723 1723 A 136 GLU HGy A 145 VAL HA 1.0 1.9 6.0 1724 1724 A 136 GLU HGx A 145 VAL HA 1.0 2.0 6.0 1725 1725 A 136 GLU HGy A 143 ARG HGy 1.0 1.9 4.3 1726 1726 A 136 GLU H A 136 GLU HGy 1.0 2.0 4.8 1727 1727 A 136 GLU H A 136 GLU HGx 1.0 1.9 4.1 1728 1728 A 136 GLU HBy A 136 GLU HA 1.0 1.9 4.1 1729 1729 A 136 GLU HBx A 137 VAL H 1.0 2.0 5.4 1730 1730 A 136 GLU HBy A 137 VAL H 1.0 1.8 3.8 1731 1731 A 136 GLU H A 136 GLU HBx 1.0 1.9 4.1 1732 1732 A 136 GLU HA A 145 VAL HA 1.0 1.7 3.1 1733 1733 A 135 ASP H A 136 GLU H 1.0 2.0 6.0 1734 1734 A 136 GLU H A 137 VAL H 1.0 2.0 6.0 1735 1735 A 122 ASN H A 136 GLU H 1.0 2.0 5.2 1736 1736 A 122 ASN HD2y A 136 GLU H 1.0 2.0 4.6 1737 1737 A 122 ASN HD2x A 136 GLU H 1.0 2.0 6.0 1738 1738 A 136 GLU H A 136 GLU HA 1.0 1.9 4.1 1739 1739 A 135 ASP HA A 136 GLU H 1.0 1.7 3.1 1740 1740 A 136 GLU H A 145 VAL HGy% 1.0 2.0 5.2 1741 1741 A 137 VAL H A 146 PHE H 1.0 1.9 6.0 1742 1742 A 137 VAL H A 144 LEU HBy 1.0 2.0 4.4 1743 1743 A 137 VAL H A 144 LEU HBx 1.0 2.0 6.0 1744 1744 A 144 LEU HBy A 137 VAL HB 1.0 1.7 2.9 1745 1745 A 137 VAL H A 137 VAL HB 1.0 1.8 3.6 1746 1746 A 98 HIS HD2 A 137 VAL HB 1.0 2.0 6.0 1747 1747 A 144 LEU HBx A 137 VAL HB 1.0 2.0 5.6 1748 1748 A 123 ARG H A 137 VAL HA 1.0 2.0 6.0 1749 1749 A 138 GLN HGx A 138 GLN HA 1.0 1.8 4.2 1750 1750 A 138 GLN HGy A 138 GLN HA 1.0 2.0 4.6 1751 1751 A 138 GLN HGy A 138 GLN HGx 1.0 1.3 2.2 1752 1752 A 138 GLN HBx A 138 GLN HBy 1.0 1.4 2.2 1753 1753 A 138 GLN H A 122 ASN H 1.0 2.0 6.0 1754 1754 A 120 TYR HBx A 138 GLN H 1.0 2.0 5.2 1755 1755 A 138 GLN HE2x A 142 PHE HD% 1.0 2.0 6.0 1756 1756 A 138 GLN HE2y A 28 ASP HBx 1.0 2.0 6.0 1757 1757 A 138 GLN HE2x A 138 GLN HGx 1.0 1.9 4.9 1758 1758 A 138 GLN HGy A 138 GLN HE2x 1.0 2.0 5.2 1759 1759 A 27 ALA HB% A 138 GLN HE2x 1.0 2.0 6.0 1760 1760 A 138 GLN HE2y A 138 GLN HE2x 1.0 1.5 2.5 1761 1761 A 138 GLN H A 137 VAL HA 1.0 1.7 3.1 1762 1762 A 138 GLN HE2y A 142 PHE HD% 1.0 2.0 6.0 1763 1763 A 120 TYR HBy A 138 GLN H 1.0 2.0 6.0 1764 1764 A 138 GLN H A 121 VAL HGy% 1.0 2.0 4.8 1765 1765 A 138 GLN HGy A 139 ILE H 1.0 2.0 4.6 1766 1766 A 139 ILE H A 138 GLN HA 1.0 1.7 3.1 1767 1767 A 121 VAL HA A 138 GLN HA 1.0 2.0 6.0 1768 1768 A 138 GLN HGy A 138 GLN HE2y 1.0 0.0 6.0 1769 1769 A 138 GLN HGy A 142 PHE HD% 1.0 2.0 5.2 1770 1770 A 29 PHE HZ A 138 GLN HGx 1.0 0.0 6.0 1771 1771 A 142 PHE HD% A 138 GLN HGx 1.0 2.0 6.0 1772 1772 A 138 GLN HE2y A 138 GLN HGx 1.0 1.8 4.0 1773 1773 A 138 GLN HGy A 138 GLN H 1.0 1.9 6.0 1774 1774 A 138 GLN H A 138 GLN HGx 1.0 2.0 6.0 1775 1775 A 138 GLN HGy A 29 PHE HZ 1.0 0.0 6.0 1776 1776 A 139 ILE HD1% A 139 ILE HA 1.0 1.9 4.9 1777 1777 A 139 ILE HA A 139 ILE HG1x 1.0 1.8 3.4 1778 1778 A 139 ILE HA A 139 ILE HB 1.0 1.7 3.5 1779 1779 A 139 ILE HA A 139 ILE HG1y 1.0 1.9 4.3 1780 1780 A 139 ILE HD1% A 139 ILE HB 1.0 1.7 3.1 1781 1781 A 139 ILE HB A 139 ILE HG1y 1.0 1.8 3.6 1782 1782 A 139 ILE HG2% A 139 ILE HG1y 1.0 1.8 3.6 1783 1783 A 139 ILE HG1x A 139 ILE HG1y 1.0 1.4 2.2 1784 1784 A 139 ILE HD1% A 139 ILE HG1x 1.0 1.8 3.4 1785 1785 A 139 ILE HG2% A 139 ILE HG1x 1.0 1.8 4.2 1786 1786 A 139 ILE HG1x A 139 ILE HB 1.0 1.7 2.9 1787 1787 A 139 ILE HG2% A 139 ILE HA 1.0 1.8 4.0 1788 1788 A 139 ILE HG2% A 139 ILE HB 1.0 1.4 2.4 1789 1789 A 139 ILE HG2% A 139 ILE HD1% 1.0 1.4 2.2 1790 1790 A 139 ILE H A 138 GLN H 1.0 2.0 6.0 1791 1791 A 139 ILE H A 144 LEU H 1.0 2.0 6.0 1792 1792 A 138 GLN HE2x A 139 ILE H 1.0 2.0 6.0 1793 1793 A 138 GLN HE2y A 139 ILE H 1.0 2.0 5.6 1794 1794 A 139 ILE H A 139 ILE HB 1.0 1.9 4.5 1795 1795 A 139 ILE HD1% A 139 ILE HG1y 1.0 1.9 3.9 1796 1796 A 139 ILE HA A 140 GLY H 1.0 1.7 3.1 1797 1797 A 89 LEU HG A 139 ILE HD1% 1.0 1.5 2.7 1798 1798 A 142 PHE HBx A 139 ILE HD1% 1.0 2.0 6.0 1799 1799 A 139 ILE HD1% A 98 HIS HBy 1.0 0.0 6.0 1800 1800 A 98 HIS HD2 A 139 ILE HD1% 1.0 1.9 4.1 1801 1801 A 139 ILE HD1% A 117 ASN HD2x 1.0 2.0 5.6 1802 1802 A 139 ILE HD1% A 139 ILE H 1.0 2.0 5.6 1803 1803 A 139 ILE HG2% A 110 VAL HGy% 1.0 0.0 6.0 1804 1804 A 139 ILE HG2% A 137 VAL HB 1.0 2.0 4.6 1805 1805 A 139 ILE HG2% A 98 HIS HBx 1.0 2.0 6.0 1806 1806 A 98 HIS HD2 A 139 ILE HG2% 1.0 1.6 2.8 1807 1807 A 139 ILE HG2% A 139 ILE H 1.0 1.9 3.7 1808 1808 A 139 ILE HG2% A 137 VAL HGx% 1.0 1.4 2.4 1809 1809 A 139 ILE HA A 139 ILE H 1.0 1.9 3.9 1810 1810 A 142 PHE HBy A 139 ILE HB 1.0 1.9 6.0 1811 1811 A 139 ILE HA A 98 HIS HD1 1.0 1.9 5.1 1812 1812 A 68 SER HBy A 139 ILE HD1% 1.0 2.0 6.0 1813 1813 A 69 ARG H A 139 ILE HD1% 1.0 2.0 6.0 1814 1814 A 139 ILE HD1% A 140 GLY H 1.0 2.0 5.6 1815 1815 A 139 ILE HG2% A 140 GLY H 1.0 2.0 6.0 1816 1816 A 139 ILE HG2% A 98 HIS HD1 1.0 0.0 6.0 1817 1817 A 80 GLY HAx A 139 ILE HD1% 1.0 1.8 3.8 1818 1818 A 139 ILE HD1% A 140 GLY HAy 1.0 2.0 5.4 1819 1819 A 140 GLY H A 139 ILE H 1.0 2.0 5.8 1820 1820 A 141 LYS H A 140 GLY H 1.0 1.9 4.7 1821 1821 A 140 GLY HAx A 140 GLY H 1.0 1.8 3.4 1822 1822 A 141 LYS HBy A 140 GLY H 1.0 2.0 6.0 1823 1823 A 140 GLY HAx A 140 GLY HAy 1.0 1.6 2.6 1824 1824 A 138 GLN HGy A 140 GLY H 1.0 1.7 6.0 1825 1825 A 140 GLY HAy A 140 GLY H 1.0 1.8 3.8 1826 1826 A 93 THR HB A 140 GLY HAy 1.0 2.0 5.2 1827 1827 A 142 PHE HD% A 140 GLY HAy 1.0 2.0 5.4 1828 1828 A 141 LYS H A 140 GLY HAx 1.0 1.9 4.1 1829 1829 A 142 PHE HD% A 140 GLY HAx 1.0 2.0 6.0 1830 1830 A 141 LYS HBy A 141 LYS HA 1.0 1.8 3.4 1831 1831 A 141 LYS HBx A 141 LYS HA 1.0 1.7 3.1 1832 1832 A 141 LYS HBx A 141 LYS HEy 1.0 2.0 6.0 1833 1833 A 141 LYS HEx A 141 LYS HBx 1.0 2.0 6.0 1834 1834 A 141 LYS HBy A 141 LYS HEy 1.0 1.9 4.1 1835 1835 A 141 LYS HBy A 141 LYS HBx 1.0 1.6 2.6 1836 1836 A 141 LYS HDx A 141 LYS HDy 1.0 1.2 2.2 1837 1837 A 141 LYS HEx A 141 LYS HEy 1.0 1.2 2.2 1838 1838 A 141 LYS HBy A 141 LYS HEx 1.0 1.9 4.5 1839 1839 A 141 LYS HGy A 141 LYS HGx 1.0 1.1 2.2 1840 1840 A 142 PHE HD% A 141 LYS HA 1.0 2.0 5.0 1841 1841 A 93 THR HB A 141 LYS H 1.0 2.0 5.4 1842 1842 A 141 LYS H A 140 GLY HAy 1.0 1.7 3.1 1843 1843 A 138 GLN HGy A 141 LYS HA 1.0 2.0 5.8 1844 1844 A 141 LYS HEx A 93 THR HG2% 1.0 2.0 4.8 1845 1845 A 141 LYS HBy A 141 LYS H 1.0 1.9 4.5 1846 1846 A 141 LYS HBx A 141 LYS H 1.0 1.9 4.1 1847 1847 A 138 GLN HE2y A 141 LYS HA 1.0 1.8 3.6 1848 1848 A 138 GLN HE2x A 141 LYS HA 1.0 1.9 4.3 1849 1849 A 142 PHE HA A 142 PHE HBx 1.0 1.7 3.5 1850 1850 A 142 PHE HBy A 142 PHE HBx 1.0 1.5 2.7 1851 1851 A 142 PHE HA A 142 PHE HE% 1.0 2.0 6.0 1852 1852 A 142 PHE HE% A 142 PHE HBy 1.0 2.0 4.8 1853 1853 A 142 PHE HBx A 139 ILE H 1.0 2.0 6.0 1854 1854 A 27 ALA HB% A 142 PHE HE% 1.0 0.0 6.0 1855 1855 A 142 PHE HE% A 89 LEU HBx 1.0 1.9 4.1 1856 1856 A 89 LEU HDy% A 142 PHE HE% 1.0 0.0 6.0 1857 1857 A 66 ALA H A 142 PHE HD% 1.0 1.8 3.6 1858 1858 A 26 ARG HE A 142 PHE HBx 1.0 0.0 6.0 1859 1859 A 63 GLY H A 142 PHE HBx 1.0 2.0 4.6 1860 1860 A 143 ARG H A 64 PRO HDy 1.0 2.0 6.0 1861 1861 A 60 VAL HA A 143 ARG H 1.0 2.0 5.2 1862 1862 A 143 ARG H A 63 GLY H 1.0 1.9 5.1 1863 1863 A 143 ARG HE A 143 ARG HBx 1.0 2.0 5.4 1864 1864 A 143 ARG HBx A 143 ARG HA 1.0 1.9 3.9 1865 1865 A 143 ARG HGy A 143 ARG HA 1.0 1.8 3.6 1866 1866 A 143 ARG HA A 143 ARG HBy 1.0 1.8 4.2 1867 1867 A 143 ARG HA A 143 ARG HGx 1.0 1.9 4.3 1868 1868 A 143 ARG HBy A 143 ARG HGx 1.0 1.7 2.9 1869 1869 A 143 ARG HBx A 143 ARG HGx 1.0 1.8 3.6 1870 1870 A 143 ARG HGy A 143 ARG HGx 1.0 1.5 2.5 1871 1871 A 137 VAL H A 143 ARG HA 1.0 1.9 5.1 1872 1872 A 143 ARG H A 142 PHE HA 1.0 1.7 3.1 1873 1873 A 143 ARG H A 63 GLY HAy 1.0 1.9 4.7 1874 1874 A 143 ARG H A 142 PHE HBx 1.0 1.9 4.1 1875 1875 A 143 ARG H A 143 ARG HBx 1.0 1.9 3.7 1876 1876 A 142 PHE HBy A 143 ARG HBx 1.0 2.0 6.0 1877 1877 A 26 ARG HE A 143 ARG HBy 1.0 1.9 4.7 1878 1878 A 62 ARG H A 143 ARG HBx 1.0 1.9 4.5 1879 1879 A 62 ARG H A 143 ARG HBy 1.0 2.0 5.6 1880 1880 A 26 ARG HE A 143 ARG HBx 1.0 2.0 6.0 1881 1881 A 26 ARG HE A 143 ARG HGx 1.0 0.0 6.0 1882 1882 A 137 VAL H A 143 ARG HGx 1.0 2.0 5.8 1883 1883 A 144 LEU HA A 144 LEU HBx 1.0 1.8 3.4 1884 1884 A 144 LEU HA A 144 LEU HG 1.0 1.7 3.3 1885 1885 A 144 LEU HBy A 144 LEU HG 1.0 1.7 3.3 1886 1886 A 144 LEU HBx A 144 LEU HG 1.0 1.7 3.3 1887 1887 A 144 LEU HBy A 144 LEU HBx 1.0 1.7 2.9 1888 1888 A 143 ARG H A 144 LEU H 1.0 2.0 5.6 1889 1889 A 144 LEU H A 144 LEU HG 1.0 1.8 3.8 1890 1890 A 60 VAL HA A 144 LEU HG 1.0 1.8 3.6 1891 1891 A 144 LEU H A 144 LEU HDx% 1.0 1.8 3.4 1892 1892 A 142 PHE HBx A 144 LEU HDx% 1.0 1.9 4.1 1893 1893 A 142 PHE HBy A 144 LEU HDx% 1.0 1.8 3.6 1894 1894 A 139 ILE H A 144 LEU HDx% 1.0 1.9 4.1 1895 1895 A 137 VAL HB A 144 LEU HDx% 1.0 1.8 3.4 1896 1896 A 139 ILE HG2% A 144 LEU HDx% 1.0 1.6 2.6 1897 1897 A 144 LEU HA A 144 LEU H 1.0 1.8 3.8 1898 1898 A 60 VAL H A 144 LEU HDy% 1.0 1.8 3.4 1899 1899 A 137 VAL H A 144 LEU HDx% 1.0 1.9 4.9 1900 1900 A 145 VAL H A 144 LEU HG 1.0 2.0 5.8 1901 1901 A 144 LEU H A 144 LEU HBy 1.0 1.9 4.3 1902 1902 A 144 LEU H A 144 LEU HBx 1.0 2.0 6.0 1903 1903 A 142 PHE HBx A 144 LEU HG 1.0 2.0 5.6 1904 1904 A 61 LYS H A 144 LEU HG 1.0 2.0 6.0 1905 1905 A 145 VAL HA A 145 VAL HB 1.0 1.7 3.1 1906 1906 A 145 VAL HGy% A 145 VAL HB 1.0 1.5 2.5 1907 1907 A 145 VAL HGx% A 145 VAL HA 1.0 1.7 3.3 1908 1908 A 145 VAL HGx% A 145 VAL HB 1.0 1.6 2.6 1909 1909 A 145 VAL HGx% A 145 VAL HGy% 1.0 1.4 2.2 1910 1910 A 145 VAL H A 61 LYS HDx 1.0 1.9 6.0 1911 1911 A 145 VAL H A 145 VAL HB 1.0 1.8 4.0 1912 1912 A 137 VAL H A 145 VAL HA 1.0 2.0 5.6 1913 1913 A 145 VAL HGx% A 137 VAL H 1.0 0.0 6.0 1914 1914 A 145 VAL HGy% A 146 PHE H 1.0 1.7 3.3 1915 1915 A 59 VAL H A 145 VAL HGy% 1.0 1.8 3.6 1916 1916 A 58 LEU HA A 145 VAL HGy% 1.0 1.9 4.3 1917 1917 A 134 GLY HAy A 145 VAL HGy% 1.0 2.0 5.2 1918 1918 A 134 GLY HAx A 145 VAL HGy% 1.0 1.7 3.1 1919 1919 A 145 VAL HGx% A 136 GLU HBy 1.0 1.8 3.4 1920 1920 A 145 VAL HGx% A 136 GLU HGy 1.0 0.0 6.0 1921 1921 A 145 VAL HGx% A 146 PHE H 1.0 1.9 4.1 1922 1922 A 145 VAL H A 145 VAL HGx% 1.0 1.7 2.9 1923 1923 A 145 VAL H A 144 LEU HA 1.0 1.5 2.7 1924 1924 A 145 VAL H A 144 LEU HBx 1.0 1.8 3.8 1925 1925 A 145 VAL HGx% A 134 GLY H 1.0 2.0 5.8 1926 1926 A 144 LEU HA A 145 VAL HGx% 1.0 1.9 4.7 1927 1927 A 134 GLY H A 145 VAL HGy% 1.0 1.9 4.1 1928 1928 A 145 VAL H A 145 VAL HA 1.0 1.8 3.6 1929 1929 A 61 LYS H A 145 VAL HGx% 1.0 1.7 3.5 1930 1930 A 145 VAL HGx% A 136 GLU HA 1.0 1.8 4.0 1931 1931 A 145 VAL HGy% A 136 GLU HA 1.0 2.0 5.8 1932 1932 A 145 VAL HGy% A 137 VAL H 1.0 0.0 6.0 1933 1933 A 146 PHE HBx A 146 PHE HA 1.0 1.8 3.8 1934 1934 A 146 PHE HBx A 146 PHE HBy 1.0 1.6 2.6 1935 1935 A 146 PHE HA A 146 PHE HBy 1.0 1.8 3.6 1936 1936 A 135 ASP HBx A 146 PHE H 1.0 2.0 5.2 1937 1937 A 58 LEU HG A 146 PHE H 1.0 1.9 6.0 1938 1938 A 145 VAL H A 146 PHE H 1.0 2.0 6.0 1939 1939 A 146 PHE HD% A 146 PHE H 1.0 1.9 4.3 1940 1940 A 145 VAL HA A 146 PHE H 1.0 1.6 2.8 1941 1941 A 146 PHE H A 146 PHE HBy 1.0 1.9 4.3 1942 1942 A 146 PHE HBx A 146 PHE H 1.0 1.9 3.9 1943 1943 A 58 LEU HA A 146 PHE HA 1.0 1.8 3.4 1944 1944 A 146 PHE HA A 145 VAL HGy% 1.0 1.7 3.5 1945 1945 A 58 LEU HDy% A 146 PHE HBx 1.0 2.0 6.0 1946 1946 A 58 LEU HG A 146 PHE HA 1.0 2.0 5.0 1947 1947 A 146 PHE HA A 146 PHE HD% 1.0 1.9 4.5 1948 1948 A 134 GLY H A 147 LEU H 1.0 1.5 6.0 1949 1949 A 146 PHE HBy A 147 LEU H 1.0 2.0 6.0 1950 1950 A 59 VAL H A 147 LEU H 1.0 2.0 6.0 1951 1951 A 147 LEU HA A 147 LEU HBx 1.0 1.8 3.6 1952 1952 A 147 LEU HBx A 147 LEU HBy 1.0 1.7 3.1 1953 1953 A 147 LEU HDy% A 147 LEU HBx 1.0 1.8 4.2 1954 1954 A 147 LEU HA A 147 LEU HG 1.0 1.9 4.5 1955 1955 A 147 LEU HDy% A 147 LEU HG 1.0 1.7 3.1 1956 1956 A 147 LEU HDx% A 147 LEU HA 1.0 1.6 3.0 1957 1957 A 147 LEU HDx% A 147 LEU HBx 1.0 1.6 2.8 1958 1958 A 147 LEU HDx% A 147 LEU HDy% 1.0 1.5 2.3 1959 1959 A 147 LEU HDx% A 147 LEU HBy 1.0 2.0 5.6 1960 1960 A 147 LEU HDy% A 147 LEU HBy 1.0 2.0 4.8 1961 1961 A 148 THR H A 147 LEU H 1.0 2.0 5.8 1962 1962 A 146 PHE HD% A 147 LEU H 1.0 2.0 5.4 1963 1963 A 58 LEU HA A 147 LEU H 1.0 2.0 6.0 1964 1964 A 146 PHE HA A 147 LEU H 1.0 1.6 3.0 1965 1965 A 146 PHE HBx A 147 LEU H 1.0 2.0 6.0 1966 1966 A 147 LEU H A 147 LEU HBx 1.0 1.9 4.3 1967 1967 A 147 LEU HA A 147 LEU H 1.0 1.8 3.6 1968 1968 A 147 LEU HDx% A 134 GLY H 1.0 1.8 3.6 1969 1969 A 147 LEU HDx% A 147 LEU H 1.0 1.9 3.9 1970 1970 A 148 THR H A 147 LEU HDx% 1.0 1.9 3.9 1971 1971 A 148 THR H A 147 LEU HA 1.0 1.6 3.0 1972 1972 A 148 THR H A 134 GLY H 1.0 0.0 6.0 1973 1973 A 148 THR H A 133 ASN HBy 1.0 2.0 4.6 1974 1974 A 148 THR H A 147 LEU HBx 1.0 1.8 3.6 1975 1975 A 148 THR H A 148 THR HG2% 1.0 1.8 3.6 1976 1976 A 148 THR HG2% A 148 THR HA 1.0 1.9 3.9 1977 1977 A 148 THR HB A 148 THR HG2% 1.0 2.0 5.2 1978 1978 A 148 THR HG1 A 148 THR HB 1.0 2.0 4.6 1979 1979 A 148 THR H A 148 THR HA 1.0 1.7 3.1 1980 1980 A 56 ALA HB% A 148 THR HA 1.0 1.7 3.3 1981 1981 A 56 ALA HA A 148 THR HA 1.0 1.8 3.6 1982 1982 A 51 LEU H A 148 THR HG2% 1.0 1.9 4.7 1983 1983 A 108 PHE HD% A 148 THR HG2% 1.0 0.0 6.0 1984 1984 A 52 PRO HDx A 149 GLY H 1.0 0.0 6.0 1985 1985 A 51 LEU HBx A 149 GLY H 1.0 1.9 4.5 1986 1986 A 149 GLY H A 148 THR HG2% 1.0 2.0 4.6 1987 1987 A 51 LEU HDx% A 149 GLY H 1.0 1.9 4.5 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _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 81 ARG HE A 94 VAL O 1.0 1.6 2.6 2 2 A 94 VAL O A 81 ARG NE 1.0 2.5 3.5 3 3 A 72 LEU H A 56 ALA O 1.0 1.6 2.6 4 4 A 56 ALA O A 72 LEU N 1.0 2.5 3.5 5 5 A 58 LEU H A 70 PHE O 1.0 1.6 2.6 6 6 A 70 PHE O A 58 LEU N 1.0 2.5 3.5 7 7 A 70 PHE H A 58 LEU O 1.0 1.6 2.6 8 8 A 58 LEU O A 70 PHE N 1.0 2.5 3.5 9 9 A 60 VAL H A 68 SER O 1.0 1.6 2.6 10 10 A 68 SER O A 60 VAL N 1.0 2.5 3.5 11 11 A 68 SER H A 60 VAL O 1.0 1.6 2.6 12 12 A 60 VAL O A 68 SER N 1.0 2.5 3.5 13 13 A 57 LEU H A 147 LEU O 1.0 1.6 2.6 14 14 A 147 LEU O A 57 LEU N 1.0 2.5 3.5 15 15 A 147 LEU H A 57 LEU O 1.0 1.6 2.6 16 16 A 57 LEU O A 147 LEU N 1.0 2.5 3.5 17 17 A 59 VAL H A 145 VAL O 1.0 1.6 2.6 18 18 A 145 VAL O A 59 VAL N 1.0 2.5 3.5 19 19 A 145 VAL H A 59 VAL O 1.0 1.6 2.6 20 20 A 59 VAL O A 145 VAL N 1.0 2.5 3.5 21 21 A 61 LYS H A 143 ARG O 1.0 1.6 2.6 22 22 A 143 ARG O A 61 LYS N 1.0 2.5 3.5 23 23 A 134 GLY H A 146 PHE O 1.0 1.6 2.6 24 24 A 146 PHE O A 134 GLY N 1.0 2.5 3.5 25 25 A 146 PHE H A 135 ASP O 1.0 1.6 2.6 26 26 A 135 ASP O A 146 PHE N 1.0 2.5 3.5 27 27 A 137 VAL H A 144 LEU O 1.0 1.6 2.6 28 28 A 144 LEU O A 137 VAL N 1.0 2.5 3.5 29 29 A 144 LEU H A 137 VAL O 1.0 1.6 2.6 30 30 A 137 VAL O A 144 LEU N 1.0 2.5 3.5 31 31 A 139 ILE H A 142 PHE O 1.0 1.6 2.6 32 32 A 142 PHE O A 139 ILE N 1.0 2.5 3.5 33 33 A 122 ASN H A 136 GLU O 1.0 1.6 2.6 34 34 A 136 GLU O A 122 ASN N 1.0 2.5 3.5 35 35 A 138 GLN H A 120 TYR O 1.0 1.6 2.6 36 36 A 120 TYR O A 138 GLN N 1.0 2.5 3.5 37 37 A 120 TYR H A 138 GLN O 1.0 1.6 2.6 38 38 A 138 GLN O A 120 TYR N 1.0 2.5 3.5 39 39 A 140 GLY H A 118 GLY O 1.0 1.6 2.6 40 40 A 118 GLY O A 140 GLY N 1.0 2.5 3.5 41 41 A 110 VAL H A 129 ALA O 1.0 1.6 2.6 42 42 A 129 ALA O A 110 VAL N 1.0 2.5 3.5 43 43 A 129 ALA H A 110 VAL O 1.0 1.6 2.6 44 44 A 110 VAL O A 129 ALA N 1.0 2.5 3.5 45 45 A 112 ASP H A 127 ASP O 1.0 1.6 2.6 46 46 A 127 ASP O A 112 ASP N 1.0 2.5 3.5 47 47 A 107 GLU H A 104 GLU O 1.0 1.6 2.6 48 48 A 104 GLU O A 107 GLU N 1.0 2.5 3.5 49 49 A 104 GLU H A 107 GLU O 1.0 1.6 2.6 50 50 A 107 GLU O A 104 GLU N 1.0 2.5 3.5 51 51 A 109 ASN H A 102 ARG O 1.0 1.6 2.6 52 52 A 102 ARG O A 109 ASN N 1.0 2.5 3.5 53 53 A 102 ARG H A 109 ASN O 1.0 1.6 2.6 54 54 A 109 ASN O A 102 ARG N 1.0 2.5 3.5 55 55 A 111 VAL H A 100 GLU O 1.0 1.6 2.6 56 56 A 100 GLU O A 111 VAL N 1.0 2.5 3.5 57 57 A 100 GLU H A 111 VAL O 1.0 1.6 2.6 58 58 A 111 VAL O A 100 GLU N 1.0 2.5 3.5 59 59 A 113 VAL H A 98 HIS O 1.0 1.6 2.6 60 60 A 98 HIS O A 113 VAL N 1.0 2.5 3.5 61 61 A 103 LEU H A 75 ALA O 1.0 1.6 2.6 62 62 A 75 ALA O A 103 LEU N 1.0 2.5 3.5 63 63 A 77 THR H A 101 PHE O 1.0 1.6 2.6 64 64 A 101 PHE O A 77 THR N 1.0 2.5 3.5 65 65 A 101 PHE H A 77 THR O 1.0 1.6 2.6 66 66 A 77 THR O A 101 PHE N 1.0 2.5 3.5 67 67 A 79 ALA H A 99 ALA O 1.0 1.6 2.6 68 68 A 99 ALA O A 79 ALA N 1.0 2.5 3.5 69 69 A 99 ALA H A 79 ALA O 1.0 1.6 2.6 70 70 A 79 ALA O A 99 ALA N 1.0 2.5 3.5 71 71 A 87 ILE H A 78 SER O 1.0 1.6 2.6 72 72 A 78 SER O A 87 ILE N 1.0 2.5 3.5 73 73 A 80 GLY H A 87 ILE O 1.0 1.6 2.6 74 74 A 87 ILE O A 80 GLY N 1.0 2.5 3.5 75 75 A 89 LEU H A 80 GLY O 1.0 1.6 2.6 76 76 A 80 GLY O A 89 LEU N 1.0 2.5 3.5 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _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 29 PHE C A 30 LEU N A 30 LEU CA A 30 LEU C 1.0 -141.0 -31.0 PHI 2 2 A 54 GLY C A 55 SER N A 55 SER CA A 55 SER C 1.0 -186.0 -86.0 PHI 3 3 A 55 SER C A 56 ALA N A 56 ALA CA A 56 ALA C 1.0 -159.0 -127.0 PHI 4 4 A 56 ALA C A 57 LEU N A 57 LEU CA A 57 LEU C 1.0 -160.0 -108.0 PHI 5 5 A 57 LEU C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 -158.0 -88.0 PHI 6 6 A 58 LEU C A 59 VAL N A 59 VAL CA A 59 VAL C 1.0 -144.0 -90.0 PHI 7 7 A 59 VAL C A 60 VAL N A 60 VAL CA A 60 VAL C 1.0 -100.0 -50.0 PHI 8 8 A 64 PRO C A 65 ASN N A 65 ASN CA A 65 ASN C 1.0 -127.0 -33.0 PHI 9 9 A 66 ALA C A 67 GLY N A 67 GLY CA A 67 GLY C 1.0 82.0 114.0 PHI 10 10 A 68 SER C A 69 ARG N A 69 ARG CA A 69 ARG C 1.0 -170.0 -86.0 PHI 11 11 A 69 ARG C A 70 PHE N A 70 PHE CA A 70 PHE C 1.0 -147.0 -99.0 PHI 12 12 A 70 PHE C A 71 LEU N A 71 LEU CA A 71 LEU C 1.0 -136.0 -66.0 PHI 13 13 A 73 ASP C A 74 GLN N A 74 GLN CA A 74 GLN C 1.0 -182.0 -44.0 PHI 14 14 A 76 ILE C A 77 THR N A 77 THR CA A 77 THR C 1.0 -131.0 -83.0 PHI 15 15 A 77 THR C A 78 SER N A 78 SER CA A 78 SER C 1.0 -135.0 -65.0 PHI 16 16 A 78 SER C A 79 ALA N A 79 ALA CA A 79 ALA C 1.0 -165.0 -97.0 PHI 17 17 A 80 GLY C A 81 ARG N A 81 ARG CA A 81 ARG C 1.0 -174.0 -54.0 PHI 18 18 A 81 ARG C A 82 HIS N A 82 HIS CA A 82 HIS C 1.0 -137.0 -47.0 PHI 19 19 A 87 ILE C A 88 PHE N A 88 PHE CA A 88 PHE C 1.0 -116.0 -78.0 PHI 20 20 A 88 PHE C A 89 LEU N A 89 LEU CA A 89 LEU C 1.0 -124.0 -76.0 PHI 21 21 A 93 THR C A 94 VAL N A 94 VAL CA A 94 VAL C 1.0 -142.0 -58.0 PHI 22 22 A 98 HIS C A 99 ALA N A 99 ALA CA A 99 ALA C 1.0 -175.0 -95.0 PHI 23 23 A 99 ALA C A 100 GLU N A 100 GLU CA A 100 GLU C 1.0 -160.0 -104.0 PHI 24 24 A 103 LEU C A 104 GLU N A 104 GLU CA A 104 GLU C 1.0 -164.0 -72.0 PHI 25 25 A 104 GLU C A 105 ASN N A 105 ASN CA A 105 ASN C 1.0 42.0 62.0 PHI 26 26 A 105 ASN C A 106 ASN N A 106 ASN CA A 106 ASN C 1.0 53.0 75.0 PHI 27 27 A 106 ASN C A 107 GLU N A 107 GLU CA A 107 GLU C 1.0 -138.0 -76.0 PHI 28 28 A 107 GLU C A 108 PHE N A 108 PHE CA A 108 PHE C 1.0 -158.0 -86.0 PHI 29 29 A 108 PHE C A 109 ASN N A 109 ASN CA A 109 ASN C 1.0 -162.0 -84.0 PHI 30 30 A 109 ASN C A 110 VAL N A 110 VAL CA A 110 VAL C 1.0 -156.0 -108.0 PHI 31 31 A 110 VAL C A 111 VAL N A 111 VAL CA A 111 VAL C 1.0 -129.0 -103.0 PHI 32 32 A 111 VAL C A 112 ASP N A 112 ASP CA A 112 ASP C 1.0 -107.0 -59.0 PHI 33 33 A 114 GLY C A 115 SER N A 115 SER CA A 115 SER C 1.0 -119.0 -41.0 PHI 34 34 A 115 SER C A 116 LEU N A 116 LEU CA A 116 LEU C 1.0 -71.0 -41.0 PHI 35 35 A 116 LEU C A 117 ASN N A 117 ASN CA A 117 ASN C 1.0 -132.0 -56.0 PHI 36 36 A 118 GLY C A 119 THR N A 119 THR CA A 119 THR C 1.0 -109.0 -49.0 PHI 37 37 A 119 THR C A 120 TYR N A 120 TYR CA A 120 TYR C 1.0 -141.0 -87.0 PHI 38 38 A 120 TYR C A 121 VAL N A 121 VAL CA A 121 VAL C 1.0 -150.0 -82.0 PHI 39 39 A 124 GLU C A 125 PRO N A 125 PRO CA A 125 PRO C 1.0 -82.0 -46.0 PHI 40 40 A 125 PRO C A 126 VAL N A 126 VAL CA A 126 VAL C 1.0 -151.0 -61.0 PHI 41 41 A 127 ASP C A 128 SER N A 128 SER CA A 128 SER C 1.0 -165.0 -79.0 PHI 42 42 A 131 LEU C A 132 ALA N A 132 ALA CA A 132 ALA C 1.0 -176.0 -74.0 PHI 43 43 A 133 ASN C A 134 GLY N A 134 GLY CA A 134 GLY C 1.0 83.0 109.0 PHI 44 44 A 135 ASP C A 136 GLU N A 136 GLU CA A 136 GLU C 1.0 -153.0 -95.0 PHI 45 45 A 136 GLU C A 137 VAL N A 137 VAL CA A 137 VAL C 1.0 -147.0 -101.0 PHI 46 46 A 137 VAL C A 138 GLN N A 138 GLN CA A 138 GLN C 1.0 -129.0 -95.0 PHI 47 47 A 138 GLN C A 139 ILE N A 139 ILE CA A 139 ILE C 1.0 -141.0 -93.0 PHI 48 48 A 144 LEU C A 145 VAL N A 145 VAL CA A 145 VAL C 1.0 -140.0 -106.0 PHI 49 49 A 30 LEU N A 30 LEU CA A 30 LEU C A 31 SER N 1.0 -67.0 41.0 PSI 50 50 A 55 SER N A 55 SER CA A 55 SER C A 56 ALA N 1.0 125.0 181.0 PSI 51 51 A 56 ALA N A 56 ALA CA A 56 ALA C A 57 LEU N 1.0 120.0 168.0 PSI 52 52 A 57 LEU N A 57 LEU CA A 57 LEU C A 58 LEU N 1.0 109.0 171.0 PSI 53 53 A 58 LEU N A 58 LEU CA A 58 LEU C A 59 VAL N 1.0 113.0 157.0 PSI 54 54 A 59 VAL N A 59 VAL CA A 59 VAL C A 60 VAL N 1.0 112.0 162.0 PSI 55 55 A 60 VAL N A 60 VAL CA A 60 VAL C A 61 LYS N 1.0 110.0 144.0 PSI 56 56 A 65 ASN N A 65 ASN CA A 65 ASN C A 66 ALA N 1.0 -58.0 40.0 PSI 57 57 A 67 GLY N A 67 GLY CA A 67 GLY C A 68 SER N 1.0 -36.0 0.0 PSI 58 58 A 69 ARG N A 69 ARG CA A 69 ARG C A 70 PHE N 1.0 120.0 176.0 PSI 59 59 A 70 PHE N A 70 PHE CA A 70 PHE C A 71 LEU N 1.0 95.0 147.0 PSI 60 60 A 71 LEU N A 71 LEU CA A 71 LEU C A 72 LEU N 1.0 92.0 158.0 PSI 61 61 A 74 GLN N A 74 GLN CA A 74 GLN C A 75 ALA N 1.0 129.0 191.0 PSI 62 62 A 77 THR N A 77 THR CA A 77 THR C A 78 SER N 1.0 111.0 171.0 PSI 63 63 A 78 SER N A 78 SER CA A 78 SER C A 79 ALA N 1.0 127.0 155.0 PSI 64 64 A 79 ALA N A 79 ALA CA A 79 ALA C A 80 GLY N 1.0 108.0 186.0 PSI 65 65 A 81 ARG N A 81 ARG CA A 81 ARG C A 82 HIS N 1.0 105.0 165.0 PSI 66 66 A 82 HIS N A 82 HIS CA A 82 HIS C A 83 PRO N 1.0 96.0 160.0 PSI 67 67 A 88 PHE N A 88 PHE CA A 88 PHE C A 89 LEU N 1.0 106.0 134.0 PSI 68 68 A 89 LEU N A 89 LEU CA A 89 LEU C A 90 ASP N 1.0 73.0 161.0 PSI 69 69 A 94 VAL N A 94 VAL CA A 94 VAL C A 95 SER N 1.0 69.0 177.0 PSI 70 70 A 99 ALA N A 99 ALA CA A 99 ALA C A 100 GLU N 1.0 123.0 179.0 PSI 71 71 A 100 GLU N A 100 GLU CA A 100 GLU C A 101 PHE N 1.0 114.0 178.0 PSI 72 72 A 104 GLU N A 104 GLU CA A 104 GLU C A 105 ASN N 1.0 111.0 143.0 PSI 73 73 A 105 ASN N A 105 ASN CA A 105 ASN C A 106 ASN N 1.0 33.0 53.0 PSI 74 74 A 106 ASN N A 106 ASN CA A 106 ASN C A 107 GLU N 1.0 3.0 33.0 PSI 75 75 A 107 GLU N A 107 GLU CA A 107 GLU C A 108 PHE N 1.0 119.0 167.0 PSI 76 76 A 108 PHE N A 108 PHE CA A 108 PHE C A 109 ASN N 1.0 117.0 155.0 PSI 77 77 A 109 ASN N A 109 ASN CA A 109 ASN C A 110 VAL N 1.0 115.0 185.0 PSI 78 78 A 110 VAL N A 110 VAL CA A 110 VAL C A 111 VAL N 1.0 119.0 163.0 PSI 79 79 A 111 VAL N A 111 VAL CA A 111 VAL C A 112 ASP N 1.0 114.0 150.0 PSI 80 80 A 112 ASP N A 112 ASP CA A 112 ASP C A 113 VAL N 1.0 115.0 171.0 PSI 81 81 A 115 SER N A 115 SER CA A 115 SER C A 116 LEU N 1.0 106.0 172.0 PSI 82 82 A 116 LEU N A 116 LEU CA A 116 LEU C A 117 ASN N 1.0 -54.0 -10.0 PSI 83 83 A 117 ASN N A 117 ASN CA A 117 ASN C A 118 GLY N 1.0 -35.0 31.0 PSI 84 84 A 119 THR N A 119 THR CA A 119 THR C A 120 TYR N 1.0 109.0 159.0 PSI 85 85 A 120 TYR N A 120 TYR CA A 120 TYR C A 121 VAL N 1.0 106.0 166.0 PSI 86 86 A 121 VAL N A 121 VAL CA A 121 VAL C A 122 ASN N 1.0 108.0 140.0 PSI 87 87 A 125 PRO N A 125 PRO CA A 125 PRO C A 126 VAL N 1.0 124.0 164.0 PSI 88 88 A 126 VAL N A 126 VAL CA A 126 VAL C A 127 ASP N 1.0 151.0 179.0 PSI 89 89 A 128 SER N A 128 SER CA A 128 SER C A 129 ALA N 1.0 92.0 202.0 PSI 90 90 A 132 ALA N A 132 ALA CA A 132 ALA C A 133 ASN N 1.0 122.0 182.0 PSI 91 91 A 134 GLY N A 134 GLY CA A 134 GLY C A 135 ASP N 1.0 -28.0 4.0 PSI 92 92 A 136 GLU N A 136 GLU CA A 136 GLU C A 137 VAL N 1.0 115.0 161.0 PSI 93 93 A 137 VAL N A 137 VAL CA A 137 VAL C A 138 GLN N 1.0 99.0 141.0 PSI 94 94 A 138 GLN N A 138 GLN CA A 138 GLN C A 139 ILE N 1.0 101.0 145.0 PSI 95 95 A 139 ILE N A 139 ILE CA A 139 ILE C A 140 GLY N 1.0 90.0 140.0 PSI 96 96 A 145 VAL N A 145 VAL CA A 145 VAL C A 146 PHE N 1.0 111.0 143.0 PSI stop_ save_