data_nef_c25036_2mqj 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 2MQJ 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 8 HIS start . . 2 A 9 MET middle . . 3 A 10 LYS middle . . 4 A 11 ILE middle . . 5 A 12 LYS middle . . 6 A 13 ILE middle . . 7 A 14 VAL middle . . 8 A 15 PRO middle . false 9 A 16 ALA middle . . 10 A 17 VAL middle . . 11 A 18 GLY middle . false 12 A 19 GLY middle . false 13 A 20 GLY middle . false 14 A 21 SER middle . . 15 A 22 PRO middle . false 16 A 23 LEU middle . . 17 A 24 GLU middle . . 18 A 25 LEU middle . . 19 A 26 GLU middle . . 20 A 27 VAL middle . . 21 A 28 ALA middle . . 22 A 29 PRO middle . false 23 A 30 ASN middle . . 24 A 31 ALA middle . . 25 A 32 THR middle . . 26 A 33 VAL middle . . 27 A 34 GLY middle . false 28 A 35 ALA middle . . 29 A 36 VAL middle . . 30 A 37 ARG middle . . 31 A 38 THR middle . . 32 A 39 LYS middle . . 33 A 40 VAL middle . . 34 A 41 CYS middle . . 35 A 42 ALA middle . . 36 A 43 MET middle . . 37 A 44 LYS middle . . 38 A 45 LYS middle . . 39 A 46 LEU middle . . 40 A 47 PRO middle . false 41 A 48 PRO middle . false 42 A 49 ASP middle . . 43 A 50 THR middle . . 44 A 51 THR middle . . 45 A 52 ARG middle . . 46 A 53 LEU middle . . 47 A 54 THR middle . . 48 A 55 TYR middle . . 49 A 56 LYS middle . . 50 A 57 GLY middle . false 51 A 58 ARG middle . . 52 A 59 ALA middle . . 53 A 60 LEU middle . . 54 A 61 LYS middle . . 55 A 62 ASP middle . . 56 A 63 THR middle . . 57 A 64 GLU middle . . 58 A 65 THR middle . . 59 A 66 LEU middle . . 60 A 67 GLU middle . . 61 A 68 SER middle . . 62 A 69 LEU middle . . 63 A 70 GLY middle . false 64 A 71 VAL middle . . 65 A 72 ALA middle . . 66 A 73 ASP middle . . 67 A 74 GLY middle . false 68 A 75 ASP middle . . 69 A 76 LYS middle . . 70 A 77 PHE middle . . 71 A 78 VAL middle . . 72 A 79 LEU middle . . 73 A 80 ILE middle . . 74 A 81 THR middle . . 75 A 82 ARG middle . . 76 A 83 THR middle . . 77 A 84 VAL middle . . 78 A 85 GLY middle . false 79 A 86 GLY middle . false 80 A 87 CYS middle . . 81 A 88 GLY middle . false 82 A 89 GLU middle . . 83 A 90 PRO middle . false 84 A 91 ILE middle . . 85 A 92 ARG middle . . 86 A 93 ARG middle . . 87 A 94 ALA middle . . 88 A 95 ALA end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 8 HIS HA H 1 4.797 0.02 A 8 HIS HBx H 1 3.006 0.02 A 8 HIS HBy H 1 3.006 0.02 A 8 HIS CA C 13 55.345 5.00 A 8 HIS CB C 13 31.142 5.00 A 9 MET H H 1 8.901 0.02 A 9 MET HA H 1 4.659 0.02 A 9 MET HBx H 1 1.903 0.02 A 9 MET HBy H 1 1.903 0.02 A 9 MET HE% H 1 2.261 0.02 A 9 MET CA C 13 54.872 5.00 A 9 MET CB C 13 35.656 5.00 A 9 MET N N 15 120.294 0.20 A 10 LYS H H 1 8.918 0.02 A 10 LYS HA H 1 5.316 0.02 A 10 LYS HBx H 1 1.634 0.02 A 10 LYS HBy H 1 1.634 0.02 A 10 LYS HEx H 1 2.924 0.02 A 10 LYS HEy H 1 2.924 0.02 A 10 LYS HGy H 1 1.418 0.02 A 10 LYS HGx H 1 1.230 0.02 A 10 LYS CA C 13 54.997 5.00 A 10 LYS CB C 13 34.200 5.00 A 10 LYS CD C 13 29.271 5.00 A 10 LYS CE C 13 41.342 5.00 A 10 LYS CG C 13 24.778 5.00 A 10 LYS N N 15 122.537 0.20 A 11 ILE H H 1 8.660 0.02 A 11 ILE HA H 1 4.959 0.02 A 11 ILE HB H 1 1.831 0.02 A 11 ILE HD1% H 1 0.691 0.02 A 11 ILE HG2% H 1 0.917 0.02 A 11 ILE CA C 13 58.727 5.00 A 11 ILE CB C 13 41.588 5.00 A 11 ILE CD1 C 13 13.983 5.00 A 11 ILE CG1 C 13 24.814 5.00 A 11 ILE CG2 C 13 17.694 5.00 A 11 ILE N N 15 116.404 0.20 A 12 LYS H H 1 8.749 0.02 A 12 LYS HA H 1 5.228 0.02 A 12 LYS HBx H 1 1.623 0.02 A 12 LYS HBy H 1 1.623 0.02 A 12 LYS HEx H 1 2.928 0.02 A 12 LYS HEy H 1 2.928 0.02 A 12 LYS HGy H 1 1.424 0.02 A 12 LYS HGx H 1 1.265 0.02 A 12 LYS CA C 13 54.358 5.00 A 12 LYS CB C 13 35.887 5.00 A 12 LYS CD C 13 29.674 5.00 A 12 LYS CE C 13 41.611 5.00 A 12 LYS CG C 13 25.197 5.00 A 12 LYS N N 15 120.261 0.20 A 13 ILE H H 1 9.325 0.02 A 13 ILE HA H 1 4.980 0.02 A 13 ILE HB H 1 2.125 0.02 A 13 ILE HD1% H 1 0.624 0.02 A 13 ILE HG1x H 1 1.350 0.02 A 13 ILE HG2% H 1 0.807 0.02 A 13 ILE CA C 13 58.882 5.00 A 13 ILE CB C 13 37.469 5.00 A 13 ILE CG1 C 13 27.416 5.00 A 13 ILE CG2 C 13 19.289 5.00 A 13 ILE N N 15 123.207 0.20 A 14 VAL H H 1 9.199 0.02 A 14 VAL CA C 13 58.808 5.00 A 14 VAL CB C 13 33.939 5.00 A 14 VAL N N 15 126.755 0.20 A 15 PRO HA H 1 4.790 0.02 A 15 PRO HBx H 1 2.048 0.02 A 15 PRO HBy H 1 2.287 0.02 A 15 PRO CA C 13 61.984 5.00 A 15 PRO CB C 13 32.080 5.00 A 15 PRO CD C 13 50.242 5.00 A 16 ALA H H 1 8.491 0.02 A 16 ALA HA H 1 4.109 0.02 A 16 ALA HB% H 1 1.464 0.02 A 16 ALA CA C 13 54.058 5.00 A 16 ALA CB C 13 19.672 5.00 A 16 ALA N N 15 125.807 0.20 A 17 VAL H H 1 7.881 0.02 A 17 VAL HA H 1 4.292 0.02 A 17 VAL HB H 1 2.058 0.02 A 17 VAL HGx% H 1 0.948 0.02 A 17 VAL HGy% H 1 0.948 0.02 A 17 VAL CA C 13 61.248 5.00 A 17 VAL CB C 13 34.072 5.00 A 17 VAL CGy C 13 20.399 5.00 A 17 VAL N N 15 113.674 0.20 A 18 GLY H H 1 8.678 0.02 A 18 GLY HAx H 1 4.010 0.02 A 18 GLY HAy H 1 4.010 0.02 A 18 GLY CA C 13 45.373 5.00 A 18 GLY N N 15 112.520 0.20 A 19 GLY H H 1 8.384 0.02 A 19 GLY N N 15 108.636 0.20 A 20 GLY H H 1 8.390 0.02 A 20 GLY HAx H 1 4.008 0.02 A 20 GLY HAy H 1 4.008 0.02 A 20 GLY CA C 13 44.519 5.00 A 20 GLY N N 15 108.905 0.20 A 21 SER H H 1 8.532 0.02 A 21 SER CA C 13 57.063 5.00 A 21 SER CB C 13 63.292 5.00 A 21 SER N N 15 116.655 0.20 A 22 PRO HA H 1 4.743 0.02 A 22 PRO HBx H 1 1.852 0.02 A 22 PRO HBy H 1 2.183 0.02 A 22 PRO HDx H 1 3.654 0.02 A 22 PRO HDy H 1 3.654 0.02 A 22 PRO CA C 13 62.603 5.00 A 22 PRO CB C 13 32.625 5.00 A 22 PRO CD C 13 50.436 5.00 A 22 PRO CG C 13 27.112 5.00 A 23 LEU H H 1 8.626 0.02 A 23 LEU HA H 1 4.724 0.02 A 23 LEU HB2 H 1 1.603 0.02 A 23 LEU HB3 H 1 1.603 0.02 A 23 LEU HDx% H 1 0.951 0.02 A 23 LEU HDy% H 1 0.951 0.02 A 23 LEU CA C 13 53.729 5.00 A 23 LEU CB C 13 44.926 5.00 A 23 LEU CDx C 13 24.956 5.00 A 23 LEU CDy C 13 24.956 5.00 A 23 LEU CG C 13 27.136 5.00 A 23 LEU N N 15 123.040 0.20 A 24 GLU H H 1 8.786 0.02 A 24 GLU HA H 1 5.226 0.02 A 24 GLU HBx H 1 1.904 0.02 A 24 GLU HBy H 1 1.904 0.02 A 24 GLU HGx H 1 2.150 0.02 A 24 GLU HGy H 1 2.150 0.02 A 24 GLU CA C 13 55.096 5.00 A 24 GLU CB C 13 31.982 5.00 A 24 GLU CG C 13 37.189 5.00 A 24 GLU N N 15 125.487 0.20 A 25 LEU H H 1 8.720 0.02 A 25 LEU HA H 1 4.699 0.02 A 25 LEU HBy H 1 1.407 0.02 A 25 LEU HBx H 1 1.214 0.02 A 25 LEU HDx% H 1 0.773 0.02 A 25 LEU HDy% H 1 0.773 0.02 A 25 LEU CA C 13 53.350 5.00 A 25 LEU CB C 13 46.365 5.00 A 25 LEU CDx C 13 24.644 5.00 A 25 LEU CDy C 13 24.644 5.00 A 25 LEU CG C 13 26.886 5.00 A 25 LEU N N 15 124.808 0.20 A 26 GLU H H 1 8.452 0.02 A 26 GLU HA H 1 5.074 0.02 A 26 GLU HBx H 1 1.841 0.02 A 26 GLU HBy H 1 1.841 0.02 A 26 GLU HGy H 1 2.203 0.02 A 26 GLU HGx H 1 1.995 0.02 A 26 GLU CA C 13 55.353 5.00 A 26 GLU CB C 13 30.623 5.00 A 26 GLU CG C 13 36.711 5.00 A 26 GLU N N 15 122.791 0.20 A 27 VAL H H 1 9.040 0.02 A 27 VAL HA H 1 4.609 0.02 A 27 VAL HB H 1 1.926 0.02 A 27 VAL HGx% H 1 0.681 0.02 A 27 VAL HGy% H 1 0.565 0.02 A 27 VAL CA C 13 58.764 5.00 A 27 VAL CB C 13 35.753 5.00 A 27 VAL CGx C 13 18.856 5.00 A 27 VAL CGy C 13 21.916 5.00 A 27 VAL N N 15 119.526 0.20 A 28 ALA H H 1 8.243 0.02 A 28 ALA CA C 13 49.749 5.00 A 28 ALA CB C 13 19.234 5.00 A 28 ALA N N 15 125.087 0.20 A 29 PRO HA H 1 4.142 0.02 A 29 PRO HBx H 1 1.935 0.02 A 29 PRO HBy H 1 2.309 0.02 A 29 PRO CA C 13 64.626 5.00 A 29 PRO CB C 13 31.701 5.00 A 29 PRO CD C 13 49.896 5.00 A 29 PRO CG C 13 27.467 5.00 A 30 ASN H H 1 7.668 0.02 A 30 ASN HA H 1 4.648 0.02 A 30 ASN HBy H 1 3.088 0.02 A 30 ASN HBx H 1 2.735 0.02 A 30 ASN CA C 13 52.098 5.00 A 30 ASN CB C 13 36.994 5.00 A 30 ASN N N 15 109.945 0.20 A 31 ALA H H 1 7.678 0.02 A 31 ALA HA H 1 4.294 0.02 A 31 ALA HB% H 1 1.428 0.02 A 31 ALA CA C 13 52.498 5.00 A 31 ALA CB C 13 18.992 5.00 A 31 ALA N N 15 122.630 0.20 A 32 THR H H 1 7.745 0.02 A 32 THR HA H 1 4.859 0.02 A 32 THR HG2% H 1 1.228 0.02 A 32 THR CA C 13 59.244 5.00 A 32 THR CB C 13 71.089 5.00 A 32 THR CG2 C 13 21.526 5.00 A 32 THR N N 15 108.310 0.20 A 33 VAL H H 1 8.940 0.02 A 33 VAL HA H 1 3.179 0.02 A 33 VAL HB H 1 2.404 0.02 A 33 VAL HGx% H 1 0.926 0.02 A 33 VAL HGy% H 1 0.802 0.02 A 33 VAL CA C 13 66.683 5.00 A 33 VAL CB C 13 31.460 5.00 A 33 VAL CGx C 13 24.798 5.00 A 33 VAL N N 15 121.284 0.20 A 34 GLY H H 1 9.397 0.02 A 34 GLY HAy H 1 3.869 0.02 A 34 GLY HAx H 1 3.691 0.02 A 34 GLY CA C 13 46.942 5.00 A 34 GLY N N 15 107.393 0.20 A 35 ALA H H 1 8.044 0.02 A 35 ALA HA H 1 4.107 0.02 A 35 ALA HB% H 1 1.548 0.02 A 35 ALA CA C 13 55.200 5.00 A 35 ALA CB C 13 18.206 5.00 A 35 ALA N N 15 126.449 0.20 A 36 VAL H H 1 7.726 0.02 A 36 VAL HA H 1 3.371 0.02 A 36 VAL HB H 1 2.029 0.02 A 36 VAL HGx% H 1 0.847 0.02 A 36 VAL HGy% H 1 0.550 0.02 A 36 VAL CA C 13 66.668 5.00 A 36 VAL CB C 13 31.570 5.00 A 36 VAL CGx C 13 21.662 5.00 A 36 VAL N N 15 119.722 0.20 A 37 ARG H H 1 9.487 0.02 A 37 ARG HA H 1 3.586 0.02 A 37 ARG HBx H 1 1.627 0.02 A 37 ARG HBy H 1 1.627 0.02 A 37 ARG HGx H 1 2.151 0.02 A 37 ARG HGy H 1 2.151 0.02 A 37 ARG CA C 13 60.826 5.00 A 37 ARG CB C 13 31.997 5.00 A 37 ARG CD C 13 42.767 5.00 A 37 ARG CG C 13 27.608 5.00 A 37 ARG N N 15 120.500 0.20 A 38 THR H H 1 8.621 0.02 A 38 THR HA H 1 4.224 0.02 A 38 THR HB H 1 3.794 0.02 A 38 THR HG2% H 1 1.257 0.02 A 38 THR CA C 13 68.761 5.00 A 38 THR CB C 13 66.850 5.00 A 38 THR CG2 C 13 21.200 5.00 A 38 THR N N 15 114.379 0.20 A 39 LYS H H 1 7.499 0.02 A 39 LYS HA H 1 4.223 0.02 A 39 LYS HBx H 1 1.991 0.02 A 39 LYS HBy H 1 1.991 0.02 A 39 LYS HDx H 1 1.691 0.02 A 39 LYS HDy H 1 1.691 0.02 A 39 LYS HEx H 1 3.009 0.02 A 39 LYS HEy H 1 3.009 0.02 A 39 LYS HGx H 1 1.506 0.02 A 39 LYS HGy H 1 1.506 0.02 A 39 LYS CA C 13 59.264 5.00 A 39 LYS CB C 13 32.003 5.00 A 39 LYS CD C 13 29.023 5.00 A 39 LYS CG C 13 24.506 5.00 A 39 LYS N N 15 123.995 0.20 A 40 VAL H H 1 8.553 0.02 A 40 VAL HA H 1 3.501 0.02 A 40 VAL HB H 1 2.171 0.02 A 40 VAL HGx% H 1 1.027 0.02 A 40 VAL HGy% H 1 0.860 0.02 A 40 VAL CA C 13 66.733 5.00 A 40 VAL CB C 13 31.320 5.00 A 40 VAL CGx C 13 23.964 5.00 A 40 VAL N N 15 118.912 0.20 A 41 CYS H H 1 8.388 0.02 A 41 CYS HA H 1 3.932 0.02 A 41 CYS HBy H 1 3.184 0.02 A 41 CYS HBx H 1 2.997 0.02 A 41 CYS CA C 13 65.365 5.00 A 41 CYS CB C 13 25.920 5.00 A 41 CYS N N 15 116.608 0.20 A 42 ALA H H 1 7.844 0.02 A 42 ALA HA H 1 4.266 0.02 A 42 ALA HB% H 1 1.564 0.02 A 42 ALA CA C 13 54.860 5.00 A 42 ALA CB C 13 18.223 5.00 A 42 ALA N N 15 121.216 0.20 A 43 MET H H 1 8.378 0.02 A 43 MET HA H 1 4.116 0.02 A 43 MET HBy H 1 2.233 0.02 A 43 MET HBx H 1 2.109 0.02 A 43 MET HGy H 1 2.861 0.02 A 43 MET HGx H 1 2.579 0.02 A 43 MET CA C 13 59.052 5.00 A 43 MET CB C 13 34.028 5.00 A 43 MET N N 15 117.555 0.20 A 44 LYS H H 1 8.068 0.02 A 44 LYS HA H 1 4.354 0.02 A 44 LYS HBy H 1 2.013 0.02 A 44 LYS HBx H 1 1.616 0.02 A 44 LYS HEx H 1 2.857 0.02 A 44 LYS HEy H 1 2.857 0.02 A 44 LYS HGx H 1 1.376 0.02 A 44 LYS HGy H 1 1.376 0.02 A 44 LYS CA C 13 55.116 5.00 A 44 LYS CB C 13 32.497 5.00 A 44 LYS CD C 13 28.452 5.00 A 44 LYS CG C 13 24.398 5.00 A 44 LYS N N 15 114.814 0.20 A 45 LYS H H 1 7.633 0.02 A 45 LYS HA H 1 3.974 0.02 A 45 LYS HBy H 1 2.086 0.02 A 45 LYS HBx H 1 1.863 0.02 A 45 LYS HDx H 1 1.710 0.02 A 45 LYS HDy H 1 1.710 0.02 A 45 LYS HEx H 1 3.026 0.02 A 45 LYS HEy H 1 3.026 0.02 A 45 LYS HGx H 1 1.367 0.02 A 45 LYS HGy H 1 1.367 0.02 A 45 LYS CA C 13 56.966 5.00 A 45 LYS CB C 13 28.754 5.00 A 45 LYS CE C 13 42.197 5.00 A 45 LYS CG C 13 24.599 5.00 A 45 LYS N N 15 118.534 0.20 A 46 LEU H H 1 8.464 0.02 A 46 LEU CA C 13 51.248 5.00 A 46 LEU N N 15 119.644 0.20 A 48 PRO HA H 1 4.634 0.02 A 48 PRO HBx H 1 2.120 0.02 A 48 PRO HBy H 1 2.295 0.02 A 48 PRO CA C 13 64.948 5.00 A 48 PRO CB C 13 31.877 5.00 A 48 PRO CD C 13 51.017 5.00 A 48 PRO CG C 13 27.663 5.00 A 49 ASP H H 1 8.757 0.02 A 49 ASP HA H 1 4.548 0.02 A 49 ASP HBx H 1 2.723 0.02 A 49 ASP HBy H 1 2.723 0.02 A 49 ASP CA C 13 56.103 5.00 A 49 ASP CB C 13 40.001 5.00 A 49 ASP N N 15 114.068 0.20 A 50 THR H H 1 7.248 0.02 A 50 THR HA H 1 4.587 0.02 A 50 THR HG2% H 1 1.118 0.02 A 50 THR CA C 13 60.473 5.00 A 50 THR CB C 13 69.108 5.00 A 50 THR CG2 C 13 21.086 5.00 A 50 THR N N 15 104.972 0.20 A 51 THR H H 1 7.099 0.02 A 51 THR HA H 1 5.008 0.02 A 51 THR HB H 1 3.759 0.02 A 51 THR HG2% H 1 1.068 0.02 A 51 THR CA C 13 62.480 5.00 A 51 THR CB C 13 70.512 5.00 A 51 THR CG2 C 13 21.934 5.00 A 51 THR N N 15 117.713 0.20 A 52 ARG H H 1 9.191 0.02 A 52 ARG HA H 1 4.704 0.02 A 52 ARG HBy H 1 1.859 0.02 A 52 ARG HBx H 1 1.686 0.02 A 52 ARG HDx H 1 3.160 0.02 A 52 ARG HDy H 1 3.160 0.02 A 52 ARG CA C 13 53.689 5.00 A 52 ARG CB C 13 34.058 5.00 A 52 ARG CD C 13 42.927 5.00 A 52 ARG CG C 13 26.729 5.00 A 52 ARG N N 15 125.497 0.20 A 53 LEU H H 1 8.768 0.02 A 53 LEU HA H 1 5.776 0.02 A 53 LEU HBy H 1 1.504 0.02 A 53 LEU HBx H 1 1.384 0.02 A 53 LEU HD11 H 1 0.852 0.02 A 53 LEU HD12 H 1 0.694 0.02 A 53 LEU HD13 H 1 0.852 0.02 A 53 LEU CA C 13 52.877 5.00 A 53 LEU CB C 13 46.610 5.00 A 53 LEU CDx C 13 24.999 5.00 A 53 LEU CDy C 13 24.999 5.00 A 53 LEU N N 15 119.114 0.20 A 54 THR H H 1 9.201 0.02 A 54 THR HA H 1 5.160 0.02 A 54 THR HB H 1 3.797 0.02 A 54 THR HG2% H 1 0.966 0.02 A 54 THR CA C 13 59.262 5.00 A 54 THR CB C 13 71.910 5.00 A 54 THR CG2 C 13 20.657 5.00 A 54 THR N N 15 111.738 0.20 A 55 TYR H H 1 8.180 0.02 A 55 TYR HA H 1 4.958 0.02 A 55 TYR HBy H 1 2.825 0.02 A 55 TYR HBx H 1 2.690 0.02 A 55 TYR CA C 13 55.903 5.00 A 55 TYR CB C 13 42.704 5.00 A 55 TYR N N 15 119.694 0.20 A 56 LYS H H 1 9.347 0.02 A 56 LYS HA H 1 3.611 0.02 A 56 LYS HBy H 1 1.696 0.02 A 56 LYS HBx H 1 1.444 0.02 A 56 LYS HEx H 1 2.795 0.02 A 56 LYS HEy H 1 2.795 0.02 A 56 LYS CA C 13 57.341 5.00 A 56 LYS CB C 13 29.698 5.00 A 56 LYS CE C 13 41.994 5.00 A 56 LYS CG C 13 24.713 5.00 A 56 LYS N N 15 127.379 0.20 A 57 GLY H H 1 8.835 0.02 A 57 GLY HAy H 1 4.161 0.02 A 57 GLY HAx H 1 3.491 0.02 A 57 GLY CA C 13 44.962 5.00 A 57 GLY N N 15 103.595 0.20 A 58 ARG H H 1 7.924 0.02 A 58 ARG HA H 1 4.506 0.02 A 58 ARG HBx H 1 2.003 0.02 A 58 ARG HBy H 1 2.003 0.02 A 58 ARG HDy H 1 3.313 0.02 A 58 ARG HDx H 1 3.179 0.02 A 58 ARG HGx H 1 1.694 0.02 A 58 ARG HGy H 1 1.694 0.02 A 58 ARG CA C 13 55.219 5.00 A 58 ARG CB C 13 32.156 5.00 A 58 ARG CD C 13 43.700 5.00 A 58 ARG CG C 13 26.971 5.00 A 58 ARG N N 15 122.348 0.20 A 59 ALA H H 1 8.541 0.02 A 59 ALA HA H 1 4.391 0.02 A 59 ALA HB% H 1 1.381 0.02 A 59 ALA CA C 13 52.182 5.00 A 59 ALA CB C 13 18.341 5.00 A 59 ALA N N 15 125.908 0.20 A 60 LEU H H 1 8.158 0.02 A 60 LEU HA H 1 4.732 0.02 A 60 LEU HBy H 1 1.661 0.02 A 60 LEU HBx H 1 1.501 0.02 A 60 LEU HDx% H 1 0.970 0.02 A 60 LEU HDy% H 1 0.698 0.02 A 60 LEU CA C 13 53.619 5.00 A 60 LEU CB C 13 46.058 5.00 A 60 LEU CDx C 13 25.370 5.00 A 60 LEU CDy C 13 25.370 5.00 A 60 LEU N N 15 121.948 0.20 A 61 LYS H H 1 9.695 0.02 A 61 LYS HA H 1 4.675 0.02 A 61 LYS HBx H 1 1.970 0.02 A 61 LYS HEx H 1 2.953 0.02 A 61 LYS HEy H 1 2.953 0.02 A 61 LYS HGx H 1 1.544 0.02 A 61 LYS HGy H 1 1.544 0.02 A 61 LYS CA C 13 54.737 5.00 A 61 LYS CB C 13 34.123 5.00 A 61 LYS N N 15 123.808 0.20 A 62 ASP H H 1 9.034 0.02 A 62 ASP HA H 1 4.345 0.02 A 62 ASP HBx H 1 2.691 0.02 A 62 ASP HBy H 1 2.691 0.02 A 62 ASP CA C 13 56.179 5.00 A 62 ASP CB C 13 40.660 5.00 A 62 ASP N N 15 121.113 0.20 A 63 THR H H 1 7.206 0.02 A 63 THR HA H 1 4.441 0.02 A 63 THR HB H 1 4.136 0.02 A 63 THR HG2% H 1 1.286 0.02 A 63 THR CA C 13 61.689 5.00 A 63 THR CB C 13 69.027 5.00 A 63 THR CG2 C 13 21.597 5.00 A 63 THR N N 15 103.993 0.20 A 64 GLU H H 1 7.526 0.02 A 64 GLU HA H 1 4.370 0.02 A 64 GLU HBy H 1 2.279 0.02 A 64 GLU HBx H 1 1.891 0.02 A 64 GLU CA C 13 57.504 5.00 A 64 GLU CB C 13 30.158 5.00 A 64 GLU CG C 13 38.609 5.00 A 64 GLU N N 15 121.940 0.20 A 65 THR H H 1 8.370 0.02 A 65 THR HA H 1 5.066 0.02 A 65 THR HB H 1 4.470 0.02 A 65 THR HG2% H 1 1.264 0.02 A 65 THR CA C 13 59.325 5.00 A 65 THR CB C 13 71.446 5.00 A 65 THR CG2 C 13 21.540 5.00 A 65 THR N N 15 110.685 0.20 A 66 LEU H H 1 8.630 0.02 A 66 LEU CB C 13 39.076 5.00 A 66 LEU N N 15 122.201 0.20 A 67 GLU HA H 1 4.297 0.02 A 67 GLU HBy H 1 2.000 0.02 A 67 GLU HBx H 1 1.894 0.02 A 67 GLU HGx H 1 2.207 0.02 A 67 GLU HGy H 1 2.207 0.02 A 67 GLU CA C 13 58.621 5.00 A 67 GLU CB C 13 29.148 5.00 A 67 GLU CG C 13 35.156 5.00 A 68 SER H H 1 8.150 0.02 A 68 SER HA H 1 4.215 0.02 A 68 SER HBx H 1 4.035 0.02 A 68 SER HBy H 1 4.035 0.02 A 68 SER CA C 13 61.236 5.00 A 68 SER CB C 13 62.747 5.00 A 68 SER N N 15 118.837 0.20 A 69 LEU H H 1 7.414 0.02 A 69 LEU HA H 1 4.324 0.02 A 69 LEU HBy H 1 1.891 0.02 A 69 LEU HBx H 1 1.470 0.02 A 69 LEU HDx% H 1 0.907 0.02 A 69 LEU HDy% H 1 0.665 0.02 A 69 LEU CA C 13 55.007 5.00 A 69 LEU CB C 13 44.260 5.00 A 69 LEU CG C 13 25.911 5.00 A 69 LEU N N 15 121.146 0.20 A 70 GLY H H 1 7.816 0.02 A 70 GLY HAy H 1 4.073 0.02 A 70 GLY HAx H 1 3.888 0.02 A 70 GLY CA C 13 45.944 5.00 A 70 GLY N N 15 106.967 0.20 A 71 VAL H H 1 7.034 0.02 A 71 VAL HA H 1 3.873 0.02 A 71 VAL HB H 1 1.594 0.02 A 71 VAL HGx% H 1 0.902 0.02 A 71 VAL HGy% H 1 0.680 0.02 A 71 VAL CA C 13 63.074 5.00 A 71 VAL CB C 13 31.801 5.00 A 71 VAL CGx C 13 22.231 5.00 A 71 VAL N N 15 119.365 0.20 A 72 ALA H H 1 8.594 0.02 A 72 ALA HA H 1 4.703 0.02 A 72 ALA HB% H 1 1.412 0.02 A 72 ALA CA C 13 49.827 5.00 A 72 ALA CB C 13 22.622 5.00 A 72 ALA N N 15 130.355 0.20 A 73 ASP H H 1 8.345 0.02 A 73 ASP HA H 1 4.413 0.02 A 73 ASP HB2 H 1 2.663 0.02 A 73 ASP HB3 H 1 2.663 0.02 A 73 ASP CA C 13 56.113 5.00 A 73 ASP CB C 13 42.038 5.00 A 73 ASP N N 15 117.729 0.20 A 74 GLY H H 1 9.551 0.02 A 74 GLY HAy H 1 4.373 0.02 A 74 GLY HAx H 1 3.599 0.02 A 74 GLY CA C 13 44.919 5.00 A 74 GLY N N 15 115.397 0.20 A 75 ASP H H 1 8.188 0.02 A 75 ASP HA H 1 4.722 0.02 A 75 ASP HBy H 1 3.239 0.02 A 75 ASP HBx H 1 2.821 0.02 A 75 ASP CA C 13 55.163 5.00 A 75 ASP CB C 13 42.864 5.00 A 75 ASP N N 15 121.472 0.20 A 76 LYS H H 1 8.275 0.02 A 76 LYS HA H 1 5.596 0.02 A 76 LYS HBx H 1 1.722 0.02 A 76 LYS HBy H 1 1.722 0.02 A 76 LYS HEx H 1 2.946 0.02 A 76 LYS HEy H 1 2.946 0.02 A 76 LYS HGy H 1 1.508 0.02 A 76 LYS HGx H 1 1.345 0.02 A 76 LYS CA C 13 54.551 5.00 A 76 LYS CB C 13 35.494 5.00 A 76 LYS CD C 13 29.396 5.00 A 76 LYS CE C 13 41.577 5.00 A 76 LYS CG C 13 24.648 5.00 A 76 LYS N N 15 115.622 0.20 A 77 PHE H H 1 9.409 0.02 A 77 PHE HA H 1 5.370 0.02 A 77 PHE HBx H 1 3.017 0.02 A 77 PHE HBy H 1 3.017 0.02 A 77 PHE CA C 13 55.184 5.00 A 77 PHE CB C 13 42.260 5.00 A 77 PHE N N 15 122.784 0.20 A 78 VAL H H 1 8.598 0.02 A 78 VAL HA H 1 4.842 0.02 A 78 VAL HB H 1 2.137 0.02 A 78 VAL HGx% H 1 0.897 0.02 A 78 VAL HGy% H 1 0.897 0.02 A 78 VAL CA C 13 61.336 5.00 A 78 VAL CB C 13 32.072 5.00 A 78 VAL CGx C 13 21.184 5.00 A 78 VAL N N 15 122.474 0.20 A 79 LEU H H 1 8.432 0.02 A 79 LEU HA H 1 4.937 0.02 A 79 LEU HB2 H 1 1.604 0.02 A 79 LEU HB3 H 1 1.097 0.02 A 79 LEU HDx% H 1 0.701 0.02 A 79 LEU HDy% H 1 0.701 0.02 A 79 LEU CA C 13 53.788 5.00 A 79 LEU CB C 13 45.032 5.00 A 79 LEU CDx C 13 25.213 5.00 A 79 LEU CDy C 13 25.213 5.00 A 79 LEU N N 15 128.361 0.20 A 80 ILE H H 1 9.228 0.02 A 80 ILE HA H 1 4.179 0.02 A 80 ILE HB H 1 1.700 0.02 A 80 ILE HG12 H 1 1.429 0.02 A 80 ILE HG2% H 1 0.881 0.02 A 80 ILE CA C 13 60.278 5.00 A 80 ILE CB C 13 40.469 5.00 A 80 ILE CD1 C 13 13.126 5.00 A 80 ILE CG2 C 13 17.358 5.00 A 80 ILE N N 15 129.558 0.20 A 81 THR H H 1 8.511 0.02 A 81 THR HA H 1 5.017 0.02 A 81 THR HB H 1 4.184 0.02 A 81 THR HG2% H 1 1.171 0.02 A 81 THR CA C 13 59.923 5.00 A 81 THR CB C 13 70.332 5.00 A 81 THR CG2 C 13 21.179 5.00 A 81 THR N N 15 118.269 0.20 A 82 ARG H H 1 8.319 0.02 A 82 ARG HA H 1 4.474 0.02 A 82 ARG HBx H 1 1.801 0.02 A 82 ARG HBy H 1 1.801 0.02 A 82 ARG HDx H 1 3.179 0.02 A 82 ARG HDy H 1 3.179 0.02 A 82 ARG HGx H 1 1.613 0.02 A 82 ARG HGy H 1 1.613 0.02 A 82 ARG CA C 13 55.763 5.00 A 82 ARG CB C 13 31.216 5.00 A 82 ARG CD C 13 43.269 5.00 A 82 ARG CG C 13 26.899 5.00 A 82 ARG N N 15 123.173 0.20 A 83 THR H H 1 8.497 0.02 A 83 THR HA H 1 4.396 0.02 A 83 THR HB H 1 5.252 0.02 A 83 THR HG2% H 1 1.207 0.02 A 83 THR CA C 13 61.720 5.00 A 83 THR CB C 13 69.847 5.00 A 83 THR CG2 C 13 21.115 5.00 A 83 THR N N 15 117.798 0.20 A 84 VAL H H 1 8.394 0.02 A 84 VAL HA H 1 4.167 0.02 A 84 VAL HB H 1 2.086 0.02 A 84 VAL HGx% H 1 0.947 0.02 A 84 VAL HGy% H 1 0.947 0.02 A 84 VAL CA C 13 62.272 5.00 A 84 VAL CB C 13 32.797 5.00 A 84 VAL CGx C 13 20.972 5.00 A 84 VAL CGy C 13 20.972 5.00 A 84 VAL N N 15 123.015 0.20 A 85 GLY H H 1 8.613 0.02 A 85 GLY HAx H 1 4.297 0.02 A 85 GLY CA C 13 45.166 5.00 A 85 GLY N N 15 112.949 0.20 A 86 GLY H H 1 8.494 0.02 A 86 GLY HAx H 1 4.011 0.02 A 86 GLY HAy H 1 4.011 0.02 A 86 GLY CA C 13 45.238 5.00 A 86 GLY N N 15 108.268 0.20 A 87 CYS H H 1 8.482 0.02 A 87 CYS HA H 1 4.559 0.02 A 87 CYS HBx H 1 2.965 0.02 A 87 CYS HBy H 1 2.965 0.02 A 87 CYS CA C 13 58.491 5.00 A 87 CYS CB C 13 28.229 5.00 A 87 CYS N N 15 118.687 0.20 A 88 GLY H H 1 8.594 0.02 A 88 GLY HAx H 1 3.933 0.02 A 88 GLY HAy H 1 3.933 0.02 A 88 GLY CA C 13 45.092 5.00 A 88 GLY N N 15 111.528 0.20 A 89 GLU H H 1 7.974 0.02 A 89 GLU CA C 13 54.258 5.00 A 89 GLU CB C 13 30.604 5.00 A 89 GLU N N 15 119.482 0.20 A 90 PRO HA H 1 4.439 0.02 A 90 PRO HBx H 1 2.282 0.02 A 90 PRO HBy H 1 2.282 0.02 A 90 PRO HDy H 1 3.794 0.02 A 90 PRO HDx H 1 3.677 0.02 A 90 PRO HGy H 1 1.828 0.02 A 90 PRO CA C 13 62.733 5.00 A 90 PRO CB C 13 31.958 5.00 A 90 PRO CD C 13 50.192 5.00 A 90 PRO CG C 13 27.189 5.00 A 91 ILE H H 1 8.298 0.02 A 91 ILE HA H 1 4.072 0.02 A 91 ILE HB H 1 1.792 0.02 A 91 ILE CA C 13 61.101 5.00 A 91 ILE CB C 13 38.380 5.00 A 91 ILE CD1 C 13 12.049 5.00 A 91 ILE CG2 C 13 16.997 5.00 A 91 ILE N N 15 121.704 0.20 A 92 ARG H H 1 8.492 0.02 A 92 ARG HA H 1 4.368 0.02 A 92 ARG HBx H 1 1.780 0.02 A 92 ARG HBy H 1 1.780 0.02 A 92 ARG CA C 13 55.676 5.00 A 92 ARG CB C 13 30.855 5.00 A 92 ARG CD C 13 43.126 5.00 A 92 ARG CG C 13 26.894 5.00 A 92 ARG N N 15 126.325 0.20 A 93 ARG H H 1 8.496 0.02 A 93 ARG HA H 1 4.330 0.02 A 93 ARG CA C 13 55.738 5.00 A 93 ARG CB C 13 30.972 5.00 A 93 ARG CD C 13 43.141 5.00 A 93 ARG CG C 13 26.839 5.00 A 93 ARG N N 15 123.839 0.20 A 94 ALA H H 1 8.479 0.02 A 94 ALA HA H 1 4.304 0.02 A 94 ALA CA C 13 52.150 5.00 A 94 ALA CB C 13 19.168 5.00 A 94 ALA N N 15 126.719 0.20 A 95 ALA H H 1 8.008 0.02 A 95 ALA CA C 13 53.841 5.00 A 95 ALA CB C 13 19.842 5.00 A 95 ALA N N 15 129.249 0.20 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 10 LYS H A 9 MET HA 1.0 1.8 3.6 2 2 A 10 LYS H A 9 MET HBx 1.0 1.8 4.1 3 2 A 10 LYS H A 9 MET HBy 1.0 1.8 4.1 4 3 A 10 LYS H A 10 LYS HA 1.0 1.8 5.1 5 4 A 10 LYS H A 10 LYS HEx 1.0 1.8 5.7 6 4 A 10 LYS H A 10 LYS HEy 1.0 1.8 5.7 7 5 A 10 LYS H A 10 LYS HGy 1.0 1.8 5.7 8 6 A 10 LYS H A 10 LYS HGx 1.0 1.8 5.7 9 7 A 10 LYS H A 11 ILE H 1.0 1.8 6.3 10 8 A 10 LYS H A 27 VAL H 1.0 1.8 6.4 11 9 A 10 LYS H A 74 GLY H 1.0 1.8 5.9 12 10 A 10 LYS H A 73 ASP HA 1.0 1.8 5.5 13 11 A 10 LYS H A 73 ASP HB2 1.0 1.8 6.1 14 11 A 10 LYS H A 73 ASP HB3 1.0 1.8 6.1 15 12 A 10 LYS H A 74 GLY HAx 1.0 1.8 6.4 16 13 A 10 LYS HA A 11 ILE H 1.0 1.8 3.6 17 14 A 11 ILE H A 10 LYS HBx 1.0 1.8 4.7 18 14 A 11 ILE H A 10 LYS HBy 1.0 1.8 4.7 19 15 A 11 ILE H A 10 LYS HEx 1.0 1.8 6.1 20 15 A 10 LYS HEy A 11 ILE H 1.0 1.8 6.1 21 16 A 11 ILE H A 10 LYS HGy 1.0 1.8 5.4 22 17 A 10 LYS HGx A 11 ILE H 1.0 1.8 5.2 23 18 A 10 LYS H A 11 ILE H 1.0 1.8 6.3 24 19 A 11 ILE H A 11 ILE HA 1.0 1.8 4.8 25 20 A 11 ILE H A 25 LEU HA 1.0 1.8 6.0 26 21 A 11 ILE H A 27 VAL H 1.0 1.8 5.0 27 22 A 11 ILE H A 26 GLU HA 1.0 1.8 4.0 28 23 A 11 ILE H A 24 GLU HGx 1.0 1.8 6.1 29 23 A 11 ILE H A 24 GLU HGy 1.0 1.8 6.1 30 24 A 11 ILE H A 25 LEU H 1.0 1.8 4.0 31 25 A 11 ILE H A 24 GLU HA 1.0 1.8 4.8 32 26 A 11 ILE H A 75 ASP H 1.0 1.8 6.3 33 27 A 11 ILE HA A 12 LYS H 1.0 1.8 3.6 34 28 A 12 LYS H A 11 ILE HB 1.0 1.8 4.7 35 29 A 12 LYS H A 11 ILE HD1% 1.0 1.8 5.4 36 30 A 12 LYS H A 11 ILE HG1x 1.0 1.8 5.4 37 30 A 12 LYS H A 11 ILE HG1y 1.0 1.8 5.4 38 31 A 12 LYS H A 12 LYS HA 1.0 1.8 4.8 39 32 A 12 LYS H A 12 LYS HGx 1.0 1.8 5.7 40 33 A 24 GLU HA A 12 LYS H 1.0 1.8 6.0 41 34 A 24 GLU HA A 12 LYS H 1.0 1.8 6.0 42 35 A 12 LYS H A 74 GLY HAy 1.0 1.8 6.4 43 36 A 74 GLY HAx A 12 LYS H 1.0 1.8 6.4 44 37 A 12 LYS H A 76 LYS HA 1.0 1.8 4.0 45 38 A 12 LYS HA A 13 ILE H 1.0 1.8 3.6 46 39 A 13 ILE H A 12 LYS HBx 1.0 1.8 4.0 47 39 A 13 ILE H A 12 LYS HBy 1.0 1.8 4.0 48 40 A 13 ILE H A 12 LYS HEx 1.0 1.8 5.7 49 40 A 13 ILE H A 12 LYS HEy 1.0 1.8 5.7 50 41 A 13 ILE H A 12 LYS HGx 1.0 1.8 5.7 51 41 A 13 ILE H A 12 LYS HGy 1.0 1.8 5.7 52 42 A 13 ILE H A 13 ILE HA 1.0 1.8 4.8 53 43 A 13 ILE H A 13 ILE HB 1.0 1.8 5.4 54 44 A 13 ILE H A 13 ILE HG1x 1.0 1.8 5.7 55 45 A 13 ILE H A 13 ILE HG2% 1.0 1.8 5.7 56 46 A 13 ILE H A 23 LEU H 1.0 1.8 4.0 57 47 A 24 GLU HA A 13 ILE H 1.0 1.8 4.0 58 48 A 25 LEU H A 13 ILE H 1.0 1.8 5.0 59 49 A 13 ILE H A 22 PRO HA 1.0 1.8 5.0 60 50 A 13 ILE H A 22 PRO HBy 1.0 1.8 5.7 61 51 A 13 ILE H A 23 LEU HA 1.0 1.8 6.1 62 52 A 76 LYS HA A 13 ILE H 1.0 1.8 6.5 63 53 A 13 ILE HA A 14 VAL H 1.0 1.8 3.6 64 54 A 13 ILE HB A 14 VAL H 1.0 1.8 4.7 65 55 A 14 VAL H A 13 ILE HG1y 1.0 1.8 5.4 66 55 A 14 VAL H A 13 ILE HG1x 1.0 1.8 5.4 67 56 A 13 ILE HG2% A 14 VAL H 1.0 1.8 5.4 68 57 A 14 VAL H A 22 PRO HBx 1.0 1.8 6.1 69 58 A 14 VAL H A 22 PRO HDx 1.0 1.8 6.4 70 58 A 14 VAL H A 22 PRO HDy 1.0 1.8 6.4 71 59 A 23 LEU H A 14 VAL H 1.0 1.8 6.3 72 60 A 14 VAL H A 77 PHE HA 1.0 1.8 6.1 73 61 A 14 VAL H A 77 PHE HBx 1.0 1.8 6.5 74 61 A 14 VAL H A 77 PHE HBy 1.0 1.8 6.5 75 62 A 76 LYS HA A 14 VAL H 1.0 1.8 6.1 76 63 A 14 VAL H A 79 LEU H 1.0 1.8 4.7 77 64 A 14 VAL H A 78 VAL HA 1.0 1.8 4.0 78 65 A 16 ALA H A 16 ALA HB% 1.0 1.8 5.3 79 66 A 78 VAL HA A 16 ALA H 1.0 1.8 5.5 80 67 A 79 LEU H A 16 ALA H 1.0 1.8 4.5 81 68 A 16 ALA H A 79 LEU HB3 1.0 1.8 6.0 82 69 A 16 ALA H A 80 ILE H 1.0 1.8 6.4 83 70 A 16 ALA H A 81 THR H 1.0 1.8 4.5 84 71 A 16 ALA H A 80 ILE HA 1.0 1.8 4.1 85 72 A 17 VAL H A 16 ALA HA 1.0 1.8 3.8 86 73 A 16 ALA HB% A 17 VAL H 1.0 1.8 4.1 87 74 A 16 ALA H A 17 VAL H 1.0 1.8 6.3 88 75 A 17 VAL H A 21 SER H 1.0 1.8 5.0 89 76 A 18 GLY H A 17 VAL HA 1.0 1.8 3.6 90 77 A 18 GLY H A 17 VAL HB 1.0 1.8 5.4 91 78 A 18 GLY H A 17 VAL HGx% 1.0 1.8 5.4 92 78 A 18 GLY H A 17 VAL HGy% 1.0 1.8 5.4 93 79 A 21 SER H A 20 GLY HAx 1.0 1.8 4.4 94 79 A 21 SER H A 20 GLY HAy 1.0 1.8 4.4 95 80 A 23 LEU H A 22 PRO HA 1.0 1.8 4.6 96 81 A 23 LEU H A 24 GLU H 1.0 1.8 6.3 97 82 A 24 GLU HA A 23 LEU H 1.0 1.8 6.5 98 83 A 23 LEU H A 23 LEU HA 1.0 1.8 4.8 99 84 A 23 LEU H A 23 LEU HB2 1.0 1.8 5.3 100 84 A 23 LEU H A 23 LEU HB3 1.0 1.8 5.3 101 85 A 13 ILE H A 23 LEU H 1.0 1.8 4.0 102 86 A 12 LYS HA A 23 LEU H 1.0 1.8 5.0 103 87 A 23 LEU H A 12 LYS HBx 1.0 1.8 6.0 104 87 A 12 LYS HBy A 23 LEU H 1.0 1.8 6.0 105 88 A 23 LEU HA A 24 GLU H 1.0 1.8 3.6 106 89 A 24 GLU H A 23 LEU HB2 1.0 1.8 4.0 107 89 A 24 GLU H A 23 LEU HB3 1.0 1.8 4.0 108 90 A 24 GLU H A 23 LEU HDx% 1.0 1.8 4.0 109 90 A 24 GLU H A 23 LEU HDy% 1.0 1.8 4.0 110 91 A 24 GLU HA A 24 GLU H 1.0 1.8 5.3 111 92 A 24 GLU H A 24 GLU HBx 1.0 1.8 5.7 112 92 A 24 GLU H A 24 GLU HBy 1.0 1.8 5.7 113 93 A 13 ILE H A 24 GLU H 1.0 1.8 6.3 114 94 A 12 LYS HA A 24 GLU H 1.0 1.8 6.1 115 95 A 25 LEU H A 24 GLU HA 1.0 1.8 3.6 116 96 A 25 LEU H A 24 GLU HBx 1.0 1.8 4.0 117 96 A 25 LEU H A 24 GLU HBy 1.0 1.8 4.0 118 97 A 25 LEU H A 24 GLU HGx 1.0 1.8 5.4 119 97 A 24 GLU HGy A 25 LEU H 1.0 1.8 5.4 120 98 A 25 LEU H A 25 LEU HBy 1.0 1.8 5.3 121 99 A 25 LEU H A 25 LEU HBx 1.0 1.8 5.3 122 100 A 25 LEU HA A 25 LEU H 1.0 1.8 5.1 123 101 A 25 LEU H A 26 GLU H 1.0 1.8 6.3 124 102 A 11 ILE HA A 25 LEU H 1.0 1.8 6.0 125 103 A 25 LEU H A 12 LYS HBx 1.0 1.8 5.4 126 103 A 25 LEU H A 12 LYS HBy 1.0 1.8 5.4 127 104 A 25 LEU H A 12 LYS HA 1.0 1.8 4.0 128 105 A 25 LEU H A 12 LYS HGy 1.0 1.8 5.7 129 106 A 25 LEU H A 13 ILE H 1.0 1.8 5.0 130 107 A 11 ILE H A 25 LEU H 1.0 1.8 4.0 131 108 A 25 LEU HA A 26 GLU H 1.0 1.8 3.6 132 109 A 25 LEU HBy A 26 GLU H 1.0 1.8 5.4 133 110 A 25 LEU HBx A 26 GLU H 1.0 1.8 5.4 134 111 A 26 GLU H A 25 LEU HDx% 1.0 1.8 5.7 135 111 A 26 GLU H A 25 LEU HDy% 1.0 1.8 5.7 136 112 A 26 GLU H A 26 GLU HGy 1.0 1.8 5.7 137 113 A 26 GLU H A 26 GLU HBx 1.0 1.8 5.7 138 113 A 26 GLU H A 26 GLU HBy 1.0 1.8 5.7 139 114 A 25 LEU H A 26 GLU H 1.0 1.8 6.3 140 115 A 27 VAL H A 26 GLU H 1.0 1.8 6.3 141 116 A 26 GLU HA A 26 GLU H 1.0 1.8 5.1 142 117 A 10 LYS HA A 26 GLU H 1.0 1.8 6.1 143 118 A 27 VAL H A 26 GLU HA 1.0 1.8 3.6 144 119 A 27 VAL H A 26 GLU HBx 1.0 1.8 4.0 145 119 A 27 VAL H A 26 GLU HBy 1.0 1.8 4.0 146 120 A 27 VAL H A 26 GLU HGy 1.0 1.8 5.4 147 120 A 27 VAL H A 26 GLU HGx 1.0 1.8 5.4 148 121 A 27 VAL H A 26 GLU H 1.0 1.8 6.3 149 122 A 27 VAL H A 27 VAL HA 1.0 1.8 5.1 150 123 A 27 VAL H A 27 VAL HGy% 1.0 1.8 5.7 151 124 A 27 VAL H A 28 ALA H 1.0 1.8 6.3 152 125 A 11 ILE H A 27 VAL H 1.0 1.8 5.0 153 126 A 10 LYS H A 27 VAL H 1.0 1.8 6.3 154 127 A 10 LYS HA A 27 VAL H 1.0 1.8 4.0 155 128 A 27 VAL H A 10 LYS HGy 1.0 1.8 5.7 156 129 A 27 VAL H A 27 VAL HGy% 1.0 1.8 5.7 157 130 A 27 VAL HA A 28 ALA H 1.0 1.8 3.6 158 131 A 28 ALA H A 27 VAL HB 1.0 1.8 4.6 159 132 A 28 ALA H A 27 VAL HGx% 1.0 1.8 5.0 160 133 A 27 VAL H A 28 ALA H 1.0 1.8 6.3 161 134 A 26 GLU HA A 28 ALA H 1.0 1.8 6.4 162 135 A 28 ALA H A 30 ASN H 1.0 1.8 6.1 163 136 A 28 ALA H A 31 ALA H 1.0 1.8 5.9 164 137 A 30 ASN H A 29 PRO HA 1.0 1.8 4.7 165 138 A 30 ASN H A 29 PRO HBx 1.0 1.8 5.7 166 139 A 30 ASN H A 29 PRO HBy 1.0 1.8 5.7 167 140 A 30 ASN H A 30 ASN HA 1.0 1.8 3.8 168 141 A 30 ASN H A 30 ASN HBy 1.0 1.8 4.4 169 142 A 30 ASN H A 30 ASN HBx 1.0 1.8 4.4 170 143 A 30 ASN H A 31 ALA H 1.0 1.8 3.5 171 144 A 31 ALA H A 30 ASN HA 1.0 1.8 4.0 172 145 A 31 ALA H A 30 ASN HBy 1.0 1.8 5.1 173 146 A 31 ALA H A 30 ASN HBx 1.0 1.8 5.1 174 147 A 31 ALA H A 31 ALA HA 1.0 1.8 3.8 175 148 A 31 ALA H A 31 ALA HB% 1.0 1.8 4.7 176 149 A 31 ALA H A 29 PRO HA 1.0 1.8 5.4 177 150 A 31 ALA H A 29 PRO HBx 1.0 1.8 6.1 178 151 A 30 ASN H A 31 ALA H 1.0 1.8 3.7 179 152 A 28 ALA H A 31 ALA H 1.0 1.8 5.9 180 153 A 31 ALA H A 65 THR HA 1.0 1.8 6.4 181 154 A 31 ALA H A 65 THR HB 1.0 1.8 6.4 182 155 A 31 ALA HA A 32 THR H 1.0 1.8 3.6 183 156 A 31 ALA HB% A 32 THR H 1.0 1.8 4.4 184 157 A 32 THR H A 32 THR HA 1.0 1.8 4.5 185 158 A 32 THR H A 32 THR HG2% 1.0 1.8 5.4 186 159 A 29 PRO HBy A 32 THR H 1.0 1.8 6.4 187 160 A 32 THR H A 33 VAL H 1.0 1.8 5.7 188 161 A 32 THR H A 35 ALA H 1.0 1.8 5.0 189 162 A 32 THR H A 36 VAL H 1.0 1.8 6.0 190 163 A 65 THR HA A 32 THR H 1.0 1.8 6.1 191 164 A 32 THR H A 66 LEU H 1.0 1.8 6.5 192 165 A 32 THR HA A 33 VAL H 1.0 1.8 3.8 193 166 A 32 THR HG2% A 33 VAL H 1.0 1.8 4.8 194 167 A 33 VAL H A 33 VAL HA 1.0 1.8 4.1 195 168 A 33 VAL H A 33 VAL HB 1.0 1.8 4.8 196 169 A 32 THR H A 33 VAL H 1.0 1.8 5.7 197 170 A 33 VAL H A 35 ALA H 1.0 1.8 4.5 198 171 A 33 VAL H A 36 VAL H 1.0 1.8 5.0 199 172 A 33 VAL H A 34 GLY H 1.0 1.8 3.5 200 173 A 33 VAL H A 64 GLU H 1.0 1.8 6.5 201 174 A 65 THR HA A 33 VAL H 1.0 1.8 6.1 202 175 A 33 VAL H A 62 ASP HA 1.0 1.8 6.4 203 176 A 33 VAL HA A 34 GLY H 1.0 1.8 4.0 204 177 A 33 VAL HB A 34 GLY H 1.0 1.8 4.4 205 178 A 34 GLY H A 33 VAL HGx% 1.0 1.8 5.4 206 179 A 34 GLY H A 33 VAL HGy% 1.0 1.8 5.4 207 180 A 32 THR HA A 34 GLY H 1.0 1.8 4.4 208 181 A 32 THR HG2% A 34 GLY H 1.0 1.8 5.4 209 182 A 34 GLY H A 34 GLY HAy 1.0 1.8 4.1 210 183 A 34 GLY H A 34 GLY HAx 1.0 1.8 4.1 211 184 A 36 VAL H A 34 GLY H 1.0 1.8 4.5 212 185 A 33 VAL H A 34 GLY H 1.0 1.8 3.5 213 186 A 35 ALA H A 34 GLY H 1.0 1.8 3.5 214 187 A 34 GLY H A 38 THR H 1.0 1.8 6.0 215 188 A 34 GLY H A 37 ARG H 1.0 1.8 5.0 216 189 A 34 GLY H A 63 THR H 1.0 1.8 6.5 217 190 A 34 GLY H A 62 ASP HA 1.0 1.8 6.1 218 191 A 35 ALA H A 34 GLY HAy 1.0 1.8 4.0 219 192 A 35 ALA H A 34 GLY HAx 1.0 1.8 4.0 220 193 A 32 THR HA A 35 ALA H 1.0 1.8 4.4 221 194 A 32 THR HG2% A 35 ALA H 1.0 1.8 5.9 222 195 A 35 ALA H A 35 ALA HA 1.0 1.8 4.1 223 196 A 35 ALA H A 35 ALA HB% 1.0 1.8 3.6 224 197 A 35 ALA H A 33 VAL HA 1.0 1.8 4.5 225 198 A 35 ALA H A 33 VAL HB 1.0 1.8 5.5 226 199 A 35 ALA H A 36 VAL H 1.0 1.8 3.5 227 200 A 33 VAL H A 35 ALA H 1.0 1.8 4.5 228 201 A 35 ALA H A 34 GLY H 1.0 1.8 3.5 229 202 A 35 ALA H A 38 THR H 1.0 1.8 5.0 230 203 A 32 THR H A 35 ALA H 1.0 1.8 5.0 231 204 A 36 VAL H A 35 ALA HA 1.0 1.8 3.4 232 205 A 36 VAL H A 35 ALA HB% 1.0 1.8 3.7 233 206 A 36 VAL H A 36 VAL HA 1.0 1.8 3.7 234 207 A 36 VAL H A 36 VAL HB 1.0 1.8 4.0 235 208 A 36 VAL H A 36 VAL HGx% 1.0 1.8 5.1 236 209 A 36 VAL H A 36 VAL HGy% 1.0 1.8 5.1 237 210 A 36 VAL H A 34 GLY HAy 1.0 1.8 4.5 238 211 A 36 VAL H A 33 VAL HA 1.0 1.8 4.1 239 212 A 36 VAL H A 37 ARG H 1.0 1.8 3.5 240 213 A 36 VAL H A 38 THR H 1.0 1.8 4.5 241 214 A 35 ALA H A 36 VAL H 1.0 1.8 3.5 242 215 A 32 THR H A 36 VAL H 1.0 1.8 6.0 243 216 A 37 ARG H A 36 VAL HA 1.0 1.8 4.0 244 217 A 37 ARG H A 36 VAL HB 1.0 1.8 4.4 245 218 A 37 ARG H A 36 VAL HGx% 1.0 1.8 4.2 246 219 A 37 ARG H A 36 VAL HGy% 1.0 1.8 5.4 247 220 A 37 ARG H A 37 ARG HA 1.0 1.8 3.6 248 221 A 37 ARG H A 37 ARG HBx 1.0 1.8 4.4 249 221 A 37 ARG H A 37 ARG HBy 1.0 1.8 4.4 250 222 A 37 ARG H A 37 ARG HGx 1.0 1.8 5.1 251 222 A 37 ARG H A 37 ARG HGy 1.0 1.8 5.1 252 223 A 33 VAL HA A 37 ARG H 1.0 1.8 4.5 253 224 A 38 THR H A 37 ARG H 1.0 1.8 3.5 254 225 A 35 ALA H A 37 ARG H 1.0 1.8 4.5 255 226 A 36 VAL H A 37 ARG H 1.0 1.8 3.4 256 227 A 37 ARG H A 39 LYS H 1.0 1.8 4.5 257 228 A 34 GLY H A 37 ARG H 1.0 1.8 5.0 258 229 A 33 VAL H A 37 ARG H 1.0 1.8 6.0 259 230 A 37 ARG H A 34 GLY HAx 1.0 1.8 4.1 260 230 A 37 ARG H A 34 GLY HAy 1.0 1.8 4.1 261 231 A 38 THR H A 37 ARG HA 1.0 1.8 4.0 262 232 A 38 THR H A 37 ARG HBx 1.0 1.8 4.0 263 232 A 38 THR H A 37 ARG HBy 1.0 1.8 4.0 264 233 A 38 THR H A 37 ARG HGx 1.0 1.8 5.4 265 233 A 38 THR H A 37 ARG HGy 1.0 1.8 5.4 266 234 A 38 THR H A 36 VAL HA 1.0 1.8 4.5 267 235 A 38 THR H A 38 THR HA 1.0 1.8 3.6 268 236 A 38 THR H A 38 THR HG2% 1.0 1.8 5.1 269 237 A 35 ALA H A 38 THR H 1.0 1.8 5.0 270 238 A 36 VAL H A 38 THR H 1.0 1.8 4.4 271 239 A 38 THR H A 37 ARG H 1.0 1.8 3.5 272 240 A 38 THR H A 39 LYS H 1.0 1.8 3.5 273 241 A 38 THR H A 40 VAL H 1.0 1.8 4.5 274 242 A 38 THR H A 35 ALA HA 1.0 1.8 4.1 275 243 A 39 LYS H A 38 THR HA 1.0 1.8 3.6 276 244 A 39 LYS H A 38 THR HB 1.0 1.8 5.4 277 245 A 39 LYS H A 38 THR HG2% 1.0 1.8 5.4 278 246 A 36 VAL HA A 39 LYS H 1.0 1.8 4.1 279 247 A 36 VAL HGx% A 39 LYS H 1.0 1.8 6.4 280 248 A 36 VAL HGy% A 39 LYS H 1.0 1.8 6.4 281 249 A 39 LYS H A 39 LYS HA 1.0 1.8 3.6 282 250 A 39 LYS H A 39 LYS HBx 1.0 1.8 4.4 283 250 A 39 LYS H A 39 LYS HBy 1.0 1.8 4.4 284 251 A 39 LYS H A 39 LYS HDx 1.0 1.8 5.1 285 251 A 39 LYS H A 39 LYS HDy 1.0 1.8 5.1 286 252 A 39 LYS H A 39 LYS HEx 1.0 1.8 5.4 287 252 A 39 LYS H A 39 LYS HEy 1.0 1.8 5.4 288 253 A 39 LYS H A 39 LYS HGx 1.0 1.8 5.4 289 253 A 39 LYS H A 39 LYS HGy 1.0 1.8 5.4 290 254 A 37 ARG H A 39 LYS H 1.0 1.8 4.5 291 255 A 39 LYS H A 40 VAL H 1.0 1.8 3.5 292 256 A 39 LYS H A 41 CYS H 1.0 1.8 4.5 293 257 A 39 LYS H A 43 MET H 1.0 1.8 6.0 294 258 A 35 ALA H A 39 LYS H 1.0 1.8 6.0 295 259 A 39 LYS H A 42 ALA H 1.0 1.8 5.0 296 260 A 36 VAL H A 39 LYS H 1.0 1.8 5.0 297 261 A 40 VAL H A 39 LYS HA 1.0 1.8 4.0 298 262 A 40 VAL H A 39 LYS HBx 1.0 1.8 3.6 299 262 A 40 VAL H A 39 LYS HBy 1.0 1.8 3.6 300 263 A 40 VAL H A 39 LYS HDx 1.0 1.8 5.4 301 263 A 40 VAL H A 39 LYS HDy 1.0 1.8 5.4 302 264 A 40 VAL H A 39 LYS HEx 1.0 1.8 5.4 303 264 A 40 VAL H A 39 LYS HEy 1.0 1.8 5.4 304 265 A 40 VAL H A 39 LYS HGx 1.0 1.8 5.4 305 265 A 40 VAL H A 39 LYS HGy 1.0 1.8 5.4 306 266 A 37 ARG HA A 40 VAL H 1.0 1.8 4.1 307 267 A 40 VAL H A 40 VAL HA 1.0 1.8 3.6 308 268 A 40 VAL H A 40 VAL HB 1.0 1.8 4.6 309 269 A 40 VAL H A 40 VAL HGx% 1.0 1.8 5.1 310 270 A 40 VAL H A 40 VAL HGy% 1.0 1.8 5.1 311 271 A 38 THR HA A 40 VAL H 1.0 1.8 4.5 312 272 A 40 VAL H A 41 CYS H 1.0 1.8 3.5 313 273 A 40 VAL H A 43 MET H 1.0 1.8 5.0 314 274 A 40 VAL H A 42 ALA H 1.0 1.8 4.5 315 275 A 39 LYS H A 40 VAL H 1.0 1.8 3.5 316 276 A 37 ARG H A 40 VAL H 1.0 1.8 5.0 317 277 A 41 CYS H A 40 VAL HA 1.0 1.8 4.0 318 278 A 41 CYS H A 40 VAL HB 1.0 1.8 4.0 319 279 A 41 CYS H A 40 VAL HGx% 1.0 1.8 4.2 320 280 A 41 CYS H A 40 VAL HGy% 1.0 1.8 4.2 321 281 A 38 THR HG2% A 41 CYS H 1.0 1.8 5.7 322 282 A 41 CYS H A 41 CYS HA 1.0 1.8 3.7 323 283 A 41 CYS H A 41 CYS HBy 1.0 1.8 4.5 324 284 A 41 CYS H A 41 CYS HBx 1.0 1.8 4.5 325 285 A 41 CYS H A 42 ALA H 1.0 1.8 3.5 326 286 A 39 LYS H A 41 CYS H 1.0 1.8 4.5 327 287 A 40 VAL H A 41 CYS H 1.0 1.8 3.5 328 288 A 38 THR HA A 41 CYS H 1.0 1.8 4.1 329 289 A 38 THR HB A 41 CYS H 1.0 1.8 5.7 330 290 A 42 ALA H A 41 CYS HA 1.0 1.8 4.4 331 291 A 42 ALA H A 41 CYS HBy 1.0 1.8 5.1 332 292 A 42 ALA H A 42 ALA HB% 1.0 1.8 5.1 333 293 A 42 ALA H A 42 ALA HA 1.0 1.8 3.8 334 294 A 42 ALA H A 40 VAL HA 1.0 1.8 4.5 335 295 A 42 ALA H A 40 VAL HGx% 1.0 1.8 6.1 336 296 A 42 ALA H A 40 VAL HGy% 1.0 1.8 6.1 337 297 A 38 THR HA A 42 ALA H 1.0 1.8 4.5 338 298 A 39 LYS HA A 42 ALA H 1.0 1.8 4.1 339 299 A 42 ALA H A 39 LYS HEx 1.0 1.8 6.4 340 299 A 39 LYS HEy A 42 ALA H 1.0 1.8 6.4 341 300 A 40 VAL H A 42 ALA H 1.0 1.8 4.5 342 301 A 43 MET H A 42 ALA H 1.0 1.8 3.5 343 302 A 41 CYS H A 42 ALA H 1.0 1.8 3.5 344 303 A 43 MET H A 42 ALA HA 1.0 1.8 3.6 345 304 A 43 MET H A 42 ALA HB% 1.0 1.8 3.6 346 305 A 43 MET H A 43 MET HA 1.0 1.8 4.1 347 306 A 43 MET H A 43 MET HBy 1.0 1.8 4.8 348 307 A 43 MET H A 43 MET HBx 1.0 1.8 4.8 349 308 A 43 MET H A 43 MET HGy 1.0 1.8 5.1 350 309 A 43 MET H A 43 MET HGx 1.0 1.8 5.1 351 310 A 43 MET H A 40 VAL HA 1.0 1.8 4.0 352 311 A 39 LYS HA A 43 MET H 1.0 1.8 5.1 353 312 A 41 CYS H A 43 MET H 1.0 1.8 4.5 354 313 A 43 MET H A 42 ALA H 1.0 1.8 3.5 355 314 A 43 MET H A 45 LYS H 1.0 1.8 4.5 356 315 A 43 MET HA A 44 LYS H 1.0 1.8 4.4 357 316 A 43 MET HBy A 44 LYS H 1.0 1.8 4.0 358 317 A 43 MET HBx A 44 LYS H 1.0 1.8 3.8 359 318 A 45 LYS H A 44 LYS H 1.0 1.8 3.5 360 319 A 44 LYS H A 44 LYS HA 1.0 1.8 4.1 361 320 A 44 LYS H A 44 LYS HBx 1.0 1.8 5.7 362 321 A 44 LYS H A 45 LYS HA 1.0 1.8 4.4 363 322 A 43 MET H A 44 LYS H 1.0 1.8 4.1 364 323 A 42 ALA H A 44 LYS H 1.0 1.8 4.5 365 324 A 41 CYS H A 44 LYS H 1.0 1.8 5.0 366 325 A 40 VAL HGy% A 44 LYS H 1.0 1.8 6.1 367 326 A 40 VAL HA A 44 LYS H 1.0 1.8 4.5 368 327 A 45 LYS H A 44 LYS HA 1.0 1.8 4.0 369 328 A 45 LYS H A 44 LYS HBy 1.0 1.8 4.0 370 329 A 45 LYS H A 44 LYS HBx 1.0 1.8 4.2 371 330 A 45 LYS H A 44 LYS HEx 1.0 1.8 5.4 372 330 A 45 LYS H A 44 LYS HEy 1.0 1.8 5.4 373 331 A 45 LYS H A 44 LYS HGx 1.0 1.8 4.0 374 331 A 45 LYS H A 44 LYS HGy 1.0 1.8 4.0 375 332 A 45 LYS H A 44 LYS H 1.0 1.8 3.5 376 333 A 45 LYS H A 45 LYS HA 1.0 1.8 3.6 377 334 A 45 LYS H A 45 LYS HBy 1.0 1.8 4.6 378 335 A 45 LYS H A 45 LYS HBx 1.0 1.8 4.6 379 336 A 45 LYS H A 45 LYS HEx 1.0 1.8 6.1 380 336 A 45 LYS H A 45 LYS HEy 1.0 1.8 6.1 381 337 A 42 ALA H A 45 LYS H 1.0 1.8 5.0 382 338 A 45 LYS HA A 46 LEU H 1.0 1.8 3.6 383 339 A 45 LYS HBy A 46 LEU H 1.0 1.8 5.4 384 340 A 45 LYS HBx A 46 LEU H 1.0 1.8 5.4 385 341 A 46 LEU H A 45 LYS HEx 1.0 1.8 5.4 386 341 A 45 LYS HEy A 46 LEU H 1.0 1.8 5.4 387 342 A 45 LYS H A 46 LEU H 1.0 1.8 4.1 388 343 A 44 LYS H A 46 LEU H 1.0 1.8 4.8 389 344 A 42 ALA H A 46 LEU H 1.0 1.8 6.1 390 345 A 42 ALA HA A 46 LEU H 1.0 1.8 4.8 391 346 A 41 CYS HBy A 46 LEU H 1.0 1.8 6.1 392 347 A 41 CYS HBx A 46 LEU H 1.0 1.8 6.1 393 348 A 49 ASP H A 48 PRO HA 1.0 1.8 3.8 394 349 A 49 ASP H A 50 THR H 1.0 1.8 4.7 395 350 A 49 ASP H A 51 THR HB 1.0 1.8 6.5 396 351 A 49 ASP H A 49 ASP HBx 1.0 1.8 4.6 397 351 A 49 ASP H A 49 ASP HBy 1.0 1.8 4.6 398 352 A 49 ASP H A 49 ASP HA 1.0 1.8 3.5 399 353 A 50 THR H A 49 ASP HA 1.0 1.8 3.6 400 354 A 50 THR H A 49 ASP HBx 1.0 1.8 5.4 401 354 A 50 THR H A 49 ASP HBy 1.0 1.8 5.4 402 355 A 50 THR H A 50 THR HG2% 1.0 1.8 5.4 403 356 A 50 THR H A 51 THR HB 1.0 1.8 5.4 404 357 A 49 ASP H A 50 THR H 1.0 1.8 4.4 405 358 A 50 THR H A 82 ARG H 1.0 1.8 6.1 406 359 A 51 THR H A 50 THR HA 1.0 1.8 4.4 407 360 A 50 THR HG2% A 51 THR H 1.0 1.8 5.4 408 361 A 51 THR H A 51 THR HG2% 1.0 1.8 5.4 409 362 A 51 THR H A 52 ARG H 1.0 1.8 6.3 410 363 A 49 ASP H A 51 THR H 1.0 1.8 6.5 411 364 A 82 ARG H A 51 THR H 1.0 1.8 6.5 412 365 A 51 THR H A 81 THR HA 1.0 1.8 6.1 413 366 A 51 THR H A 51 THR HA 1.0 1.8 5.1 414 367 A 51 THR HB A 51 THR H 1.0 1.8 5.7 415 368 A 51 THR H A 49 ASP HBx 1.0 1.8 6.4 416 368 A 49 ASP HBy A 51 THR H 1.0 1.8 6.4 417 369 A 52 ARG H A 51 THR HA 1.0 1.8 3.6 418 370 A 51 THR HB A 52 ARG H 1.0 1.8 5.4 419 371 A 51 THR HG2% A 52 ARG H 1.0 1.8 4.0 420 372 A 52 ARG H A 53 LEU H 1.0 1.8 6.4 421 373 A 51 THR H A 52 ARG H 1.0 1.8 6.3 422 374 A 52 ARG H A 52 ARG HA 1.0 1.8 5.3 423 375 A 52 ARG H A 52 ARG HDx 1.0 1.8 5.4 424 375 A 52 ARG H A 52 ARG HDy 1.0 1.8 5.4 425 376 A 52 ARG H A 52 ARG HBx 1.0 1.8 4.7 426 377 A 52 ARG H A 53 LEU HBy 1.0 1.8 5.7 427 378 A 82 ARG H A 52 ARG H 1.0 1.8 5.5 428 379 A 52 ARG H A 81 THR HB 1.0 1.8 5.7 429 380 A 52 ARG H A 81 THR HA 1.0 1.8 4.1 430 381 A 80 ILE HA A 52 ARG H 1.0 1.8 6.0 431 382 A 80 ILE H A 52 ARG H 1.0 1.8 4.0 432 383 A 52 ARG H A 79 LEU HA 1.0 1.8 5.1 433 384 A 53 LEU H A 52 ARG HA 1.0 1.8 3.6 434 385 A 53 LEU H A 52 ARG HBy 1.0 1.8 4.0 435 386 A 53 LEU H A 52 ARG HBx 1.0 1.8 4.0 436 387 A 53 LEU H A 52 ARG HDx 1.0 1.8 5.4 437 387 A 53 LEU H A 52 ARG HDy 1.0 1.8 5.4 438 388 A 53 LEU H A 52 ARG HGx 1.0 1.8 5.7 439 388 A 53 LEU H A 52 ARG HGy 1.0 1.8 5.7 440 389 A 52 ARG H A 53 LEU H 1.0 1.8 6.3 441 390 A 53 LEU H A 53 LEU HA 1.0 1.8 5.1 442 391 A 53 LEU H A 53 LEU HBy 1.0 1.8 5.4 443 392 A 53 LEU H A 53 LEU HD11 1.0 1.8 5.7 444 393 A 53 LEU H A 61 LYS HEx 1.0 1.8 5.9 445 393 A 53 LEU H A 61 LYS HEy 1.0 1.8 5.9 446 394 A 53 LEU H A 60 LEU H 1.0 1.8 6.1 447 395 A 79 LEU HA A 53 LEU HA 1.0 1.8 4.0 448 396 A 53 LEU HA A 54 THR H 1.0 1.8 3.6 449 397 A 54 THR H A 53 LEU HBy 1.0 1.8 4.0 450 397 A 54 THR H A 53 LEU HBx 1.0 1.8 4.0 451 398 A 54 THR H A 53 LEU HD11 1.0 1.8 3.8 452 399 A 54 THR H A 53 LEU HD11 1.0 1.8 5.4 453 400 A 54 THR H A 54 THR HB 1.0 1.8 6.1 454 401 A 79 LEU HA A 54 THR H 1.0 1.8 4.5 455 402 A 79 LEU H A 54 THR H 1.0 1.8 6.3 456 403 A 54 THR H A 78 VAL H 1.0 1.8 4.0 457 404 A 54 THR H A 78 VAL HB 1.0 1.8 5.7 458 405 A 54 THR H A 77 PHE HBx 1.0 1.8 5.5 459 405 A 77 PHE HBy A 54 THR H 1.0 1.8 5.5 460 406 A 77 PHE HA A 54 THR H 1.0 1.8 5.0 461 407 A 54 THR HA A 59 ALA HA 1.0 1.8 4.1 462 408 A 54 THR H A 59 ALA HA 1.0 1.8 6.4 463 409 A 54 THR H A 59 ALA HB% 1.0 1.8 6.1 464 410 A 60 LEU H A 54 THR H 1.0 1.8 6.3 465 411 A 54 THR HA A 55 TYR H 1.0 1.8 3.6 466 412 A 54 THR HB A 55 TYR H 1.0 1.8 4.2 467 413 A 55 TYR H A 54 THR HG2% 1.0 1.8 5.7 468 414 A 54 THR H A 55 TYR H 1.0 1.8 6.3 469 415 A 55 TYR H A 55 TYR HA 1.0 1.8 5.3 470 416 A 55 TYR H A 55 TYR HBy 1.0 1.8 5.5 471 417 A 55 TYR H A 56 LYS H 1.0 1.8 6.3 472 418 A 55 TYR H A 57 GLY H 1.0 1.8 6.3 473 419 A 55 TYR H A 57 GLY HAy 1.0 1.8 6.1 474 420 A 55 TYR H A 58 ARG H 1.0 1.8 4.1 475 421 A 55 TYR H A 58 ARG HGx 1.0 1.8 6.4 476 421 A 55 TYR H A 58 ARG HGy 1.0 1.8 6.4 477 422 A 55 TYR H A 60 LEU HA 1.0 1.8 6.5 478 423 A 55 TYR H A 60 LEU HDx% 1.0 1.8 6.1 479 424 A 55 TYR H A 60 LEU HDy% 1.0 1.8 6.1 480 425 A 59 ALA HA A 55 TYR H 1.0 1.8 4.5 481 426 A 55 TYR H A 56 LYS H 1.0 1.8 6.3 482 427 A 55 TYR HA A 56 LYS H 1.0 1.8 4.8 483 428 A 55 TYR HBy A 56 LYS H 1.0 1.8 5.4 484 429 A 56 LYS H A 56 LYS HA 1.0 1.8 4.8 485 430 A 56 LYS H A 57 GLY H 1.0 1.8 5.1 486 431 A 56 LYS H A 57 GLY HAy 1.0 1.8 5.9 487 432 A 56 LYS H A 58 ARG H 1.0 1.8 6.5 488 433 A 77 PHE HA A 56 LYS H 1.0 1.8 5.7 489 434 A 55 TYR H A 56 LYS H 1.0 1.8 6.3 490 435 A 57 GLY H A 56 LYS HA 1.0 1.8 4.4 491 436 A 57 GLY H A 56 LYS HBy 1.0 1.8 5.4 492 437 A 57 GLY H A 56 LYS HBx 1.0 1.8 5.4 493 438 A 57 GLY H A 56 LYS HEx 1.0 1.8 5.4 494 438 A 57 GLY H A 56 LYS HEy 1.0 1.8 5.4 495 439 A 56 LYS H A 57 GLY H 1.0 1.8 5.1 496 440 A 57 GLY H A 57 GLY HAy 1.0 1.8 4.4 497 441 A 55 TYR H A 57 GLY H 1.0 1.8 6.1 498 442 A 57 GLY H A 58 ARG H 1.0 1.8 5.1 499 443 A 57 GLY HAy A 58 ARG H 1.0 1.8 4.0 500 444 A 58 ARG H A 57 GLY HAx 1.0 1.8 4.0 501 445 A 57 GLY H A 58 ARG H 1.0 1.8 5.1 502 446 A 58 ARG H A 59 ALA H 1.0 1.8 6.3 503 447 A 58 ARG H A 58 ARG HA 1.0 1.8 4.8 504 448 A 56 LYS H A 58 ARG H 1.0 1.8 6.1 505 449 A 58 ARG H A 56 LYS HBy 1.0 1.8 5.5 506 450 A 58 ARG H A 56 LYS HBx 1.0 1.8 5.5 507 451 A 58 ARG H A 58 ARG HBx 1.0 1.8 5.4 508 451 A 58 ARG H A 58 ARG HBy 1.0 1.8 5.4 509 452 A 58 ARG H A 58 ARG HDy 1.0 1.8 6.1 510 453 A 58 ARG H A 58 ARG HDx 1.0 1.8 6.1 511 454 A 58 ARG H A 58 ARG HGx 1.0 1.8 6.4 512 454 A 58 ARG H A 58 ARG HGy 1.0 1.8 6.4 513 455 A 55 TYR HA A 58 ARG H 1.0 1.8 6.0 514 456 A 55 TYR HBy A 58 ARG H 1.0 1.8 6.4 515 457 A 58 ARG H A 55 TYR HBx 1.0 1.8 6.4 516 458 A 54 THR HA A 58 ARG H 1.0 1.8 4.9 517 459 A 54 THR HB A 58 ARG H 1.0 1.8 5.4 518 460 A 54 THR HG2% A 58 ARG H 1.0 1.8 5.7 519 461 A 55 TYR H A 58 ARG H 1.0 1.8 4.0 520 462 A 59 ALA H A 58 ARG HA 1.0 1.8 3.6 521 463 A 59 ALA H A 58 ARG HBx 1.0 1.8 4.8 522 463 A 59 ALA H A 58 ARG HBy 1.0 1.8 4.8 523 464 A 59 ALA H A 58 ARG HDy 1.0 1.8 5.4 524 465 A 59 ALA H A 58 ARG HDx 1.0 1.8 5.4 525 466 A 58 ARG H A 59 ALA H 1.0 1.8 6.1 526 467 A 60 LEU H A 59 ALA H 1.0 1.8 6.1 527 468 A 59 ALA HB% A 59 ALA H 1.0 1.8 5.7 528 469 A 54 THR HA A 59 ALA H 1.0 1.8 6.1 529 470 A 54 THR HG2% A 59 ALA H 1.0 1.8 5.9 530 471 A 60 LEU H A 59 ALA HA 1.0 1.8 3.6 531 472 A 60 LEU H A 59 ALA HB% 1.0 1.8 3.8 532 473 A 60 LEU H A 61 LYS H 1.0 1.8 6.3 533 474 A 60 LEU H A 59 ALA H 1.0 1.8 6.3 534 475 A 60 LEU H A 60 LEU HBy 1.0 1.8 5.4 535 476 A 60 LEU H A 60 LEU HDy% 1.0 1.8 5.7 536 477 A 60 LEU H A 60 LEU HDx% 1.0 1.8 5.7 537 478 A 60 LEU H A 54 THR HA 1.0 1.8 4.5 538 479 A 60 LEU H A 54 THR HG2% 1.0 1.8 5.7 539 480 A 53 LEU H A 60 LEU H 1.0 1.8 6.1 540 481 A 60 LEU H A 53 LEU HBx 1.0 1.8 6.1 541 482 A 60 LEU H A 53 LEU HD11 1.0 1.8 6.1 542 483 A 60 LEU H A 54 THR H 1.0 1.8 6.4 543 484 A 60 LEU H A 55 TYR H 1.0 1.8 5.1 544 485 A 60 LEU HA A 61 LYS H 1.0 1.8 3.6 545 486 A 61 LYS H A 60 LEU HBx 1.0 1.8 4.0 546 487 A 60 LEU HDx% A 61 LYS H 1.0 1.8 5.0 547 488 A 60 LEU HDy% A 61 LYS H 1.0 1.8 5.4 548 489 A 60 LEU H A 61 LYS H 1.0 1.8 5.7 549 490 A 63 THR H A 61 LYS H 1.0 1.8 6.3 550 491 A 61 LYS H A 62 ASP H 1.0 1.8 5.9 551 492 A 64 GLU H A 61 LYS H 1.0 1.8 5.7 552 493 A 62 ASP H A 61 LYS HA 1.0 1.8 3.6 553 494 A 62 ASP H A 61 LYS HBx 1.0 1.8 5.1 554 495 A 62 ASP H A 61 LYS HEx 1.0 1.8 5.7 555 495 A 61 LYS HEy A 62 ASP H 1.0 1.8 5.7 556 496 A 62 ASP H A 61 LYS HGx 1.0 1.8 5.7 557 496 A 62 ASP H A 61 LYS HGy 1.0 1.8 5.7 558 497 A 61 LYS H A 62 ASP H 1.0 1.8 6.1 559 498 A 63 THR H A 62 ASP H 1.0 1.8 4.7 560 499 A 62 ASP HA A 62 ASP H 1.0 1.8 4.4 561 500 A 62 ASP H A 62 ASP HBx 1.0 1.8 5.3 562 500 A 62 ASP H A 62 ASP HBy 1.0 1.8 5.3 563 501 A 64 GLU H A 62 ASP H 1.0 1.8 6.4 564 502 A 34 GLY H A 62 ASP H 1.0 1.8 6.4 565 503 A 62 ASP HA A 63 THR H 1.0 1.8 4.8 566 504 A 63 THR H A 62 ASP HBx 1.0 1.8 5.4 567 504 A 63 THR H A 62 ASP HBy 1.0 1.8 5.4 568 505 A 63 THR H A 63 THR HB 1.0 1.8 4.7 569 506 A 63 THR H A 63 THR HA 1.0 1.8 4.1 570 507 A 63 THR H A 63 THR HG2% 1.0 1.8 5.7 571 508 A 63 THR H A 61 LYS H 1.0 1.8 6.4 572 509 A 63 THR H A 61 LYS HBx 1.0 1.8 5.5 573 510 A 63 THR H A 61 LYS HGx 1.0 1.8 6.1 574 510 A 63 THR H A 61 LYS HGy 1.0 1.8 6.1 575 511 A 64 GLU H A 63 THR H 1.0 1.8 4.0 576 512 A 63 THR H A 62 ASP H 1.0 1.8 4.1 577 513 A 63 THR H A 61 LYS HA 1.0 1.8 5.4 578 514 A 32 THR HA A 63 THR H 1.0 1.8 6.5 579 515 A 33 VAL HB A 63 THR H 1.0 1.8 6.5 580 516 A 64 GLU H A 63 THR HA 1.0 1.8 4.4 581 517 A 64 GLU H A 63 THR HB 1.0 1.8 5.4 582 518 A 64 GLU H A 63 THR HG2% 1.0 1.8 5.4 583 519 A 64 GLU H A 63 THR H 1.0 1.8 4.1 584 520 A 64 GLU H A 65 THR H 1.0 1.8 5.5 585 521 A 64 GLU H A 61 LYS H 1.0 1.8 5.7 586 522 A 64 GLU H A 61 LYS HA 1.0 1.8 5.7 587 523 A 64 GLU H A 61 LYS HGx 1.0 1.8 6.1 588 523 A 64 GLU H A 61 LYS HGy 1.0 1.8 6.1 589 524 A 64 GLU H A 64 GLU HBy 1.0 1.8 4.7 590 525 A 64 GLU H A 64 GLU HBx 1.0 1.8 4.8 591 526 A 64 GLU H A 64 GLU HA 1.0 1.8 3.5 592 527 A 64 GLU H A 62 ASP HA 1.0 1.8 4.5 593 528 A 33 VAL H A 64 GLU H 1.0 1.8 6.5 594 529 A 64 GLU H A 33 VAL HGx% 1.0 1.8 6.1 595 530 A 33 VAL HB A 64 GLU H 1.0 1.8 5.7 596 531 A 32 THR HA A 64 GLU H 1.0 1.8 6.4 597 532 A 65 THR H A 64 GLU HA 1.0 1.8 3.6 598 533 A 65 THR H A 64 GLU HBy 1.0 1.8 4.0 599 534 A 65 THR H A 64 GLU HBx 1.0 1.8 4.0 600 535 A 64 GLU H A 65 THR H 1.0 1.8 5.5 601 536 A 65 THR HA A 65 THR H 1.0 1.8 4.4 602 537 A 65 THR H A 65 THR HG2% 1.0 1.8 5.7 603 538 A 65 THR H A 68 SER H 1.0 1.8 5.9 604 539 A 66 LEU H A 65 THR H 1.0 1.8 5.1 605 540 A 65 THR H A 68 SER HBx 1.0 1.8 5.4 606 540 A 65 THR H A 68 SER HBy 1.0 1.8 5.4 607 541 A 65 THR H A 69 LEU HDx% 1.0 1.8 6.1 608 542 A 65 THR H A 69 LEU HDy% 1.0 1.8 6.1 609 543 A 33 VAL H A 65 THR H 1.0 1.8 6.5 610 544 A 32 THR HA A 65 THR H 1.0 1.8 5.9 611 545 A 30 ASN HA A 65 THR H 1.0 1.8 6.5 612 546 A 65 THR HA A 66 LEU H 1.0 1.8 3.8 613 547 A 65 THR HB A 66 LEU H 1.0 1.8 4.8 614 548 A 66 LEU H A 65 THR HG2% 1.0 1.8 5.1 615 549 A 66 LEU H A 68 SER H 1.0 1.8 5.4 616 550 A 66 LEU H A 69 LEU H 1.0 1.8 6.4 617 551 A 66 LEU H A 63 THR HB 1.0 1.8 6.1 618 552 A 31 ALA H A 66 LEU H 1.0 1.8 6.1 619 553 A 31 ALA HA A 66 LEU H 1.0 1.8 6.4 620 554 A 68 SER H A 67 GLU HA 1.0 1.8 4.0 621 555 A 68 SER H A 67 GLU HBy 1.0 1.8 4.0 622 555 A 68 SER H A 67 GLU HBx 1.0 1.8 4.0 623 556 A 68 SER H A 67 GLU HGx 1.0 1.8 5.4 624 556 A 68 SER H A 67 GLU HGy 1.0 1.8 5.4 625 557 A 68 SER H A 69 LEU H 1.0 1.8 4.1 626 558 A 68 SER H A 68 SER HBx 1.0 1.8 5.1 627 558 A 68 SER H A 68 SER HBy 1.0 1.8 5.1 628 559 A 68 SER H A 68 SER HA 1.0 1.8 4.1 629 560 A 68 SER H A 70 GLY H 1.0 1.8 5.7 630 561 A 65 THR HA A 68 SER H 1.0 1.8 5.7 631 562 A 65 THR HB A 68 SER H 1.0 1.8 5.7 632 563 A 69 LEU H A 68 SER HA 1.0 1.8 4.2 633 564 A 69 LEU H A 68 SER HBx 1.0 1.8 5.4 634 564 A 68 SER HBy A 69 LEU H 1.0 1.8 5.4 635 565 A 69 LEU H A 70 GLY H 1.0 1.8 4.1 636 566 A 68 SER H A 69 LEU H 1.0 1.8 4.1 637 567 A 69 LEU H A 70 GLY H 1.0 1.8 5.1 638 568 A 69 LEU H A 71 VAL H 1.0 1.8 5.4 639 569 A 69 LEU H A 69 LEU HBy 1.0 1.8 4.7 640 570 A 69 LEU H A 69 LEU HBx 1.0 1.8 4.7 641 571 A 69 LEU H A 69 LEU HA 1.0 1.8 3.8 642 572 A 69 LEU HDx% A 69 LEU H 1.0 1.8 5.4 643 573 A 69 LEU H A 70 GLY HAx 1.0 1.8 4.8 644 574 A 69 LEU H A 67 GLU HA 1.0 1.8 4.7 645 575 A 69 LEU H A 67 GLU HBx 1.0 1.8 5.7 646 576 A 70 GLY H A 69 LEU HA 1.0 1.8 4.0 647 577 A 70 GLY H A 69 LEU HBy 1.0 1.8 5.2 648 578 A 70 GLY H A 69 LEU HBx 1.0 1.8 5.4 649 579 A 69 LEU HDx% A 70 GLY H 1.0 1.8 5.7 650 580 A 69 LEU HDy% A 70 GLY H 1.0 1.8 5.7 651 581 A 70 GLY H A 71 VAL H 1.0 1.8 4.1 652 582 A 69 LEU H A 70 GLY H 1.0 1.8 4.1 653 583 A 70 GLY H A 70 GLY HAy 1.0 1.8 3.5 654 584 A 70 GLY H A 70 GLY HAx 1.0 1.8 3.5 655 585 A 68 SER H A 70 GLY H 1.0 1.8 5.7 656 586 A 71 VAL H A 70 GLY HAy 1.0 1.8 3.6 657 587 A 71 VAL H A 70 GLY HAx 1.0 1.8 3.6 658 588 A 71 VAL H A 72 ALA H 1.0 1.8 6.1 659 589 A 70 GLY H A 71 VAL H 1.0 1.8 4.1 660 590 A 69 LEU H A 71 VAL H 1.0 1.8 5.4 661 591 A 71 VAL H A 71 VAL HA 1.0 1.8 4.1 662 592 A 71 VAL H A 71 VAL HB 1.0 1.8 4.7 663 593 A 71 VAL H A 71 VAL HGy% 1.0 1.8 5.7 664 594 A 68 SER H A 71 VAL H 1.0 1.8 6.5 665 595 A 71 VAL H A 69 LEU HBy 1.0 1.8 5.7 666 596 A 67 GLU HA A 71 VAL H 1.0 1.8 5.7 667 597 A 72 ALA H A 71 VAL HA 1.0 1.8 3.6 668 598 A 72 ALA H A 71 VAL HB 1.0 1.8 5.4 669 599 A 72 ALA H A 71 VAL HGx% 1.0 1.8 4.3 670 600 A 72 ALA H A 71 VAL HGy% 1.0 1.8 5.4 671 601 A 71 VAL H A 72 ALA H 1.0 1.8 6.1 672 602 A 72 ALA H A 72 ALA HA 1.0 1.8 3.4 673 603 A 72 ALA H A 72 ALA HB% 1.0 1.8 5.7 674 604 A 72 ALA HA A 73 ASP H 1.0 1.8 4.0 675 605 A 73 ASP H A 72 ALA HB% 1.0 1.8 3.6 676 606 A 73 ASP HA A 73 ASP H 1.0 1.8 4.8 677 607 A 73 ASP H A 73 ASP HB2 1.0 1.8 5.4 678 607 A 73 ASP HB3 A 73 ASP H 1.0 1.8 5.4 679 608 A 74 GLY H A 73 ASP H 1.0 1.8 6.3 680 609 A 72 ALA H A 73 ASP H 1.0 1.8 6.3 681 610 A 10 LYS H A 73 ASP H 1.0 1.8 6.5 682 611 A 74 GLY H A 73 ASP HA 1.0 1.8 3.6 683 612 A 74 GLY H A 73 ASP HB2 1.0 1.8 4.0 684 612 A 74 GLY H A 73 ASP HB3 1.0 1.8 4.0 685 613 A 74 GLY H A 74 GLY HAx 1.0 1.8 4.7 686 614 A 74 GLY H A 75 ASP HBy 1.0 1.8 4.7 687 615 A 74 GLY H A 75 ASP H 1.0 1.8 5.5 688 616 A 74 GLY H A 73 ASP H 1.0 1.8 6.1 689 617 A 10 LYS HA A 74 GLY H 1.0 1.8 6.3 690 618 A 10 LYS H A 74 GLY H 1.0 1.8 5.7 691 619 A 75 ASP H A 74 GLY HAy 1.0 1.8 4.0 692 620 A 74 GLY HAx A 75 ASP H 1.0 1.8 4.0 693 621 A 74 GLY H A 75 ASP H 1.0 1.8 5.4 694 622 A 75 ASP H A 75 ASP HA 1.0 1.8 4.7 695 623 A 75 ASP H A 75 ASP HBy 1.0 1.8 5.3 696 624 A 75 ASP H A 75 ASP HBx 1.0 1.8 5.3 697 625 A 11 ILE HA A 75 ASP H 1.0 1.8 4.5 698 626 A 75 ASP H A 12 LYS H 1.0 1.8 5.1 699 627 A 10 LYS H A 75 ASP H 1.0 1.8 6.1 700 628 A 75 ASP HA A 76 LYS H 1.0 1.8 3.6 701 629 A 75 ASP HBy A 76 LYS H 1.0 1.8 4.4 702 630 A 75 ASP HBx A 76 LYS H 1.0 1.8 4.4 703 631 A 76 LYS H A 77 PHE H 1.0 1.8 6.3 704 632 A 76 LYS H A 76 LYS HGy 1.0 1.8 5.9 705 633 A 76 LYS H A 76 LYS HGx 1.0 1.8 5.9 706 634 A 76 LYS HA A 76 LYS H 1.0 1.8 5.3 707 635 A 76 LYS H A 76 LYS HBx 1.0 1.8 5.4 708 635 A 76 LYS H A 76 LYS HBy 1.0 1.8 5.4 709 636 A 12 LYS H A 76 LYS H 1.0 1.8 6.3 710 637 A 76 LYS HA A 77 PHE H 1.0 1.8 3.6 711 638 A 77 PHE H A 76 LYS HBx 1.0 1.8 4.2 712 638 A 77 PHE H A 76 LYS HBy 1.0 1.8 4.2 713 639 A 77 PHE H A 76 LYS HGx 1.0 1.8 5.4 714 640 A 77 PHE HA A 77 PHE H 1.0 1.8 5.3 715 641 A 77 PHE H A 77 PHE HBx 1.0 1.8 5.7 716 641 A 77 PHE HBy A 77 PHE H 1.0 1.8 5.7 717 642 A 77 PHE HA A 55 TYR HA 1.0 1.8 4.7 718 643 A 14 VAL H A 77 PHE H 1.0 1.8 4.5 719 644 A 13 ILE HB A 77 PHE H 1.0 1.8 5.3 720 645 A 13 ILE HA A 77 PHE H 1.0 1.8 4.0 721 646 A 12 LYS H A 77 PHE H 1.0 1.8 4.5 722 647 A 11 ILE HA A 77 PHE H 1.0 1.8 5.7 723 648 A 77 PHE HA A 78 VAL H 1.0 1.8 3.6 724 649 A 78 VAL H A 77 PHE HBx 1.0 1.8 4.2 725 649 A 77 PHE HBy A 78 VAL H 1.0 1.8 4.2 726 650 A 78 VAL HA A 78 VAL H 1.0 1.8 4.8 727 651 A 54 THR H A 78 VAL H 1.0 1.8 4.0 728 652 A 53 LEU HA A 78 VAL H 1.0 1.8 5.0 729 653 A 78 VAL H A 55 TYR HA 1.0 1.8 4.4 730 654 A 78 VAL H A 56 LYS H 1.0 1.8 5.5 731 655 A 79 LEU H A 78 VAL HA 1.0 1.8 3.6 732 656 A 79 LEU H A 78 VAL HB 1.0 1.8 5.4 733 657 A 79 LEU H A 78 VAL HGx% 1.0 1.8 5.6 734 657 A 79 LEU H A 78 VAL HGy% 1.0 1.8 5.6 735 658 A 79 LEU H A 80 ILE H 1.0 1.8 6.3 736 659 A 79 LEU H A 54 THR H 1.0 1.8 6.1 737 660 A 79 LEU H A 53 LEU HA 1.0 1.8 5.9 738 661 A 79 LEU H A 79 LEU HB2 1.0 1.8 5.5 739 662 A 79 LEU H A 79 LEU HB3 1.0 1.8 5.5 740 663 A 14 VAL H A 79 LEU H 1.0 1.8 4.5 741 664 A 79 LEU H A 16 ALA HA 1.0 1.8 6.4 742 665 A 79 LEU H A 16 ALA H 1.0 1.8 4.5 743 666 A 79 LEU H A 15 PRO HA 1.0 1.8 4.0 744 667 A 80 ILE H A 79 LEU HA 1.0 1.8 3.6 745 668 A 80 ILE H A 79 LEU HB2 1.0 1.8 4.4 746 669 A 79 LEU HB3 A 80 ILE H 1.0 1.8 4.4 747 670 A 80 ILE H A 79 LEU HDx% 1.0 1.8 5.6 748 670 A 80 ILE H A 79 LEU HDy% 1.0 1.8 5.6 749 671 A 80 ILE H A 53 LEU H 1.0 1.8 6.1 750 672 A 80 ILE H A 53 LEU HA 1.0 1.8 4.1 751 673 A 80 ILE H A 53 LEU HBx 1.0 1.8 6.1 752 674 A 80 ILE H A 53 LEU HD11 1.0 1.8 6.1 753 675 A 80 ILE H A 51 THR HG2% 1.0 1.8 6.1 754 676 A 80 ILE H A 52 ARG H 1.0 1.8 4.0 755 677 A 80 ILE H A 51 THR HA 1.0 1.8 4.7 756 678 A 80 ILE H A 54 THR H 1.0 1.8 5.0 757 679 A 16 ALA H A 80 ILE H 1.0 1.8 6.3 758 680 A 81 THR H A 80 ILE HA 1.0 1.8 4.1 759 681 A 81 THR H A 80 ILE HG12 1.0 1.8 5.4 760 682 A 81 THR H A 80 ILE HG2% 1.0 1.8 4.8 761 683 A 80 ILE H A 81 THR H 1.0 1.8 6.3 762 684 A 81 THR H A 51 THR HA 1.0 1.8 6.0 763 685 A 16 ALA H A 81 THR H 1.0 1.8 4.7 764 686 A 82 ARG H A 81 THR HA 1.0 1.8 3.6 765 687 A 82 ARG H A 81 THR HB 1.0 1.8 4.5 766 688 A 82 ARG H A 81 THR HG2% 1.0 1.8 5.7 767 689 A 82 ARG H A 52 ARG H 1.0 1.8 5.9 768 690 A 82 ARG H A 51 THR HA 1.0 1.8 4.1 769 691 A 51 THR HB A 82 ARG H 1.0 1.8 5.5 770 692 A 82 ARG H A 82 ARG HA 1.0 1.8 4.1 771 693 A 82 ARG H A 82 ARG HBx 1.0 1.8 5.1 772 693 A 82 ARG H A 82 ARG HBy 1.0 1.8 5.1 773 694 A 82 ARG H A 83 THR H 1.0 1.8 6.3 774 695 A 82 ARG HA A 83 THR H 1.0 1.8 3.6 775 696 A 83 THR H A 82 ARG HBx 1.0 1.8 4.2 776 696 A 82 ARG HBy A 83 THR H 1.0 1.8 4.2 777 697 A 83 THR H A 82 ARG HGx 1.0 1.8 5.4 778 697 A 83 THR H A 82 ARG HGy 1.0 1.8 5.4 779 698 A 82 ARG H A 83 THR H 1.0 1.8 6.4 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 37 ARG H A 33 VAL O 1.0 2.0 2.0 2 2 A 33 VAL O A 37 ARG N 1.0 3.0 3.0 3 3 A 38 THR H A 34 GLY O 1.0 2.0 2.0 4 4 A 34 GLY O A 38 THR N 1.0 3.0 3.0 5 5 A 39 LYS H A 35 ALA O 1.0 2.0 2.0 6 6 A 35 ALA O A 39 LYS N 1.0 3.0 3.0 7 7 A 40 VAL H A 36 VAL O 1.0 2.0 2.0 8 8 A 36 VAL O A 40 VAL N 1.0 3.0 3.0 9 9 A 41 CYS H A 37 ARG O 1.0 2.0 2.0 10 10 A 37 ARG O A 41 CYS N 1.0 3.0 3.0 11 11 A 42 ALA H A 38 THR O 1.0 2.0 2.0 12 12 A 38 THR O A 42 ALA N 1.0 3.0 3.0 13 13 A 11 ILE H A 25 LEU O 1.0 2.2 2.2 14 14 A 25 LEU O A 11 ILE N 1.0 3.2 3.2 15 15 A 25 LEU H A 11 ILE O 1.0 2.2 2.2 16 16 A 11 ILE O A 25 LEU N 1.0 3.2 3.2 17 17 A 13 ILE H A 23 LEU O 1.0 2.2 2.2 18 18 A 23 LEU O A 13 ILE N 1.0 3.2 3.2 19 19 A 23 LEU H A 13 ILE O 1.0 2.2 2.2 20 20 A 13 ILE O A 23 LEU N 1.0 3.2 3.2 21 21 A 54 THR H A 78 VAL O 1.0 2.2 2.2 22 22 A 78 VAL O A 54 THR N 1.0 3.2 3.2 23 23 A 78 VAL H A 54 THR O 1.0 2.2 2.2 24 24 A 54 THR O A 78 VAL N 1.0 3.2 3.2 25 25 A 52 ARG H A 80 ILE O 1.0 2.2 2.2 26 26 A 80 ILE O A 52 ARG N 1.0 3.2 3.2 27 27 A 80 ILE H A 52 ARG O 1.0 2.2 2.2 28 28 A 52 ARG O A 80 ILE N 1.0 3.2 3.2 29 29 A 79 LEU H A 14 VAL O 1.0 2.4 2.4 30 30 A 14 VAL O A 79 LEU N 1.0 3.4 3.4 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 9 MET C A 10 LYS N A 10 LYS CA A 10 LYS C 1.0 -129.87 -89.81 PHI 2 2 A 10 LYS N A 10 LYS CA A 10 LYS C A 11 ILE N 1.0 133.19 154.21 PSI 3 3 A 10 LYS C A 11 ILE N A 11 ILE CA A 11 ILE C 1.0 -139.21 -125.79 PHI 4 4 A 11 ILE N A 11 ILE CA A 11 ILE C A 12 LYS N 1.0 144.39 170.29 PSI 5 5 A 11 ILE C A 12 LYS N A 12 LYS CA A 12 LYS C 1.0 -138.71 -117.65 PHI 6 6 A 12 LYS N A 12 LYS CA A 12 LYS C A 13 ILE N 1.0 118.10 147.18 PSI 7 7 A 12 LYS C A 13 ILE N A 13 ILE CA A 13 ILE C 1.0 -119.04 -105.70 PHI 8 8 A 13 ILE N A 13 ILE CA A 13 ILE C A 14 VAL N 1.0 109.84 125.76 PSI 9 9 A 13 ILE C A 14 VAL N A 14 VAL CA A 14 VAL C 1.0 -134.10 -101.54 PHI 10 10 A 14 VAL N A 14 VAL CA A 14 VAL C A 15 PRO N 1.0 111.38 142.24 PSI 11 11 A 15 PRO N A 15 PRO CA A 15 PRO C A 16 ALA N 1.0 134.35 153.55 PSI 12 12 A 20 GLY C A 21 SER N A 21 SER CA A 21 SER C 1.0 -127.30 -65.86 PHI 13 13 A 21 SER N A 21 SER CA A 21 SER C A 22 PRO N 1.0 127.70 157.78 PSI 14 14 A 22 PRO N A 22 PRO CA A 22 PRO C A 23 LEU N 1.0 130.98 161.82 PSI 15 15 A 22 PRO C A 23 LEU N A 23 LEU CA A 23 LEU C 1.0 -128.04 -82.72 PHI 16 16 A 23 LEU N A 23 LEU CA A 23 LEU C A 24 GLU N 1.0 119.80 142.76 PSI 17 17 A 23 LEU C A 24 GLU N A 24 GLU CA A 24 GLU C 1.0 -137.10 -90.58 PHI 18 18 A 24 GLU N A 24 GLU CA A 24 GLU C A 25 LEU N 1.0 128.79 142.29 PSI 19 19 A 24 GLU C A 25 LEU N A 25 LEU CA A 25 LEU C 1.0 -142.64 -119.56 PHI 20 20 A 25 LEU N A 25 LEU CA A 25 LEU C A 26 GLU N 1.0 130.12 159.96 PSI 21 21 A 25 LEU C A 26 GLU N A 26 GLU CA A 26 GLU C 1.0 -138.38 -100.26 PHI 22 22 A 26 GLU N A 26 GLU CA A 26 GLU C A 27 VAL N 1.0 110.71 144.99 PSI 23 23 A 26 GLU C A 27 VAL N A 27 VAL CA A 27 VAL C 1.0 -138.42 -120.42 PHI 24 24 A 27 VAL N A 27 VAL CA A 27 VAL C A 28 ALA N 1.0 147.82 167.62 PSI 25 25 A 27 VAL C A 28 ALA N A 28 ALA CA A 28 ALA C 1.0 -134.07 -79.61 PHI 26 26 A 28 ALA N A 28 ALA CA A 28 ALA C A 29 PRO N 1.0 118.67 179.33 PSI 27 27 A 29 PRO N A 29 PRO CA A 29 PRO C A 30 ASN N 1.0 -34.61 -15.11 PSI 28 28 A 29 PRO C A 30 ASN N A 30 ASN CA A 30 ASN C 1.0 -106.26 -89.20 PHI 29 29 A 30 ASN N A 30 ASN CA A 30 ASN C A 31 ALA N 1.0 0.13 19.15 PSI 30 30 A 31 ALA C A 32 THR N A 32 THR CA A 32 THR C 1.0 -153.15 -101.31 PHI 31 31 A 32 THR N A 32 THR CA A 32 THR C A 33 VAL N 1.0 146.60 162.84 PSI 32 32 A 32 THR C A 33 VAL N A 33 VAL CA A 33 VAL C 1.0 -65.50 -53.90 PHI 33 33 A 33 VAL N A 33 VAL CA A 33 VAL C A 34 GLY N 1.0 -47.14 -35.24 PSI 34 34 A 33 VAL C A 34 GLY N A 34 GLY CA A 34 GLY C 1.0 -69.43 -62.65 PHI 35 35 A 34 GLY N A 34 GLY CA A 34 GLY C A 35 ALA N 1.0 -44.56 -33.76 PSI 36 36 A 34 GLY C A 35 ALA N A 35 ALA CA A 35 ALA C 1.0 -69.66 -57.70 PHI 37 37 A 35 ALA N A 35 ALA CA A 35 ALA C A 36 VAL N 1.0 -45.22 -37.26 PSI 38 38 A 35 ALA C A 36 VAL N A 36 VAL CA A 36 VAL C 1.0 -66.40 -59.60 PHI 39 39 A 36 VAL N A 36 VAL CA A 36 VAL C A 37 ARG N 1.0 -45.66 -39.40 PSI 40 40 A 36 VAL C A 37 ARG N A 37 ARG CA A 37 ARG C 1.0 -63.64 -57.86 PHI 41 41 A 37 ARG N A 37 ARG CA A 37 ARG C A 38 THR N 1.0 -49.07 -40.69 PSI 42 42 A 37 ARG C A 38 THR N A 38 THR CA A 38 THR C 1.0 -71.14 -55.12 PHI 43 43 A 38 THR N A 38 THR CA A 38 THR C A 39 LYS N 1.0 -45.53 -36.69 PSI 44 44 A 38 THR C A 39 LYS N A 39 LYS CA A 39 LYS C 1.0 -69.00 -63.68 PHI 45 45 A 39 LYS N A 39 LYS CA A 39 LYS C A 40 VAL N 1.0 -45.22 -37.58 PSI 46 46 A 39 LYS C A 40 VAL N A 40 VAL CA A 40 VAL C 1.0 -68.27 -62.37 PHI 47 47 A 40 VAL N A 40 VAL CA A 40 VAL C A 41 CYS N 1.0 -49.44 -40.32 PSI 48 48 A 40 VAL C A 41 CYS N A 41 CYS CA A 41 CYS C 1.0 -64.77 -55.61 PHI 49 49 A 41 CYS N A 41 CYS CA A 41 CYS C A 42 ALA N 1.0 -45.87 -31.05 PSI 50 50 A 41 CYS C A 42 ALA N A 42 ALA CA A 42 ALA C 1.0 -68.57 -61.81 PHI 51 51 A 42 ALA N A 42 ALA CA A 42 ALA C A 43 MET N 1.0 -46.12 -36.64 PSI 52 52 A 42 ALA C A 43 MET N A 43 MET CA A 43 MET C 1.0 -68.54 -59.40 PHI 53 53 A 43 MET N A 43 MET CA A 43 MET C A 44 LYS N 1.0 -45.31 -29.45 PSI 54 54 A 43 MET C A 44 LYS N A 44 LYS CA A 44 LYS C 1.0 -103.36 -82.50 PHI 55 55 A 44 LYS N A 44 LYS CA A 44 LYS C A 45 LYS N 1.0 -7.76 11.56 PSI 56 56 A 44 LYS C A 45 LYS N A 45 LYS CA A 45 LYS C 1.0 46.57 62.67 PHI 57 57 A 45 LYS N A 45 LYS CA A 45 LYS C A 46 LEU N 1.0 30.07 55.65 PSI 58 58 A 48 PRO N A 48 PRO CA A 48 PRO C A 49 ASP N 1.0 -45.41 -26.37 PSI 59 59 A 48 PRO C A 49 ASP N A 49 ASP CA A 49 ASP C 1.0 -83.46 -58.74 PHI 60 60 A 49 ASP N A 49 ASP CA A 49 ASP C A 50 THR N 1.0 -41.03 -14.21 PSI 61 61 A 49 ASP C A 50 THR N A 50 THR CA A 50 THR C 1.0 -114.13 -93.45 PHI 62 62 A 50 THR C A 51 THR N A 51 THR CA A 51 THR C 1.0 -141.26 -103.72 PHI 63 63 A 51 THR N A 51 THR CA A 51 THR C A 52 ARG N 1.0 95.30 145.30 PSI 64 64 A 51 THR C A 52 ARG N A 52 ARG CA A 52 ARG C 1.0 -140.91 -103.37 PHI 65 65 A 52 ARG N A 52 ARG CA A 52 ARG C A 53 LEU N 1.0 135.46 164.86 PSI 66 66 A 52 ARG C A 53 LEU N A 53 LEU CA A 53 LEU C 1.0 -150.67 -108.35 PHI 67 67 A 53 LEU N A 53 LEU CA A 53 LEU C A 54 THR N 1.0 119.12 145.04 PSI 68 68 A 53 LEU C A 54 THR N A 54 THR CA A 54 THR C 1.0 -127.07 -85.99 PHI 69 69 A 54 THR N A 54 THR CA A 54 THR C A 55 TYR N 1.0 100.31 156.07 PSI 70 70 A 54 THR C A 55 TYR N A 55 TYR CA A 55 TYR C 1.0 -156.90 -111.54 PHI 71 71 A 55 TYR N A 55 TYR CA A 55 TYR C A 56 LYS N 1.0 127.73 156.97 PSI 72 72 A 55 TYR C A 56 LYS N A 56 LYS CA A 56 LYS C 1.0 47.26 62.18 PHI 73 73 A 56 LYS N A 56 LYS CA A 56 LYS C A 57 GLY N 1.0 33.26 50.36 PSI 74 74 A 56 LYS C A 57 GLY N A 57 GLY CA A 57 GLY C 1.0 71.23 88.61 PHI 75 75 A 57 GLY N A 57 GLY CA A 57 GLY C A 58 ARG N 1.0 -11.64 14.40 PSI 76 76 A 57 GLY C A 58 ARG N A 58 ARG CA A 58 ARG C 1.0 -125.46 -97.84 PHI 77 77 A 58 ARG N A 58 ARG CA A 58 ARG C A 59 ALA N 1.0 119.16 162.30 PSI 78 78 A 58 ARG C A 59 ALA N A 59 ALA CA A 59 ALA C 1.0 -103.77 -74.75 PHI 79 79 A 59 ALA N A 59 ALA CA A 59 ALA C A 60 LEU N 1.0 118.57 149.15 PSI 80 80 A 59 ALA C A 60 LEU N A 60 LEU CA A 60 LEU C 1.0 -137.24 -84.02 PHI 81 81 A 60 LEU N A 60 LEU CA A 60 LEU C A 61 LYS N 1.0 131.68 153.58 PSI 82 82 A 61 LYS C A 62 ASP N A 62 ASP CA A 62 ASP C 1.0 -74.89 -57.41 PHI 83 83 A 62 ASP N A 62 ASP CA A 62 ASP C A 63 THR N 1.0 -38.70 -7.36 PSI 84 84 A 63 THR N A 63 THR CA A 63 THR C A 64 GLU N 1.0 -16.95 16.47 PSI 85 85 A 64 GLU C A 65 THR N A 65 THR CA A 65 THR C 1.0 -140.45 -96.37 PHI 86 86 A 65 THR N A 65 THR CA A 65 THR C A 66 LEU N 1.0 150.45 162.33 PSI 87 87 A 66 LEU C A 67 GLU N A 67 GLU CA A 67 GLU C 1.0 -69.76 -58.40 PHI 88 88 A 67 GLU N A 67 GLU CA A 67 GLU C A 68 SER N 1.0 -44.81 -28.19 PSI 89 89 A 67 GLU C A 68 SER N A 68 SER CA A 68 SER C 1.0 -71.66 -64.06 PHI 90 90 A 68 SER N A 68 SER CA A 68 SER C A 69 LEU N 1.0 -32.61 -12.83 PSI 91 91 A 68 SER C A 69 LEU N A 69 LEU CA A 69 LEU C 1.0 -98.72 -76.10 PHI 92 92 A 69 LEU N A 69 LEU CA A 69 LEU C A 70 GLY N 1.0 -13.80 7.26 PSI 93 93 A 70 GLY C A 71 VAL N A 71 VAL CA A 71 VAL C 1.0 -91.45 -67.01 PHI 94 94 A 71 VAL N A 71 VAL CA A 71 VAL C A 72 ALA N 1.0 130.00 141.46 PSI 95 95 A 71 VAL C A 72 ALA N A 72 ALA CA A 72 ALA C 1.0 -144.26 -97.16 PHI 96 96 A 72 ALA N A 72 ALA CA A 72 ALA C A 73 ASP N 1.0 147.39 174.67 PSI 97 97 A 72 ALA C A 73 ASP N A 73 ASP CA A 73 ASP C 1.0 -108.84 -49.08 PHI 98 98 A 73 ASP N A 73 ASP CA A 73 ASP C A 74 GLY N 1.0 123.42 147.62 PSI 99 99 A 75 ASP C A 76 LYS N A 76 LYS CA A 76 LYS C 1.0 -147.64 -105.50 PHI 100 100 A 76 LYS N A 76 LYS CA A 76 LYS C A 77 PHE N 1.0 129.34 159.24 PSI 101 101 A 76 LYS C A 77 PHE N A 77 PHE CA A 77 PHE C 1.0 -135.99 -111.75 PHI 102 102 A 77 PHE N A 77 PHE CA A 77 PHE C A 78 VAL N 1.0 112.46 149.82 PSI 103 103 A 77 PHE C A 78 VAL N A 78 VAL CA A 78 VAL C 1.0 -117.65 -101.33 PHI 104 104 A 78 VAL N A 78 VAL CA A 78 VAL C A 79 LEU N 1.0 117.12 127.08 PSI 105 105 A 78 VAL C A 79 LEU N A 79 LEU CA A 79 LEU C 1.0 -122.08 -105.60 PHI 106 106 A 79 LEU N A 79 LEU CA A 79 LEU C A 80 ILE N 1.0 112.47 131.95 PSI 107 107 A 79 LEU C A 80 ILE N A 80 ILE CA A 80 ILE C 1.0 -129.86 -106.38 PHI 108 108 A 80 ILE N A 80 ILE CA A 80 ILE C A 81 THR N 1.0 122.65 146.73 PSI 109 109 A 80 ILE C A 81 THR N A 81 THR CA A 81 THR C 1.0 -157.10 -114.42 PHI 110 110 A 81 THR N A 81 THR CA A 81 THR C A 82 ARG N 1.0 131.19 170.87 PSI 111 111 A 81 THR C A 82 ARG N A 82 ARG CA A 82 ARG C 1.0 -125.40 -71.70 PHI 112 112 A 82 ARG N A 82 ARG CA A 82 ARG C A 83 THR N 1.0 127.50 154.46 PSI stop_ save_