data_nef_c25970_2nbb 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 2NBB 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 GLY start . false 2 A 2 SER middle . . 3 A 3 GLU middle . . 4 A 4 ASN middle . . 5 A 5 PHE middle . . 6 A 6 GLN middle . . 7 A 7 THR middle . . 8 A 8 LEU middle . . 9 A 9 LEU middle . . 10 A 10 ASP middle . . 11 A 11 ALA middle . . 12 A 12 GLY middle . false 13 A 13 LEU middle . . 14 A 14 PRO middle . false 15 A 15 GLN middle . . 16 A 16 LYS middle . . 17 A 17 VAL middle . . 18 A 18 ALA middle . . 19 A 19 GLU middle . . 20 A 20 LYS middle . . 21 A 21 LEU middle . . 22 A 22 ASP middle . . 23 A 23 GLU middle . . 24 A 24 ILE middle . . 25 A 25 TYR middle . . 26 A 26 VAL middle . . 27 A 27 ALA middle . . 28 A 28 GLY middle . false 29 A 29 LEU middle . . 30 A 30 VAL middle . . 31 A 31 ALA middle . . 32 A 32 HIS middle . . 33 A 33 SER middle . . 34 A 34 ASP middle . . 35 A 35 LEU middle . . 36 A 36 ASP middle . . 37 A 37 GLU middle . . 38 A 38 ARG middle . . 39 A 39 ALA middle . . 40 A 40 ILE middle . . 41 A 41 GLU middle . . 42 A 42 ALA middle . . 43 A 43 LEU middle . . 44 A 44 LYS middle . . 45 A 45 GLU middle . . 46 A 46 PHE middle . . 47 A 47 ASN middle . . 48 A 48 GLU middle . . 49 A 49 ASP middle . . 50 A 50 GLY middle . false 51 A 51 ALA middle . . 52 A 52 LEU middle . . 53 A 53 ALA middle . . 54 A 54 VAL middle . . 55 A 55 LEU middle . . 56 A 56 GLN middle . . 57 A 57 GLN middle . . 58 A 58 PHE middle . . 59 A 59 LYS middle . . 60 A 60 ASP middle . . 61 A 61 SER middle . . 62 A 62 ASP middle . . 63 A 63 LEU middle . . 64 A 64 SER middle . . 65 A 65 HIS middle . . 66 A 66 VAL middle . . 67 A 67 GLN middle . . 68 A 68 ASN middle . . 69 A 69 LYS middle . . 70 A 70 SER middle . . 71 A 71 ALA middle . . 72 A 72 PHE middle . . 73 A 73 LEU middle . . 74 A 74 CYS middle . . 75 A 75 GLY middle . false 76 A 76 VAL middle . . 77 A 77 MET middle . . 78 A 78 LYS middle . . 79 A 79 THR middle . . 80 A 80 TYR middle . . 81 A 81 ARG middle . . 82 A 82 GLN middle . . 83 A 83 ARG middle . . 84 A 84 GLU middle . . 85 A 85 LYS middle . . 86 A 86 GLN middle . . 87 A 87 GLY middle . false 88 A 88 THR middle . . 89 A 89 LYS middle . . 90 A 90 VAL middle . . 91 A 91 ALA middle . . 92 A 92 ASP middle . . 93 A 93 SER middle . . 94 A 94 SER middle . . 95 A 95 LYS middle . . 96 A 96 GLY middle . false 97 A 97 PRO middle . false 98 A 98 ASP middle . . 99 A 99 GLU middle . . 100 A 100 ALA middle . . 101 A 101 LYS middle . . 102 A 102 ILE middle . . 103 A 103 LYS middle . . 104 A 104 ALA middle . . 105 A 105 LEU middle . . 106 A 106 LEU middle . . 107 A 107 GLU middle . . 108 A 108 ARG middle . . 109 A 109 THR middle . . 110 A 110 GLY middle . false 111 A 111 TYR middle . . 112 A 112 THR middle . . 113 A 113 LEU middle . . 114 A 114 ASP middle . . 115 A 115 VAL middle . . 116 A 116 THR middle . . 117 A 117 THR middle . . 118 A 118 GLY end . false stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 GLY HAy H 1 3.712 0.008 A 1 GLY HAx H 1 3.537 0.008 A 1 GLY C C 13 167.632 0.19 A 1 GLY CA C 13 40.618 0.19 A 2 SER H H 1 9.734 0.008 A 2 SER HA H 1 4.503 0.008 A 2 SER HBy H 1 4.104 0.008 A 2 SER HBx H 1 3.922 0.008 A 2 SER C C 13 172.832 0.19 A 2 SER CA C 13 55.860 0.19 A 2 SER CB C 13 61.614 0.19 A 2 SER N N 15 118.913 0.14 A 3 GLU H H 1 9.164 0.008 A 3 GLU HA H 1 4.165 0.008 A 3 GLU HBx H 1 1.952 0.008 A 3 GLU HBy H 1 1.952 0.008 A 3 GLU HGx H 1 2.200 0.008 A 3 GLU HGy H 1 2.200 0.008 A 3 GLU C C 13 174.388 0.19 A 3 GLU CA C 13 55.637 0.19 A 3 GLU CB C 13 26.425 0.19 A 3 GLU CG C 13 33.108 0.19 A 3 GLU N N 15 121.433 0.14 A 4 ASN H H 1 8.445 0.008 A 4 ASN HA H 1 4.527 0.008 A 4 ASN HBx H 1 2.443 0.008 A 4 ASN HBy H 1 2.443 0.008 A 4 ASN HD2x H 1 6.593 0.008 A 4 ASN HD2y H 1 7.606 0.008 A 4 ASN C C 13 172.788 0.19 A 4 ASN CA C 13 51.560 0.19 A 4 ASN CB C 13 36.756 0.19 A 4 ASN N N 15 117.480 0.14 A 4 ASN ND2 N 15 113.828 0.14 A 5 PHE H H 1 7.840 0.008 A 5 PHE HA H 1 3.969 0.008 A 5 PHE HBx H 1 2.996 0.008 A 5 PHE HBy H 1 3.204 0.008 A 5 PHE HDx H 1 7.003 0.008 A 5 PHE HDy H 1 7.003 0.008 A 5 PHE HEx H 1 7.164 0.008 A 5 PHE HEy H 1 7.164 0.008 A 5 PHE CA C 13 58.734 0.19 A 5 PHE CB C 13 36.339 0.19 A 5 PHE CDx C 13 128.714 0.19 A 5 PHE CDy C 13 128.714 0.19 A 5 PHE CEx C 13 128.731 0.19 A 5 PHE CEy C 13 128.731 0.19 A 5 PHE N N 15 121.507 0.14 A 6 GLN H H 1 8.310 0.008 A 6 GLN HA H 1 3.470 0.008 A 6 GLN HBy H 1 2.090 0.008 A 6 GLN HBx H 1 1.950 0.008 A 6 GLN HE2x H 1 6.726 0.008 A 6 GLN HE2y H 1 7.734 0.008 A 6 GLN HGx H 1 2.280 0.008 A 6 GLN HGy H 1 2.280 0.008 A 6 GLN C C 13 174.663 0.19 A 6 GLN CA C 13 55.303 0.19 A 6 GLN CB C 13 25.480 0.19 A 6 GLN CG C 13 30.749 0.19 A 6 GLN N N 15 117.776 0.14 A 6 GLN NE2 N 15 115.891 0.14 A 7 THR H H 1 7.602 0.008 A 7 THR HA H 1 3.851 0.008 A 7 THR HB H 1 4.091 0.008 A 7 THR HG2% H 1 1.108 0.008 A 7 THR C C 13 173.957 0.19 A 7 THR CA C 13 62.968 0.19 A 7 THR CB C 13 65.797 0.19 A 7 THR CG2 C 13 19.252 0.19 A 7 THR N N 15 114.096 0.14 A 8 LEU H H 1 7.476 0.008 A 8 LEU HA H 1 3.882 0.008 A 8 LEU HBx H 1 1.040 0.008 A 8 LEU HBy H 1 1.932 0.008 A 8 LEU HDx% H 1 0.744 0.008 A 8 LEU HDy% H 1 0.832 0.008 A 8 LEU HG H 1 1.803 0.008 A 8 LEU C C 13 175.887 0.19 A 8 LEU CA C 13 54.578 0.19 A 8 LEU CB C 13 39.136 0.19 A 8 LEU CDx C 13 19.351 0.19 A 8 LEU CDy C 13 23.784 0.19 A 8 LEU CG C 13 23.495 0.19 A 8 LEU N N 15 121.797 0.14 A 9 LEU H H 1 7.394 0.008 A 9 LEU HA H 1 3.995 0.008 A 9 LEU HBy H 1 1.532 0.008 A 9 LEU HBx H 1 1.240 0.008 A 9 LEU HDx% H 1 0.561 0.008 A 9 LEU HDy% H 1 0.525 0.008 A 9 LEU HG H 1 0.986 0.008 A 9 LEU C C 13 179.651 0.19 A 9 LEU CA C 13 54.274 0.19 A 9 LEU CB C 13 38.510 0.19 A 9 LEU CDy C 13 22.942 0.19 A 9 LEU CDx C 13 19.843 0.19 A 9 LEU CG C 13 23.230 0.19 A 9 LEU N N 15 119.407 0.14 A 10 ASP H H 1 8.684 0.008 A 10 ASP HA H 1 4.220 0.008 A 10 ASP HBy H 1 2.649 0.008 A 10 ASP HBx H 1 2.564 0.008 A 10 ASP C C 13 174.747 0.19 A 10 ASP CA C 13 53.817 0.19 A 10 ASP CB C 13 37.151 0.19 A 10 ASP N N 15 121.973 0.14 A 11 ALA H H 1 7.403 0.008 A 11 ALA HA H 1 4.200 0.008 A 11 ALA HB% H 1 1.391 0.008 A 11 ALA C C 13 174.573 0.19 A 11 ALA CA C 13 49.699 0.19 A 11 ALA CB C 13 15.534 0.19 A 11 ALA N N 15 121.075 0.14 A 12 GLY H H 1 7.821 0.008 A 12 GLY HAy H 1 4.054 0.008 A 12 GLY HAx H 1 3.608 0.008 A 12 GLY C C 13 172.185 0.19 A 12 GLY CA C 13 42.236 0.19 A 12 GLY N N 15 104.003 0.14 A 13 LEU H H 1 7.225 0.008 A 13 LEU HA H 1 4.357 0.008 A 13 LEU HBy H 1 1.349 0.008 A 13 LEU HBx H 1 0.977 0.008 A 13 LEU HDx% H 1 0.694 0.008 A 13 LEU HDy% H 1 0.716 0.008 A 13 LEU HG H 1 1.445 0.008 A 13 LEU CA C 13 50.098 0.19 A 13 LEU CB C 13 38.646 0.19 A 13 LEU CDx C 13 21.077 0.19 A 13 LEU CDy C 13 23.734 0.19 A 13 LEU CG C 13 24.552 0.19 A 13 LEU N N 15 120.491 0.14 A 14 PRO HA H 1 4.344 0.008 A 14 PRO HBy H 1 2.493 0.008 A 14 PRO HBx H 1 1.722 0.008 A 14 PRO HDx H 1 3.254 0.008 A 14 PRO HDy H 1 3.984 0.008 A 14 PRO HGy H 1 2.096 0.008 A 14 PRO HGx H 1 1.961 0.008 A 14 PRO C C 13 174.614 0.19 A 14 PRO CA C 13 59.553 0.19 A 14 PRO CB C 13 29.886 0.19 A 14 PRO CD C 13 47.704 0.19 A 14 PRO CG C 13 25.421 0.19 A 15 GLN H H 1 8.826 0.008 A 15 GLN HA H 1 3.682 0.008 A 15 GLN HBy H 1 2.221 0.008 A 15 GLN HBx H 1 1.915 0.008 A 15 GLN HE2x H 1 6.691 0.008 A 15 GLN HE2y H 1 7.863 0.008 A 15 GLN HGy H 1 2.346 0.008 A 15 GLN HGx H 1 2.296 0.008 A 15 GLN C C 13 174.841 0.19 A 15 GLN CA C 13 57.819 0.19 A 15 GLN CB C 13 25.477 0.19 A 15 GLN CG C 13 30.003 0.19 A 15 GLN N N 15 124.333 0.14 A 15 GLN NE2 N 15 111.751 0.14 A 16 LYS H H 1 9.287 0.008 A 16 LYS HA H 1 4.014 0.008 A 16 LYS HBx H 1 1.681 0.008 A 16 LYS HBy H 1 1.681 0.008 A 16 LYS HDx H 1 1.592 0.008 A 16 LYS HDy H 1 1.592 0.008 A 16 LYS HEx H 1 2.864 0.008 A 16 LYS HEy H 1 2.864 0.008 A 16 LYS HGx H 1 1.413 0.008 A 16 LYS HGy H 1 1.534 0.008 A 16 LYS C C 13 176.802 0.19 A 16 LYS CA C 13 56.610 0.19 A 16 LYS CB C 13 30.008 0.19 A 16 LYS CD C 13 26.080 0.19 A 16 LYS CE C 13 39.311 0.19 A 16 LYS CG C 13 23.024 0.19 A 16 LYS N N 15 115.595 0.14 A 17 VAL H H 1 7.005 0.008 A 17 VAL HA H 1 3.378 0.008 A 17 VAL HB H 1 1.986 0.008 A 17 VAL HGx% H 1 0.907 0.008 A 17 VAL HGy% H 1 0.775 0.008 A 17 VAL C C 13 173.947 0.19 A 17 VAL CA C 13 62.800 0.19 A 17 VAL CB C 13 29.201 0.19 A 17 VAL CGy C 13 20.508 0.19 A 17 VAL CGx C 13 19.353 0.19 A 17 VAL N N 15 118.379 0.14 A 18 ALA H H 1 8.350 0.008 A 18 ALA HA H 1 3.724 0.008 A 18 ALA HB% H 1 1.095 0.008 A 18 ALA C C 13 176.579 0.19 A 18 ALA CA C 13 52.454 0.19 A 18 ALA CB C 13 15.665 0.19 A 18 ALA N N 15 121.741 0.14 A 19 GLU H H 1 8.588 0.008 A 19 GLU HA H 1 3.904 0.008 A 19 GLU HBx H 1 1.941 0.008 A 19 GLU HBy H 1 2.085 0.008 A 19 GLU HGy H 1 2.559 0.008 A 19 GLU HGx H 1 2.094 0.008 A 19 GLU C C 13 176.196 0.19 A 19 GLU CA C 13 56.980 0.19 A 19 GLU CB C 13 27.433 0.19 A 19 GLU CG C 13 34.427 0.19 A 19 GLU N N 15 116.150 0.14 A 20 LYS H H 1 7.355 0.008 A 20 LYS HA H 1 4.063 0.008 A 20 LYS HBx H 1 1.941 0.008 A 20 LYS HBy H 1 2.087 0.008 A 20 LYS HDx H 1 1.805 0.008 A 20 LYS HDy H 1 1.805 0.008 A 20 LYS HEx H 1 2.840 0.008 A 20 LYS HGx H 1 2.087 0.008 A 20 LYS HGy H 1 2.087 0.008 A 20 LYS C C 13 175.716 0.19 A 20 LYS CA C 13 54.279 0.19 A 20 LYS CB C 13 27.588 0.19 A 20 LYS CD C 13 27.839 0.19 A 20 LYS CE C 13 39.084 0.19 A 20 LYS CG C 13 27.221 0.19 A 20 LYS N N 15 120.149 0.14 A 21 LEU H H 1 8.208 0.008 A 21 LEU HA H 1 3.895 0.008 A 21 LEU HBx H 1 1.261 0.008 A 21 LEU HBy H 1 1.456 0.008 A 21 LEU HDx% H 1 0.554 0.008 A 21 LEU HDy% H 1 0.559 0.008 A 21 LEU HG H 1 1.229 0.008 A 21 LEU C C 13 175.154 0.19 A 21 LEU CA C 13 54.718 0.19 A 21 LEU CB C 13 38.390 0.19 A 21 LEU CDx C 13 20.322 0.19 A 21 LEU CDy C 13 22.463 0.19 A 21 LEU CG C 13 24.012 0.19 A 21 LEU N N 15 120.104 0.14 A 22 ASP H H 1 8.381 0.008 A 22 ASP HA H 1 4.420 0.008 A 22 ASP HBy H 1 2.684 0.008 A 22 ASP HBx H 1 2.631 0.008 A 22 ASP C C 13 175.187 0.19 A 22 ASP CA C 13 55.321 0.19 A 22 ASP CB C 13 39.434 0.19 A 22 ASP N N 15 118.676 0.14 A 23 GLU H H 1 7.764 0.008 A 23 GLU HA H 1 3.883 0.008 A 23 GLU HBx H 1 2.153 0.008 A 23 GLU HBy H 1 2.220 0.008 A 23 GLU HGy H 1 2.459 0.008 A 23 GLU HGx H 1 2.074 0.008 A 23 GLU C C 13 177.135 0.19 A 23 GLU CA C 13 56.697 0.19 A 23 GLU CB C 13 27.106 0.19 A 23 GLU CG C 13 33.899 0.19 A 23 GLU N N 15 117.118 0.14 A 24 ILE H H 1 7.518 0.008 A 24 ILE HA H 1 3.605 0.008 A 24 ILE HB H 1 2.196 0.008 A 24 ILE HD1% H 1 0.875 0.008 A 24 ILE HG1y H 1 1.997 0.008 A 24 ILE HG1x H 1 0.814 0.008 A 24 ILE HG2% H 1 0.883 0.008 A 24 ILE C C 13 174.921 0.19 A 24 ILE CA C 13 63.129 0.19 A 24 ILE CB C 13 35.032 0.19 A 24 ILE CD1 C 13 12.385 0.19 A 24 ILE CG1 C 13 27.358 0.19 A 24 ILE CG2 C 13 15.998 0.19 A 24 ILE N N 15 121.428 0.14 A 25 TYR H H 1 7.974 0.008 A 25 TYR HA H 1 4.811 0.008 A 25 TYR HBx H 1 3.110 0.008 A 25 TYR HBy H 1 3.343 0.008 A 25 TYR HDx H 1 7.013 0.008 A 25 TYR HDy H 1 7.013 0.008 A 25 TYR HEx H 1 6.492 0.008 A 25 TYR HEy H 1 6.492 0.008 A 25 TYR C C 13 179.020 0.19 A 25 TYR CA C 13 56.160 0.19 A 25 TYR CB C 13 34.550 0.19 A 25 TYR CDx C 13 129.268 0.19 A 25 TYR CEx C 13 115.928 0.19 A 25 TYR N N 15 120.882 0.14 A 26 VAL H H 1 9.111 0.008 A 26 VAL HA H 1 3.592 0.008 A 26 VAL HB H 1 2.045 0.008 A 26 VAL HGx% H 1 1.042 0.008 A 26 VAL HGy% H 1 0.882 0.008 A 26 VAL C C 13 175.366 0.19 A 26 VAL CA C 13 63.452 0.19 A 26 VAL CB C 13 29.139 0.19 A 26 VAL CGy C 13 20.984 0.19 A 26 VAL CGx C 13 18.559 0.19 A 26 VAL N N 15 123.442 0.14 A 27 ALA H H 1 7.702 0.008 A 27 ALA HA H 1 4.199 0.008 A 27 ALA HB% H 1 1.479 0.008 A 27 ALA C C 13 175.626 0.19 A 27 ALA CA C 13 50.235 0.19 A 27 ALA CB C 13 16.045 0.19 A 27 ALA N N 15 120.013 0.14 A 28 GLY H H 1 7.924 0.008 A 28 GLY HAy H 1 4.010 0.008 A 28 GLY HAx H 1 3.767 0.008 A 28 GLY C C 13 172.331 0.19 A 28 GLY CA C 13 42.594 0.19 A 28 GLY N N 15 105.510 0.14 A 29 LEU H H 1 7.509 0.008 A 29 LEU HA H 1 3.997 0.008 A 29 LEU HBx H 1 1.379 0.008 A 29 LEU HBy H 1 1.657 0.008 A 29 LEU HDx% H 1 0.760 0.008 A 29 LEU HDy% H 1 0.888 0.008 A 29 LEU HG H 1 1.513 0.008 A 29 LEU C C 13 173.808 0.19 A 29 LEU CA C 13 54.193 0.19 A 29 LEU CB C 13 39.854 0.19 A 29 LEU CDx C 13 20.290 0.19 A 29 LEU CDy C 13 22.968 0.19 A 29 LEU CG C 13 24.712 0.19 A 29 LEU N N 15 119.069 0.14 A 30 VAL H H 1 7.060 0.008 A 30 VAL HA H 1 4.209 0.008 A 30 VAL HB H 1 2.035 0.008 A 30 VAL HGx% H 1 0.849 0.008 A 30 VAL HGy% H 1 0.667 0.008 A 30 VAL C C 13 170.255 0.19 A 30 VAL CA C 13 56.314 0.19 A 30 VAL CB C 13 32.457 0.19 A 30 VAL CGy C 13 19.420 0.19 A 30 VAL CGx C 13 18.037 0.19 A 30 VAL N N 15 109.199 0.14 A 31 ALA H H 1 8.949 0.008 A 31 ALA HA H 1 4.553 0.008 A 31 ALA HB% H 1 1.282 0.008 A 31 ALA C C 13 175.990 0.19 A 31 ALA CA C 13 47.468 0.19 A 31 ALA CB C 13 18.087 0.19 A 31 ALA N N 15 126.162 0.14 A 32 HIS H H 1 8.677 0.008 A 32 HIS HA H 1 3.985 0.008 A 32 HIS HBx H 1 2.774 0.008 A 32 HIS HBy H 1 2.818 0.008 A 32 HIS HD2 H 1 6.891 0.008 A 32 HIS HE1 H 1 7.885 0.008 A 32 HIS C C 13 174.376 0.19 A 32 HIS CA C 13 56.678 0.19 A 32 HIS CB C 13 26.589 0.19 A 32 HIS CD2 C 13 116.245 0.19 A 32 HIS CE1 C 13 134.380 0.19 A 32 HIS N N 15 120.709 0.14 A 33 SER H H 1 7.810 0.008 A 33 SER HA H 1 4.122 0.008 A 33 SER HBx H 1 3.674 0.008 A 33 SER HBy H 1 3.916 0.008 A 33 SER C C 13 172.435 0.19 A 33 SER CA C 13 56.128 0.19 A 33 SER CB C 13 60.021 0.19 A 33 SER N N 15 109.944 0.14 A 34 ASP H H 1 7.672 0.008 A 34 ASP HA H 1 4.514 0.008 A 34 ASP HBx H 1 2.553 0.008 A 34 ASP HBy H 1 2.916 0.008 A 34 ASP CA C 13 53.419 0.19 A 34 ASP CB C 13 39.634 0.19 A 34 ASP N N 15 119.726 0.14 A 35 LEU H H 1 7.389 0.008 A 35 LEU HA H 1 4.442 0.008 A 35 LEU HBy H 1 1.789 0.008 A 35 LEU HBx H 1 0.973 0.008 A 35 LEU HDx% H 1 0.567 0.008 A 35 LEU HDy% H 1 0.696 0.008 A 35 LEU HG H 1 1.515 0.008 A 35 LEU CA C 13 50.320 0.19 A 35 LEU CB C 13 38.779 0.19 A 35 LEU CDx C 13 20.502 0.19 A 35 LEU CDy C 13 22.866 0.19 A 35 LEU CG C 13 24.184 0.19 A 35 LEU N N 15 118.140 0.14 A 36 ASP H H 1 8.026 0.008 A 36 ASP HA H 1 4.415 0.008 A 36 ASP HBy H 1 2.929 0.008 A 36 ASP HBx H 1 2.612 0.008 A 36 ASP C C 13 173.045 0.19 A 36 ASP CA C 13 49.807 0.19 A 36 ASP CB C 13 39.302 0.19 A 36 ASP N N 15 122.935 0.14 A 37 GLU H H 1 8.578 0.008 A 37 GLU HA H 1 3.817 0.008 A 37 GLU HBx H 1 1.947 0.008 A 37 GLU HBy H 1 1.947 0.008 A 37 GLU HGx H 1 2.243 0.008 A 37 GLU HGy H 1 2.243 0.008 A 37 GLU C C 13 175.873 0.19 A 37 GLU CA C 13 56.898 0.19 A 37 GLU CB C 13 26.560 0.19 A 37 GLU CG C 13 33.482 0.19 A 37 GLU N N 15 119.313 0.14 A 38 ARG H H 1 7.968 0.008 A 38 ARG HA H 1 3.923 0.008 A 38 ARG HBx H 1 1.711 0.008 A 38 ARG HBy H 1 1.801 0.008 A 38 ARG HDx H 1 3.099 0.008 A 38 ARG HDy H 1 3.099 0.008 A 38 ARG HGx H 1 1.583 0.008 A 38 ARG HGy H 1 1.583 0.008 A 38 ARG C C 13 176.280 0.19 A 38 ARG CA C 13 55.770 0.19 A 38 ARG CB C 13 26.747 0.19 A 38 ARG CD C 13 40.469 0.19 A 38 ARG CG C 13 24.439 0.19 A 38 ARG N N 15 117.845 0.14 A 38 ARG NHy N 15 75.993 0.14 A 39 ALA H H 1 7.859 0.008 A 39 ALA HA H 1 3.870 0.008 A 39 ALA HB% H 1 1.307 0.008 A 39 ALA C C 13 175.869 0.19 A 39 ALA CA C 13 52.172 0.19 A 39 ALA CB C 13 15.300 0.19 A 39 ALA N N 15 123.101 0.14 A 40 ILE H H 1 7.425 0.008 A 40 ILE HA H 1 3.434 0.008 A 40 ILE HB H 1 1.854 0.008 A 40 ILE HD1% H 1 0.526 0.008 A 40 ILE HG1x H 1 1.094 0.008 A 40 ILE HG1y H 1 1.319 0.008 A 40 ILE HG2% H 1 0.703 0.008 A 40 ILE C C 13 175.192 0.19 A 40 ILE CA C 13 60.787 0.19 A 40 ILE CB C 13 33.741 0.19 A 40 ILE CD1 C 13 7.865 0.19 A 40 ILE CG1 C 13 25.598 0.19 A 40 ILE CG2 C 13 14.559 0.19 A 40 ILE N N 15 116.419 0.14 A 41 GLU H H 1 8.181 0.008 A 41 GLU HA H 1 3.779 0.008 A 41 GLU HBx H 1 1.943 0.008 A 41 GLU HBy H 1 1.943 0.008 A 41 GLU HGy H 1 2.271 0.008 A 41 GLU HGx H 1 2.235 0.008 A 41 GLU C C 13 176.502 0.19 A 41 GLU CA C 13 56.350 0.19 A 41 GLU CB C 13 26.520 0.19 A 41 GLU CG C 13 33.514 0.19 A 41 GLU N N 15 117.790 0.14 A 42 ALA H H 1 7.613 0.008 A 42 ALA HA H 1 4.060 0.008 A 42 ALA HB% H 1 1.441 0.008 A 42 ALA CA C 13 51.980 0.19 A 42 ALA CB C 13 15.401 0.19 A 42 ALA N N 15 120.812 0.14 A 43 LEU H H 1 7.769 0.008 A 43 LEU HA H 1 4.128 0.008 A 43 LEU HBy H 1 1.646 0.008 A 43 LEU HBx H 1 1.578 0.008 A 43 LEU HDx% H 1 0.579 0.008 A 43 LEU HDy% H 1 0.636 0.008 A 43 LEU HG H 1 1.580 0.008 A 43 LEU C C 13 176.358 0.19 A 43 LEU CA C 13 54.829 0.19 A 43 LEU CB C 13 39.598 0.19 A 43 LEU CDy C 13 22.556 0.19 A 43 LEU CDx C 13 21.679 0.19 A 43 LEU CG C 13 24.132 0.19 A 43 LEU N N 15 120.398 0.14 A 44 LYS H H 1 7.733 0.008 A 44 LYS HA H 1 4.024 0.008 A 44 LYS HBy H 1 1.905 0.008 A 44 LYS HBx H 1 1.779 0.008 A 44 LYS HDx H 1 1.579 0.008 A 44 LYS HDy H 1 1.579 0.008 A 44 LYS HGx H 1 1.290 0.008 A 44 LYS HGy H 1 1.290 0.008 A 44 LYS C C 13 174.405 0.19 A 44 LYS CA C 13 55.611 0.19 A 44 LYS CB C 13 29.848 0.19 A 44 LYS CD C 13 27.073 0.19 A 44 LYS CG C 13 23.287 0.19 A 44 LYS N N 15 116.588 0.14 A 45 GLU H H 1 7.294 0.008 A 45 GLU HA H 1 4.022 0.008 A 45 GLU HBx H 1 1.861 0.008 A 45 GLU HBy H 1 1.861 0.008 A 45 GLU HGy H 1 2.420 0.008 A 45 GLU HGx H 1 2.092 0.008 A 45 GLU C C 13 174.393 0.19 A 45 GLU CA C 13 54.376 0.19 A 45 GLU CB C 13 27.210 0.19 A 45 GLU CG C 13 33.789 0.19 A 45 GLU N N 15 115.805 0.14 A 46 PHE H H 1 7.362 0.008 A 46 PHE HA H 1 4.333 0.008 A 46 PHE HBy H 1 3.204 0.008 A 46 PHE HBx H 1 2.991 0.008 A 46 PHE HDx H 1 7.322 0.008 A 46 PHE HDy H 1 7.322 0.008 A 46 PHE HEx H 1 7.140 0.008 A 46 PHE HEy H 1 7.140 0.008 A 46 PHE HZ H 1 7.230 0.008 A 46 PHE C C 13 173.947 0.19 A 46 PHE CA C 13 55.539 0.19 A 46 PHE CB C 13 38.490 0.19 A 46 PHE CDx C 13 128.688 0.19 A 46 PHE CDy C 13 128.688 0.19 A 46 PHE CEx C 13 128.575 0.19 A 46 PHE CEy C 13 128.575 0.19 A 46 PHE CZ C 13 125.683 0.19 A 46 PHE N N 15 118.412 0.14 A 47 ASN H H 1 8.383 0.008 A 47 ASN HA H 1 4.601 0.008 A 47 ASN HBy H 1 3.165 0.008 A 47 ASN HBx H 1 2.940 0.008 A 47 ASN HD2x H 1 7.013 0.008 A 47 ASN HD2y H 1 7.676 0.008 A 47 ASN C C 13 172.502 0.19 A 47 ASN CA C 13 49.604 0.19 A 47 ASN CB C 13 35.248 0.19 A 47 ASN N N 15 117.521 0.14 A 47 ASN ND2 N 15 112.867 0.14 A 48 GLU H H 1 8.671 0.008 A 48 GLU HA H 1 3.671 0.008 A 48 GLU HBx H 1 1.924 0.008 A 48 GLU HBy H 1 2.026 0.008 A 48 GLU HGx H 1 2.026 0.008 A 48 GLU HGy H 1 2.026 0.008 A 48 GLU C C 13 174.316 0.19 A 48 GLU CA C 13 58.565 0.19 A 48 GLU CB C 13 27.733 0.19 A 48 GLU CG C 13 34.683 0.19 A 48 GLU N N 15 121.077 0.14 A 49 ASP H H 1 8.200 0.008 A 49 ASP HA H 1 4.217 0.008 A 49 ASP HBx H 1 2.504 0.008 A 49 ASP HBy H 1 2.573 0.008 A 49 ASP C C 13 176.775 0.19 A 49 ASP CA C 13 54.663 0.19 A 49 ASP CB C 13 37.590 0.19 A 49 ASP N N 15 115.255 0.14 A 50 GLY H H 1 8.150 0.008 A 50 GLY HAx H 1 3.707 0.008 A 50 GLY HAy H 1 3.833 0.008 A 50 GLY C C 13 171.491 0.19 A 50 GLY CA C 13 44.456 0.19 A 50 GLY N N 15 109.705 0.14 A 51 ALA H H 1 8.547 0.008 A 51 ALA HA H 1 3.346 0.008 A 51 ALA HB% H 1 1.310 0.008 A 51 ALA C C 13 177.028 0.19 A 51 ALA CA C 13 52.097 0.19 A 51 ALA CB C 13 16.853 0.19 A 51 ALA N N 15 123.574 0.14 A 52 LEU H H 1 8.131 0.008 A 52 LEU HA H 1 3.777 0.008 A 52 LEU HBy H 1 1.813 0.008 A 52 LEU HBx H 1 1.353 0.008 A 52 LEU HDx% H 1 0.662 0.008 A 52 LEU HDy% H 1 0.763 0.008 A 52 LEU HG H 1 1.813 0.008 A 52 LEU C C 13 176.763 0.19 A 52 LEU CA C 13 55.349 0.19 A 52 LEU CB C 13 38.012 0.19 A 52 LEU CDx C 13 20.739 0.19 A 52 LEU CDy C 13 23.039 0.19 A 52 LEU CG C 13 24.206 0.19 A 52 LEU N N 15 115.645 0.14 A 53 ALA H H 1 7.525 0.008 A 53 ALA HA H 1 4.024 0.008 A 53 ALA HB% H 1 1.369 0.008 A 53 ALA CA C 13 52.392 0.19 A 53 ALA CB C 13 15.659 0.19 A 53 ALA N N 15 123.428 0.14 A 54 VAL H H 1 7.879 0.008 A 54 VAL HA H 1 3.088 0.008 A 54 VAL HB H 1 1.630 0.008 A 54 VAL HGx% H 1 0.308 0.008 A 54 VAL HGy% H 1 0.039 0.008 A 54 VAL C C 13 175.873 0.19 A 54 VAL CA C 13 62.950 0.19 A 54 VAL CB C 13 28.399 0.19 A 54 VAL CGx C 13 18.748 0.19 A 54 VAL CGy C 13 19.726 0.19 A 54 VAL N N 15 119.325 0.14 A 55 LEU H H 1 7.967 0.008 A 55 LEU HA H 1 3.837 0.008 A 55 LEU HBx H 1 1.026 0.008 A 55 LEU HBy H 1 1.799 0.008 A 55 LEU HDx% H 1 0.515 0.008 A 55 LEU HDy% H 1 0.666 0.008 A 55 LEU HG H 1 1.748 0.008 A 55 LEU C C 13 176.014 0.19 A 55 LEU CA C 13 54.609 0.19 A 55 LEU CB C 13 38.909 0.19 A 55 LEU CDx C 13 19.640 0.19 A 55 LEU CDy C 13 25.053 0.19 A 55 LEU CG C 13 23.688 0.19 A 55 LEU N N 15 118.068 0.14 A 56 GLN H H 1 8.100 0.008 A 56 GLN HA H 1 3.760 0.008 A 56 GLN HBy H 1 2.126 0.008 A 56 GLN HBx H 1 2.053 0.008 A 56 GLN HE2y H 1 7.935 0.008 A 56 GLN HE2x H 1 6.818 0.008 A 56 GLN HGx H 1 2.285 0.008 A 56 GLN HGy H 1 2.285 0.008 A 56 GLN C C 13 174.356 0.19 A 56 GLN CA C 13 55.601 0.19 A 56 GLN CB C 13 25.330 0.19 A 56 GLN CG C 13 30.429 0.19 A 56 GLN N N 15 120.271 0.14 A 56 GLN NE2 N 15 116.192 0.14 A 57 GLN H H 1 7.718 0.008 A 57 GLN HA H 1 3.986 0.008 A 57 GLN HBx H 1 1.936 0.008 A 57 GLN HBy H 1 1.936 0.008 A 57 GLN HE2x H 1 6.569 0.008 A 57 GLN HE2y H 1 7.369 0.008 A 57 GLN HGx H 1 2.250 0.008 A 57 GLN HGy H 1 2.451 0.008 A 57 GLN C C 13 177.122 0.19 A 57 GLN CA C 13 56.190 0.19 A 57 GLN CB C 13 25.275 0.19 A 57 GLN CG C 13 31.204 0.19 A 57 GLN N N 15 117.571 0.14 A 57 GLN NE2 N 15 109.942 0.14 A 58 PHE H H 1 8.494 0.008 A 58 PHE HA H 1 4.200 0.008 A 58 PHE HBx H 1 2.939 0.008 A 58 PHE HBy H 1 3.327 0.008 A 58 PHE HDx H 1 7.062 0.008 A 58 PHE HDy H 1 7.062 0.008 A 58 PHE HEx H 1 7.182 0.008 A 58 PHE HEy H 1 7.182 0.008 A 58 PHE HZ H 1 6.918 0.008 A 58 PHE C C 13 172.946 0.19 A 58 PHE CA C 13 58.583 0.19 A 58 PHE CB C 13 37.445 0.19 A 58 PHE CDx C 13 128.541 0.19 A 58 PHE CDy C 13 128.541 0.19 A 58 PHE CEx C 13 128.629 0.19 A 58 PHE CEy C 13 128.629 0.19 A 58 PHE CZ C 13 126.517 0.19 A 58 PHE N N 15 120.337 0.14 A 59 LYS H H 1 8.421 0.008 A 59 LYS HA H 1 3.622 0.008 A 59 LYS HBx H 1 1.798 0.008 A 59 LYS HDy H 1 1.522 0.008 A 59 LYS HDx H 1 1.450 0.008 A 59 LYS HEx H 1 2.774 0.008 A 59 LYS HEy H 1 2.774 0.008 A 59 LYS HGx H 1 1.237 0.008 A 59 LYS HGy H 1 1.517 0.008 A 59 LYS C C 13 174.011 0.19 A 59 LYS CA C 13 56.183 0.19 A 59 LYS CB C 13 29.596 0.19 A 59 LYS CD C 13 26.841 0.19 A 59 LYS CE C 13 39.190 0.19 A 59 LYS CG C 13 22.303 0.19 A 59 LYS N N 15 117.717 0.14 A 60 ASP H H 1 7.627 0.008 A 60 ASP HA H 1 4.630 0.008 A 60 ASP HBy H 1 2.810 0.008 A 60 ASP HBx H 1 2.544 0.008 A 60 ASP C C 13 174.252 0.19 A 60 ASP CA C 13 51.895 0.19 A 60 ASP CB C 13 38.073 0.19 A 60 ASP N N 15 116.567 0.14 A 61 SER H H 1 7.375 0.008 A 61 SER HA H 1 4.380 0.008 A 61 SER HBy H 1 3.902 0.008 A 61 SER HBx H 1 3.624 0.008 A 61 SER C C 13 169.535 0.19 A 61 SER CA C 13 56.579 0.19 A 61 SER CB C 13 61.590 0.19 A 61 SER N N 15 117.036 0.14 A 62 ASP H H 1 8.503 0.008 A 62 ASP HA H 1 4.545 0.008 A 62 ASP HBy H 1 2.757 0.008 A 62 ASP HBx H 1 2.513 0.008 A 62 ASP CA C 13 50.210 0.19 A 62 ASP CB C 13 36.298 0.19 A 62 ASP N N 15 120.555 0.14 A 63 LEU H H 1 8.252 0.008 A 63 LEU HA H 1 3.804 0.008 A 63 LEU HBy H 1 1.449 0.008 A 63 LEU HBx H 1 1.093 0.008 A 63 LEU HDx% H 1 0.104 0.008 A 63 LEU HDy% H 1 -0.180 0.008 A 63 LEU HG H 1 1.143 0.008 A 63 LEU CA C 13 51.895 0.19 A 63 LEU CB C 13 39.085 0.19 A 63 LEU CDy C 13 23.174 0.19 A 63 LEU CDx C 13 20.024 0.19 A 63 LEU CG C 13 23.210 0.19 A 63 LEU N N 15 126.188 0.14 A 64 SER H H 1 8.221 0.008 A 64 SER HA H 1 3.853 0.008 A 64 SER HBy H 1 3.680 0.008 A 64 SER HBx H 1 3.534 0.008 A 64 SER C C 13 172.835 0.19 A 64 SER CA C 13 58.814 0.19 A 64 SER CB C 13 59.803 0.19 A 64 SER N N 15 116.368 0.14 A 65 HIS H H 1 8.154 0.008 A 65 HIS HA H 1 4.713 0.008 A 65 HIS HBx H 1 2.704 0.008 A 65 HIS HBy H 1 3.432 0.008 A 65 HIS HD2 H 1 7.179 0.008 A 65 HIS HE1 H 1 8.354 0.008 A 65 HIS C C 13 171.011 0.19 A 65 HIS CA C 13 52.241 0.19 A 65 HIS CB C 13 25.656 0.19 A 65 HIS CD2 C 13 117.092 0.19 A 65 HIS CE1 C 13 133.324 0.19 A 65 HIS N N 15 117.550 0.14 A 66 VAL H H 1 6.993 0.008 A 66 VAL HA H 1 3.860 0.008 A 66 VAL HB H 1 1.650 0.008 A 66 VAL HGx% H 1 0.575 0.008 A 66 VAL HGy% H 1 0.403 0.008 A 66 VAL C C 13 172.361 0.19 A 66 VAL CA C 13 59.059 0.19 A 66 VAL CB C 13 29.748 0.19 A 66 VAL CGy C 13 19.341 0.19 A 66 VAL CGx C 13 18.329 0.19 A 66 VAL N N 15 121.439 0.14 A 67 GLN H H 1 8.560 0.008 A 67 GLN HA H 1 4.141 0.008 A 67 GLN HBy H 1 2.035 0.008 A 67 GLN HBx H 1 1.892 0.008 A 67 GLN HE2x H 1 6.758 0.008 A 67 GLN HE2y H 1 7.408 0.008 A 67 GLN HGx H 1 2.325 0.008 A 67 GLN HGy H 1 2.325 0.008 A 67 GLN CA C 13 55.047 0.19 A 67 GLN CB C 13 26.494 0.19 A 67 GLN CG C 13 31.288 0.19 A 67 GLN N N 15 127.272 0.14 A 67 GLN NE2 N 15 112.133 0.14 A 68 ASN H H 1 8.211 0.008 A 68 ASN HA H 1 4.932 0.008 A 68 ASN HBx H 1 2.636 0.008 A 68 ASN HBy H 1 3.071 0.008 A 68 ASN HD2y H 1 7.684 0.008 A 68 ASN HD2x H 1 7.079 0.008 A 68 ASN C C 13 173.073 0.19 A 68 ASN CA C 13 48.605 0.19 A 68 ASN CB C 13 35.214 0.19 A 68 ASN N N 15 117.031 0.14 A 68 ASN ND2 N 15 112.879 0.14 A 69 LYS H H 1 9.072 0.008 A 69 LYS HA H 1 3.927 0.008 A 69 LYS HBx H 1 1.884 0.008 A 69 LYS HDx H 1 1.663 0.008 A 69 LYS HDy H 1 1.663 0.008 A 69 LYS HEx H 1 2.995 0.008 A 69 LYS HEy H 1 2.995 0.008 A 69 LYS HGy H 1 1.564 0.008 A 69 LYS HGx H 1 1.376 0.008 A 69 LYS C C 13 175.246 0.19 A 69 LYS CA C 13 57.495 0.19 A 69 LYS CB C 13 30.487 0.19 A 69 LYS CD C 13 26.795 0.19 A 69 LYS CE C 13 40.016 0.19 A 69 LYS CG C 13 25.349 0.19 A 69 LYS N N 15 125.017 0.14 A 70 SER H H 1 8.514 0.008 A 70 SER HBx H 1 3.974 0.008 A 70 SER HBy H 1 4.215 0.008 A 70 SER CB C 13 59.878 0.19 A 70 SER N N 15 115.927 0.14 A 71 ALA H H 1 7.908 0.008 A 71 ALA HA H 1 3.962 0.008 A 71 ALA HB% H 1 1.330 0.008 A 71 ALA CA C 13 51.854 0.19 A 71 ALA CB C 13 15.126 0.19 A 71 ALA N N 15 123.395 0.14 A 72 PHE H H 1 7.892 0.008 A 72 PHE HA H 1 4.134 0.008 A 72 PHE HBx H 1 3.190 0.008 A 72 PHE HBy H 1 3.190 0.008 A 72 PHE HDx H 1 7.175 0.008 A 72 PHE HDy H 1 7.175 0.008 A 72 PHE HEx H 1 7.246 0.008 A 72 PHE HEy H 1 7.246 0.008 A 72 PHE HZ H 1 7.223 0.008 A 72 PHE C C 13 175.686 0.19 A 72 PHE CA C 13 58.850 0.19 A 72 PHE CB C 13 37.404 0.19 A 72 PHE CDx C 13 128.727 0.19 A 72 PHE CDy C 13 128.727 0.19 A 72 PHE CEx C 13 128.874 0.19 A 72 PHE CEy C 13 128.874 0.19 A 72 PHE CZ C 13 127.421 0.19 A 72 PHE N N 15 120.055 0.14 A 73 LEU H H 1 8.484 0.008 A 73 LEU HA H 1 3.751 0.008 A 73 LEU HBy H 1 1.854 0.008 A 73 LEU HBx H 1 1.064 0.008 A 73 LEU HDx% H 1 0.326 0.008 A 73 LEU HDy% H 1 0.104 0.008 A 73 LEU HG H 1 1.251 0.008 A 73 LEU C C 13 175.893 0.19 A 73 LEU CA C 13 55.639 0.19 A 73 LEU CB C 13 37.550 0.19 A 73 LEU CDy C 13 22.761 0.19 A 73 LEU CDx C 13 18.964 0.19 A 73 LEU CG C 13 23.979 0.19 A 73 LEU N N 15 121.810 0.14 A 74 CYS H H 1 8.309 0.008 A 74 CYS HA H 1 4.119 0.008 A 74 CYS HBy H 1 2.955 0.008 A 74 CYS HBx H 1 2.775 0.008 A 74 CYS C C 13 174.946 0.19 A 74 CYS CA C 13 61.373 0.19 A 74 CYS CB C 13 23.618 0.19 A 74 CYS N N 15 116.936 0.14 A 75 GLY H H 1 8.124 0.008 A 75 GLY HAy H 1 3.795 0.008 A 75 GLY HAx H 1 3.761 0.008 A 75 GLY C C 13 173.623 0.19 A 75 GLY CA C 13 44.471 0.19 A 75 GLY N N 15 110.569 0.14 A 76 VAL H H 1 7.875 0.008 A 76 VAL HA H 1 3.512 0.008 A 76 VAL HB H 1 2.148 0.008 A 76 VAL HGx% H 1 0.869 0.008 A 76 VAL HGy% H 1 0.713 0.008 A 76 VAL CA C 13 63.458 0.19 A 76 VAL CB C 13 28.598 0.19 A 76 VAL CGx C 13 20.117 0.19 A 76 VAL CGy C 13 20.175 0.19 A 76 VAL N N 15 124.470 0.14 A 77 MET H H 1 7.945 0.008 A 77 MET HA H 1 3.753 0.008 A 77 MET HBx H 1 1.983 0.008 A 77 MET HBy H 1 2.488 0.008 A 77 MET HE% H 1 1.966 0.008 A 77 MET HGx H 1 2.071 0.008 A 77 MET HGy H 1 2.344 0.008 A 77 MET C C 13 174.624 0.19 A 77 MET CA C 13 57.789 0.19 A 77 MET CB C 13 31.875 0.19 A 77 MET CE C 13 16.016 0.19 A 77 MET CG C 13 31.096 0.19 A 77 MET N N 15 118.242 0.14 A 78 LYS H H 1 7.893 0.008 A 78 LYS HA H 1 3.959 0.008 A 78 LYS HBx H 1 1.896 0.008 A 78 LYS HBy H 1 1.896 0.008 A 78 LYS HEx H 1 2.799 0.008 A 78 LYS HEy H 1 2.799 0.008 A 78 LYS HGx H 1 1.483 0.008 A 78 LYS HGy H 1 1.483 0.008 A 78 LYS C C 13 176.613 0.19 A 78 LYS CA C 13 57.021 0.19 A 78 LYS CB C 13 29.687 0.19 A 78 LYS CE C 13 39.160 0.19 A 78 LYS CG C 13 22.382 0.19 A 78 LYS N N 15 119.060 0.14 A 79 THR H H 1 8.073 0.008 A 79 THR HA H 1 3.868 0.008 A 79 THR HB H 1 4.148 0.008 A 79 THR HG2% H 1 1.139 0.008 A 79 THR C C 13 173.525 0.19 A 79 THR CA C 13 63.327 0.19 A 79 THR CB C 13 65.891 0.19 A 79 THR CG2 C 13 19.264 0.19 A 79 THR N N 15 115.304 0.14 A 80 TYR H H 1 8.245 0.008 A 80 TYR HA H 1 3.955 0.008 A 80 TYR HBx H 1 2.958 0.008 A 80 TYR HBy H 1 2.994 0.008 A 80 TYR HDx H 1 6.904 0.008 A 80 TYR HDy H 1 6.904 0.008 A 80 TYR HEx H 1 6.633 0.008 A 80 TYR HEy H 1 6.633 0.008 A 80 TYR C C 13 174.599 0.19 A 80 TYR CA C 13 59.238 0.19 A 80 TYR CB C 13 36.209 0.19 A 80 TYR CDx C 13 130.279 0.19 A 80 TYR CDy C 13 130.279 0.19 A 80 TYR CEx C 13 115.079 0.19 A 80 TYR CEy C 13 115.079 0.19 A 80 TYR N N 15 123.507 0.14 A 81 ARG H H 1 8.233 0.008 A 81 ARG HA H 1 4.037 0.008 A 81 ARG HBx H 1 1.851 0.008 A 81 ARG HBy H 1 1.951 0.008 A 81 ARG HDy H 1 3.038 0.008 A 81 ARG HE H 1 7.174 0.008 A 81 ARG HGy H 1 1.828 0.008 A 81 ARG HGx H 1 1.677 0.008 A 81 ARG C C 13 175.625 0.19 A 81 ARG CA C 13 55.897 0.19 A 81 ARG CB C 13 27.773 0.19 A 81 ARG CD C 13 40.577 0.19 A 81 ARG CG C 13 25.072 0.19 A 81 ARG N N 15 118.227 0.14 A 81 ARG NE N 15 84.239 0.14 A 82 GLN H H 1 7.807 0.008 A 82 GLN HA H 1 4.031 0.008 A 82 GLN HBx H 1 2.074 0.008 A 82 GLN HBy H 1 2.074 0.008 A 82 GLN HE2x H 1 6.795 0.008 A 82 GLN HE2y H 1 7.372 0.008 A 82 GLN HGx H 1 2.305 0.008 A 82 GLN HGy H 1 2.431 0.008 A 82 GLN C C 13 174.812 0.19 A 82 GLN CA C 13 55.069 0.19 A 82 GLN CB C 13 25.754 0.19 A 82 GLN CG C 13 31.347 0.19 A 82 GLN N N 15 118.054 0.14 A 82 GLN NE2 N 15 111.547 0.14 A 83 ARG H H 1 7.731 0.008 A 83 ARG HA H 1 4.015 0.008 A 83 ARG HBx H 1 1.692 0.008 A 83 ARG HBy H 1 1.692 0.008 A 83 ARG HDx H 1 2.948 0.008 A 83 ARG HDy H 1 2.948 0.008 A 83 ARG HGx H 1 1.484 0.008 A 83 ARG HGy H 1 1.484 0.008 A 83 ARG CA C 13 55.103 0.19 A 83 ARG CB C 13 27.489 0.19 A 83 ARG CD C 13 40.720 0.19 A 83 ARG CG C 13 24.338 0.19 A 83 ARG N N 15 119.467 0.14 A 84 GLU H H 1 7.897 0.008 A 84 GLU HA H 1 3.978 0.008 A 84 GLU HBx H 1 1.835 0.008 A 84 GLU HBy H 1 1.917 0.008 A 84 GLU HGy H 1 2.120 0.008 A 84 GLU HGx H 1 2.016 0.008 A 84 GLU CA C 13 59.921 0.19 A 84 GLU CB C 13 27.328 0.19 A 84 GLU CG C 13 33.494 0.19 A 84 GLU N N 15 120.021 0.14 A 85 LYS H H 1 8.500 0.008 A 85 LYS N N 15 120.428 0.14 A 86 GLN H H 1 8.215 0.008 A 86 GLN HA H 1 4.126 0.008 A 86 GLN HBx H 1 1.968 0.008 A 86 GLN HBy H 1 1.968 0.008 A 86 GLN HE2y H 1 7.448 0.008 A 86 GLN HE2x H 1 6.770 0.008 A 86 GLN C C 13 174.052 0.19 A 86 GLN CA C 13 53.476 0.19 A 86 GLN CB C 13 27.482 0.19 A 86 GLN N N 15 117.072 0.14 A 86 GLN NE2 N 15 112.412 0.14 A 87 GLY H H 1 8.188 0.008 A 87 GLY HAx H 1 3.917 0.008 A 87 GLY HAy H 1 3.917 0.008 A 87 GLY C C 13 171.580 0.19 A 87 GLY CA C 13 42.729 0.19 A 87 GLY N N 15 109.075 0.14 A 88 THR H H 1 7.937 0.008 A 88 THR HA H 1 4.216 0.008 A 88 THR HB H 1 4.721 0.008 A 88 THR HG2% H 1 1.097 0.008 A 88 THR C C 13 171.742 0.19 A 88 THR CA C 13 59.357 0.19 A 88 THR CB C 13 67.214 0.19 A 88 THR CG2 C 13 18.888 0.19 A 88 THR N N 15 113.955 0.14 A 89 LYS H H 1 8.259 0.008 A 89 LYS HA H 1 4.276 0.008 A 89 LYS HBx H 1 1.661 0.008 A 89 LYS HBy H 1 1.726 0.008 A 89 LYS C C 13 173.757 0.19 A 89 LYS CA C 13 53.580 0.19 A 89 LYS CB C 13 30.314 0.19 A 89 LYS N N 15 124.185 0.14 A 90 VAL H H 1 8.103 0.008 A 90 VAL HA H 1 3.967 0.008 A 90 VAL HB H 1 1.944 0.008 A 90 VAL HGx% H 1 0.830 0.008 A 90 VAL HGy% H 1 0.829 0.008 A 90 VAL C C 13 173.187 0.19 A 90 VAL CA C 13 59.319 0.19 A 90 VAL CB C 13 29.974 0.19 A 90 VAL CGx C 13 18.082 0.19 A 90 VAL CGy C 13 18.480 0.19 A 90 VAL N N 15 122.111 0.14 A 91 ALA H H 1 8.327 0.008 A 91 ALA HA H 1 4.199 0.008 A 91 ALA HB% H 1 1.277 0.008 A 91 ALA C C 13 174.695 0.19 A 91 ALA CA C 13 49.551 0.19 A 91 ALA CB C 13 16.567 0.19 A 91 ALA N N 15 127.842 0.14 A 92 ASP H H 1 8.223 0.008 A 92 ASP HA H 1 4.511 0.008 A 92 ASP HBy H 1 2.625 0.008 A 92 ASP HBx H 1 2.555 0.008 A 92 ASP C C 13 173.869 0.19 A 92 ASP CA C 13 51.439 0.19 A 92 ASP CB C 13 38.509 0.19 A 92 ASP N N 15 120.170 0.14 A 93 SER H H 1 8.272 0.008 A 93 SER HA H 1 4.349 0.008 A 93 SER HBy H 1 3.770 0.008 A 93 SER C C 13 172.187 0.19 A 93 SER CA C 13 55.793 0.19 A 93 SER CB C 13 60.934 0.19 A 93 SER N N 15 116.914 0.14 A 94 SER H H 1 8.329 0.008 A 94 SER HA H 1 4.340 0.008 A 94 SER HBx H 1 3.858 0.008 A 94 SER C C 13 171.807 0.19 A 94 SER CA C 13 56.262 0.19 A 94 SER CB C 13 60.935 0.19 A 94 SER N N 15 117.942 0.14 A 95 LYS H H 1 8.076 0.008 A 95 LYS HA H 1 4.296 0.008 A 95 LYS HBy H 1 1.681 0.008 A 95 LYS HGy H 1 1.327 0.008 A 95 LYS C C 13 173.981 0.19 A 95 LYS CA C 13 53.496 0.19 A 95 LYS CB C 13 30.433 0.19 A 95 LYS CG C 13 22.023 0.19 A 95 LYS N N 15 122.575 0.14 A 96 GLY H H 1 8.177 0.008 A 96 GLY HAx H 1 3.952 0.008 A 96 GLY HAy H 1 4.071 0.008 A 96 GLY CA C 13 42.037 0.19 A 96 GLY N N 15 109.829 0.14 A 97 PRO HA H 1 4.311 0.008 A 97 PRO HBx H 1 2.168 0.008 A 97 PRO HDx H 1 3.515 0.008 A 97 PRO HDy H 1 3.546 0.008 A 97 PRO HGx H 1 1.908 0.008 A 97 PRO CA C 13 60.558 0.19 A 97 PRO CB C 13 29.399 0.19 A 97 PRO CD C 13 47.019 0.19 A 97 PRO CG C 13 24.409 0.19 A 98 ASP H H 1 8.333 0.008 A 98 ASP HA H 1 4.472 0.008 A 98 ASP HBx H 1 2.544 0.008 A 98 ASP HBy H 1 2.644 0.008 A 98 ASP C C 13 173.966 0.19 A 98 ASP CA C 13 52.414 0.19 A 98 ASP CB C 13 38.295 0.19 A 98 ASP N N 15 120.167 0.14 A 99 GLU H H 1 8.246 0.008 A 99 GLU HA H 1 4.000 0.008 A 99 GLU HBy H 1 1.924 0.008 A 99 GLU HBx H 1 1.845 0.008 A 99 GLU HGx H 1 2.164 0.008 A 99 GLU HGy H 1 2.164 0.008 A 99 GLU C C 13 174.603 0.19 A 99 GLU CA C 13 55.456 0.19 A 99 GLU CB C 13 27.169 0.19 A 99 GLU CG C 13 33.491 0.19 A 99 GLU N N 15 121.782 0.14 A 100 ALA H H 1 8.153 0.008 A 100 ALA HA H 1 4.087 0.008 A 100 ALA HB% H 1 1.326 0.008 A 100 ALA C C 13 176.512 0.19 A 100 ALA CA C 13 51.065 0.19 A 100 ALA CB C 13 15.853 0.19 A 100 ALA N N 15 122.759 0.14 A 101 LYS H H 1 7.853 0.008 A 101 LYS HA H 1 4.079 0.008 A 101 LYS HBx H 1 1.761 0.008 A 101 LYS HDx H 1 1.578 0.008 A 101 LYS HDy H 1 1.578 0.008 A 101 LYS HEx H 1 2.856 0.008 A 101 LYS HEy H 1 2.856 0.008 A 101 LYS HGy H 1 1.387 0.008 A 101 LYS HGx H 1 1.319 0.008 A 101 LYS C C 13 175.072 0.19 A 101 LYS CA C 13 54.990 0.19 A 101 LYS CB C 13 29.950 0.19 A 101 LYS CD C 13 26.435 0.19 A 101 LYS CE C 13 39.252 0.19 A 101 LYS CG C 13 22.049 0.19 A 101 LYS N N 15 119.630 0.14 A 102 ILE H H 1 7.785 0.008 A 102 ILE HA H 1 3.829 0.008 A 102 ILE HB H 1 1.788 0.008 A 102 ILE HD1% H 1 0.723 0.008 A 102 ILE HG1y H 1 1.435 0.008 A 102 ILE HG1x H 1 1.097 0.008 A 102 ILE HG2% H 1 0.801 0.008 A 102 ILE C C 13 174.528 0.19 A 102 ILE CA C 13 59.816 0.19 A 102 ILE CB C 13 35.437 0.19 A 102 ILE CD1 C 13 10.012 0.19 A 102 ILE CG1 C 13 25.410 0.19 A 102 ILE CG2 C 13 14.743 0.19 A 102 ILE N N 15 120.413 0.14 A 103 LYS H H 1 8.062 0.008 A 103 LYS HA H 1 4.005 0.008 A 103 LYS HBx H 1 1.714 0.008 A 103 LYS HDx H 1 1.571 0.008 A 103 LYS HDy H 1 1.571 0.008 A 103 LYS HEx H 1 2.872 0.008 A 103 LYS HEy H 1 2.872 0.008 A 103 LYS HGy H 1 1.399 0.008 A 103 LYS HGx H 1 1.299 0.008 A 103 LYS C C 13 174.678 0.19 A 103 LYS CA C 13 55.352 0.19 A 103 LYS CB C 13 30.015 0.19 A 103 LYS CD C 13 26.434 0.19 A 103 LYS CE C 13 39.361 0.19 A 103 LYS CG C 13 22.311 0.19 A 103 LYS N N 15 122.617 0.14 A 104 ALA H H 1 7.860 0.008 A 104 ALA HA H 1 4.125 0.008 A 104 ALA HB% H 1 1.319 0.008 A 104 ALA C C 13 176.144 0.19 A 104 ALA CA C 13 50.643 0.19 A 104 ALA CB C 13 15.999 0.19 A 104 ALA N N 15 122.308 0.14 A 105 LEU H H 1 7.816 0.008 A 105 LEU HA H 1 4.117 0.008 A 105 LEU HBy H 1 1.633 0.008 A 105 LEU HDx% H 1 0.766 0.008 A 105 LEU HDy% H 1 0.804 0.008 A 105 LEU HG H 1 1.450 0.008 A 105 LEU C C 13 175.641 0.19 A 105 LEU CA C 13 53.619 0.19 A 105 LEU CB C 13 39.397 0.19 A 105 LEU CDx C 13 20.958 0.19 A 105 LEU CDy C 13 22.199 0.19 A 105 LEU N N 15 119.827 0.14 A 106 LEU H H 1 7.925 0.008 A 106 LEU HA H 1 4.127 0.008 A 106 LEU HBy H 1 1.642 0.008 A 106 LEU HBx H 1 1.470 0.008 A 106 LEU HDx% H 1 0.788 0.008 A 106 LEU HDy% H 1 0.733 0.008 A 106 LEU C C 13 175.394 0.19 A 106 LEU CA C 13 53.068 0.19 A 106 LEU CB C 13 39.456 0.19 A 106 LEU CDy C 13 22.348 0.19 A 106 LEU CDx C 13 20.668 0.19 A 106 LEU N N 15 120.985 0.14 A 107 GLU H H 1 7.997 0.008 A 107 GLU HA H 1 4.114 0.008 A 107 GLU HBx H 1 1.910 0.008 A 107 GLU HGx H 1 2.137 0.008 A 107 GLU HGy H 1 2.137 0.008 A 107 GLU C C 13 174.156 0.19 A 107 GLU CA C 13 54.401 0.19 A 107 GLU CB C 13 27.384 0.19 A 107 GLU CG C 13 33.595 0.19 A 107 GLU N N 15 120.039 0.14 A 108 ARG H H 1 8.012 0.008 A 108 ARG HA H 1 4.270 0.008 A 108 ARG HBx H 1 1.746 0.008 A 108 ARG HBy H 1 1.814 0.008 A 108 ARG HDx H 1 3.069 0.008 A 108 ARG HDy H 1 3.069 0.008 A 108 ARG HGx H 1 1.537 0.008 A 108 ARG HGy H 1 1.537 0.008 A 108 ARG C C 13 173.932 0.19 A 108 ARG CA C 13 53.796 0.19 A 108 ARG CB C 13 27.912 0.19 A 108 ARG CD C 13 40.689 0.19 A 108 ARG CG C 13 24.477 0.19 A 108 ARG N N 15 120.451 0.14 A 109 THR H H 1 8.031 0.008 A 109 THR HA H 1 4.219 0.008 A 109 THR HB H 1 4.718 0.008 A 109 THR HG2% H 1 1.109 0.008 A 109 THR C C 13 172.444 0.19 A 109 THR CA C 13 59.528 0.19 A 109 THR CB C 13 67.153 0.19 A 109 THR CG2 C 13 18.990 0.19 A 109 THR N N 15 113.983 0.14 A 110 GLY H H 1 8.266 0.008 A 110 GLY HAx H 1 3.789 0.008 A 110 GLY HAy H 1 3.856 0.008 A 110 GLY C C 13 171.048 0.19 A 110 GLY CA C 13 42.655 0.19 A 110 GLY N N 15 110.753 0.14 A 111 TYR H H 1 7.917 0.008 A 111 TYR HA H 1 4.518 0.008 A 111 TYR HBx H 1 2.843 0.008 A 111 TYR HBy H 1 2.938 0.008 A 111 TYR HDx H 1 6.983 0.008 A 111 TYR HDy H 1 6.983 0.008 A 111 TYR HEx H 1 6.709 0.008 A 111 TYR HEy H 1 6.709 0.008 A 111 TYR C C 13 172.988 0.19 A 111 TYR CA C 13 55.044 0.19 A 111 TYR CB C 13 36.322 0.19 A 111 TYR CDx C 13 130.316 0.19 A 111 TYR CEx C 13 115.394 0.19 A 111 TYR N N 15 119.890 0.14 A 112 THR H H 1 7.949 0.008 A 112 THR HA H 1 4.280 0.008 A 112 THR HB H 1 4.036 0.008 A 112 THR HG2% H 1 1.046 0.008 A 112 THR C C 13 171.094 0.19 A 112 THR CA C 13 58.848 0.19 A 112 THR CB C 13 67.027 0.19 A 112 THR CG2 C 13 18.766 0.19 A 112 THR N N 15 116.266 0.14 A 113 LEU H H 1 8.061 0.008 A 113 LEU HA H 1 4.217 0.008 A 113 LEU HBx H 1 1.489 0.008 A 113 LEU HDy% H 1 1.489 0.008 A 113 LEU C C 13 173.966 0.19 A 113 LEU CA C 13 52.275 0.19 A 113 LEU CB C 13 39.716 0.19 A 113 LEU CDy C 13 24.338 0.19 A 113 LEU N N 15 124.493 0.14 A 114 ASP H H 1 8.241 0.008 A 114 ASP HA H 1 4.488 0.008 A 114 ASP HBx H 1 2.468 0.008 A 114 ASP HBy H 1 2.624 0.008 A 114 ASP C C 13 173.377 0.19 A 114 ASP CA C 13 51.687 0.19 A 114 ASP CB C 13 38.364 0.19 A 114 ASP N N 15 121.752 0.14 A 115 VAL H H 1 7.999 0.008 A 115 VAL HA H 1 4.130 0.008 A 115 VAL HB H 1 2.047 0.008 A 115 VAL HGy% H 1 0.821 0.008 A 115 VAL C C 13 173.767 0.19 A 115 VAL CA C 13 59.217 0.19 A 115 VAL CB C 13 29.974 0.19 A 115 VAL CGx C 13 16.614 0.19 A 115 VAL CGy C 13 17.398 0.19 A 115 VAL N N 15 119.841 0.14 A 116 THR H H 1 8.274 0.008 A 116 THR HA H 1 4.339 0.008 A 116 THR HB H 1 4.097 0.008 A 116 THR HG2% H 1 1.107 0.008 A 116 THR C C 13 172.083 0.19 A 116 THR CA C 13 59.028 0.19 A 116 THR CB C 13 67.157 0.19 A 116 THR CG2 C 13 18.916 0.19 A 116 THR N N 15 117.476 0.14 A 117 THR H H 1 8.017 0.008 A 117 THR HB H 1 4.197 0.008 A 117 THR C C 13 171.438 0.19 A 117 THR CA C 13 50.252 0.19 A 117 THR CB C 13 67.022 0.19 A 117 THR CG2 C 13 20.353 0.19 A 117 THR N N 15 115.649 0.14 A 118 GLY H H 1 7.911 0.008 A 118 GLY HAx H 1 3.673 0.008 A 118 GLY HAy H 1 3.673 0.008 A 118 GLY CA C 13 43.478 0.19 A 118 GLY N N 15 117.228 0.14 stop_ save_ save_DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-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 46 PHE HBy A 50 GLY HAy 1.0 . 4.42 2 2 A 50 GLY HAy A 53 ALA H 1.0 . 4.46 3 3 A 50 GLY HAy A 80 TYR HE% 1.0 . 4.83 4 4 A 75 GLY HAx A 78 LYS HBx 1.0 . 4.03 5 4 A 75 GLY HAx A 78 LYS HBy 1.0 . 4.03 6 5 A 75 GLY HAx A 74 CYS H 1.0 . 5.50 7 6 A 46 PHE HD% A 50 GLY HAx 1.0 . 4.43 8 7 A 80 TYR HE% A 50 GLY HAx 1.0 . 4.83 9 8 A 25 TYR HA A 28 GLY HAy 1.0 . 5.36 10 9 A 27 ALA HB% A 28 GLY HAx 1.0 . 5.22 11 10 A 28 GLY HAy A 27 ALA HB% 1.0 . 5.22 12 11 A 86 GLN HBy A 87 GLY HAx 1.0 . 5.26 13 11 A 87 GLY HAy A 86 GLN HBx 1.0 . 5.26 14 11 A 86 GLN HBy A 87 GLY HAy 1.0 . 5.26 15 11 A 86 GLN HBx A 87 GLY HAx 1.0 . 5.26 16 12 A 88 THR HG2% A 87 GLY HAx 1.0 . 5.50 17 12 A 87 GLY HAy A 88 THR HG2% 1.0 . 5.50 18 13 A 110 GLY HAx A 111 TYR HD% 1.0 . 5.29 19 14 A 11 ALA H A 12 GLY HAy 1.0 . 5.46 20 15 A 12 GLY HAy A 44 LYS HDx 1.0 . 4.62 21 15 A 12 GLY HAy A 44 LYS HDy 1.0 . 4.62 22 16 A 12 GLY HAy A 11 ALA HB% 1.0 . 5.37 23 17 A 11 ALA HB% A 12 GLY HAx 1.0 . 5.50 24 18 A 12 GLY HAx A 44 LYS HDx 1.0 . 5.06 25 18 A 44 LYS HDy A 12 GLY HAx 1.0 . 5.06 26 19 A 96 GLY HAx A 97 PRO HDx 1.0 . 3.22 27 19 A 96 GLY HAx A 97 PRO HDy 1.0 . 3.22 28 20 A 96 GLY HAx A 97 PRO HGx 1.0 . 4.92 29 21 A 1 GLY HAx A 2 SER HA 1.0 . 5.32 30 22 A 108 ARG H A 108 ARG HDx 1.0 . 4.98 31 22 A 108 ARG H A 108 ARG HDy 1.0 . 4.98 32 23 A 108 ARG HA A 108 ARG HDx 1.0 . 5.14 33 23 A 108 ARG HDy A 108 ARG HA 1.0 . 5.14 34 24 A 108 ARG HBx A 108 ARG HDx 1.0 . 3.36 35 24 A 108 ARG HDy A 108 ARG HBx 1.0 . 3.36 36 25 A 83 ARG H A 83 ARG HDx 1.0 . 4.82 37 25 A 83 ARG H A 83 ARG HDy 1.0 . 4.82 38 26 A 83 ARG HA A 83 ARG HDx 1.0 . 4.37 39 26 A 83 ARG HDy A 83 ARG HA 1.0 . 4.37 40 27 A 1 GLY HAx A 26 VAL HGy% 1.0 . 5.14 41 28 A 81 ARG H A 81 ARG HDy 1.0 . 4.83 42 29 A 81 ARG HDy A 81 ARG HBx 1.0 . 3.30 43 30 A 80 TYR HD% A 83 ARG HDx 1.0 . 5.50 44 30 A 83 ARG HDy A 80 TYR HD% 1.0 . 5.50 45 31 A 63 LEU HA A 69 LYS HEx 1.0 . 4.97 46 31 A 63 LEU HA A 69 LYS HEy 1.0 . 4.97 47 32 A 69 LYS HGx A 69 LYS HEx 1.0 . 4.16 48 32 A 69 LYS HEy A 69 LYS HGx 1.0 . 4.16 49 33 A 63 LEU HBx A 69 LYS HEx 1.0 . 4.03 50 33 A 69 LYS HEy A 63 LEU HBx 1.0 . 4.03 51 34 A 66 VAL HGx% A 69 LYS HEx 1.0 . 5.50 52 34 A 69 LYS HEy A 66 VAL HGx% 1.0 . 5.50 53 35 A 29 LEU HBy A 63 LEU HDx% 1.0 . 4.90 54 36 A 29 LEU HBy A 29 LEU H 1.0 . 3.46 55 37 A 29 LEU HBy A 29 LEU HDy% 1.0 . 3.34 56 38 A 29 LEU H A 29 LEU HBx 1.0 . 3.75 57 39 A 29 LEU HBx A 24 ILE HA 1.0 . 5.14 58 40 A 29 LEU HBx A 24 ILE HG2% 1.0 . 3.62 59 41 A 63 LEU HDx% A 29 LEU HBx 1.0 . 4.49 60 42 A 113 LEU H A 113 LEU HBx 1.0 . 3.47 61 43 A 34 ASP HBy A 35 LEU H 1.0 . 4.33 62 44 A 34 ASP HBy A 31 ALA H 1.0 . 4.00 63 45 A 34 ASP HBy A 30 VAL HGx% 1.0 . 4.54 64 46 A 34 ASP HBy A 30 VAL HGy% 1.0 . 4.50 65 47 A 31 ALA H A 34 ASP HBx 1.0 . 4.37 66 48 A 34 ASP HBx A 30 VAL HB 1.0 . 4.20 67 49 A 30 VAL HGy% A 34 ASP HBx 1.0 . 4.80 68 50 A 34 ASP HBx A 69 LYS HBx 1.0 . 3.92 69 51 A 30 VAL HGx% A 34 ASP HBx 1.0 . 4.81 70 52 A 43 LEU H A 43 LEU HBy 1.0 . 3.16 71 53 A 43 LEU HBy A 40 ILE HA 1.0 . 4.12 72 54 A 43 LEU HBy A 43 LEU HDy% 1.0 . 3.62 73 55 A 43 LEU HBy A 77 MET HE% 1.0 . 4.53 74 56 A 40 ILE HA A 43 LEU HBx 1.0 . 3.87 75 57 A 77 MET HE% A 43 LEU HBx 1.0 . 4.96 76 58 A 43 LEU HDy% A 43 LEU HBx 1.0 . 3.48 77 59 A 113 LEU HBx A 114 ASP H 1.0 . 4.28 78 60 A 106 LEU HBx A 106 LEU HDx% 1.0 . 3.60 79 61 A 34 ASP HBy A 31 ALA HB% 1.0 . 4.96 80 62 A 102 ILE HA A 105 LEU HBy 1.0 . 4.38 81 63 A 36 ASP HBy A 37 GLU H 1.0 . 3.36 82 64 A 36 ASP HBy A 36 ASP H 1.0 . 3.77 83 65 A 20 LYS H A 20 LYS HEx 1.0 . 4.96 84 66 A 103 LYS HGx A 103 LYS HEx 1.0 . 3.39 85 66 A 103 LYS HGx A 103 LYS HEy 1.0 . 3.39 86 67 A 5 PHE HD% A 22 ASP HBy 1.0 . 4.34 87 68 A 22 ASP HBy A 8 LEU HDy% 1.0 . 4.49 88 69 A 22 ASP HBy A 23 GLU H 1.0 . 3.96 89 70 A 23 GLU H A 22 ASP HBx 1.0 . 3.98 90 71 A 22 ASP HBx A 23 GLU HA 1.0 . 4.28 91 72 A 37 GLU H A 36 ASP HBx 1.0 . 3.60 92 73 A 36 ASP H A 36 ASP HBx 1.0 . 3.67 93 74 A 106 LEU HBx A 106 LEU HDy% 1.0 . 3.76 94 75 A 106 LEU HBx A 106 LEU H 1.0 . 3.72 95 76 A 75 GLY HAx A 78 LYS HEx 1.0 . 4.29 96 76 A 75 GLY HAx A 78 LYS HEy 1.0 . 4.29 97 77 A 14 PRO HA A 16 LYS HEx 1.0 . 5.50 98 77 A 14 PRO HA A 16 LYS HEy 1.0 . 5.50 99 78 A 78 LYS HBx A 78 LYS HEx 1.0 . 3.54 100 78 A 78 LYS HEy A 78 LYS HBx 1.0 . 3.54 101 78 A 78 LYS HBy A 78 LYS HEy 1.0 . 3.54 102 78 A 78 LYS HBy A 78 LYS HEx 1.0 . 3.54 103 79 A 59 LYS H A 59 LYS HEx 1.0 . 5.18 104 79 A 59 LYS H A 59 LYS HEy 1.0 . 5.18 105 80 A 56 GLN HE2y A 59 LYS HEx 1.0 . 5.43 106 80 A 59 LYS HEy A 56 GLN HE2y 1.0 . 5.43 107 81 A 59 LYS HDy A 59 LYS HEx 1.0 . 2.90 108 81 A 59 LYS HEy A 59 LYS HDy 1.0 . 2.90 109 82 A 22 ASP HBy A 21 LEU H 1.0 . 5.32 110 83 A 36 ASP HBx A 39 ALA HB% 1.0 . 5.47 111 84 A 8 LEU H A 8 LEU HBy 1.0 . 3.61 112 85 A 62 ASP HA A 63 LEU HBy 1.0 . 5.14 113 86 A 63 LEU HBx A 63 LEU H 1.0 . 4.10 114 87 A 63 LEU HBx A 63 LEU HDx% 1.0 . 3.89 115 88 A 63 LEU HBx A 63 LEU HDy% 1.0 . 4.01 116 89 A 20 LYS HEx A 20 LYS HA 1.0 . 3.86 117 90 A 20 LYS HEx A 52 LEU HDx% 1.0 . 4.17 118 91 A 56 GLN HE2x A 59 LYS HEx 1.0 . 4.81 119 91 A 59 LYS HEy A 56 GLN HE2x 1.0 . 4.81 120 92 A 59 LYS HGx A 59 LYS HEx 1.0 . 3.79 121 92 A 59 LYS HEy A 59 LYS HGx 1.0 . 3.79 122 93 A 24 ILE HD1% A 59 LYS HEx 1.0 . 3.99 123 93 A 59 LYS HEy A 24 ILE HD1% 1.0 . 3.99 124 94 A 8 LEU HBy A 17 VAL HGy% 1.0 . 3.85 125 95 A 8 LEU HBy A 9 LEU HDx% 1.0 . 5.50 126 96 A 63 LEU HBy A 69 LYS HEx 1.0 . 4.54 127 96 A 69 LYS HEy A 63 LEU HBy 1.0 . 4.54 128 97 A 55 LEU HBx A 55 LEU HDy% 1.0 . 3.64 129 98 A 55 LEU H A 55 LEU HBy 1.0 . 3.87 130 99 A 55 LEU HDy% A 55 LEU HBy 1.0 . 3.50 131 100 A 55 LEU HBx A 55 LEU HDx% 1.0 . 4.13 132 101 A 21 LEU H A 21 LEU HBy 1.0 . 3.46 133 102 A 13 LEU H A 13 LEU HBy 1.0 . 3.66 134 103 A 13 LEU HBy A 14 PRO HDy 1.0 . 4.71 135 104 A 13 LEU HBy A 18 ALA H 1.0 . 4.80 136 105 A 18 ALA H A 13 LEU HBx 1.0 . 4.62 137 106 A 14 PRO HDy A 13 LEU HBx 1.0 . 4.36 138 107 A 13 LEU HBx A 14 PRO HDx 1.0 . 4.23 139 108 A 46 PHE HBy A 51 ALA H 1.0 . 4.06 140 109 A 46 PHE HBy A 51 ALA HB% 1.0 . 4.09 141 110 A 46 PHE HBy A 43 LEU HDy% 1.0 . 5.50 142 111 A 46 PHE HBx A 47 ASN H 1.0 . 4.38 143 112 A 51 ALA HB% A 46 PHE HBx 1.0 . 4.07 144 113 A 114 ASP H A 114 ASP HBy 1.0 . 3.76 145 114 A 9 LEU H A 9 LEU HBy 1.0 . 3.55 146 115 A 9 LEU HDx% A 9 LEU HBy 1.0 . 3.72 147 116 A 8 LEU HDy% A 21 LEU HBy 1.0 . 4.25 148 117 A 21 LEU HBy A 21 LEU HDy% 1.0 . 3.64 149 117 A 21 LEU HBy A 21 LEU HDx% 1.0 . 3.64 150 118 A 9 LEU H A 9 LEU HBx 1.0 . 3.83 151 119 A 98 ASP H A 98 ASP HBy 1.0 . 3.83 152 120 A 114 ASP HBy A 115 VAL H 1.0 . 5.22 153 121 A 92 ASP HBx A 93 SER H 1.0 . 3.84 154 122 A 115 VAL H A 114 ASP HBx 1.0 . 5.27 155 123 A 13 LEU HBy A 13 LEU HDy% 1.0 . 3.43 156 124 A 59 LYS H A 60 ASP HBy 1.0 . 5.39 157 125 A 60 ASP HBy A 60 ASP H 1.0 . 3.56 158 126 A 60 ASP HBy A 57 GLN HA 1.0 . 4.15 159 127 A 57 GLN HA A 60 ASP HBx 1.0 . 3.94 160 128 A 52 LEU H A 52 LEU HBx 1.0 . 3.71 161 129 A 53 ALA H A 52 LEU HBx 1.0 . 4.19 162 130 A 52 LEU HBx A 49 ASP HA 1.0 . 4.90 163 131 A 49 ASP H A 49 ASP HBy 1.0 . 3.13 164 132 A 49 ASP HBy A 47 ASN HD2x 1.0 . 5.29 165 133 A 50 GLY HAx A 49 ASP HBx 1.0 . 5.50 166 134 A 49 ASP HBx A 52 LEU HBy 1.0 . 5.49 167 135 A 49 ASP HBx A 53 ALA HB% 1.0 . 5.50 168 136 A 49 ASP HBx A 52 LEU HDy% 1.0 . 5.50 169 137 A 58 PHE HE% A 73 LEU HBy 1.0 . 5.02 170 138 A 72 PHE H A 73 LEU HBx 1.0 . 4.99 171 139 A 58 PHE HE% A 73 LEU HBx 1.0 . 4.66 172 140 A 73 LEU HBx A 73 LEU HDy% 1.0 . 4.24 173 141 A 58 PHE HBy A 76 VAL HGy% 1.0 . 5.36 174 142 A 58 PHE HBy A 54 VAL HGx% 1.0 . 5.50 175 143 A 73 LEU HBy A 72 PHE HBx 1.0 . 5.03 176 143 A 73 LEU HBy A 72 PHE HBy 1.0 . 5.03 177 144 A 71 ALA HB% A 72 PHE HBx 1.0 . 5.42 178 144 A 72 PHE HBy A 71 ALA HB% 1.0 . 5.42 179 145 A 63 LEU HDy% A 72 PHE HBx 1.0 . 5.50 180 145 A 63 LEU HDy% A 72 PHE HBy 1.0 . 5.50 181 146 A 58 PHE H A 58 PHE HBx 1.0 . 3.36 182 147 A 58 PHE HBx A 55 LEU HA 1.0 . 3.95 183 148 A 58 PHE HBx A 76 VAL HB 1.0 . 5.22 184 149 A 58 PHE HBx A 76 VAL HGx% 1.0 . 4.67 185 150 A 54 VAL HGx% A 58 PHE HBx 1.0 . 5.50 186 151 A 73 LEU HDy% A 58 PHE HBx 1.0 . 4.30 187 152 A 49 ASP HBx A 48 GLU HGx 1.0 . 5.40 188 152 A 49 ASP HBx A 48 GLU HGy 1.0 . 5.40 189 153 A 49 ASP HBy A 53 ALA HB% 1.0 . 5.50 190 154 A 10 ASP H A 10 ASP HBx 1.0 . 3.50 191 155 A 11 ALA H A 10 ASP HBx 1.0 . 4.45 192 156 A 10 ASP HBx A 7 THR HA 1.0 . 3.72 193 157 A 7 THR HG2% A 4 ASN HBx 1.0 . 5.50 194 157 A 4 ASN HBy A 7 THR HG2% 1.0 . 5.50 195 158 A 8 LEU HDy% A 4 ASN HBx 1.0 . 5.02 196 158 A 8 LEU HDy% A 4 ASN HBy 1.0 . 5.02 197 159 A 7 THR HB A 4 ASN HBx 1.0 . 4.97 198 159 A 4 ASN HBy A 7 THR HB 1.0 . 4.97 199 160 A 22 ASP HBy A 5 PHE HBy 1.0 . 4.73 200 161 A 111 TYR H A 111 TYR HBy 1.0 . 3.74 201 162 A 63 LEU H A 62 ASP HBy 1.0 . 4.72 202 163 A 54 VAL HGx% A 80 TYR HBy 1.0 . 4.96 203 164 A 5 PHE HBx A 6 GLN HBx 1.0 . 5.15 204 165 A 76 VAL HGx% A 80 TYR HBy 1.0 . 5.18 205 166 A 80 TYR HBy A 77 MET HA 1.0 . 4.22 206 167 A 54 VAL HGy% A 80 TYR HBx 1.0 . 4.28 207 168 A 111 TYR H A 111 TYR HBx 1.0 . 3.94 208 169 A 102 ILE HB A 103 LYS H 1.0 . 3.78 209 170 A 47 ASN H A 47 ASN HBy 1.0 . 4.03 210 171 A 49 ASP H A 47 ASN HBy 1.0 . 4.47 211 172 A 47 ASN HBy A 47 ASN HD2y 1.0 . 4.03 212 173 A 49 ASP H A 47 ASN HBx 1.0 . 4.59 213 174 A 47 ASN HBx A 48 GLU HBy 1.0 . 5.42 214 175 A 47 ASN HBx A 48 GLU H 1.0 . 3.52 215 176 A 68 ASN HBx A 71 ALA H 1.0 . 4.55 216 177 A 71 ALA H A 68 ASN HBy 1.0 . 4.69 217 178 A 68 ASN HBx A 69 LYS H 1.0 . 5.17 218 179 A 23 GLU H A 24 ILE HB 1.0 . 5.34 219 180 A 24 ILE HB A 25 TYR HD% 1.0 . 5.37 220 181 A 24 ILE HB A 21 LEU HDy% 1.0 . 4.14 221 181 A 21 LEU HDx% A 24 ILE HB 1.0 . 4.14 222 182 A 49 ASP H A 48 GLU HGx 1.0 . 3.86 223 182 A 49 ASP H A 48 GLU HGy 1.0 . 3.86 224 183 A 24 ILE HG2% A 25 TYR HBy 1.0 . 5.50 225 184 A 30 VAL HGy% A 25 TYR HBy 1.0 . 5.50 226 185 A 9 LEU HDx% A 19 GLU HGx 1.0 . 5.50 227 186 A 19 GLU H A 19 GLU HGy 1.0 . 3.49 228 187 A 20 LYS H A 19 GLU HGy 1.0 . 4.86 229 188 A 19 GLU HGy A 5 PHE HE% 1.0 . 3.95 230 189 A 19 GLU HGy A 19 GLU HA 1.0 . 3.83 231 190 A 19 GLU HGy A 18 ALA HB% 1.0 . 5.30 232 191 A 19 GLU HGy A 15 GLN HE2y 1.0 . 4.77 233 192 A 19 GLU HGy A 15 GLN HA 1.0 . 5.37 234 193 A 19 GLU HGx A 19 GLU H 1.0 . 3.82 235 194 A 19 GLU HGx A 5 PHE HE% 1.0 . 4.22 236 195 A 19 GLU HGx A 19 GLU HA 1.0 . 3.59 237 196 A 23 GLU HGy A 24 ILE H 1.0 . 5.50 238 197 A 24 ILE HA A 23 GLU HGx 1.0 . 5.50 239 198 A 23 GLU H A 23 GLU HGy 1.0 . 3.85 240 199 A 45 GLU H A 45 GLU HGx 1.0 . 3.80 241 200 A 24 ILE H A 23 GLU HGx 1.0 . 5.09 242 201 A 40 ILE HB A 41 GLU H 1.0 . 3.44 243 202 A 40 ILE HB A 40 ILE H 1.0 . 3.13 244 203 A 40 ILE HB A 37 GLU HA 1.0 . 3.48 245 204 A 45 GLU H A 45 GLU HGy 1.0 . 3.59 246 205 A 80 TYR HD% A 84 GLU HGy 1.0 . 5.50 247 206 A 84 GLU HGy A 84 GLU H 1.0 . 3.88 248 207 A 80 TYR HE% A 84 GLU HGy 1.0 . 5.50 249 208 A 84 GLU HA A 84 GLU HGx 1.0 . 3.78 250 209 A 80 TYR HE% A 84 GLU HGx 1.0 . 5.50 251 210 A 38 ARG H A 37 GLU HGx 1.0 . 4.26 252 210 A 37 GLU HGy A 38 ARG H 1.0 . 4.26 253 211 A 41 GLU H A 41 GLU HGx 1.0 . 3.74 254 211 A 41 GLU H A 41 GLU HGy 1.0 . 3.74 255 212 A 41 GLU HA A 41 GLU HGx 1.0 . 3.55 256 212 A 41 GLU HGy A 41 GLU HA 1.0 . 3.55 257 213 A 37 GLU HBy A 37 GLU HGx 1.0 . 2.59 258 213 A 37 GLU HBx A 37 GLU HGx 1.0 . 2.59 259 213 A 37 GLU HGy A 37 GLU HBx 1.0 . 2.59 260 213 A 37 GLU HGy A 37 GLU HBy 1.0 . 2.59 261 214 A 40 ILE HG1y A 37 GLU HGx 1.0 . 5.27 262 214 A 37 GLU HGy A 40 ILE HG1y 1.0 . 5.27 263 215 A 40 ILE HG2% A 41 GLU HGx 1.0 . 5.34 264 215 A 41 GLU HGy A 40 ILE HG2% 1.0 . 5.34 265 216 A 37 GLU HGy A 38 ARG HGx 1.0 . 5.33 266 216 A 37 GLU HGx A 38 ARG HGx 1.0 . 5.33 267 216 A 38 ARG HGy A 37 GLU HGx 1.0 . 5.33 268 216 A 37 GLU HGy A 38 ARG HGy 1.0 . 5.33 269 217 A 37 GLU H A 37 GLU HGx 1.0 . 4.05 270 217 A 37 GLU H A 37 GLU HGy 1.0 . 4.05 271 218 A 99 GLU H A 99 GLU HGx 1.0 . 4.85 272 218 A 99 GLU H A 99 GLU HGy 1.0 . 4.85 273 219 A 84 GLU H A 84 GLU HGx 1.0 . 3.88 274 220 A 31 ALA H A 30 VAL HB 1.0 . 3.48 275 221 A 34 ASP HBy A 30 VAL HB 1.0 . 3.91 276 222 A 30 VAL HB A 30 VAL H 1.0 . 3.85 277 223 A 77 MET H A 77 MET HBy 1.0 . 3.62 278 224 A 77 MET HBy A 74 CYS HA 1.0 . 4.70 279 225 A 77 MET HBy A 73 LEU HG 1.0 . 5.00 280 226 A 77 MET H A 77 MET HBx 1.0 . 4.02 281 227 A 54 VAL HGx% A 77 MET HBx 1.0 . 4.11 282 228 A 77 MET HBy A 81 ARG HE 1.0 . 4.95 283 229 A 83 ARG H A 82 GLN HGy 1.0 . 3.75 284 230 A 57 GLN HA A 57 GLN HGy 1.0 . 3.57 285 231 A 67 GLN HA A 67 GLN HGx 1.0 . 3.49 286 231 A 67 GLN HA A 67 GLN HGy 1.0 . 3.49 287 232 A 82 GLN HA A 82 GLN HGx 1.0 . 3.63 288 233 A 82 GLN HGx A 82 GLN H 1.0 . 3.83 289 234 A 54 VAL HGx% A 77 MET HGx 1.0 . 5.50 290 235 A 58 PHE H A 57 GLN HGy 1.0 . 5.09 291 236 A 57 GLN HGy A 54 VAL HA 1.0 . 5.33 292 237 A 77 MET H A 77 MET HGy 1.0 . 3.82 293 238 A 81 ARG HE A 77 MET HGy 1.0 . 5.49 294 239 A 67 GLN HBy A 67 GLN HGx 1.0 . 2.82 295 239 A 67 GLN HGy A 67 GLN HBy 1.0 . 2.82 296 240 A 58 PHE H A 57 GLN HGx 1.0 . 4.91 297 241 A 76 VAL HGx% A 57 GLN HGx 1.0 . 4.77 298 242 A 54 VAL HA A 57 GLN HGx 1.0 . 5.50 299 243 A 76 VAL HGy% A 57 GLN HGx 1.0 . 5.39 300 244 A 81 ARG HE A 77 MET HGx 1.0 . 4.25 301 245 A 74 CYS HA A 77 MET HGx 1.0 . 4.55 302 246 A 77 MET HA A 77 MET HGx 1.0 . 4.17 303 247 A 77 MET HGx A 42 ALA HB% 1.0 . 5.50 304 248 A 6 GLN HE2y A 6 GLN HGx 1.0 . 3.28 305 248 A 6 GLN HGy A 6 GLN HE2y 1.0 . 3.28 306 249 A 69 LYS HBx A 58 PHE HE% 1.0 . 5.10 307 250 A 69 LYS HBx A 35 LEU HDx% 1.0 . 4.40 308 251 A 63 LEU HDx% A 69 LYS HBx 1.0 . 5.50 309 252 A 95 LYS H A 95 LYS HBy 1.0 . 3.94 310 253 A 56 GLN HE2y A 56 GLN HGx 1.0 . 3.61 311 253 A 56 GLN HE2y A 56 GLN HGy 1.0 . 3.61 312 254 A 89 LYS H A 89 LYS HBy 1.0 . 3.96 313 255 A 15 GLN H A 15 GLN HGy 1.0 . 4.40 314 256 A 19 GLU H A 15 GLN HGy 1.0 . 5.50 315 257 A 15 GLN HA A 15 GLN HGy 1.0 . 3.69 316 258 A 16 LYS H A 15 GLN HGy 1.0 . 4.43 317 259 A 15 GLN HE2y A 15 GLN HGy 1.0 . 4.05 318 260 A 5 PHE HE% A 15 GLN HGy 1.0 . 4.21 319 261 A 16 LYS HA A 15 GLN HGy 1.0 . 4.52 320 262 A 9 LEU HDy% A 15 GLN HGy 1.0 . 4.53 321 263 A 15 GLN HA A 15 GLN HGx 1.0 . 3.61 322 264 A 90 VAL HB A 91 ALA H 1.0 . 4.35 323 265 A 90 VAL HB A 90 VAL H 1.0 . 3.67 324 266 A 16 LYS H A 14 PRO HBy 1.0 . 4.55 325 267 A 15 GLN H A 14 PRO HBy 1.0 . 3.80 326 268 A 14 PRO HBy A 17 VAL H 1.0 . 4.75 327 269 A 14 PRO HBy A 17 VAL HGx% 1.0 . 4.35 328 270 A 9 LEU HDy% A 15 GLN HGx 1.0 . 4.69 329 271 A 16 LYS H A 15 GLN HGx 1.0 . 4.35 330 272 A 45 GLU H A 44 LYS HBy 1.0 . 4.68 331 273 A 40 ILE HG2% A 44 LYS HBy 1.0 . 5.22 332 274 A 101 LYS HA A 101 LYS HBx 1.0 . 3.02 333 275 A 103 LYS H A 103 LYS HBx 1.0 . 3.61 334 276 A 17 VAL HGx% A 14 PRO HBx 1.0 . 4.59 335 277 A 103 LYS HBx A 103 LYS HA 1.0 . 2.95 336 278 A 14 PRO HBx A 16 LYS HEx 1.0 . 5.00 337 278 A 16 LYS HEy A 14 PRO HBx 1.0 . 5.00 338 279 A 44 LYS HBy A 44 LYS H 1.0 . 3.61 339 280 A 78 LYS H A 78 LYS HBx 1.0 . 2.97 340 280 A 78 LYS HBy A 78 LYS H 1.0 . 2.97 341 281 A 44 LYS HBy A 44 LYS HDx 1.0 . 2.86 342 281 A 44 LYS HDy A 44 LYS HBy 1.0 . 2.86 343 282 A 45 GLU H A 44 LYS HBx 1.0 . 4.44 344 283 A 66 VAL H A 66 VAL HB 1.0 . 3.20 345 284 A 66 VAL HB A 72 PHE HD% 1.0 . 5.42 346 285 A 63 LEU HBx A 66 VAL HB 1.0 . 4.98 347 286 A 66 VAL HB A 65 HIS HA 1.0 . 5.50 348 287 A 63 LEU HDy% A 66 VAL HB 1.0 . 4.40 349 288 A 26 VAL H A 26 VAL HB 1.0 . 3.25 350 289 A 26 VAL HB A 25 TYR H 1.0 . 4.85 351 290 A 23 GLU HA A 26 VAL HB 1.0 . 3.44 352 291 A 16 LYS H A 17 VAL HB 1.0 . 5.21 353 292 A 14 PRO HDy A 17 VAL HB 1.0 . 4.48 354 293 A 14 PRO HDx A 17 VAL HB 1.0 . 3.82 355 294 A 17 VAL HB A 13 LEU HA 1.0 . 5.00 356 295 A 76 VAL HB A 76 VAL H 1.0 . 3.20 357 296 A 54 VAL HGx% A 76 VAL HB 1.0 . 4.51 358 297 A 54 VAL H A 54 VAL HB 1.0 . 3.13 359 298 A 77 MET HA A 54 VAL HB 1.0 . 5.21 360 299 A 76 VAL HGx% A 54 VAL HB 1.0 . 4.85 361 300 A 43 LEU HDy% A 54 VAL HB 1.0 . 4.61 362 301 A 76 VAL HA A 79 THR HB 1.0 . 3.96 363 302 A 17 VAL HA A 20 LYS HDx 1.0 . 4.01 364 302 A 17 VAL HA A 20 LYS HDy 1.0 . 4.01 365 303 A 52 LEU HDx% A 20 LYS HDx 1.0 . 3.48 366 303 A 52 LEU HDx% A 20 LYS HDy 1.0 . 3.48 367 304 A 108 ARG H A 108 ARG HBx 1.0 . 3.99 368 305 A 7 THR HB A 8 LEU HDx% 1.0 . 5.50 369 306 A 48 GLU HBy A 47 ASN HA 1.0 . 4.98 370 307 A 49 ASP H A 48 GLU HBy 1.0 . 3.51 371 308 A 81 ARG HDy A 81 ARG HBy 1.0 . 4.02 372 309 A 48 GLU H A 48 GLU HBx 1.0 . 3.54 373 310 A 81 ARG H A 81 ARG HBx 1.0 . 3.47 374 311 A 86 GLN H A 86 GLN HBx 1.0 . 3.33 375 311 A 86 GLN HBy A 86 GLN H 1.0 . 3.33 376 312 A 24 ILE HG1x A 21 LEU HDy% 1.0 . 4.37 377 312 A 21 LEU HDx% A 24 ILE HG1x 1.0 . 4.37 378 313 A 18 ALA H A 19 GLU HBy 1.0 . 5.50 379 314 A 99 GLU HA A 99 GLU HBx 1.0 . 2.93 380 315 A 83 ARG HBy A 83 ARG HDx 1.0 . 3.76 381 315 A 83 ARG HDy A 83 ARG HBx 1.0 . 3.76 382 315 A 83 ARG HDy A 83 ARG HBy 1.0 . 3.76 383 315 A 83 ARG HBx A 83 ARG HDx 1.0 . 3.76 384 316 A 24 ILE HG1x A 21 LEU HA 1.0 . 4.78 385 317 A 24 ILE H A 24 ILE HG1x 1.0 . 4.26 386 318 A 24 ILE HA A 24 ILE HG1x 1.0 . 3.76 387 319 A 24 ILE H A 23 GLU HBy 1.0 . 4.19 388 320 A 23 GLU H A 23 GLU HBy 1.0 . 3.54 389 321 A 20 LYS H A 20 LYS HBx 1.0 . 3.96 390 322 A 24 ILE HG1x A 59 LYS HBx 1.0 . 5.15 391 323 A 24 ILE HG1x A 59 LYS HDx 1.0 . 4.63 392 324 A 23 GLU H A 23 GLU HBx 1.0 . 3.48 393 325 A 24 ILE H A 23 GLU HBx 1.0 . 4.13 394 326 A 41 GLU HA A 44 LYS HDx 1.0 . 4.00 395 326 A 44 LYS HDy A 41 GLU HA 1.0 . 4.00 396 327 A 59 LYS HDy A 24 ILE HD1% 1.0 . 5.13 397 328 A 59 LYS H A 59 LYS HDy 1.0 . 5.34 398 329 A 59 LYS HDx A 56 GLN HA 1.0 . 4.86 399 330 A 59 LYS HDx A 59 LYS HA 1.0 . 4.81 400 331 A 59 LYS HBx A 59 LYS HDx 1.0 . 3.93 401 332 A 59 LYS H A 59 LYS HDx 1.0 . 5.49 402 333 A 56 GLN HE2x A 59 LYS HDx 1.0 . 5.20 403 334 A 24 ILE HD1% A 59 LYS HDx 1.0 . 4.40 404 335 A 31 ALA HB% A 32 HIS HBx 1.0 . 5.19 405 336 A 38 ARG H A 38 ARG HBy 1.0 . 3.35 406 337 A 69 LYS H A 69 LYS HDx 1.0 . 5.21 407 337 A 69 LYS H A 69 LYS HDy 1.0 . 5.21 408 338 A 34 ASP HBx A 69 LYS HDx 1.0 . 5.09 409 338 A 34 ASP HBx A 69 LYS HDy 1.0 . 5.09 410 339 A 66 VAL HGx% A 69 LYS HDx 1.0 . 4.59 411 339 A 66 VAL HGx% A 69 LYS HDy 1.0 . 4.59 412 340 A 56 GLN HE2y A 59 LYS HDx 1.0 . 5.41 413 341 A 25 TYR HE% A 32 HIS HBy 1.0 . 5.15 414 342 A 32 HIS HBx A 25 TYR HE% 1.0 . 5.36 415 343 A 32 HIS HBx A 31 ALA HA 1.0 . 5.47 416 344 A 32 HIS HBx A 32 HIS H 1.0 . 4.19 417 345 A 32 HIS HBx A 33 SER H 1.0 . 4.64 418 346 A 40 ILE HG2% A 41 GLU HBx 1.0 . 5.50 419 346 A 40 ILE HG2% A 41 GLU HBy 1.0 . 5.50 420 347 A 101 LYS H A 101 LYS HDx 1.0 . 4.14 421 347 A 101 LYS H A 101 LYS HDy 1.0 . 4.14 422 348 A 67 GLN HBy A 67 GLN H 1.0 . 4.05 423 349 A 67 GLN HBy A 68 ASN H 1.0 . 4.06 424 350 A 37 GLU H A 37 GLU HBx 1.0 . 3.11 425 350 A 37 GLU H A 37 GLU HBy 1.0 . 3.11 426 351 A 37 GLU HBy A 38 ARG HGx 1.0 . 3.30 427 351 A 38 ARG HGy A 37 GLU HBx 1.0 . 3.30 428 351 A 37 GLU HBy A 38 ARG HGy 1.0 . 3.30 429 351 A 37 GLU HBx A 38 ARG HGx 1.0 . 3.30 430 352 A 38 ARG HBy A 38 ARG HGx 1.0 . 2.50 431 352 A 38 ARG HGy A 38 ARG HBy 1.0 . 2.50 432 353 A 103 LYS H A 103 LYS HDx 1.0 . 4.48 433 353 A 103 LYS H A 103 LYS HDy 1.0 . 4.48 434 354 A 103 LYS HDx A 103 LYS HEx 1.0 . 2.86 435 354 A 103 LYS HEy A 103 LYS HDx 1.0 . 2.86 436 354 A 103 LYS HEy A 103 LYS HDy 1.0 . 2.86 437 354 A 103 LYS HDy A 103 LYS HEx 1.0 . 2.86 438 355 A 101 LYS HBx A 101 LYS HDx 1.0 . 2.40 439 355 A 101 LYS HBx A 101 LYS HDy 1.0 . 2.40 440 356 A 103 LYS HA A 103 LYS HDx 1.0 . 3.74 441 356 A 103 LYS HA A 103 LYS HDy 1.0 . 3.74 442 357 A 16 LYS H A 16 LYS HDx 1.0 . 4.53 443 357 A 16 LYS H A 16 LYS HDy 1.0 . 4.53 444 358 A 52 LEU HDy% A 16 LYS HDx 1.0 . 4.06 445 358 A 52 LEU HDy% A 16 LYS HDy 1.0 . 4.06 446 359 A 82 GLN H A 82 GLN HBx 1.0 . 2.96 447 359 A 82 GLN H A 82 GLN HBy 1.0 . 2.96 448 360 A 79 THR HG2% A 82 GLN HBx 1.0 . 5.24 449 360 A 82 GLN HBy A 79 THR HG2% 1.0 . 5.24 450 361 A 65 HIS HBx A 66 VAL HGy% 1.0 . 5.44 451 362 A 82 GLN HA A 82 GLN HBx 1.0 . 2.96 452 362 A 82 GLN HA A 82 GLN HBy 1.0 . 2.96 453 363 A 40 ILE HG1y A 40 ILE HG2% 1.0 . 3.74 454 364 A 40 ILE H A 40 ILE HG1y 1.0 . 3.64 455 365 A 41 GLU H A 40 ILE HG1x 1.0 . 5.46 456 366 A 40 ILE H A 40 ILE HG1x 1.0 . 3.60 457 367 A 16 LYS H A 15 GLN HBy 1.0 . 3.90 458 368 A 14 PRO HA A 15 GLN HBy 1.0 . 4.78 459 369 A 9 LEU HDy% A 15 GLN HBy 1.0 . 4.64 460 370 A 17 VAL H A 14 PRO HGy 1.0 . 5.12 461 371 A 6 GLN H A 6 GLN HBy 1.0 . 3.52 462 372 A 53 ALA HB% A 56 GLN HBx 1.0 . 5.42 463 373 A 17 VAL H A 14 PRO HGx 1.0 . 4.90 464 374 A 17 VAL HGx% A 14 PRO HGx 1.0 . 4.10 465 375 A 9 LEU HDy% A 15 GLN HBx 1.0 . 5.00 466 376 A 16 LYS H A 15 GLN HBx 1.0 . 3.45 467 377 A 63 LEU HDy% A 69 LYS HGy 1.0 . 5.50 468 378 A 66 VAL HGx% A 69 LYS HGy 1.0 . 5.50 469 379 A 58 PHE H A 56 GLN HBy 1.0 . 5.25 470 380 A 54 VAL HA A 56 GLN HBy 1.0 . 4.95 471 381 A 56 GLN HBx A 56 GLN H 1.0 . 3.64 472 382 A 6 GLN HBx A 3 GLU HA 1.0 . 5.03 473 383 A 69 LYS H A 69 LYS HGy 1.0 . 4.47 474 384 A 69 LYS HGy A 30 VAL HA 1.0 . 5.37 475 385 A 63 LEU HDx% A 69 LYS HGy 1.0 . 5.50 476 386 A 69 LYS HGx A 63 LEU HDy% 1.0 . 5.25 477 387 A 69 LYS HGx A 63 LEU HDx% 1.0 . 5.50 478 388 A 26 VAL HA A 28 GLY H 1.0 . 4.11 479 389 A 24 ILE HA A 24 ILE HG1y 1.0 . 3.59 480 390 A 58 PHE H A 57 GLN HBx 1.0 . 3.75 481 390 A 58 PHE H A 57 GLN HBy 1.0 . 3.75 482 391 A 57 GLN H A 57 GLN HBx 1.0 . 3.43 483 391 A 57 GLN HBy A 57 GLN H 1.0 . 3.43 484 392 A 80 TYR HD% A 81 ARG HGy 1.0 . 5.12 485 393 A 81 ARG H A 81 ARG HGy 1.0 . 3.97 486 394 A 82 GLN H A 81 ARG HGy 1.0 . 5.39 487 395 A 55 LEU HDy% A 21 LEU HBx 1.0 . 3.54 488 396 A 82 GLN H A 79 THR HA 1.0 . 4.36 489 397 A 79 THR HA A 82 GLN HBx 1.0 . 3.58 490 397 A 82 GLN HBy A 79 THR HA 1.0 . 3.58 491 398 A 27 ALA HB% A 24 ILE HA 1.0 . 3.87 492 399 A 81 ARG H A 81 ARG HGx 1.0 . 4.04 493 400 A 82 GLN H A 81 ARG HGx 1.0 . 5.50 494 401 A 81 ARG HGx A 81 ARG HA 1.0 . 3.38 495 402 A 63 LEU HDx% A 29 LEU HG 1.0 . 5.35 496 403 A 24 ILE HA A 29 LEU HG 1.0 . 5.22 497 404 A 20 LYS H A 55 LEU HDy% 1.0 . 4.95 498 405 A 7 THR HA A 10 ASP HBy 1.0 . 3.56 499 406 A 77 MET HA A 54 VAL HA 1.0 . 5.14 500 407 A 54 VAL HA A 57 GLN HBx 1.0 . 4.36 501 407 A 54 VAL HA A 57 GLN HBy 1.0 . 4.36 502 408 A 54 VAL HGy% A 54 VAL HA 1.0 . 3.69 503 409 A 58 PHE H A 54 VAL HA 1.0 . 4.88 504 410 A 29 LEU H A 29 LEU HG 1.0 . 3.47 505 411 A 30 VAL H A 29 LEU HG 1.0 . 5.45 506 412 A 19 GLU H A 17 VAL HA 1.0 . 5.18 507 413 A 97 PRO HGx A 98 ASP H 1.0 . 5.06 508 414 A 83 ARG H A 83 ARG HGx 1.0 . 4.37 509 414 A 83 ARG H A 83 ARG HGy 1.0 . 4.37 510 415 A 83 ARG HA A 83 ARG HGx 1.0 . 3.73 511 415 A 83 ARG HA A 83 ARG HGy 1.0 . 3.73 512 416 A 13 LEU H A 13 LEU HG 1.0 . 5.01 513 417 A 13 LEU HA A 13 LEU HG 1.0 . 4.10 514 418 A 38 ARG H A 38 ARG HGx 1.0 . 3.46 515 418 A 38 ARG H A 38 ARG HGy 1.0 . 3.46 516 419 A 46 PHE HD% A 43 LEU HG 1.0 . 5.50 517 420 A 113 LEU H A 113 LEU HDy% 1.0 . 4.75 518 421 A 113 LEU HDy% A 113 LEU HA 1.0 . 4.84 519 422 A 49 ASP HA A 52 LEU HG 1.0 . 4.66 520 423 A 52 LEU HG A 52 LEU HA 1.0 . 4.13 521 424 A 17 VAL HA A 52 LEU HG 1.0 . 4.71 522 425 A 25 TYR HE% A 21 LEU HG 1.0 . 4.99 523 426 A 40 ILE HA A 43 LEU HG 1.0 . 5.04 524 427 A 73 LEU HG A 73 LEU H 1.0 . 4.88 525 428 A 77 MET H A 73 LEU HG 1.0 . 5.50 526 429 A 58 PHE HE% A 73 LEU HG 1.0 . 5.50 527 430 A 8 LEU HDy% A 21 LEU H 1.0 . 5.04 528 431 A 5 PHE HD% A 8 LEU HDy% 1.0 . 4.51 529 432 A 8 LEU HDy% A 25 TYR HE% 1.0 . 4.23 530 433 A 8 LEU HDy% A 22 ASP H 1.0 . 4.14 531 434 A 8 LEU HDy% A 18 ALA HA 1.0 . 3.67 532 435 A 55 LEU HA A 55 LEU HG 1.0 . 4.01 533 436 A 54 VAL HGx% A 55 LEU HG 1.0 . 5.07 534 437 A 54 VAL HGy% A 55 LEU HG 1.0 . 5.30 535 438 A 8 LEU HDy% A 8 LEU H 1.0 . 3.93 536 439 A 8 LEU HDy% A 8 LEU HBx 1.0 . 3.39 537 440 A 11 ALA H A 13 LEU HDy% 1.0 . 4.92 538 441 A 13 LEU H A 13 LEU HDy% 1.0 . 4.36 539 442 A 13 LEU HDy% A 13 LEU HA 1.0 . 4.55 540 443 A 14 PRO HDx A 13 LEU HDy% 1.0 . 5.40 541 444 A 11 ALA HB% A 13 LEU HDy% 1.0 . 3.38 542 445 A 39 ALA HB% A 74 CYS HBy 1.0 . 5.35 543 446 A 71 ALA HA A 74 CYS HBx 1.0 . 3.85 544 447 A 77 MET HE% A 74 CYS HBx 1.0 . 5.50 545 448 A 39 ALA HB% A 74 CYS HBx 1.0 . 5.45 546 449 A 55 LEU HG A 51 ALA HA 1.0 . 5.50 547 450 A 2 SER HBy A 3 GLU H 1.0 . 3.65 548 451 A 26 VAL HGy% A 2 SER HBy 1.0 . 4.60 549 452 A 26 VAL HGy% A 2 SER HBx 1.0 . 4.24 550 453 A 2 SER HBx A 26 VAL HGx% 1.0 . 5.50 551 454 A 63 LEU HDy% A 61 SER HBy 1.0 . 4.45 552 455 A 61 SER HBx A 63 LEU HG 1.0 . 4.93 553 456 A 61 SER HBx A 72 PHE HZ 1.0 . 3.91 554 457 A 63 LEU HG A 69 LYS HEx 1.0 . 5.47 555 457 A 69 LYS HEy A 63 LEU HG 1.0 . 5.47 556 458 A 9 LEU H A 9 LEU HG 1.0 . 3.71 557 459 A 9 LEU HG A 6 GLN HA 1.0 . 4.48 558 460 A 16 LYS HGy A 16 LYS HEx 1.0 . 4.20 559 460 A 16 LYS HEy A 16 LYS HGy 1.0 . 4.20 560 461 A 16 LYS HA A 16 LYS HGy 1.0 . 3.68 561 462 A 63 LEU HA A 63 LEU HG 1.0 . 4.26 562 463 A 20 LYS H A 52 LEU HDy% 1.0 . 5.50 563 464 A 63 LEU HDx% A 62 ASP HA 1.0 . 5.50 564 465 A 63 LEU HDx% A 61 SER HBx 1.0 . 4.40 565 466 A 63 LEU HDx% A 69 LYS HDx 1.0 . 4.21 566 466 A 63 LEU HDx% A 69 LYS HDy 1.0 . 4.21 567 467 A 63 LEU HDx% A 59 LYS H 1.0 . 5.41 568 468 A 63 LEU HDx% A 63 LEU H 1.0 . 4.00 569 469 A 63 LEU HDx% A 58 PHE HE% 1.0 . 4.36 570 470 A 63 LEU HDx% A 69 LYS HEx 1.0 . 4.55 571 470 A 69 LYS HEy A 63 LEU HDx% 1.0 . 4.55 572 471 A 63 LEU HDx% A 63 LEU HBy 1.0 . 3.26 573 472 A 77 MET H A 74 CYS HA 1.0 . 3.85 574 473 A 74 CYS HA A 77 MET HGy 1.0 . 4.02 575 474 A 17 VAL H A 16 LYS HGy 1.0 . 5.17 576 475 A 16 LYS H A 16 LYS HGy 1.0 . 3.85 577 476 A 52 LEU H A 52 LEU HDy% 1.0 . 3.99 578 477 A 53 ALA H A 52 LEU HDy% 1.0 . 5.12 579 478 A 52 LEU HDy% A 17 VAL HA 1.0 . 4.75 580 479 A 52 LEU HDy% A 16 LYS HEx 1.0 . 4.60 581 479 A 16 LYS HEy A 52 LEU HDy% 1.0 . 4.60 582 480 A 49 ASP HBy A 52 LEU HDy% 1.0 . 5.50 583 481 A 52 LEU HDy% A 48 GLU HGx 1.0 . 3.49 584 481 A 52 LEU HDy% A 48 GLU HGy 1.0 . 3.49 585 482 A 52 LEU HDy% A 16 LYS HBx 1.0 . 3.34 586 482 A 52 LEU HDy% A 16 LYS HBy 1.0 . 3.34 587 483 A 52 LEU HBx A 52 LEU HDy% 1.0 . 3.24 588 484 A 52 LEU HDy% A 16 LYS H 1.0 . 5.39 589 485 A 9 LEU HDx% A 15 GLN H 1.0 . 5.50 590 486 A 9 LEU HDx% A 9 LEU H 1.0 . 3.98 591 487 A 74 CYS HA A 73 LEU HG 1.0 . 4.98 592 488 A 74 CYS HA A 73 LEU HDx% 1.0 . 5.50 593 489 A 17 VAL HGx% A 16 LYS HGy 1.0 . 3.81 594 490 A 16 LYS H A 16 LYS HGx 1.0 . 3.83 595 491 A 16 LYS HA A 16 LYS HGx 1.0 . 3.71 596 492 A 29 LEU H A 29 LEU HDy% 1.0 . 4.13 597 493 A 29 LEU HDy% A 30 VAL H 1.0 . 5.38 598 494 A 29 LEU HDy% A 29 LEU HA 1.0 . 4.24 599 495 A 29 LEU HDy% A 59 LYS HA 1.0 . 3.41 600 496 A 29 LEU HDy% A 59 LYS HEx 1.0 . 4.22 601 496 A 29 LEU HDy% A 59 LYS HEy 1.0 . 4.22 602 497 A 63 LEU HDx% A 29 LEU HDy% 1.0 . 4.43 603 498 A 52 LEU HDy% A 52 LEU HA 1.0 . 4.85 604 499 A 52 LEU HDy% A 17 VAL H 1.0 . 5.47 605 500 A 35 LEU H A 35 LEU HDy% 1.0 . 4.95 606 501 A 35 LEU HDy% A 70 SER HBx 1.0 . 4.78 607 502 A 35 LEU HDy% A 35 LEU HBy 1.0 . 3.62 608 503 A 35 LEU HDy% A 35 LEU HA 1.0 . 4.55 609 504 A 9 LEU HDx% A 5 PHE HE% 1.0 . 3.93 610 505 A 9 LEU HDx% A 15 GLN HA 1.0 . 4.28 611 506 A 9 LEU HDx% A 6 GLN HA 1.0 . 3.70 612 507 A 9 LEU HDx% A 6 GLN HGx 1.0 . 4.71 613 507 A 9 LEU HDx% A 6 GLN HGy 1.0 . 4.71 614 508 A 93 SER H A 94 SER HBx 1.0 . 4.59 615 509 A 93 SER HBy A 94 SER H 1.0 . 4.35 616 510 A 9 LEU HDx% A 9 LEU HBx 1.0 . 3.06 617 511 A 73 LEU H A 73 LEU HDx% 1.0 . 4.60 618 512 A 58 PHE HE% A 73 LEU HDx% 1.0 . 5.50 619 513 A 73 LEU HBy A 73 LEU HDx% 1.0 . 3.44 620 514 A 73 LEU HBx A 73 LEU HDx% 1.0 . 3.60 621 515 A 55 LEU HDx% A 73 LEU HDx% 1.0 . 3.31 622 516 A 43 LEU H A 40 ILE HA 1.0 . 3.76 623 517 A 40 ILE HA A 42 ALA H 1.0 . 5.05 624 518 A 40 ILE HA A 40 ILE HG1y 1.0 . 3.67 625 519 A 40 ILE HA A 40 ILE HG1x 1.0 . 3.68 626 520 A 43 LEU H A 43 LEU HDx% 1.0 . 4.40 627 521 A 98 ASP H A 97 PRO HA 1.0 . 3.23 628 522 A 78 LYS H A 78 LYS HGx 1.0 . 4.52 629 522 A 78 LYS H A 78 LYS HGy 1.0 . 4.52 630 523 A 78 LYS HA A 78 LYS HGx 1.0 . 3.96 631 523 A 78 LYS HGy A 78 LYS HA 1.0 . 3.96 632 524 A 78 LYS HEx A 78 LYS HGx 1.0 . 4.03 633 524 A 78 LYS HGy A 78 LYS HEx 1.0 . 4.03 634 524 A 78 LYS HEy A 78 LYS HGy 1.0 . 4.03 635 524 A 78 LYS HEy A 78 LYS HGx 1.0 . 4.03 636 525 A 103 LYS HGy A 103 LYS HEx 1.0 . 4.05 637 525 A 103 LYS HEy A 103 LYS HGy 1.0 . 4.05 638 526 A 59 LYS HGx A 56 GLN HA 1.0 . 5.50 639 527 A 56 GLN HA A 59 LYS HGy 1.0 . 4.32 640 528 A 59 LYS HGy A 59 LYS HEx 1.0 . 3.85 641 528 A 59 LYS HEy A 59 LYS HGy 1.0 . 3.85 642 529 A 103 LYS H A 103 LYS HGy 1.0 . 4.55 643 530 A 101 LYS HA A 101 LYS HGy 1.0 . 3.87 644 531 A 101 LYS HGy A 101 LYS HDx 1.0 . 2.40 645 531 A 101 LYS HDy A 101 LYS HGy 1.0 . 2.40 646 532 A 101 LYS H A 101 LYS HGy 1.0 . 4.02 647 533 A 101 LYS H A 101 LYS HGx 1.0 . 4.04 648 534 A 101 LYS HGx A 101 LYS HEx 1.0 . 3.83 649 534 A 101 LYS HGx A 101 LYS HEy 1.0 . 3.83 650 535 A 103 LYS HGx A 103 LYS H 1.0 . 4.34 651 536 A 103 LYS HGx A 103 LYS HA 1.0 . 3.77 652 537 A 59 LYS HGx A 24 ILE HG1x 1.0 . 3.40 653 538 A 106 LEU HDx% A 106 LEU H 1.0 . 5.04 654 539 A 24 ILE HG1x A 59 LYS HGy 1.0 . 2.94 655 540 A 105 LEU H A 105 LEU HDy% 1.0 . 5.34 656 541 A 105 LEU HDy% A 105 LEU HA 1.0 . 4.12 657 542 A 102 ILE HA A 105 LEU HDy% 1.0 . 4.41 658 543 A 101 LYS HBx A 101 LYS HGx 1.0 . 2.99 659 544 A 70 SER HBx A 35 LEU HA 1.0 . 4.03 660 545 A 39 ALA HB% A 70 SER HBx 1.0 . 3.80 661 546 A 35 LEU HDx% A 70 SER HBx 1.0 . 3.84 662 547 A 73 LEU HDx% A 70 SER HBx 1.0 . 5.03 663 548 A 102 ILE HA A 102 ILE HG1y 1.0 . 3.93 664 549 A 102 ILE HA A 102 ILE HG1x 1.0 . 3.89 665 550 A 102 ILE HA A 102 ILE HG2% 1.0 . 3.51 666 551 A 64 SER H A 64 SER HBx 1.0 . 3.83 667 552 A 43 LEU HDy% A 51 ALA H 1.0 . 5.50 668 553 A 43 LEU HDy% A 43 LEU HA 1.0 . 3.48 669 554 A 43 LEU HDy% A 51 ALA HA 1.0 . 3.71 670 555 A 43 LEU HDy% A 46 PHE HBx 1.0 . 4.95 671 556 A 43 LEU HDy% A 77 MET HE% 1.0 . 4.43 672 557 A 43 LEU HDy% A 54 VAL HGx% 1.0 . 3.75 673 558 A 43 LEU HDy% A 54 VAL HGy% 1.0 . 4.18 674 559 A 14 PRO HA A 15 GLN HA 1.0 . 4.34 675 560 A 14 PRO HA A 15 GLN H 1.0 . 2.84 676 561 A 91 ALA H A 90 VAL HA 1.0 . 2.92 677 562 A 90 VAL HA A 90 VAL HGx% 1.0 . 3.60 678 562 A 90 VAL HA A 90 VAL HGy% 1.0 . 3.60 679 563 A 109 THR HA A 110 GLY H 1.0 . 3.05 680 564 A 88 THR HG2% A 88 THR HA 1.0 . 3.44 681 565 A 115 VAL HA A 115 VAL HGy% 1.0 . 4.12 682 566 A 80 TYR HD% A 80 TYR HA 1.0 . 3.79 683 567 A 80 TYR HBx A 80 TYR HA 1.0 . 3.00 684 568 A 44 LYS H A 13 LEU HDx% 1.0 . 4.16 685 569 A 13 LEU HDx% A 46 PHE HZ 1.0 . 4.53 686 570 A 13 LEU HA A 13 LEU HDx% 1.0 . 3.18 687 571 A 13 LEU HDx% A 44 LYS HA 1.0 . 3.32 688 572 A 14 PRO HDx A 13 LEU HDx% 1.0 . 3.94 689 573 A 13 LEU HBx A 13 LEU HDx% 1.0 . 3.49 690 574 A 66 VAL HGx% A 66 VAL HA 1.0 . 3.62 691 575 A 66 VAL HGy% A 66 VAL HA 1.0 . 3.40 692 576 A 26 VAL HGy% A 25 TYR HBy 1.0 . 5.22 693 577 A 26 VAL HGy% A 25 TYR HBx 1.0 . 5.38 694 578 A 26 VAL HGy% A 26 VAL H 1.0 . 3.06 695 579 A 26 VAL HGy% A 25 TYR H 1.0 . 4.52 696 580 A 26 VAL HGy% A 27 ALA H 1.0 . 4.06 697 581 A 26 VAL HGy% A 25 TYR HD% 1.0 . 4.76 698 582 A 26 VAL HGy% A 23 GLU HA 1.0 . 3.34 699 583 A 26 VAL HGy% A 26 VAL HA 1.0 . 3.08 700 584 A 27 ALA HB% A 26 VAL HGy% 1.0 . 4.97 701 585 A 105 LEU H A 105 LEU HDx% 1.0 . 5.50 702 586 A 105 LEU HA A 105 LEU HDx% 1.0 . 3.51 703 587 A 72 PHE HA A 75 GLY H 1.0 . 4.20 704 588 A 66 VAL HGx% A 72 PHE HA 1.0 . 4.96 705 589 A 71 ALA HB% A 72 PHE HA 1.0 . 5.04 706 590 A 52 LEU HDx% A 52 LEU H 1.0 . 3.93 707 591 A 52 LEU HDx% A 52 LEU HA 1.0 . 3.04 708 592 A 52 LEU HDx% A 17 VAL HA 1.0 . 3.24 709 593 A 52 LEU HDx% A 52 LEU HBx 1.0 . 3.19 710 594 A 72 PHE HA A 75 GLY HAy 1.0 . 4.86 711 595 A 16 LYS H A 17 VAL HGx% 1.0 . 4.85 712 596 A 17 VAL HGx% A 13 LEU HA 1.0 . 4.98 713 597 A 53 ALA H A 52 LEU HDx% 1.0 . 5.21 714 598 A 52 LEU HDx% A 17 VAL H 1.0 . 4.91 715 599 A 58 PHE HA A 58 PHE HD% 1.0 . 3.77 716 600 A 59 LYS HGy A 58 PHE HA 1.0 . 5.50 717 601 A 73 LEU HDy% A 58 PHE HA 1.0 . 4.93 718 602 A 22 ASP HBy A 5 PHE HA 1.0 . 4.63 719 603 A 5 PHE HA A 8 LEU HG 1.0 . 4.32 720 604 A 8 LEU HBx A 5 PHE HA 1.0 . 4.17 721 605 A 9 LEU HDx% A 5 PHE HA 1.0 . 5.31 722 606 A 8 LEU H A 5 PHE HA 1.0 . 4.77 723 607 A 5 PHE HD% A 5 PHE HA 1.0 . 3.86 724 608 A 18 ALA H A 17 VAL HGx% 1.0 . 4.35 725 609 A 52 LEU H A 17 VAL HGx% 1.0 . 4.41 726 610 A 46 PHE HD% A 17 VAL HGx% 1.0 . 5.50 727 611 A 17 VAL H A 17 VAL HGx% 1.0 . 3.31 728 612 A 14 PRO HDy A 17 VAL HGx% 1.0 . 4.52 729 613 A 17 VAL HGx% A 17 VAL HA 1.0 . 3.27 730 614 A 35 LEU HDx% A 70 SER H 1.0 . 4.46 731 615 A 36 ASP H A 35 LEU HDx% 1.0 . 4.29 732 616 A 35 LEU H A 35 LEU HDx% 1.0 . 4.23 733 617 A 35 LEU HDx% A 35 LEU HA 1.0 . 3.18 734 618 A 35 LEU HDx% A 70 SER HBy 1.0 . 4.61 735 619 A 34 ASP HBy A 35 LEU HDx% 1.0 . 5.50 736 620 A 34 ASP HBx A 35 LEU HDx% 1.0 . 4.76 737 621 A 73 LEU HBy A 35 LEU HDx% 1.0 . 3.59 738 622 A 73 LEU HDy% A 35 LEU HDx% 1.0 . 4.92 739 623 A 58 PHE HA A 57 GLN HBx 1.0 . 5.16 740 623 A 57 GLN HBy A 58 PHE HA 1.0 . 5.16 741 624 A 21 LEU H A 21 LEU HDy% 1.0 . 4.99 742 624 A 21 LEU H A 21 LEU HDx% 1.0 . 4.99 743 625 A 25 TYR HD% A 21 LEU HDy% 1.0 . 4.63 744 625 A 21 LEU HDx% A 25 TYR HD% 1.0 . 4.63 745 626 A 25 TYR HE% A 21 LEU HDy% 1.0 . 4.22 746 626 A 21 LEU HDx% A 25 TYR HE% 1.0 . 4.22 747 627 A 21 LEU HA A 21 LEU HDy% 1.0 . 3.17 748 627 A 21 LEU HDx% A 21 LEU HA 1.0 . 3.17 749 628 A 17 VAL HA A 21 LEU HDy% 1.0 . 5.50 750 628 A 21 LEU HDx% A 17 VAL HA 1.0 . 5.50 751 629 A 48 GLU HA A 48 GLU HGx 1.0 . 2.96 752 629 A 48 GLU HGy A 48 GLU HA 1.0 . 2.96 753 630 A 17 VAL HGx% A 48 GLU HA 1.0 . 3.54 754 631 A 76 VAL HGx% A 57 GLN HBx 1.0 . 3.53 755 631 A 76 VAL HGx% A 57 GLN HBy 1.0 . 3.53 756 632 A 76 VAL HGx% A 57 GLN HGy 1.0 . 4.65 757 633 A 63 LEU H A 29 LEU HDx% 1.0 . 5.48 758 634 A 29 LEU H A 29 LEU HDx% 1.0 . 4.17 759 635 A 30 VAL H A 29 LEU HDx% 1.0 . 5.47 760 636 A 29 LEU HA A 29 LEU HDx% 1.0 . 3.01 761 637 A 59 LYS HA A 29 LEU HDx% 1.0 . 4.16 762 638 A 63 LEU HDx% A 29 LEU HDx% 1.0 . 4.28 763 639 A 76 VAL HGy% A 58 PHE H 1.0 . 4.65 764 640 A 76 VAL HGy% A 75 GLY H 1.0 . 4.64 765 641 A 76 VAL HGy% A 76 VAL H 1.0 . 3.10 766 642 A 76 VAL HGy% A 58 PHE HA 1.0 . 3.83 767 643 A 76 VAL HGy% A 73 LEU HA 1.0 . 3.52 768 644 A 76 VAL HGy% A 76 VAL HA 1.0 . 3.16 769 645 A 76 VAL HGy% A 58 PHE HBx 1.0 . 4.44 770 646 A 76 VAL HGy% A 57 GLN HGy 1.0 . 5.16 771 647 A 76 VAL HGy% A 57 GLN HBx 1.0 . 5.46 772 647 A 76 VAL HGy% A 57 GLN HBy 1.0 . 5.46 773 648 A 76 VAL HGy% A 54 VAL HGx% 1.0 . 4.89 774 649 A 73 LEU HDy% A 76 VAL HGy% 1.0 . 4.44 775 650 A 58 PHE H A 76 VAL HGx% 1.0 . 4.36 776 651 A 76 VAL HGx% A 76 VAL H 1.0 . 3.88 777 652 A 76 VAL HGx% A 57 GLN HE2x 1.0 . 5.31 778 653 A 76 VAL HGx% A 77 MET HA 1.0 . 4.06 779 654 A 76 VAL HGx% A 76 VAL HA 1.0 . 3.41 780 655 A 76 VAL HGx% A 54 VAL HA 1.0 . 3.55 781 656 A 54 VAL HGx% A 76 VAL HGx% 1.0 . 3.51 782 657 A 76 VAL HGx% A 54 VAL HGy% 1.0 . 3.81 783 658 A 63 LEU HDy% A 62 ASP H 1.0 . 5.16 784 659 A 63 LEU H A 63 LEU HDy% 1.0 . 4.19 785 660 A 63 LEU HDy% A 72 PHE HD% 1.0 . 3.53 786 661 A 63 LEU HDy% A 58 PHE HA 1.0 . 4.96 787 662 A 63 LEU HA A 63 LEU HDy% 1.0 . 3.03 788 663 A 63 LEU HDy% A 61 SER HBx 1.0 . 4.09 789 664 A 63 LEU HDy% A 69 LYS HEx 1.0 . 4.38 790 664 A 69 LYS HEy A 63 LEU HDy% 1.0 . 4.38 791 665 A 63 LEU HDy% A 69 LYS HDx 1.0 . 3.96 792 665 A 63 LEU HDy% A 69 LYS HDy 1.0 . 3.96 793 666 A 63 LEU HBy A 63 LEU HDy% 1.0 . 4.05 794 667 A 15 GLN H A 9 LEU HDy% 1.0 . 4.51 795 668 A 9 LEU H A 9 LEU HDy% 1.0 . 4.27 796 669 A 9 LEU HDy% A 6 GLN HE2x 1.0 . 5.42 797 670 A 14 PRO HA A 9 LEU HDy% 1.0 . 5.38 798 671 A 9 LEU HDy% A 9 LEU HA 1.0 . 3.07 799 672 A 15 GLN HA A 9 LEU HDy% 1.0 . 3.16 800 673 A 9 LEU HBy A 9 LEU HDy% 1.0 . 4.09 801 674 A 9 LEU HBx A 9 LEU HDy% 1.0 . 3.37 802 675 A 18 ALA H A 9 LEU HDy% 1.0 . 5.26 803 676 A 55 LEU HDx% A 54 VAL HGx% 1.0 . 3.79 804 677 A 54 VAL HGy% A 80 TYR H 1.0 . 4.71 805 678 A 54 VAL HGy% A 54 VAL H 1.0 . 3.25 806 679 A 54 VAL HGy% A 77 MET HBy 1.0 . 4.36 807 680 A 54 VAL HGy% A 77 MET HBx 1.0 . 3.66 808 681 A 53 ALA HB% A 54 VAL HGy% 1.0 . 4.53 809 682 A 77 MET HA A 80 TYR H 1.0 . 4.00 810 683 A 77 MET HA A 77 MET HGy 1.0 . 3.83 811 684 A 77 MET HA A 54 VAL HGy% 1.0 . 3.82 812 685 A 5 PHE HE% A 15 GLN HA 1.0 . 4.57 813 686 A 18 ALA H A 15 GLN HA 1.0 . 4.46 814 687 A 18 ALA HB% A 15 GLN HA 1.0 . 3.82 815 688 A 55 LEU H A 55 LEU HDx% 1.0 . 4.08 816 689 A 55 LEU HDx% A 55 LEU HA 1.0 . 2.99 817 690 A 55 LEU HDx% A 58 PHE HBy 1.0 . 4.82 818 691 A 55 LEU HDx% A 73 LEU HDy% 1.0 . 3.93 819 692 A 55 LEU HDx% A 58 PHE HBx 1.0 . 4.89 820 693 A 58 PHE HZ A 69 LYS HA 1.0 . 5.16 821 694 A 69 LYS HA A 72 PHE HBx 1.0 . 3.19 822 694 A 72 PHE HBy A 69 LYS HA 1.0 . 3.19 823 695 A 69 LYS HGy A 69 LYS HA 1.0 . 3.80 824 696 A 66 VAL HGx% A 69 LYS HA 1.0 . 3.59 825 697 A 69 LYS HGx A 69 LYS HA 1.0 . 3.85 826 698 A 66 VAL HGy% A 69 LYS HA 1.0 . 5.50 827 699 A 31 ALA H A 30 VAL HGx% 1.0 . 3.90 828 700 A 30 VAL HGx% A 25 TYR HE% 1.0 . 4.20 829 701 A 30 VAL HGx% A 30 VAL HA 1.0 . 3.42 830 702 A 30 VAL HGx% A 69 LYS HDx 1.0 . 3.96 831 702 A 30 VAL HGx% A 69 LYS HDy 1.0 . 3.96 832 703 A 63 LEU HDx% A 30 VAL HGx% 1.0 . 4.34 833 704 A 8 LEU HDx% A 21 LEU HDy% 1.0 . 3.18 834 704 A 21 LEU HDx% A 8 LEU HDx% 1.0 . 3.18 835 705 A 58 PHE HE% A 69 LYS HA 1.0 . 4.38 836 706 A 79 THR HG2% A 80 TYR H 1.0 . 4.22 837 707 A 79 THR HG2% A 79 THR H 1.0 . 3.95 838 708 A 79 THR HG2% A 79 THR HA 1.0 . 3.18 839 709 A 76 VAL HA A 79 THR HG2% 1.0 . 4.52 840 710 A 79 THR HG2% A 83 ARG HDx 1.0 . 4.30 841 710 A 83 ARG HDy A 79 THR HG2% 1.0 . 4.30 842 711 A 8 LEU HDy% A 7 THR HG2% 1.0 . 4.60 843 712 A 10 ASP H A 7 THR HG2% 1.0 . 5.50 844 713 A 7 THR HG2% A 7 THR H 1.0 . 3.91 845 714 A 7 THR HA A 7 THR HG2% 1.0 . 3.21 846 715 A 7 THR HG2% A 4 ASN HA 1.0 . 4.94 847 716 A 17 VAL HGy% A 19 GLU H 1.0 . 5.08 848 717 A 20 LYS H A 17 VAL HGy% 1.0 . 5.12 849 718 A 17 VAL HGy% A 17 VAL H 1.0 . 4.21 850 719 A 17 VAL HGy% A 13 LEU HA 1.0 . 5.01 851 720 A 17 VAL HGy% A 17 VAL HA 1.0 . 3.33 852 721 A 8 LEU H A 8 LEU HDx% 1.0 . 3.94 853 722 A 8 LEU HDx% A 25 TYR HE% 1.0 . 4.36 854 723 A 8 LEU HDx% A 8 LEU HA 1.0 . 3.08 855 724 A 8 LEU HDx% A 8 LEU HBx 1.0 . 3.28 856 725 A 66 VAL HGx% A 69 LYS H 1.0 . 4.92 857 726 A 66 VAL HGx% A 67 GLN H 1.0 . 4.30 858 727 A 66 VAL HGx% A 68 ASN H 1.0 . 4.37 859 728 A 66 VAL HGx% A 72 PHE H 1.0 . 4.20 860 729 A 66 VAL HGx% A 66 VAL H 1.0 . 4.35 861 730 A 66 VAL HGx% A 68 ASN HA 1.0 . 5.24 862 731 A 66 VAL HGx% A 67 GLN HA 1.0 . 4.78 863 732 A 66 VAL HGx% A 72 PHE HBx 1.0 . 3.15 864 732 A 66 VAL HGx% A 72 PHE HBy 1.0 . 3.15 865 733 A 66 VAL HGx% A 69 LYS HBx 1.0 . 5.41 866 734 A 69 LYS HGx A 66 VAL HGx% 1.0 . 4.32 867 735 A 66 VAL HGx% A 63 LEU HDy% 1.0 . 4.25 868 736 A 7 THR HG2% A 3 GLU HGx 1.0 . 4.68 869 736 A 7 THR HG2% A 3 GLU HGy 1.0 . 4.68 870 737 A 7 THR HG2% A 8 LEU HG 1.0 . 3.77 871 738 A 116 THR H A 116 THR HG2% 1.0 . 5.17 872 739 A 73 LEU HDy% A 73 LEU H 1.0 . 4.21 873 740 A 73 LEU HDy% A 73 LEU HA 1.0 . 3.20 874 741 A 73 LEU HDy% A 58 PHE HBy 1.0 . 4.77 875 742 A 81 ARG HDy A 78 LYS HA 1.0 . 4.58 876 743 A 78 LYS HA A 78 LYS HBx 1.0 . 2.85 877 743 A 78 LYS HBy A 78 LYS HA 1.0 . 2.85 878 744 A 109 THR H A 109 THR HG2% 1.0 . 4.36 879 745 A 109 THR HG2% A 108 ARG HGx 1.0 . 3.74 880 745 A 109 THR HG2% A 108 ARG HGy 1.0 . 3.74 881 746 A 114 ASP H A 112 THR HG2% 1.0 . 5.50 882 747 A 112 THR HG2% A 112 THR H 1.0 . 4.53 883 748 A 19 GLU HA A 22 ASP H 1.0 . 4.18 884 749 A 5 PHE HD% A 19 GLU HA 1.0 . 4.54 885 750 A 37 GLU HA A 37 GLU HGx 1.0 . 3.58 886 750 A 37 GLU HA A 37 GLU HGy 1.0 . 3.58 887 751 A 37 GLU HA A 37 GLU HBx 1.0 . 2.81 888 751 A 37 GLU HA A 37 GLU HBy 1.0 . 2.81 889 752 A 37 GLU HA A 40 ILE HG1y 1.0 . 4.49 890 753 A 37 GLU HA A 40 ILE HG2% 1.0 . 5.06 891 754 A 37 GLU HA A 40 ILE HD1% 1.0 . 4.73 892 755 A 54 VAL HGx% A 58 PHE H 1.0 . 5.30 893 756 A 54 VAL HGx% A 77 MET H 1.0 . 3.55 894 757 A 54 VAL HGx% A 77 MET HA 1.0 . 3.71 895 758 A 54 VAL HGx% A 51 ALA HA 1.0 . 4.32 896 759 A 54 VAL HGx% A 54 VAL HA 1.0 . 3.40 897 760 A 54 VAL HGx% A 77 MET HBy 1.0 . 3.71 898 761 A 51 ALA HB% A 54 VAL HGx% 1.0 . 5.50 899 762 A 54 VAL HGx% A 43 LEU HDx% 1.0 . 4.40 900 763 A 61 SER HA A 62 ASP HBx 1.0 . 4.61 901 764 A 20 LYS H A 16 LYS HA 1.0 . 4.90 902 765 A 23 GLU HA A 23 GLU HGx 1.0 . 2.92 903 766 A 23 GLU HA A 23 GLU HGy 1.0 . 3.85 904 767 A 26 VAL H A 26 VAL HGx% 1.0 . 3.85 905 768 A 23 GLU HA A 26 VAL HGx% 1.0 . 4.07 906 769 A 26 VAL HA A 26 VAL HGx% 1.0 . 3.28 907 770 A 26 VAL HGx% A 27 ALA H 1.0 . 4.04 908 771 A 27 ALA HB% A 26 VAL HGx% 1.0 . 5.08 909 772 A 60 ASP H A 61 SER HA 1.0 . 5.01 910 773 A 18 ALA H A 16 LYS HA 1.0 . 5.37 911 774 A 19 GLU H A 16 LYS HA 1.0 . 3.88 912 775 A 16 LYS HA A 19 GLU HBy 1.0 . 3.29 913 776 A 16 LYS HA A 16 LYS HBx 1.0 . 2.94 914 776 A 16 LYS HA A 16 LYS HBy 1.0 . 2.94 915 777 A 91 ALA H A 90 VAL HGx% 1.0 . 4.44 916 777 A 91 ALA H A 90 VAL HGy% 1.0 . 4.44 917 778 A 65 HIS HA A 66 VAL HGy% 1.0 . 4.62 918 779 A 66 VAL HGy% A 72 PHE HBx 1.0 . 4.63 919 779 A 72 PHE HBy A 66 VAL HGy% 1.0 . 4.63 920 780 A 66 VAL HGy% A 69 LYS HEx 1.0 . 5.40 921 780 A 69 LYS HEy A 66 VAL HGy% 1.0 . 5.40 922 781 A 63 LEU HDx% A 66 VAL HGy% 1.0 . 4.87 923 782 A 30 VAL HA A 69 LYS HDx 1.0 . 4.33 924 782 A 69 LYS HDy A 30 VAL HA 1.0 . 4.33 925 783 A 31 ALA H A 30 VAL HA 1.0 . 2.85 926 784 A 30 VAL HA A 69 LYS HEx 1.0 . 4.65 927 784 A 69 LYS HEy A 30 VAL HA 1.0 . 4.65 928 785 A 30 VAL HGx% A 32 HIS HA 1.0 . 5.44 929 786 A 41 GLU HA A 44 LYS H 1.0 . 4.39 930 787 A 41 GLU HA A 41 GLU HBx 1.0 . 2.92 931 787 A 41 GLU HA A 41 GLU HBy 1.0 . 2.92 932 788 A 41 GLU HA A 44 LYS HGx 1.0 . 4.89 933 788 A 41 GLU HA A 44 LYS HGy 1.0 . 4.89 934 789 A 67 GLN H A 66 VAL HGy% 1.0 . 4.97 935 790 A 68 ASN H A 66 VAL HGy% 1.0 . 4.45 936 791 A 72 PHE HD% A 66 VAL HGy% 1.0 . 3.88 937 792 A 66 VAL H A 66 VAL HGy% 1.0 . 3.46 938 793 A 63 LEU HA A 66 VAL HGy% 1.0 . 2.97 939 794 A 63 LEU HDy% A 66 VAL HGy% 1.0 . 3.71 940 795 A 25 TYR HA A 26 VAL HA 1.0 . 4.89 941 796 A 31 ALA HB% A 33 SER HA 1.0 . 5.37 942 797 A 32 HIS HBx A 33 SER HA 1.0 . 5.50 943 798 A 59 LYS HA A 61 SER H 1.0 . 5.19 944 799 A 59 LYS HA A 59 LYS HGy 1.0 . 3.89 945 800 A 59 LYS HGx A 59 LYS HA 1.0 . 3.79 946 801 A 63 LEU HDx% A 59 LYS HA 1.0 . 4.26 947 802 A 31 ALA H A 31 ALA HB% 1.0 . 3.07 948 803 A 31 ALA HB% A 32 HIS H 1.0 . 4.19 949 804 A 31 ALA HB% A 34 ASP H 1.0 . 4.02 950 805 A 31 ALA HB% A 30 VAL H 1.0 . 5.50 951 806 A 31 ALA HB% A 30 VAL HA 1.0 . 4.25 952 807 A 31 ALA HB% A 32 HIS HA 1.0 . 5.19 953 808 A 30 VAL HB A 31 ALA HB% 1.0 . 4.57 954 809 A 35 LEU H A 33 SER HA 1.0 . 4.35 955 810 A 33 SER HA A 33 SER HBy 1.0 . 2.97 956 811 A 59 LYS HA A 58 PHE HD% 1.0 . 5.20 957 812 A 31 ALA H A 30 VAL HGy% 1.0 . 3.81 958 813 A 30 VAL HGy% A 25 TYR H 1.0 . 5.00 959 814 A 30 VAL HGy% A 30 VAL H 1.0 . 3.38 960 815 A 30 VAL HGy% A 25 TYR HE% 1.0 . 4.38 961 816 A 25 TYR HA A 30 VAL HGy% 1.0 . 3.93 962 817 A 30 VAL HGy% A 30 VAL HA 1.0 . 3.72 963 818 A 30 VAL HGy% A 32 HIS HA 1.0 . 5.24 964 819 A 2 SER HA A 3 GLU HGx 1.0 . 4.96 965 819 A 2 SER HA A 3 GLU HGy 1.0 . 4.96 966 820 A 57 GLN HA A 57 GLN HGx 1.0 . 3.56 967 821 A 2 SER HA A 3 GLU H 1.0 . 3.13 968 822 A 2 SER HA A 2 SER HBy 1.0 . 2.93 969 823 A 41 GLU H A 38 ARG HA 1.0 . 3.81 970 824 A 42 ALA H A 38 ARG HA 1.0 . 4.68 971 825 A 38 ARG HA A 38 ARG HDx 1.0 . 4.32 972 825 A 38 ARG HA A 38 ARG HDy 1.0 . 4.32 973 826 A 38 ARG HA A 41 GLU HBx 1.0 . 3.13 974 826 A 41 GLU HBy A 38 ARG HA 1.0 . 3.13 975 827 A 38 ARG HA A 38 ARG HGx 1.0 . 3.49 976 827 A 38 ARG HGy A 38 ARG HA 1.0 . 3.49 977 828 A 37 GLU H A 38 ARG HA 1.0 . 5.21 978 829 A 59 LYS HDy A 56 GLN HA 1.0 . 3.93 979 830 A 3 GLU HA A 3 GLU HGx 1.0 . 3.51 980 830 A 3 GLU HA A 3 GLU HGy 1.0 . 3.51 981 831 A 3 GLU HA A 3 GLU HBx 1.0 . 2.73 982 831 A 3 GLU HA A 3 GLU HBy 1.0 . 2.73 983 832 A 80 TYR HD% A 81 ARG HA 1.0 . 4.44 984 833 A 81 ARG HGy A 81 ARG HA 1.0 . 3.03 985 834 A 76 VAL H A 73 LEU HA 1.0 . 3.80 986 835 A 56 GLN HA A 56 GLN HBy 1.0 . 2.99 987 836 A 59 LYS HBx A 56 GLN HA 1.0 . 3.54 988 837 A 73 LEU HG A 73 LEU HA 1.0 . 3.90 989 838 A 73 LEU HDx% A 73 LEU HA 1.0 . 4.44 990 839 A 3 GLU HA A 5 PHE H 1.0 . 4.57 991 840 A 115 VAL H A 115 VAL HGy% 1.0 . 4.50 992 841 A 115 VAL HGy% A 116 THR HG2% 1.0 . 4.48 993 842 A 8 LEU HDy% A 22 ASP HA 1.0 . 4.53 994 843 A 46 PHE HA A 45 GLU HBx 1.0 . 4.96 995 843 A 45 GLU HBy A 46 PHE HA 1.0 . 4.96 996 844 A 47 ASN H A 46 PHE HA 1.0 . 2.99 997 845 A 44 LYS HBy A 44 LYS HA 1.0 . 2.97 998 846 A 44 LYS HA A 44 LYS HGx 1.0 . 3.35 999 846 A 44 LYS HA A 44 LYS HGy 1.0 . 3.35 1000 847 A 6 GLN HE2y A 6 GLN HA 1.0 . 4.78 1001 848 A 5 PHE HD% A 6 GLN HA 1.0 . 5.35 1002 849 A 7 THR HA A 6 GLN HA 1.0 . 5.17 1003 850 A 9 LEU HBx A 6 GLN HA 1.0 . 4.26 1004 851 A 25 TYR H A 22 ASP HA 1.0 . 4.08 1005 852 A 25 TYR HBy A 22 ASP HA 1.0 . 3.66 1006 853 A 9 LEU H A 6 GLN HA 1.0 . 3.88 1007 854 A 6 GLN HA A 6 GLN HGx 1.0 . 3.70 1008 854 A 6 GLN HGy A 6 GLN HA 1.0 . 3.70 1009 855 A 9 LEU HBy A 6 GLN HA 1.0 . 3.70 1010 856 A 112 THR H A 111 TYR HA 1.0 . 3.20 1011 857 A 111 TYR HD% A 111 TYR HA 1.0 . 3.88 1012 858 A 77 MET HE% A 43 LEU HA 1.0 . 3.57 1013 859 A 82 GLN HA A 82 GLN H 1.0 . 2.92 1014 860 A 83 ARG HA A 83 ARG HBx 1.0 . 2.72 1015 860 A 83 ARG HA A 83 ARG HBy 1.0 . 2.72 1016 861 A 51 ALA H A 51 ALA HB% 1.0 . 3.04 1017 862 A 51 ALA HB% A 52 LEU H 1.0 . 3.40 1018 863 A 53 ALA H A 51 ALA HB% 1.0 . 5.48 1019 864 A 46 PHE HD% A 51 ALA HB% 1.0 . 4.42 1020 865 A 51 ALA HB% A 46 PHE HA 1.0 . 5.50 1021 866 A 51 ALA HB% A 17 VAL HB 1.0 . 3.97 1022 867 A 51 ALA HB% A 55 LEU HG 1.0 . 4.20 1023 868 A 51 ALA HB% A 17 VAL HGx% 1.0 . 3.42 1024 869 A 17 VAL HGy% A 51 ALA HB% 1.0 . 3.40 1025 870 A 43 LEU HDy% A 51 ALA HB% 1.0 . 3.58 1026 871 A 51 ALA HB% A 54 VAL HGy% 1.0 . 5.34 1027 872 A 49 ASP HA A 47 ASN HD2y 1.0 . 5.50 1028 873 A 67 GLN HA A 66 VAL HA 1.0 . 4.41 1029 874 A 46 PHE HBx A 43 LEU HA 1.0 . 5.23 1030 875 A 90 VAL HA A 91 ALA HB% 1.0 . 5.50 1031 876 A 53 ALA H A 49 ASP HA 1.0 . 4.92 1032 877 A 43 LEU HG A 43 LEU HA 1.0 . 3.12 1033 878 A 101 LYS HA A 102 ILE H 1.0 . 3.15 1034 879 A 101 LYS HA A 101 LYS HGx 1.0 . 3.40 1035 880 A 24 ILE HB A 21 LEU HA 1.0 . 3.57 1036 881 A 25 TYR H A 21 LEU HA 1.0 . 5.12 1037 882 A 89 LYS HBy A 91 ALA HB% 1.0 . 4.96 1038 883 A 91 ALA H A 91 ALA HB% 1.0 . 3.57 1039 884 A 51 ALA H A 49 ASP HA 1.0 . 5.05 1040 885 A 49 ASP HA A 49 ASP HBx 1.0 . 2.90 1041 886 A 49 ASP HA A 48 GLU HGx 1.0 . 4.10 1042 886 A 49 ASP HA A 48 GLU HGy 1.0 . 4.10 1043 887 A 49 ASP HA A 52 LEU HBy 1.0 . 3.39 1044 888 A 49 ASP HA A 52 LEU HDy% 1.0 . 3.60 1045 889 A 8 LEU HG A 8 LEU HA 1.0 . 3.70 1046 890 A 55 LEU HA A 58 PHE HD% 1.0 . 4.69 1047 891 A 58 PHE HBy A 55 LEU HA 1.0 . 3.79 1048 892 A 58 PHE H A 55 LEU HA 1.0 . 3.88 1049 893 A 54 VAL HGx% A 55 LEU HA 1.0 . 4.62 1050 894 A 73 LEU HDy% A 55 LEU HA 1.0 . 4.68 1051 895 A 20 LYS HA A 20 LYS HDx 1.0 . 3.03 1052 895 A 20 LYS HA A 20 LYS HDy 1.0 . 3.03 1053 896 A 20 LYS HA A 52 LEU HDx% 1.0 . 4.66 1054 897 A 45 GLU HGy A 45 GLU HA 1.0 . 4.21 1055 898 A 9 LEU HG A 9 LEU HA 1.0 . 3.82 1056 899 A 74 CYS H A 77 MET HE% 1.0 . 4.49 1057 900 A 77 MET HE% A 75 GLY H 1.0 . 5.36 1058 901 A 77 MET HE% A 77 MET H 1.0 . 4.66 1059 902 A 43 LEU H A 77 MET HE% 1.0 . 3.65 1060 903 A 77 MET HE% A 42 ALA H 1.0 . 4.83 1061 904 A 77 MET HE% A 74 CYS HA 1.0 . 2.92 1062 905 A 77 MET HE% A 39 ALA HA 1.0 . 3.43 1063 906 A 40 ILE HA A 77 MET HE% 1.0 . 5.50 1064 907 A 77 MET HE% A 77 MET HBy 1.0 . 3.70 1065 908 A 77 MET HE% A 43 LEU HG 1.0 . 3.83 1066 909 A 77 MET HE% A 42 ALA HB% 1.0 . 3.24 1067 910 A 77 MET HE% A 73 LEU HG 1.0 . 3.06 1068 911 A 77 MET HE% A 43 LEU HDx% 1.0 . 3.69 1069 912 A 77 MET HE% A 54 VAL HGx% 1.0 . 3.35 1070 913 A 77 MET HE% A 73 LEU HDy% 1.0 . 3.76 1071 914 A 108 ARG H A 107 GLU HA 1.0 . 3.04 1072 915 A 45 GLU HA A 45 GLU HBx 1.0 . 2.94 1073 915 A 45 GLU HBy A 45 GLU HA 1.0 . 2.94 1074 916 A 45 GLU HA A 46 PHE H 1.0 . 3.20 1075 917 A 29 LEU HG A 29 LEU HA 1.0 . 3.43 1076 918 A 27 ALA HB% A 26 VAL H 1.0 . 4.90 1077 919 A 27 ALA HB% A 28 GLY H 1.0 . 3.89 1078 920 A 27 ALA HB% A 27 ALA H 1.0 . 3.00 1079 921 A 27 ALA HB% A 29 LEU H 1.0 . 3.91 1080 922 A 27 ALA HB% A 29 LEU HDy% 1.0 . 3.66 1081 923 A 24 ILE HG2% A 59 LYS H 1.0 . 5.50 1082 924 A 24 ILE HG2% A 27 ALA H 1.0 . 5.08 1083 925 A 24 ILE HG2% A 24 ILE H 1.0 . 3.69 1084 926 A 24 ILE HG2% A 58 PHE HD% 1.0 . 3.67 1085 927 A 24 ILE HG2% A 25 TYR HE% 1.0 . 5.50 1086 928 A 25 TYR HA A 24 ILE HG2% 1.0 . 4.45 1087 929 A 24 ILE HG2% A 21 LEU HA 1.0 . 5.03 1088 930 A 24 ILE HA A 24 ILE HG2% 1.0 . 3.37 1089 931 A 24 ILE HG2% A 59 LYS HEx 1.0 . 5.50 1090 931 A 24 ILE HG2% A 59 LYS HEy 1.0 . 5.50 1091 932 A 24 ILE HG2% A 24 ILE HG1y 1.0 . 4.22 1092 933 A 29 LEU HBy A 24 ILE HG2% 1.0 . 3.79 1093 934 A 24 ILE HG2% A 30 VAL HGy% 1.0 . 3.51 1094 935 A 29 LEU HBx A 29 LEU HA 1.0 . 3.00 1095 936 A 63 LEU HDx% A 29 LEU HA 1.0 . 5.20 1096 937 A 100 ALA H A 100 ALA HB% 1.0 . 3.37 1097 938 A 19 GLU H A 18 ALA HB% 1.0 . 3.53 1098 939 A 18 ALA H A 18 ALA HB% 1.0 . 3.03 1099 940 A 18 ALA HB% A 5 PHE HA 1.0 . 3.86 1100 941 A 8 LEU HBy A 18 ALA HB% 1.0 . 3.71 1101 942 A 17 VAL HGy% A 18 ALA HB% 1.0 . 3.94 1102 943 A 18 ALA HB% A 9 LEU HDy% 1.0 . 3.56 1103 944 A 18 ALA HB% A 16 LYS H 1.0 . 5.50 1104 945 A 11 ALA HB% A 10 ASP HA 1.0 . 4.76 1105 946 A 10 ASP HA A 12 GLY H 1.0 . 4.19 1106 947 A 10 ASP HBx A 10 ASP HA 1.0 . 3.02 1107 948 A 11 ALA H A 11 ALA HB% 1.0 . 2.99 1108 949 A 11 ALA HB% A 8 LEU HA 1.0 . 3.44 1109 950 A 11 ALA HB% A 10 ASP HBx 1.0 . 5.50 1110 951 A 51 ALA H A 53 ALA HB% 1.0 . 5.50 1111 952 A 53 ALA HB% A 54 VAL H 1.0 . 3.32 1112 953 A 53 ALA H A 53 ALA HB% 1.0 . 2.99 1113 954 A 50 GLY HAy A 53 ALA HB% 1.0 . 3.61 1114 955 A 53 ALA HB% A 54 VAL HA 1.0 . 4.82 1115 956 A 53 ALA HB% A 54 VAL HGx% 1.0 . 5.50 1116 957 A 69 LYS HBx A 34 ASP HA 1.0 . 5.17 1117 958 A 41 GLU H A 42 ALA HB% 1.0 . 4.61 1118 959 A 43 LEU H A 42 ALA HB% 1.0 . 3.41 1119 960 A 42 ALA HB% A 42 ALA H 1.0 . 2.96 1120 961 A 42 ALA HB% A 39 ALA HA 1.0 . 3.37 1121 962 A 45 GLU HGy A 42 ALA HB% 1.0 . 5.50 1122 963 A 11 ALA HB% A 10 ASP H 1.0 . 5.00 1123 964 A 95 LYS HA A 95 LYS HGy 1.0 . 3.90 1124 965 A 90 VAL H A 89 LYS HA 1.0 . 2.86 1125 966 A 71 ALA HB% A 68 ASN HBx 1.0 . 4.06 1126 967 A 71 ALA HB% A 71 ALA H 1.0 . 2.87 1127 968 A 77 MET HE% A 39 ALA HB% 1.0 . 4.17 1128 969 A 39 ALA HB% A 35 LEU HBx 1.0 . 3.82 1129 970 A 39 ALA HB% A 35 LEU HDx% 1.0 . 3.91 1130 971 A 39 ALA HB% A 73 LEU HDx% 1.0 . 3.79 1131 972 A 39 ALA HB% A 40 ILE H 1.0 . 3.56 1132 973 A 39 ALA HB% A 35 LEU HA 1.0 . 4.44 1133 974 A 40 ILE HA A 39 ALA HB% 1.0 . 5.50 1134 975 A 39 ALA HB% A 73 LEU HDy% 1.0 . 5.50 1135 976 A 71 ALA HB% A 68 ASN HD2x 1.0 . 4.18 1136 977 A 71 ALA HB% A 68 ASN HBy 1.0 . 3.54 1137 978 A 103 LYS H A 102 ILE HG2% 1.0 . 4.28 1138 979 A 102 ILE HG1y A 102 ILE HG2% 1.0 . 3.85 1139 980 A 102 ILE HG2% A 102 ILE H 1.0 . 4.19 1140 981 A 103 LYS HA A 102 ILE HG2% 1.0 . 4.24 1141 982 A 102 ILE HG1x A 102 ILE HG2% 1.0 . 3.49 1142 983 A 41 GLU H A 40 ILE HG2% 1.0 . 4.06 1143 984 A 43 LEU H A 40 ILE HG2% 1.0 . 5.06 1144 985 A 40 ILE H A 40 ILE HG2% 1.0 . 4.01 1145 986 A 41 GLU HA A 40 ILE HG2% 1.0 . 3.92 1146 987 A 40 ILE HA A 40 ILE HG2% 1.0 . 3.27 1147 988 A 40 ILE HG2% A 44 LYS HDx 1.0 . 3.97 1148 988 A 44 LYS HDy A 40 ILE HG2% 1.0 . 3.97 1149 989 A 5 PHE HD% A 18 ALA HA 1.0 . 4.91 1150 990 A 20 LYS H A 18 ALA HA 1.0 . 5.33 1151 991 A 8 LEU HBy A 18 ALA HA 1.0 . 4.31 1152 992 A 21 LEU HBy A 18 ALA HA 1.0 . 3.78 1153 993 A 21 LEU HBx A 18 ALA HA 1.0 . 3.77 1154 994 A 17 VAL HGy% A 18 ALA HA 1.0 . 3.52 1155 995 A 18 ALA HA A 21 LEU HDy% 1.0 . 4.13 1156 995 A 21 LEU HDx% A 18 ALA HA 1.0 . 4.13 1157 996 A 57 GLN H A 53 ALA HA 1.0 . 5.04 1158 997 A 114 ASP H A 113 LEU HA 1.0 . 3.34 1159 998 A 43 LEU HG A 39 ALA HA 1.0 . 5.36 1160 999 A 45 GLU HGy A 42 ALA HA 1.0 . 4.08 1161 1000 A 54 VAL H A 51 ALA HA 1.0 . 4.02 1162 1001 A 54 VAL HB A 51 ALA HA 1.0 . 3.39 1163 1002 A 54 VAL HGy% A 51 ALA HA 1.0 . 3.91 1164 1003 A 45 GLU H A 42 ALA HA 1.0 . 4.12 1165 1004 A 74 CYS H A 71 ALA HA 1.0 . 4.27 1166 1005 A 71 ALA HA A 75 GLY H 1.0 . 4.71 1167 1006 A 63 LEU HA A 66 VAL H 1.0 . 4.31 1168 1007 A 63 LEU HA A 66 VAL HGx% 1.0 . 4.75 1169 1008 A 63 LEU HA A 63 LEU HDx% 1.0 . 4.64 1170 1009 A 51 ALA HA A 43 LEU HA 1.0 . 5.50 1171 1010 A 74 CYS HBy A 71 ALA HA 1.0 . 3.53 1172 1011 A 7 THR HB A 4 ASN HA 1.0 . 4.18 1173 1012 A 4 ASN HA A 4 ASN HBx 1.0 . 2.96 1174 1012 A 4 ASN HBy A 4 ASN HA 1.0 . 2.96 1175 1013 A 115 VAL H A 114 ASP HA 1.0 . 3.54 1176 1014 A 99 GLU HBy A 100 ALA HA 1.0 . 5.50 1177 1015 A 105 LEU H A 104 ALA HA 1.0 . 3.14 1178 1016 A 103 LYS HBx A 104 ALA HA 1.0 . 5.10 1179 1017 A 21 LEU H A 24 ILE HD1% 1.0 . 5.35 1180 1018 A 24 ILE HD1% A 25 TYR H 1.0 . 4.68 1181 1019 A 24 ILE HD1% A 21 LEU HA 1.0 . 3.47 1182 1020 A 24 ILE HA A 24 ILE HD1% 1.0 . 3.89 1183 1021 A 24 ILE HD1% A 58 PHE HBy 1.0 . 4.84 1184 1022 A 24 ILE HD1% A 24 ILE HB 1.0 . 3.38 1185 1023 A 24 ILE HD1% A 55 LEU HBy 1.0 . 3.52 1186 1024 A 24 ILE HD1% A 21 LEU HDy% 1.0 . 3.53 1187 1024 A 24 ILE HD1% A 21 LEU HDx% 1.0 . 3.53 1188 1025 A 62 ASP HA A 63 LEU H 1.0 . 2.84 1189 1026 A 62 ASP HA A 63 LEU HG 1.0 . 4.49 1190 1027 A 26 VAL HA A 27 ALA HA 1.0 . 4.76 1191 1028 A 63 LEU HA A 62 ASP HA 1.0 . 4.67 1192 1029 A 13 LEU HA A 14 PRO HGx 1.0 . 4.45 1193 1030 A 26 VAL H A 27 ALA HA 1.0 . 4.94 1194 1031 A 26 VAL HGx% A 27 ALA HA 1.0 . 4.34 1195 1032 A 37 GLU H A 36 ASP HA 1.0 . 3.02 1196 1033 A 36 ASP HA A 37 GLU HBx 1.0 . 4.44 1197 1033 A 37 GLU HBy A 36 ASP HA 1.0 . 4.44 1198 1034 A 48 GLU H A 47 ASN HA 1.0 . 3.12 1199 1035 A 47 ASN HBy A 47 ASN HA 1.0 . 3.00 1200 1036 A 47 ASN HBx A 47 ASN HA 1.0 . 3.02 1201 1037 A 71 ALA HB% A 68 ASN HA 1.0 . 4.95 1202 1038 A 69 LYS H A 68 ASN HA 1.0 . 3.20 1203 1039 A 71 ALA H A 68 ASN HA 1.0 . 4.83 1204 1040 A 102 ILE H A 102 ILE HD1% 1.0 . 5.02 1205 1041 A 102 ILE HA A 102 ILE HD1% 1.0 . 4.25 1206 1042 A 102 ILE HB A 102 ILE HD1% 1.0 . 3.76 1207 1043 A 14 PRO HDx A 46 PHE HZ 1.0 . 5.50 1208 1044 A 18 ALA H A 14 PRO HDx 1.0 . 5.36 1209 1045 A 30 VAL HB A 31 ALA HA 1.0 . 4.26 1210 1046 A 14 PRO HDy A 13 LEU HA 1.0 . 3.07 1211 1047 A 14 PRO HDy A 13 LEU HDx% 1.0 . 4.35 1212 1048 A 14 PRO HDy A 46 PHE HZ 1.0 . 5.50 1213 1049 A 14 PRO HDx A 17 VAL H 1.0 . 5.04 1214 1050 A 14 PRO HDx A 13 LEU HA 1.0 . 3.32 1215 1051 A 13 LEU HBy A 14 PRO HDx 1.0 . 4.37 1216 1052 A 14 PRO HDx A 17 VAL HGx% 1.0 . 4.07 1217 1053 A 96 GLY H A 97 PRO HDx 1.0 . 5.50 1218 1053 A 97 PRO HDy A 96 GLY H 1.0 . 5.50 1219 1054 A 95 LYS HA A 97 PRO HDx 1.0 . 4.26 1220 1054 A 97 PRO HDy A 95 LYS HA 1.0 . 4.26 1221 1055 A 98 ASP H A 97 PRO HDx 1.0 . 5.43 1222 1055 A 97 PRO HDy A 98 ASP H 1.0 . 5.43 1223 1056 A 40 ILE H A 40 ILE HD1% 1.0 . 4.01 1224 1057 A 40 ILE HA A 40 ILE HD1% 1.0 . 3.31 1225 1058 A 40 ILE HB A 40 ILE HD1% 1.0 . 3.55 1226 1059 A 40 ILE HG2% A 40 ILE HD1% 1.0 . 2.90 1227 1060 A 67 GLN H A 66 VAL HA 1.0 . 3.33 1228 1061 A 67 GLN H A 67 GLN HGx 1.0 . 4.97 1229 1061 A 67 GLN HGy A 67 GLN H 1.0 . 4.97 1230 1062 A 31 ALA H A 30 VAL H 1.0 . 4.91 1231 1063 A 31 ALA H A 69 LYS HDx 1.0 . 5.50 1232 1063 A 31 ALA H A 69 LYS HDy 1.0 . 5.50 1233 1064 A 63 LEU H A 62 ASP H 1.0 . 4.19 1234 1065 A 63 LEU H A 62 ASP HBx 1.0 . 4.64 1235 1066 A 63 LEU HBy A 63 LEU H 1.0 . 3.44 1236 1067 A 63 LEU H A 63 LEU HG 1.0 . 3.31 1237 1068 A 71 ALA H A 69 LYS H 1.0 . 5.01 1238 1069 A 69 LYS HBx A 69 LYS H 1.0 . 3.56 1239 1070 A 69 LYS HGx A 69 LYS H 1.0 . 4.52 1240 1071 A 69 LYS H A 66 VAL HGy% 1.0 . 5.50 1241 1072 A 68 ASN HBy A 69 LYS H 1.0 . 5.17 1242 1073 A 54 VAL HGx% A 76 VAL H 1.0 . 5.50 1243 1074 A 76 VAL H A 72 PHE HA 1.0 . 4.77 1244 1075 A 76 VAL H A 75 GLY HAy 1.0 . 3.55 1245 1076 A 77 MET HE% A 76 VAL H 1.0 . 5.50 1246 1077 A 73 LEU HDy% A 76 VAL H 1.0 . 5.50 1247 1078 A 76 VAL H A 73 LEU H 1.0 . 5.43 1248 1079 A 15 GLN H A 16 LYS H 1.0 . 3.90 1249 1080 A 18 ALA H A 15 GLN H 1.0 . 5.50 1250 1081 A 15 GLN H A 17 VAL H 1.0 . 5.13 1251 1082 A 15 GLN H A 15 GLN HBy 1.0 . 3.17 1252 1083 A 15 GLN H A 15 GLN HBx 1.0 . 3.29 1253 1084 A 15 GLN H A 14 PRO HBx 1.0 . 3.94 1254 1085 A 14 PRO HDx A 15 GLN H 1.0 . 5.50 1255 1086 A 113 LEU H A 112 THR HG2% 1.0 . 5.50 1256 1087 A 89 LYS H A 88 THR H 1.0 . 4.16 1257 1088 A 89 LYS H A 88 THR HB 1.0 . 4.23 1258 1089 A 89 LYS H A 88 THR HA 1.0 . 3.06 1259 1090 A 89 LYS H A 89 LYS HBx 1.0 . 3.50 1260 1091 A 88 THR HG2% A 89 LYS H 1.0 . 5.02 1261 1092 A 51 ALA H A 50 GLY H 1.0 . 3.05 1262 1093 A 50 GLY HAx A 51 ALA H 1.0 . 3.44 1263 1094 A 51 ALA H A 46 PHE HBx 1.0 . 4.02 1264 1095 A 51 ALA H A 52 LEU HBy 1.0 . 4.68 1265 1096 A 51 ALA H A 54 VAL HGy% 1.0 . 5.50 1266 1097 A 76 VAL HGx% A 80 TYR H 1.0 . 5.50 1267 1098 A 79 THR HB A 80 TYR H 1.0 . 3.75 1268 1099 A 78 LYS H A 80 TYR H 1.0 . 4.95 1269 1100 A 80 TYR HBy A 80 TYR H 1.0 . 3.15 1270 1101 A 53 ALA H A 51 ALA H 1.0 . 5.17 1271 1102 A 53 ALA H A 52 LEU H 1.0 . 3.34 1272 1103 A 53 ALA H A 54 VAL H 1.0 . 3.40 1273 1104 A 53 ALA H A 52 LEU HBy 1.0 . 3.50 1274 1105 A 53 ALA H A 54 VAL HGx% 1.0 . 5.50 1275 1106 A 29 LEU H A 26 VAL H 1.0 . 4.89 1276 1107 A 25 TYR HD% A 26 VAL H 1.0 . 4.95 1277 1108 A 23 GLU HA A 26 VAL H 1.0 . 4.17 1278 1109 A 25 TYR HBy A 26 VAL H 1.0 . 4.28 1279 1110 A 26 VAL H A 25 TYR HBx 1.0 . 4.47 1280 1111 A 71 ALA H A 70 SER HBy 1.0 . 3.77 1281 1112 A 53 ALA H A 55 LEU HBx 1.0 . 5.05 1282 1113 A 53 ALA H A 51 ALA HA 1.0 . 5.18 1283 1114 A 53 ALA H A 54 VAL HGy% 1.0 . 5.19 1284 1115 A 53 ALA H A 54 VAL HA 1.0 . 5.50 1285 1116 A 74 CYS H A 71 ALA H 1.0 . 5.50 1286 1117 A 40 ILE H A 39 ALA H 1.0 . 3.51 1287 1118 A 39 ALA HB% A 39 ALA H 1.0 . 3.42 1288 1119 A 40 ILE HG1x A 39 ALA H 1.0 . 5.36 1289 1120 A 36 ASP HBx A 39 ALA H 1.0 . 5.50 1290 1121 A 35 LEU HA A 39 ALA H 1.0 . 5.50 1291 1122 A 36 ASP H A 40 ILE H 1.0 . 4.65 1292 1123 A 36 ASP H A 35 LEU HBy 1.0 . 4.64 1293 1124 A 36 ASP H A 35 LEU HG 1.0 . 5.50 1294 1125 A 37 GLU H A 36 ASP H 1.0 . 4.65 1295 1126 A 36 ASP H A 35 LEU HA 1.0 . 2.93 1296 1127 A 36 ASP H A 70 SER HBy 1.0 . 4.18 1297 1128 A 36 ASP H A 70 SER HBx 1.0 . 4.19 1298 1129 A 36 ASP H A 39 ALA HB% 1.0 . 4.04 1299 1130 A 36 ASP H A 35 LEU HBx 1.0 . 4.18 1300 1131 A 101 LYS H A 100 ALA H 1.0 . 3.89 1301 1132 A 100 ALA H A 99 GLU HBy 1.0 . 4.19 1302 1133 A 95 LYS H A 95 LYS HGy 1.0 . 4.37 1303 1134 A 103 LYS H A 102 ILE HG1x 1.0 . 5.50 1304 1135 A 95 LYS H A 94 SER H 1.0 . 3.68 1305 1136 A 95 LYS H A 94 SER HA 1.0 . 3.24 1306 1137 A 103 LYS H A 104 ALA H 1.0 . 3.44 1307 1138 A 103 LYS HBx A 104 ALA H 1.0 . 3.97 1308 1139 A 104 ALA H A 104 ALA HB% 1.0 . 3.78 1309 1140 A 91 ALA H A 90 VAL H 1.0 . 3.61 1310 1141 A 89 LYS HBy A 90 VAL H 1.0 . 4.28 1311 1142 A 90 VAL H A 91 ALA HB% 1.0 . 5.43 1312 1143 A 90 VAL H A 90 VAL HGx% 1.0 . 4.02 1313 1143 A 90 VAL H A 90 VAL HGy% 1.0 . 4.02 1314 1144 A 88 THR HG2% A 90 VAL H 1.0 . 5.50 1315 1145 A 11 ALA H A 10 ASP H 1.0 . 3.12 1316 1146 A 10 ASP H A 7 THR HA 1.0 . 3.89 1317 1147 A 10 ASP H A 6 GLN HA 1.0 . 4.76 1318 1148 A 10 ASP H A 10 ASP HBy 1.0 . 3.24 1319 1149 A 8 LEU HBy A 10 ASP H 1.0 . 5.50 1320 1150 A 9 LEU HBy A 10 ASP H 1.0 . 3.66 1321 1151 A 9 LEU HBx A 10 ASP H 1.0 . 3.86 1322 1152 A 9 LEU HDx% A 10 ASP H 1.0 . 4.88 1323 1153 A 10 ASP H A 6 GLN HGx 1.0 . 4.97 1324 1153 A 10 ASP H A 6 GLN HGy 1.0 . 4.97 1325 1154 A 72 PHE H A 73 LEU H 1.0 . 3.62 1326 1155 A 58 PHE HE% A 73 LEU H 1.0 . 4.05 1327 1156 A 73 LEU H A 71 ALA HA 1.0 . 5.04 1328 1157 A 73 LEU H A 72 PHE HBx 1.0 . 3.55 1329 1157 A 72 PHE HBy A 73 LEU H 1.0 . 3.55 1330 1158 A 73 LEU HBy A 73 LEU H 1.0 . 3.41 1331 1159 A 39 ALA HB% A 73 LEU H 1.0 . 4.75 1332 1160 A 73 LEU HBx A 73 LEU H 1.0 . 3.47 1333 1161 A 99 GLU H A 99 GLU HBy 1.0 . 3.54 1334 1162 A 73 LEU H A 75 GLY H 1.0 . 5.48 1335 1163 A 35 LEU HDx% A 73 LEU H 1.0 . 4.97 1336 1164 A 20 LYS H A 18 ALA H 1.0 . 5.16 1337 1165 A 18 ALA H A 17 VAL H 1.0 . 3.15 1338 1166 A 18 ALA H A 17 VAL HB 1.0 . 3.36 1339 1167 A 17 VAL HGy% A 18 ALA H 1.0 . 4.08 1340 1168 A 9 LEU HDx% A 18 ALA H 1.0 . 4.76 1341 1169 A 18 ALA H A 19 GLU HGy 1.0 . 5.50 1342 1170 A 99 GLU H A 97 PRO HBx 1.0 . 4.56 1343 1171 A 99 GLU H A 98 ASP HA 1.0 . 3.40 1344 1172 A 99 GLU H A 98 ASP HBx 1.0 . 4.07 1345 1173 A 8 LEU H A 6 GLN H 1.0 . 5.50 1346 1174 A 8 LEU H A 10 ASP H 1.0 . 5.01 1347 1175 A 8 LEU H A 6 GLN HA 1.0 . 5.43 1348 1176 A 8 LEU H A 8 LEU HG 1.0 . 3.37 1349 1177 A 8 LEU H A 8 LEU HBx 1.0 . 3.60 1350 1178 A 5 PHE H A 4 ASN HD2y 1.0 . 4.71 1351 1179 A 8 LEU H A 5 PHE H 1.0 . 5.50 1352 1180 A 63 LEU HBx A 66 VAL H 1.0 . 5.50 1353 1181 A 3 GLU H A 2 SER H 1.0 . 5.50 1354 1182 A 3 GLU H A 2 SER HBx 1.0 . 3.86 1355 1183 A 3 GLU H A 3 GLU HGx 1.0 . 4.01 1356 1183 A 3 GLU H A 3 GLU HGy 1.0 . 4.01 1357 1184 A 3 GLU H A 3 GLU HBx 1.0 . 3.24 1358 1184 A 3 GLU H A 3 GLU HBy 1.0 . 3.24 1359 1185 A 26 VAL HGy% A 3 GLU H 1.0 . 5.50 1360 1186 A 3 GLU H A 5 PHE H 1.0 . 5.38 1361 1187 A 3 GLU H A 4 ASN HBx 1.0 . 5.50 1362 1187 A 4 ASN HBy A 3 GLU H 1.0 . 5.50 1363 1188 A 5 PHE HD% A 5 PHE H 1.0 . 4.99 1364 1189 A 5 PHE HBy A 5 PHE H 1.0 . 3.34 1365 1190 A 5 PHE HBx A 5 PHE H 1.0 . 3.33 1366 1191 A 5 PHE H A 4 ASN HBx 1.0 . 3.91 1367 1191 A 4 ASN HBy A 5 PHE H 1.0 . 3.91 1368 1192 A 6 GLN HBx A 5 PHE H 1.0 . 5.04 1369 1193 A 8 LEU HDy% A 5 PHE H 1.0 . 5.50 1370 1194 A 24 ILE H A 26 VAL H 1.0 . 5.33 1371 1195 A 21 LEU H A 24 ILE H 1.0 . 5.50 1372 1196 A 24 ILE H A 21 LEU HA 1.0 . 4.01 1373 1197 A 24 ILE HB A 24 ILE H 1.0 . 3.17 1374 1198 A 24 ILE H A 24 ILE HG1y 1.0 . 3.47 1375 1199 A 24 ILE HD1% A 24 ILE H 1.0 . 3.67 1376 1200 A 66 VAL H A 65 HIS HBx 1.0 . 4.88 1377 1201 A 25 TYR HBy A 24 ILE H 1.0 . 5.50 1378 1202 A 66 VAL H A 67 GLN H 1.0 . 5.04 1379 1203 A 66 VAL H A 65 HIS H 1.0 . 3.33 1380 1204 A 66 VAL H A 65 HIS HBy 1.0 . 4.76 1381 1205 A 63 LEU HDy% A 66 VAL H 1.0 . 5.41 1382 1206 A 66 VAL H A 69 LYS HEx 1.0 . 5.44 1383 1206 A 69 LYS HEy A 66 VAL H 1.0 . 5.44 1384 1207 A 47 ASN HBy A 48 GLU H 1.0 . 3.37 1385 1208 A 48 GLU HBy A 48 GLU H 1.0 . 2.98 1386 1209 A 48 GLU H A 17 VAL HGx% 1.0 . 5.50 1387 1210 A 11 ALA H A 12 GLY H 1.0 . 3.40 1388 1211 A 11 ALA H A 13 LEU H 1.0 . 4.38 1389 1212 A 11 ALA H A 8 LEU HA 1.0 . 4.00 1390 1213 A 11 ALA H A 12 GLY HAx 1.0 . 4.97 1391 1214 A 11 ALA H A 10 ASP HBy 1.0 . 3.79 1392 1215 A 23 GLU H A 25 TYR H 1.0 . 4.35 1393 1216 A 106 LEU H A 105 LEU HA 1.0 . 3.44 1394 1217 A 106 LEU H A 106 LEU HBy 1.0 . 3.21 1395 1218 A 106 LEU H A 105 LEU HDx% 1.0 . 5.04 1396 1219 A 26 VAL H A 25 TYR H 1.0 . 3.61 1397 1220 A 24 ILE H A 25 TYR H 1.0 . 3.53 1398 1221 A 23 GLU HA A 25 TYR H 1.0 . 4.55 1399 1222 A 25 TYR HBy A 25 TYR H 1.0 . 3.57 1400 1223 A 25 TYR H A 25 TYR HBx 1.0 . 3.70 1401 1224 A 24 ILE HB A 25 TYR H 1.0 . 3.60 1402 1225 A 24 ILE HG2% A 25 TYR H 1.0 . 4.13 1403 1226 A 41 GLU HGy A 42 ALA H 1.0 . 5.12 1404 1227 A 43 LEU HBy A 42 ALA H 1.0 . 4.99 1405 1228 A 25 TYR HE% A 32 HIS H 1.0 . 5.50 1406 1229 A 32 HIS HBy A 32 HIS H 1.0 . 3.70 1407 1230 A 40 ILE HG2% A 42 ALA H 1.0 . 5.50 1408 1231 A 41 GLU H A 42 ALA H 1.0 . 3.41 1409 1232 A 40 ILE H A 42 ALA H 1.0 . 4.30 1410 1233 A 42 ALA H A 39 ALA HA 1.0 . 3.91 1411 1234 A 42 ALA H A 41 GLU HBx 1.0 . 3.42 1412 1234 A 41 GLU HBy A 42 ALA H 1.0 . 3.42 1413 1235 A 62 ASP H A 61 SER HA 1.0 . 3.11 1414 1236 A 61 SER HBx A 62 ASP H 1.0 . 3.62 1415 1237 A 62 ASP HBy A 62 ASP H 1.0 . 3.37 1416 1238 A 62 ASP H A 62 ASP HBx 1.0 . 3.40 1417 1239 A 108 ARG H A 109 THR HB 1.0 . 4.91 1418 1240 A 13 LEU H A 14 PRO HDx 1.0 . 5.50 1419 1241 A 11 ALA HB% A 13 LEU H 1.0 . 3.42 1420 1242 A 13 LEU H A 13 LEU HDx% 1.0 . 4.11 1421 1243 A 61 SER HBy A 62 ASP H 1.0 . 3.65 1422 1244 A 108 ARG H A 108 ARG HGx 1.0 . 4.46 1423 1244 A 108 ARG H A 108 ARG HGy 1.0 . 4.46 1424 1245 A 103 LYS H A 102 ILE H 1.0 . 3.60 1425 1246 A 102 ILE HB A 102 ILE H 1.0 . 3.25 1426 1247 A 102 ILE HG1x A 102 ILE H 1.0 . 5.13 1427 1248 A 43 LEU H A 43 LEU HG 1.0 . 3.06 1428 1249 A 43 LEU H A 43 LEU HDy% 1.0 . 4.19 1429 1250 A 13 LEU H A 13 LEU HBx 1.0 . 3.80 1430 1251 A 58 PHE H A 58 PHE HD% 1.0 . 4.64 1431 1252 A 73 LEU HDy% A 58 PHE H 1.0 . 5.48 1432 1253 A 58 PHE HBy A 58 PHE H 1.0 . 3.35 1433 1254 A 58 PHE H A 56 GLN H 1.0 . 4.74 1434 1255 A 56 GLN H A 53 ALA HA 1.0 . 3.94 1435 1256 A 56 GLN HBy A 56 GLN H 1.0 . 3.08 1436 1257 A 53 ALA HB% A 56 GLN H 1.0 . 4.87 1437 1258 A 55 LEU HBx A 56 GLN H 1.0 . 4.41 1438 1259 A 98 ASP H A 99 GLU HBx 1.0 . 4.13 1439 1260 A 91 ALA HA A 92 ASP H 1.0 . 3.12 1440 1261 A 21 LEU H A 19 GLU H 1.0 . 4.79 1441 1262 A 23 GLU H A 21 LEU H 1.0 . 5.10 1442 1263 A 21 LEU H A 21 LEU HBx 1.0 . 3.26 1443 1264 A 21 LEU H A 55 LEU HDy% 1.0 . 3.95 1444 1265 A 53 ALA H A 56 GLN H 1.0 . 5.50 1445 1266 A 54 VAL HA A 56 GLN H 1.0 . 5.50 1446 1267 A 84 GLU H A 85 LYS H 1.0 . 3.56 1447 1268 A 72 PHE H A 72 PHE HD% 1.0 . 4.70 1448 1269 A 72 PHE H A 72 PHE HBx 1.0 . 3.04 1449 1269 A 72 PHE H A 72 PHE HBy 1.0 . 3.04 1450 1270 A 20 LYS H A 21 LEU H 1.0 . 3.54 1451 1271 A 20 LYS H A 17 VAL HA 1.0 . 4.05 1452 1272 A 20 LYS H A 19 GLU HBy 1.0 . 3.64 1453 1273 A 20 LYS H A 20 LYS HDx 1.0 . 3.06 1454 1273 A 20 LYS H A 20 LYS HDy 1.0 . 3.06 1455 1274 A 20 LYS H A 18 ALA HB% 1.0 . 5.09 1456 1275 A 20 LYS H A 52 LEU HDx% 1.0 . 4.21 1457 1276 A 111 TYR H A 110 GLY H 1.0 . 4.14 1458 1277 A 72 PHE H A 71 ALA HB% 1.0 . 3.68 1459 1278 A 26 VAL H A 27 ALA H 1.0 . 3.57 1460 1279 A 28 GLY H A 27 ALA H 1.0 . 3.31 1461 1280 A 29 LEU H A 27 ALA H 1.0 . 4.27 1462 1281 A 30 VAL H A 27 ALA H 1.0 . 5.50 1463 1282 A 23 GLU HA A 27 ALA H 1.0 . 4.72 1464 1283 A 26 VAL HB A 27 ALA H 1.0 . 3.68 1465 1284 A 107 GLU H A 107 GLU HBx 1.0 . 3.48 1466 1285 A 107 GLU H A 106 LEU HA 1.0 . 3.26 1467 1286 A 106 LEU HBy A 107 GLU H 1.0 . 4.49 1468 1287 A 111 TYR HD% A 111 TYR H 1.0 . 5.50 1469 1288 A 83 ARG H A 84 GLU H 1.0 . 3.49 1470 1289 A 84 GLU H A 84 GLU HBx 1.0 . 3.12 1471 1290 A 54 VAL H A 56 GLN H 1.0 . 3.79 1472 1291 A 101 LYS HBx A 101 LYS H 1.0 . 3.01 1473 1292 A 114 ASP H A 115 VAL H 1.0 . 3.47 1474 1293 A 105 LEU HBy A 105 LEU H 1.0 . 3.35 1475 1294 A 105 LEU H A 104 ALA HB% 1.0 . 4.21 1476 1295 A 32 HIS HA A 34 ASP H 1.0 . 4.49 1477 1296 A 34 ASP HBx A 34 ASP H 1.0 . 3.84 1478 1297 A 31 ALA H A 34 ASP H 1.0 . 4.79 1479 1298 A 34 ASP H A 33 SER HBx 1.0 . 5.35 1480 1299 A 34 ASP HBy A 34 ASP H 1.0 . 3.44 1481 1300 A 35 LEU HDx% A 34 ASP H 1.0 . 5.50 1482 1301 A 80 TYR HD% A 54 VAL H 1.0 . 5.50 1483 1302 A 54 VAL HGx% A 54 VAL H 1.0 . 4.37 1484 1303 A 54 VAL H A 52 LEU HA 1.0 . 4.26 1485 1304 A 83 ARG H A 81 ARG H 1.0 . 4.79 1486 1305 A 83 ARG H A 82 GLN HBx 1.0 . 3.66 1487 1305 A 83 ARG H A 82 GLN HBy 1.0 . 3.66 1488 1306 A 83 ARG H A 83 ARG HBx 1.0 . 3.13 1489 1306 A 83 ARG H A 83 ARG HBy 1.0 . 3.13 1490 1307 A 83 ARG H A 79 THR HG2% 1.0 . 5.50 1491 1308 A 9 LEU H A 10 ASP H 1.0 . 3.72 1492 1309 A 9 LEU H A 8 LEU HBx 1.0 . 3.33 1493 1310 A 37 GLU H A 38 ARG H 1.0 . 3.61 1494 1311 A 8 LEU HBy A 9 LEU H 1.0 . 4.04 1495 1312 A 75 GLY HAx A 78 LYS H 1.0 . 4.07 1496 1313 A 77 MET HGy A 78 LYS H 1.0 . 4.34 1497 1314 A 25 TYR HA A 29 LEU H 1.0 . 5.33 1498 1315 A 29 LEU H A 30 VAL HA 1.0 . 5.11 1499 1316 A 26 VAL HGy% A 2 SER H 1.0 . 5.50 1500 1317 A 21 LEU H A 22 ASP H 1.0 . 3.53 1501 1318 A 23 GLU H A 22 ASP H 1.0 . 3.71 1502 1319 A 20 LYS H A 22 ASP H 1.0 . 4.96 1503 1320 A 5 PHE HD% A 22 ASP H 1.0 . 5.00 1504 1321 A 22 ASP HBy A 22 ASP H 1.0 . 2.99 1505 1322 A 21 LEU HBy A 22 ASP H 1.0 . 3.95 1506 1323 A 21 LEU HBx A 22 ASP H 1.0 . 3.94 1507 1324 A 22 ASP H A 21 LEU HDy% 1.0 . 4.66 1508 1325 A 24 ILE H A 22 ASP H 1.0 . 5.22 1509 1326 A 20 LYS H A 17 VAL H 1.0 . 5.50 1510 1327 A 19 GLU H A 17 VAL H 1.0 . 4.65 1511 1328 A 15 GLN HA A 17 VAL H 1.0 . 4.55 1512 1329 A 17 VAL H A 17 VAL HB 1.0 . 3.22 1513 1330 A 17 VAL H A 14 PRO HBx 1.0 . 3.54 1514 1331 A 46 PHE HBy A 46 PHE H 1.0 . 3.75 1515 1332 A 45 GLU HGx A 46 PHE H 1.0 . 5.50 1516 1333 A 81 ARG H A 80 TYR HD% 1.0 . 4.72 1517 1334 A 81 ARG H A 80 TYR HBy 1.0 . 3.94 1518 1335 A 55 LEU HBx A 55 LEU H 1.0 . 3.85 1519 1336 A 55 LEU HDy% A 55 LEU H 1.0 . 4.06 1520 1337 A 55 LEU H A 54 VAL HGy% 1.0 . 4.30 1521 1338 A 77 MET H A 77 MET HGx 1.0 . 3.55 1522 1339 A 76 VAL HGx% A 77 MET H 1.0 . 4.53 1523 1340 A 35 LEU H A 34 ASP H 1.0 . 3.36 1524 1341 A 35 LEU H A 34 ASP HBx 1.0 . 4.76 1525 1342 A 35 LEU H A 35 LEU HBy 1.0 . 3.57 1526 1343 A 35 LEU H A 35 LEU HBx 1.0 . 3.98 1527 1344 A 35 LEU H A 36 ASP H 1.0 . 4.63 1528 1345 A 51 ALA HB% A 46 PHE H 1.0 . 5.00 1529 1346 A 53 ALA H A 55 LEU H 1.0 . 5.42 1530 1347 A 55 LEU H A 55 LEU HG 1.0 . 2.95 1531 1348 A 55 LEU H A 51 ALA HB% 1.0 . 4.32 1532 1349 A 35 LEU H A 35 LEU HG 1.0 . 3.87 1533 1350 A 94 SER H A 93 SER HA 1.0 . 3.45 1534 1351 A 81 ARG H A 82 GLN H 1.0 . 3.41 1535 1352 A 82 GLN HGy A 82 GLN H 1.0 . 4.13 1536 1353 A 82 GLN H A 79 THR HG2% 1.0 . 5.50 1537 1354 A 9 LEU HDx% A 6 GLN H 1.0 . 5.50 1538 1355 A 6 GLN H A 3 GLU HA 1.0 . 4.66 1539 1356 A 6 GLN H A 5 PHE H 1.0 . 3.70 1540 1357 A 5 PHE HBy A 6 GLN H 1.0 . 4.04 1541 1358 A 5 PHE HBx A 6 GLN H 1.0 . 3.59 1542 1359 A 6 GLN H A 6 GLN HGx 1.0 . 4.17 1543 1359 A 6 GLN HGy A 6 GLN H 1.0 . 4.17 1544 1360 A 6 GLN HBx A 6 GLN H 1.0 . 3.24 1545 1361 A 6 GLN H A 8 LEU HBx 1.0 . 5.50 1546 1362 A 41 GLU H A 38 ARG H 1.0 . 5.02 1547 1363 A 41 GLU H A 39 ALA H 1.0 . 4.59 1548 1364 A 41 GLU H A 40 ILE H 1.0 . 3.52 1549 1365 A 41 GLU H A 41 GLU HBx 1.0 . 3.04 1550 1365 A 41 GLU H A 41 GLU HBy 1.0 . 3.04 1551 1366 A 47 ASN H A 49 ASP H 1.0 . 5.31 1552 1367 A 59 LYS H A 58 PHE HD% 1.0 . 4.43 1553 1368 A 59 LYS H A 58 PHE HBy 1.0 . 3.69 1554 1369 A 59 LYS H A 58 PHE HBx 1.0 . 3.93 1555 1370 A 59 LYS H A 59 LYS HBx 1.0 . 3.08 1556 1371 A 59 LYS H A 59 LYS HGy 1.0 . 4.17 1557 1372 A 59 LYS H A 59 LYS HGx 1.0 . 4.82 1558 1373 A 59 LYS H A 24 ILE HD1% 1.0 . 4.41 1559 1374 A 41 GLU H A 40 ILE HD1% 1.0 . 5.50 1560 1375 A 46 PHE HBy A 47 ASN H 1.0 . 3.38 1561 1376 A 47 ASN H A 47 ASN HBx 1.0 . 3.42 1562 1377 A 47 ASN H A 50 GLY H 1.0 . 4.38 1563 1378 A 65 HIS H A 65 HIS HBy 1.0 . 4.16 1564 1379 A 65 HIS HBx A 65 HIS H 1.0 . 3.75 1565 1380 A 66 VAL HB A 65 HIS H 1.0 . 4.96 1566 1381 A 3 GLU H A 4 ASN H 1.0 . 3.66 1567 1382 A 5 PHE H A 4 ASN H 1.0 . 3.37 1568 1383 A 2 SER HBx A 4 ASN H 1.0 . 4.40 1569 1384 A 4 ASN H A 4 ASN HBx 1.0 . 3.18 1570 1384 A 4 ASN HBy A 4 ASN H 1.0 . 3.18 1571 1385 A 4 ASN H A 3 GLU HGx 1.0 . 4.36 1572 1385 A 3 GLU HGy A 4 ASN H 1.0 . 4.36 1573 1386 A 4 ASN H A 3 GLU HBx 1.0 . 3.72 1574 1386 A 3 GLU HBy A 4 ASN H 1.0 . 3.72 1575 1387 A 47 ASN H A 46 PHE H 1.0 . 4.54 1576 1388 A 51 ALA HB% A 47 ASN H 1.0 . 5.33 1577 1389 A 115 VAL HA A 116 THR H 1.0 . 3.50 1578 1390 A 66 VAL HGy% A 65 HIS H 1.0 . 4.93 1579 1391 A 58 PHE H A 57 GLN H 1.0 . 3.51 1580 1392 A 56 GLN H A 57 GLN H 1.0 . 3.46 1581 1393 A 57 GLN HGy A 57 GLN H 1.0 . 4.01 1582 1394 A 56 GLN HBy A 57 GLN H 1.0 . 3.03 1583 1395 A 54 VAL HA A 57 GLN H 1.0 . 4.50 1584 1396 A 76 VAL HGx% A 57 GLN H 1.0 . 5.26 1585 1397 A 58 PHE HBy A 57 GLN H 1.0 . 5.40 1586 1398 A 59 LYS HBx A 61 SER H 1.0 . 5.50 1587 1399 A 68 ASN H A 69 LYS HA 1.0 . 5.50 1588 1400 A 71 ALA HB% A 68 ASN H 1.0 . 5.50 1589 1401 A 23 GLU H A 24 ILE HD1% 1.0 . 5.13 1590 1402 A 23 GLU H A 24 ILE H 1.0 . 3.58 1591 1403 A 62 ASP H A 61 SER H 1.0 . 4.59 1592 1404 A 60 ASP H A 61 SER H 1.0 . 3.40 1593 1405 A 58 PHE HA A 61 SER H 1.0 . 4.73 1594 1406 A 61 SER HBy A 61 SER H 1.0 . 3.33 1595 1407 A 61 SER HBx A 61 SER H 1.0 . 3.85 1596 1408 A 60 ASP HBy A 61 SER H 1.0 . 5.02 1597 1409 A 60 ASP HBx A 61 SER H 1.0 . 4.82 1598 1410 A 63 LEU HDy% A 61 SER H 1.0 . 5.50 1599 1411 A 74 CYS H A 75 GLY H 1.0 . 3.75 1600 1412 A 74 CYS H A 72 PHE H 1.0 . 4.39 1601 1413 A 74 CYS H A 74 CYS HBy 1.0 . 3.57 1602 1414 A 74 CYS H A 74 CYS HBx 1.0 . 3.83 1603 1415 A 74 CYS H A 73 LEU HBy 1.0 . 3.74 1604 1416 A 74 CYS H A 39 ALA HB% 1.0 . 4.72 1605 1417 A 74 CYS H A 73 LEU HDx% 1.0 . 5.33 1606 1418 A 74 CYS H A 73 LEU HDy% 1.0 . 5.50 1607 1419 A 74 CYS H A 73 LEU HBx 1.0 . 4.31 1608 1420 A 67 GLN H A 68 ASN H 1.0 . 4.58 1609 1421 A 63 LEU HG A 61 SER H 1.0 . 5.35 1610 1422 A 63 LEU H A 61 SER H 1.0 . 5.50 1611 1423 A 93 SER H A 92 ASP HA 1.0 . 3.43 1612 1424 A 93 SER H A 93 SER HBy 1.0 . 4.07 1613 1425 A 40 ILE HA A 44 LYS H 1.0 . 5.50 1614 1426 A 44 LYS H A 44 LYS HBx 1.0 . 3.26 1615 1427 A 44 LYS H A 44 LYS HGx 1.0 . 4.08 1616 1427 A 44 LYS H A 44 LYS HGy 1.0 . 4.08 1617 1428 A 60 ASP H A 58 PHE HA 1.0 . 5.25 1618 1429 A 60 ASP H A 59 LYS HGy 1.0 . 4.50 1619 1430 A 59 LYS HGx A 60 ASP H 1.0 . 5.16 1620 1431 A 59 LYS H A 60 ASP H 1.0 . 3.55 1621 1432 A 60 ASP H A 57 GLN HA 1.0 . 4.11 1622 1433 A 60 ASP H A 58 PHE HBy 1.0 . 5.50 1623 1434 A 60 ASP H A 60 ASP HBx 1.0 . 3.25 1624 1435 A 60 ASP H A 59 LYS HBx 1.0 . 3.56 1625 1436 A 63 LEU HDx% A 60 ASP H 1.0 . 5.50 1626 1437 A 40 ILE H A 37 GLU HA 1.0 . 3.87 1627 1438 A 40 ILE H A 37 GLU HGx 1.0 . 5.50 1628 1438 A 40 ILE H A 37 GLU HGy 1.0 . 5.50 1629 1439 A 66 VAL H A 64 SER H 1.0 . 5.24 1630 1440 A 62 ASP HA A 64 SER H 1.0 . 4.06 1631 1441 A 64 SER H A 64 SER HBy 1.0 . 3.34 1632 1442 A 63 LEU HBy A 64 SER H 1.0 . 4.48 1633 1443 A 66 VAL HGy% A 64 SER H 1.0 . 5.50 1634 1444 A 112 THR H A 117 THR HB 1.0 . 4.33 1635 1445 A 40 ILE H A 36 ASP HA 1.0 . 5.50 1636 1446 A 63 LEU HDy% A 64 SER H 1.0 . 5.50 1637 1447 A 56 GLN HE2y A 57 GLN H 1.0 . 4.80 1638 1448 A 56 GLN HE2x A 56 GLN HA 1.0 . 5.41 1639 1449 A 56 GLN HE2x A 56 GLN HGx 1.0 . 3.90 1640 1449 A 56 GLN HE2x A 56 GLN HGy 1.0 . 3.90 1641 1450 A 59 LYS HDy A 56 GLN HE2x 1.0 . 4.31 1642 1451 A 19 GLU H A 16 LYS H 1.0 . 5.20 1643 1452 A 18 ALA H A 19 GLU H 1.0 . 3.51 1644 1453 A 20 LYS H A 19 GLU H 1.0 . 3.59 1645 1454 A 19 GLU H A 5 PHE HE% 1.0 . 4.14 1646 1455 A 19 GLU H A 19 GLU HBy 1.0 . 3.24 1647 1456 A 56 GLN HE2y A 59 LYS HDy 1.0 . 5.09 1648 1457 A 56 GLN HE2x A 57 GLN H 1.0 . 5.50 1649 1458 A 56 GLN HE2x A 59 LYS HBx 1.0 . 5.29 1650 1459 A 56 GLN HE2x A 59 LYS HGx 1.0 . 5.50 1651 1460 A 9 LEU HDx% A 19 GLU H 1.0 . 5.50 1652 1461 A 35 LEU HA A 70 SER H 1.0 . 5.50 1653 1462 A 34 ASP HBx A 70 SER H 1.0 . 5.50 1654 1463 A 69 LYS H A 70 SER H 1.0 . 3.52 1655 1464 A 71 ALA H A 70 SER H 1.0 . 3.22 1656 1465 A 70 SER H A 68 ASN HA 1.0 . 4.40 1657 1466 A 70 SER H A 70 SER HBy 1.0 . 3.43 1658 1467 A 70 SER HBx A 70 SER H 1.0 . 3.48 1659 1468 A 70 SER H A 72 PHE HBx 1.0 . 5.50 1660 1468 A 72 PHE HBy A 70 SER H 1.0 . 5.50 1661 1469 A 69 LYS HBx A 70 SER H 1.0 . 3.73 1662 1470 A 71 ALA HB% A 70 SER H 1.0 . 4.47 1663 1471 A 9 LEU HBx A 6 GLN HE2y 1.0 . 5.25 1664 1472 A 10 ASP H A 6 GLN HE2x 1.0 . 5.47 1665 1473 A 10 ASP H A 6 GLN HE2y 1.0 . 5.17 1666 1474 A 9 LEU HBy A 6 GLN HE2y 1.0 . 4.83 1667 1475 A 9 LEU HDx% A 6 GLN HE2y 1.0 . 5.22 1668 1476 A 46 PHE HBx A 45 GLU H 1.0 . 5.28 1669 1477 A 6 GLN HA A 6 GLN HE2x 1.0 . 5.21 1670 1478 A 6 GLN HE2x A 6 GLN HGx 1.0 . 3.81 1671 1478 A 6 GLN HGy A 6 GLN HE2x 1.0 . 3.81 1672 1479 A 9 LEU HBy A 6 GLN HE2x 1.0 . 4.61 1673 1480 A 9 LEU HBx A 6 GLN HE2x 1.0 . 4.90 1674 1481 A 9 LEU HG A 6 GLN HE2x 1.0 . 5.50 1675 1482 A 9 LEU HDx% A 6 GLN HE2x 1.0 . 4.52 1676 1483 A 45 GLU H A 41 GLU HA 1.0 . 5.50 1677 1484 A 45 GLU H A 44 LYS H 1.0 . 3.40 1678 1485 A 45 GLU H A 45 GLU HBx 1.0 . 3.02 1679 1485 A 45 GLU H A 45 GLU HBy 1.0 . 3.02 1680 1486 A 45 GLU H A 13 LEU HDx% 1.0 . 5.50 1681 1487 A 16 LYS H A 17 VAL H 1.0 . 3.55 1682 1488 A 14 PRO HA A 16 LYS H 1.0 . 5.21 1683 1489 A 52 LEU H A 49 ASP HA 1.0 . 4.59 1684 1490 A 51 ALA H A 52 LEU H 1.0 . 3.61 1685 1491 A 52 LEU H A 52 LEU HBy 1.0 . 2.92 1686 1492 A 116 THR H A 117 THR H 1.0 . 3.90 1687 1493 A 9 LEU H A 6 GLN HE2y 1.0 . 5.50 1688 1494 A 18 ALA H A 16 LYS H 1.0 . 4.79 1689 1495 A 16 LYS H A 16 LYS HBx 1.0 . 3.21 1690 1495 A 16 LYS H A 16 LYS HBy 1.0 . 3.21 1691 1496 A 116 THR HG2% A 117 THR H 1.0 . 5.50 1692 1497 A 76 VAL HGx% A 79 THR H 1.0 . 5.50 1693 1498 A 76 VAL HGy% A 79 THR H 1.0 . 5.50 1694 1499 A 78 LYS H A 79 THR H 1.0 . 3.54 1695 1500 A 79 THR HB A 79 THR H 1.0 . 3.32 1696 1501 A 76 VAL HA A 79 THR H 1.0 . 4.36 1697 1502 A 80 TYR HBy A 79 THR H 1.0 . 4.89 1698 1503 A 49 ASP H A 48 GLU H 1.0 . 3.63 1699 1504 A 49 ASP H A 49 ASP HBx 1.0 . 3.04 1700 1505 A 49 ASP H A 52 LEU HDy% 1.0 . 5.50 1701 1506 A 6 GLN H A 7 THR H 1.0 . 3.57 1702 1507 A 7 THR HB A 7 THR H 1.0 . 3.24 1703 1508 A 6 GLN HBx A 7 THR H 1.0 . 3.66 1704 1509 A 110 GLY H A 109 THR H 1.0 . 3.94 1705 1510 A 108 ARG HA A 109 THR H 1.0 . 3.53 1706 1511 A 88 THR HG2% A 88 THR H 1.0 . 4.57 1707 1512 A 25 TYR H A 4 ASN HD2y 1.0 . 5.46 1708 1513 A 7 THR H A 5 PHE H 1.0 . 4.10 1709 1514 A 7 THR H A 4 ASN HA 1.0 . 4.10 1710 1515 A 9 LEU HDx% A 7 THR H 1.0 . 5.50 1711 1516 A 88 THR H A 87 GLY H 1.0 . 3.56 1712 1517 A 88 THR H A 87 GLY HAx 1.0 . 3.25 1713 1517 A 87 GLY HAy A 88 THR H 1.0 . 3.25 1714 1518 A 88 THR H A 88 THR HB 1.0 . 3.76 1715 1519 A 88 THR H A 86 GLN HA 1.0 . 3.63 1716 1520 A 25 TYR HD% A 4 ASN HD2y 1.0 . 5.32 1717 1521 A 8 LEU HG A 4 ASN HD2x 1.0 . 5.50 1718 1522 A 18 ALA HB% A 4 ASN HD2x 1.0 . 5.50 1719 1523 A 5 PHE H A 4 ASN HD2x 1.0 . 5.23 1720 1524 A 88 THR H A 86 GLN HBx 1.0 . 5.50 1721 1524 A 86 GLN HBy A 88 THR H 1.0 . 5.50 1722 1525 A 4 ASN HD2y A 4 ASN HBx 1.0 . 3.45 1723 1525 A 4 ASN HBy A 4 ASN HD2y 1.0 . 3.45 1724 1526 A 4 ASN H A 4 ASN HD2x 1.0 . 5.16 1725 1527 A 25 TYR HD% A 4 ASN HD2x 1.0 . 5.50 1726 1528 A 4 ASN HD2x A 4 ASN HBx 1.0 . 3.89 1727 1528 A 4 ASN HBy A 4 ASN HD2x 1.0 . 3.89 1728 1529 A 68 ASN HA A 68 ASN HD2y 1.0 . 5.50 1729 1530 A 71 ALA H A 68 ASN HD2y 1.0 . 4.46 1730 1531 A 71 ALA HA A 68 ASN HD2y 1.0 . 5.50 1731 1532 A 68 ASN HBx A 68 ASN HD2y 1.0 . 3.80 1732 1533 A 71 ALA HB% A 68 ASN HD2y 1.0 . 4.49 1733 1534 A 49 ASP H A 47 ASN HD2y 1.0 . 4.76 1734 1535 A 47 ASN HD2y A 47 ASN HBx 1.0 . 3.84 1735 1536 A 71 ALA H A 68 ASN HD2x 1.0 . 4.68 1736 1537 A 71 ALA HA A 68 ASN HD2x 1.0 . 5.50 1737 1538 A 47 ASN H A 47 ASN HD2x 1.0 . 5.50 1738 1539 A 49 ASP H A 47 ASN HD2x 1.0 . 5.30 1739 1540 A 47 ASN HD2x A 48 GLU H 1.0 . 5.50 1740 1541 A 47 ASN HD2x A 49 ASP HBx 1.0 . 4.97 1741 1542 A 47 ASN HD2y A 48 GLU H 1.0 . 5.31 1742 1543 A 47 ASN H A 47 ASN HD2y 1.0 . 5.01 1743 1544 A 70 SER H A 68 ASN HD2x 1.0 . 5.50 1744 1545 A 19 GLU HGx A 15 GLN HE2y 1.0 . 4.95 1745 1546 A 9 LEU HDx% A 15 GLN HE2y 1.0 . 5.50 1746 1547 A 19 GLU HGy A 15 GLN HE2x 1.0 . 5.30 1747 1548 A 15 GLN HE2y A 15 GLN HGx 1.0 . 3.84 1748 1548 A 15 GLN HE2y A 15 GLN HGy 1.0 . 3.84 1749 1549 A 15 GLN HA A 15 GLN HE2x 1.0 . 5.50 1750 1550 A 5 PHE HE% A 15 GLN HE2x 1.0 . 4.77 1751 1551 A 15 GLN HBx A 15 GLN HE2x 1.0 . 5.50 1752 1552 A 9 LEU HDx% A 15 GLN HE2x 1.0 . 5.46 1753 1553 A 18 ALA HB% A 15 GLN HE2x 1.0 . 5.50 1754 1554 A 79 THR HA A 82 GLN HE2x 1.0 . 5.50 1755 1555 A 82 GLN HE2x A 82 GLN HBx 1.0 . 5.50 1756 1555 A 82 GLN HBy A 82 GLN HE2x 1.0 . 5.50 1757 1556 A 110 GLY H A 109 THR HB 1.0 . 4.13 1758 1557 A 76 VAL H A 75 GLY H 1.0 . 3.48 1759 1558 A 74 CYS HBx A 75 GLY H 1.0 . 4.39 1760 1559 A 74 CYS HBy A 75 GLY H 1.0 . 4.14 1761 1560 A 75 GLY H A 78 LYS HBx 1.0 . 5.36 1762 1560 A 78 LYS HBy A 75 GLY H 1.0 . 5.36 1763 1561 A 81 ARG HE A 81 ARG HA 1.0 . 5.50 1764 1562 A 76 VAL HGx% A 57 GLN HE2y 1.0 . 5.50 1765 1563 A 81 ARG H A 81 ARG HE 1.0 . 5.50 1766 1564 A 57 GLN HA A 57 GLN HE2x 1.0 . 5.50 1767 1565 A 32 HIS H A 33 SER H 1.0 . 5.11 1768 1566 A 33 SER H A 33 SER HBx 1.0 . 4.20 1769 1567 A 32 HIS HBy A 33 SER H 1.0 . 4.25 1770 1568 A 31 ALA HB% A 33 SER H 1.0 . 4.76 1771 1569 A 76 VAL HGy% A 57 GLN HE2x 1.0 . 5.50 1772 1570 A 50 GLY H A 48 GLU HGx 1.0 . 5.50 1773 1570 A 48 GLU HGy A 50 GLY H 1.0 . 5.50 1774 1571 A 46 PHE HBy A 50 GLY H 1.0 . 4.59 1775 1572 A 51 ALA HB% A 50 GLY H 1.0 . 4.61 1776 1573 A 53 ALA H A 50 GLY H 1.0 . 5.50 1777 1574 A 49 ASP HBx A 50 GLY H 1.0 . 3.69 1778 1575 A 48 GLU HBy A 50 GLY H 1.0 . 5.50 1779 1576 A 29 LEU H A 30 VAL H 1.0 . 3.31 1780 1577 A 25 TYR HA A 30 VAL H 1.0 . 4.64 1781 1578 A 28 GLY HAx A 30 VAL H 1.0 . 4.73 1782 1579 A 29 LEU HBy A 30 VAL H 1.0 . 3.87 1783 1580 A 29 LEU HBx A 30 VAL H 1.0 . 4.08 1784 1581 A 30 VAL HGx% A 30 VAL H 1.0 . 3.87 1785 1582 A 88 THR HB A 87 GLY H 1.0 . 3.74 1786 1583 A 87 GLY H A 86 GLN HBx 1.0 . 4.26 1787 1583 A 86 GLN HBy A 87 GLY H 1.0 . 4.26 1788 1584 A 26 VAL H A 28 GLY H 1.0 . 5.42 1789 1585 A 29 LEU H A 28 GLY H 1.0 . 3.41 1790 1586 A 30 VAL H A 28 GLY H 1.0 . 4.55 1791 1587 A 28 GLY H A 26 VAL HGx% 1.0 . 5.10 1792 1588 A 25 TYR HA A 28 GLY H 1.0 . 5.50 1793 1589 A 13 LEU H A 12 GLY H 1.0 . 3.38 1794 1590 A 10 ASP HBy A 12 GLY H 1.0 . 5.50 1795 1591 A 11 ALA HB% A 12 GLY H 1.0 . 4.22 1796 1592 A 13 LEU HDy% A 12 GLY H 1.0 . 5.50 1797 1593 A 80 TYR HD% A 80 TYR H 1.0 . 3.51 1798 1594 A 80 TYR HD% A 77 MET HA 1.0 . 4.21 1799 1595 A 80 TYR HD% A 81 ARG HGx 1.0 . 4.25 1800 1596 A 80 TYR HD% A 53 ALA HB% 1.0 . 4.00 1801 1597 A 80 TYR HD% A 76 VAL HGx% 1.0 . 4.77 1802 1598 A 80 TYR HD% A 54 VAL HGx% 1.0 . 4.17 1803 1599 A 80 TYR HD% A 54 VAL HGy% 1.0 . 3.54 1804 1600 A 111 TYR HD% A 112 THR HA 1.0 . 5.50 1805 1601 A 25 TYR HA A 25 TYR HD% 1.0 . 3.06 1806 1602 A 25 TYR HD% A 22 ASP HA 1.0 . 3.42 1807 1603 A 25 TYR HD% A 4 ASN HBx 1.0 . 4.14 1808 1603 A 4 ASN HBy A 25 TYR HD% 1.0 . 4.14 1809 1604 A 25 TYR HD% A 21 LEU HG 1.0 . 4.35 1810 1605 A 25 TYR HD% A 25 TYR H 1.0 . 3.62 1811 1606 A 30 VAL HGy% A 25 TYR HD% 1.0 . 3.47 1812 1607 A 62 ASP H A 72 PHE HE% 1.0 . 4.81 1813 1608 A 72 PHE HZ A 72 PHE HE% 1.0 . 2.40 1814 1609 A 61 SER HBy A 72 PHE HE% 1.0 . 4.53 1815 1610 A 61 SER HBx A 72 PHE HE% 1.0 . 4.69 1816 1611 A 66 VAL HGy% A 72 PHE HE% 1.0 . 4.51 1817 1612 A 63 LEU HDy% A 72 PHE HE% 1.0 . 3.97 1818 1613 A 5 PHE HD% A 9 LEU HDx% 1.0 . 3.63 1819 1614 A 46 PHE HD% A 46 PHE HA 1.0 . 4.11 1820 1615 A 46 PHE HD% A 43 LEU HA 1.0 . 3.33 1821 1616 A 46 PHE HD% A 43 LEU HDy% 1.0 . 4.18 1822 1617 A 63 LEU HDx% A 72 PHE HE% 1.0 . 5.27 1823 1618 A 72 PHE HD% A 72 PHE HA 1.0 . 3.70 1824 1619 A 5 PHE HE% A 15 GLN HE2y 1.0 . 4.09 1825 1620 A 5 PHE HE% A 19 GLU HA 1.0 . 3.62 1826 1621 A 5 PHE HE% A 18 ALA HB% 1.0 . 3.74 1827 1622 A 66 VAL HGx% A 72 PHE HD% 1.0 . 3.36 1828 1623 A 5 PHE HD% A 6 GLN H 1.0 . 4.76 1829 1624 A 5 PHE HD% A 22 ASP HBx 1.0 . 3.94 1830 1625 A 5 PHE HD% A 6 GLN HBy 1.0 . 4.48 1831 1626 A 5 PHE HD% A 18 ALA HB% 1.0 . 3.77 1832 1627 A 5 PHE HD% A 19 GLU H 1.0 . 4.63 1833 1628 A 46 PHE HD% A 51 ALA H 1.0 . 5.39 1834 1629 A 58 PHE HE% A 73 LEU HDy% 1.0 . 3.72 1835 1630 A 13 LEU HA A 46 PHE HE% 1.0 . 5.22 1836 1631 A 43 LEU HBy A 46 PHE HE% 1.0 . 4.95 1837 1632 A 43 LEU HA A 46 PHE HE% 1.0 . 3.76 1838 1633 A 73 LEU H A 58 PHE HD% 1.0 . 4.08 1839 1634 A 73 LEU HBy A 58 PHE HD% 1.0 . 4.50 1840 1635 A 24 ILE HD1% A 58 PHE HD% 1.0 . 3.32 1841 1636 A 73 LEU HDx% A 58 PHE HD% 1.0 . 4.91 1842 1637 A 73 LEU HDy% A 58 PHE HD% 1.0 . 3.84 1843 1638 A 63 LEU HDy% A 58 PHE HD% 1.0 . 4.29 1844 1639 A 63 LEU HDy% A 72 PHE HZ 1.0 . 4.84 1845 1640 A 61 SER HBy A 72 PHE HZ 1.0 . 4.69 1846 1641 A 73 LEU H A 58 PHE HZ 1.0 . 5.50 1847 1642 A 63 LEU HDy% A 58 PHE HZ 1.0 . 4.95 1848 1643 A 63 LEU HDx% A 58 PHE HZ 1.0 . 4.15 1849 1644 A 69 LYS HBx A 58 PHE HZ 1.0 . 3.59 1850 1645 A 58 PHE HZ A 69 LYS HDx 1.0 . 4.49 1851 1645 A 69 LYS HDy A 58 PHE HZ 1.0 . 4.49 1852 1646 A 30 VAL HGx% A 58 PHE HZ 1.0 . 3.56 1853 1647 A 73 LEU HDx% A 58 PHE HZ 1.0 . 5.50 1854 1648 A 33 SER HA A 32 HIS HD2 1.0 . 5.50 1855 1649 A 32 HIS HBy A 32 HIS HD2 1.0 . 3.69 1856 1650 A 32 HIS H A 32 HIS HD2 1.0 . 5.50 1857 1651 A 32 HIS HA A 32 HIS HD2 1.0 . 5.50 1858 1652 A 25 TYR HE% A 22 ASP HA 1.0 . 5.11 1859 1653 A 25 TYR HE% A 32 HIS HA 1.0 . 3.67 1860 1654 A 25 TYR HE% A 4 ASN HBx 1.0 . 3.89 1861 1654 A 4 ASN HBy A 25 TYR HE% 1.0 . 3.89 1862 1655 A 25 TYR H A 25 TYR HE% 1.0 . 5.03 1863 1656 A 80 TYR HE% A 77 MET HA 1.0 . 3.65 1864 1657 A 80 TYR HE% A 77 MET HGx 1.0 . 4.44 1865 1658 A 80 TYR HE% A 53 ALA HB% 1.0 . 3.10 1866 1659 A 80 TYR HE% A 76 VAL HGx% 1.0 . 5.21 1867 1660 A 80 TYR HE% A 54 VAL HGy% 1.0 . 4.27 stop_ save_