data_nef_c30243_5urn save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 5URN stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 PRO start . false 2 A 2 SER middle . . 3 A 3 HIS middle . . 4 A 4 SER middle . . 5 A 5 GLY middle . false 6 A 6 ALA middle . . 7 A 7 ALA middle . . 8 A 8 ILE middle . . 9 A 9 PHE middle . . 10 A 10 GLU middle . . 11 A 11 LYS middle . . 12 A 12 VAL middle . . 13 A 13 SER middle . . 14 A 14 GLY middle . false 15 A 15 ILE middle . . 16 A 16 ILE middle . . 17 A 17 ALA middle . . 18 A 18 ILE middle . . 19 A 19 ASN middle . . 20 A 20 GLU middle . . 21 A 21 ASP middle . . 22 A 22 VAL middle . . 23 A 23 SER middle . . 24 A 24 PRO middle . false 25 A 25 ALA middle . . 26 A 26 GLU middle . . 27 A 27 LEU middle . . 28 A 28 THR middle . . 29 A 29 TRP middle . . 30 A 30 ARG middle . . 31 A 31 SER middle . . 32 A 32 THR middle . . 33 A 33 ASP middle . . 34 A 34 GLY middle . false 35 A 35 ASP middle . . 36 A 36 LYS middle . . 37 A 37 VAL middle . . 38 A 38 HIS middle . . 39 A 39 THR middle . . 40 A 40 VAL middle . . 41 A 41 VAL middle . . 42 A 42 LEU middle . . 43 A 43 SER middle . . 44 A 44 THR middle . . 45 A 45 ILE middle . . 46 A 46 ASP middle . . 47 A 47 LYS middle . . 48 A 48 LEU middle . . 49 A 49 GLN middle . . 50 A 50 ALA middle . . 51 A 51 THR middle . . 52 A 52 PRO middle . false 53 A 53 ALA middle . . 54 A 54 SER middle . . 55 A 55 SER middle . . 56 A 56 GLU middle . . 57 A 57 LYS middle . . 58 A 58 MET middle . . 59 A 59 MET middle . . 60 A 60 LEU middle . . 61 A 61 ARG middle . . 62 A 62 LEU middle . . 63 A 63 ILE middle . . 64 A 64 GLY middle . false 65 A 65 LYS middle . . 66 A 66 VAL middle . . 67 A 67 ASP middle . . 68 A 68 GLU middle . . 69 A 69 SER middle . . 70 A 70 LYS middle . . 71 A 71 LYS middle . . 72 A 72 ARG middle . . 73 A 73 LYS middle . . 74 A 74 ASP middle . . 75 A 75 ASN middle . . 76 A 76 GLU middle . . 77 A 77 GLY middle . false 78 A 78 ASN middle . . 79 A 79 GLU middle . . 80 A 80 VAL middle . . 81 A 81 VAL middle . . 82 A 82 PRO middle . false 83 A 83 LYS middle . . 84 A 84 PRO middle . false 85 A 85 GLN middle . . 86 A 86 ARG middle . . 87 A 87 HIS middle . . 88 A 88 MET middle . . 89 A 89 PHE middle . . 90 A 90 SER middle . . 91 A 91 PHE middle . . 92 A 92 ASN middle . . 93 A 93 ASN middle . . 94 A 94 ARG middle . . 95 A 95 THR middle . . 96 A 96 VAL middle . . 97 A 97 MET middle . . 98 A 98 ASP middle . . 99 A 99 ASN middle . . 100 A 100 ILE middle . . 101 A 101 LYS middle . . 102 A 102 MET middle . . 103 A 103 THR middle . . 104 A 104 LEU middle . . 105 A 105 GLN middle . . 106 A 106 GLN middle . . 107 A 107 ILE middle . . 108 A 108 ILE middle . . 109 A 109 SER middle . . 110 A 110 ARG middle . . 111 A 111 TYR middle . . 112 A 112 LYS middle . . 113 A 113 ASP middle . . 114 A 114 ALA middle . . 115 A 115 ASP end . . 116 B 519 GLY start . false 117 B 520 SER middle . . 118 B 521 PRO middle . false 119 B 522 GLY middle . false 120 B 523 TYR middle . . 121 B 524 PRO middle . false 122 B 525 ASN middle . . 123 B 526 GLY middle . false 124 B 527 LEU middle . . 125 B 528 LEU middle . . 126 B 529 SER middle . . 127 B 530 GLY middle . false 128 B 531 ASP middle . . 129 B 532 GLU middle . . 130 B 533 ASP middle . . 131 B 534 PHE middle . . 132 B 535 SER middle . . 133 B 536 SER middle . . 134 B 537 ILE middle . . 135 B 538 ALA middle . . 136 B 539 ASP middle . . 137 B 540 MET middle . . 138 B 541 ASP middle . . 139 B 542 PHE middle . . 140 B 543 SER middle . . 141 B 544 ALA middle . . 142 B 545 LEU middle . . 143 B 546 LEU middle . . 144 B 547 SER middle . . 145 B 548 GLN middle . . 146 B 549 ILE middle . . 147 B 550 SER middle . . 148 B 551 SER end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 PRO HA H 1 4.579 0.000 A 1 PRO HBy H 1 1.553 0.000 A 1 PRO HBx H 1 1.109 0.000 A 1 PRO C C 13 176.877 0.000 A 1 PRO CA C 13 63.978 0.035 A 1 PRO CB C 13 32.404 0.000 A 1 PRO CG C 13 27.563 0.000 A 2 SER H H 1 8.070 0.009 A 2 SER HA H 1 4.303 0.000 A 2 SER CA C 13 58.946 0.000 A 2 SER CB C 13 63.289 0.000 A 2 SER N N 15 113.111 0.034 A 3 HIS HA H 1 4.644 0.002 A 3 HIS HBx H 1 2.970 0.003 A 3 HIS HBy H 1 3.585 0.005 A 3 HIS HD2 H 1 7.021 0.000 A 3 HIS HE1 H 1 7.992 0.000 A 3 HIS C C 13 173.974 0.000 A 3 HIS CA C 13 56.397 0.000 A 3 HIS CB C 13 31.445 0.026 A 3 HIS CD2 C 13 118.119 0.000 A 3 HIS CE1 C 13 138.135 0.000 A 4 SER H H 1 7.839 0.004 A 4 SER HA H 1 5.457 0.004 A 4 SER HBy H 1 3.862 0.007 A 4 SER HBx H 1 3.861 0.006 A 4 SER C C 13 173.573 0.000 A 4 SER CA C 13 56.838 0.000 A 4 SER CB C 13 65.942 0.001 A 4 SER N N 15 113.605 0.010 A 5 GLY H H 1 8.362 0.004 A 5 GLY HAy H 1 4.236 0.004 A 5 GLY HAx H 1 4.095 0.007 A 5 GLY C C 13 170.978 0.000 A 5 GLY CA C 13 45.302 0.009 A 5 GLY N N 15 107.049 0.019 A 6 ALA H H 1 8.642 0.002 A 6 ALA HA H 1 4.940 0.000 A 6 ALA HB% H 1 1.538 0.001 A 6 ALA C C 13 176.859 0.000 A 6 ALA CA C 13 52.615 0.000 A 6 ALA CB C 13 19.248 0.001 A 6 ALA N N 15 125.247 0.009 A 7 ALA H H 1 8.399 0.003 A 7 ALA HA H 1 4.631 0.004 A 7 ALA HB% H 1 0.990 0.007 A 7 ALA C C 13 176.669 0.000 A 7 ALA CA C 13 51.614 0.000 A 7 ALA CB C 13 23.927 0.001 A 7 ALA N N 15 120.097 0.008 A 8 ILE H H 1 9.340 0.003 A 8 ILE HA H 1 4.956 0.008 A 8 ILE HB H 1 1.554 0.005 A 8 ILE HD1% H 1 0.751 0.003 A 8 ILE HG1x H 1 0.958 0.006 A 8 ILE HG1y H 1 1.467 0.004 A 8 ILE HG2% H 1 0.592 0.004 A 8 ILE C C 13 175.248 0.000 A 8 ILE CA C 13 59.739 0.003 A 8 ILE CB C 13 39.334 0.001 A 8 ILE CD1 C 13 13.416 0.000 A 8 ILE CG1 C 13 28.675 0.022 A 8 ILE CG2 C 13 17.176 0.000 A 8 ILE N N 15 125.544 0.032 A 9 PHE H H 1 8.475 0.002 A 9 PHE HA H 1 4.310 0.000 A 9 PHE HBx H 1 0.308 0.004 A 9 PHE HBy H 1 1.126 0.004 A 9 PHE HDx H 1 6.141 0.002 A 9 PHE HDy H 1 6.141 0.002 A 9 PHE HEx H 1 6.559 0.004 A 9 PHE HEy H 1 6.559 0.004 A 9 PHE HZ H 1 6.317 0.000 A 9 PHE C C 13 174.028 0.000 A 9 PHE CA C 13 55.912 0.000 A 9 PHE CB C 13 39.418 0.003 A 9 PHE CDx C 13 131.712 0.000 A 9 PHE CDy C 13 131.712 0.000 A 9 PHE CEx C 13 129.820 0.000 A 9 PHE CEy C 13 129.820 0.000 A 9 PHE CZ C 13 128.576 0.000 A 9 PHE N N 15 128.883 0.014 A 10 GLU H H 1 8.773 0.002 A 10 GLU HA H 1 3.164 0.001 A 10 GLU HBy H 1 1.560 0.007 A 10 GLU HBx H 1 1.203 0.004 A 10 GLU HGx H 1 0.694 0.009 A 10 GLU HGy H 1 0.913 0.007 A 10 GLU CA C 13 56.672 0.000 A 10 GLU CB C 13 26.672 0.005 A 10 GLU CG C 13 35.119 0.000 A 10 GLU N N 15 126.420 0.008 A 11 LYS H H 1 7.916 0.002 A 11 LYS HA H 1 3.383 0.003 A 11 LYS HBx H 1 1.943 0.007 A 11 LYS HBy H 1 2.158 0.004 A 11 LYS HDy H 1 1.611 0.000 A 11 LYS HDx H 1 1.533 0.000 A 11 LYS HE2 H 1 2.863 0.000 A 11 LYS HE3 H 1 2.863 0.000 A 11 LYS HGx H 1 1.153 0.018 A 11 LYS HGy H 1 1.171 0.000 A 11 LYS C C 13 175.523 0.000 A 11 LYS CA C 13 58.404 0.001 A 11 LYS CB C 13 30.004 0.007 A 11 LYS CD C 13 29.001 0.011 A 11 LYS CE C 13 41.881 0.000 A 11 LYS CG C 13 25.696 0.000 A 11 LYS N N 15 105.917 0.027 A 12 VAL H H 1 7.918 0.002 A 12 VAL HA H 1 4.400 0.003 A 12 VAL HB H 1 2.523 0.004 A 12 VAL HGx% H 1 1.114 0.004 A 12 VAL HGy% H 1 1.471 0.003 A 12 VAL C C 13 175.181 0.000 A 12 VAL CA C 13 61.844 0.002 A 12 VAL CB C 13 34.181 0.002 A 12 VAL CGx C 13 21.897 0.000 A 12 VAL CGy C 13 22.552 0.000 A 12 VAL N N 15 123.709 0.011 A 13 SER H H 1 8.888 0.002 A 13 SER HA H 1 4.612 0.004 A 13 SER HBx H 1 3.973 0.008 A 13 SER HBy H 1 4.012 0.004 A 13 SER C C 13 175.349 0.000 A 13 SER CA C 13 59.682 0.002 A 13 SER CB C 13 63.506 0.027 A 13 SER N N 15 121.991 0.034 A 14 GLY H H 1 8.304 0.002 A 14 GLY HAx H 1 4.120 0.004 A 14 GLY HAy H 1 4.331 0.005 A 14 GLY C C 13 172.767 0.000 A 14 GLY CA C 13 46.337 0.012 A 14 GLY N N 15 113.244 0.024 A 15 ILE H H 1 8.314 0.002 A 15 ILE HA H 1 4.786 0.011 A 15 ILE HB H 1 1.621 0.002 A 15 ILE HD1% H 1 0.762 0.002 A 15 ILE HG1y H 1 1.351 0.001 A 15 ILE HG1x H 1 1.079 0.001 A 15 ILE HG2% H 1 0.758 0.002 A 15 ILE C C 13 175.432 0.000 A 15 ILE CA C 13 59.236 0.000 A 15 ILE CB C 13 41.385 0.002 A 15 ILE CD1 C 13 12.025 0.000 A 15 ILE CG1 C 13 27.224 0.022 A 15 ILE CG2 C 13 17.217 0.000 A 15 ILE N N 15 123.197 0.014 A 16 ILE H H 1 9.426 0.002 A 16 ILE HA H 1 4.961 0.005 A 16 ILE HB H 1 1.620 0.007 A 16 ILE HD1% H 1 0.146 0.000 A 16 ILE HG1y H 1 1.562 0.008 A 16 ILE HG1x H 1 0.772 0.000 A 16 ILE HG2% H 1 0.759 0.001 A 16 ILE C C 13 173.330 0.000 A 16 ILE CA C 13 59.625 0.000 A 16 ILE CB C 13 41.491 0.001 A 16 ILE CD1 C 13 13.681 0.000 A 16 ILE CG1 C 13 29.685 0.000 A 16 ILE CG2 C 13 16.469 0.000 A 16 ILE N N 15 127.746 0.011 A 17 ALA H H 1 8.977 0.002 A 17 ALA HA H 1 5.090 0.015 A 17 ALA HB% H 1 1.346 0.004 A 17 ALA C C 13 176.226 0.000 A 17 ALA CA C 13 51.428 0.000 A 17 ALA CB C 13 22.001 0.002 A 17 ALA N N 15 127.830 0.019 A 18 ILE H H 1 8.691 0.002 A 18 ILE HA H 1 4.558 0.004 A 18 ILE HB H 1 1.824 0.007 A 18 ILE HD1% H 1 0.779 0.006 A 18 ILE HG1y H 1 1.529 0.009 A 18 ILE HG1x H 1 0.783 0.000 A 18 ILE HG2% H 1 0.679 0.006 A 18 ILE C C 13 174.312 0.000 A 18 ILE CA C 13 60.598 0.000 A 18 ILE CB C 13 38.982 0.000 A 18 ILE CD1 C 13 14.802 0.000 A 18 ILE CG1 C 13 28.490 0.011 A 18 ILE CG2 C 13 17.828 0.000 A 18 ILE N N 15 122.279 0.045 A 19 ASN H H 1 9.378 0.013 A 19 ASN HA H 1 5.071 0.008 A 19 ASN HBx H 1 2.732 0.002 A 19 ASN HBy H 1 3.109 0.006 A 19 ASN HD21 H 1 6.853 0.003 A 19 ASN HD22 H 1 7.708 0.002 A 19 ASN C C 13 174.761 0.000 A 19 ASN CA C 13 51.683 0.001 A 19 ASN CB C 13 39.410 0.015 A 19 ASN CG C 13 176.813 0.039 A 19 ASN N N 15 127.574 0.066 A 19 ASN ND2 N 15 110.833 0.031 A 20 GLU H H 1 9.044 0.008 A 20 GLU HA H 1 4.684 0.006 A 20 GLU HBy H 1 2.410 0.004 A 20 GLU HBx H 1 1.983 0.008 A 20 GLU HGx H 1 2.044 0.002 A 20 GLU HGy H 1 2.185 0.005 A 20 GLU C C 13 176.166 0.000 A 20 GLU CA C 13 55.691 0.000 A 20 GLU CB C 13 30.718 0.067 A 20 GLU CG C 13 39.028 0.032 A 20 GLU N N 15 121.613 0.038 A 21 ASP H H 1 8.721 0.001 A 21 ASP HA H 1 4.603 0.006 A 21 ASP HBx H 1 2.795 0.004 A 21 ASP HBy H 1 2.865 0.003 A 21 ASP C C 13 175.717 0.000 A 21 ASP CA C 13 55.386 0.001 A 21 ASP CB C 13 40.489 0.007 A 21 ASP N N 15 121.100 0.021 A 22 VAL H H 1 6.836 0.003 A 22 VAL HA H 1 4.303 0.002 A 22 VAL HB H 1 1.995 0.000 A 22 VAL HGx% H 1 0.807 0.005 A 22 VAL HGy% H 1 0.769 0.009 A 22 VAL C C 13 173.427 0.000 A 22 VAL CA C 13 58.823 0.001 A 22 VAL CB C 13 33.891 0.000 A 22 VAL CGy C 13 21.103 0.000 A 22 VAL CGx C 13 18.105 0.000 A 22 VAL N N 15 113.108 0.039 A 23 SER H H 1 8.049 0.003 A 23 SER HA H 1 4.728 0.005 A 23 SER HBy H 1 3.725 0.004 A 23 SER HBx H 1 3.599 0.006 A 23 SER CA C 13 53.507 0.000 A 23 SER CB C 13 64.598 0.003 A 23 SER N N 15 114.997 0.007 A 24 PRO HA H 1 4.753 0.000 A 24 PRO HBx H 1 1.801 0.003 A 24 PRO HBy H 1 2.122 0.006 A 24 PRO HDx H 1 3.459 0.004 A 24 PRO HDy H 1 3.463 0.000 A 24 PRO HGy H 1 1.826 0.000 A 24 PRO HGx H 1 1.763 0.000 A 24 PRO C C 13 174.783 0.000 A 24 PRO CA C 13 62.741 0.001 A 24 PRO CB C 13 34.728 0.007 A 24 PRO CD C 13 49.590 0.000 A 24 PRO CG C 13 25.889 0.006 A 25 ALA H H 1 7.953 0.001 A 25 ALA HA H 1 4.498 0.003 A 25 ALA HB% H 1 1.535 0.002 A 25 ALA C C 13 175.769 0.000 A 25 ALA CA C 13 52.457 0.001 A 25 ALA CB C 13 20.393 0.003 A 25 ALA N N 15 120.437 0.010 A 26 GLU H H 1 7.854 0.003 A 26 GLU HA H 1 5.025 0.004 A 26 GLU HBx H 1 1.688 0.009 A 26 GLU HBy H 1 1.772 0.002 A 26 GLU HGx H 1 1.981 0.001 A 26 GLU HGy H 1 2.337 0.000 A 26 GLU C C 13 174.621 0.000 A 26 GLU CA C 13 54.047 0.001 A 26 GLU CB C 13 34.498 0.001 A 26 GLU CG C 13 36.059 0.000 A 26 GLU N N 15 115.449 0.010 A 27 LEU H H 1 8.889 0.002 A 27 LEU HA H 1 5.017 0.003 A 27 LEU HBy H 1 1.590 0.004 A 27 LEU HBx H 1 1.377 0.005 A 27 LEU HDx% H 1 0.638 0.001 A 27 LEU HDy% H 1 0.546 0.004 A 27 LEU HG H 1 1.380 0.005 A 27 LEU C C 13 174.737 0.000 A 27 LEU CA C 13 53.125 0.004 A 27 LEU CB C 13 45.417 0.000 A 27 LEU CDy C 13 27.155 0.000 A 27 LEU CDx C 13 25.679 0.000 A 27 LEU CG C 13 27.175 0.000 A 27 LEU N N 15 124.591 0.010 A 28 THR H H 1 9.268 0.001 A 28 THR HA H 1 5.213 0.002 A 28 THR HB H 1 3.938 0.006 A 28 THR HG2% H 1 1.118 0.002 A 28 THR C C 13 172.697 0.000 A 28 THR CA C 13 61.038 0.001 A 28 THR CB C 13 71.435 0.002 A 28 THR CG2 C 13 21.875 0.000 A 28 THR N N 15 121.619 0.026 A 29 TRP H H 1 9.454 0.003 A 29 TRP HA H 1 5.407 0.005 A 29 TRP HBx H 1 2.783 0.008 A 29 TRP HBy H 1 3.128 0.004 A 29 TRP HD1 H 1 6.652 0.017 A 29 TRP HE1 H 1 9.477 0.002 A 29 TRP HE3 H 1 7.327 0.011 A 29 TRP HH2 H 1 7.080 0.002 A 29 TRP HZ2 H 1 7.609 0.003 A 29 TRP HZ3 H 1 6.903 0.003 A 29 TRP C C 13 173.908 0.000 A 29 TRP CA C 13 55.774 0.001 A 29 TRP CB C 13 31.964 0.016 A 29 TRP CD1 C 13 124.321 0.000 A 29 TRP CE3 C 13 120.880 0.000 A 29 TRP CH2 C 13 124.515 0.000 A 29 TRP CZ2 C 13 114.619 0.000 A 29 TRP CZ3 C 13 121.823 0.000 A 29 TRP N N 15 128.870 0.007 A 29 TRP NE1 N 15 126.239 0.009 A 30 ARG H H 1 7.612 0.003 A 30 ARG HA H 1 4.814 0.006 A 30 ARG HBx H 1 1.413 0.008 A 30 ARG HBy H 1 1.533 0.004 A 30 ARG HDy H 1 3.090 0.000 A 30 ARG HDx H 1 3.020 0.000 A 30 ARG HE H 1 7.136 0.000 A 30 ARG HGx H 1 1.426 0.007 A 30 ARG HGy H 1 1.591 0.009 A 30 ARG C C 13 174.792 0.000 A 30 ARG CA C 13 53.467 0.001 A 30 ARG CB C 13 33.565 0.001 A 30 ARG CD C 13 43.303 0.000 A 30 ARG CG C 13 27.348 0.010 A 30 ARG N N 15 126.363 0.017 A 30 ARG NE N 15 84.796 0.000 A 31 SER H H 1 8.089 0.002 A 31 SER HA H 1 4.102 0.001 A 31 SER HBy H 1 4.456 0.003 A 31 SER HBx H 1 3.992 0.005 A 31 SER HG H 1 5.305 0.019 A 31 SER C C 13 176.427 0.000 A 31 SER CA C 13 57.866 0.000 A 31 SER CB C 13 64.210 0.020 A 31 SER N N 15 118.482 0.010 A 32 THR H H 1 8.549 0.003 A 32 THR HA H 1 3.847 0.007 A 32 THR HB H 1 4.110 0.006 A 32 THR HG2% H 1 1.212 0.004 A 32 THR C C 13 175.632 0.000 A 32 THR CA C 13 65.832 0.000 A 32 THR CB C 13 68.334 0.004 A 32 THR CG2 C 13 22.089 0.000 A 32 THR N N 15 119.022 0.020 A 33 ASP H H 1 8.218 0.002 A 33 ASP HA H 1 4.615 0.002 A 33 ASP HBy H 1 2.775 0.006 A 33 ASP HBx H 1 2.691 0.016 A 33 ASP C C 13 177.097 0.000 A 33 ASP CA C 13 54.458 0.004 A 33 ASP CB C 13 41.055 0.003 A 33 ASP N N 15 117.337 0.027 A 34 GLY H H 1 7.930 0.002 A 34 GLY HAx H 1 3.529 0.002 A 34 GLY HAy H 1 4.118 0.008 A 34 GLY C C 13 173.801 0.000 A 34 GLY CA C 13 45.338 0.014 A 34 GLY N N 15 109.196 0.012 A 35 ASP H H 1 8.253 0.001 A 35 ASP HA H 1 4.502 0.003 A 35 ASP HBx H 1 2.641 0.007 A 35 ASP HBy H 1 2.710 0.015 A 35 ASP C C 13 175.405 0.000 A 35 ASP CA C 13 54.854 0.001 A 35 ASP CB C 13 40.895 0.001 A 35 ASP N N 15 118.054 0.004 A 36 LYS H H 1 7.760 0.003 A 36 LYS HA H 1 4.803 0.002 A 36 LYS HBx H 1 1.919 0.004 A 36 LYS HBy H 1 2.157 0.006 A 36 LYS HD2 H 1 1.981 0.000 A 36 LYS HD3 H 1 1.981 0.000 A 36 LYS HEy H 1 3.183 0.000 A 36 LYS HEx H 1 3.145 0.000 A 36 LYS HGx H 1 1.612 0.004 A 36 LYS HGy H 1 1.731 0.004 A 36 LYS C C 13 174.557 0.000 A 36 LYS CA C 13 55.399 0.001 A 36 LYS CB C 13 35.623 0.036 A 36 LYS CD C 13 29.544 0.000 A 36 LYS CE C 13 42.051 0.013 A 36 LYS CG C 13 25.318 0.010 A 36 LYS N N 15 120.364 0.013 A 37 VAL H H 1 8.528 0.002 A 37 VAL HA H 1 5.261 0.003 A 37 VAL HB H 1 2.025 0.002 A 37 VAL HG2% H 1 0.911 0.002 A 37 VAL C C 13 175.138 0.000 A 37 VAL CA C 13 60.176 0.000 A 37 VAL CB C 13 35.702 0.001 A 37 VAL CG2 C 13 20.806 0.000 A 37 VAL N N 15 121.849 0.022 A 38 HIS H H 1 9.657 0.002 A 38 HIS HA H 1 5.047 0.001 A 38 HIS HBy H 1 2.809 0.002 A 38 HIS HBx H 1 2.741 0.001 A 38 HIS HD2 H 1 5.990 0.000 A 38 HIS HE1 H 1 8.254 0.000 A 38 HIS C C 13 173.461 0.000 A 38 HIS CA C 13 55.921 0.001 A 38 HIS CB C 13 34.243 0.000 A 38 HIS CD2 C 13 116.757 0.000 A 38 HIS CE1 C 13 138.605 0.000 A 38 HIS N N 15 126.573 0.008 A 39 THR H H 1 8.314 0.003 A 39 THR HA H 1 5.126 0.001 A 39 THR HB H 1 3.726 0.004 A 39 THR HG2% H 1 0.963 0.010 A 39 THR C C 13 173.132 0.000 A 39 THR CA C 13 61.423 0.001 A 39 THR CB C 13 70.680 0.001 A 39 THR CG2 C 13 21.798 0.000 A 39 THR N N 15 124.119 0.012 A 40 VAL H H 1 9.377 0.002 A 40 VAL HA H 1 3.903 0.006 A 40 VAL HB H 1 1.763 0.004 A 40 VAL HGx% H 1 0.255 0.003 A 40 VAL HGy% H 1 0.370 0.003 A 40 VAL C C 13 174.771 0.000 A 40 VAL CA C 13 60.678 0.004 A 40 VAL CB C 13 34.111 0.000 A 40 VAL CGx C 13 19.526 0.000 A 40 VAL CGy C 13 21.083 0.000 A 40 VAL N N 15 126.090 0.010 A 41 VAL H H 1 9.043 0.002 A 41 VAL HA H 1 3.964 0.004 A 41 VAL HB H 1 2.011 0.004 A 41 VAL HGx% H 1 1.004 0.003 A 41 VAL HGy% H 1 0.927 0.003 A 41 VAL C C 13 179.365 0.000 A 41 VAL CA C 13 63.503 0.003 A 41 VAL CB C 13 30.726 0.000 A 41 VAL CGy C 13 21.784 0.000 A 41 VAL CGx C 13 20.779 0.000 A 41 VAL N N 15 129.810 0.019 A 42 LEU H H 1 9.190 0.007 A 42 LEU HA H 1 3.929 0.002 A 42 LEU HBx H 1 1.440 0.003 A 42 LEU HBy H 1 1.789 0.008 A 42 LEU HDx% H 1 0.734 0.002 A 42 LEU HDy% H 1 0.687 0.002 A 42 LEU HG H 1 1.699 0.012 A 42 LEU C C 13 176.223 0.000 A 42 LEU CA C 13 58.544 0.000 A 42 LEU CB C 13 40.976 0.011 A 42 LEU CDy C 13 26.305 0.000 A 42 LEU CDx C 13 22.727 0.000 A 42 LEU CG C 13 26.946 0.000 A 42 LEU N N 15 130.132 0.049 A 43 SER H H 1 6.963 0.002 A 43 SER HA H 1 3.912 0.008 A 43 SER HBy H 1 3.775 0.001 A 43 SER HBx H 1 2.603 0.015 A 43 SER C C 13 175.488 0.000 A 43 SER CA C 13 59.397 0.000 A 43 SER CB C 13 61.174 0.023 A 43 SER N N 15 109.709 0.015 A 44 THR H H 1 7.649 0.002 A 44 THR HA H 1 4.501 0.001 A 44 THR HB H 1 4.655 0.003 A 44 THR HG1 H 1 4.961 0.001 A 44 THR HG2% H 1 1.207 0.004 A 44 THR C C 13 173.629 0.000 A 44 THR CA C 13 61.997 0.002 A 44 THR CB C 13 69.694 0.001 A 44 THR CG2 C 13 20.950 0.000 A 44 THR N N 15 110.348 0.026 A 45 ILE H H 1 7.117 0.004 A 45 ILE HA H 1 4.297 0.003 A 45 ILE HB H 1 2.302 0.004 A 45 ILE HD1% H 1 0.591 0.006 A 45 ILE HG1x H 1 1.071 0.001 A 45 ILE HG1y H 1 1.704 0.002 A 45 ILE HG2% H 1 0.892 0.003 A 45 ILE C C 13 173.789 0.000 A 45 ILE CA C 13 57.856 0.002 A 45 ILE CB C 13 36.476 0.002 A 45 ILE CD1 C 13 8.721 0.000 A 45 ILE CG1 C 13 27.231 0.013 A 45 ILE CG2 C 13 18.814 0.000 A 45 ILE N N 15 120.945 0.028 A 46 ASP H H 1 9.322 0.003 A 46 ASP HA H 1 4.694 0.021 A 46 ASP HBx H 1 2.441 0.004 A 46 ASP HBy H 1 2.515 0.002 A 46 ASP C C 13 175.562 0.000 A 46 ASP CA C 13 54.675 0.003 A 46 ASP CB C 13 44.544 0.006 A 46 ASP N N 15 126.345 0.029 A 47 LYS H H 1 7.586 0.002 A 47 LYS HA H 1 4.719 0.002 A 47 LYS HBx H 1 1.675 0.002 A 47 LYS HBy H 1 1.831 0.012 A 47 LYS HDy H 1 1.656 0.000 A 47 LYS HDx H 1 1.606 0.000 A 47 LYS HEx H 1 2.920 0.000 A 47 LYS HEy H 1 2.935 0.015 A 47 LYS HGx H 1 1.251 0.003 A 47 LYS HGy H 1 1.317 0.006 A 47 LYS C C 13 172.923 0.000 A 47 LYS CA C 13 54.256 0.000 A 47 LYS CB C 13 36.525 0.001 A 47 LYS CD C 13 29.215 0.006 A 47 LYS CE C 13 41.729 0.000 A 47 LYS CG C 13 24.307 0.008 A 47 LYS N N 15 112.561 0.024 A 48 LEU H H 1 8.701 0.003 A 48 LEU HA H 1 5.222 0.003 A 48 LEU HBx H 1 1.381 0.005 A 48 LEU HBy H 1 1.678 0.004 A 48 LEU HDx% H 1 0.734 0.010 A 48 LEU HDy% H 1 0.908 0.012 A 48 LEU HG H 1 1.578 0.005 A 48 LEU C C 13 175.606 0.000 A 48 LEU CA C 13 53.241 0.001 A 48 LEU CB C 13 45.031 0.017 A 48 LEU CDx C 13 26.303 0.000 A 48 LEU CDy C 13 26.464 0.000 A 48 LEU CG C 13 27.510 0.000 A 48 LEU N N 15 122.524 0.001 A 49 GLN H H 1 9.269 0.003 A 49 GLN HA H 1 4.886 0.009 A 49 GLN HBx H 1 1.956 0.004 A 49 GLN HBy H 1 1.959 0.003 A 49 GLN HE21 H 1 6.931 0.004 A 49 GLN HE22 H 1 7.541 0.004 A 49 GLN HGx H 1 2.068 0.011 A 49 GLN HGy H 1 2.319 0.006 A 49 GLN C C 13 174.066 0.000 A 49 GLN CA C 13 54.127 0.001 A 49 GLN CB C 13 32.680 0.001 A 49 GLN CD C 13 179.087 0.023 A 49 GLN CG C 13 33.603 0.000 A 49 GLN N N 15 123.340 0.014 A 49 GLN NE2 N 15 111.690 0.033 A 50 ALA H H 1 8.861 0.006 A 50 ALA HA H 1 5.589 0.009 A 50 ALA HB% H 1 1.350 0.001 A 50 ALA C C 13 177.233 0.000 A 50 ALA CA C 13 50.131 0.003 A 50 ALA CB C 13 23.318 0.001 A 50 ALA N N 15 125.140 0.043 A 51 THR H H 1 8.231 0.001 A 51 THR HA H 1 4.435 0.002 A 51 THR HB H 1 4.320 0.008 A 51 THR HG2% H 1 1.104 0.012 A 51 THR CA C 13 59.413 0.000 A 51 THR CB C 13 67.911 0.000 A 51 THR CG2 C 13 23.872 0.000 A 51 THR N N 15 113.477 0.013 A 52 PRO HA H 1 4.603 0.000 A 52 PRO HBx H 1 2.081 0.000 A 52 PRO HBy H 1 2.397 0.000 A 52 PRO HDy H 1 3.837 0.005 A 52 PRO HDx H 1 3.589 0.003 A 52 PRO HGx H 1 1.983 0.003 A 52 PRO HGy H 1 2.092 0.000 A 52 PRO CA C 13 62.490 0.000 A 52 PRO CB C 13 32.622 0.000 A 52 PRO CD C 13 50.505 0.011 A 52 PRO CG C 13 27.469 0.005 A 53 ALA HA H 1 4.056 0.008 A 53 ALA HB% H 1 1.440 0.002 A 53 ALA C C 13 177.505 0.000 A 53 ALA CA C 13 54.696 0.001 A 53 ALA CB C 13 17.872 0.001 A 54 SER H H 1 7.608 0.002 A 54 SER HA H 1 4.249 0.004 A 54 SER HBx H 1 3.806 0.010 A 54 SER HBy H 1 4.061 0.003 A 54 SER C C 13 174.839 0.000 A 54 SER CA C 13 57.798 0.001 A 54 SER CB C 13 62.840 0.000 A 54 SER N N 15 107.282 0.017 A 55 SER H H 1 7.635 0.002 A 55 SER HA H 1 4.511 0.001 A 55 SER HBx H 1 3.888 0.005 A 55 SER HBy H 1 3.988 0.006 A 55 SER C C 13 174.888 0.000 A 55 SER CA C 13 57.328 0.001 A 55 SER CB C 13 63.847 0.008 A 55 SER N N 15 117.035 0.019 A 56 GLU H H 1 8.920 0.002 A 56 GLU HA H 1 4.151 0.006 A 56 GLU HBx H 1 2.028 0.002 A 56 GLU HBy H 1 2.126 0.001 A 56 GLU HGy H 1 2.359 0.006 A 56 GLU HGx H 1 2.273 0.013 A 56 GLU C C 13 177.598 0.000 A 56 GLU CA C 13 57.837 0.000 A 56 GLU CB C 13 29.430 0.016 A 56 GLU CG C 13 36.455 0.000 A 56 GLU N N 15 125.558 0.008 A 57 LYS H H 1 8.062 0.002 A 57 LYS HA H 1 4.301 0.005 A 57 LYS HBy H 1 1.750 0.006 A 57 LYS HBx H 1 1.669 0.008 A 57 LYS HDx H 1 1.601 0.007 A 57 LYS HDy H 1 1.608 0.000 A 57 LYS HE2 H 1 2.932 0.000 A 57 LYS HE3 H 1 2.932 0.000 A 57 LYS HGy H 1 1.459 0.004 A 57 LYS HGx H 1 1.376 0.005 A 57 LYS C C 13 175.831 0.000 A 57 LYS CA C 13 55.677 0.126 A 57 LYS CB C 13 33.587 0.001 A 57 LYS CD C 13 29.404 0.000 A 57 LYS CE C 13 41.913 0.000 A 57 LYS CG C 13 25.217 0.000 A 57 LYS N N 15 118.954 0.016 A 58 MET H H 1 8.832 0.006 A 58 MET HA H 1 4.321 0.005 A 58 MET HBy H 1 2.411 0.008 A 58 MET HBx H 1 2.126 0.008 A 58 MET HE% H 1 2.080 0.010 A 58 MET HG2 H 1 2.330 0.000 A 58 MET HG3 H 1 2.330 0.000 A 58 MET C C 13 174.148 0.000 A 58 MET CA C 13 54.871 0.000 A 58 MET CB C 13 35.085 0.001 A 58 MET CE C 13 18.784 0.000 A 58 MET CG C 13 32.438 0.000 A 58 MET N N 15 124.358 0.006 A 59 MET H H 1 8.381 0.002 A 59 MET HA H 1 5.694 0.002 A 59 MET HBy H 1 2.130 0.005 A 59 MET HBx H 1 1.877 0.002 A 59 MET HE% H 1 1.907 0.003 A 59 MET HGy H 1 2.674 0.010 A 59 MET HGx H 1 2.360 0.007 A 59 MET C C 13 173.985 0.000 A 59 MET CA C 13 54.802 0.002 A 59 MET CB C 13 38.553 0.005 A 59 MET CE C 13 17.373 0.000 A 59 MET CG C 13 31.886 0.005 A 59 MET N N 15 121.603 0.020 A 60 LEU H H 1 9.077 0.002 A 60 LEU HA H 1 5.456 0.009 A 60 LEU HBx H 1 1.707 0.004 A 60 LEU HBy H 1 1.831 0.015 A 60 LEU HDx% H 1 0.879 0.009 A 60 LEU HDy% H 1 0.986 0.005 A 60 LEU HG H 1 1.831 0.020 A 60 LEU C C 13 175.157 0.000 A 60 LEU CA C 13 53.026 0.002 A 60 LEU CB C 13 47.234 0.008 A 60 LEU CDy C 13 25.425 0.000 A 60 LEU CDx C 13 24.970 0.000 A 60 LEU CG C 13 26.950 0.000 A 60 LEU N N 15 119.533 0.011 A 61 ARG H H 1 9.420 0.004 A 61 ARG HA H 1 5.462 0.006 A 61 ARG HBy H 1 1.662 0.016 A 61 ARG HBx H 1 1.378 0.016 A 61 ARG HDy H 1 2.921 0.000 A 61 ARG HDx H 1 2.798 0.000 A 61 ARG HGx H 1 1.253 0.000 A 61 ARG HGy H 1 1.324 0.000 A 61 ARG C C 13 174.110 0.000 A 61 ARG CA C 13 54.432 0.001 A 61 ARG CB C 13 34.633 0.007 A 61 ARG CD C 13 44.109 0.007 A 61 ARG CG C 13 26.949 0.003 A 61 ARG N N 15 122.165 0.006 A 62 LEU H H 1 9.346 0.003 A 62 LEU HA H 1 5.046 0.001 A 62 LEU HBx H 1 1.697 0.010 A 62 LEU HBy H 1 1.942 0.013 A 62 LEU HDx% H 1 0.899 0.002 A 62 LEU HDy% H 1 1.015 0.005 A 62 LEU HG H 1 1.848 0.007 A 62 LEU C C 13 175.476 0.000 A 62 LEU CA C 13 54.470 0.002 A 62 LEU CB C 13 42.623 0.028 A 62 LEU CDy C 13 26.900 0.000 A 62 LEU CDx C 13 25.240 0.000 A 62 LEU CG C 13 28.903 0.000 A 62 LEU N N 15 126.615 0.037 A 63 ILE H H 1 8.949 0.004 A 63 ILE HA H 1 4.603 0.002 A 63 ILE HB H 1 1.913 0.012 A 63 ILE HD1% H 1 0.686 0.008 A 63 ILE HG1y H 1 1.327 0.003 A 63 ILE HG1x H 1 1.063 0.001 A 63 ILE HG2% H 1 1.060 0.002 A 63 ILE C C 13 176.351 0.000 A 63 ILE CA C 13 59.481 0.004 A 63 ILE CB C 13 38.605 0.001 A 63 ILE CD1 C 13 12.048 0.000 A 63 ILE CG1 C 13 27.296 0.011 A 63 ILE CG2 C 13 17.483 0.000 A 63 ILE N N 15 123.626 0.031 A 64 GLY H H 1 9.322 0.004 A 64 GLY HAy H 1 4.717 0.001 A 64 GLY HAx H 1 4.057 0.002 A 64 GLY C C 13 172.531 0.000 A 64 GLY CA C 13 45.321 0.025 A 64 GLY N N 15 115.586 0.018 A 65 LYS H H 1 8.366 0.003 A 65 LYS HA H 1 4.289 0.005 A 65 LYS HBx H 1 1.598 0.003 A 65 LYS HBy H 1 1.889 0.004 A 65 LYS HDx H 1 1.599 0.000 A 65 LYS HDy H 1 1.708 0.003 A 65 LYS HEx H 1 2.839 0.000 A 65 LYS HEy H 1 2.945 0.000 A 65 LYS HGy H 1 1.405 0.003 A 65 LYS HGx H 1 1.218 0.006 A 65 LYS C C 13 177.368 0.000 A 65 LYS CA C 13 56.525 0.000 A 65 LYS CB C 13 34.225 0.001 A 65 LYS CD C 13 29.382 0.007 A 65 LYS CE C 13 42.371 0.000 A 65 LYS CG C 13 26.389 0.006 A 65 LYS N N 15 119.518 0.011 A 66 VAL H H 1 8.619 0.002 A 66 VAL HA H 1 4.094 0.003 A 66 VAL HB H 1 1.966 0.002 A 66 VAL HGx% H 1 0.892 0.007 A 66 VAL HGy% H 1 0.841 0.004 A 66 VAL C C 13 175.248 0.000 A 66 VAL CA C 13 61.935 0.000 A 66 VAL CB C 13 33.186 0.000 A 66 VAL CGx C 13 20.890 0.000 A 66 VAL CGy C 13 21.296 0.000 A 66 VAL N N 15 122.039 0.020 A 67 ASP H H 1 8.468 0.001 A 67 ASP HA H 1 4.703 0.002 A 67 ASP HBx H 1 2.580 0.000 A 67 ASP HBy H 1 2.810 0.001 A 67 ASP C C 13 176.670 0.000 A 67 ASP CA C 13 52.965 0.000 A 67 ASP CB C 13 40.888 0.009 A 67 ASP N N 15 125.472 0.018 A 68 GLU H H 1 8.741 0.002 A 68 GLU HA H 1 4.116 0.006 A 68 GLU HBy H 1 2.165 0.005 A 68 GLU HBx H 1 1.972 0.004 A 68 GLU HGy H 1 2.335 0.000 A 68 GLU HGx H 1 2.221 0.000 A 68 GLU C C 13 177.364 0.000 A 68 GLU CA C 13 57.540 0.000 A 68 GLU CB C 13 29.547 0.001 A 68 GLU CG C 13 36.583 0.005 A 68 GLU N N 15 124.470 0.007 A 69 SER H H 1 8.490 0.002 A 69 SER HA H 1 4.311 0.014 A 69 SER HBx H 1 3.925 0.003 A 69 SER HBy H 1 3.971 0.001 A 69 SER C C 13 175.217 0.000 A 69 SER CA C 13 59.916 0.000 A 69 SER CB C 13 63.354 0.003 A 69 SER N N 15 115.730 0.009 A 70 LYS H H 1 7.720 0.001 A 70 LYS HA H 1 4.387 0.004 A 70 LYS HBy H 1 1.922 0.002 A 70 LYS HBx H 1 1.754 0.005 A 70 LYS HDx H 1 1.656 0.002 A 70 LYS HDy H 1 1.659 0.000 A 70 LYS HE2 H 1 2.957 0.000 A 70 LYS HE3 H 1 2.957 0.000 A 70 LYS HGx H 1 1.354 0.009 A 70 LYS HGy H 1 1.455 0.006 A 70 LYS C C 13 176.226 0.000 A 70 LYS CA C 13 55.339 0.001 A 70 LYS CB C 13 32.227 0.001 A 70 LYS CD C 13 28.869 0.000 A 70 LYS CE C 13 41.821 0.000 A 70 LYS CG C 13 24.766 0.004 A 70 LYS N N 15 121.828 0.012 A 71 LYS H H 1 7.795 0.002 A 71 LYS HA H 1 4.379 0.001 A 71 LYS HBx H 1 1.749 0.001 A 71 LYS HBy H 1 1.795 0.001 A 71 LYS HD2 H 1 1.666 0.000 A 71 LYS HD3 H 1 1.666 0.000 A 71 LYS HE2 H 1 2.960 0.000 A 71 LYS HE3 H 1 2.960 0.000 A 71 LYS HGy H 1 1.463 0.000 A 71 LYS HGx H 1 1.358 0.000 A 71 LYS C C 13 176.202 0.000 A 71 LYS CA C 13 56.404 0.002 A 71 LYS CB C 13 33.009 0.002 A 71 LYS CD C 13 28.865 0.000 A 71 LYS CE C 13 41.714 0.000 A 71 LYS CG C 13 24.577 0.004 A 71 LYS N N 15 121.138 0.009 A 72 ARG H H 1 8.411 0.003 A 72 ARG HA H 1 4.551 0.004 A 72 ARG HBy H 1 1.868 0.005 A 72 ARG HBx H 1 1.743 0.017 A 72 ARG HD2 H 1 3.189 0.000 A 72 ARG HD3 H 1 3.189 0.000 A 72 ARG HGx H 1 1.582 0.000 A 72 ARG HGy H 1 1.588 0.007 A 72 ARG C C 13 175.361 0.000 A 72 ARG CA C 13 54.908 0.000 A 72 ARG CB C 13 32.125 0.002 A 72 ARG CD C 13 43.128 0.000 A 72 ARG CG C 13 26.803 0.000 A 72 ARG N N 15 122.170 0.014 A 73 LYS H H 1 8.403 0.004 A 73 LYS HA H 1 4.847 0.013 A 73 LYS HB2 H 1 1.719 0.002 A 73 LYS HB3 H 1 1.720 0.007 A 73 LYS HD2 H 1 1.602 0.000 A 73 LYS HD3 H 1 1.602 0.000 A 73 LYS HE2 H 1 2.968 0.000 A 73 LYS HE3 H 1 2.968 0.000 A 73 LYS HGx H 1 1.313 0.007 A 73 LYS HGy H 1 1.408 0.000 A 73 LYS C C 13 176.959 0.000 A 73 LYS CA C 13 55.213 0.002 A 73 LYS CB C 13 34.438 0.001 A 73 LYS CD C 13 28.977 0.000 A 73 LYS CE C 13 41.666 0.000 A 73 LYS CG C 13 25.151 0.000 A 73 LYS N N 15 121.412 0.015 A 74 ASP H H 1 8.566 0.001 A 74 ASP HA H 1 4.631 0.005 A 74 ASP HBy H 1 3.114 0.008 A 74 ASP HBx H 1 2.626 0.002 A 74 ASP C C 13 177.364 0.000 A 74 ASP CA C 13 52.915 0.001 A 74 ASP CB C 13 40.958 0.006 A 74 ASP N N 15 121.975 0.027 A 75 ASN H H 1 8.413 0.003 A 75 ASN HA H 1 4.536 0.006 A 75 ASN HBx H 1 2.847 0.003 A 75 ASN HBy H 1 2.850 0.000 A 75 ASN HD21 H 1 7.648 0.000 A 75 ASN HD22 H 1 6.948 0.003 A 75 ASN C C 13 175.948 0.000 A 75 ASN CA C 13 54.666 0.001 A 75 ASN CB C 13 38.084 0.000 A 75 ASN CG C 13 177.350 0.009 A 75 ASN N N 15 116.374 0.035 A 75 ASN ND2 N 15 113.195 0.000 A 76 GLU H H 1 8.170 0.010 A 76 GLU HA H 1 4.360 0.001 A 76 GLU HBy H 1 2.208 0.004 A 76 GLU HBx H 1 1.965 0.003 A 76 GLU HGx H 1 2.206 0.004 A 76 GLU HGy H 1 2.212 0.001 A 76 GLU C C 13 176.588 0.000 A 76 GLU CA C 13 56.097 0.000 A 76 GLU CB C 13 30.037 0.006 A 76 GLU CG C 13 36.556 0.000 A 76 GLU N N 15 119.105 0.020 A 77 GLY H H 1 8.124 0.003 A 77 GLY HAx H 1 3.678 0.006 A 77 GLY HAy H 1 4.179 0.004 A 77 GLY C C 13 174.234 0.000 A 77 GLY CA C 13 45.116 0.004 A 77 GLY N N 15 108.193 0.032 A 78 ASN H H 1 8.542 0.004 A 78 ASN HA H 1 4.727 0.000 A 78 ASN HBx H 1 2.663 0.004 A 78 ASN HBy H 1 2.841 0.003 A 78 ASN HD21 H 1 7.053 0.002 A 78 ASN HD22 H 1 8.199 0.004 A 78 ASN C C 13 175.061 0.000 A 78 ASN CA C 13 52.613 0.001 A 78 ASN CB C 13 38.830 0.001 A 78 ASN CG C 13 176.977 0.000 A 78 ASN N N 15 119.824 0.005 A 78 ASN ND2 N 15 116.895 0.029 A 79 GLU H H 1 8.678 0.006 A 79 GLU HA H 1 4.436 0.003 A 79 GLU HBx H 1 1.929 0.015 A 79 GLU HBy H 1 1.931 0.018 A 79 GLU HGy H 1 2.267 0.003 A 79 GLU HGx H 1 2.099 0.002 A 79 GLU C C 13 176.307 0.000 A 79 GLU CA C 13 56.543 0.000 A 79 GLU CB C 13 30.505 0.001 A 79 GLU CG C 13 36.711 0.005 A 79 GLU N N 15 121.692 0.014 A 80 VAL H H 1 8.539 0.001 A 80 VAL HA H 1 4.226 0.002 A 80 VAL HB H 1 1.953 0.003 A 80 VAL HGx% H 1 0.855 0.000 A 80 VAL HGy% H 1 0.857 0.006 A 80 VAL C C 13 175.597 0.000 A 80 VAL CA C 13 61.450 0.000 A 80 VAL CB C 13 33.182 0.000 A 80 VAL CGy C 13 20.502 0.000 A 80 VAL CGx C 13 20.313 0.000 A 80 VAL N N 15 123.842 0.008 A 81 VAL H H 1 8.380 0.001 A 81 VAL HA H 1 4.413 0.001 A 81 VAL HB H 1 2.032 0.003 A 81 VAL HGx% H 1 0.950 0.002 A 81 VAL HGy% H 1 0.977 0.001 A 81 VAL CA C 13 59.416 0.001 A 81 VAL CB C 13 32.811 0.003 A 81 VAL CGx C 13 20.766 0.000 A 81 VAL CGy C 13 21.059 0.000 A 81 VAL N N 15 126.470 0.008 A 82 PRO HA H 1 4.407 0.003 A 82 PRO HBx H 1 1.859 0.003 A 82 PRO HBy H 1 2.261 0.004 A 82 PRO HDy H 1 3.848 0.000 A 82 PRO HDx H 1 3.625 0.009 A 82 PRO HGy H 1 2.031 0.001 A 82 PRO HGx H 1 1.945 0.001 A 82 PRO C C 13 176.082 0.000 A 82 PRO CA C 13 62.676 0.000 A 82 PRO CB C 13 32.119 0.005 A 82 PRO CD C 13 50.964 0.000 A 82 PRO CG C 13 27.450 0.030 A 83 LYS H H 1 8.319 0.003 A 83 LYS HA H 1 4.554 0.006 A 83 LYS HBy H 1 1.779 0.006 A 83 LYS HBx H 1 1.669 0.003 A 83 LYS HD2 H 1 1.686 0.000 A 83 LYS HD3 H 1 1.686 0.000 A 83 LYS HE2 H 1 2.971 0.000 A 83 LYS HE3 H 1 2.971 0.000 A 83 LYS HGy H 1 1.530 0.000 A 83 LYS HGx H 1 1.459 0.002 A 83 LYS CA C 13 53.743 0.001 A 83 LYS CB C 13 32.234 0.009 A 83 LYS CD C 13 28.843 0.000 A 83 LYS CE C 13 41.706 0.000 A 83 LYS CG C 13 24.704 0.000 A 83 LYS N N 15 121.862 0.036 A 84 PRO HA H 1 4.305 0.006 A 84 PRO HBy H 1 2.242 0.002 A 84 PRO HBx H 1 1.805 0.015 A 84 PRO HDx H 1 3.600 0.000 A 84 PRO HDy H 1 3.753 0.000 A 84 PRO HGy H 1 1.912 0.003 A 84 PRO HGx H 1 1.909 0.000 A 84 PRO C C 13 176.935 0.000 A 84 PRO CA C 13 62.358 0.000 A 84 PRO CB C 13 32.503 0.000 A 84 PRO CD C 13 50.292 0.000 A 84 PRO CG C 13 26.953 0.000 A 85 GLN H H 1 8.487 0.003 A 85 GLN HA H 1 4.158 0.004 A 85 GLN HBx H 1 1.850 0.004 A 85 GLN HBy H 1 1.907 0.006 A 85 GLN HE21 H 1 7.035 0.003 A 85 GLN HE22 H 1 7.619 0.003 A 85 GLN HGx H 1 2.266 0.003 A 85 GLN HGy H 1 2.360 0.004 A 85 GLN C C 13 175.077 0.000 A 85 GLN CA C 13 55.927 0.000 A 85 GLN CB C 13 29.865 0.005 A 85 GLN CD C 13 180.269 0.004 A 85 GLN CG C 13 33.934 0.008 A 85 GLN N N 15 121.258 0.005 A 85 GLN NE2 N 15 112.746 0.011 A 86 ARG H H 1 8.229 0.004 A 86 ARG HA H 1 5.137 0.007 A 86 ARG HBy H 1 1.640 0.014 A 86 ARG HBx H 1 1.444 0.005 A 86 ARG HD2 H 1 3.036 0.000 A 86 ARG HD3 H 1 3.036 0.000 A 86 ARG HG2 H 1 1.584 0.000 A 86 ARG HG3 H 1 1.584 0.000 A 86 ARG C C 13 174.913 0.000 A 86 ARG CA C 13 54.498 0.000 A 86 ARG CB C 13 33.214 0.000 A 86 ARG CD C 13 43.533 0.000 A 86 ARG CG C 13 27.177 0.000 A 86 ARG N N 15 121.011 0.025 A 87 HIS H H 1 8.663 0.005 A 87 HIS HA H 1 4.742 0.000 A 87 HIS HBy H 1 3.193 0.004 A 87 HIS HBx H 1 2.745 0.002 A 87 HIS HD2 H 1 6.669 0.004 A 87 HIS HE1 H 1 7.986 0.000 A 87 HIS C C 13 173.930 0.000 A 87 HIS CA C 13 54.099 0.000 A 87 HIS CB C 13 33.458 0.000 A 87 HIS CD2 C 13 118.328 0.000 A 87 HIS CE1 C 13 139.416 0.000 A 87 HIS N N 15 120.941 0.046 A 88 MET H H 1 8.633 0.002 A 88 MET HA H 1 5.334 0.006 A 88 MET HBx H 1 1.684 0.005 A 88 MET HBy H 1 1.942 0.001 A 88 MET HE% H 1 1.939 0.001 A 88 MET HGx H 1 2.306 0.004 A 88 MET HGy H 1 2.372 0.006 A 88 MET C C 13 173.571 0.000 A 88 MET CA C 13 54.626 0.003 A 88 MET CB C 13 35.169 0.005 A 88 MET CE C 13 17.485 0.017 A 88 MET CG C 13 32.280 0.003 A 88 MET N N 15 125.858 0.039 A 89 PHE H H 1 9.002 0.005 A 89 PHE HA H 1 5.184 0.001 A 89 PHE HBx H 1 2.594 0.002 A 89 PHE HBy H 1 2.596 0.001 A 89 PHE HDx H 1 6.828 0.001 A 89 PHE HDy H 1 6.828 0.001 A 89 PHE HEx H 1 6.633 0.000 A 89 PHE HEy H 1 6.633 0.000 A 89 PHE HZ H 1 6.576 0.000 A 89 PHE C C 13 174.473 0.000 A 89 PHE CA C 13 56.153 0.000 A 89 PHE CB C 13 43.978 0.002 A 89 PHE CDx C 13 131.452 0.000 A 89 PHE CDy C 13 131.452 0.000 A 89 PHE CEx C 13 130.646 0.000 A 89 PHE CEy C 13 130.646 0.000 A 89 PHE CZ C 13 127.913 0.000 A 89 PHE N N 15 122.319 0.011 A 90 SER H H 1 8.686 0.008 A 90 SER HA H 1 5.672 0.001 A 90 SER HBx H 1 3.715 0.005 A 90 SER HBy H 1 3.834 0.004 A 90 SER C C 13 173.032 0.000 A 90 SER CA C 13 56.641 0.001 A 90 SER CB C 13 64.635 0.040 A 90 SER N N 15 116.248 0.025 A 91 PHE H H 1 8.861 0.003 A 91 PHE HA H 1 4.894 0.003 A 91 PHE HBx H 1 2.784 0.003 A 91 PHE HBy H 1 3.305 0.010 A 91 PHE HDx H 1 7.436 0.008 A 91 PHE HDy H 1 7.436 0.008 A 91 PHE HEx H 1 7.078 0.004 A 91 PHE HEy H 1 7.078 0.004 A 91 PHE HZ H 1 6.776 0.000 A 91 PHE C C 13 174.436 0.000 A 91 PHE CA C 13 57.217 0.001 A 91 PHE CB C 13 43.484 0.021 A 91 PHE CDx C 13 132.678 0.000 A 91 PHE CDy C 13 132.678 0.000 A 91 PHE CEx C 13 130.690 0.000 A 91 PHE CEy C 13 130.690 0.000 A 91 PHE CZ C 13 127.345 0.000 A 91 PHE N N 15 120.208 0.014 A 92 ASN H H 1 9.112 0.005 A 92 ASN HA H 1 5.085 0.002 A 92 ASN HBy H 1 2.889 0.004 A 92 ASN HBx H 1 2.887 0.001 A 92 ASN HD21 H 1 6.805 0.003 A 92 ASN HD22 H 1 7.596 0.002 A 92 ASN C C 13 174.816 0.000 A 92 ASN CA C 13 52.136 0.000 A 92 ASN CB C 13 39.954 0.000 A 92 ASN CG C 13 177.042 0.000 A 92 ASN N N 15 115.969 0.052 A 92 ASN ND2 N 15 111.291 0.006 A 93 ASN H H 1 7.270 0.002 A 93 ASN HA H 1 4.900 0.006 A 93 ASN HBy H 1 2.875 0.009 A 93 ASN HBx H 1 2.816 0.005 A 93 ASN HD21 H 1 7.903 0.003 A 93 ASN HD22 H 1 7.206 0.002 A 93 ASN C C 13 174.560 0.000 A 93 ASN CA C 13 52.983 0.002 A 93 ASN CB C 13 41.658 0.003 A 93 ASN CG C 13 176.447 0.028 A 93 ASN N N 15 118.540 0.022 A 93 ASN ND2 N 15 113.946 0.060 A 94 ARG H H 1 9.316 0.002 A 94 ARG HA H 1 3.857 0.004 A 94 ARG HBy H 1 1.988 0.007 A 94 ARG HBx H 1 1.800 0.002 A 94 ARG HDx H 1 3.114 0.000 A 94 ARG HDy H 1 3.367 0.000 A 94 ARG HGy H 1 1.783 0.000 A 94 ARG HGx H 1 1.639 0.000 A 94 ARG C C 13 176.816 0.000 A 94 ARG CA C 13 59.351 0.001 A 94 ARG CB C 13 30.000 0.005 A 94 ARG CD C 13 42.489 0.012 A 94 ARG CG C 13 26.554 0.013 A 94 ARG N N 15 129.173 0.018 A 95 THR H H 1 7.982 0.002 A 95 THR HA H 1 3.995 0.002 A 95 THR HB H 1 4.316 0.002 A 95 THR HG2% H 1 1.270 0.002 A 95 THR C C 13 176.659 0.000 A 95 THR CA C 13 66.204 0.000 A 95 THR CB C 13 68.348 0.000 A 95 THR CG2 C 13 21.751 0.000 A 95 THR N N 15 115.657 0.017 A 96 VAL H H 1 7.574 0.004 A 96 VAL HA H 1 3.784 0.003 A 96 VAL HB H 1 2.364 0.011 A 96 VAL HGx% H 1 1.260 0.004 A 96 VAL HGy% H 1 1.213 0.011 A 96 VAL C C 13 177.516 0.000 A 96 VAL CA C 13 65.798 0.002 A 96 VAL CB C 13 32.414 0.001 A 96 VAL CGx C 13 21.181 0.000 A 96 VAL CGy C 13 22.082 0.000 A 96 VAL N N 15 121.812 0.026 A 97 MET H H 1 7.332 0.003 A 97 MET HA H 1 2.339 0.007 A 97 MET HBx H 1 1.923 0.002 A 97 MET HBy H 1 2.034 0.000 A 97 MET HE% H 1 2.064 0.011 A 97 MET HGy H 1 2.351 0.000 A 97 MET HGx H 1 2.348 0.004 A 97 MET C C 13 177.153 0.000 A 97 MET CA C 13 59.527 0.000 A 97 MET CB C 13 32.544 0.004 A 97 MET CE C 13 17.686 0.000 A 97 MET CG C 13 31.701 0.000 A 97 MET N N 15 117.484 0.007 A 98 ASP H H 1 8.687 0.002 A 98 ASP HA H 1 4.267 0.004 A 98 ASP HBx H 1 2.538 0.002 A 98 ASP HBy H 1 2.710 0.013 A 98 ASP C C 13 178.979 0.000 A 98 ASP CA C 13 57.364 0.001 A 98 ASP CB C 13 39.751 0.004 A 98 ASP N N 15 118.072 0.014 A 99 ASN H H 1 8.102 0.003 A 99 ASN HA H 1 4.435 0.004 A 99 ASN HBx H 1 2.743 0.004 A 99 ASN HBy H 1 3.015 0.006 A 99 ASN HD21 H 1 6.954 0.003 A 99 ASN HD22 H 1 7.436 0.006 A 99 ASN C C 13 178.100 0.000 A 99 ASN CA C 13 56.104 0.000 A 99 ASN CB C 13 38.276 0.006 A 99 ASN CG C 13 176.334 0.018 A 99 ASN N N 15 120.254 0.010 A 99 ASN ND2 N 15 111.583 0.022 A 100 ILE H H 1 8.060 0.003 A 100 ILE HA H 1 3.624 0.001 A 100 ILE HB H 1 1.897 0.009 A 100 ILE HD1% H 1 0.519 0.005 A 100 ILE HG1x H 1 1.280 0.008 A 100 ILE HG1y H 1 1.561 0.006 A 100 ILE HG2% H 1 0.696 0.004 A 100 ILE C C 13 177.524 0.000 A 100 ILE CA C 13 62.571 0.004 A 100 ILE CB C 13 35.740 0.001 A 100 ILE CD1 C 13 9.565 0.000 A 100 ILE CG1 C 13 28.179 0.000 A 100 ILE CG2 C 13 17.167 0.000 A 100 ILE N N 15 121.003 0.019 A 101 LYS H H 1 8.904 0.002 A 101 LYS HA H 1 3.629 0.006 A 101 LYS HBy H 1 2.016 0.002 A 101 LYS HBx H 1 1.815 0.003 A 101 LYS HDy H 1 1.639 0.000 A 101 LYS HDx H 1 1.507 0.011 A 101 LYS HE2 H 1 2.862 0.004 A 101 LYS HE3 H 1 2.862 0.004 A 101 LYS HGx H 1 1.316 0.001 A 101 LYS HGy H 1 1.326 0.010 A 101 LYS C C 13 177.513 0.000 A 101 LYS CA C 13 60.096 0.000 A 101 LYS CB C 13 32.864 0.005 A 101 LYS CD C 13 29.437 0.005 A 101 LYS CE C 13 41.149 0.000 A 101 LYS CG C 13 24.213 0.000 A 101 LYS N N 15 120.681 0.013 A 102 MET H H 1 8.035 0.002 A 102 MET HA H 1 4.165 0.002 A 102 MET HBy H 1 2.236 0.004 A 102 MET HBx H 1 2.139 0.008 A 102 MET HE% H 1 2.080 0.000 A 102 MET HGy H 1 2.685 0.006 A 102 MET HGx H 1 2.611 0.013 A 102 MET C C 13 178.966 0.000 A 102 MET CA C 13 58.617 0.001 A 102 MET CB C 13 31.990 0.001 A 102 MET CE C 13 16.651 0.000 A 102 MET CG C 13 31.823 0.004 A 102 MET N N 15 116.956 0.026 A 103 THR H H 1 7.715 0.004 A 103 THR HA H 1 3.849 0.008 A 103 THR HB H 1 3.966 0.002 A 103 THR HG2% H 1 0.765 0.010 A 103 THR C C 13 176.541 0.000 A 103 THR CA C 13 66.142 0.001 A 103 THR CB C 13 67.808 0.001 A 103 THR CG2 C 13 21.971 0.000 A 103 THR N N 15 118.109 0.018 A 104 LEU H H 1 8.555 0.003 A 104 LEU HA H 1 3.861 0.001 A 104 LEU HBx H 1 1.110 0.005 A 104 LEU HBy H 1 2.090 0.009 A 104 LEU HDx% H 1 0.786 0.007 A 104 LEU HDy% H 1 0.737 0.032 A 104 LEU HG H 1 1.885 0.008 A 104 LEU C C 13 178.351 0.000 A 104 LEU CA C 13 57.875 0.000 A 104 LEU CB C 13 42.647 0.007 A 104 LEU CDx C 13 24.712 0.000 A 104 LEU CDy C 13 26.815 0.000 A 104 LEU CG C 13 26.516 0.000 A 104 LEU N N 15 119.326 0.021 A 105 GLN H H 1 8.715 0.003 A 105 GLN HA H 1 3.909 0.003 A 105 GLN HBx H 1 2.106 0.000 A 105 GLN HBy H 1 2.245 0.008 A 105 GLN HE21 H 1 6.815 0.001 A 105 GLN HE22 H 1 7.380 0.002 A 105 GLN HGx H 1 2.372 0.011 A 105 GLN HGy H 1 2.453 0.003 A 105 GLN C C 13 178.755 0.000 A 105 GLN CA C 13 59.310 0.000 A 105 GLN CB C 13 28.081 0.000 A 105 GLN CD C 13 179.635 0.017 A 105 GLN CG C 13 34.062 0.005 A 105 GLN N N 15 118.089 0.012 A 105 GLN NE2 N 15 111.393 0.038 A 106 GLN H H 1 7.611 0.002 A 106 GLN HA H 1 4.045 0.003 A 106 GLN HBx H 1 2.174 0.005 A 106 GLN HBy H 1 2.304 0.001 A 106 GLN HE21 H 1 6.847 0.001 A 106 GLN HE22 H 1 7.361 0.004 A 106 GLN HGx H 1 2.403 0.001 A 106 GLN HGy H 1 2.579 0.004 A 106 GLN C C 13 178.631 0.000 A 106 GLN CA C 13 58.733 0.001 A 106 GLN CB C 13 28.698 0.000 A 106 GLN CD C 13 180.133 0.005 A 106 GLN CG C 13 33.856 0.000 A 106 GLN N N 15 118.229 0.008 A 106 GLN NE2 N 15 111.211 0.013 A 107 ILE H H 1 7.826 0.004 A 107 ILE HA H 1 3.457 0.002 A 107 ILE HB H 1 1.681 0.001 A 107 ILE HD1% H 1 0.627 0.003 A 107 ILE HG1y H 1 1.894 0.013 A 107 ILE HG1x H 1 0.859 0.010 A 107 ILE HG2% H 1 0.824 0.007 A 107 ILE C C 13 177.638 0.000 A 107 ILE CA C 13 65.437 0.001 A 107 ILE CB C 13 38.846 0.002 A 107 ILE CD1 C 13 15.625 0.000 A 107 ILE CG1 C 13 28.659 0.000 A 107 ILE CG2 C 13 18.979 0.000 A 107 ILE N N 15 120.344 0.013 A 108 ILE H H 1 8.741 0.001 A 108 ILE HA H 1 3.804 0.005 A 108 ILE HB H 1 1.867 0.004 A 108 ILE HD1% H 1 0.741 0.006 A 108 ILE HG1y H 1 1.686 0.007 A 108 ILE HG1x H 1 1.241 0.003 A 108 ILE HG2% H 1 0.917 0.005 A 108 ILE C C 13 179.211 0.000 A 108 ILE CA C 13 65.365 0.001 A 108 ILE CB C 13 38.469 0.001 A 108 ILE CD1 C 13 15.138 0.000 A 108 ILE CG1 C 13 29.151 0.000 A 108 ILE CG2 C 13 17.016 0.000 A 108 ILE N N 15 117.380 0.024 A 109 SER H H 1 7.858 0.002 A 109 SER HA H 1 4.204 0.007 A 109 SER HBy H 1 4.007 0.004 A 109 SER HBx H 1 4.001 0.000 A 109 SER C C 13 176.058 0.000 A 109 SER CA C 13 61.831 0.000 A 109 SER CB C 13 62.867 0.001 A 109 SER N N 15 114.420 0.013 A 110 ARG H H 1 7.561 0.003 A 110 ARG HA H 1 4.105 0.004 A 110 ARG HB2 H 1 1.662 0.000 A 110 ARG HB3 H 1 1.662 0.000 A 110 ARG HDy H 1 3.135 0.003 A 110 ARG HDx H 1 2.995 0.004 A 110 ARG HE H 1 7.064 0.000 A 110 ARG HGx H 1 1.505 0.006 A 110 ARG HGy H 1 1.659 0.003 A 110 ARG C C 13 178.547 0.000 A 110 ARG CA C 13 58.443 0.001 A 110 ARG CB C 13 29.780 0.000 A 110 ARG CD C 13 43.568 0.000 A 110 ARG CG C 13 26.944 0.007 A 110 ARG N N 15 121.165 0.014 A 110 ARG NE N 15 84.823 0.000 A 111 TYR H H 1 7.456 0.003 A 111 TYR HA H 1 4.766 0.000 A 111 TYR HBx H 1 3.058 0.005 A 111 TYR HBy H 1 3.391 0.002 A 111 TYR HDx H 1 7.090 0.004 A 111 TYR HDy H 1 7.090 0.004 A 111 TYR HEx H 1 6.710 0.006 A 111 TYR HEy H 1 6.710 0.006 A 111 TYR C C 13 177.027 0.000 A 111 TYR CA C 13 57.604 0.000 A 111 TYR CB C 13 37.388 0.009 A 111 TYR CDx C 13 132.560 0.000 A 111 TYR CDy C 13 132.560 0.000 A 111 TYR CEx C 13 117.799 0.000 A 111 TYR CEy C 13 117.799 0.000 A 111 TYR N N 15 117.191 0.009 A 112 LYS H H 1 7.774 0.002 A 112 LYS HA H 1 4.356 0.004 A 112 LYS HB2 H 1 1.942 0.004 A 112 LYS HB3 H 1 1.942 0.003 A 112 LYS HD2 H 1 1.794 0.000 A 112 LYS HD3 H 1 1.794 0.000 A 112 LYS HE2 H 1 3.083 0.000 A 112 LYS HE3 H 1 3.083 0.000 A 112 LYS HGy H 1 1.656 0.003 A 112 LYS HGx H 1 1.579 0.005 A 112 LYS C C 13 177.371 0.000 A 112 LYS CA C 13 57.191 0.001 A 112 LYS CB C 13 32.725 0.001 A 112 LYS CD C 13 28.804 0.000 A 112 LYS CE C 13 41.804 0.000 A 112 LYS CG C 13 24.605 0.016 A 112 LYS N N 15 120.991 0.023 A 113 ASP H H 1 8.299 0.002 A 113 ASP HA H 1 4.619 0.003 A 113 ASP HBx H 1 2.697 0.003 A 113 ASP HBy H 1 2.758 0.008 A 113 ASP C C 13 176.664 0.000 A 113 ASP CA C 13 55.037 0.000 A 113 ASP CB C 13 40.954 0.002 A 113 ASP N N 15 120.787 0.024 A 114 ALA H H 1 8.038 0.002 A 114 ALA HA H 1 4.336 0.006 A 114 ALA HB% H 1 1.478 0.000 A 114 ALA C C 13 177.983 0.000 A 114 ALA CA C 13 52.866 0.000 A 114 ALA CB C 13 19.027 0.000 A 114 ALA N N 15 123.604 0.007 A 115 ASP H H 1 8.223 0.001 A 115 ASP HA H 1 4.630 0.001 A 115 ASP HBx H 1 2.728 0.000 A 115 ASP HBy H 1 2.735 0.006 A 115 ASP CA C 13 54.476 0.000 A 115 ASP CB C 13 41.100 0.001 A 115 ASP N N 15 119.283 0.033 B 519 GLY HA2 H 1 3.862 0.000 B 519 GLY HA3 H 1 3.862 0.000 B 519 GLY CA C 13 43.151 0.000 B 520 SER HA H 1 4.841 0.000 B 520 SER HBy H 1 3.860 0.000 B 520 SER HBx H 1 3.847 0.000 B 520 SER CA C 13 56.466 0.000 B 520 SER CB C 13 63.562 0.000 B 521 PRO HA H 1 4.414 0.000 B 521 PRO HBx H 1 1.877 0.000 B 521 PRO HBy H 1 2.257 0.000 B 521 PRO HDx H 1 3.733 0.000 B 521 PRO HDy H 1 3.843 0.000 B 521 PRO HGy H 1 2.022 0.000 B 521 PRO HGx H 1 2.020 0.000 B 521 PRO C C 13 177.272 0.000 B 521 PRO CA C 13 63.621 0.000 B 521 PRO CB C 13 32.006 0.015 B 521 PRO CD C 13 50.769 0.016 B 521 PRO CG C 13 27.453 0.000 B 522 GLY H H 1 8.330 0.000 B 522 GLY HA2 H 1 3.824 0.000 B 522 GLY HA3 H 1 3.824 0.000 B 522 GLY C C 13 173.396 0.000 B 522 GLY CA C 13 44.880 0.000 B 522 GLY N N 15 108.831 0.000 B 523 TYR H H 1 7.993 0.000 B 523 TYR HA H 1 4.829 0.000 B 523 TYR HBy H 1 3.031 0.000 B 523 TYR HBx H 1 2.824 0.000 B 523 TYR HDx H 1 7.120 0.000 B 523 TYR HDy H 1 7.120 0.000 B 523 TYR CA C 13 55.770 0.000 B 523 TYR CB C 13 38.341 0.015 B 523 TYR CDx C 13 132.642 0.000 B 523 TYR CDy C 13 132.642 0.000 B 523 TYR N N 15 120.531 0.000 B 524 PRO HA H 1 4.408 0.000 B 524 PRO HBy H 1 2.258 0.000 B 524 PRO HBx H 1 1.929 0.000 B 524 PRO HDx H 1 3.521 0.000 B 524 PRO HDy H 1 3.715 0.000 B 524 PRO HGx H 1 1.981 0.000 B 524 PRO HGy H 1 1.984 0.000 B 524 PRO C C 13 176.835 0.000 B 524 PRO CA C 13 63.548 0.000 B 524 PRO CB C 13 32.002 0.012 B 524 PRO CD C 13 50.603 0.005 B 524 PRO CG C 13 27.419 0.003 B 525 ASN H H 1 8.435 0.000 B 525 ASN HA H 1 4.693 0.000 B 525 ASN HBy H 1 2.861 0.000 B 525 ASN HBx H 1 2.796 0.000 B 525 ASN HD21 H 1 6.924 0.000 B 525 ASN HD22 H 1 7.615 0.000 B 525 ASN C C 13 175.871 0.000 B 525 ASN CA C 13 53.326 0.000 B 525 ASN CB C 13 38.870 0.011 B 525 ASN CG C 13 177.158 0.025 B 525 ASN N N 15 118.189 0.000 B 525 ASN ND2 N 15 112.722 0.016 B 526 GLY H H 1 8.315 0.000 B 526 GLY HA2 H 1 3.943 0.000 B 526 GLY HA3 H 1 3.943 0.000 B 526 GLY C C 13 174.060 0.000 B 526 GLY CA C 13 45.423 0.000 B 526 GLY N N 15 108.937 0.000 B 527 LEU H H 1 8.022 0.000 B 527 LEU HA H 1 4.336 0.000 B 527 LEU HBy H 1 1.613 0.000 B 527 LEU HBx H 1 1.560 0.000 B 527 LEU HDx% H 1 0.881 0.000 B 527 LEU HDy% H 1 0.818 0.000 B 527 LEU HG H 1 1.559 0.000 B 527 LEU C C 13 177.303 0.000 B 527 LEU CA C 13 55.243 0.000 B 527 LEU CB C 13 42.178 0.005 B 527 LEU CDy C 13 25.140 0.000 B 527 LEU CDx C 13 23.448 0.000 B 527 LEU CG C 13 27.125 0.000 B 527 LEU N N 15 121.388 0.000 B 528 LEU H H 1 8.212 0.000 B 528 LEU HA H 1 4.388 0.000 B 528 LEU HBy H 1 1.627 0.000 B 528 LEU HBx H 1 1.578 0.000 B 528 LEU HDx% H 1 0.814 0.000 B 528 LEU HDy% H 1 0.878 0.000 B 528 LEU HG H 1 1.577 0.000 B 528 LEU C C 13 177.362 0.000 B 528 LEU CA C 13 54.869 0.000 B 528 LEU CB C 13 42.182 0.003 B 528 LEU CDx C 13 23.514 0.000 B 528 LEU CDy C 13 25.144 0.000 B 528 LEU CG C 13 27.132 0.000 B 528 LEU N N 15 122.306 0.000 B 529 SER H H 1 8.358 0.000 B 529 SER HA H 1 4.382 0.000 B 529 SER HB2 H 1 3.800 0.000 B 529 SER HB3 H 1 3.800 0.000 B 529 SER C C 13 175.169 0.000 B 529 SER CA C 13 58.399 0.000 B 529 SER CB C 13 63.854 0.000 B 529 SER N N 15 116.400 0.000 B 530 GLY H H 1 8.506 0.000 B 530 GLY HA2 H 1 3.976 0.000 B 530 GLY HA3 H 1 3.976 0.000 B 530 GLY C C 13 174.107 0.000 B 530 GLY CA C 13 45.409 0.000 B 530 GLY N N 15 111.162 0.000 B 531 ASP H H 1 8.210 0.000 B 531 ASP HA H 1 4.599 0.000 B 531 ASP HBy H 1 2.672 0.000 B 531 ASP HBx H 1 2.570 0.000 B 531 ASP C C 13 176.630 0.000 B 531 ASP CA C 13 54.494 0.000 B 531 ASP CB C 13 41.296 0.003 B 531 ASP N N 15 120.367 0.000 B 532 GLU H H 1 8.481 0.000 B 532 GLU HA H 1 4.140 0.000 B 532 GLU HBy H 1 1.908 0.000 B 532 GLU HBx H 1 1.851 0.000 B 532 GLU HG2 H 1 2.184 0.000 B 532 GLU HG3 H 1 2.184 0.000 B 532 GLU C C 13 176.202 0.000 B 532 GLU CA C 13 57.069 0.014 B 532 GLU CB C 13 30.055 0.007 B 532 GLU CG C 13 36.377 0.000 B 532 GLU N N 15 120.562 0.000 B 533 ASP H H 1 8.200 0.000 B 533 ASP HA H 1 4.522 0.000 B 533 ASP HBx H 1 2.498 0.000 B 533 ASP HBy H 1 2.580 0.000 B 533 ASP C C 13 176.193 0.000 B 533 ASP CA C 13 54.191 0.006 B 533 ASP CB C 13 41.190 0.010 B 533 ASP N N 15 120.261 0.000 B 534 PHE H H 1 8.141 0.000 B 534 PHE HA H 1 4.525 0.000 B 534 PHE HBx H 1 2.946 0.000 B 534 PHE HBy H 1 3.152 0.000 B 534 PHE HDx H 1 7.158 0.000 B 534 PHE HDy H 1 7.158 0.000 B 534 PHE C C 13 176.170 0.000 B 534 PHE CA C 13 58.101 0.000 B 534 PHE CB C 13 39.337 0.006 B 534 PHE CDx C 13 131.379 0.000 B 534 PHE CDy C 13 131.379 0.000 B 534 PHE N N 15 120.629 0.000 B 535 SER H H 1 8.245 0.000 B 535 SER HA H 1 4.375 0.005 B 535 SER HBy H 1 3.858 0.005 B 535 SER HBx H 1 3.823 0.000 B 535 SER C C 13 174.834 0.000 B 535 SER CA C 13 59.125 0.023 B 535 SER CB C 13 63.785 0.004 B 535 SER N N 15 116.182 0.000 B 536 SER H H 1 8.238 0.000 B 536 SER HA H 1 4.468 0.006 B 536 SER HBy H 1 3.873 0.000 B 536 SER HBx H 1 3.870 0.003 B 536 SER C C 13 174.883 0.000 B 536 SER CA C 13 58.591 0.026 B 536 SER CB C 13 63.654 0.000 B 536 SER N N 15 117.392 0.000 B 537 ILE H H 1 7.943 0.000 B 537 ILE HA H 1 4.113 0.000 B 537 ILE HB H 1 1.865 0.000 B 537 ILE HD1% H 1 0.816 0.001 B 537 ILE HG1y H 1 1.446 0.000 B 537 ILE HG1x H 1 1.163 0.000 B 537 ILE HG2% H 1 0.883 0.001 B 537 ILE C C 13 176.239 0.000 B 537 ILE CA C 13 61.696 0.000 B 537 ILE CB C 13 38.490 0.000 B 537 ILE CD1 C 13 13.408 0.000 B 537 ILE CG1 C 13 27.626 0.006 B 537 ILE CG2 C 13 17.807 0.000 B 537 ILE N N 15 121.739 0.000 B 538 ALA H H 1 8.163 0.000 B 538 ALA HA H 1 4.267 0.003 B 538 ALA HB% H 1 1.357 0.007 B 538 ALA C C 13 177.758 0.000 B 538 ALA CA C 13 52.933 0.000 B 538 ALA CB C 13 19.347 0.000 B 538 ALA N N 15 126.303 0.000 B 539 ASP H H 1 8.101 0.000 B 539 ASP HA H 1 4.522 0.005 B 539 ASP HBy H 1 2.697 0.000 B 539 ASP HBx H 1 2.599 0.002 B 539 ASP C C 13 176.705 0.000 B 539 ASP CA C 13 54.870 0.000 B 539 ASP CB C 13 41.184 0.004 B 539 ASP N N 15 118.615 0.000 B 540 MET H H 1 8.044 0.000 B 540 MET HA H 1 4.304 0.000 B 540 MET HB2 H 1 1.954 0.000 B 540 MET HB3 H 1 1.954 0.000 B 540 MET HE% H 1 2.016 0.001 B 540 MET HGx H 1 2.426 0.000 B 540 MET HGy H 1 2.484 0.000 B 540 MET C C 13 176.024 0.000 B 540 MET CA C 13 56.032 0.000 B 540 MET CB C 13 33.033 0.000 B 540 MET CE C 13 17.167 0.025 B 540 MET CG C 13 32.115 0.001 B 540 MET N N 15 119.677 0.000 B 541 ASP H H 1 8.208 0.000 B 541 ASP HA H 1 4.533 0.000 B 541 ASP HBx H 1 2.584 0.002 B 541 ASP HBy H 1 2.656 0.001 B 541 ASP C C 13 176.677 0.000 B 541 ASP CA C 13 54.326 0.000 B 541 ASP CB C 13 41.093 0.001 B 541 ASP N N 15 120.848 0.000 B 542 PHE H H 1 8.239 0.000 B 542 PHE HA H 1 4.446 0.004 B 542 PHE HBx H 1 3.026 0.010 B 542 PHE HBy H 1 3.203 0.006 B 542 PHE HDx H 1 7.193 0.000 B 542 PHE HDy H 1 7.193 0.000 B 542 PHE HEx H 1 7.277 0.014 B 542 PHE HEy H 1 7.277 0.014 B 542 PHE C C 13 176.620 0.000 B 542 PHE CA C 13 58.856 0.000 B 542 PHE CB C 13 39.091 0.003 B 542 PHE CDx C 13 131.360 0.000 B 542 PHE CDy C 13 131.360 0.000 B 542 PHE N N 15 121.509 0.000 B 543 SER H H 1 8.261 0.000 B 543 SER HA H 1 4.229 0.000 B 543 SER HBy H 1 3.901 0.000 B 543 SER HBx H 1 3.859 0.000 B 543 SER C C 13 175.317 0.000 B 543 SER CA C 13 60.022 0.000 B 543 SER CB C 13 63.270 0.010 B 543 SER N N 15 116.108 0.000 B 544 ALA H H 1 8.082 0.000 B 544 ALA HA H 1 4.263 0.000 B 544 ALA HB% H 1 1.411 0.000 B 544 ALA C C 13 178.469 0.000 B 544 ALA CA C 13 53.246 0.000 B 544 ALA CB C 13 18.882 0.000 B 544 ALA N N 15 125.073 0.000 B 545 LEU H H 1 7.857 0.001 B 545 LEU HA H 1 4.243 0.000 B 545 LEU HBy H 1 1.662 0.000 B 545 LEU HBx H 1 1.569 0.000 B 545 LEU HDx% H 1 0.875 0.007 B 545 LEU HDy% H 1 0.856 0.006 B 545 LEU HG H 1 1.635 0.006 B 545 LEU C C 13 177.944 0.000 B 545 LEU CA C 13 55.808 0.000 B 545 LEU CB C 13 42.197 0.006 B 545 LEU CDy C 13 25.098 0.000 B 545 LEU CDx C 13 23.686 0.000 B 545 LEU CG C 13 27.117 0.000 B 545 LEU N N 15 119.451 0.014 B 546 LEU H H 1 7.897 0.000 B 546 LEU HA H 1 4.267 0.000 B 546 LEU HBy H 1 1.662 0.000 B 546 LEU HBx H 1 1.570 0.000 B 546 LEU HDx% H 1 0.878 0.007 B 546 LEU HDy% H 1 0.846 0.005 B 546 LEU HG H 1 1.628 0.000 B 546 LEU C C 13 177.728 0.000 B 546 LEU CA C 13 55.561 0.000 B 546 LEU CB C 13 42.222 0.002 B 546 LEU CDy C 13 25.124 0.000 B 546 LEU CDx C 13 23.711 0.000 B 546 LEU CG C 13 27.110 0.000 B 546 LEU N N 15 120.507 0.000 B 547 SER H H 1 8.002 0.000 B 547 SER HA H 1 4.408 0.000 B 547 SER HB2 H 1 3.872 0.000 B 547 SER HB3 H 1 3.872 0.000 B 547 SER C C 13 174.587 0.000 B 547 SER CA C 13 58.521 0.000 B 547 SER CB C 13 63.417 0.000 B 547 SER N N 15 114.914 0.001 B 548 GLN H H 1 8.172 0.000 B 548 GLN HA H 1 4.384 0.000 B 548 GLN HBx H 1 2.012 0.000 B 548 GLN HBy H 1 2.144 0.000 B 548 GLN HE21 H 1 6.826 0.000 B 548 GLN HE22 H 1 7.481 0.000 B 548 GLN HG2 H 1 2.361 0.000 B 548 GLN HG3 H 1 2.361 0.000 B 548 GLN C C 13 175.946 0.000 B 548 GLN CA C 13 55.833 0.000 B 548 GLN CB C 13 29.471 0.001 B 548 GLN CD C 13 180.476 0.000 B 548 GLN CG C 13 33.861 0.000 B 548 GLN N N 15 121.506 0.000 B 548 GLN NE2 N 15 112.147 0.000 B 549 ILE H H 1 8.063 0.000 B 549 ILE HA H 1 4.244 0.000 B 549 ILE HB H 1 1.900 0.000 B 549 ILE HD1% H 1 0.850 0.000 B 549 ILE HG1x H 1 1.200 0.000 B 549 ILE HG1y H 1 1.474 0.000 B 549 ILE HG2% H 1 0.923 0.000 B 549 ILE C C 13 176.206 0.000 B 549 ILE CA C 13 61.117 0.000 B 549 ILE CB C 13 38.847 0.000 B 549 ILE CD1 C 13 13.176 0.000 B 549 ILE CG1 C 13 27.283 0.001 B 549 ILE CG2 C 13 17.648 0.000 B 549 ILE N N 15 121.116 0.000 B 550 SER H H 1 8.321 0.000 B 550 SER HA H 1 4.549 0.000 B 550 SER HBy H 1 3.891 0.000 B 550 SER HBx H 1 3.878 0.000 B 550 SER C C 13 173.678 0.000 B 550 SER CA C 13 58.070 0.000 B 550 SER CB C 13 63.962 0.000 B 550 SER N N 15 120.140 0.000 B 551 SER H H 1 8.001 0.000 B 551 SER HA H 1 4.285 0.000 B 551 SER HB2 H 1 3.848 0.000 B 551 SER HB3 H 1 3.848 0.000 B 551 SER CA C 13 59.922 0.000 B 551 SER CB C 13 64.739 0.000 B 551 SER N N 15 123.538 0.000 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 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 8 ILE HG1y A 8 ILE HD1% 1.0 1.487 2.459 2 2 A 8 ILE HD1% A 8 ILE HG1x 1.0 1.532 2.598 3 3 A 8 ILE HD1% A 8 ILE HG2% 1.0 1.457 2.373 4 4 A 8 ILE HG1y A 8 ILE HG2% 1.0 1.601 2.827 5 5 A 8 ILE HG1x A 8 ILE HG2% 1.0 2.000 5.000 6 6 A 8 ILE HG2% A 8 ILE HB 1.0 1.550 2.654 7 7 A 8 ILE HG2% A 8 ILE HA 1.0 1.632 2.936 8 8 A 8 ILE HG2% A 13 SER HA 1.0 1.788 3.604 9 9 A 8 ILE HG2% A 12 VAL HA 1.0 1.924 4.516 10 10 A 8 ILE HG2% A 90 SER HBx 1.0 1.772 3.526 11 11 A 8 ILE HG2% A 11 LYS HA 1.0 1.596 2.810 12 12 A 8 ILE HG2% A 11 LYS HBy 1.0 1.927 4.545 13 13 A 8 ILE HG2% A 11 LYS HBx 1.0 2.000 5.000 14 14 A 8 ILE HG2% A 11 LYS HGx 1.0 2.000 5.000 15 15 A 8 ILE HD1% A 8 ILE HB 1.0 1.612 2.866 16 16 A 8 ILE HD1% A 92 ASN HBy 1.0 2.000 5.000 17 17 A 8 ILE HD1% A 11 LYS HA 1.0 1.924 4.524 18 18 A 8 ILE HD1% A 90 SER HBx 1.0 1.774 3.534 19 19 A 8 ILE HD1% A 13 SER HA 1.0 2.000 5.000 20 20 A 8 ILE HG1x A 8 ILE HB 1.0 1.749 3.417 21 21 A 8 ILE HA A 13 SER HA 1.0 1.659 3.037 22 22 A 8 ILE HA A 29 TRP HD1 1.0 2.000 5.000 23 23 A 8 ILE HA A 29 TRP HZ2 1.0 1.961 4.919 24 24 A 8 ILE HA A 13 SER HBx 1.0 1.902 4.330 25 25 A 16 ILE HA A 29 TRP HBy 1.0 2.000 5.000 26 26 A 16 ILE HA A 29 TRP HBx 1.0 1.901 4.317 27 27 A 8 ILE HB A 8 ILE HA 1.0 1.707 3.229 28 28 A 8 ILE HG1x A 8 ILE HA 1.0 1.734 3.348 29 29 A 8 ILE HG1y A 8 ILE HA 1.0 1.741 3.381 30 30 A 8 ILE HD1% A 8 ILE HA 1.0 2.000 5.000 31 31 A 8 ILE HG1y A 13 SER HA 1.0 1.756 3.452 32 32 A 8 ILE HG1y A 8 ILE HG1x 1.0 1.545 2.641 33 33 A 8 ILE HG1y A 8 ILE HB 1.0 1.737 3.363 34 34 A 3 HIS HA A 3 HIS HBx 1.0 1.708 3.232 35 35 A 3 HIS HA A 3 HIS HBy 1.0 1.747 3.409 36 36 A 3 HIS HA A 18 ILE HB 1.0 1.791 3.623 37 37 A 3 HIS HA A 18 ILE HD1% 1.0 1.672 3.088 38 38 A 3 HIS HA A 18 ILE HG2% 1.0 1.883 4.183 39 39 A 3 HIS HA A 18 ILE HG1x 1.0 1.888 4.220 40 40 A 3 HIS HA A 3 HIS HD2 1.0 1.929 4.563 41 41 A 3 HIS HBx A 3 HIS HD2 1.0 1.870 4.094 42 42 A 3 HIS HBy A 3 HIS HD2 1.0 1.886 4.204 43 43 A 3 HIS HBx A 3 HIS HBy 1.0 1.574 2.734 44 44 A 3 HIS HBy A 18 ILE HB 1.0 1.910 4.390 45 45 A 3 HIS HBx A 18 ILE HB 1.0 1.884 4.184 46 46 A 3 HIS HBy A 18 ILE HD1% 1.0 1.877 4.137 47 47 A 5 GLY HAy A 5 GLY HAx 1.0 1.567 2.713 48 48 A 6 ALA HA A 15 ILE HA 1.0 1.591 2.793 49 49 A 7 ALA HA A 91 PHE HDy 1.0 1.947 4.755 50 49 A 7 ALA HA A 91 PHE HDx 1.0 1.947 4.755 51 50 A 7 ALA HA A 6 ALA HB% 1.0 1.879 4.153 52 51 A 7 ALA HA A 16 ILE HG2% 1.0 2.000 5.000 53 52 A 7 ALA HA A 16 ILE HD1% 1.0 1.968 5.018 54 53 A 6 ALA HA A 6 ALA HB% 1.0 1.509 2.527 55 54 A 15 ILE HA A 6 ALA HB% 1.0 1.734 3.350 56 55 A 6 ALA HB% A 96 VAL HGy% 1.0 1.820 3.782 57 56 A 89 PHE HBy A 7 ALA HB% 1.0 1.727 3.317 58 57 A 7 ALA HB% A 16 ILE HB 1.0 1.668 3.072 59 58 A 7 ALA HB% A 16 ILE HG1x 1.0 2.000 5.000 60 59 A 7 ALA HA A 7 ALA HB% 1.0 1.549 2.651 61 60 A 16 ILE HA A 7 ALA HB% 1.0 1.812 3.736 62 61 A 29 TRP HD1 A 7 ALA HB% 1.0 1.693 3.173 63 62 A 7 ALA HB% A 91 PHE HZ 1.0 1.743 3.389 64 63 A 7 ALA HB% A 91 PHE HEy 1.0 1.743 3.391 65 63 A 7 ALA HB% A 91 PHE HEx 1.0 1.743 3.391 66 64 A 91 PHE HDy A 7 ALA HB% 1.0 1.867 4.069 67 64 A 91 PHE HDx A 7 ALA HB% 1.0 1.867 4.069 68 65 A 9 PHE HBx A 9 PHE HBy 1.0 1.761 3.477 69 66 A 9 PHE HBy A 9 PHE HDy 1.0 1.828 3.824 70 66 A 9 PHE HBy A 9 PHE HDx 1.0 1.828 3.824 71 67 A 9 PHE HBx A 9 PHE HDy 1.0 1.821 3.785 72 67 A 9 PHE HBx A 9 PHE HDx 1.0 1.821 3.785 73 68 A 9 PHE HBx A 89 PHE HDy 1.0 1.935 4.623 74 68 A 9 PHE HBx A 89 PHE HDx 1.0 1.935 4.623 75 69 A 9 PHE HBy A 89 PHE HDy 1.0 1.915 4.437 76 69 A 9 PHE HBy A 89 PHE HDx 1.0 1.915 4.437 77 70 A 9 PHE HBy A 89 PHE HEy 1.0 1.914 4.430 78 70 A 9 PHE HBy A 89 PHE HEx 1.0 1.914 4.430 79 71 A 10 GLU HA A 10 GLU HBy 1.0 1.720 3.286 80 72 A 10 GLU HBy A 10 GLU HBx 1.0 1.630 2.930 81 73 A 10 GLU HA A 10 GLU HBx 1.0 1.646 2.988 82 74 A 10 GLU HBx A 10 GLU HGy 1.0 1.648 2.996 83 75 A 10 GLU HGy A 10 GLU HGx 1.0 1.522 2.568 84 76 A 10 GLU HBy A 10 GLU HGy 1.0 1.738 3.368 85 77 A 10 GLU HBy A 10 GLU HGx 1.0 1.725 3.309 86 78 A 10 GLU HBx A 10 GLU HGx 1.0 1.750 3.418 87 79 A 10 GLU HA A 10 GLU HGx 1.0 1.762 3.478 88 80 A 10 GLU HA A 10 GLU HGy 1.0 2.000 5.000 89 81 A 9 PHE HDy A 10 GLU HGy 1.0 1.970 5.038 90 81 A 9 PHE HDx A 10 GLU HGy 1.0 1.970 5.038 91 82 A 9 PHE HDy A 10 GLU HGx 1.0 1.952 4.812 92 82 A 9 PHE HDx A 10 GLU HGx 1.0 1.952 4.812 93 83 A 10 GLU HGx A 9 PHE HZ 1.0 1.980 5.206 94 84 A 10 GLU HGy A 9 PHE HZ 1.0 1.983 5.277 95 85 A 10 GLU HGy A 9 PHE HEy 1.0 1.954 4.830 96 85 A 10 GLU HGy A 9 PHE HEx 1.0 1.954 4.830 97 86 A 10 GLU HGx A 9 PHE HEy 1.0 1.916 4.448 98 86 A 10 GLU HGx A 9 PHE HEx 1.0 1.916 4.448 99 87 A 9 PHE HBx A 9 PHE HA 1.0 1.824 3.802 100 88 A 8 ILE HG2% A 9 PHE HA 1.0 1.902 4.324 101 89 A 9 PHE HBy A 9 PHE HA 1.0 1.762 3.478 102 90 A 57 LYS HA A 57 LYS HGy 1.0 2.000 5.000 103 91 A 57 LYS HA A 57 LYS HBx 1.0 1.670 3.078 104 92 A 57 LYS HA A 57 LYS HBy 1.0 1.727 3.317 105 93 A 9 PHE HDy A 9 PHE HA 1.0 1.717 3.275 106 93 A 9 PHE HDx A 9 PHE HA 1.0 1.717 3.275 107 94 A 9 PHE HEy A 9 PHE HA 1.0 1.923 4.505 108 94 A 9 PHE HEx A 9 PHE HA 1.0 1.923 4.505 109 95 A 89 PHE HDy A 9 PHE HA 1.0 1.918 4.470 110 95 A 89 PHE HDx A 9 PHE HA 1.0 1.918 4.470 111 96 A 11 LYS HA A 11 LYS HGx 1.0 1.678 3.112 112 97 A 11 LYS HA A 11 LYS HDy 1.0 1.870 4.088 113 98 A 11 LYS HA A 11 LYS HBx 1.0 1.705 3.223 114 99 A 11 LYS HA A 11 LYS HBy 1.0 1.734 3.350 115 100 A 11 LYS HA A 11 LYS HE2 1.0 1.966 5.000 116 101 A 11 LYS HBy A 11 LYS HBx 1.0 1.462 2.390 117 102 A 11 LYS HBx A 11 LYS HGx 1.0 1.695 3.179 118 103 A 11 LYS HBy A 11 LYS HGx 1.0 1.698 3.194 119 104 A 11 LYS HGx A 11 LYS HE2 1.0 1.786 3.598 120 105 A 10 GLU HA A 11 LYS HGy 1.0 1.892 4.248 121 106 A 11 LYS HBy A 11 LYS HDx 1.0 2.000 5.000 122 107 A 11 LYS HBy A 11 LYS HDy 1.0 1.761 3.473 123 108 A 11 LYS HBx A 11 LYS HDx 1.0 2.000 5.000 124 109 A 11 LYS HBx A 11 LYS HDy 1.0 1.658 3.034 125 110 A 11 LYS HGx A 11 LYS HDx 1.0 1.644 2.980 126 111 A 11 LYS HGx A 11 LYS HDy 1.0 1.649 2.999 127 112 A 11 LYS HBy A 11 LYS HE2 1.0 1.827 3.821 128 113 A 11 LYS HBx A 11 LYS HE2 1.0 1.791 3.619 129 114 A 11 LYS HE2 A 11 LYS HDx 1.0 2.000 5.000 130 115 A 11 LYS HDy A 11 LYS HE2 1.0 1.545 2.639 131 116 A 12 VAL HA A 29 TRP HZ2 1.0 1.990 5.458 132 117 A 12 VAL HA A 29 TRP HH2 1.0 1.974 5.114 133 118 A 12 VAL HA A 12 VAL HB 1.0 1.808 3.714 134 119 A 29 TRP HH2 A 12 VAL HB 1.0 2.000 5.000 135 120 A 29 TRP HZ2 A 12 VAL HB 1.0 2.000 5.000 136 121 A 36 LYS HBy A 12 VAL HGy% 1.0 1.911 4.397 137 122 A 12 VAL HB A 12 VAL HGy% 1.0 1.592 2.796 138 123 A 12 VAL HGy% A 36 LYS HEx 1.0 1.960 4.904 139 124 A 12 VAL HGy% A 31 SER HBx 1.0 2.000 5.000 140 125 A 12 VAL HA A 12 VAL HGy% 1.0 1.579 2.751 141 126 A 12 VAL HGy% A 29 TRP HZ3 1.0 1.890 4.228 142 127 A 29 TRP HH2 A 12 VAL HGy% 1.0 1.679 3.115 143 128 A 29 TRP HZ2 A 12 VAL HGy% 1.0 1.729 3.325 144 129 A 12 VAL HGy% A 12 VAL HGx% 1.0 1.431 2.301 145 130 A 28 THR HG2% A 30 ARG HGy 1.0 1.670 3.078 146 131 A 28 THR HG2% A 26 GLU HBy 1.0 2.000 5.000 147 132 A 12 VAL HGx% A 36 LYS HD2 1.0 1.677 3.107 148 133 A 28 THR HG2% A 37 VAL HG2% 1.0 1.490 2.468 149 134 A 12 VAL HB A 12 VAL HGx% 1.0 1.569 2.717 150 135 A 28 THR HG2% A 19 ASN HBx 1.0 1.947 4.753 151 136 A 28 THR HG2% A 30 ARG HDx 1.0 1.919 4.469 152 137 A 36 LYS HEx A 12 VAL HGx% 1.0 1.832 3.846 153 138 A 28 THR HG2% A 39 THR HB 1.0 1.891 4.245 154 139 A 28 THR HG2% A 28 THR HB 1.0 1.466 2.400 155 140 A 12 VAL HA A 12 VAL HGx% 1.0 2.000 5.000 156 141 A 28 THR HG2% A 39 THR HA 1.0 1.699 3.197 157 142 A 28 THR HG2% A 28 THR HA 1.0 1.589 2.783 158 143 A 29 TRP HH2 A 12 VAL HGx% 1.0 1.854 3.982 159 144 A 29 TRP HZ2 A 12 VAL HGx% 1.0 1.964 4.964 160 145 A 63 ILE HA A 63 ILE HB 1.0 1.829 3.829 161 146 A 63 ILE HA A 86 ARG HG2 1.0 1.842 3.912 162 147 A 8 ILE HG1x A 13 SER HA 1.0 1.752 3.432 163 148 A 63 ILE HA A 63 ILE HG1x 1.0 1.838 3.884 164 149 A 13 SER HA A 29 TRP HZ2 1.0 1.985 5.323 165 150 A 41 VAL HA A 26 GLU HGx 1.0 2.000 5.000 166 151 A 41 VAL HA A 26 GLU HBx 1.0 1.835 3.871 167 152 A 26 GLU HBy A 41 VAL HA 1.0 1.832 3.850 168 153 A 8 ILE HG1x A 13 SER HBx 1.0 1.798 3.660 169 154 A 8 ILE HD1% A 13 SER HBx 1.0 1.813 3.743 170 155 A 8 ILE HG2% A 13 SER HBx 1.0 1.936 4.632 171 156 A 14 GLY HAy A 14 GLY HAx 1.0 1.622 2.898 172 157 A 14 GLY HAx A 32 THR HG2% 1.0 1.974 5.108 173 158 A 29 TRP HZ2 A 14 GLY HAx 1.0 1.947 4.751 174 159 A 29 TRP HZ2 A 14 GLY HAy 1.0 1.959 4.897 175 160 A 15 ILE HA A 15 ILE HG1x 1.0 1.866 4.066 176 161 A 15 ILE HA A 15 ILE HG1y 1.0 1.815 3.751 177 162 A 15 ILE HA A 7 ALA HB% 1.0 1.942 4.702 178 163 A 16 ILE HB A 27 LEU HDx% 1.0 2.000 5.000 179 164 A 15 ILE HB A 32 THR HA 1.0 1.988 5.380 180 165 A 15 ILE HA A 15 ILE HB 1.0 1.754 3.436 181 166 A 16 ILE HA A 16 ILE HB 1.0 1.735 3.353 182 167 A 29 TRP HD1 A 16 ILE HB 1.0 1.780 3.568 183 168 A 45 ILE HG1y A 40 VAL HGx% 1.0 1.928 4.552 184 169 A 15 ILE HG1x A 15 ILE HG1y 1.0 1.461 2.385 185 170 A 15 ILE HG1x A 15 ILE HB 1.0 1.629 2.927 186 171 A 15 ILE HG1y A 15 ILE HB 1.0 1.712 3.250 187 172 A 45 ILE HG1y A 45 ILE HG1x 1.0 1.739 3.369 188 173 A 63 ILE HA A 63 ILE HG1y 1.0 1.922 4.496 189 174 A 6 ALA HA A 15 ILE HG1x 1.0 1.942 5.319 190 175 A 14 GLY HAx A 15 ILE HG1x 1.0 1.966 4.992 191 176 A 63 ILE HB A 63 ILE HG1y 1.0 1.771 3.521 192 177 A 63 ILE HG1y A 49 GLN HGx 1.0 1.928 4.552 193 178 A 63 ILE HG1x A 49 GLN HGx 1.0 1.889 4.223 194 179 A 15 ILE HG1y A 15 ILE HG2% 1.0 1.609 2.853 195 180 A 15 ILE HG1x A 15 ILE HG2% 1.0 2.000 5.000 196 181 A 15 ILE HB A 15 ILE HG2% 1.0 1.504 2.510 197 182 A 15 ILE HA A 15 ILE HG2% 1.0 1.618 2.884 198 183 A 6 ALA HA A 15 ILE HG2% 1.0 1.733 3.345 199 184 A 15 ILE HG2% A 17 ALA HA 1.0 1.923 4.515 200 185 A 15 ILE HG1y A 15 ILE HD1% 1.0 1.428 2.292 201 186 A 32 THR HG2% A 15 ILE HD1% 1.0 1.717 3.273 202 187 A 15 ILE HG1x A 15 ILE HD1% 1.0 1.524 2.576 203 188 A 15 ILE HB A 15 ILE HD1% 1.0 2.000 5.000 204 189 A 6 ALA HB% A 15 ILE HD1% 1.0 1.662 3.048 205 190 A 15 ILE HD1% A 32 THR HB 1.0 2.000 5.000 206 191 A 15 ILE HA A 15 ILE HD1% 1.0 1.650 3.002 207 192 A 6 ALA HA A 15 ILE HD1% 1.0 1.671 3.085 208 193 A 16 ILE HG2% A 16 ILE HD1% 1.0 1.614 2.870 209 194 A 16 ILE HG2% A 27 LEU HDx% 1.0 2.000 5.000 210 195 A 16 ILE HG2% A 7 ALA HB% 1.0 1.625 2.913 211 196 A 16 ILE HG2% A 96 VAL HGx% 1.0 1.768 3.508 212 197 A 16 ILE HG2% A 16 ILE HB 1.0 1.610 2.858 213 198 A 16 ILE HG2% A 16 ILE HG1x 1.0 1.626 2.916 214 199 A 16 ILE HG2% A 4 SER HBy 1.0 1.915 4.433 215 200 A 16 ILE HA A 16 ILE HG2% 1.0 1.755 3.449 216 201 A 16 ILE HG2% A 17 ALA HA 1.0 1.817 3.765 217 202 A 16 ILE HG2% A 4 SER HA 1.0 1.807 3.707 218 203 A 29 TRP HD1 A 16 ILE HG2% 1.0 2.000 5.000 219 204 A 16 ILE HG2% A 91 PHE HZ 1.0 1.880 4.162 220 205 A 16 ILE HG2% A 91 PHE HEy 1.0 1.821 3.785 221 205 A 16 ILE HG2% A 91 PHE HEx 1.0 1.821 3.785 222 206 A 16 ILE HD1% A 16 ILE HB 1.0 1.630 2.928 223 207 A 16 ILE HD1% A 16 ILE HG1x 1.0 1.626 2.914 224 208 A 16 ILE HD1% A 27 LEU HDx% 1.0 1.658 3.034 225 209 A 16 ILE HD1% A 27 LEU HDy% 1.0 1.634 2.944 226 210 A 16 ILE HD1% A 60 LEU HDx% 1.0 1.797 3.655 227 211 A 16 ILE HD1% A 7 ALA HB% 1.0 1.612 2.864 228 212 A 16 ILE HD1% A 100 ILE HG1y 1.0 1.890 4.236 229 213 A 16 ILE HD1% A 27 LEU HG 1.0 1.849 3.949 230 214 A 16 ILE HD1% A 89 PHE HBx 1.0 1.850 3.964 231 215 A 16 ILE HA A 16 ILE HD1% 1.0 1.874 4.114 232 216 A 16 ILE HD1% A 89 PHE HDy 1.0 1.733 3.343 233 216 A 16 ILE HD1% A 89 PHE HDx 1.0 1.733 3.343 234 217 A 16 ILE HD1% A 89 PHE HEx 1.0 1.774 3.536 235 217 A 16 ILE HD1% A 89 PHE HEy 1.0 1.774 3.536 236 218 A 16 ILE HD1% A 91 PHE HEy 1.0 1.818 3.770 237 218 A 16 ILE HD1% A 91 PHE HEx 1.0 1.818 3.770 238 219 A 16 ILE HD1% A 16 ILE HG1y 1.0 1.703 3.215 239 220 A 16 ILE HG1x A 16 ILE HG1y 1.0 1.551 2.657 240 221 A 16 ILE HG1x A 27 LEU HDx% 1.0 1.871 4.093 241 222 A 7 ALA HB% A 16 ILE HG1y 1.0 1.877 4.133 242 223 A 16 ILE HB A 16 ILE HG1y 1.0 1.740 3.374 243 224 A 29 TRP HBx A 16 ILE HG1y 1.0 1.950 4.782 244 225 A 29 TRP HBy A 16 ILE HG1x 1.0 1.964 4.956 245 226 A 16 ILE HG1x A 27 LEU HDy% 1.0 1.837 3.883 246 227 A 27 LEU HDx% A 16 ILE HG1y 1.0 1.770 3.518 247 228 A 29 TRP HD1 A 16 ILE HG1x 1.0 2.000 5.000 248 229 A 29 TRP HD1 A 16 ILE HG1y 1.0 1.835 3.867 249 230 A 16 ILE HA A 16 ILE HG1y 1.0 1.653 3.017 250 231 A 16 ILE HA A 16 ILE HG1x 1.0 1.715 3.265 251 232 A 16 ILE HB A 16 ILE HG1x 1.0 2.000 5.000 252 233 A 17 ALA HA A 17 ALA HB% 1.0 1.510 2.528 253 234 A 17 ALA HB% A 18 ILE HA 1.0 1.934 4.618 254 235 A 28 THR HB A 17 ALA HB% 1.0 1.750 3.424 255 236 A 4 SER HBy A 17 ALA HB% 1.0 1.653 3.013 256 237 A 18 ILE HB A 17 ALA HB% 1.0 2.000 5.000 257 238 A 19 ASN HBx A 19 ASN HA 1.0 1.700 3.204 258 239 A 19 ASN HA A 19 ASN HBy 1.0 1.747 3.407 259 240 A 19 ASN HA A 20 GLU HA 1.0 1.949 4.769 260 241 A 3 HIS HD2 A 19 ASN HA 1.0 1.989 5.407 261 242 A 19 ASN HBx A 19 ASN HBy 1.0 1.591 2.793 262 243 A 26 GLU HBy A 19 ASN HBx 1.0 1.904 4.340 263 244 A 26 GLU HBy A 19 ASN HBy 1.0 1.899 4.307 264 245 A 26 GLU HBx A 19 ASN HBy 1.0 1.909 4.389 265 246 A 19 ASN HBx A 26 GLU HBx 1.0 1.928 4.554 266 247 A 26 GLU HGx A 19 ASN HBy 1.0 1.973 5.111 267 248 A 19 ASN HBx A 26 GLU HGx 1.0 1.977 5.159 268 249 A 19 ASN HBy A 22 VAL HGy% 1.0 1.847 3.935 269 250 A 20 GLU HGx A 20 GLU HBy 1.0 1.654 3.020 270 251 A 20 GLU HGx A 20 GLU HGy 1.0 1.556 2.676 271 252 A 20 GLU HGy A 103 THR HG2% 1.0 1.892 4.250 272 253 A 20 GLU HGx A 103 THR HG2% 1.0 1.911 4.405 273 254 A 3 HIS HD2 A 20 GLU HGx 1.0 1.986 5.358 274 255 A 3 HIS HD2 A 20 GLU HGy 1.0 1.952 4.808 275 256 A 20 GLU HA A 20 GLU HBx 1.0 1.737 3.363 276 257 A 20 GLU HGy A 20 GLU HBx 1.0 1.696 3.186 277 258 A 20 GLU HGx A 20 GLU HBx 1.0 1.632 2.934 278 259 A 20 GLU HBy A 20 GLU HBx 1.0 1.525 2.577 279 260 A 20 GLU HBx A 25 ALA HB% 1.0 1.878 4.146 280 261 A 20 GLU HBx A 107 ILE HD1% 1.0 1.916 4.446 281 262 A 20 GLU HBy A 20 GLU HGy 1.0 1.582 2.760 282 263 A 20 GLU HA A 20 GLU HGy 1.0 1.797 3.659 283 264 A 20 GLU HA A 20 GLU HGx 1.0 1.734 3.350 284 265 A 20 GLU HA A 20 GLU HBy 1.0 1.741 3.377 285 266 A 20 GLU HA A 22 VAL HGx% 1.0 1.867 4.069 286 267 A 20 GLU HA A 107 ILE HD1% 1.0 1.921 4.491 287 268 A 18 ILE HB A 18 ILE HA 1.0 1.806 3.704 288 269 A 18 ILE HG1x A 18 ILE HA 1.0 1.793 3.631 289 270 A 18 ILE HA A 27 LEU HBx 1.0 1.855 3.989 290 271 A 18 ILE HD1% A 18 ILE HA 1.0 2.000 5.000 291 272 A 18 ILE HG1x A 27 LEU HA 1.0 1.950 4.776 292 273 A 3 HIS HBx A 18 ILE HG1x 1.0 1.942 4.696 293 274 A 18 ILE HB A 18 ILE HG1x 1.0 1.808 3.710 294 275 A 18 ILE HD1% A 18 ILE HG2% 1.0 1.350 2.090 295 276 A 18 ILE HG2% A 18 ILE HG1x 1.0 1.652 3.010 296 277 A 18 ILE HB A 18 ILE HG2% 1.0 1.593 2.801 297 278 A 18 ILE HG2% A 20 GLU HGx 1.0 1.788 3.608 298 279 A 18 ILE HG2% A 20 GLU HGy 1.0 1.782 3.576 299 280 A 18 ILE HG2% A 18 ILE HA 1.0 1.669 3.077 300 281 A 18 ILE HG2% A 3 HIS HD2 1.0 1.734 3.346 301 282 A 18 ILE HD1% A 27 LEU HDy% 1.0 1.642 2.970 302 283 A 18 ILE HD1% A 18 ILE HG1x 1.0 1.555 2.673 303 284 A 18 ILE HB A 18 ILE HD1% 1.0 1.644 2.980 304 285 A 18 ILE HD1% A 100 ILE HB 1.0 2.000 5.000 305 286 A 18 ILE HD1% A 100 ILE HA 1.0 1.748 3.414 306 287 A 18 ILE HD1% A 104 LEU HA 1.0 1.775 3.543 307 288 A 18 ILE HD1% A 103 THR HB 1.0 1.693 3.173 308 289 A 18 ILE HD1% A 3 HIS HD2 1.0 1.943 4.699 309 290 A 21 ASP HA A 21 ASP HBy 1.0 1.642 2.974 310 291 A 21 ASP HA A 21 ASP HBx 1.0 1.608 2.850 311 292 A 22 VAL HA A 22 VAL HB 1.0 1.589 2.783 312 293 A 22 VAL HGx% A 22 VAL HA 1.0 1.518 2.554 313 294 A 22 VAL HGx% A 22 VAL HB 1.0 1.438 2.320 314 295 A 22 VAL HGx% A 21 ASP HBy 1.0 1.932 4.592 315 296 A 26 GLU HBy A 22 VAL HGy% 1.0 2.000 5.000 316 297 A 26 GLU HBx A 22 VAL HGy% 1.0 2.000 5.000 317 298 A 22 VAL HGy% A 22 VAL HB 1.0 1.520 2.560 318 299 A 22 VAL HGy% A 26 GLU HGy 1.0 1.748 3.410 319 300 A 22 VAL HGy% A 22 VAL HGx% 1.0 2.000 5.000 320 301 A 22 VAL HGy% A 22 VAL HA 1.0 2.000 5.000 321 302 A 24 PRO HA A 24 PRO HDx 1.0 1.871 4.095 322 303 A 24 PRO HA A 24 PRO HBx 1.0 1.712 3.252 323 304 A 24 PRO HA A 111 TYR HEy 1.0 1.980 5.224 324 304 A 24 PRO HA A 111 TYR HEx 1.0 1.980 5.224 325 305 A 24 PRO HA A 24 PRO HGx 1.0 1.733 3.343 326 306 A 24 PRO HA A 24 PRO HGy 1.0 2.000 5.000 327 307 A 24 PRO HDx A 24 PRO HGx 1.0 1.637 2.957 328 308 A 24 PRO HDx A 24 PRO HBx 1.0 1.637 2.957 329 309 A 24 PRO HA A 24 PRO HBy 1.0 1.680 3.122 330 310 A 24 PRO HBy A 43 SER HBy 1.0 1.894 4.264 331 311 A 24 PRO HDx A 24 PRO HBy 1.0 1.846 3.938 332 312 A 24 PRO HBy A 43 SER HBx 1.0 1.869 4.087 333 313 A 24 PRO HGy A 24 PRO HBy 1.0 1.661 3.047 334 314 A 24 PRO HBx A 24 PRO HBy 1.0 1.555 2.671 335 315 A 24 PRO HGx A 24 PRO HBy 1.0 1.553 2.665 336 316 A 111 TYR HEy A 24 PRO HBy 1.0 1.971 5.055 337 316 A 111 TYR HEx A 24 PRO HBy 1.0 1.971 5.055 338 317 A 24 PRO HBx A 111 TYR HEy 1.0 1.992 5.508 339 317 A 24 PRO HBx A 111 TYR HEx 1.0 1.992 5.508 340 318 A 24 PRO HGy A 43 SER HBy 1.0 1.944 4.708 341 319 A 24 PRO HDx A 24 PRO HGy 1.0 1.646 2.986 342 320 A 24 PRO HGx A 43 SER HBx 1.0 1.952 4.800 343 321 A 24 PRO HGy A 43 SER HBx 1.0 1.944 4.718 344 322 A 24 PRO HGx A 24 PRO HGy 1.0 1.416 2.260 345 323 A 24 PRO HBx A 24 PRO HGy 1.0 2.000 5.000 346 324 A 24 PRO HBx A 24 PRO HGx 1.0 2.000 5.000 347 325 A 20 GLU HA A 25 ALA HA 1.0 1.751 3.427 348 326 A 26 GLU HGx A 25 ALA HA 1.0 1.925 4.519 349 327 A 26 GLU HBx A 25 ALA HA 1.0 2.000 5.000 350 328 A 25 ALA HB% A 25 ALA HA 1.0 1.571 2.725 351 329 A 22 VAL HGy% A 25 ALA HA 1.0 1.670 3.080 352 330 A 20 GLU HA A 25 ALA HB% 1.0 1.690 3.162 353 331 A 25 ALA HB% A 26 GLU HA 1.0 1.977 5.175 354 332 A 25 ALA HB% A 107 ILE HA 1.0 1.987 5.367 355 333 A 20 GLU HGy A 25 ALA HB% 1.0 1.837 3.881 356 334 A 20 GLU HGx A 25 ALA HB% 1.0 1.763 3.485 357 335 A 20 GLU HBy A 25 ALA HB% 1.0 1.809 3.719 358 336 A 25 ALA HB% A 42 LEU HBy 1.0 1.755 3.447 359 337 A 25 ALA HB% A 42 LEU HDy% 1.0 1.605 2.839 360 338 A 26 GLU HGx A 26 GLU HBx 1.0 1.763 3.485 361 339 A 26 GLU HBy A 26 GLU HGx 1.0 1.753 3.437 362 340 A 26 GLU HBx A 40 VAL HGx% 1.0 2.000 5.000 363 341 A 41 VAL HA A 26 GLU HGy 1.0 1.846 3.930 364 342 A 26 GLU HGx A 26 GLU HGy 1.0 1.521 2.565 365 343 A 26 GLU HBx A 26 GLU HGy 1.0 1.721 3.291 366 344 A 26 GLU HBy A 26 GLU HGy 1.0 1.707 3.229 367 345 A 26 GLU HGx A 22 VAL HGy% 1.0 1.854 3.984 368 346 A 48 LEU HA A 62 LEU HA 1.0 1.734 3.350 369 347 A 48 LEU HA A 48 LEU HBy 1.0 1.739 3.373 370 348 A 48 LEU HA A 48 LEU HBx 1.0 1.733 3.345 371 349 A 48 LEU HA A 48 LEU HDy% 1.0 2.000 5.000 372 350 A 48 LEU HA A 62 LEU HDx% 1.0 1.918 4.464 373 351 A 48 LEU HA A 47 LYS HBy 1.0 1.884 4.184 374 352 A 48 LEU HA A 47 LYS HA 1.0 1.958 4.882 375 353 A 27 LEU HDx% A 27 LEU HDy% 1.0 1.421 2.273 376 354 A 27 LEU HDx% A 40 VAL HGx% 1.0 1.784 3.588 377 355 A 27 LEU HDx% A 40 VAL HGy% 1.0 1.639 2.963 378 356 A 27 LEU HDx% A 60 LEU HDx% 1.0 2.000 5.000 379 357 A 27 LEU HDx% A 27 LEU HBy 1.0 1.660 3.042 380 358 A 27 LEU HDx% A 40 VAL HB 1.0 2.000 5.000 381 359 A 27 LEU HDx% A 27 LEU HA 1.0 1.826 3.816 382 360 A 27 LEU HDx% A 89 PHE HZ 1.0 1.706 3.224 383 361 A 89 PHE HEy A 27 LEU HDx% 1.0 1.716 3.266 384 361 A 89 PHE HEx A 27 LEU HDx% 1.0 1.716 3.266 385 362 A 89 PHE HDy A 27 LEU HDx% 1.0 1.954 4.824 386 362 A 89 PHE HDx A 27 LEU HDx% 1.0 1.954 4.824 387 363 A 27 LEU HDx% A 40 VAL HA 1.0 2.000 5.000 388 364 A 40 VAL HGx% A 27 LEU HDy% 1.0 1.912 4.408 389 365 A 16 ILE HG2% A 27 LEU HDy% 1.0 1.395 2.205 390 366 A 27 LEU HDx% A 27 LEU HG 1.0 1.470 2.412 391 367 A 27 LEU HDy% A 27 LEU HBy 1.0 2.000 5.000 392 368 A 27 LEU HDy% A 27 LEU HA 1.0 1.714 3.262 393 369 A 27 LEU HDy% A 27 LEU HG 1.0 1.505 2.517 394 370 A 16 ILE HG2% A 27 LEU HG 1.0 2.000 5.000 395 371 A 27 LEU HG A 27 LEU HA 1.0 1.814 3.746 396 372 A 27 LEU HA A 27 LEU HBy 1.0 1.789 3.613 397 373 A 27 LEU HBx A 27 LEU HA 1.0 1.699 3.199 398 374 A 18 ILE HD1% A 27 LEU HA 1.0 2.000 5.000 399 375 A 27 LEU HBx A 27 LEU HBy 1.0 1.673 3.093 400 376 A 27 LEU HBx A 40 VAL HB 1.0 2.000 5.000 401 377 A 27 LEU HDy% A 27 LEU HBx 1.0 1.773 3.531 402 378 A 27 LEU HDx% A 27 LEU HBx 1.0 1.899 4.305 403 379 A 28 THR HB A 28 THR HA 1.0 1.648 2.996 404 380 A 37 VAL HG2% A 28 THR HB 1.0 2.000 5.000 405 381 A 28 THR HB A 39 THR HA 1.0 2.000 5.000 406 382 A 29 TRP HD1 A 29 TRP HA 1.0 1.846 3.930 407 383 A 29 TRP HBy A 29 TRP HA 1.0 1.833 3.859 408 384 A 29 TRP HBx A 29 TRP HA 1.0 1.767 3.501 409 385 A 16 ILE HG1x A 29 TRP HA 1.0 1.872 4.108 410 386 A 16 ILE HG1y A 29 TRP HA 1.0 1.828 3.826 411 387 A 16 ILE HD1% A 29 TRP HA 1.0 1.968 5.026 412 388 A 29 TRP HBy A 29 TRP HBx 1.0 1.748 3.412 413 389 A 29 TRP HD1 A 29 TRP HBx 1.0 1.852 3.970 414 390 A 29 TRP HD1 A 29 TRP HBy 1.0 1.892 4.248 415 391 A 29 TRP HBy A 29 TRP HE3 1.0 1.931 4.591 416 392 A 29 TRP HBx A 29 TRP HE3 1.0 1.956 4.856 417 393 A 29 TRP HBy A 16 ILE HG1y 1.0 1.972 5.078 418 394 A 30 ARG HA A 30 ARG HBx 1.0 1.747 3.409 419 395 A 30 ARG HA A 30 ARG HBy 1.0 1.747 3.411 420 396 A 30 ARG HDx A 30 ARG HA 1.0 1.930 4.570 421 397 A 30 ARG HDx A 30 ARG HBx 1.0 1.812 3.736 422 398 A 30 ARG HDx A 30 ARG HBy 1.0 1.789 3.611 423 399 A 30 ARG HBx A 30 ARG HDy 1.0 1.842 3.906 424 400 A 30 ARG HBx A 30 ARG HBy 1.0 1.479 2.439 425 401 A 15 ILE HG2% A 30 ARG HBy 1.0 1.978 5.184 426 402 A 30 ARG HDx A 34 GLY HAy 1.0 1.960 4.904 427 403 A 30 ARG HDx A 34 GLY HAx 1.0 1.941 4.691 428 404 A 30 ARG HDy A 34 GLY HAx 1.0 1.924 4.514 429 405 A 30 ARG HDy A 34 GLY HAy 1.0 1.968 5.016 430 406 A 30 ARG HDx A 30 ARG HDy 1.0 1.296 1.958 431 407 A 37 VAL HG2% A 30 ARG HDx 1.0 1.830 3.836 432 408 A 30 ARG HDx A 30 ARG HGx 1.0 1.634 2.942 433 409 A 30 ARG HDy A 30 ARG HGx 1.0 2.000 5.000 434 410 A 30 ARG HGy A 30 ARG HDx 1.0 1.670 3.080 435 411 A 30 ARG HGy A 30 ARG HDy 1.0 1.600 2.822 436 412 A 30 ARG HDx A 15 ILE HG2% 1.0 1.964 4.962 437 413 A 30 ARG HA A 30 ARG HDy 1.0 1.958 4.884 438 414 A 30 ARG HGy A 30 ARG HA 1.0 1.763 3.485 439 415 A 30 ARG HA A 30 ARG HGx 1.0 1.761 3.473 440 416 A 30 ARG HGy A 30 ARG HBy 1.0 2.000 5.000 441 417 A 30 ARG HGy A 30 ARG HBx 1.0 1.530 2.592 442 418 A 48 LEU HA A 48 LEU HG 1.0 1.817 3.761 443 419 A 34 GLY HAy A 30 ARG HGx 1.0 1.960 4.902 444 420 A 30 ARG HGy A 30 ARG HGx 1.0 1.380 2.164 445 421 A 30 ARG HGy A 37 VAL HG2% 1.0 1.615 3.875 446 422 A 32 THR HA A 32 THR HB 1.0 1.583 2.765 447 423 A 14 GLY HAy A 32 THR HA 1.0 1.859 4.011 448 424 A 17 ALA HA A 4 SER HBy 1.0 1.740 3.376 449 425 A 15 ILE HG1y A 32 THR HA 1.0 1.898 4.294 450 426 A 14 GLY HAy A 32 THR HB 1.0 1.947 4.755 451 427 A 96 VAL HGy% A 96 VAL HB 1.0 1.560 2.690 452 428 A 96 VAL HGy% A 93 ASN HBx 1.0 1.691 3.165 453 429 A 96 VAL HGy% A 99 ASN HBy 1.0 1.947 4.743 454 430 A 32 THR HG2% A 32 THR HA 1.0 1.514 2.540 455 431 A 13 SER HBx A 32 THR HG2% 1.0 1.723 3.299 456 432 A 32 THR HG2% A 32 THR HB 1.0 1.430 2.300 457 433 A 5 GLY HAy A 96 VAL HGy% 1.0 1.816 3.758 458 434 A 14 GLY HAy A 32 THR HG2% 1.0 1.711 3.249 459 435 A 13 SER HA A 32 THR HG2% 1.0 1.885 4.201 460 436 A 33 ASP HA A 33 ASP HBy 1.0 1.501 2.501 461 437 A 34 GLY HAy A 34 GLY HAx 1.0 1.515 2.547 462 438 A 30 ARG HGy A 34 GLY HAx 1.0 1.930 4.570 463 439 A 30 ARG HGy A 34 GLY HAy 1.0 1.900 4.310 464 440 A 37 VAL HG2% A 34 GLY HAx 1.0 1.993 5.547 465 441 A 35 ASP HA A 35 ASP HBy 1.0 1.589 2.787 466 442 A 35 ASP HA A 35 ASP HBx 1.0 2.000 5.000 467 443 A 36 LYS HBy A 36 LYS HA 1.0 1.697 3.189 468 444 A 36 LYS HA A 36 LYS HBx 1.0 1.718 3.278 469 445 A 36 LYS HBy A 31 SER HBy 1.0 1.881 4.169 470 446 A 31 SER HBx A 36 LYS HBx 1.0 1.796 3.648 471 447 A 36 LYS HBy A 31 SER HBx 1.0 1.842 3.906 472 448 A 36 LYS HEx A 36 LYS HBx 1.0 1.983 5.289 473 449 A 36 LYS HBy A 36 LYS HEx 1.0 1.980 5.214 474 450 A 36 LYS HBy A 29 TRP HZ3 1.0 1.818 3.772 475 451 A 29 TRP HH2 A 36 LYS HBy 1.0 1.913 4.413 476 452 A 29 TRP HH2 A 36 LYS HBx 1.0 1.880 4.162 477 453 A 29 TRP HZ3 A 36 LYS HBx 1.0 1.842 3.914 478 454 A 36 LYS HBy A 36 LYS HBx 1.0 1.569 2.717 479 455 A 36 LYS HBy A 36 LYS HGy 1.0 1.755 3.445 480 456 A 36 LYS HBy A 36 LYS HGx 1.0 1.767 3.501 481 457 A 36 LYS HD2 A 36 LYS HGx 1.0 1.609 2.853 482 458 A 36 LYS HBx A 36 LYS HGx 1.0 1.696 3.186 483 459 A 36 LYS HBx A 36 LYS HGy 1.0 1.666 3.064 484 460 A 36 LYS HGy A 36 LYS HGx 1.0 1.454 2.368 485 461 A 36 LYS HEx A 36 LYS HGx 1.0 1.822 3.792 486 462 A 31 SER HBx A 36 LYS HGy 1.0 1.959 4.895 487 463 A 31 SER HBx A 36 LYS HGx 1.0 1.979 5.197 488 464 A 36 LYS HA A 36 LYS HGy 1.0 1.776 3.546 489 465 A 29 TRP HZ3 A 36 LYS HGx 1.0 1.884 4.186 490 466 A 29 TRP HZ3 A 36 LYS HGy 1.0 1.922 4.504 491 467 A 29 TRP HH2 A 36 LYS HGy 1.0 1.996 5.660 492 468 A 29 TRP HH2 A 36 LYS HGx 1.0 1.983 5.279 493 469 A 31 SER HBy A 36 LYS HD3 1.0 1.910 4.390 494 469 A 36 LYS HD2 A 31 SER HBy 1.0 1.910 4.390 495 470 A 36 LYS HEx A 36 LYS HD2 1.0 2.000 5.000 496 471 A 12 VAL HB A 36 LYS HD2 1.0 1.856 4.000 497 472 A 36 LYS HBy A 36 LYS HD2 1.0 2.000 5.000 498 473 A 36 LYS HD2 A 36 LYS HBx 1.0 1.337 2.057 499 474 A 36 LYS HD2 A 36 LYS HGy 1.0 2.000 5.000 500 475 A 12 VAL HGy% A 36 LYS HD2 1.0 1.728 3.320 501 476 A 68 GLU HBy A 81 VAL HGy% 1.0 1.973 5.105 502 477 A 29 TRP HH2 A 36 LYS HD2 1.0 1.840 3.900 503 478 A 29 TRP HZ3 A 36 LYS HD2 1.0 1.843 3.915 504 479 A 36 LYS HEx A 36 LYS HGy 1.0 1.832 3.846 505 480 A 36 LYS HGy A 36 LYS HEy 1.0 1.851 3.967 506 481 A 36 LYS HGx A 36 LYS HEy 1.0 1.827 3.817 507 482 A 36 LYS HA A 36 LYS HEy 1.0 1.998 5.756 508 483 A 12 VAL HGy% A 36 LYS HEy 1.0 1.935 4.621 509 484 A 36 LYS HBx A 36 LYS HEy 1.0 1.816 3.760 510 485 A 36 LYS HA A 36 LYS HGx 1.0 1.763 3.483 511 486 A 36 LYS HD2 A 36 LYS HA 1.0 2.000 5.000 512 487 A 36 LYS HD2 A 36 LYS HEy 1.0 1.607 2.847 513 488 A 30 ARG HA A 37 VAL HA 1.0 1.620 2.894 514 489 A 29 TRP HZ3 A 37 VAL HA 1.0 1.956 4.848 515 490 A 29 TRP HE3 A 37 VAL HA 1.0 1.879 4.155 516 491 A 30 ARG HGy A 37 VAL HA 1.0 1.860 4.022 517 492 A 30 ARG HGx A 37 VAL HA 1.0 1.874 4.120 518 493 A 30 ARG HDx A 37 VAL HB 1.0 1.989 5.429 519 494 A 30 ARG HA A 37 VAL HB 1.0 1.866 4.062 520 495 A 37 VAL HA A 37 VAL HB 1.0 1.691 3.167 521 496 A 28 THR HG2% A 37 VAL HB 1.0 1.935 4.629 522 497 A 37 VAL HG2% A 37 VAL HA 1.0 1.613 2.867 523 498 A 37 VAL HG2% A 30 ARG HA 1.0 1.711 3.247 524 499 A 37 VAL HG2% A 37 VAL HB 1.0 1.429 3.299 525 500 A 37 VAL HG2% A 30 ARG HGx 1.0 1.646 3.988 526 501 A 38 HIS HA A 38 HIS HBy 1.0 1.661 3.047 527 502 A 29 TRP HBy A 38 HIS HA 1.0 1.967 5.005 528 503 A 38 HIS HA A 38 HIS HD2 1.0 1.964 4.972 529 504 A 9 PHE HEy A 38 HIS HA 1.0 1.977 5.175 530 504 A 9 PHE HEx A 38 HIS HA 1.0 1.977 5.175 531 505 A 37 VAL HG2% A 38 HIS HA 1.0 1.870 4.092 532 506 A 29 TRP HE3 A 38 HIS HA 1.0 1.947 4.747 533 507 A 38 HIS HBy A 38 HIS HD2 1.0 1.939 4.661 534 508 A 9 PHE HEy A 38 HIS HBy 1.0 1.951 4.799 535 508 A 9 PHE HEx A 38 HIS HBy 1.0 1.951 4.799 536 509 A 29 TRP HE3 A 38 HIS HBy 1.0 1.906 4.360 537 510 A 26 GLU HBx A 39 THR HG2% 1.0 1.684 3.134 538 511 A 39 THR HG2% A 41 VAL HB 1.0 2.000 5.000 539 512 A 26 GLU HGy A 39 THR HG2% 1.0 1.898 4.294 540 513 A 28 THR HB A 39 THR HG2% 1.0 2.000 5.000 541 514 A 39 THR HA A 39 THR HG2% 1.0 1.662 3.048 542 515 A 28 THR HA A 39 THR HG2% 1.0 1.790 3.620 543 516 A 39 THR HB A 39 THR HA 1.0 1.714 3.258 544 517 A 39 THR HB A 28 THR HA 1.0 2.000 5.000 545 518 A 39 THR HB A 39 THR HG2% 1.0 1.502 2.506 546 519 A 26 GLU HBy A 39 THR HB 1.0 1.995 5.591 547 520 A 39 THR HA A 28 THR HA 1.0 1.549 2.651 548 521 A 39 THR HA A 27 LEU HDx% 1.0 1.938 4.658 549 522 A 39 THR HA A 40 VAL HGy% 1.0 1.943 4.701 550 523 A 40 VAL HB A 40 VAL HA 1.0 1.814 3.746 551 524 A 40 VAL HA A 41 VAL HGy% 1.0 1.837 3.879 552 525 A 40 VAL HB A 42 LEU HDx% 1.0 2.000 5.000 553 526 A 42 LEU HDy% A 40 VAL HB 1.0 2.000 5.000 554 527 A 40 VAL HGx% A 40 VAL HB 1.0 1.568 2.714 555 528 A 40 VAL HGx% A 45 ILE HB 1.0 1.921 4.485 556 529 A 40 VAL HGx% A 27 LEU HBx 1.0 1.856 4.000 557 530 A 40 VAL HGx% A 45 ILE HD1% 1.0 1.547 2.647 558 531 A 40 VAL HGx% A 42 LEU HDx% 1.0 1.587 2.777 559 532 A 40 VAL HGx% A 40 VAL HGy% 1.0 1.464 2.396 560 533 A 40 VAL HGx% A 40 VAL HA 1.0 2.000 5.000 561 534 A 40 VAL HGx% A 45 ILE HA 1.0 1.979 5.201 562 535 A 40 VAL HGx% A 26 GLU HA 1.0 1.972 5.070 563 536 A 40 VAL HGx% A 87 HIS HD2 1.0 2.000 5.000 564 537 A 40 VAL HGy% A 42 LEU HDx% 1.0 2.000 5.000 565 538 A 62 LEU HDx% A 40 VAL HGy% 1.0 1.804 3.692 566 539 A 27 LEU HBx A 40 VAL HGy% 1.0 2.375 4.629 567 540 A 40 VAL HGy% A 27 LEU HBy 1.0 2.456 4.596 568 541 A 40 VAL HGy% A 40 VAL HB 1.0 1.617 2.881 569 542 A 40 VAL HGy% A 87 HIS HBy 1.0 1.880 4.162 570 543 A 40 VAL HGy% A 87 HIS HBx 1.0 1.942 4.688 571 544 A 40 VAL HGy% A 40 VAL HA 1.0 1.632 2.938 572 545 A 40 VAL HGy% A 38 HIS HD2 1.0 1.754 3.438 573 546 A 40 VAL HGy% A 89 PHE HZ 1.0 1.776 3.546 574 547 A 89 PHE HEx A 40 VAL HGy% 1.0 1.835 3.867 575 547 A 89 PHE HEy A 40 VAL HGy% 1.0 1.835 3.867 576 548 A 40 VAL HGy% A 87 HIS HE1 1.0 1.887 4.209 577 549 A 41 VAL HA A 41 VAL HGy% 1.0 1.582 2.760 578 550 A 26 GLU HGy A 41 VAL HGy% 1.0 1.800 3.668 579 551 A 41 VAL HB A 41 VAL HGy% 1.0 1.450 2.356 580 552 A 41 VAL HB A 44 THR HG2% 1.0 1.709 3.243 581 553 A 41 VAL HB A 44 THR HB 1.0 1.909 4.387 582 554 A 41 VAL HA A 41 VAL HB 1.0 1.735 3.355 583 555 A 41 VAL HA A 41 VAL HGx% 1.0 1.610 2.856 584 556 A 24 PRO HDx A 41 VAL HGx% 1.0 1.798 3.658 585 557 A 43 SER HBx A 41 VAL HGx% 1.0 1.946 4.742 586 558 A 26 GLU HGy A 41 VAL HGx% 1.0 1.882 4.174 587 559 A 24 PRO HBy A 41 VAL HGx% 1.0 1.732 3.342 588 560 A 41 VAL HB A 41 VAL HGx% 1.0 1.526 2.578 589 561 A 24 PRO HBx A 41 VAL HGx% 1.0 1.534 2.606 590 562 A 44 THR HG2% A 41 VAL HGx% 1.0 1.542 2.628 591 563 A 26 GLU HA A 41 VAL HGx% 1.0 1.892 4.250 592 564 A 24 PRO HA A 41 VAL HGx% 1.0 1.933 4.603 593 565 A 45 ILE HB A 42 LEU HA 1.0 1.877 4.141 594 566 A 42 LEU HBy A 42 LEU HA 1.0 1.782 3.576 595 567 A 42 LEU HA A 42 LEU HG 1.0 2.000 5.000 596 568 A 42 LEU HA A 42 LEU HBx 1.0 1.833 3.859 597 569 A 42 LEU HDy% A 42 LEU HA 1.0 1.819 3.779 598 570 A 42 LEU HA A 45 ILE HG2% 1.0 1.818 3.766 599 571 A 62 LEU HDx% A 42 LEU HA 1.0 1.892 4.252 600 572 A 45 ILE HG1y A 42 LEU HA 1.0 1.868 4.078 601 573 A 42 LEU HBy A 42 LEU HBx 1.0 1.763 3.483 602 574 A 42 LEU HBy A 42 LEU HG 1.0 1.809 3.719 603 575 A 42 LEU HG A 42 LEU HBx 1.0 1.843 3.917 604 576 A 42 LEU HBy A 107 ILE HG2% 1.0 1.840 3.900 605 577 A 111 TYR HEy A 42 LEU HBy 1.0 1.961 4.921 606 577 A 111 TYR HEx A 42 LEU HBy 1.0 1.961 4.921 607 578 A 111 TYR HEy A 42 LEU HBx 1.0 1.980 5.228 608 578 A 111 TYR HEx A 42 LEU HBx 1.0 1.980 5.228 609 579 A 42 LEU HBy A 108 ILE HG2% 1.0 1.973 5.101 610 580 A 42 LEU HDy% A 42 LEU HG 1.0 1.704 3.218 611 581 A 42 LEU HDx% A 42 LEU HBx 1.0 1.663 3.055 612 582 A 42 LEU HDx% A 42 LEU HG 1.0 1.553 2.663 613 583 A 42 LEU HBy A 42 LEU HDx% 1.0 2.000 5.000 614 584 A 42 LEU HDx% A 104 LEU HDy% 1.0 1.443 2.335 615 585 A 42 LEU HDx% A 45 ILE HG2% 1.0 1.591 2.793 616 586 A 45 ILE HG1y A 42 LEU HDx% 1.0 1.710 3.246 617 587 A 42 LEU HDx% A 45 ILE HB 1.0 1.859 4.019 618 588 A 42 LEU HDx% A 42 LEU HA 1.0 1.586 2.772 619 589 A 26 GLU HA A 42 LEU HDx% 1.0 1.858 4.008 620 590 A 44 THR HB A 65 LYS HBx 1.0 1.931 4.579 621 591 A 44 THR HB A 44 THR HA 1.0 1.576 2.742 622 592 A 44 THR HG2% A 44 THR HA 1.0 1.602 3.828 623 593 A 44 THR HA A 65 LYS HDy 1.0 1.868 4.080 624 594 A 44 THR HG2% A 44 THR HB 1.0 1.549 2.653 625 595 A 44 THR HG2% A 42 LEU HA 1.0 1.943 4.713 626 596 A 46 ASP HA A 46 ASP HBy 1.0 1.761 3.471 627 597 A 46 ASP HA A 46 ASP HBx 1.0 1.752 3.432 628 598 A 46 ASP HA A 65 LYS HGy 1.0 1.904 4.344 629 599 A 46 ASP HA A 65 LYS HGx 1.0 1.908 4.370 630 600 A 46 ASP HBy A 46 ASP HBx 1.0 1.575 2.739 631 601 A 46 ASP HBx A 65 LYS HGy 1.0 1.886 4.200 632 602 A 46 ASP HBy A 65 LYS HGy 1.0 1.883 4.181 633 603 A 46 ASP HBy A 65 LYS HGx 1.0 1.880 4.160 634 604 A 47 LYS HBy A 47 LYS HA 1.0 1.702 3.212 635 605 A 47 LYS HA A 47 LYS HBx 1.0 1.678 3.112 636 606 A 47 LYS HA A 108 ILE HD1% 1.0 1.842 3.906 637 607 A 40 VAL HGy% A 87 HIS HA 1.0 1.978 5.182 638 608 A 47 LYS HA A 47 LYS HGy 1.0 1.788 3.610 639 609 A 47 LYS HA A 47 LYS HGx 1.0 1.794 3.636 640 610 A 9 PHE HEy A 87 HIS HA 1.0 1.849 3.953 641 610 A 9 PHE HEx A 87 HIS HA 1.0 1.849 3.953 642 611 A 87 HIS HD2 A 87 HIS HA 1.0 1.899 4.307 643 612 A 47 LYS HBy A 47 LYS HEx 1.0 1.936 4.626 644 613 A 47 LYS HBy A 47 LYS HBx 1.0 1.483 2.451 645 614 A 47 LYS HBx A 47 LYS HGy 1.0 1.775 3.543 646 615 A 47 LYS HBy A 47 LYS HGy 1.0 1.760 3.468 647 616 A 47 LYS HBx A 47 LYS HGx 1.0 1.681 3.123 648 617 A 47 LYS HBy A 47 LYS HGx 1.0 1.762 3.478 649 618 A 47 LYS HGy A 47 LYS HGx 1.0 1.350 2.088 650 619 A 47 LYS HGy A 63 ILE HD1% 1.0 1.898 4.298 651 620 A 47 LYS HA A 47 LYS HEx 1.0 1.936 4.634 652 621 A 47 LYS HBx A 47 LYS HEx 1.0 1.443 2.337 653 622 A 47 LYS HEx A 47 LYS HDx 1.0 2.000 5.000 654 623 A 47 LYS HGx A 47 LYS HEx 1.0 2.000 5.000 655 624 A 47 LYS HGy A 47 LYS HEx 1.0 1.576 2.740 656 625 A 47 LYS HEx A 47 LYS HDy 1.0 1.522 2.566 657 626 A 47 LYS HA A 47 LYS HDy 1.0 1.945 4.729 658 627 A 47 LYS HA A 47 LYS HDx 1.0 2.000 5.000 659 628 A 48 LEU HBy A 48 LEU HBx 1.0 1.543 2.633 660 629 A 48 LEU HBx A 48 LEU HDy% 1.0 1.676 3.104 661 630 A 48 LEU HBx A 104 LEU HDx% 1.0 2.000 5.000 662 631 A 62 LEU HA A 48 LEU HDy% 1.0 2.000 5.000 663 632 A 48 LEU HDy% A 105 GLN HA 1.0 1.780 3.564 664 633 A 48 LEU HDy% A 101 LYS HA 1.0 1.805 3.697 665 634 A 48 LEU HDy% A 104 LEU HBy 1.0 1.702 3.210 666 635 A 48 LEU HDy% A 62 LEU HG 1.0 2.000 5.000 667 636 A 48 LEU HBy A 48 LEU HDy% 1.0 1.547 2.647 668 637 A 48 LEU HDy% A 104 LEU HDx% 1.0 1.420 2.272 669 638 A 48 LEU HDy% A 48 LEU HG 1.0 1.615 2.875 670 639 A 48 LEU HBx A 48 LEU HG 1.0 2.000 5.000 671 640 A 48 LEU HBy A 48 LEU HG 1.0 2.000 5.000 672 641 A 49 GLN HA A 49 GLN HBx 1.0 1.687 3.151 673 642 A 49 GLN HGx A 49 GLN HA 1.0 2.000 5.000 674 643 A 49 GLN HA A 49 GLN HGy 1.0 1.763 3.481 675 644 A 49 GLN HA A 61 ARG HBx 1.0 1.904 4.344 676 645 A 49 GLN HA A 50 ALA HB% 1.0 1.899 4.305 677 646 A 49 GLN HBx A 49 GLN HGy 1.0 1.684 3.138 678 647 A 49 GLN HGx A 49 GLN HBx 1.0 1.475 2.425 679 648 A 49 GLN HGx A 49 GLN HGy 1.0 1.616 2.880 680 649 A 63 ILE HD1% A 49 GLN HGy 1.0 1.965 4.981 681 650 A 63 ILE HG1x A 49 GLN HGy 1.0 1.967 5.011 682 651 A 49 GLN HGy A 61 ARG HBx 1.0 1.938 4.654 683 652 A 49 GLN HGx A 61 ARG HBx 1.0 1.938 4.656 684 653 A 50 ALA HA A 60 LEU HG 1.0 1.939 4.659 685 654 A 50 ALA HB% A 50 ALA HA 1.0 1.554 2.666 686 655 A 50 ALA HB% A 60 LEU HA 1.0 1.739 3.373 687 656 A 50 ALA HB% A 101 LYS HE2 1.0 1.759 3.461 688 657 A 50 ALA HB% A 97 MET HE% 1.0 2.000 5.000 689 658 A 50 ALA HB% A 97 MET HA 1.0 1.955 4.843 690 659 A 50 ALA HB% A 97 MET HBy 1.0 1.839 3.895 691 660 A 50 ALA HB% A 60 LEU HG 1.0 1.778 3.558 692 661 A 50 ALA HB% A 101 LYS HDy 1.0 1.659 3.039 693 662 A 60 LEU HDx% A 50 ALA HB% 1.0 1.659 3.035 694 663 A 50 ALA HB% A 101 LYS HDx 1.0 1.677 3.107 695 664 A 53 ALA HA A 53 ALA HB% 1.0 1.429 2.295 696 665 A 53 ALA HB% A 54 SER HBx 1.0 1.963 4.949 697 666 A 53 ALA HB% A 94 ARG HGx 1.0 1.736 3.358 698 667 A 53 ALA HB% A 94 ARG HGy 1.0 1.851 3.969 699 668 A 54 SER HA A 54 SER HBy 1.0 1.590 2.788 700 669 A 53 ALA HB% A 54 SER HA 1.0 1.898 4.292 701 670 A 54 SER HBx A 54 SER HA 1.0 1.625 2.911 702 671 A 54 SER HBx A 54 SER HBy 1.0 1.476 2.428 703 672 A 55 SER HA A 51 THR HB 1.0 2.000 5.000 704 673 A 55 SER HA A 55 SER HBy 1.0 1.657 3.029 705 674 A 55 SER HA A 55 SER HBx 1.0 1.610 2.856 706 675 A 55 SER HA A 52 PRO HBx 1.0 1.944 4.716 707 676 A 55 SER HA A 52 PRO HGy 1.0 1.949 4.777 708 677 A 55 SER HBy A 55 SER HBx 1.0 1.322 2.018 709 678 A 55 SER HBy A 52 PRO HDx 1.0 1.836 3.876 710 679 A 55 SER HBx A 52 PRO HDx 1.0 1.845 3.929 711 680 A 55 SER HBx A 52 PRO HBx 1.0 1.858 4.016 712 681 A 55 SER HBx A 52 PRO HGy 1.0 1.847 3.937 713 682 A 55 SER HBy A 51 THR HG2% 1.0 1.839 3.889 714 683 A 56 GLU HA A 56 GLU HBx 1.0 1.614 2.870 715 684 A 56 GLU HA A 56 GLU HGx 1.0 1.701 3.207 716 685 A 56 GLU HA A 56 GLU HBy 1.0 1.630 2.932 717 686 A 57 LYS HA A 56 GLU HBy 1.0 1.941 4.687 718 687 A 57 LYS HA A 56 GLU HBx 1.0 1.969 5.023 719 688 A 56 GLU HBx A 56 GLU HBy 1.0 1.377 2.157 720 689 A 56 GLU HGx A 56 GLU HGy 1.0 1.267 1.889 721 690 A 56 GLU HBx A 56 GLU HGy 1.0 2.000 5.000 722 691 A 56 GLU HBx A 56 GLU HGx 1.0 1.443 2.335 723 692 A 56 GLU HA A 56 GLU HGy 1.0 1.760 3.470 724 693 A 56 GLU HBy A 56 GLU HGy 1.0 1.583 2.765 725 694 A 56 GLU HGx A 56 GLU HBy 1.0 2.000 5.000 726 695 A 57 LYS HA A 57 LYS HGx 1.0 1.715 3.267 727 696 A 57 LYS HA A 58 MET HBx 1.0 2.000 5.000 728 697 A 57 LYS HA A 58 MET HG2 1.0 1.899 4.305 729 698 A 57 LYS HA A 57 LYS HE3 1.0 1.951 4.793 730 698 A 57 LYS HA A 57 LYS HE2 1.0 1.951 4.793 731 699 A 59 MET HA A 59 MET HBy 1.0 1.837 3.879 732 700 A 90 SER HBx A 59 MET HA 1.0 1.973 5.109 733 701 A 59 MET HA A 90 SER HBy 1.0 1.938 4.652 734 702 A 91 PHE HEy A 59 MET HA 1.0 1.987 5.373 735 702 A 91 PHE HEx A 59 MET HA 1.0 1.987 5.373 736 703 A 91 PHE HDy A 59 MET HA 1.0 1.891 4.241 737 703 A 91 PHE HDx A 59 MET HA 1.0 1.891 4.241 738 704 A 59 MET HA A 59 MET HBx 1.0 1.813 3.739 739 705 A 59 MET HBy A 59 MET HGx 1.0 1.780 3.568 740 706 A 59 MET HBy A 59 MET HBx 1.0 1.648 2.994 741 707 A 59 MET HA A 59 MET HGy 1.0 1.731 3.333 742 708 A 59 MET HA A 59 MET HGx 1.0 1.768 3.508 743 709 A 91 PHE HDy A 59 MET HGx 1.0 1.928 5.560 744 709 A 91 PHE HDx A 59 MET HGx 1.0 1.928 5.560 745 710 A 59 MET HGx A 59 MET HGy 1.0 1.533 2.601 746 711 A 59 MET HBx A 59 MET HGy 1.0 1.537 2.615 747 712 A 59 MET HBy A 59 MET HGy 1.0 1.757 3.457 748 713 A 51 THR HG2% A 59 MET HGx 1.0 1.817 3.761 749 714 A 59 MET HA A 59 MET HE% 1.0 2.000 5.000 750 715 A 59 MET HGy A 59 MET HE% 1.0 1.695 3.183 751 716 A 59 MET HGx A 59 MET HE% 1.0 2.000 5.000 752 717 A 59 MET HBx A 59 MET HE% 1.0 1.716 3.268 753 718 A 57 LYS HBx A 59 MET HE% 1.0 1.684 3.136 754 719 A 59 MET HE% A 61 ARG HGx 1.0 1.957 4.877 755 720 A 51 THR HG2% A 59 MET HE% 1.0 1.594 2.800 756 721 A 60 LEU HA A 60 LEU HBy 1.0 1.756 3.450 757 722 A 60 LEU HA A 60 LEU HBx 1.0 1.779 3.561 758 723 A 60 LEU HDx% A 60 LEU HA 1.0 1.808 3.718 759 724 A 60 LEU HA A 51 THR HG2% 1.0 1.966 4.994 760 725 A 60 LEU HA A 97 MET HE% 1.0 1.929 4.563 761 726 A 50 ALA HA A 60 LEU HA 1.0 1.684 3.134 762 727 A 60 LEU HBy A 60 LEU HBx 1.0 1.575 2.737 763 728 A 97 MET HE% A 60 LEU HBy 1.0 2.000 5.000 764 729 A 97 MET HE% A 60 LEU HBx 1.0 1.931 4.581 765 730 A 89 PHE HBx A 60 LEU HBx 1.0 1.978 5.184 766 731 A 50 ALA HA A 60 LEU HBy 1.0 1.975 5.141 767 732 A 50 ALA HA A 60 LEU HBx 1.0 1.973 5.091 768 733 A 91 PHE HEy A 60 LEU HBx 1.0 1.887 4.217 769 733 A 91 PHE HEx A 60 LEU HBx 1.0 1.887 4.217 770 734 A 91 PHE HEy A 60 LEU HBy 1.0 1.876 4.132 771 734 A 91 PHE HEx A 60 LEU HBy 1.0 1.876 4.132 772 735 A 60 LEU HA A 60 LEU HDy% 1.0 1.614 2.874 773 736 A 50 ALA HA A 60 LEU HDy% 1.0 2.000 5.000 774 737 A 91 PHE HEy A 60 LEU HDy% 1.0 1.870 4.090 775 737 A 91 PHE HEx A 60 LEU HDy% 1.0 1.870 4.090 776 738 A 89 PHE HDy A 60 LEU HDy% 1.0 1.813 3.741 777 738 A 89 PHE HDx A 60 LEU HDy% 1.0 1.813 3.741 778 739 A 91 PHE HZ A 60 LEU HDy% 1.0 2.000 5.000 779 740 A 89 PHE HEx A 60 LEU HDy% 1.0 1.778 3.558 780 740 A 89 PHE HEy A 60 LEU HDy% 1.0 1.778 3.558 781 741 A 60 LEU HDy% A 98 ASP HA 1.0 1.985 5.303 782 742 A 101 LYS HA A 60 LEU HDy% 1.0 1.816 3.758 783 743 A 62 LEU HDx% A 87 HIS HBx 1.0 1.887 4.209 784 744 A 97 MET HA A 60 LEU HDy% 1.0 1.898 4.292 785 745 A 89 PHE HBx A 60 LEU HDy% 1.0 1.925 4.529 786 746 A 97 MET HE% A 60 LEU HDy% 1.0 2.000 5.000 787 747 A 62 LEU HDx% A 62 LEU HBy 1.0 1.647 2.989 788 748 A 60 LEU HG A 60 LEU HDy% 1.0 1.495 2.487 789 749 A 60 LEU HBy A 60 LEU HDy% 1.0 1.527 2.585 790 750 A 60 LEU HBx A 60 LEU HDy% 1.0 2.000 5.000 791 751 A 101 LYS HDx A 60 LEU HDy% 1.0 1.691 3.165 792 752 A 50 ALA HB% A 60 LEU HDy% 1.0 2.000 5.000 793 753 A 62 LEU HDx% A 62 LEU HDy% 1.0 1.347 2.081 794 754 A 60 LEU HDy% A 100 ILE HG2% 1.0 2.000 5.000 795 755 A 60 LEU HDx% A 50 ALA HA 1.0 1.947 4.745 796 756 A 91 PHE HZ A 60 LEU HDx% 1.0 1.785 3.595 797 757 A 91 PHE HEx A 60 LEU HDx% 1.0 1.767 3.501 798 757 A 91 PHE HEy A 60 LEU HDx% 1.0 1.767 3.501 799 758 A 60 LEU HDx% A 101 LYS HA 1.0 2.000 5.000 800 759 A 60 LEU HDx% A 101 LYS HE2 1.0 1.963 4.945 801 760 A 60 LEU HDx% A 89 PHE HBx 1.0 1.945 4.725 802 761 A 60 LEU HDx% A 97 MET HA 1.0 1.873 4.115 803 762 A 60 LEU HDx% A 97 MET HE% 1.0 2.000 5.000 804 763 A 60 LEU HDx% A 60 LEU HBy 1.0 1.541 2.625 805 764 A 60 LEU HDx% A 60 LEU HBx 1.0 1.659 3.035 806 765 A 60 LEU HDx% A 100 ILE HG1x 1.0 1.750 4.422 807 766 A 60 LEU HDx% A 60 LEU HDy% 1.0 1.405 2.233 808 767 A 60 LEU HG A 60 LEU HA 1.0 1.918 4.456 809 768 A 91 PHE HEy A 60 LEU HG 1.0 2.000 5.000 810 768 A 91 PHE HEx A 60 LEU HG 1.0 2.000 5.000 811 769 A 91 PHE HZ A 60 LEU HG 1.0 1.976 5.132 812 770 A 91 PHE HDy A 60 LEU HG 1.0 1.979 5.205 813 770 A 91 PHE HDx A 60 LEU HG 1.0 1.979 5.205 814 771 A 60 LEU HG A 60 LEU HBx 1.0 1.709 3.241 815 772 A 60 LEU HDx% A 60 LEU HG 1.0 1.744 3.394 816 773 A 61 ARG HA A 61 ARG HDx 1.0 1.971 5.065 817 774 A 61 ARG HA A 61 ARG HDy 1.0 1.975 5.131 818 775 A 61 ARG HA A 88 MET HE% 1.0 2.000 5.000 819 776 A 61 ARG HBx A 61 ARG HA 1.0 1.802 3.678 820 777 A 61 ARG HA A 61 ARG HBy 1.0 1.772 3.526 821 778 A 61 ARG HGx A 61 ARG HA 1.0 1.843 3.913 822 779 A 61 ARG HBy A 88 MET HA 1.0 1.982 5.258 823 780 A 61 ARG HBx A 88 MET HA 1.0 1.942 4.694 824 781 A 61 ARG HBy A 88 MET HGx 1.0 1.964 4.966 825 782 A 88 MET HE% A 61 ARG HBy 1.0 2.000 5.000 826 783 A 61 ARG HBx A 88 MET HGx 1.0 2.000 5.000 827 784 A 61 ARG HBx A 61 ARG HBy 1.0 1.698 3.192 828 785 A 61 ARG HBx A 61 ARG HGx 1.0 1.811 3.729 829 786 A 61 ARG HGx A 61 ARG HBy 1.0 1.831 3.845 830 787 A 61 ARG HDx A 61 ARG HDy 1.0 1.696 3.186 831 788 A 61 ARG HBx A 61 ARG HDy 1.0 1.892 4.252 832 789 A 61 ARG HBx A 61 ARG HDx 1.0 1.873 4.115 833 790 A 61 ARG HDy A 61 ARG HBy 1.0 1.825 3.809 834 791 A 61 ARG HDx A 61 ARG HBy 1.0 1.821 3.785 835 792 A 61 ARG HDy A 61 ARG HGy 1.0 1.790 3.618 836 793 A 61 ARG HGx A 61 ARG HDy 1.0 1.827 3.817 837 794 A 61 ARG HGx A 61 ARG HDx 1.0 1.818 3.770 838 795 A 61 ARG HDx A 61 ARG HGy 1.0 1.782 3.576 839 796 A 88 MET HA A 61 ARG HGy 1.0 1.954 4.828 840 797 A 61 ARG HA A 61 ARG HGy 1.0 1.794 3.636 841 798 A 61 ARG HBx A 61 ARG HGy 1.0 1.767 3.503 842 799 A 61 ARG HBy A 61 ARG HGy 1.0 1.824 3.804 843 800 A 62 LEU HA A 62 LEU HBy 1.0 1.821 3.783 844 801 A 62 LEU HA A 62 LEU HBx 1.0 1.766 3.494 845 802 A 62 LEU HA A 62 LEU HDx% 1.0 1.833 3.851 846 803 A 62 LEU HA A 62 LEU HDy% 1.0 1.695 3.183 847 804 A 87 HIS HD2 A 62 LEU HBy 1.0 1.928 4.558 848 805 A 89 PHE HEy A 62 LEU HBx 1.0 1.958 4.880 849 805 A 89 PHE HEx A 62 LEU HBx 1.0 1.958 4.880 850 806 A 62 LEU HBy A 62 LEU HBx 1.0 1.806 3.698 851 807 A 62 LEU HBy A 62 LEU HDy% 1.0 1.820 3.782 852 808 A 45 ILE HD1% A 62 LEU HBx 1.0 1.877 4.137 853 809 A 48 LEU HA A 62 LEU HDy% 1.0 1.817 3.763 854 810 A 101 LYS HA A 62 LEU HDy% 1.0 1.775 5.059 855 811 A 104 LEU HBy A 62 LEU HDy% 1.0 1.702 4.208 856 812 A 62 LEU HDy% A 62 LEU HBx 1.0 1.597 2.813 857 813 A 50 ALA HB% A 62 LEU HDy% 1.0 2.000 5.000 858 814 A 62 LEU HDy% A 104 LEU HBx 1.0 2.000 5.000 859 815 A 104 LEU HDy% A 62 LEU HDy% 1.0 1.601 2.825 860 816 A 62 LEU HDx% A 62 LEU HG 1.0 1.521 2.563 861 817 A 62 LEU HDx% A 62 LEU HBx 1.0 2.000 5.000 862 818 A 62 LEU HA A 62 LEU HG 1.0 2.000 5.000 863 819 A 62 LEU HG A 62 LEU HBy 1.0 1.649 2.997 864 820 A 62 LEU HG A 62 LEU HDy% 1.0 1.587 2.777 865 821 A 104 LEU HDy% A 62 LEU HG 1.0 1.804 3.690 866 822 A 62 LEU HG A 62 LEU HBx 1.0 1.719 3.279 867 823 A 89 PHE HEy A 62 LEU HG 1.0 1.945 4.733 868 823 A 89 PHE HEx A 62 LEU HG 1.0 1.945 4.733 869 824 A 63 ILE HB A 63 ILE HG1x 1.0 1.718 3.278 870 825 A 84 PRO HDx A 63 ILE HG2% 1.0 1.994 5.564 871 826 A 63 ILE HG2% A 86 ARG HD2 1.0 1.918 4.464 872 827 A 46 ASP HBy A 63 ILE HG2% 1.0 1.898 4.300 873 828 A 46 ASP HBx A 63 ILE HG2% 1.0 1.914 4.426 874 829 A 63 ILE HG2% A 84 PRO HBy 1.0 1.794 3.636 875 830 A 63 ILE HB A 63 ILE HG2% 1.0 1.500 2.502 876 831 A 47 LYS HBy A 63 ILE HG2% 1.0 1.670 3.082 877 832 A 47 LYS HBx A 63 ILE HG2% 1.0 2.000 5.000 878 833 A 47 LYS HDx A 63 ILE HG2% 1.0 2.000 5.000 879 834 A 63 ILE HG1x A 63 ILE HG2% 1.0 1.621 2.899 880 835 A 63 ILE HD1% A 63 ILE HG2% 1.0 2.000 5.000 881 836 A 63 ILE HD1% A 86 ARG HA 1.0 1.852 3.972 882 837 A 47 LYS HA A 63 ILE HD1% 1.0 1.972 5.068 883 838 A 63 ILE HA A 63 ILE HD1% 1.0 1.676 3.102 884 839 A 63 ILE HD1% A 86 ARG HD2 1.0 1.731 3.337 885 840 A 47 LYS HEx A 63 ILE HD1% 1.0 2.000 5.000 886 841 A 49 GLN HGx A 63 ILE HD1% 1.0 1.766 3.498 887 842 A 63 ILE HB A 63 ILE HD1% 1.0 1.615 2.877 888 843 A 47 LYS HBy A 63 ILE HD1% 1.0 1.762 3.478 889 844 A 47 LYS HBx A 63 ILE HD1% 1.0 2.000 5.000 890 845 A 48 LEU HG A 63 ILE HD1% 1.0 2.000 5.000 891 846 A 63 ILE HD1% A 86 ARG HBy 1.0 2.000 5.000 892 847 A 63 ILE HG1x A 63 ILE HD1% 1.0 1.524 2.576 893 848 A 63 ILE HG1y A 63 ILE HD1% 1.0 1.420 2.274 894 849 A 63 ILE HG1x A 63 ILE HG1y 1.0 1.417 2.263 895 850 A 64 GLY HAx A 64 GLY HAy 1.0 1.636 2.950 896 851 A 45 ILE HA A 64 GLY HAx 1.0 2.000 5.000 897 852 A 65 LYS HBx A 65 LYS HBy 1.0 1.572 2.730 898 853 A 65 LYS HGy A 65 LYS HBy 1.0 1.779 3.563 899 854 A 65 LYS HBx A 65 LYS HGx 1.0 1.788 3.608 900 855 A 65 LYS HBx A 65 LYS HGy 1.0 1.751 3.427 901 856 A 65 LYS HBx A 44 THR HA 1.0 1.970 5.052 902 857 A 46 ASP HA A 65 LYS HA 1.0 2.000 5.000 903 858 A 46 ASP HBy A 65 LYS HA 1.0 1.743 3.389 904 859 A 46 ASP HBx A 65 LYS HA 1.0 1.713 3.257 905 860 A 65 LYS HBy A 65 LYS HA 1.0 1.702 3.208 906 861 A 65 LYS HDy A 65 LYS HA 1.0 2.000 5.000 907 862 A 65 LYS HBx A 65 LYS HA 1.0 1.721 3.291 908 863 A 65 LYS HGy A 65 LYS HA 1.0 1.744 3.392 909 864 A 65 LYS HGx A 65 LYS HA 1.0 1.780 3.566 910 865 A 65 LYS HEy A 65 LYS HEx 1.0 1.320 2.016 911 866 A 65 LYS HA A 65 LYS HEx 1.0 2.000 5.000 912 867 A 65 LYS HA A 65 LYS HEy 1.0 2.000 5.000 913 868 A 44 THR HA A 65 LYS HEy 1.0 1.947 4.757 914 869 A 44 THR HA A 65 LYS HEx 1.0 2.000 5.000 915 870 A 46 ASP HA A 65 LYS HEx 1.0 1.838 3.886 916 871 A 46 ASP HA A 65 LYS HEy 1.0 1.843 3.911 917 872 A 65 LYS HBy A 65 LYS HEy 1.0 2.000 5.000 918 873 A 65 LYS HBy A 65 LYS HEx 1.0 1.902 4.334 919 874 A 65 LYS HBx A 65 LYS HEx 1.0 2.000 5.000 920 875 A 65 LYS HBx A 65 LYS HEy 1.0 2.000 5.000 921 876 A 65 LYS HGx A 65 LYS HEx 1.0 1.739 3.369 922 877 A 65 LYS HGy A 65 LYS HEx 1.0 1.695 3.183 923 878 A 65 LYS HDy A 65 LYS HEx 1.0 1.693 3.171 924 879 A 46 ASP HBx A 65 LYS HEy 1.0 1.943 4.713 925 880 A 46 ASP HBx A 65 LYS HEx 1.0 1.916 4.444 926 881 A 46 ASP HBy A 65 LYS HEy 1.0 1.961 4.925 927 882 A 65 LYS HEx A 111 TYR HBx 1.0 2.000 5.000 928 883 A 65 LYS HA A 65 LYS HDx 1.0 1.900 4.312 929 884 A 44 THR HA A 65 LYS HDx 1.0 1.853 3.977 930 885 A 44 THR HB A 65 LYS HDx 1.0 2.000 5.000 931 886 A 44 THR HB A 65 LYS HDy 1.0 1.961 4.929 932 887 A 65 LYS HDy A 65 LYS HEy 1.0 1.770 3.514 933 888 A 65 LYS HEx A 65 LYS HDx 1.0 1.673 3.089 934 889 A 65 LYS HEy A 65 LYS HDx 1.0 1.656 3.026 935 890 A 65 LYS HDy A 65 LYS HDx 1.0 1.324 2.026 936 891 A 65 LYS HDy A 65 LYS HGx 1.0 1.722 3.296 937 892 A 65 LYS HGx A 65 LYS HDx 1.0 1.672 3.088 938 893 A 65 LYS HGx A 65 LYS HEy 1.0 1.868 4.074 939 894 A 65 LYS HGy A 65 LYS HEy 1.0 1.857 4.009 940 895 A 46 ASP HBx A 65 LYS HGx 1.0 1.885 4.197 941 896 A 65 LYS HGx A 65 LYS HBy 1.0 1.829 3.831 942 897 A 65 LYS HGy A 65 LYS HGx 1.0 1.642 2.970 943 898 A 65 LYS HDy A 65 LYS HGy 1.0 1.745 3.399 944 899 A 65 LYS HGy A 65 LYS HDx 1.0 1.568 2.712 945 900 A 65 LYS HDy A 65 LYS HBy 1.0 1.732 3.342 946 901 A 65 LYS HBx A 65 LYS HDy 1.0 1.694 3.180 947 902 A 84 PRO HBy A 66 VAL HA 1.0 2.000 5.000 948 903 A 66 VAL HA A 66 VAL HB 1.0 1.648 2.994 949 904 A 66 VAL HA A 66 VAL HGy% 1.0 1.599 2.821 950 905 A 66 VAL HA A 67 ASP HA 1.0 1.959 4.901 951 906 A 80 VAL HB A 73 LYS HA 1.0 2.000 5.000 952 907 A 66 VAL HB A 68 GLU HGy 1.0 1.851 3.965 953 908 A 66 VAL HB A 66 VAL HGy% 1.0 1.469 2.407 954 909 A 66 VAL HA A 66 VAL HGx% 1.0 1.629 2.923 955 910 A 66 VAL HGx% A 82 PRO HDx 1.0 1.912 4.408 956 911 A 84 PRO HBy A 66 VAL HGy% 1.0 1.805 3.697 957 912 A 66 VAL HB A 66 VAL HGx% 1.0 1.440 2.328 958 913 A 66 VAL HGx% A 84 PRO HA 1.0 1.773 3.533 959 914 A 66 VAL HGx% A 84 PRO HDy 1.0 1.871 4.095 960 915 A 67 ASP HA A 67 ASP HBy 1.0 1.670 3.082 961 916 A 67 ASP HA A 67 ASP HBx 1.0 1.648 2.998 962 917 A 66 VAL HGy% A 67 ASP HA 1.0 1.928 4.552 963 917 A 67 ASP HA A 66 VAL HGx% 1.0 1.928 4.552 964 918 A 67 ASP HBy A 67 ASP HBx 1.0 1.440 2.326 965 919 A 67 ASP HBx A 70 LYS HGy 1.0 1.982 5.266 966 920 A 67 ASP HBx A 70 LYS HBy 1.0 1.983 5.277 967 921 A 68 GLU HA A 69 SER HA 1.0 2.000 5.000 968 922 A 68 GLU HA A 68 GLU HBx 1.0 1.628 2.920 969 923 A 68 GLU HBy A 68 GLU HA 1.0 1.666 3.066 970 924 A 70 LYS HGy A 68 GLU HA 1.0 1.781 3.876 971 925 A 81 VAL HGy% A 68 GLU HA 1.0 1.817 3.765 972 926 A 68 GLU HGy A 68 GLU HA 1.0 1.786 3.596 973 927 A 68 GLU HGy A 68 GLU HGx 1.0 1.268 1.892 974 928 A 68 GLU HGy A 68 GLU HBx 1.0 2.000 5.000 975 929 A 68 GLU HBx A 68 GLU HGx 1.0 2.000 5.000 976 930 A 68 GLU HBy A 68 GLU HGy 1.0 1.577 2.745 977 931 A 68 GLU HA A 68 GLU HGx 1.0 1.667 3.067 978 932 A 68 GLU HBy A 68 GLU HGx 1.0 2.000 5.000 979 933 A 68 GLU HBy A 68 GLU HBx 1.0 1.342 2.068 980 934 A 69 SER HA A 69 SER HBy 1.0 1.485 2.455 981 935 A 69 SER HA A 69 SER HBx 1.0 1.518 2.554 982 936 A 70 LYS HBy A 70 LYS HA 1.0 1.607 2.847 983 937 A 70 LYS HA A 70 LYS HBx 1.0 1.664 3.056 984 938 A 70 LYS HA A 70 LYS HDx 1.0 2.000 5.000 985 939 A 70 LYS HA A 70 LYS HGx 1.0 2.000 5.000 986 940 A 70 LYS HBy A 70 LYS HBx 1.0 1.320 2.016 987 941 A 70 LYS HGy A 70 LYS HBy 1.0 1.756 3.452 988 942 A 70 LYS HGy A 70 LYS HBx 1.0 1.676 3.106 989 943 A 70 LYS HGy A 70 LYS HA 1.0 2.000 5.000 990 944 A 70 LYS HBy A 70 LYS HGx 1.0 1.665 3.063 991 945 A 70 LYS HBx A 70 LYS HGx 1.0 1.488 2.466 992 946 A 70 LYS HDx A 70 LYS HGx 1.0 2.000 5.000 993 947 A 67 ASP HBx A 70 LYS HGx 1.0 1.972 5.084 994 948 A 70 LYS HGx A 82 PRO HBy 1.0 1.936 4.630 995 949 A 67 ASP HBy A 70 LYS HGx 1.0 1.952 4.810 996 950 A 70 LYS HA A 70 LYS HE2 1.0 1.932 4.600 997 951 A 83 LYS HE2 A 83 LYS HA 1.0 1.954 4.840 998 952 A 70 LYS HBy A 70 LYS HE2 1.0 1.846 3.932 999 953 A 70 LYS HDx A 70 LYS HE2 1.0 2.000 5.000 1000 954 A 70 LYS HBx A 70 LYS HE2 1.0 1.664 3.060 1001 955 A 70 LYS HGx A 70 LYS HE2 1.0 2.000 5.000 1002 956 A 70 LYS HBy A 70 LYS HDx 1.0 1.607 2.849 1003 957 A 70 LYS HBx A 70 LYS HDx 1.0 2.000 5.000 1004 958 A 71 LYS HA A 82 PRO HDy 1.0 1.809 3.719 1005 959 A 82 PRO HDx A 71 LYS HA 1.0 1.884 4.186 1006 960 A 71 LYS HA A 71 LYS HGy 1.0 1.825 3.805 1007 961 A 71 LYS HA A 81 VAL HGx% 1.0 1.866 5.066 1008 962 A 71 LYS HA A 71 LYS HBy 1.0 1.717 3.275 1009 963 A 71 LYS HGx A 71 LYS HE3 1.0 1.686 3.144 1010 963 A 71 LYS HGx A 71 LYS HE2 1.0 1.686 3.144 1011 964 A 71 LYS HA A 71 LYS HGx 1.0 1.725 3.309 1012 965 A 71 LYS HGy A 71 LYS HBy 1.0 1.527 2.581 1013 966 A 71 LYS HBy A 71 LYS HGx 1.0 1.632 2.936 1014 967 A 71 LYS HGy A 71 LYS HGx 1.0 1.205 1.751 1015 968 A 71 LYS HA A 71 LYS HD2 1.0 1.769 3.511 1016 969 A 82 PRO HDx A 70 LYS HDy 1.0 1.918 4.456 1017 970 A 71 LYS HBy A 71 LYS HD2 1.0 1.380 2.168 1018 971 A 71 LYS HGy A 71 LYS HD2 1.0 2.000 5.000 1019 972 A 71 LYS HGx A 71 LYS HD2 1.0 2.000 5.000 1020 973 A 71 LYS HA A 71 LYS HE2 1.0 1.957 4.869 1021 974 A 71 LYS HGy A 71 LYS HE2 1.0 1.606 2.842 1022 975 A 71 LYS HGx A 71 LYS HE2 1.0 1.730 3.330 1023 976 A 71 LYS HE2 A 71 LYS HD2 1.0 2.000 5.000 1024 977 A 71 LYS HBy A 71 LYS HE2 1.0 1.783 3.583 1025 978 A 73 LYS HA A 72 ARG HA 1.0 1.934 4.616 1026 979 A 72 ARG HA A 72 ARG HBx 1.0 1.638 2.962 1027 980 A 72 ARG HA A 72 ARG HBy 1.0 1.674 3.098 1028 981 A 72 ARG HA A 72 ARG HGy 1.0 1.727 3.319 1029 982 A 72 ARG HA A 80 VAL HGy% 1.0 1.962 4.936 1030 983 A 72 ARG HBx A 72 ARG HGx 1.0 1.558 2.682 1031 984 A 72 ARG HBx A 80 VAL HGy% 1.0 1.818 3.768 1032 985 A 72 ARG HBx A 72 ARG HBy 1.0 1.303 1.973 1033 986 A 72 ARG HA A 72 ARG HGx 1.0 1.804 3.690 1034 987 A 72 ARG HBy A 72 ARG HGx 1.0 2.000 5.000 1035 988 A 72 ARG HA A 72 ARG HD2 1.0 2.000 5.000 1036 989 A 80 VAL HB A 72 ARG HD3 1.0 1.915 4.435 1037 989 A 80 VAL HB A 72 ARG HD2 1.0 1.915 4.435 1038 990 A 72 ARG HBx A 72 ARG HD2 1.0 1.709 3.239 1039 991 A 72 ARG HBy A 72 ARG HD2 1.0 1.704 3.218 1040 992 A 72 ARG HGx A 72 ARG HD2 1.0 1.541 2.627 1041 993 A 80 VAL HGy% A 72 ARG HD2 1.0 1.893 4.257 1042 994 A 73 LYS HA A 73 LYS HB2 1.0 1.616 2.880 1043 995 A 73 LYS HA A 74 ASP HBx 1.0 1.998 5.758 1044 996 A 73 LYS HA A 79 GLU HBy 1.0 2.000 5.000 1045 996 A 73 LYS HA A 79 GLU HBx 1.0 2.000 5.000 1046 997 A 73 LYS HA A 73 LYS HGx 1.0 1.786 3.598 1047 998 A 73 LYS HA A 80 VAL HGy% 1.0 1.851 3.967 1048 999 A 73 LYS HB2 A 73 LYS HE2 1.0 1.944 4.726 1049 1000 A 73 LYS HGx A 73 LYS HD2 1.0 2.000 5.000 1050 1001 A 73 LYS HD2 A 73 LYS HGy 1.0 1.473 2.419 1051 1002 A 73 LYS HB2 A 73 LYS HD2 1.0 2.000 5.000 1052 1003 A 73 LYS HD2 A 77 GLY HAy 1.0 1.964 4.954 1053 1004 A 73 LYS HA A 73 LYS HD2 1.0 1.931 4.587 1054 1005 A 73 LYS HA A 73 LYS HGy 1.0 1.837 3.875 1055 1006 A 73 LYS HGx A 73 LYS HE2 1.0 1.838 3.886 1056 1007 A 73 LYS HB2 A 73 LYS HGx 1.0 1.644 2.980 1057 1008 A 73 LYS HGx A 73 LYS HGy 1.0 1.346 2.078 1058 1009 A 73 LYS HB2 A 73 LYS HGy 1.0 1.606 2.842 1059 1010 A 73 LYS HA A 73 LYS HE2 1.0 1.950 4.778 1060 1011 A 74 ASP HA A 74 ASP HBy 1.0 1.553 2.663 1061 1012 A 74 ASP HBx A 74 ASP HA 1.0 1.569 2.719 1062 1013 A 80 VAL HGy% A 74 ASP HA 1.0 1.864 4.050 1063 1014 A 74 ASP HBx A 74 ASP HBy 1.0 1.420 2.272 1064 1015 A 75 ASN HA A 75 ASN HBx 1.0 1.524 2.574 1065 1016 A 76 GLU HA A 76 GLU HBx 1.0 1.524 2.574 1066 1017 A 76 GLU HA A 76 GLU HBy 1.0 1.707 3.229 1067 1018 A 75 ASN HBx A 76 GLU HA 1.0 1.956 4.850 1068 1019 A 76 GLU HBx A 76 GLU HBy 1.0 1.324 2.024 1069 1020 A 76 GLU HA A 76 GLU HGx 1.0 1.633 2.939 1070 1021 A 76 GLU HBy A 76 GLU HGx 1.0 2.000 5.000 1071 1022 A 75 ASN HBx A 76 GLU HGx 1.0 1.912 4.408 1072 1023 A 77 GLY HAy A 77 GLY HAx 1.0 1.368 2.136 1073 1024 A 73 LYS HB2 A 77 GLY HAy 1.0 1.850 3.962 1074 1025 A 77 GLY HAy A 73 LYS HD3 1.0 1.889 4.227 1075 1025 A 73 LYS HD2 A 77 GLY HAy 1.0 1.889 4.227 1076 1026 A 77 GLY HAx A 73 LYS HD3 1.0 1.842 3.910 1077 1026 A 73 LYS HD2 A 77 GLY HAx 1.0 1.842 3.910 1078 1027 A 73 LYS HB2 A 77 GLY HAx 1.0 1.774 3.536 1079 1028 A 73 LYS HGx A 77 GLY HAx 1.0 1.968 5.018 1080 1029 A 78 ASN HA A 78 ASN HBy 1.0 1.692 3.168 1081 1030 A 78 ASN HA A 78 ASN HBx 1.0 1.595 2.805 1082 1031 A 79 GLU HBy A 78 ASN HA 1.0 1.924 4.518 1083 1031 A 79 GLU HBx A 78 ASN HA 1.0 1.924 4.518 1084 1032 A 78 ASN HBy A 78 ASN HBx 1.0 1.382 2.170 1085 1033 A 78 ASN HBy A 80 VAL HGx% 1.0 1.927 4.547 1086 1034 A 78 ASN HBx A 80 VAL HGx% 1.0 1.948 4.756 1087 1035 A 78 ASN HA A 79 GLU HA 1.0 1.897 4.293 1088 1036 A 73 LYS HA A 79 GLU HA 1.0 1.605 2.841 1089 1037 A 79 GLU HA A 79 GLU HGy 1.0 1.812 3.736 1090 1038 A 79 GLU HA A 79 GLU HGx 1.0 1.776 3.550 1091 1039 A 79 GLU HBx A 79 GLU HA 1.0 1.575 2.737 1092 1040 A 71 LYS HBy A 79 GLU HA 1.0 2.000 5.000 1093 1041 A 73 LYS HD3 A 79 GLU HA 1.0 1.880 4.164 1094 1041 A 73 LYS HD2 A 79 GLU HA 1.0 1.880 4.164 1095 1042 A 73 LYS HGy A 79 GLU HA 1.0 1.890 4.232 1096 1043 A 73 LYS HGx A 79 GLU HA 1.0 1.796 3.652 1097 1044 A 79 GLU HBy A 80 VAL HA 1.0 1.974 5.110 1098 1044 A 79 GLU HBx A 80 VAL HA 1.0 1.974 5.110 1099 1045 A 71 LYS HE3 A 79 GLU HBx 1.0 1.936 4.626 1100 1045 A 71 LYS HE2 A 79 GLU HBx 1.0 1.936 4.626 1101 1046 A 79 GLU HBx A 79 GLU HGy 1.0 2.000 5.000 1102 1047 A 79 GLU HBx A 79 GLU HGx 1.0 1.425 2.285 1103 1048 A 81 VAL HGx% A 79 GLU HBy 1.0 1.897 4.291 1104 1048 A 81 VAL HGx% A 79 GLU HBx 1.0 1.897 4.291 1105 1049 A 73 LYS HE2 A 79 GLU HGy 1.0 1.961 4.915 1106 1050 A 73 LYS HE2 A 79 GLU HGx 1.0 1.977 5.159 1107 1051 A 79 GLU HGy A 79 GLU HGx 1.0 1.389 2.187 1108 1052 A 71 LYS HBy A 79 GLU HGy 1.0 1.907 4.369 1109 1053 A 71 LYS HBy A 79 GLU HGx 1.0 1.928 4.562 1110 1054 A 79 GLU HGx A 71 LYS HD3 1.0 1.950 4.788 1111 1054 A 71 LYS HD2 A 79 GLU HGx 1.0 1.950 4.788 1112 1055 A 81 VAL HGy% A 79 GLU HGy 1.0 2.000 5.000 1113 1056 A 80 VAL HB A 80 VAL HA 1.0 1.675 3.099 1114 1057 A 81 VAL HGx% A 80 VAL HA 1.0 1.825 3.807 1115 1058 A 80 VAL HGy% A 80 VAL HA 1.0 2.000 5.000 1116 1059 A 80 VAL HB A 80 VAL HGy% 1.0 1.551 2.659 1117 1060 A 72 ARG HBy A 80 VAL HGy% 1.0 1.889 4.225 1118 1061 A 80 VAL HGy% A 72 ARG HGx 1.0 1.834 3.856 1119 1062 A 80 VAL HGy% A 74 ASP HBx 1.0 1.711 3.247 1120 1063 A 80 VAL HGy% A 74 ASP HBy 1.0 1.860 4.020 1121 1064 A 80 VAL HGy% A 79 GLU HA 1.0 1.887 4.207 1122 1065 A 82 PRO HBy A 82 PRO HA 1.0 2.000 5.000 1123 1066 A 82 PRO HA A 83 LYS HGy 1.0 1.947 4.753 1124 1067 A 82 PRO HA A 82 PRO HBx 1.0 1.656 3.028 1125 1068 A 82 PRO HDx A 82 PRO HBy 1.0 1.837 3.881 1126 1069 A 82 PRO HBy A 82 PRO HDy 1.0 1.824 3.798 1127 1070 A 82 PRO HDy A 82 PRO HBx 1.0 2.000 5.000 1128 1071 A 82 PRO HBx A 82 PRO HGx 1.0 1.526 2.578 1129 1072 A 82 PRO HBy A 82 PRO HGx 1.0 1.589 2.785 1130 1073 A 82 PRO HBy A 82 PRO HGy 1.0 2.000 5.000 1131 1074 A 82 PRO HBy A 82 PRO HBx 1.0 1.415 2.257 1132 1075 A 82 PRO HBx A 82 PRO HGy 1.0 2.000 5.000 1133 1076 A 82 PRO HA A 82 PRO HGx 1.0 2.000 5.000 1134 1077 A 82 PRO HA A 82 PRO HGy 1.0 1.729 3.327 1135 1078 A 82 PRO HDx A 82 PRO HGy 1.0 1.661 3.045 1136 1079 A 82 PRO HGx A 82 PRO HGy 1.0 1.290 1.944 1137 1080 A 82 PRO HDy A 82 PRO HGx 1.0 1.561 2.693 1138 1081 A 82 PRO HDy A 82 PRO HGy 1.0 1.664 3.056 1139 1082 A 82 PRO HDx A 82 PRO HA 1.0 2.000 5.000 1140 1083 A 82 PRO HDx A 82 PRO HDy 1.0 1.454 2.364 1141 1084 A 82 PRO HDx A 82 PRO HGx 1.0 1.654 3.018 1142 1085 A 82 PRO HDx A 82 PRO HBx 1.0 2.000 5.000 1143 1086 A 82 PRO HDx A 81 VAL HGx% 1.0 2.000 5.000 1144 1087 A 82 PRO HDy A 81 VAL HGx% 1.0 2.000 5.000 1145 1088 A 82 PRO HDy A 80 VAL HGy% 1.0 1.926 4.536 1146 1089 A 82 PRO HDy A 82 PRO HA 1.0 2.000 5.000 1147 1090 A 84 PRO HA A 83 LYS HA 1.0 1.906 4.362 1148 1091 A 84 PRO HA A 84 PRO HGy 1.0 2.000 5.000 1149 1092 A 66 VAL HGy% A 84 PRO HA 1.0 1.795 3.641 1150 1093 A 84 PRO HBy A 84 PRO HA 1.0 1.606 2.846 1151 1094 A 84 PRO HBy A 84 PRO HDy 1.0 1.867 4.067 1152 1095 A 84 PRO HDx A 84 PRO HBy 1.0 1.859 4.019 1153 1096 A 84 PRO HA A 84 PRO HBx 1.0 1.659 3.037 1154 1097 A 84 PRO HBy A 84 PRO HGy 1.0 1.575 2.737 1155 1098 A 84 PRO HBy A 84 PRO HBx 1.0 1.496 2.488 1156 1099 A 84 PRO HGy A 84 PRO HBx 1.0 1.406 2.234 1157 1100 A 52 PRO HDx A 51 THR HA 1.0 1.748 3.410 1158 1101 A 84 PRO HDx A 84 PRO HA 1.0 2.000 5.000 1159 1102 A 84 PRO HA A 84 PRO HDy 1.0 2.000 5.000 1160 1103 A 84 PRO HDx A 84 PRO HDy 1.0 1.557 2.677 1161 1104 A 84 PRO HDy A 84 PRO HBx 1.0 2.000 5.000 1162 1105 A 84 PRO HDx A 84 PRO HBx 1.0 1.729 3.329 1163 1106 A 84 PRO HDx A 84 PRO HGy 1.0 1.647 2.991 1164 1107 A 84 PRO HDx A 66 VAL HGx% 1.0 1.886 4.204 1165 1108 A 84 PRO HDy A 84 PRO HGy 1.0 1.667 3.069 1166 1109 A 63 ILE HG2% A 84 PRO HGy 1.0 1.757 3.453 1167 1110 A 66 VAL HGx% A 84 PRO HGy 1.0 2.000 5.000 1168 1110 A 66 VAL HGy% A 84 PRO HGy 1.0 2.000 5.000 1169 1111 A 85 GLN HA A 85 GLN HBx 1.0 1.634 2.944 1170 1112 A 85 GLN HA A 85 GLN HBy 1.0 1.663 3.051 1171 1113 A 85 GLN HA A 85 GLN HGx 1.0 1.748 3.414 1172 1114 A 63 ILE HA A 85 GLN HA 1.0 1.988 5.378 1173 1115 A 85 GLN HBy A 85 GLN HGx 1.0 1.672 3.086 1174 1116 A 85 GLN HBx A 85 GLN HBy 1.0 1.384 2.176 1175 1117 A 64 GLY HAx A 85 GLN HBy 1.0 1.930 4.570 1176 1118 A 85 GLN HA A 85 GLN HGy 1.0 1.736 3.358 1177 1119 A 84 PRO HA A 85 GLN HGy 1.0 1.936 4.634 1178 1120 A 84 PRO HA A 85 GLN HGx 1.0 1.959 4.887 1179 1121 A 85 GLN HGx A 85 GLN HGy 1.0 1.280 1.920 1180 1122 A 85 GLN HBx A 85 GLN HGy 1.0 1.671 3.085 1181 1123 A 85 GLN HBy A 85 GLN HGy 1.0 1.653 3.015 1182 1124 A 85 GLN HBx A 85 GLN HGx 1.0 1.676 3.104 1183 1125 A 86 ARG HA A 85 GLN HA 1.0 1.982 5.242 1184 1126 A 63 ILE HA A 86 ARG HA 1.0 1.711 3.245 1185 1127 A 86 ARG HA A 86 ARG HBx 1.0 1.727 3.315 1186 1128 A 86 ARG HA A 86 ARG HBy 1.0 1.670 3.080 1187 1129 A 63 ILE HG1x A 86 ARG HA 1.0 1.885 4.199 1188 1130 A 63 ILE HG2% A 86 ARG HA 1.0 1.854 3.982 1189 1131 A 63 ILE HB A 86 ARG HA 1.0 2.000 5.000 1190 1132 A 86 ARG HBy A 86 ARG HBx 1.0 1.549 2.651 1191 1133 A 63 ILE HD1% A 86 ARG HBx 1.0 1.973 5.095 1192 1134 A 86 ARG HD2 A 86 ARG HA 1.0 1.916 4.442 1193 1135 A 86 ARG HD2 A 86 ARG HBy 1.0 1.623 2.901 1194 1136 A 86 ARG HD2 A 86 ARG HBx 1.0 2.000 5.000 1195 1137 A 86 ARG HG2 A 86 ARG HD2 1.0 1.629 2.925 1196 1138 A 86 ARG HG2 A 86 ARG HA 1.0 1.763 3.485 1197 1139 A 62 LEU HDx% A 48 LEU HG 1.0 1.852 3.976 1198 1140 A 86 ARG HG2 A 86 ARG HBy 1.0 2.000 5.000 1199 1141 A 86 ARG HG2 A 86 ARG HBx 1.0 2.000 5.000 1200 1142 A 87 HIS HBx A 87 HIS HA 1.0 1.770 3.516 1201 1143 A 87 HIS HBy A 87 HIS HA 1.0 1.697 3.189 1202 1144 A 87 HIS HD2 A 87 HIS HBx 1.0 1.877 4.137 1203 1145 A 87 HIS HD2 A 87 HIS HBy 1.0 1.865 4.057 1204 1146 A 87 HIS HBy A 87 HIS HBx 1.0 1.738 3.368 1205 1147 A 87 HIS HBy A 62 LEU HBy 1.0 1.914 4.422 1206 1148 A 87 HIS HBx A 62 LEU HBy 1.0 1.845 3.925 1207 1149 A 87 HIS HBy A 62 LEU HG 1.0 1.958 4.878 1208 1150 A 87 HIS HBx A 62 LEU HG 1.0 1.958 4.876 1209 1151 A 87 HIS HBy A 62 LEU HBx 1.0 1.957 4.879 1210 1152 A 87 HIS HBx A 62 LEU HDy% 1.0 1.968 5.014 1211 1153 A 87 HIS HBy A 62 LEU HDy% 1.0 1.966 4.988 1212 1154 A 9 PHE HDy A 89 PHE HA 1.0 1.936 4.634 1213 1154 A 9 PHE HDx A 89 PHE HA 1.0 1.936 4.634 1214 1155 A 89 PHE HDy A 89 PHE HA 1.0 1.757 3.457 1215 1155 A 89 PHE HDx A 89 PHE HA 1.0 1.757 3.457 1216 1156 A 91 PHE HEy A 89 PHE HA 1.0 1.978 5.190 1217 1156 A 91 PHE HEx A 89 PHE HA 1.0 1.978 5.190 1218 1157 A 89 PHE HEy A 89 PHE HA 1.0 1.947 4.757 1219 1157 A 89 PHE HEx A 89 PHE HA 1.0 1.947 4.757 1220 1158 A 9 PHE HA A 89 PHE HA 1.0 1.885 4.199 1221 1159 A 89 PHE HBx A 89 PHE HA 1.0 1.724 3.304 1222 1160 A 7 ALA HB% A 89 PHE HA 1.0 1.885 4.195 1223 1161 A 16 ILE HD1% A 89 PHE HA 1.0 1.983 5.285 1224 1162 A 9 PHE HBx A 89 PHE HA 1.0 2.000 5.930 1225 1163 A 8 ILE HG2% A 89 PHE HA 1.0 2.000 6.098 1226 1164 A 9 PHE HBy A 89 PHE HA 1.0 1.966 4.998 1227 1165 A 60 LEU HBy A 89 PHE HA 1.0 1.994 5.540 1228 1166 A 89 PHE HDy A 89 PHE HBx 1.0 1.809 3.721 1229 1166 A 89 PHE HDx A 89 PHE HBx 1.0 1.809 3.721 1230 1167 A 91 PHE HEy A 89 PHE HBx 1.0 1.916 4.440 1231 1167 A 91 PHE HEx A 89 PHE HBx 1.0 1.916 4.440 1232 1168 A 89 PHE HBx A 60 LEU HBy 1.0 1.961 4.921 1233 1169 A 7 ALA HB% A 89 PHE HBx 1.0 1.850 3.960 1234 1170 A 90 SER HBy A 90 SER HA 1.0 1.678 3.114 1235 1171 A 90 SER HBx A 90 SER HA 1.0 1.724 3.304 1236 1172 A 90 SER HBx A 90 SER HBy 1.0 1.432 2.306 1237 1173 A 90 SER HBy A 59 MET HGy 1.0 1.875 4.129 1238 1174 A 90 SER HBx A 59 MET HGy 1.0 2.000 5.000 1239 1175 A 90 SER HBy A 59 MET HGx 1.0 1.927 4.545 1240 1176 A 90 SER HBx A 59 MET HGx 1.0 1.952 4.816 1241 1177 A 8 ILE HB A 90 SER HBy 1.0 1.698 3.196 1242 1178 A 8 ILE HB A 90 SER HBx 1.0 1.665 3.059 1243 1179 A 8 ILE HG1y A 90 SER HBx 1.0 1.931 4.585 1244 1180 A 8 ILE HG1y A 90 SER HBy 1.0 2.000 5.000 1245 1181 A 8 ILE HD1% A 90 SER HBy 1.0 1.819 3.773 1246 1182 A 8 ILE HG2% A 90 SER HBy 1.0 1.824 3.804 1247 1183 A 91 PHE HDy A 90 SER HA 1.0 1.875 4.125 1248 1183 A 91 PHE HDx A 90 SER HA 1.0 1.875 4.125 1249 1184 A 91 PHE HEy A 90 SER HA 1.0 1.986 5.362 1250 1184 A 91 PHE HEx A 90 SER HA 1.0 1.986 5.362 1251 1185 A 59 MET HGy A 90 SER HA 1.0 1.817 3.763 1252 1186 A 59 MET HGx A 90 SER HA 1.0 1.863 4.043 1253 1187 A 59 MET HBx A 90 SER HA 1.0 1.918 4.458 1254 1188 A 59 MET HBy A 90 SER HA 1.0 1.915 4.437 1255 1189 A 8 ILE HB A 90 SER HA 1.0 1.961 4.927 1256 1190 A 7 ALA HA A 91 PHE HA 1.0 1.761 3.473 1257 1191 A 91 PHE HA A 91 PHE HBy 1.0 1.774 3.538 1258 1192 A 91 PHE HA A 91 PHE HBx 1.0 1.801 3.675 1259 1193 A 6 ALA HB% A 91 PHE HA 1.0 1.938 4.660 1260 1194 A 7 ALA HB% A 91 PHE HA 1.0 1.883 4.185 1261 1195 A 8 ILE HD1% A 91 PHE HA 1.0 1.957 4.873 1262 1196 A 91 PHE HDy A 91 PHE HA 1.0 1.775 3.543 1263 1196 A 91 PHE HDx A 91 PHE HA 1.0 1.775 3.543 1264 1197 A 91 PHE HBy A 91 PHE HBx 1.0 1.761 3.473 1265 1198 A 91 PHE HDy A 91 PHE HBy 1.0 1.797 3.651 1266 1198 A 91 PHE HDx A 91 PHE HBy 1.0 1.797 3.651 1267 1199 A 91 PHE HDy A 91 PHE HBx 1.0 1.824 3.806 1268 1199 A 91 PHE HDx A 91 PHE HBx 1.0 1.824 3.806 1269 1200 A 97 MET HBy A 91 PHE HBy 1.0 1.956 4.854 1270 1201 A 97 MET HBy A 91 PHE HBx 1.0 1.936 4.634 1271 1202 A 92 ASN HBy A 92 ASN HA 1.0 1.558 2.684 1272 1203 A 91 PHE HBx A 92 ASN HA 1.0 2.000 5.000 1273 1204 A 92 ASN HA A 58 MET HE% 1.0 2.000 5.000 1274 1205 A 92 ASN HBy A 6 ALA HB% 1.0 1.966 4.996 1275 1206 A 96 VAL HGy% A 93 ASN HA 1.0 1.972 5.076 1276 1207 A 93 ASN HA A 93 ASN HBy 1.0 1.785 3.591 1277 1208 A 93 ASN HBx A 93 ASN HA 1.0 1.811 3.729 1278 1209 A 96 VAL HB A 93 ASN HBy 1.0 2.000 5.000 1279 1210 A 96 VAL HB A 93 ASN HBx 1.0 1.844 3.922 1280 1211 A 94 ARG HA A 94 ARG HBx 1.0 1.737 3.365 1281 1212 A 94 ARG HGx A 94 ARG HA 1.0 1.789 3.611 1282 1213 A 94 ARG HA A 94 ARG HBy 1.0 1.858 4.012 1283 1214 A 94 ARG HBy A 94 ARG HDx 1.0 1.920 4.478 1284 1215 A 94 ARG HBy A 94 ARG HDy 1.0 1.921 4.487 1285 1216 A 94 ARG HGx A 94 ARG HBy 1.0 1.743 3.387 1286 1217 A 94 ARG HBx A 94 ARG HBy 1.0 1.606 2.844 1287 1218 A 94 ARG HDx A 94 ARG HDy 1.0 1.506 2.518 1288 1219 A 94 ARG HA A 94 ARG HDx 1.0 1.838 3.882 1289 1220 A 94 ARG HA A 94 ARG HDy 1.0 1.822 3.790 1290 1221 A 53 ALA HA A 94 ARG HDy 1.0 1.969 5.031 1291 1222 A 53 ALA HA A 94 ARG HDx 1.0 1.932 4.600 1292 1223 A 94 ARG HGx A 94 ARG HDx 1.0 1.748 3.412 1293 1224 A 53 ALA HB% A 94 ARG HDx 1.0 1.917 4.455 1294 1225 A 94 ARG HGy A 94 ARG HDx 1.0 1.677 3.107 1295 1226 A 94 ARG HBx A 94 ARG HDx 1.0 1.832 3.848 1296 1227 A 94 ARG HBx A 94 ARG HDy 1.0 1.812 3.732 1297 1228 A 94 ARG HGy A 94 ARG HDy 1.0 1.677 3.107 1298 1229 A 94 ARG HGx A 94 ARG HDy 1.0 1.745 3.399 1299 1230 A 58 MET HE% A 94 ARG HDx 1.0 1.879 4.153 1300 1231 A 58 MET HE% A 94 ARG HDy 1.0 1.873 4.111 1301 1232 A 94 ARG HDy A 58 MET HG3 1.0 1.965 4.969 1302 1232 A 58 MET HG2 A 94 ARG HDy 1.0 1.965 4.969 1303 1233 A 94 ARG HDx A 97 MET HGy 1.0 1.963 4.947 1304 1234 A 94 ARG HGy A 94 ARG HA 1.0 1.854 3.986 1305 1235 A 94 ARG HGy A 94 ARG HBx 1.0 1.744 3.396 1306 1236 A 94 ARG HGx A 94 ARG HBx 1.0 1.753 3.433 1307 1237 A 94 ARG HGx A 94 ARG HGy 1.0 1.522 2.566 1308 1238 A 95 THR HB A 95 THR HA 1.0 1.650 3.004 1309 1239 A 95 THR HA A 98 ASP HBy 1.0 1.749 3.417 1310 1240 A 95 THR HA A 98 ASP HBx 1.0 1.813 3.739 1311 1241 A 95 THR HB A 95 THR HG2% 1.0 1.488 2.466 1312 1242 A 95 THR HA A 95 THR HG2% 1.0 1.593 2.797 1313 1243 A 99 ASN HBy A 95 THR HG2% 1.0 1.949 4.783 1314 1244 A 96 VAL HB A 96 VAL HA 1.0 1.801 3.677 1315 1245 A 99 ASN HBy A 96 VAL HA 1.0 1.814 3.746 1316 1246 A 91 PHE HEy A 96 VAL HA 1.0 1.920 4.480 1317 1246 A 91 PHE HEx A 96 VAL HA 1.0 1.920 4.480 1318 1247 A 59 MET HGy A 88 MET HGy 1.0 1.564 2.700 1319 1248 A 96 VAL HGx% A 96 VAL HB 1.0 1.617 2.881 1320 1249 A 51 THR HG2% A 88 MET HGy 1.0 2.000 5.000 1321 1250 A 96 VAL HGx% A 96 VAL HA 1.0 1.561 2.691 1322 1251 A 96 VAL HGy% A 96 VAL HA 1.0 1.572 2.726 1323 1252 A 5 GLY HAx A 96 VAL HGx% 1.0 1.723 3.299 1324 1253 A 91 PHE HDx A 96 VAL HGx% 1.0 1.730 3.330 1325 1253 A 91 PHE HDy A 96 VAL HGx% 1.0 1.730 3.330 1326 1254 A 91 PHE HEx A 96 VAL HGx% 1.0 1.762 3.480 1327 1254 A 91 PHE HEy A 96 VAL HGx% 1.0 1.762 3.480 1328 1255 A 96 VAL HGx% A 100 ILE HD1% 1.0 1.767 3.501 1329 1256 A 98 ASP HA A 98 ASP HBy 1.0 1.755 3.447 1330 1257 A 98 ASP HA A 98 ASP HBx 1.0 1.736 3.358 1331 1258 A 98 ASP HA A 101 LYS HBy 1.0 1.717 3.271 1332 1259 A 98 ASP HA A 101 LYS HBx 1.0 1.784 3.586 1333 1260 A 101 LYS HDx A 98 ASP HA 1.0 2.000 5.000 1334 1261 A 98 ASP HBy A 98 ASP HBx 1.0 1.586 2.772 1335 1262 A 99 ASN HBy A 99 ASN HA 1.0 1.737 3.365 1336 1263 A 99 ASN HA A 99 ASN HBx 1.0 1.701 3.205 1337 1264 A 99 ASN HBy A 99 ASN HBx 1.0 1.577 2.743 1338 1265 A 96 VAL HGx% A 99 ASN HBy 1.0 1.924 4.514 1339 1266 A 96 VAL HGx% A 99 ASN HBx 1.0 1.935 4.621 1340 1267 A 96 VAL HA A 99 ASN HBx 1.0 1.854 3.980 1341 1268 A 100 ILE HB A 100 ILE HA 1.0 1.815 3.753 1342 1269 A 100 ILE HA A 100 ILE HG1x 1.0 1.842 3.910 1343 1270 A 100 ILE HG1y A 100 ILE HA 1.0 1.866 4.060 1344 1271 A 100 ILE HB A 97 MET HA 1.0 1.825 3.807 1345 1272 A 100 ILE HG1y A 100 ILE HB 1.0 1.753 3.435 1346 1273 A 16 ILE HD1% A 100 ILE HG2% 1.0 1.753 3.433 1347 1274 A 100 ILE HA A 100 ILE HG2% 1.0 1.655 3.025 1348 1275 A 97 MET HA A 100 ILE HG2% 1.0 1.924 4.522 1349 1276 A 104 LEU HBy A 100 ILE HG2% 1.0 2.000 5.000 1350 1277 A 103 THR HB A 100 ILE HG2% 1.0 1.916 4.448 1351 1278 A 91 PHE HZ A 100 ILE HG2% 1.0 1.787 3.601 1352 1279 A 91 PHE HEy A 100 ILE HG2% 1.0 1.869 4.083 1353 1279 A 91 PHE HEx A 100 ILE HG2% 1.0 1.869 4.083 1354 1280 A 60 LEU HDx% A 100 ILE HG2% 1.0 1.571 2.721 1355 1281 A 100 ILE HG2% A 104 LEU HBx 1.0 2.000 5.000 1356 1282 A 100 ILE HB A 100 ILE HD1% 1.0 1.715 3.261 1357 1283 A 100 ILE HG2% A 100 ILE HD1% 1.0 1.477 2.433 1358 1284 A 16 ILE HG2% A 100 ILE HD1% 1.0 1.495 2.487 1359 1285 A 97 MET HA A 100 ILE HD1% 1.0 1.951 4.791 1360 1286 A 100 ILE HA A 100 ILE HD1% 1.0 1.578 2.746 1361 1287 A 4 SER HBy A 100 ILE HD1% 1.0 2.000 5.000 1362 1288 A 103 THR HB A 100 ILE HD1% 1.0 1.897 5.285 1363 1289 A 5 GLY HAx A 100 ILE HD1% 1.0 1.870 4.088 1364 1290 A 5 GLY HAy A 100 ILE HD1% 1.0 1.910 4.392 1365 1291 A 3 HIS HA A 100 ILE HD1% 1.0 1.855 3.993 1366 1292 A 4 SER HA A 100 ILE HD1% 1.0 1.792 3.628 1367 1293 A 17 ALA HA A 100 ILE HD1% 1.0 1.954 4.834 1368 1294 A 91 PHE HEy A 100 ILE HD1% 1.0 1.824 3.802 1369 1294 A 91 PHE HEx A 100 ILE HD1% 1.0 1.824 3.802 1370 1295 A 91 PHE HZ A 100 ILE HD1% 1.0 1.936 4.626 1371 1296 A 100 ILE HB A 100 ILE HG1x 1.0 1.722 3.292 1372 1297 A 100 ILE HG1y A 97 MET HA 1.0 1.979 5.201 1373 1298 A 91 PHE HEy A 100 ILE HG1y 1.0 1.942 4.696 1374 1298 A 91 PHE HEx A 100 ILE HG1y 1.0 1.942 4.696 1375 1299 A 91 PHE HEy A 100 ILE HG1x 1.0 1.962 4.926 1376 1299 A 91 PHE HEx A 100 ILE HG1x 1.0 1.962 4.926 1377 1300 A 101 LYS HA A 101 LYS HGx 1.0 1.739 3.375 1378 1301 A 101 LYS HA A 101 LYS HDx 1.0 1.919 4.467 1379 1302 A 101 LYS HA A 101 LYS HBx 1.0 1.753 3.433 1380 1303 A 101 LYS HA A 104 LEU HBx 1.0 1.915 4.443 1381 1304 A 104 LEU HDy% A 101 LYS HA 1.0 2.000 5.000 1382 1305 A 101 LYS HA A 101 LYS HBy 1.0 1.737 3.361 1383 1306 A 81 VAL HB A 81 VAL HA 1.0 1.716 3.270 1384 1307 A 82 PRO HDy A 81 VAL HB 1.0 1.859 4.015 1385 1308 A 101 LYS HBx A 101 LYS HGx 1.0 1.762 3.480 1386 1309 A 101 LYS HBy A 101 LYS HGx 1.0 1.751 3.429 1387 1310 A 101 LYS HDx A 101 LYS HGx 1.0 2.000 5.000 1388 1311 A 101 LYS HA A 101 LYS HE2 1.0 2.000 5.000 1389 1312 A 101 LYS HE2 A 60 LEU HDy% 1.0 2.000 5.000 1390 1313 A 98 ASP HA A 101 LYS HE3 1.0 1.751 3.427 1391 1313 A 101 LYS HE2 A 98 ASP HA 1.0 1.751 3.427 1392 1314 A 101 LYS HA A 101 LYS HDy 1.0 2.000 5.000 1393 1315 A 60 LEU HDx% A 101 LYS HDx 1.0 1.808 3.712 1394 1316 A 101 LYS HDy A 60 LEU HDy% 1.0 1.799 3.663 1395 1317 A 103 THR HB A 103 THR HG2% 1.0 1.552 2.662 1396 1318 A 3 HIS HA A 103 THR HG2% 1.0 1.889 4.225 1397 1319 A 100 ILE HA A 103 THR HG2% 1.0 2.000 5.000 1398 1320 A 106 GLN HBy A 103 THR HG2% 1.0 1.939 4.661 1399 1321 A 103 THR HG2% A 107 ILE HG1x 1.0 2.803 4.683 1400 1322 A 18 ILE HB A 103 THR HG2% 1.0 1.840 3.894 1401 1323 A 18 ILE HG1x A 103 THR HG2% 1.0 1.890 4.234 1402 1324 A 3 HIS HD2 A 103 THR HG2% 1.0 1.905 4.349 1403 1325 A 3 HIS HE1 A 103 THR HG2% 1.0 1.944 4.708 1404 1326 A 100 ILE HA A 103 THR HB 1.0 1.761 3.475 1405 1327 A 103 THR HB A 107 ILE HG1y 1.0 2.000 5.000 1406 1328 A 18 ILE HG2% A 103 THR HB 1.0 1.819 3.779 1407 1329 A 103 THR HB A 103 THR HA 1.0 2.000 5.000 1408 1330 A 106 GLN HBy A 103 THR HA 1.0 1.811 3.725 1409 1331 A 103 THR HA A 106 GLN HBx 1.0 2.000 5.000 1410 1332 A 104 LEU HA A 104 LEU HBy 1.0 1.827 3.823 1411 1333 A 104 LEU HA A 104 LEU HG 1.0 1.821 3.785 1412 1334 A 104 LEU HA A 107 ILE HB 1.0 1.794 3.642 1413 1335 A 104 LEU HA A 104 LEU HDy% 1.0 1.600 2.820 1414 1336 A 104 LEU HA A 48 LEU HDy% 1.0 1.817 3.761 1415 1337 A 104 LEU HA A 104 LEU HBx 1.0 2.000 5.000 1416 1338 A 104 LEU HA A 104 LEU HDx% 1.0 2.000 5.000 1417 1339 A 18 ILE HG2% A 104 LEU HA 1.0 2.000 5.000 1418 1340 A 101 LYS HA A 104 LEU HBy 1.0 1.938 4.650 1419 1341 A 104 LEU HDx% A 101 LYS HA 1.0 1.831 3.843 1420 1342 A 48 LEU HBy A 104 LEU HDx% 1.0 1.720 3.286 1421 1343 A 18 ILE HG1x A 104 LEU HDx% 1.0 2.000 5.000 1422 1344 A 104 LEU HDy% A 100 ILE HD1% 1.0 2.000 5.000 1423 1345 A 104 LEU HDy% A 104 LEU HG 1.0 1.654 3.020 1424 1346 A 18 ILE HG1x A 104 LEU HDy% 1.0 1.779 3.559 1425 1347 A 104 LEU HDy% A 107 ILE HB 1.0 2.000 5.000 1426 1348 A 100 ILE HA A 104 LEU HDy% 1.0 2.000 5.000 1427 1349 A 103 THR HB A 104 LEU HDy% 1.0 2.000 5.000 1428 1350 A 18 ILE HA A 104 LEU HDy% 1.0 1.999 5.851 1429 1351 A 27 LEU HA A 104 LEU HDy% 1.0 1.961 4.911 1430 1352 A 40 VAL HGx% A 104 LEU HDy% 1.0 1.988 5.400 1431 1353 A 104 LEU HBy A 104 LEU HG 1.0 1.854 3.984 1432 1354 A 43 SER HA A 111 TYR HBy 1.0 1.856 3.994 1433 1355 A 111 TYR HBx A 43 SER HA 1.0 1.865 4.053 1434 1356 A 105 GLN HA A 105 GLN HBy 1.0 1.709 3.239 1435 1357 A 105 GLN HA A 105 GLN HBx 1.0 1.695 3.183 1436 1358 A 105 GLN HA A 108 ILE HB 1.0 1.779 3.563 1437 1359 A 105 GLN HA A 108 ILE HG1x 1.0 1.804 3.692 1438 1360 A 111 TYR HEy A 43 SER HA 1.0 1.946 4.738 1439 1360 A 111 TYR HEx A 43 SER HA 1.0 1.946 4.738 1440 1361 A 105 GLN HBx A 102 MET HA 1.0 1.847 3.943 1441 1362 A 105 GLN HBy A 102 MET HA 1.0 1.858 4.012 1442 1363 A 105 GLN HBy A 106 GLN HGy 1.0 1.942 4.700 1443 1364 A 105 GLN HA A 105 GLN HGy 1.0 1.783 3.583 1444 1365 A 105 GLN HA A 105 GLN HGx 1.0 1.765 3.493 1445 1366 A 105 GLN HBy A 105 GLN HGy 1.0 2.000 5.000 1446 1367 A 105 GLN HBx A 105 GLN HGy 1.0 1.659 3.035 1447 1368 A 105 GLN HBx A 105 GLN HGx 1.0 2.000 5.000 1448 1369 A 105 GLN HBy A 105 GLN HGx 1.0 2.000 5.000 1449 1370 A 48 LEU HDy% A 105 GLN HGy 1.0 1.779 3.563 1450 1371 A 48 LEU HDy% A 105 GLN HGx 1.0 1.757 3.457 1451 1372 A 108 ILE HG2% A 43 SER HA 1.0 2.000 5.000 1452 1373 A 106 GLN HA A 106 GLN HGx 1.0 1.736 3.358 1453 1374 A 106 GLN HBy A 106 GLN HA 1.0 1.665 3.063 1454 1375 A 106 GLN HBx A 106 GLN HA 1.0 1.656 3.024 1455 1376 A 103 THR HA A 106 GLN HGy 1.0 1.890 4.236 1456 1377 A 103 THR HA A 106 GLN HGx 1.0 1.879 4.159 1457 1378 A 106 GLN HBy A 106 GLN HGy 1.0 1.624 2.908 1458 1379 A 106 GLN HBx A 106 GLN HGy 1.0 1.677 3.107 1459 1380 A 106 GLN HBx A 106 GLN HGx 1.0 1.598 2.814 1460 1381 A 106 GLN HBy A 106 GLN HGx 1.0 2.000 5.000 1461 1382 A 106 GLN HGy A 102 MET HE% 1.0 1.901 4.317 1462 1383 A 106 GLN HGy A 103 THR HG2% 1.0 1.980 5.228 1463 1384 A 106 GLN HGy A 102 MET HGy 1.0 1.654 3.018 1464 1385 A 106 GLN HGx A 102 MET HGy 1.0 1.802 3.684 1465 1386 A 107 ILE HA A 110 ARG HDx 1.0 1.924 4.514 1466 1387 A 107 ILE HA A 110 ARG HDy 1.0 1.893 4.257 1467 1388 A 107 ILE HA A 107 ILE HG1x 1.0 1.752 3.434 1468 1389 A 107 ILE HA A 107 ILE HB 1.0 1.707 3.229 1469 1390 A 107 ILE HD1% A 107 ILE HA 1.0 1.787 4.601 1470 1391 A 107 ILE HA A 107 ILE HG1y 1.0 2.000 5.000 1471 1392 A 107 ILE HB A 107 ILE HG1x 1.0 1.813 3.741 1472 1393 A 107 ILE HA A 107 ILE HG2% 1.0 1.660 3.042 1473 1394 A 107 ILE HB A 107 ILE HG2% 1.0 1.561 2.689 1474 1395 A 25 ALA HB% A 107 ILE HG2% 1.0 1.572 2.726 1475 1396 A 110 ARG HDx A 107 ILE HG2% 1.0 1.979 5.203 1476 1397 A 42 LEU HA A 107 ILE HG2% 1.0 2.000 5.000 1477 1398 A 25 ALA HB% A 107 ILE HD1% 1.0 1.673 3.093 1478 1399 A 20 GLU HGx A 107 ILE HD1% 1.0 1.747 3.409 1479 1400 A 107 ILE HD1% A 104 LEU HA 1.0 1.753 5.439 1480 1401 A 107 ILE HD1% A 103 THR HB 1.0 1.923 4.509 1481 1402 A 107 ILE HB A 107 ILE HG1y 1.0 1.695 3.181 1482 1403 A 114 ALA HA A 113 ASP HBy 1.0 1.968 5.018 1483 1404 A 114 ALA HA A 113 ASP HBx 1.0 1.978 5.196 1484 1405 A 114 ALA HA A 114 ALA HB% 1.0 1.474 2.424 1485 1406 A 114 ALA HB% A 111 TYR HA 1.0 1.842 3.906 1486 1407 A 114 ALA HB% A 111 TYR HDx 1.0 1.999 5.795 1487 1407 A 114 ALA HB% A 111 TYR HDy 1.0 1.999 5.795 1488 1408 A 111 TYR HBy A 111 TYR HA 1.0 1.728 3.324 1489 1409 A 111 TYR HBx A 111 TYR HA 1.0 1.771 3.519 1490 1410 A 114 ALA HA A 111 TYR HA 1.0 1.941 4.681 1491 1411 A 43 SER HA A 111 TYR HA 1.0 1.953 4.825 1492 1412 A 43 SER HBy A 111 TYR HA 1.0 1.970 5.044 1493 1413 A 111 TYR HA A 111 TYR HDy 1.0 1.697 3.189 1494 1413 A 111 TYR HA A 111 TYR HDx 1.0 1.697 3.189 1495 1414 A 111 TYR HEy A 111 TYR HA 1.0 2.000 5.000 1496 1414 A 111 TYR HEx A 111 TYR HA 1.0 2.000 5.000 1497 1415 A 111 TYR HBx A 108 ILE HA 1.0 1.928 4.554 1498 1416 A 111 TYR HBy A 108 ILE HA 1.0 2.000 5.000 1499 1417 A 109 SER HA A 112 LYS HB3 1.0 1.777 3.551 1500 1417 A 109 SER HA A 112 LYS HB2 1.0 1.777 3.551 1501 1418 A 109 SER HA A 109 SER HBy 1.0 1.531 2.595 1502 1419 A 112 LYS HB2 A 109 SER HBy 1.0 1.909 4.381 1503 1420 A 109 SER HBy A 112 LYS HD2 1.0 1.952 4.808 1504 1421 A 108 ILE HB A 108 ILE HA 1.0 1.749 3.415 1505 1422 A 108 ILE HG1x A 108 ILE HA 1.0 1.761 3.473 1506 1423 A 108 ILE HA A 108 ILE HG1y 1.0 1.626 2.912 1507 1424 A 111 TYR HEy A 108 ILE HA 1.0 1.960 4.906 1508 1424 A 111 TYR HEx A 108 ILE HA 1.0 1.960 4.906 1509 1425 A 108 ILE HG2% A 108 ILE HA 1.0 1.639 2.965 1510 1426 A 108 ILE HG2% A 105 GLN HA 1.0 2.000 5.000 1511 1427 A 108 ILE HG2% A 108 ILE HB 1.0 1.561 2.691 1512 1428 A 42 LEU HBx A 108 ILE HG2% 1.0 1.864 4.048 1513 1429 A 108 ILE HG2% A 112 LYS HGx 1.0 2.000 5.000 1514 1430 A 45 ILE HB A 108 ILE HG2% 1.0 1.806 3.702 1515 1431 A 108 ILE HG2% A 112 LYS HE2 1.0 1.831 3.845 1516 1432 A 47 LYS HA A 108 ILE HG2% 1.0 1.847 3.935 1517 1433 A 108 ILE HG2% A 111 TYR HDy 1.0 1.993 5.525 1518 1433 A 108 ILE HG2% A 111 TYR HDx 1.0 1.993 5.525 1519 1434 A 108 ILE HD1% A 105 GLN HA 1.0 1.714 3.262 1520 1435 A 45 ILE HB A 108 ILE HD1% 1.0 1.816 3.754 1521 1436 A 108 ILE HD1% A 104 LEU HBy 1.0 1.818 3.770 1522 1437 A 48 LEU HG A 108 ILE HD1% 1.0 1.736 3.356 1523 1438 A 48 LEU HBx A 108 ILE HD1% 1.0 2.000 5.000 1524 1439 A 108 ILE HD1% A 104 LEU HDx% 1.0 2.000 5.000 1525 1440 A 48 LEU HA A 108 ILE HD1% 1.0 1.959 4.893 1526 1441 A 108 ILE HB A 108 ILE HG1y 1.0 1.827 3.821 1527 1442 A 108 ILE HB A 108 ILE HG1x 1.0 1.768 3.508 1528 1443 A 110 ARG HA A 110 ARG HGx 1.0 1.696 3.188 1529 1444 A 110 ARG HDx A 110 ARG HA 1.0 1.906 4.362 1530 1445 A 110 ARG HDy A 107 ILE HG2% 1.0 1.942 4.698 1531 1446 A 110 ARG HDy A 110 ARG HA 1.0 2.000 5.000 1532 1447 A 110 ARG HA A 110 ARG HB2 1.0 1.652 3.014 1533 1448 A 110 ARG HA A 110 ARG HGy 1.0 1.745 3.397 1534 1449 A 107 ILE HA A 110 ARG HGx 1.0 1.908 4.378 1535 1450 A 107 ILE HA A 110 ARG HGy 1.0 1.863 4.043 1536 1451 A 112 LYS HB2 A 112 LYS HA 1.0 1.586 2.774 1537 1452 A 112 LYS HD2 A 112 LYS HA 1.0 2.000 5.000 1538 1453 A 112 LYS HA A 112 LYS HGy 1.0 1.774 3.536 1539 1454 A 112 LYS HB3 A 112 LYS HA 1.0 2.000 5.000 1540 1455 A 112 LYS HGx A 112 LYS HA 1.0 1.767 3.503 1541 1456 A 109 SER HA A 112 LYS HGx 1.0 1.898 4.298 1542 1457 A 109 SER HA A 112 LYS HGy 1.0 1.890 4.232 1543 1458 A 109 SER HA A 112 LYS HD2 1.0 1.884 4.192 1544 1459 A 46 ASP HA A 112 LYS HD2 1.0 1.948 4.764 1545 1460 A 108 ILE HG2% A 112 LYS HD2 1.0 1.799 3.665 1546 1461 A 46 ASP HA A 112 LYS HE2 1.0 1.848 3.948 1547 1462 A 112 LYS HE2 A 112 LYS HA 1.0 1.915 4.441 1548 1463 A 109 SER HA A 112 LYS HE2 1.0 1.919 4.471 1549 1464 A 108 ILE HG2% A 112 LYS HE2 1.0 1.744 3.394 1550 1464 A 108 ILE HG2% A 112 LYS HE3 1.0 1.744 3.394 1551 1465 A 45 ILE HB A 45 ILE HA 1.0 1.883 4.181 1552 1466 A 45 ILE HG1x A 45 ILE HA 1.0 1.880 4.164 1553 1467 A 62 LEU HDx% A 45 ILE HA 1.0 1.927 4.539 1554 1468 A 45 ILE HA A 64 GLY HAy 1.0 1.749 3.415 1555 1469 A 45 ILE HB A 45 ILE HG2% 1.0 1.643 2.977 1556 1470 A 45 ILE HG1y A 45 ILE HB 1.0 1.801 3.675 1557 1471 A 45 ILE HD1% A 64 GLY HAy 1.0 1.716 3.272 1558 1472 A 45 ILE HD1% A 45 ILE HA 1.0 1.601 2.825 1559 1473 A 45 ILE HD1% A 64 GLY HAx 1.0 1.775 3.539 1560 1474 A 45 ILE HD1% A 42 LEU HA 1.0 1.822 3.792 1561 1475 A 45 ILE HD1% A 87 HIS HBx 1.0 1.978 5.176 1562 1476 A 45 ILE HB A 45 ILE HD1% 1.0 1.753 3.435 1563 1477 A 45 ILE HD1% A 62 LEU HBy 1.0 1.746 3.404 1564 1478 A 45 ILE HG1x A 45 ILE HD1% 1.0 1.579 2.751 1565 1479 A 45 ILE HG1y A 45 ILE HD1% 1.0 1.646 2.986 1566 1480 A 45 ILE HD1% A 45 ILE HG2% 1.0 1.524 2.574 1567 1481 A 45 ILE HA A 45 ILE HG2% 1.0 1.725 3.311 1568 1482 A 45 ILE HG2% A 64 GLY HAy 1.0 1.821 3.785 1569 1483 A 63 ILE HA A 45 ILE HG2% 1.0 1.932 4.594 1570 1484 A 45 ILE HG1x A 45 ILE HG2% 1.0 1.625 2.909 1571 1485 A 45 ILE HG1y A 45 ILE HG2% 1.0 2.000 5.000 1572 1486 A 45 ILE HG2% A 62 LEU HBy 1.0 1.825 3.807 1573 1487 A 45 ILE HG2% A 104 LEU HBy 1.0 1.902 4.324 1574 1488 A 45 ILE HG2% A 65 LYS HGx 1.0 2.000 5.000 1575 1489 A 62 LEU HDx% A 45 ILE HG2% 1.0 1.601 2.825 1576 1490 A 45 ILE HG2% A 108 ILE HD1% 1.0 1.560 2.690 1577 1491 A 62 LEU HA A 45 ILE HG2% 1.0 1.856 3.998 1578 1492 A 87 HIS HD2 A 45 ILE HG2% 1.0 1.963 4.947 1579 1493 A 45 ILE HG1y A 45 ILE HA 1.0 1.941 4.679 1580 1494 A 45 ILE HG1x A 45 ILE HB 1.0 1.708 3.238 1581 1495 A 40 VAL HGy% A 45 ILE HD1% 1.0 1.876 4.134 1582 1496 A 62 LEU HA A 45 ILE HD1% 1.0 1.908 4.380 1583 1497 A 45 ILE HD1% A 87 HIS HD2 1.0 1.701 3.203 1584 1498 A 102 MET HA A 105 GLN HGx 1.0 2.000 5.000 1585 1499 A 102 MET HA A 102 MET HBx 1.0 1.607 2.847 1586 1500 A 102 MET HA A 102 MET HBy 1.0 1.622 2.898 1587 1501 A 98 ASP HA A 102 MET HBx 1.0 2.000 5.000 1588 1502 A 98 ASP HA A 102 MET HBy 1.0 1.981 5.243 1589 1503 A 99 ASN HA A 102 MET HBy 1.0 1.886 4.206 1590 1504 A 99 ASN HA A 102 MET HBx 1.0 1.735 3.355 1591 1505 A 102 MET HGy A 102 MET HBx 1.0 2.000 5.000 1592 1506 A 102 MET HBx A 102 MET HGx 1.0 1.569 2.715 1593 1507 A 102 MET HBy A 102 MET HGx 1.0 2.000 5.000 1594 1508 A 102 MET HGy A 102 MET HBy 1.0 1.519 2.559 1595 1509 A 102 MET HA A 102 MET HGy 1.0 1.726 3.310 1596 1510 A 102 MET HA A 102 MET HGx 1.0 1.733 3.345 1597 1511 A 99 ASN HA A 102 MET HGx 1.0 1.908 4.376 1598 1512 A 61 ARG HA A 88 MET HA 1.0 1.665 3.063 1599 1513 A 88 MET HA A 88 MET HBx 1.0 1.754 3.444 1600 1514 A 88 MET HA A 88 MET HBy 1.0 1.732 3.338 1601 1515 A 60 LEU HBy A 88 MET HA 1.0 1.955 4.855 1602 1516 A 61 ARG HGx A 88 MET HA 1.0 1.929 4.559 1603 1517 A 60 LEU HDy% A 88 MET HA 1.0 1.961 4.927 1604 1518 A 61 ARG HA A 88 MET HGx 1.0 1.859 4.015 1605 1519 A 61 ARG HA A 88 MET HGy 1.0 1.869 4.079 1606 1520 A 88 MET HA A 88 MET HGy 1.0 1.772 3.526 1607 1521 A 88 MET HA A 88 MET HGx 1.0 1.777 3.551 1608 1522 A 88 MET HGy A 88 MET HBy 1.0 1.675 3.101 1609 1523 A 88 MET HGx A 88 MET HBy 1.0 1.704 3.216 1610 1524 A 88 MET HGy A 88 MET HBx 1.0 2.000 5.000 1611 1525 A 88 MET HGx A 88 MET HBx 1.0 1.576 2.740 1612 1526 A 61 ARG HDy A 88 MET HGx 1.0 1.856 4.002 1613 1527 A 61 ARG HDx A 88 MET HGx 1.0 1.905 4.349 1614 1528 A 61 ARG HA A 88 MET HBx 1.0 1.946 4.740 1615 1529 A 61 ARG HA A 88 MET HBy 1.0 1.915 4.429 1616 1530 A 88 MET HBx A 88 MET HBy 1.0 1.542 2.630 1617 1531 A 61 ARG HDx A 88 MET HBy 1.0 1.967 5.005 1618 1532 A 61 ARG HDy A 88 MET HBy 1.0 1.955 4.843 1619 1533 A 82 PRO HDx A 81 VAL HA 1.0 1.600 2.824 1620 1534 A 81 VAL HGy% A 81 VAL HA 1.0 1.627 2.919 1621 1535 A 50 ALA HB% A 51 THR HA 1.0 1.918 4.464 1622 1536 A 80 VAL HGx% A 81 VAL HA 1.0 1.870 4.094 1623 1536 A 80 VAL HGy% A 81 VAL HA 1.0 1.870 4.094 1624 1537 A 81 VAL HGy% A 81 VAL HB 1.0 1.488 2.464 1625 1538 A 81 VAL HGx% A 71 LYS HE2 1.0 1.974 5.112 1626 1538 A 81 VAL HGx% A 71 LYS HE3 1.0 1.974 5.112 1627 1539 A 81 VAL HGx% A 81 VAL HA 1.0 2.000 5.000 1628 1540 A 81 VAL HGy% A 82 PRO HDy 1.0 1.766 3.500 1629 1541 A 81 VAL HGy% A 82 PRO HDx 1.0 1.701 3.205 1630 1542 A 81 VAL HGy% A 71 LYS HE2 1.0 1.981 5.235 1631 1542 A 81 VAL HGy% A 71 LYS HE3 1.0 1.981 5.235 1632 1543 A 81 VAL HGx% A 81 VAL HB 1.0 1.507 2.521 1633 1544 A 115 ASP HA A 115 ASP HBx 1.0 1.473 2.421 1634 1545 A 51 THR HB A 51 THR HA 1.0 1.646 2.988 1635 1546 A 51 THR HG2% A 51 THR HA 1.0 1.665 3.063 1636 1547 A 51 THR HB A 51 THR HG2% 1.0 1.594 2.804 1637 1548 A 50 ALA HB% A 51 THR HG2% 1.0 2.000 5.000 1638 1549 A 57 LYS HGy A 51 THR HG2% 1.0 1.883 4.179 1639 1550 A 57 LYS HBx A 51 THR HG2% 1.0 1.762 3.474 1640 1551 A 57 LYS HBy A 51 THR HG2% 1.0 1.801 3.677 1641 1552 A 51 THR HG2% A 59 MET HBx 1.0 1.775 3.545 1642 1553 A 51 THR HG2% A 59 MET HGy 1.0 1.869 4.083 1643 1554 A 52 PRO HDx A 51 THR HG2% 1.0 1.844 3.922 1644 1555 A 55 SER HBx A 51 THR HG2% 1.0 2.000 5.000 1645 1556 A 51 THR HG2% A 59 MET HA 1.0 1.949 4.769 1646 1557 A 23 SER HA A 23 SER HBy 1.0 1.637 2.955 1647 1558 A 23 SER HA A 23 SER HBx 1.0 1.625 2.909 1648 1559 A 22 VAL HA A 23 SER HBy 1.0 1.941 4.677 1649 1560 A 43 SER HA A 111 TYR HDy 1.0 1.809 3.719 1650 1560 A 43 SER HA A 111 TYR HDx 1.0 1.809 3.719 1651 1561 A 43 SER HBy A 43 SER HA 1.0 1.654 3.022 1652 1562 A 43 SER HBx A 43 SER HA 1.0 1.699 3.197 1653 1563 A 43 SER HBy A 43 SER HBx 1.0 1.647 2.995 1654 1564 A 24 PRO HBx A 43 SER HBy 1.0 1.912 4.410 1655 1565 A 43 SER HBy A 41 VAL HGx% 1.0 1.974 5.116 1656 1566 A 43 SER HBy A 111 TYR HDy 1.0 1.960 4.900 1657 1566 A 43 SER HBy A 111 TYR HDx 1.0 1.960 4.900 1658 1567 A 31 SER HBx A 31 SER HA 1.0 1.637 2.955 1659 1568 A 12 VAL HGy% A 31 SER HA 1.0 1.741 3.377 1660 1569 A 29 TRP HZ2 A 31 SER HA 1.0 1.892 4.252 1661 1570 A 29 TRP HH2 A 31 SER HA 1.0 1.923 4.515 1662 1571 A 29 TRP HZ3 A 31 SER HA 1.0 1.998 5.724 1663 1572 A 29 TRP HZ2 A 31 SER HBy 1.0 1.961 4.931 1664 1573 A 29 TRP HH2 A 31 SER HBy 1.0 1.874 4.118 1665 1574 A 29 TRP HZ3 A 31 SER HBy 1.0 1.971 5.057 1666 1575 A 31 SER HBx A 29 TRP HZ3 1.0 1.971 5.065 1667 1576 A 29 TRP HH2 A 31 SER HBx 1.0 1.893 4.257 1668 1577 A 31 SER HBy A 31 SER HA 1.0 1.692 3.166 1669 1578 A 31 SER HBx A 31 SER HBy 1.0 1.598 2.818 1670 1579 A 36 LYS HBx A 31 SER HBy 1.0 1.852 3.970 1671 1580 A 84 PRO HDy A 83 LYS HA 1.0 1.618 2.884 1672 1581 A 84 PRO HDx A 83 LYS HA 1.0 1.632 2.934 1673 1582 A 68 GLU HGx A 83 LYS HA 1.0 1.944 4.722 1674 1583 A 83 LYS HA A 84 PRO HGx 1.0 2.000 5.000 1675 1583 A 83 LYS HA A 84 PRO HGy 1.0 2.000 5.000 1676 1584 A 83 LYS HA A 83 LYS HBy 1.0 1.700 3.202 1677 1585 A 83 LYS HA A 83 LYS HBx 1.0 1.695 3.183 1678 1586 A 83 LYS HA A 83 LYS HGy 1.0 1.819 3.773 1679 1587 A 66 VAL HGy% A 83 LYS HA 1.0 1.923 4.509 1680 1588 A 84 PRO HDy A 83 LYS HBx 1.0 1.892 4.254 1681 1589 A 84 PRO HDx A 83 LYS HBx 1.0 1.865 4.055 1682 1590 A 83 LYS HBy A 83 LYS HBx 1.0 1.438 2.322 1683 1591 A 83 LYS HA A 83 LYS HGx 1.0 1.820 3.780 1684 1592 A 84 PRO HDy A 83 LYS HGy 1.0 1.963 4.947 1685 1593 A 84 PRO HDy A 83 LYS HGx 1.0 1.977 5.151 1686 1594 A 84 PRO HDx A 83 LYS HGx 1.0 1.939 4.669 1687 1595 A 84 PRO HDx A 83 LYS HGy 1.0 1.936 4.634 1688 1596 A 83 LYS HGy A 83 LYS HE3 1.0 1.832 3.848 1689 1596 A 83 LYS HE2 A 83 LYS HGy 1.0 1.832 3.848 1690 1597 A 83 LYS HGy A 83 LYS HBy 1.0 1.661 3.045 1691 1598 A 83 LYS HGy A 83 LYS HBx 1.0 2.000 5.000 1692 1599 A 83 LYS HGy A 83 LYS HGx 1.0 1.231 1.809 1693 1600 A 83 LYS HBx A 83 LYS HGx 1.0 2.000 5.000 1694 1601 A 83 LYS HBy A 83 LYS HGx 1.0 1.497 2.493 1695 1602 A 83 LYS HE2 A 83 LYS HBx 1.0 1.450 2.354 1696 1603 A 83 LYS HE2 A 83 LYS HBy 1.0 1.745 3.401 1697 1604 A 83 LYS HE2 A 83 LYS HGx 1.0 1.635 2.947 1698 1605 A 83 LYS HE2 A 83 LYS HGy 1.0 2.000 5.000 1699 1606 A 83 LYS HGx A 83 LYS HD2 1.0 1.468 2.404 1700 1607 A 83 LYS HGy A 83 LYS HD2 1.0 1.485 2.455 1701 1608 A 83 LYS HE2 A 83 LYS HD2 1.0 1.658 3.034 1702 1609 A 88 MET HE% A 88 MET HGy 1.0 2.000 5.000 1703 1610 A 88 MET HE% A 88 MET HGx 1.0 1.684 3.136 1704 1611 A 88 MET HE% A 88 MET HBy 1.0 1.716 3.268 1705 1612 A 102 MET HA A 102 MET HE% 1.0 1.905 4.349 1706 1613 A 58 MET HBx A 58 MET HE% 1.0 1.736 3.356 1707 1614 A 58 MET HE% A 58 MET HA 1.0 1.674 3.096 1708 1615 A 58 MET HBx A 58 MET HG2 1.0 1.756 3.450 1709 1616 A 58 MET HG2 A 58 MET HBy 1.0 1.772 3.530 1710 1617 A 58 MET HBx A 58 MET HA 1.0 1.774 3.540 1711 1618 A 58 MET HG2 A 58 MET HA 1.0 1.729 3.329 1712 1619 A 58 MET HA A 58 MET HBy 1.0 1.748 3.410 1713 1620 A 97 MET HE% A 94 ARG HA 1.0 1.832 3.850 1714 1621 A 97 MET HBy A 97 MET HGy 1.0 1.416 2.262 1715 1622 A 94 ARG HA A 97 MET HGy 1.0 1.771 3.519 1716 1623 A 97 MET HBy A 94 ARG HA 1.0 1.845 3.927 1717 1624 A 94 ARG HA A 97 MET HBx 1.0 2.000 5.000 1718 1625 A 97 MET HGy A 97 MET HBx 1.0 2.000 5.000 1719 1626 A 57 LYS HBy A 57 LYS HE2 1.0 1.905 4.349 1720 1627 A 57 LYS HBx A 57 LYS HE2 1.0 1.939 4.661 1721 1628 A 57 LYS HBy A 57 LYS HGx 1.0 1.598 2.818 1722 1629 A 57 LYS HBx A 57 LYS HGx 1.0 1.588 2.780 1723 1630 A 57 LYS HGy A 57 LYS HBx 1.0 1.407 2.237 1724 1631 A 57 LYS HGy A 57 LYS HBy 1.0 1.545 2.639 1725 1632 A 57 LYS HGy A 57 LYS HE2 1.0 1.560 2.686 1726 1633 A 57 LYS HGx A 57 LYS HE2 1.0 1.558 2.680 1727 1634 A 57 LYS HA A 57 LYS HDx 1.0 1.687 3.147 1728 1635 A 57 LYS HGy A 57 LYS HDx 1.0 2.000 5.000 1729 1636 A 57 LYS HGx A 57 LYS HDx 1.0 1.492 2.478 1730 1637 A 57 LYS HE2 A 57 LYS HDx 1.0 2.000 5.000 1731 1638 A 4 SER HBy A 4 SER HA 1.0 1.569 2.717 1732 1639 A 17 ALA HA A 4 SER HA 1.0 1.651 3.005 1733 1640 A 15 ILE HG2% A 4 SER HA 1.0 2.000 5.000 1734 1641 A 4 SER HA A 17 ALA HB% 1.0 2.000 5.000 1735 1642 A 5 GLY HAy A 96 VAL HGx% 1.0 1.770 3.518 1736 1643 A 7 ALA HB% A 27 LEU HDy% 1.0 2.000 5.000 1737 1644 A 8 ILE HG1x A 90 SER HBx 1.0 1.862 4.038 1738 1645 A 8 ILE HG1x A 90 SER HBy 1.0 1.890 4.234 1739 1646 A 8 ILE HA A 90 SER HBx 1.0 1.986 5.354 1740 1647 A 8 ILE HA A 90 SER HBy 1.0 1.983 5.275 1741 1648 A 8 ILE HG1y A 13 SER HBx 1.0 1.596 2.808 1742 1649 A 9 PHE HBy A 10 GLU HGx 1.0 2.000 5.000 1743 1650 A 8 ILE HG2% A 12 VAL HGx% 1.0 1.988 5.390 1744 1651 A 12 VAL HGy% A 36 LYS HBx 1.0 1.815 3.749 1745 1652 A 12 VAL HGx% A 36 LYS HBx 1.0 2.000 5.000 1746 1653 A 12 VAL HGy% A 31 SER HBy 1.0 1.695 3.179 1747 1654 A 12 VAL HGx% A 36 LYS HEy 1.0 1.858 4.008 1748 1655 A 6 ALA HA A 15 ILE HG1y 1.0 1.910 4.398 1749 1656 A 32 THR HG2% A 15 ILE HB 1.0 2.000 5.000 1750 1657 A 6 ALA HB% A 15 ILE HG2% 1.0 2.000 5.000 1751 1658 A 16 ILE HA A 29 TRP HA 1.0 1.667 3.067 1752 1659 A 16 ILE HG2% A 29 TRP HA 1.0 2.000 5.000 1753 1660 A 16 ILE HB A 29 TRP HA 1.0 1.910 4.390 1754 1661 A 29 TRP HD1 A 16 ILE HA 1.0 1.867 4.067 1755 1662 A 16 ILE HD1% A 100 ILE HD1% 1.0 2.000 5.000 1756 1663 A 29 TRP HBx A 16 ILE HG1x 1.0 1.927 4.545 1757 1664 A 18 ILE HB A 3 HIS HD2 1.0 1.839 3.891 1758 1665 A 18 ILE HG1x A 27 LEU HDx% 1.0 2.000 5.000 1759 1666 A 26 GLU HGy A 26 GLU HA 1.0 1.815 3.755 1760 1667 A 26 GLU HGx A 26 GLU HA 1.0 2.000 5.000 1761 1668 A 26 GLU HBx A 26 GLU HA 1.0 1.678 3.110 1762 1669 A 26 GLU HBy A 26 GLU HA 1.0 1.657 3.029 1763 1670 A 18 ILE HD1% A 27 LEU HG 1.0 2.000 5.000 1764 1671 A 3 HIS HBx A 18 ILE HD1% 1.0 1.771 3.525 1765 1672 A 3 HIS HBx A 18 ILE HG2% 1.0 1.910 4.392 1766 1673 A 3 HIS HBy A 18 ILE HG2% 1.0 1.944 4.712 1767 1674 A 18 ILE HG2% A 27 LEU HA 1.0 1.742 3.386 1768 1675 A 19 ASN HBx A 22 VAL HGy% 1.0 1.857 4.009 1769 1676 A 18 ILE HG2% A 19 ASN HA 1.0 1.891 4.247 1770 1677 A 18 ILE HA A 19 ASN HA 1.0 2.000 5.000 1771 1678 A 20 GLU HGy A 107 ILE HD1% 1.0 1.785 3.591 1772 1679 A 20 GLU HBy A 107 ILE HD1% 1.0 2.000 5.000 1773 1680 A 18 ILE HG2% A 20 GLU HBx 1.0 1.914 4.422 1774 1681 A 18 ILE HG2% A 20 GLU HBy 1.0 2.000 5.000 1775 1682 A 22 VAL HGx% A 21 ASP HBx 1.0 1.917 4.453 1776 1683 A 26 GLU HGx A 22 VAL HGx% 1.0 2.000 5.000 1777 1684 A 22 VAL HGx% A 25 ALA HA 1.0 2.000 5.000 1778 1685 A 22 VAL HGy% A 26 GLU HA 1.0 2.000 5.000 1779 1686 A 24 PRO HGx A 41 VAL HGx% 1.0 2.000 5.000 1780 1687 A 24 PRO HGy A 41 VAL HGx% 1.0 2.000 5.000 1781 1688 A 24 PRO HGx A 43 SER HBy 1.0 1.915 4.429 1782 1689 A 26 GLU HGx A 39 THR HG2% 1.0 2.000 5.000 1783 1690 A 26 GLU HBy A 39 THR HG2% 1.0 1.774 3.538 1784 1691 A 26 GLU HA A 39 THR HG2% 1.0 1.772 4.526 1785 1692 A 27 LEU HBx A 26 GLU HA 1.0 2.000 5.000 1786 1693 A 41 VAL HA A 26 GLU HA 1.0 1.699 3.199 1787 1694 A 18 ILE HA A 27 LEU HA 1.0 1.682 3.128 1788 1695 A 27 LEU HDy% A 40 VAL HGy% 1.0 2.000 5.000 1789 1696 A 40 VAL HGx% A 27 LEU HBy 1.0 1.818 3.770 1790 1697 A 27 LEU HBy A 42 LEU HDx% 1.0 1.809 3.717 1791 1698 A 18 ILE HG2% A 27 LEU HBx 1.0 2.000 5.000 1792 1699 A 27 LEU HDy% A 18 ILE HA 1.0 1.786 3.596 1793 1700 A 27 LEU HDx% A 38 HIS HD2 1.0 1.958 4.884 1794 1701 A 89 PHE HEy A 27 LEU HDy% 1.0 1.881 4.167 1795 1701 A 89 PHE HEx A 27 LEU HDy% 1.0 1.881 4.167 1796 1702 A 91 PHE HZ A 27 LEU HDy% 1.0 1.998 5.718 1797 1703 A 37 VAL HG2% A 30 ARG HBx 1.0 2.000 5.000 1798 1704 A 37 VAL HG2% A 30 ARG HBy 1.0 2.000 5.000 1799 1705 A 37 VAL HG2% A 30 ARG HDy 1.0 1.888 4.222 1800 1706 A 30 ARG HGy A 37 VAL HB 1.0 1.857 4.001 1801 1707 A 30 ARG HGx A 37 VAL HB 1.0 1.927 4.551 1802 1708 A 30 ARG HBy A 34 GLY HAy 1.0 1.948 4.758 1803 1709 A 30 ARG HBx A 37 VAL HA 1.0 1.874 4.116 1804 1710 A 30 ARG HBy A 37 VAL HA 1.0 2.000 5.000 1805 1711 A 29 TRP HE3 A 30 ARG HA 1.0 1.949 4.771 1806 1712 A 36 LYS HBy A 31 SER HA 1.0 2.000 5.000 1807 1713 A 36 LYS HBx A 31 SER HA 1.0 2.000 5.000 1808 1714 A 14 GLY HAy A 31 SER HBy 1.0 2.000 5.000 1809 1715 A 15 ILE HG1x A 32 THR HA 1.0 1.685 3.139 1810 1716 A 31 SER HBx A 34 GLY HAx 1.0 2.000 5.000 1811 1717 A 31 SER HBx A 34 GLY HAy 1.0 1.750 3.420 1812 1718 A 31 SER HBx A 36 LYS HD2 1.0 2.000 5.000 1813 1719 A 37 VAL HA A 38 HIS HBx 1.0 1.971 5.057 1814 1720 A 37 VAL HG2% A 39 THR HA 1.0 1.983 5.287 1815 1721 A 29 TRP HBy A 38 HIS HBy 1.0 1.910 4.392 1816 1722 A 39 THR HA A 38 HIS HA 1.0 2.000 5.000 1817 1723 A 37 VAL HA A 38 HIS HA 1.0 1.951 4.805 1818 1724 A 40 VAL HGx% A 62 LEU HDx% 1.0 1.689 3.155 1819 1725 A 40 VAL HGx% A 45 ILE HG2% 1.0 2.000 5.000 1820 1726 A 41 VAL HGy% A 41 VAL HGx% 1.0 2.000 5.000 1821 1727 A 40 VAL HGx% A 42 LEU HA 1.0 1.658 3.034 1822 1728 A 40 VAL HGx% A 42 LEU HG 1.0 2.000 5.000 1823 1729 A 25 ALA HB% A 42 LEU HDx% 1.0 2.000 5.000 1824 1730 A 24 PRO HBy A 43 SER HA 1.0 2.000 5.000 1825 1731 A 44 THR HA A 65 LYS HGy 1.0 1.970 5.052 1826 1732 A 44 THR HG2% A 65 LYS HDy 1.0 1.938 4.658 1827 1733 A 44 THR HA A 65 LYS HBy 1.0 1.963 4.951 1828 1734 A 40 VAL HGx% A 45 ILE HG1x 1.0 1.884 4.190 1829 1735 A 45 ILE HA A 65 LYS HGx 1.0 1.968 5.020 1830 1736 A 47 LYS HGx A 63 ILE HD1% 1.0 2.000 5.000 1831 1737 A 47 LYS HEx A 63 ILE HG2% 1.0 1.761 3.477 1832 1738 A 48 LEU HBy A 62 LEU HDx% 1.0 1.634 4.944 1833 1739 A 48 LEU HBy A 104 LEU HBy 1.0 1.918 4.468 1834 1740 A 48 LEU HBx A 104 LEU HBy 1.0 2.000 5.000 1835 1741 A 63 ILE HD1% A 49 GLN HBx 1.0 1.996 5.618 1836 1742 A 49 GLN HBx A 61 ARG HBx 1.0 1.692 3.168 1837 1743 A 47 LYS HBy A 49 GLN HGy 1.0 1.875 4.121 1838 1744 A 57 LYS HBx A 51 THR HA 1.0 1.969 5.031 1839 1745 A 51 THR HB A 59 MET HBy 1.0 1.950 4.794 1840 1746 A 51 THR HB A 52 PRO HDx 1.0 1.767 3.501 1841 1747 A 51 THR HB A 55 SER HBx 1.0 1.744 3.392 1842 1748 A 55 SER HBx A 51 THR HA 1.0 2.000 5.000 1843 1749 A 51 THR HB A 55 SER HBy 1.0 1.653 3.013 1844 1750 A 55 SER HBy A 51 THR HA 1.0 1.864 4.052 1845 1751 A 52 PRO HA A 52 PRO HBy 1.0 1.637 2.955 1846 1752 A 52 PRO HBx A 52 PRO HA 1.0 1.653 3.017 1847 1753 A 52 PRO HBx A 52 PRO HBy 1.0 1.534 2.606 1848 1754 A 52 PRO HGy A 52 PRO HBy 1.0 1.710 3.244 1849 1755 A 52 PRO HBx A 52 PRO HGy 1.0 1.429 2.295 1850 1756 A 52 PRO HGy A 52 PRO HA 1.0 1.848 3.946 1851 1757 A 52 PRO HGy A 52 PRO HDx 1.0 1.756 3.450 1852 1758 A 52 PRO HGy A 52 PRO HDy 1.0 1.689 3.155 1853 1759 A 52 PRO HA A 52 PRO HDy 1.0 1.892 4.252 1854 1760 A 52 PRO HBx A 52 PRO HDy 1.0 1.897 4.287 1855 1761 A 52 PRO HDx A 52 PRO HBy 1.0 1.948 4.772 1856 1762 A 52 PRO HBy A 52 PRO HDy 1.0 1.890 4.236 1857 1763 A 52 PRO HDx A 52 PRO HDy 1.0 1.599 2.821 1858 1764 A 52 PRO HDx A 52 PRO HA 1.0 2.000 5.000 1859 1765 A 52 PRO HBx A 52 PRO HDx 1.0 1.824 3.802 1860 1766 A 51 THR HG2% A 52 PRO HDy 1.0 2.000 5.000 1861 1767 A 57 LYS HGy A 55 SER HBy 1.0 2.000 5.000 1862 1768 A 57 LYS HBx A 55 SER HBy 1.0 1.902 4.330 1863 1769 A 57 LYS HBy A 55 SER HBy 1.0 2.000 5.000 1864 1770 A 51 THR HG2% A 57 LYS HGx 1.0 1.973 5.105 1865 1771 A 51 THR HG2% A 57 LYS HE2 1.0 2.000 5.000 1866 1772 A 57 LYS HA A 51 THR HG2% 1.0 1.844 3.918 1867 1773 A 51 THR HG2% A 57 LYS HDx 1.0 2.000 5.000 1868 1774 A 57 LYS HA A 59 MET HE% 1.0 1.856 4.002 1869 1775 A 57 LYS HE2 A 59 MET HE% 1.0 1.725 3.311 1870 1776 A 57 LYS HBx A 59 MET HBy 1.0 1.860 4.024 1871 1777 A 57 LYS HBy A 59 MET HBy 1.0 2.000 5.000 1872 1778 A 57 LYS HBy A 59 MET HE% 1.0 1.650 3.004 1873 1779 A 57 LYS HGy A 59 MET HE% 1.0 1.736 3.354 1874 1780 A 59 MET HE% A 57 LYS HDx 1.0 2.000 5.000 1875 1781 A 56 GLU HBy A 57 LYS HGx 1.0 1.940 4.672 1876 1782 A 56 GLU HBx A 57 LYS HGx 1.0 1.947 4.747 1877 1783 A 57 LYS HGy A 56 GLU HBx 1.0 1.971 5.063 1878 1784 A 56 GLU HBy A 57 LYS HDx 1.0 1.748 3.408 1879 1785 A 56 GLU HBx A 57 LYS HDx 1.0 1.827 3.817 1880 1786 A 57 LYS HA A 56 GLU HA 1.0 2.000 5.000 1881 1787 A 57 LYS HBy A 51 THR HB 1.0 1.758 3.462 1882 1788 A 57 LYS HBx A 51 THR HB 1.0 1.799 3.663 1883 1789 A 96 VAL HGy% A 58 MET HE% 1.0 2.000 5.000 1884 1790 A 94 ARG HGx A 58 MET HE% 1.0 2.000 5.000 1885 1791 A 94 ARG HGy A 58 MET HE% 1.0 1.667 3.067 1886 1792 A 58 MET HE% A 94 ARG HBy 1.0 2.000 5.000 1887 1793 A 57 LYS HBy A 58 MET HA 1.0 1.987 5.365 1888 1794 A 57 LYS HBx A 58 MET HA 1.0 1.974 5.118 1889 1795 A 58 MET HE% A 94 ARG HBx 1.0 2.000 5.000 1890 1796 A 91 PHE HBx A 58 MET HBy 1.0 1.953 4.821 1891 1797 A 58 MET HBx A 91 PHE HBx 1.0 1.955 4.853 1892 1798 A 91 PHE HBx A 58 MET HE% 1.0 1.860 4.024 1893 1799 A 93 ASN HBx A 58 MET HE% 1.0 2.000 5.000 1894 1800 A 58 MET HE% A 93 ASN HBy 1.0 2.000 5.000 1895 1801 A 91 PHE HBy A 58 MET HBy 1.0 1.969 5.023 1896 1802 A 58 MET HBx A 91 PHE HBy 1.0 1.978 5.172 1897 1803 A 91 PHE HBy A 58 MET HE% 1.0 1.946 4.742 1898 1804 A 58 MET HE% A 94 ARG HA 1.0 1.804 3.690 1899 1805 A 59 MET HA A 58 MET HE% 1.0 2.000 5.000 1900 1806 A 91 PHE HDy A 58 MET HE% 1.0 1.913 4.421 1901 1806 A 91 PHE HDx A 58 MET HE% 1.0 1.913 4.421 1902 1807 A 57 LYS HGx A 59 MET HE% 1.0 1.766 3.500 1903 1808 A 97 MET HE% A 59 MET HA 1.0 1.996 5.632 1904 1809 A 59 MET HBx A 59 MET HGx 1.0 1.683 3.131 1905 1810 A 59 MET HE% A 88 MET HGx 1.0 1.773 3.535 1906 1811 A 59 MET HBy A 88 MET HGx 1.0 1.888 4.218 1907 1812 A 59 MET HGy A 88 MET HGx 1.0 2.000 5.000 1908 1813 A 50 ALA HB% A 60 LEU HBx 1.0 1.980 5.216 1909 1814 A 50 ALA HB% A 60 LEU HBy 1.0 1.987 5.359 1910 1815 A 60 LEU HDx% A 98 ASP HA 1.0 1.988 5.386 1911 1816 A 91 PHE HZ A 91 PHE HEy 1.0 2.000 5.980 1912 1816 A 91 PHE HZ A 91 PHE HEx 1.0 2.000 5.980 1913 1817 A 91 PHE HDx A 91 PHE HEy 1.0 1.993 6.479 1914 1817 A 91 PHE HDy A 91 PHE HEy 1.0 1.993 6.479 1915 1817 A 91 PHE HDy A 91 PHE HEx 1.0 1.993 6.479 1916 1817 A 91 PHE HDx A 91 PHE HEx 1.0 1.993 6.479 1917 1818 A 63 ILE HD1% A 61 ARG HGy 1.0 2.000 5.000 1918 1819 A 63 ILE HD1% A 61 ARG HGx 1.0 2.000 5.000 1919 1820 A 88 MET HGx A 61 ARG HGy 1.0 1.968 5.018 1920 1821 A 48 LEU HA A 62 LEU HBy 1.0 2.000 5.000 1921 1822 A 82 PRO HDx A 72 ARG HBy 1.0 1.936 4.632 1922 1823 A 43 SER HBx A 111 TYR HDy 1.0 1.991 5.475 1923 1823 A 43 SER HBx A 111 TYR HDx 1.0 1.991 5.475 1924 1824 A 24 PRO HBx A 43 SER HBx 1.0 1.906 4.362 1925 1825 A 26 GLU HA A 42 LEU HDy% 1.0 1.856 4.000 1926 1826 A 105 GLN HA A 48 LEU HDx% 1.0 1.844 3.922 1927 1827 A 111 TYR HEx A 42 LEU HDy% 1.0 1.970 5.052 1928 1827 A 111 TYR HEy A 42 LEU HDy% 1.0 1.970 5.052 1929 1828 A 104 LEU HA A 48 LEU HDx% 1.0 2.000 5.000 1930 1829 A 48 LEU HDy% A 108 ILE HG1y 1.0 2.000 5.000 1931 1830 A 48 LEU HDy% A 104 LEU HBx 1.0 1.580 2.754 1932 1831 A 48 LEU HDy% A 105 GLN HBy 1.0 2.000 5.000 1933 1832 A 48 LEU HDy% A 101 LYS HE3 1.0 1.984 5.300 1934 1832 A 48 LEU HDy% A 101 LYS HE2 1.0 1.984 5.300 1935 1833 A 42 LEU HBy A 42 LEU HDy% 1.0 1.677 3.107 1936 1834 A 42 LEU HDy% A 42 LEU HBx 1.0 1.711 3.247 1937 1835 A 48 LEU HBy A 48 LEU HDx% 1.0 2.000 5.000 1938 1836 A 48 LEU HG A 48 LEU HDx% 1.0 1.642 2.974 1939 1837 A 48 LEU HDy% A 48 LEU HDx% 1.0 1.666 3.066 1940 1838 A 40 VAL HGx% A 42 LEU HDy% 1.0 1.971 5.059 1941 1839 A 89 PHE HEy A 48 LEU HDy% 1.0 2.000 5.000 1942 1839 A 89 PHE HEx A 48 LEU HDy% 1.0 2.000 5.000 1943 1840 A 48 LEU HBx A 105 GLN HA 1.0 1.988 5.384 1944 1841 A 87 HIS HA A 62 LEU HBy 1.0 1.995 5.615 1945 1842 A 104 LEU HBx A 48 LEU HDx% 1.0 1.745 3.399 1946 1843 A 16 ILE HD1% A 104 LEU HDx% 1.0 1.989 5.415 1947 1844 A 15 ILE HG2% A 4 SER HBy 1.0 2.000 5.000 1948 1845 A 103 THR HA A 103 THR HG2% 1.0 1.552 2.660 1949 1846 A 45 ILE HD1% A 87 HIS HBy 1.0 1.990 5.432 1950 1847 A 89 PHE HEy A 89 PHE HBx 1.0 1.963 4.959 1951 1847 A 89 PHE HEx A 89 PHE HBx 1.0 1.963 4.959 1952 1848 A 89 PHE HZ A 38 HIS HD2 1.0 1.848 8.352 1953 1849 A 91 PHE HEy A 91 PHE HBx 1.0 1.974 5.112 1954 1849 A 91 PHE HEx A 91 PHE HBx 1.0 1.974 5.112 1955 1850 A 91 PHE HEy A 91 PHE HBy 1.0 1.986 5.330 1956 1850 A 91 PHE HEx A 91 PHE HBy 1.0 1.986 5.330 1957 1851 A 29 TRP HZ2 A 31 SER HBx 1.0 1.972 5.072 1958 1852 A 40 VAL HGx% A 87 HIS HE1 1.0 1.998 5.770 1959 1853 A 27 LEU HA A 18 ILE HG1y 1.0 1.960 4.906 1960 1854 A 18 ILE HA A 18 ILE HG1y 1.0 1.875 4.127 1961 1855 A 18 ILE HG1x A 18 ILE HG1y 1.0 1.692 3.170 1962 1856 A 97 MET HE% A 91 PHE HA 1.0 2.000 5.000 1963 1857 A 97 MET HE% A 58 MET HA 1.0 1.752 3.430 1964 1858 A 97 MET HE% A 91 PHE HBy 1.0 1.896 4.284 1965 1859 A 97 MET HE% A 94 ARG HDy 1.0 1.949 4.777 1966 1860 A 91 PHE HDx A 97 MET HE% 1.0 1.966 4.990 1967 1860 A 91 PHE HDy A 97 MET HE% 1.0 1.966 4.990 1968 1861 A 111 TYR HDx A 107 ILE HG2% 1.0 1.840 3.902 1969 1861 A 111 TYR HDy A 107 ILE HG2% 1.0 1.840 3.902 1970 1862 A 111 TYR HEx A 107 ILE HG2% 1.0 1.668 3.072 1971 1862 A 111 TYR HEy A 107 ILE HG2% 1.0 1.668 3.072 1972 1863 A 104 LEU HA A 107 ILE HG2% 1.0 1.829 3.829 1973 1864 A 91 PHE HZ A 60 LEU HBx 1.0 1.986 5.332 1974 1865 A 91 PHE HZ A 60 LEU HBy 1.0 1.977 5.173 1975 1866 A 91 PHE HDy A 60 LEU HBy 1.0 1.999 5.835 1976 1866 A 91 PHE HDx A 60 LEU HBy 1.0 1.999 5.835 1977 1867 A 113 ASP HBy A 110 ARG HA 1.0 2.000 5.000 1978 1868 A 113 ASP HBx A 110 ARG HA 1.0 1.878 4.152 1979 1869 A 113 ASP HBx A 113 ASP HA 1.0 2.000 5.000 1980 1870 A 113 ASP HBy A 113 ASP HA 1.0 2.000 5.000 1981 1871 A 83 LYS HA A 84 PRO HGy 1.0 2.000 5.000 1982 1872 A 69 SER HA A 71 LYS HGx 1.0 1.984 5.296 1983 1873 A 71 LYS HA A 71 LYS HBx 1.0 1.689 3.157 1984 1874 A 71 LYS HE2 A 71 LYS HBx 1.0 1.902 4.328 1985 1875 A 71 LYS HGx A 71 LYS HBx 1.0 1.699 3.197 1986 1876 A 71 LYS HGy A 71 LYS HBx 1.0 1.492 2.474 1987 1877 A 80 VAL HGy% A 78 ASN HBy 1.0 1.999 5.773 1988 1878 A 7 ALA HB% A 89 PHE HDx 1.0 1.746 3.404 1989 1878 A 7 ALA HB% A 89 PHE HDy 1.0 1.746 3.404 1990 1879 A 59 MET HE% A 61 ARG HDy 1.0 1.925 4.525 1991 1880 A 52 PRO HDx A 52 PRO HGx 1.0 1.783 3.581 1992 1881 A 52 PRO HA A 52 PRO HGx 1.0 1.815 3.755 1993 1882 A 52 PRO HDy A 52 PRO HGx 1.0 1.652 3.010 1994 1883 A 52 PRO HBy A 52 PRO HGx 1.0 1.713 3.255 1995 1884 A 97 MET HA A 100 ILE HG1x 1.0 1.776 3.550 1996 1885 A 97 MET HA A 97 MET HBy 1.0 1.688 3.152 1997 1886 A 91 PHE HZ A 97 MET HA 1.0 1.981 5.223 1998 1887 A 91 PHE HDy A 97 MET HA 1.0 1.949 4.779 1999 1887 A 91 PHE HDx A 97 MET HA 1.0 1.949 4.779 2000 1888 A 91 PHE HEy A 97 MET HA 1.0 1.938 4.652 2001 1888 A 91 PHE HEx A 97 MET HA 1.0 1.938 4.652 2002 1889 A 90 SER HBx A 58 MET HBy 1.0 1.968 5.020 2003 1890 A 61 ARG HDx A 88 MET HE% 1.0 1.871 4.097 2004 1891 A 61 ARG HDy A 88 MET HE% 1.0 1.857 4.007 2005 1892 A 59 MET HGy A 88 MET HE% 1.0 1.818 3.766 2006 1893 A 59 MET HBx A 88 MET HE% 1.0 1.722 3.296 2007 1894 A 91 PHE HDy A 97 MET HBy 1.0 1.952 4.810 2008 1894 A 91 PHE HDx A 97 MET HBy 1.0 1.952 4.810 2009 1895 A 91 PHE HDy A 100 ILE HG1x 1.0 1.998 5.722 2010 1895 A 91 PHE HDx A 100 ILE HG1x 1.0 1.998 5.722 2011 1896 A 1 PRO HBy A 1 PRO HBx 1.0 1.854 3.984 2012 1897 A 91 PHE HDy A 90 SER HBy 1.0 1.989 5.435 2013 1897 A 91 PHE HDx A 90 SER HBy 1.0 1.989 5.435 2014 1898 A 22 VAL HGy% A 23 SER HBx 1.0 1.963 4.957 2015 1899 A 29 TRP HBy A 38 HIS HBx 1.0 1.946 4.746 2016 1900 A 38 HIS HD2 A 38 HIS HBx 1.0 1.970 5.064 2017 1901 A 9 PHE HEy A 38 HIS HBx 1.0 1.968 5.020 2018 1901 A 9 PHE HEx A 38 HIS HBx 1.0 1.968 5.020 2019 1902 A 9 PHE HDy A 38 HIS HBy 1.0 1.994 5.544 2020 1902 A 9 PHE HDx A 38 HIS HBy 1.0 1.994 5.544 2021 1903 A 29 TRP HE3 A 38 HIS HBx 1.0 1.921 4.489 2022 1904 A 38 HIS HA A 38 HIS HBx 1.0 1.724 3.302 2023 1905 A 37 VAL HA A 38 HIS HBy 1.0 1.993 5.523 2024 1906 A 89 PHE HEy A 40 VAL HGx% 1.0 1.875 4.129 2025 1906 A 89 PHE HEx A 40 VAL HGx% 1.0 1.875 4.129 2026 1907 A 40 VAL HA A 87 HIS HE1 1.0 1.998 5.706 2027 1908 A 99 ASN HA A 102 MET HE% 1.0 1.811 3.731 2028 1909 A 53 ALA HB% A 94 ARG HDy 1.0 1.894 4.264 2029 1910 A 111 TYR HEy A 43 SER HBx 1.0 1.998 5.794 2030 1910 A 111 TYR HEx A 43 SER HBx 1.0 1.998 5.794 2031 1911 A 111 TYR HEy A 43 SER HBy 1.0 1.999 5.809 2032 1911 A 111 TYR HEx A 43 SER HBy 1.0 1.999 5.809 2033 1912 A 111 TYR HEy A 42 LEU HDx% 1.0 1.987 5.369 2034 1912 A 111 TYR HEx A 42 LEU HDx% 1.0 1.987 5.369 2035 1913 A 42 LEU HDy% A 40 VAL HGy% 1.0 2.000 5.000 2036 1914 A 2 SER H A 1 PRO HA 1.0 1.852 3.974 2037 1915 A 4 SER HA A 4 SER H 1.0 1.821 3.785 2038 1916 A 3 HIS HA A 4 SER H 1.0 1.760 3.466 2039 1917 A 4 SER HBy A 4 SER H 1.0 1.789 3.611 2040 1918 A 3 HIS HBx A 4 SER H 1.0 1.981 5.225 2041 1919 A 3 HIS HBy A 4 SER H 1.0 1.957 4.871 2042 1920 A 100 ILE HD1% A 4 SER H 1.0 1.882 4.172 2043 1921 A 16 ILE HG2% A 4 SER H 1.0 1.954 4.824 2044 1922 A 16 ILE HG2% A 5 GLY H 1.0 1.721 3.291 2045 1923 A 16 ILE HB A 5 GLY H 1.0 1.899 4.303 2046 1924 A 4 SER HA A 5 GLY H 1.0 1.631 2.933 2047 1925 A 5 GLY HAy A 5 GLY H 1.0 1.804 3.692 2048 1926 A 5 GLY HAx A 5 GLY H 1.0 1.817 3.761 2049 1927 A 5 GLY H A 4 SER HBx 1.0 2.000 5.000 2050 1928 A 6 ALA HA A 6 ALA H 1.0 1.792 3.626 2051 1929 A 5 GLY HAy A 6 ALA H 1.0 1.648 2.998 2052 1930 A 5 GLY HAx A 6 ALA H 1.0 2.000 5.000 2053 1931 A 6 ALA HB% A 6 ALA H 1.0 2.000 5.000 2054 1932 A 96 VAL HGx% A 6 ALA H 1.0 1.809 3.715 2055 1933 A 15 ILE HD1% A 6 ALA H 1.0 1.915 4.433 2056 1934 A 15 ILE HD1% A 7 ALA H 1.0 1.846 3.934 2057 1935 A 7 ALA HB% A 7 ALA H 1.0 1.784 3.586 2058 1936 A 6 ALA HB% A 7 ALA H 1.0 1.700 3.200 2059 1937 A 7 ALA HA A 7 ALA H 1.0 1.805 3.697 2060 1938 A 15 ILE HA A 7 ALA H 1.0 1.768 3.508 2061 1939 A 6 ALA HA A 7 ALA H 1.0 1.564 2.702 2062 1940 A 7 ALA H A 16 ILE H 1.0 1.862 4.036 2063 1941 A 7 ALA H A 15 ILE H 1.0 2.000 5.000 2064 1942 A 5 GLY H A 6 ALA H 1.0 1.907 4.369 2065 1943 A 17 ALA HB% A 5 GLY H 1.0 1.941 4.681 2066 1944 A 100 ILE HD1% A 5 GLY H 1.0 1.932 4.592 2067 1945 A 4 SER H A 5 GLY H 1.0 1.948 4.766 2068 1946 A 2 SER H A 2 SER HA 1.0 1.942 4.692 2069 1947 A 8 ILE HB A 8 ILE H 1.0 1.753 3.437 2070 1948 A 8 ILE HG1x A 8 ILE H 1.0 1.884 4.184 2071 1949 A 7 ALA HB% A 8 ILE H 1.0 1.767 3.507 2072 1950 A 8 ILE HG2% A 8 ILE H 1.0 1.915 4.431 2073 1951 A 8 ILE HD1% A 8 ILE H 1.0 1.915 4.433 2074 1952 A 8 ILE HA A 8 ILE H 1.0 1.891 4.243 2075 1953 A 7 ALA HA A 8 ILE H 1.0 1.688 3.152 2076 1954 A 90 SER HBx A 8 ILE H 1.0 1.939 4.667 2077 1955 A 9 PHE H A 11 LYS H 1.0 1.857 4.001 2078 1956 A 29 TRP HZ2 A 9 PHE H 1.0 1.864 4.052 2079 1957 A 8 ILE HA A 9 PHE H 1.0 1.663 3.053 2080 1958 A 13 SER HA A 9 PHE H 1.0 1.908 4.374 2081 1959 A 9 PHE HA A 9 PHE H 1.0 1.869 4.081 2082 1960 A 8 ILE HG1x A 9 PHE H 1.0 2.000 5.000 2083 1961 A 9 PHE HBy A 9 PHE H 1.0 1.860 4.024 2084 1962 A 8 ILE HG2% A 9 PHE H 1.0 1.770 3.520 2085 1963 A 9 PHE HBx A 9 PHE H 1.0 1.877 4.141 2086 1964 A 10 GLU HBx A 10 GLU H 1.0 1.898 4.292 2087 1965 A 10 GLU HBy A 10 GLU H 1.0 1.866 4.064 2088 1966 A 10 GLU HGy A 10 GLU H 1.0 1.834 3.864 2089 1967 A 10 GLU HGx A 10 GLU H 1.0 1.848 3.944 2090 1968 A 8 ILE HG2% A 10 GLU H 1.0 1.946 4.740 2091 1969 A 9 PHE HA A 10 GLU H 1.0 1.670 3.082 2092 1970 A 10 GLU HA A 10 GLU H 1.0 1.648 2.998 2093 1971 A 9 PHE HDy A 10 GLU H 1.0 1.888 4.216 2094 1971 A 9 PHE HDx A 10 GLU H 1.0 1.888 4.216 2095 1972 A 11 LYS H A 10 GLU H 1.0 1.832 3.850 2096 1973 A 11 LYS HA A 11 LYS H 1.0 1.612 2.866 2097 1974 A 10 GLU HA A 11 LYS H 1.0 1.722 3.296 2098 1975 A 11 LYS HBy A 11 LYS H 1.0 1.902 4.326 2099 1976 A 11 LYS HBx A 11 LYS H 1.0 1.878 4.142 2100 1977 A 10 GLU HBx A 11 LYS H 1.0 1.886 4.204 2101 1978 A 10 GLU HBy A 11 LYS H 1.0 2.000 5.000 2102 1979 A 10 GLU HGy A 11 LYS H 1.0 1.964 4.966 2103 1980 A 8 ILE HG2% A 11 LYS H 1.0 1.735 3.353 2104 1981 A 12 VAL HGx% A 12 VAL H 1.0 1.666 3.064 2105 1982 A 8 ILE HG2% A 12 VAL H 1.0 1.741 3.379 2106 1983 A 12 VAL HGy% A 12 VAL H 1.0 1.833 3.855 2107 1984 A 12 VAL HB A 12 VAL H 1.0 1.660 3.040 2108 1985 A 11 LYS HA A 12 VAL H 1.0 1.877 4.139 2109 1986 A 12 VAL HA A 12 VAL H 1.0 1.760 3.472 2110 1987 A 9 PHE H A 12 VAL H 1.0 1.831 3.843 2111 1988 A 12 VAL H A 13 SER H 1.0 1.927 4.541 2112 1989 A 13 SER HA A 13 SER H 1.0 1.826 3.812 2113 1990 A 12 VAL HA A 13 SER H 1.0 1.544 2.638 2114 1991 A 13 SER H A 13 SER HBy 1.0 1.658 3.032 2115 1992 A 12 VAL HGy% A 13 SER H 1.0 1.708 3.232 2116 1993 A 12 VAL HGx% A 13 SER H 1.0 2.000 5.000 2117 1994 A 8 ILE HA A 14 GLY H 1.0 1.803 3.683 2118 1995 A 13 SER HA A 14 GLY H 1.0 1.594 2.802 2119 1996 A 14 GLY HAy A 14 GLY H 1.0 1.845 3.923 2120 1997 A 14 GLY HAx A 14 GLY H 1.0 1.798 3.660 2121 1998 A 13 SER HBy A 14 GLY H 1.0 2.000 5.000 2122 1999 A 8 ILE HG1x A 14 GLY H 1.0 1.903 4.333 2123 2000 A 8 ILE HG1y A 14 GLY H 1.0 1.917 4.455 2124 2001 A 8 ILE HD1% A 14 GLY H 1.0 1.938 4.658 2125 2002 A 15 ILE HB A 15 ILE H 1.0 1.741 3.379 2126 2003 A 15 ILE HG1x A 15 ILE H 1.0 1.936 4.634 2127 2004 A 15 ILE HG1y A 15 ILE H 1.0 1.921 4.485 2128 2005 A 15 ILE HD1% A 15 ILE H 1.0 1.848 3.948 2129 2006 A 15 ILE HA A 15 ILE H 1.0 1.853 3.981 2130 2007 A 14 GLY HAy A 15 ILE H 1.0 1.754 3.440 2131 2008 A 14 GLY HAx A 15 ILE H 1.0 1.694 3.176 2132 2009 A 15 ILE H A 32 THR H 1.0 1.925 4.529 2133 2010 A 15 ILE H A 29 TRP HE1 1.0 1.919 4.477 2134 2011 A 5 GLY H A 16 ILE H 1.0 1.847 3.939 2135 2012 A 16 ILE HA A 16 ILE H 1.0 1.821 3.783 2136 2013 A 15 ILE HA A 16 ILE H 1.0 1.683 3.133 2137 2014 A 16 ILE HB A 16 ILE H 1.0 1.780 3.564 2138 2015 A 15 ILE HG2% A 16 ILE H 1.0 1.696 3.184 2139 2016 A 17 ALA HB% A 17 ALA H 1.0 1.745 3.397 2140 2017 A 16 ILE HG2% A 17 ALA H 1.0 1.765 3.495 2141 2018 A 29 TRP HA A 17 ALA H 1.0 1.878 4.142 2142 2019 A 17 ALA HA A 17 ALA H 1.0 1.840 3.894 2143 2020 A 16 ILE HA A 17 ALA H 1.0 1.648 2.994 2144 2021 A 17 ALA H A 28 THR H 1.0 1.861 4.031 2145 2022 A 17 ALA HA A 18 ILE H 1.0 1.654 3.018 2146 2023 A 18 ILE HA A 18 ILE H 1.0 1.891 4.245 2147 2024 A 18 ILE HG1x A 18 ILE H 1.0 1.846 3.932 2148 2025 A 17 ALA HB% A 18 ILE H 1.0 1.742 3.382 2149 2026 A 18 ILE HG2% A 18 ILE H 1.0 1.852 3.968 2150 2027 A 18 ILE HD1% A 18 ILE H 1.0 2.000 5.000 2151 2028 A 19 ASN HA A 19 ASN H 1.0 1.791 3.623 2152 2029 A 18 ILE HA A 19 ASN H 1.0 1.655 3.021 2153 2030 A 19 ASN HBy A 19 ASN H 1.0 1.831 3.843 2154 2031 A 19 ASN HBx A 19 ASN H 1.0 1.824 3.802 2155 2032 A 18 ILE HG1x A 19 ASN H 1.0 1.894 4.260 2156 2033 A 18 ILE HD1% A 19 ASN H 1.0 2.000 5.000 2157 2034 A 18 ILE HG2% A 19 ASN H 1.0 1.796 3.646 2158 2035 A 19 ASN H A 20 GLU H 1.0 1.964 4.962 2159 2036 A 19 ASN HA A 20 GLU H 1.0 1.615 2.873 2160 2037 A 20 GLU HA A 20 GLU H 1.0 1.862 4.042 2161 2038 A 19 ASN HBy A 20 GLU H 1.0 1.996 5.640 2162 2039 A 19 ASN HBx A 20 GLU H 1.0 1.950 4.788 2163 2040 A 20 GLU HBx A 20 GLU H 1.0 1.886 4.206 2164 2041 A 20 GLU HGy A 20 GLU H 1.0 1.884 4.194 2165 2042 A 20 GLU HBy A 20 GLU H 1.0 1.812 3.738 2166 2043 A 22 VAL HGy% A 20 GLU H 1.0 1.972 5.072 2167 2044 A 22 VAL HGy% A 21 ASP H 1.0 1.866 4.064 2168 2045 A 20 GLU HBy A 21 ASP H 1.0 1.907 4.371 2169 2046 A 21 ASP HBy A 21 ASP H 1.0 2.000 5.000 2170 2047 A 21 ASP HBx A 21 ASP H 1.0 1.760 3.468 2171 2048 A 21 ASP HA A 21 ASP H 1.0 1.744 3.394 2172 2049 A 20 GLU HA A 21 ASP H 1.0 1.843 3.917 2173 2050 A 20 GLU H A 21 ASP H 1.0 2.000 5.000 2174 2051 A 20 GLU H A 22 VAL H 1.0 1.898 4.300 2175 2052 A 21 ASP H A 22 VAL H 1.0 1.618 2.886 2176 2053 A 22 VAL H A 23 SER H 1.0 1.910 4.388 2177 2054 A 20 GLU HA A 22 VAL H 1.0 1.844 3.922 2178 2055 A 21 ASP HA A 22 VAL H 1.0 1.770 3.514 2179 2056 A 25 ALA HA A 22 VAL H 1.0 1.939 4.663 2180 2057 A 22 VAL HA A 22 VAL H 1.0 1.715 3.267 2181 2058 A 21 ASP HBy A 22 VAL H 1.0 1.842 3.906 2182 2059 A 21 ASP HBx A 22 VAL H 1.0 1.882 4.176 2183 2060 A 22 VAL HB A 22 VAL H 1.0 1.799 3.667 2184 2061 A 39 THR HG2% A 22 VAL H 1.0 0.000 16.547 2185 2062 A 22 VAL HGx% A 22 VAL H 1.0 1.575 2.737 2186 2063 A 23 SER HA A 23 SER H 1.0 1.786 3.594 2187 2064 A 22 VAL HA A 23 SER H 1.0 2.000 5.000 2188 2065 A 23 SER HBy A 23 SER H 1.0 1.735 3.355 2189 2066 A 23 SER HBx A 23 SER H 1.0 1.768 3.508 2190 2067 A 22 VAL HB A 23 SER H 1.0 1.635 2.945 2191 2068 A 22 VAL HGx% A 23 SER H 1.0 2.000 5.000 2192 2069 A 25 ALA HA A 25 ALA H 1.0 1.791 3.621 2193 2070 A 24 PRO HBy A 25 ALA H 1.0 1.862 4.036 2194 2071 A 24 PRO HBx A 25 ALA H 1.0 2.000 5.000 2195 2072 A 25 ALA HB% A 25 ALA H 1.0 1.649 3.001 2196 2073 A 22 VAL HGy% A 25 ALA H 1.0 1.949 4.781 2197 2074 A 22 VAL HGy% A 26 GLU H 1.0 1.772 3.526 2198 2075 A 25 ALA HB% A 26 GLU H 1.0 1.743 3.385 2199 2076 A 26 GLU HBy A 26 GLU H 1.0 1.799 3.669 2200 2077 A 26 GLU HBx A 26 GLU H 1.0 1.831 3.843 2201 2078 A 26 GLU HGx A 26 GLU H 1.0 1.942 4.690 2202 2079 A 26 GLU HGy A 26 GLU H 1.0 1.915 4.433 2203 2080 A 19 ASN HBx A 26 GLU H 1.0 1.957 4.861 2204 2081 A 19 ASN HBy A 26 GLU H 1.0 1.913 4.423 2205 2082 A 25 ALA HA A 26 GLU H 1.0 1.609 2.855 2206 2083 A 20 GLU HA A 26 GLU H 1.0 1.943 4.707 2207 2084 A 26 GLU HA A 26 GLU H 1.0 1.856 3.998 2208 2085 A 27 LEU H A 40 VAL H 1.0 1.908 4.370 2209 2086 A 27 LEU H A 42 LEU H 1.0 1.922 4.498 2210 2087 A 26 GLU HA A 27 LEU H 1.0 1.660 3.044 2211 2088 A 41 VAL HA A 27 LEU H 1.0 1.957 4.881 2212 2089 A 26 GLU HBx A 27 LEU H 1.0 1.798 3.658 2213 2090 A 27 LEU HBy A 27 LEU H 1.0 1.826 3.814 2214 2091 A 27 LEU HBx A 27 LEU H 1.0 1.822 3.790 2215 2092 A 39 THR HG2% A 27 LEU H 1.0 1.915 4.435 2216 2093 A 42 LEU HDy% A 27 LEU H 1.0 1.872 4.100 2217 2094 A 40 VAL HGx% A 27 LEU H 1.0 1.976 5.154 2218 2095 A 26 GLU HGx A 27 LEU H 1.0 1.961 4.931 2219 2096 A 26 GLU HBy A 27 LEU H 1.0 1.798 3.662 2220 2097 A 27 LEU HDy% A 27 LEU H 1.0 1.945 4.725 2221 2098 A 27 LEU HDx% A 27 LEU H 1.0 1.966 5.004 2222 2099 A 16 ILE HG2% A 28 THR H 1.0 2.000 5.000 2223 2100 A 27 LEU HBy A 28 THR H 1.0 1.944 4.722 2224 2101 A 27 LEU HBx A 28 THR H 1.0 2.000 5.000 2225 2102 A 28 THR HG2% A 28 THR H 1.0 1.931 4.581 2226 2103 A 39 THR HG2% A 28 THR H 1.0 1.990 5.434 2227 2104 A 27 LEU HDy% A 28 THR H 1.0 1.910 4.392 2228 2105 A 27 LEU HDx% A 28 THR H 1.0 1.919 4.471 2229 2106 A 18 ILE HA A 28 THR H 1.0 1.910 4.392 2230 2107 A 28 THR HA A 28 THR H 1.0 1.866 4.064 2231 2108 A 27 LEU HA A 28 THR H 1.0 1.640 2.968 2232 2109 A 28 THR HB A 28 THR H 1.0 1.802 3.682 2233 2110 A 29 TRP H A 38 HIS H 1.0 1.891 4.243 2234 2111 A 29 TRP H A 30 ARG H 1.0 1.983 5.267 2235 2112 A 29 TRP HE3 A 29 TRP H 1.0 2.000 6.068 2236 2113 A 29 TRP HD1 A 29 TRP H 1.0 1.995 5.615 2237 2114 A 29 TRP HA A 29 TRP H 1.0 1.894 4.262 2238 2115 A 28 THR HA A 29 TRP H 1.0 1.675 3.099 2239 2116 A 39 THR HA A 29 TRP H 1.0 1.857 4.005 2240 2117 A 28 THR HB A 29 TRP H 1.0 1.910 4.398 2241 2118 A 29 TRP HBy A 29 TRP H 1.0 1.856 3.998 2242 2119 A 29 TRP HBx A 29 TRP H 1.0 1.840 3.898 2243 2120 A 28 THR HG2% A 29 TRP H 1.0 1.845 3.927 2244 2121 A 15 ILE HG2% A 30 ARG H 1.0 1.924 4.514 2245 2122 A 30 ARG HGx A 30 ARG H 1.0 1.829 3.831 2246 2123 A 30 ARG HBx A 30 ARG H 1.0 1.822 3.794 2247 2124 A 30 ARG HGy A 30 ARG H 1.0 2.000 5.000 2248 2125 A 29 TRP HBx A 30 ARG H 1.0 1.944 4.710 2249 2126 A 29 TRP HBy A 30 ARG H 1.0 1.973 5.093 2250 2127 A 14 GLY HAx A 30 ARG H 1.0 1.978 5.186 2251 2128 A 29 TRP HA A 30 ARG H 1.0 1.619 2.889 2252 2129 A 16 ILE HA A 30 ARG H 1.0 1.875 4.129 2253 2130 A 30 ARG HA A 30 ARG H 1.0 1.844 3.918 2254 2131 A 29 TRP HD1 A 30 ARG H 1.0 1.953 4.815 2255 2132 A 15 ILE H A 30 ARG H 1.0 1.781 3.573 2256 2133 A 30 ARG H A 31 SER H 1.0 1.965 4.983 2257 2134 A 30 ARG HBx A 31 SER H 1.0 1.858 4.010 2258 2135 A 30 ARG HBy A 31 SER H 1.0 1.831 3.843 2259 2136 A 37 VAL HG2% A 31 SER H 1.0 1.929 4.559 2260 2137 A 36 LYS HBy A 31 SER H 1.0 1.952 4.798 2261 2138 A 36 LYS HBx A 31 SER H 1.0 1.919 4.473 2262 2139 A 31 SER HBy A 31 SER H 1.0 1.857 4.005 2263 2140 A 31 SER HA A 31 SER H 1.0 1.793 3.629 2264 2141 A 31 SER HBx A 31 SER H 1.0 1.796 3.650 2265 2142 A 30 ARG HA A 31 SER H 1.0 1.609 2.855 2266 2143 A 31 SER H A 31 SER HG 1.0 1.837 3.877 2267 2144 A 29 TRP HE3 A 31 SER H 1.0 1.993 5.529 2268 2145 A 29 TRP HH2 A 31 SER H 1.0 1.964 4.950 2269 2146 A 29 TRP HZ3 A 31 SER H 1.0 1.941 4.687 2270 2147 A 32 THR H A 31 SER H 1.0 1.937 4.643 2271 2148 A 32 THR H A 33 ASP H 1.0 1.839 3.891 2272 2149 A 31 SER HG A 33 ASP H 1.0 1.929 4.565 2273 2150 A 33 ASP HA A 33 ASP H 1.0 1.744 3.390 2274 2151 A 31 SER HBy A 33 ASP H 1.0 1.920 4.482 2275 2152 A 32 THR HB A 33 ASP H 1.0 2.000 5.000 2276 2153 A 31 SER HBx A 33 ASP H 1.0 1.943 4.703 2277 2154 A 32 THR HA A 33 ASP H 1.0 1.886 4.204 2278 2155 A 33 ASP HBy A 33 ASP H 1.0 2.000 5.000 2279 2156 A 33 ASP H A 33 ASP HBx 1.0 1.780 3.568 2280 2157 A 12 VAL HGy% A 33 ASP H 1.0 1.999 5.853 2281 2158 A 32 THR HG2% A 33 ASP H 1.0 1.899 4.305 2282 2159 A 33 ASP H A 34 GLY H 1.0 1.700 3.202 2283 2160 A 35 ASP HA A 34 GLY H 1.0 1.977 5.165 2284 2161 A 34 GLY HAx A 34 GLY H 1.0 1.683 3.133 2285 2162 A 33 ASP HA A 34 GLY H 1.0 1.814 3.746 2286 2163 A 34 GLY HAy A 34 GLY H 1.0 1.709 3.241 2287 2164 A 33 ASP HBy A 34 GLY H 1.0 1.941 4.681 2288 2165 A 31 SER HG A 35 ASP H 1.0 1.823 3.797 2289 2166 A 35 ASP HA A 35 ASP H 1.0 1.700 3.204 2290 2167 A 34 GLY HAy A 35 ASP H 1.0 1.822 3.792 2291 2168 A 34 GLY HAx A 35 ASP H 1.0 1.850 3.956 2292 2169 A 35 ASP HBy A 35 ASP H 1.0 1.739 3.369 2293 2170 A 35 ASP HBx A 35 ASP H 1.0 1.754 3.440 2294 2171 A 36 LYS H A 37 VAL H 1.0 2.000 5.000 2295 2172 A 35 ASP H A 36 LYS H 1.0 1.711 3.249 2296 2173 A 31 SER H A 36 LYS H 1.0 1.862 4.040 2297 2174 A 34 GLY H A 36 LYS H 1.0 1.902 4.320 2298 2175 A 31 SER HG A 36 LYS H 1.0 1.798 3.660 2299 2176 A 36 LYS HA A 36 LYS H 1.0 1.732 3.340 2300 2177 A 35 ASP HA A 36 LYS H 1.0 1.793 3.633 2301 2178 A 34 GLY HAy A 36 LYS H 1.0 1.912 4.414 2302 2179 A 35 ASP HBy A 36 LYS H 1.0 1.917 4.453 2303 2180 A 36 LYS HBy A 36 LYS H 1.0 1.817 3.765 2304 2181 A 36 LYS HBx A 36 LYS H 1.0 1.753 3.435 2305 2182 A 36 LYS HGy A 36 LYS H 1.0 2.000 5.000 2306 2183 A 36 LYS HGx A 36 LYS H 1.0 1.939 4.667 2307 2184 A 38 HIS H A 37 VAL H 1.0 1.939 4.667 2308 2185 A 36 LYS HA A 37 VAL H 1.0 1.507 2.521 2309 2186 A 37 VAL HA A 37 VAL H 1.0 1.812 3.734 2310 2187 A 36 LYS HBy A 37 VAL H 1.0 1.866 4.064 2311 2188 A 37 VAL HB A 37 VAL H 1.0 1.738 3.364 2312 2189 A 36 LYS HBx A 37 VAL H 1.0 1.898 4.294 2313 2190 A 36 LYS HGx A 37 VAL H 1.0 1.918 4.458 2314 2191 A 36 LYS HGy A 37 VAL H 1.0 1.743 3.389 2315 2192 A 37 VAL HG2% A 37 VAL H 1.0 2.000 5.000 2316 2193 A 37 VAL HG2% A 38 HIS H 1.0 1.779 3.561 2317 2194 A 29 TRP HBy A 38 HIS H 1.0 1.964 4.968 2318 2195 A 38 HIS HBy A 38 HIS H 1.0 1.803 3.687 2319 2196 A 37 VAL HB A 38 HIS H 1.0 1.913 4.415 2320 2197 A 37 VAL HA A 38 HIS H 1.0 1.658 3.034 2321 2198 A 38 HIS HA A 38 HIS H 1.0 1.846 3.934 2322 2199 A 30 ARG HA A 38 HIS H 1.0 1.889 4.231 2323 2200 A 29 TRP HE3 A 38 HIS H 1.0 1.818 3.772 2324 2201 A 28 THR HA A 39 THR H 1.0 1.974 5.102 2325 2202 A 39 THR HA A 39 THR H 1.0 1.804 3.694 2326 2203 A 38 HIS HA A 39 THR H 1.0 1.588 2.782 2327 2204 A 39 THR HB A 39 THR H 1.0 1.714 3.258 2328 2205 A 38 HIS HBy A 39 THR H 1.0 1.910 4.386 2329 2206 A 39 THR HG2% A 39 THR H 1.0 1.870 4.090 2330 2207 A 39 THR HG2% A 40 VAL H 1.0 1.785 3.591 2331 2208 A 27 LEU HDx% A 40 VAL H 1.0 1.936 4.632 2332 2209 A 40 VAL HGx% A 40 VAL H 1.0 1.925 4.529 2333 2210 A 40 VAL HGy% A 40 VAL H 1.0 1.849 3.955 2334 2211 A 40 VAL HB A 40 VAL H 1.0 1.827 3.823 2335 2212 A 27 LEU HBy A 40 VAL H 1.0 1.950 4.784 2336 2213 A 27 LEU HG A 40 VAL H 1.0 1.975 5.143 2337 2214 A 28 THR HG2% A 40 VAL H 1.0 1.966 4.990 2338 2215 A 40 VAL HA A 40 VAL H 1.0 1.859 4.011 2339 2216 A 39 THR HB A 40 VAL H 1.0 1.984 5.308 2340 2217 A 28 THR HA A 40 VAL H 1.0 1.849 3.953 2341 2218 A 39 THR HA A 40 VAL H 1.0 1.658 3.034 2342 2219 A 26 GLU HA A 40 VAL H 1.0 1.961 4.931 2343 2220 A 40 VAL H A 41 VAL H 1.0 1.958 4.882 2344 2221 A 40 VAL HA A 41 VAL H 1.0 1.599 2.819 2345 2222 A 41 VAL HB A 41 VAL H 1.0 1.700 3.200 2346 2223 A 40 VAL HB A 41 VAL H 1.0 1.959 4.893 2347 2224 A 44 THR HG2% A 41 VAL H 1.0 1.930 4.570 2348 2225 A 41 VAL HGy% A 41 VAL H 1.0 1.691 3.165 2349 2226 A 40 VAL HGx% A 41 VAL H 1.0 1.811 3.727 2350 2227 A 40 VAL HGy% A 41 VAL H 1.0 2.000 5.000 2351 2228 A 42 LEU HDx% A 42 LEU H 1.0 1.854 3.982 2352 2229 A 41 VAL HGx% A 42 LEU H 1.0 1.845 3.931 2353 2230 A 41 VAL HGy% A 42 LEU H 1.0 1.920 4.482 2354 2231 A 42 LEU H A 107 ILE HG2% 1.0 1.957 4.879 2355 2232 A 42 LEU HG A 42 LEU H 1.0 2.000 5.000 2356 2233 A 41 VAL HB A 42 LEU H 1.0 1.967 5.009 2357 2234 A 42 LEU HBy A 42 LEU H 1.0 1.794 3.634 2358 2235 A 25 ALA HB% A 42 LEU H 1.0 1.953 4.823 2359 2236 A 42 LEU HBx A 42 LEU H 1.0 1.891 4.243 2360 2237 A 26 GLU HA A 42 LEU H 1.0 1.846 3.932 2361 2238 A 41 VAL HA A 42 LEU H 1.0 1.706 3.226 2362 2239 A 42 LEU H A 43 SER H 1.0 1.859 4.015 2363 2240 A 43 SER H A 44 THR H 1.0 1.758 3.458 2364 2241 A 43 SER H A 45 ILE H 1.0 1.869 4.085 2365 2242 A 111 TYR HEy A 43 SER H 1.0 1.987 5.355 2366 2242 A 111 TYR HEx A 43 SER H 1.0 1.987 5.355 2367 2243 A 43 SER HA A 43 SER H 1.0 1.744 3.396 2368 2244 A 43 SER HBy A 43 SER H 1.0 1.861 4.025 2369 2245 A 43 SER HBx A 43 SER H 1.0 1.823 3.801 2370 2246 A 24 PRO HBy A 43 SER H 1.0 1.940 4.674 2371 2247 A 41 VAL HB A 43 SER H 1.0 1.957 4.879 2372 2248 A 42 LEU HBy A 43 SER H 1.0 1.797 3.651 2373 2249 A 41 VAL HGx% A 43 SER H 1.0 1.677 3.109 2374 2250 A 44 THR HG2% A 43 SER H 1.0 1.912 4.410 2375 2251 A 42 LEU HDx% A 43 SER H 1.0 1.979 5.207 2376 2252 A 41 VAL HGx% A 44 THR H 1.0 1.871 4.101 2377 2253 A 44 THR HG2% A 44 THR H 1.0 1.708 3.232 2378 2254 A 44 THR H A 44 THR HG1 1.0 1.870 4.094 2379 2255 A 44 THR HB A 44 THR H 1.0 1.920 4.474 2380 2256 A 44 THR HA A 44 THR H 1.0 1.813 3.739 2381 2257 A 43 SER HA A 44 THR H 1.0 1.833 3.859 2382 2258 A 45 ILE H A 46 ASP H 1.0 1.974 5.124 2383 2259 A 44 THR H A 45 ILE H 1.0 1.753 3.435 2384 2260 A 44 THR HB A 45 ILE H 1.0 1.976 5.162 2385 2261 A 44 THR HA A 45 ILE H 1.0 1.874 4.114 2386 2262 A 45 ILE HA A 45 ILE H 1.0 1.876 4.130 2387 2263 A 43 SER HA A 45 ILE H 1.0 1.833 3.857 2388 2264 A 45 ILE H A 44 THR HG1 1.0 1.989 5.421 2389 2265 A 45 ILE HB A 45 ILE H 1.0 1.677 3.107 2390 2266 A 45 ILE HG1x A 45 ILE H 1.0 2.000 5.000 2391 2267 A 44 THR HG2% A 45 ILE H 1.0 1.893 4.255 2392 2268 A 45 ILE HG1y A 45 ILE H 1.0 1.842 3.910 2393 2269 A 45 ILE HG2% A 45 ILE H 1.0 2.000 5.000 2394 2270 A 45 ILE HD1% A 45 ILE H 1.0 1.846 3.938 2395 2271 A 42 LEU HDx% A 45 ILE H 1.0 1.933 4.609 2396 2272 A 40 VAL HGx% A 45 ILE H 1.0 1.978 5.184 2397 2273 A 45 ILE HD1% A 46 ASP H 1.0 1.936 4.638 2398 2274 A 45 ILE HG2% A 46 ASP H 1.0 1.822 3.786 2399 2275 A 46 ASP HBx A 46 ASP H 1.0 1.845 3.931 2400 2276 A 46 ASP HBy A 46 ASP H 1.0 1.826 3.814 2401 2277 A 46 ASP HA A 46 ASP H 1.0 1.840 3.898 2402 2278 A 45 ILE HA A 46 ASP H 1.0 1.746 3.404 2403 2279 A 46 ASP H A 47 LYS H 1.0 1.726 3.312 2404 2280 A 47 LYS H A 63 ILE H 1.0 1.912 4.408 2405 2281 A 46 ASP HA A 47 LYS H 1.0 1.782 3.580 2406 2282 A 46 ASP HBy A 47 LYS H 1.0 1.767 3.503 2407 2283 A 46 ASP HBx A 47 LYS H 1.0 1.832 3.852 2408 2284 A 63 ILE HB A 47 LYS H 1.0 1.805 3.695 2409 2285 A 47 LYS HBy A 47 LYS H 1.0 1.896 4.278 2410 2286 A 47 LYS HBx A 47 LYS H 1.0 1.844 3.918 2411 2287 A 47 LYS HGx A 47 LYS H 1.0 1.901 4.315 2412 2288 A 47 LYS HGy A 47 LYS H 1.0 1.871 4.097 2413 2289 A 63 ILE HG2% A 47 LYS H 1.0 1.905 4.353 2414 2290 A 63 ILE HD1% A 47 LYS H 1.0 1.965 4.973 2415 2291 A 47 LYS HBx A 48 LEU H 1.0 1.678 4.110 2416 2292 A 48 LEU HDy% A 48 LEU H 1.0 2.000 5.000 2417 2293 A 47 LYS HA A 48 LEU H 1.0 1.574 2.732 2418 2294 A 48 LEU HA A 48 LEU H 1.0 1.846 3.936 2419 2295 A 49 GLN H A 61 ARG H 1.0 1.839 3.895 2420 2296 A 49 GLN HA A 49 GLN H 1.0 1.869 4.077 2421 2297 A 62 LEU HA A 49 GLN H 1.0 1.963 4.953 2422 2298 A 48 LEU HA A 49 GLN H 1.0 1.631 2.933 2423 2299 A 60 LEU HA A 49 GLN H 1.0 1.977 5.173 2424 2300 A 49 GLN HGy A 49 GLN H 1.0 1.948 4.764 2425 2301 A 49 GLN HGx A 49 GLN H 1.0 1.884 4.188 2426 2302 A 49 GLN H A 49 GLN HBy 1.0 2.000 5.000 2427 2303 A 48 LEU HBy A 49 GLN H 1.0 1.859 4.019 2428 2304 A 48 LEU HG A 49 GLN H 1.0 2.000 5.000 2429 2305 A 48 LEU HBx A 49 GLN H 1.0 1.881 4.167 2430 2306 A 48 LEU HDy% A 49 GLN H 1.0 2.000 5.000 2431 2307 A 63 ILE HD1% A 49 GLN H 1.0 1.997 5.683 2432 2308 A 60 LEU HDx% A 50 ALA H 1.0 1.999 5.861 2433 2309 A 50 ALA HB% A 50 ALA H 1.0 1.819 3.773 2434 2310 A 49 GLN HBx A 50 ALA H 1.0 1.911 4.401 2435 2311 A 49 GLN HGy A 50 ALA H 1.0 1.976 5.144 2436 2312 A 49 GLN HA A 50 ALA H 1.0 1.731 3.335 2437 2313 A 50 ALA HA A 50 ALA H 1.0 1.942 4.690 2438 2314 A 61 ARG H A 51 THR H 1.0 1.991 5.459 2439 2315 A 50 ALA H A 51 THR H 1.0 2.000 5.978 2440 2316 A 51 THR H A 59 MET H 1.0 1.836 3.876 2441 2317 A 50 ALA HA A 51 THR H 1.0 1.621 2.897 2442 2318 A 60 LEU HA A 51 THR H 1.0 1.898 4.294 2443 2319 A 51 THR HA A 51 THR H 1.0 1.826 3.812 2444 2320 A 51 THR HB A 51 THR H 1.0 1.880 4.160 2445 2321 A 97 MET HE% A 51 THR H 1.0 1.778 3.558 2446 2322 A 59 MET HE% A 51 THR H 1.0 1.952 4.814 2447 2323 A 50 ALA HB% A 51 THR H 1.0 1.703 3.213 2448 2324 A 53 ALA HB% A 54 SER H 1.0 1.915 4.443 2449 2325 A 54 SER HA A 54 SER H 1.0 1.871 4.101 2450 2326 A 54 SER HBy A 54 SER H 1.0 1.883 4.187 2451 2327 A 54 SER HBx A 54 SER H 1.0 1.892 4.248 2452 2328 A 52 PRO HBy A 55 SER H 1.0 1.990 5.446 2453 2329 A 52 PRO HBx A 55 SER H 1.0 1.837 3.877 2454 2330 A 52 PRO HGy A 55 SER H 1.0 1.879 4.149 2455 2331 A 53 ALA HB% A 55 SER H 1.0 1.975 5.141 2456 2332 A 55 SER HA A 55 SER H 1.0 1.739 3.369 2457 2333 A 51 THR HB A 55 SER H 1.0 1.939 4.657 2458 2334 A 54 SER HA A 55 SER H 1.0 1.836 3.872 2459 2335 A 55 SER HBy A 55 SER H 1.0 2.000 5.000 2460 2336 A 55 SER HBx A 55 SER H 1.0 1.684 3.134 2461 2337 A 52 PRO HDx A 55 SER H 1.0 1.982 5.268 2462 2338 A 54 SER HBx A 55 SER H 1.0 1.916 4.446 2463 2339 A 55 SER HA A 56 GLU H 1.0 1.723 3.303 2464 2340 A 56 GLU HA A 56 GLU H 1.0 1.873 4.115 2465 2341 A 56 GLU HGy A 56 GLU H 1.0 1.987 5.389 2466 2342 A 56 GLU HGx A 56 GLU H 1.0 1.975 5.123 2467 2343 A 56 GLU HBx A 56 GLU H 1.0 1.890 4.236 2468 2344 A 56 GLU HBy A 56 GLU H 1.0 1.852 3.974 2469 2345 A 56 GLU HBy A 57 LYS H 1.0 1.889 4.231 2470 2346 A 57 LYS HDx A 57 LYS H 1.0 1.962 4.946 2471 2347 A 57 LYS HGy A 57 LYS H 1.0 2.000 5.000 2472 2348 A 56 GLU HGy A 57 LYS H 1.0 1.972 5.078 2473 2349 A 56 GLU HBx A 57 LYS H 1.0 1.893 4.257 2474 2350 A 57 LYS HBy A 57 LYS H 1.0 2.000 5.000 2475 2351 A 57 LYS HBx A 57 LYS H 1.0 1.728 3.322 2476 2352 A 57 LYS HGx A 57 LYS H 1.0 1.817 3.761 2477 2353 A 55 SER HA A 57 LYS H 1.0 1.879 4.153 2478 2354 A 57 LYS HA A 57 LYS H 1.0 1.747 3.405 2479 2355 A 56 GLU HA A 57 LYS H 1.0 1.831 3.841 2480 2356 A 55 SER HBy A 57 LYS H 1.0 1.904 4.340 2481 2357 A 55 SER HBx A 57 LYS H 1.0 1.935 4.623 2482 2358 A 56 GLU H A 57 LYS H 1.0 1.796 3.648 2483 2359 A 57 LYS HA A 58 MET H 1.0 1.733 3.345 2484 2360 A 58 MET HBx A 58 MET H 1.0 1.900 4.312 2485 2361 A 58 MET HBy A 58 MET H 1.0 1.965 4.981 2486 2362 A 58 MET HE% A 58 MET H 1.0 1.964 4.970 2487 2363 A 57 LYS HBy A 58 MET H 1.0 1.913 4.421 2488 2364 A 59 MET HGx A 59 MET H 1.0 1.875 4.123 2489 2365 A 59 MET HBx A 59 MET H 1.0 1.797 3.655 2490 2366 A 59 MET HBy A 59 MET H 1.0 1.798 3.664 2491 2367 A 51 THR HG2% A 59 MET H 1.0 1.779 3.561 2492 2368 A 59 MET HGy A 59 MET H 1.0 1.994 5.550 2493 2369 A 58 MET HA A 59 MET H 1.0 1.656 3.026 2494 2370 A 59 MET HA A 59 MET H 1.0 1.896 4.276 2495 2371 A 59 MET H A 58 MET H 1.0 1.996 5.632 2496 2372 A 61 ARG H A 60 LEU H 1.0 1.962 4.948 2497 2373 A 91 PHE HDy A 60 LEU H 1.0 1.940 4.678 2498 2373 A 91 PHE HDx A 60 LEU H 1.0 1.940 4.678 2499 2374 A 91 PHE HEy A 60 LEU H 1.0 1.899 4.305 2500 2374 A 91 PHE HEx A 60 LEU H 1.0 1.899 4.305 2501 2375 A 59 MET HA A 60 LEU H 1.0 1.651 3.009 2502 2376 A 60 LEU HA A 60 LEU H 1.0 1.890 4.236 2503 2377 A 59 MET HGy A 60 LEU H 1.0 1.939 4.661 2504 2378 A 59 MET HGx A 60 LEU H 1.0 1.945 4.731 2505 2379 A 59 MET HBx A 60 LEU H 1.0 1.854 3.986 2506 2380 A 60 LEU HBy A 60 LEU H 1.0 1.805 3.695 2507 2381 A 60 LEU HBx A 60 LEU H 1.0 1.891 4.247 2508 2382 A 59 MET HBy A 60 LEU H 1.0 1.842 3.908 2509 2383 A 60 LEU HDy% A 60 LEU H 1.0 1.961 4.913 2510 2384 A 50 ALA HA A 61 ARG H 1.0 1.870 4.090 2511 2385 A 60 LEU HA A 61 ARG H 1.0 1.619 2.889 2512 2386 A 88 MET HA A 61 ARG H 1.0 1.984 5.304 2513 2387 A 49 GLN HBx A 61 ARG H 1.0 1.919 4.473 2514 2388 A 60 LEU HBy A 61 ARG H 1.0 1.901 4.319 2515 2389 A 61 ARG HBx A 61 ARG H 1.0 1.831 3.843 2516 2390 A 61 ARG HBy A 61 ARG H 1.0 1.851 3.965 2517 2391 A 60 LEU HDy% A 61 ARG H 1.0 1.899 4.303 2518 2392 A 60 LEU HDx% A 61 ARG H 1.0 2.000 5.000 2519 2393 A 62 LEU HBy A 62 LEU H 1.0 1.874 4.118 2520 2394 A 62 LEU HG A 62 LEU H 1.0 2.000 5.000 2521 2395 A 61 ARG HBx A 62 LEU H 1.0 1.872 4.102 2522 2396 A 61 ARG HBy A 62 LEU H 1.0 1.901 4.323 2523 2397 A 62 LEU HDx% A 62 LEU H 1.0 2.000 5.000 2524 2398 A 62 LEU HDy% A 62 LEU H 1.0 1.887 4.213 2525 2399 A 87 HIS HBx A 62 LEU H 1.0 1.958 4.886 2526 2400 A 88 MET HA A 62 LEU H 1.0 1.912 4.402 2527 2401 A 61 ARG HA A 62 LEU H 1.0 1.703 3.215 2528 2402 A 63 ILE H A 64 GLY H 1.0 1.939 4.667 2529 2403 A 48 LEU HA A 63 ILE H 1.0 1.903 4.331 2530 2404 A 62 LEU HA A 63 ILE H 1.0 1.661 3.047 2531 2405 A 63 ILE HA A 63 ILE H 1.0 1.907 4.369 2532 2406 A 62 LEU HBy A 63 ILE H 1.0 2.000 5.000 2533 2407 A 62 LEU HBx A 63 ILE H 1.0 2.000 5.000 2534 2408 A 63 ILE HG1x A 63 ILE H 1.0 1.869 4.085 2535 2409 A 62 LEU HDy% A 63 ILE H 1.0 2.000 5.000 2536 2410 A 63 ILE HD1% A 63 ILE H 1.0 1.919 4.475 2537 2411 A 64 GLY H A 65 LYS H 1.0 1.956 4.856 2538 2412 A 86 ARG HA A 64 GLY H 1.0 1.933 4.599 2539 2413 A 64 GLY HAy A 64 GLY H 1.0 1.836 3.870 2540 2414 A 63 ILE HA A 64 GLY H 1.0 1.670 3.080 2541 2415 A 45 ILE HA A 64 GLY H 1.0 1.956 4.860 2542 2416 A 64 GLY HAx A 64 GLY H 1.0 1.769 3.515 2543 2417 A 85 GLN HBy A 64 GLY H 1.0 1.919 4.473 2544 2418 A 84 PRO HBx A 64 GLY H 1.0 1.999 5.807 2545 2419 A 63 ILE HG2% A 64 GLY H 1.0 1.799 3.667 2546 2420 A 46 ASP H A 65 LYS H 1.0 1.858 4.014 2547 2421 A 65 LYS HA A 65 LYS H 1.0 1.735 3.353 2548 2422 A 64 GLY HAx A 65 LYS H 1.0 1.756 3.450 2549 2423 A 46 ASP HBx A 65 LYS H 1.0 1.957 4.867 2550 2424 A 65 LYS HBy A 65 LYS H 1.0 1.805 3.695 2551 2425 A 65 LYS HDy A 65 LYS H 1.0 1.937 4.639 2552 2426 A 65 LYS HBx A 65 LYS H 1.0 1.728 3.320 2553 2427 A 65 LYS HGy A 65 LYS H 1.0 1.858 4.010 2554 2428 A 65 LYS HGx A 65 LYS H 1.0 1.789 3.613 2555 2429 A 45 ILE HG2% A 65 LYS H 1.0 1.961 4.923 2556 2430 A 45 ILE HD1% A 65 LYS H 1.0 1.934 4.618 2557 2431 A 65 LYS HBy A 66 VAL H 1.0 1.754 3.438 2558 2432 A 65 LYS HBx A 66 VAL H 1.0 2.000 5.000 2559 2433 A 46 ASP HBx A 66 VAL H 1.0 1.940 4.670 2560 2434 A 65 LYS HGx A 66 VAL H 1.0 1.953 4.821 2561 2435 A 66 VAL HGy% A 66 VAL H 1.0 2.000 5.000 2562 2436 A 66 VAL HA A 66 VAL H 1.0 1.768 3.508 2563 2437 A 65 LYS HA A 66 VAL H 1.0 1.555 2.669 2564 2438 A 65 LYS H A 66 VAL H 1.0 1.941 4.687 2565 2439 A 66 VAL HA A 67 ASP H 1.0 1.603 2.831 2566 2440 A 67 ASP HBy A 67 ASP H 1.0 1.786 3.594 2567 2441 A 67 ASP HBx A 67 ASP H 1.0 1.812 3.736 2568 2442 A 66 VAL HB A 67 ASP H 1.0 1.869 4.089 2569 2443 A 66 VAL HGx% A 67 ASP H 1.0 1.839 3.893 2570 2444 A 67 ASP HA A 68 GLU H 1.0 1.530 2.592 2571 2445 A 68 GLU HA A 68 GLU H 1.0 1.743 3.391 2572 2446 A 68 GLU HGy A 68 GLU H 1.0 1.880 4.156 2573 2447 A 68 GLU HBx A 68 GLU H 1.0 1.801 3.675 2574 2448 A 68 GLU HBy A 68 GLU H 1.0 1.705 3.223 2575 2449 A 67 ASP HBx A 68 GLU H 1.0 1.956 4.850 2576 2450 A 67 ASP HBy A 68 GLU H 1.0 1.989 5.431 2577 2451 A 68 GLU H A 69 SER H 1.0 1.764 3.484 2578 2452 A 69 SER H A 70 LYS H 1.0 1.778 3.560 2579 2453 A 69 SER HA A 69 SER H 1.0 1.744 3.392 2580 2454 A 68 GLU HA A 69 SER H 1.0 1.821 3.785 2581 2455 A 69 SER HBy A 69 SER H 1.0 1.740 3.372 2582 2456 A 68 GLU HBx A 69 SER H 1.0 1.963 4.959 2583 2457 A 68 GLU HBy A 69 SER H 1.0 1.948 4.760 2584 2458 A 68 GLU H A 70 LYS H 1.0 1.994 5.576 2585 2459 A 70 LYS HA A 70 LYS H 1.0 1.785 3.591 2586 2460 A 69 SER HA A 70 LYS H 1.0 1.791 3.621 2587 2461 A 68 GLU HA A 70 LYS H 1.0 1.962 4.932 2588 2462 A 69 SER HBy A 70 LYS H 1.0 1.975 5.137 2589 2463 A 70 LYS HBy A 70 LYS H 1.0 1.843 3.917 2590 2464 A 70 LYS HBx A 70 LYS H 1.0 1.732 3.342 2591 2465 A 70 LYS HGy A 70 LYS H 1.0 1.885 4.197 2592 2466 A 70 LYS HGx A 70 LYS H 1.0 1.898 4.296 2593 2467 A 8 ILE HG1y A 9 PHE H 1.0 1.951 4.799 2594 2468 A 8 ILE HB A 9 PHE H 1.0 1.987 5.365 2595 2469 A 9 PHE HBy A 10 GLU H 1.0 1.894 4.262 2596 2470 A 9 PHE HBx A 10 GLU H 1.0 1.992 5.500 2597 2471 A 11 LYS HGx A 11 LYS H 1.0 1.742 3.384 2598 2472 A 10 GLU HGx A 11 LYS H 1.0 1.977 5.171 2599 2473 A 10 GLU HA A 12 VAL H 1.0 1.980 5.222 2600 2474 A 11 LYS HBy A 12 VAL H 1.0 1.976 5.152 2601 2475 A 10 GLU HBx A 12 VAL H 1.0 1.950 4.788 2602 2476 A 11 LYS HBx A 12 VAL H 1.0 1.975 5.131 2603 2477 A 12 VAL HB A 13 SER H 1.0 1.930 4.570 2604 2478 A 13 SER HBx A 14 GLY H 1.0 1.839 3.889 2605 2479 A 16 ILE HB A 17 ALA H 1.0 1.905 4.355 2606 2480 A 16 ILE HG1x A 17 ALA H 1.0 1.949 4.775 2607 2481 A 18 ILE HB A 19 ASN H 1.0 1.990 5.440 2608 2482 A 26 GLU HBy A 19 ASN H 1.0 1.980 5.222 2609 2483 A 17 ALA HB% A 19 ASN H 1.0 1.972 5.074 2610 2484 A 20 GLU HBx A 21 ASP H 1.0 1.988 5.394 2611 2485 A 22 VAL HGy% A 23 SER H 1.0 1.749 3.417 2612 2486 A 30 ARG HGy A 31 SER H 1.0 1.894 4.266 2613 2487 A 33 ASP HBx A 34 GLY H 1.0 1.939 4.669 2614 2488 A 35 ASP HBx A 36 LYS H 1.0 1.944 4.718 2615 2489 A 42 LEU HBx A 43 SER H 1.0 1.987 5.365 2616 2490 A 47 LYS HBy A 48 LEU H 1.0 1.706 3.228 2617 2491 A 48 LEU HBx A 48 LEU H 1.0 1.702 3.208 2618 2492 A 47 LYS HGx A 48 LEU H 1.0 1.921 4.489 2619 2493 A 48 LEU H A 47 LYS HEy 1.0 1.984 5.306 2620 2494 A 54 SER HBy A 55 SER H 1.0 1.838 3.886 2621 2495 A 56 GLU HGx A 57 LYS H 1.0 1.970 5.040 2622 2496 A 57 LYS HBx A 58 MET H 1.0 1.954 4.830 2623 2497 A 60 LEU HBx A 61 ARG H 1.0 2.000 5.000 2624 2498 A 60 LEU HG A 61 ARG H 1.0 1.905 4.353 2625 2499 A 65 LYS HGy A 66 VAL H 1.0 1.847 3.943 2626 2500 A 66 VAL HGy% A 67 ASP H 1.0 1.910 4.398 2627 2501 A 70 LYS HA A 71 LYS H 1.0 2.000 5.000 2628 2502 A 70 LYS HGy A 71 LYS H 1.0 1.825 3.807 2629 2503 A 70 LYS HGx A 71 LYS H 1.0 1.891 4.241 2630 2504 A 70 LYS HBx A 71 LYS H 1.0 2.000 5.000 2631 2505 A 70 LYS HBy A 71 LYS H 1.0 2.000 5.000 2632 2506 A 71 LYS H A 72 ARG H 1.0 2.000 5.000 2633 2507 A 72 ARG HA A 72 ARG H 1.0 1.779 3.559 2634 2508 A 71 LYS HA A 72 ARG H 1.0 1.523 2.569 2635 2509 A 82 PRO HGy A 72 ARG H 1.0 1.900 4.310 2636 2510 A 72 ARG HBx A 72 ARG H 1.0 1.854 3.982 2637 2511 A 71 LYS HBx A 72 ARG H 1.0 2.000 5.000 2638 2512 A 72 ARG HGy A 72 ARG H 1.0 2.000 5.000 2639 2513 A 71 LYS HGx A 72 ARG H 1.0 1.999 5.797 2640 2514 A 80 VAL HGy% A 72 ARG H 1.0 1.961 4.929 2641 2515 A 73 LYS HA A 73 LYS H 1.0 1.800 3.672 2642 2516 A 72 ARG HA A 73 LYS H 1.0 1.612 2.866 2643 2517 A 72 ARG HBy A 73 LYS H 1.0 2.000 5.000 2644 2518 A 72 ARG HGy A 73 LYS H 1.0 1.900 4.312 2645 2519 A 72 ARG HBx A 73 LYS H 1.0 1.862 4.036 2646 2520 A 73 LYS HGy A 73 LYS H 1.0 1.935 4.621 2647 2521 A 73 LYS HGx A 73 LYS H 1.0 1.972 5.078 2648 2522 A 73 LYS H A 74 ASP H 1.0 1.903 4.337 2649 2523 A 74 ASP H A 77 GLY H 1.0 1.970 5.052 2650 2524 A 73 LYS HA A 74 ASP H 1.0 1.525 2.575 2651 2525 A 74 ASP HA A 74 ASP H 1.0 1.811 3.733 2652 2526 A 79 GLU HA A 74 ASP H 1.0 1.956 4.856 2653 2527 A 74 ASP HBx A 74 ASP H 1.0 1.789 3.615 2654 2528 A 74 ASP HBy A 74 ASP H 1.0 1.880 4.164 2655 2529 A 73 LYS HB2 A 74 ASP H 1.0 1.743 3.389 2656 2530 A 80 VAL HGy% A 74 ASP H 1.0 1.827 3.823 2657 2531 A 75 ASN HA A 75 ASN H 1.0 1.984 5.304 2658 2532 A 74 ASP HA A 75 ASN H 1.0 1.953 4.815 2659 2533 A 74 ASP HBy A 75 ASN H 1.0 1.923 4.505 2660 2534 A 75 ASN HBx A 75 ASN H 1.0 1.924 4.522 2661 2535 A 74 ASP HBx A 75 ASN H 1.0 1.984 5.292 2662 2536 A 74 ASP HBy A 76 GLU H 1.0 1.976 5.162 2663 2537 A 75 ASN HBx A 76 GLU H 1.0 1.882 4.176 2664 2538 A 76 GLU H A 76 GLU HGy 1.0 1.693 3.173 2665 2539 A 76 GLU HBy A 76 GLU H 1.0 1.675 3.099 2666 2540 A 75 ASN HA A 76 GLU H 1.0 1.843 3.915 2667 2541 A 76 GLU HA A 76 GLU H 1.0 1.726 3.314 2668 2542 A 75 ASN H A 76 GLU H 1.0 1.879 4.151 2669 2543 A 76 GLU HA A 77 GLY H 1.0 1.800 3.670 2670 2544 A 77 GLY HAy A 77 GLY H 1.0 1.735 3.353 2671 2545 A 77 GLY HAx A 77 GLY H 1.0 1.657 3.029 2672 2546 A 76 GLU HBx A 77 GLY H 1.0 1.949 4.779 2673 2547 A 76 GLU HBy A 77 GLY H 1.0 1.954 4.832 2674 2548 A 77 GLY H A 73 LYS HB3 1.0 1.978 5.176 2675 2549 A 77 GLY H A 78 ASN H 1.0 1.719 3.281 2676 2550 A 76 GLU H A 78 ASN H 1.0 1.873 4.109 2677 2551 A 77 GLY HAy A 78 ASN H 1.0 1.872 4.102 2678 2552 A 77 GLY HAx A 78 ASN H 1.0 1.863 4.045 2679 2553 A 78 ASN HBy A 78 ASN H 1.0 1.706 3.228 2680 2554 A 76 GLU HBx A 78 ASN H 1.0 1.982 5.256 2681 2555 A 76 GLU HBy A 78 ASN H 1.0 1.949 4.775 2682 2556 A 73 LYS HB3 A 78 ASN H 1.0 1.999 5.825 2683 2557 A 78 ASN H A 79 GLU H 1.0 2.000 5.000 2684 2558 A 79 GLU HA A 79 GLU H 1.0 1.770 3.514 2685 2559 A 78 ASN HBy A 79 GLU H 1.0 1.941 4.675 2686 2560 A 78 ASN HBx A 79 GLU H 1.0 1.778 3.558 2687 2561 A 79 GLU HGy A 79 GLU H 1.0 2.000 5.000 2688 2562 A 79 GLU HGx A 79 GLU H 1.0 1.962 4.926 2689 2563 A 79 GLU HBy A 79 GLU H 1.0 1.590 2.788 2690 2564 A 73 LYS HA A 80 VAL H 1.0 1.840 3.900 2691 2565 A 79 GLU HA A 80 VAL H 1.0 1.489 2.467 2692 2566 A 80 VAL HA A 80 VAL H 1.0 1.792 3.630 2693 2567 A 79 GLU HBx A 80 VAL H 1.0 2.000 5.000 2694 2568 A 79 GLU HGx A 80 VAL H 1.0 2.000 6.140 2695 2569 A 79 GLU HGy A 80 VAL H 1.0 1.988 5.376 2696 2570 A 80 VAL HGy% A 80 VAL H 1.0 1.701 3.207 2697 2571 A 80 VAL HB A 81 VAL H 1.0 1.866 4.058 2698 2572 A 81 VAL HB A 81 VAL H 1.0 1.675 3.101 2699 2573 A 81 VAL HGy% A 81 VAL H 1.0 2.000 5.000 2700 2574 A 80 VAL HGy% A 81 VAL H 1.0 2.000 5.000 2701 2575 A 81 VAL HA A 81 VAL H 1.0 1.769 3.511 2702 2576 A 80 VAL HA A 81 VAL H 1.0 1.496 2.490 2703 2577 A 80 VAL H A 81 VAL H 1.0 2.000 5.000 2704 2578 A 83 LYS HA A 83 LYS H 1.0 1.753 3.435 2705 2579 A 82 PRO HA A 83 LYS H 1.0 1.472 2.418 2706 2580 A 84 PRO HDy A 83 LYS H 1.0 1.984 5.300 2707 2581 A 82 PRO HBy A 83 LYS H 1.0 1.828 3.826 2708 2582 A 82 PRO HGx A 83 LYS H 1.0 2.000 5.862 2709 2583 A 82 PRO HGy A 83 LYS H 1.0 1.954 4.832 2710 2584 A 82 PRO HBx A 83 LYS H 1.0 1.814 3.744 2711 2585 A 83 LYS HBy A 83 LYS H 1.0 2.000 5.000 2712 2586 A 83 LYS HBx A 83 LYS H 1.0 1.641 2.969 2713 2587 A 83 LYS HGy A 83 LYS H 1.0 1.802 3.680 2714 2588 A 83 LYS HGx A 83 LYS H 1.0 1.872 4.108 2715 2589 A 66 VAL HGx% A 83 LYS H 1.0 1.961 4.919 2716 2590 A 64 GLY H A 85 GLN H 1.0 1.988 5.402 2717 2591 A 85 GLN H A 86 ARG H 1.0 1.940 4.668 2718 2592 A 84 PRO HA A 85 GLN H 1.0 1.556 2.674 2719 2593 A 85 GLN HA A 85 GLN H 1.0 1.788 3.608 2720 2594 A 64 GLY HAx A 85 GLN H 1.0 1.933 4.607 2721 2595 A 85 GLN HGy A 85 GLN H 1.0 1.866 4.064 2722 2596 A 84 PRO HBy A 85 GLN H 1.0 1.792 3.624 2723 2597 A 84 PRO HGx A 85 GLN H 1.0 2.000 5.000 2724 2598 A 84 PRO HBx A 85 GLN H 1.0 1.716 3.272 2725 2599 A 66 VAL HGy% A 85 GLN H 1.0 1.969 5.035 2726 2600 A 86 ARG HA A 86 ARG H 1.0 1.851 3.965 2727 2601 A 85 GLN HA A 86 ARG H 1.0 1.541 2.625 2728 2602 A 85 GLN HGy A 86 ARG H 1.0 2.000 5.000 2729 2603 A 85 GLN HGx A 86 ARG H 1.0 1.959 4.903 2730 2604 A 85 GLN HBy A 86 ARG H 1.0 1.863 4.039 2731 2605 A 85 GLN HBx A 86 ARG H 1.0 1.824 3.800 2732 2606 A 86 ARG HBx A 86 ARG H 1.0 1.792 3.628 2733 2607 A 86 ARG HBy A 86 ARG H 1.0 1.834 3.858 2734 2608 A 62 LEU H A 87 HIS H 1.0 1.855 3.995 2735 2609 A 87 HIS HD2 A 87 HIS H 1.0 1.857 4.001 2736 2610 A 86 ARG HA A 87 HIS H 1.0 1.650 3.002 2737 2611 A 87 HIS HBx A 87 HIS H 1.0 1.882 4.174 2738 2612 A 87 HIS HBy A 87 HIS H 1.0 1.932 4.600 2739 2613 A 62 LEU HBy A 87 HIS H 1.0 1.932 4.598 2740 2614 A 86 ARG HBy A 87 HIS H 1.0 1.861 4.025 2741 2615 A 86 ARG HBx A 87 HIS H 1.0 1.906 4.358 2742 2616 A 63 ILE HA A 87 HIS H 1.0 1.946 4.744 2743 2617 A 88 MET HBy A 88 MET H 1.0 1.798 3.662 2744 2618 A 88 MET HBx A 88 MET H 1.0 1.765 3.493 2745 2619 A 87 HIS HBy A 88 MET H 1.0 1.916 4.442 2746 2620 A 87 HIS HBx A 88 MET H 1.0 1.976 5.154 2747 2621 A 88 MET HA A 88 MET H 1.0 1.876 4.132 2748 2622 A 9 PHE HEy A 88 MET H 1.0 1.821 3.787 2749 2622 A 9 PHE HEx A 88 MET H 1.0 1.821 3.787 2750 2623 A 9 PHE HDy A 88 MET H 1.0 1.985 5.303 2751 2623 A 9 PHE HDx A 88 MET H 1.0 1.985 5.303 2752 2624 A 88 MET H A 89 PHE H 1.0 1.972 5.076 2753 2625 A 90 SER HBy A 90 SER H 1.0 1.890 4.238 2754 2626 A 90 SER HBx A 90 SER H 1.0 1.861 4.029 2755 2627 A 89 PHE HA A 90 SER H 1.0 1.647 2.993 2756 2628 A 90 SER HA A 90 SER H 1.0 1.882 4.176 2757 2629 A 89 PHE HDy A 90 SER H 1.0 1.947 4.757 2758 2629 A 89 PHE HDx A 90 SER H 1.0 1.947 4.757 2759 2630 A 89 PHE HBx A 90 SER H 1.0 1.850 3.962 2760 2631 A 8 ILE HB A 90 SER H 1.0 1.874 4.114 2761 2632 A 7 ALA HB% A 90 SER H 1.0 1.908 4.372 2762 2633 A 8 ILE HG2% A 90 SER H 1.0 1.953 4.821 2763 2634 A 8 ILE H A 90 SER H 1.0 1.864 4.050 2764 2635 A 91 PHE HA A 91 PHE H 1.0 1.886 4.206 2765 2636 A 90 SER HBy A 91 PHE H 1.0 1.876 4.128 2766 2637 A 90 SER HBx A 91 PHE H 1.0 1.937 4.647 2767 2638 A 91 PHE HBy A 91 PHE H 1.0 1.901 4.317 2768 2639 A 91 PHE HBx A 91 PHE H 1.0 1.857 4.005 2769 2640 A 58 MET HBx A 91 PHE H 1.0 1.912 4.412 2770 2641 A 58 MET HBy A 91 PHE H 1.0 1.950 4.776 2771 2642 A 90 SER HA A 91 PHE H 1.0 1.668 3.072 2772 2643 A 91 PHE HDy A 91 PHE H 1.0 1.790 3.616 2773 2643 A 91 PHE HDx A 91 PHE H 1.0 1.790 3.616 2774 2644 A 91 PHE HDy A 92 ASN H 1.0 1.994 5.576 2775 2644 A 91 PHE HDx A 92 ASN H 1.0 1.994 5.576 2776 2645 A 91 PHE HA A 92 ASN H 1.0 1.912 4.404 2777 2646 A 92 ASN H A 93 ASN H 1.0 1.884 4.184 2778 2647 A 91 PHE HDy A 93 ASN H 1.0 1.908 4.370 2779 2647 A 91 PHE HDx A 93 ASN H 1.0 1.908 4.370 2780 2648 A 93 ASN HA A 93 ASN H 1.0 1.804 3.690 2781 2649 A 92 ASN HA A 93 ASN H 1.0 1.915 4.429 2782 2650 A 91 PHE HBy A 93 ASN H 1.0 1.833 3.853 2783 2651 A 92 ASN HBy A 93 ASN H 1.0 2.000 5.000 2784 2652 A 93 ASN HBx A 93 ASN H 1.0 1.780 3.570 2785 2653 A 97 MET HGy A 93 ASN H 1.0 2.000 5.000 2786 2654 A 97 MET HE% A 93 ASN H 1.0 1.946 4.734 2787 2655 A 96 VAL HGy% A 93 ASN H 1.0 1.948 4.760 2788 2656 A 93 ASN HA A 94 ARG H 1.0 1.792 3.624 2789 2657 A 94 ARG HA A 94 ARG H 1.0 1.961 4.923 2790 2658 A 94 ARG HBy A 94 ARG H 1.0 1.887 4.211 2791 2659 A 94 ARG HBx A 94 ARG H 1.0 1.913 4.413 2792 2660 A 97 MET HE% A 94 ARG H 1.0 1.925 4.529 2793 2661 A 94 ARG H A 95 THR H 1.0 1.864 4.050 2794 2662 A 95 THR H A 96 VAL H 1.0 1.712 3.252 2795 2663 A 93 ASN HA A 95 THR H 1.0 1.939 4.665 2796 2664 A 95 THR HB A 95 THR H 1.0 1.633 2.941 2797 2665 A 95 THR HA A 95 THR H 1.0 1.737 3.361 2798 2666 A 94 ARG HA A 95 THR H 1.0 1.903 4.339 2799 2667 A 93 ASN HBy A 95 THR H 1.0 1.974 5.104 2800 2668 A 96 VAL HB A 95 THR H 1.0 1.973 5.097 2801 2669 A 94 ARG HBx A 95 THR H 1.0 1.894 4.270 2802 2670 A 94 ARG HBy A 95 THR H 1.0 1.832 3.850 2803 2671 A 95 THR HG2% A 95 THR H 1.0 2.000 5.000 2804 2672 A 95 THR HB A 96 VAL H 1.0 1.772 3.528 2805 2673 A 95 THR HA A 96 VAL H 1.0 1.926 4.542 2806 2674 A 96 VAL HA A 96 VAL H 1.0 1.802 3.680 2807 2675 A 93 ASN HBy A 96 VAL H 1.0 1.926 4.540 2808 2676 A 93 ASN HBx A 96 VAL H 1.0 1.923 4.501 2809 2677 A 96 VAL HB A 96 VAL H 1.0 1.716 3.272 2810 2678 A 96 VAL HGy% A 96 VAL H 1.0 1.640 2.968 2811 2679 A 97 MET H A 98 ASP H 1.0 1.826 3.814 2812 2680 A 96 VAL H A 97 MET H 1.0 1.786 3.598 2813 2681 A 96 VAL HA A 97 MET H 1.0 1.921 4.487 2814 2682 A 94 ARG HA A 97 MET H 1.0 1.888 4.218 2815 2683 A 93 ASN HBx A 97 MET H 1.0 1.951 4.801 2816 2684 A 96 VAL HB A 97 MET H 1.0 1.676 3.102 2817 2685 A 97 MET HBy A 97 MET H 1.0 1.730 3.330 2818 2686 A 100 ILE HG1x A 97 MET H 1.0 1.945 4.721 2819 2687 A 96 VAL HGx% A 97 MET H 1.0 1.793 3.631 2820 2688 A 96 VAL HGy% A 97 MET H 1.0 1.839 3.887 2821 2689 A 96 VAL H A 98 ASP H 1.0 1.871 4.101 2822 2690 A 98 ASP HA A 98 ASP H 1.0 1.784 3.590 2823 2691 A 95 THR HA A 98 ASP H 1.0 1.872 4.102 2824 2692 A 94 ARG HA A 98 ASP H 1.0 1.831 3.845 2825 2693 A 98 ASP HBy A 98 ASP H 1.0 1.714 3.260 2826 2694 A 98 ASP HBx A 98 ASP H 1.0 1.775 3.539 2827 2695 A 97 MET HGy A 98 ASP H 1.0 1.853 3.981 2828 2696 A 97 MET HBy A 98 ASP H 1.0 2.000 5.000 2829 2697 A 94 ARG HBy A 98 ASP H 1.0 1.949 4.765 2830 2698 A 98 ASP H A 99 ASN H 1.0 1.781 3.571 2831 2699 A 99 ASN H A 101 LYS H 1.0 1.979 5.207 2832 2700 A 99 ASN H A 99 ASN HD22 1.0 1.960 4.908 2833 2701 A 99 ASN HA A 99 ASN H 1.0 1.736 3.356 2834 2702 A 98 ASP HA A 99 ASN H 1.0 1.907 4.367 2835 2703 A 95 THR HA A 99 ASN H 1.0 1.944 4.716 2836 2704 A 96 VAL HA A 99 ASN H 1.0 1.894 4.268 2837 2705 A 99 ASN HBy A 99 ASN H 1.0 1.699 3.199 2838 2706 A 98 ASP HBy A 99 ASN H 1.0 1.695 3.183 2839 2707 A 98 ASP HBx A 99 ASN H 1.0 1.873 4.115 2840 2708 A 95 THR HG2% A 99 ASN H 1.0 2.000 5.000 2841 2709 A 97 MET HA A 99 ASN H 1.0 1.995 5.591 2842 2710 A 96 VAL HA A 100 ILE H 1.0 1.990 5.468 2843 2711 A 100 ILE HA A 100 ILE H 1.0 1.813 3.739 2844 2712 A 97 MET HA A 100 ILE H 1.0 1.960 4.906 2845 2713 A 100 ILE HB A 100 ILE H 1.0 1.689 3.159 2846 2714 A 100 ILE HG1x A 100 ILE H 1.0 1.803 3.689 2847 2715 A 100 ILE HG1y A 100 ILE H 1.0 1.817 3.765 2848 2716 A 100 ILE HG2% A 100 ILE H 1.0 1.859 4.019 2849 2717 A 100 ILE HD1% A 100 ILE H 1.0 1.908 4.372 2850 2718 A 101 LYS H A 100 ILE H 1.0 1.722 3.296 2851 2719 A 98 ASP HA A 101 LYS H 1.0 1.883 4.183 2852 2720 A 101 LYS HA A 101 LYS H 1.0 1.771 3.519 2853 2721 A 101 LYS HBy A 101 LYS H 1.0 1.751 3.425 2854 2722 A 100 ILE HB A 101 LYS H 1.0 1.755 3.443 2855 2723 A 101 LYS HBx A 101 LYS H 1.0 1.728 3.320 2856 2724 A 101 LYS HDx A 101 LYS H 1.0 1.932 4.592 2857 2725 A 101 LYS H A 101 LYS HGy 1.0 1.864 4.052 2858 2726 A 60 LEU HDy% A 101 LYS H 1.0 1.969 5.037 2859 2727 A 60 LEU HDx% A 101 LYS H 1.0 1.872 4.104 2860 2728 A 104 LEU HDy% A 101 LYS H 1.0 1.991 5.467 2861 2729 A 100 ILE HG2% A 101 LYS H 1.0 1.874 4.122 2862 2730 A 100 ILE HG1y A 101 LYS H 1.0 2.000 5.000 2863 2731 A 97 MET HA A 101 LYS H 1.0 1.991 5.479 2864 2732 A 100 ILE HD1% A 101 LYS H 1.0 1.994 5.560 2865 2733 A 100 ILE HG1x A 101 LYS H 1.0 1.940 4.674 2866 2734 A 101 LYS H A 102 MET H 1.0 1.821 3.783 2867 2735 A 99 ASN HA A 102 MET H 1.0 1.916 4.438 2868 2736 A 99 ASN HA A 103 THR H 1.0 1.916 4.438 2869 2737 A 98 ASP HA A 102 MET H 1.0 1.943 4.709 2870 2738 A 102 MET HA A 102 MET H 1.0 1.754 3.444 2871 2739 A 101 LYS HA A 102 MET H 1.0 1.890 4.234 2872 2740 A 102 MET HGy A 102 MET H 1.0 2.000 5.000 2873 2741 A 102 MET HGx A 102 MET H 1.0 2.000 5.000 2874 2742 A 102 MET HBx A 102 MET H 1.0 1.703 3.215 2875 2743 A 102 MET HBy A 102 MET H 1.0 1.743 3.389 2876 2744 A 101 LYS HBy A 102 MET H 1.0 1.787 3.603 2877 2745 A 101 LYS HBx A 102 MET H 1.0 1.860 4.022 2878 2746 A 101 LYS HDx A 102 MET H 1.0 1.989 5.417 2879 2747 A 101 LYS HGx A 102 MET H 1.0 1.901 4.321 2880 2748 A 101 LYS HE2 A 102 MET H 1.0 1.989 5.413 2881 2749 A 104 LEU H A 105 GLN H 1.0 1.799 3.665 2882 2750 A 104 LEU H A 106 GLN H 1.0 1.950 4.790 2883 2751 A 103 THR HB A 104 LEU H 1.0 1.736 3.356 2884 2752 A 103 THR HA A 104 LEU H 1.0 2.000 5.000 2885 2753 A 101 LYS HA A 104 LEU H 1.0 1.892 4.248 2886 2754 A 104 LEU HBy A 104 LEU H 1.0 1.774 3.538 2887 2755 A 104 LEU HG A 104 LEU H 1.0 1.751 3.427 2888 2756 A 104 LEU HBx A 104 LEU H 1.0 1.829 3.831 2889 2757 A 104 LEU H A 107 ILE HG1y 1.0 1.878 4.144 2890 2758 A 104 LEU H A 103 THR HG2% 1.0 1.746 3.400 2891 2759 A 104 LEU HDx% A 104 LEU H 1.0 1.765 3.495 2892 2760 A 105 GLN HA A 105 GLN H 1.0 1.749 3.415 2893 2761 A 102 MET HA A 105 GLN H 1.0 1.899 4.307 2894 2762 A 105 GLN HGy A 105 GLN H 1.0 1.861 4.033 2895 2763 A 105 GLN HGx A 105 GLN H 1.0 1.853 3.975 2896 2764 A 105 GLN HBy A 105 GLN H 1.0 1.710 3.244 2897 2765 A 104 LEU HBy A 105 GLN H 1.0 1.680 3.122 2898 2766 A 104 LEU HG A 105 GLN H 1.0 1.847 3.941 2899 2767 A 48 LEU HDx% A 105 GLN H 1.0 1.848 3.948 2900 2768 A 48 LEU HDy% A 105 GLN H 1.0 1.812 3.736 2901 2769 A 104 LEU HBx A 105 GLN H 1.0 1.892 4.246 2902 2770 A 104 LEU HDx% A 105 GLN H 1.0 1.901 4.325 2903 2771 A 104 LEU HA A 105 GLN H 1.0 1.796 3.652 2904 2772 A 105 GLN H A 106 GLN H 1.0 1.754 3.438 2905 2773 A 106 GLN H A 107 ILE H 1.0 1.759 3.463 2906 2774 A 106 GLN HA A 106 GLN H 1.0 1.723 3.303 2907 2775 A 105 GLN HA A 106 GLN H 1.0 1.877 4.135 2908 2776 A 103 THR HA A 106 GLN H 1.0 1.834 3.862 2909 2777 A 106 GLN HGx A 106 GLN H 1.0 1.808 3.714 2910 2778 A 106 GLN HBy A 106 GLN H 1.0 1.676 3.104 2911 2779 A 106 GLN HBx A 106 GLN H 1.0 2.000 5.000 2912 2780 A 106 GLN H A 107 ILE HG1x 1.0 3.700 5.256 2913 2781 A 106 GLN H A 103 THR HG2% 1.0 1.935 4.623 2914 2782 A 106 GLN HA A 107 ILE H 1.0 1.905 4.353 2915 2783 A 104 LEU HA A 107 ILE H 1.0 1.864 4.054 2916 2784 A 107 ILE HA A 107 ILE H 1.0 1.796 3.652 2917 2785 A 106 GLN HBy A 107 ILE H 1.0 1.850 3.964 2918 2786 A 106 GLN HBx A 107 ILE H 1.0 1.862 4.038 2919 2787 A 107 ILE H A 107 ILE HG1x 1.0 1.735 3.351 2920 2788 A 107 ILE HB A 107 ILE H 1.0 1.698 3.192 2921 2789 A 107 ILE H A 107 ILE HG1y 1.0 1.768 3.506 2922 2790 A 107 ILE H A 103 THR HG2% 1.0 2.000 5.000 2923 2791 A 107 ILE HD1% A 107 ILE H 1.0 1.836 3.876 2924 2792 A 107 ILE H A 108 ILE H 1.0 1.747 3.409 2925 2793 A 107 ILE HA A 108 ILE H 1.0 1.954 4.822 2926 2794 A 108 ILE HA A 108 ILE H 1.0 1.814 3.746 2927 2795 A 105 GLN HA A 108 ILE H 1.0 1.922 4.494 2928 2796 A 108 ILE H A 107 ILE HG1x 1.0 3.800 5.000 2929 2797 A 107 ILE HB A 108 ILE H 1.0 1.694 3.178 2930 2798 A 108 ILE HG1y A 108 ILE H 1.0 1.835 3.867 2931 2799 A 108 ILE HG2% A 108 ILE H 1.0 2.000 5.000 2932 2800 A 108 ILE H A 107 ILE HG2% 1.0 1.850 3.962 2933 2801 A 108 ILE HD1% A 108 ILE H 1.0 1.825 3.811 2934 2802 A 107 ILE HD1% A 108 ILE H 1.0 2.000 5.000 2935 2803 A 108 ILE H A 107 ILE HG1y 1.0 2.000 5.000 2936 2804 A 115 ASP HA A 115 ASP H 1.0 1.740 3.376 2937 2805 A 114 ALA HA A 115 ASP H 1.0 1.704 3.218 2938 2806 A 115 ASP H A 115 ASP HBy 1.0 1.668 3.074 2939 2807 A 114 ALA HB% A 115 ASP H 1.0 1.794 3.640 2940 2808 A 114 ALA H A 113 ASP H 1.0 1.710 3.246 2941 2809 A 115 ASP H A 114 ALA H 1.0 1.725 3.311 2942 2810 A 113 ASP HA A 114 ALA H 1.0 2.000 5.000 2943 2811 A 114 ALA HA A 114 ALA H 1.0 1.703 3.215 2944 2812 A 113 ASP HBy A 114 ALA H 1.0 1.827 3.819 2945 2813 A 113 ASP HBx A 114 ALA H 1.0 1.819 3.773 2946 2814 A 114 ALA HB% A 114 ALA H 1.0 1.575 2.737 2947 2815 A 112 LYS H A 110 ARG H 1.0 1.898 4.294 2948 2816 A 112 LYS H A 111 TYR H 1.0 1.685 3.141 2949 2817 A 112 LYS HA A 112 LYS H 1.0 1.669 3.079 2950 2818 A 109 SER HA A 112 LYS H 1.0 1.861 4.031 2951 2819 A 110 ARG HA A 112 LYS H 1.0 1.947 4.757 2952 2820 A 111 TYR HBy A 112 LYS H 1.0 1.916 4.440 2953 2821 A 111 TYR HBx A 112 LYS H 1.0 1.889 4.229 2954 2822 A 112 LYS HB3 A 112 LYS H 1.0 1.572 2.726 2955 2823 A 112 LYS HGx A 112 LYS H 1.0 2.000 5.000 2956 2824 A 110 ARG H A 109 SER H 1.0 1.734 3.348 2957 2825 A 109 SER HBy A 110 ARG H 1.0 2.000 5.000 2958 2826 A 110 ARG HA A 110 ARG H 1.0 1.694 3.178 2959 2827 A 109 SER HA A 110 ARG H 1.0 1.850 3.960 2960 2828 A 107 ILE HA A 110 ARG H 1.0 1.898 4.294 2961 2829 A 108 ILE HA A 110 ARG H 1.0 1.966 4.988 2962 2830 A 110 ARG HDx A 110 ARG H 1.0 1.990 5.462 2963 2831 A 110 ARG HDy A 110 ARG H 1.0 1.969 5.035 2964 2832 A 110 ARG HGy A 110 ARG H 1.0 2.000 5.000 2965 2833 A 110 ARG HGx A 110 ARG H 1.0 1.834 3.862 2966 2834 A 108 ILE H A 109 SER H 1.0 1.760 3.468 2967 2835 A 109 SER HA A 109 SER H 1.0 1.702 3.210 2968 2836 A 109 SER HBy A 109 SER H 1.0 1.621 2.897 2969 2837 A 105 GLN HA A 109 SER H 1.0 1.893 4.251 2970 2838 A 108 ILE HA A 109 SER H 1.0 1.876 4.132 2971 2839 A 108 ILE HB A 109 SER H 1.0 1.770 3.516 2972 2840 A 108 ILE HG1x A 109 SER H 1.0 2.000 5.000 2973 2841 A 108 ILE HG1y A 109 SER H 1.0 1.952 4.808 2974 2842 A 108 ILE HG2% A 109 SER H 1.0 1.827 3.825 2975 2843 A 108 ILE HD1% A 109 SER H 1.0 2.000 5.000 2976 2844 A 110 ARG H A 111 TYR H 1.0 1.671 3.083 2977 2845 A 111 TYR HDy A 111 TYR H 1.0 1.837 3.877 2978 2845 A 111 TYR HDx A 111 TYR H 1.0 1.837 3.877 2979 2846 A 113 ASP H A 111 TYR H 1.0 1.994 5.584 2980 2847 A 111 TYR H A 109 SER H 1.0 1.942 4.696 2981 2848 A 109 SER HA A 111 TYR H 1.0 1.943 4.705 2982 2849 A 110 ARG HA A 111 TYR H 1.0 1.862 4.036 2983 2850 A 108 ILE HA A 111 TYR H 1.0 1.907 4.365 2984 2851 A 111 TYR HBy A 111 TYR H 1.0 1.782 3.576 2985 2852 A 111 TYR HBx A 111 TYR H 1.0 1.724 3.304 2986 2853 A 112 LYS HB3 A 111 TYR H 1.0 2.000 5.000 2987 2854 A 110 ARG HB2 A 111 TYR H 1.0 1.726 3.314 2988 2855 A 110 ARG HGx A 111 TYR H 1.0 1.943 4.707 2989 2856 A 108 ILE HG2% A 111 TYR H 1.0 1.999 6.173 2990 2857 A 113 ASP H A 112 LYS H 1.0 1.761 3.473 2991 2858 A 113 ASP HA A 113 ASP H 1.0 1.686 3.142 2992 2859 A 112 LYS HA A 113 ASP H 1.0 2.000 5.000 2993 2860 A 113 ASP HBx A 113 ASP H 1.0 1.687 3.151 2994 2861 A 113 ASP HBy A 113 ASP H 1.0 1.736 3.356 2995 2862 A 112 LYS HB2 A 113 ASP H 1.0 2.000 5.000 2996 2863 A 112 LYS HGy A 113 ASP H 1.0 1.979 5.199 2997 2864 A 102 MET H A 103 THR H 1.0 1.765 3.491 2998 2865 A 103 THR H A 104 LEU H 1.0 1.775 3.541 2999 2866 A 103 THR H A 105 GLN H 1.0 1.963 4.953 3000 2867 A 102 MET HA A 103 THR H 1.0 1.883 4.181 3001 2868 A 103 THR HB A 103 THR H 1.0 1.694 3.178 3002 2869 A 103 THR HA A 103 THR H 1.0 1.736 3.356 3003 2870 A 100 ILE HA A 103 THR H 1.0 1.895 4.269 3004 2871 A 102 MET HGy A 103 THR H 1.0 1.985 5.331 3005 2872 A 102 MET HBx A 103 THR H 1.0 1.804 3.696 3006 2873 A 102 MET HBy A 103 THR H 1.0 1.793 3.635 3007 2874 A 103 THR H A 103 THR HG2% 1.0 1.806 3.702 3008 2875 A 102 MET HGx A 103 THR H 1.0 1.997 5.687 3009 2876 A 89 PHE HDy A 89 PHE H 1.0 1.864 4.054 3010 2876 A 89 PHE HDx A 89 PHE H 1.0 1.864 4.054 3011 2877 A 61 ARG HA A 89 PHE H 1.0 1.861 4.029 3012 2878 A 88 MET HA A 89 PHE H 1.0 1.650 3.004 3013 2879 A 89 PHE HA A 89 PHE H 1.0 1.885 4.191 3014 2880 A 89 PHE HBx A 89 PHE H 1.0 1.824 3.798 3015 2881 A 88 MET HGy A 89 PHE H 1.0 1.921 4.489 3016 2882 A 88 MET HGx A 89 PHE H 1.0 1.907 4.363 3017 2883 A 88 MET HBx A 89 PHE H 1.0 1.911 4.401 3018 2884 A 88 MET HBy A 89 PHE H 1.0 1.925 4.527 3019 2885 A 60 LEU HDy% A 89 PHE H 1.0 1.972 5.080 3020 2886 A 81 VAL HGx% A 81 VAL H 1.0 1.728 3.320 3021 2887 A 51 THR HG2% A 51 THR H 1.0 1.814 3.750 3022 2888 A 17 ALA HA A 4 SER H 1.0 1.974 5.124 3023 2889 A 17 ALA HA A 5 GLY H 1.0 1.988 5.396 3024 2890 A 7 ALA H A 8 ILE H 1.0 1.972 5.072 3025 2891 A 9 PHE HEy A 10 GLU H 1.0 1.988 5.394 3026 2891 A 9 PHE HEx A 10 GLU H 1.0 1.988 5.394 3027 2892 A 10 GLU HBy A 12 VAL H 1.0 1.948 4.762 3028 2893 A 13 SER H A 14 GLY H 1.0 1.951 4.799 3029 2894 A 13 SER HBx A 13 SER H 1.0 2.000 5.000 3030 2895 A 8 ILE HD1% A 13 SER H 1.0 1.986 5.360 3031 2896 A 8 ILE HG2% A 14 GLY H 1.0 1.992 5.524 3032 2897 A 17 ALA H A 18 ILE H 1.0 1.964 4.964 3033 2898 A 18 ILE H A 19 ASN H 1.0 1.976 5.148 3034 2899 A 4 SER HA A 18 ILE H 1.0 1.943 4.705 3035 2900 A 4 SER HBy A 18 ILE H 1.0 1.960 4.904 3036 2901 A 3 HIS HBx A 18 ILE H 1.0 1.950 4.786 3037 2902 A 18 ILE HB A 18 ILE H 1.0 1.742 3.382 3038 2903 A 19 ASN H A 26 GLU H 1.0 1.930 4.576 3039 2904 A 26 GLU HA A 19 ASN H 1.0 2.000 5.000 3040 2905 A 20 GLU HGx A 20 GLU H 1.0 1.825 3.807 3041 2906 A 22 VAL HGy% A 22 VAL H 1.0 1.575 2.737 3042 2907 A 26 GLU H A 27 LEU H 1.0 1.969 5.029 3043 2908 A 40 VAL HGy% A 27 LEU H 1.0 1.978 5.194 3044 2909 A 14 GLY HAy A 30 ARG H 1.0 2.000 6.134 3045 2910 A 31 SER HBy A 32 THR H 1.0 1.829 3.837 3046 2911 A 31 SER HA A 32 THR H 1.0 1.594 2.802 3047 2912 A 31 SER HBx A 32 THR H 1.0 2.000 5.000 3048 2913 A 32 THR HA A 32 THR H 1.0 1.734 3.350 3049 2914 A 14 GLY HAy A 32 THR H 1.0 1.811 3.733 3050 2915 A 32 THR HG2% A 32 THR H 1.0 1.882 4.172 3051 2916 A 12 VAL HGy% A 32 THR H 1.0 1.914 4.426 3052 2917 A 34 GLY H A 35 ASP H 1.0 1.723 3.303 3053 2918 A 38 HIS H A 39 THR H 1.0 1.972 5.084 3054 2919 A 40 VAL H A 39 THR H 1.0 1.987 5.365 3055 2920 A 28 THR H A 19 ASN H 1.0 1.843 3.913 3056 2921 A 42 LEU H A 41 VAL H 1.0 1.910 4.392 3057 2922 A 41 VAL HA A 41 VAL H 1.0 1.783 3.579 3058 2923 A 41 VAL HGx% A 41 VAL H 1.0 1.809 3.719 3059 2924 A 42 LEU HA A 42 LEU H 1.0 1.791 3.625 3060 2925 A 48 LEU H A 49 GLN H 1.0 1.952 4.802 3061 2926 A 63 ILE H A 48 LEU H 1.0 1.942 4.694 3062 2927 A 48 LEU HG A 48 LEU H 1.0 1.832 3.850 3063 2928 A 48 LEU HDx% A 48 LEU H 1.0 1.776 3.546 3064 2929 A 52 PRO HDy A 51 THR H 1.0 1.988 5.392 3065 2930 A 55 SER H A 56 GLU H 1.0 1.974 5.108 3066 2931 A 55 SER H A 57 LYS H 1.0 1.976 5.146 3067 2932 A 55 SER HBy A 56 GLU H 1.0 1.984 5.298 3068 2933 A 57 LYS H A 58 MET H 1.0 1.983 5.267 3069 2934 A 58 MET HE% A 59 MET H 1.0 1.801 3.675 3070 2935 A 59 MET HE% A 59 MET H 1.0 1.846 3.938 3071 2936 A 61 ARG H A 62 LEU H 1.0 2.000 5.000 3072 2937 A 92 ASN HBy A 93 ASN HD21 1.0 1.952 4.806 3073 2938 A 92 ASN HBy A 93 ASN HD22 1.0 1.961 4.923 3074 2939 A 93 ASN HD21 A 93 ASN HD22 1.0 1.663 3.053 3075 2940 A 93 ASN HA A 93 ASN HD22 1.0 1.998 5.730 3076 2941 A 92 ASN HBy A 92 ASN HD22 1.0 1.869 4.081 3077 2942 A 92 ASN HBy A 92 ASN HD21 1.0 1.895 4.267 3078 2943 A 92 ASN HD22 A 92 ASN HD21 1.0 1.504 2.514 3079 2944 A 19 ASN HBy A 19 ASN HD22 1.0 1.918 4.462 3080 2945 A 19 ASN HBx A 19 ASN HD22 1.0 1.895 4.273 3081 2946 A 19 ASN HBy A 19 ASN HD21 1.0 1.946 4.742 3082 2947 A 19 ASN HBx A 19 ASN HD21 1.0 1.927 4.539 3083 2948 A 85 GLN HGy A 85 GLN HE21 1.0 1.973 5.099 3084 2949 A 85 GLN HGx A 85 GLN HE21 1.0 1.982 5.252 3085 2950 A 85 GLN HGy A 85 GLN HE22 1.0 1.950 4.786 3086 2951 A 85 GLN HGx A 85 GLN HE22 1.0 1.957 4.873 3087 2952 A 78 ASN HBy A 78 ASN HD21 1.0 1.830 3.842 3088 2953 A 78 ASN HBx A 78 ASN HD21 1.0 1.981 5.235 3089 2954 A 76 GLU HGx A 78 ASN HD21 1.0 1.984 5.296 3090 2955 A 76 GLU HBy A 78 ASN HD21 1.0 1.976 5.146 3091 2956 A 78 ASN HBy A 78 ASN HD22 1.0 1.747 3.407 3092 2957 A 78 ASN HBx A 78 ASN HD22 1.0 1.931 4.583 3093 2958 A 76 GLU HBx A 78 ASN HD22 1.0 1.981 5.233 3094 2959 A 76 GLU HBy A 78 ASN HD22 1.0 1.966 4.982 3095 2960 A 78 ASN H A 78 ASN HD21 1.0 1.968 5.016 3096 2961 A 78 ASN H A 78 ASN HD22 1.0 1.932 4.602 3097 2962 A 29 TRP HD1 A 29 TRP HE1 1.0 1.661 3.045 3098 2963 A 29 TRP HE1 A 30 ARG H 1.0 2.000 5.000 3099 2964 A 9 PHE H A 29 TRP HE1 1.0 1.883 4.181 3100 2965 A 14 GLY H A 29 TRP HE1 1.0 1.742 3.386 3101 2966 A 8 ILE HA A 29 TRP HE1 1.0 1.872 4.100 3102 2967 A 13 SER HA A 29 TRP HE1 1.0 1.906 4.366 3103 2968 A 14 GLY HAy A 29 TRP HE1 1.0 1.895 4.279 3104 2969 A 14 GLY HAx A 29 TRP HE1 1.0 1.855 3.991 3105 2970 A 8 ILE HG1x A 29 TRP HE1 1.0 2.000 5.884 3106 2971 A 9 PHE HBy A 29 TRP HE1 1.0 1.916 4.448 3107 2972 A 7 ALA HB% A 29 TRP HE1 1.0 1.841 3.907 3108 2973 A 9 PHE HBx A 29 TRP HE1 1.0 1.991 5.485 3109 2974 A 69 SER HBx A 70 LYS H 1.0 1.977 5.153 3110 2975 A 71 LYS HBy A 72 ARG H 1.0 2.000 5.000 3111 2976 A 38 HIS HBx A 39 THR H 1.0 1.942 4.702 3112 2977 A 38 HIS HBx A 38 HIS H 1.0 1.849 3.953 3113 2978 A 49 GLN HGy A 49 GLN HE22 1.0 1.911 4.397 3114 2979 A 49 GLN HGy A 49 GLN HE21 1.0 1.914 4.426 3115 2980 A 49 GLN HGx A 49 GLN HE22 1.0 1.961 4.923 3116 2981 A 49 GLN HGx A 49 GLN HE21 1.0 1.972 5.076 3117 2982 A 63 ILE HD1% A 49 GLN HE22 1.0 1.996 5.682 3118 2983 A 95 THR HG2% A 99 ASN HD22 1.0 1.920 4.476 3119 2984 A 95 THR HG2% A 99 ASN HD21 1.0 1.896 4.280 3120 2985 A 99 ASN H A 99 ASN HD21 1.0 1.976 5.154 3121 2986 A 48 LEU HDy% A 105 GLN HE22 1.0 1.976 5.152 3122 2987 A 22 VAL HGx% A 19 ASN HD21 1.0 1.881 4.169 3123 2988 A 22 VAL HGx% A 19 ASN HD22 1.0 1.904 4.344 3124 2989 A 42 LEU HDy% A 42 LEU H 1.0 1.863 4.045 3125 2990 A 42 LEU HDy% A 43 SER H 1.0 1.979 5.207 3126 2991 A 7 ALA HB% A 16 ILE H 1.0 1.963 4.947 3127 2992 A 16 ILE H A 17 ALA H 1.0 1.952 4.806 3128 2993 A 28 THR HG2% A 38 HIS H 1.0 1.960 4.916 3129 2994 A 87 HIS HBy A 62 LEU H 1.0 1.990 5.438 3130 2995 A 88 MET HGy A 88 MET H 1.0 1.979 5.201 3131 2996 A 66 VAL H A 67 ASP H 1.0 1.915 4.431 3132 2997 A 6 ALA H A 7 ALA H 1.0 1.907 4.369 3133 2998 A 72 ARG H A 80 VAL H 1.0 1.835 3.869 3134 2999 A 8 ILE HA A 12 VAL H 1.0 1.981 5.241 3135 3000 A 29 TRP HH2 A 12 VAL H 1.0 1.955 4.843 3136 3001 A 10 GLU H A 12 VAL H 1.0 1.980 5.218 3137 3002 A 63 ILE H A 49 GLN H 1.0 1.944 4.718 3138 3003 A 45 ILE HD1% A 63 ILE H 1.0 1.993 5.507 3139 3004 A 49 GLN HBx A 49 GLN H 1.0 1.798 3.656 3140 3005 A 29 TRP HA A 15 ILE H 1.0 1.979 5.197 3141 3006 A 28 THR H A 27 LEU H 1.0 1.974 5.114 3142 3007 A 17 ALA HB% A 28 THR H 1.0 2.000 5.000 3143 3008 A 18 ILE HG2% A 20 GLU H 1.0 1.986 5.344 3144 3009 A 89 PHE H A 90 SER H 1.0 1.952 4.818 3145 3010 A 96 VAL HGx% A 5 GLY H 1.0 1.963 4.943 3146 3011 A 75 ASN HA A 77 GLY H 1.0 1.987 5.373 3147 3012 A 42 LEU H A 44 THR H 1.0 1.995 5.593 3148 3013 A 42 LEU HBy A 44 THR H 1.0 1.963 4.941 3149 3014 A 48 LEU HDx% A 47 LYS H 1.0 1.967 5.001 3150 3015 A 25 ALA HB% A 22 VAL H 1.0 1.991 5.461 3151 3016 A 19 ASN HA A 22 VAL H 1.0 1.990 5.428 3152 3017 A 2 SER H A 4 SER H 1.0 1.960 4.908 3153 3018 A 41 VAL HGy% A 26 GLU H 1.0 1.967 5.007 3154 3019 A 69 SER HBx A 69 SER H 1.0 2.000 5.000 3155 3020 A 63 ILE HD1% A 64 GLY H 1.0 1.966 4.994 3156 3021 A 63 ILE HB A 64 GLY H 1.0 1.919 4.473 3157 3022 A 91 PHE HBy A 92 ASN H 1.0 2.000 6.014 3158 3023 A 92 ASN HA A 92 ASN H 1.0 1.988 5.386 3159 3024 A 102 MET H A 105 GLN H 1.0 1.991 5.491 3160 3025 A 100 ILE HB A 102 MET H 1.0 1.965 4.985 3161 3026 A 60 LEU HDx% A 102 MET H 1.0 1.984 5.288 3162 3027 A 104 LEU HDx% A 102 MET H 1.0 1.986 5.350 3163 3028 A 112 LYS HA A 111 TYR H 1.0 1.995 5.585 3164 3029 A 43 SER HA A 111 TYR H 1.0 1.989 5.427 3165 3030 A 32 THR H A 31 SER HG 1.0 1.998 5.786 3166 3031 A 12 VAL HGx% A 32 THR H 1.0 1.998 5.724 3167 3032 A 91 PHE HDy A 97 MET H 1.0 1.808 3.712 3168 3032 A 91 PHE HDx A 97 MET H 1.0 1.808 3.712 3169 3033 A 95 THR H A 97 MET H 1.0 1.968 5.024 3170 3034 A 102 MET H A 104 LEU H 1.0 1.976 5.148 3171 3035 A 48 LEU HDy% A 104 LEU H 1.0 1.894 4.266 3172 3036 A 7 ALA H A 29 TRP HE1 1.0 1.878 4.144 3173 3037 A 16 ILE HB A 7 ALA H 1.0 1.935 4.615 3174 3038 A 91 PHE HEy A 91 PHE H 1.0 1.990 5.458 3175 3038 A 91 PHE HEx A 91 PHE H 1.0 1.990 5.458 3176 3039 A 25 ALA H A 26 GLU H 1.0 2.000 5.000 3177 3040 A 29 TRP HZ3 A 36 LYS H 1.0 1.991 5.469 3178 3041 A 67 ASP HBy A 70 LYS H 1.0 1.999 5.849 3179 3042 A 110 ARG H A 107 ILE HG2% 1.0 1.989 5.433 3180 3043 A 86 ARG H A 87 HIS H 1.0 1.977 5.171 3181 3044 A 109 SER HA A 113 ASP H 1.0 1.960 4.908 3182 3045 A 110 ARG HA A 113 ASP H 1.0 1.953 4.821 3183 3046 A 73 LYS H A 80 VAL H 1.0 2.000 5.000 3184 3047 A 85 GLN HBx A 85 GLN H 1.0 2.000 5.000 3185 3048 A 29 TRP HZ3 A 37 VAL H 1.0 1.981 5.241 3186 3049 A 66 VAL HGx% A 66 VAL H 1.0 1.785 3.589 3187 3050 A 63 ILE HD1% A 87 HIS H 1.0 1.988 5.380 3188 3051 A 62 LEU HDx% A 87 HIS H 1.0 1.979 5.197 3189 3052 A 62 LEU HDy% A 87 HIS H 1.0 1.997 6.275 3190 3053 A 8 ILE HG2% A 13 SER H 1.0 1.983 5.281 3191 3054 A 95 THR HA A 99 ASN H 1.0 2.000 4.800 3192 3055 A 100 ILE HA A 103 THR HB 1.0 2.000 4.800 3193 3056 A 100 ILE HA A 103 THR HG2% 1.0 2.000 4.800 3194 3056 A 100 ILE HA A 103 THR HG1 1.0 2.000 4.800 3195 3057 A 101 LYS HA A 105 GLN H 1.0 2.000 4.800 3196 3058 A 102 MET HA A 105 GLN H 1.0 2.000 4.800 3197 3059 A 106 GLN H A 103 THR HG2% 1.0 2.000 4.800 3198 3059 A 106 GLN H A 103 THR HG1 1.0 2.000 4.800 3199 3060 A 106 GLN HA A 110 ARG H 1.0 2.000 4.800 3200 3061 A 107 ILE HA A 111 TYR H 1.0 2.000 4.800 3201 3062 A 111 TYR H A 107 ILE HG1x 1.0 2.000 4.800 3202 3062 A 111 TYR H A 107 ILE HG2% 1.0 2.000 4.800 3203 3062 A 111 TYR H A 107 ILE HG1y 1.0 2.000 4.800 3204 3063 A 111 TYR HDx A 108 ILE HA 1.0 2.000 4.800 3205 3063 A 111 TYR HDy A 108 ILE HA 1.0 2.000 4.800 3206 3064 A 108 ILE HA A 112 LYS H 1.0 2.000 4.800 3207 3065 A 111 TYR HA A 115 ASP H 1.0 2.000 4.800 3208 3066 B 545 LEU HBx B 545 LEU HA 1.0 1.683 3.129 3209 3067 B 528 LEU HBx B 528 LEU HA 1.0 1.723 3.301 3210 3068 B 520 SER HBx B 520 SER HA 1.0 1.765 3.495 3211 3069 B 528 LEU HBy B 528 LEU HDy% 1.0 1.514 2.544 3212 3070 B 524 PRO HDy B 524 PRO HGx 1.0 1.802 3.676 3213 3071 B 548 GLN HBy B 548 GLN HA 1.0 1.788 3.610 3214 3072 B 534 PHE HBx B 534 PHE HA 1.0 1.815 3.747 3215 3073 B 537 ILE HG1x B 537 ILE HB 1.0 1.887 4.209 3216 3074 B 549 ILE HG1y B 549 ILE HD1% 1.0 1.705 3.223 3217 3075 B 527 LEU HBx B 527 LEU HDy% 1.0 2.203 3.397 3218 3076 B 521 PRO HBx B 521 PRO HGy 1.0 1.655 3.021 3219 3077 B 520 SER HA B 520 SER HBy 1.0 1.787 3.599 3220 3078 B 521 PRO HDx B 521 PRO HGx 1.0 1.820 3.776 3221 3079 B 535 SER HA B 535 SER HBx 1.0 1.601 2.825 3222 3080 B 521 PRO HGy B 521 PRO HDx 1.0 1.820 3.776 3223 3081 B 524 PRO HBy B 524 PRO HA 1.0 1.733 3.343 3224 3082 B 521 PRO HDx B 521 PRO HBy 1.0 1.979 5.213 3225 3083 B 540 MET HB2 B 540 MET HGx 1.0 1.729 3.323 3226 3084 B 524 PRO HDy B 524 PRO HBy 1.0 1.977 5.151 3227 3085 B 546 LEU HBx B 546 LEU HDy% 1.0 1.633 2.941 3228 3086 B 549 ILE HD1% B 549 ILE HB 1.0 1.808 3.718 3229 3087 B 527 LEU HDy% B 527 LEU HBy 1.0 2.227 3.373 3230 3088 B 543 SER HA B 543 SER HBx 1.0 1.639 2.961 3231 3089 B 549 ILE HB B 549 ILE HG2% 1.0 1.653 3.013 3232 3090 B 532 GLU HBx B 532 GLU HG3 1.0 1.610 2.860 3233 3091 B 545 LEU HBy B 545 LEU HDx% 1.0 2.370 3.430 3234 3092 B 537 ILE HB B 537 ILE HG1y 1.0 1.808 3.714 3235 3093 B 521 PRO HGx B 521 PRO HBy 1.0 1.457 2.373 3236 3094 B 537 ILE HA B 537 ILE HG2% 1.0 1.692 3.168 3237 3095 B 549 ILE HG1y B 549 ILE HA 1.0 1.975 5.137 3238 3096 B 524 PRO HBx B 524 PRO HGy 1.0 2.483 3.449 3239 3097 B 521 PRO HGy B 521 PRO HDy 1.0 1.865 4.057 3240 3098 B 546 LEU HDy% B 546 LEU HG 1.0 1.642 2.974 3241 3099 B 527 LEU HBx B 527 LEU HDx% 1.0 1.541 2.627 3242 3100 B 545 LEU HG B 545 LEU HDy% 1.0 1.594 2.802 3243 3101 B 528 LEU HA B 528 LEU HBy 1.0 1.810 3.724 3244 3102 B 528 LEU HDy% B 528 LEU HG 1.0 1.495 2.487 3245 3103 B 533 ASP HBy B 533 ASP HA 1.0 1.638 2.956 3246 3104 B 537 ILE HG1x B 537 ILE HD1% 1.0 1.671 3.083 3247 3105 B 536 SER HA B 536 SER HBy 1.0 1.574 2.734 3248 3106 B 549 ILE HG1y B 549 ILE HG2% 1.0 1.880 4.160 3249 3107 B 546 LEU HDy% B 546 LEU HBy 1.0 1.649 2.999 3250 3108 B 527 LEU HBy B 527 LEU HA 1.0 1.772 3.526 3251 3109 B 548 GLN HA B 548 GLN HG3 1.0 1.784 3.588 3252 3110 B 543 SER HA B 543 SER HBy 1.0 1.621 2.895 3253 3111 B 521 PRO HGx B 521 PRO HA 1.0 1.914 4.432 3254 3112 B 540 MET HGy B 540 MET HB3 1.0 1.734 3.348 3255 3113 B 524 PRO HA B 524 PRO HBx 1.0 1.892 4.246 3256 3114 B 533 ASP HA B 533 ASP HBx 1.0 1.723 3.303 3257 3115 B 541 ASP HA B 541 ASP HBy 1.0 1.624 2.910 3258 3116 B 549 ILE HB B 549 ILE HA 1.0 1.803 3.685 3259 3117 B 538 ALA HA B 538 ALA HB% 1.0 1.557 2.679 3260 3118 B 549 ILE HA B 549 ILE HG1x 1.0 1.909 4.387 3261 3119 B 549 ILE HG1y B 549 ILE HB 1.0 1.867 4.071 3262 3120 B 525 ASN HA B 525 ASN HBx 1.0 1.895 4.271 3263 3121 B 521 PRO HBx B 521 PRO HGx 1.0 1.655 3.021 3264 3122 B 521 PRO HDx B 521 PRO HA 1.0 1.982 5.260 3265 3123 B 549 ILE HD1% B 549 ILE HG1x 1.0 1.708 3.234 3266 3124 B 546 LEU HG B 546 LEU HDx% 1.0 1.514 2.544 3267 3125 B 547 SER HA B 547 SER HB3 1.0 1.550 2.654 3268 3126 B 545 LEU HDx% B 545 LEU HG 1.0 1.514 2.544 3269 3127 B 546 LEU HBy B 546 LEU HDx% 1.0 1.529 2.589 3270 3128 B 532 GLU HG3 B 532 GLU HBy 1.0 2.250 3.354 3271 3129 B 524 PRO HDy B 524 PRO HBx 1.0 1.971 5.075 3272 3130 B 528 LEU HA B 528 LEU HG 1.0 1.723 3.301 3273 3131 B 527 LEU HBx B 527 LEU HA 1.0 1.727 3.315 3274 3132 B 540 MET HGy B 540 MET HE% 1.0 1.906 4.356 3275 3133 B 537 ILE HG1x B 537 ILE HG2% 1.0 1.790 3.620 3276 3134 B 551 SER HA B 551 SER HB3 1.0 1.773 3.535 3277 3135 B 521 PRO HGx B 521 PRO HDy 1.0 1.862 4.032 3278 3136 B 529 SER HB3 B 529 SER HA 1.0 1.645 2.985 3279 3137 B 532 GLU HG3 B 532 GLU HA 1.0 1.733 3.343 3280 3138 B 537 ILE HG1y B 537 ILE HA 1.0 1.888 4.216 3281 3139 B 545 LEU HA B 545 LEU HG 1.0 1.737 3.363 3282 3140 B 527 LEU HDx% B 527 LEU HG 1.0 1.541 2.627 3283 3141 B 521 PRO HBx B 521 PRO HA 1.0 1.930 4.570 3284 3142 B 531 ASP HA B 531 ASP HBx 1.0 1.754 3.442 3285 3143 B 540 MET HGx B 540 MET HE% 1.0 1.879 4.151 3286 3144 B 531 ASP HA B 531 ASP HBy 1.0 1.727 3.319 3287 3145 B 546 LEU HBy B 546 LEU HA 1.0 1.681 3.123 3288 3146 B 524 PRO HGx B 524 PRO HBx 1.0 2.483 3.449 3289 3147 B 528 LEU HBx B 528 LEU HDy% 1.0 1.495 2.487 3290 3148 B 521 PRO HGy B 521 PRO HA 1.0 1.914 4.432 3291 3149 B 524 PRO HGx B 524 PRO HBy 1.0 2.484 3.452 3292 3150 B 548 GLN HA B 548 GLN HG2 1.0 1.784 3.588 3293 3151 B 527 LEU HDy% B 527 LEU HG 1.0 1.588 2.782 3294 3152 B 537 ILE HB B 537 ILE HA 1.0 1.742 3.384 3295 3153 B 532 GLU HBy B 532 GLU HA 1.0 1.722 3.296 3296 3154 B 545 LEU HBx B 545 LEU HDx% 1.0 2.392 3.408 3297 3155 B 534 PHE HA B 534 PHE HBy 1.0 1.764 3.484 3298 3156 B 532 GLU HBx B 532 GLU HA 1.0 1.738 3.366 3299 3157 B 545 LEU HBx B 545 LEU HDy% 1.0 1.565 2.705 3300 3158 B 524 PRO HBx B 524 PRO HDx 1.0 1.950 4.786 3301 3159 B 537 ILE HG1y B 537 ILE HG2% 1.0 1.786 3.600 3302 3160 B 523 TYR HA B 523 TYR HBy 1.0 1.883 4.179 3303 3161 B 521 PRO HBy B 521 PRO HDy 1.0 1.995 5.609 3304 3162 B 537 ILE HG1y B 537 ILE HD1% 1.0 1.676 3.104 3305 3163 B 551 SER HA B 551 SER HB2 1.0 1.773 3.535 3306 3164 B 537 ILE HB B 537 ILE HG2% 1.0 1.593 2.797 3307 3165 B 528 LEU HBy B 528 LEU HDx% 1.0 1.921 4.485 3308 3165 B 549 ILE HB B 549 ILE HG1x 1.0 1.921 4.485 3309 3166 B 548 GLN HG3 B 548 GLN HBx 1.0 1.663 3.053 3310 3167 B 540 MET HGx B 540 MET HA 1.0 1.834 3.862 3311 3168 B 545 LEU HA B 545 LEU HBy 1.0 1.682 3.128 3312 3169 B 524 PRO HGx B 524 PRO HDx 1.0 1.833 3.853 3313 3170 B 521 PRO HBy B 521 PRO HA 1.0 1.733 3.343 3314 3171 B 545 LEU HBy B 545 LEU HDy% 1.0 1.621 3.895 3315 3172 B 537 ILE HG1x B 537 ILE HA 1.0 1.844 3.920 3316 3173 B 529 SER HA B 529 SER HB2 1.0 1.645 2.985 3317 3174 B 540 MET HGx B 540 MET HB3 1.0 1.729 3.323 3318 3175 B 540 MET HB2 B 540 MET HA 1.0 1.639 2.961 3319 3176 B 521 PRO HGy B 521 PRO HBy 1.0 1.457 2.373 3320 3177 B 532 GLU HBx B 532 GLU HG2 1.0 1.610 2.860 3321 3178 B 541 ASP HA B 541 ASP HBx 1.0 1.624 2.910 3322 3179 B 528 LEU HBx B 528 LEU HDx% 1.0 1.727 3.315 3323 3179 B 527 LEU HA B 527 LEU HG 1.0 1.727 3.315 3324 3180 B 545 LEU HBy B 545 LEU HG 1.0 2.283 2.917 3325 3181 B 542 PHE HA B 542 PHE HBy 1.0 1.762 3.480 3326 3182 B 536 SER HA B 536 SER HBx 1.0 1.574 2.734 3327 3183 B 539 ASP HBx B 539 ASP HA 1.0 1.609 2.857 3328 3184 B 550 SER HBy B 550 SER HA 1.0 1.661 3.043 3329 3185 B 524 PRO HGy B 524 PRO HDx 1.0 1.826 3.816 3330 3186 B 521 PRO HDy B 521 PRO HA 1.0 1.986 5.350 3331 3187 B 546 LEU HG B 546 LEU HA 1.0 1.717 3.275 3332 3188 B 539 ASP HA B 539 ASP HBy 1.0 1.712 3.250 3333 3189 B 524 PRO HGx B 524 PRO HA 1.0 1.887 4.211 3334 3190 B 549 ILE HG2% B 549 ILE HA 1.0 1.790 3.618 3335 3191 B 550 SER HA B 550 SER HBx 1.0 1.678 3.110 3336 3192 B 545 LEU HBx B 545 LEU HG 1.0 2.307 2.893 3337 3193 B 532 GLU HBy B 532 GLU HG2 1.0 2.250 3.354 3338 3194 B 540 MET HB2 B 540 MET HGy 1.0 1.734 3.348 3339 3195 B 528 LEU HG B 528 LEU HDx% 1.0 1.534 2.602 3340 3196 B 523 TYR HA B 523 TYR HBx 1.0 1.917 4.453 3341 3197 B 548 GLN HA B 548 GLN HBx 1.0 1.815 3.751 3342 3198 B 521 PRO HBx B 521 PRO HDy 1.0 1.999 6.239 3343 3199 B 540 MET HB3 B 540 MET HA 1.0 1.639 2.961 3344 3200 B 521 PRO HBx B 521 PRO HDx 1.0 1.992 5.500 3345 3201 B 532 GLU HA B 532 GLU HG2 1.0 1.733 3.343 3346 3202 B 548 GLN HBy B 548 GLN HG3 1.0 1.464 2.394 3347 3203 B 527 LEU HBy B 527 LEU HDx% 1.0 1.990 3.010 3348 3204 B 544 ALA HA B 544 ALA HB% 1.0 1.546 2.644 3349 3205 B 548 GLN HG2 B 548 GLN HBx 1.0 1.663 3.053 3350 3206 B 546 LEU HBx B 546 LEU HA 1.0 1.663 3.051 3351 3207 B 525 ASN HA B 525 ASN HBy 1.0 1.844 3.924 3352 3208 B 537 ILE HB B 537 ILE HD1% 1.0 1.777 3.549 3353 3209 B 540 MET HGy B 540 MET HA 1.0 1.891 4.245 3354 3210 B 524 PRO HDy B 524 PRO HGy 1.0 1.802 3.676 3355 3211 B 542 PHE HA B 542 PHE HBx 1.0 1.778 3.558 3356 3212 B 524 PRO HA B 524 PRO HGy 1.0 1.887 4.211 3357 3213 B 549 ILE HG2% B 549 ILE HG1x 1.0 1.895 4.279 3358 3214 B 537 ILE HA B 540 MET HE% 1.0 1.975 5.135 3359 3215 B 540 MET HB2 B 537 ILE HA 1.0 1.894 4.270 3360 3216 B 537 ILE HA B 538 ALA HB% 1.0 1.990 5.436 3361 3217 B 537 ILE HA B 537 ILE HD1% 1.0 1.841 3.901 3362 3218 B 540 MET HGx B 537 ILE HA 1.0 1.999 5.827 3363 3219 B 537 ILE HA B 536 SER HA 1.0 1.934 4.610 3364 3220 B 534 PHE HA B 537 ILE HD1% 1.0 1.959 4.893 3365 3220 B 537 ILE HD1% B 538 ALA HB% 1.0 1.959 4.893 3366 3221 B 537 ILE HD1% B 540 MET HE% 1.0 1.957 4.863 3367 3222 B 540 MET HB2 B 537 ILE HD1% 1.0 1.829 3.829 3368 3223 B 537 ILE HG2% B 538 ALA HB% 1.0 1.878 4.152 3369 3224 B 537 ILE HG2% B 540 MET HE% 1.0 1.913 4.427 3370 3225 B 540 MET HB2 B 537 ILE HG2% 1.0 1.806 3.704 3371 3226 B 534 PHE HA B 537 ILE HG2% 1.0 1.962 4.932 3372 3227 B 537 ILE HA B 538 ALA HA 1.0 1.930 4.576 3373 3228 B 537 ILE HG1x B 537 ILE HG1y 1.0 1.567 2.711 3374 3229 B 524 PRO HDy B 523 TYR HBy 1.0 1.997 6.315 3375 3230 B 524 PRO HDy B 523 TYR HA 1.0 1.701 3.207 3376 3231 B 524 PRO HDx B 523 TYR HA 1.0 1.798 3.662 3377 3232 B 524 PRO HDx B 523 TYR HBy 1.0 1.961 4.929 3378 3233 B 524 PRO HDx B 523 TYR HBx 1.0 1.998 5.756 3379 3234 B 524 PRO HBy B 524 PRO HDx 1.0 1.968 7.050 3380 3235 B 524 PRO HBy B 524 PRO HBx 1.0 1.640 2.966 3381 3236 B 527 LEU HDx% B 527 LEU HA 1.0 1.860 4.024 3382 3237 B 527 LEU HDy% B 527 LEU HA 1.0 1.747 3.407 3383 3238 B 528 LEU HA B 527 LEU HDy% 1.0 1.698 3.192 3384 3239 B 545 LEU HA B 545 LEU HDx% 1.0 2.141 3.859 3385 3240 B 531 ASP HA B 534 PHE HDx 1.0 1.998 5.754 3386 3241 B 540 MET HB2 B 541 ASP HA 1.0 1.934 4.618 3387 3242 B 541 ASP HA B 544 ALA HB% 1.0 1.880 4.156 3388 3243 B 543 SER HBx B 544 ALA HB% 1.0 1.977 5.163 3389 3244 B 538 ALA HA B 539 ASP HA 1.0 1.944 4.714 3390 3245 B 540 MET HB2 B 538 ALA HA 1.0 1.966 4.988 3391 3246 B 549 ILE HD1% B 549 ILE HA 1.0 1.941 4.693 3392 3247 B 543 SER HA B 546 LEU HBy 1.0 1.937 4.647 3393 3248 B 543 SER HA B 546 LEU HG 1.0 1.923 4.505 3394 3249 B 543 SER HA B 546 LEU HDx% 1.0 1.901 4.313 3395 3250 B 535 SER HA B 538 ALA HB% 1.0 1.946 4.750 3396 3251 B 542 PHE HA B 542 PHE HDx 1.0 1.859 4.021 3397 3252 B 545 LEU HBy B 542 PHE HA 1.0 1.909 4.385 3398 3253 B 545 LEU HBx B 542 PHE HA 1.0 1.980 5.216 3399 3254 B 534 PHE HA B 534 PHE HDx 1.0 1.867 4.067 3400 3255 B 532 GLU HA B 531 ASP HA 1.0 1.985 5.301 3401 3256 B 533 ASP HA B 532 GLU HA 1.0 1.947 4.741 3402 3257 B 520 SER HA B 521 PRO HDx 1.0 1.704 3.216 3403 3258 B 520 SER HA B 521 PRO HDy 1.0 1.765 3.495 3404 3259 B 543 SER HBy B 540 MET HA 1.0 1.921 4.489 3405 3260 B 545 LEU HA B 545 LEU HDy% 1.0 1.644 2.984 3406 3261 B 538 ALA HB% B 539 ASP HA 1.0 1.983 5.277 3407 3262 B 541 ASP HBy B 538 ALA HA 1.0 1.964 4.960 3408 3263 B 534 PHE HBx B 534 PHE HBy 1.0 1.593 2.799 3409 3264 B 542 PHE HBx B 542 PHE HDx 1.0 1.878 4.146 3410 3265 B 542 PHE HBy B 542 PHE HDx 1.0 1.881 4.173 3411 3266 B 542 PHE HBy B 542 PHE HBx 1.0 1.584 2.768 3412 3267 B 545 LEU HDx% B 542 PHE HBy 1.0 1.989 5.401 3413 3268 B 523 TYR HBy B 523 TYR HBx 1.0 1.619 2.891 3414 3269 B 545 LEU HA B 548 GLN HG2 1.0 1.959 4.899 3415 3270 B 545 LEU HDx% B 548 GLN HG2 1.0 1.992 5.532 3416 3271 B 524 PRO HGy B 523 TYR HA 1.0 2.000 6.024 3417 3272 B 523 TYR HBx B 523 TYR HDx 1.0 1.899 4.301 3418 3273 B 523 TYR HBy B 523 TYR HDx 1.0 1.921 4.493 3419 3274 B 523 TYR HA B 523 TYR HDx 1.0 1.951 4.799 3420 3275 B 534 PHE HBy B 534 PHE HDx 1.0 1.883 4.179 3421 3276 B 534 PHE HBx B 534 PHE HDx 1.0 1.883 4.187 3422 3277 B 540 MET HE% B 540 MET HA 1.0 1.882 4.172 3423 3278 B 527 LEU HA B 530 GLY HA2 1.0 1.915 4.433 3424 3279 B 537 ILE HG2% B 538 ALA HA 1.0 1.884 4.184 3425 3280 B 545 LEU HG B 542 PHE HA 1.0 1.972 5.070 3426 3281 B 545 LEU HDx% B 542 PHE HA 1.0 1.864 4.052 3427 3282 B 546 LEU HDx% B 542 PHE HDx 1.0 1.926 4.532 3428 3283 B 546 LEU HDy% B 542 PHE HDx 1.0 1.985 5.327 3429 3284 B 546 LEU HDx% B 542 PHE HEx 1.0 1.930 4.578 3430 3285 B 546 LEU HDy% B 542 PHE HEx 1.0 1.977 5.163 3431 3286 B 538 ALA HA B 541 ASP H 1.0 1.694 3.176 3432 3287 B 526 GLY H B 526 GLY HA3 1.0 1.872 4.110 3433 3288 B 531 ASP HBx B 531 ASP H 1.0 1.628 2.922 3434 3289 B 548 GLN HG2 B 548 GLN HE21 1.0 1.980 5.208 3435 3290 B 546 LEU HBx B 546 LEU H 1.0 2.297 3.703 3436 3291 B 535 SER HBx B 535 SER H 1.0 1.783 3.581 3437 3292 B 543 SER HBy B 543 SER H 1.0 1.677 3.109 3438 3293 B 544 ALA HB% B 544 ALA H 1.0 1.686 3.142 3439 3294 B 548 GLN HA B 549 ILE H 1.0 1.699 3.199 3440 3295 B 544 ALA HA B 544 ALA H 1.0 1.741 3.377 3441 3296 B 549 ILE HB B 549 ILE H 1.0 1.809 3.721 3442 3297 B 546 LEU HA B 546 LEU H 1.0 1.688 3.152 3443 3298 B 548 GLN HG2 B 548 GLN HE22 1.0 1.911 4.397 3444 3299 B 527 LEU HBx B 527 LEU H 1.0 1.725 3.309 3445 3300 B 524 PRO HA B 525 ASN H 1.0 1.871 4.101 3446 3301 B 550 SER HA B 550 SER H 1.0 1.933 4.599 3447 3302 B 541 ASP HBy B 541 ASP H 1.0 1.720 3.286 3448 3303 B 543 SER HA B 544 ALA H 1.0 1.761 3.477 3449 3304 B 548 GLN HA B 548 GLN H 1.0 1.781 3.569 3450 3305 B 527 LEU HA B 528 LEU H 1.0 1.650 3.004 3451 3306 B 551 SER HB3 B 551 SER H 1.0 1.921 4.485 3452 3307 B 539 ASP HBx B 539 ASP H 1.0 1.714 3.260 3453 3308 B 527 LEU HA B 527 LEU H 1.0 1.891 4.241 3454 3309 B 523 TYR HBy B 523 TYR H 1.0 1.933 4.611 3455 3310 B 529 SER HB3 B 529 SER H 1.0 1.897 4.291 3456 3311 B 535 SER HA B 535 SER H 1.0 1.798 3.660 3457 3312 B 536 SER HA B 537 ILE H 1.0 2.285 3.715 3458 3313 B 535 SER H B 535 SER HBy 1.0 1.769 3.509 3459 3314 B 550 SER HA B 551 SER H 1.0 1.807 3.709 3460 3315 B 531 ASP HBy B 531 ASP H 1.0 1.822 3.786 3461 3316 B 537 ILE HB B 537 ILE H 1.0 1.718 3.278 3462 3317 B 545 LEU HBx B 545 LEU H 1.0 1.746 3.402 3463 3318 B 546 LEU HBy B 546 LEU H 1.0 1.622 2.900 3464 3319 B 531 ASP HA B 532 GLU H 1.0 1.695 3.181 3465 3320 B 522 GLY H B 522 GLY HA2 1.0 1.963 4.953 3466 3321 B 540 MET HB2 B 540 MET H 1.0 1.682 3.128 3467 3322 B 536 SER HA B 536 SER H 1.0 1.916 4.442 3468 3323 B 551 SER HB2 B 551 SER H 1.0 1.921 4.485 3469 3324 B 523 TYR H B 522 GLY HA3 1.0 1.848 3.950 3470 3325 B 542 PHE HA B 543 SER H 1.0 1.763 3.481 3471 3326 B 532 GLU HBy B 532 GLU H 1.0 1.717 3.273 3472 3327 B 547 SER H B 547 SER HB2 1.0 1.779 3.561 3473 3328 B 538 ALA HA B 538 ALA H 1.0 1.763 3.485 3474 3329 B 529 SER HB2 B 529 SER H 1.0 1.897 4.291 3475 3330 B 533 ASP HA B 534 PHE H 1.0 2.336 3.664 3476 3331 B 545 LEU HBy B 545 LEU H 1.0 1.612 2.864 3477 3332 B 545 LEU HA B 545 LEU H 1.0 1.642 2.974 3478 3333 B 534 PHE HBx B 534 PHE H 1.0 1.784 3.586 3479 3334 B 544 ALA HA B 545 LEU H 1.0 2.642 3.974 3480 3335 B 550 SER HBy B 550 SER H 1.0 1.969 5.031 3481 3336 B 533 ASP HBy B 533 ASP H 1.0 1.641 2.971 3482 3337 B 528 LEU HA B 529 SER H 1.0 1.697 3.191 3483 3338 B 547 SER HA B 548 GLN H 1.0 1.798 3.658 3484 3339 B 530 GLY HA2 B 531 ASP H 1.0 1.683 3.133 3485 3340 B 527 LEU HBy B 527 LEU H 1.0 2.237 3.763 3486 3341 B 537 ILE HA B 538 ALA H 1.0 2.726 4.034 3487 3342 B 531 ASP HA B 531 ASP H 1.0 1.740 3.378 3488 3343 B 548 GLN HBy B 548 GLN H 1.0 1.956 4.860 3489 3344 B 534 PHE HA B 534 PHE H 1.0 1.640 2.968 3490 3345 B 529 SER HA B 529 SER H 1.0 1.719 3.283 3491 3346 B 547 SER HA B 547 SER H 1.0 1.859 4.019 3492 3347 B 539 ASP HA B 542 PHE H 1.0 1.703 3.215 3493 3348 B 532 GLU HA B 533 ASP H 1.0 1.638 2.958 3494 3349 B 525 ASN HBy B 525 ASN H 1.0 1.938 4.648 3495 3350 B 532 GLU HBx B 532 GLU H 1.0 1.697 3.189 3496 3351 B 535 SER HA B 536 SER H 1.0 1.887 4.211 3497 3352 B 523 TYR HA B 523 TYR H 1.0 1.948 4.762 3498 3353 B 542 PHE HBy B 542 PHE H 1.0 1.788 3.608 3499 3354 B 532 GLU HA B 532 GLU H 1.0 1.726 3.316 3500 3355 B 523 TYR HBx B 523 TYR H 1.0 1.836 3.870 3501 3356 B 549 ILE HA B 550 SER H 1.0 1.802 3.684 3502 3357 B 534 PHE HBy B 534 PHE H 1.0 1.841 3.907 3503 3358 B 523 TYR H B 522 GLY HA2 1.0 1.848 3.950 3504 3359 B 530 GLY H B 530 GLY HA3 1.0 1.772 3.526 3505 3360 B 538 ALA HA B 539 ASP H 1.0 1.658 3.034 3506 3361 B 528 LEU HBx B 528 LEU H 1.0 1.669 3.077 3507 3362 B 526 GLY HA3 B 527 LEU H 1.0 1.770 3.516 3508 3363 B 527 LEU H B 526 GLY HA2 1.0 1.770 3.516 3509 3364 B 543 SER HA B 543 SER H 1.0 1.775 3.543 3510 3365 B 546 LEU HA B 547 SER H 1.0 1.748 3.410 3511 3366 B 526 GLY H B 526 GLY HA2 1.0 1.872 4.110 3512 3367 B 536 SER HBy B 536 SER H 1.0 1.951 4.801 3513 3368 B 543 SER HBx B 543 SER H 1.0 1.674 3.098 3514 3369 B 548 GLN HG3 B 548 GLN HE22 1.0 1.911 4.397 3515 3370 B 537 ILE HA B 537 ILE H 1.0 1.821 3.783 3516 3371 B 549 ILE HA B 549 ILE H 1.0 1.846 3.938 3517 3372 B 529 SER HA B 530 GLY H 1.0 1.795 3.643 3518 3373 B 530 GLY HA2 B 530 GLY H 1.0 1.772 3.526 3519 3374 B 538 ALA HB% B 538 ALA H 1.0 1.655 3.021 3520 3375 B 548 GLN HBx B 548 GLN H 1.0 1.844 3.924 3521 3376 B 542 PHE HBx B 542 PHE H 1.0 1.751 3.425 3522 3377 B 528 LEU HBy B 528 LEU H 1.0 1.685 3.143 3523 3378 B 533 ASP HA B 533 ASP H 1.0 1.785 3.593 3524 3379 B 539 ASP HBy B 539 ASP H 1.0 1.775 3.545 3525 3380 B 528 LEU HA B 528 LEU H 1.0 1.750 3.422 3526 3381 B 533 ASP HBx B 533 ASP H 1.0 1.720 3.286 3527 3382 B 534 PHE HA B 535 SER H 1.0 1.708 3.236 3528 3383 B 537 ILE HG1y B 537 ILE H 1.0 1.811 3.727 3529 3384 B 537 ILE HG2% B 537 ILE H 1.0 1.845 3.929 3530 3385 B 537 ILE HG1x B 537 ILE H 1.0 1.842 3.912 3531 3386 B 536 SER HBy B 537 ILE H 1.0 1.846 3.938 3532 3387 B 537 ILE H B 538 ALA H 1.0 1.809 3.717 3533 3388 B 525 ASN HD22 B 525 ASN HD21 1.0 1.501 2.501 3534 3389 B 528 LEU HDx% B 528 LEU H 1.0 1.961 4.919 3535 3390 B 527 LEU HBy B 529 SER H 1.0 1.898 4.294 3536 3391 B 531 ASP H B 530 GLY H 1.0 1.670 3.080 3537 3392 B 532 GLU HBx B 531 ASP H 1.0 2.992 5.008 3538 3393 B 531 ASP H B 532 GLU H 1.0 1.707 3.231 3539 3394 B 532 GLU HG2 B 531 ASP H 1.0 1.923 4.505 3540 3395 B 532 GLU HBx B 533 ASP H 1.0 1.831 3.845 3541 3396 B 532 GLU HG2 B 532 GLU H 1.0 1.786 3.596 3542 3397 B 533 ASP HBy B 532 GLU H 1.0 1.873 4.113 3543 3398 B 534 PHE HDx B 534 PHE H 1.0 1.850 3.960 3544 3399 B 534 PHE HBy B 535 SER H 1.0 1.899 4.303 3545 3400 B 534 PHE HDx B 535 SER H 1.0 1.948 4.762 3546 3401 B 535 SER H B 534 PHE H 1.0 1.719 3.283 3547 3402 B 539 ASP H B 538 ALA H 1.0 1.775 3.539 3548 3403 B 537 ILE HG2% B 538 ALA H 1.0 1.832 3.852 3549 3404 B 537 ILE HB B 538 ALA H 1.0 1.836 3.874 3550 3405 B 538 ALA HB% B 539 ASP H 1.0 1.741 3.381 3551 3406 B 535 SER HA B 539 ASP H 1.0 1.950 4.796 3552 3407 B 541 ASP H B 540 MET H 1.0 1.798 3.658 3553 3408 B 539 ASP HBy B 540 MET H 1.0 1.876 4.130 3554 3409 B 539 ASP HBx B 540 MET H 1.0 1.936 4.640 3555 3410 B 541 ASP HBx B 541 ASP H 1.0 1.692 3.170 3556 3411 B 540 MET HB3 B 541 ASP H 1.0 1.799 3.663 3557 3412 B 541 ASP HBy B 542 PHE H 1.0 1.891 4.237 3558 3413 B 543 SER H B 544 ALA H 1.0 1.784 3.586 3559 3414 B 542 PHE HBy B 543 SER H 1.0 1.855 3.993 3560 3415 B 543 SER HBy B 544 ALA H 1.0 1.893 4.263 3561 3416 B 544 ALA H B 545 LEU H 1.0 1.799 3.663 3562 3417 B 544 ALA HB% B 545 LEU H 1.0 1.771 3.521 3563 3418 B 545 LEU HDx% B 545 LEU H 1.0 1.907 4.371 3564 3419 B 546 LEU H B 547 SER H 1.0 1.712 3.252 3565 3420 B 545 LEU HDx% B 546 LEU H 1.0 1.844 4.924 3566 3421 B 546 LEU HG B 547 SER H 1.0 1.868 4.080 3567 3422 B 548 GLN HE21 B 548 GLN HE22 1.0 1.376 2.154 3568 3423 B 549 ILE H B 548 GLN H 1.0 1.786 3.598 3569 3424 B 549 ILE H B 550 SER H 1.0 1.901 4.315 3570 3425 B 549 ILE HG1x B 549 ILE H 1.0 1.842 3.906 3571 3426 B 549 ILE HG1y B 549 ILE H 1.0 1.912 4.410 3572 3427 B 548 GLN HBx B 549 ILE H 1.0 1.948 4.756 3573 3428 B 548 GLN HBy B 549 ILE H 1.0 1.966 4.996 3574 3429 B 548 GLN HG2 B 549 ILE H 1.0 1.974 5.108 3575 3430 B 549 ILE HB B 550 SER H 1.0 1.989 5.411 3576 3431 B 527 LEU H B 528 LEU H 1.0 1.895 4.273 3577 3432 B 532 GLU HBy B 533 ASP H 1.0 1.839 3.891 3578 3433 B 532 GLU HBy B 531 ASP H 1.0 2.959 5.041 3579 3434 B 546 LEU H B 545 LEU H 1.0 1.600 3.600 3580 3435 B 541 ASP H B 542 PHE H 1.0 1.600 3.600 3581 3436 B 539 ASP H B 540 MET H 1.0 1.600 3.600 3582 3437 B 543 SER H B 542 PHE H 1.0 1.500 3.500 3583 3438 B 544 ALA HA B 547 SER HB3 1.0 2.500 4.500 3584 3438 B 544 ALA HA B 547 SER HB2 1.0 2.500 4.500 3585 3439 B 534 PHE HA B 537 ILE HB 1.0 2.800 4.800 3586 3440 B 542 PHE HA B 545 LEU H 1.0 3.000 5.000 3587 3441 B 543 SER HA B 546 LEU H 1.0 2.500 3.700 3588 3442 B 544 ALA HA B 547 SER H 1.0 2.700 4.100 3589 3443 B 533 ASP HA B 536 SER HBy 1.0 2.700 4.500 3590 3444 B 542 PHE HBy B 539 ASP HA 1.0 3.100 5.100 3591 3445 B 539 ASP HA B 542 PHE HBx 1.0 3.200 5.200 3592 3446 B 536 SER HA B 539 ASP HBy 1.0 2.800 4.800 3593 3447 A 49 GLN HA B 546 LEU HDy% 1.0 3.500 5.100 3594 3448 A 49 GLN HBx B 542 PHE HEy 1.0 3.100 4.500 3595 3448 A 49 GLN HBx B 542 PHE HEx 1.0 3.100 4.500 3596 3449 A 49 GLN HBx B 542 PHE HBx 1.0 3.200 4.600 3597 3450 A 49 GLN HBx B 546 LEU HDx% 1.0 3.300 4.700 3598 3451 A 49 GLN HBy B 546 LEU HDy% 1.0 3.300 4.700 3599 3452 A 50 ALA HA B 542 PHE HEy 1.0 3.000 4.400 3600 3452 A 50 ALA HA B 542 PHE HEx 1.0 3.000 4.400 3601 3453 A 50 ALA HA B 546 LEU HDy% 1.0 3.300 4.900 3602 3454 A 50 ALA HB% B 546 LEU HDy% 1.0 2.900 4.100 3603 3455 A 50 ALA HB% B 542 PHE HEx 1.0 3.300 4.900 3604 3455 A 50 ALA HB% B 542 PHE HEy 1.0 3.300 4.900 3605 3456 A 51 THR HG2% B 542 PHE HEx 1.0 2.800 4.000 3606 3456 A 51 THR HG2% B 542 PHE HEy 1.0 2.800 4.000 3607 3457 A 51 THR HG2% B 545 LEU HDx% 1.0 2.700 3.900 3608 3458 A 52 PRO HGy B 546 LEU HDy% 1.0 3.500 5.100 3609 3459 A 52 PRO HGx B 545 LEU HDy% 1.0 3.800 5.600 3610 3460 A 52 PRO HDx B 546 LEU HDy% 1.0 3.600 5.200 3611 3461 A 52 PRO HDy B 545 LEU HDy% 1.0 3.400 5.000 3612 3462 A 55 SER HBx B 545 LEU HDx% 1.0 2.200 3.800 3613 3463 A 57 LYS HBx B 545 LEU HDx% 1.0 2.800 4.200 3614 3464 A 57 LYS HBy B 545 LEU HDx% 1.0 2.100 3.500 3615 3465 A 59 MET HBx B 542 PHE HEy 1.0 2.900 4.300 3616 3465 A 59 MET HBx B 542 PHE HEx 1.0 2.900 4.300 3617 3466 A 59 MET HBy B 542 PHE HEy 1.0 3.000 4.400 3618 3466 A 59 MET HBy B 542 PHE HEx 1.0 3.000 4.400 3619 3467 A 59 MET HBy B 545 LEU HDx% 1.0 3.500 5.100 3620 3468 A 59 MET HGy B 542 PHE HEy 1.0 3.400 5.000 3621 3468 A 59 MET HGy B 542 PHE HEx 1.0 3.400 5.000 3622 3469 A 59 MET HE% B 541 ASP HBx 1.0 2.900 4.300 3623 3470 A 59 MET HE% B 542 PHE HBy 1.0 2.200 5.600 3624 3471 A 59 MET HE% B 542 PHE HEx 1.0 2.500 3.700 3625 3471 A 59 MET HE% B 542 PHE HEy 1.0 2.500 3.700 3626 3472 A 59 MET HE% B 538 ALA HB% 1.0 3.000 4.400 3627 3473 A 59 MET HE% B 545 LEU HDx% 1.0 2.500 4.500 3628 3474 A 60 LEU HA B 542 PHE HEy 1.0 3.300 4.700 3629 3474 A 60 LEU HA B 542 PHE HEx 1.0 3.300 4.700 3630 3475 A 61 ARG HBx B 542 PHE HEy 1.0 3.000 4.600 3631 3475 A 61 ARG HBx B 542 PHE HEx 1.0 3.000 4.600 3632 3476 A 61 ARG HBy B 542 PHE HEy 1.0 3.000 4.600 3633 3476 A 61 ARG HBy B 542 PHE HEx 1.0 3.000 4.600 3634 3477 A 61 ARG HGy B 542 PHE HEy 1.0 1.700 3.300 3635 3477 A 61 ARG HGy B 542 PHE HEx 1.0 1.700 3.300 3636 3478 A 61 ARG HGx B 542 PHE HEy 1.0 3.600 5.200 3637 3478 A 61 ARG HGx B 542 PHE HEx 1.0 3.600 5.200 3638 3479 A 61 ARG HDx B 542 PHE HEy 1.0 3.300 4.900 3639 3479 A 61 ARG HDx B 542 PHE HEx 1.0 3.300 4.900 3640 3480 A 61 ARG HDy B 542 PHE HEy 1.0 3.600 5.200 3641 3480 A 61 ARG HDy B 542 PHE HEx 1.0 3.600 5.200 3642 3481 A 88 MET HGy B 542 PHE HEy 1.0 2.900 4.300 3643 3481 A 88 MET HGy B 542 PHE HEx 1.0 2.900 4.300 3644 3482 A 88 MET HGx B 542 PHE HEy 1.0 3.000 4.400 3645 3482 A 88 MET HGx B 542 PHE HEx 1.0 3.000 4.400 3646 3483 A 88 MET HBy B 535 SER HBx 1.0 3.400 4.600 3647 3484 A 88 MET HE% B 535 SER HBy 1.0 2.700 3.900 3648 3485 A 88 MET HE% B 535 SER HA 1.0 2.800 4.200 3649 3486 A 88 MET HE% B 538 ALA HB% 1.0 2.600 3.800 3650 3487 A 88 MET HE% B 539 ASP HA 1.0 3.000 5.000 3651 3488 A 88 MET HE% B 541 ASP HBy 1.0 3.300 4.900 3652 3489 A 88 MET HE% B 541 ASP HBx 1.0 3.300 4.900 3653 3490 A 88 MET HE% B 542 PHE HBx 1.0 3.400 5.000 3654 3491 A 88 MET HE% B 542 PHE HBy 1.0 3.200 4.600 3655 3492 A 88 MET HE% B 542 PHE HEy 1.0 2.700 3.900 3656 3492 A 88 MET HE% B 542 PHE HEx 1.0 2.700 3.900 stop_ save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_2 _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 3 HIS C A 4 SER N A 4 SER CA A 4 SER C 1.0 -156.9 -107.1 PHI 2 2 A 4 SER N A 4 SER CA A 4 SER C A 5 GLY N 1.0 135.2 175.2 PSI 3 3 A 6 ALA C A 7 ALA N A 7 ALA CA A 7 ALA C 1.0 -156.8 -108.2 PHI 4 4 A 7 ALA N A 7 ALA CA A 7 ALA C A 8 ILE N 1.0 103.2 178.2 PSI 5 5 A 7 ALA C A 8 ILE N A 8 ILE CA A 8 ILE C 1.0 -125.6 -78.8 PHI 6 6 A 8 ILE N A 8 ILE CA A 8 ILE C A 9 PHE N 1.0 100.5 140.5 PSI 7 7 A 8 ILE C A 9 PHE N A 9 PHE CA A 9 PHE C 1.0 -148.3 -100.3 PHI 8 8 A 9 PHE N A 9 PHE CA A 9 PHE C A 10 GLU N 1.0 100.9 140.9 PSI 9 9 A 9 PHE C A 10 GLU N A 10 GLU CA A 10 GLU C 1.0 32.8 72.8 PHI 10 10 A 10 GLU N A 10 GLU CA A 10 GLU C A 11 LYS N 1.0 23.5 63.5 PSI 11 11 A 10 GLU C A 11 LYS N A 11 LYS CA A 11 LYS C 1.0 52.7 92.7 PHI 12 12 A 11 LYS N A 11 LYS CA A 11 LYS C A 12 VAL N 1.0 -8.3 31.7 PSI 13 13 A 11 LYS C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -132.9 -92.9 PHI 14 14 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 SER N 1.0 108.1 148.1 PSI 15 15 A 14 GLY C A 15 ILE N A 15 ILE CA A 15 ILE C 1.0 -141.5 -99.5 PHI 16 16 A 15 ILE N A 15 ILE CA A 15 ILE C A 16 ILE N 1.0 112.8 152.8 PSI 17 17 A 15 ILE C A 16 ILE N A 16 ILE CA A 16 ILE C 1.0 -140.9 -100.9 PHI 18 18 A 16 ILE N A 16 ILE CA A 16 ILE C A 17 ALA N 1.0 109.3 149.3 PSI 19 19 A 16 ILE C A 17 ALA N A 17 ALA CA A 17 ALA C 1.0 -135.8 -91.8 PHI 20 20 A 17 ALA N A 17 ALA CA A 17 ALA C A 18 ILE N 1.0 105.7 145.7 PSI 21 21 A 17 ALA C A 18 ILE N A 18 ILE CA A 18 ILE C 1.0 -126.8 -86.8 PHI 22 22 A 18 ILE N A 18 ILE CA A 18 ILE C A 19 ASN N 1.0 98.2 138.2 PSI 23 23 A 18 ILE C A 19 ASN N A 19 ASN CA A 19 ASN C 1.0 -124.5 -84.5 PHI 24 24 A 19 ASN N A 19 ASN CA A 19 ASN C A 20 GLU N 1.0 100.2 142.2 PSI 25 25 A 19 ASN C A 20 GLU N A 20 GLU CA A 20 GLU C 1.0 -135.8 -43.8 PHI 26 26 A 20 GLU N A 20 GLU CA A 20 GLU C A 21 ASP N 1.0 112.1 166.9 PSI 27 27 A 21 ASP C A 22 VAL N A 22 VAL CA A 22 VAL C 1.0 -162.7 -105.1 PHI 28 28 A 22 VAL N A 22 VAL CA A 22 VAL C A 23 SER N 1.0 128.5 177.1 PSI 29 29 A 22 VAL C A 23 SER N A 23 SER CA A 23 SER C 1.0 -160.1 -85.7 PHI 30 30 A 23 SER N A 23 SER CA A 23 SER C A 24 PRO N 1.0 104.9 166.9 PSI 31 31 A 23 SER C A 24 PRO N A 24 PRO CA A 24 PRO C 1.0 -92.1 -52.1 PHI 32 32 A 24 PRO N A 24 PRO CA A 24 PRO C A 25 ALA N 1.0 135.3 175.3 PSI 33 33 A 25 ALA C A 26 GLU N A 26 GLU CA A 26 GLU C 1.0 -156.0 -113.0 PHI 34 34 A 26 GLU N A 26 GLU CA A 26 GLU C A 27 LEU N 1.0 120.2 168.6 PSI 35 35 A 26 GLU C A 27 LEU N A 27 LEU CA A 27 LEU C 1.0 -144.6 -104.6 PHI 36 36 A 27 LEU N A 27 LEU CA A 27 LEU C A 28 THR N 1.0 105.6 149.6 PSI 37 37 A 27 LEU C A 28 THR N A 28 THR CA A 28 THR C 1.0 -138.1 -98.1 PHI 38 38 A 28 THR N A 28 THR CA A 28 THR C A 29 TRP N 1.0 107.2 151.2 PSI 39 39 A 28 THR C A 29 TRP N A 29 TRP CA A 29 TRP C 1.0 -141.9 -85.3 PHI 40 40 A 29 TRP N A 29 TRP CA A 29 TRP C A 30 ARG N 1.0 106.4 150.0 PSI 41 41 A 29 TRP C A 30 ARG N A 30 ARG CA A 30 ARG C 1.0 -153.9 -105.3 PHI 42 42 A 30 ARG N A 30 ARG CA A 30 ARG C A 31 SER N 1.0 104.2 179.0 PSI 43 43 A 30 ARG C A 31 SER N A 31 SER CA A 31 SER C 1.0 -95.4 -55.4 PHI 44 44 A 31 SER N A 31 SER CA A 31 SER C A 32 THR N 1.0 133.2 186.6 PSI 45 45 A 31 SER C A 32 THR N A 32 THR CA A 32 THR C 1.0 -79.5 -39.5 PHI 46 46 A 32 THR N A 32 THR CA A 32 THR C A 33 ASP N 1.0 -46.4 -6.4 PSI 47 47 A 32 THR C A 33 ASP N A 33 ASP CA A 33 ASP C 1.0 -99.7 -59.7 PHI 48 48 A 33 ASP N A 33 ASP CA A 33 ASP C A 34 GLY N 1.0 -31.2 17.6 PSI 49 49 A 33 ASP C A 34 GLY N A 34 GLY CA A 34 GLY C 1.0 71.3 111.3 PHI 50 50 A 34 GLY N A 34 GLY CA A 34 GLY C A 35 ASP N 1.0 -23.4 16.6 PSI 51 51 A 35 ASP C A 36 LYS N A 36 LYS CA A 36 LYS C 1.0 -160.0 -71.6 PHI 52 52 A 36 LYS N A 36 LYS CA A 36 LYS C A 37 VAL N 1.0 119.8 161.6 PSI 53 53 A 36 LYS C A 37 VAL N A 37 VAL CA A 37 VAL C 1.0 -148.8 -104.8 PHI 54 54 A 37 VAL N A 37 VAL CA A 37 VAL C A 38 HIS N 1.0 117.4 157.4 PSI 55 55 A 37 VAL C A 38 HIS N A 38 HIS CA A 38 HIS C 1.0 -143.5 -103.1 PHI 56 56 A 38 HIS N A 38 HIS CA A 38 HIS C A 39 THR N 1.0 110.0 150.0 PSI 57 57 A 38 HIS C A 39 THR N A 39 THR CA A 39 THR C 1.0 -128.7 -87.9 PHI 58 58 A 39 THR N A 39 THR CA A 39 THR C A 40 VAL N 1.0 107.4 147.4 PSI 59 59 A 39 THR C A 40 VAL N A 40 VAL CA A 40 VAL C 1.0 -144.4 -95.4 PHI 60 60 A 40 VAL N A 40 VAL CA A 40 VAL C A 41 VAL N 1.0 108.4 148.6 PSI 61 61 A 40 VAL C A 41 VAL N A 41 VAL CA A 41 VAL C 1.0 -90.5 -46.5 PHI 62 62 A 41 VAL N A 41 VAL CA A 41 VAL C A 42 LEU N 1.0 110.6 150.6 PSI 63 63 A 41 VAL C A 42 LEU N A 42 LEU CA A 42 LEU C 1.0 -79.2 -39.2 PHI 64 64 A 42 LEU N A 42 LEU CA A 42 LEU C A 43 SER N 1.0 -53.9 -13.9 PSI 65 65 A 42 LEU C A 43 SER N A 43 SER CA A 43 SER C 1.0 -91.2 -51.2 PHI 66 66 A 43 SER N A 43 SER CA A 43 SER C A 44 THR N 1.0 -34.3 5.7 PSI 67 67 A 43 SER C A 44 THR N A 44 THR CA A 44 THR C 1.0 -114.9 -72.5 PHI 68 68 A 44 THR N A 44 THR CA A 44 THR C A 45 ILE N 1.0 -22.0 18.0 PSI 69 69 A 44 THR C A 45 ILE N A 45 ILE CA A 45 ILE C 1.0 -114.5 -74.1 PHI 70 70 A 45 ILE N A 45 ILE CA A 45 ILE C A 46 ASP N 1.0 100.5 148.7 PSI 71 71 A 45 ILE C A 46 ASP N A 46 ASP CA A 46 ASP C 1.0 -123.9 -73.3 PHI 72 72 A 46 ASP N A 46 ASP CA A 46 ASP C A 47 LYS N 1.0 -54.4 -9.0 PSI 73 73 A 46 ASP C A 47 LYS N A 47 LYS CA A 47 LYS C 1.0 -173.7 -133.7 PHI 74 74 A 47 LYS N A 47 LYS CA A 47 LYS C A 48 LEU N 1.0 134.3 174.3 PSI 75 75 A 47 LYS C A 48 LEU N A 48 LEU CA A 48 LEU C 1.0 -149.8 -105.8 PHI 76 76 A 48 LEU N A 48 LEU CA A 48 LEU C A 49 GLN N 1.0 111.8 151.8 PSI 77 77 A 48 LEU C A 49 GLN N A 49 GLN CA A 49 GLN C 1.0 -155.0 -94.6 PHI 78 78 A 49 GLN N A 49 GLN CA A 49 GLN C A 50 ALA N 1.0 115.4 165.8 PSI 79 79 A 49 GLN C A 50 ALA N A 50 ALA CA A 50 ALA C 1.0 -154.0 -108.2 PHI 80 80 A 50 ALA N A 50 ALA CA A 50 ALA C A 51 THR N 1.0 117.8 170.6 PSI 81 81 A 50 ALA C A 51 THR N A 51 THR CA A 51 THR C 1.0 -100.0 -46.6 PHI 82 82 A 51 THR N A 51 THR CA A 51 THR C A 52 PRO N 1.0 106.3 167.7 PSI 83 83 A 51 THR C A 52 PRO N A 52 PRO CA A 52 PRO C 1.0 -79.6 -39.6 PHI 84 84 A 52 PRO N A 52 PRO CA A 52 PRO C A 53 ALA N 1.0 125.8 165.8 PSI 85 85 A 52 PRO C A 53 ALA N A 53 ALA CA A 53 ALA C 1.0 -82.3 -42.3 PHI 86 86 A 53 ALA N A 53 ALA CA A 53 ALA C A 54 SER N 1.0 -45.2 -5.2 PSI 87 87 A 53 ALA C A 54 SER N A 54 SER CA A 54 SER C 1.0 -111.0 -71.0 PHI 88 88 A 54 SER N A 54 SER CA A 54 SER C A 55 SER N 1.0 -17.9 27.9 PSI 89 89 A 54 SER C A 55 SER N A 55 SER CA A 55 SER C 1.0 -119.2 -38.4 PHI 90 90 A 55 SER N A 55 SER CA A 55 SER C A 56 GLU N 1.0 103.9 170.9 PSI 91 91 A 57 LYS C A 58 MET N A 58 MET CA A 58 MET C 1.0 -144.4 -76.0 PHI 92 92 A 58 MET N A 58 MET CA A 58 MET C A 59 MET N 1.0 102.5 162.5 PSI 93 93 A 58 MET C A 59 MET N A 59 MET CA A 59 MET C 1.0 -159.8 -99.8 PHI 94 94 A 59 MET N A 59 MET CA A 59 MET C A 60 LEU N 1.0 125.6 165.6 PSI 95 95 A 59 MET C A 60 LEU N A 60 LEU CA A 60 LEU C 1.0 -151.0 -111.0 PHI 96 96 A 60 LEU N A 60 LEU CA A 60 LEU C A 61 ARG N 1.0 120.8 164.8 PSI 97 97 A 60 LEU C A 61 ARG N A 61 ARG CA A 61 ARG C 1.0 -145.7 -101.5 PHI 98 98 A 61 ARG N A 61 ARG CA A 61 ARG C A 62 LEU N 1.0 111.3 151.3 PSI 99 99 A 61 ARG C A 62 LEU N A 62 LEU CA A 62 LEU C 1.0 -127.5 -87.5 PHI 100 100 A 62 LEU N A 62 LEU CA A 62 LEU C A 63 ILE N 1.0 102.7 142.7 PSI 101 101 A 62 LEU C A 63 ILE N A 63 ILE CA A 63 ILE C 1.0 -125.6 -85.6 PHI 102 102 A 63 ILE N A 63 ILE CA A 63 ILE C A 64 GLY N 1.0 99.1 145.1 PSI 103 103 A 63 ILE C A 64 GLY N A 64 GLY CA A 64 GLY C 1.0 -177.4 -37.4 PHI 104 104 A 64 GLY N A 64 GLY CA A 64 GLY C A 65 LYS N 1.0 114.9 199.3 PSI 105 105 A 64 GLY C A 65 LYS N A 65 LYS CA A 65 LYS C 1.0 -91.8 -51.8 PHI 106 106 A 65 LYS N A 65 LYS CA A 65 LYS C A 66 VAL N 1.0 109.9 169.9 PSI 107 107 A 65 LYS C A 66 VAL N A 66 VAL CA A 66 VAL C 1.0 -118.2 -48.2 PHI 108 108 A 66 VAL N A 66 VAL CA A 66 VAL C A 67 ASP N 1.0 110.6 164.2 PSI 109 109 A 66 VAL C A 67 ASP N A 67 ASP CA A 67 ASP C 1.0 -106.4 -54.0 PHI 110 110 A 67 ASP N A 67 ASP CA A 67 ASP C A 68 GLU N 1.0 79.3 146.3 PSI 111 111 A 67 ASP C A 68 GLU N A 68 GLU CA A 68 GLU C 1.0 -84.4 -44.4 PHI 112 112 A 68 GLU N A 68 GLU CA A 68 GLU C A 69 SER N 1.0 -42.7 -2.7 PSI 113 113 A 68 GLU C A 69 SER N A 69 SER CA A 69 SER C 1.0 -92.8 -52.8 PHI 114 114 A 69 SER N A 69 SER CA A 69 SER C A 70 LYS N 1.0 -37.4 2.6 PSI 115 115 A 70 LYS C A 71 LYS N A 71 LYS CA A 71 LYS C 1.0 -93.9 -49.9 PHI 116 116 A 71 LYS N A 71 LYS CA A 71 LYS C A 72 ARG N 1.0 117.0 157.0 PSI 117 117 A 71 LYS C A 72 ARG N A 72 ARG CA A 72 ARG C 1.0 -141.0 -61.6 PHI 118 118 A 72 ARG N A 72 ARG CA A 72 ARG C A 73 LYS N 1.0 105.8 167.4 PSI 119 119 A 72 ARG C A 73 LYS N A 73 LYS CA A 73 LYS C 1.0 -145.8 -67.0 PHI 120 120 A 73 LYS N A 73 LYS CA A 73 LYS C A 74 ASP N 1.0 109.7 164.9 PSI 121 121 A 73 LYS C A 74 ASP N A 74 ASP CA A 74 ASP C 1.0 -102.9 -62.9 PHI 122 122 A 74 ASP C A 75 ASN N A 75 ASN CA A 75 ASN C 1.0 -92.3 -52.3 PHI 123 123 A 75 ASN N A 75 ASN CA A 75 ASN C A 76 GLU N 1.0 -31.0 9.0 PSI 124 124 A 79 GLU C A 80 VAL N A 80 VAL CA A 80 VAL C 1.0 -128.3 -77.1 PHI 125 125 A 80 VAL N A 80 VAL CA A 80 VAL C A 81 VAL N 1.0 102.2 146.2 PSI 126 126 A 80 VAL C A 81 VAL N A 81 VAL CA A 81 VAL C 1.0 -136.6 -46.6 PHI 127 127 A 81 VAL N A 81 VAL CA A 81 VAL C A 82 PRO N 1.0 96.4 162.0 PSI 128 128 A 81 VAL C A 82 PRO N A 82 PRO CA A 82 PRO C 1.0 -82.9 -42.9 PHI 129 129 A 82 PRO N A 82 PRO CA A 82 PRO C A 83 LYS N 1.0 120.5 171.9 PSI 130 130 A 82 PRO C A 83 LYS N A 83 LYS CA A 83 LYS C 1.0 -94.2 -47.8 PHI 131 131 A 83 LYS N A 83 LYS CA A 83 LYS C A 84 PRO N 1.0 115.8 169.8 PSI 132 132 A 83 LYS C A 84 PRO N A 84 PRO CA A 84 PRO C 1.0 -86.6 -46.6 PHI 133 133 A 84 PRO N A 84 PRO CA A 84 PRO C A 85 GLN N 1.0 127.1 167.1 PSI 134 134 A 84 PRO C A 85 GLN N A 85 GLN CA A 85 GLN C 1.0 -90.8 -49.0 PHI 135 135 A 85 GLN N A 85 GLN CA A 85 GLN C A 86 ARG N 1.0 116.7 162.5 PSI 136 136 A 85 GLN C A 86 ARG N A 86 ARG CA A 86 ARG C 1.0 -154.7 -96.5 PHI 137 137 A 86 ARG N A 86 ARG CA A 86 ARG C A 87 HIS N 1.0 113.1 158.3 PSI 138 138 A 86 ARG C A 87 HIS N A 87 HIS CA A 87 HIS C 1.0 -154.0 -97.4 PHI 139 139 A 87 HIS N A 87 HIS CA A 87 HIS C A 88 MET N 1.0 113.6 157.8 PSI 140 140 A 87 HIS C A 88 MET N A 88 MET CA A 88 MET C 1.0 -139.4 -97.6 PHI 141 141 A 88 MET N A 88 MET CA A 88 MET C A 89 PHE N 1.0 109.9 149.9 PSI 142 142 A 88 MET C A 89 PHE N A 89 PHE CA A 89 PHE C 1.0 -149.0 -109.0 PHI 143 143 A 89 PHE N A 89 PHE CA A 89 PHE C A 90 SER N 1.0 125.5 165.5 PSI 144 144 A 89 PHE C A 90 SER N A 90 SER CA A 90 SER C 1.0 -151.8 -81.8 PHI 145 145 A 90 SER N A 90 SER CA A 90 SER C A 91 PHE N 1.0 119.7 159.7 PSI 146 146 A 90 SER C A 91 PHE N A 91 PHE CA A 91 PHE C 1.0 -156.7 -115.3 PHI 147 147 A 91 PHE N A 91 PHE CA A 91 PHE C A 92 ASN N 1.0 126.8 175.2 PSI 148 148 A 92 ASN C A 93 ASN N A 93 ASN CA A 93 ASN C 1.0 -167.7 -67.7 PHI 149 149 A 93 ASN N A 93 ASN CA A 93 ASN C A 94 ARG N 1.0 103.2 143.2 PSI 150 150 A 93 ASN C A 94 ARG N A 94 ARG CA A 94 ARG C 1.0 -82.1 -42.1 PHI 151 151 A 94 ARG N A 94 ARG CA A 94 ARG C A 95 THR N 1.0 -58.6 -18.6 PSI 152 152 A 94 ARG C A 95 THR N A 95 THR CA A 95 THR C 1.0 -83.8 -43.8 PHI 153 153 A 95 THR N A 95 THR CA A 95 THR C A 96 VAL N 1.0 -59.7 -19.7 PSI 154 154 A 95 THR C A 96 VAL N A 96 VAL CA A 96 VAL C 1.0 -87.1 -47.1 PHI 155 155 A 96 VAL N A 96 VAL CA A 96 VAL C A 97 MET N 1.0 -62.4 -22.4 PSI 156 156 A 96 VAL C A 97 MET N A 97 MET CA A 97 MET C 1.0 -82.4 -42.4 PHI 157 157 A 97 MET N A 97 MET CA A 97 MET C A 98 ASP N 1.0 -64.0 -24.0 PSI 158 158 A 97 MET C A 98 ASP N A 98 ASP CA A 98 ASP C 1.0 -85.8 -45.8 PHI 159 159 A 98 ASP N A 98 ASP CA A 98 ASP C A 99 ASN N 1.0 -57.3 -17.3 PSI 160 160 A 98 ASP C A 99 ASN N A 99 ASN CA A 99 ASN C 1.0 -86.5 -46.5 PHI 161 161 A 99 ASN N A 99 ASN CA A 99 ASN C A 100 ILE N 1.0 -60.8 -20.8 PSI 162 162 A 99 ASN C A 100 ILE N A 100 ILE CA A 100 ILE C 1.0 -87.2 -47.2 PHI 163 163 A 100 ILE N A 100 ILE CA A 100 ILE C A 101 LYS N 1.0 -58.5 -16.5 PSI 164 164 A 100 ILE C A 101 LYS N A 101 LYS CA A 101 LYS C 1.0 -82.3 -42.3 PHI 165 165 A 101 LYS N A 101 LYS CA A 101 LYS C A 102 MET N 1.0 -62.1 -22.1 PSI 166 166 A 101 LYS C A 102 MET N A 102 MET CA A 102 MET C 1.0 -85.7 -45.7 PHI 167 167 A 102 MET N A 102 MET CA A 102 MET C A 103 THR N 1.0 -58.6 -18.6 PSI 168 168 A 102 MET C A 103 THR N A 103 THR CA A 103 THR C 1.0 -87.0 -47.0 PHI 169 169 A 103 THR N A 103 THR CA A 103 THR C A 104 LEU N 1.0 -62.1 -22.1 PSI 170 170 A 103 THR C A 104 LEU N A 104 LEU CA A 104 LEU C 1.0 -85.1 -45.1 PHI 171 171 A 104 LEU N A 104 LEU CA A 104 LEU C A 105 GLN N 1.0 -61.0 -21.0 PSI 172 172 A 104 LEU C A 105 GLN N A 105 GLN CA A 105 GLN C 1.0 -83.2 -43.2 PHI 173 173 A 105 GLN N A 105 GLN CA A 105 GLN C A 106 GLN N 1.0 -60.3 -20.3 PSI 174 174 A 105 GLN C A 106 GLN N A 106 GLN CA A 106 GLN C 1.0 -86.1 -46.1 PHI 175 175 A 106 GLN N A 106 GLN CA A 106 GLN C A 107 ILE N 1.0 -61.3 -21.3 PSI 176 176 A 106 GLN C A 107 ILE N A 107 ILE CA A 107 ILE C 1.0 -85.0 -45.0 PHI 177 177 A 107 ILE N A 107 ILE CA A 107 ILE C A 108 ILE N 1.0 -64.9 -24.9 PSI 178 178 A 107 ILE C A 108 ILE N A 108 ILE CA A 108 ILE C 1.0 -82.7 -42.7 PHI 179 179 A 108 ILE N A 108 ILE CA A 108 ILE C A 109 SER N 1.0 -60.0 -20.0 PSI 180 180 A 108 ILE C A 109 SER N A 109 SER CA A 109 SER C 1.0 -85.7 -45.7 PHI 181 181 A 109 SER N A 109 SER CA A 109 SER C A 110 ARG N 1.0 -57.1 -17.1 PSI 182 182 A 109 SER C A 110 ARG N A 110 ARG CA A 110 ARG C 1.0 -89.1 -49.1 PHI 183 183 A 110 ARG N A 110 ARG CA A 110 ARG C A 111 TYR N 1.0 -53.4 -13.4 PSI 184 184 A 110 ARG C A 111 TYR N A 111 TYR CA A 111 TYR C 1.0 -128.5 -75.5 PHI 185 185 A 111 TYR N A 111 TYR CA A 111 TYR C A 112 LYS N 1.0 -28.9 38.7 PSI 186 186 A 112 LYS C A 113 ASP N A 113 ASP CA A 113 ASP C 1.0 -102.8 -60.2 PHI 187 187 A 113 ASP N A 113 ASP CA A 113 ASP C A 114 ALA N 1.0 -37.2 17.4 PSI 188 188 B 532 GLU C B 533 ASP N B 533 ASP CA B 533 ASP C 1.0 -115.0 -45.0 PHI 189 189 B 533 ASP N B 533 ASP CA B 533 ASP C B 534 PHE N 1.0 -60.0 8.0 PSI 190 190 B 533 ASP C B 534 PHE N B 534 PHE CA B 534 PHE C 1.0 -117.0 -47.0 PHI 191 191 B 534 PHE N B 534 PHE CA B 534 PHE C B 535 SER N 1.0 -59.0 11.0 PSI 192 192 B 534 PHE C B 535 SER N B 535 SER CA B 535 SER C 1.0 -111.0 -39.0 PHI 193 193 B 535 SER N B 535 SER CA B 535 SER C B 536 SER N 1.0 -56.0 -4.0 PSI 194 194 B 535 SER C B 536 SER N B 536 SER CA B 536 SER C 1.0 -97.0 -47.0 PHI 195 195 B 536 SER N B 536 SER CA B 536 SER C B 537 ILE N 1.0 -56.0 -8.0 PSI 196 196 B 536 SER C B 537 ILE N B 537 ILE CA B 537 ILE C 1.0 -91.0 -47.0 PHI 197 197 B 537 ILE N B 537 ILE CA B 537 ILE C B 538 ALA N 1.0 -65.0 -1.0 PSI 198 198 B 538 ALA C B 539 ASP N B 539 ASP CA B 539 ASP C 1.0 -115.0 -45.0 PHI 199 199 B 539 ASP N B 539 ASP CA B 539 ASP C B 540 MET N 1.0 -58.0 10.0 PSI 200 200 B 539 ASP C B 540 MET N B 540 MET CA B 540 MET C 1.0 -114.0 -42.0 PHI 201 201 B 540 MET N B 540 MET CA B 540 MET C B 541 ASP N 1.0 -59.0 9.0 PSI 202 202 B 540 MET C B 541 ASP N B 541 ASP CA B 541 ASP C 1.0 -89.0 -49.0 PHI 203 203 B 541 ASP N B 541 ASP CA B 541 ASP C B 542 PHE N 1.0 -59.0 -21.0 PSI 204 204 B 541 ASP C B 542 PHE N B 542 PHE CA B 542 PHE C 1.0 -84.0 -46.0 PHI 205 205 B 542 PHE N B 542 PHE CA B 542 PHE C B 543 SER N 1.0 -66.0 -2.0 PSI 206 206 B 542 PHE C B 543 SER N B 543 SER CA B 543 SER C 1.0 -86.0 -46.0 PHI 207 207 B 543 SER N B 543 SER CA B 543 SER C B 544 ALA N 1.0 -57.0 -17.0 PSI 208 208 B 543 SER C B 544 ALA N B 544 ALA CA B 544 ALA C 1.0 -91.0 -47.0 PHI 209 209 B 544 ALA N B 544 ALA CA B 544 ALA C B 545 LEU N 1.0 -66.0 0.0 PSI 210 210 B 544 ALA C B 545 LEU N B 545 LEU CA B 545 LEU C 1.0 -86.0 -48.0 PHI 211 211 B 545 LEU N B 545 LEU CA B 545 LEU C B 546 LEU N 1.0 -69.0 -1.0 PSI stop_ save_