data_nef_c36026_5h3m save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 36027 PDB 5H3M stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 GLU start . . 2 A 2 HIS middle . . 3 A 3 PRO middle . false 4 A 4 GLU middle . . 5 A 5 PHE middle . . 6 A 6 LEU middle . . 7 A 7 LYS middle . . 8 A 8 ALA middle . . 9 A 9 GLY middle . false 10 A 10 LYS middle . . 11 A 11 GLU middle . . 12 A 12 PRO middle . false 13 A 13 GLY middle . false 14 A 14 LEU middle . . 15 A 15 GLN middle . . 16 A 16 ILE middle . . 17 A 17 TRP middle . . 18 A 18 ARG middle . . 19 A 19 VAL middle . . 20 A 20 GLU middle . . 21 A 21 LYS middle . . 22 A 22 PHE middle . . 23 A 23 ASP middle . . 24 A 24 LEU middle . . 25 A 25 VAL middle . . 26 A 26 PRO middle . false 27 A 27 VAL middle . . 28 A 28 PRO middle . false 29 A 29 THR middle . . 30 A 30 ASN middle . . 31 A 31 LEU middle . . 32 A 32 TYR middle . . 33 A 33 GLY middle . false 34 A 34 ASP middle . . 35 A 35 PHE middle . . 36 A 36 PHE middle . . 37 A 37 THR middle . . 38 A 38 GLY middle . false 39 A 39 ASP middle . . 40 A 40 ALA middle . . 41 A 41 TYR middle . . 42 A 42 VAL middle . . 43 A 43 ILE middle . . 44 A 44 LEU middle . . 45 A 45 LYS middle . . 46 A 46 THR middle . . 47 A 47 VAL middle . . 48 A 48 GLN middle . . 49 A 49 LEU middle . . 50 A 50 ARG middle . . 51 A 51 ASN middle . . 52 A 52 GLY middle . false 53 A 53 ASN middle . . 54 A 54 LEU middle . . 55 A 55 GLN middle . . 56 A 56 TYR middle . . 57 A 57 ASP middle . . 58 A 58 LEU middle . . 59 A 59 HIS middle . . 60 A 60 TYR middle . . 61 A 61 TRP middle . . 62 A 62 LEU middle . . 63 A 63 GLY middle . false 64 A 64 ASN middle . . 65 A 65 GLU middle . . 66 A 66 CYS middle . . 67 A 67 SER middle . . 68 A 68 GLN middle . . 69 A 69 ASP middle . . 70 A 70 GLU middle . . 71 A 71 SER middle . . 72 A 72 GLY middle . false 73 A 73 ALA middle . . 74 A 74 ALA middle . . 75 A 75 ALA middle . . 76 A 76 ILE middle . . 77 A 77 PHE middle . . 78 A 78 THR middle . . 79 A 79 VAL middle . . 80 A 80 GLN middle . . 81 A 81 LEU middle . . 82 A 82 ASP middle . . 83 A 83 ASP middle . . 84 A 84 TYR middle . . 85 A 85 LEU middle . . 86 A 86 ASN middle . . 87 A 87 GLY middle . false 88 A 88 ARG middle . . 89 A 89 ALA middle . . 90 A 90 VAL middle . . 91 A 91 GLN middle . . 92 A 92 HIS middle . . 93 A 93 ARG middle . . 94 A 94 GLU middle . . 95 A 95 VAL middle . . 96 A 96 GLN middle . . 97 A 97 GLY middle . false 98 A 98 PHE middle . . 99 A 99 GLU middle . . 100 A 100 SER middle . . 101 A 101 ALA middle . . 102 A 102 THR middle . . 103 A 103 PHE middle . . 104 A 104 LEU middle . . 105 A 105 GLY middle . false 106 A 106 TYR middle . . 107 A 107 PHE middle . . 108 A 108 LYS middle . . 109 A 109 SER middle . . 110 A 110 GLY middle . false 111 A 111 LEU middle . . 112 A 112 LYS middle . . 113 A 113 TYR middle . . 114 A 114 LYS middle . . 115 A 115 LYS middle . . 116 A 116 GLY middle . false 117 A 117 GLY middle . false 118 A 118 VAL middle . . 119 A 119 ALA middle . . 120 A 120 SER middle . . 121 A 121 GLY middle . false 122 A 122 PHE middle . . 123 A 123 LYS middle . . 124 A 124 HIS middle . . 125 A 125 VAL middle . . 126 A 126 VAL middle . . 127 A 127 PRO middle . false 128 A 128 ASN middle . . 129 A 129 GLU middle . . 130 A 130 VAL middle . . 131 A 131 VAL middle . . 132 A 132 VAL middle . . 133 A 133 GLN end . . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 2 HIS H H 1 8.320 0.000 A 2 HIS HD2 H 1 7.058 0.000 A 2 HIS CD2 C 13 120.449 0.000 A 2 HIS N N 15 125.466 0.000 A 4 GLU H H 1 10.198 0.013 A 4 GLU HA H 1 4.209 0.000 A 4 GLU HBy H 1 1.819 0.000 A 4 GLU N N 15 120.413 0.011 A 5 PHE H H 1 7.998 0.002 A 5 PHE HA H 1 4.094 0.009 A 5 PHE HBx H 1 2.142 0.003 A 5 PHE HBy H 1 2.632 0.002 A 5 PHE HDx H 1 6.604 0.001 A 5 PHE HDy H 1 6.604 0.001 A 5 PHE HEx H 1 6.795 0.018 A 5 PHE HEy H 1 6.795 0.018 A 5 PHE CDx C 13 129.623 0.049 A 5 PHE CDy C 13 129.623 0.049 A 5 PHE CEx C 13 130.714 0.004 A 5 PHE CEy C 13 130.714 0.004 A 5 PHE N N 15 119.235 0.011 A 6 LEU H H 1 7.373 0.010 A 6 LEU HA H 1 4.196 0.017 A 6 LEU HBy H 1 1.748 0.004 A 6 LEU HBx H 1 1.587 0.034 A 6 LEU HDx% H 1 0.925 0.006 A 6 LEU HDy% H 1 0.919 0.001 A 6 LEU N N 15 115.938 0.011 A 7 LYS H H 1 7.282 0.010 A 7 LYS HA H 1 4.316 0.002 A 7 LYS HBy H 1 2.121 0.003 A 7 LYS HBx H 1 1.909 0.003 A 7 LYS HGx H 1 1.434 0.000 A 7 LYS HGy H 1 1.553 0.000 A 7 LYS N N 15 114.398 0.008 A 8 ALA H H 1 8.079 0.011 A 8 ALA HA H 1 4.569 0.006 A 8 ALA HB% H 1 1.381 0.005 A 8 ALA CB C 13 20.097 0.019 A 8 ALA N N 15 123.742 0.010 A 9 GLY H H 1 9.476 0.001 A 9 GLY HAx H 1 3.724 0.022 A 9 GLY HAy H 1 4.240 0.004 A 9 GLY N N 15 110.163 0.012 A 10 LYS H H 1 8.212 0.002 A 10 LYS HA H 1 4.272 0.013 A 10 LYS HBx H 1 1.769 0.003 A 10 LYS HBy H 1 1.881 0.012 A 10 LYS HGx H 1 1.289 0.000 A 10 LYS HGy H 1 1.480 0.000 A 10 LYS N N 15 118.139 0.010 A 11 GLU H H 1 8.217 0.001 A 11 GLU HA H 1 4.800 0.000 A 11 GLU HBx H 1 2.034 0.000 A 11 GLU HGy H 1 2.165 0.000 A 11 GLU N N 15 116.083 0.015 A 12 PRO HA H 1 3.963 0.007 A 12 PRO HBy H 1 2.157 0.000 A 12 PRO HBx H 1 1.911 0.000 A 13 GLY H H 1 8.739 0.002 A 13 GLY HAx H 1 3.732 0.004 A 13 GLY HAy H 1 4.474 0.012 A 13 GLY N N 15 110.874 0.014 A 14 LEU H H 1 8.316 0.004 A 14 LEU HA H 1 4.978 0.012 A 14 LEU HBy H 1 1.763 0.011 A 14 LEU HBx H 1 1.028 0.006 A 14 LEU HDx% H 1 0.181 0.006 A 14 LEU HDy% H 1 0.359 0.008 A 14 LEU HG H 1 0.881 0.000 A 14 LEU N N 15 122.311 0.018 A 15 GLN H H 1 8.486 0.001 A 15 GLN HA H 1 4.486 0.006 A 15 GLN HBx H 1 0.899 0.000 A 15 GLN HBy H 1 1.654 0.000 A 15 GLN HE2x H 1 7.529 0.004 A 15 GLN HE2y H 1 8.041 0.000 A 15 GLN HGy H 1 2.215 0.023 A 15 GLN HGx H 1 1.997 0.001 A 15 GLN N N 15 124.568 0.013 A 16 ILE H H 1 6.901 0.002 A 16 ILE HA H 1 4.970 0.007 A 16 ILE HB H 1 1.135 0.012 A 16 ILE HD1% H 1 0.199 0.006 A 16 ILE HG2% H 1 0.901 0.003 A 16 ILE CD1 C 13 13.490 0.020 A 16 ILE CG2 C 13 17.294 0.027 A 16 ILE N N 15 119.145 0.005 A 17 TRP H H 1 9.968 0.003 A 17 TRP HA H 1 5.415 0.009 A 17 TRP HBy H 1 2.928 0.008 A 17 TRP HD1 H 1 6.436 0.007 A 17 TRP HE1 H 1 11.087 0.004 A 17 TRP HE3 H 1 7.615 0.009 A 17 TRP HH2 H 1 6.749 0.018 A 17 TRP HZ2 H 1 7.094 0.005 A 17 TRP CD1 C 13 124.888 0.000 A 17 TRP CE3 C 13 123.619 0.000 A 17 TRP CH2 C 13 123.898 0.029 A 17 TRP CZ2 C 13 112.841 0.027 A 17 TRP N N 15 127.020 0.011 A 18 ARG H H 1 9.782 0.010 A 18 ARG HA H 1 4.518 0.010 A 18 ARG HBx H 1 1.482 0.000 A 18 ARG HBy H 1 2.021 0.000 A 18 ARG HGy H 1 1.526 0.003 A 18 ARG HGx H 1 0.947 0.000 A 18 ARG N N 15 124.561 0.014 A 19 VAL H H 1 8.344 0.004 A 19 VAL HA H 1 4.019 0.020 A 19 VAL HB H 1 2.067 0.006 A 19 VAL HGx% H 1 0.861 0.010 A 19 VAL HGy% H 1 0.956 0.013 A 19 VAL N N 15 126.674 0.011 A 20 GLU H H 1 8.458 0.002 A 20 GLU HA H 1 4.726 0.008 A 20 GLU HBx H 1 1.971 0.015 A 20 GLU HBy H 1 2.086 0.005 A 20 GLU HGy H 1 2.262 0.000 A 20 GLU N N 15 128.615 0.024 A 21 LYS H H 1 8.800 0.001 A 21 LYS HBx H 1 1.723 0.000 A 21 LYS N N 15 124.028 0.030 A 22 PHE H H 1 8.094 0.003 A 22 PHE HBx H 1 2.888 0.009 A 22 PHE HBy H 1 3.447 0.001 A 22 PHE HDx H 1 7.238 0.009 A 22 PHE HDy H 1 7.238 0.009 A 22 PHE HEx H 1 7.058 0.000 A 22 PHE HEy H 1 7.058 0.000 A 22 PHE HZ H 1 6.886 0.000 A 22 PHE CDx C 13 131.939 0.000 A 22 PHE CDy C 13 131.939 0.000 A 22 PHE CEx C 13 129.323 0.000 A 22 PHE CEy C 13 129.323 0.000 A 22 PHE CZ C 13 129.627 0.000 A 22 PHE N N 15 112.087 0.031 A 23 ASP H H 1 7.615 0.006 A 23 ASP HA H 1 4.703 0.004 A 23 ASP HBx H 1 2.633 0.001 A 23 ASP N N 15 117.143 0.027 A 24 LEU H H 1 7.943 0.002 A 24 LEU HA H 1 4.621 0.006 A 24 LEU HBx H 1 0.603 0.000 A 24 LEU HDx% H 1 -0.067 0.011 A 24 LEU HDy% H 1 0.222 0.009 A 24 LEU CDy C 13 24.747 0.013 A 24 LEU CDx C 13 24.205 0.018 A 24 LEU N N 15 117.970 0.034 A 25 VAL H H 1 9.029 0.003 A 25 VAL HA H 1 4.819 0.002 A 25 VAL HB H 1 2.029 0.000 A 25 VAL HGx% H 1 0.911 0.003 A 25 VAL HGy% H 1 1.023 0.002 A 25 VAL CGy C 13 21.071 0.000 A 25 VAL CGx C 13 20.714 0.024 A 25 VAL N N 15 122.746 0.023 A 26 PRO HA H 1 4.453 0.014 A 26 PRO HBy H 1 2.247 0.000 A 27 VAL H H 1 8.259 0.007 A 27 VAL HA H 1 4.437 0.000 A 27 VAL HB H 1 1.871 0.000 A 27 VAL HGx% H 1 1.194 0.007 A 27 VAL HGy% H 1 1.149 0.001 A 27 VAL CGy C 13 23.925 0.042 A 27 VAL CGx C 13 20.369 0.025 A 27 VAL N N 15 127.250 0.021 A 28 PRO HA H 1 4.489 0.000 A 28 PRO HBx H 1 1.907 0.001 A 28 PRO HBy H 1 2.338 0.010 A 29 THR H H 1 8.264 0.000 A 29 THR HA H 1 2.766 0.016 A 29 THR HB H 1 3.702 0.001 A 29 THR HG2% H 1 0.978 0.005 A 29 THR CG2 C 13 22.048 0.028 A 29 THR N N 15 114.850 0.007 A 30 ASN H H 1 8.315 0.004 A 30 ASN HA H 1 4.377 0.000 A 30 ASN HBx H 1 2.629 0.004 A 30 ASN HBy H 1 2.804 0.000 A 30 ASN N N 15 116.856 0.012 A 31 LEU H H 1 7.926 0.005 A 31 LEU HA H 1 4.406 0.006 A 31 LEU HBy H 1 1.706 0.001 A 31 LEU HBx H 1 1.571 0.026 A 31 LEU HDx% H 1 0.738 0.004 A 31 LEU HDy% H 1 0.907 0.015 A 31 LEU CDx C 13 22.669 0.013 A 31 LEU CDy C 13 25.499 0.000 A 31 LEU N N 15 119.010 0.017 A 32 TYR H H 1 7.317 0.002 A 32 TYR HA H 1 4.113 0.006 A 32 TYR HBx H 1 2.765 0.007 A 32 TYR HBy H 1 3.254 0.012 A 32 TYR HDx H 1 6.889 0.004 A 32 TYR HDy H 1 6.889 0.004 A 32 TYR HEx H 1 6.869 0.000 A 32 TYR HEy H 1 6.869 0.000 A 32 TYR CDx C 13 131.455 0.011 A 32 TYR CDy C 13 131.455 0.011 A 32 TYR CEx C 13 118.760 0.000 A 32 TYR CEy C 13 118.760 0.000 A 32 TYR N N 15 120.953 0.009 A 33 GLY H H 1 8.028 0.004 A 33 GLY HAx H 1 2.381 0.002 A 33 GLY HAy H 1 4.115 0.001 A 33 GLY N N 15 112.972 0.018 A 34 ASP H H 1 7.337 0.002 A 34 ASP HA H 1 4.855 0.000 A 34 ASP HBx H 1 1.945 0.000 A 34 ASP HBy H 1 2.637 0.000 A 34 ASP N N 15 120.932 0.016 A 35 PHE HA H 1 4.053 0.003 A 35 PHE HBx H 1 1.898 0.000 A 35 PHE HDx H 1 5.460 0.002 A 35 PHE HDy H 1 5.460 0.009 A 35 PHE HEx H 1 5.970 0.002 A 35 PHE HEy H 1 5.970 0.009 A 35 PHE HZ H 1 6.411 0.000 A 35 PHE CDx C 13 131.516 0.022 A 35 PHE CDy C 13 131.516 0.022 A 35 PHE CEx C 13 128.669 0.000 A 35 PHE CEy C 13 128.669 0.000 A 35 PHE CZ C 13 126.538 0.000 A 36 PHE H H 1 8.759 0.001 A 36 PHE HA H 1 5.372 0.008 A 36 PHE HBx H 1 3.474 0.000 A 36 PHE HBy H 1 3.563 0.017 A 36 PHE HDx H 1 7.270 0.003 A 36 PHE HDy H 1 7.270 0.003 A 36 PHE CDx C 13 132.206 0.000 A 36 PHE CDy C 13 132.206 0.000 A 36 PHE N N 15 123.294 0.012 A 37 THR H H 1 9.172 0.009 A 37 THR HA H 1 4.452 0.008 A 37 THR HB H 1 4.635 0.025 A 37 THR HG2% H 1 1.432 0.004 A 37 THR CG2 C 13 22.794 0.020 A 37 THR N N 15 114.165 0.013 A 38 GLY H H 1 8.582 0.003 A 38 GLY HAy H 1 4.047 0.012 A 38 GLY HAx H 1 3.540 0.003 A 38 GLY N N 15 108.021 0.021 A 39 ASP H H 1 7.954 0.001 A 39 ASP HA H 1 5.414 0.002 A 39 ASP HBx H 1 2.662 0.001 A 39 ASP HBy H 1 2.979 0.003 A 39 ASP N N 15 119.810 0.006 A 40 ALA H H 1 8.096 0.007 A 40 ALA HA H 1 5.973 0.005 A 40 ALA HB% H 1 1.501 0.009 A 40 ALA CB C 13 24.044 0.025 A 40 ALA N N 15 117.169 0.007 A 41 TYR H H 1 9.388 0.005 A 41 TYR HA H 1 5.732 0.006 A 41 TYR HBx H 1 2.923 0.007 A 41 TYR HBy H 1 3.244 0.006 A 41 TYR HDx H 1 7.305 0.014 A 41 TYR HDy H 1 7.305 0.014 A 41 TYR HEx H 1 7.252 0.004 A 41 TYR HEy H 1 7.252 0.004 A 41 TYR CDx C 13 134.030 0.031 A 41 TYR CDy C 13 134.030 0.031 A 41 TYR CEx C 13 118.516 0.012 A 41 TYR CEy C 13 118.516 0.012 A 41 TYR N N 15 116.184 0.009 A 42 VAL H H 1 9.702 0.007 A 42 VAL HA H 1 4.986 0.006 A 42 VAL HB H 1 1.998 0.006 A 42 VAL HGx% H 1 0.845 0.001 A 42 VAL HGy% H 1 0.974 0.010 A 42 VAL CGy C 13 21.799 0.038 A 42 VAL N N 15 120.900 0.011 A 43 ILE H H 1 10.039 0.003 A 43 ILE HA H 1 5.451 0.011 A 43 ILE HB H 1 2.253 0.020 A 43 ILE HD1% H 1 1.325 0.008 A 43 ILE HG1y H 1 2.075 0.000 A 43 ILE HG1x H 1 1.671 0.000 A 43 ILE HG2% H 1 0.972 0.005 A 43 ILE CD1 C 13 18.897 0.016 A 43 ILE CG2 C 13 22.750 0.015 A 43 ILE N N 15 128.220 0.019 A 44 LEU H H 1 9.641 0.001 A 44 LEU HA H 1 5.691 0.011 A 44 LEU HBx H 1 1.446 0.012 A 44 LEU HBy H 1 2.258 0.001 A 44 LEU HDx% H 1 0.948 0.019 A 44 LEU HDy% H 1 0.990 0.005 A 44 LEU HG H 1 1.723 0.000 A 44 LEU CDx C 13 23.236 0.030 A 44 LEU CDy C 13 27.384 0.015 A 44 LEU CG C 13 27.641 0.000 A 44 LEU N N 15 127.572 0.012 A 45 LYS H H 1 9.767 0.001 A 45 LYS HA H 1 5.042 0.004 A 45 LYS HBy H 1 2.247 0.000 A 45 LYS HBx H 1 0.939 0.008 A 45 LYS HEx H 1 2.813 0.000 A 45 LYS HGx H 1 1.219 0.000 A 45 LYS HGy H 1 1.358 0.482 A 45 LYS N N 15 134.436 0.016 A 46 THR H H 1 9.265 0.002 A 46 THR HA H 1 5.161 0.008 A 46 THR HB H 1 4.146 0.001 A 46 THR HG2% H 1 0.836 0.007 A 46 THR CG2 C 13 23.862 0.081 A 46 THR N N 15 126.696 0.012 A 47 VAL H H 1 9.113 0.003 A 47 VAL HA H 1 4.319 0.003 A 47 VAL HB H 1 1.873 0.002 A 47 VAL HGx% H 1 0.844 0.000 A 47 VAL HGy% H 1 0.826 0.002 A 47 VAL CGy C 13 21.517 0.000 A 47 VAL CGx C 13 21.056 0.000 A 47 VAL N N 15 127.223 0.008 A 48 GLN H H 1 8.822 0.000 A 48 GLN HA H 1 4.714 0.018 A 48 GLN HBx H 1 1.572 0.003 A 48 GLN HBy H 1 2.014 0.000 A 48 GLN HGx H 1 1.908 0.000 A 48 GLN HGy H 1 2.395 0.005 A 48 GLN N N 15 125.129 0.010 A 49 LEU H H 1 8.828 0.001 A 49 LEU HA H 1 4.466 0.000 A 49 LEU HBx H 1 1.559 0.002 A 49 LEU HBy H 1 1.918 0.005 A 49 LEU HDx% H 1 0.803 0.012 A 49 LEU HDy% H 1 0.765 0.015 A 49 LEU HG H 1 1.477 0.019 A 49 LEU CDy C 13 25.320 0.000 A 49 LEU CDx C 13 21.841 0.000 A 49 LEU CG C 13 26.994 0.000 A 49 LEU N N 15 128.108 0.019 A 50 ARG H H 1 8.703 0.001 A 50 ARG HA H 1 4.030 0.004 A 50 ARG HBx H 1 1.847 0.010 A 50 ARG HGx H 1 1.580 0.004 A 50 ARG N N 15 121.565 0.006 A 51 ASN H H 1 7.730 0.003 A 51 ASN HA H 1 4.486 0.004 A 51 ASN HBx H 1 2.780 0.008 A 51 ASN HBy H 1 3.178 0.015 A 51 ASN N N 15 114.063 0.008 A 52 GLY H H 1 8.047 0.006 A 52 GLY HAy H 1 4.340 0.006 A 52 GLY HAx H 1 3.516 0.003 A 52 GLY N N 15 107.733 0.020 A 53 ASN H H 1 7.991 0.001 A 53 ASN HA H 1 4.631 0.004 A 53 ASN HBx H 1 2.699 0.001 A 53 ASN HBy H 1 2.843 0.003 A 53 ASN HD2x H 1 6.949 0.000 A 53 ASN N N 15 119.831 0.006 A 54 LEU H H 1 8.236 0.004 A 54 LEU HA H 1 4.967 0.003 A 54 LEU HBx H 1 0.649 0.007 A 54 LEU HBy H 1 1.432 0.000 A 54 LEU HDx% H 1 0.786 0.011 A 54 LEU HDy% H 1 0.537 0.006 A 54 LEU HG H 1 1.631 0.004 A 54 LEU CDy C 13 25.357 0.010 A 54 LEU CDx C 13 22.479 0.037 A 54 LEU N N 15 119.179 0.005 A 55 GLN H H 1 8.868 0.003 A 55 GLN HA H 1 4.370 0.001 A 55 GLN HBx H 1 1.795 0.005 A 55 GLN HGx H 1 2.263 0.003 A 55 GLN N N 15 122.436 0.008 A 56 TYR H H 1 8.636 0.001 A 56 TYR HA H 1 5.714 0.009 A 56 TYR HBx H 1 2.638 0.005 A 56 TYR HBy H 1 2.875 0.011 A 56 TYR HDx H 1 7.094 0.006 A 56 TYR HDy H 1 7.094 0.006 A 56 TYR HEx H 1 6.858 0.011 A 56 TYR HEy H 1 6.858 0.011 A 56 TYR CDx C 13 133.617 0.146 A 56 TYR CDy C 13 133.617 0.146 A 56 TYR CEx C 13 118.451 0.000 A 56 TYR CEy C 13 118.451 0.000 A 56 TYR N N 15 122.642 0.009 A 57 ASP H H 1 9.147 0.003 A 57 ASP HA H 1 5.456 0.004 A 57 ASP HBx H 1 2.808 0.003 A 57 ASP N N 15 123.157 0.008 A 58 LEU H H 1 9.333 0.003 A 58 LEU HA H 1 5.532 0.011 A 58 LEU HBx H 1 1.221 0.020 A 58 LEU HBy H 1 1.636 0.007 A 58 LEU HDx% H 1 0.917 0.004 A 58 LEU HDy% H 1 0.895 0.002 A 58 LEU CDx C 13 25.098 0.020 A 58 LEU CDy C 13 27.137 0.037 A 58 LEU N N 15 127.067 0.019 A 59 HIS H H 1 10.432 0.003 A 59 HIS HA H 1 6.118 0.007 A 59 HIS HBx H 1 3.088 0.001 A 59 HIS HBy H 1 3.462 0.012 A 59 HIS HD2 H 1 7.187 0.000 A 59 HIS N N 15 124.222 0.012 A 60 TYR H H 1 8.641 0.004 A 60 TYR HA H 1 6.041 0.011 A 60 TYR HBx H 1 2.923 0.007 A 60 TYR HBy H 1 3.443 0.000 A 60 TYR HDx H 1 7.009 0.003 A 60 TYR HEx H 1 6.749 0.010 A 60 TYR CDx C 13 133.961 0.053 A 60 TYR CEx C 13 116.844 0.000 A 60 TYR N N 15 120.062 0.018 A 61 TRP H H 1 9.411 0.006 A 61 TRP HA H 1 5.357 0.002 A 61 TRP HBy H 1 3.029 0.009 A 61 TRP HBx H 1 2.290 0.014 A 61 TRP HD1 H 1 6.098 0.006 A 61 TRP HE1 H 1 11.235 0.002 A 61 TRP HE3 H 1 7.765 0.000 A 61 TRP HZ2 H 1 7.058 0.000 A 61 TRP CD1 C 13 126.370 0.000 A 61 TRP CE3 C 13 122.076 0.000 A 61 TRP CZ2 C 13 112.380 0.000 A 61 TRP N N 15 124.645 0.012 A 61 TRP NE1 N 15 129.133 0.016 A 62 LEU H H 1 7.739 0.010 A 62 LEU HA H 1 4.620 0.005 A 62 LEU HBx H 1 1.183 0.003 A 62 LEU HBy H 1 1.668 0.011 A 62 LEU HDx% H 1 0.872 0.010 A 62 LEU HDy% H 1 1.019 0.012 A 62 LEU HG H 1 1.697 0.000 A 62 LEU CDy C 13 25.507 0.000 A 62 LEU CDx C 13 24.511 0.013 A 62 LEU N N 15 125.057 0.008 A 63 GLY H H 1 7.463 0.002 A 63 GLY HAy H 1 4.062 0.021 A 63 GLY HAx H 1 3.615 0.016 A 63 GLY N N 15 112.834 0.015 A 64 ASN H H 1 8.919 0.003 A 64 ASN HA H 1 4.300 0.024 A 64 ASN HBy H 1 2.652 0.006 A 64 ASN HD2y H 1 7.450 0.000 A 64 ASN N N 15 120.454 0.013 A 64 ASN ND2 N 15 109.860 0.000 A 65 GLU H H 1 8.122 0.001 A 65 GLU HA H 1 4.542 0.002 A 65 GLU HBx H 1 1.476 0.003 A 65 GLU HBy H 1 2.338 0.002 A 65 GLU HGy H 1 2.149 0.002 A 65 GLU N N 15 115.897 0.006 A 66 CYS H H 1 7.413 0.007 A 66 CYS HA H 1 4.471 0.000 A 66 CYS HBx H 1 2.630 0.004 A 66 CYS HBy H 1 2.812 0.011 A 66 CYS N N 15 121.532 0.009 A 67 SER H H 1 8.981 0.012 A 67 SER HA H 1 4.488 0.000 A 67 SER HBy H 1 4.266 0.000 A 67 SER HBx H 1 4.101 0.010 A 67 SER N N 15 124.031 0.013 A 68 GLN H H 1 9.089 0.001 A 68 GLN HA H 1 4.376 0.015 A 68 GLN HBx H 1 2.079 0.002 A 68 GLN HGx H 1 2.417 0.000 A 68 GLN N N 15 122.222 0.007 A 69 ASP H H 1 8.549 0.002 A 69 ASP HA H 1 4.352 0.002 A 69 ASP HBy H 1 2.590 0.006 A 69 ASP N N 15 119.152 0.007 A 70 GLU H H 1 7.623 0.002 A 70 GLU HA H 1 4.065 0.021 A 70 GLU HBy H 1 1.910 0.006 A 70 GLU HBx H 1 1.716 0.005 A 70 GLU HGx H 1 2.095 0.002 A 70 GLU HGy H 1 2.438 0.172 A 70 GLU N N 15 121.779 0.012 A 71 SER H H 1 8.416 0.003 A 71 SER HA H 1 4.029 0.031 A 71 SER HBy H 1 3.898 0.010 A 71 SER HBx H 1 3.689 0.008 A 71 SER N N 15 115.740 0.017 A 72 GLY H H 1 8.335 0.012 A 72 GLY HAx H 1 3.736 0.015 A 72 GLY HAy H 1 3.853 0.011 A 72 GLY N N 15 110.730 0.007 A 73 ALA H H 1 7.662 0.002 A 73 ALA HA H 1 3.855 0.006 A 73 ALA HB% H 1 1.311 0.009 A 73 ALA CB C 13 18.075 0.027 A 73 ALA N N 15 123.848 0.008 A 74 ALA H H 1 7.952 0.001 A 74 ALA HA H 1 3.806 0.011 A 74 ALA HB% H 1 1.456 0.013 A 74 ALA CB C 13 18.835 0.021 A 74 ALA N N 15 119.247 0.011 A 75 ALA H H 1 7.244 0.002 A 75 ALA HA H 1 3.077 0.003 A 75 ALA HB% H 1 1.268 0.014 A 75 ALA CB C 13 17.852 0.023 A 75 ALA N N 15 120.617 0.007 A 76 ILE H H 1 7.579 0.002 A 76 ILE HA H 1 3.658 0.005 A 76 ILE HB H 1 1.661 0.009 A 76 ILE HD1% H 1 0.684 0.002 A 76 ILE HG1y H 1 1.484 0.007 A 76 ILE HG1x H 1 1.056 0.006 A 76 ILE HG2% H 1 0.682 0.003 A 76 ILE CD1 C 13 12.466 0.019 A 76 ILE CG2 C 13 17.091 0.025 A 76 ILE N N 15 119.580 0.006 A 77 PHE H H 1 8.733 0.001 A 77 PHE HA H 1 4.406 0.005 A 77 PHE HBx H 1 2.908 0.008 A 77 PHE HDx H 1 7.016 0.010 A 77 PHE CDx C 13 130.701 0.053 A 77 PHE N N 15 119.027 0.004 A 78 THR H H 1 7.705 0.001 A 78 THR HA H 1 3.641 0.004 A 78 THR HB H 1 4.102 0.003 A 78 THR HG2% H 1 1.188 0.005 A 78 THR CG2 C 13 21.581 0.020 A 78 THR N N 15 115.502 0.011 A 79 VAL H H 1 7.373 0.002 A 79 VAL HA H 1 3.562 0.012 A 79 VAL HB H 1 2.181 0.010 A 79 VAL HGx% H 1 0.916 0.017 A 79 VAL HGy% H 1 1.058 0.003 A 79 VAL CGx C 13 21.150 0.000 A 79 VAL CGy C 13 22.974 0.000 A 79 VAL N N 15 122.273 0.009 A 80 GLN H H 1 8.340 0.001 A 80 GLN HA H 1 4.086 0.005 A 80 GLN HBx H 1 2.343 0.003 A 80 GLN HBy H 1 2.428 0.000 A 80 GLN HGy H 1 2.652 0.008 A 80 GLN N N 15 118.655 0.014 A 81 LEU H H 1 8.669 0.008 A 81 LEU HA H 1 3.345 0.000 A 81 LEU HBy H 1 1.395 0.008 A 81 LEU HBx H 1 0.911 0.049 A 81 LEU HDx% H 1 0.007 0.000 A 81 LEU HDy% H 1 0.185 0.006 A 81 LEU HG H 1 0.927 0.001 A 81 LEU CDx C 13 22.573 0.023 A 81 LEU CDy C 13 25.361 0.009 A 81 LEU CG C 13 26.965 0.011 A 81 LEU N N 15 123.628 0.017 A 82 ASP H H 1 8.076 0.002 A 82 ASP HA H 1 4.096 0.006 A 82 ASP HBy H 1 3.149 0.002 A 82 ASP HBx H 1 2.588 0.015 A 82 ASP N N 15 118.556 0.014 A 83 ASP H H 1 8.471 0.004 A 83 ASP HA H 1 4.250 0.012 A 83 ASP HBx H 1 2.686 0.006 A 83 ASP HBy H 1 2.856 0.011 A 83 ASP N N 15 119.420 0.016 A 84 TYR H H 1 8.009 0.006 A 84 TYR HA H 1 4.130 0.018 A 84 TYR HBy H 1 3.127 0.008 A 84 TYR HDx H 1 6.967 0.004 A 84 TYR HDy H 1 6.967 0.004 A 84 TYR HEx H 1 6.810 0.011 A 84 TYR HEy H 1 6.810 0.011 A 84 TYR CDx C 13 132.649 0.000 A 84 TYR CDy C 13 132.649 0.000 A 84 TYR CEx C 13 118.750 0.064 A 84 TYR CEy C 13 118.750 0.064 A 84 TYR N N 15 123.524 0.009 A 85 LEU H H 1 7.655 0.001 A 85 LEU HA H 1 4.104 0.000 A 85 LEU HBy H 1 1.671 0.007 A 85 LEU HBx H 1 1.374 0.009 A 85 LEU HDx% H 1 0.075 0.021 A 85 LEU HDy% H 1 0.336 0.008 A 85 LEU CDy C 13 25.763 0.020 A 85 LEU CDx C 13 21.044 0.024 A 85 LEU N N 15 119.464 0.007 A 86 ASN H H 1 7.947 0.004 A 86 ASN HA H 1 4.410 0.001 A 86 ASN HBx H 1 2.737 0.004 A 86 ASN HBy H 1 3.074 0.001 A 86 ASN N N 15 115.800 0.007 A 87 GLY H H 1 8.908 0.002 A 87 GLY HAx H 1 3.729 0.002 A 87 GLY HAy H 1 3.896 0.004 A 87 GLY N N 15 106.422 0.027 A 88 ARG H H 1 7.290 0.002 A 88 ARG HA H 1 4.331 0.003 A 88 ARG HBy H 1 2.337 0.006 A 88 ARG HBx H 1 1.860 0.005 A 88 ARG HGy H 1 1.698 0.026 A 88 ARG N N 15 116.031 0.009 A 89 ALA H H 1 8.183 0.004 A 89 ALA HA H 1 4.952 0.003 A 89 ALA HB% H 1 1.091 0.006 A 89 ALA CB C 13 20.846 0.029 A 89 ALA N N 15 121.392 0.019 A 90 VAL H H 1 8.006 0.001 A 90 VAL HA H 1 3.955 0.005 A 90 VAL HB H 1 2.202 0.012 A 90 VAL HGx% H 1 0.614 0.002 A 90 VAL HGy% H 1 1.038 0.007 A 90 VAL CGx C 13 21.419 0.000 A 90 VAL CGy C 13 21.620 0.000 A 90 VAL N N 15 124.598 0.015 A 91 GLN H H 1 8.534 0.011 A 91 GLN HA H 1 5.043 0.005 A 91 GLN HBx H 1 1.823 0.001 A 91 GLN HBy H 1 1.992 0.006 A 91 GLN HGy H 1 2.272 0.003 A 91 GLN N N 15 126.474 0.010 A 92 HIS H H 1 8.640 0.006 A 92 HIS HA H 1 4.735 0.000 A 92 HIS HBx H 1 2.621 0.001 A 92 HIS HBy H 1 3.145 0.001 A 92 HIS HD2 H 1 6.299 0.003 A 92 HIS HE1 H 1 6.867 0.007 A 92 HIS CD2 C 13 121.204 0.000 A 92 HIS CE1 C 13 136.590 0.000 A 92 HIS N N 15 118.054 0.019 A 93 ARG H H 1 8.736 0.001 A 93 ARG HA H 1 3.515 0.001 A 93 ARG HBx H 1 1.368 0.007 A 93 ARG HBy H 1 1.551 0.002 A 93 ARG HGx H 1 0.888 0.000 A 93 ARG N N 15 127.065 0.014 A 94 GLU H H 1 8.784 0.005 A 94 GLU HA H 1 4.963 0.007 A 94 GLU HBx H 1 1.408 0.000 A 94 GLU HBy H 1 1.576 0.000 A 94 GLU HGy H 1 2.012 0.000 A 94 GLU HGx H 1 1.253 0.000 A 94 GLU N N 15 126.603 0.016 A 95 VAL H H 1 7.764 0.005 A 95 VAL HA H 1 3.871 0.003 A 95 VAL HB H 1 1.746 0.006 A 95 VAL HGx% H 1 0.680 0.009 A 95 VAL HGy% H 1 0.834 0.010 A 95 VAL CGx C 13 21.138 0.000 A 95 VAL CGy C 13 21.198 0.000 A 95 VAL N N 15 120.204 0.011 A 96 GLN H H 1 6.819 0.009 A 96 GLN HA H 1 3.793 0.026 A 96 GLN HBx H 1 1.387 0.017 A 96 GLN HBy H 1 1.667 0.002 A 96 GLN HE2x H 1 6.189 0.000 A 96 GLN HE2y H 1 6.372 0.000 A 96 GLN N N 15 124.724 0.014 A 97 GLY H H 1 8.345 0.002 A 97 GLY HAx H 1 3.662 0.004 A 97 GLY HAy H 1 3.973 0.001 A 97 GLY N N 15 116.525 0.011 A 98 PHE H H 1 8.493 0.005 A 98 PHE HA H 1 4.835 0.001 A 98 PHE HBy H 1 3.465 0.004 A 98 PHE HBx H 1 2.372 0.003 A 98 PHE HDx H 1 7.152 0.001 A 98 PHE CDx C 13 132.431 0.000 A 98 PHE N N 15 120.233 0.016 A 99 GLU H H 1 10.238 0.002 A 99 GLU HA H 1 4.355 0.004 A 99 GLU HBx H 1 1.914 0.001 A 99 GLU HBy H 1 2.119 0.005 A 99 GLU HGx H 1 2.540 0.004 A 99 GLU N N 15 125.216 0.012 A 100 SER H H 1 10.123 0.003 A 100 SER HA H 1 4.226 0.002 A 100 SER HBy H 1 4.373 0.024 A 100 SER N N 15 118.443 0.018 A 101 ALA H H 1 8.807 0.001 A 101 ALA HA H 1 4.002 0.002 A 101 ALA HB% H 1 1.435 0.004 A 101 ALA CB C 13 17.857 0.000 A 101 ALA N N 15 123.837 0.032 A 102 THR H H 1 7.965 0.012 A 102 THR HA H 1 3.568 0.024 A 102 THR HB H 1 3.793 0.003 A 102 THR HG2% H 1 1.090 0.002 A 102 THR CG2 C 13 21.776 0.032 A 102 THR N N 15 113.825 0.004 A 103 PHE H H 1 7.344 0.012 A 103 PHE HA H 1 2.796 0.034 A 103 PHE HBx H 1 2.692 0.002 A 103 PHE HBy H 1 2.943 0.007 A 103 PHE HDx H 1 6.438 0.006 A 103 PHE HEx H 1 6.919 0.000 A 103 PHE CDx C 13 131.623 0.000 A 103 PHE CEx C 13 130.626 0.003 A 103 PHE N N 15 120.947 0.027 A 104 LEU H H 1 8.226 0.001 A 104 LEU HA H 1 3.811 0.006 A 104 LEU HBy H 1 1.710 0.023 A 104 LEU HBx H 1 1.407 0.008 A 104 LEU HDx% H 1 0.865 0.006 A 104 LEU HDy% H 1 0.847 0.001 A 104 LEU HG H 1 1.781 0.000 A 104 LEU CDx C 13 23.014 0.024 A 104 LEU CDy C 13 25.409 0.024 A 104 LEU N N 15 115.759 0.014 A 105 GLY H H 1 7.529 0.003 A 105 GLY HAx H 1 3.646 0.003 A 105 GLY HAy H 1 3.827 0.001 A 105 GLY N N 15 103.854 0.008 A 106 TYR H H 1 7.078 0.001 A 106 TYR HA H 1 4.321 0.012 A 106 TYR HBx H 1 1.883 0.007 A 106 TYR HBy H 1 2.157 0.005 A 106 TYR HDx H 1 6.346 0.010 A 106 TYR HEx H 1 6.188 0.017 A 106 TYR CDx C 13 130.944 0.000 A 106 TYR CEx C 13 117.345 0.000 A 106 TYR N N 15 118.017 0.012 A 107 PHE H H 1 7.109 0.002 A 107 PHE HA H 1 4.452 0.001 A 107 PHE HBy H 1 2.939 0.003 A 107 PHE HBx H 1 2.583 0.006 A 107 PHE HDx H 1 6.886 0.006 A 107 PHE HEx H 1 6.050 0.004 A 107 PHE HZ H 1 6.502 0.007 A 107 PHE CDx C 13 132.968 0.029 A 107 PHE CEx C 13 130.544 0.018 A 107 PHE CZ C 13 127.235 0.000 A 107 PHE N N 15 117.049 0.011 A 108 LYS H H 1 8.590 0.009 A 108 LYS HA H 1 4.026 0.021 A 108 LYS HBx H 1 1.808 0.001 A 108 LYS HGx H 1 1.440 0.005 A 108 LYS N N 15 124.192 0.014 A 109 SER H H 1 8.427 0.005 A 109 SER HA H 1 4.560 0.001 A 109 SER HBx H 1 3.886 0.003 A 109 SER N N 15 112.982 0.013 A 110 GLY H H 1 7.591 0.002 A 110 GLY HAx H 1 3.724 0.001 A 110 GLY HAy H 1 4.074 0.005 A 110 GLY N N 15 108.742 0.020 A 111 LEU H H 1 8.097 0.005 A 111 LEU HA H 1 4.283 0.001 A 111 LEU HBx H 1 0.812 0.009 A 111 LEU HBy H 1 1.131 0.016 A 111 LEU HDx% H 1 0.132 0.005 A 111 LEU HDy% H 1 0.489 0.007 A 111 LEU CDx C 13 24.644 0.008 A 111 LEU CDy C 13 25.794 0.006 A 111 LEU N N 15 120.361 0.009 A 112 LYS H H 1 8.394 0.005 A 112 LYS HA H 1 4.139 0.005 A 112 LYS HBy H 1 1.610 0.007 A 112 LYS HBx H 1 1.421 0.000 A 112 LYS HGx H 1 1.104 0.000 A 112 LYS N N 15 123.407 0.009 A 113 TYR H H 1 8.132 0.009 A 113 TYR HA H 1 5.508 0.000 A 113 TYR HBy H 1 2.940 0.006 A 113 TYR HBx H 1 2.836 0.005 A 113 TYR HDx H 1 7.075 0.008 A 113 TYR HEx H 1 6.876 0.000 A 113 TYR CDx C 13 132.367 0.000 A 113 TYR CEx C 13 119.097 0.001 A 113 TYR N N 15 122.661 0.015 A 114 LYS H H 1 8.888 0.011 A 114 LYS HA H 1 4.549 0.000 A 114 LYS HBx H 1 0.887 0.012 A 114 LYS HGy H 1 1.038 0.010 A 114 LYS N N 15 125.599 0.015 A 115 LYS H H 1 8.520 0.006 A 115 LYS HA H 1 4.552 0.000 A 115 LYS HBy H 1 1.814 0.005 A 115 LYS HGx H 1 1.468 0.002 A 115 LYS N N 15 123.732 0.012 A 116 GLY H H 1 8.415 0.009 A 116 GLY HAy H 1 4.253 0.000 A 116 GLY HAx H 1 3.771 0.002 A 116 GLY N N 15 112.354 0.016 A 117 GLY H H 1 7.809 0.004 A 117 GLY HAy H 1 4.245 0.000 A 117 GLY N N 15 106.656 0.024 A 118 VAL H H 1 9.348 0.006 A 118 VAL HA H 1 3.781 0.014 A 118 VAL HB H 1 1.925 0.003 A 118 VAL HGx% H 1 0.776 0.012 A 118 VAL CGx C 13 20.864 0.005 A 118 VAL N N 15 122.178 0.017 A 119 ALA H H 1 8.842 0.003 A 119 ALA HA H 1 4.333 0.001 A 119 ALA HB% H 1 1.424 0.000 A 119 ALA CB C 13 18.951 0.000 A 119 ALA N N 15 126.464 0.013 A 120 SER H H 1 8.286 0.009 A 120 SER HA H 1 4.332 0.011 A 120 SER HBy H 1 3.828 0.011 A 120 SER N N 15 115.084 0.011 A 121 GLY H H 1 8.464 0.005 A 121 GLY HAx H 1 3.821 0.000 A 121 GLY N N 15 111.252 0.023 A 122 PHE H H 1 7.878 0.003 A 122 PHE HA H 1 4.587 0.007 A 122 PHE HBy H 1 3.153 0.006 A 122 PHE HBx H 1 2.806 0.003 A 122 PHE HDx H 1 7.125 0.009 A 122 PHE CDx C 13 131.904 0.000 A 122 PHE N N 15 119.057 0.015 A 123 LYS H H 1 8.308 0.006 A 123 LYS HA H 1 4.258 0.000 A 123 LYS HBy H 1 1.730 0.000 A 123 LYS N N 15 122.296 0.023 A 124 HIS HA H 1 4.714 0.000 A 124 HIS HBx H 1 3.200 0.000 A 125 VAL H H 1 8.284 0.002 A 125 VAL HA H 1 4.095 0.008 A 125 VAL HB H 1 1.977 0.000 A 125 VAL HGx% H 1 0.877 0.000 A 125 VAL N N 15 122.973 0.007 A 126 VAL H H 1 8.311 0.002 A 126 VAL HA H 1 4.392 0.000 A 126 VAL HB H 1 2.033 0.000 A 126 VAL HGx% H 1 0.888 0.000 A 126 VAL N N 15 126.114 0.026 A 127 PRO HA H 1 4.352 0.000 A 127 PRO HBx H 1 1.895 0.000 A 127 PRO HBy H 1 2.263 0.000 A 128 ASN H H 1 8.461 0.001 A 128 ASN HA H 1 4.572 0.004 A 128 ASN HBx H 1 2.757 0.004 A 128 ASN N N 15 118.716 0.011 A 129 GLU H H 1 8.330 0.001 A 129 GLU HA H 1 4.239 0.005 A 129 GLU HBx H 1 1.925 0.000 A 129 GLU HGy H 1 2.224 0.003 A 129 GLU N N 15 120.831 0.010 A 130 VAL H H 1 8.095 0.000 A 130 VAL HA H 1 4.011 0.000 A 130 VAL HB H 1 2.013 0.000 A 130 VAL HGx% H 1 0.909 0.000 A 130 VAL N N 15 121.797 0.013 A 131 VAL H H 1 8.093 0.001 A 131 VAL HA H 1 3.987 0.000 A 131 VAL HB H 1 2.012 0.000 A 131 VAL HGx% H 1 0.889 0.000 A 131 VAL N N 15 124.617 0.006 A 132 VAL H H 1 8.168 0.000 A 132 VAL HA H 1 3.977 0.005 A 132 VAL HB H 1 1.989 0.011 A 132 VAL HGx% H 1 0.881 0.007 A 132 VAL N N 15 124.161 0.006 A 133 GLN H H 1 8.344 0.000 A 133 GLN HA H 1 4.227 0.000 A 133 GLN HGx H 1 2.329 0.000 A 133 GLN N N 15 123.772 0.012 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 3 PRO HA A 6 LEU H 1.0 1.80 3.5 2 2 A 4 GLU HA A 7 LYS H 1.0 1.80 3.5 3 3 A 4 GLU HA A 5 PHE H 1.0 1.80 5.0 4 4 A 5 PHE H A 4 GLU HBx 1.0 1.80 4.5 5 4 A 5 PHE H A 4 GLU HBy 1.0 1.80 4.5 6 5 A 5 PHE H A 4 GLU H 1.0 1.80 3.5 7 6 A 5 PHE H A 5 PHE HA 1.0 1.80 2.9 8 7 A 6 LEU H A 5 PHE HA 1.0 1.80 3.5 9 8 A 5 PHE HA A 8 ALA H 1.0 1.80 3.5 10 9 A 5 PHE H A 5 PHE HBx 1.0 1.80 3.5 11 9 A 5 PHE H A 5 PHE HBy 1.0 1.80 3.5 12 10 A 6 LEU H A 5 PHE HBx 1.0 1.80 6.0 13 10 A 6 LEU H A 5 PHE HBy 1.0 1.80 6.0 14 11 A 5 PHE H A 5 PHE HD% 1.0 1.80 5.5 15 12 A 6 LEU H A 5 PHE H 1.0 1.80 2.9 16 13 A 6 LEU H A 6 LEU HA 1.0 1.80 2.9 17 14 A 7 LYS H A 6 LEU HA 1.0 1.80 3.5 18 15 A 6 LEU H A 6 LEU HBy 1.0 1.80 3.5 19 15 A 6 LEU H A 6 LEU HBx 1.0 1.80 3.5 20 16 A 7 LYS H A 6 LEU HBy 1.0 1.80 4.5 21 16 A 7 LYS H A 6 LEU HBx 1.0 1.80 4.5 22 17 A 6 LEU H A 6 LEU HDx% 1.0 1.80 5.2 23 17 A 6 LEU H A 6 LEU HDy% 1.0 1.80 5.2 24 18 A 7 LYS H A 6 LEU HDx% 1.0 1.80 7.4 25 18 A 7 LYS H A 6 LEU HDy% 1.0 1.80 7.4 26 19 A 6 LEU H A 7 LYS H 1.0 1.80 2.9 27 20 A 7 LYS H A 7 LYS HA 1.0 1.80 3.5 28 21 A 8 ALA H A 7 LYS HA 1.0 1.80 3.5 29 22 A 7 LYS H A 7 LYS HBy 1.0 1.80 4.1 30 22 A 7 LYS H A 7 LYS HBx 1.0 1.80 4.1 31 23 A 8 ALA H A 7 LYS HBy 1.0 1.80 6.0 32 23 A 8 ALA H A 7 LYS HBx 1.0 1.80 6.0 33 24 A 7 LYS H A 7 LYS HGx 1.0 1.80 4.5 34 24 A 7 LYS H A 7 LYS HGy 1.0 1.80 4.5 35 25 A 8 ALA H A 7 LYS HGx 1.0 1.80 6.0 36 25 A 8 ALA H A 7 LYS HGy 1.0 1.80 6.0 37 26 A 7 LYS H A 8 ALA H 1.0 1.80 2.9 38 27 A 8 ALA HA A 10 LYS H 1.0 1.80 5.0 39 28 A 8 ALA HA A 15 GLN HE2x 1.0 1.80 3.5 40 29 A 8 ALA H A 8 ALA HA 1.0 1.80 3.5 41 30 A 8 ALA HA A 9 GLY H 1.0 1.80 2.9 42 31 A 15 GLN HE2x A 8 ALA HB% 1.0 1.80 6.5 43 31 A 8 ALA HB% A 15 GLN HE2y 1.0 1.80 6.5 44 32 A 8 ALA H A 8 ALA HB% 1.0 1.80 4.0 45 33 A 9 GLY H A 8 ALA HB% 1.0 1.80 5.0 46 34 A 8 ALA H A 9 GLY H 1.0 1.80 5.0 47 35 A 10 LYS H A 9 GLY HAx 1.0 1.80 3.9 48 35 A 10 LYS H A 9 GLY HAy 1.0 1.80 3.9 49 36 A 11 GLU H A 9 GLY HAx 1.0 1.80 6.0 50 36 A 9 GLY HAy A 11 GLU H 1.0 1.80 6.0 51 37 A 9 GLY H A 9 GLY HAx 1.0 1.80 3.5 52 37 A 9 GLY H A 9 GLY HAy 1.0 1.80 3.5 53 38 A 17 TRP HH2 A 9 GLY HAx 1.0 3.90 5.6 54 38 A 9 GLY HAy A 17 TRP HH2 1.0 3.90 5.6 55 39 A 10 LYS H A 9 GLY H 1.0 1.80 3.5 56 40 A 9 GLY H A 11 GLU H 1.0 1.80 5.0 57 41 A 9 GLY H A 56 TYR HE% 1.0 1.80 7.0 58 42 A 15 GLN HE2x A 9 GLY H 1.0 1.80 5.0 59 42 A 9 GLY H A 15 GLN HE2y 1.0 1.80 5.0 60 43 A 9 GLY H A 44 LEU HA 1.0 1.80 5.0 61 44 A 9 GLY H A 44 LEU HDx% 1.0 1.80 5.9 62 44 A 9 GLY H A 44 LEU HDy% 1.0 1.80 5.9 63 45 A 9 GLY H A 56 TYR HE% 1.0 1.80 7.0 64 46 A 10 LYS H A 10 LYS HA 1.0 1.80 2.9 65 47 A 11 GLU H A 10 LYS HA 1.0 1.80 3.5 66 48 A 10 LYS H A 10 LYS HBx 1.0 1.80 3.5 67 48 A 10 LYS H A 10 LYS HBy 1.0 1.80 3.5 68 49 A 11 GLU H A 10 LYS HBx 1.0 1.80 3.9 69 49 A 11 GLU H A 10 LYS HBy 1.0 1.80 3.9 70 50 A 10 LYS H A 10 LYS HGx 1.0 1.80 3.9 71 50 A 10 LYS H A 10 LYS HGy 1.0 1.80 3.9 72 51 A 10 LYS H A 15 GLN HE2x 1.0 1.80 5.0 73 52 A 10 LYS H A 44 LEU HDx% 1.0 1.80 7.4 74 52 A 10 LYS H A 44 LEU HDy% 1.0 1.80 7.4 75 53 A 10 LYS H A 56 TYR HE% 1.0 1.80 7.0 76 54 A 11 GLU H A 11 GLU HA 1.0 1.80 3.5 77 55 A 11 GLU H A 11 GLU HBx 1.0 1.80 4.1 78 55 A 11 GLU H A 11 GLU HBy 1.0 1.80 4.1 79 56 A 11 GLU H A 11 GLU HGx 1.0 1.80 4.5 80 56 A 11 GLU H A 11 GLU HGy 1.0 1.80 4.5 81 57 A 11 GLU H A 46 THR HG2% 1.0 1.80 6.5 82 58 A 11 GLU H A 54 LEU HDx% 1.0 1.80 5.9 83 58 A 11 GLU H A 54 LEU HDy% 1.0 1.80 5.9 84 59 A 12 PRO HA A 13 GLY H 1.0 1.80 2.9 85 60 A 12 PRO HA A 46 THR H 1.0 1.80 5.0 86 61 A 13 GLY H A 12 PRO HBy 1.0 1.80 4.5 87 61 A 13 GLY H A 12 PRO HBx 1.0 1.80 4.5 88 62 A 13 GLY H A 13 GLY HAx 1.0 1.80 4.1 89 62 A 13 GLY H A 13 GLY HAy 1.0 1.80 4.1 90 63 A 14 LEU H A 13 GLY HAx 1.0 1.80 3.9 91 63 A 13 GLY HAy A 14 LEU H 1.0 1.80 3.9 92 64 A 13 GLY H A 14 LEU H 1.0 1.80 5.0 93 65 A 13 GLY H A 45 LYS HA 1.0 1.80 5.0 94 66 A 13 GLY H A 46 THR HB 1.0 1.80 2.9 95 67 A 46 THR HG2% A 13 GLY H 1.0 1.80 5.0 96 68 A 13 GLY H A 46 THR H 1.0 1.80 3.5 97 69 A 14 LEU H A 14 LEU HA 1.0 1.80 3.5 98 70 A 14 LEU HA A 15 GLN H 1.0 1.80 2.9 99 71 A 46 THR H A 14 LEU HA 1.0 1.80 5.0 100 72 A 16 ILE HA A 44 LEU H 1.0 1.80 5.0 101 73 A 14 LEU H A 14 LEU HBy 1.0 1.80 3.5 102 73 A 14 LEU H A 14 LEU HBx 1.0 1.80 3.5 103 74 A 15 GLN H A 14 LEU HBy 1.0 1.80 4.5 104 74 A 15 GLN H A 14 LEU HBx 1.0 1.80 4.5 105 75 A 106 TYR H A 14 LEU HDx% 1.0 1.80 7.4 106 75 A 14 LEU HDy% A 106 TYR H 1.0 1.80 7.4 107 76 A 14 LEU H A 14 LEU HDx% 1.0 1.80 6.7 108 76 A 14 LEU H A 14 LEU HDy% 1.0 1.80 6.7 109 77 A 15 GLN H A 14 LEU HDx% 1.0 1.80 5.9 110 77 A 15 GLN H A 14 LEU HDy% 1.0 1.80 5.9 111 78 A 44 LEU H A 14 LEU HDx% 1.0 1.80 7.4 112 78 A 44 LEU H A 14 LEU HDy% 1.0 1.80 7.4 113 79 A 45 LYS H A 14 LEU HDx% 1.0 1.80 7.4 114 79 A 14 LEU HDy% A 45 LYS H 1.0 1.80 7.4 115 80 A 46 THR H A 14 LEU HDx% 1.0 1.80 7.4 116 80 A 46 THR H A 14 LEU HDy% 1.0 1.80 7.4 117 81 A 14 LEU H A 14 LEU HG 1.0 1.80 5.0 118 82 A 15 GLN H A 15 GLN HA 1.0 1.80 5.0 119 83 A 15 GLN HA A 16 ILE H 1.0 1.80 2.9 120 84 A 15 GLN H A 15 GLN HBx 1.0 1.80 4.1 121 84 A 15 GLN H A 15 GLN HBy 1.0 1.80 4.1 122 85 A 15 GLN HE2x A 15 GLN HGx 1.0 1.80 5.0 123 85 A 15 GLN HE2x A 15 GLN HGy 1.0 1.80 5.0 124 85 A 15 GLN HGx A 15 GLN HE2y 1.0 1.80 5.0 125 85 A 15 GLN HE2y A 15 GLN HGy 1.0 1.80 5.0 126 86 A 15 GLN HE2x A 44 LEU HDy% 1.0 1.80 8.0 127 86 A 15 GLN HE2y A 44 LEU HDx% 1.0 1.80 8.0 128 86 A 44 LEU HDy% A 15 GLN HE2y 1.0 1.80 8.0 129 86 A 15 GLN HE2x A 44 LEU HDx% 1.0 1.80 8.0 130 87 A 15 GLN H A 15 GLN HGy 1.0 1.80 6.0 131 87 A 15 GLN H A 15 GLN HGx 1.0 1.80 6.0 132 88 A 15 GLN H A 16 ILE H 1.0 1.80 5.0 133 89 A 15 GLN H A 44 LEU H 1.0 1.80 5.0 134 90 A 16 ILE HA A 16 ILE H 1.0 1.80 5.0 135 91 A 16 ILE HA A 17 TRP H 1.0 1.80 2.9 136 92 A 16 ILE H A 16 ILE HB 1.0 1.80 5.0 137 93 A 17 TRP H A 16 ILE HB 1.0 1.80 5.0 138 94 A 17 TRP H A 16 ILE HD1% 1.0 1.80 6.5 139 95 A 16 ILE HG2% A 42 VAL H 1.0 1.80 6.5 140 96 A 16 ILE HD1% A 33 GLY H 1.0 1.80 6.5 141 97 A 17 TRP H A 16 ILE HG2% 1.0 1.80 5.0 142 98 A 17 TRP H A 17 TRP HA 1.0 1.80 5.0 143 99 A 17 TRP HA A 18 ARG H 1.0 1.80 2.9 144 100 A 17 TRP HA A 27 VAL H 1.0 1.80 3.5 145 101 A 17 TRP H A 17 TRP HBx 1.0 1.80 4.1 146 101 A 17 TRP H A 17 TRP HBy 1.0 1.80 4.1 147 102 A 18 ARG H A 17 TRP HBx 1.0 1.80 4.5 148 102 A 18 ARG H A 17 TRP HBy 1.0 1.80 4.5 149 103 A 25 VAL H A 17 TRP HBx 1.0 1.80 4.5 150 103 A 17 TRP HBy A 25 VAL H 1.0 1.80 4.5 151 104 A 17 TRP HH2 A 44 LEU H 1.0 1.80 5.0 152 105 A 17 TRP H A 43 ILE HA 1.0 1.80 5.0 153 106 A 17 TRP H A 42 VAL H 1.0 1.80 5.0 154 107 A 18 ARG H A 18 ARG HA 1.0 1.80 3.5 155 108 A 18 ARG HA A 19 VAL H 1.0 1.80 2.9 156 109 A 42 VAL H A 18 ARG HA 1.0 1.80 5.0 157 110 A 18 ARG H A 18 ARG HBx 1.0 1.80 4.1 158 110 A 18 ARG H A 18 ARG HBy 1.0 1.80 4.1 159 111 A 18 ARG H A 18 ARG HGy 1.0 1.80 4.5 160 111 A 18 ARG H A 18 ARG HGx 1.0 1.80 4.5 161 112 A 19 VAL H A 18 ARG HGy 1.0 1.80 4.5 162 112 A 19 VAL H A 18 ARG HGx 1.0 1.80 4.5 163 113 A 18 ARG H A 19 VAL H 1.0 1.80 5.0 164 114 A 18 ARG H A 25 VAL H 1.0 1.80 3.5 165 115 A 18 ARG H A 26 PRO HA 1.0 1.80 3.5 166 116 A 18 ARG H A 27 VAL HGx% 1.0 1.80 5.9 167 116 A 18 ARG H A 27 VAL HGy% 1.0 1.80 5.9 168 117 A 18 ARG H A 27 VAL H 1.0 1.80 5.0 169 118 A 19 VAL H A 19 VAL HA 1.0 1.80 5.0 170 119 A 19 VAL HA A 20 GLU H 1.0 1.80 2.9 171 120 A 25 VAL H A 19 VAL HA 1.0 1.80 5.0 172 121 A 19 VAL H A 19 VAL HB 1.0 1.80 2.9 173 122 A 20 GLU H A 19 VAL HB 1.0 1.80 3.5 174 123 A 19 VAL H A 19 VAL HGx% 1.0 1.80 4.6 175 123 A 19 VAL H A 19 VAL HGy% 1.0 1.80 4.6 176 124 A 20 GLU H A 19 VAL HGx% 1.0 1.80 5.9 177 124 A 20 GLU H A 19 VAL HGy% 1.0 1.80 5.9 178 125 A 23 ASP H A 19 VAL HGx% 1.0 1.80 7.4 179 125 A 19 VAL HGy% A 23 ASP H 1.0 1.80 7.4 180 126 A 24 LEU H A 19 VAL HGx% 1.0 1.80 5.3 181 126 A 19 VAL HGy% A 24 LEU H 1.0 1.80 5.3 182 127 A 19 VAL H A 41 TYR HA 1.0 1.80 5.0 183 128 A 20 GLU H A 20 GLU HA 1.0 1.80 5.0 184 129 A 20 GLU HA A 21 LYS H 1.0 1.80 3.5 185 130 A 20 GLU H A 20 GLU HBx 1.0 1.80 5.6 186 130 A 20 GLU H A 20 GLU HBy 1.0 1.80 5.6 187 131 A 21 LYS H A 20 GLU HBx 1.0 1.80 4.5 188 131 A 21 LYS H A 20 GLU HBy 1.0 1.80 4.5 189 132 A 23 ASP H A 20 GLU HBx 1.0 1.80 4.5 190 132 A 23 ASP H A 20 GLU HBy 1.0 1.80 4.5 191 133 A 20 GLU H A 20 GLU HGx 1.0 1.80 6.0 192 133 A 20 GLU H A 20 GLU HGy 1.0 1.80 6.0 193 134 A 20 GLU H A 23 ASP H 1.0 1.80 5.0 194 135 A 25 VAL H A 20 GLU H 1.0 1.80 5.0 195 136 A 21 LYS H A 21 LYS HBx 1.0 1.80 3.5 196 136 A 21 LYS H A 21 LYS HBy 1.0 1.80 3.5 197 137 A 22 PHE H A 22 PHE HBx 1.0 1.80 4.1 198 137 A 22 PHE HBy A 22 PHE H 1.0 1.80 4.1 199 138 A 23 ASP H A 22 PHE HBx 1.0 1.80 6.0 200 138 A 23 ASP H A 22 PHE HBy 1.0 1.80 6.0 201 139 A 22 PHE H A 73 ALA HB% 1.0 1.80 2.9 202 140 A 23 ASP H A 22 PHE H 1.0 1.80 3.5 203 141 A 23 ASP H A 23 ASP HA 1.0 1.80 3.5 204 142 A 24 LEU H A 23 ASP HA 1.0 1.80 3.5 205 143 A 23 ASP H A 23 ASP HBx 1.0 1.80 4.1 206 143 A 23 ASP H A 23 ASP HBy 1.0 1.80 4.1 207 144 A 24 LEU H A 23 ASP HBx 1.0 1.80 3.9 208 144 A 24 LEU H A 23 ASP HBy 1.0 1.80 3.9 209 145 A 24 LEU H A 24 LEU HA 1.0 1.80 5.0 210 146 A 25 VAL H A 24 LEU HA 1.0 1.80 2.9 211 147 A 24 LEU H A 24 LEU HBx 1.0 1.80 4.1 212 147 A 24 LEU H A 24 LEU HBy 1.0 1.80 4.1 213 148 A 24 LEU H A 24 LEU HDx% 1.0 1.80 6.7 214 148 A 24 LEU H A 24 LEU HDy% 1.0 1.80 6.7 215 149 A 25 VAL H A 24 LEU HDx% 1.0 1.80 7.4 216 149 A 25 VAL H A 24 LEU HDy% 1.0 1.80 7.4 217 150 A 25 VAL H A 25 VAL HA 1.0 1.80 5.0 218 151 A 25 VAL H A 25 VAL HB 1.0 1.80 2.9 219 152 A 25 VAL H A 25 VAL HGx% 1.0 1.80 4.6 220 152 A 25 VAL H A 25 VAL HGy% 1.0 1.80 4.6 221 153 A 27 VAL H A 26 PRO HA 1.0 1.80 2.9 222 154 A 27 VAL H A 26 PRO HBx 1.0 1.80 6.0 223 154 A 27 VAL H A 26 PRO HBy 1.0 1.80 6.0 224 155 A 27 VAL H A 27 VAL HB 1.0 1.80 2.9 225 156 A 27 VAL H A 27 VAL HGx% 1.0 1.80 4.6 226 156 A 27 VAL H A 27 VAL HGy% 1.0 1.80 4.6 227 157 A 28 PRO HA A 29 THR H 1.0 1.80 2.9 228 158 A 29 THR H A 28 PRO HBx 1.0 1.80 4.5 229 158 A 29 THR H A 28 PRO HBy 1.0 1.80 4.5 230 159 A 30 ASN H A 28 PRO HBx 1.0 1.80 4.5 231 159 A 28 PRO HBy A 30 ASN H 1.0 1.80 4.5 232 160 A 29 THR H A 29 THR HA 1.0 1.80 2.9 233 161 A 29 THR HA A 31 LEU H 1.0 1.80 5.0 234 162 A 29 THR HA A 32 TYR H 1.0 1.80 3.5 235 163 A 29 THR H A 29 THR HB 1.0 1.80 3.5 236 164 A 30 ASN H A 29 THR HB 1.0 1.80 3.5 237 165 A 29 THR H A 29 THR HG2% 1.0 1.80 4.4 238 166 A 30 ASN H A 29 THR HG2% 1.0 1.80 6.5 239 167 A 30 ASN H A 30 ASN HA 1.0 1.80 2.9 240 168 A 30 ASN H A 30 ASN HBx 1.0 1.80 3.5 241 168 A 30 ASN H A 30 ASN HBy 1.0 1.80 3.5 242 169 A 31 LEU H A 30 ASN HBx 1.0 1.80 6.0 243 169 A 31 LEU H A 30 ASN HBy 1.0 1.80 6.0 244 170 A 30 ASN H A 31 LEU H 1.0 1.80 2.9 245 171 A 31 LEU H A 31 LEU HA 1.0 1.80 2.9 246 172 A 32 TYR H A 31 LEU HA 1.0 1.80 3.5 247 173 A 31 LEU H A 31 LEU HBy 1.0 1.80 3.5 248 173 A 31 LEU H A 31 LEU HBx 1.0 1.80 3.5 249 174 A 32 TYR H A 31 LEU HBy 1.0 1.80 6.0 250 174 A 32 TYR H A 31 LEU HBx 1.0 1.80 6.0 251 175 A 31 LEU H A 31 LEU HDx% 1.0 1.80 5.2 252 175 A 31 LEU H A 31 LEU HDy% 1.0 1.80 5.2 253 176 A 32 TYR H A 31 LEU HDx% 1.0 1.80 7.4 254 176 A 32 TYR H A 31 LEU HDy% 1.0 1.80 7.4 255 177 A 31 LEU H A 32 TYR H 1.0 1.80 2.9 256 178 A 32 TYR H A 32 TYR HA 1.0 1.80 2.9 257 179 A 32 TYR H A 32 TYR HBx 1.0 1.80 3.5 258 179 A 32 TYR H A 32 TYR HBy 1.0 1.80 3.5 259 180 A 33 GLY H A 32 TYR HBx 1.0 1.80 6.0 260 180 A 33 GLY H A 32 TYR HBy 1.0 1.80 6.0 261 181 A 32 TYR H A 32 TYR HD% 1.0 1.80 4.9 262 182 A 33 GLY H A 32 TYR HD% 1.0 1.80 7.0 263 183 A 33 GLY H A 32 TYR H 1.0 1.80 3.5 264 184 A 33 GLY H A 33 GLY HAx 1.0 1.80 3.5 265 184 A 33 GLY H A 33 GLY HAy 1.0 1.80 3.5 266 185 A 34 ASP H A 33 GLY HAx 1.0 1.80 3.9 267 185 A 33 GLY HAy A 34 ASP H 1.0 1.80 3.9 268 186 A 33 GLY H A 34 ASP H 1.0 1.80 2.9 269 187 A 34 ASP HA A 112 LYS H 1.0 1.80 3.5 270 188 A 34 ASP H A 34 ASP HA 1.0 1.80 3.5 271 189 A 34 ASP HA A 35 PHE H 1.0 1.80 3.5 272 190 A 34 ASP H A 34 ASP HBx 1.0 1.80 3.5 273 190 A 34 ASP H A 34 ASP HBy 1.0 1.80 3.5 274 191 A 35 PHE HA A 36 PHE H 1.0 1.80 2.9 275 192 A 35 PHE H A 114 LYS H 1.0 1.80 5.0 276 193 A 35 PHE H A 113 TYR HA 1.0 1.80 5.0 277 194 A 36 PHE H A 35 PHE HBx 1.0 1.80 6.0 278 194 A 36 PHE H A 35 PHE HBy 1.0 1.80 6.0 279 195 A 114 LYS H A 36 PHE HA 1.0 1.80 3.5 280 196 A 36 PHE H A 36 PHE HA 1.0 1.80 3.5 281 197 A 36 PHE HA A 37 THR H 1.0 1.80 2.9 282 198 A 36 PHE HA A 38 GLY H 1.0 1.80 5.0 283 199 A 36 PHE H A 36 PHE HBx 1.0 1.80 4.1 284 199 A 36 PHE H A 36 PHE HBy 1.0 1.80 4.1 285 200 A 37 THR H A 36 PHE HBx 1.0 1.80 6.0 286 200 A 37 THR H A 36 PHE HBy 1.0 1.80 6.0 287 201 A 36 PHE HD% A 116 GLY H 1.0 1.80 7.0 288 202 A 36 PHE HD% A 117 GLY H 1.0 1.80 7.0 289 203 A 36 PHE H A 41 TYR HE% 1.0 1.80 5.4 290 204 A 37 THR H A 36 PHE HD% 1.0 1.80 7.0 291 205 A 38 GLY H A 36 PHE HD% 1.0 1.80 7.0 292 206 A 37 THR H A 37 THR HA 1.0 1.80 3.5 293 207 A 38 GLY H A 37 THR HA 1.0 1.80 5.0 294 208 A 37 THR HA A 63 GLY H 1.0 1.80 5.0 295 209 A 37 THR HA A 64 ASN H 1.0 1.80 5.0 296 210 A 37 THR H A 37 THR HB 1.0 1.80 5.0 297 211 A 64 ASN H A 37 THR HB 1.0 1.80 5.0 298 212 A 37 THR HB A 65 GLU H 1.0 1.78 3.5 299 213 A 37 THR H A 37 THR HG2% 1.0 1.80 4.4 300 214 A 38 GLY H A 37 THR HG2% 1.0 1.80 6.5 301 215 A 112 LYS H A 37 THR HG2% 1.0 1.80 6.5 302 216 A 114 LYS H A 37 THR HG2% 1.0 1.80 6.5 303 217 A 114 LYS H A 37 THR H 1.0 1.80 5.0 304 218 A 37 THR H A 115 LYS HA 1.0 1.80 5.0 305 219 A 37 THR H A 116 GLY H 1.0 1.80 5.0 306 220 A 37 THR H A 38 GLY H 1.0 1.80 5.0 307 221 A 38 GLY H A 38 GLY HAy 1.0 1.80 3.5 308 221 A 38 GLY H A 38 GLY HAx 1.0 1.80 3.5 309 222 A 39 ASP H A 38 GLY HAy 1.0 1.80 4.5 310 222 A 38 GLY HAx A 39 ASP H 1.0 1.80 4.5 311 223 A 65 GLU H A 38 GLY HAy 1.0 1.80 4.5 312 223 A 65 GLU H A 38 GLY HAx 1.0 1.80 4.5 313 224 A 66 CYS H A 38 GLY HAy 1.0 1.80 4.5 314 224 A 38 GLY HAx A 66 CYS H 1.0 1.80 4.5 315 225 A 38 GLY H A 39 ASP H 1.0 1.80 2.9 316 226 A 39 ASP H A 39 ASP HA 1.0 1.80 3.5 317 227 A 39 ASP HA A 40 ALA H 1.0 1.80 2.9 318 228 A 39 ASP H A 39 ASP HBx 1.0 1.80 3.5 319 228 A 39 ASP H A 39 ASP HBy 1.0 1.80 3.5 320 229 A 40 ALA H A 39 ASP HBx 1.0 1.80 4.5 321 229 A 40 ALA H A 39 ASP HBy 1.0 1.80 4.5 322 230 A 40 ALA H A 40 ALA HA 1.0 1.80 5.0 323 231 A 40 ALA HA A 41 TYR H 1.0 1.80 2.9 324 232 A 63 GLY H A 40 ALA HA 1.0 1.80 5.0 325 233 A 40 ALA H A 40 ALA HB% 1.0 1.80 4.6 326 234 A 41 TYR H A 40 ALA HB% 1.0 1.80 4.4 327 235 A 63 GLY H A 40 ALA HB% 1.0 1.80 6.5 328 236 A 40 ALA HB% A 71 SER H 1.0 1.80 6.5 329 237 A 41 TYR HA A 41 TYR H 1.0 1.80 5.0 330 238 A 41 TYR H A 61 TRP H 1.0 1.80 3.5 331 239 A 41 TYR H A 61 TRP HE3 1.0 2.80 5.0 332 240 A 42 VAL H A 41 TYR HA 1.0 1.80 2.9 333 241 A 41 TYR H A 41 TYR HBx 1.0 1.80 4.1 334 241 A 41 TYR H A 41 TYR HBy 1.0 1.80 4.1 335 242 A 42 VAL H A 41 TYR HBx 1.0 1.80 4.5 336 242 A 42 VAL H A 41 TYR HBy 1.0 1.80 4.5 337 243 A 41 TYR H A 41 TYR HD% 1.0 1.80 5.5 338 244 A 42 VAL H A 41 TYR HD% 1.0 1.80 7.0 339 245 A 41 TYR HE% A 41 TYR H 1.0 1.80 7.0 340 246 A 42 VAL H A 42 VAL HA 1.0 1.80 3.5 341 247 A 42 VAL HA A 43 ILE H 1.0 1.80 2.9 342 248 A 61 TRP H A 42 VAL HA 1.0 1.80 5.0 343 249 A 42 VAL H A 42 VAL HB 1.0 1.80 3.5 344 250 A 42 VAL H A 42 VAL HGx% 1.0 1.80 4.6 345 250 A 42 VAL H A 42 VAL HGy% 1.0 1.80 4.6 346 251 A 43 ILE H A 42 VAL HGx% 1.0 1.80 5.3 347 251 A 43 ILE H A 42 VAL HGy% 1.0 1.80 5.3 348 252 A 60 TYR H A 42 VAL HGx% 1.0 1.80 7.4 349 252 A 42 VAL HGy% A 60 TYR H 1.0 1.80 7.4 350 253 A 61 TRP H A 42 VAL HGx% 1.0 1.80 7.4 351 253 A 61 TRP H A 42 VAL HGy% 1.0 1.80 7.4 352 254 A 74 ALA H A 42 VAL HGx% 1.0 1.80 7.4 353 254 A 42 VAL HGy% A 74 ALA H 1.0 1.80 7.4 354 255 A 77 PHE H A 42 VAL HGx% 1.0 1.80 7.4 355 255 A 42 VAL HGy% A 77 PHE H 1.0 1.80 7.4 356 256 A 78 THR H A 42 VAL HGx% 1.0 1.80 5.9 357 256 A 42 VAL HGy% A 78 THR H 1.0 1.80 5.9 358 257 A 42 VAL H A 43 ILE H 1.0 1.80 5.0 359 258 A 43 ILE H A 59 HIS H 1.0 1.80 3.5 360 259 A 43 ILE HA A 43 ILE H 1.0 1.80 5.0 361 260 A 43 ILE H A 60 TYR HA 1.0 1.80 5.0 362 261 A 44 LEU H A 43 ILE HA 1.0 1.80 2.9 363 262 A 43 ILE H A 43 ILE HB 1.0 1.80 3.5 364 263 A 44 LEU H A 43 ILE HB 1.0 1.80 3.5 365 264 A 59 HIS H A 43 ILE HB 1.0 1.80 5.0 366 265 A 43 ILE H A 43 ILE HD1% 1.0 1.80 5.0 367 266 A 61 TRP H A 43 ILE HD1% 1.0 1.80 5.0 368 267 A 44 LEU H A 43 ILE HG1x 1.0 1.80 5.0 369 268 A 44 LEU H A 43 ILE HG1y 1.0 1.80 5.0 370 269 A 43 ILE H A 59 HIS H 1.0 1.80 5.0 371 270 A 44 LEU HA A 44 LEU H 1.0 1.80 5.0 372 271 A 44 LEU HA A 45 LYS H 1.0 1.80 2.9 373 272 A 44 LEU HA A 59 HIS H 1.0 1.80 5.0 374 273 A 44 LEU H A 44 LEU HBx 1.0 1.80 5.6 375 273 A 44 LEU H A 44 LEU HBy 1.0 1.80 5.6 376 274 A 45 LYS H A 44 LEU HBx 1.0 1.80 4.5 377 274 A 45 LYS H A 44 LEU HBy 1.0 1.80 4.5 378 275 A 44 LEU H A 44 LEU HDx% 1.0 1.80 4.6 379 275 A 44 LEU HDy% A 44 LEU H 1.0 1.80 4.6 380 276 A 57 ASP H A 44 LEU HDx% 1.0 1.80 5.9 381 276 A 44 LEU HDy% A 57 ASP H 1.0 1.80 5.9 382 277 A 59 HIS H A 44 LEU HDx% 1.0 1.80 5.9 383 277 A 44 LEU HDy% A 59 HIS H 1.0 1.80 5.9 384 278 A 45 LYS HA A 45 LYS H 1.0 1.80 5.0 385 279 A 46 THR H A 45 LYS HA 1.0 1.80 2.9 386 280 A 91 GLN HA A 58 LEU H 1.0 1.80 5.0 387 281 A 45 LYS H A 45 LYS HBy 1.0 1.80 3.5 388 281 A 45 LYS H A 45 LYS HBx 1.0 1.80 3.5 389 282 A 46 THR H A 45 LYS HBy 1.0 1.80 4.5 390 282 A 46 THR H A 45 LYS HBx 1.0 1.80 4.5 391 283 A 57 ASP H A 45 LYS HBy 1.0 1.80 4.5 392 283 A 57 ASP H A 45 LYS HBx 1.0 1.80 4.5 393 284 A 45 LYS H A 45 LYS HEx 1.0 1.80 6.0 394 284 A 45 LYS H A 45 LYS HEy 1.0 1.80 6.0 395 285 A 45 LYS H A 45 LYS HGx 1.0 1.80 6.0 396 285 A 45 LYS H A 45 LYS HGy 1.0 1.80 6.0 397 286 A 46 THR H A 45 LYS HGx 1.0 1.80 4.5 398 286 A 46 THR H A 45 LYS HGy 1.0 1.80 4.5 399 287 A 45 LYS H A 57 ASP H 1.0 1.80 3.5 400 288 A 46 THR H A 46 THR HA 1.0 1.80 3.5 401 289 A 46 THR HA A 47 VAL H 1.0 1.80 2.9 402 290 A 57 ASP H A 46 THR HA 1.0 1.80 5.0 403 291 A 46 THR H A 46 THR HB 1.0 1.80 3.5 404 292 A 46 THR HG2% A 46 THR H 1.0 1.80 5.0 405 293 A 46 THR HG2% A 47 VAL H 1.0 1.80 4.4 406 294 A 46 THR H A 47 VAL H 1.0 1.80 5.0 407 295 A 46 THR H A 56 TYR HA 1.0 1.80 3.5 408 296 A 47 VAL H A 47 VAL HA 1.0 1.80 3.5 409 297 A 47 VAL HA A 48 GLN H 1.0 1.80 3.5 410 298 A 47 VAL H A 47 VAL HB 1.0 1.80 2.9 411 299 A 48 GLN H A 47 VAL HB 1.0 1.80 2.9 412 300 A 47 VAL HB A 55 GLN H 1.0 1.80 3.5 413 301 A 48 GLN H A 47 VAL HGx% 1.0 1.80 5.3 414 301 A 48 GLN H A 47 VAL HGy% 1.0 1.80 5.3 415 302 A 55 GLN H A 47 VAL HGx% 1.0 1.80 5.3 416 302 A 55 GLN H A 47 VAL HGy% 1.0 1.80 5.3 417 303 A 47 VAL H A 55 GLN H 1.0 1.80 3.5 418 304 A 48 GLN H A 48 GLN HA 1.0 1.80 3.5 419 305 A 48 GLN HA A 49 LEU H 1.0 1.80 2.9 420 306 A 55 GLN H A 48 GLN HA 1.0 1.80 5.0 421 307 A 48 GLN H A 48 GLN HBx 1.0 1.80 3.5 422 307 A 48 GLN H A 48 GLN HBy 1.0 1.80 3.5 423 308 A 49 LEU H A 48 GLN HBx 1.0 1.80 4.5 424 308 A 49 LEU H A 48 GLN HBy 1.0 1.80 4.5 425 309 A 48 GLN H A 48 GLN HGx 1.0 1.80 6.0 426 309 A 48 GLN H A 48 GLN HGy 1.0 1.80 6.0 427 310 A 49 LEU H A 48 GLN HGx 1.0 1.80 6.0 428 310 A 49 LEU H A 48 GLN HGy 1.0 1.80 6.0 429 311 A 52 GLY H A 48 GLN HGx 1.0 1.80 4.5 430 311 A 48 GLN HGy A 52 GLY H 1.0 1.80 4.5 431 312 A 49 LEU H A 49 LEU HA 1.0 1.80 3.5 432 313 A 49 LEU HA A 50 ARG H 1.0 1.80 3.5 433 314 A 49 LEU H A 49 LEU HBx 1.0 1.80 3.5 434 314 A 49 LEU H A 49 LEU HBy 1.0 1.80 3.5 435 315 A 53 ASN H A 49 LEU HBx 1.0 1.80 4.5 436 315 A 49 LEU HBy A 53 ASN H 1.0 1.80 4.5 437 316 A 49 LEU H A 49 LEU HDx% 1.0 1.80 5.2 438 316 A 49 LEU H A 49 LEU HDy% 1.0 1.80 5.2 439 317 A 50 ARG H A 49 LEU HDx% 1.0 1.80 5.3 440 317 A 50 ARG H A 49 LEU HDy% 1.0 1.80 5.3 441 318 A 51 ASN H A 49 LEU HDx% 1.0 1.80 7.4 442 318 A 49 LEU HDy% A 51 ASN H 1.0 1.80 7.4 443 319 A 53 ASN H A 49 LEU HDx% 1.0 1.80 5.9 444 319 A 53 ASN H A 49 LEU HDy% 1.0 1.80 5.9 445 320 A 49 LEU H A 49 LEU HG 1.0 1.80 2.9 446 321 A 55 GLN H A 49 LEU HG 1.0 1.80 5.0 447 322 A 49 LEU H A 50 ARG H 1.0 1.80 3.5 448 323 A 49 LEU H A 52 GLY H 1.0 1.80 5.0 449 324 A 49 LEU H A 53 ASN H 1.0 1.80 5.0 450 325 A 49 LEU H A 54 LEU HA 1.0 1.80 5.0 451 326 A 49 LEU H A 54 LEU HDx% 1.0 1.80 7.4 452 326 A 54 LEU HDy% A 49 LEU H 1.0 1.80 7.4 453 327 A 50 ARG H A 50 ARG HA 1.0 1.80 2.9 454 328 A 51 ASN H A 50 ARG HA 1.0 1.80 3.5 455 329 A 52 GLY H A 50 ARG HA 1.0 1.80 5.0 456 330 A 50 ARG H A 50 ARG HBx 1.0 1.80 3.5 457 330 A 50 ARG H A 50 ARG HBy 1.0 1.80 3.5 458 331 A 51 ASN H A 50 ARG HBx 1.0 1.80 3.9 459 331 A 51 ASN H A 50 ARG HBy 1.0 1.80 3.9 460 332 A 50 ARG H A 50 ARG HGx 1.0 1.80 3.9 461 332 A 50 ARG H A 50 ARG HGy 1.0 1.80 3.9 462 333 A 51 ASN H A 50 ARG HGx 1.0 1.80 4.5 463 333 A 51 ASN H A 50 ARG HGy 1.0 1.80 4.5 464 334 A 52 GLY H A 50 ARG HGx 1.0 1.80 6.0 465 334 A 52 GLY H A 50 ARG HGy 1.0 1.80 6.0 466 335 A 50 ARG H A 51 ASN H 1.0 1.80 2.9 467 336 A 51 ASN H A 51 ASN HA 1.0 1.80 2.9 468 337 A 52 GLY H A 51 ASN HA 1.0 1.80 3.5 469 338 A 51 ASN H A 51 ASN HBx 1.0 1.80 3.5 470 338 A 51 ASN H A 51 ASN HBy 1.0 1.80 3.5 471 339 A 52 GLY H A 51 ASN HBx 1.0 1.80 6.0 472 339 A 52 GLY H A 51 ASN HBy 1.0 1.80 6.0 473 340 A 52 GLY H A 51 ASN H 1.0 1.80 2.9 474 341 A 52 GLY H A 52 GLY HAy 1.0 1.80 3.5 475 341 A 52 GLY H A 52 GLY HAx 1.0 1.80 3.5 476 342 A 53 ASN H A 52 GLY HAy 1.0 1.80 4.5 477 342 A 53 ASN H A 52 GLY HAx 1.0 1.80 4.5 478 343 A 53 ASN H A 53 ASN HA 1.0 1.80 3.5 479 344 A 53 ASN HA A 54 LEU H 1.0 1.80 2.9 480 345 A 53 ASN H A 53 ASN HBx 1.0 1.80 3.5 481 345 A 53 ASN H A 53 ASN HBy 1.0 1.80 3.5 482 346 A 54 LEU H A 53 ASN HBx 1.0 1.80 3.9 483 346 A 54 LEU H A 53 ASN HBy 1.0 1.80 3.9 484 347 A 54 LEU HA A 54 LEU H 1.0 1.80 3.5 485 348 A 55 GLN H A 54 LEU HA 1.0 1.80 3.5 486 349 A 54 LEU H A 54 LEU HBx 1.0 1.80 3.5 487 349 A 54 LEU H A 54 LEU HBy 1.0 1.80 3.5 488 350 A 55 GLN H A 54 LEU HBx 1.0 1.80 4.5 489 350 A 55 GLN H A 54 LEU HBy 1.0 1.80 4.5 490 351 A 54 LEU H A 54 LEU HDx% 1.0 1.80 5.2 491 351 A 54 LEU HDy% A 54 LEU H 1.0 1.80 5.2 492 352 A 55 GLN H A 54 LEU HDx% 1.0 1.80 5.9 493 352 A 54 LEU HDy% A 55 GLN H 1.0 1.80 5.9 494 353 A 54 LEU H A 54 LEU HG 1.0 1.80 2.9 495 354 A 55 GLN H A 54 LEU HG 1.0 1.80 5.0 496 355 A 55 GLN H A 54 LEU H 1.0 1.80 5.0 497 356 A 55 GLN H A 55 GLN HA 1.0 1.80 3.5 498 357 A 55 GLN HA A 56 TYR H 1.0 1.80 2.9 499 358 A 55 GLN H A 55 GLN HBx 1.0 1.80 3.5 500 358 A 55 GLN H A 55 GLN HBy 1.0 1.80 3.5 501 359 A 56 TYR H A 55 GLN HBx 1.0 1.80 4.5 502 359 A 56 TYR H A 55 GLN HBy 1.0 1.80 4.5 503 360 A 55 GLN H A 55 GLN HGx 1.0 1.80 6.0 504 360 A 55 GLN H A 55 GLN HGy 1.0 1.80 6.0 505 361 A 56 TYR H A 55 GLN HGx 1.0 1.80 3.9 506 361 A 56 TYR H A 55 GLN HGy 1.0 1.80 3.9 507 362 A 56 TYR HA A 56 TYR H 1.0 1.80 3.5 508 363 A 57 ASP H A 56 TYR HA 1.0 1.80 2.9 509 364 A 56 TYR H A 56 TYR HBx 1.0 1.80 3.5 510 364 A 56 TYR H A 56 TYR HBy 1.0 1.80 3.5 511 365 A 57 ASP H A 56 TYR HBx 1.0 1.80 4.5 512 365 A 57 ASP H A 56 TYR HBy 1.0 1.80 4.5 513 366 A 90 VAL H A 56 TYR HBx 1.0 1.80 6.0 514 366 A 56 TYR HBy A 90 VAL H 1.0 1.80 6.0 515 367 A 56 TYR H A 56 TYR HD% 1.0 1.80 5.5 516 368 A 57 ASP H A 56 TYR HD% 1.0 1.80 7.0 517 369 A 56 TYR HE% A 56 TYR H 1.0 1.80 7.0 518 370 A 57 ASP H A 56 TYR H 1.0 1.80 5.0 519 371 A 56 TYR H A 89 ALA HA 1.0 1.80 3.5 520 372 A 56 TYR H A 89 ALA HB% 1.0 1.80 6.5 521 373 A 57 ASP H A 57 ASP HA 1.0 1.80 3.5 522 374 A 58 LEU H A 57 ASP HA 1.0 1.80 2.9 523 375 A 90 VAL H A 57 ASP HA 1.0 1.80 3.5 524 376 A 57 ASP H A 57 ASP HBx 1.0 1.80 3.5 525 376 A 57 ASP H A 57 ASP HBy 1.0 1.80 3.5 526 377 A 58 LEU H A 57 ASP HBx 1.0 1.80 6.0 527 377 A 58 LEU H A 57 ASP HBy 1.0 1.80 6.0 528 378 A 59 HIS H A 58 LEU HA 1.0 1.80 2.9 529 379 A 58 LEU H A 58 LEU HBx 1.0 1.80 4.1 530 379 A 58 LEU H A 58 LEU HBy 1.0 1.80 4.1 531 380 A 59 HIS H A 58 LEU HBx 1.0 1.80 6.0 532 380 A 59 HIS H A 58 LEU HBy 1.0 1.80 6.0 533 381 A 92 HIS H A 58 LEU HBx 1.0 1.80 6.0 534 381 A 58 LEU HBy A 92 HIS H 1.0 1.80 6.0 535 382 A 58 LEU H A 58 LEU HDx% 1.0 1.80 5.2 536 382 A 58 LEU H A 58 LEU HDy% 1.0 1.80 5.2 537 383 A 59 HIS H A 58 LEU HDx% 1.0 1.80 5.3 538 383 A 59 HIS H A 58 LEU HDy% 1.0 1.80 5.3 539 384 A 58 LEU H A 89 ALA HB% 1.0 1.80 6.5 540 385 A 58 LEU H A 90 VAL HB 1.0 1.80 5.0 541 386 A 91 GLN HA A 58 LEU H 1.0 1.80 3.5 542 387 A 58 LEU H A 90 VAL H 1.0 1.80 5.0 543 388 A 58 LEU H A 92 HIS HD2 1.0 1.80 3.5 544 389 A 58 LEU H A 92 HIS H 1.0 1.80 5.0 545 390 A 59 HIS H A 59 HIS HA 1.0 1.80 5.0 546 391 A 60 TYR H A 59 HIS HA 1.0 1.80 2.9 547 392 A 92 HIS H A 59 HIS HA 1.0 1.80 3.5 548 393 A 59 HIS HA A 94 GLU H 1.0 1.80 5.0 549 394 A 59 HIS H A 59 HIS HBx 1.0 1.80 4.1 550 394 A 59 HIS H A 59 HIS HBy 1.0 1.80 4.1 551 395 A 60 TYR H A 59 HIS HBx 1.0 1.80 4.5 552 395 A 60 TYR H A 59 HIS HBy 1.0 1.80 4.5 553 396 A 59 HIS H A 59 HIS HD2 1.0 1.80 3.5 554 397 A 60 TYR H A 59 HIS H 1.0 1.80 5.0 555 398 A 60 TYR H A 60 TYR HA 1.0 1.80 5.0 556 399 A 61 TRP H A 60 TYR HA 1.0 1.80 2.9 557 400 A 60 TYR H A 60 TYR HBx 1.0 1.80 5.6 558 400 A 60 TYR H A 60 TYR HBy 1.0 1.80 5.6 559 401 A 61 TRP H A 60 TYR HBx 1.0 1.80 4.5 560 401 A 61 TRP H A 60 TYR HBy 1.0 1.80 4.5 561 402 A 60 TYR H A 60 TYR HD% 1.0 1.80 5.5 562 403 A 94 GLU H A 60 TYR HD% 1.0 1.80 7.0 563 404 A 61 TRP H A 60 TYR H 1.0 1.80 5.0 564 405 A 60 TYR H A 92 HIS HBx 1.0 1.80 6.0 565 405 A 60 TYR H A 92 HIS HBy 1.0 1.80 6.0 566 406 A 60 TYR H A 93 ARG HA 1.0 1.80 3.5 567 407 A 61 TRP H A 61 TRP HA 1.0 1.80 5.0 568 408 A 61 TRP HA A 62 LEU H 1.0 1.80 2.9 569 409 A 94 GLU H A 61 TRP HA 1.0 1.80 5.0 570 410 A 61 TRP H A 61 TRP HBy 1.0 1.80 5.6 571 410 A 61 TRP H A 61 TRP HBx 1.0 1.80 5.6 572 411 A 62 LEU H A 61 TRP HBy 1.0 1.80 6.0 573 411 A 62 LEU H A 61 TRP HBx 1.0 1.80 6.0 574 412 A 61 TRP HE1 A 96 GLN HA 1.0 1.80 5.0 575 413 A 61 TRP HE1 A 96 GLN HBx 1.0 1.80 6.0 576 413 A 61 TRP HE1 A 96 GLN HBy 1.0 1.80 6.0 577 414 A 61 TRP HE1 A 96 GLN HGx 1.0 1.80 4.5 578 414 A 61 TRP HE1 A 96 GLN HGy 1.0 1.80 4.5 579 415 A 61 TRP HE1 A 97 GLY H 1.0 1.80 5.0 580 416 A 61 TRP HE1 A 99 GLU HGx 1.0 1.80 4.5 581 416 A 61 TRP HE1 A 99 GLU HGy 1.0 1.80 4.5 582 417 A 61 TRP H A 62 LEU H 1.0 1.80 5.0 583 418 A 62 LEU H A 62 LEU HA 1.0 1.80 5.0 584 419 A 63 GLY H A 62 LEU HA 1.0 1.80 2.9 585 420 A 62 LEU H A 62 LEU HBx 1.0 1.80 3.5 586 420 A 62 LEU H A 62 LEU HBy 1.0 1.80 3.5 587 421 A 63 GLY H A 62 LEU HBx 1.0 1.80 6.0 588 421 A 63 GLY H A 62 LEU HBy 1.0 1.80 6.0 589 422 A 62 LEU H A 62 LEU HDx% 1.0 1.80 6.7 590 422 A 62 LEU H A 62 LEU HDy% 1.0 1.80 6.7 591 423 A 63 GLY H A 62 LEU HDx% 1.0 1.80 7.4 592 423 A 63 GLY H A 62 LEU HDy% 1.0 1.80 7.4 593 424 A 62 LEU H A 62 LEU HG 1.0 1.80 3.5 594 425 A 63 GLY H A 62 LEU H 1.0 1.80 5.0 595 426 A 94 GLU H A 62 LEU H 1.0 1.80 5.0 596 427 A 62 LEU H A 95 VAL HA 1.0 1.80 3.5 597 428 A 62 LEU H A 95 VAL HGx% 1.0 1.80 7.4 598 428 A 62 LEU H A 95 VAL HGy% 1.0 1.80 7.4 599 429 A 62 LEU H A 96 GLN H 1.0 1.80 5.0 600 430 A 63 GLY H A 63 GLY HAy 1.0 1.80 4.1 601 430 A 63 GLY H A 63 GLY HAx 1.0 1.80 4.1 602 431 A 64 ASN H A 63 GLY HAy 1.0 1.80 3.9 603 431 A 64 ASN H A 63 GLY HAx 1.0 1.80 3.9 604 432 A 65 GLU H A 63 GLY HAy 1.0 1.80 4.5 605 432 A 65 GLU H A 63 GLY HAx 1.0 1.80 4.5 606 433 A 66 CYS H A 63 GLY HAy 1.0 1.80 6.0 607 433 A 66 CYS H A 63 GLY HAx 1.0 1.80 6.0 608 434 A 63 GLY H A 64 ASN H 1.0 1.80 5.0 609 435 A 63 GLY H A 66 CYS HBx 1.0 1.80 4.5 610 435 A 63 GLY H A 66 CYS HBy 1.0 1.80 4.5 611 436 A 64 ASN H A 64 ASN HA 1.0 1.80 3.5 612 437 A 65 GLU H A 64 ASN HA 1.0 1.80 3.5 613 438 A 66 CYS H A 64 ASN HA 1.0 1.80 3.5 614 439 A 64 ASN H A 64 ASN HBx 1.0 1.80 3.5 615 439 A 64 ASN H A 64 ASN HBy 1.0 1.80 3.5 616 440 A 65 GLU H A 64 ASN HBx 1.0 1.80 4.5 617 440 A 65 GLU H A 64 ASN HBy 1.0 1.80 4.5 618 441 A 64 ASN H A 65 GLU H 1.0 1.80 3.5 619 442 A 64 ASN H A 66 CYS H 1.0 1.80 5.0 620 443 A 64 ASN H A 96 GLN HBx 1.0 1.80 4.5 621 443 A 64 ASN H A 96 GLN HBy 1.0 1.80 4.5 622 444 A 64 ASN H A 96 GLN H 1.0 1.80 5.0 623 445 A 65 GLU H A 65 GLU HA 1.0 1.80 3.5 624 446 A 66 CYS H A 65 GLU HA 1.0 1.80 3.5 625 447 A 65 GLU H A 65 GLU HBx 1.0 1.80 3.5 626 447 A 65 GLU H A 65 GLU HBy 1.0 1.80 3.5 627 448 A 66 CYS H A 65 GLU HBx 1.0 1.80 6.0 628 448 A 66 CYS H A 65 GLU HBy 1.0 1.80 6.0 629 449 A 65 GLU H A 65 GLU HGx 1.0 1.80 3.9 630 449 A 65 GLU H A 65 GLU HGy 1.0 1.80 3.9 631 450 A 66 CYS H A 65 GLU HGx 1.0 1.80 6.0 632 450 A 66 CYS H A 65 GLU HGy 1.0 1.80 6.0 633 451 A 65 GLU H A 66 CYS H 1.0 1.80 2.9 634 452 A 66 CYS HA A 67 SER H 1.0 1.80 3.5 635 453 A 66 CYS H A 66 CYS HBx 1.0 1.80 3.5 636 453 A 66 CYS H A 66 CYS HBy 1.0 1.80 3.5 637 454 A 67 SER H A 66 CYS HBx 1.0 1.80 4.5 638 454 A 66 CYS HBy A 67 SER H 1.0 1.80 4.5 639 455 A 66 CYS H A 67 SER H 1.0 1.80 5.0 640 456 A 67 SER HA A 68 GLN H 1.0 1.80 3.5 641 457 A 67 SER H A 67 SER HBy 1.0 1.80 3.5 642 457 A 67 SER H A 67 SER HBx 1.0 1.80 3.5 643 458 A 68 GLN H A 67 SER HBy 1.0 1.80 3.9 644 458 A 68 GLN H A 67 SER HBx 1.0 1.80 3.9 645 459 A 69 ASP H A 67 SER HBy 1.0 1.80 4.5 646 459 A 67 SER HBx A 69 ASP H 1.0 1.80 4.5 647 460 A 67 SER H A 68 GLN H 1.0 1.80 5.0 648 461 A 67 SER H A 70 GLU HBy 1.0 1.80 6.0 649 461 A 67 SER H A 70 GLU HBx 1.0 1.80 6.0 650 462 A 67 SER H A 70 GLU H 1.0 1.80 5.0 651 463 A 68 GLN H A 68 GLN HA 1.0 1.80 2.9 652 464 A 69 ASP H A 68 GLN HA 1.0 1.80 3.5 653 465 A 68 GLN H A 68 GLN HBx 1.0 1.80 3.5 654 465 A 68 GLN H A 68 GLN HBy 1.0 1.80 3.5 655 466 A 69 ASP H A 68 GLN HBx 1.0 1.80 3.9 656 466 A 69 ASP H A 68 GLN HBy 1.0 1.80 3.9 657 467 A 68 GLN H A 68 GLN HGx 1.0 1.80 4.5 658 467 A 68 GLN H A 68 GLN HGy 1.0 1.80 4.5 659 468 A 69 ASP H A 68 GLN HGx 1.0 1.80 4.5 660 468 A 69 ASP H A 68 GLN HGy 1.0 1.80 4.5 661 469 A 68 GLN H A 69 ASP H 1.0 1.80 2.9 662 470 A 69 ASP H A 69 ASP HA 1.0 1.80 2.9 663 471 A 70 GLU H A 69 ASP HA 1.0 1.80 5.0 664 472 A 69 ASP HA A 72 GLY H 1.0 1.80 5.0 665 473 A 69 ASP H A 69 ASP HBx 1.0 1.80 3.5 666 473 A 69 ASP H A 69 ASP HBy 1.0 1.80 3.5 667 474 A 70 GLU H A 69 ASP HBx 1.0 1.80 4.5 668 474 A 70 GLU H A 69 ASP HBy 1.0 1.80 4.5 669 475 A 69 ASP H A 70 GLU H 1.0 1.80 2.9 670 476 A 70 GLU H A 70 GLU HA 1.0 1.80 5.0 671 477 A 71 SER H A 70 GLU HA 1.0 1.80 3.5 672 478 A 70 GLU H A 70 GLU HBy 1.0 1.80 3.5 673 478 A 70 GLU HBx A 70 GLU H 1.0 1.80 3.5 674 479 A 71 SER H A 70 GLU HBy 1.0 1.80 4.5 675 479 A 71 SER H A 70 GLU HBx 1.0 1.80 4.5 676 480 A 70 GLU H A 70 GLU HGx 1.0 1.80 4.5 677 480 A 70 GLU H A 70 GLU HGy 1.0 1.80 4.5 678 481 A 71 SER H A 70 GLU HGx 1.0 1.80 4.5 679 481 A 71 SER H A 70 GLU HGy 1.0 1.80 4.5 680 482 A 70 GLU H A 71 SER HBy 1.0 1.80 4.5 681 482 A 70 GLU H A 71 SER HBx 1.0 1.80 4.5 682 483 A 71 SER H A 70 GLU H 1.0 1.80 2.9 683 484 A 72 GLY H A 71 SER HA 1.0 1.80 5.0 684 485 A 74 ALA H A 71 SER HA 1.0 1.80 5.0 685 486 A 71 SER H A 71 SER HBy 1.0 1.80 3.5 686 486 A 71 SER H A 71 SER HBx 1.0 1.80 3.5 687 487 A 71 SER H A 72 GLY H 1.0 1.80 2.9 688 488 A 72 GLY H A 72 GLY HAx 1.0 1.80 3.5 689 488 A 72 GLY H A 72 GLY HAy 1.0 1.80 3.5 690 489 A 73 ALA H A 72 GLY HAx 1.0 1.80 3.9 691 489 A 72 GLY HAy A 73 ALA H 1.0 1.80 3.9 692 490 A 72 GLY H A 73 ALA H 1.0 1.80 2.9 693 491 A 73 ALA HA A 76 ILE H 1.0 1.80 3.5 694 492 A 73 ALA HB% A 73 ALA H 1.0 1.80 4.0 695 493 A 73 ALA HB% A 74 ALA H 1.0 1.80 4.4 696 494 A 74 ALA H A 73 ALA H 1.0 1.80 2.9 697 495 A 74 ALA H A 74 ALA HA 1.0 1.80 2.9 698 496 A 74 ALA HA A 75 ALA H 1.0 1.80 3.5 699 497 A 77 PHE H A 74 ALA HA 1.0 1.80 3.5 700 498 A 74 ALA H A 74 ALA HB% 1.0 1.80 4.0 701 499 A 75 ALA H A 74 ALA HB% 1.0 1.80 4.4 702 500 A 74 ALA H A 75 ALA H 1.0 1.80 2.9 703 501 A 75 ALA H A 75 ALA HA 1.0 1.80 2.9 704 502 A 76 ILE H A 75 ALA HA 1.0 1.80 5.0 705 503 A 78 THR H A 75 ALA HA 1.0 1.80 5.0 706 504 A 75 ALA H A 75 ALA HB% 1.0 1.80 4.0 707 505 A 76 ILE H A 75 ALA HB% 1.0 1.80 4.4 708 506 A 76 ILE H A 75 ALA H 1.0 1.80 2.9 709 507 A 76 ILE H A 76 ILE HA 1.0 1.80 2.9 710 508 A 77 PHE H A 76 ILE HA 1.0 1.80 5.0 711 509 A 76 ILE HA A 79 VAL H 1.0 1.80 3.5 712 510 A 76 ILE H A 76 ILE HB 1.0 1.80 2.9 713 511 A 77 PHE H A 76 ILE HB 1.0 1.80 2.9 714 512 A 76 ILE H A 76 ILE HG1x 1.0 1.80 3.5 715 513 A 77 PHE H A 76 ILE HG1x 1.0 1.80 5.0 716 514 A 76 ILE H A 76 ILE HG1y 1.0 1.80 2.9 717 515 A 77 PHE H A 76 ILE HG1y 1.0 1.80 5.0 718 516 A 76 ILE H A 76 ILE HG2% 1.0 1.80 4.4 719 517 A 77 PHE H A 76 ILE HG2% 1.0 1.80 5.0 720 518 A 77 PHE H A 76 ILE H 1.0 1.80 2.9 721 519 A 77 PHE H A 77 PHE HA 1.0 1.80 3.5 722 520 A 78 THR H A 77 PHE HA 1.0 1.80 5.0 723 521 A 77 PHE HA A 80 GLN H 1.0 1.80 5.0 724 522 A 77 PHE H A 77 PHE HBx 1.0 1.80 3.5 725 522 A 77 PHE H A 77 PHE HBy 1.0 1.80 3.5 726 523 A 78 THR H A 77 PHE HBx 1.0 1.80 4.5 727 523 A 78 THR H A 77 PHE HBy 1.0 1.80 4.5 728 524 A 77 PHE H A 77 PHE HD% 1.0 1.80 5.5 729 525 A 78 THR H A 77 PHE HD% 1.0 1.80 7.0 730 526 A 77 PHE H A 78 THR H 1.0 1.80 2.9 731 527 A 78 THR H A 78 THR HA 1.0 1.80 3.5 732 528 A 78 THR HA A 81 LEU H 1.0 1.80 5.0 733 529 A 78 THR H A 78 THR HB 1.0 1.80 2.9 734 530 A 79 VAL H A 78 THR HB 1.0 1.80 3.5 735 531 A 78 THR H A 78 THR HG2% 1.0 1.80 5.0 736 532 A 78 THR H A 79 VAL H 1.0 1.80 2.9 737 533 A 79 VAL H A 79 VAL HA 1.0 1.80 2.9 738 534 A 80 GLN H A 79 VAL HA 1.0 1.80 5.0 739 535 A 79 VAL HA A 82 ASP H 1.0 1.80 5.0 740 536 A 79 VAL H A 79 VAL HB 1.0 1.80 2.9 741 537 A 80 GLN H A 79 VAL HB 1.0 1.80 2.9 742 538 A 79 VAL H A 79 VAL HGx% 1.0 1.80 4.6 743 538 A 79 VAL H A 79 VAL HGy% 1.0 1.80 4.6 744 539 A 80 GLN H A 79 VAL HGx% 1.0 1.80 5.9 745 539 A 80 GLN H A 79 VAL HGy% 1.0 1.80 5.9 746 540 A 79 VAL H A 80 GLN H 1.0 1.80 2.9 747 541 A 79 VAL H A 81 LEU H 1.0 1.80 5.0 748 542 A 80 GLN H A 80 GLN HA 1.0 1.80 2.9 749 543 A 81 LEU H A 80 GLN HA 1.0 1.80 5.0 750 544 A 80 GLN HA A 83 ASP H 1.0 1.80 3.5 751 545 A 80 GLN H A 80 GLN HBx 1.0 1.80 3.5 752 545 A 80 GLN H A 80 GLN HBy 1.0 1.80 3.5 753 546 A 81 LEU H A 80 GLN HBx 1.0 1.80 4.5 754 546 A 81 LEU H A 80 GLN HBy 1.0 1.80 4.5 755 547 A 80 GLN H A 80 GLN HGx 1.0 1.80 3.9 756 547 A 80 GLN H A 80 GLN HGy 1.0 1.80 3.9 757 548 A 81 LEU H A 80 GLN HGx 1.0 1.80 6.0 758 548 A 81 LEU H A 80 GLN HGy 1.0 1.80 6.0 759 549 A 80 GLN H A 81 LEU H 1.0 1.80 3.5 760 550 A 81 LEU H A 81 LEU HA 1.0 1.80 3.5 761 551 A 82 ASP H A 81 LEU HA 1.0 1.80 5.0 762 552 A 81 LEU HA A 84 TYR H 1.0 1.80 3.5 763 553 A 81 LEU H A 81 LEU HBy 1.0 1.80 3.5 764 553 A 81 LEU H A 81 LEU HBx 1.0 1.80 3.5 765 554 A 82 ASP H A 81 LEU HBy 1.0 1.80 3.9 766 554 A 82 ASP H A 81 LEU HBx 1.0 1.80 3.9 767 555 A 81 LEU H A 81 LEU HDx% 1.0 1.80 6.7 768 555 A 81 LEU H A 81 LEU HDy% 1.0 1.80 6.7 769 556 A 81 LEU H A 82 ASP H 1.0 1.80 2.9 770 557 A 82 ASP H A 82 ASP HA 1.0 1.80 3.5 771 558 A 82 ASP HA A 85 LEU H 1.0 1.80 2.9 772 559 A 82 ASP H A 82 ASP HBy 1.0 1.80 3.5 773 559 A 82 ASP H A 82 ASP HBx 1.0 1.80 3.5 774 560 A 83 ASP H A 82 ASP HBy 1.0 1.80 3.9 775 560 A 83 ASP H A 82 ASP HBx 1.0 1.80 3.9 776 561 A 82 ASP H A 83 ASP H 1.0 1.80 2.9 777 562 A 83 ASP H A 83 ASP HA 1.0 1.80 2.9 778 563 A 83 ASP HA A 86 ASN H 1.0 1.80 3.5 779 564 A 83 ASP HA A 87 GLY H 1.0 1.80 3.5 780 565 A 83 ASP H A 83 ASP HBx 1.0 1.80 3.5 781 565 A 83 ASP H A 83 ASP HBy 1.0 1.80 3.5 782 566 A 84 TYR H A 83 ASP HBx 1.0 1.80 4.5 783 566 A 84 TYR H A 83 ASP HBy 1.0 1.80 4.5 784 567 A 83 ASP H A 84 TYR H 1.0 1.80 3.5 785 568 A 84 TYR H A 84 TYR HA 1.0 1.80 2.9 786 569 A 85 LEU H A 84 TYR HA 1.0 1.80 5.0 787 570 A 84 TYR H A 84 TYR HBx 1.0 1.80 3.5 788 570 A 84 TYR H A 84 TYR HBy 1.0 1.80 3.5 789 571 A 85 LEU H A 84 TYR HBx 1.0 1.80 4.5 790 571 A 85 LEU H A 84 TYR HBy 1.0 1.80 4.5 791 572 A 84 TYR H A 84 TYR HD% 1.0 1.80 5.5 792 573 A 85 LEU H A 84 TYR HD% 1.0 1.80 7.0 793 574 A 84 TYR H A 85 LEU HBy 1.0 1.80 6.0 794 574 A 84 TYR H A 85 LEU HBx 1.0 1.80 6.0 795 575 A 84 TYR H A 85 LEU H 1.0 1.80 2.9 796 576 A 86 ASN H A 85 LEU HA 1.0 1.80 3.5 797 577 A 85 LEU H A 85 LEU HBy 1.0 1.80 3.5 798 577 A 85 LEU H A 85 LEU HBx 1.0 1.80 3.5 799 578 A 86 ASN H A 85 LEU HBy 1.0 1.80 6.0 800 578 A 86 ASN H A 85 LEU HBx 1.0 1.80 6.0 801 579 A 87 GLY H A 85 LEU HBy 1.0 1.80 6.0 802 579 A 87 GLY H A 85 LEU HBx 1.0 1.80 6.0 803 580 A 85 LEU H A 85 LEU HDx% 1.0 1.80 5.2 804 580 A 85 LEU H A 85 LEU HDy% 1.0 1.80 5.2 805 581 A 86 ASN H A 85 LEU HDx% 1.0 1.80 7.4 806 581 A 86 ASN H A 85 LEU HDy% 1.0 1.80 7.4 807 582 A 85 LEU H A 86 ASN H 1.0 1.80 2.9 808 583 A 86 ASN H A 86 ASN HA 1.0 1.80 3.5 809 584 A 87 GLY H A 86 ASN HA 1.0 1.80 3.5 810 585 A 86 ASN H A 86 ASN HBx 1.0 1.80 4.1 811 585 A 86 ASN H A 86 ASN HBy 1.0 1.80 4.1 812 586 A 87 GLY H A 86 ASN HBx 1.0 1.80 6.0 813 586 A 87 GLY H A 86 ASN HBy 1.0 1.80 6.0 814 587 A 86 ASN H A 87 GLY H 1.0 1.80 2.9 815 588 A 87 GLY H A 87 GLY HAx 1.0 1.80 3.5 816 588 A 87 GLY H A 87 GLY HAy 1.0 1.80 3.5 817 589 A 88 ARG H A 87 GLY HAx 1.0 1.80 4.5 818 589 A 87 GLY HAy A 88 ARG H 1.0 1.80 4.5 819 590 A 87 GLY H A 88 ARG HBy 1.0 1.80 6.0 820 590 A 87 GLY H A 88 ARG HBx 1.0 1.80 6.0 821 591 A 87 GLY H A 88 ARG H 1.0 1.80 2.9 822 592 A 88 ARG H A 88 ARG HA 1.0 1.80 2.9 823 593 A 88 ARG HA A 89 ALA H 1.0 1.80 3.5 824 594 A 88 ARG H A 88 ARG HBy 1.0 1.80 3.5 825 594 A 88 ARG H A 88 ARG HBx 1.0 1.80 3.5 826 595 A 89 ALA H A 88 ARG HBy 1.0 1.80 4.5 827 595 A 88 ARG HBx A 89 ALA H 1.0 1.80 4.5 828 596 A 88 ARG H A 88 ARG HGx 1.0 1.80 3.9 829 596 A 88 ARG H A 88 ARG HGy 1.0 1.80 3.9 830 597 A 89 ALA H A 88 ARG HGx 1.0 1.80 6.0 831 597 A 89 ALA H A 88 ARG HGy 1.0 1.80 6.0 832 598 A 88 ARG H A 89 ALA H 1.0 1.80 2.9 833 599 A 89 ALA HA A 89 ALA H 1.0 1.80 3.5 834 600 A 90 VAL H A 89 ALA HA 1.0 1.80 2.9 835 601 A 89 ALA HB% A 89 ALA H 1.0 1.80 4.0 836 602 A 90 VAL H A 90 VAL HA 1.0 1.80 3.5 837 603 A 90 VAL HA A 91 GLN H 1.0 1.80 2.9 838 604 A 90 VAL H A 90 VAL HB 1.0 1.80 2.9 839 605 A 90 VAL H A 90 VAL HGx% 1.0 1.80 4.6 840 605 A 90 VAL H A 90 VAL HGy% 1.0 1.80 4.6 841 606 A 91 GLN H A 90 VAL HGx% 1.0 1.80 5.3 842 606 A 91 GLN H A 90 VAL HGy% 1.0 1.80 5.3 843 607 A 90 VAL H A 91 GLN H 1.0 1.80 5.0 844 608 A 91 GLN HA A 91 GLN H 1.0 1.80 3.5 845 609 A 91 GLN HA A 92 HIS H 1.0 1.80 2.9 846 610 A 91 GLN H A 91 GLN HBx 1.0 1.80 3.5 847 610 A 91 GLN H A 91 GLN HBy 1.0 1.80 3.5 848 611 A 92 HIS H A 91 GLN HBx 1.0 1.80 4.5 849 611 A 92 HIS H A 91 GLN HBy 1.0 1.80 4.5 850 612 A 91 GLN H A 91 GLN HGx 1.0 1.80 4.5 851 612 A 91 GLN H A 91 GLN HGy 1.0 1.80 4.5 852 613 A 92 HIS H A 91 GLN HGx 1.0 1.80 6.0 853 613 A 92 HIS H A 91 GLN HGy 1.0 1.80 6.0 854 614 A 92 HIS H A 92 HIS HA 1.0 1.80 3.5 855 615 A 92 HIS HA A 93 ARG H 1.0 1.80 2.9 856 616 A 92 HIS H A 92 HIS HBx 1.0 1.80 4.1 857 616 A 92 HIS H A 92 HIS HBy 1.0 1.80 4.1 858 617 A 93 ARG H A 92 HIS HBx 1.0 1.80 4.5 859 617 A 92 HIS HBy A 93 ARG H 1.0 1.80 4.5 860 618 A 92 HIS H A 92 HIS HD2 1.0 1.80 3.5 861 619 A 92 HIS HE1 A 103 PHE H 1.0 1.80 5.0 862 620 A 93 ARG HA A 93 ARG H 1.0 1.80 3.5 863 621 A 94 GLU H A 93 ARG HA 1.0 1.80 2.9 864 622 A 93 ARG H A 93 ARG HBx 1.0 1.80 3.5 865 622 A 93 ARG H A 93 ARG HBy 1.0 1.80 3.5 866 623 A 94 GLU H A 93 ARG HBx 1.0 1.80 4.5 867 623 A 94 GLU H A 93 ARG HBy 1.0 1.80 4.5 868 624 A 93 ARG H A 93 ARG HGx 1.0 1.80 6.0 869 624 A 93 ARG H A 93 ARG HGy 1.0 1.80 6.0 870 625 A 94 GLU H A 93 ARG HGx 1.0 1.80 4.5 871 625 A 94 GLU H A 93 ARG HGy 1.0 1.80 4.5 872 626 A 94 GLU H A 94 GLU HA 1.0 1.80 3.5 873 627 A 94 GLU HA A 95 VAL H 1.0 1.80 2.9 874 628 A 95 VAL H A 94 GLU HBx 1.0 1.80 6.0 875 628 A 95 VAL H A 94 GLU HBy 1.0 1.80 6.0 876 629 A 94 GLU H A 94 GLU HGy 1.0 1.80 4.5 877 629 A 94 GLU H A 94 GLU HGx 1.0 1.80 4.5 878 630 A 94 GLU H A 95 VAL H 1.0 1.80 5.0 879 631 A 95 VAL HA A 95 VAL H 1.0 1.80 3.5 880 632 A 95 VAL HA A 96 GLN H 1.0 1.80 2.9 881 633 A 95 VAL H A 95 VAL HB 1.0 1.80 2.9 882 634 A 96 GLN H A 95 VAL HB 1.0 1.80 5.0 883 635 A 95 VAL HB A 98 PHE H 1.0 1.80 5.0 884 636 A 95 VAL H A 95 VAL HGx% 1.0 1.80 4.6 885 636 A 95 VAL HGy% A 95 VAL H 1.0 1.80 4.6 886 637 A 96 GLN H A 95 VAL HGx% 1.0 1.80 5.9 887 637 A 95 VAL HGy% A 96 GLN H 1.0 1.80 5.9 888 638 A 98 PHE H A 95 VAL HGx% 1.0 1.80 7.4 889 638 A 95 VAL HGy% A 98 PHE H 1.0 1.80 7.4 890 639 A 96 GLN H A 95 VAL H 1.0 1.80 5.0 891 640 A 95 VAL H A 99 GLU HA 1.0 1.80 5.0 892 641 A 96 GLN HA A 96 GLN H 1.0 1.80 5.0 893 642 A 96 GLN HA A 97 GLY H 1.0 1.80 2.9 894 643 A 96 GLN HA A 98 PHE H 1.0 1.80 5.0 895 644 A 96 GLN H A 96 GLN HBx 1.0 1.80 3.5 896 644 A 96 GLN HBy A 96 GLN H 1.0 1.80 3.5 897 645 A 97 GLY H A 96 GLN HBx 1.0 1.80 4.5 898 645 A 96 GLN HBy A 97 GLY H 1.0 1.80 4.5 899 646 A 97 GLY H A 96 GLN H 1.0 1.80 5.0 900 647 A 97 GLY H A 97 GLY HAx 1.0 1.80 3.5 901 647 A 97 GLY H A 97 GLY HAy 1.0 1.80 3.5 902 648 A 98 PHE H A 97 GLY HAx 1.0 1.80 4.5 903 648 A 98 PHE H A 97 GLY HAy 1.0 1.80 4.5 904 649 A 97 GLY H A 98 PHE H 1.0 1.80 2.9 905 650 A 97 GLY H A 99 GLU H 1.0 1.80 3.5 906 651 A 98 PHE H A 98 PHE HA 1.0 1.80 3.5 907 652 A 99 GLU H A 98 PHE HA 1.0 1.80 3.5 908 653 A 98 PHE H A 98 PHE HBy 1.0 1.80 4.1 909 653 A 98 PHE H A 98 PHE HBx 1.0 1.80 4.1 910 654 A 99 GLU H A 98 PHE HBy 1.0 1.80 6.0 911 654 A 99 GLU H A 98 PHE HBx 1.0 1.80 6.0 912 655 A 98 PHE H A 98 PHE HD% 1.0 1.80 5.5 913 656 A 98 PHE H A 99 GLU H 1.0 1.80 3.5 914 657 A 99 GLU H A 100 SER H 1.0 1.80 5.0 915 658 A 99 GLU HA A 100 SER H 1.0 1.80 2.9 916 659 A 99 GLU HA A 99 GLU H 1.0 1.80 3.5 917 660 A 100 SER H A 99 GLU HBx 1.0 1.80 4.5 918 660 A 100 SER H A 99 GLU HBy 1.0 1.80 4.5 919 661 A 99 GLU H A 99 GLU HBx 1.0 1.80 3.5 920 661 A 99 GLU H A 99 GLU HBy 1.0 1.80 3.5 921 662 A 100 SER H A 99 GLU HGx 1.0 1.80 6.0 922 662 A 99 GLU HGy A 100 SER H 1.0 1.80 6.0 923 663 A 99 GLU H A 99 GLU HGx 1.0 1.80 6.0 924 663 A 99 GLU HGy A 99 GLU H 1.0 1.80 6.0 925 664 A 99 GLU H A 104 LEU HDx% 1.0 1.80 5.9 926 664 A 99 GLU H A 104 LEU HDy% 1.0 1.80 5.9 927 665 A 100 SER H A 100 SER HA 1.0 1.80 3.5 928 666 A 100 SER HA A 101 ALA H 1.0 1.80 2.9 929 667 A 101 ALA H A 100 SER HBx 1.0 1.80 3.9 930 667 A 101 ALA H A 100 SER HBy 1.0 1.80 3.9 931 668 A 102 THR H A 100 SER HBx 1.0 1.80 3.9 932 668 A 100 SER HBy A 102 THR H 1.0 1.80 3.9 933 669 A 100 SER H A 101 ALA H 1.0 1.80 5.0 934 670 A 100 SER H A 103 PHE HBx 1.0 1.80 6.0 935 670 A 100 SER H A 103 PHE HBy 1.0 1.80 6.0 936 671 A 100 SER H A 103 PHE HD% 1.0 1.80 7.0 937 672 A 103 PHE H A 100 SER H 1.0 1.80 5.0 938 673 A 100 SER H A 104 LEU HBy 1.0 1.80 6.0 939 673 A 100 SER H A 104 LEU HBx 1.0 1.80 6.0 940 674 A 100 SER H A 104 LEU HDx% 1.0 1.80 7.4 941 674 A 100 SER H A 104 LEU HDy% 1.0 1.80 7.4 942 675 A 101 ALA H A 101 ALA HA 1.0 1.80 2.9 943 676 A 102 THR H A 101 ALA HA 1.0 1.80 3.5 944 677 A 101 ALA HA A 104 LEU H 1.0 1.80 3.5 945 678 A 101 ALA H A 101 ALA HB% 1.0 1.80 4.0 946 679 A 102 THR H A 101 ALA HB% 1.0 1.80 4.4 947 680 A 101 ALA H A 102 THR H 1.0 1.80 2.9 948 681 A 103 PHE H A 101 ALA H 1.0 1.80 5.0 949 682 A 102 THR H A 102 THR HA 1.0 1.80 2.9 950 683 A 103 PHE H A 102 THR HA 1.0 1.80 3.5 951 684 A 102 THR HA A 105 GLY H 1.0 1.80 5.0 952 685 A 102 THR H A 102 THR HB 1.0 1.80 2.9 953 686 A 103 PHE H A 102 THR HB 1.0 1.80 2.9 954 687 A 102 THR H A 102 THR HG2% 1.0 1.80 5.0 955 688 A 103 PHE H A 102 THR HG2% 1.0 1.80 5.0 956 689 A 103 PHE H A 102 THR H 1.0 1.80 2.9 957 690 A 103 PHE H A 103 PHE HA 1.0 1.80 2.9 958 691 A 106 TYR H A 103 PHE HA 1.0 1.80 5.0 959 692 A 103 PHE H A 103 PHE HBx 1.0 1.80 3.5 960 692 A 103 PHE H A 103 PHE HBy 1.0 1.80 3.5 961 693 A 104 LEU H A 103 PHE HBx 1.0 1.80 4.5 962 693 A 103 PHE HBy A 104 LEU H 1.0 1.80 4.5 963 694 A 103 PHE H A 103 PHE HD% 1.0 1.80 5.5 964 695 A 103 PHE HD% A 104 LEU H 1.0 1.80 7.0 965 696 A 103 PHE H A 104 LEU H 1.0 1.80 3.5 966 697 A 104 LEU H A 104 LEU HA 1.0 1.80 2.9 967 698 A 104 LEU HA A 107 PHE H 1.0 1.80 3.5 968 699 A 104 LEU H A 104 LEU HBy 1.0 1.80 4.1 969 699 A 104 LEU HBx A 104 LEU H 1.0 1.80 4.1 970 700 A 105 GLY H A 104 LEU HBy 1.0 1.80 4.5 971 700 A 104 LEU HBx A 105 GLY H 1.0 1.80 4.5 972 701 A 104 LEU H A 104 LEU HDx% 1.0 1.80 4.6 973 701 A 104 LEU HDy% A 104 LEU H 1.0 1.80 4.6 974 702 A 105 GLY H A 104 LEU HDx% 1.0 1.80 7.4 975 702 A 104 LEU HDy% A 105 GLY H 1.0 1.80 7.4 976 703 A 104 LEU H A 104 LEU HG 1.0 1.80 2.9 977 704 A 104 LEU H A 105 GLY H 1.0 1.80 3.5 978 705 A 105 GLY H A 105 GLY HAx 1.0 1.80 3.5 979 705 A 105 GLY H A 105 GLY HAy 1.0 1.80 3.5 980 706 A 106 TYR H A 105 GLY HAx 1.0 1.80 4.5 981 706 A 106 TYR H A 105 GLY HAy 1.0 1.80 4.5 982 707 A 106 TYR H A 105 GLY H 1.0 1.80 2.9 983 708 A 106 TYR H A 106 TYR HA 1.0 1.80 2.9 984 709 A 107 PHE H A 106 TYR HA 1.0 1.80 5.0 985 710 A 106 TYR H A 106 TYR HBx 1.0 1.80 3.5 986 710 A 106 TYR H A 106 TYR HBy 1.0 1.80 3.5 987 711 A 107 PHE H A 106 TYR HBx 1.0 1.80 6.0 988 711 A 107 PHE H A 106 TYR HBy 1.0 1.80 6.0 989 712 A 106 TYR H A 106 TYR HD% 1.0 1.80 4.9 990 713 A 107 PHE H A 106 TYR HD% 1.0 1.80 7.0 991 714 A 106 TYR H A 106 TYR HE% 1.0 1.80 7.0 992 715 A 107 PHE H A 106 TYR HE% 1.0 1.80 7.0 993 716 A 106 TYR H A 107 PHE HD% 1.0 1.80 5.5 994 717 A 107 PHE H A 107 PHE HA 1.0 1.80 3.5 995 718 A 107 PHE HA A 108 LYS H 1.0 1.80 2.9 996 719 A 107 PHE H A 107 PHE HBy 1.0 1.80 3.5 997 719 A 107 PHE H A 107 PHE HBx 1.0 1.80 3.5 998 720 A 108 LYS H A 107 PHE HBy 1.0 1.80 4.5 999 720 A 108 LYS H A 107 PHE HBx 1.0 1.80 4.5 1000 721 A 110 GLY H A 107 PHE HBy 1.0 1.80 6.0 1001 721 A 107 PHE HBx A 110 GLY H 1.0 1.80 6.0 1002 722 A 107 PHE H A 107 PHE HD% 1.0 1.80 4.9 1003 723 A 107 PHE HD% A 108 LYS H 1.0 1.80 7.0 1004 724 A 107 PHE H A 108 LYS H 1.0 1.80 5.0 1005 725 A 107 PHE H A 111 LEU HDx% 1.0 1.80 7.4 1006 725 A 107 PHE H A 111 LEU HDy% 1.0 1.80 7.4 1007 726 A 108 LYS H A 108 LYS HA 1.0 1.80 2.9 1008 727 A 108 LYS HA A 109 SER H 1.0 1.80 3.5 1009 728 A 108 LYS H A 108 LYS HBx 1.0 1.80 3.5 1010 728 A 108 LYS H A 108 LYS HBy 1.0 1.80 3.5 1011 729 A 109 SER H A 108 LYS HBx 1.0 1.80 3.9 1012 729 A 109 SER H A 108 LYS HBy 1.0 1.80 3.9 1013 730 A 110 GLY H A 108 LYS HBx 1.0 1.80 6.0 1014 730 A 110 GLY H A 108 LYS HBy 1.0 1.80 6.0 1015 731 A 108 LYS H A 108 LYS HGx 1.0 1.80 4.5 1016 731 A 108 LYS H A 108 LYS HGy 1.0 1.80 4.5 1017 732 A 109 SER H A 108 LYS HGx 1.0 1.80 4.5 1018 732 A 109 SER H A 108 LYS HGy 1.0 1.80 4.5 1019 733 A 108 LYS H A 109 SER H 1.0 1.80 2.9 1020 734 A 108 LYS H A 110 GLY H 1.0 1.80 5.0 1021 735 A 109 SER H A 109 SER HA 1.0 1.80 2.9 1022 736 A 110 GLY H A 109 SER HA 1.0 1.80 3.5 1023 737 A 109 SER H A 109 SER HBx 1.0 1.80 3.5 1024 737 A 109 SER H A 109 SER HBy 1.0 1.80 3.5 1025 738 A 110 GLY H A 109 SER HBx 1.0 1.80 3.9 1026 738 A 110 GLY H A 109 SER HBy 1.0 1.80 3.9 1027 739 A 110 GLY H A 109 SER H 1.0 1.80 2.9 1028 740 A 110 GLY H A 110 GLY HAx 1.0 1.80 3.5 1029 740 A 110 GLY H A 110 GLY HAy 1.0 1.80 3.5 1030 741 A 111 LEU H A 110 GLY HAx 1.0 1.80 3.9 1031 741 A 110 GLY HAy A 111 LEU H 1.0 1.80 3.9 1032 742 A 110 GLY H A 111 LEU H 1.0 1.80 3.5 1033 743 A 111 LEU H A 111 LEU HA 1.0 1.80 3.5 1034 744 A 112 LYS H A 111 LEU HA 1.0 1.80 3.5 1035 745 A 111 LEU H A 111 LEU HBx 1.0 1.80 3.5 1036 745 A 111 LEU H A 111 LEU HBy 1.0 1.80 3.5 1037 746 A 112 LYS H A 111 LEU HBx 1.0 1.80 3.9 1038 746 A 112 LYS H A 111 LEU HBy 1.0 1.80 3.9 1039 747 A 111 LEU H A 111 LEU HDx% 1.0 1.80 5.2 1040 747 A 111 LEU HDy% A 111 LEU H 1.0 1.80 5.2 1041 748 A 112 LYS H A 111 LEU HDx% 1.0 1.80 7.4 1042 748 A 112 LYS H A 111 LEU HDy% 1.0 1.80 7.4 1043 749 A 112 LYS H A 111 LEU H 1.0 1.80 3.5 1044 750 A 112 LYS H A 112 LYS HA 1.0 1.80 3.5 1045 751 A 112 LYS HA A 113 TYR H 1.0 1.80 2.9 1046 752 A 112 LYS H A 112 LYS HBy 1.0 1.80 3.5 1047 752 A 112 LYS H A 112 LYS HBx 1.0 1.80 3.5 1048 753 A 113 TYR H A 112 LYS HBy 1.0 1.80 4.5 1049 753 A 113 TYR H A 112 LYS HBx 1.0 1.80 4.5 1050 754 A 113 TYR H A 112 LYS HGx 1.0 1.80 4.5 1051 754 A 113 TYR H A 112 LYS HGy 1.0 1.80 4.5 1052 755 A 112 LYS H A 113 TYR H 1.0 1.80 5.0 1053 756 A 113 TYR HA A 113 TYR H 1.0 1.80 3.5 1054 757 A 114 LYS H A 113 TYR HA 1.0 1.80 2.9 1055 758 A 113 TYR H A 113 TYR HBy 1.0 1.80 3.5 1056 758 A 113 TYR H A 113 TYR HBx 1.0 1.80 3.5 1057 759 A 114 LYS H A 113 TYR HBy 1.0 1.80 6.0 1058 759 A 114 LYS H A 113 TYR HBx 1.0 1.80 6.0 1059 760 A 113 TYR H A 113 TYR HD% 1.0 1.80 5.5 1060 761 A 114 LYS H A 113 TYR HD% 1.0 1.80 7.0 1061 762 A 113 TYR H A 113 TYR HE% 1.0 1.80 7.0 1062 763 A 114 LYS H A 113 TYR H 1.0 1.80 5.0 1063 764 A 114 LYS H A 114 LYS HA 1.0 1.80 3.5 1064 765 A 114 LYS HA A 115 LYS H 1.0 1.80 2.9 1065 766 A 114 LYS H A 114 LYS HBx 1.0 1.80 4.1 1066 766 A 114 LYS H A 114 LYS HBy 1.0 1.80 4.1 1067 767 A 115 LYS H A 114 LYS HBx 1.0 1.80 4.5 1068 767 A 115 LYS H A 114 LYS HBy 1.0 1.80 4.5 1069 768 A 114 LYS H A 114 LYS HGx 1.0 1.80 6.0 1070 768 A 114 LYS H A 114 LYS HGy 1.0 1.80 6.0 1071 769 A 115 LYS H A 114 LYS HGx 1.0 1.80 6.0 1072 769 A 115 LYS H A 114 LYS HGy 1.0 1.80 6.0 1073 770 A 114 LYS H A 115 LYS H 1.0 1.80 5.0 1074 771 A 116 GLY H A 115 LYS HA 1.0 1.80 2.9 1075 772 A 115 LYS H A 115 LYS HBx 1.0 1.80 3.5 1076 772 A 115 LYS H A 115 LYS HBy 1.0 1.80 3.5 1077 773 A 116 GLY H A 115 LYS HBx 1.0 1.80 4.5 1078 773 A 116 GLY H A 115 LYS HBy 1.0 1.80 4.5 1079 774 A 115 LYS H A 115 LYS HGx 1.0 1.80 3.9 1080 774 A 115 LYS H A 115 LYS HGy 1.0 1.80 3.9 1081 775 A 116 GLY H A 115 LYS HGx 1.0 1.80 4.5 1082 775 A 116 GLY H A 115 LYS HGy 1.0 1.80 4.5 1083 776 A 116 GLY H A 116 GLY HAy 1.0 1.80 3.5 1084 776 A 116 GLY H A 116 GLY HAx 1.0 1.80 3.5 1085 777 A 117 GLY H A 116 GLY HAy 1.0 1.80 3.9 1086 777 A 117 GLY H A 116 GLY HAx 1.0 1.80 3.9 1087 778 A 116 GLY H A 117 GLY H 1.0 1.80 5.0 1088 779 A 117 GLY H A 117 GLY HAx 1.0 1.80 3.5 1089 779 A 117 GLY H A 117 GLY HAy 1.0 1.80 3.5 1090 780 A 117 GLY H A 118 VAL H 1.0 1.80 5.0 1091 781 A 118 VAL H A 118 VAL HA 1.0 1.80 3.5 1092 782 A 118 VAL HA A 119 ALA H 1.0 1.80 3.5 1093 783 A 118 VAL H A 118 VAL HB 1.0 1.80 5.0 1094 784 A 119 ALA H A 118 VAL HB 1.0 1.80 3.5 1095 785 A 118 VAL H A 118 VAL HGx% 1.0 1.80 6.7 1096 785 A 118 VAL H A 118 VAL HG21 1.0 1.80 6.7 1097 786 A 119 ALA H A 118 VAL HGx% 1.0 1.80 5.9 1098 786 A 119 ALA H A 118 VAL HG21 1.0 1.80 5.9 1099 787 A 120 SER H A 118 VAL HGx% 1.0 1.80 7.4 1100 787 A 118 VAL HG21 A 120 SER H 1.0 1.80 7.4 1101 788 A 118 VAL H A 119 ALA H 1.0 1.80 3.5 1102 789 A 119 ALA H A 119 ALA HA 1.0 1.80 2.9 1103 790 A 120 SER H A 119 ALA HA 1.0 1.80 3.5 1104 791 A 119 ALA H A 119 ALA HB% 1.0 1.80 4.0 1105 792 A 120 SER H A 119 ALA HB% 1.0 1.80 5.0 1106 793 A 119 ALA HB% A 122 PHE H 1.0 1.80 6.5 1107 794 A 119 ALA H A 120 SER H 1.0 1.80 3.5 1108 795 A 120 SER HA A 121 GLY H 1.0 1.80 2.9 1109 796 A 122 PHE H A 120 SER HA 1.0 1.80 5.0 1110 797 A 120 SER H A 120 SER HBx 1.0 1.80 3.5 1111 797 A 120 SER H A 120 SER HBy 1.0 1.80 3.5 1112 798 A 121 GLY H A 120 SER HBx 1.0 1.80 3.9 1113 798 A 121 GLY H A 120 SER HBy 1.0 1.80 3.9 1114 799 A 120 SER H A 121 GLY H 1.0 1.80 3.5 1115 800 A 122 PHE H A 121 GLY HAx 1.0 1.80 3.9 1116 800 A 122 PHE H A 121 GLY HAy 1.0 1.80 3.9 1117 801 A 122 PHE H A 121 GLY H 1.0 1.80 2.9 1118 802 A 122 PHE H A 122 PHE HA 1.0 1.80 3.5 1119 803 A 122 PHE HA A 123 LYS H 1.0 1.80 3.5 1120 804 A 122 PHE H A 122 PHE HBy 1.0 1.80 3.5 1121 804 A 122 PHE H A 122 PHE HBx 1.0 1.80 3.5 1122 805 A 123 LYS H A 122 PHE HBy 1.0 1.80 3.9 1123 805 A 123 LYS H A 122 PHE HBx 1.0 1.80 3.9 1124 806 A 122 PHE H A 122 PHE HD% 1.0 1.80 4.9 1125 807 A 123 LYS H A 122 PHE HD% 1.0 1.80 7.0 1126 808 A 122 PHE H A 123 LYS H 1.0 1.80 2.9 1127 809 A 123 LYS H A 123 LYS HA 1.0 1.80 2.9 1128 810 A 123 LYS H A 123 LYS HBx 1.0 1.80 3.5 1129 810 A 123 LYS H A 123 LYS HBy 1.0 1.80 3.5 1130 811 A 124 HIS HA A 125 VAL H 1.0 1.80 2.9 1131 812 A 125 VAL H A 124 HIS HBx 1.0 1.80 4.5 1132 812 A 125 VAL H A 124 HIS HBy 1.0 1.80 4.5 1133 813 A 125 VAL H A 125 VAL HA 1.0 1.80 3.5 1134 814 A 125 VAL HA A 126 VAL H 1.0 1.80 2.9 1135 815 A 125 VAL H A 125 VAL HB 1.0 1.80 2.9 1136 816 A 125 VAL H A 125 VAL HGx% 1.0 1.80 4.6 1137 816 A 125 VAL H A 125 VAL HG21 1.0 1.80 4.6 1138 817 A 126 VAL H A 126 VAL HA 1.0 1.80 3.5 1139 818 A 126 VAL H A 126 VAL HB 1.0 1.80 2.9 1140 819 A 126 VAL H A 126 VAL HGx% 1.0 1.80 4.6 1141 819 A 126 VAL H A 126 VAL HG21 1.0 1.80 4.6 1142 820 A 127 PRO HA A 128 ASN H 1.0 1.80 2.9 1143 821 A 128 ASN H A 127 PRO HBx 1.0 1.80 4.5 1144 821 A 128 ASN H A 127 PRO HBy 1.0 1.80 4.5 1145 822 A 128 ASN H A 128 ASN HA 1.0 1.80 2.9 1146 823 A 128 ASN HA A 129 GLU H 1.0 1.80 2.9 1147 824 A 128 ASN H A 128 ASN HBx 1.0 1.80 3.5 1148 824 A 128 ASN H A 128 ASN HBy 1.0 1.80 3.5 1149 825 A 129 GLU H A 128 ASN HBx 1.0 1.80 4.5 1150 825 A 129 GLU H A 128 ASN HBy 1.0 1.80 4.5 1151 826 A 129 GLU H A 129 GLU HA 1.0 1.80 3.5 1152 827 A 129 GLU HA A 130 VAL H 1.0 1.80 3.5 1153 828 A 129 GLU H A 129 GLU HBx 1.0 1.80 3.5 1154 828 A 129 GLU H A 129 GLU HBy 1.0 1.80 3.5 1155 829 A 129 GLU H A 129 GLU HGx 1.0 1.80 4.5 1156 829 A 129 GLU H A 129 GLU HGy 1.0 1.80 4.5 1157 830 A 130 VAL H A 129 GLU HGx 1.0 1.80 6.0 1158 830 A 130 VAL H A 129 GLU HGy 1.0 1.80 6.0 1159 831 A 130 VAL H A 130 VAL HA 1.0 1.80 3.5 1160 832 A 130 VAL H A 130 VAL HB 1.0 1.80 2.9 1161 833 A 130 VAL H A 130 VAL HGx% 1.0 1.80 5.2 1162 833 A 130 VAL H A 130 VAL HG21 1.0 1.80 5.2 1163 834 A 131 VAL HA A 131 VAL H 1.0 1.80 2.9 1164 835 A 131 VAL H A 131 VAL HB 1.0 1.80 2.9 1165 836 A 131 VAL H A 131 VAL HGx% 1.0 1.80 4.6 1166 836 A 131 VAL H A 131 VAL HG21 1.0 1.80 4.6 1167 837 A 132 VAL HA A 132 VAL H 1.0 1.80 2.9 1168 838 A 132 VAL HA A 133 GLN H 1.0 1.80 3.5 1169 839 A 132 VAL H A 132 VAL HB 1.0 1.80 2.9 1170 840 A 133 GLN H A 132 VAL HB 1.0 1.80 2.9 1171 841 A 132 VAL H A 132 VAL HGx% 1.0 1.80 4.6 1172 841 A 132 VAL H A 132 VAL HG21 1.0 1.80 4.6 1173 842 A 133 GLN H A 132 VAL HGx% 1.0 1.80 5.9 1174 842 A 133 GLN H A 132 VAL HG21 1.0 1.80 5.9 1175 843 A 133 GLN H A 133 GLN HA 1.0 1.80 3.5 1176 844 A 133 GLN H A 133 GLN HGx 1.0 1.80 6.0 1177 844 A 133 GLN H A 133 GLN HGy 1.0 1.80 6.0 1178 845 A 23 ASP HA A 2 HIS HD2 1.0 1.80 3.5 1179 846 A 58 LEU HA A 44 LEU HDx% 1.0 1.80 7.0 1180 846 A 44 LEU HDy% A 58 LEU HA 1.0 1.80 7.0 1181 847 A 56 TYR HD% A 44 LEU HDx% 1.0 1.80 8.0 1182 847 A 44 LEU HDy% A 56 TYR HD% 1.0 1.80 8.0 1183 848 A 56 TYR HE% A 44 LEU HDx% 1.0 1.80 8.0 1184 848 A 56 TYR HE% A 44 LEU HDy% 1.0 1.80 8.0 1185 849 A 5 PHE HD% A 81 LEU HDx% 1.0 1.80 6.5 1186 849 A 5 PHE HD% A 81 LEU HDy% 1.0 1.80 6.5 1187 850 A 84 TYR HE% A 6 LEU HDx% 1.0 1.80 7.0 1188 850 A 6 LEU HDy% A 84 TYR HE% 1.0 1.80 7.0 1189 851 A 5 PHE HA A 8 ALA HB% 1.0 1.80 5.0 1190 852 A 8 ALA HA A 17 TRP HZ2 1.0 1.80 5.0 1191 853 A 8 ALA HB% A 17 TRP HH2 1.0 1.80 5.0 1192 854 A 8 ALA HB% A 17 TRP HZ2 1.0 1.80 5.0 1193 855 A 8 ALA HB% A 17 TRP HE3 1.0 1.80 5.0 1194 856 A 17 TRP HH2 A 44 LEU HDx% 1.0 1.80 6.5 1195 856 A 17 TRP HH2 A 44 LEU HDy% 1.0 1.80 6.5 1196 857 A 17 TRP HZ2 A 44 LEU HDx% 1.0 1.80 6.5 1197 857 A 44 LEU HDy% A 17 TRP HZ2 1.0 1.80 6.5 1198 858 A 17 TRP HE3 A 44 LEU HDx% 1.0 1.80 6.5 1199 858 A 44 LEU HDy% A 17 TRP HE3 1.0 1.80 6.5 1200 859 A 44 LEU HDx% A 85 LEU HDx% 1.0 1.80 6.5 1201 859 A 44 LEU HDy% A 85 LEU HDx% 1.0 1.80 6.5 1202 859 A 85 LEU HDy% A 44 LEU HDx% 1.0 1.80 6.5 1203 859 A 44 LEU HDy% A 85 LEU HDy% 1.0 1.80 6.5 1204 860 A 9 GLY HAy A 44 LEU HDx% 1.0 1.80 6.5 1205 860 A 9 GLY HAx A 44 LEU HDx% 1.0 1.80 6.5 1206 860 A 44 LEU HDy% A 9 GLY HAx 1.0 1.80 6.5 1207 860 A 9 GLY HAy A 44 LEU HDy% 1.0 1.80 6.5 1208 861 A 8 ALA HB% A 85 LEU HDx% 1.0 1.80 5.0 1209 861 A 8 ALA HB% A 85 LEU HDy% 1.0 1.80 5.0 1210 862 A 8 ALA HB% A 44 LEU HDx% 1.0 1.80 6.5 1211 862 A 8 ALA HB% A 44 LEU HDy% 1.0 1.80 6.5 1212 863 A 8 ALA HB% A 81 LEU HDx% 1.0 1.80 6.5 1213 863 A 8 ALA HB% A 81 LEU HDy% 1.0 1.80 6.5 1214 864 A 56 TYR HE% A 85 LEU HDx% 1.0 1.80 6.5 1215 864 A 56 TYR HE% A 85 LEU HDy% 1.0 1.80 6.5 1216 865 A 16 ILE HD1% A 14 LEU HDx% 1.0 1.80 6.5 1217 865 A 14 LEU HDy% A 16 ILE HD1% 1.0 1.80 6.5 1218 866 A 43 ILE HB A 14 LEU HDx% 1.0 1.80 5.0 1219 866 A 14 LEU HDy% A 43 ILE HB 1.0 1.80 5.0 1220 867 A 43 ILE HG2% A 14 LEU HDx% 1.0 1.80 6.5 1221 867 A 14 LEU HDy% A 43 ILE HG2% 1.0 1.80 6.5 1222 868 A 43 ILE HD1% A 14 LEU HDx% 1.0 1.80 8.0 1223 868 A 14 LEU HDy% A 43 ILE HD1% 1.0 1.80 8.0 1224 869 A 32 TYR HD% A 14 LEU HDx% 1.0 1.80 8.0 1225 869 A 14 LEU HDy% A 32 TYR HD% 1.0 1.80 8.0 1226 870 A 32 TYR HE% A 14 LEU HDx% 1.0 1.80 8.0 1227 870 A 14 LEU HDy% A 32 TYR HE% 1.0 1.80 8.0 1228 871 A 106 TYR HD% A 14 LEU HDx% 1.0 1.80 8.0 1229 871 A 14 LEU HDy% A 106 TYR HD% 1.0 1.80 8.0 1230 872 A 106 TYR HE% A 14 LEU HDx% 1.0 1.80 8.0 1231 872 A 14 LEU HDy% A 106 TYR HE% 1.0 1.80 8.0 1232 873 A 107 PHE HE% A 14 LEU HDx% 1.0 1.80 8.0 1233 873 A 14 LEU HDy% A 107 PHE HE% 1.0 1.80 8.0 1234 874 A 16 ILE HD1% A 32 TYR HA 1.0 1.80 6.5 1235 875 A 16 ILE HD1% A 32 TYR HBx 1.0 1.80 8.0 1236 875 A 16 ILE HD1% A 32 TYR HBy 1.0 1.80 8.0 1237 876 A 16 ILE HD1% A 27 VAL HGx% 1.0 1.80 8.0 1238 876 A 16 ILE HD1% A 27 VAL HGy% 1.0 1.80 8.0 1239 877 A 16 ILE HD1% A 107 PHE HD% 1.0 1.80 8.0 1240 878 A 16 ILE HD1% A 107 PHE HE% 1.0 1.80 6.5 1241 879 A 16 ILE HD1% A 107 PHE HZ 1.0 1.80 5.0 1242 880 A 16 ILE HG2% A 41 TYR HE% 1.0 1.80 8.0 1243 881 A 16 ILE HG2% A 41 TYR HD% 1.0 1.80 6.5 1244 882 A 16 ILE HG2% A 43 ILE HA 1.0 1.80 6.5 1245 883 A 16 ILE HG2% A 27 VAL HB 1.0 1.80 6.5 1246 884 A 16 ILE HG2% A 107 PHE HE% 1.0 1.80 6.5 1247 885 A 19 VAL HGy% A 24 LEU HDx% 1.0 1.80 6.5 1248 885 A 19 VAL HGx% A 24 LEU HDx% 1.0 1.80 6.5 1249 885 A 24 LEU HDy% A 19 VAL HGx% 1.0 1.80 6.5 1250 885 A 19 VAL HGy% A 24 LEU HDy% 1.0 1.80 6.5 1251 886 A 40 ALA HB% A 19 VAL HGx% 1.0 1.80 6.5 1252 886 A 19 VAL HGy% A 40 ALA HB% 1.0 1.80 6.5 1253 887 A 73 ALA HB% A 19 VAL HGx% 1.0 1.80 6.5 1254 887 A 19 VAL HGy% A 73 ALA HB% 1.0 1.80 6.5 1255 888 A 74 ALA HA A 19 VAL HGx% 1.0 1.80 5.0 1256 888 A 19 VAL HGy% A 74 ALA HA 1.0 1.80 5.0 1257 889 A 73 ALA HB% A 19 VAL HGx% 1.0 1.80 6.5 1258 889 A 19 VAL HGy% A 73 ALA HB% 1.0 1.80 6.5 1259 890 A 74 ALA HB% A 19 VAL HGx% 1.0 1.80 6.5 1260 890 A 19 VAL HGy% A 74 ALA HB% 1.0 1.80 6.5 1261 891 A 77 PHE HD% A 19 VAL HGx% 1.0 1.80 6.5 1262 891 A 19 VAL HGy% A 77 PHE HD% 1.0 1.80 6.5 1263 892 A 41 TYR HA A 19 VAL HGx% 1.0 1.80 8.0 1264 892 A 19 VAL HGy% A 41 TYR HA 1.0 1.80 8.0 1265 893 A 73 ALA HB% A 22 PHE HD% 1.0 1.80 6.5 1266 894 A 73 ALA HB% A 22 PHE HE% 1.0 1.80 6.5 1267 895 A 19 VAL HA A 24 LEU HDx% 1.0 1.80 6.5 1268 895 A 19 VAL HA A 24 LEU HDy% 1.0 1.80 6.5 1269 896 A 24 LEU HDx% A 77 PHE HBx 1.0 1.80 6.5 1270 896 A 77 PHE HBy A 24 LEU HDx% 1.0 1.80 6.5 1271 896 A 24 LEU HDy% A 77 PHE HBy 1.0 1.80 6.5 1272 896 A 24 LEU HDy% A 77 PHE HBx 1.0 1.80 6.5 1273 897 A 77 PHE HD% A 24 LEU HDx% 1.0 1.80 6.5 1274 897 A 24 LEU HDy% A 77 PHE HD% 1.0 1.80 6.5 1275 898 A 5 PHE HE% A 24 LEU HDx% 1.0 1.80 8.0 1276 898 A 24 LEU HDy% A 5 PHE HE% 1.0 1.80 8.0 1277 899 A 41 TYR HD% A 27 VAL HGx% 1.0 1.80 6.5 1278 899 A 27 VAL HGy% A 41 TYR HD% 1.0 1.80 6.5 1279 900 A 41 TYR HE% A 27 VAL HGx% 1.0 1.80 6.5 1280 900 A 27 VAL HGy% A 41 TYR HE% 1.0 1.80 6.5 1281 901 A 17 TRP HA A 27 VAL HGx% 1.0 1.80 6.5 1282 901 A 17 TRP HA A 27 VAL HGy% 1.0 1.80 6.5 1283 902 A 32 TYR HD% A 27 VAL HGx% 1.0 1.80 6.5 1284 902 A 27 VAL HGy% A 32 TYR HD% 1.0 1.80 6.5 1285 903 A 29 THR HG2% A 32 TYR HD% 1.0 1.80 8.0 1286 904 A 37 THR HG2% A 96 GLN HE2y 1.0 1.80 6.5 1287 904 A 37 THR HG2% A 96 GLN HE2x 1.0 1.80 6.5 1288 905 A 37 THR HG2% A 113 TYR HBy 1.0 1.80 6.5 1289 905 A 37 THR HG2% A 113 TYR HBx 1.0 1.80 6.5 1290 906 A 37 THR HG2% A 113 TYR HD% 1.0 1.80 8.0 1291 907 A 113 TYR HA A 37 THR HG2% 1.0 1.80 6.5 1292 908 A 37 THR HG2% A 115 LYS HA 1.0 1.80 6.5 1293 909 A 19 VAL HB A 40 ALA HB% 1.0 1.80 6.5 1294 910 A 40 ALA HB% A 62 LEU HDx% 1.0 1.80 6.5 1295 910 A 40 ALA HB% A 62 LEU HDy% 1.0 1.80 6.5 1296 911 A 24 LEU HDx% A 42 VAL HGx% 1.0 1.80 6.5 1297 911 A 24 LEU HDy% A 42 VAL HGx% 1.0 1.80 6.5 1298 911 A 42 VAL HGy% A 24 LEU HDx% 1.0 1.80 6.5 1299 911 A 24 LEU HDy% A 42 VAL HGy% 1.0 1.80 6.5 1300 912 A 43 ILE HD1% A 41 TYR HBx 1.0 1.80 8.0 1301 912 A 41 TYR HBy A 43 ILE HD1% 1.0 1.80 8.0 1302 913 A 43 ILE HD1% A 59 HIS HBy 1.0 1.80 8.0 1303 913 A 43 ILE HD1% A 59 HIS HBx 1.0 1.80 8.0 1304 914 A 43 ILE HD1% A 61 TRP HBx 1.0 1.80 8.0 1305 914 A 43 ILE HD1% A 61 TRP HBy 1.0 1.80 8.0 1306 915 A 60 TYR HA A 43 ILE HD1% 1.0 1.80 6.5 1307 916 A 43 ILE HD1% A 35 PHE HE% 1.0 1.80 8.0 1308 917 A 43 ILE HD1% A 103 PHE HD% 1.0 1.80 6.5 1309 918 A 43 ILE HD1% A 103 PHE HE% 1.0 1.80 6.5 1310 919 A 106 TYR HD% A 43 ILE HG2% 1.0 1.80 8.0 1311 920 A 43 ILE HG2% A 103 PHE HE% 1.0 1.80 8.0 1312 921 A 106 TYR HE% A 43 ILE HG2% 1.0 1.80 8.0 1313 922 A 43 ILE HG2% A 14 LEU HDx% 1.0 1.80 6.5 1314 922 A 14 LEU HDy% A 43 ILE HG2% 1.0 1.80 6.5 1315 923 A 9 GLY HAy A 44 LEU HDx% 1.0 1.80 6.5 1316 923 A 9 GLY HAx A 44 LEU HDx% 1.0 1.80 6.5 1317 923 A 44 LEU HDy% A 9 GLY HAx 1.0 1.80 6.5 1318 923 A 9 GLY HAy A 44 LEU HDy% 1.0 1.80 6.5 1319 924 A 44 LEU HDx% A 85 LEU HDx% 1.0 1.80 6.5 1320 924 A 44 LEU HDy% A 85 LEU HDx% 1.0 1.80 6.5 1321 924 A 85 LEU HDy% A 44 LEU HDx% 1.0 1.80 6.5 1322 924 A 44 LEU HDy% A 85 LEU HDy% 1.0 1.80 6.5 1323 925 A 46 THR HG2% A 56 TYR HD% 1.0 1.80 8.0 1324 926 A 56 TYR HE% A 46 THR HG2% 1.0 1.80 8.0 1325 927 A 56 TYR HE% A 54 LEU HDx% 1.0 1.80 8.0 1326 927 A 56 TYR HE% A 54 LEU HDy% 1.0 1.80 8.0 1327 928 A 60 TYR HE% A 62 LEU HDx% 1.0 1.80 8.0 1328 928 A 62 LEU HDy% A 60 TYR HE% 1.0 1.80 8.0 1329 929 A 60 TYR HD% A 62 LEU HDx% 1.0 1.80 6.5 1330 929 A 60 TYR HD% A 62 LEU HDy% 1.0 1.80 6.5 1331 930 A 62 LEU HDx% A 71 SER HBy 1.0 1.80 6.5 1332 930 A 62 LEU HDy% A 71 SER HBy 1.0 1.80 6.5 1333 930 A 71 SER HBx A 62 LEU HDx% 1.0 1.80 6.5 1334 930 A 62 LEU HDy% A 71 SER HBx 1.0 1.80 6.5 1335 931 A 71 SER HA A 62 LEU HDx% 1.0 1.80 6.5 1336 931 A 62 LEU HDy% A 71 SER HA 1.0 1.80 6.5 1337 932 A 74 ALA HB% A 62 LEU HDx% 1.0 1.80 6.5 1338 932 A 62 LEU HDy% A 74 ALA HB% 1.0 1.80 6.5 1339 933 A 73 ALA HB% A 22 PHE HD% 1.0 1.80 8.0 1340 934 A 60 TYR HD% A 74 ALA HB% 1.0 1.80 6.5 1341 935 A 60 TYR HD% A 78 THR HG2% 1.0 1.80 5.5 1342 936 A 71 SER HA A 62 LEU HDx% 1.0 1.80 5.0 1343 936 A 62 LEU HDy% A 71 SER HA 1.0 1.80 5.0 1344 937 A 62 LEU HDx% A 71 SER HBy 1.0 1.80 6.0 1345 937 A 62 LEU HDy% A 71 SER HBy 1.0 1.80 6.0 1346 937 A 71 SER HBx A 62 LEU HDx% 1.0 1.80 6.0 1347 937 A 62 LEU HDy% A 71 SER HBx 1.0 1.80 6.0 1348 938 A 60 TYR HD% A 62 LEU HDx% 1.0 1.80 6.5 1349 938 A 60 TYR HD% A 62 LEU HDy% 1.0 1.80 6.5 1350 939 A 60 TYR HD% A 78 THR HG2% 1.0 1.80 6.5 1351 940 A 78 THR HG2% A 60 TYR HE% 1.0 1.80 6.5 1352 941 A 60 TYR HE% A 62 LEU HDx% 1.0 1.80 6.5 1353 941 A 62 LEU HDy% A 60 TYR HE% 1.0 1.80 6.5 1354 942 A 75 ALA HB% A 60 TYR HE% 1.0 1.80 6.5 1355 943 A 60 TYR HE% A 79 VAL HGx% 1.0 1.80 6.5 1356 943 A 79 VAL HGy% A 60 TYR HE% 1.0 1.80 6.5 1357 944 A 74 ALA HB% A 42 VAL HGx% 1.0 1.80 6.5 1358 944 A 42 VAL HGy% A 74 ALA HB% 1.0 1.80 6.5 1359 945 A 71 SER HA A 74 ALA HB% 1.0 1.80 5.0 1360 946 A 75 ALA HB% A 72 GLY HAx 1.0 1.80 5.0 1361 946 A 72 GLY HAy A 75 ALA HB% 1.0 1.80 5.0 1362 947 A 73 ALA HA A 76 ILE HD1% 1.0 1.80 5.0 1363 948 A 73 ALA HA A 76 ILE HG2% 1.0 1.80 5.0 1364 949 A 75 ALA HA A 78 THR HG2% 1.0 1.80 5.0 1365 950 A 82 ASP HA A 85 LEU HDx% 1.0 1.80 5.0 1366 950 A 82 ASP HA A 85 LEU HDy% 1.0 1.80 5.0 1367 951 A 76 ILE HG2% A 80 GLN HE2y 1.0 1.80 6.5 1368 951 A 76 ILE HG2% A 80 GLN HE2x 1.0 1.80 6.5 1369 952 A 56 TYR HD% A 85 LEU HDx% 1.0 1.80 6.5 1370 952 A 56 TYR HD% A 85 LEU HDy% 1.0 1.80 6.5 1371 953 A 56 TYR HE% A 85 LEU HDx% 1.0 1.80 6.5 1372 953 A 56 TYR HE% A 85 LEU HDy% 1.0 1.80 6.5 1373 954 A 84 TYR HA A 81 LEU HDx% 1.0 1.80 5.5 1374 954 A 81 LEU HDy% A 84 TYR HA 1.0 1.80 5.5 1375 955 A 84 TYR HD% A 81 LEU HDx% 1.0 1.80 8.0 1376 955 A 81 LEU HDy% A 84 TYR HD% 1.0 1.80 8.0 1377 956 A 84 TYR HE% A 81 LEU HDx% 1.0 1.80 8.0 1378 956 A 81 LEU HDy% A 84 TYR HE% 1.0 1.80 8.0 1379 957 A 33 GLY HAy A 111 LEU HDx% 1.0 1.80 8.0 1380 957 A 33 GLY HAx A 111 LEU HDx% 1.0 1.80 8.0 1381 957 A 111 LEU HDy% A 33 GLY HAx 1.0 1.80 8.0 1382 957 A 33 GLY HAy A 111 LEU HDy% 1.0 1.80 8.0 1383 958 A 35 PHE HD% A 111 LEU HDx% 1.0 1.80 8.0 1384 958 A 111 LEU HDy% A 35 PHE HD% 1.0 1.80 8.0 1385 959 A 35 PHE HE% A 111 LEU HDx% 1.0 1.80 8.0 1386 959 A 111 LEU HDy% A 35 PHE HE% 1.0 1.80 8.0 1387 960 A 101 ALA HA A 104 LEU HDx% 1.0 1.80 5.5 1388 960 A 104 LEU HDy% A 101 ALA HA 1.0 1.80 5.5 1389 961 A 99 GLU HBx A 104 LEU HDx% 1.0 1.80 6.5 1390 961 A 99 GLU HBy A 104 LEU HDx% 1.0 1.80 6.5 1391 961 A 104 LEU HDy% A 99 GLU HBx 1.0 1.80 6.5 1392 961 A 99 GLU HBy A 104 LEU HDy% 1.0 1.80 6.5 1393 962 A 103 PHE HD% A 104 LEU HDx% 1.0 1.80 6.5 1394 962 A 104 LEU HDy% A 103 PHE HD% 1.0 1.80 6.5 1395 963 A 104 LEU HDx% A 111 LEU HDx% 1.0 1.80 6.5 1396 963 A 104 LEU HDy% A 111 LEU HDx% 1.0 1.80 6.5 1397 963 A 111 LEU HDy% A 104 LEU HDx% 1.0 1.80 6.5 1398 963 A 104 LEU HDy% A 111 LEU HDy% 1.0 1.80 6.5 1399 964 A 107 PHE HD% A 14 LEU HDx% 1.0 1.80 8.0 1400 964 A 14 LEU HDy% A 107 PHE HD% 1.0 1.80 8.0 1401 965 A 113 TYR HD% A 111 LEU HDx% 1.0 1.80 8.0 1402 965 A 111 LEU HDy% A 113 TYR HD% 1.0 1.80 8.0 1403 966 A 37 THR HG2% A 113 TYR HD% 1.0 1.80 8.0 1404 967 A 113 TYR HE% A 111 LEU HDx% 1.0 1.80 8.0 1405 967 A 111 LEU HDy% A 113 TYR HE% 1.0 1.80 8.0 1406 968 A 84 TYR HD% A 85 LEU HDx% 1.0 1.80 8.0 1407 968 A 84 TYR HD% A 85 LEU HDy% 1.0 1.80 8.0 1408 969 A 84 TYR HE% A 85 LEU HDx% 1.0 1.80 8.0 1409 969 A 85 LEU HDy% A 84 TYR HE% 1.0 1.80 8.0 1410 970 A 89 ALA HB% A 85 LEU HDx% 1.0 1.80 8.0 1411 970 A 89 ALA HB% A 85 LEU HDy% 1.0 1.80 8.0 1412 971 A 89 ALA HB% A 56 TYR HBx 1.0 1.80 8.0 1413 971 A 56 TYR HBy A 89 ALA HB% 1.0 1.80 8.0 1414 972 A 92 HIS HE1 A 102 THR HG2% 1.0 1.80 7.0 1415 973 A 102 THR HG2% A 106 TYR HE% 1.0 1.80 8.0 1416 974 A 36 PHE HD% A 118 VAL HGx% 1.0 1.80 8.0 1417 974 A 36 PHE HD% A 118 VAL HG21 1.0 1.80 8.0 1418 975 A 119 ALA HB% A 122 PHE HD% 1.0 1.80 8.0 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 112 LYS H A 33 GLY O 1.0 1.8 2.2 2 2 A 33 GLY O A 112 LYS N 1.0 2.2 3.3 3 3 A 114 LYS H A 35 PHE O 1.0 1.8 2.2 4 4 A 35 PHE O A 114 LYS N 1.0 2.2 3.3 5 5 A 35 PHE H A 112 LYS O 1.0 1.8 2.2 6 6 A 112 LYS O A 35 PHE N 1.0 2.2 3.3 7 7 A 46 THR H A 13 GLY O 1.0 1.8 2.2 8 8 A 13 GLY O A 46 THR N 1.0 2.2 3.3 9 9 A 44 LEU H A 15 GLN O 1.0 1.8 2.2 10 10 A 15 GLN O A 44 LEU N 1.0 2.2 3.3 11 11 A 42 VAL H A 17 TRP O 1.0 1.8 2.2 12 12 A 17 TRP O A 42 VAL N 1.0 2.2 3.3 13 13 A 13 GLY H A 46 THR O 1.0 1.8 2.2 14 14 A 46 THR O A 13 GLY N 1.0 2.2 3.3 15 15 A 15 GLN H A 44 LEU O 1.0 1.8 2.2 16 16 A 44 LEU O A 15 GLN N 1.0 2.2 3.3 17 17 A 17 TRP H A 42 VAL O 1.0 1.8 2.2 18 18 A 42 VAL O A 17 TRP N 1.0 2.2 3.3 19 19 A 19 VAL H A 40 ALA O 1.0 1.8 2.2 20 20 A 40 ALA O A 19 VAL N 1.0 2.2 3.3 21 21 A 18 ARG H A 25 VAL O 1.0 1.8 2.2 22 22 A 25 VAL O A 18 ARG N 1.0 2.2 3.3 23 23 A 55 GLN H A 47 VAL O 1.0 1.8 2.2 24 24 A 47 VAL O A 55 GLN N 1.0 2.2 3.3 25 25 A 57 ASP H A 45 LYS O 1.0 1.8 2.2 26 26 A 45 LYS O A 57 ASP N 1.0 2.2 3.3 27 27 A 59 HIS H A 43 ILE O 1.0 1.8 2.2 28 28 A 43 ILE O A 59 HIS N 1.0 2.2 3.3 29 29 A 61 TRP H A 41 TYR O 1.0 1.8 2.2 30 30 A 41 TYR O A 61 TRP N 1.0 2.2 3.3 31 31 A 41 TYR H A 61 TRP O 1.0 1.8 2.2 32 32 A 61 TRP O A 41 TYR N 1.0 2.2 3.3 33 33 A 43 ILE H A 59 HIS O 1.0 1.8 2.2 34 34 A 59 HIS O A 43 ILE N 1.0 2.2 3.3 35 35 A 45 LYS H A 57 ASP O 1.0 1.8 2.2 36 36 A 57 ASP O A 45 LYS N 1.0 2.2 3.3 37 37 A 47 VAL H A 55 GLN O 1.0 1.8 2.2 38 38 A 55 GLN O A 47 VAL N 1.0 2.2 3.3 39 39 A 62 LEU H A 94 GLU O 1.0 1.8 2.2 40 40 A 94 GLU O A 62 LEU N 1.0 2.2 3.3 41 41 A 60 TYR H A 92 HIS O 1.0 1.8 2.2 42 42 A 92 HIS O A 60 TYR N 1.0 2.2 3.3 43 43 A 58 LEU H A 90 VAL O 1.0 1.8 2.2 44 44 A 90 VAL O A 58 LEU N 1.0 2.2 3.3 45 45 A 92 HIS H A 58 LEU O 1.0 1.8 2.2 46 46 A 58 LEU O A 92 HIS N 1.0 2.2 3.3 47 47 A 94 GLU H A 60 TYR O 1.0 1.8 2.2 48 48 A 60 TYR O A 94 GLU N 1.0 2.2 3.3 49 49 A 8 ALA H A 4 GLU O 1.0 1.8 2.2 50 50 A 4 GLU O A 8 ALA N 1.0 2.2 3.3 51 51 A 32 TYR H A 28 PRO O 1.0 1.8 2.2 52 52 A 28 PRO O A 32 TYR N 1.0 2.2 3.3 53 53 A 107 PHE H A 103 PHE O 1.0 1.8 2.2 54 54 A 103 PHE O A 107 PHE N 1.0 2.2 3.3 55 55 A 106 TYR H A 102 THR O 1.0 1.8 2.2 56 56 A 102 THR O A 106 TYR N 1.0 2.2 3.3 57 57 A 105 GLY H A 101 ALA O 1.0 1.8 2.2 58 58 A 101 ALA O A 105 GLY N 1.0 2.2 3.3 59 59 A 104 LEU H A 100 SER O 1.0 1.8 2.2 60 60 A 100 SER O A 104 LEU N 1.0 2.2 3.3 61 61 A 72 GLY H A 68 GLN O 1.0 1.8 2.2 62 62 A 68 GLN O A 72 GLY N 1.0 2.2 3.3 63 63 A 73 ALA H A 69 ASP O 1.0 1.8 2.2 64 64 A 69 ASP O A 73 ALA N 1.0 2.2 3.3 65 65 A 74 ALA H A 70 GLU O 1.0 1.8 2.2 66 66 A 70 GLU O A 74 ALA N 1.0 2.2 3.3 67 67 A 75 ALA H A 71 SER O 1.0 1.8 2.2 68 68 A 71 SER O A 75 ALA N 1.0 2.2 3.3 69 69 A 76 ILE H A 72 GLY O 1.0 1.8 2.2 70 70 A 72 GLY O A 76 ILE N 1.0 2.2 3.3 71 71 A 77 PHE H A 73 ALA O 1.0 1.8 2.2 72 72 A 73 ALA O A 77 PHE N 1.0 2.2 3.3 73 73 A 78 THR H A 74 ALA O 1.0 1.8 2.2 74 74 A 74 ALA O A 78 THR N 1.0 2.2 3.3 75 75 A 79 VAL H A 75 ALA O 1.0 1.8 2.2 76 76 A 75 ALA O A 79 VAL N 1.0 2.2 3.3 77 77 A 80 GLN H A 76 ILE O 1.0 1.8 2.2 78 78 A 76 ILE O A 80 GLN N 1.0 2.2 3.3 79 79 A 81 LEU H A 77 PHE O 1.0 1.8 2.2 80 80 A 77 PHE O A 81 LEU N 1.0 2.2 3.3 81 81 A 82 ASP H A 78 THR O 1.0 1.8 2.2 82 82 A 78 THR O A 82 ASP N 1.0 2.2 3.3 83 83 A 83 ASP H A 79 VAL O 1.0 1.8 2.2 84 84 A 79 VAL O A 83 ASP N 1.0 2.2 3.3 85 85 A 84 TYR H A 80 GLN O 1.0 1.8 2.2 86 86 A 80 GLN O A 84 TYR N 1.0 2.2 3.3 87 87 A 85 LEU H A 81 LEU O 1.0 1.8 2.2 88 88 A 81 LEU O A 85 LEU N 1.0 2.2 3.3 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 3 PRO C A 4 GLU N A 4 GLU CA A 4 GLU C 1.0 -83.0 -43.0 PHI 2 2 A 4 GLU N A 4 GLU CA A 4 GLU C A 5 PHE N 1.0 -57.0 -13.0 PSI 3 3 A 4 GLU C A 5 PHE N A 5 PHE CA A 5 PHE C 1.0 -92.0 -38.0 PHI 4 4 A 5 PHE N A 5 PHE CA A 5 PHE C A 6 LEU N 1.0 -63.0 -23.0 PSI 5 5 A 5 PHE C A 6 LEU N A 6 LEU CA A 6 LEU C 1.0 -113.0 -29.0 PHI 6 6 A 6 LEU N A 6 LEU CA A 6 LEU C A 7 LYS N 1.0 -68.0 -8.0 PSI 7 7 A 6 LEU C A 7 LYS N A 7 LYS CA A 7 LYS C 1.0 -125.0 -65.0 PHI 8 8 A 7 LYS N A 7 LYS CA A 7 LYS C A 8 ALA N 1.0 -61.0 39.0 PSI 9 9 A 8 ALA C A 9 GLY N A 9 GLY CA A 9 GLY C 1.0 27.0 127.0 PHI 10 10 A 9 GLY N A 9 GLY CA A 9 GLY C A 10 LYS N 1.0 -43.0 57.0 PSI 11 11 A 9 GLY C A 10 LYS N A 10 LYS CA A 10 LYS C 1.0 -142.0 -42.0 PHI 12 12 A 10 LYS N A 10 LYS CA A 10 LYS C A 11 GLU N 1.0 -69.0 3.0 PSI 13 13 A 13 GLY C A 14 LEU N A 14 LEU CA A 14 LEU C 1.0 -155.0 -55.0 PHI 14 14 A 14 LEU N A 14 LEU CA A 14 LEU C A 15 GLN N 1.0 103.0 179.0 PSI 15 15 A 14 LEU C A 15 GLN N A 15 GLN CA A 15 GLN C 1.0 -152.0 -52.0 PHI 16 16 A 15 GLN N A 15 GLN CA A 15 GLN C A 16 ILE N 1.0 95.0 167.0 PSI 17 17 A 15 GLN C A 16 ILE N A 16 ILE CA A 16 ILE C 1.0 -156.0 -90.0 PHI 18 18 A 16 ILE N A 16 ILE CA A 16 ILE C A 17 TRP N 1.0 113.0 153.0 PSI 19 19 A 16 ILE C A 17 TRP N A 17 TRP CA A 17 TRP C 1.0 -155.0 -89.0 PHI 20 20 A 17 TRP N A 17 TRP CA A 17 TRP C A 18 ARG N 1.0 111.0 171.0 PSI 21 21 A 17 TRP C A 18 ARG N A 18 ARG CA A 18 ARG C 1.0 -165.0 -65.0 PHI 22 22 A 18 ARG N A 18 ARG CA A 18 ARG C A 19 VAL N 1.0 106.0 146.0 PSI 23 23 A 18 ARG C A 19 VAL N A 19 VAL CA A 19 VAL C 1.0 -136.0 -70.0 PHI 24 24 A 19 VAL N A 19 VAL CA A 19 VAL C A 20 GLU N 1.0 102.0 142.0 PSI 25 25 A 19 VAL C A 20 GLU N A 20 GLU CA A 20 GLU C 1.0 -159.0 -59.0 PHI 26 26 A 20 GLU N A 20 GLU CA A 20 GLU C A 21 LYS N 1.0 76.0 176.0 PSI 27 27 A 22 PHE C A 23 ASP N A 23 ASP CA A 23 ASP C 1.0 -127.0 -27.0 PHI 28 28 A 24 LEU N A 24 LEU CA A 24 LEU C A 25 VAL N 1.0 123.0 167.0 PSI 29 29 A 24 LEU C A 25 VAL N A 25 VAL CA A 25 VAL C 1.0 -154.0 -54.0 PHI 30 30 A 25 VAL N A 25 VAL CA A 25 VAL C A 26 PRO N 1.0 77.0 177.0 PSI 31 31 A 28 PRO C A 29 THR N A 29 THR CA A 29 THR C 1.0 -86.0 -38.0 PHI 32 32 A 29 THR N A 29 THR CA A 29 THR C A 30 ASN N 1.0 -54.0 -10.0 PSI 33 33 A 29 THR C A 30 ASN N A 30 ASN CA A 30 ASN C 1.0 -82.0 -42.0 PHI 34 34 A 30 ASN N A 30 ASN CA A 30 ASN C A 31 LEU N 1.0 -60.0 -20.0 PSI 35 35 A 30 ASN C A 31 LEU N A 31 LEU CA A 31 LEU C 1.0 -136.0 -36.0 PHI 36 36 A 31 LEU N A 31 LEU CA A 31 LEU C A 32 TYR N 1.0 -55.0 13.0 PSI 37 37 A 32 TYR C A 33 GLY N A 33 GLY CA A 33 GLY C 1.0 57.0 123.0 PHI 38 38 A 35 PHE N A 35 PHE CA A 35 PHE C A 36 PHE N 1.0 120.0 168.0 PSI 39 39 A 35 PHE C A 36 PHE N A 36 PHE CA A 36 PHE C 1.0 -165.0 -65.0 PHI 40 40 A 36 PHE N A 36 PHE CA A 36 PHE C A 37 THR N 1.0 103.0 171.0 PSI 41 41 A 38 GLY N A 38 GLY CA A 38 GLY C A 39 ASP N 1.0 -73.0 27.0 PSI 42 42 A 39 ASP C A 40 ALA N A 40 ALA CA A 40 ALA C 1.0 -166.0 -112.0 PHI 43 43 A 40 ALA N A 40 ALA CA A 40 ALA C A 41 TYR N 1.0 141.0 181.0 PSI 44 44 A 40 ALA C A 41 TYR N A 41 TYR CA A 41 TYR C 1.0 -172.0 -76.0 PHI 45 45 A 41 TYR N A 41 TYR CA A 41 TYR C A 42 VAL N 1.0 122.0 170.0 PSI 46 46 A 41 TYR C A 42 VAL N A 42 VAL CA A 42 VAL C 1.0 -148.0 -94.0 PHI 47 47 A 42 VAL N A 42 VAL CA A 42 VAL C A 43 ILE N 1.0 101.0 145.0 PSI 48 48 A 42 VAL C A 43 ILE N A 43 ILE CA A 43 ILE C 1.0 -152.0 -74.0 PHI 49 49 A 43 ILE N A 43 ILE CA A 43 ILE C A 44 LEU N 1.0 105.0 145.0 PSI 50 50 A 43 ILE C A 44 LEU N A 44 LEU CA A 44 LEU C 1.0 -160.0 -64.0 PHI 51 51 A 44 LEU N A 44 LEU CA A 44 LEU C A 45 LYS N 1.0 88.0 188.0 PSI 52 52 A 44 LEU C A 45 LYS N A 45 LYS CA A 45 LYS C 1.0 -176.0 -76.0 PHI 53 53 A 45 LYS N A 45 LYS CA A 45 LYS C A 46 THR N 1.0 95.0 155.0 PSI 54 54 A 45 LYS C A 46 THR N A 46 THR CA A 46 THR C 1.0 -164.0 -64.0 PHI 55 55 A 46 THR N A 46 THR CA A 46 THR C A 47 VAL N 1.0 99.0 163.0 PSI 56 56 A 46 THR C A 47 VAL N A 47 VAL CA A 47 VAL C 1.0 -151.0 -85.0 PHI 57 57 A 47 VAL N A 47 VAL CA A 47 VAL C A 48 GLN N 1.0 102.0 162.0 PSI 58 58 A 47 VAL C A 48 GLN N A 48 GLN CA A 48 GLN C 1.0 -153.0 -53.0 PHI 59 59 A 48 GLN N A 48 GLN CA A 48 GLN C A 49 LEU N 1.0 101.0 157.0 PSI 60 60 A 49 LEU C A 50 ARG N A 50 ARG CA A 50 ARG C 1.0 -140.0 -40.0 PHI 61 61 A 50 ARG N A 50 ARG CA A 50 ARG C A 51 ASN N 1.0 -63.0 25.0 PSI 62 62 A 55 GLN C A 56 TYR N A 56 TYR CA A 56 TYR C 1.0 -168.0 -72.0 PHI 63 63 A 56 TYR N A 56 TYR CA A 56 TYR C A 57 ASP N 1.0 110.0 182.0 PSI 64 64 A 56 TYR C A 57 ASP N A 57 ASP CA A 57 ASP C 1.0 -167.0 -71.0 PHI 65 65 A 57 ASP N A 57 ASP CA A 57 ASP C A 58 LEU N 1.0 100.0 164.0 PSI 66 66 A 57 ASP C A 58 LEU N A 58 LEU CA A 58 LEU C 1.0 -147.0 -75.0 PHI 67 67 A 58 LEU N A 58 LEU CA A 58 LEU C A 59 HIS N 1.0 103.0 143.0 PSI 68 68 A 58 LEU C A 59 HIS N A 59 HIS CA A 59 HIS C 1.0 -157.0 -73.0 PHI 69 69 A 59 HIS N A 59 HIS CA A 59 HIS C A 60 TYR N 1.0 109.0 173.0 PSI 70 70 A 59 HIS C A 60 TYR N A 60 TYR CA A 60 TYR C 1.0 -168.0 -84.0 PHI 71 71 A 60 TYR N A 60 TYR CA A 60 TYR C A 61 TRP N 1.0 107.0 175.0 PSI 72 72 A 60 TYR C A 61 TRP N A 61 TRP CA A 61 TRP C 1.0 -170.0 -86.0 PHI 73 73 A 61 TRP N A 61 TRP CA A 61 TRP C A 62 LEU N 1.0 96.0 168.0 PSI 74 74 A 61 TRP C A 62 LEU N A 62 LEU CA A 62 LEU C 1.0 -152.0 -52.0 PHI 75 75 A 62 LEU N A 62 LEU CA A 62 LEU C A 63 GLY N 1.0 106.0 178.0 PSI 76 76 A 63 GLY C A 64 ASN N A 64 ASN CA A 64 ASN C 1.0 22.0 88.0 PHI 77 77 A 64 ASN N A 64 ASN CA A 64 ASN C A 65 GLU N 1.0 2.0 62.0 PSI 78 78 A 64 ASN C A 65 GLU N A 65 GLU CA A 65 GLU C 1.0 -144.0 -66.0 PHI 79 79 A 65 GLU N A 65 GLU CA A 65 GLU C A 66 CYS N 1.0 -44.0 36.0 PSI 80 80 A 65 GLU C A 66 CYS N A 66 CYS CA A 66 CYS C 1.0 -143.0 -43.0 PHI 81 81 A 66 CYS N A 66 CYS CA A 66 CYS C A 67 SER N 1.0 106.0 146.0 PSI 82 82 A 66 CYS C A 67 SER N A 67 SER CA A 67 SER C 1.0 -102.0 -42.0 PHI 83 83 A 67 SER N A 67 SER CA A 67 SER C A 68 GLN N 1.0 107.0 175.0 PSI 84 84 A 67 SER C A 68 GLN N A 68 GLN CA A 68 GLN C 1.0 -81.0 -39.0 PHI 85 85 A 68 GLN N A 68 GLN CA A 68 GLN C A 69 ASP N 1.0 -61.0 -9.0 PSI 86 86 A 68 GLN C A 69 ASP N A 69 ASP CA A 69 ASP C 1.0 -88.0 -46.0 PHI 87 87 A 69 ASP N A 69 ASP CA A 69 ASP C A 70 GLU N 1.0 -58.0 -18.0 PSI 88 88 A 69 ASP C A 70 GLU N A 70 GLU CA A 70 GLU C 1.0 -86.9 -46.9 PHI 89 89 A 70 GLU N A 70 GLU CA A 70 GLU C A 71 SER N 1.0 -60.5 -20.5 PSI 90 90 A 70 GLU C A 71 SER N A 71 SER CA A 71 SER C 1.0 -84.8 -44.8 PHI 91 91 A 71 SER N A 71 SER CA A 71 SER C A 72 GLY N 1.0 -60.4 -20.4 PSI 92 92 A 71 SER C A 72 GLY N A 72 GLY CA A 72 GLY C 1.0 -84.3 -44.3 PHI 93 93 A 72 GLY N A 72 GLY CA A 72 GLY C A 73 ALA N 1.0 -60.1 -20.1 PSI 94 94 A 72 GLY C A 73 ALA N A 73 ALA CA A 73 ALA C 1.0 -85.8 -45.8 PHI 95 95 A 73 ALA N A 73 ALA CA A 73 ALA C A 74 ALA N 1.0 -59.5 -19.5 PSI 96 96 A 73 ALA C A 74 ALA N A 74 ALA CA A 74 ALA C 1.0 -83.3 -43.3 PHI 97 97 A 74 ALA N A 74 ALA CA A 74 ALA C A 75 ALA N 1.0 -59.9 -19.9 PSI 98 98 A 74 ALA C A 75 ALA N A 75 ALA CA A 75 ALA C 1.0 -82.8 -42.8 PHI 99 99 A 75 ALA N A 75 ALA CA A 75 ALA C A 76 ILE N 1.0 -60.5 -20.5 PSI 100 100 A 75 ALA C A 76 ILE N A 76 ILE CA A 76 ILE C 1.0 -84.5 -44.5 PHI 101 101 A 76 ILE N A 76 ILE CA A 76 ILE C A 77 PHE N 1.0 -61.8 -21.8 PSI 102 102 A 76 ILE C A 77 PHE N A 77 PHE CA A 77 PHE C 1.0 -83.5 -43.5 PHI 103 103 A 77 PHE N A 77 PHE CA A 77 PHE C A 78 THR N 1.0 -59.5 -19.5 PSI 104 104 A 77 PHE C A 78 THR N A 78 THR CA A 78 THR C 1.0 -86.4 -46.4 PHI 105 105 A 78 THR N A 78 THR CA A 78 THR C A 79 VAL N 1.0 -60.7 -20.7 PSI 106 106 A 78 THR C A 79 VAL N A 79 VAL CA A 79 VAL C 1.0 -81.6 -41.6 PHI 107 107 A 79 VAL N A 79 VAL CA A 79 VAL C A 80 GLN N 1.0 -64.9 -24.9 PSI 108 108 A 79 VAL C A 80 GLN N A 80 GLN CA A 80 GLN C 1.0 -86.3 -43.7 PHI 109 109 A 80 GLN N A 80 GLN CA A 80 GLN C A 81 LEU N 1.0 -59.2 -19.2 PSI 110 110 A 80 GLN C A 81 LEU N A 81 LEU CA A 81 LEU C 1.0 -81.3 -41.3 PHI 111 111 A 81 LEU N A 81 LEU CA A 81 LEU C A 82 ASP N 1.0 -61.3 -21.3 PSI 112 112 A 81 LEU C A 82 ASP N A 82 ASP CA A 82 ASP C 1.0 -79.9 -39.9 PHI 113 113 A 82 ASP N A 82 ASP CA A 82 ASP C A 83 ASP N 1.0 -61.5 -18.3 PSI 114 114 A 82 ASP C A 83 ASP N A 83 ASP CA A 83 ASP C 1.0 -92.0 -45.2 PHI 115 115 A 83 ASP N A 83 ASP CA A 83 ASP C A 84 TYR N 1.0 -54.6 -14.6 PSI 116 116 A 83 ASP C A 84 TYR N A 84 TYR CA A 84 TYR C 1.0 -85.1 -45.1 PHI 117 117 A 84 TYR N A 84 TYR CA A 84 TYR C A 85 LEU N 1.0 -63.8 -23.8 PSI 118 118 A 84 TYR C A 85 LEU N A 85 LEU CA A 85 LEU C 1.0 -83.8 -43.8 PHI 119 119 A 85 LEU N A 85 LEU CA A 85 LEU C A 86 ASN N 1.0 -62.8 -22.8 PSI 120 120 A 85 LEU C A 86 ASN N A 86 ASN CA A 86 ASN C 1.0 -121.0 -55.0 PHI 121 121 A 86 ASN N A 86 ASN CA A 86 ASN C A 87 GLY N 1.0 -42.0 14.0 PSI 122 122 A 89 ALA C A 90 VAL N A 90 VAL CA A 90 VAL C 1.0 -152.0 -52.0 PHI 123 123 A 90 VAL N A 90 VAL CA A 90 VAL C A 91 GLN N 1.0 110.0 150.0 PSI 124 124 A 90 VAL C A 91 GLN N A 91 GLN CA A 91 GLN C 1.0 -153.0 -53.0 PHI 125 125 A 91 GLN N A 91 GLN CA A 91 GLN C A 92 HIS N 1.0 100.0 184.0 PSI 126 126 A 91 GLN C A 92 HIS N A 92 HIS CA A 92 HIS C 1.0 -160.2 -60.2 PHI 127 127 A 92 HIS N A 92 HIS CA A 92 HIS C A 93 ARG N 1.0 109.9 159.7 PSI 128 128 A 92 HIS C A 93 ARG N A 93 ARG CA A 93 ARG C 1.0 -157.0 -57.0 PHI 129 129 A 93 ARG N A 93 ARG CA A 93 ARG C A 94 GLU N 1.0 110.0 150.0 PSI 130 130 A 94 GLU C A 95 VAL N A 95 VAL CA A 95 VAL C 1.0 -152.0 -52.0 PHI 131 131 A 100 SER C A 101 ALA N A 101 ALA CA A 101 ALA C 1.0 -84.0 -44.0 PHI 132 132 A 101 ALA N A 101 ALA CA A 101 ALA C A 102 THR N 1.0 -61.2 -21.2 PSI 133 133 A 101 ALA C A 102 THR N A 102 THR CA A 102 THR C 1.0 -85.2 -45.2 PHI 134 134 A 102 THR N A 102 THR CA A 102 THR C A 103 PHE N 1.0 -62.8 -22.8 PSI 135 135 A 102 THR C A 103 PHE N A 103 PHE CA A 103 PHE C 1.0 -84.5 -44.5 PHI 136 136 A 103 PHE N A 103 PHE CA A 103 PHE C A 104 LEU N 1.0 -66.1 -26.1 PSI 137 137 A 106 TYR N A 106 TYR CA A 106 TYR C A 107 PHE N 1.0 -66.3 -5.9 PSI 138 138 A 107 PHE C A 108 LYS N A 108 LYS CA A 108 LYS C 1.0 -105.9 -13.7 PHI 139 139 A 108 LYS N A 108 LYS CA A 108 LYS C A 109 SER N 1.0 -63.6 -13.0 PSI 140 140 A 108 LYS C A 109 SER N A 109 SER CA A 109 SER C 1.0 -105.6 -54.0 PHI 141 141 A 109 SER N A 109 SER CA A 109 SER C A 110 GLY N 1.0 -40.4 22.4 PSI 142 142 A 112 LYS C A 113 TYR N A 113 TYR CA A 113 TYR C 1.0 -154.0 -82.0 PHI 143 143 A 113 TYR N A 113 TYR CA A 113 TYR C A 114 LYS N 1.0 108.0 164.0 PSI 144 144 A 113 TYR C A 114 LYS N A 114 LYS CA A 114 LYS C 1.0 -166.0 -66.0 PHI 145 145 A 114 LYS N A 114 LYS CA A 114 LYS C A 115 LYS N 1.0 109.0 169.0 PSI 146 146 A 114 LYS C A 115 LYS N A 115 LYS CA A 115 LYS C 1.0 -154.0 -54.0 PHI 147 147 A 115 LYS N A 115 LYS CA A 115 LYS C A 116 GLY N 1.0 110.0 170.0 PSI 148 148 A 117 GLY C A 118 VAL N A 118 VAL CA A 118 VAL C 1.0 -124.0 -24.0 PHI 149 149 A 118 VAL N A 118 VAL CA A 118 VAL C A 119 ALA N 1.0 -65.0 23.0 PSI 150 150 A 118 VAL C A 119 ALA N A 119 ALA CA A 119 ALA C 1.0 -86.0 -46.0 PHI 151 151 A 119 ALA N A 119 ALA CA A 119 ALA C A 120 SER N 1.0 -62.0 -22.0 PSI 152 152 A 119 ALA C A 120 SER N A 120 SER CA A 120 SER C 1.0 -111.0 -27.0 PHI 153 153 A 120 SER N A 120 SER CA A 120 SER C A 121 GLY N 1.0 -72.0 4.0 PSI 154 154 A 120 SER C A 121 GLY N A 121 GLY CA A 121 GLY C 1.0 -82.0 -42.0 PHI 155 155 A 121 GLY N A 121 GLY CA A 121 GLY C A 122 PHE N 1.0 -60.0 -20.0 PSI 156 156 A 121 GLY C A 122 PHE N A 122 PHE CA A 122 PHE C 1.0 -86.0 -46.0 PHI 157 157 A 122 PHE N A 122 PHE CA A 122 PHE C A 123 LYS N 1.0 -58.0 -18.0 PSI 158 158 A 122 PHE C A 123 LYS N A 123 LYS CA A 123 LYS C 1.0 -115.0 -25.0 PHI 159 159 A 123 LYS N A 123 LYS CA A 123 LYS C A 124 HIS N 1.0 -68.0 4.0 PSI 160 160 A 124 HIS C A 125 VAL N A 125 VAL CA A 125 VAL C 1.0 -146.0 -68.0 PHI 161 161 A 125 VAL N A 125 VAL CA A 125 VAL C A 126 VAL N 1.0 107.0 147.0 PSI 162 162 A 125 VAL C A 126 VAL N A 126 VAL CA A 126 VAL C 1.0 -157.0 -57.0 PHI 163 163 A 126 VAL N A 126 VAL CA A 126 VAL C A 127 PRO N 1.0 72.0 168.0 PSI 164 164 A 126 VAL C A 127 PRO N A 127 PRO CA A 127 PRO C 1.0 -79.0 -39.0 PHI 165 165 A 127 PRO N A 127 PRO CA A 127 PRO C A 128 ASN N 1.0 126.0 166.0 PSI 166 166 A 128 ASN C A 129 GLU N A 129 GLU CA A 129 GLU C 1.0 -88.0 -48.0 PHI 167 167 A 129 GLU N A 129 GLU CA A 129 GLU C A 130 VAL N 1.0 -57.0 -17.0 PSI 168 168 A 129 GLU C A 130 VAL N A 130 VAL CA A 130 VAL C 1.0 -87.0 -47.0 PHI 169 169 A 130 VAL N A 130 VAL CA A 130 VAL C A 131 VAL N 1.0 -61.0 -17.0 PSI 170 170 A 130 VAL C A 131 VAL N A 131 VAL CA A 131 VAL C 1.0 -87.0 -47.0 PHI 171 171 A 131 VAL N A 131 VAL CA A 131 VAL C A 132 VAL N 1.0 -61.0 -17.0 PSI 172 172 A 131 VAL C A 132 VAL N A 132 VAL CA A 132 VAL C 1.0 -87.0 -47.0 PHI 173 173 A 132 VAL N A 132 VAL CA A 132 VAL C A 133 GLN N 1.0 -62.0 -14.0 PSI stop_ save_