data_nef_c16040_2kb6 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 19 CYS SG 1 68 CYS SG 1 30 CYS SG 1 75 CYS SG 1 48 CYS SG 1 90 CYS SG 1 1 PCA C 1 2 ASP N stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 PCA start -OXT . 2 A 2 ASP middle -H2 . 3 A 3 TRP middle . . 4 A 4 LEU middle . . 5 A 5 THR middle . . 6 A 6 PHE middle . . 7 A 7 GLN middle . . 8 A 8 LYS middle . . 9 A 9 LYS middle . . 10 A 10 HIS middle . . 11 A 11 ILE middle . . 12 A 12 THR middle . . 13 A 13 ASN middle . . 14 A 14 THR middle . . 15 A 15 ARG middle . . 16 A 16 ASP middle . . 17 A 17 VAL middle . . 18 A 18 ASP middle . . 19 A 19 CYS middle -HG . 20 A 20 ASP middle . . 21 A 21 ASN middle . . 22 A 22 ILE middle . . 23 A 23 MET middle . . 24 A 24 SER middle . . 25 A 25 THR middle . . 26 A 26 ASN middle . . 27 A 27 LEU middle . . 28 A 28 PHE middle . . 29 A 29 HIS middle . . 30 A 30 CYS middle -HG . 31 A 31 LYS middle . . 32 A 32 ASP middle . . 33 A 33 LYS middle . . 34 A 34 ASN middle . . 35 A 35 THR middle . . 36 A 36 PHE middle . . 37 A 37 ILE middle . . 38 A 38 TYR middle . . 39 A 39 SER middle . . 40 A 40 ARG middle . . 41 A 41 PRO middle . false 42 A 42 GLU middle . . 43 A 43 PRO middle . false 44 A 44 VAL middle . . 45 A 45 LYS middle . . 46 A 46 ALA middle . . 47 A 47 ILE middle . . 48 A 48 CYS middle -HG . 49 A 49 LYS middle . . 50 A 50 GLY middle . false 51 A 51 ILE middle . . 52 A 52 ILE middle . . 53 A 53 ALA middle . . 54 A 54 SER middle . . 55 A 55 LYS middle . . 56 A 56 ASN middle . . 57 A 57 VAL middle . . 58 A 58 LEU middle . . 59 A 59 THR middle . . 60 A 60 THR middle . . 61 A 61 SER middle . . 62 A 62 GLU middle . . 63 A 63 PHE middle . . 64 A 64 TYR middle . . 65 A 65 LEU middle . . 66 A 66 SER middle . . 67 A 67 ASP middle . . 68 A 68 CYS middle -HG . 69 A 69 ASN middle . . 70 A 70 VAL middle . . 71 A 71 THR middle . . 72 A 72 SER middle . . 73 A 73 ARG middle . . 74 A 74 PRO middle . false 75 A 75 CYS middle -HG . 76 A 76 LYS middle . . 77 A 77 TYR middle . . 78 A 78 LYS middle . . 79 A 79 LEU middle . . 80 A 80 LYS middle . . 81 A 81 LYS middle . . 82 A 82 SER middle . . 83 A 83 THR middle . . 84 A 84 ASN middle . . 85 A 85 LYS middle . . 86 A 86 PHE middle . . 87 A 87 ALA middle . . 88 A 88 VAL middle . . 89 A 89 THR middle . . 90 A 90 CYS middle -HG . 91 A 91 GLU middle . . 92 A 92 ASN middle . . 93 A 93 GLN middle . . 94 A 94 ALA middle . . 95 A 95 PRO middle . false 96 A 96 VAL middle . . 97 A 97 HIS middle . . 98 A 98 PHE middle . . 99 A 99 VAL middle . . 100 A 100 GLY middle . false 101 A 101 VAL middle . . 102 A 102 GLY middle . false 103 A 103 SER middle . . 104 A 104 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 1 PCA H1 H 1 8.154 0.010 A 1 PCA HA H 1 3.939 0.010 A 1 PCA HBx H 1 1.613 0.010 A 1 PCA HBy H 1 2.104 0.010 A 1 PCA HGx H 1 2.455 0.010 A 1 PCA HGy H 1 2.665 0.010 A 1 PCA N N 15 123.554 0.010 A 2 ASP H H 1 7.871 0.010 A 2 ASP HA H 1 4.626 0.010 A 2 ASP HBx H 1 2.971 0.010 A 2 ASP HBy H 1 2.972 0.010 A 2 ASP N N 15 114.213 0.010 A 3 TRP H H 1 9.300 0.010 A 3 TRP HA H 1 5.398 0.010 A 3 TRP HBx H 1 3.133 0.010 A 3 TRP HBy H 1 3.238 0.010 A 3 TRP HD1 H 1 7.197 0.010 A 3 TRP HE1 H 1 10.385 0.010 A 3 TRP HE3 H 1 7.273 0.010 A 3 TRP HH2 H 1 7.125 0.010 A 3 TRP HZ2 H 1 7.273 0.010 A 3 TRP HZ3 H 1 7.125 0.010 A 3 TRP N N 15 123.555 0.010 A 3 TRP NE1 N 15 130.553 0.010 A 4 LEU H H 1 8.275 0.010 A 4 LEU HA H 1 3.677 0.010 A 4 LEU HBx H 1 1.475 0.010 A 4 LEU HBy H 1 1.635 0.010 A 4 LEU HD1% H 1 0.790 0.010 A 4 LEU HD2% H 1 0.789 0.010 A 4 LEU HG H 1 1.505 0.010 A 4 LEU N N 15 120.894 0.010 A 5 THR H H 1 8.719 0.010 A 5 THR HA H 1 3.799 0.010 A 5 THR HB H 1 3.580 0.010 A 5 THR HG2% H 1 1.112 0.010 A 5 THR N N 15 117.567 0.010 A 6 PHE H H 1 8.735 0.010 A 6 PHE HA H 1 4.139 0.010 A 6 PHE HBx H 1 3.009 0.010 A 6 PHE HBy H 1 3.483 0.010 A 6 PHE HDx H 1 6.963 0.010 A 6 PHE HDy H 1 6.963 0.010 A 6 PHE HEx H 1 6.962 0.010 A 6 PHE HEy H 1 6.962 0.010 A 6 PHE HZ H 1 6.264 0.010 A 6 PHE N N 15 122.982 0.010 A 7 GLN H H 1 8.053 0.010 A 7 GLN HA H 1 3.456 0.010 A 7 GLN HBx H 1 1.707 0.010 A 7 GLN HBy H 1 1.708 0.010 A 7 GLN HE2y H 1 6.560 0.010 A 7 GLN HE2x H 1 4.402 0.010 A 7 GLN HGx H 1 2.121 0.010 A 7 GLN HGy H 1 2.122 0.010 A 7 GLN N N 15 117.062 0.010 A 7 GLN NE2 N 15 107.922 0.010 A 8 LYS H H 1 7.366 0.010 A 8 LYS HA H 1 3.845 0.010 A 8 LYS HBx H 1 1.659 0.010 A 8 LYS HBy H 1 1.744 0.010 A 8 LYS HDx H 1 1.512 0.010 A 8 LYS HDy H 1 1.513 0.010 A 8 LYS HEx H 1 2.759 0.010 A 8 LYS HEy H 1 2.759 0.010 A 8 LYS HGx H 1 1.354 0.010 A 8 LYS HGy H 1 1.355 0.010 A 8 LYS HZ1 H 1 7.341 0.010 A 8 LYS HZ2 H 1 7.341 0.010 A 8 LYS HZ3 H 1 7.341 0.010 A 8 LYS N N 15 117.944 0.010 A 9 LYS H H 1 7.996 0.010 A 9 LYS HA H 1 3.969 0.010 A 9 LYS HBx H 1 1.220 0.010 A 9 LYS HBy H 1 1.221 0.010 A 9 LYS HDx H 1 1.166 0.010 A 9 LYS HDy H 1 1.167 0.010 A 9 LYS HGx H 1 0.831 0.010 A 9 LYS HGy H 1 0.832 0.010 A 9 LYS N N 15 115.014 0.010 A 10 HIS H H 1 7.785 0.010 A 10 HIS HA H 1 4.536 0.010 A 10 HIS HBx H 1 1.637 0.010 A 10 HIS HBy H 1 2.526 0.010 A 10 HIS HD2 H 1 7.834 0.010 A 10 HIS HE1 H 1 6.993 0.010 A 10 HIS N N 15 107.185 0.010 A 11 ILE H H 1 8.179 0.010 A 11 ILE HA H 1 5.064 0.010 A 11 ILE HB H 1 2.149 0.010 A 11 ILE HD1% H 1 0.365 0.010 A 11 ILE HG1x H 1 1.246 0.010 A 11 ILE HG1y H 1 1.562 0.010 A 11 ILE HG2% H 1 0.978 0.010 A 11 ILE N N 15 121.378 0.010 A 12 THR H H 1 8.546 0.010 A 12 THR HA H 1 5.002 0.010 A 12 THR HB H 1 3.647 0.010 A 12 THR HG2% H 1 1.001 0.010 A 12 THR N N 15 120.322 0.010 A 13 ASN H H 1 8.263 0.010 A 13 ASN HA H 1 4.827 0.010 A 13 ASN HBx H 1 2.735 0.010 A 13 ASN HBy H 1 2.992 0.010 A 13 ASN HD2y H 1 7.527 0.010 A 13 ASN HD2x H 1 6.750 0.010 A 13 ASN N N 15 123.517 0.010 A 13 ASN ND2 N 15 111.421 0.010 A 14 THR H H 1 7.878 0.010 A 14 THR HA H 1 4.395 0.010 A 14 THR HB H 1 3.830 0.010 A 14 THR HG2% H 1 0.723 0.010 A 14 THR N N 15 113.563 0.010 A 15 ARG H H 1 8.545 0.010 A 15 ARG HA H 1 3.448 0.010 A 15 ARG HBx H 1 1.257 0.010 A 15 ARG HBy H 1 1.258 0.010 A 15 ARG HDx H 1 3.459 0.010 A 15 ARG HDy H 1 3.460 0.010 A 15 ARG HE H 1 8.163 0.010 A 15 ARG HGx H 1 1.538 0.010 A 15 ARG HGy H 1 1.671 0.010 A 15 ARG N N 15 126.331 0.010 A 16 ASP H H 1 7.846 0.010 A 16 ASP HA H 1 4.512 0.010 A 16 ASP HBx H 1 2.128 0.010 A 16 ASP HBy H 1 2.304 0.010 A 16 ASP N N 15 121.932 0.010 A 17 VAL H H 1 6.499 0.010 A 17 VAL HA H 1 2.954 0.010 A 17 VAL HB H 1 1.215 0.010 A 17 VAL HG1% H 1 0.328 0.010 A 17 VAL HG2% H 1 -0.171 0.010 A 17 VAL N N 15 121.499 0.010 A 18 ASP H H 1 8.566 0.010 A 18 ASP HA H 1 4.524 0.010 A 18 ASP HBx H 1 2.362 0.010 A 18 ASP HBy H 1 2.783 0.010 A 18 ASP N N 15 127.059 0.010 A 19 CYS H H 1 7.838 0.010 A 19 CYS HA H 1 3.556 0.010 A 19 CYS HBx H 1 2.862 0.010 A 19 CYS HBy H 1 2.863 0.010 A 19 CYS N N 15 120.870 0.010 A 20 ASP H H 1 8.819 0.010 A 20 ASP HA H 1 4.298 0.010 A 20 ASP HBx H 1 2.510 0.010 A 20 ASP HBy H 1 2.680 0.010 A 20 ASP N N 15 118.657 0.010 A 21 ASN H H 1 6.997 0.010 A 21 ASN HA H 1 4.589 0.010 A 21 ASN HBx H 1 2.497 0.010 A 21 ASN HBy H 1 2.498 0.010 A 21 ASN HD2y H 1 8.296 0.010 A 21 ASN HD2x H 1 6.781 0.010 A 21 ASN N N 15 114.544 0.010 A 21 ASN ND2 N 15 115.555 0.010 A 22 ILE H H 1 7.844 0.010 A 22 ILE HA H 1 3.957 0.010 A 22 ILE HB H 1 1.428 0.010 A 22 ILE HD1% H 1 0.632 0.010 A 22 ILE HG1x H 1 1.094 0.010 A 22 ILE HG1y H 1 1.300 0.010 A 22 ILE HG2% H 1 0.425 0.010 A 22 ILE N N 15 119.569 0.010 A 23 MET H H 1 8.494 0.010 A 23 MET HA H 1 4.138 0.010 A 23 MET HBx H 1 1.591 0.010 A 23 MET HBy H 1 1.851 0.010 A 23 MET HGx H 1 2.522 0.010 A 23 MET HGy H 1 2.523 0.010 A 23 MET N N 15 117.955 0.010 A 24 SER H H 1 7.101 0.010 A 24 SER HA H 1 4.114 0.010 A 24 SER HBx H 1 3.973 0.010 A 24 SER HBy H 1 3.974 0.010 A 24 SER N N 15 108.759 0.010 A 25 THR H H 1 7.455 0.010 A 25 THR HA H 1 4.553 0.010 A 25 THR HB H 1 4.468 0.010 A 25 THR HG2% H 1 1.440 0.010 A 25 THR N N 15 113.003 0.010 A 26 ASN H H 1 7.468 0.010 A 26 ASN HA H 1 4.070 0.010 A 26 ASN HBx H 1 2.740 0.010 A 26 ASN HBy H 1 2.741 0.010 A 26 ASN HD2y H 1 7.639 0.010 A 26 ASN HD2x H 1 6.881 0.010 A 26 ASN N N 15 117.889 0.010 A 26 ASN ND2 N 15 112.766 0.010 A 27 LEU H H 1 7.379 0.010 A 27 LEU HA H 1 3.763 0.010 A 27 LEU HBx H 1 1.659 0.010 A 27 LEU HBy H 1 1.732 0.010 A 27 LEU HD1% H 1 0.345 0.010 A 27 LEU HD2% H 1 0.527 0.010 A 27 LEU HG H 1 1.093 0.010 A 27 LEU N N 15 117.538 0.010 A 28 PHE H H 1 6.693 0.010 A 28 PHE HA H 1 4.334 0.010 A 28 PHE HBx H 1 2.874 0.010 A 28 PHE HBy H 1 2.875 0.010 A 28 PHE HDx H 1 6.893 0.010 A 28 PHE HDy H 1 6.893 0.010 A 28 PHE HEx H 1 6.816 0.010 A 28 PHE HEy H 1 6.816 0.010 A 28 PHE HZ H 1 6.201 0.010 A 28 PHE N N 15 113.427 0.010 A 29 HIS H H 1 8.798 0.010 A 29 HIS HA H 1 4.249 0.010 A 29 HIS HBx H 1 2.948 0.010 A 29 HIS HBy H 1 3.179 0.010 A 29 HIS HD2 H 1 7.652 0.010 A 29 HIS HE1 H 1 6.848 0.010 A 29 HIS N N 15 114.076 0.010 A 30 CYS H H 1 9.153 0.010 A 30 CYS HA H 1 4.512 0.010 A 30 CYS HBx H 1 3.192 0.010 A 30 CYS HBy H 1 3.262 0.010 A 30 CYS N N 15 109.137 0.010 A 31 LYS H H 1 7.521 0.010 A 31 LYS HA H 1 4.334 0.010 A 31 LYS HBx H 1 2.144 0.010 A 31 LYS HBy H 1 2.145 0.010 A 31 LYS HDx H 1 1.658 0.010 A 31 LYS HDy H 1 1.659 0.010 A 31 LYS HEx H 1 2.891 0.010 A 31 LYS HEy H 1 2.891 0.010 A 31 LYS HGx H 1 1.330 0.010 A 31 LYS HGy H 1 1.331 0.010 A 31 LYS HZ1 H 1 7.089 0.010 A 31 LYS HZ2 H 1 7.089 0.010 A 31 LYS HZ3 H 1 7.089 0.010 A 31 LYS N N 15 117.016 0.010 A 32 ASP H H 1 8.496 0.010 A 32 ASP HA H 1 4.139 0.010 A 32 ASP HBx H 1 2.679 0.010 A 32 ASP HBy H 1 2.680 0.010 A 32 ASP N N 15 120.267 0.010 A 33 LYS H H 1 7.519 0.010 A 33 LYS HA H 1 5.563 0.010 A 33 LYS HBx H 1 1.755 0.010 A 33 LYS HBy H 1 1.756 0.010 A 33 LYS HDx H 1 1.524 0.010 A 33 LYS HDy H 1 1.525 0.010 A 33 LYS HEx H 1 2.848 0.010 A 33 LYS HEy H 1 2.848 0.010 A 33 LYS HGx H 1 1.293 0.010 A 33 LYS HGy H 1 1.294 0.010 A 33 LYS HZ1 H 1 6.935 0.010 A 33 LYS HZ2 H 1 6.935 0.010 A 33 LYS HZ3 H 1 6.935 0.010 A 33 LYS N N 15 114.737 0.010 A 34 ASN H H 1 7.794 0.010 A 34 ASN HA H 1 4.477 0.010 A 34 ASN HBx H 1 1.732 0.010 A 34 ASN HBy H 1 2.011 0.010 A 34 ASN HD2y H 1 6.088 0.010 A 34 ASN HD2x H 1 3.496 0.010 A 34 ASN N N 15 116.413 0.010 A 34 ASN ND2 N 15 116.121 0.010 A 35 THR H H 1 7.819 0.010 A 35 THR HA H 1 4.454 0.010 A 35 THR HB H 1 2.374 0.010 A 35 THR HG2% H 1 0.724 0.010 A 35 THR N N 15 122.595 0.010 A 36 PHE H H 1 9.192 0.010 A 36 PHE HA H 1 4.465 0.010 A 36 PHE HBx H 1 2.397 0.010 A 36 PHE HBy H 1 2.888 0.010 A 36 PHE HDx H 1 6.806 0.010 A 36 PHE HDy H 1 6.806 0.010 A 36 PHE HEx H 1 6.485 0.010 A 36 PHE HEy H 1 6.485 0.010 A 36 PHE HZ H 1 5.988 0.010 A 36 PHE N N 15 125.174 0.010 A 37 ILE H H 1 9.389 0.010 A 37 ILE HA H 1 4.197 0.010 A 37 ILE HB H 1 1.731 0.010 A 37 ILE HD1% H 1 -0.009 0.010 A 37 ILE HG1x H 1 1.127 0.010 A 37 ILE HG1y H 1 1.205 0.010 A 37 ILE HG2% H 1 0.766 0.010 A 37 ILE N N 15 122.998 0.010 A 38 TYR H H 1 8.959 0.010 A 38 TYR HA H 1 5.341 0.010 A 38 TYR HBx H 1 2.525 0.010 A 38 TYR HBy H 1 3.086 0.010 A 38 TYR HDx H 1 6.836 0.010 A 38 TYR HDy H 1 6.836 0.010 A 38 TYR HEx H 1 6.582 0.010 A 38 TYR HEy H 1 6.582 0.010 A 38 TYR N N 15 129.369 0.010 A 39 SER H H 1 7.608 0.010 A 39 SER HA H 1 4.298 0.010 A 39 SER HBx H 1 3.106 0.010 A 39 SER HBy H 1 4.103 0.010 A 39 SER N N 15 121.061 0.010 A 40 ARG H H 1 8.441 0.010 A 40 ARG HA H 1 4.633 0.010 A 40 ARG HBx H 1 1.780 0.010 A 40 ARG HBy H 1 1.813 0.010 A 40 ARG HDx H 1 3.232 0.010 A 40 ARG HDy H 1 3.282 0.010 A 40 ARG HE H 1 7.194 0.010 A 40 ARG HGx H 1 1.613 0.010 A 40 ARG HGy H 1 1.614 0.010 A 40 ARG N N 15 123.846 0.010 A 41 PRO HA H 1 3.881 0.010 A 41 PRO HBx H 1 2.317 0.010 A 41 PRO HBy H 1 2.318 0.010 A 41 PRO HDx H 1 3.611 0.010 A 41 PRO HDy H 1 3.832 0.010 A 41 PRO HGx H 1 2.227 0.010 A 41 PRO HGy H 1 2.228 0.010 A 42 GLU H H 1 9.361 0.010 A 42 GLU HA H 1 4.103 0.010 A 42 GLU HBx H 1 1.929 0.010 A 42 GLU HBy H 1 1.930 0.010 A 42 GLU HGx H 1 2.256 0.010 A 42 GLU HGy H 1 2.257 0.010 A 42 GLU N N 15 118.394 0.010 A 43 PRO HA H 1 4.371 0.010 A 43 PRO HBx H 1 2.387 0.010 A 43 PRO HBy H 1 2.388 0.010 A 43 PRO HDx H 1 3.832 0.010 A 43 PRO HDy H 1 3.877 0.010 A 43 PRO HGx H 1 2.023 0.010 A 43 PRO HGy H 1 2.024 0.010 A 44 VAL H H 1 6.810 0.010 A 44 VAL HA H 1 3.823 0.010 A 44 VAL HB H 1 2.510 0.010 A 44 VAL HG1% H 1 1.185 0.010 A 44 VAL HG2% H 1 1.112 0.010 A 44 VAL N N 15 116.005 0.010 A 45 LYS H H 1 8.399 0.010 A 45 LYS HA H 1 2.748 0.010 A 45 LYS HBx H 1 1.496 0.010 A 45 LYS HBy H 1 1.497 0.010 A 45 LYS HDx H 1 1.346 0.010 A 45 LYS HDy H 1 1.347 0.010 A 45 LYS HGx H 1 1.146 0.010 A 45 LYS HGy H 1 1.147 0.010 A 45 LYS N N 15 121.531 0.010 A 46 ALA H H 1 7.601 0.010 A 46 ALA HA H 1 3.823 0.010 A 46 ALA HB% H 1 1.343 0.010 A 46 ALA N N 15 115.333 0.010 A 47 ILE H H 1 7.345 0.010 A 47 ILE HA H 1 3.592 0.010 A 47 ILE HB H 1 1.623 0.010 A 47 ILE HD1% H 1 0.432 0.010 A 47 ILE HG1x H 1 1.166 0.010 A 47 ILE HG1y H 1 1.167 0.010 A 47 ILE HG2% H 1 0.583 0.010 A 47 ILE N N 15 119.605 0.010 A 48 CYS H H 1 7.094 0.010 A 48 CYS HA H 1 4.589 0.010 A 48 CYS HBx H 1 1.756 0.010 A 48 CYS HBy H 1 2.851 0.010 A 48 CYS N N 15 111.804 0.010 A 49 LYS H H 1 7.223 0.010 A 49 LYS HA H 1 3.787 0.010 A 49 LYS HBx H 1 1.695 0.010 A 49 LYS HBy H 1 1.696 0.010 A 49 LYS HDx H 1 1.475 0.010 A 49 LYS HDy H 1 1.475 0.010 A 49 LYS HEx H 1 2.863 0.010 A 49 LYS HEy H 1 2.863 0.010 A 49 LYS HGx H 1 1.306 0.010 A 49 LYS HGy H 1 1.307 0.010 A 49 LYS N N 15 123.849 0.010 A 50 GLY H H 1 9.126 0.010 A 50 GLY HAy H 1 4.018 0.010 A 50 GLY HAx H 1 3.398 0.010 A 50 GLY N N 15 114.134 0.010 A 51 ILE H H 1 7.759 0.010 A 51 ILE HA H 1 3.904 0.010 A 51 ILE HB H 1 1.683 0.010 A 51 ILE HD1% H 1 0.989 0.010 A 51 ILE HG1x H 1 1.161 0.010 A 51 ILE HG1y H 1 1.246 0.010 A 51 ILE HG2% H 1 0.644 0.010 A 51 ILE N N 15 122.336 0.010 A 52 ILE H H 1 8.204 0.010 A 52 ILE HA H 1 3.706 0.010 A 52 ILE HB H 1 1.824 0.010 A 52 ILE HD1% H 1 0.668 0.010 A 52 ILE HG1x H 1 1.088 0.010 A 52 ILE HG1y H 1 1.322 0.010 A 52 ILE HG2% H 1 0.866 0.010 A 52 ILE N N 15 128.010 0.010 A 53 ALA H H 1 7.722 0.010 A 53 ALA HA H 1 4.220 0.010 A 53 ALA HB% H 1 1.287 0.010 A 53 ALA N N 15 123.517 0.010 A 54 SER H H 1 7.929 0.010 A 54 SER HA H 1 4.885 0.010 A 54 SER HBx H 1 3.604 0.010 A 54 SER HBy H 1 3.605 0.010 A 54 SER N N 15 112.613 0.010 A 55 LYS H H 1 8.361 0.010 A 55 LYS HA H 1 4.261 0.010 A 55 LYS HBx H 1 1.731 0.010 A 55 LYS HBy H 1 1.732 0.010 A 55 LYS HDx H 1 1.500 0.010 A 55 LYS HDy H 1 1.501 0.010 A 55 LYS HEx H 1 2.863 0.010 A 55 LYS HEy H 1 2.863 0.010 A 55 LYS HGx H 1 1.281 0.010 A 55 LYS HGy H 1 1.282 0.010 A 55 LYS N N 15 126.198 0.010 A 56 ASN H H 1 8.677 0.010 A 56 ASN HA H 1 5.629 0.010 A 56 ASN HBx H 1 2.273 0.010 A 56 ASN HBy H 1 2.662 0.010 A 56 ASN HD2y H 1 7.550 0.010 A 56 ASN HD2x H 1 7.005 0.010 A 56 ASN N N 15 125.474 0.010 A 56 ASN ND2 N 15 112.160 0.010 A 57 VAL H H 1 9.071 0.010 A 57 VAL HA H 1 4.102 0.010 A 57 VAL HB H 1 1.695 0.010 A 57 VAL HG1% H 1 0.645 0.010 A 57 VAL HG2% H 1 0.528 0.010 A 57 VAL N N 15 122.842 0.010 A 58 LEU H H 1 8.003 0.010 A 58 LEU HA H 1 4.565 0.010 A 58 LEU HBx H 1 1.124 0.010 A 58 LEU HBy H 1 1.551 0.010 A 58 LEU HD1% H 1 0.727 0.010 A 58 LEU HD2% H 1 0.522 0.010 A 58 LEU HG H 1 1.683 0.010 A 58 LEU N N 15 126.427 0.010 A 59 THR H H 1 8.729 0.010 A 59 THR HA H 1 4.018 0.010 A 59 THR HB H 1 4.121 0.010 A 59 THR HG2% H 1 1.100 0.010 A 59 THR N N 15 117.852 0.010 A 60 THR H H 1 8.464 0.010 A 60 THR HA H 1 4.152 0.010 A 60 THR HB H 1 4.273 0.010 A 60 THR HG2% H 1 1.173 0.010 A 60 THR N N 15 110.875 0.010 A 61 SER H H 1 7.518 0.010 A 61 SER HA H 1 4.553 0.010 A 61 SER HBx H 1 3.567 0.010 A 61 SER HBy H 1 3.568 0.010 A 61 SER N N 15 114.743 0.010 A 62 GLU H H 1 8.363 0.010 A 62 GLU HA H 1 4.045 0.010 A 62 GLU HBx H 1 1.579 0.010 A 62 GLU HBy H 1 1.661 0.010 A 62 GLU HGx H 1 2.005 0.010 A 62 GLU HGy H 1 2.117 0.010 A 62 GLU N N 15 119.457 0.010 A 63 PHE H H 1 8.539 0.010 A 63 PHE HA H 1 4.512 0.010 A 63 PHE HBx H 1 2.923 0.010 A 63 PHE HBy H 1 3.250 0.010 A 63 PHE HDx H 1 7.362 0.010 A 63 PHE HDy H 1 7.362 0.010 A 63 PHE HEx H 1 7.361 0.010 A 63 PHE HEy H 1 7.361 0.010 A 63 PHE HZ H 1 7.360 0.010 A 63 PHE N N 15 121.301 0.010 A 64 TYR H H 1 9.648 0.010 A 64 TYR HA H 1 4.839 0.010 A 64 TYR HBx H 1 2.922 0.010 A 64 TYR HBy H 1 3.495 0.010 A 64 TYR HDx H 1 7.310 0.010 A 64 TYR HDy H 1 7.310 0.010 A 64 TYR HEx H 1 6.834 0.010 A 64 TYR HEy H 1 6.834 0.010 A 64 TYR N N 15 119.292 0.010 A 65 LEU H H 1 9.244 0.010 A 65 LEU HA H 1 5.308 0.010 A 65 LEU HBx H 1 1.881 0.010 A 65 LEU HBy H 1 1.882 0.010 A 65 LEU HD1% H 1 0.863 0.010 A 65 LEU HD2% H 1 0.607 0.010 A 65 LEU HG H 1 1.167 0.010 A 65 LEU N N 15 125.959 0.010 A 66 SER H H 1 9.446 0.010 A 66 SER HA H 1 5.096 0.010 A 66 SER HBx H 1 3.623 0.010 A 66 SER HBy H 1 3.845 0.010 A 66 SER N N 15 121.031 0.010 A 67 ASP H H 1 9.348 0.010 A 67 ASP HA H 1 5.459 0.010 A 67 ASP HBx H 1 2.431 0.010 A 67 ASP HBy H 1 2.516 0.010 A 67 ASP N N 15 125.532 0.010 A 68 CYS H H 1 8.355 0.010 A 68 CYS HA H 1 5.131 0.010 A 68 CYS HBx H 1 2.280 0.010 A 68 CYS HBy H 1 2.607 0.010 A 68 CYS N N 15 118.606 0.010 A 69 ASN H H 1 8.586 0.010 A 69 ASN HA H 1 5.471 0.010 A 69 ASN HBx H 1 2.647 0.010 A 69 ASN HBy H 1 2.735 0.010 A 69 ASN HD2y H 1 7.342 0.010 A 69 ASN HD2x H 1 7.095 0.010 A 69 ASN N N 15 121.731 0.010 A 69 ASN ND2 N 15 111.409 0.010 A 70 VAL H H 1 9.041 0.010 A 70 VAL HA H 1 3.446 0.010 A 70 VAL HB H 1 2.082 0.010 A 70 VAL HG1% H 1 0.831 0.010 A 70 VAL HG2% H 1 0.668 0.010 A 70 VAL N N 15 128.654 0.010 A 71 THR H H 1 8.073 0.010 A 71 THR HA H 1 4.562 0.010 A 71 THR HB H 1 4.771 0.010 A 71 THR HG2% H 1 1.076 0.010 A 71 THR N N 15 116.683 0.010 A 72 SER H H 1 8.060 0.010 A 72 SER HA H 1 4.102 0.010 A 72 SER HBx H 1 3.810 0.010 A 72 SER HBy H 1 3.927 0.010 A 73 ARG H H 1 7.728 0.010 A 73 ARG HA H 1 4.577 0.010 A 73 ARG HBx H 1 1.380 0.010 A 73 ARG HBy H 1 1.489 0.010 A 73 ARG HDx H 1 3.056 0.010 A 73 ARG HDy H 1 3.057 0.010 A 73 ARG HE H 1 6.954 0.010 A 73 ARG HGx H 1 1.418 0.010 A 73 ARG HGy H 1 1.419 0.010 A 73 ARG N N 15 124.362 0.010 A 74 PRO HA H 1 3.845 0.010 A 74 PRO HBx H 1 2.127 0.010 A 74 PRO HBy H 1 2.128 0.010 A 74 PRO HDx H 1 3.445 0.010 A 74 PRO HDy H 1 3.787 0.010 A 74 PRO HGx H 1 1.950 0.010 A 74 PRO HGy H 1 1.951 0.010 A 75 CYS H H 1 8.594 0.010 A 75 CYS HA H 1 4.113 0.010 A 75 CYS HBx H 1 3.703 0.010 A 75 CYS HBy H 1 3.704 0.010 A 75 CYS N N 15 120.291 0.010 A 76 LYS H H 1 7.041 0.010 A 76 LYS HA H 1 4.745 0.010 A 76 LYS HBx H 1 1.542 0.010 A 76 LYS HBy H 1 1.543 0.010 A 76 LYS HDx H 1 1.403 0.010 A 76 LYS HDy H 1 1.404 0.010 A 76 LYS HGx H 1 1.062 0.010 A 76 LYS HGy H 1 1.063 0.010 A 76 LYS N N 15 116.469 0.010 A 77 TYR H H 1 9.907 0.010 A 77 TYR HA H 1 4.301 0.010 A 77 TYR HBx H 1 2.513 0.010 A 77 TYR HBy H 1 2.601 0.010 A 77 TYR HDx H 1 7.151 0.010 A 77 TYR HDy H 1 7.151 0.010 A 77 TYR HEx H 1 6.305 0.010 A 77 TYR HEy H 1 6.305 0.010 A 77 TYR N N 15 123.774 0.010 A 78 LYS H H 1 8.852 0.010 A 78 LYS HA H 1 4.529 0.010 A 78 LYS HBx H 1 1.625 0.010 A 78 LYS HBy H 1 1.720 0.010 A 78 LYS HDx H 1 1.597 0.010 A 78 LYS HDy H 1 1.598 0.010 A 78 LYS HEx H 1 2.887 0.010 A 78 LYS HEy H 1 2.887 0.010 A 78 LYS HGx H 1 1.330 0.010 A 78 LYS HGy H 1 1.331 0.010 A 78 LYS HZ1 H 1 7.088 0.010 A 78 LYS HZ2 H 1 7.088 0.010 A 78 LYS HZ3 H 1 7.088 0.010 A 78 LYS N N 15 120.664 0.010 A 79 LEU H H 1 8.392 0.010 A 79 LEU HA H 1 5.259 0.010 A 79 LEU HBx H 1 1.532 0.010 A 79 LEU HBy H 1 1.730 0.010 A 79 LEU HD1% H 1 0.983 0.010 A 79 LEU HD2% H 1 0.890 0.010 A 79 LEU HG H 1 1.322 0.010 A 79 LEU N N 15 126.842 0.010 A 80 LYS H H 1 9.300 0.010 A 80 LYS HA H 1 4.745 0.010 A 80 LYS HBx H 1 1.693 0.010 A 80 LYS HBy H 1 1.797 0.010 A 80 LYS HDy H 1 1.590 0.010 A 80 LYS HDx H 1 1.510 0.010 A 80 LYS HGx H 1 1.275 0.010 A 80 LYS HGy H 1 1.357 0.010 A 80 LYS N N 15 128.617 0.010 A 81 LYS H H 1 9.242 0.010 A 81 LYS HA H 1 5.159 0.010 A 81 LYS HBx H 1 1.730 0.010 A 81 LYS HBy H 1 1.731 0.010 A 81 LYS HDx H 1 1.342 0.010 A 81 LYS HDy H 1 1.520 0.010 A 81 LYS HEx H 1 2.747 0.010 A 81 LYS HEy H 1 2.747 0.010 A 81 LYS HGx H 1 1.211 0.010 A 81 LYS HGy H 1 1.472 0.010 A 81 LYS N N 15 130.142 0.010 A 82 SER H H 1 8.828 0.010 A 82 SER HA H 1 4.753 0.010 A 82 SER HBx H 1 3.828 0.010 A 82 SER HBy H 1 3.829 0.010 A 82 SER N N 15 117.009 0.010 A 83 THR H H 1 8.402 0.010 A 83 THR HA H 1 5.374 0.010 A 83 THR HB H 1 3.878 0.010 A 83 THR HG2% H 1 0.881 0.010 A 83 THR N N 15 115.259 0.010 A 84 ASN H H 1 9.053 0.010 A 84 ASN HA H 1 4.863 0.010 A 84 ASN HBx H 1 2.565 0.010 A 84 ASN HBy H 1 3.051 0.010 A 84 ASN HD2y H 1 7.820 0.010 A 84 ASN HD2x H 1 7.181 0.010 A 84 ASN N N 15 121.758 0.010 A 84 ASN ND2 N 15 111.750 0.010 A 85 LYS H H 1 8.837 0.010 A 85 LYS HA H 1 4.401 0.010 A 85 LYS HBx H 1 1.810 0.010 A 85 LYS HBy H 1 1.811 0.010 A 85 LYS HDx H 1 1.454 0.010 A 85 LYS HDy H 1 1.455 0.010 A 85 LYS HGx H 1 1.360 0.010 A 85 LYS HGy H 1 1.361 0.010 A 85 LYS N N 15 120.865 0.010 A 86 PHE H H 1 7.830 0.010 A 86 PHE HA H 1 4.944 0.010 A 86 PHE HBx H 1 2.922 0.010 A 86 PHE HBy H 1 3.039 0.010 A 86 PHE HDx H 1 6.751 0.010 A 86 PHE HDy H 1 6.751 0.010 A 86 PHE HEx H 1 6.520 0.010 A 86 PHE HEy H 1 6.520 0.010 A 86 PHE HZ H 1 6.285 0.010 A 86 PHE N N 15 114.090 0.010 A 87 ALA H H 1 8.702 0.010 A 87 ALA HA H 1 5.715 0.010 A 87 ALA HB% H 1 0.899 0.010 A 87 ALA N N 15 121.161 0.010 A 88 VAL H H 1 8.472 0.010 A 88 VAL HA H 1 4.918 0.010 A 88 VAL HB H 1 2.073 0.010 A 88 VAL HG1% H 1 1.009 0.010 A 88 VAL HG2% H 1 0.547 0.010 A 88 VAL N N 15 112.187 0.010 A 89 THR H H 1 8.469 0.010 A 89 THR HA H 1 4.760 0.010 A 89 THR HB H 1 3.714 0.010 A 89 THR HG2% H 1 1.015 0.010 A 89 THR N N 15 118.002 0.010 A 90 CYS H H 1 9.106 0.010 A 90 CYS HA H 1 5.049 0.010 A 90 CYS HBx H 1 2.475 0.010 A 90 CYS HBy H 1 2.689 0.010 A 90 CYS N N 15 126.735 0.010 A 91 GLU H H 1 8.687 0.010 A 91 GLU HA H 1 4.079 0.010 A 91 GLU HBx H 1 1.804 0.010 A 91 GLU HBy H 1 1.805 0.010 A 91 GLU HGx H 1 2.060 0.010 A 91 GLU HGy H 1 2.133 0.010 A 91 GLU N N 15 118.639 0.010 A 92 ASN H H 1 10.229 0.010 A 92 ASN HA H 1 4.237 0.010 A 92 ASN HBx H 1 2.656 0.010 A 92 ASN HBy H 1 2.997 0.010 A 92 ASN HD2y H 1 7.663 0.010 A 92 ASN HD2x H 1 6.855 0.010 A 92 ASN N N 15 126.427 0.010 A 92 ASN ND2 N 15 113.599 0.010 A 93 GLN H H 1 8.746 0.010 A 93 GLN HA H 1 3.939 0.010 A 93 GLN HBx H 1 1.531 0.010 A 93 GLN HBy H 1 1.532 0.010 A 93 GLN HE2y H 1 7.677 0.010 A 93 GLN HE2x H 1 6.986 0.010 A 93 GLN HGx H 1 1.952 0.010 A 93 GLN HGy H 1 2.129 0.010 A 93 GLN N N 15 105.324 0.010 A 93 GLN NE2 N 15 114.227 0.010 A 94 ALA H H 1 7.487 0.010 A 94 ALA HA H 1 4.313 0.010 A 94 ALA HB% H 1 0.819 0.010 A 94 ALA N N 15 118.760 0.010 A 95 PRO HA H 1 5.061 0.010 A 95 PRO HBx H 1 2.069 0.010 A 95 PRO HBy H 1 2.070 0.010 A 95 PRO HDx H 1 3.716 0.010 A 95 PRO HDy H 1 3.717 0.010 A 95 PRO HGx H 1 1.601 0.010 A 95 PRO HGy H 1 1.602 0.010 A 96 VAL H H 1 8.499 0.010 A 96 VAL HA H 1 4.443 0.010 A 96 VAL HB H 1 1.598 0.010 A 96 VAL HG1% H 1 0.831 0.010 A 96 VAL HG2% H 1 0.620 0.010 A 96 VAL N N 15 108.711 0.010 A 97 HIS H H 1 7.326 0.010 A 97 HIS HA H 1 5.400 0.010 A 97 HIS HBx H 1 2.840 0.010 A 97 HIS HBy H 1 3.051 0.010 A 97 HIS HD2 H 1 6.791 0.010 A 97 HIS HE1 H 1 6.939 0.010 A 97 HIS N N 15 116.780 0.010 A 98 PHE H H 1 8.120 0.010 A 98 PHE HA H 1 4.430 0.010 A 98 PHE HBx H 1 2.899 0.010 A 98 PHE HBy H 1 3.021 0.010 A 98 PHE HDx H 1 6.583 0.010 A 98 PHE HDy H 1 6.583 0.010 A 98 PHE HEx H 1 6.930 0.010 A 98 PHE HEy H 1 6.930 0.010 A 98 PHE HZ H 1 6.772 0.010 A 99 VAL H H 1 8.208 0.010 A 99 VAL HA H 1 3.829 0.010 A 99 VAL HB H 1 1.369 0.010 A 99 VAL HG1% H 1 0.644 0.010 A 99 VAL HG2% H 1 0.551 0.010 A 99 VAL N N 15 129.253 0.010 A 100 GLY H H 1 6.578 0.010 A 100 GLY HAy H 1 4.212 0.010 A 100 GLY HAx H 1 3.921 0.010 A 100 GLY N N 15 104.609 0.010 A 101 VAL H H 1 8.454 0.010 A 101 VAL HA H 1 4.371 0.010 A 101 VAL HB H 1 2.097 0.010 A 101 VAL HG1% H 1 1.033 0.010 A 101 VAL HG2% H 1 1.032 0.010 A 101 VAL N N 15 116.884 0.010 A 102 GLY H H 1 8.333 0.010 A 102 GLY HAy H 1 3.945 0.010 A 102 GLY HAx H 1 3.641 0.010 A 102 GLY N N 15 112.591 0.010 A 103 SER H H 1 7.904 0.010 A 103 SER HA H 1 4.322 0.010 A 103 SER HBx H 1 3.677 0.010 A 103 SER HBy H 1 3.775 0.010 A 103 SER N N 15 114.061 0.010 A 104 ALA H H 1 7.910 0.010 A 104 ALA HA H 1 4.006 0.010 A 104 ALA HB% H 1 1.173 0.010 A 104 ALA N N 15 130.752 0.010 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 42 GLU H A 43 PRO HDy 1.0 1.829 3.837 2 2 A 67 ASP H A 79 LEU HA 1.0 2.000 6.030 3 3 A 67 ASP H A 81 LYS HA 1.0 1.810 3.726 4 4 A 65 LEU H A 66 SER H 1.0 1.893 4.253 5 5 A 65 LEU H A 64 TYR HDy 1.0 1.954 4.832 6 5 A 65 LEU H A 64 TYR HDx 1.0 1.954 4.832 7 6 A 81 LYS H A 80 LYS HA 1.0 1.869 4.081 8 7 A 30 CYS H A 30 CYS HBx 1.0 1.904 4.338 9 8 A 57 VAL H A 56 ASN HD2y 1.0 1.940 4.672 10 9 A 70 VAL H A 69 ASN HBx 1.0 1.976 5.150 11 10 A 38 TYR H A 65 LEU HA 1.0 1.897 4.287 12 11 A 78 LYS H A 77 TYR HEy 1.0 1.998 5.730 13 11 A 78 LYS H A 77 TYR HEx 1.0 1.998 5.730 14 12 A 59 THR H A 58 LEU HBx 1.0 1.791 3.621 15 13 A 99 VAL H A 101 VAL H 1.0 1.999 6.151 16 14 A 89 THR H A 56 ASN HA 1.0 1.939 4.671 17 15 A 101 VAL H A 86 PHE HBx 1.0 1.953 4.811 18 16 A 83 THR H A 83 THR HB 1.0 1.664 3.056 19 17 A 55 LYS H A 91 GLU HA 1.0 1.907 4.365 20 18 A 11 ILE H A 10 HIS HBy 1.0 1.749 3.417 21 19 A 98 PHE H A 97 HIS HA 1.0 1.661 3.043 22 20 A 98 PHE H A 97 HIS HBx 1.0 1.807 3.711 23 21 A 98 PHE H A 98 PHE HBx 1.0 1.858 4.008 24 22 A 98 PHE H A 98 PHE HBy 1.0 1.887 4.211 25 23 A 7 GLN H A 10 HIS H 1.0 1.934 4.614 26 24 A 72 SER H A 72 SER HBx 1.0 1.871 4.101 27 25 A 71 THR H A 77 TYR HBy 1.0 1.908 4.380 28 26 A 72 SER H A 71 THR HA 1.0 1.802 3.678 29 27 A 72 SER H A 71 THR HG2% 1.0 1.684 3.138 30 28 A 7 GLN H A 5 THR HB 1.0 1.992 6.524 31 29 A 11 ILE H A 9 LYS H 1.0 1.789 3.615 32 30 A 9 LYS H A 27 LEU HD1% 1.0 1.985 5.317 33 31 A 19 CYS H A 18 ASP HBx 1.0 1.927 4.541 34 32 A 22 ILE H A 22 ILE HG1x 1.0 1.839 3.889 35 33 A 19 CYS H A 17 VAL HG1% 1.0 1.999 6.091 36 34 A 84 ASN HD2y A 86 PHE HA 1.0 1.856 3.998 37 35 A 53 ALA H A 52 ILE HG1x 1.0 1.677 3.107 38 36 A 29 HIS HD2 A 29 HIS HBy 1.0 1.876 4.132 39 37 A 70 VAL H A 33 LYS H 1.0 1.959 4.899 40 38 A 26 ASN H A 29 HIS HA 1.0 1.967 4.999 41 39 A 64 TYR H A 63 PHE HDy 1.0 1.884 4.188 42 39 A 64 TYR H A 63 PHE HDx 1.0 1.884 4.188 43 40 A 61 SER H A 63 PHE HEy 1.0 1.627 2.919 44 40 A 63 PHE HEx A 61 SER H 1.0 1.627 2.919 45 41 A 63 PHE HDy A 86 PHE HEx 1.0 1.775 3.545 46 41 A 63 PHE HDy A 86 PHE HEy 1.0 1.775 3.545 47 41 A 63 PHE HDx A 86 PHE HEy 1.0 1.775 3.545 48 41 A 63 PHE HDx A 86 PHE HEx 1.0 1.775 3.545 49 42 A 63 PHE HDy A 63 PHE HA 1.0 1.727 3.319 50 42 A 63 PHE HDx A 63 PHE HA 1.0 1.727 3.319 51 43 A 63 PHE HDy A 85 LYS HA 1.0 1.883 4.181 52 43 A 63 PHE HDx A 85 LYS HA 1.0 1.883 4.181 53 44 A 63 PHE HDy A 39 SER HBx 1.0 1.735 3.351 54 44 A 63 PHE HDx A 39 SER HBx 1.0 1.735 3.351 55 45 A 63 PHE HDy A 62 GLU HA 1.0 1.756 3.448 56 45 A 63 PHE HDx A 62 GLU HA 1.0 1.756 3.448 57 46 A 63 PHE HDy A 63 PHE HBx 1.0 1.659 3.039 58 46 A 63 PHE HDx A 63 PHE HBx 1.0 1.659 3.039 59 47 A 63 PHE HDy A 63 PHE HBy 1.0 1.661 3.045 60 47 A 63 PHE HDx A 63 PHE HBy 1.0 1.661 3.045 61 48 A 63 PHE HDx A 37 ILE HG2% 1.0 1.692 3.168 62 48 A 63 PHE HDy A 37 ILE HG2% 1.0 1.692 3.168 63 49 A 8 LYS HEx A 8 LYS HZ% 1.0 1.766 3.502 64 49 A 8 LYS HEy A 8 LYS HZ% 1.0 1.766 3.502 65 50 A 64 TYR HDy A 83 THR HA 1.0 1.821 3.787 66 50 A 64 TYR HDx A 83 THR HA 1.0 1.821 3.787 67 51 A 64 TYR HDy A 64 TYR HA 1.0 1.740 3.372 68 51 A 64 TYR HDx A 64 TYR HA 1.0 1.740 3.372 69 52 A 64 TYR HDy A 64 TYR HBx 1.0 1.728 3.320 70 52 A 64 TYR HDx A 64 TYR HBx 1.0 1.728 3.320 71 53 A 64 TYR HDy A 64 TYR HBy 1.0 1.746 3.402 72 53 A 64 TYR HDx A 64 TYR HBy 1.0 1.746 3.402 73 54 A 64 TYR HDx A 83 THR HG2% 1.0 1.816 3.758 74 54 A 64 TYR HDy A 83 THR HG2% 1.0 1.816 3.758 75 55 A 3 TRP HZ2 A 42 GLU HA 1.0 1.998 6.276 76 56 A 3 TRP HE3 A 45 LYS HA 1.0 1.952 4.808 77 57 A 3 TRP HD1 A 3 TRP HA 1.0 2.000 6.098 78 58 A 3 TRP HD1 A 7 GLN HE2x 1.0 1.953 4.809 79 59 A 3 TRP HD1 A 4 LEU HA 1.0 1.945 4.725 80 60 A 40 ARG HE A 40 ARG HDy 1.0 1.761 3.473 81 61 A 3 TRP HD1 A 3 TRP HBy 1.0 1.688 3.150 82 62 A 70 VAL HA A 77 TYR HDy 1.0 2.000 6.088 83 62 A 77 TYR HDx A 70 VAL HA 1.0 2.000 6.088 84 63 A 3 TRP HZ3 A 6 PHE HEy 1.0 1.678 3.110 85 63 A 3 TRP HZ3 A 6 PHE HEx 1.0 1.678 3.110 86 64 A 3 TRP HZ3 A 44 VAL HB 1.0 1.773 3.531 87 65 A 31 LYS HGx A 31 LYS HZ% 1.0 1.846 3.938 88 66 A 98 PHE HZ A 98 PHE HEy 1.0 1.686 3.144 89 66 A 98 PHE HEx A 98 PHE HZ 1.0 1.686 3.144 90 67 A 3 TRP HA A 6 PHE HDy 1.0 1.782 3.578 91 67 A 3 TRP HA A 6 PHE HDx 1.0 1.782 3.578 92 68 A 6 PHE HDy A 6 PHE HA 1.0 1.750 3.420 93 68 A 6 PHE HDx A 6 PHE HA 1.0 1.750 3.420 94 69 A 6 PHE HDy A 6 PHE HBx 1.0 1.606 2.842 95 69 A 6 PHE HDx A 6 PHE HBx 1.0 1.606 2.842 96 70 A 6 PHE HDy A 6 PHE HBy 1.0 1.780 3.568 97 70 A 6 PHE HDx A 6 PHE HBy 1.0 1.780 3.568 98 71 A 28 PHE HEx A 28 PHE HDy 1.0 1.367 2.133 99 71 A 28 PHE HEy A 28 PHE HDy 1.0 1.367 2.133 100 71 A 28 PHE HDx A 28 PHE HEy 1.0 1.367 2.133 101 71 A 28 PHE HDx A 28 PHE HEx 1.0 1.367 2.133 102 72 A 98 PHE HEy A 98 PHE HDy 1.0 1.742 3.388 103 72 A 98 PHE HEy A 98 PHE HDx 1.0 1.742 3.388 104 72 A 98 PHE HEx A 98 PHE HDy 1.0 1.742 3.388 105 72 A 98 PHE HEx A 98 PHE HDx 1.0 1.742 3.388 106 73 A 97 HIS HE1 A 99 VAL HG2% 1.0 1.725 3.307 107 74 A 28 PHE HDy A 34 ASN HD2y 1.0 1.935 4.627 108 74 A 28 PHE HDx A 34 ASN HD2y 1.0 1.935 4.627 109 75 A 28 PHE HDy A 28 PHE HA 1.0 1.648 2.994 110 75 A 28 PHE HDx A 28 PHE HA 1.0 1.648 2.994 111 76 A 28 PHE HDy A 31 LYS HEy 1.0 1.525 2.575 112 76 A 28 PHE HDy A 31 LYS HEx 1.0 1.525 2.575 113 76 A 28 PHE HDx A 31 LYS HEx 1.0 1.525 2.575 114 76 A 28 PHE HDx A 31 LYS HEy 1.0 1.525 2.575 115 77 A 28 PHE HDx A 25 THR HG2% 1.0 1.847 3.945 116 77 A 28 PHE HDy A 25 THR HG2% 1.0 1.847 3.945 117 78 A 28 PHE HDy A 31 LYS HGy 1.0 1.825 3.811 118 78 A 28 PHE HDx A 31 LYS HGy 1.0 1.825 3.811 119 79 A 98 PHE HEy A 35 THR HG2% 1.0 1.795 3.643 120 79 A 98 PHE HEx A 35 THR HG2% 1.0 1.795 3.643 121 80 A 28 PHE HDx A 22 ILE HG2% 1.0 1.701 3.207 122 80 A 28 PHE HDy A 22 ILE HG2% 1.0 1.701 3.207 123 81 A 92 ASN HD2x A 52 ILE H 1.0 1.997 6.343 124 82 A 92 ASN HD2x A 92 ASN HA 1.0 1.873 4.113 125 83 A 91 GLU HA A 92 ASN HD2x 1.0 1.988 5.406 126 84 A 29 HIS HBy A 29 HIS HE1 1.0 1.943 4.711 127 85 A 13 ASN HA A 38 TYR HDy 1.0 1.760 3.468 128 85 A 38 TYR HDx A 13 ASN HA 1.0 1.760 3.468 129 86 A 64 TYR HBx A 38 TYR HDy 1.0 1.653 3.015 130 86 A 64 TYR HBx A 38 TYR HDx 1.0 1.653 3.015 131 87 A 38 TYR HDy A 38 TYR HBx 1.0 1.610 2.858 132 87 A 38 TYR HDx A 38 TYR HBx 1.0 1.610 2.858 133 88 A 28 PHE HEy A 34 ASN HBy 1.0 1.896 4.280 134 88 A 28 PHE HEx A 34 ASN HBy 1.0 1.896 4.280 135 89 A 83 THR HG2% A 64 TYR HEx 1.0 1.719 3.283 136 89 A 83 THR HG2% A 64 TYR HEy 1.0 1.719 3.283 137 90 A 44 VAL H A 43 PRO HDx 1.0 1.856 4.000 138 91 A 66 SER HBy A 36 PHE HDy 1.0 1.760 3.470 139 91 A 36 PHE HDx A 66 SER HBy 1.0 1.760 3.470 140 92 A 44 VAL H A 44 VAL HG1% 1.0 1.800 3.672 141 93 A 36 PHE HDx A 12 THR HG2% 1.0 1.495 2.485 142 93 A 36 PHE HDy A 12 THR HG2% 1.0 1.495 2.485 143 94 A 28 PHE HEy A 27 LEU HD2% 1.0 1.722 3.296 144 94 A 28 PHE HEx A 27 LEU HD2% 1.0 1.722 3.296 145 95 A 28 PHE HEx A 22 ILE HG2% 1.0 1.696 3.188 146 95 A 28 PHE HEy A 22 ILE HG2% 1.0 1.696 3.188 147 96 A 27 LEU HD1% A 28 PHE HEx 1.0 1.679 3.115 148 96 A 27 LEU HD1% A 28 PHE HEy 1.0 1.679 3.115 149 97 A 13 ASN HD2x A 13 ASN H 1.0 1.550 2.656 150 98 A 63 PHE HDx A 86 PHE HDy 1.0 1.818 3.768 151 98 A 63 PHE HDy A 86 PHE HDy 1.0 1.818 3.768 152 98 A 63 PHE HDy A 86 PHE HDx 1.0 1.818 3.768 153 98 A 63 PHE HDx A 86 PHE HDx 1.0 1.818 3.768 154 99 A 86 PHE HDy A 58 LEU HA 1.0 1.983 5.269 155 99 A 86 PHE HDx A 58 LEU HA 1.0 1.983 5.269 156 100 A 98 PHE HZ A 101 VAL HA 1.0 1.854 3.982 157 101 A 63 PHE HBx A 86 PHE HDy 1.0 1.936 4.636 158 101 A 63 PHE HBx A 86 PHE HDx 1.0 1.936 4.636 159 102 A 86 PHE HBx A 86 PHE HDy 1.0 1.590 2.788 160 102 A 86 PHE HBx A 86 PHE HDx 1.0 1.590 2.788 161 103 A 86 PHE HDy A 86 PHE HBy 1.0 1.553 2.665 162 103 A 86 PHE HDx A 86 PHE HBy 1.0 1.553 2.665 163 104 A 98 PHE HZ A 101 VAL HB 1.0 1.961 4.925 164 105 A 98 PHE HZ A 101 VAL HG1% 1.0 1.570 2.720 165 106 A 86 PHE HDx A 65 LEU HD1% 1.0 1.735 3.355 166 106 A 86 PHE HDy A 65 LEU HD1% 1.0 1.735 3.355 167 107 A 98 PHE HZ A 35 THR HG2% 1.0 1.670 3.078 168 108 A 86 PHE HDy A 65 LEU HD2% 1.0 1.691 3.163 169 108 A 86 PHE HDx A 65 LEU HD2% 1.0 1.691 3.163 170 109 A 86 PHE HDx A 88 VAL HG2% 1.0 1.756 3.450 171 109 A 86 PHE HDy A 88 VAL HG2% 1.0 1.756 3.450 172 110 A 86 PHE HDy A 47 ILE HD1% 1.0 1.798 3.658 173 110 A 86 PHE HDx A 47 ILE HD1% 1.0 1.798 3.658 174 111 A 86 PHE HDy A 37 ILE HD1% 1.0 1.994 6.456 175 111 A 86 PHE HDx A 37 ILE HD1% 1.0 1.994 6.456 176 112 A 28 PHE HEx A 17 VAL HG2% 1.0 1.882 4.174 177 112 A 28 PHE HEy A 17 VAL HG2% 1.0 1.882 4.174 178 113 A 28 PHE HDy A 28 PHE H 1.0 1.596 2.810 179 113 A 28 PHE HDx A 28 PHE H 1.0 1.596 2.810 180 114 A 29 HIS HA A 28 PHE H 1.0 1.888 4.220 181 115 A 28 PHE H A 23 MET HA 1.0 1.859 4.013 182 116 A 28 PHE H A 27 LEU HBy 1.0 1.997 5.711 183 117 A 64 TYR HDy A 38 TYR HEy 1.0 1.895 4.271 184 117 A 64 TYR HDx A 38 TYR HEy 1.0 1.895 4.271 185 117 A 64 TYR HDy A 38 TYR HEx 1.0 1.895 4.271 186 117 A 64 TYR HDx A 38 TYR HEx 1.0 1.895 4.271 187 118 A 38 TYR HDy A 38 TYR HEy 1.0 1.439 2.325 188 118 A 38 TYR HDx A 38 TYR HEy 1.0 1.439 2.325 189 118 A 38 TYR HDy A 38 TYR HEx 1.0 1.439 2.325 190 118 A 38 TYR HDx A 38 TYR HEx 1.0 1.439 2.325 191 119 A 38 TYR HEy A 38 TYR HA 1.0 1.956 4.850 192 119 A 38 TYR HEx A 38 TYR HA 1.0 1.956 4.850 193 120 A 100 GLY H A 99 VAL HA 1.0 1.760 3.468 194 121 A 7 GLN HE2y A 7 GLN HA 1.0 2.000 6.112 195 122 A 98 PHE HBx A 98 PHE HDy 1.0 1.752 3.432 196 122 A 98 PHE HBx A 98 PHE HDx 1.0 1.752 3.432 197 123 A 98 PHE HBy A 98 PHE HDy 1.0 1.665 3.063 198 123 A 98 PHE HBy A 98 PHE HDx 1.0 1.665 3.063 199 124 A 100 GLY H A 99 VAL HG1% 1.0 1.725 3.309 200 125 A 98 PHE HDx A 37 ILE HD1% 1.0 1.892 4.250 201 125 A 98 PHE HDy A 37 ILE HD1% 1.0 1.892 4.250 202 126 A 86 PHE HEy A 86 PHE HDy 1.0 1.471 2.415 203 126 A 86 PHE HEy A 86 PHE HDx 1.0 1.471 2.415 204 126 A 86 PHE HEx A 86 PHE HDy 1.0 1.471 2.415 205 126 A 86 PHE HEx A 86 PHE HDx 1.0 1.471 2.415 206 127 A 86 PHE HEy A 63 PHE HBx 1.0 1.841 3.903 207 127 A 86 PHE HEx A 63 PHE HBx 1.0 1.841 3.903 208 128 A 86 PHE HEy A 63 PHE HBy 1.0 1.689 3.155 209 128 A 86 PHE HEx A 63 PHE HBy 1.0 1.689 3.155 210 129 A 86 PHE HEx A 88 VAL HG1% 1.0 1.537 2.613 211 129 A 86 PHE HEy A 88 VAL HG1% 1.0 1.537 2.613 212 130 A 86 PHE HEx A 37 ILE HG2% 1.0 1.733 3.347 213 130 A 86 PHE HEy A 37 ILE HG2% 1.0 1.733 3.347 214 131 A 86 PHE HEx A 65 LEU HD2% 1.0 1.717 3.277 215 131 A 86 PHE HEy A 65 LEU HD2% 1.0 1.717 3.277 216 132 A 86 PHE HEx A 88 VAL HG2% 1.0 1.721 3.287 217 132 A 86 PHE HEy A 88 VAL HG2% 1.0 1.721 3.287 218 133 A 86 PHE HEx A 47 ILE HD1% 1.0 1.703 3.213 219 133 A 86 PHE HEy A 47 ILE HD1% 1.0 1.703 3.213 220 134 A 86 PHE HEx A 37 ILE HD1% 1.0 1.916 4.444 221 134 A 86 PHE HEy A 37 ILE HD1% 1.0 1.916 4.444 222 135 A 77 TYR HEy A 77 TYR HDx 1.0 1.659 3.039 223 135 A 77 TYR HEx A 77 TYR HDy 1.0 1.659 3.039 224 135 A 77 TYR HEx A 77 TYR HDx 1.0 1.659 3.039 225 135 A 77 TYR HEy A 77 TYR HDy 1.0 1.659 3.039 226 136 A 77 TYR HEy A 33 LYS HA 1.0 1.877 8.105 227 136 A 77 TYR HEx A 33 LYS HA 1.0 1.877 8.105 228 137 A 77 TYR HEy A 68 CYS HA 1.0 1.994 6.434 229 137 A 77 TYR HEx A 68 CYS HA 1.0 1.994 6.434 230 138 A 77 TYR HEy A 76 LYS HA 1.0 1.894 4.260 231 138 A 77 TYR HEx A 76 LYS HA 1.0 1.894 4.260 232 139 A 77 TYR HEy A 70 VAL HA 1.0 1.858 4.010 233 139 A 77 TYR HEx A 70 VAL HA 1.0 1.858 4.010 234 140 A 77 TYR HEy A 68 CYS HBx 1.0 1.784 3.586 235 140 A 77 TYR HEx A 68 CYS HBx 1.0 1.784 3.586 236 141 A 77 TYR HEy A 23 MET HGy 1.0 1.753 3.435 237 141 A 77 TYR HEx A 23 MET HGy 1.0 1.753 3.435 238 142 A 77 TYR HEy A 68 CYS HBy 1.0 1.893 4.255 239 142 A 77 TYR HEx A 68 CYS HBy 1.0 1.893 4.255 240 143 A 77 TYR HEy A 70 VAL HB 1.0 2.000 6.126 241 143 A 77 TYR HEx A 70 VAL HB 1.0 2.000 6.126 242 144 A 86 PHE HDy A 86 PHE HZ 1.0 1.810 3.722 243 144 A 86 PHE HDx A 86 PHE HZ 1.0 1.810 3.722 244 145 A 86 PHE HEy A 86 PHE HZ 1.0 1.560 2.686 245 145 A 86 PHE HEx A 86 PHE HZ 1.0 1.560 2.686 246 146 A 88 VAL HG1% A 86 PHE HZ 1.0 1.846 3.936 247 147 A 37 ILE HG2% A 86 PHE HZ 1.0 1.870 4.090 248 148 A 77 TYR HEx A 70 VAL HG2% 1.0 1.698 3.190 249 148 A 77 TYR HEy A 70 VAL HG2% 1.0 1.698 3.190 250 149 A 47 ILE HD1% A 86 PHE HZ 1.0 1.798 3.660 251 150 A 6 PHE HZ A 11 ILE HD1% 1.0 1.704 3.216 252 151 A 6 PHE HEy A 6 PHE HZ 1.0 1.755 3.445 253 151 A 6 PHE HEx A 6 PHE HZ 1.0 1.755 3.445 254 152 A 6 PHE HBy A 6 PHE HZ 1.0 1.995 6.423 255 153 A 45 LYS HA A 6 PHE HZ 1.0 1.994 5.582 256 154 A 44 VAL HB A 6 PHE HZ 1.0 1.882 4.168 257 155 A 6 PHE HZ A 11 ILE HG1x 1.0 1.942 4.700 258 156 A 6 PHE HZ A 11 ILE HG1y 1.0 1.767 3.501 259 157 A 28 PHE HDy A 28 PHE HZ 1.0 1.808 3.714 260 157 A 28 PHE HDx A 28 PHE HZ 1.0 1.808 3.714 261 158 A 28 PHE HEy A 28 PHE HZ 1.0 1.563 2.699 262 158 A 28 PHE HEx A 28 PHE HZ 1.0 1.563 2.699 263 159 A 34 ASN HD2y A 28 PHE HZ 1.0 1.811 3.725 264 160 A 28 PHE HZ A 34 ASN HD2x 1.0 1.895 4.277 265 161 A 28 PHE HZ A 22 ILE HG1y 1.0 2.000 5.884 266 162 A 28 PHE HZ A 22 ILE HD1% 1.0 1.859 4.013 267 163 A 22 ILE HG2% A 28 PHE HZ 1.0 1.690 3.160 268 164 A 17 VAL HG2% A 28 PHE HZ 1.0 1.893 4.253 269 165 A 36 PHE HZ A 36 PHE HEy 1.0 1.961 4.929 270 165 A 36 PHE HZ A 36 PHE HEx 1.0 1.961 4.929 271 166 A 66 SER HBy A 36 PHE HZ 1.0 1.817 3.765 272 167 A 36 PHE HZ A 17 VAL HB 1.0 1.952 4.804 273 168 A 17 VAL HG1% A 36 PHE HZ 1.0 1.896 4.278 274 169 A 58 LEU HA A 87 ALA HA 1.0 1.659 3.037 275 170 A 47 ILE HD1% A 87 ALA HA 1.0 1.944 4.726 276 171 A 56 ASN HA A 89 THR HA 1.0 1.816 3.758 277 172 A 31 LYS HGx A 33 LYS HA 1.0 1.867 4.067 278 173 A 34 ASN H A 67 ASP HA 1.0 1.920 4.486 279 174 A 33 LYS HA A 69 ASN HA 1.0 1.599 2.821 280 175 A 68 CYS HA A 69 ASN HA 1.0 1.903 4.335 281 176 A 67 ASP HA A 35 THR HA 1.0 1.666 3.066 282 177 A 69 ASN HBx A 69 ASN HA 1.0 1.689 3.157 283 178 A 69 ASN HA A 69 ASN HBy 1.0 1.723 3.303 284 179 A 67 ASP HA A 67 ASP HBx 1.0 1.819 3.775 285 180 A 67 ASP HA A 67 ASP HBy 1.0 1.717 3.271 286 181 A 70 VAL HB A 69 ASN HA 1.0 1.918 4.458 287 182 A 69 ASN HA A 70 VAL HG1% 1.0 1.874 4.120 288 183 A 35 THR HG2% A 67 ASP HA 1.0 1.863 4.047 289 184 A 70 VAL HG2% A 69 ASN HA 1.0 1.988 5.382 290 185 A 3 TRP HA A 6 PHE HBx 1.0 1.726 3.312 291 186 A 3 TRP HA A 3 TRP HBx 1.0 1.703 3.213 292 187 A 3 TRP HA A 3 TRP HBy 1.0 1.743 3.389 293 188 A 97 HIS HA A 97 HIS HBy 1.0 1.755 3.445 294 189 A 3 TRP HA A 96 VAL HG1% 1.0 1.695 3.181 295 190 A 65 LEU H A 83 THR HA 1.0 1.813 3.739 296 191 A 38 TYR HDy A 38 TYR HA 1.0 1.681 3.123 297 191 A 38 TYR HDx A 38 TYR HA 1.0 1.681 3.123 298 192 A 83 THR HA A 64 TYR HA 1.0 1.677 3.107 299 193 A 83 THR HB A 83 THR HA 1.0 1.774 3.538 300 194 A 38 TYR HA A 38 TYR HBy 1.0 1.759 3.467 301 195 A 12 THR HG2% A 38 TYR HA 1.0 1.668 3.074 302 196 A 83 THR HA A 83 THR HG2% 1.0 1.631 2.935 303 197 A 65 LEU HA A 65 LEU HG 1.0 1.709 3.241 304 198 A 65 LEU HA A 35 THR HG2% 1.0 1.775 3.543 305 199 A 65 LEU HA A 65 LEU HD2% 1.0 1.652 3.012 306 200 A 79 LEU HA A 69 ASN H 1.0 1.991 6.539 307 201 A 79 LEU HA A 68 CYS HA 1.0 1.714 3.262 308 202 A 79 LEU HA A 78 LYS HA 1.0 1.906 7.826 309 203 A 79 LEU HA A 79 LEU HBx 1.0 1.735 3.355 310 204 A 79 LEU HA A 79 LEU HBy 1.0 1.721 3.291 311 205 A 79 LEU HA A 79 LEU HG 1.0 1.792 3.628 312 206 A 79 LEU HA A 79 LEU HD1% 1.0 1.864 4.054 313 207 A 81 LYS HA A 81 LYS HGx 1.0 1.769 3.511 314 208 A 81 LYS HA A 81 LYS HGy 1.0 1.808 3.714 315 209 A 68 CYS HA A 68 CYS HBx 1.0 1.868 4.080 316 210 A 68 CYS HA A 68 CYS HBy 1.0 1.908 4.376 317 211 A 81 LYS HGx A 66 SER HA 1.0 1.991 5.491 318 212 A 81 LYS HGy A 66 SER HA 1.0 1.904 4.340 319 213 A 66 SER HA A 79 LEU HD2% 1.0 1.854 3.982 320 214 A 90 CYS HA A 90 CYS HBx 1.0 1.965 4.971 321 215 A 11 ILE HG1y A 11 ILE HA 1.0 1.861 4.027 322 216 A 90 CYS HA A 89 THR HG2% 1.0 1.788 3.604 323 217 A 14 THR HA A 14 THR HB 1.0 1.909 4.381 324 218 A 14 THR HA A 14 THR HG2% 1.0 1.832 3.848 325 219 A 86 PHE HA A 101 VAL HA 1.0 1.853 3.977 326 220 A 77 TYR HA A 78 LYS HEx 1.0 1.741 3.381 327 220 A 77 TYR HA A 78 LYS HEy 1.0 1.741 3.381 328 221 A 90 CYS HBx A 94 ALA HA 1.0 1.859 4.017 329 222 A 37 ILE HG2% A 39 SER HA 1.0 1.933 4.601 330 223 A 60 THR HB A 60 THR HA 1.0 1.660 3.040 331 224 A 89 THR HG2% A 55 LYS HA 1.0 1.952 4.810 332 225 A 53 ALA HA A 54 SER HA 1.0 1.990 5.452 333 226 A 92 ASN HA A 52 ILE HA 1.0 1.751 3.423 334 227 A 29 HIS HA A 29 HIS HBx 1.0 1.730 3.328 335 228 A 29 HIS HBy A 29 HIS HA 1.0 1.566 2.708 336 229 A 92 ASN HA A 92 ASN HBy 1.0 1.790 3.620 337 230 A 53 ALA HA A 91 GLU HGx 1.0 1.993 5.523 338 231 A 92 ASN HA A 52 ILE HD1% 1.0 1.676 3.106 339 232 A 65 LEU HA A 37 ILE HA 1.0 1.820 3.778 340 233 A 65 LEU HD2% A 37 ILE HA 1.0 1.674 3.096 341 234 A 37 ILE HD1% A 37 ILE HA 1.0 1.958 4.880 342 235 A 100 GLY HAx A 100 GLY HAy 1.0 1.720 3.286 343 236 A 60 THR HA A 61 SER HA 1.0 1.963 4.949 344 237 A 60 THR HA A 60 THR HG2% 1.0 1.662 3.046 345 238 A 59 THR H A 59 THR HB 1.0 1.773 3.533 346 239 A 28 PHE HDy A 23 MET HA 1.0 1.724 3.304 347 239 A 28 PHE HDx A 23 MET HA 1.0 1.724 3.304 348 240 A 24 SER HA A 25 THR HB 1.0 1.987 5.353 349 241 A 70 VAL HA A 75 CYS HA 1.0 1.959 4.897 350 242 A 47 ILE HD1% A 59 THR HB 1.0 1.827 3.821 351 243 A 57 VAL HA A 57 VAL HB 1.0 1.636 2.950 352 244 A 59 THR HB A 59 THR HG2% 1.0 1.681 3.125 353 245 A 39 SER HBx A 37 ILE HG2% 1.0 1.753 3.437 354 246 A 57 VAL HA A 57 VAL HG1% 1.0 1.523 2.571 355 247 A 59 THR HB A 58 LEU HD2% 1.0 1.803 3.689 356 248 A 91 GLU HA A 54 SER HA 1.0 1.805 3.699 357 249 A 91 GLU HA A 91 GLU HGx 1.0 1.739 3.373 358 250 A 85 LYS HA A 62 GLU HA 1.0 1.744 3.398 359 251 A 62 GLU HA A 62 GLU HBx 1.0 1.724 3.304 360 252 A 62 GLU HA A 62 GLU HBy 1.0 1.701 3.209 361 253 A 62 GLU HA A 83 THR HG2% 1.0 1.848 3.946 362 254 A 59 THR HA A 47 ILE HG2% 1.0 1.796 3.646 363 255 A 47 ILE HD1% A 59 THR HA 1.0 1.610 2.858 364 256 A 50 GLY HAx A 50 GLY HAy 1.0 1.558 2.682 365 257 A 104 ALA HA A 104 ALA HB% 1.0 1.597 2.815 366 258 A 27 LEU HD1% A 9 LYS HA 1.0 1.748 3.416 367 259 A 24 SER H A 22 ILE HA 1.0 1.922 4.500 368 260 A 22 ILE HG1x A 22 ILE HA 1.0 1.832 3.844 369 261 A 22 ILE HG1y A 22 ILE HA 1.0 1.773 3.527 370 262 A 22 ILE HG2% A 22 ILE HA 1.0 1.672 3.088 371 263 A 93 GLN HA A 48 CYS HBx 1.0 1.909 4.385 372 264 A 1 PCA HA A 1 PCA HBx 1.0 1.644 2.984 373 265 A 93 GLN HA A 93 GLN HGy 1.0 1.650 3.004 374 266 A 1 PCA HA A 1 PCA HBy 1.0 1.819 3.775 375 267 A 7 GLN HE2y A 41 PRO HA 1.0 1.936 4.636 376 268 A 72 SER HBx A 72 SER HA 1.0 1.562 2.696 377 269 A 51 ILE HA A 51 ILE HG1y 1.0 1.797 3.655 378 270 A 51 ILE HA A 51 ILE HG2% 1.0 1.545 2.641 379 271 A 43 PRO HDx A 40 ARG HBx 1.0 1.792 3.630 380 272 A 81 LYS HGx A 66 SER HBx 1.0 1.583 2.763 381 273 A 14 THR HB A 14 THR HG2% 1.0 1.585 2.773 382 274 A 66 SER HA A 66 SER HBx 1.0 1.870 4.096 383 275 A 41 PRO HDx A 40 ARG HA 1.0 1.602 2.830 384 276 A 99 VAL HA A 99 VAL HG1% 1.0 1.591 2.791 385 277 A 99 VAL HG2% A 99 VAL HA 1.0 1.583 2.765 386 278 A 17 VAL HG1% A 66 SER HBx 1.0 1.756 3.448 387 279 A 72 SER HA A 72 SER HBy 1.0 1.620 2.894 388 280 A 44 VAL HG1% A 44 VAL HA 1.0 1.625 2.913 389 281 A 5 THR HA A 5 THR HG2% 1.0 1.479 2.437 390 282 A 74 PRO HDx A 73 ARG HA 1.0 1.605 2.839 391 283 A 74 PRO HDx A 74 PRO HDy 1.0 1.508 2.522 392 284 A 103 SER HBx A 58 LEU HD1% 1.0 1.730 3.332 393 285 A 58 LEU HD2% A 103 SER HBx 1.0 1.564 2.702 394 286 A 27 LEU HD1% A 27 LEU HA 1.0 1.746 3.400 395 287 A 89 THR HA A 89 THR HB 1.0 1.851 3.963 396 288 A 4 LEU HA A 5 THR H 1.0 1.815 3.753 397 289 A 22 ILE HG2% A 19 CYS HA 1.0 1.653 3.017 398 290 A 17 VAL HG2% A 19 CYS HA 1.0 1.754 3.442 399 291 A 71 THR H A 70 VAL HA 1.0 1.642 2.976 400 292 A 73 ARG HA A 74 PRO HDy 1.0 1.698 3.192 401 293 A 70 VAL HA A 70 VAL HB 1.0 1.718 3.276 402 294 A 74 PRO HDy A 73 ARG HBx 1.0 1.820 3.782 403 295 A 70 VAL HA A 70 VAL HG1% 1.0 1.758 3.462 404 296 A 70 VAL HA A 70 VAL HG2% 1.0 1.731 3.331 405 297 A 40 ARG HA A 40 ARG HDx 1.0 1.938 7.472 406 298 A 29 HIS HA A 30 CYS HBy 1.0 1.899 4.303 407 299 A 30 CYS HBy A 26 ASN HA 1.0 1.990 6.570 408 300 A 29 HIS HBy A 29 HIS HBx 1.0 1.501 2.505 409 301 A 39 SER HBx A 39 SER HBy 1.0 1.596 2.808 410 302 A 39 SER HBy A 37 ILE HB 1.0 1.863 4.037 411 303 A 3 TRP HBy A 4 LEU HBx 1.0 1.939 4.663 412 304 A 38 TYR HBx A 38 TYR HA 1.0 1.838 3.884 413 305 A 39 SER HA A 39 SER HBy 1.0 1.660 3.042 414 306 A 84 ASN HBx A 84 ASN HBy 1.0 1.581 2.757 415 307 A 86 PHE HBx A 86 PHE HA 1.0 1.736 3.360 416 308 A 98 PHE HBx A 98 PHE HA 1.0 1.845 3.925 417 309 A 6 PHE HA A 6 PHE HBy 1.0 1.780 3.566 418 310 A 6 PHE HBy A 96 VAL HG1% 1.0 1.821 3.789 419 311 A 92 ASN HA A 92 ASN HBx 1.0 1.831 3.841 420 312 A 13 ASN HA A 13 ASN HBx 1.0 1.688 3.154 421 313 A 29 HIS HBy A 26 ASN HA 1.0 1.989 6.601 422 314 A 17 VAL HA A 18 ASP HBy 1.0 1.925 4.525 423 315 A 17 VAL HB A 17 VAL HA 1.0 1.845 3.925 424 316 A 14 THR HG2% A 17 VAL HA 1.0 1.781 3.575 425 317 A 17 VAL HG1% A 17 VAL HA 1.0 1.697 3.187 426 318 A 17 VAL HG2% A 17 VAL HA 1.0 1.701 3.205 427 319 A 29 HIS HBy A 26 ASN HD2x 1.0 1.688 3.152 428 320 A 86 PHE HA A 86 PHE HBy 1.0 1.745 3.397 429 321 A 64 TYR HBx A 64 TYR HBy 1.0 1.605 2.839 430 322 A 48 CYS HBx A 48 CYS HA 1.0 1.863 4.045 431 323 A 55 LYS HBx A 55 LYS HEx 1.0 1.542 2.628 432 323 A 55 LYS HEy A 55 LYS HBx 1.0 1.542 2.628 433 324 A 97 HIS HBy A 89 THR HB 1.0 1.847 3.939 434 325 A 97 HIS HBx A 97 HIS HBy 1.0 1.461 2.385 435 326 A 18 ASP HBx A 18 ASP HA 1.0 1.925 4.525 436 327 A 45 LYS HA A 48 CYS H 1.0 1.864 4.050 437 328 A 13 ASN HA A 13 ASN HBy 1.0 1.755 3.441 438 329 A 45 LYS HA A 94 ALA HA 1.0 1.760 3.468 439 330 A 13 ASN HBx A 13 ASN HBy 1.0 1.476 2.428 440 331 A 81 LYS HDy A 81 LYS HEx 1.0 1.611 2.861 441 331 A 81 LYS HEy A 81 LYS HDy 1.0 1.611 2.861 442 332 A 92 ASN HBy A 92 ASN HBx 1.0 1.454 2.364 443 333 A 1 PCA HBy A 1 PCA HGx 1.0 1.712 3.254 444 334 A 78 LYS H A 77 TYR HBx 1.0 1.702 3.210 445 335 A 69 ASN H A 77 TYR HBx 1.0 1.947 4.753 446 336 A 77 TYR HDy A 77 TYR HBx 1.0 1.765 3.493 447 336 A 77 TYR HDx A 77 TYR HBx 1.0 1.765 3.493 448 337 A 68 CYS HA A 77 TYR HBx 1.0 1.940 4.678 449 338 A 84 ASN HBy A 84 ASN HA 1.0 1.885 4.199 450 339 A 21 ASN HD2y A 20 ASP HBy 1.0 1.882 4.178 451 340 A 44 VAL HB A 46 ALA H 1.0 1.999 6.225 452 341 A 44 VAL HB A 44 VAL HA 1.0 1.908 4.372 453 342 A 93 GLN HA A 90 CYS HBy 1.0 1.792 3.630 454 343 A 90 CYS HA A 90 CYS HBy 1.0 1.820 3.776 455 344 A 48 CYS HA A 90 CYS HBy 1.0 1.679 3.115 456 345 A 18 ASP HBy A 18 ASP HA 1.0 1.793 3.631 457 346 A 18 ASP HBx A 18 ASP HBy 1.0 1.504 2.514 458 347 A 16 ASP HBx A 16 ASP HA 1.0 1.745 3.395 459 348 A 56 ASN HA A 56 ASN HBy 1.0 1.886 4.204 460 349 A 56 ASN HBy A 56 ASN HBx 1.0 1.481 2.443 461 350 A 42 GLU HA A 41 PRO HGy 1.0 1.808 3.714 462 351 A 16 ASP HBx A 16 ASP HBy 1.0 1.398 2.212 463 352 A 1 PCA HBx A 1 PCA HGx 1.0 1.475 2.427 464 353 A 88 VAL HB A 88 VAL HA 1.0 1.697 3.187 465 354 A 101 VAL HA A 101 VAL HB 1.0 1.646 2.986 466 355 A 88 VAL HG1% A 88 VAL HB 1.0 1.570 2.722 467 356 A 54 SER HA A 91 GLU HGy 1.0 1.785 3.591 468 357 A 28 PHE HEy A 34 ASN HBx 1.0 1.926 4.530 469 357 A 28 PHE HEx A 34 ASN HBx 1.0 1.926 4.530 470 358 A 34 ASN HBx A 34 ASN HA 1.0 1.796 3.650 471 359 A 31 LYS HGy A 34 ASN HBx 1.0 1.846 3.932 472 360 A 23 MET HA A 23 MET HBx 1.0 1.785 3.595 473 361 A 85 LYS HA A 85 LYS HBx 1.0 1.688 3.152 474 362 A 80 LYS HA A 80 LYS HBx 1.0 1.819 3.777 475 363 A 40 ARG HA A 40 ARG HBy 1.0 1.726 3.310 476 364 A 31 LYS HZ% A 34 ASN HBy 1.0 1.702 3.208 477 365 A 11 ILE HA A 37 ILE HB 1.0 1.838 3.888 478 366 A 78 LYS HA A 78 LYS HBx 1.0 1.618 2.884 479 367 A 34 ASN HBy A 34 ASN HBx 1.0 1.455 2.367 480 368 A 37 ILE HD1% A 37 ILE HB 1.0 1.918 4.464 481 369 A 80 LYS HA A 80 LYS HBy 1.0 1.695 3.179 482 370 A 51 ILE HG2% A 51 ILE HB 1.0 1.421 2.273 483 371 A 38 TYR HEy A 15 ARG HGx 1.0 1.972 5.070 484 371 A 38 TYR HEx A 15 ARG HGx 1.0 1.972 5.070 485 372 A 10 HIS HBy A 37 ILE H 1.0 1.960 4.916 486 373 A 10 HIS HBy A 10 HIS HBx 1.0 1.572 2.728 487 374 A 8 LYS HBy A 8 LYS HA 1.0 1.584 2.766 488 375 A 4 LEU HA A 4 LEU HBx 1.0 1.727 3.315 489 376 A 47 ILE HB A 47 ILE HA 1.0 1.658 3.034 490 377 A 23 MET HBy A 30 CYS HA 1.0 1.576 2.738 491 378 A 96 VAL HB A 96 VAL HA 1.0 1.663 3.053 492 379 A 96 VAL HG1% A 96 VAL HB 1.0 1.803 3.685 493 380 A 62 GLU HBy A 62 GLU HGy 1.0 1.772 3.530 494 381 A 58 LEU HBx A 58 LEU HBy 1.0 1.362 2.118 495 382 A 4 LEU H A 4 LEU HG 1.0 1.800 3.674 496 383 A 15 ARG HGy A 15 ARG HE 1.0 1.722 3.294 497 384 A 73 ARG HA A 73 ARG HBx 1.0 1.688 3.152 498 385 A 4 LEU HA A 4 LEU HBy 1.0 1.746 3.402 499 386 A 25 THR HG2% A 25 THR HA 1.0 1.600 2.824 500 387 A 25 THR HG2% A 25 THR HB 1.0 1.693 3.173 501 388 A 22 ILE HA A 22 ILE HB 1.0 1.555 2.673 502 389 A 78 LYS H A 78 LYS HGx 1.0 1.737 3.363 503 390 A 31 LYS HGx A 34 ASN H 1.0 1.837 3.875 504 391 A 81 LYS HA A 80 LYS HGx 1.0 1.896 4.282 505 392 A 43 PRO HA A 46 ALA HB% 1.0 1.642 2.970 506 393 A 46 ALA HB% A 46 ALA HA 1.0 1.520 2.562 507 394 A 53 ALA HA A 53 ALA HB% 1.0 1.523 2.571 508 395 A 51 ILE HA A 51 ILE HG1x 1.0 1.754 3.440 509 396 A 53 ALA HB% A 52 ILE HG2% 1.0 1.502 2.506 510 397 A 3 TRP HZ3 A 44 VAL HG1% 1.0 1.850 3.960 511 398 A 6 PHE HEy A 44 VAL HG1% 1.0 1.662 3.046 512 398 A 6 PHE HEx A 44 VAL HG1% 1.0 1.662 3.046 513 399 A 60 THR HB A 60 THR HG2% 1.0 1.649 2.999 514 400 A 44 VAL HB A 44 VAL HG1% 1.0 1.752 3.434 515 401 A 65 LEU HD1% A 65 LEU HG 1.0 1.426 2.288 516 402 A 59 THR H A 59 THR HG2% 1.0 1.845 3.925 517 403 A 86 PHE HDx A 59 THR HG2% 1.0 1.798 3.662 518 403 A 86 PHE HDy A 59 THR HG2% 1.0 1.798 3.662 519 404 A 5 THR HB A 5 THR HG2% 1.0 1.647 2.993 520 405 A 39 SER HBy A 44 VAL HG2% 1.0 1.825 3.813 521 406 A 71 THR HG2% A 71 THR HB 1.0 1.696 3.184 522 407 A 71 THR HA A 71 THR HG2% 1.0 1.518 2.554 523 408 A 22 ILE HG1y A 25 THR HB 1.0 1.705 3.221 524 409 A 86 PHE HBy A 101 VAL HG1% 1.0 1.769 3.511 525 410 A 37 ILE HD1% A 88 VAL HG1% 1.0 1.585 2.771 526 411 A 56 ASN HA A 89 THR HG2% 1.0 2.000 5.990 527 412 A 89 THR HA A 89 THR HG2% 1.0 1.658 3.032 528 413 A 89 THR HG2% A 89 THR HB 1.0 1.646 2.988 529 414 A 88 VAL HG1% A 88 VAL HA 1.0 1.654 3.020 530 415 A 12 THR HG2% A 12 THR HB 1.0 1.676 3.102 531 416 A 7 GLN HA A 11 ILE HG2% 1.0 1.744 3.392 532 417 A 12 THR HG2% A 38 TYR HBy 1.0 1.624 2.906 533 418 A 12 THR HG2% A 36 PHE HBy 1.0 1.739 3.369 534 419 A 57 VAL HG2% A 51 ILE HD1% 1.0 1.553 2.665 535 420 A 17 VAL HG2% A 79 LEU HD1% 1.0 1.933 4.609 536 421 A 79 LEU HD1% A 18 ASP HA 1.0 1.641 2.971 537 422 A 11 ILE HA A 11 ILE HG2% 1.0 1.695 3.183 538 423 A 11 ILE HG2% A 11 ILE HB 1.0 1.623 2.903 539 424 A 87 ALA HA A 87 ALA HB% 1.0 1.603 2.833 540 425 A 58 LEU HA A 87 ALA HB% 1.0 1.690 3.160 541 426 A 79 LEU HA A 79 LEU HD2% 1.0 1.702 3.208 542 427 A 53 ALA HA A 52 ILE HG2% 1.0 1.754 3.438 543 428 A 83 THR HB A 83 THR HG2% 1.0 1.615 2.877 544 429 A 79 LEU HD2% A 66 SER HBx 1.0 1.722 3.292 545 430 A 52 ILE HA A 52 ILE HG2% 1.0 1.702 3.212 546 431 A 86 PHE HBx A 65 LEU HD1% 1.0 1.749 3.419 547 432 A 65 LEU HD1% A 84 ASN HBy 1.0 1.806 3.698 548 433 A 52 ILE HG2% A 52 ILE HB 1.0 1.487 2.463 549 434 A 17 VAL HG2% A 79 LEU HD2% 1.0 1.871 4.095 550 435 A 71 THR H A 70 VAL HG1% 1.0 1.921 4.487 551 436 A 96 VAL HG1% A 2 ASP HA 1.0 1.703 3.215 552 437 A 96 VAL HG1% A 96 VAL HA 1.0 1.653 3.015 553 438 A 94 ALA HA A 94 ALA HB% 1.0 1.677 3.107 554 439 A 70 VAL HG1% A 32 ASP HA 1.0 1.669 3.077 555 440 A 3 TRP HBx A 94 ALA HB% 1.0 1.733 3.347 556 441 A 3 TRP HBy A 94 ALA HB% 1.0 1.751 3.427 557 442 A 70 VAL HG1% A 32 ASP HBy 1.0 1.626 2.912 558 443 A 70 VAL HB A 70 VAL HG1% 1.0 1.669 3.079 559 444 A 4 LEU HA A 4 LEU HD1% 1.0 1.800 3.672 560 445 A 45 LYS HA A 94 ALA HB% 1.0 1.955 4.851 561 446 A 4 LEU HG A 4 LEU HD1% 1.0 1.621 2.897 562 447 A 37 ILE HG2% A 37 ILE HA 1.0 1.700 3.202 563 448 A 63 PHE HBx A 37 ILE HG2% 1.0 1.808 3.710 564 449 A 37 ILE HG2% A 39 SER HBy 1.0 1.778 3.554 565 450 A 37 ILE HG2% A 37 ILE HB 1.0 1.719 3.281 566 451 A 37 ILE HG2% A 44 VAL HG2% 1.0 1.475 2.425 567 452 A 35 THR HG2% A 35 THR HA 1.0 1.658 3.032 568 453 A 58 LEU HD1% A 103 SER HBy 1.0 1.763 3.485 569 454 A 35 THR HG2% A 35 THR HB 1.0 1.670 3.078 570 455 A 58 LEU HD1% A 58 LEU H 1.0 1.929 4.567 571 456 A 58 LEU HA A 58 LEU HD1% 1.0 1.853 3.979 572 457 A 58 LEU HD1% A 103 SER HA 1.0 1.842 3.910 573 458 A 58 LEU HBx A 58 LEU HD1% 1.0 1.634 2.942 574 459 A 70 VAL HG2% A 74 PRO HA 1.0 1.783 3.583 575 460 A 70 VAL HB A 70 VAL HG2% 1.0 1.697 3.189 576 461 A 90 CYS HA A 51 ILE HG2% 1.0 1.802 3.684 577 462 A 54 SER HA A 51 ILE HG2% 1.0 1.880 4.162 578 463 A 91 GLU HA A 51 ILE HG2% 1.0 1.572 2.726 579 464 A 52 ILE HA A 52 ILE HD1% 1.0 1.646 2.988 580 465 A 90 CYS HBx A 51 ILE HG2% 1.0 1.702 3.210 581 466 A 51 ILE HG2% A 90 CYS HBy 1.0 1.759 3.461 582 467 A 28 PHE HEy A 22 ILE HD1% 1.0 1.687 3.149 583 467 A 28 PHE HEx A 22 ILE HD1% 1.0 1.687 3.149 584 468 A 63 PHE HA A 65 LEU HD2% 1.0 1.874 4.120 585 469 A 96 VAL HA A 96 VAL HG2% 1.0 1.732 3.338 586 470 A 63 PHE HBy A 65 LEU HD2% 1.0 1.883 4.179 587 471 A 47 ILE HG2% A 47 ILE HA 1.0 1.737 3.359 588 472 A 47 ILE HG2% A 47 ILE HB 1.0 1.519 2.559 589 473 A 56 ASN HA A 99 VAL HG2% 1.0 1.868 4.078 590 474 A 99 VAL HG2% A 98 PHE HA 1.0 1.759 3.461 591 475 A 88 VAL HG2% A 88 VAL HB 1.0 1.720 3.290 592 476 A 99 VAL HG2% A 99 VAL HB 1.0 1.532 2.598 593 477 A 88 VAL HG2% A 88 VAL HG1% 1.0 1.569 2.715 594 478 A 87 ALA HA A 58 LEU HD2% 1.0 1.730 3.332 595 479 A 58 LEU HA A 58 LEU HD2% 1.0 1.651 3.005 596 480 A 58 LEU HD2% A 103 SER HA 1.0 1.832 3.850 597 481 A 27 LEU HD2% A 9 LYS HA 1.0 1.837 3.879 598 482 A 8 LYS HEx A 27 LEU HD2% 1.0 1.789 3.611 599 482 A 8 LYS HEy A 27 LEU HD2% 1.0 1.789 3.611 600 483 A 88 VAL HG2% A 90 CYS HBy 1.0 1.953 4.817 601 484 A 27 LEU HD2% A 27 LEU HBy 1.0 1.505 2.515 602 485 A 22 ILE HG2% A 23 MET HBx 1.0 1.790 3.620 603 486 A 22 ILE HG2% A 22 ILE HB 1.0 1.679 3.115 604 487 A 11 ILE HD1% A 11 ILE HA 1.0 1.997 5.739 605 488 A 11 ILE HD1% A 37 ILE HA 1.0 2.000 5.868 606 489 A 11 ILE HD1% A 37 ILE HB 1.0 1.632 2.936 607 490 A 27 LEU HD1% A 8 LYS HZ% 1.0 1.944 4.720 608 491 A 27 LEU HD1% A 27 LEU HBy 1.0 1.753 3.435 609 492 A 27 LEU HD1% A 27 LEU HG 1.0 1.589 2.785 610 493 A 17 VAL HG1% A 36 PHE HBy 1.0 1.904 4.344 611 494 A 17 VAL HG1% A 17 VAL HB 1.0 1.506 2.520 612 495 A 17 VAL HG2% A 18 ASP HA 1.0 1.971 5.073 613 496 A 17 VAL HG2% A 22 ILE HB 1.0 1.925 4.525 614 497 A 17 VAL HG2% A 17 VAL HB 1.0 1.603 2.831 615 498 A 17 VAL HG2% A 22 ILE HD1% 1.0 1.713 3.253 616 499 A 22 ILE HG2% A 17 VAL HG2% 1.0 1.690 3.160 617 500 A 17 VAL HG1% A 17 VAL HG2% 1.0 1.572 2.728 618 501 A 103 SER HA A 104 ALA H 1.0 1.580 2.754 619 502 A 104 ALA HA A 104 ALA H 1.0 1.892 4.248 620 503 A 103 SER HBx A 104 ALA H 1.0 1.841 3.903 621 504 A 104 ALA HB% A 104 ALA H 1.0 1.736 3.356 622 505 A 103 SER HBy A 104 ALA H 1.0 1.922 4.500 623 506 A 58 LEU HD1% A 104 ALA H 1.0 1.958 4.894 624 507 A 58 LEU HD2% A 104 ALA H 1.0 1.991 5.495 625 508 A 3 TRP HZ2 A 3 TRP HE1 1.0 1.839 3.895 626 509 A 3 TRP HD1 A 3 TRP HE1 1.0 1.583 2.765 627 510 A 7 GLN HE2y A 3 TRP HE1 1.0 1.901 4.323 628 511 A 7 GLN HE2x A 3 TRP HE1 1.0 1.871 4.101 629 512 A 3 TRP HBy A 3 TRP HE1 1.0 1.993 5.547 630 513 A 81 LYS H A 81 LYS HGx 1.0 1.943 7.409 631 514 A 38 TYR H A 37 ILE H 1.0 1.956 4.866 632 515 A 38 TYR H A 39 SER H 1.0 1.990 5.446 633 516 A 38 TYR H A 38 TYR HA 1.0 1.720 3.284 634 517 A 38 TYR H A 39 SER HA 1.0 1.998 6.290 635 518 A 38 TYR H A 37 ILE HA 1.0 1.617 2.881 636 519 A 38 TYR H A 64 TYR HBx 1.0 1.912 4.408 637 520 A 38 TYR H A 63 PHE HBx 1.0 1.948 7.340 638 521 A 38 TYR H A 38 TYR HBx 1.0 1.768 3.508 639 522 A 38 TYR H A 38 TYR HBy 1.0 1.766 3.500 640 523 A 38 TYR H A 37 ILE HB 1.0 1.998 6.266 641 524 A 38 TYR H A 37 ILE HG2% 1.0 1.736 3.358 642 525 A 38 TYR H A 65 LEU HD2% 1.0 1.962 4.930 643 526 A 99 VAL H A 87 ALA H 1.0 1.999 6.179 644 527 A 99 VAL H A 97 HIS HE1 1.0 1.988 6.640 645 528 A 99 VAL H A 98 PHE HZ 1.0 2.000 6.118 646 529 A 99 VAL H A 100 GLY H 1.0 1.636 2.950 647 530 A 99 VAL H A 88 VAL HA 1.0 1.773 3.535 648 531 A 99 VAL H A 98 PHE HA 1.0 1.643 2.977 649 532 A 99 VAL H A 99 VAL HA 1.0 1.784 3.588 650 533 A 99 VAL H A 88 VAL HB 1.0 1.970 5.040 651 534 A 99 VAL H A 99 VAL HB 1.0 1.635 2.945 652 535 A 99 VAL H A 88 VAL HG1% 1.0 1.854 3.986 653 536 A 99 VAL H A 87 ALA HB% 1.0 1.908 4.380 654 537 A 99 VAL H A 99 VAL HG1% 1.0 1.963 4.957 655 538 A 99 VAL H A 99 VAL HG2% 1.0 1.676 3.104 656 539 A 70 VAL H A 77 TYR HDy 1.0 1.999 6.209 657 539 A 70 VAL H A 77 TYR HDx 1.0 1.999 6.209 658 540 A 70 VAL H A 77 TYR HEy 1.0 1.962 4.928 659 540 A 70 VAL H A 77 TYR HEx 1.0 1.962 4.928 660 541 A 70 VAL H A 33 LYS HA 1.0 1.964 4.964 661 542 A 70 VAL H A 69 ASN HA 1.0 1.694 3.176 662 543 A 70 VAL H A 32 ASP HA 1.0 1.980 5.212 663 544 A 70 VAL H A 70 VAL HA 1.0 1.756 3.450 664 545 A 70 VAL H A 77 TYR HBy 1.0 1.990 6.576 665 546 A 70 VAL H A 70 VAL HB 1.0 1.706 3.230 666 547 A 70 VAL H A 70 VAL HG1% 1.0 1.717 3.275 667 548 A 70 VAL H A 70 VAL HG2% 1.0 1.833 3.851 668 549 A 80 LYS H A 69 ASN HD2y 1.0 1.661 9.633 669 550 A 67 ASP HA A 80 LYS H 1.0 1.964 4.956 670 551 A 79 LEU HA A 80 LYS H 1.0 1.581 2.757 671 552 A 66 SER HA A 80 LYS H 1.0 1.968 5.018 672 553 A 80 LYS HA A 80 LYS H 1.0 1.737 3.359 673 554 A 66 SER HBx A 80 LYS H 1.0 1.793 8.783 674 555 A 67 ASP HBx A 80 LYS H 1.0 1.957 4.877 675 556 A 67 ASP HBy A 80 LYS H 1.0 1.992 5.516 676 557 A 80 LYS HBx A 80 LYS H 1.0 1.749 3.417 677 558 A 80 LYS HBy A 80 LYS H 1.0 1.705 3.221 678 559 A 79 LEU HG A 80 LYS H 1.0 1.843 3.915 679 560 A 79 LEU HD1% A 80 LYS H 1.0 1.970 5.046 680 561 A 79 LEU HD2% A 80 LYS H 1.0 1.704 3.218 681 562 A 52 ILE H A 92 ASN H 1.0 1.961 7.151 682 563 A 52 ILE H A 51 ILE HA 1.0 1.597 2.813 683 564 A 52 ILE H A 52 ILE HA 1.0 1.938 4.660 684 565 A 52 ILE H A 52 ILE HB 1.0 1.781 3.573 685 566 A 52 ILE H A 51 ILE HB 1.0 1.991 5.463 686 567 A 52 ILE H A 53 ALA HB% 1.0 1.846 3.938 687 568 A 52 ILE H A 52 ILE HG1y 1.0 1.954 4.844 688 569 A 52 ILE H A 52 ILE HG2% 1.0 1.914 4.426 689 570 A 52 ILE H A 51 ILE HG2% 1.0 1.778 3.560 690 571 A 19 CYS H A 18 ASP H 1.0 1.943 4.699 691 572 A 18 ASP H A 17 VAL H 1.0 1.998 6.218 692 573 A 18 ASP HA A 18 ASP H 1.0 1.863 4.045 693 574 A 17 VAL HA A 18 ASP H 1.0 1.638 2.960 694 575 A 18 ASP HBx A 18 ASP H 1.0 1.897 4.295 695 576 A 18 ASP HBy A 18 ASP H 1.0 1.782 3.580 696 577 A 17 VAL HB A 18 ASP H 1.0 1.998 5.804 697 578 A 14 THR HG2% A 18 ASP H 1.0 2.000 6.016 698 579 A 17 VAL HG1% A 18 ASP H 1.0 1.978 5.192 699 580 A 17 VAL HG2% A 18 ASP H 1.0 1.821 3.785 700 581 A 80 LYS H A 79 LEU H 1.0 1.927 4.547 701 582 A 79 LEU HA A 79 LEU H 1.0 1.745 3.397 702 583 A 68 CYS HA A 79 LEU H 1.0 2.000 6.054 703 584 A 78 LYS HA A 79 LEU H 1.0 1.483 2.449 704 585 A 79 LEU H A 78 LYS HBy 1.0 1.829 3.833 705 586 A 79 LEU HBy A 79 LEU H 1.0 1.672 3.090 706 587 A 79 LEU HD1% A 79 LEU H 1.0 1.944 4.716 707 588 A 79 LEU HD2% A 79 LEU H 1.0 1.941 4.679 708 589 A 89 THR H A 90 CYS H 1.0 1.961 4.925 709 590 A 55 LYS H A 90 CYS H 1.0 1.892 4.246 710 591 A 56 ASN HA A 90 CYS H 1.0 1.818 3.770 711 592 A 90 CYS HA A 90 CYS H 1.0 1.925 4.535 712 593 A 54 SER HA A 90 CYS H 1.0 2.000 6.020 713 594 A 89 THR HA A 90 CYS H 1.0 1.566 2.708 714 595 A 89 THR HB A 90 CYS H 1.0 2.000 6.026 715 596 A 90 CYS HBx A 90 CYS H 1.0 1.836 3.874 716 597 A 90 CYS HBy A 90 CYS H 1.0 1.899 4.305 717 598 A 89 THR HG2% A 90 CYS H 1.0 1.719 3.283 718 599 A 51 ILE HG2% A 90 CYS H 1.0 1.841 3.903 719 600 A 57 VAL H A 58 LEU H 1.0 1.988 5.406 720 601 A 59 THR H A 58 LEU H 1.0 1.992 5.484 721 602 A 87 ALA HA A 58 LEU H 1.0 2.000 6.136 722 603 A 58 LEU HA A 58 LEU H 1.0 1.781 3.573 723 604 A 57 VAL HA A 58 LEU H 1.0 1.567 2.711 724 605 A 58 LEU HBx A 58 LEU H 1.0 1.706 3.226 725 606 A 58 LEU HBy A 58 LEU H 1.0 1.688 3.152 726 607 A 57 VAL HG1% A 58 LEU H 1.0 1.712 3.256 727 608 A 47 ILE HD1% A 58 LEU H 1.0 2.000 6.050 728 609 A 92 ASN H A 92 ASN HD2y 1.0 1.999 6.227 729 610 A 54 SER HA A 92 ASN H 1.0 1.992 6.528 730 611 A 92 ASN HA A 92 ASN H 1.0 1.636 2.952 731 612 A 91 GLU HA A 92 ASN H 1.0 1.654 3.018 732 613 A 52 ILE HA A 92 ASN H 1.0 1.731 3.335 733 614 A 92 ASN HBx A 92 ASN H 1.0 1.936 4.630 734 615 A 92 ASN HBy A 92 ASN H 1.0 1.937 4.651 735 616 A 91 GLU HGx A 92 ASN H 1.0 1.917 4.457 736 617 A 91 GLU HGy A 92 ASN H 1.0 1.923 4.507 737 618 A 93 GLN HGy A 92 ASN H 1.0 1.993 6.487 738 619 A 51 ILE HB A 92 ASN H 1.0 1.782 8.860 739 620 A 53 ALA HB% A 92 ASN H 1.0 1.977 6.863 740 621 A 92 ASN H A 52 ILE HG1y 1.0 1.984 6.724 741 622 A 52 ILE HG2% A 92 ASN H 1.0 1.930 4.574 742 623 A 15 ARG H A 16 ASP H 1.0 1.999 6.073 743 624 A 14 THR HA A 15 ARG H 1.0 1.863 4.047 744 625 A 15 ARG H A 15 ARG HA 1.0 1.999 6.109 745 626 A 12 THR HG2% A 15 ARG H 1.0 1.951 7.303 746 627 A 55 LYS H A 54 SER HA 1.0 1.521 2.563 747 628 A 55 LYS H A 55 LYS HA 1.0 1.770 3.518 748 629 A 55 LYS H A 90 CYS HBx 1.0 2.000 6.102 749 630 A 55 LYS H A 90 CYS HBy 1.0 1.987 5.347 750 631 A 55 LYS H A 89 THR HG2% 1.0 1.831 3.847 751 632 A 55 LYS H A 51 ILE HG2% 1.0 1.851 3.961 752 633 A 65 LEU H A 64 TYR H 1.0 1.999 6.189 753 634 A 65 LEU H A 65 LEU HA 1.0 1.744 3.396 754 635 A 65 LEU H A 64 TYR HA 1.0 1.617 2.883 755 636 A 65 LEU H A 64 TYR HBx 1.0 1.923 4.501 756 637 A 65 LEU H A 64 TYR HBy 1.0 1.925 4.533 757 638 A 65 LEU H A 65 LEU HG 1.0 1.868 4.080 758 639 A 65 LEU H A 65 LEU HD2% 1.0 1.926 4.530 759 640 A 67 ASP H A 69 ASN HD2x 1.0 1.947 7.363 760 641 A 67 ASP H A 67 ASP HA 1.0 1.882 4.178 761 642 A 67 ASP H A 66 SER HA 1.0 1.549 2.651 762 643 A 67 ASP H A 35 THR HA 1.0 1.971 5.061 763 644 A 67 ASP H A 66 SER HBx 1.0 1.903 4.335 764 645 A 67 ASP H A 66 SER HBy 1.0 1.949 4.773 765 646 A 67 ASP H A 67 ASP HBx 1.0 1.697 3.189 766 647 A 67 ASP H A 67 ASP HBy 1.0 1.841 3.903 767 648 A 67 ASP H A 80 LYS HBy 1.0 1.972 5.074 768 649 A 67 ASP H A 81 LYS HGx 1.0 1.994 5.552 769 650 A 67 ASP H A 79 LEU HG 1.0 1.999 5.943 770 651 A 67 ASP H A 79 LEU HD2% 1.0 1.843 3.919 771 652 A 67 ASP H A 35 THR HG2% 1.0 1.998 6.252 772 653 A 55 LYS H A 56 ASN H 1.0 1.994 5.592 773 654 A 56 ASN HD2y A 56 ASN H 1.0 1.992 6.514 774 655 A 56 ASN HA A 56 ASN H 1.0 1.894 4.260 775 656 A 55 LYS HA A 56 ASN H 1.0 1.519 2.557 776 657 A 56 ASN HBx A 56 ASN H 1.0 1.691 3.161 777 658 A 56 ASN HBy A 56 ASN H 1.0 1.773 3.531 778 659 A 56 ASN H A 55 LYS HBy 1.0 1.832 3.848 779 660 A 89 THR HG2% A 56 ASN H 1.0 2.000 6.016 780 661 A 37 ILE H A 36 PHE H 1.0 1.921 4.485 781 662 A 36 PHE HDy A 36 PHE H 1.0 1.803 3.685 782 662 A 36 PHE HDx A 36 PHE H 1.0 1.803 3.685 783 663 A 67 ASP HA A 36 PHE H 1.0 1.867 4.069 784 664 A 65 LEU HA A 36 PHE H 1.0 1.997 6.295 785 665 A 35 THR HA A 36 PHE H 1.0 1.597 2.809 786 666 A 66 SER HBy A 36 PHE H 1.0 1.968 5.022 787 667 A 36 PHE H A 36 PHE HBx 1.0 1.833 3.853 788 668 A 65 LEU HD1% A 36 PHE H 1.0 2.000 5.984 789 669 A 35 THR HG2% A 36 PHE H 1.0 1.769 3.511 790 670 A 65 LEU HD2% A 36 PHE H 1.0 1.988 6.632 791 671 A 73 ARG H A 76 LYS H 1.0 1.978 6.850 792 672 A 73 ARG HA A 73 ARG H 1.0 1.700 3.202 793 673 A 72 SER HA A 73 ARG H 1.0 1.834 3.862 794 674 A 72 SER HBx A 73 ARG H 1.0 1.986 5.340 795 675 A 72 SER HBy A 73 ARG H 1.0 1.916 4.442 796 676 A 73 ARG H A 73 ARG HBy 1.0 1.787 3.599 797 677 A 70 VAL HG2% A 73 ARG H 1.0 1.982 6.768 798 678 A 49 LYS H A 50 GLY H 1.0 1.954 4.840 799 679 A 48 CYS HA A 49 LYS H 1.0 1.813 3.737 800 680 A 49 LYS H A 49 LYS HA 1.0 1.783 3.583 801 681 A 47 ILE HA A 49 LYS H 1.0 1.944 7.392 802 682 A 48 CYS HBx A 49 LYS H 1.0 1.992 5.502 803 683 A 40 ARG HA A 40 ARG H 1.0 1.805 3.699 804 684 A 39 SER HA A 40 ARG H 1.0 1.741 3.381 805 685 A 39 SER HBx A 40 ARG H 1.0 2.000 5.900 806 686 A 43 PRO HDx A 40 ARG H 1.0 1.998 6.210 807 687 A 40 ARG HDx A 40 ARG H 1.0 1.745 9.111 808 688 A 39 SER HBy A 40 ARG H 1.0 1.988 6.636 809 689 A 40 ARG HBx A 40 ARG H 1.0 1.922 4.506 810 690 A 78 LYS H A 77 TYR H 1.0 1.999 5.853 811 691 A 77 TYR HDy A 77 TYR H 1.0 1.807 3.705 812 691 A 77 TYR HDx A 77 TYR H 1.0 1.807 3.705 813 692 A 76 LYS H A 77 TYR H 1.0 1.997 5.655 814 693 A 77 TYR HEy A 77 TYR H 1.0 1.999 6.069 815 693 A 77 TYR HEx A 77 TYR H 1.0 1.999 6.069 816 694 A 76 LYS HA A 77 TYR H 1.0 1.758 3.460 817 695 A 78 LYS HA A 77 TYR H 1.0 1.995 6.435 818 696 A 77 TYR HA A 77 TYR H 1.0 1.978 5.182 819 697 A 70 VAL HA A 77 TYR H 1.0 1.991 6.541 820 698 A 77 TYR HBx A 77 TYR H 1.0 1.836 3.874 821 699 A 77 TYR HBy A 77 TYR H 1.0 1.920 4.482 822 700 A 3 TRP HD1 A 3 TRP H 1.0 1.978 6.854 823 701 A 3 TRP HA A 3 TRP H 1.0 1.981 5.247 824 702 A 2 ASP HA A 3 TRP H 1.0 1.845 3.927 825 703 A 3 TRP HBx A 3 TRP H 1.0 1.874 4.120 826 704 A 3 TRP HBy A 3 TRP H 1.0 1.790 3.616 827 705 A 13 ASN H A 14 THR H 1.0 1.823 3.799 828 706 A 13 ASN H A 12 THR HA 1.0 1.723 3.303 829 707 A 13 ASN HA A 13 ASN H 1.0 1.887 4.217 830 708 A 13 ASN H A 12 THR HB 1.0 1.975 5.139 831 709 A 13 ASN H A 13 ASN HBx 1.0 1.993 5.557 832 710 A 13 ASN H A 13 ASN HBy 1.0 1.991 5.491 833 711 A 13 ASN H A 14 THR HG2% 1.0 1.997 6.309 834 712 A 53 ALA H A 53 ALA HA 1.0 1.753 3.437 835 713 A 53 ALA H A 51 ILE HA 1.0 1.911 4.399 836 714 A 53 ALA H A 52 ILE HA 1.0 1.996 5.628 837 715 A 53 ALA H A 53 ALA HB% 1.0 1.559 2.683 838 716 A 7 GLN H A 6 PHE H 1.0 1.758 3.456 839 717 A 6 PHE HDy A 6 PHE H 1.0 1.876 4.128 840 717 A 6 PHE HDx A 6 PHE H 1.0 1.876 4.128 841 718 A 6 PHE HZ A 6 PHE H 1.0 1.780 8.876 842 719 A 3 TRP HA A 6 PHE H 1.0 1.981 5.243 843 720 A 6 PHE HA A 6 PHE H 1.0 1.706 3.228 844 721 A 5 THR HA A 6 PHE H 1.0 1.779 3.557 845 722 A 4 LEU HA A 6 PHE H 1.0 1.997 5.669 846 723 A 6 PHE HBx A 6 PHE H 1.0 1.673 3.093 847 724 A 6 PHE HBy A 6 PHE H 1.0 1.681 3.123 848 725 A 4 LEU HBy A 6 PHE H 1.0 2.000 6.030 849 726 A 5 THR HG2% A 6 PHE H 1.0 1.860 4.024 850 727 A 36 PHE HDy A 37 ILE H 1.0 1.967 4.993 851 727 A 36 PHE HDx A 37 ILE H 1.0 1.967 4.993 852 728 A 11 ILE HA A 37 ILE H 1.0 1.861 4.027 853 729 A 37 ILE H A 10 HIS HA 1.0 2.000 6.034 854 730 A 37 ILE H A 36 PHE HA 1.0 1.651 3.009 855 731 A 37 ILE HA A 37 ILE H 1.0 1.914 4.432 856 732 A 37 ILE H A 12 THR HB 1.0 1.999 5.891 857 733 A 37 ILE H A 36 PHE HBx 1.0 1.966 4.998 858 734 A 37 ILE H A 10 HIS HBx 1.0 1.999 6.121 859 735 A 37 ILE H A 36 PHE HBy 1.0 1.847 3.941 860 736 A 37 ILE HB A 37 ILE H 1.0 1.703 3.211 861 737 A 11 ILE HG1x A 37 ILE H 1.0 1.998 6.196 862 738 A 37 ILE H A 37 ILE HG1x 1.0 1.985 6.695 863 739 A 12 THR HG2% A 37 ILE H 1.0 1.758 3.456 864 740 A 65 LEU HD2% A 37 ILE H 1.0 1.971 6.995 865 741 A 11 ILE HD1% A 37 ILE H 1.0 1.904 4.338 866 742 A 37 ILE HD1% A 37 ILE H 1.0 1.918 4.458 867 743 A 57 VAL H A 55 LYS H 1.0 1.990 6.558 868 744 A 57 VAL H A 56 ASN HA 1.0 1.590 2.786 869 745 A 57 VAL H A 89 THR HA 1.0 1.893 4.251 870 746 A 57 VAL H A 48 CYS HA 1.0 1.825 8.547 871 747 A 57 VAL H A 57 VAL HA 1.0 1.843 3.917 872 748 A 57 VAL H A 56 ASN HBx 1.0 1.983 5.281 873 749 A 57 VAL H A 56 ASN HBy 1.0 1.903 4.335 874 750 A 57 VAL H A 57 VAL HB 1.0 1.796 3.650 875 751 A 57 VAL H A 87 ALA HB% 1.0 1.997 5.669 876 752 A 57 VAL H A 57 VAL HG1% 1.0 1.818 3.772 877 753 A 36 PHE H A 35 THR H 1.0 1.994 5.564 878 754 A 67 ASP HA A 35 THR H 1.0 2.000 5.884 879 755 A 34 ASN HA A 35 THR H 1.0 1.472 2.418 880 756 A 35 THR HB A 35 THR H 1.0 1.639 2.959 881 757 A 34 ASN HBx A 35 THR H 1.0 1.940 4.668 882 758 A 34 ASN HBy A 35 THR H 1.0 1.928 4.550 883 759 A 35 THR HG2% A 35 THR H 1.0 1.841 3.899 884 760 A 51 ILE H A 93 GLN H 1.0 2.000 5.946 885 761 A 52 ILE H A 51 ILE H 1.0 1.965 4.977 886 762 A 48 CYS HA A 51 ILE H 1.0 1.992 5.524 887 763 A 92 ASN HA A 51 ILE H 1.0 1.832 8.492 888 764 A 50 GLY HAx A 51 ILE H 1.0 1.867 4.069 889 765 A 49 LYS HA A 51 ILE H 1.0 1.903 4.333 890 766 A 50 GLY HAy A 51 ILE H 1.0 1.889 4.231 891 767 A 48 CYS HBx A 51 ILE H 1.0 1.998 5.746 892 768 A 51 ILE H A 93 GLN HGx 1.0 1.979 5.207 893 769 A 93 GLN HGy A 51 ILE H 1.0 1.887 4.217 894 770 A 52 ILE HB A 51 ILE H 1.0 1.997 6.289 895 771 A 51 ILE HB A 51 ILE H 1.0 1.689 3.159 896 772 A 51 ILE HG1y A 51 ILE H 1.0 1.882 4.176 897 773 A 52 ILE HG2% A 51 ILE H 1.0 1.984 5.300 898 774 A 51 ILE HG2% A 51 ILE H 1.0 1.807 3.711 899 775 A 16 ASP HA A 16 ASP H 1.0 1.813 3.743 900 776 A 14 THR HA A 16 ASP H 1.0 1.936 4.634 901 777 A 14 THR HB A 16 ASP H 1.0 1.997 6.303 902 778 A 16 ASP H A 15 ARG HA 1.0 1.978 5.188 903 779 A 16 ASP HBx A 16 ASP H 1.0 1.797 3.651 904 780 A 16 ASP HBy A 16 ASP H 1.0 1.762 3.478 905 781 A 14 THR HG2% A 16 ASP H 1.0 1.853 3.977 906 782 A 84 ASN H A 63 PHE H 1.0 1.789 3.611 907 783 A 83 THR H A 84 ASN H 1.0 1.944 4.710 908 784 A 83 THR HA A 84 ASN H 1.0 1.584 2.766 909 785 A 84 ASN HA A 84 ASN H 1.0 1.767 3.503 910 786 A 63 PHE HA A 84 ASN H 1.0 1.996 6.356 911 787 A 62 GLU HA A 84 ASN H 1.0 1.926 4.540 912 788 A 83 THR HB A 84 ASN H 1.0 1.909 4.383 913 789 A 63 PHE HBx A 84 ASN H 1.0 1.827 8.523 914 790 A 84 ASN HBx A 84 ASN H 1.0 1.916 4.444 915 791 A 84 ASN HBy A 84 ASN H 1.0 1.880 4.158 916 792 A 62 GLU HGy A 84 ASN H 1.0 1.989 6.617 917 793 A 62 GLU HBx A 84 ASN H 1.0 1.991 5.453 918 794 A 62 GLU HBy A 84 ASN H 1.0 1.907 4.365 919 795 A 65 LEU HD2% A 84 ASN H 1.0 1.988 5.404 920 796 A 70 VAL H A 69 ASN H 1.0 1.972 5.088 921 797 A 69 ASN H A 68 CYS H 1.0 1.916 4.442 922 798 A 69 ASN H A 69 ASN HD2y 1.0 1.991 5.469 923 799 A 69 ASN H A 69 ASN HD2x 1.0 1.990 6.580 924 800 A 69 ASN HA A 69 ASN H 1.0 1.863 4.045 925 801 A 68 CYS HA A 69 ASN H 1.0 1.604 2.834 926 802 A 69 ASN HBx A 69 ASN H 1.0 1.840 3.902 927 803 A 69 ASN HBy A 69 ASN H 1.0 1.828 3.822 928 804 A 77 TYR HBy A 69 ASN H 1.0 1.918 4.470 929 805 A 68 CYS HBy A 69 ASN H 1.0 1.944 4.714 930 806 A 46 ALA H A 45 LYS H 1.0 1.795 3.643 931 807 A 43 PRO HA A 45 LYS H 1.0 1.975 5.131 932 808 A 42 GLU HA A 45 LYS H 1.0 1.908 4.376 933 809 A 44 VAL HA A 45 LYS H 1.0 1.925 4.521 934 810 A 45 LYS HA A 45 LYS H 1.0 1.886 4.210 935 811 A 44 VAL HB A 45 LYS H 1.0 1.748 3.414 936 812 A 44 VAL HG2% A 45 LYS H 1.0 1.865 4.053 937 813 A 17 VAL H A 16 ASP H 1.0 1.958 4.882 938 814 A 16 ASP HA A 17 VAL H 1.0 1.622 2.900 939 815 A 17 VAL H A 15 ARG HA 1.0 1.966 7.082 940 816 A 17 VAL HA A 17 VAL H 1.0 1.894 4.264 941 817 A 16 ASP HBx A 17 VAL H 1.0 1.976 5.142 942 818 A 16 ASP HBy A 17 VAL H 1.0 1.995 6.367 943 819 A 17 VAL HB A 17 VAL H 1.0 1.742 3.384 944 820 A 79 LEU HD1% A 17 VAL H 1.0 1.843 3.915 945 821 A 79 LEU HD2% A 17 VAL H 1.0 1.922 4.494 946 822 A 14 THR HG2% A 17 VAL H 1.0 1.996 5.648 947 823 A 17 VAL HG1% A 17 VAL H 1.0 1.655 3.023 948 824 A 17 VAL HG2% A 17 VAL H 1.0 1.888 4.214 949 825 A 11 ILE H A 37 ILE H 1.0 1.942 7.414 950 826 A 11 ILE H A 11 ILE HA 1.0 1.894 4.266 951 827 A 11 ILE H A 10 HIS HA 1.0 1.957 4.869 952 828 A 11 ILE H A 9 LYS HA 1.0 1.709 9.339 953 829 A 11 ILE H A 8 LYS HA 1.0 1.996 6.364 954 830 A 11 ILE H A 7 GLN HA 1.0 1.891 4.239 955 831 A 11 ILE H A 10 HIS HBx 1.0 1.977 5.157 956 832 A 11 ILE H A 11 ILE HB 1.0 1.806 3.698 957 833 A 11 ILE H A 11 ILE HG1x 1.0 1.904 4.340 958 834 A 11 ILE H A 11 ILE HG2% 1.0 1.879 4.153 959 835 A 11 ILE H A 11 ILE HD1% 1.0 1.980 6.824 960 836 A 63 PHE HDy A 63 PHE H 1.0 1.823 3.795 961 836 A 63 PHE HDx A 63 PHE H 1.0 1.823 3.795 962 837 A 86 PHE HDy A 63 PHE H 1.0 1.996 6.356 963 837 A 86 PHE HDx A 63 PHE H 1.0 1.996 6.356 964 838 A 86 PHE HEy A 63 PHE H 1.0 1.992 6.508 965 838 A 86 PHE HEx A 63 PHE H 1.0 1.992 6.508 966 839 A 83 THR HA A 63 PHE H 1.0 1.977 5.171 967 840 A 84 ASN HA A 63 PHE H 1.0 1.994 5.594 968 841 A 63 PHE HA A 63 PHE H 1.0 1.857 4.005 969 842 A 85 LYS HA A 63 PHE H 1.0 1.919 4.471 970 843 A 62 GLU HA A 63 PHE H 1.0 1.655 3.021 971 844 A 63 PHE HBx A 63 PHE H 1.0 1.941 4.679 972 845 A 63 PHE HBy A 63 PHE H 1.0 1.843 3.917 973 846 A 63 PHE H A 62 GLU HGx 1.0 1.941 4.677 974 847 A 62 GLU HGy A 63 PHE H 1.0 1.980 5.222 975 848 A 62 GLU HBx A 63 PHE H 1.0 1.949 4.773 976 849 A 62 GLU HBy A 63 PHE H 1.0 1.839 3.893 977 850 A 65 LEU HD2% A 63 PHE H 1.0 1.999 6.131 978 851 A 87 ALA H A 102 GLY H 1.0 1.999 5.915 979 852 A 87 ALA H A 86 PHE H 1.0 1.982 6.780 980 853 A 86 PHE HDy A 87 ALA H 1.0 1.774 3.536 981 853 A 86 PHE HDx A 87 ALA H 1.0 1.774 3.536 982 854 A 100 GLY H A 87 ALA H 1.0 1.759 3.463 983 855 A 87 ALA HA A 87 ALA H 1.0 1.831 3.841 984 856 A 86 PHE HA A 87 ALA H 1.0 1.594 2.802 985 857 A 58 LEU HA A 87 ALA H 1.0 1.999 6.169 986 858 A 101 VAL HA A 87 ALA H 1.0 1.801 3.675 987 859 A 100 GLY HAx A 87 ALA H 1.0 1.983 6.759 988 860 A 100 GLY HAy A 87 ALA H 1.0 1.975 6.921 989 861 A 86 PHE HBx A 87 ALA H 1.0 1.671 3.083 990 862 A 86 PHE HBy A 87 ALA H 1.0 1.794 3.642 991 863 A 99 VAL HB A 87 ALA H 1.0 1.999 5.825 992 864 A 87 ALA HB% A 87 ALA H 1.0 1.617 2.879 993 865 A 39 SER H A 40 ARG H 1.0 1.999 6.197 994 866 A 38 TYR HDy A 39 SER H 1.0 1.947 4.761 995 866 A 38 TYR HDx A 39 SER H 1.0 1.947 4.761 996 867 A 38 TYR HEy A 39 SER H 1.0 1.885 8.033 997 867 A 38 TYR HEx A 39 SER H 1.0 1.885 8.033 998 868 A 38 TYR HA A 39 SER H 1.0 1.648 2.996 999 869 A 11 ILE HA A 39 SER H 1.0 1.999 6.237 1000 870 A 39 SER HA A 39 SER H 1.0 1.844 3.920 1001 871 A 39 SER HBx A 39 SER H 1.0 1.943 4.699 1002 872 A 39 SER HBy A 39 SER H 1.0 1.878 4.148 1003 873 A 38 TYR HBy A 39 SER H 1.0 1.904 4.338 1004 874 A 44 VAL HG2% A 39 SER H 1.0 1.989 6.621 1005 875 A 11 ILE HG2% A 39 SER H 1.0 1.827 3.823 1006 876 A 37 ILE HG2% A 39 SER H 1.0 1.973 5.089 1007 877 A 66 SER H A 36 PHE H 1.0 1.921 4.495 1008 878 A 66 SER H A 38 TYR H 1.0 1.994 6.444 1009 879 A 66 SER H A 65 LEU HA 1.0 1.623 2.905 1010 880 A 66 SER H A 66 SER HA 1.0 1.866 4.060 1011 881 A 66 SER H A 37 ILE HA 1.0 1.968 5.026 1012 882 A 66 SER H A 66 SER HBx 1.0 1.887 4.213 1013 883 A 66 SER H A 66 SER HBy 1.0 1.837 3.879 1014 884 A 66 SER H A 35 THR HG2% 1.0 1.879 4.155 1015 885 A 66 SER H A 65 LEU HD2% 1.0 1.854 3.986 1016 886 A 66 SER H A 17 VAL HG1% 1.0 1.994 6.414 1017 887 A 4 LEU H A 3 TRP H 1.0 1.889 4.227 1018 888 A 5 THR H A 4 LEU H 1.0 1.726 3.312 1019 889 A 3 TRP HD1 A 4 LEU H 1.0 1.980 5.222 1020 890 A 7 GLN HE2y A 4 LEU H 1.0 2.000 6.106 1021 891 A 3 TRP HA A 4 LEU H 1.0 1.963 4.947 1022 892 A 4 LEU H A 2 ASP HA 1.0 1.987 5.351 1023 893 A 7 GLN HE2x A 4 LEU H 1.0 1.999 6.189 1024 894 A 5 THR HA A 4 LEU H 1.0 1.995 5.597 1025 895 A 4 LEU HA A 4 LEU H 1.0 1.748 3.410 1026 896 A 5 THR HB A 4 LEU H 1.0 1.997 5.707 1027 897 A 3 TRP HBx A 4 LEU H 1.0 1.901 4.319 1028 898 A 3 TRP HBy A 4 LEU H 1.0 1.826 3.812 1029 899 A 4 LEU HBx A 4 LEU H 1.0 1.652 3.014 1030 900 A 19 CYS H A 20 ASP H 1.0 1.856 4.002 1031 901 A 19 CYS H A 21 ASN H 1.0 1.999 6.195 1032 902 A 19 CYS H A 18 ASP HA 1.0 1.596 2.808 1033 903 A 19 CYS H A 19 CYS HA 1.0 1.755 3.449 1034 904 A 19 CYS H A 18 ASP HBy 1.0 1.939 4.673 1035 905 A 19 CYS H A 17 VAL HB 1.0 1.997 5.713 1036 906 A 19 CYS H A 79 LEU HD1% 1.0 1.976 6.896 1037 907 A 19 CYS H A 79 LEU HD2% 1.0 1.994 5.568 1038 908 A 19 CYS H A 22 ILE HG2% 1.0 1.999 5.829 1039 909 A 19 CYS H A 17 VAL HG2% 1.0 1.839 3.887 1040 910 A 84 ASN HD2y A 85 LYS H 1.0 1.976 5.154 1041 911 A 85 LYS H A 84 ASN HD2x 1.0 1.953 4.825 1042 912 A 84 ASN HA A 85 LYS H 1.0 1.727 3.315 1043 913 A 85 LYS HA A 85 LYS H 1.0 1.848 3.948 1044 914 A 62 GLU HA A 85 LYS H 1.0 2.000 6.070 1045 915 A 85 LYS H A 102 GLY HAx 1.0 1.954 7.266 1046 916 A 84 ASN HBx A 85 LYS H 1.0 1.892 4.246 1047 917 A 62 GLU HGy A 85 LYS H 1.0 1.999 6.137 1048 918 A 84 ASN H A 85 LYS H 1.0 1.895 4.277 1049 919 A 78 LYS H A 71 THR H 1.0 1.963 4.949 1050 920 A 78 LYS H A 68 CYS HA 1.0 1.948 4.764 1051 921 A 78 LYS H A 78 LYS HA 1.0 1.727 3.319 1052 922 A 86 PHE HBy A 85 LYS H 1.0 1.999 5.827 1053 923 A 84 ASN HBy A 85 LYS H 1.0 1.754 3.440 1054 924 A 78 LYS H A 78 LYS HBx 1.0 1.804 3.694 1055 925 A 78 LYS H A 71 THR HG2% 1.0 1.834 3.862 1056 926 A 78 LYS H A 70 VAL HG2% 1.0 1.999 6.159 1057 927 A 75 CYS HA A 75 CYS H 1.0 1.957 4.869 1058 928 A 74 PRO HA A 75 CYS H 1.0 1.579 2.751 1059 929 A 70 VAL HG1% A 75 CYS H 1.0 1.998 5.758 1060 930 A 70 VAL HG2% A 75 CYS H 1.0 1.760 3.468 1061 931 A 37 ILE H A 12 THR H 1.0 1.944 4.722 1062 932 A 14 THR H A 12 THR H 1.0 1.977 6.887 1063 933 A 39 SER H A 12 THR H 1.0 1.887 4.217 1064 934 A 38 TYR HA A 12 THR H 1.0 1.914 4.430 1065 935 A 11 ILE HA A 12 THR H 1.0 1.517 2.553 1066 936 A 12 THR HB A 12 THR H 1.0 1.887 4.211 1067 937 A 36 PHE HBy A 12 THR H 1.0 1.998 5.794 1068 938 A 11 ILE HB A 12 THR H 1.0 1.907 4.371 1069 939 A 37 ILE HB A 12 THR H 1.0 1.973 5.099 1070 940 A 11 ILE HG1x A 12 THR H 1.0 1.986 5.330 1071 941 A 12 THR HG2% A 12 THR H 1.0 1.498 2.494 1072 942 A 11 ILE HD1% A 12 THR H 1.0 2.000 6.124 1073 943 A 32 ASP H A 31 LYS HA 1.0 1.642 2.974 1074 944 A 32 ASP HA A 32 ASP H 1.0 1.776 3.546 1075 945 A 32 ASP H A 32 ASP HBx 1.0 1.704 3.220 1076 946 A 31 LYS HGx A 32 ASP H 1.0 1.904 4.340 1077 947 A 70 VAL HG1% A 32 ASP H 1.0 2.000 5.924 1078 948 A 46 ALA H A 47 ILE H 1.0 1.908 4.376 1079 949 A 48 CYS H A 47 ILE H 1.0 1.857 4.003 1080 950 A 47 ILE HA A 47 ILE H 1.0 1.899 4.303 1081 951 A 47 ILE HB A 47 ILE H 1.0 1.859 4.015 1082 952 A 46 ALA HB% A 47 ILE H 1.0 1.927 4.553 1083 953 A 47 ILE H A 47 ILE HG1x 1.0 1.856 3.996 1084 954 A 47 ILE HG2% A 47 ILE H 1.0 1.849 3.951 1085 955 A 47 ILE HD1% A 47 ILE H 1.0 1.998 6.272 1086 956 A 22 ILE H A 22 ILE HA 1.0 1.881 4.167 1087 957 A 22 ILE H A 22 ILE HB 1.0 1.681 3.125 1088 958 A 22 ILE H A 22 ILE HG1y 1.0 1.976 5.144 1089 959 A 22 ILE H A 22 ILE HG2% 1.0 1.866 4.062 1090 960 A 61 SER H A 62 GLU H 1.0 1.965 4.981 1091 961 A 84 ASN HA A 62 GLU H 1.0 1.998 5.758 1092 962 A 61 SER HA A 62 GLU H 1.0 1.652 3.012 1093 963 A 62 GLU HA A 62 GLU H 1.0 1.912 4.410 1094 964 A 62 GLU HGx A 62 GLU H 1.0 1.810 3.724 1095 965 A 62 GLU HGy A 62 GLU H 1.0 1.951 4.803 1096 966 A 62 GLU HBx A 62 GLU H 1.0 1.746 3.402 1097 967 A 62 GLU HBy A 62 GLU H 1.0 1.854 3.984 1098 968 A 38 TYR H A 64 TYR H 1.0 1.994 6.460 1099 969 A 64 TYR H A 63 PHE H 1.0 1.999 5.775 1100 970 A 64 TYR H A 64 TYR HEy 1.0 1.945 4.731 1101 970 A 64 TYR H A 64 TYR HEx 1.0 1.945 4.731 1102 971 A 64 TYR H A 83 THR HA 1.0 1.982 6.774 1103 972 A 64 TYR H A 64 TYR HA 1.0 1.892 4.250 1104 973 A 64 TYR H A 63 PHE HA 1.0 1.576 2.738 1105 974 A 64 TYR H A 64 TYR HBx 1.0 1.700 3.200 1106 975 A 64 TYR H A 63 PHE HBx 1.0 1.830 3.836 1107 976 A 64 TYR H A 38 TYR HBx 1.0 1.973 5.089 1108 977 A 64 TYR H A 63 PHE HBy 1.0 1.688 3.154 1109 978 A 64 TYR H A 83 THR HG2% 1.0 1.999 6.107 1110 979 A 64 TYR H A 37 ILE HG2% 1.0 1.965 4.987 1111 980 A 64 TYR H A 65 LEU HD2% 1.0 1.998 6.278 1112 981 A 92 ASN H A 94 ALA H 1.0 1.999 5.837 1113 982 A 94 ALA H A 91 GLU H 1.0 1.701 3.205 1114 983 A 90 CYS HA A 94 ALA H 1.0 1.940 4.676 1115 984 A 94 ALA HA A 94 ALA H 1.0 1.819 3.775 1116 985 A 91 GLU HA A 94 ALA H 1.0 1.993 5.523 1117 986 A 93 GLN HA A 94 ALA H 1.0 1.759 3.463 1118 987 A 92 ASN HBx A 94 ALA H 1.0 1.996 6.372 1119 988 A 48 CYS HBx A 94 ALA H 1.0 1.907 4.373 1120 989 A 92 ASN HBy A 94 ALA H 1.0 1.944 7.404 1121 990 A 90 CYS HBy A 94 ALA H 1.0 1.992 6.502 1122 991 A 93 GLN HGy A 94 ALA H 1.0 1.974 5.112 1123 992 A 94 ALA H A 48 CYS HBy 1.0 1.932 4.592 1124 993 A 94 ALA HB% A 94 ALA H 1.0 1.669 3.079 1125 994 A 51 ILE HG2% A 94 ALA H 1.0 1.982 5.260 1126 995 A 67 ASP H A 68 CYS H 1.0 1.990 5.426 1127 996 A 36 PHE H A 68 CYS H 1.0 1.993 5.525 1128 997 A 67 ASP HA A 68 CYS H 1.0 1.588 2.782 1129 998 A 68 CYS HA A 68 CYS H 1.0 1.859 4.013 1130 999 A 35 THR HA A 68 CYS H 1.0 1.851 3.963 1131 1000 A 68 CYS HBx A 68 CYS H 1.0 1.823 3.801 1132 1001 A 67 ASP HBx A 68 CYS H 1.0 1.997 5.721 1133 1002 A 67 ASP HBy A 68 CYS H 1.0 1.899 4.299 1134 1003 A 68 CYS HBy A 68 CYS H 1.0 1.871 4.091 1135 1004 A 35 THR HG2% A 68 CYS H 1.0 1.980 6.812 1136 1005 A 92 ASN H A 91 GLU H 1.0 1.999 6.177 1137 1006 A 90 CYS HA A 91 GLU H 1.0 1.636 2.948 1138 1007 A 91 GLU HA A 91 GLU H 1.0 1.828 3.828 1139 1008 A 48 CYS HBx A 91 GLU H 1.0 1.993 6.455 1140 1009 A 90 CYS HBx A 91 GLU H 1.0 1.977 5.153 1141 1010 A 90 CYS HBy A 91 GLU H 1.0 1.885 4.201 1142 1011 A 91 GLU HGx A 91 GLU H 1.0 1.996 6.326 1143 1012 A 91 GLU HGy A 91 GLU H 1.0 1.997 6.313 1144 1013 A 94 ALA HB% A 91 GLU H 1.0 1.825 3.813 1145 1014 A 68 CYS HA A 20 ASP H 1.0 1.996 6.374 1146 1015 A 18 ASP HA A 20 ASP H 1.0 1.982 5.268 1147 1016 A 20 ASP H A 20 ASP HA 1.0 1.878 4.150 1148 1017 A 19 CYS HA A 20 ASP H 1.0 1.976 5.154 1149 1018 A 20 ASP H A 20 ASP HBx 1.0 1.857 4.003 1150 1019 A 20 ASP HBy A 20 ASP H 1.0 1.800 3.670 1151 1020 A 42 GLU H A 40 ARG HA 1.0 1.954 4.834 1152 1021 A 42 GLU H A 42 GLU HA 1.0 1.756 3.450 1153 1022 A 42 GLU H A 43 PRO HDx 1.0 1.712 3.250 1154 1023 A 42 GLU H A 41 PRO HDy 1.0 1.805 3.697 1155 1024 A 42 GLU H A 44 VAL HB 1.0 1.996 5.618 1156 1025 A 42 GLU H A 41 PRO HGy 1.0 1.678 3.112 1157 1026 A 42 GLU H A 40 ARG HBy 1.0 1.958 4.880 1158 1027 A 89 THR H A 97 HIS H 1.0 1.861 4.025 1159 1028 A 89 THR H A 97 HIS HA 1.0 1.999 6.177 1160 1029 A 89 THR H A 88 VAL HA 1.0 1.645 2.985 1161 1030 A 89 THR H A 89 THR HA 1.0 1.916 4.442 1162 1031 A 89 THR H A 98 PHE HA 1.0 1.829 3.831 1163 1032 A 89 THR H A 89 THR HB 1.0 1.669 3.075 1164 1033 A 89 THR H A 97 HIS HBx 1.0 1.893 4.253 1165 1034 A 89 THR H A 97 HIS HBy 1.0 1.920 4.482 1166 1035 A 89 THR H A 88 VAL HB 1.0 1.667 3.071 1167 1036 A 89 THR H A 99 VAL HG2% 1.0 1.613 2.869 1168 1037 A 22 ILE H A 23 MET H 1.0 1.810 3.722 1169 1038 A 24 SER H A 23 MET H 1.0 1.810 3.720 1170 1039 A 21 ASN H A 23 MET H 1.0 1.943 4.709 1171 1040 A 20 ASP HA A 23 MET H 1.0 1.999 5.855 1172 1041 A 23 MET HA A 23 MET H 1.0 1.869 4.087 1173 1042 A 22 ILE HA A 23 MET H 1.0 1.933 4.609 1174 1043 A 19 CYS HA A 23 MET H 1.0 1.919 4.473 1175 1044 A 23 MET HBx A 23 MET H 1.0 1.798 3.662 1176 1045 A 23 MET HBy A 23 MET H 1.0 1.821 3.785 1177 1046 A 22 ILE HB A 23 MET H 1.0 1.847 3.943 1178 1047 A 22 ILE HG1x A 23 MET H 1.0 1.994 5.558 1179 1048 A 22 ILE HG2% A 23 MET H 1.0 1.706 3.224 1180 1049 A 9 LYS H A 8 LYS H 1.0 1.634 2.942 1181 1050 A 6 PHE HA A 8 LYS H 1.0 1.995 6.401 1182 1051 A 8 LYS HA A 8 LYS H 1.0 1.755 3.445 1183 1052 A 5 THR HB A 8 LYS H 1.0 1.986 5.352 1184 1053 A 7 GLN HA A 8 LYS H 1.0 1.929 4.561 1185 1054 A 8 LYS HBy A 8 LYS H 1.0 1.672 3.088 1186 1055 A 59 THR H A 86 PHE HDy 1.0 1.972 6.958 1187 1055 A 59 THR H A 86 PHE HDx 1.0 1.972 6.958 1188 1056 A 59 THR H A 87 ALA HA 1.0 1.848 3.944 1189 1057 A 59 THR H A 86 PHE HA 1.0 1.995 6.405 1190 1058 A 59 THR H A 58 LEU HA 1.0 1.613 2.867 1191 1059 A 59 THR H A 59 THR HA 1.0 1.793 3.635 1192 1060 A 59 THR H A 87 ALA HB% 1.0 1.932 4.592 1193 1061 A 59 THR H A 57 VAL HG1% 1.0 1.910 4.394 1194 1062 A 59 THR H A 58 LEU HD2% 1.0 1.811 3.731 1195 1063 A 59 THR H A 47 ILE HD1% 1.0 1.696 3.184 1196 1064 A 5 THR HA A 5 THR H 1.0 1.703 3.213 1197 1065 A 5 THR HB A 5 THR H 1.0 1.854 3.984 1198 1066 A 5 THR H A 2 ASP HBx 1.0 1.983 5.279 1199 1067 A 5 THR H A 4 LEU HBx 1.0 1.741 3.379 1200 1068 A 5 THR HG2% A 5 THR H 1.0 1.842 3.908 1201 1069 A 28 PHE H A 27 LEU H 1.0 1.942 4.688 1202 1070 A 25 THR HA A 27 LEU H 1.0 1.990 5.446 1203 1071 A 27 LEU HG A 27 LEU H 1.0 1.877 4.135 1204 1072 A 27 LEU HD2% A 27 LEU H 1.0 1.926 4.540 1205 1073 A 32 ASP H A 31 LYS H 1.0 1.969 5.029 1206 1074 A 28 PHE HDy A 31 LYS H 1.0 1.999 6.071 1207 1074 A 28 PHE HDx A 31 LYS H 1.0 1.999 6.071 1208 1075 A 28 PHE H A 31 LYS H 1.0 1.980 6.814 1209 1076 A 30 CYS HA A 31 LYS H 1.0 1.768 3.508 1210 1077 A 31 LYS HA A 31 LYS H 1.0 1.714 3.258 1211 1078 A 30 CYS HBx A 31 LYS H 1.0 2.000 6.078 1212 1079 A 23 MET HBx A 31 LYS H 1.0 1.983 5.275 1213 1080 A 7 GLN H A 8 LYS H 1.0 1.791 3.621 1214 1081 A 7 GLN H A 6 PHE HDy 1.0 1.898 4.290 1215 1081 A 7 GLN H A 6 PHE HDx 1.0 1.898 4.290 1216 1082 A 7 GLN H A 7 GLN HE2y 1.0 1.995 5.593 1217 1083 A 7 GLN H A 3 TRP HA 1.0 1.959 4.893 1218 1084 A 7 GLN H A 7 GLN HE2x 1.0 1.937 4.643 1219 1085 A 7 GLN H A 6 PHE HA 1.0 1.904 4.350 1220 1086 A 7 GLN H A 5 THR HA 1.0 1.994 5.554 1221 1087 A 7 GLN H A 4 LEU HA 1.0 1.913 4.423 1222 1088 A 7 GLN H A 6 PHE HBy 1.0 1.892 4.246 1223 1089 A 67 ASP H A 82 SER H 1.0 1.999 5.879 1224 1090 A 65 LEU H A 82 SER H 1.0 1.813 3.741 1225 1091 A 83 THR H A 82 SER H 1.0 2.000 6.006 1226 1092 A 83 THR HA A 82 SER H 1.0 1.982 5.272 1227 1093 A 81 LYS HA A 82 SER H 1.0 1.492 2.478 1228 1094 A 66 SER HA A 82 SER H 1.0 1.764 3.488 1229 1095 A 64 TYR HA A 82 SER H 1.0 1.948 4.762 1230 1096 A 81 LYS HGx A 82 SER H 1.0 1.868 4.078 1231 1097 A 101 VAL H A 100 GLY H 1.0 1.873 4.111 1232 1098 A 101 VAL H A 101 VAL HA 1.0 1.785 3.595 1233 1099 A 101 VAL H A 100 GLY HAx 1.0 1.703 3.215 1234 1100 A 101 VAL H A 100 GLY HAy 1.0 1.638 2.956 1235 1101 A 101 VAL H A 101 VAL HB 1.0 1.772 3.526 1236 1102 A 97 HIS H A 96 VAL H 1.0 1.642 2.970 1237 1103 A 97 HIS HA A 97 HIS H 1.0 1.824 3.806 1238 1104 A 97 HIS H A 95 PRO HA 1.0 2.000 6.068 1239 1105 A 88 VAL HA A 97 HIS H 1.0 1.997 6.289 1240 1106 A 96 VAL HA A 97 HIS H 1.0 1.777 3.553 1241 1107 A 89 THR HB A 97 HIS H 1.0 1.837 3.879 1242 1108 A 97 HIS HBx A 97 HIS H 1.0 1.953 4.821 1243 1109 A 97 HIS HBy A 97 HIS H 1.0 1.885 4.199 1244 1110 A 96 VAL HB A 97 HIS H 1.0 1.996 5.646 1245 1111 A 96 VAL HG1% A 97 HIS H 1.0 1.956 4.856 1246 1112 A 96 VAL HG2% A 97 HIS H 1.0 1.796 3.646 1247 1113 A 70 VAL H A 71 THR H 1.0 1.987 5.383 1248 1114 A 77 TYR HEy A 71 THR H 1.0 1.988 6.622 1249 1114 A 77 TYR HEx A 71 THR H 1.0 1.988 6.622 1250 1115 A 71 THR H A 71 THR HB 1.0 1.791 3.621 1251 1116 A 71 THR H A 71 THR HA 1.0 1.779 3.563 1252 1117 A 7 GLN H A 7 GLN HA 1.0 1.589 2.787 1253 1118 A 71 THR H A 70 VAL HB 1.0 1.955 4.839 1254 1119 A 71 THR H A 70 VAL HG2% 1.0 1.693 3.173 1255 1120 A 70 VAL H A 34 ASN H 1.0 1.825 8.547 1256 1121 A 34 ASN H A 68 CYS H 1.0 1.838 3.884 1257 1122 A 33 LYS HA A 34 ASN H 1.0 1.586 2.776 1258 1123 A 34 ASN H A 34 ASN HA 1.0 1.735 3.355 1259 1124 A 34 ASN HD2x A 34 ASN H 1.0 1.797 8.757 1260 1125 A 68 CYS HBx A 34 ASN H 1.0 1.947 4.759 1261 1126 A 34 ASN H A 67 ASP HBy 1.0 1.990 6.572 1262 1127 A 68 CYS HBy A 34 ASN H 1.0 1.992 5.516 1263 1128 A 34 ASN H A 34 ASN HBx 1.0 1.885 4.201 1264 1129 A 76 LYS H A 75 CYS H 1.0 1.772 3.526 1265 1130 A 71 THR H A 76 LYS H 1.0 1.999 6.193 1266 1131 A 73 ARG HA A 76 LYS H 1.0 1.976 6.910 1267 1132 A 75 CYS HA A 76 LYS H 1.0 1.995 6.407 1268 1133 A 74 PRO HA A 76 LYS H 1.0 1.927 4.539 1269 1134 A 77 TYR HBy A 76 LYS H 1.0 1.992 6.516 1270 1135 A 70 VAL HB A 76 LYS H 1.0 1.977 6.877 1271 1136 A 70 VAL HG2% A 76 LYS H 1.0 1.689 3.157 1272 1137 A 34 ASN HD2y A 10 HIS HE1 1.0 1.801 3.679 1273 1138 A 34 ASN HD2y A 10 HIS HA 1.0 1.931 4.587 1274 1139 A 34 ASN HD2y A 34 ASN HD2x 1.0 1.618 2.888 1275 1140 A 34 ASN HD2y A 34 ASN HBx 1.0 1.973 5.099 1276 1141 A 34 ASN HD2y A 34 ASN HBy 1.0 1.862 4.038 1277 1142 A 42 GLU H A 44 VAL H 1.0 1.995 6.427 1278 1143 A 44 VAL H A 45 LYS H 1.0 1.683 3.131 1279 1144 A 44 VAL H A 46 ALA H 1.0 1.946 4.738 1280 1145 A 44 VAL H A 43 PRO HA 1.0 1.838 3.884 1281 1146 A 44 VAL H A 44 VAL HA 1.0 1.750 3.420 1282 1147 A 44 VAL H A 41 PRO HDy 1.0 2.000 5.982 1283 1148 A 44 VAL HB A 44 VAL H 1.0 1.644 2.980 1284 1149 A 44 VAL H A 40 ARG HBx 1.0 1.960 4.914 1285 1150 A 44 VAL H A 44 VAL HG2% 1.0 1.719 3.285 1286 1151 A 21 ASN HD2y A 21 ASN HD2x 1.0 1.350 2.090 1287 1152 A 18 ASP HBx A 21 ASN HD2y 1.0 1.813 8.631 1288 1153 A 46 ALA H A 43 PRO HA 1.0 1.916 4.448 1289 1154 A 42 GLU HA A 46 ALA H 1.0 1.999 6.235 1290 1155 A 46 ALA H A 46 ALA HA 1.0 1.759 3.463 1291 1156 A 46 ALA H A 47 ILE HA 1.0 2.000 6.018 1292 1157 A 45 LYS HA A 46 ALA H 1.0 1.969 5.027 1293 1158 A 46 ALA H A 47 ILE HB 1.0 1.991 5.467 1294 1159 A 46 ALA H A 45 LYS HBy 1.0 1.865 4.061 1295 1160 A 46 ALA H A 46 ALA HB% 1.0 1.627 2.919 1296 1161 A 83 THR H A 83 THR HA 1.0 1.860 4.024 1297 1162 A 83 THR H A 83 THR HG2% 1.0 1.880 4.158 1298 1163 A 9 LYS H A 6 PHE H 1.0 1.981 6.807 1299 1164 A 10 HIS H A 9 LYS H 1.0 1.656 3.026 1300 1165 A 9 LYS H A 6 PHE HA 1.0 1.923 4.503 1301 1166 A 9 LYS H A 9 LYS HA 1.0 1.836 3.874 1302 1167 A 9 LYS H A 8 LYS HA 1.0 1.865 4.061 1303 1168 A 5 THR HB A 9 LYS H 1.0 1.999 5.777 1304 1169 A 9 LYS H A 7 GLN HA 1.0 1.999 5.891 1305 1170 A 9 LYS H A 8 LYS HEx 1.0 1.986 6.672 1306 1170 A 9 LYS H A 8 LYS HEy 1.0 1.986 6.672 1307 1171 A 9 LYS H A 8 LYS HBx 1.0 1.829 3.835 1308 1172 A 9 LYS H A 5 THR HG2% 1.0 1.896 4.284 1309 1173 A 59 THR H A 61 SER H 1.0 1.999 6.187 1310 1174 A 33 LYS H A 33 LYS HA 1.0 1.827 3.817 1311 1175 A 61 SER H A 85 LYS HA 1.0 1.951 4.797 1312 1176 A 61 SER H A 60 THR HB 1.0 1.775 3.539 1313 1177 A 61 SER H A 59 THR HA 1.0 1.773 3.529 1314 1178 A 33 LYS H A 32 ASP HBx 1.0 1.788 3.606 1315 1179 A 33 LYS H A 34 ASN HBx 1.0 1.885 8.025 1316 1180 A 33 LYS H A 31 LYS HGx 1.0 1.737 3.363 1317 1181 A 33 LYS H A 70 VAL HG1% 1.0 1.967 5.001 1318 1182 A 61 SER H A 47 ILE HG2% 1.0 1.995 6.415 1319 1183 A 61 SER H A 47 ILE HD1% 1.0 1.915 4.439 1320 1184 A 20 ASP H A 21 ASN H 1.0 1.809 3.721 1321 1185 A 21 ASN HD2y A 21 ASN H 1.0 1.989 5.433 1322 1186 A 22 ILE H A 21 ASN H 1.0 1.604 2.836 1323 1187 A 21 ASN H A 21 ASN HA 1.0 1.849 3.949 1324 1188 A 21 ASN H A 20 ASP HA 1.0 1.956 4.850 1325 1189 A 19 CYS HA A 21 ASN H 1.0 1.847 8.363 1326 1190 A 18 ASP HBx A 21 ASN H 1.0 1.958 4.880 1327 1191 A 21 ASN H A 20 ASP HBx 1.0 1.878 4.146 1328 1192 A 22 ILE HB A 21 ASN H 1.0 1.983 5.273 1329 1193 A 22 ILE HG2% A 21 ASN H 1.0 1.989 5.421 1330 1194 A 93 GLN HE2y A 93 GLN HE2x 1.0 1.638 2.960 1331 1195 A 93 GLN HGx A 93 GLN HE2y 1.0 1.943 4.711 1332 1196 A 93 GLN HGy A 93 GLN HE2y 1.0 1.839 3.889 1333 1197 A 52 ILE HD1% A 93 GLN HE2y 1.0 1.956 4.858 1334 1198 A 3 TRP H A 2 ASP H 1.0 1.996 6.340 1335 1199 A 2 ASP HA A 2 ASP H 1.0 1.638 2.958 1336 1200 A 5 THR HB A 2 ASP H 1.0 1.996 5.660 1337 1201 A 1 PCA HGx A 2 ASP H 1.0 1.964 4.960 1338 1202 A 2 ASP H A 1 PCA HGy 1.0 1.918 4.468 1339 1203 A 1 PCA HBx A 2 ASP H 1.0 1.924 4.512 1340 1204 A 1 PCA HBy A 2 ASP H 1.0 1.883 4.181 1341 1205 A 50 GLY H A 51 ILE H 1.0 1.784 3.586 1342 1206 A 50 GLY HAx A 50 GLY H 1.0 1.685 3.139 1343 1207 A 51 ILE HA A 50 GLY H 1.0 1.964 4.962 1344 1208 A 50 GLY H A 49 LYS HA 1.0 1.545 2.639 1345 1209 A 50 GLY HAy A 50 GLY H 1.0 1.657 3.031 1346 1210 A 50 GLY H A 93 GLN HGx 1.0 1.987 5.369 1347 1211 A 93 GLN HGy A 50 GLY H 1.0 1.787 3.601 1348 1212 A 27 LEU H A 29 HIS H 1.0 1.997 6.279 1349 1213 A 28 PHE H A 29 HIS H 1.0 1.557 2.677 1350 1214 A 29 HIS HA A 29 HIS H 1.0 1.623 2.901 1351 1215 A 26 ASN HA A 29 HIS H 1.0 1.784 3.588 1352 1216 A 27 LEU HA A 29 HIS H 1.0 1.983 6.737 1353 1217 A 29 HIS HBx A 29 HIS H 1.0 1.869 4.085 1354 1218 A 29 HIS HBy A 29 HIS H 1.0 1.798 3.662 1355 1219 A 27 LEU HD2% A 29 HIS H 1.0 1.822 8.568 1356 1220 A 103 SER HA A 103 SER H 1.0 1.997 5.699 1357 1221 A 103 SER H A 102 GLY HAy 1.0 1.965 4.967 1358 1222 A 86 PHE H A 85 LYS H 1.0 1.995 5.613 1359 1223 A 59 THR H A 86 PHE H 1.0 1.836 3.874 1360 1224 A 86 PHE HDy A 86 PHE H 1.0 1.795 3.643 1361 1224 A 86 PHE HDx A 86 PHE H 1.0 1.795 3.643 1362 1225 A 86 PHE HEy A 86 PHE H 1.0 1.996 5.638 1363 1225 A 86 PHE HEx A 86 PHE H 1.0 1.996 5.638 1364 1226 A 86 PHE HA A 86 PHE H 1.0 1.767 3.503 1365 1227 A 85 LYS HA A 86 PHE H 1.0 1.586 2.774 1366 1228 A 59 THR HA A 86 PHE H 1.0 1.965 4.975 1367 1229 A 86 PHE HBx A 86 PHE H 1.0 1.951 4.789 1368 1230 A 86 PHE HBy A 86 PHE H 1.0 1.931 4.583 1369 1231 A 65 LEU HD1% A 86 PHE H 1.0 1.865 4.057 1370 1232 A 58 LEU HD2% A 86 PHE H 1.0 1.875 4.123 1371 1233 A 47 ILE HD1% A 86 PHE H 1.0 1.855 3.993 1372 1234 A 38 TYR HDy A 14 THR H 1.0 1.893 4.253 1373 1234 A 38 TYR HDx A 14 THR H 1.0 1.893 4.253 1374 1235 A 38 TYR HEy A 14 THR H 1.0 1.971 5.071 1375 1235 A 38 TYR HEx A 14 THR H 1.0 1.971 5.071 1376 1236 A 14 THR H A 12 THR HA 1.0 1.901 4.323 1377 1237 A 13 ASN HA A 14 THR H 1.0 1.796 3.650 1378 1238 A 14 THR HA A 14 THR H 1.0 1.781 3.569 1379 1239 A 14 THR HB A 14 THR H 1.0 1.857 4.005 1380 1240 A 12 THR HB A 14 THR H 1.0 1.968 5.022 1381 1241 A 13 ASN HBx A 14 THR H 1.0 1.997 5.709 1382 1242 A 13 ASN HBy A 14 THR H 1.0 1.989 5.443 1383 1243 A 12 THR HG2% A 14 THR H 1.0 1.819 3.775 1384 1244 A 14 THR HG2% A 14 THR H 1.0 1.654 3.018 1385 1245 A 17 VAL HG1% A 14 THR H 1.0 1.997 5.671 1386 1246 A 92 ASN HBx A 92 ASN HD2y 1.0 1.930 4.574 1387 1247 A 92 ASN HBy A 92 ASN HD2y 1.0 1.863 4.037 1388 1248 A 91 GLU HGy A 92 ASN HD2y 1.0 1.986 6.694 1389 1249 A 92 ASN HD2x A 92 ASN HD2y 1.0 1.426 2.288 1390 1250 A 92 ASN HD2x A 92 ASN HBx 1.0 1.997 5.737 1391 1251 A 92 ASN HD2x A 92 ASN HBy 1.0 1.939 4.657 1392 1252 A 92 ASN HD2x A 91 GLU HGy 1.0 1.999 6.197 1393 1253 A 28 PHE H A 26 ASN HA 1.0 1.984 5.290 1394 1254 A 28 PHE H A 27 LEU HA 1.0 1.946 4.748 1395 1255 A 27 LEU HD2% A 28 PHE H 1.0 1.976 5.138 1396 1256 A 27 LEU HD1% A 28 PHE H 1.0 1.976 6.896 1397 1257 A 30 CYS H A 25 THR H 1.0 1.760 9.012 1398 1258 A 29 HIS H A 25 THR H 1.0 1.961 7.153 1399 1259 A 23 MET H A 25 THR H 1.0 1.998 6.232 1400 1260 A 24 SER H A 25 THR H 1.0 1.710 3.244 1401 1261 A 28 PHE HDy A 25 THR H 1.0 1.970 5.050 1402 1261 A 28 PHE HDx A 25 THR H 1.0 1.970 5.050 1403 1262 A 25 THR HA A 25 THR H 1.0 1.896 4.276 1404 1263 A 25 THR HB A 25 THR H 1.0 1.781 3.573 1405 1264 A 29 HIS HA A 25 THR H 1.0 1.853 8.319 1406 1265 A 24 SER HA A 25 THR H 1.0 1.914 4.434 1407 1266 A 23 MET HBy A 25 THR H 1.0 1.969 7.037 1408 1267 A 25 THR HG2% A 25 THR H 1.0 1.786 3.594 1409 1268 A 22 ILE HG1x A 25 THR H 1.0 1.998 6.212 1410 1269 A 55 LYS H A 54 SER H 1.0 1.987 5.349 1411 1270 A 54 SER HA A 54 SER H 1.0 1.753 3.431 1412 1271 A 53 ALA HA A 54 SER H 1.0 1.606 2.842 1413 1272 A 91 GLU HGy A 54 SER H 1.0 1.998 5.758 1414 1273 A 91 GLU HGx A 54 SER H 1.0 1.974 5.110 1415 1274 A 53 ALA HB% A 54 SER H 1.0 1.666 3.066 1416 1275 A 89 THR HG2% A 54 SER H 1.0 1.981 6.801 1417 1276 A 52 ILE HG2% A 54 SER H 1.0 1.971 6.991 1418 1277 A 51 ILE HG2% A 54 SER H 1.0 1.991 6.567 1419 1278 A 86 PHE HA A 102 GLY H 1.0 1.844 3.926 1420 1279 A 101 VAL HA A 102 GLY H 1.0 1.741 3.383 1421 1280 A 102 GLY H A 102 GLY HAx 1.0 1.814 3.746 1422 1281 A 102 GLY H A 102 GLY HAy 1.0 1.799 3.667 1423 1282 A 86 PHE HBy A 102 GLY H 1.0 1.980 6.818 1424 1283 A 101 VAL HB A 102 GLY H 1.0 1.867 4.069 1425 1284 A 87 ALA HB% A 102 GLY H 1.0 1.994 6.466 1426 1285 A 58 LEU HD2% A 102 GLY H 1.0 1.999 6.123 1427 1286 A 56 ASN H A 56 ASN HD2x 1.0 1.783 8.849 1428 1287 A 56 ASN HBx A 56 ASN HD2x 1.0 1.822 3.794 1429 1288 A 56 ASN HBy A 56 ASN HD2x 1.0 1.894 4.268 1430 1289 A 99 VAL HG2% A 56 ASN HD2x 1.0 1.955 4.851 1431 1290 A 99 VAL HG1% A 56 ASN HD2x 1.0 1.878 4.146 1432 1291 A 56 ASN HD2y A 56 ASN HD2x 1.0 1.462 2.390 1433 1292 A 56 ASN HD2y A 56 ASN HBx 1.0 1.822 3.794 1434 1293 A 56 ASN HD2y A 56 ASN HBy 1.0 1.849 3.949 1435 1294 A 56 ASN HD2y A 99 VAL HG1% 1.0 1.983 5.263 1436 1295 A 56 ASN HD2y A 99 VAL HG2% 1.0 1.879 4.147 1437 1296 A 57 VAL H A 88 VAL H 1.0 1.760 3.468 1438 1297 A 86 PHE HDy A 88 VAL H 1.0 1.993 6.483 1439 1297 A 86 PHE HDx A 88 VAL H 1.0 1.993 6.483 1440 1298 A 100 GLY H A 88 VAL H 1.0 1.988 6.640 1441 1299 A 87 ALA HA A 88 VAL H 1.0 1.519 2.559 1442 1300 A 88 VAL HA A 88 VAL H 1.0 1.907 4.371 1443 1301 A 58 LEU HA A 88 VAL H 1.0 1.849 3.953 1444 1302 A 88 VAL HB A 88 VAL H 1.0 1.958 4.878 1445 1303 A 57 VAL HB A 88 VAL H 1.0 1.968 5.016 1446 1304 A 99 VAL HB A 88 VAL H 1.0 1.972 5.080 1447 1305 A 88 VAL HG1% A 88 VAL H 1.0 1.800 3.668 1448 1306 A 87 ALA HB% A 88 VAL H 1.0 1.657 3.029 1449 1307 A 88 VAL HG2% A 88 VAL H 1.0 1.637 2.953 1450 1308 A 48 CYS H A 49 LYS H 1.0 1.601 2.825 1451 1309 A 48 CYS HA A 48 CYS H 1.0 1.738 3.364 1452 1310 A 93 GLN HA A 48 CYS H 1.0 1.995 6.407 1453 1311 A 48 CYS H A 47 ILE HA 1.0 1.901 4.317 1454 1312 A 48 CYS HBx A 48 CYS H 1.0 1.794 3.636 1455 1313 A 48 CYS H A 48 CYS HBy 1.0 1.647 2.993 1456 1314 A 48 CYS H A 47 ILE HB 1.0 1.673 3.093 1457 1315 A 47 ILE HG2% A 48 CYS H 1.0 1.828 3.828 1458 1316 A 47 ILE HD1% A 48 CYS H 1.0 1.827 8.529 1459 1317 A 84 ASN HA A 84 ASN HD2x 1.0 1.996 6.364 1460 1318 A 103 SER HBx A 84 ASN HD2x 1.0 1.986 6.680 1461 1319 A 84 ASN HD2x A 102 GLY HAy 1.0 1.991 6.523 1462 1320 A 84 ASN HBx A 84 ASN HD2x 1.0 1.925 4.523 1463 1321 A 84 ASN HBy A 84 ASN HD2x 1.0 1.794 3.642 1464 1322 A 101 VAL HB A 84 ASN HD2x 1.0 1.973 5.099 1465 1323 A 65 LEU HD1% A 84 ASN HD2x 1.0 1.993 6.495 1466 1324 A 84 ASN HD2y A 84 ASN HD2x 1.0 1.408 2.240 1467 1325 A 84 ASN HD2y A 84 ASN HA 1.0 2.000 5.944 1468 1326 A 84 ASN HD2y A 84 ASN HBx 1.0 1.775 3.539 1469 1327 A 84 ASN HD2y A 84 ASN HBy 1.0 1.725 3.307 1470 1328 A 84 ASN HD2y A 101 VAL HB 1.0 1.951 4.787 1471 1329 A 84 ASN HD2y A 65 LEU HD1% 1.0 1.982 5.254 1472 1330 A 13 ASN HD2x A 13 ASN HBx 1.0 1.949 4.771 1473 1331 A 13 ASN HD2x A 13 ASN HBy 1.0 1.949 4.769 1474 1332 A 80 LYS H A 69 ASN HD2x 1.0 1.991 6.519 1475 1333 A 67 ASP HBx A 69 ASN HD2x 1.0 1.992 5.502 1476 1334 A 67 ASP HBy A 69 ASN HD2x 1.0 1.974 5.110 1477 1335 A 69 ASN HD2y A 69 ASN HD2x 1.0 1.505 2.515 1478 1336 A 69 ASN HA A 69 ASN HD2y 1.0 1.989 6.595 1479 1337 A 69 ASN HBx A 69 ASN HD2y 1.0 1.878 4.140 1480 1338 A 69 ASN HBy A 69 ASN HD2y 1.0 1.807 3.709 1481 1339 A 67 ASP HBx A 69 ASN HD2y 1.0 1.996 5.656 1482 1340 A 67 ASP HBy A 69 ASN HD2y 1.0 1.999 6.125 1483 1341 A 80 LYS HBy A 69 ASN HD2y 1.0 1.915 4.435 1484 1342 A 80 LYS HGx A 69 ASN HD2y 1.0 1.969 7.023 1485 1343 A 13 ASN HD2x A 13 ASN HD2y 1.0 1.517 2.553 1486 1344 A 13 ASN HBx A 13 ASN HD2y 1.0 1.924 4.520 1487 1345 A 13 ASN HBy A 13 ASN HD2y 1.0 1.938 4.650 1488 1346 A 85 LYS HA A 60 THR H 1.0 2.000 6.054 1489 1347 A 60 THR HB A 60 THR H 1.0 1.913 4.415 1490 1348 A 60 THR HA A 60 THR H 1.0 1.865 4.055 1491 1349 A 59 THR HA A 60 THR H 1.0 1.605 2.837 1492 1350 A 57 VAL HG1% A 60 THR H 1.0 1.978 6.876 1493 1351 A 47 ILE HG2% A 60 THR H 1.0 1.993 6.463 1494 1352 A 47 ILE HD1% A 60 THR H 1.0 1.899 4.305 1495 1353 A 30 CYS H A 29 HIS H 1.0 1.858 4.012 1496 1354 A 30 CYS H A 31 LYS H 1.0 1.776 3.546 1497 1355 A 30 CYS H A 28 PHE H 1.0 1.988 5.388 1498 1356 A 30 CYS H A 30 CYS HA 1.0 1.745 3.395 1499 1357 A 30 CYS H A 29 HIS HA 1.0 1.776 3.548 1500 1358 A 30 CYS H A 30 CYS HBy 1.0 1.851 3.969 1501 1359 A 30 CYS H A 29 HIS HBy 1.0 1.947 4.747 1502 1360 A 91 GLU H A 96 VAL H 1.0 1.998 5.760 1503 1361 A 96 VAL H A 95 PRO HA 1.0 1.864 4.048 1504 1362 A 96 VAL HA A 96 VAL H 1.0 1.615 2.873 1505 1363 A 97 HIS HBx A 96 VAL H 1.0 2.000 5.980 1506 1364 A 97 HIS HBy A 96 VAL H 1.0 2.000 6.030 1507 1365 A 96 VAL HB A 96 VAL H 1.0 1.938 4.658 1508 1366 A 96 VAL HG1% A 96 VAL H 1.0 1.802 3.680 1509 1367 A 96 VAL HG2% A 96 VAL H 1.0 1.761 3.473 1510 1368 A 22 ILE H A 24 SER H 1.0 1.987 5.375 1511 1369 A 24 SER H A 21 ASN HA 1.0 1.962 4.936 1512 1370 A 25 THR HB A 24 SER H 1.0 1.994 5.568 1513 1371 A 24 SER HA A 24 SER H 1.0 1.839 3.893 1514 1372 A 24 SER H A 23 MET HBx 1.0 1.990 6.600 1515 1373 A 22 ILE HG2% A 24 SER H 1.0 2.000 6.136 1516 1374 A 3 TRP HD1 A 7 GLN HE2y 1.0 1.970 5.062 1517 1375 A 7 GLN HE2x A 7 GLN HE2y 1.0 1.544 2.638 1518 1376 A 11 ILE H A 10 HIS H 1.0 1.603 2.835 1519 1377 A 10 HIS H A 8 LYS H 1.0 1.964 4.970 1520 1378 A 10 HIS H A 11 ILE HA 1.0 2.000 6.106 1521 1379 A 10 HIS H A 10 HIS HA 1.0 1.732 3.338 1522 1380 A 10 HIS H A 6 PHE HA 1.0 1.902 4.330 1523 1381 A 10 HIS H A 9 LYS HA 1.0 1.843 3.921 1524 1382 A 10 HIS H A 8 LYS HA 1.0 1.999 6.139 1525 1383 A 10 HIS H A 7 GLN HA 1.0 1.849 3.953 1526 1384 A 10 HIS H A 10 HIS HBx 1.0 1.818 3.766 1527 1385 A 10 HIS H A 11 ILE HB 1.0 1.993 5.511 1528 1386 A 10 HIS HBy A 10 HIS H 1.0 1.680 3.120 1529 1387 A 92 ASN H A 93 GLN H 1.0 1.879 4.155 1530 1388 A 53 ALA H A 93 GLN H 1.0 1.997 6.315 1531 1389 A 93 GLN H A 94 ALA H 1.0 1.780 3.566 1532 1390 A 92 ASN HA A 93 GLN H 1.0 1.754 3.440 1533 1391 A 91 GLU HA A 93 GLN H 1.0 1.942 4.688 1534 1392 A 93 GLN HA A 93 GLN H 1.0 1.616 2.876 1535 1393 A 52 ILE HA A 93 GLN H 1.0 1.776 3.544 1536 1394 A 92 ASN HBx A 93 GLN H 1.0 1.996 5.652 1537 1395 A 48 CYS HBx A 93 GLN H 1.0 1.999 5.835 1538 1396 A 92 ASN HBy A 93 GLN H 1.0 1.992 6.536 1539 1397 A 90 CYS HBy A 93 GLN H 1.0 1.785 8.843 1540 1398 A 93 GLN H A 93 GLN HGx 1.0 1.924 4.514 1541 1399 A 93 GLN HGy A 93 GLN H 1.0 1.741 3.377 1542 1400 A 51 ILE HB A 93 GLN H 1.0 1.994 5.546 1543 1401 A 94 ALA HB% A 93 GLN H 1.0 1.974 5.116 1544 1402 A 51 ILE HG2% A 93 GLN H 1.0 1.929 4.565 1545 1403 A 100 GLY H A 87 ALA HA 1.0 1.867 8.199 1546 1404 A 100 GLY H A 98 PHE HA 1.0 1.969 5.039 1547 1405 A 100 GLY H A 100 GLY HAx 1.0 1.842 3.910 1548 1406 A 100 GLY H A 100 GLY HAy 1.0 1.901 4.317 1549 1407 A 86 PHE HBx A 100 GLY H 1.0 1.987 6.661 1550 1408 A 100 GLY H A 99 VAL HB 1.0 1.808 3.714 1551 1409 A 100 GLY H A 87 ALA HB% 1.0 1.902 4.328 1552 1410 A 99 VAL HG2% A 100 GLY H 1.0 1.936 4.636 1553 1411 A 3 TRP HZ3 A 3 TRP HE1 1.0 1.997 6.313 1554 1411 A 3 TRP HE1 A 3 TRP HH2 1.0 1.997 6.313 1555 1412 A 29 HIS H A 28 PHE HBx 1.0 1.795 3.645 1556 1412 A 29 HIS H A 28 PHE HBy 1.0 1.795 3.645 1557 1413 A 59 THR H A 85 LYS HA 1.0 1.884 4.188 1558 1413 A 96 VAL HA A 6 PHE H 1.0 1.884 4.188 1559 1413 A 7 GLN HE2x A 6 PHE H 1.0 1.884 4.188 1560 1414 A 59 THR H A 59 THR HB 1.0 1.801 3.673 1561 1414 A 6 PHE HA A 6 PHE H 1.0 1.801 3.673 1562 1415 A 32 ASP HA A 32 ASP H 1.0 1.704 3.218 1563 1415 A 23 MET HA A 23 MET H 1.0 1.704 3.218 1564 1416 A 15 ARG HE A 15 ARG HDx 1.0 1.812 3.736 1565 1416 A 15 ARG HE A 15 ARG HDy 1.0 1.812 3.736 1566 1417 A 72 SER H A 71 THR HA 1.0 1.925 4.529 1567 1417 A 71 THR H A 71 THR HA 1.0 1.925 4.529 1568 1418 A 7 GLN H A 7 GLN HGx 1.0 1.922 4.492 1569 1418 A 7 GLN H A 7 GLN HGy 1.0 1.922 4.492 1570 1419 A 71 THR H A 76 LYS HBx 1.0 1.901 4.321 1571 1419 A 71 THR H A 76 LYS HBy 1.0 1.901 4.321 1572 1420 A 73 ARG HBx A 73 ARG H 1.0 1.689 3.155 1573 1420 A 53 ALA H A 55 LYS HDx 1.0 1.689 3.155 1574 1421 A 73 ARG H A 73 ARG HGx 1.0 1.739 3.369 1575 1421 A 73 ARG H A 73 ARG HGy 1.0 1.739 3.369 1576 1422 A 29 HIS HD2 A 31 LYS HBx 1.0 1.997 6.333 1577 1422 A 29 HIS HD2 A 31 LYS HBy 1.0 1.997 6.333 1578 1423 A 46 ALA H A 44 VAL HG2% 1.0 1.933 4.603 1579 1423 A 44 VAL HG2% A 39 SER H 1.0 1.933 4.603 1580 1424 A 63 PHE HEx A 63 PHE HA 1.0 1.817 3.765 1581 1424 A 63 PHE HEy A 63 PHE HA 1.0 1.817 3.765 1582 1424 A 63 PHE HDy A 63 PHE HA 1.0 1.817 3.765 1583 1424 A 63 PHE HDx A 63 PHE HA 1.0 1.817 3.765 1584 1425 A 63 PHE HEx A 39 SER HBy 1.0 1.836 3.874 1585 1425 A 63 PHE HDy A 39 SER HBy 1.0 1.836 3.874 1586 1425 A 63 PHE HDx A 39 SER HBy 1.0 1.836 3.874 1587 1425 A 63 PHE HEy A 39 SER HBy 1.0 1.836 3.874 1588 1426 A 63 PHE HEx A 59 THR HG2% 1.0 1.694 3.178 1589 1426 A 63 PHE HEy A 59 THR HG2% 1.0 1.694 3.178 1590 1426 A 63 PHE HDx A 59 THR HG2% 1.0 1.694 3.178 1591 1426 A 63 PHE HDy A 59 THR HG2% 1.0 1.694 3.178 1592 1427 A 46 ALA HB% A 47 ILE H 1.0 1.776 3.548 1593 1427 A 8 LYS HZ% A 8 LYS HGx 1.0 1.776 3.548 1594 1428 A 64 TYR HDy A 64 TYR HEy 1.0 1.429 2.297 1595 1428 A 64 TYR HDx A 38 TYR HDx 1.0 1.429 2.297 1596 1428 A 64 TYR HDx A 38 TYR HDy 1.0 1.429 2.297 1597 1428 A 64 TYR HDy A 64 TYR HEx 1.0 1.429 2.297 1598 1428 A 64 TYR HDy A 38 TYR HDx 1.0 1.429 2.297 1599 1428 A 64 TYR HDx A 64 TYR HEy 1.0 1.429 2.297 1600 1428 A 64 TYR HDy A 38 TYR HDy 1.0 1.429 2.297 1601 1428 A 64 TYR HDx A 64 TYR HEx 1.0 1.429 2.297 1602 1429 A 3 TRP HZ2 A 44 VAL HB 1.0 1.941 4.685 1603 1429 A 3 TRP HE3 A 44 VAL HB 1.0 1.941 4.685 1604 1430 A 3 TRP HZ2 A 41 PRO HBx 1.0 1.798 3.658 1605 1430 A 3 TRP HZ2 A 41 PRO HBy 1.0 1.798 3.658 1606 1431 A 3 TRP HE3 A 95 PRO HBx 1.0 1.934 4.608 1607 1431 A 3 TRP HE3 A 95 PRO HBy 1.0 1.934 4.608 1608 1432 A 3 TRP HZ2 A 45 LYS HBx 1.0 1.804 3.692 1609 1432 A 3 TRP HZ2 A 45 LYS HBy 1.0 1.804 3.692 1610 1432 A 3 TRP HE3 A 45 LYS HBx 1.0 1.804 3.692 1611 1433 A 3 TRP HE3 A 45 LYS HGy 1.0 1.803 3.685 1612 1433 A 3 TRP HE3 A 45 LYS HGx 1.0 1.803 3.685 1613 1433 A 3 TRP HE3 A 44 VAL HG1% 1.0 1.803 3.685 1614 1434 A 3 TRP HD1 A 4 LEU HD2% 1.0 1.905 4.357 1615 1434 A 3 TRP HD1 A 94 ALA HB% 1.0 1.905 4.357 1616 1434 A 3 TRP HD1 A 4 LEU HD1% 1.0 1.905 4.357 1617 1435 A 77 TYR HDx A 77 TYR HA 1.0 1.748 3.410 1618 1435 A 77 TYR HDy A 20 ASP HA 1.0 1.748 3.410 1619 1435 A 77 TYR HDx A 20 ASP HA 1.0 1.748 3.410 1620 1435 A 77 TYR HDy A 77 TYR HA 1.0 1.748 3.410 1621 1436 A 3 TRP HE3 A 3 TRP HZ3 1.0 1.585 2.771 1622 1436 A 3 TRP HZ2 A 3 TRP HH2 1.0 1.585 2.771 1623 1437 A 3 TRP HZ3 A 44 VAL H 1.0 1.911 4.407 1624 1437 A 44 VAL H A 3 TRP HH2 1.0 1.911 4.407 1625 1438 A 7 GLN HE2x A 3 TRP HZ3 1.0 1.888 4.218 1626 1438 A 7 GLN HE2x A 3 TRP HH2 1.0 1.888 4.218 1627 1439 A 3 TRP HH2 A 41 PRO HBx 1.0 1.867 4.069 1628 1439 A 3 TRP HH2 A 41 PRO HBy 1.0 1.867 4.069 1629 1440 A 3 TRP HH2 A 41 PRO HGx 1.0 1.829 3.835 1630 1440 A 41 PRO HGy A 3 TRP HH2 1.0 1.829 3.835 1631 1441 A 3 TRP HZ3 A 45 LYS HBx 1.0 1.788 3.610 1632 1441 A 3 TRP HH2 A 45 LYS HBx 1.0 1.788 3.610 1633 1441 A 45 LYS HBy A 3 TRP HH2 1.0 1.788 3.610 1634 1442 A 78 LYS HEx A 78 LYS HZ% 1.0 1.754 3.440 1635 1442 A 31 LYS HZ% A 31 LYS HEy 1.0 1.754 3.440 1636 1442 A 31 LYS HZ% A 31 LYS HEx 1.0 1.754 3.440 1637 1442 A 78 LYS HEy A 78 LYS HZ% 1.0 1.754 3.440 1638 1443 A 69 ASN HBy A 69 ASN HD2x 1.0 1.897 4.289 1639 1443 A 31 LYS HZ% A 32 ASP HBx 1.0 1.897 4.289 1640 1444 A 31 LYS HZ% A 31 LYS HDx 1.0 1.632 2.936 1641 1444 A 48 CYS H A 47 ILE HB 1.0 1.632 2.936 1642 1444 A 31 LYS HZ% A 31 LYS HDy 1.0 1.632 2.936 1643 1445 A 6 PHE HEx A 6 PHE H 1.0 1.982 5.262 1644 1445 A 6 PHE HEy A 6 PHE H 1.0 1.982 5.262 1645 1445 A 6 PHE HEy A 5 THR H 1.0 1.982 5.262 1646 1445 A 6 PHE HEx A 5 THR H 1.0 1.982 5.262 1647 1446 A 33 LYS HZ% A 33 LYS HDx 1.0 1.869 4.083 1648 1446 A 76 LYS HBx A 73 ARG HE 1.0 1.869 4.083 1649 1446 A 33 LYS HDy A 33 LYS HZ% 1.0 1.869 4.083 1650 1447 A 33 LYS HZ% A 33 LYS HBy 1.0 1.816 3.756 1651 1447 A 33 LYS HZ% A 33 LYS HBx 1.0 1.816 3.756 1652 1448 A 28 PHE HDy A 28 PHE HBx 1.0 1.590 2.788 1653 1448 A 28 PHE HDx A 28 PHE HBx 1.0 1.590 2.788 1654 1448 A 28 PHE HDy A 28 PHE HBy 1.0 1.590 2.788 1655 1448 A 28 PHE HDx A 28 PHE HBy 1.0 1.590 2.788 1656 1449 A 28 PHE HDx A 34 ASN HBy 1.0 1.753 3.437 1657 1449 A 28 PHE HDy A 34 ASN HBy 1.0 1.753 3.437 1658 1449 A 28 PHE HDy A 27 LEU HBx 1.0 1.753 3.437 1659 1449 A 28 PHE HDx A 27 LEU HBx 1.0 1.753 3.437 1660 1450 A 28 PHE HEx A 31 LYS HGy 1.0 2.000 5.924 1661 1450 A 28 PHE HEy A 31 LYS HGy 1.0 2.000 5.924 1662 1450 A 31 LYS HGx A 28 PHE HEy 1.0 2.000 5.924 1663 1450 A 31 LYS HGx A 28 PHE HEx 1.0 2.000 5.924 1664 1451 A 36 PHE HDx A 36 PHE HA 1.0 1.790 3.616 1665 1451 A 36 PHE HDy A 36 PHE HA 1.0 1.790 3.616 1666 1451 A 36 PHE HDy A 35 THR HA 1.0 1.790 3.616 1667 1451 A 36 PHE HDx A 35 THR HA 1.0 1.790 3.616 1668 1452 A 28 PHE HEx A 28 PHE HBx 1.0 1.725 3.307 1669 1452 A 28 PHE HEx A 19 CYS HBx 1.0 1.725 3.307 1670 1452 A 28 PHE HEx A 28 PHE HBy 1.0 1.725 3.307 1671 1452 A 28 PHE HEx A 19 CYS HBy 1.0 1.725 3.307 1672 1452 A 28 PHE HEy A 19 CYS HBy 1.0 1.725 3.307 1673 1452 A 28 PHE HEy A 28 PHE HBx 1.0 1.725 3.307 1674 1452 A 28 PHE HEy A 28 PHE HBy 1.0 1.725 3.307 1675 1452 A 28 PHE HEy A 19 CYS HBx 1.0 1.725 3.307 1676 1453 A 86 PHE HDy A 88 VAL HA 1.0 1.774 3.534 1677 1453 A 86 PHE HDx A 88 VAL HA 1.0 1.774 3.534 1678 1453 A 86 PHE HA A 86 PHE HDy 1.0 1.774 3.534 1679 1453 A 86 PHE HA A 86 PHE HDx 1.0 1.774 3.534 1680 1454 A 86 PHE HDy A 65 LEU HG 1.0 1.782 3.578 1681 1454 A 86 PHE HDx A 65 LEU HG 1.0 1.782 3.578 1682 1454 A 86 PHE HDy A 37 ILE HG1x 1.0 1.782 3.578 1683 1454 A 86 PHE HDx A 37 ILE HG1x 1.0 1.782 3.578 1684 1455 A 86 PHE HEy A 88 VAL HA 1.0 1.969 5.043 1685 1455 A 86 PHE HEx A 88 VAL HA 1.0 1.969 5.043 1686 1455 A 86 PHE HA A 86 PHE HEy 1.0 1.969 5.043 1687 1455 A 86 PHE HA A 86 PHE HEx 1.0 1.969 5.043 1688 1456 A 63 PHE HEy A 86 PHE HZ 1.0 1.932 4.590 1689 1456 A 86 PHE HZ A 63 PHE HZ 1.0 1.932 4.590 1690 1456 A 63 PHE HEx A 86 PHE HZ 1.0 1.932 4.590 1691 1456 A 63 PHE HDy A 86 PHE HZ 1.0 1.932 4.590 1692 1456 A 63 PHE HDx A 86 PHE HZ 1.0 1.932 4.590 1693 1457 A 44 VAL HG1% A 86 PHE HZ 1.0 1.681 3.123 1694 1457 A 86 PHE HZ A 37 ILE HG1x 1.0 1.681 3.123 1695 1458 A 86 PHE HZ A 59 THR HG2% 1.0 1.815 3.753 1696 1458 A 86 PHE HZ A 44 VAL HG2% 1.0 1.815 3.753 1697 1459 A 6 PHE HZ A 95 PRO HGx 1.0 1.907 4.365 1698 1459 A 6 PHE HZ A 95 PRO HGy 1.0 1.907 4.365 1699 1460 A 99 VAL HG1% A 87 ALA HA 1.0 1.885 4.193 1700 1460 A 87 ALA HA A 57 VAL HG1% 1.0 1.885 4.193 1701 1461 A 33 LYS HA A 32 ASP HBx 1.0 1.898 4.294 1702 1461 A 33 LYS HA A 32 ASP HBy 1.0 1.898 4.294 1703 1462 A 33 LYS HA A 33 LYS HBx 1.0 1.646 2.988 1704 1462 A 33 LYS HA A 33 LYS HBy 1.0 1.646 2.988 1705 1463 A 33 LYS HA A 33 LYS HDx 1.0 1.865 4.057 1706 1463 A 33 LYS HA A 33 LYS HDy 1.0 1.865 4.057 1707 1464 A 33 LYS HA A 33 LYS HGx 1.0 1.809 3.721 1708 1464 A 33 LYS HA A 33 LYS HGy 1.0 1.809 3.721 1709 1464 A 31 LYS HGx A 33 LYS HA 1.0 1.809 3.721 1710 1465 A 69 ASN HA A 33 LYS HBx 1.0 1.845 3.927 1711 1465 A 69 ASN HA A 33 LYS HBy 1.0 1.845 3.927 1712 1466 A 69 ASN HA A 33 LYS HGx 1.0 1.876 4.130 1713 1466 A 69 ASN HA A 33 LYS HGy 1.0 1.876 4.130 1714 1467 A 3 TRP HA A 6 PHE HBy 1.0 1.637 2.957 1715 1467 A 97 HIS HA A 97 HIS HBx 1.0 1.637 2.957 1716 1468 A 83 THR HA A 65 LEU HBx 1.0 1.887 4.209 1717 1468 A 83 THR HA A 65 LEU HBy 1.0 1.887 4.209 1718 1469 A 65 LEU HA A 65 LEU HBx 1.0 1.757 3.451 1719 1469 A 65 LEU HA A 65 LEU HBy 1.0 1.757 3.451 1720 1470 A 81 LYS HA A 81 LYS HBx 1.0 1.704 3.222 1721 1470 A 81 LYS HA A 81 LYS HBy 1.0 1.704 3.222 1722 1471 A 96 VAL HA A 95 PRO HA 1.0 1.880 4.162 1723 1471 A 90 CYS HA A 96 VAL HA 1.0 1.880 4.162 1724 1472 A 101 VAL HA A 85 LYS HBx 1.0 1.968 5.014 1725 1472 A 101 VAL HA A 85 LYS HBy 1.0 1.968 5.014 1726 1472 A 40 ARG HBx A 43 PRO HA 1.0 1.968 5.014 1727 1473 A 103 SER HA A 104 ALA H 1.0 1.916 4.450 1728 1473 A 103 SER HA A 103 SER H 1.0 1.916 4.450 1729 1474 A 55 LYS HA A 55 LYS HBx 1.0 1.781 3.571 1730 1474 A 55 LYS HA A 55 LYS HBy 1.0 1.781 3.571 1731 1475 A 55 LYS HA A 55 LYS HDx 1.0 1.785 3.595 1732 1475 A 55 LYS HA A 55 LYS HDy 1.0 1.785 3.595 1733 1476 A 53 ALA HA A 91 GLU HBy 1.0 1.993 5.535 1734 1476 A 53 ALA HA A 52 ILE HB 1.0 1.993 5.535 1735 1476 A 53 ALA HA A 91 GLU HBx 1.0 1.993 5.535 1736 1477 A 32 ASP HA A 32 ASP HBx 1.0 1.612 2.866 1737 1477 A 32 ASP HA A 32 ASP HBy 1.0 1.612 2.866 1738 1478 A 61 SER HA A 59 THR HB 1.0 1.933 4.603 1739 1478 A 58 LEU HA A 59 THR HB 1.0 1.933 4.603 1740 1478 A 24 SER HA A 25 THR HA 1.0 1.933 4.603 1741 1479 A 42 GLU HA A 42 GLU HGx 1.0 1.707 3.231 1742 1479 A 42 GLU HA A 42 GLU HGy 1.0 1.707 3.231 1743 1480 A 42 GLU HA A 42 GLU HBx 1.0 1.678 3.112 1744 1480 A 42 GLU HA A 42 GLU HBy 1.0 1.678 3.112 1745 1481 A 59 THR HB A 85 LYS HDx 1.0 1.658 3.034 1746 1481 A 42 GLU HA A 45 LYS HBx 1.0 1.658 3.034 1747 1481 A 42 GLU HA A 45 LYS HBy 1.0 1.658 3.034 1748 1482 A 25 THR HG2% A 24 SER HA 1.0 1.856 4.002 1749 1482 A 75 CYS HA A 76 LYS HDx 1.0 1.856 4.002 1750 1482 A 75 CYS HA A 76 LYS HDy 1.0 1.856 4.002 1751 1483 A 91 GLU HA A 91 GLU HBx 1.0 1.602 2.830 1752 1483 A 91 GLU HA A 91 GLU HBy 1.0 1.602 2.830 1753 1484 A 9 LYS HA A 9 LYS HGx 1.0 1.701 3.203 1754 1484 A 9 LYS HA A 9 LYS HGy 1.0 1.701 3.203 1755 1485 A 1 PCA HA A 96 VAL HG2% 1.0 1.698 3.192 1756 1485 A 93 GLN HA A 51 ILE HG2% 1.0 1.698 3.192 1757 1486 A 90 CYS HBx A 93 GLN HA 1.0 1.672 3.088 1758 1486 A 1 PCA HA A 1 PCA HGx 1.0 1.672 3.088 1759 1487 A 93 GLN HA A 90 CYS HBy 1.0 1.731 3.335 1760 1487 A 1 PCA HA A 1 PCA HGy 1.0 1.731 3.335 1761 1488 A 43 PRO HDx A 43 PRO HBx 1.0 1.831 3.845 1762 1488 A 43 PRO HDx A 43 PRO HBy 1.0 1.831 3.845 1763 1489 A 41 PRO HA A 41 PRO HBx 1.0 1.636 2.952 1764 1489 A 41 PRO HA A 41 PRO HBy 1.0 1.636 2.952 1765 1490 A 43 PRO HDx A 43 PRO HGx 1.0 1.609 2.853 1766 1490 A 43 PRO HDx A 43 PRO HGy 1.0 1.609 2.853 1767 1491 A 74 PRO HA A 74 PRO HBx 1.0 1.665 3.059 1768 1491 A 74 PRO HA A 74 PRO HBy 1.0 1.665 3.059 1769 1492 A 65 LEU HBx A 82 SER HBx 1.0 1.809 3.719 1770 1492 A 65 LEU HBy A 82 SER HBx 1.0 1.809 3.719 1771 1492 A 65 LEU HBx A 82 SER HBy 1.0 1.809 3.719 1772 1492 A 65 LEU HBy A 82 SER HBy 1.0 1.809 3.719 1773 1493 A 43 PRO HDy A 43 PRO HBx 1.0 1.854 3.984 1774 1493 A 43 PRO HDy A 43 PRO HBy 1.0 1.854 3.984 1775 1494 A 44 VAL HA A 11 ILE HG2% 1.0 1.988 5.386 1776 1494 A 12 THR HG2% A 14 THR HB 1.0 1.988 5.386 1777 1494 A 41 PRO HDx A 11 ILE HG2% 1.0 1.988 5.386 1778 1495 A 65 LEU HD1% A 82 SER HBy 1.0 1.858 4.010 1779 1495 A 83 THR HG2% A 82 SER HBx 1.0 1.858 4.010 1780 1495 A 99 VAL HA A 87 ALA HB% 1.0 1.858 4.010 1781 1495 A 65 LEU HD1% A 82 SER HBx 1.0 1.858 4.010 1782 1496 A 67 ASP H A 82 SER HBx 1.0 1.960 4.914 1783 1496 A 67 ASP H A 82 SER HBy 1.0 1.960 4.914 1784 1497 A 74 PRO HDx A 74 PRO HBy 1.0 1.862 4.036 1785 1497 A 49 LYS HA A 93 GLN HGx 1.0 1.862 4.036 1786 1497 A 74 PRO HDx A 74 PRO HBx 1.0 1.862 4.036 1787 1498 A 49 LYS HA A 49 LYS HBx 1.0 1.424 2.282 1788 1498 A 49 LYS HA A 49 LYS HBy 1.0 1.424 2.282 1789 1499 A 74 PRO HDx A 73 ARG HBx 1.0 1.740 3.372 1790 1499 A 49 LYS HA A 49 LYS HDx 1.0 1.740 3.372 1791 1499 A 49 LYS HA A 49 LYS HDy 1.0 1.740 3.372 1792 1499 A 5 THR HA A 4 LEU HG 1.0 1.740 3.372 1793 1500 A 74 PRO HDx A 74 PRO HGx 1.0 1.709 3.241 1794 1500 A 74 PRO HDx A 74 PRO HGy 1.0 1.709 3.241 1795 1501 A 38 TYR HDx A 15 ARG HDx 1.0 1.858 4.010 1796 1501 A 38 TYR HDy A 15 ARG HDx 1.0 1.858 4.010 1797 1501 A 38 TYR HDy A 15 ARG HDy 1.0 1.858 4.010 1798 1501 A 38 TYR HDx A 15 ARG HDy 1.0 1.858 4.010 1799 1502 A 64 TYR HDx A 15 ARG HDx 1.0 1.890 4.234 1800 1502 A 64 TYR HDy A 15 ARG HDy 1.0 1.890 4.234 1801 1502 A 64 TYR HDx A 15 ARG HDy 1.0 1.890 4.234 1802 1502 A 64 TYR HDy A 15 ARG HDx 1.0 1.890 4.234 1803 1503 A 70 VAL HA A 69 ASN HBy 1.0 1.965 4.979 1804 1503 A 70 VAL HA A 68 CYS HBx 1.0 1.965 4.979 1805 1504 A 7 GLN HA A 7 GLN HBx 1.0 1.599 2.821 1806 1504 A 7 GLN HA A 7 GLN HBy 1.0 1.599 2.821 1807 1505 A 7 GLN HA A 11 ILE HG1y 1.0 1.726 3.312 1808 1505 A 15 ARG HDy A 15 ARG HBy 1.0 1.726 3.312 1809 1505 A 15 ARG HA A 15 ARG HBx 1.0 1.726 3.312 1810 1505 A 15 ARG HA A 15 ARG HBy 1.0 1.726 3.312 1811 1505 A 15 ARG HDy A 15 ARG HBx 1.0 1.726 3.312 1812 1506 A 74 PRO HDy A 74 PRO HBx 1.0 1.753 3.437 1813 1506 A 74 PRO HDy A 74 PRO HBy 1.0 1.753 3.437 1814 1507 A 15 ARG HGy A 15 ARG HDy 1.0 1.792 3.630 1815 1507 A 7 GLN HA A 11 ILE HG1x 1.0 1.792 3.630 1816 1507 A 15 ARG HGy A 15 ARG HDx 1.0 1.792 3.630 1817 1508 A 40 ARG HBx A 40 ARG HDx 1.0 1.728 3.322 1818 1508 A 40 ARG HDx A 40 ARG HBy 1.0 1.728 3.322 1819 1509 A 63 PHE HA A 63 PHE HBx 1.0 1.728 3.324 1820 1509 A 30 CYS HBx A 30 CYS HA 1.0 1.728 3.324 1821 1510 A 40 ARG HDy A 40 ARG HA 1.0 1.999 5.803 1822 1510 A 3 TRP HBx A 2 ASP HA 1.0 1.999 5.803 1823 1511 A 40 ARG HDy A 40 ARG HBx 1.0 1.775 3.541 1824 1511 A 40 ARG HDy A 40 ARG HBy 1.0 1.775 3.541 1825 1512 A 29 HIS HE1 A 29 HIS HBx 1.0 1.877 4.143 1826 1512 A 29 HIS HBx A 26 ASN HD2x 1.0 1.877 4.143 1827 1513 A 73 ARG HBx A 73 ARG HDx 1.0 1.639 2.959 1828 1513 A 73 ARG HBx A 73 ARG HDy 1.0 1.639 2.959 1829 1514 A 73 ARG HGy A 73 ARG HDx 1.0 1.664 3.058 1830 1514 A 73 ARG HGx A 73 ARG HDy 1.0 1.664 3.058 1831 1514 A 73 ARG HGy A 73 ARG HDy 1.0 1.664 3.058 1832 1515 A 2 ASP HA A 2 ASP HBx 1.0 1.603 2.833 1833 1515 A 2 ASP HA A 2 ASP HBy 1.0 1.603 2.833 1834 1516 A 17 VAL HA A 18 ASP HA 1.0 1.862 4.038 1835 1516 A 17 VAL HA A 16 ASP HA 1.0 1.862 4.038 1836 1517 A 98 PHE HDy A 86 PHE HBy 1.0 1.825 3.809 1837 1517 A 98 PHE HDx A 86 PHE HBy 1.0 1.825 3.809 1838 1517 A 64 TYR HBy A 38 TYR HEy 1.0 1.825 3.809 1839 1517 A 64 TYR HBy A 38 TYR HEx 1.0 1.825 3.809 1840 1518 A 30 CYS H A 28 PHE HBx 1.0 1.920 4.486 1841 1518 A 30 CYS H A 28 PHE HBy 1.0 1.920 4.486 1842 1519 A 25 THR HB A 28 PHE HBx 1.0 1.878 4.144 1843 1519 A 25 THR HB A 28 PHE HBy 1.0 1.878 4.144 1844 1519 A 35 THR HA A 19 CYS HBx 1.0 1.878 4.144 1845 1519 A 35 THR HA A 19 CYS HBy 1.0 1.878 4.144 1846 1520 A 31 LYS HEx A 31 LYS HDx 1.0 1.479 2.439 1847 1520 A 31 LYS HEx A 31 LYS HDy 1.0 1.479 2.439 1848 1520 A 31 LYS HEy A 31 LYS HDy 1.0 1.479 2.439 1849 1520 A 31 LYS HEy A 31 LYS HDx 1.0 1.479 2.439 1850 1521 A 27 LEU HD1% A 28 PHE HBx 1.0 1.850 3.962 1851 1521 A 17 VAL HG1% A 19 CYS HBy 1.0 1.850 3.962 1852 1521 A 17 VAL HG1% A 19 CYS HBx 1.0 1.850 3.962 1853 1522 A 17 VAL HG2% A 19 CYS HBy 1.0 1.993 5.553 1854 1522 A 17 VAL HG2% A 19 CYS HBx 1.0 1.993 5.553 1855 1523 A 33 LYS HDx A 33 LYS HEx 1.0 1.503 2.509 1856 1523 A 33 LYS HDx A 33 LYS HEy 1.0 1.503 2.509 1857 1523 A 33 LYS HDy A 33 LYS HEx 1.0 1.503 2.509 1858 1523 A 33 LYS HDy A 33 LYS HEy 1.0 1.503 2.509 1859 1524 A 33 LYS HGx A 33 LYS HEy 1.0 1.476 2.430 1860 1524 A 33 LYS HGx A 33 LYS HEx 1.0 1.476 2.430 1861 1524 A 33 LYS HGy A 33 LYS HEx 1.0 1.476 2.430 1862 1524 A 33 LYS HGy A 33 LYS HEy 1.0 1.476 2.430 1863 1525 A 81 LYS HEx A 81 LYS HDx 1.0 1.443 2.335 1864 1525 A 81 LYS HEy A 81 LYS HDx 1.0 1.443 2.335 1865 1525 A 8 LYS HEy A 8 LYS HDy 1.0 1.443 2.335 1866 1525 A 8 LYS HEy A 8 LYS HDx 1.0 1.443 2.335 1867 1525 A 8 LYS HEx A 8 LYS HDx 1.0 1.443 2.335 1868 1525 A 8 LYS HEx A 8 LYS HDy 1.0 1.443 2.335 1869 1526 A 8 LYS HEx A 9 LYS HGy 1.0 1.935 4.623 1870 1526 A 8 LYS HEy A 9 LYS HGx 1.0 1.935 4.623 1871 1526 A 8 LYS HEy A 9 LYS HGy 1.0 1.935 4.623 1872 1526 A 45 LYS HA A 94 ALA HB% 1.0 1.935 4.623 1873 1526 A 8 LYS HEx A 9 LYS HGx 1.0 1.935 4.623 1874 1527 A 17 VAL HG1% A 81 LYS HEy 1.0 1.901 4.321 1875 1527 A 27 LEU HD1% A 26 ASN HBy 1.0 1.901 4.321 1876 1527 A 17 VAL HG1% A 81 LYS HEx 1.0 1.901 4.321 1877 1528 A 99 VAL HG1% A 56 ASN HBx 1.0 1.799 3.669 1878 1528 A 70 VAL HG2% A 32 ASP HBy 1.0 1.799 3.669 1879 1529 A 78 LYS H A 77 TYR HBy 1.0 1.758 3.458 1880 1529 A 20 ASP HBy A 20 ASP H 1.0 1.758 3.458 1881 1530 A 22 ILE H A 23 MET HGx 1.0 1.667 3.069 1882 1530 A 10 HIS HBx A 10 HIS HD2 1.0 1.667 3.069 1883 1531 A 20 ASP HBy A 21 ASN H 1.0 1.668 3.074 1884 1531 A 6 PHE HEy A 10 HIS HBx 1.0 1.668 3.074 1885 1531 A 6 PHE HEx A 10 HIS HBx 1.0 1.668 3.074 1886 1531 A 6 PHE HEy A 44 VAL HB 1.0 1.668 3.074 1887 1531 A 6 PHE HEx A 44 VAL HB 1.0 1.668 3.074 1888 1532 A 44 VAL HB A 44 VAL H 1.0 1.661 3.047 1889 1532 A 38 TYR HDy A 38 TYR HBy 1.0 1.661 3.047 1890 1532 A 38 TYR HDx A 38 TYR HBy 1.0 1.661 3.047 1891 1533 A 21 ASN HA A 21 ASN HBx 1.0 1.670 3.082 1892 1533 A 21 ASN HA A 21 ASN HBy 1.0 1.670 3.082 1893 1534 A 78 LYS HA A 20 ASP HBy 1.0 1.834 3.862 1894 1534 A 18 ASP HA A 20 ASP HBy 1.0 1.834 3.862 1895 1535 A 44 VAL HB A 95 PRO HGx 1.0 1.728 3.320 1896 1535 A 44 VAL HB A 95 PRO HGy 1.0 1.728 3.320 1897 1536 A 44 VAL H A 43 PRO HBy 1.0 1.712 3.252 1898 1536 A 36 PHE HDy A 36 PHE HBy 1.0 1.712 3.252 1899 1536 A 36 PHE HDx A 36 PHE HBy 1.0 1.712 3.252 1900 1537 A 43 PRO HA A 43 PRO HBx 1.0 1.575 2.737 1901 1537 A 43 PRO HA A 43 PRO HBy 1.0 1.575 2.737 1902 1538 A 43 PRO HBy A 43 PRO HGy 1.0 1.703 3.215 1903 1538 A 43 PRO HBy A 43 PRO HGx 1.0 1.703 3.215 1904 1538 A 43 PRO HBx A 43 PRO HGx 1.0 1.703 3.215 1905 1538 A 43 PRO HBx A 43 PRO HGy 1.0 1.703 3.215 1906 1539 A 41 PRO HA A 41 PRO HGx 1.0 1.705 3.221 1907 1539 A 43 PRO HDx A 41 PRO HGy 1.0 1.705 3.221 1908 1539 A 41 PRO HA A 41 PRO HGy 1.0 1.705 3.221 1909 1540 A 41 PRO HBx A 41 PRO HGx 1.0 1.379 2.163 1910 1540 A 41 PRO HBy A 41 PRO HGx 1.0 1.379 2.163 1911 1540 A 41 PRO HGy A 41 PRO HBy 1.0 1.379 2.163 1912 1541 A 31 LYS HA A 31 LYS HBx 1.0 1.653 3.013 1913 1541 A 31 LYS HA A 31 LYS HBy 1.0 1.653 3.013 1914 1542 A 7 GLN HA A 7 GLN HGy 1.0 1.727 3.317 1915 1542 A 74 PRO HDy A 74 PRO HBx 1.0 1.727 3.317 1916 1542 A 7 GLN HA A 7 GLN HGx 1.0 1.727 3.317 1917 1543 A 48 CYS HBx A 93 GLN HGx 1.0 1.581 2.757 1918 1543 A 28 PHE HBy A 31 LYS HBx 1.0 1.581 2.757 1919 1543 A 28 PHE HBy A 31 LYS HBy 1.0 1.581 2.757 1920 1543 A 28 PHE HBx A 31 LYS HBx 1.0 1.581 2.757 1921 1544 A 5 THR HA A 7 GLN HGx 1.0 1.930 4.578 1922 1544 A 5 THR HA A 7 GLN HGy 1.0 1.930 4.578 1923 1545 A 93 GLN HGx A 93 GLN HBx 1.0 1.631 2.931 1924 1545 A 93 GLN HGx A 93 GLN HBy 1.0 1.631 2.931 1925 1546 A 40 ARG HE A 43 PRO HGy 1.0 1.990 6.596 1926 1546 A 40 ARG HE A 43 PRO HGx 1.0 1.990 6.596 1927 1547 A 43 PRO HA A 43 PRO HGx 1.0 1.716 3.270 1928 1547 A 43 PRO HA A 43 PRO HGy 1.0 1.716 3.270 1929 1548 A 65 LEU HG A 65 LEU HBy 1.0 1.703 3.213 1930 1548 A 65 LEU HG A 65 LEU HBx 1.0 1.703 3.213 1931 1549 A 91 GLU HGx A 91 GLU HBx 1.0 1.436 2.316 1932 1549 A 91 GLU HGx A 91 GLU HBy 1.0 1.436 2.316 1933 1550 A 65 LEU HD1% A 65 LEU HBy 1.0 1.617 2.881 1934 1550 A 65 LEU HD1% A 65 LEU HBx 1.0 1.617 2.881 1935 1551 A 84 ASN HA A 85 LYS HBx 1.0 1.901 4.317 1936 1551 A 84 ASN HA A 85 LYS HBy 1.0 1.901 4.317 1937 1552 A 84 ASN HD2y A 85 LYS HBx 1.0 1.836 3.874 1938 1552 A 84 ASN HD2y A 85 LYS HBy 1.0 1.836 3.874 1939 1553 A 81 LYS HEy A 81 LYS HBx 1.0 1.755 3.443 1940 1553 A 81 LYS HEx A 81 LYS HBx 1.0 1.755 3.443 1941 1553 A 81 LYS HEx A 81 LYS HBy 1.0 1.755 3.443 1942 1553 A 81 LYS HEy A 81 LYS HBy 1.0 1.755 3.443 1943 1554 A 11 ILE HB A 7 GLN HBy 1.0 1.413 2.255 1944 1554 A 7 GLN HGx A 7 GLN HBx 1.0 1.413 2.255 1945 1554 A 7 GLN HGy A 7 GLN HBx 1.0 1.413 2.255 1946 1554 A 7 GLN HGx A 7 GLN HBy 1.0 1.413 2.255 1947 1554 A 7 GLN HGy A 7 GLN HBy 1.0 1.413 2.255 1948 1555 A 31 LYS HA A 31 LYS HDy 1.0 1.736 3.358 1949 1555 A 31 LYS HA A 31 LYS HDx 1.0 1.736 3.358 1950 1555 A 28 PHE HA A 31 LYS HDy 1.0 1.736 3.358 1951 1555 A 28 PHE HA A 27 LEU HBy 1.0 1.736 3.358 1952 1556 A 22 ILE HG2% A 27 LEU HBy 1.0 1.826 3.812 1953 1556 A 22 ILE HG2% A 31 LYS HDx 1.0 1.826 3.812 1954 1556 A 22 ILE HG2% A 31 LYS HDy 1.0 1.826 3.812 1955 1557 A 76 LYS HBx A 73 ARG HE 1.0 1.749 3.415 1956 1557 A 76 LYS HBy A 73 ARG HE 1.0 1.749 3.415 1957 1558 A 93 GLN HA A 93 GLN HBx 1.0 1.824 3.798 1958 1558 A 93 GLN HA A 93 GLN HBy 1.0 1.824 3.798 1959 1559 A 93 GLN HGy A 93 GLN HBx 1.0 1.663 3.051 1960 1559 A 93 GLN HGy A 93 GLN HBy 1.0 1.663 3.051 1961 1560 A 8 LYS HZ% A 8 LYS HDx 1.0 1.697 3.187 1962 1560 A 8 LYS HZ% A 8 LYS HDy 1.0 1.697 3.187 1963 1561 A 5 THR HB A 8 LYS HDx 1.0 1.799 3.661 1964 1561 A 5 THR HB A 8 LYS HDy 1.0 1.799 3.661 1965 1561 A 5 THR HB A 4 LEU HG 1.0 1.799 3.661 1966 1562 A 4 LEU HBy A 4 LEU HD1% 1.0 1.664 3.056 1967 1562 A 4 LEU HBy A 4 LEU HD2% 1.0 1.664 3.056 1968 1563 A 46 ALA HB% A 49 LYS H 1.0 1.926 4.538 1969 1563 A 3 TRP HD1 A 45 LYS HDy 1.0 1.926 4.538 1970 1564 A 42 GLU HA A 46 ALA HB% 1.0 1.868 4.078 1971 1564 A 42 GLU HA A 45 LYS HDx 1.0 1.868 4.078 1972 1564 A 42 GLU HA A 45 LYS HDy 1.0 1.868 4.078 1973 1565 A 3 TRP HBy A 45 LYS HDx 1.0 1.995 5.601 1974 1565 A 3 TRP HBy A 45 LYS HDy 1.0 1.995 5.601 1975 1566 A 81 LYS HEy A 81 LYS HDy 1.0 1.646 2.986 1976 1566 A 8 LYS HEx A 8 LYS HGy 1.0 1.646 2.986 1977 1566 A 8 LYS HEy A 8 LYS HGy 1.0 1.646 2.986 1978 1566 A 81 LYS HDy A 81 LYS HEx 1.0 1.646 2.986 1979 1567 A 79 LEU HG A 79 LEU HD2% 1.0 1.500 2.500 1980 1567 A 52 ILE HG1x A 52 ILE HG2% 1.0 1.500 2.500 1981 1568 A 58 LEU HD2% A 85 LYS HGx 1.0 1.692 3.166 1982 1568 A 27 LEU HD2% A 8 LYS HGy 1.0 1.692 3.166 1983 1568 A 58 LEU HD2% A 85 LYS HGy 1.0 1.692 3.166 1984 1569 A 67 ASP HBx A 33 LYS HGx 1.0 1.991 6.549 1985 1569 A 22 ILE HG1x A 23 MET HGx 1.0 1.991 6.549 1986 1569 A 22 ILE HG1x A 21 ASN HBx 1.0 1.991 6.549 1987 1569 A 22 ILE HG1x A 21 ASN HBy 1.0 1.991 6.549 1988 1570 A 51 ILE HG1x A 49 LYS HDy 1.0 2.000 5.950 1989 1570 A 51 ILE HG1x A 49 LYS HDx 1.0 2.000 5.950 1990 1570 A 81 LYS HGx A 15 ARG HBx 1.0 2.000 5.950 1991 1570 A 81 LYS HGx A 15 ARG HBy 1.0 2.000 5.950 1992 1571 A 51 ILE HD1% A 55 LYS HGy 1.0 1.511 2.533 1993 1571 A 51 ILE HD1% A 55 LYS HGx 1.0 1.511 2.533 1994 1572 A 51 ILE HG2% A 55 LYS HGy 1.0 1.627 2.921 1995 1572 A 51 ILE HG2% A 53 ALA HB% 1.0 1.627 2.921 1996 1572 A 51 ILE HG2% A 55 LYS HGx 1.0 1.627 2.921 1997 1573 A 86 PHE HEy A 59 THR HG2% 1.0 1.909 4.379 1998 1573 A 86 PHE HEy A 44 VAL HG2% 1.0 1.909 4.379 1999 1573 A 86 PHE HEx A 44 VAL HG2% 1.0 1.909 4.379 2000 1573 A 86 PHE HEx A 59 THR HG2% 1.0 1.909 4.379 2001 1574 A 5 THR HA A 5 THR HG2% 1.0 1.505 2.515 2002 1574 A 44 VAL HA A 44 VAL HG2% 1.0 1.505 2.515 2003 1575 A 86 PHE HA A 101 VAL HG2% 1.0 1.794 3.640 2004 1575 A 86 PHE HA A 101 VAL HG1% 1.0 1.794 3.640 2005 1576 A 71 THR HG2% A 78 LYS HGy 1.0 1.868 4.076 2006 1576 A 71 THR HG2% A 78 LYS HGx 1.0 1.868 4.076 2007 1577 A 101 VAL HA A 101 VAL HG1% 1.0 1.604 2.836 2008 1577 A 101 VAL HA A 101 VAL HG2% 1.0 1.604 2.836 2009 1578 A 100 GLY HAx A 101 VAL HG2% 1.0 1.865 4.055 2010 1578 A 101 VAL HG1% A 100 GLY HAx 1.0 1.865 4.055 2011 1579 A 101 VAL HG1% A 100 GLY HAy 1.0 1.872 4.104 2012 1579 A 102 GLY HAx A 101 VAL HG2% 1.0 1.872 4.104 2013 1579 A 100 GLY HAy A 101 VAL HG2% 1.0 1.872 4.104 2014 1580 A 86 PHE HBx A 101 VAL HG1% 1.0 1.685 3.139 2015 1580 A 86 PHE HBx A 101 VAL HG2% 1.0 1.685 3.139 2016 1581 A 101 VAL HB A 101 VAL HG2% 1.0 1.516 2.548 2017 1581 A 101 VAL HB A 101 VAL HG1% 1.0 1.516 2.548 2018 1582 A 17 VAL HG1% A 79 LEU HD1% 1.0 1.605 2.839 2019 1582 A 17 VAL HG1% A 12 THR HG2% 1.0 1.605 2.839 2020 1583 A 11 ILE HG2% A 7 GLN HBy 1.0 1.595 2.803 2021 1583 A 79 LEU HBx A 79 LEU HD1% 1.0 1.595 2.803 2022 1584 A 86 PHE HA A 87 ALA HB% 1.0 1.866 4.062 2023 1584 A 88 VAL HA A 87 ALA HB% 1.0 1.866 4.062 2024 1585 A 83 THR HG2% A 84 ASN HA 1.0 1.741 3.381 2025 1585 A 64 TYR HA A 83 THR HG2% 1.0 1.741 3.381 2026 1586 A 79 LEU HD2% A 18 ASP HA 1.0 1.766 3.494 2027 1586 A 63 PHE HA A 83 THR HG2% 1.0 1.766 3.494 2028 1587 A 4 LEU HBx A 4 LEU HD1% 1.0 1.838 3.890 2029 1587 A 4 LEU HBx A 4 LEU HD2% 1.0 1.838 3.890 2030 1588 A 59 THR H A 58 LEU HD1% 1.0 1.999 6.159 2031 1588 A 58 LEU HD1% A 87 ALA H 1.0 1.999 6.159 2032 1589 A 76 LYS HA A 70 VAL HG2% 1.0 1.870 4.088 2033 1589 A 70 VAL HG2% A 71 THR HB 1.0 1.870 4.088 2034 1590 A 51 ILE HG2% A 48 CYS HA 1.0 1.715 3.263 2035 1590 A 58 LEU HA A 57 VAL HG1% 1.0 1.715 3.263 2036 1590 A 57 VAL HG1% A 48 CYS HA 1.0 1.715 3.263 2037 1591 A 57 VAL HB A 57 VAL HG1% 1.0 1.361 2.119 2038 1591 A 51 ILE HG2% A 51 ILE HB 1.0 1.361 2.119 2039 1592 A 51 ILE HG2% A 55 LYS HDy 1.0 1.579 2.751 2040 1592 A 51 ILE HG2% A 55 LYS HDx 1.0 1.579 2.751 2041 1593 A 22 ILE HD1% A 22 ILE HA 1.0 1.756 3.452 2042 1593 A 1 PCA HA A 96 VAL HG2% 1.0 1.756 3.452 2043 1594 A 65 LEU HD2% A 65 LEU HBy 1.0 1.592 2.794 2044 1594 A 65 LEU HD2% A 65 LEU HBx 1.0 1.592 2.794 2045 1595 A 57 VAL H A 99 VAL HG2% 1.0 1.848 3.946 2046 1595 A 57 VAL H A 88 VAL HG2% 1.0 1.848 3.946 2047 1596 A 88 VAL HG2% A 95 PRO HA 1.0 1.898 4.292 2048 1596 A 88 VAL HG2% A 90 CYS HA 1.0 1.898 4.292 2049 1597 A 99 VAL HG2% A 88 VAL HA 1.0 1.682 3.130 2050 1597 A 88 VAL HG2% A 88 VAL HA 1.0 1.682 3.130 2051 1598 A 88 VAL HG2% A 89 THR HA 1.0 1.854 3.980 2052 1598 A 99 VAL HG2% A 89 THR HA 1.0 1.854 3.980 2053 1599 A 47 ILE HD1% A 59 THR HB 1.0 1.911 4.401 2054 1599 A 22 ILE HG2% A 23 MET HA 1.0 1.911 4.401 2055 1600 A 11 ILE HD1% A 10 HIS HBx 1.0 1.901 4.323 2056 1600 A 44 VAL HB A 11 ILE HD1% 1.0 1.901 4.323 2057 1601 A 3 TRP HZ2 A 11 ILE HD1% 1.0 1.984 5.298 2058 1601 A 3 TRP HE3 A 11 ILE HD1% 1.0 1.984 5.298 2059 1602 A 27 LEU HD1% A 8 LYS HDx 1.0 1.749 3.419 2060 1602 A 27 LEU HD1% A 8 LYS HDy 1.0 1.749 3.419 2061 1603 A 17 VAL HG1% A 16 ASP HA 1.0 1.887 4.215 2062 1603 A 17 VAL HG1% A 18 ASP HA 1.0 1.887 4.215 2063 1604 A 17 VAL HG1% A 66 SER HBy 1.0 1.798 3.656 2064 1604 A 17 VAL HG1% A 12 THR HB 1.0 1.798 3.656 2065 1605 A 28 PHE HEx A 17 VAL HG2% 1.0 1.825 3.805 2066 1605 A 36 PHE HDx A 17 VAL HG2% 1.0 1.825 3.805 2067 1605 A 36 PHE HDy A 17 VAL HG2% 1.0 1.825 3.805 2068 1605 A 28 PHE HEy A 17 VAL HG2% 1.0 1.825 3.805 2069 1606 A 3 TRP HE1 A 41 PRO HGx 1.0 2.000 5.926 2070 1606 A 41 PRO HGy A 3 TRP HE1 1.0 2.000 5.926 2071 1607 A 4 LEU HG A 3 TRP HE1 1.0 1.964 7.116 2072 1607 A 4 LEU HBy A 3 TRP HE1 1.0 1.964 7.116 2073 1607 A 3 TRP HE1 A 45 LYS HBx 1.0 1.964 7.116 2074 1608 A 3 TRP HE1 A 4 LEU HD2% 1.0 1.997 5.723 2075 1608 A 94 ALA HB% A 3 TRP HE1 1.0 1.997 5.723 2076 1608 A 4 LEU HD1% A 3 TRP HE1 1.0 1.997 5.723 2077 1609 A 81 LYS H A 81 LYS HBx 1.0 1.913 4.419 2078 1609 A 81 LYS H A 81 LYS HBy 1.0 1.913 4.419 2079 1610 A 81 LYS H A 81 LYS HDy 1.0 1.930 7.562 2080 1610 A 81 LYS H A 80 LYS HGx 1.0 1.930 7.562 2081 1611 A 38 TYR H A 64 TYR HBy 1.0 1.967 5.011 2082 1611 A 38 TYR H A 63 PHE HBy 1.0 1.967 5.011 2083 1612 A 38 TYR H A 44 VAL HG2% 1.0 1.982 6.768 2084 1612 A 38 TYR H A 37 ILE HG1y 1.0 1.982 6.768 2085 1613 A 38 TYR H A 65 LEU HD1% 1.0 2.000 5.996 2086 1613 A 38 TYR H A 83 THR HG2% 1.0 2.000 5.996 2087 1614 A 99 VAL H A 89 THR H 1.0 1.840 3.896 2088 1614 A 99 VAL H A 88 VAL H 1.0 1.840 3.896 2089 1615 A 70 VAL H A 69 ASN HBy 1.0 1.907 4.367 2090 1615 A 70 VAL H A 32 ASP HBy 1.0 1.907 4.367 2091 1616 A 70 VAL H A 33 LYS HBx 1.0 1.991 6.545 2092 1616 A 70 VAL H A 33 LYS HBy 1.0 1.991 6.545 2093 1617 A 70 VAL H A 33 LYS HGx 1.0 1.818 8.592 2094 1617 A 70 VAL H A 33 LYS HGy 1.0 1.818 8.592 2095 1618 A 78 LYS HA A 80 LYS H 1.0 1.993 6.501 2096 1618 A 18 ASP HA A 80 LYS H 1.0 1.993 6.501 2097 1619 A 80 LYS H A 80 LYS HDy 1.0 1.899 4.309 2098 1619 A 79 LEU HBy A 80 LYS H 1.0 1.899 4.309 2099 1620 A 52 ILE H A 92 ASN HA 1.0 1.981 5.233 2100 1620 A 52 ILE H A 53 ALA HA 1.0 1.981 5.233 2101 1621 A 52 ILE H A 55 LYS HDx 1.0 1.999 6.199 2102 1621 A 52 ILE H A 55 LYS HDy 1.0 1.999 6.199 2103 1622 A 79 LEU H A 20 ASP H 1.0 2.000 5.966 2104 1622 A 78 LYS H A 79 LEU H 1.0 2.000 5.966 2105 1623 A 79 LEU H A 19 CYS HBy 1.0 1.992 6.504 2106 1623 A 79 LEU H A 19 CYS HBx 1.0 1.992 6.504 2107 1623 A 78 LYS HEx A 79 LEU H 1.0 1.992 6.504 2108 1623 A 78 LYS HEy A 79 LEU H 1.0 1.992 6.504 2109 1624 A 79 LEU HBx A 79 LEU H 1.0 1.565 2.703 2110 1624 A 78 LYS HBx A 79 LEU H 1.0 1.565 2.703 2111 1625 A 79 LEU HG A 79 LEU H 1.0 1.778 3.556 2112 1625 A 78 LYS HGx A 79 LEU H 1.0 1.778 3.556 2113 1626 A 55 LYS HEx A 90 CYS H 1.0 1.984 6.730 2114 1626 A 55 LYS HEy A 90 CYS H 1.0 1.984 6.730 2115 1626 A 48 CYS HBx A 90 CYS H 1.0 1.984 6.730 2116 1627 A 57 VAL HB A 90 CYS H 1.0 2.000 6.042 2117 1627 A 90 CYS H A 55 LYS HBy 1.0 2.000 6.042 2118 1628 A 90 CYS H A 55 LYS HDx 1.0 1.998 6.246 2119 1628 A 90 CYS H A 55 LYS HDy 1.0 1.998 6.246 2120 1629 A 90 CYS H A 55 LYS HGx 1.0 1.795 8.769 2121 1629 A 90 CYS H A 55 LYS HGy 1.0 1.795 8.769 2122 1630 A 88 VAL HG2% A 90 CYS H 1.0 1.979 5.205 2123 1630 A 57 VAL HG2% A 90 CYS H 1.0 1.979 5.205 2124 1631 A 58 LEU H A 58 LEU HG 1.0 1.801 3.673 2125 1631 A 57 VAL HB A 58 LEU H 1.0 1.801 3.673 2126 1632 A 57 VAL HG2% A 58 LEU H 1.0 1.823 3.799 2127 1632 A 58 LEU HD2% A 58 LEU H 1.0 1.823 3.799 2128 1633 A 92 ASN H A 91 GLU HBx 1.0 1.839 3.893 2129 1633 A 92 ASN H A 91 GLU HBy 1.0 1.839 3.893 2130 1634 A 92 ASN H A 93 GLN HBx 1.0 1.752 9.064 2131 1634 A 92 ASN H A 93 GLN HBy 1.0 1.752 9.064 2132 1635 A 51 ILE HG2% A 92 ASN H 1.0 1.952 4.810 2133 1635 A 52 ILE HD1% A 92 ASN H 1.0 1.952 4.810 2134 1636 A 15 ARG H A 15 ARG HBx 1.0 1.997 6.305 2135 1636 A 15 ARG H A 15 ARG HBy 1.0 1.997 6.305 2136 1637 A 55 LYS H A 54 SER HBx 1.0 1.832 3.848 2137 1637 A 55 LYS H A 54 SER HBy 1.0 1.832 3.848 2138 1638 A 55 LYS H A 55 LYS HGx 1.0 1.952 4.804 2139 1638 A 55 LYS H A 55 LYS HGy 1.0 1.952 4.804 2140 1639 A 65 LEU H A 63 PHE HEx 1.0 1.996 6.346 2141 1639 A 65 LEU H A 63 PHE HEy 1.0 1.996 6.346 2142 1639 A 65 LEU H A 63 PHE HDy 1.0 1.996 6.346 2143 1639 A 65 LEU H A 63 PHE HDx 1.0 1.996 6.346 2144 1640 A 65 LEU H A 83 THR HB 1.0 1.942 7.422 2145 1640 A 65 LEU H A 66 SER HBx 1.0 1.942 7.422 2146 1641 A 65 LEU H A 65 LEU HBx 1.0 1.661 3.045 2147 1641 A 65 LEU H A 65 LEU HBy 1.0 1.661 3.045 2148 1642 A 65 LEU H A 81 LYS HBx 1.0 1.998 6.284 2149 1642 A 65 LEU H A 81 LYS HBy 1.0 1.998 6.284 2150 1643 A 65 LEU H A 65 LEU HD1% 1.0 1.781 3.573 2151 1643 A 65 LEU H A 83 THR HG2% 1.0 1.781 3.573 2152 1644 A 65 LEU H A 37 ILE HG2% 1.0 1.999 6.157 2153 1644 A 65 LEU H A 35 THR HG2% 1.0 1.999 6.157 2154 1645 A 67 ASP H A 69 ASN HBy 1.0 1.997 6.285 2155 1645 A 67 ASP H A 68 CYS HBx 1.0 1.997 6.285 2156 1646 A 67 ASP H A 12 THR HG2% 1.0 1.999 6.171 2157 1646 A 67 ASP H A 79 LEU HD1% 1.0 1.999 6.171 2158 1647 A 90 CYS H A 56 ASN H 1.0 1.981 5.241 2159 1647 A 57 VAL H A 56 ASN H 1.0 1.981 5.241 2160 1648 A 56 ASN H A 55 LYS HDx 1.0 1.945 4.725 2161 1648 A 56 ASN H A 55 LYS HDy 1.0 1.945 4.725 2162 1649 A 56 ASN H A 55 LYS HGx 1.0 1.759 3.463 2163 1649 A 56 ASN H A 55 LYS HGy 1.0 1.759 3.463 2164 1650 A 51 ILE HG2% A 56 ASN H 1.0 1.988 5.400 2165 1650 A 57 VAL HG1% A 56 ASN H 1.0 1.988 5.400 2166 1650 A 99 VAL HG1% A 56 ASN H 1.0 1.988 5.400 2167 1651 A 66 SER HA A 36 PHE H 1.0 1.948 7.338 2168 1651 A 11 ILE HA A 36 PHE H 1.0 1.948 7.338 2169 1652 A 36 PHE HBy A 36 PHE H 1.0 1.817 3.763 2170 1652 A 35 THR HB A 36 PHE H 1.0 1.817 3.763 2171 1653 A 74 PRO HDy A 73 ARG H 1.0 1.988 5.392 2172 1653 A 70 VAL HA A 73 ARG H 1.0 1.988 5.392 2173 1654 A 73 ARG H A 73 ARG HDx 1.0 1.988 5.370 2174 1654 A 73 ARG H A 73 ARG HDy 1.0 1.988 5.370 2175 1655 A 73 ARG H A 76 LYS HGy 1.0 1.974 5.116 2176 1655 A 71 THR HG2% A 73 ARG H 1.0 1.974 5.116 2177 1656 A 49 LYS H A 49 LYS HBx 1.0 1.535 2.607 2178 1656 A 49 LYS H A 49 LYS HBy 1.0 1.535 2.607 2179 1657 A 49 LYS H A 49 LYS HGx 1.0 1.851 3.967 2180 1657 A 49 LYS H A 49 LYS HGy 1.0 1.851 3.967 2181 1658 A 57 VAL HG1% A 49 LYS H 1.0 1.996 6.382 2182 1658 A 51 ILE HG2% A 49 LYS H 1.0 1.996 6.382 2183 1659 A 40 ARG H A 43 PRO HGx 1.0 1.996 6.334 2184 1659 A 40 ARG H A 43 PRO HGy 1.0 1.996 6.334 2185 1660 A 40 ARG H A 40 ARG HGx 1.0 1.920 4.478 2186 1660 A 40 ARG H A 40 ARG HGy 1.0 1.920 4.478 2187 1661 A 77 TYR H A 28 PHE HBy 1.0 1.965 7.093 2188 1661 A 77 TYR H A 19 CYS HBx 1.0 1.965 7.093 2189 1661 A 77 TYR H A 19 CYS HBy 1.0 1.965 7.093 2190 1662 A 77 TYR H A 76 LYS HBx 1.0 1.958 4.888 2191 1662 A 77 TYR H A 76 LYS HBy 1.0 1.958 4.888 2192 1663 A 77 TYR H A 76 LYS HDx 1.0 1.962 4.932 2193 1663 A 77 TYR H A 76 LYS HDy 1.0 1.962 4.932 2194 1664 A 77 TYR H A 76 LYS HGy 1.0 1.969 5.043 2195 1664 A 77 TYR H A 76 LYS HGx 1.0 1.969 5.043 2196 1664 A 71 THR HG2% A 77 TYR H 1.0 1.969 5.043 2197 1665 A 3 TRP H A 2 ASP HBx 1.0 1.832 3.846 2198 1665 A 3 TRP H A 2 ASP HBy 1.0 1.832 3.846 2199 1666 A 94 ALA HB% A 3 TRP H 1.0 1.993 5.547 2200 1666 A 96 VAL HG1% A 3 TRP H 1.0 1.993 5.547 2201 1667 A 12 THR HG2% A 13 ASN H 1.0 2.000 6.002 2202 1667 A 13 ASN H A 11 ILE HG2% 1.0 2.000 6.002 2203 1668 A 53 ALA H A 51 ILE HG2% 1.0 1.829 3.835 2204 1668 A 53 ALA H A 52 ILE HD1% 1.0 1.829 3.835 2205 1669 A 96 VAL HA A 6 PHE H 1.0 2.000 6.024 2206 1669 A 7 GLN HE2x A 6 PHE H 1.0 2.000 6.024 2207 1670 A 96 VAL HB A 6 PHE H 1.0 2.000 6.040 2208 1670 A 4 LEU HBx A 6 PHE H 1.0 2.000 6.040 2209 1670 A 1 PCA HBy A 6 PHE H 1.0 2.000 6.040 2210 1671 A 4 LEU HD1% A 6 PHE H 1.0 1.996 5.652 2211 1671 A 96 VAL HG1% A 6 PHE H 1.0 1.996 5.652 2212 1672 A 35 THR HG2% A 37 ILE H 1.0 1.895 4.273 2213 1672 A 37 ILE HG2% A 37 ILE H 1.0 1.895 4.273 2214 1673 A 57 VAL H A 51 ILE HD1% 1.0 1.997 5.685 2215 1673 A 57 VAL H A 88 VAL HG1% 1.0 1.997 5.685 2216 1673 A 57 VAL H A 89 THR HG2% 1.0 1.997 5.685 2217 1674 A 57 VAL H A 57 VAL HG2% 1.0 1.940 4.666 2218 1674 A 57 VAL H A 88 VAL HG2% 1.0 1.940 4.666 2219 1675 A 28 PHE HEy A 35 THR H 1.0 1.995 6.427 2220 1675 A 28 PHE HEx A 35 THR H 1.0 1.995 6.427 2221 1675 A 36 PHE HDy A 35 THR H 1.0 1.995 6.427 2222 1675 A 36 PHE HDx A 35 THR H 1.0 1.995 6.427 2223 1676 A 93 GLN HA A 51 ILE H 1.0 1.774 3.538 2224 1676 A 51 ILE HA A 51 ILE H 1.0 1.774 3.538 2225 1677 A 51 ILE H A 93 GLN HBx 1.0 1.853 3.979 2226 1677 A 51 ILE H A 93 GLN HBy 1.0 1.853 3.979 2227 1678 A 51 ILE H A 55 LYS HGy 1.0 1.984 5.304 2228 1678 A 51 ILE H A 49 LYS HGx 1.0 1.984 5.304 2229 1678 A 51 ILE H A 49 LYS HGy 1.0 1.984 5.304 2230 1679 A 16 ASP H A 15 ARG HBx 1.0 1.994 5.564 2231 1679 A 16 ASP H A 15 ARG HBy 1.0 1.994 5.564 2232 1680 A 79 LEU HD1% A 16 ASP H 1.0 1.999 5.757 2233 1680 A 12 THR HG2% A 16 ASP H 1.0 1.999 5.757 2234 1681 A 64 TYR HDy A 84 ASN H 1.0 2.000 6.008 2235 1681 A 64 TYR HDx A 84 ASN H 1.0 2.000 6.008 2236 1681 A 63 PHE HDy A 84 ASN H 1.0 2.000 6.008 2237 1681 A 63 PHE HDx A 84 ASN H 1.0 2.000 6.008 2238 1682 A 86 PHE HBy A 84 ASN H 1.0 2.000 6.014 2239 1682 A 63 PHE HBy A 84 ASN H 1.0 2.000 6.014 2240 1683 A 84 ASN H A 62 GLU HGx 1.0 1.984 6.712 2241 1683 A 101 VAL HB A 84 ASN H 1.0 1.984 6.712 2242 1684 A 84 ASN H A 65 LEU HBx 1.0 1.904 4.342 2243 1684 A 84 ASN H A 65 LEU HBy 1.0 1.904 4.342 2244 1685 A 65 LEU HD1% A 84 ASN H 1.0 1.728 3.324 2245 1685 A 83 THR HG2% A 84 ASN H 1.0 1.728 3.324 2246 1686 A 69 ASN H A 33 LYS HBx 1.0 1.991 5.457 2247 1686 A 69 ASN H A 33 LYS HBy 1.0 1.991 5.457 2248 1687 A 69 ASN H A 80 LYS HDx 1.0 1.995 5.615 2249 1687 A 69 ASN H A 78 LYS HDx 1.0 1.995 5.615 2250 1688 A 69 ASN H A 80 LYS HGx 1.0 1.991 5.485 2251 1688 A 69 ASN H A 79 LEU HG 1.0 1.991 5.485 2252 1688 A 69 ASN H A 78 LYS HGx 1.0 1.991 5.485 2253 1688 A 69 ASN H A 78 LYS HGy 1.0 1.991 5.485 2254 1689 A 3 TRP HZ2 A 45 LYS H 1.0 1.948 4.764 2255 1689 A 3 TRP HE3 A 45 LYS H 1.0 1.948 4.764 2256 1690 A 45 LYS H A 3 TRP HH2 1.0 1.825 3.805 2257 1690 A 3 TRP HZ3 A 45 LYS H 1.0 1.825 3.805 2258 1691 A 45 LYS H A 45 LYS HBx 1.0 1.776 3.548 2259 1691 A 45 LYS H A 45 LYS HBy 1.0 1.776 3.548 2260 1692 A 46 ALA HB% A 45 LYS H 1.0 1.835 3.865 2261 1692 A 45 LYS H A 45 LYS HDx 1.0 1.835 3.865 2262 1692 A 45 LYS H A 45 LYS HDy 1.0 1.835 3.865 2263 1693 A 45 LYS H A 45 LYS HGy 1.0 1.876 4.132 2264 1693 A 44 VAL HG1% A 45 LYS H 1.0 1.876 4.132 2265 1694 A 66 SER HBx A 17 VAL H 1.0 1.996 5.652 2266 1694 A 14 THR HB A 17 VAL H 1.0 1.996 5.652 2267 1695 A 11 ILE H A 6 PHE HEy 1.0 1.999 6.089 2268 1695 A 11 ILE H A 6 PHE HEx 1.0 1.999 6.089 2269 1695 A 11 ILE H A 6 PHE HDy 1.0 1.999 6.089 2270 1695 A 11 ILE H A 6 PHE HDx 1.0 1.999 6.089 2271 1696 A 11 ILE H A 11 ILE HG1y 1.0 1.938 4.652 2272 1696 A 11 ILE H A 9 LYS HBy 1.0 1.938 4.652 2273 1697 A 11 ILE H A 9 LYS HGx 1.0 1.998 6.264 2274 1697 A 11 ILE H A 9 LYS HGy 1.0 1.998 6.264 2275 1698 A 63 PHE H A 86 PHE H 1.0 1.728 9.220 2276 1698 A 84 ASN HD2y A 63 PHE H 1.0 1.728 9.220 2277 1699 A 63 PHE H A 65 LEU HBy 1.0 1.946 7.372 2278 1699 A 63 PHE H A 65 LEU HBx 1.0 1.946 7.372 2279 1700 A 85 LYS HBx A 63 PHE H 1.0 1.975 6.919 2280 1700 A 63 PHE H A 85 LYS HBy 1.0 1.975 6.919 2281 1701 A 65 LEU HD1% A 63 PHE H 1.0 1.883 4.179 2282 1701 A 83 THR HG2% A 63 PHE H 1.0 1.883 4.179 2283 1702 A 101 VAL H A 87 ALA H 1.0 1.931 4.589 2284 1702 A 87 ALA H A 88 VAL H 1.0 1.931 4.589 2285 1703 A 88 VAL HG1% A 87 ALA H 1.0 1.875 4.127 2286 1703 A 101 VAL HG1% A 87 ALA H 1.0 1.875 4.127 2287 1704 A 99 VAL HG1% A 87 ALA H 1.0 1.999 5.865 2288 1704 A 65 LEU HD2% A 87 ALA H 1.0 1.999 5.865 2289 1705 A 58 LEU HD2% A 87 ALA H 1.0 1.844 3.926 2290 1705 A 88 VAL HG2% A 87 ALA H 1.0 1.844 3.926 2291 1706 A 66 SER H A 36 PHE HA 1.0 1.993 5.525 2292 1706 A 66 SER H A 35 THR HA 1.0 1.993 5.525 2293 1707 A 66 SER H A 36 PHE HBy 1.0 2.000 6.086 2294 1707 A 66 SER H A 67 ASP HBy 1.0 2.000 6.086 2295 1708 A 66 SER H A 65 LEU HBx 1.0 1.891 4.247 2296 1708 A 66 SER H A 65 LEU HBy 1.0 1.891 4.247 2297 1709 A 66 SER H A 65 LEU HG 1.0 1.953 4.825 2298 1709 A 66 SER H A 37 ILE HG1y 1.0 1.953 4.825 2299 1710 A 66 SER H A 79 LEU HD2% 1.0 1.961 4.931 2300 1710 A 66 SER H A 65 LEU HD1% 1.0 1.961 4.931 2301 1711 A 4 LEU H A 2 ASP HBx 1.0 1.954 4.824 2302 1711 A 4 LEU H A 2 ASP HBy 1.0 1.954 4.824 2303 1712 A 4 LEU H A 4 LEU HG 1.0 1.700 3.200 2304 1712 A 4 LEU H A 4 LEU HBy 1.0 1.700 3.200 2305 1713 A 4 LEU H A 4 LEU HD1% 1.0 1.961 4.921 2306 1713 A 4 LEU H A 4 LEU HD2% 1.0 1.961 4.921 2307 1714 A 19 CYS H A 19 CYS HBx 1.0 1.810 3.724 2308 1714 A 19 CYS H A 19 CYS HBy 1.0 1.810 3.724 2309 1715 A 19 CYS H A 21 ASN HBx 1.0 1.976 5.156 2310 1715 A 19 CYS H A 20 ASP HBy 1.0 1.976 5.156 2311 1716 A 103 SER HBy A 85 LYS H 1.0 1.845 8.389 2312 1716 A 85 LYS H A 102 GLY HAy 1.0 1.845 8.389 2313 1717 A 85 LYS HBx A 85 LYS H 1.0 1.840 3.894 2314 1717 A 85 LYS H A 85 LYS HBy 1.0 1.840 3.894 2315 1718 A 85 LYS H A 85 LYS HGx 1.0 1.688 3.152 2316 1718 A 85 LYS H A 85 LYS HGy 1.0 1.688 3.152 2317 1719 A 65 LEU HD1% A 85 LYS H 1.0 1.897 4.287 2318 1719 A 83 THR HG2% A 85 LYS H 1.0 1.897 4.287 2319 1720 A 102 GLY H A 85 LYS H 1.0 1.994 5.580 2320 1720 A 85 LYS H A 62 GLU H 1.0 1.994 5.580 2321 1721 A 78 LYS H A 69 ASN HBy 1.0 1.943 4.713 2322 1721 A 78 LYS H A 20 ASP HBx 1.0 1.943 4.713 2323 1722 A 78 LYS H A 78 LYS HDx 1.0 1.692 3.170 2324 1722 A 78 LYS H A 78 LYS HDy 1.0 1.692 3.170 2325 1722 A 78 LYS H A 78 LYS HBy 1.0 1.692 3.170 2326 1723 A 65 LEU HG A 85 LYS H 1.0 1.999 6.225 2327 1723 A 60 THR HG2% A 85 LYS H 1.0 1.999 6.225 2328 1724 A 75 CYS H A 75 CYS HBx 1.0 1.653 3.015 2329 1724 A 75 CYS H A 75 CYS HBy 1.0 1.653 3.015 2330 1725 A 75 CYS H A 74 PRO HBx 1.0 1.878 4.146 2331 1725 A 75 CYS H A 74 PRO HBy 1.0 1.878 4.146 2332 1726 A 32 ASP H A 31 LYS HBx 1.0 1.787 3.605 2333 1726 A 32 ASP H A 31 LYS HBy 1.0 1.787 3.605 2334 1727 A 32 ASP H A 31 LYS HDx 1.0 1.885 4.199 2335 1727 A 32 ASP H A 31 LYS HDy 1.0 1.885 4.199 2336 1728 A 46 ALA HA A 47 ILE H 1.0 1.907 4.363 2337 1728 A 44 VAL HA A 47 ILE H 1.0 1.907 4.363 2338 1729 A 47 ILE H A 45 LYS HBx 1.0 1.985 5.327 2339 1729 A 47 ILE H A 45 LYS HBy 1.0 1.985 5.327 2340 1730 A 22 ILE H A 21 ASN HBx 1.0 1.805 3.695 2341 1730 A 22 ILE H A 21 ASN HBy 1.0 1.805 3.695 2342 1731 A 62 GLU H A 61 SER HBx 1.0 1.764 3.488 2343 1731 A 62 GLU H A 61 SER HBy 1.0 1.764 3.488 2344 1732 A 64 TYR HDx A 64 TYR H 1.0 1.852 3.972 2345 1732 A 64 TYR HDy A 64 TYR H 1.0 1.852 3.972 2346 1732 A 64 TYR H A 63 PHE HDy 1.0 1.852 3.972 2347 1732 A 64 TYR H A 63 PHE HDx 1.0 1.852 3.972 2348 1733 A 93 GLN HGx A 94 ALA H 1.0 1.999 6.125 2349 1733 A 91 GLU HGx A 94 ALA H 1.0 1.999 6.125 2350 1734 A 94 ALA H A 93 GLN HBx 1.0 1.989 5.413 2351 1734 A 94 ALA H A 93 GLN HBy 1.0 1.989 5.413 2352 1735 A 36 PHE HDx A 68 CYS H 1.0 1.983 5.291 2353 1735 A 28 PHE HEy A 68 CYS H 1.0 1.983 5.291 2354 1735 A 28 PHE HEx A 68 CYS H 1.0 1.983 5.291 2355 1735 A 36 PHE HDy A 68 CYS H 1.0 1.983 5.291 2356 1736 A 68 CYS H A 19 CYS HBx 1.0 1.957 7.213 2357 1736 A 68 CYS H A 19 CYS HBy 1.0 1.957 7.213 2358 1737 A 68 CYS H A 33 LYS HBx 1.0 1.998 5.746 2359 1737 A 68 CYS H A 33 LYS HBy 1.0 1.998 5.746 2360 1738 A 51 ILE HG2% A 91 GLU H 1.0 1.930 4.568 2361 1738 A 96 VAL HG2% A 91 GLU H 1.0 1.930 4.568 2362 1739 A 20 ASP H A 19 CYS HBx 1.0 1.898 4.290 2363 1739 A 20 ASP H A 19 CYS HBy 1.0 1.898 4.290 2364 1740 A 42 GLU H A 41 PRO HBx 1.0 1.712 3.252 2365 1740 A 42 GLU H A 41 PRO HBy 1.0 1.712 3.252 2366 1741 A 42 GLU H A 43 PRO HGx 1.0 1.877 4.143 2367 1741 A 42 GLU H A 43 PRO HGy 1.0 1.877 4.143 2368 1742 A 42 GLU H A 42 GLU HBx 1.0 1.815 3.755 2369 1742 A 42 GLU H A 42 GLU HBy 1.0 1.815 3.755 2370 1743 A 42 GLU H A 40 ARG HGx 1.0 1.919 4.467 2371 1743 A 42 GLU H A 40 ARG HGy 1.0 1.919 4.467 2372 1744 A 89 THR H A 88 VAL HG1% 1.0 1.718 3.280 2373 1744 A 89 THR H A 89 THR HG2% 1.0 1.718 3.280 2374 1745 A 6 PHE H A 8 LYS H 1.0 1.998 6.308 2375 1745 A 5 THR H A 8 LYS H 1.0 1.998 6.308 2376 1746 A 8 LYS H A 8 LYS HBx 1.0 1.576 2.742 2377 1746 A 8 LYS H A 7 GLN HBx 1.0 1.576 2.742 2378 1747 A 8 LYS H A 8 LYS HDx 1.0 1.713 3.255 2379 1747 A 8 LYS H A 8 LYS HDy 1.0 1.713 3.255 2380 1748 A 8 LYS H A 8 LYS HGx 1.0 1.832 3.850 2381 1748 A 8 LYS H A 8 LYS HGy 1.0 1.832 3.850 2382 1749 A 8 LYS H A 9 LYS HBx 1.0 1.937 4.645 2383 1749 A 8 LYS H A 9 LYS HBy 1.0 1.937 4.645 2384 1750 A 11 ILE HD1% A 8 LYS H 1.0 1.998 5.766 2385 1750 A 27 LEU HD1% A 8 LYS H 1.0 1.998 5.766 2386 1751 A 59 THR H A 85 LYS HGx 1.0 1.987 5.377 2387 1751 A 59 THR H A 85 LYS HGy 1.0 1.987 5.377 2388 1752 A 5 THR H A 4 LEU HG 1.0 1.884 4.186 2389 1752 A 5 THR H A 4 LEU HBy 1.0 1.884 4.186 2390 1753 A 27 LEU H A 26 ASN HBx 1.0 1.990 5.456 2391 1753 A 27 LEU H A 26 ASN HBy 1.0 1.990 5.456 2392 1754 A 32 ASP HA A 31 LYS H 1.0 1.998 5.808 2393 1754 A 23 MET HA A 31 LYS H 1.0 1.998 5.808 2394 1755 A 30 CYS HBy A 31 LYS H 1.0 1.962 4.932 2395 1755 A 29 HIS HBx A 31 LYS H 1.0 1.962 4.932 2396 1756 A 31 LYS H A 28 PHE HBx 1.0 1.926 4.538 2397 1756 A 31 LYS H A 28 PHE HBy 1.0 1.926 4.538 2398 1757 A 31 LYS H A 31 LYS HBx 1.0 1.715 3.265 2399 1757 A 31 LYS H A 31 LYS HBy 1.0 1.715 3.265 2400 1758 A 31 LYS H A 31 LYS HDx 1.0 1.656 3.028 2401 1758 A 31 LYS H A 31 LYS HDy 1.0 1.656 3.028 2402 1759 A 31 LYS HGx A 31 LYS H 1.0 1.766 3.500 2403 1759 A 31 LYS HGy A 31 LYS H 1.0 1.766 3.500 2404 1760 A 7 GLN H A 7 GLN HBx 1.0 1.751 3.425 2405 1760 A 7 GLN H A 7 GLN HBy 1.0 1.751 3.425 2406 1761 A 82 SER H A 82 SER HBx 1.0 1.820 3.782 2407 1761 A 82 SER H A 82 SER HBy 1.0 1.820 3.782 2408 1762 A 82 SER H A 65 LEU HBx 1.0 1.906 4.358 2409 1762 A 82 SER H A 65 LEU HBy 1.0 1.906 4.358 2410 1763 A 82 SER H A 81 LYS HBx 1.0 1.720 3.286 2411 1763 A 82 SER H A 81 LYS HBy 1.0 1.720 3.286 2412 1764 A 81 LYS HDy A 82 SER H 1.0 2.000 6.042 2413 1764 A 80 LYS HGx A 82 SER H 1.0 2.000 6.042 2414 1765 A 83 THR HG2% A 82 SER H 1.0 1.970 5.044 2415 1765 A 79 LEU HD2% A 82 SER H 1.0 1.970 5.044 2416 1765 A 65 LEU HD1% A 82 SER H 1.0 1.970 5.044 2417 1766 A 101 VAL H A 101 VAL HG1% 1.0 1.624 2.908 2418 1766 A 101 VAL H A 101 VAL HG2% 1.0 1.624 2.908 2419 1767 A 6 PHE HDx A 97 HIS H 1.0 1.887 4.217 2420 1767 A 6 PHE HDy A 97 HIS H 1.0 1.887 4.217 2421 1767 A 6 PHE HEy A 97 HIS H 1.0 1.887 4.217 2422 1767 A 6 PHE HEx A 97 HIS H 1.0 1.887 4.217 2423 1768 A 97 HIS H A 95 PRO HBx 1.0 1.981 5.231 2424 1768 A 88 VAL HB A 97 HIS H 1.0 1.981 5.231 2425 1769 A 88 VAL HG1% A 97 HIS H 1.0 1.957 4.875 2426 1769 A 89 THR HG2% A 97 HIS H 1.0 1.957 4.875 2427 1770 A 34 ASN H A 69 ASN HA 1.0 1.830 3.840 2428 1770 A 34 ASN H A 67 ASP HA 1.0 1.830 3.840 2429 1771 A 34 ASN H A 31 LYS HBx 1.0 1.976 6.916 2430 1771 A 34 ASN H A 31 LYS HBy 1.0 1.976 6.916 2431 1772 A 34 ASN HBy A 34 ASN H 1.0 1.685 3.141 2432 1772 A 34 ASN H A 33 LYS HBy 1.0 1.685 3.141 2433 1773 A 34 ASN H A 33 LYS HDx 1.0 1.965 4.983 2434 1773 A 34 ASN H A 33 LYS HDy 1.0 1.965 4.983 2435 1774 A 31 LYS HGx A 34 ASN H 1.0 1.807 3.709 2436 1774 A 31 LYS HGy A 34 ASN H 1.0 1.807 3.709 2437 1775 A 76 LYS H A 75 CYS HBx 1.0 1.761 3.475 2438 1775 A 76 LYS H A 75 CYS HBy 1.0 1.761 3.475 2439 1776 A 74 PRO HDy A 76 LYS H 1.0 2.000 6.166 2440 1776 A 70 VAL HA A 76 LYS H 1.0 2.000 6.166 2441 1777 A 76 LYS H A 76 LYS HBx 1.0 1.728 3.324 2442 1777 A 76 LYS H A 76 LYS HBy 1.0 1.728 3.324 2443 1778 A 76 LYS H A 76 LYS HDx 1.0 1.686 3.142 2444 1778 A 76 LYS H A 76 LYS HDy 1.0 1.686 3.142 2445 1778 A 76 LYS H A 73 ARG HBy 1.0 1.686 3.142 2446 1779 A 76 LYS H A 76 LYS HGx 1.0 1.735 3.355 2447 1779 A 76 LYS H A 76 LYS HGy 1.0 1.735 3.355 2448 1780 A 34 ASN HD2y A 34 ASN H 1.0 1.837 8.453 2449 1780 A 10 HIS H A 34 ASN HD2y 1.0 1.837 8.453 2450 1781 A 34 ASN HD2y A 36 PHE HDx 1.0 1.962 4.932 2451 1781 A 34 ASN HD2y A 36 PHE HDy 1.0 1.962 4.932 2452 1781 A 28 PHE HEy A 34 ASN HD2y 1.0 1.962 4.932 2453 1781 A 28 PHE HEx A 34 ASN HD2y 1.0 1.962 4.932 2454 1782 A 42 GLU HA A 44 VAL H 1.0 1.981 5.237 2455 1782 A 39 SER HBx A 44 VAL H 1.0 1.981 5.237 2456 1783 A 44 VAL H A 43 PRO HBx 1.0 1.946 4.738 2457 1783 A 44 VAL H A 43 PRO HBy 1.0 1.946 4.738 2458 1784 A 44 VAL H A 42 GLU HGx 1.0 1.995 6.433 2459 1784 A 44 VAL H A 42 GLU HGy 1.0 1.995 6.433 2460 1784 A 44 VAL H A 41 PRO HGy 1.0 1.995 6.433 2461 1785 A 44 VAL H A 43 PRO HGx 1.0 1.917 4.451 2462 1785 A 44 VAL H A 43 PRO HGy 1.0 1.917 4.451 2463 1786 A 21 ASN HD2x A 21 ASN HBy 1.0 1.717 3.277 2464 1786 A 20 ASP HBy A 21 ASN HD2x 1.0 1.717 3.277 2465 1786 A 21 ASN HD2x A 21 ASN HBx 1.0 1.717 3.277 2466 1787 A 21 ASN HD2y A 21 ASN HBx 1.0 1.708 3.238 2467 1787 A 21 ASN HD2y A 21 ASN HBy 1.0 1.708 3.238 2468 1787 A 21 ASN HD2y A 20 ASP HBy 1.0 1.708 3.238 2469 1788 A 48 CYS H A 46 ALA H 1.0 2.000 6.142 2470 1788 A 3 TRP HZ3 A 46 ALA H 1.0 2.000 6.142 2471 1789 A 46 ALA H A 47 ILE HG1x 1.0 1.963 4.943 2472 1789 A 46 ALA H A 45 LYS HGx 1.0 1.963 4.943 2473 1789 A 46 ALA H A 45 LYS HGy 1.0 1.963 4.943 2474 1790 A 83 THR H A 82 SER HBx 1.0 1.609 2.857 2475 1790 A 83 THR H A 82 SER HBy 1.0 1.609 2.857 2476 1791 A 9 LYS H A 6 PHE HEx 1.0 1.966 4.988 2477 1791 A 9 LYS H A 6 PHE HEy 1.0 1.966 4.988 2478 1791 A 9 LYS H A 6 PHE HDy 1.0 1.966 4.988 2479 1791 A 9 LYS H A 6 PHE HDx 1.0 1.966 4.988 2480 1792 A 10 HIS HBy A 9 LYS H 1.0 1.867 4.075 2481 1792 A 9 LYS H A 8 LYS HBy 1.0 1.867 4.075 2482 1793 A 9 LYS H A 8 LYS HDx 1.0 1.858 4.008 2483 1793 A 9 LYS H A 8 LYS HDy 1.0 1.858 4.008 2484 1794 A 9 LYS H A 8 LYS HGx 1.0 1.966 4.994 2485 1794 A 9 LYS H A 8 LYS HGy 1.0 1.966 4.994 2486 1795 A 9 LYS H A 9 LYS HBx 1.0 1.679 3.115 2487 1795 A 9 LYS H A 9 LYS HBy 1.0 1.679 3.115 2488 1796 A 9 LYS H A 9 LYS HGx 1.0 1.834 3.862 2489 1796 A 9 LYS H A 9 LYS HGy 1.0 1.834 3.862 2490 1797 A 61 SER H A 60 THR H 1.0 1.643 2.975 2491 1797 A 33 LYS H A 32 ASP H 1.0 1.643 2.975 2492 1798 A 61 SER H A 60 THR HA 1.0 1.764 3.488 2493 1798 A 33 LYS H A 32 ASP HA 1.0 1.764 3.488 2494 1799 A 61 SER H A 61 SER HBx 1.0 1.702 3.212 2495 1799 A 61 SER H A 61 SER HBy 1.0 1.702 3.212 2496 1800 A 33 LYS H A 31 LYS HBx 1.0 1.969 5.037 2497 1800 A 33 LYS H A 31 LYS HBy 1.0 1.969 5.037 2498 1801 A 33 LYS H A 33 LYS HBx 1.0 1.806 3.700 2499 1801 A 33 LYS H A 33 LYS HBy 1.0 1.806 3.700 2500 1802 A 33 LYS H A 33 LYS HDx 1.0 1.828 3.826 2501 1802 A 33 LYS H A 33 LYS HDy 1.0 1.828 3.826 2502 1803 A 61 SER H A 60 THR HG2% 1.0 1.889 4.225 2503 1803 A 61 SER H A 47 ILE HG1y 1.0 1.889 4.225 2504 1804 A 93 GLN HA A 93 GLN HE2x 1.0 2.000 6.128 2505 1804 A 22 ILE HA A 21 ASN H 1.0 2.000 6.128 2506 1805 A 21 ASN H A 21 ASN HBx 1.0 1.640 2.968 2507 1805 A 20 ASP HBy A 21 ASN H 1.0 1.640 2.968 2508 1806 A 93 GLN HE2y A 93 GLN HBx 1.0 1.969 5.035 2509 1806 A 93 GLN HE2y A 93 GLN HBy 1.0 1.969 5.035 2510 1807 A 5 THR H A 2 ASP H 1.0 1.842 3.906 2511 1807 A 2 ASP H A 6 PHE H 1.0 1.842 3.906 2512 1808 A 2 ASP H A 2 ASP HBy 1.0 1.838 3.880 2513 1808 A 2 ASP H A 2 ASP HBx 1.0 1.838 3.880 2514 1809 A 50 GLY H A 49 LYS HEx 1.0 1.974 6.944 2515 1809 A 50 GLY H A 49 LYS HEy 1.0 1.974 6.944 2516 1809 A 48 CYS HBx A 50 GLY H 1.0 1.974 6.944 2517 1810 A 51 ILE HB A 50 GLY H 1.0 1.841 3.907 2518 1810 A 50 GLY H A 49 LYS HBx 1.0 1.841 3.907 2519 1810 A 50 GLY H A 49 LYS HBy 1.0 1.841 3.907 2520 1811 A 50 GLY H A 93 GLN HBx 1.0 1.791 3.621 2521 1811 A 50 GLY H A 93 GLN HBy 1.0 1.791 3.621 2522 1812 A 50 GLY H A 49 LYS HGx 1.0 1.775 3.543 2523 1812 A 50 GLY H A 49 LYS HGy 1.0 1.775 3.543 2524 1813 A 51 ILE HG2% A 50 GLY H 1.0 1.998 6.248 2525 1813 A 52 ILE HD1% A 50 GLY H 1.0 1.998 6.248 2526 1814 A 28 PHE HDy A 29 HIS H 1.0 1.883 4.179 2527 1814 A 28 PHE HDx A 29 HIS H 1.0 1.883 4.179 2528 1814 A 26 ASN HD2x A 29 HIS H 1.0 1.883 4.179 2529 1815 A 30 CYS HA A 29 HIS H 1.0 1.960 4.912 2530 1815 A 25 THR HB A 29 HIS H 1.0 1.960 4.912 2531 1816 A 31 LYS HGx A 29 HIS H 1.0 1.997 6.331 2532 1816 A 31 LYS HGy A 29 HIS H 1.0 1.997 6.331 2533 1817 A 27 LEU HG A 29 HIS H 1.0 1.977 6.887 2534 1817 A 22 ILE HG1y A 29 HIS H 1.0 1.977 6.887 2535 1818 A 85 LYS HBx A 86 PHE H 1.0 1.718 3.276 2536 1818 A 86 PHE H A 85 LYS HBy 1.0 1.718 3.276 2537 1819 A 86 PHE H A 85 LYS HGx 1.0 1.765 3.497 2538 1819 A 86 PHE H A 85 LYS HGy 1.0 1.765 3.497 2539 1820 A 88 VAL HG1% A 86 PHE H 1.0 1.993 5.543 2540 1820 A 101 VAL HG1% A 86 PHE H 1.0 1.993 5.543 2541 1820 A 86 PHE H A 101 VAL HG2% 1.0 1.993 5.543 2542 1821 A 15 ARG H A 14 THR H 1.0 1.988 6.618 2543 1821 A 14 THR H A 12 THR H 1.0 1.988 6.618 2544 1822 A 28 PHE H A 28 PHE HBx 1.0 1.849 3.957 2545 1822 A 28 PHE H A 28 PHE HBy 1.0 1.849 3.957 2546 1823 A 28 PHE H A 27 LEU HG 1.0 1.917 4.457 2547 1823 A 28 PHE H A 22 ILE HG1y 1.0 1.917 4.457 2548 1824 A 28 PHE HA A 25 THR H 1.0 1.997 6.299 2549 1824 A 20 ASP HA A 25 THR H 1.0 1.997 6.299 2550 1825 A 25 THR H A 24 SER HBy 1.0 1.963 4.953 2551 1825 A 22 ILE HA A 25 THR H 1.0 1.963 4.953 2552 1825 A 25 THR H A 24 SER HBx 1.0 1.963 4.953 2553 1826 A 25 THR H A 28 PHE HBx 1.0 1.997 6.357 2554 1826 A 25 THR H A 28 PHE HBy 1.0 1.997 6.357 2555 1827 A 54 SER H A 54 SER HBx 1.0 1.598 2.816 2556 1827 A 54 SER H A 54 SER HBy 1.0 1.598 2.816 2557 1828 A 54 SER H A 91 GLU HBx 1.0 1.999 6.185 2558 1828 A 54 SER H A 91 GLU HBy 1.0 1.999 6.185 2559 1829 A 86 PHE HBx A 102 GLY H 1.0 1.999 6.085 2560 1829 A 84 ASN HBx A 102 GLY H 1.0 1.999 6.085 2561 1830 A 102 GLY H A 101 VAL HG2% 1.0 1.895 4.273 2562 1830 A 101 VAL HG1% A 102 GLY H 1.0 1.895 4.273 2563 1831 A 48 CYS H A 49 LYS HA 1.0 1.853 3.973 2564 1831 A 48 CYS H A 46 ALA HA 1.0 1.853 3.973 2565 1832 A 69 ASN HD2x A 80 LYS HDy 1.0 1.961 4.925 2566 1832 A 48 CYS H A 93 GLN HBy 1.0 1.961 4.925 2567 1832 A 48 CYS H A 45 LYS HBx 1.0 1.961 4.925 2568 1832 A 48 CYS H A 45 LYS HBy 1.0 1.961 4.925 2569 1833 A 80 LYS HGx A 69 ASN HD2x 1.0 1.958 4.888 2570 1833 A 48 CYS H A 46 ALA HB% 1.0 1.958 4.888 2571 1834 A 48 CYS H A 47 ILE HG1y 1.0 1.952 4.800 2572 1834 A 48 CYS H A 47 ILE HG1x 1.0 1.952 4.800 2573 1834 A 48 CYS H A 45 LYS HGx 1.0 1.952 4.800 2574 1834 A 48 CYS H A 45 LYS HGy 1.0 1.952 4.800 2575 1835 A 48 CYS H A 94 ALA HB% 1.0 1.853 8.317 2576 1835 A 70 VAL HG1% A 69 ASN HD2x 1.0 1.853 8.317 2577 1836 A 101 VAL HG1% A 84 ASN HD2x 1.0 1.856 3.998 2578 1836 A 84 ASN HD2x A 101 VAL HG2% 1.0 1.856 3.998 2579 1837 A 84 ASN HD2y A 82 SER HBx 1.0 1.990 6.548 2580 1837 A 84 ASN HD2y A 82 SER HBy 1.0 1.990 6.548 2581 1838 A 84 ASN HD2y A 101 VAL HG2% 1.0 1.759 3.463 2582 1838 A 84 ASN HD2y A 101 VAL HG1% 1.0 1.759 3.463 2583 1839 A 45 LYS HA A 48 CYS H 1.0 1.908 4.374 2584 1839 A 69 ASN HBx A 69 ASN HD2x 1.0 1.908 4.374 2585 1840 A 80 LYS HBy A 69 ASN HD2x 1.0 1.893 4.261 2586 1840 A 48 CYS H A 49 LYS HBx 1.0 1.893 4.261 2587 1840 A 48 CYS H A 49 LYS HBy 1.0 1.893 4.261 2588 1841 A 80 LYS HBx A 69 ASN HD2y 1.0 1.985 5.321 2589 1841 A 69 ASN HD2y A 33 LYS HBx 1.0 1.985 5.321 2590 1842 A 60 THR HG2% A 60 THR H 1.0 1.757 3.457 2591 1842 A 60 THR H A 47 ILE HG1y 1.0 1.757 3.457 2592 1843 A 30 CYS H A 28 PHE HDy 1.0 1.996 6.360 2593 1843 A 30 CYS H A 28 PHE HDx 1.0 1.996 6.360 2594 1843 A 30 CYS H A 26 ASN HD2x 1.0 1.996 6.360 2595 1844 A 30 CYS H A 24 SER HA 1.0 1.923 4.501 2596 1844 A 30 CYS H A 23 MET HA 1.0 1.923 4.501 2597 1845 A 30 CYS H A 31 LYS HGx 1.0 1.997 6.303 2598 1845 A 30 CYS H A 31 LYS HGy 1.0 1.997 6.303 2599 1846 A 97 HIS HA A 96 VAL H 1.0 1.976 5.148 2600 1846 A 3 TRP HA A 96 VAL H 1.0 1.976 5.148 2601 1847 A 96 VAL H A 95 PRO HDx 1.0 1.976 5.156 2602 1847 A 96 VAL H A 95 PRO HDy 1.0 1.976 5.156 2603 1847 A 89 THR HB A 96 VAL H 1.0 1.976 5.156 2604 1848 A 96 VAL H A 95 PRO HBx 1.0 1.997 5.691 2605 1848 A 96 VAL H A 95 PRO HBy 1.0 1.997 5.691 2606 1848 A 88 VAL HB A 96 VAL H 1.0 1.997 5.691 2607 1849 A 96 VAL H A 91 GLU HBx 1.0 1.978 6.866 2608 1849 A 96 VAL H A 91 GLU HBy 1.0 1.978 6.866 2609 1850 A 88 VAL HG1% A 96 VAL H 1.0 1.987 5.365 2610 1850 A 89 THR HG2% A 96 VAL H 1.0 1.987 5.365 2611 1851 A 24 SER H A 24 SER HBx 1.0 1.839 3.895 2612 1851 A 24 SER H A 24 SER HBy 1.0 1.839 3.895 2613 1852 A 7 GLN HE2y A 4 LEU HD2% 1.0 1.980 5.224 2614 1852 A 7 GLN HE2y A 4 LEU HD1% 1.0 1.980 5.224 2615 1853 A 10 HIS H A 6 PHE HEy 1.0 1.933 4.603 2616 1853 A 10 HIS H A 6 PHE HEx 1.0 1.933 4.603 2617 1853 A 10 HIS H A 6 PHE HDy 1.0 1.933 4.603 2618 1853 A 10 HIS H A 6 PHE HDx 1.0 1.933 4.603 2619 1854 A 10 HIS H A 8 LYS HBx 1.0 1.990 5.442 2620 1854 A 10 HIS H A 37 ILE HB 1.0 1.990 5.442 2621 1855 A 10 HIS H A 8 LYS HDx 1.0 1.975 5.131 2622 1855 A 10 HIS H A 8 LYS HDy 1.0 1.975 5.131 2623 1856 A 10 HIS H A 9 LYS HBx 1.0 1.722 3.294 2624 1856 A 10 HIS H A 9 LYS HBy 1.0 1.722 3.294 2625 1857 A 10 HIS H A 11 ILE HG2% 1.0 2.000 6.064 2626 1857 A 10 HIS H A 12 THR HG2% 1.0 2.000 6.064 2627 1858 A 10 HIS H A 9 LYS HGx 1.0 1.928 4.558 2628 1858 A 10 HIS H A 9 LYS HGy 1.0 1.928 4.558 2629 1859 A 10 HIS H A 27 LEU HD1% 1.0 2.000 5.896 2630 1859 A 10 HIS H A 11 ILE HD1% 1.0 2.000 5.896 2631 1860 A 93 GLN H A 91 GLU HBx 1.0 2.000 6.058 2632 1860 A 93 GLN H A 91 GLU HBy 1.0 2.000 6.058 2633 1860 A 52 ILE HB A 93 GLN H 1.0 2.000 6.058 2634 1861 A 93 GLN H A 93 GLN HBx 1.0 1.807 3.705 2635 1861 A 93 GLN H A 93 GLN HBy 1.0 1.807 3.705 2636 1862 A 93 GLN H A 55 LYS HGy 1.0 1.980 6.816 2637 1862 A 93 GLN H A 55 LYS HGx 1.0 1.980 6.816 2638 1862 A 53 ALA HB% A 93 GLN H 1.0 1.980 6.816 2639 1863 A 100 GLY H A 88 VAL HA 1.0 1.967 5.009 2640 1863 A 86 PHE HA A 100 GLY H 1.0 1.967 5.009 2641 1864 A 98 PHE HBy A 100 GLY H 1.0 1.752 9.062 2642 1864 A 86 PHE HBy A 100 GLY H 1.0 1.752 9.062 2643 1865 A 101 VAL HG1% A 100 GLY H 1.0 1.978 5.194 2644 1865 A 100 GLY H A 88 VAL HG1% 1.0 1.978 5.194 stop_ save_ save_CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_2 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 4 LEU C A 5 THR N A 5 THR CA A 5 THR C 1.0 -87.0 -51.0 PHI 2 2 A 5 THR C A 6 PHE N A 6 PHE CA A 6 PHE C 1.0 -68.0 -52.0 PHI 3 3 A 6 PHE C A 7 GLN N A 7 GLN CA A 7 GLN C 1.0 -69.0 -53.0 PHI 4 4 A 7 GLN C A 8 LYS N A 8 LYS CA A 8 LYS C 1.0 -76.0 -52.0 PHI 5 5 A 8 LYS C A 9 LYS N A 9 LYS CA A 9 LYS C 1.0 -99.0 -43.0 PHI 6 6 A 9 LYS C A 10 HIS N A 10 HIS CA A 10 HIS C 1.0 -147.0 -83.0 PHI 7 7 A 10 HIS C A 11 ILE N A 11 ILE CA A 11 ILE C 1.0 -145.0 -97.0 PHI 8 8 A 11 ILE C A 12 THR N A 12 THR CA A 12 THR C 1.0 -149.0 -85.0 PHI 9 9 A 14 THR C A 15 ARG N A 15 ARG CA A 15 ARG C 1.0 -72.0 -52.0 PHI 10 10 A 18 ASP C A 19 CYS N A 19 CYS CA A 19 CYS C 1.0 -71.0 -43.0 PHI 11 11 A 19 CYS C A 20 ASP N A 20 ASP CA A 20 ASP C 1.0 -68.0 -52.0 PHI 12 12 A 20 ASP C A 21 ASN N A 21 ASN CA A 21 ASN C 1.0 -88.0 -44.0 PHI 13 13 A 21 ASN C A 22 ILE N A 22 ILE CA A 22 ILE C 1.0 -82.0 -50.0 PHI 14 14 A 22 ILE C A 23 MET N A 23 MET CA A 23 MET C 1.0 -83.0 -47.0 PHI 15 15 A 23 MET C A 24 SER N A 24 SER CA A 24 SER C 1.0 -114.0 -42.0 PHI 16 16 A 25 THR C A 26 ASN N A 26 ASN CA A 26 ASN C 1.0 -71.0 -51.0 PHI 17 17 A 26 ASN C A 27 LEU N A 27 LEU CA A 27 LEU C 1.0 -68.0 -52.0 PHI 18 18 A 27 LEU C A 28 PHE N A 28 PHE CA A 28 PHE C 1.0 -95.0 -47.0 PHI 19 19 A 32 ASP C A 33 LYS N A 33 LYS CA A 33 LYS C 1.0 -168.0 -96.0 PHI 20 20 A 33 LYS C A 34 ASN N A 34 ASN CA A 34 ASN C 1.0 -191.0 -51.0 PHI 21 21 A 34 ASN C A 35 THR N A 35 THR CA A 35 THR C 1.0 -143.0 -75.0 PHI 22 22 A 35 THR C A 36 PHE N A 36 PHE CA A 36 PHE C 1.0 -118.0 -70.0 PHI 23 23 A 36 PHE C A 37 ILE N A 37 ILE CA A 37 ILE C 1.0 -142.0 -82.0 PHI 24 24 A 37 ILE C A 38 TYR N A 38 TYR CA A 38 TYR C 1.0 -137.0 -61.0 PHI 25 25 A 38 TYR C A 39 SER N A 39 SER CA A 39 SER C 1.0 -153.0 -61.0 PHI 26 26 A 39 SER C A 40 ARG N A 40 ARG CA A 40 ARG C 1.0 -136.0 -40.0 PHI 27 27 A 40 ARG C A 41 PRO N A 41 PRO CA A 41 PRO C 1.0 -75.0 -43.0 PHI 28 28 A 41 PRO C A 42 GLU N A 42 GLU CA A 42 GLU C 1.0 -73.0 -53.0 PHI 29 29 A 42 GLU C A 43 PRO N A 43 PRO CA A 43 PRO C 1.0 -65.0 -53.0 PHI 30 30 A 43 PRO C A 44 VAL N A 44 VAL CA A 44 VAL C 1.0 -91.0 -43.0 PHI 31 31 A 44 VAL C A 45 LYS N A 45 LYS CA A 45 LYS C 1.0 -69.0 -49.0 PHI 32 32 A 45 LYS C A 46 ALA N A 46 ALA CA A 46 ALA C 1.0 -75.0 -51.0 PHI 33 33 A 46 ALA C A 47 ILE N A 47 ILE CA A 47 ILE C 1.0 -92.0 -44.0 PHI 34 34 A 47 ILE C A 48 CYS N A 48 CYS CA A 48 CYS C 1.0 -126.0 -38.0 PHI 35 35 A 49 LYS C A 50 GLY N A 50 GLY CA A 50 GLY C 1.0 82.0 106.0 PHI 36 36 A 53 ALA C A 54 SER N A 54 SER CA A 54 SER C 1.0 -144.0 -48.0 PHI 37 37 A 54 SER C A 55 LYS N A 55 LYS CA A 55 LYS C 1.0 -176.0 -52.0 PHI 38 38 A 55 LYS C A 56 ASN N A 56 ASN CA A 56 ASN C 1.0 -139.0 -55.0 PHI 39 39 A 56 ASN C A 57 VAL N A 57 VAL CA A 57 VAL C 1.0 -141.0 -89.0 PHI 40 40 A 59 THR C A 60 THR N A 60 THR CA A 60 THR C 1.0 -100.0 -48.0 PHI 41 41 A 63 PHE C A 64 TYR N A 64 TYR CA A 64 TYR C 1.0 -140.0 -72.0 PHI 42 42 A 64 TYR C A 65 LEU N A 65 LEU CA A 65 LEU C 1.0 -136.0 -84.0 PHI 43 43 A 65 LEU C A 66 SER N A 66 SER CA A 66 SER C 1.0 -163.0 -79.0 PHI 44 44 A 66 SER C A 67 ASP N A 67 ASP CA A 67 ASP C 1.0 -140.0 -88.0 PHI 45 45 A 67 ASP C A 68 CYS N A 68 CYS CA A 68 CYS C 1.0 -160.0 -92.0 PHI 46 46 A 68 CYS C A 69 ASN N A 69 ASN CA A 69 ASN C 1.0 -162.0 -62.0 PHI 47 47 A 69 ASN C A 70 VAL N A 70 VAL CA A 70 VAL C 1.0 -135.0 -35.0 PHI 48 48 A 72 SER C A 73 ARG N A 73 ARG CA A 73 ARG C 1.0 -153.0 -41.0 PHI 49 49 A 75 CYS C A 76 LYS N A 76 LYS CA A 76 LYS C 1.0 -170.0 -102.0 PHI 50 50 A 76 LYS C A 77 TYR N A 77 TYR CA A 77 TYR C 1.0 -146.0 -50.0 PHI 51 51 A 77 TYR C A 78 LYS N A 78 LYS CA A 78 LYS C 1.0 -172.0 -56.0 PHI 52 52 A 78 LYS C A 79 LEU N A 79 LEU CA A 79 LEU C 1.0 -149.0 -73.0 PHI 53 53 A 79 LEU C A 80 LYS N A 80 LYS CA A 80 LYS C 1.0 -144.0 -60.0 PHI 54 54 A 80 LYS C A 81 LYS N A 81 LYS CA A 81 LYS C 1.0 -145.0 -81.0 PHI 55 55 A 81 LYS C A 82 SER N A 82 SER CA A 82 SER C 1.0 -195.0 -51.0 PHI 56 56 A 82 SER C A 83 THR N A 83 THR CA A 83 THR C 1.0 -164.0 -76.0 PHI 57 57 A 83 THR C A 84 ASN N A 84 ASN CA A 84 ASN C 1.0 -183.0 -47.0 PHI 58 58 A 85 LYS C A 86 PHE N A 86 PHE CA A 86 PHE C 1.0 -185.0 -85.0 PHI 59 59 A 86 PHE C A 87 ALA N A 87 ALA CA A 87 ALA C 1.0 -143.0 -87.0 PHI 60 60 A 87 ALA C A 88 VAL N A 88 VAL CA A 88 VAL C 1.0 -159.0 -107.0 PHI 61 61 A 88 VAL C A 89 THR N A 89 THR CA A 89 THR C 1.0 -140.0 -80.0 PHI 62 62 A 89 THR C A 90 CYS N A 90 CYS CA A 90 CYS C 1.0 -142.0 -54.0 PHI 63 63 A 90 CYS C A 91 GLU N A 91 GLU CA A 91 GLU C 1.0 -185.0 -33.0 PHI 64 64 A 96 VAL C A 97 HIS N A 97 HIS CA A 97 HIS C 1.0 -172.0 -72.0 PHI 65 65 A 97 HIS C A 98 PHE N A 98 PHE CA A 98 PHE C 1.0 -160.0 -64.0 PHI 66 66 A 100 GLY C A 101 VAL N A 101 VAL CA A 101 VAL C 1.0 -147.0 -55.0 PHI 67 67 A 5 THR N A 5 THR CA A 5 THR C A 6 PHE N 1.0 -60.0 -20.0 PSI 68 68 A 6 PHE N A 6 PHE CA A 6 PHE C A 7 GLN N 1.0 -58.0 -26.0 PSI 69 69 A 7 GLN N A 7 GLN CA A 7 GLN C A 8 LYS N 1.0 -54.0 -30.0 PSI 70 70 A 8 LYS N A 8 LYS CA A 8 LYS C A 9 LYS N 1.0 -56.0 -32.0 PSI 71 71 A 9 LYS N A 9 LYS CA A 9 LYS C A 10 HIS N 1.0 -58.0 -10.0 PSI 72 72 A 10 HIS N A 10 HIS CA A 10 HIS C A 11 ILE N 1.0 -12.0 20.0 PSI 73 73 A 11 ILE N A 11 ILE CA A 11 ILE C A 12 THR N 1.0 102.0 166.0 PSI 74 74 A 12 THR N A 12 THR CA A 12 THR C A 13 ASN N 1.0 88.0 184.0 PSI 75 75 A 15 ARG N A 15 ARG CA A 15 ARG C A 16 ASP N 1.0 -51.0 -31.0 PSI 76 76 A 19 CYS N A 19 CYS CA A 19 CYS C A 20 ASP N 1.0 -59.0 -31.0 PSI 77 77 A 20 ASP N A 20 ASP CA A 20 ASP C A 21 ASN N 1.0 -58.0 -14.0 PSI 78 78 A 21 ASN N A 21 ASN CA A 21 ASN C A 22 ILE N 1.0 -62.0 -18.0 PSI 79 79 A 22 ILE N A 22 ILE CA A 22 ILE C A 23 MET N 1.0 -54.0 -34.0 PSI 80 80 A 23 MET N A 23 MET CA A 23 MET C A 24 SER N 1.0 -64.0 -16.0 PSI 81 81 A 24 SER N A 24 SER CA A 24 SER C A 25 THR N 1.0 -55.0 29.0 PSI 82 82 A 26 ASN N A 26 ASN CA A 26 ASN C A 27 LEU N 1.0 -66.0 -6.0 PSI 83 83 A 27 LEU N A 27 LEU CA A 27 LEU C A 28 PHE N 1.0 -64.0 -16.0 PSI 84 84 A 28 PHE N A 28 PHE CA A 28 PHE C A 29 HIS N 1.0 -54.0 -26.0 PSI 85 85 A 33 LYS N A 33 LYS CA A 33 LYS C A 34 ASN N 1.0 139.0 171.0 PSI 86 86 A 34 ASN N A 34 ASN CA A 34 ASN C A 35 THR N 1.0 103.0 159.0 PSI 87 87 A 35 THR N A 35 THR CA A 35 THR C A 36 PHE N 1.0 90.0 150.0 PSI 88 88 A 36 PHE N A 36 PHE CA A 36 PHE C A 37 ILE N 1.0 87.0 171.0 PSI 89 89 A 37 ILE N A 37 ILE CA A 37 ILE C A 38 TYR N 1.0 94.0 154.0 PSI 90 90 A 38 TYR N A 38 TYR CA A 38 TYR C A 39 SER N 1.0 66.0 170.0 PSI 91 91 A 39 SER N A 39 SER CA A 39 SER C A 40 ARG N 1.0 85.0 177.0 PSI 92 92 A 40 ARG N A 40 ARG CA A 40 ARG C A 41 PRO N 1.0 122.0 170.0 PSI 93 93 A 41 PRO N A 41 PRO CA A 41 PRO C A 42 GLU N 1.0 -58.0 2.0 PSI 94 94 A 42 GLU N A 42 GLU CA A 42 GLU C A 43 PRO N 1.0 -68.0 -4.0 PSI 95 95 A 43 PRO N A 43 PRO CA A 43 PRO C A 44 VAL N 1.0 -49.0 -13.0 PSI 96 96 A 44 VAL N A 44 VAL CA A 44 VAL C A 45 LYS N 1.0 -59.0 -31.0 PSI 97 97 A 45 LYS N A 45 LYS CA A 45 LYS C A 46 ALA N 1.0 -55.0 -31.0 PSI 98 98 A 46 ALA N A 46 ALA CA A 46 ALA C A 47 ILE N 1.0 -54.0 -22.0 PSI 99 99 A 47 ILE N A 47 ILE CA A 47 ILE C A 48 CYS N 1.0 -48.0 -24.0 PSI 100 100 A 48 CYS N A 48 CYS CA A 48 CYS C A 49 LYS N 1.0 -61.0 23.0 PSI 101 101 A 50 GLY N A 50 GLY CA A 50 GLY C A 51 ILE N 1.0 -24.0 0.0 PSI 102 102 A 54 SER N A 54 SER CA A 54 SER C A 55 LYS N 1.0 83.0 167.0 PSI 103 103 A 55 LYS N A 55 LYS CA A 55 LYS C A 56 ASN N 1.0 84.0 144.0 PSI 104 104 A 56 ASN N A 56 ASN CA A 56 ASN C A 57 VAL N 1.0 96.0 156.0 PSI 105 105 A 57 VAL N A 57 VAL CA A 57 VAL C A 58 LEU N 1.0 109.0 145.0 PSI 106 106 A 60 THR N A 60 THR CA A 60 THR C A 61 SER N 1.0 -52.0 8.0 PSI 107 107 A 64 TYR N A 64 TYR CA A 64 TYR C A 65 LEU N 1.0 93.0 165.0 PSI 108 108 A 65 LEU N A 65 LEU CA A 65 LEU C A 66 SER N 1.0 118.0 146.0 PSI 109 109 A 66 SER N A 66 SER CA A 66 SER C A 67 ASP N 1.0 101.0 165.0 PSI 110 110 A 67 ASP N A 67 ASP CA A 67 ASP C A 68 CYS N 1.0 111.0 167.0 PSI 111 111 A 68 CYS N A 68 CYS CA A 68 CYS C A 69 ASN N 1.0 103.0 187.0 PSI 112 112 A 69 ASN N A 69 ASN CA A 69 ASN C A 70 VAL N 1.0 77.0 161.0 PSI 113 113 A 70 VAL N A 70 VAL CA A 70 VAL C A 71 THR N 1.0 85.0 169.0 PSI 114 114 A 73 ARG N A 73 ARG CA A 73 ARG C A 74 PRO N 1.0 98.0 174.0 PSI 115 115 A 76 LYS N A 76 LYS CA A 76 LYS C A 77 TYR N 1.0 106.0 190.0 PSI 116 116 A 77 TYR N A 77 TYR CA A 77 TYR C A 78 LYS N 1.0 100.0 188.0 PSI 117 117 A 78 LYS N A 78 LYS CA A 78 LYS C A 79 LEU N 1.0 104.0 152.0 PSI 118 118 A 79 LEU N A 79 LEU CA A 79 LEU C A 80 LYS N 1.0 102.0 150.0 PSI 119 119 A 80 LYS N A 80 LYS CA A 80 LYS C A 81 LYS N 1.0 101.0 149.0 PSI 120 120 A 81 LYS N A 81 LYS CA A 81 LYS C A 82 SER N 1.0 91.0 187.0 PSI 121 121 A 82 SER N A 82 SER CA A 82 SER C A 83 THR N 1.0 129.0 197.0 PSI 122 122 A 83 THR N A 83 THR CA A 83 THR C A 84 ASN N 1.0 105.0 161.0 PSI 123 123 A 84 ASN N A 84 ASN CA A 84 ASN C A 85 LYS N 1.0 104.0 192.0 PSI 124 124 A 86 PHE N A 86 PHE CA A 86 PHE C A 87 ALA N 1.0 135.0 179.0 PSI 125 125 A 87 ALA N A 87 ALA CA A 87 ALA C A 88 VAL N 1.0 108.0 176.0 PSI 126 126 A 88 VAL N A 88 VAL CA A 88 VAL C A 89 THR N 1.0 122.0 178.0 PSI 127 127 A 89 THR N A 89 THR CA A 89 THR C A 90 CYS N 1.0 109.0 149.0 PSI 128 128 A 90 CYS N A 90 CYS CA A 90 CYS C A 91 GLU N 1.0 118.0 186.0 PSI 129 129 A 91 GLU N A 91 GLU CA A 91 GLU C A 92 ASN N 1.0 108.0 164.0 PSI 130 130 A 97 HIS N A 97 HIS CA A 97 HIS C A 98 PHE N 1.0 133.0 165.0 PSI 131 131 A 98 PHE N A 98 PHE CA A 98 PHE C A 99 VAL N 1.0 92.0 172.0 PSI 132 132 A 101 VAL N A 101 VAL CA A 101 VAL C A 102 GLY N 1.0 98.0 186.0 PSI stop_ save_