data_nef_c18842_2m14 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 1Y5O PDB 2GS0 PDB 2K2U PDB 2L2I PDB 2LOX stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 PRO start . false 2 A 2 SER middle . . 3 A 3 HIS middle . . 4 A 4 SER middle . . 5 A 5 GLY middle . false 6 A 6 ALA middle . . 7 A 7 ALA middle . . 8 A 8 ILE middle . . 9 A 9 PHE middle . . 10 A 10 GLU middle . . 11 A 11 LYS middle . . 12 A 12 VAL middle . . 13 A 13 SER middle . . 14 A 14 GLY middle . false 15 A 15 ILE middle . . 16 A 16 ILE middle . . 17 A 17 ALA middle . . 18 A 18 ILE middle . . 19 A 19 ASN middle . . 20 A 20 GLU middle . . 21 A 21 ASP middle . . 22 A 22 VAL middle . . 23 A 23 SER middle . . 24 A 24 PRO middle . false 25 A 25 ALA middle . . 26 A 26 GLU middle . . 27 A 27 LEU middle . . 28 A 28 THR middle . . 29 A 29 TRP middle . . 30 A 30 ARG middle . . 31 A 31 SER middle . . 32 A 32 THR middle . . 33 A 33 ASP middle . . 34 A 34 GLY middle . false 35 A 35 ASP middle . . 36 A 36 LYS middle . . 37 A 37 VAL middle . . 38 A 38 HIS middle . . 39 A 39 THR middle . . 40 A 40 VAL middle . . 41 A 41 VAL middle . . 42 A 42 LEU middle . . 43 A 43 SER middle . . 44 A 44 THR middle . . 45 A 45 ILE middle . . 46 A 46 ASP middle . . 47 A 47 LYS middle . . 48 A 48 LEU middle . . 49 A 49 GLN middle . . 50 A 50 ALA middle . . 51 A 51 THR middle . . 52 A 52 PRO middle . false 53 A 53 ALA middle . . 54 A 54 SER middle . . 55 A 55 SER middle . . 56 A 56 GLU middle . . 57 A 57 LYS middle . . 58 A 58 MET middle . . 59 A 59 MET middle . . 60 A 60 LEU middle . . 61 A 61 ARG middle . . 62 A 62 LEU middle . . 63 A 63 ILE middle . . 64 A 64 GLY middle . false 65 A 65 LYS middle . . 66 A 66 VAL middle . . 67 A 67 ASP middle . . 68 A 68 GLU middle . . 69 A 69 SER middle . . 70 A 70 LYS middle . . 71 A 71 LYS middle . . 72 A 72 ARG middle . . 73 A 73 LYS middle . . 74 A 74 ASP middle . . 75 A 75 ASN middle . . 76 A 76 GLU middle . . 77 A 77 GLY middle . false 78 A 78 ASN middle . . 79 A 79 GLU middle . . 80 A 80 VAL middle . . 81 A 81 VAL middle . . 82 A 82 PRO middle . false 83 A 83 LYS middle . . 84 A 84 PRO middle . false 85 A 85 GLN middle . . 86 A 86 ARG middle . . 87 A 87 HIS middle . . 88 A 88 MET middle . . 89 A 89 PHE middle . . 90 A 90 SER middle . . 91 A 91 PHE middle . . 92 A 92 ASN middle . . 93 A 93 ASN middle . . 94 A 94 ARG middle . . 95 A 95 THR middle . . 96 A 96 VAL middle . . 97 A 97 MET middle . . 98 A 98 ASP middle . . 99 A 99 ASN middle . . 100 A 100 ILE middle . . 101 A 101 LYS middle . . 102 A 102 MET middle . . 103 A 103 THR middle . . 104 A 104 LEU middle . . 105 A 105 GLN middle . . 106 A 106 GLN middle . . 107 A 107 ILE middle . . 108 A 108 ILE middle . . 109 A 109 SER middle . . 110 A 110 ARG middle . . 111 A 111 TYR middle . . 112 A 112 LYS middle . . 113 A 113 ASP middle . . 114 A 114 ALA middle . . 115 A 115 ASP middle . . 116 A 116 GLY middle . false 117 A 117 ASN middle . . 118 A 118 SER middle . . 119 A 119 SER end . . 120 B 74 GLY start . false 121 B 75 SER middle . . 122 B 76 THR middle . . 123 B 77 ASP middle . . 124 B 78 ASP middle . . 125 B 79 SER middle . . 126 B 80 VAL middle . . 127 B 81 GLU middle . . 128 B 82 GLU middle . . 129 B 83 ILE middle . . 130 B 84 GLN middle . . 131 B 85 SER middle . . 132 B 86 SER middle . . 133 B 87 GLU middle . . 134 B 88 GLU middle . . 135 B 89 ASP middle . . 136 B 90 TYR middle . . 137 B 91 ASP middle . . 138 B 92 SER middle . . 139 B 93 GLU middle . . 140 B 94 GLU middle . . 141 B 95 PHE middle . . 142 B 96 GLU middle . . 143 B 97 ASP middle . . 144 B 98 VAL middle . . 145 B 99 THR middle . . 146 B 100 ASP middle . . 147 B 101 GLY middle . false 148 B 102 ASN middle . . 149 B 103 GLU middle . . 150 B 104 VAL middle . . 151 B 105 ALA middle . . 152 B 106 GLY middle . false 153 B 107 VAL middle . . 154 B 108 GLU middle . . 155 B 109 ASP middle . . 156 B 110 ILE middle . . 157 B 111 SER middle . . 158 B 112 VAL middle . . 159 B 113 GLU middle . . 160 B 114 ILE middle . . 161 B 115 LYS end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 PRO HA H 1 4.585 0.010 A 1 PRO HBx H 1 1.933 0.000 A 1 PRO HBy H 1 2.348 0.000 A 1 PRO HDx H 1 3.834 0.000 A 1 PRO HDy H 1 3.907 0.000 A 1 PRO HGy H 1 2.083 0.000 A 1 PRO HGx H 1 2.049 0.011 A 1 PRO C C 13 176.937 0.000 A 1 PRO CA C 13 63.825 0.000 A 1 PRO CD C 13 50.919 0.004 A 1 PRO CG C 13 27.500 0.000 A 2 SER H H 1 8.096 0.016 A 2 SER HA H 1 4.355 0.003 A 2 SER HBx H 1 3.793 0.002 A 2 SER HBy H 1 3.881 0.007 A 2 SER CA C 13 58.647 0.058 A 2 SER CB C 13 63.504 0.011 A 2 SER N N 15 113.417 0.199 A 3 HIS HA H 1 4.677 0.007 A 3 HIS HBx H 1 3.004 0.009 A 3 HIS HBy H 1 3.626 0.007 A 3 HIS HD2 H 1 7.064 0.006 A 3 HIS C C 13 173.601 0.000 A 3 HIS CA C 13 56.229 0.045 A 3 HIS CB C 13 31.323 0.042 A 3 HIS CD2 C 13 117.899 0.026 A 4 SER H H 1 7.865 0.006 A 4 SER HA H 1 5.483 0.008 A 4 SER HBx H 1 3.874 0.008 A 4 SER HBy H 1 3.918 0.000 A 4 SER C C 13 173.624 0.000 A 4 SER CA C 13 56.904 0.014 A 4 SER CB C 13 65.900 0.074 A 4 SER N N 15 113.555 0.030 A 5 GLY H H 1 8.370 0.007 A 5 GLY HAy H 1 4.267 0.009 A 5 GLY HAx H 1 4.076 0.006 A 5 GLY C C 13 170.915 0.000 A 5 GLY CA C 13 45.417 0.031 A 5 GLY N N 15 107.050 0.014 A 6 ALA H H 1 8.671 0.005 A 6 ALA HA H 1 4.953 0.008 A 6 ALA HB% H 1 1.554 0.005 A 6 ALA C C 13 176.816 0.000 A 6 ALA CA C 13 52.605 0.025 A 6 ALA CB C 13 19.373 0.010 A 6 ALA N N 15 125.347 0.025 A 7 ALA H H 1 8.391 0.002 A 7 ALA HA H 1 4.662 0.008 A 7 ALA HB% H 1 1.005 0.008 A 7 ALA C C 13 176.697 0.000 A 7 ALA CA C 13 51.668 0.017 A 7 ALA CB C 13 24.048 0.051 A 7 ALA N N 15 120.077 0.046 A 8 ILE H H 1 9.383 0.003 A 8 ILE HA H 1 4.987 0.013 A 8 ILE HB H 1 1.591 0.011 A 8 ILE HD1% H 1 0.780 0.008 A 8 ILE HG1y H 1 1.511 0.008 A 8 ILE HG1x H 1 0.972 0.009 A 8 ILE HG2% H 1 0.617 0.007 A 8 ILE C C 13 175.327 0.000 A 8 ILE CA C 13 59.844 0.026 A 8 ILE CB C 13 39.589 0.033 A 8 ILE CD1 C 13 13.759 0.042 A 8 ILE CG1 C 13 29.044 0.000 A 8 ILE CG2 C 13 17.348 0.008 A 8 ILE N N 15 125.517 0.027 A 9 PHE H H 1 8.467 0.009 A 9 PHE HA H 1 4.317 0.010 A 9 PHE HBx H 1 2.572 0.002 A 9 PHE HBy H 1 2.745 0.008 A 9 PHE HDx H 1 6.164 0.007 A 9 PHE HDy H 1 6.164 0.007 A 9 PHE HEx H 1 6.565 0.005 A 9 PHE HEy H 1 6.565 0.005 A 9 PHE HZ H 1 6.324 0.002 A 9 PHE C C 13 173.920 0.000 A 9 PHE CA C 13 56.118 0.034 A 9 PHE CB C 13 39.825 0.038 A 9 PHE CDx C 13 131.038 0.049 A 9 PHE CDy C 13 131.038 0.049 A 9 PHE CEx C 13 129.201 0.045 A 9 PHE CEy C 13 129.201 0.045 A 9 PHE CZ C 13 127.920 0.007 A 9 PHE N N 15 128.853 0.054 A 10 GLU H H 1 8.769 0.017 A 10 GLU HA H 1 3.202 0.007 A 10 GLU HBy H 1 1.585 0.003 A 10 GLU HBx H 1 1.211 0.013 A 10 GLU HGx H 1 0.691 0.006 A 10 GLU HGy H 1 0.954 0.004 A 10 GLU C C 13 175.226 0.000 A 10 GLU CA C 13 56.680 0.014 A 10 GLU CB C 13 26.695 0.014 A 10 GLU CG C 13 35.353 0.028 A 10 GLU N N 15 126.396 0.065 A 11 LYS H H 1 7.931 0.013 A 11 LYS HA H 1 3.402 0.005 A 11 LYS HBy H 1 2.186 0.011 A 11 LYS HBx H 1 1.958 0.008 A 11 LYS HDx H 1 1.554 0.009 A 11 LYS HDy H 1 1.627 0.000 A 11 LYS HE3 H 1 2.889 0.005 A 11 LYS HG3 H 1 1.191 0.006 A 11 LYS C C 13 175.596 0.000 A 11 LYS CA C 13 58.448 0.023 A 11 LYS CB C 13 30.134 0.028 A 11 LYS CD C 13 29.100 0.000 A 11 LYS CG C 13 25.698 0.014 A 11 LYS N N 15 105.585 0.059 A 12 VAL H H 1 7.954 0.004 A 12 VAL HA H 1 4.417 0.005 A 12 VAL HB H 1 2.549 0.005 A 12 VAL HGx% H 1 1.134 0.004 A 12 VAL HGy% H 1 1.489 0.005 A 12 VAL C C 13 175.188 0.000 A 12 VAL CA C 13 61.685 0.024 A 12 VAL CB C 13 34.179 0.025 A 12 VAL CGx C 13 22.126 0.032 A 12 VAL CGy C 13 22.614 0.027 A 12 VAL N N 15 123.819 0.040 A 13 SER H H 1 8.895 0.003 A 13 SER HA H 1 4.624 0.007 A 13 SER HBy H 1 4.031 0.012 A 13 SER HBx H 1 4.010 0.014 A 13 SER C C 13 175.408 0.000 A 13 SER CA C 13 59.766 0.018 A 13 SER CB C 13 63.591 0.046 A 13 SER N N 15 121.981 0.031 A 14 GLY H H 1 8.287 0.009 A 14 GLY HAy H 1 4.350 0.010 A 14 GLY HAx H 1 4.149 0.014 A 14 GLY C C 13 172.790 0.000 A 14 GLY CA C 13 46.537 0.034 A 14 GLY N N 15 113.215 0.068 A 15 ILE H H 1 8.330 0.004 A 15 ILE HA H 1 4.820 0.013 A 15 ILE HB H 1 1.647 0.022 A 15 ILE HD1% H 1 0.782 0.002 A 15 ILE HG13 H 1 1.092 0.006 A 15 ILE HG2% H 1 0.781 0.004 A 15 ILE C C 13 175.417 0.000 A 15 ILE CA C 13 59.303 0.028 A 15 ILE CB C 13 41.796 0.000 A 15 ILE CD1 C 13 12.179 0.021 A 15 ILE CG1 C 13 27.400 0.101 A 15 ILE CG2 C 13 17.414 0.036 A 15 ILE N N 15 123.244 0.024 A 16 ILE H H 1 9.438 0.005 A 16 ILE HA H 1 4.967 0.015 A 16 ILE HB H 1 1.630 0.013 A 16 ILE HD1% H 1 0.158 0.005 A 16 ILE HG1y H 1 1.570 0.013 A 16 ILE HG1x H 1 0.776 0.007 A 16 ILE HG2% H 1 0.779 0.005 A 16 ILE C C 13 173.248 0.000 A 16 ILE CA C 13 59.812 0.026 A 16 ILE CB C 13 41.723 0.063 A 16 ILE CD1 C 13 13.918 0.038 A 16 ILE CG1 C 13 29.775 0.017 A 16 ILE CG2 C 13 16.808 0.035 A 16 ILE N N 15 127.640 0.018 A 17 ALA H H 1 8.968 0.005 A 17 ALA HA H 1 5.105 0.011 A 17 ALA HB% H 1 1.359 0.008 A 17 ALA C C 13 177.510 0.000 A 17 ALA CA C 13 51.445 0.322 A 17 ALA CB C 13 22.161 0.011 A 17 ALA N N 15 127.760 0.041 A 18 ILE H H 1 8.665 0.006 A 18 ILE HA H 1 4.591 0.015 A 18 ILE HB H 1 1.843 0.014 A 18 ILE HD1% H 1 0.796 0.008 A 18 ILE HG1x H 1 0.970 0.011 A 18 ILE HG1y H 1 1.520 0.006 A 18 ILE HG2% H 1 0.702 0.007 A 18 ILE C C 13 174.334 0.000 A 18 ILE CA C 13 60.656 0.031 A 18 ILE CB C 13 39.064 0.042 A 18 ILE CD1 C 13 14.901 0.015 A 18 ILE CG1 C 13 29.019 0.051 A 18 ILE CG2 C 13 18.098 0.018 A 18 ILE N N 15 122.269 0.032 A 19 ASN H H 1 9.378 0.004 A 19 ASN HA H 1 5.080 0.016 A 19 ASN HBy H 1 3.122 0.010 A 19 ASN HBx H 1 2.747 0.006 A 19 ASN HD21 H 1 7.713 0.001 A 19 ASN HD22 H 1 6.862 0.005 A 19 ASN C C 13 174.784 0.000 A 19 ASN CA C 13 51.638 0.020 A 19 ASN CB C 13 39.591 0.022 A 19 ASN CG C 13 176.780 0.013 A 19 ASN N N 15 127.568 0.025 A 19 ASN ND2 N 15 110.676 0.153 A 20 GLU H H 1 9.046 0.009 A 20 GLU HA H 1 4.703 0.013 A 20 GLU HBy H 1 2.421 0.008 A 20 GLU HBx H 1 2.002 0.004 A 20 GLU HGx H 1 2.070 0.009 A 20 GLU HGy H 1 2.203 0.008 A 20 GLU C C 13 176.152 0.000 A 20 GLU CA C 13 55.891 0.016 A 20 GLU CB C 13 30.867 0.045 A 20 GLU CG C 13 39.076 0.034 A 20 GLU N N 15 121.587 0.088 A 21 ASP H H 1 8.724 0.008 A 21 ASP HA H 1 4.619 0.004 A 21 ASP HBx H 1 2.822 0.035 A 21 ASP HBy H 1 2.866 0.030 A 21 ASP C C 13 175.688 0.000 A 21 ASP CA C 13 55.512 0.021 A 21 ASP CB C 13 40.476 0.047 A 21 ASP N N 15 121.077 0.112 A 22 VAL H H 1 6.844 0.003 A 22 VAL HA H 1 4.318 0.005 A 22 VAL HB H 1 2.009 0.005 A 22 VAL HGx% H 1 0.784 0.006 A 22 VAL HGy% H 1 0.835 0.001 A 22 VAL C C 13 173.445 0.000 A 22 VAL CA C 13 59.049 0.021 A 22 VAL CB C 13 34.022 0.011 A 22 VAL CGx C 13 18.045 0.037 A 22 VAL CGy C 13 21.300 0.000 A 22 VAL N N 15 113.035 0.046 A 23 SER H H 1 8.046 0.002 A 23 SER HA H 1 4.735 0.005 A 23 SER HBy H 1 3.739 0.005 A 23 SER HBx H 1 3.614 0.003 A 23 SER CA C 13 53.765 0.032 A 23 SER CB C 13 64.743 0.026 A 23 SER N N 15 114.945 0.006 A 24 PRO HA H 1 4.768 0.014 A 24 PRO HBx H 1 1.808 0.017 A 24 PRO HBy H 1 2.134 0.006 A 24 PRO HD3 H 1 3.480 0.006 A 24 PRO HGy H 1 1.838 0.006 A 24 PRO HGx H 1 1.781 0.004 A 24 PRO C C 13 174.807 0.000 A 24 PRO CA C 13 62.760 0.038 A 24 PRO CB C 13 34.741 0.068 A 24 PRO CD C 13 49.714 0.020 A 24 PRO CG C 13 25.987 0.023 A 25 ALA H H 1 7.979 0.003 A 25 ALA HA H 1 4.515 0.008 A 25 ALA HB% H 1 1.547 0.005 A 25 ALA C C 13 175.790 0.000 A 25 ALA CA C 13 52.533 0.004 A 25 ALA CB C 13 20.582 0.019 A 25 ALA N N 15 120.415 0.019 A 26 GLU H H 1 7.851 0.004 A 26 GLU HA H 1 5.039 0.007 A 26 GLU HBx H 1 1.714 0.014 A 26 GLU HBy H 1 1.786 0.019 A 26 GLU HGx H 1 1.999 0.008 A 26 GLU HGy H 1 2.355 0.011 A 26 GLU C C 13 174.619 0.000 A 26 GLU CA C 13 54.029 0.043 A 26 GLU CB C 13 34.616 0.067 A 26 GLU CG C 13 36.163 0.067 A 26 GLU N N 15 115.395 0.029 A 27 LEU H H 1 8.898 0.004 A 27 LEU HA H 1 5.026 0.013 A 27 LEU HBy H 1 1.628 0.014 A 27 LEU HBx H 1 1.394 0.013 A 27 LEU HDx% H 1 0.671 0.012 A 27 LEU HDy% H 1 0.576 0.006 A 27 LEU HG H 1 1.407 0.004 A 27 LEU C C 13 174.740 0.000 A 27 LEU CA C 13 53.781 0.023 A 27 LEU CB C 13 45.609 0.029 A 27 LEU CDy C 13 27.340 0.033 A 27 LEU CDx C 13 25.818 0.028 A 27 LEU CG C 13 27.392 0.032 A 27 LEU N N 15 124.661 0.033 A 28 THR H H 1 9.283 0.002 A 28 THR HA H 1 5.207 0.023 A 28 THR HB H 1 3.960 0.006 A 28 THR HG2% H 1 1.135 0.005 A 28 THR C C 13 172.661 0.000 A 28 THR CA C 13 61.178 0.088 A 28 THR CB C 13 71.422 0.013 A 28 THR CG2 C 13 22.031 0.068 A 28 THR N N 15 121.731 0.049 A 29 TRP H H 1 9.399 0.009 A 29 TRP HA H 1 5.431 0.006 A 29 TRP HBx H 1 2.803 0.012 A 29 TRP HBy H 1 3.153 0.012 A 29 TRP HD1 H 1 6.682 0.016 A 29 TRP HE1 H 1 9.517 0.004 A 29 TRP HE3 H 1 7.357 0.015 A 29 TRP HH2 H 1 7.084 0.007 A 29 TRP HZ2 H 1 7.637 0.014 A 29 TRP HZ3 H 1 6.904 0.009 A 29 TRP C C 13 173.939 0.000 A 29 TRP CA C 13 55.782 0.049 A 29 TRP CB C 13 32.177 0.253 A 29 TRP CD1 C 13 123.964 0.054 A 29 TRP CE3 C 13 120.453 0.097 A 29 TRP CZ3 C 13 121.469 0.047 A 29 TRP N N 15 128.950 0.029 A 29 TRP NE1 N 15 126.365 0.022 A 30 ARG H H 1 7.613 0.003 A 30 ARG HA H 1 4.829 0.014 A 30 ARG HBx H 1 1.433 0.009 A 30 ARG HBy H 1 1.559 0.011 A 30 ARG HDy H 1 3.110 0.005 A 30 ARG HDx H 1 3.046 0.006 A 30 ARG HE H 1 7.130 0.006 A 30 ARG HGy H 1 1.611 0.006 A 30 ARG HGx H 1 1.464 0.015 A 30 ARG C C 13 174.751 0.000 A 30 ARG CA C 13 53.389 0.039 A 30 ARG CB C 13 33.818 0.020 A 30 ARG CD C 13 43.284 0.006 A 30 ARG CG C 13 27.300 0.000 A 30 ARG N N 15 126.402 0.024 A 30 ARG NE N 15 111.049 0.047 A 31 SER H H 1 8.086 0.004 A 31 SER HA H 1 4.138 0.008 A 31 SER HBy H 1 4.482 0.007 A 31 SER HBx H 1 4.005 0.006 A 31 SER C C 13 176.426 0.000 A 31 SER CA C 13 58.013 0.019 A 31 SER CB C 13 64.081 0.044 A 31 SER N N 15 118.353 0.028 A 32 THR H H 1 8.556 0.004 A 32 THR HA H 1 3.856 0.006 A 32 THR HB H 1 4.127 0.003 A 32 THR HG2% H 1 1.226 0.008 A 32 THR C C 13 175.664 0.000 A 32 THR CA C 13 66.142 0.074 A 32 THR CB C 13 68.446 0.003 A 32 THR CG2 C 13 22.241 0.023 A 32 THR N N 15 119.213 0.034 A 33 ASP H H 1 8.236 0.007 A 33 ASP HA H 1 4.627 0.010 A 33 ASP HBx H 1 2.706 0.008 A 33 ASP HBy H 1 2.777 0.018 A 33 ASP C C 13 177.098 0.000 A 33 ASP CA C 13 54.367 0.066 A 33 ASP N N 15 117.260 0.050 A 34 GLY H H 1 7.935 0.003 A 34 GLY HAy H 1 4.133 0.006 A 34 GLY HAx H 1 3.538 0.009 A 34 GLY C C 13 173.778 0.000 A 34 GLY CA C 13 45.399 0.024 A 34 GLY N N 15 109.136 0.033 A 35 ASP H H 1 8.271 0.005 A 35 ASP HA H 1 4.530 0.008 A 35 ASP HBx H 1 2.659 0.005 A 35 ASP HBy H 1 2.751 0.007 A 35 ASP C C 13 175.403 0.000 A 35 ASP CA C 13 54.811 0.000 A 35 ASP CB C 13 41.042 0.000 A 35 ASP N N 15 117.913 0.036 A 36 LYS H H 1 7.769 0.003 A 36 LYS HA H 1 4.907 0.008 A 36 LYS HBy H 1 2.170 0.004 A 36 LYS HBx H 1 1.933 0.010 A 36 LYS HD3 H 1 1.994 0.004 A 36 LYS HE3 H 1 3.185 0.007 A 36 LYS HGy H 1 1.754 0.017 A 36 LYS HGx H 1 1.629 0.006 A 36 LYS C C 13 174.651 0.000 A 36 LYS CA C 13 55.407 0.053 A 36 LYS CB C 13 35.834 0.049 A 36 LYS CD C 13 29.640 0.006 A 36 LYS CE C 13 42.208 0.008 A 36 LYS CG C 13 25.512 0.010 A 36 LYS N N 15 120.335 0.047 A 37 VAL H H 1 8.582 0.006 A 37 VAL HA H 1 5.315 0.007 A 37 VAL HB H 1 2.043 0.008 A 37 VAL HG2% H 1 0.930 0.007 A 37 VAL C C 13 175.069 0.000 A 37 VAL CA C 13 60.098 0.063 A 37 VAL CB C 13 36.058 0.012 A 37 VAL CG2 C 13 20.906 0.024 A 37 VAL N N 15 121.484 0.069 A 38 HIS H H 1 9.621 0.004 A 38 HIS HA H 1 5.084 0.008 A 38 HIS HBy H 1 2.830 0.015 A 38 HIS HBx H 1 2.768 0.025 A 38 HIS HD2 H 1 6.017 0.004 A 38 HIS C C 13 173.268 0.000 A 38 HIS CA C 13 56.068 0.024 A 38 HIS CB C 13 34.088 0.000 A 38 HIS CD2 C 13 116.586 0.060 A 38 HIS N N 15 125.660 0.116 A 39 THR H H 1 8.527 0.010 A 39 THR HA H 1 5.139 0.006 A 39 THR HB H 1 3.749 0.006 A 39 THR HG2% H 1 0.984 0.008 A 39 THR C C 13 173.208 0.000 A 39 THR CA C 13 61.518 0.084 A 39 THR CB C 13 70.665 0.018 A 39 THR CG2 C 13 21.509 0.002 A 39 THR N N 15 124.752 0.100 A 40 VAL H H 1 9.388 0.006 A 40 VAL HA H 1 3.924 0.003 A 40 VAL HB H 1 1.788 0.007 A 40 VAL HGx% H 1 0.277 0.006 A 40 VAL HGy% H 1 0.375 0.006 A 40 VAL C C 13 174.731 0.000 A 40 VAL CA C 13 60.350 0.016 A 40 VAL CB C 13 34.365 0.049 A 40 VAL CGx C 13 19.830 0.058 A 40 VAL CGy C 13 21.276 0.026 A 40 VAL N N 15 126.002 0.039 A 41 VAL H H 1 9.054 0.003 A 41 VAL HA H 1 3.984 0.008 A 41 VAL HB H 1 2.021 0.012 A 41 VAL HGx% H 1 1.013 0.009 A 41 VAL HGy% H 1 0.947 0.003 A 41 VAL C C 13 179.410 0.000 A 41 VAL CA C 13 63.616 0.049 A 41 VAL CB C 13 30.988 0.041 A 41 VAL CGy C 13 22.017 0.018 A 41 VAL CGx C 13 21.035 0.000 A 41 VAL N N 15 129.872 0.064 A 42 LEU H H 1 9.193 0.005 A 42 LEU HA H 1 3.954 0.009 A 42 LEU HBx H 1 1.463 0.009 A 42 LEU HBy H 1 1.800 0.008 A 42 LEU HDx% H 1 0.699 0.009 A 42 LEU HDy% H 1 0.759 0.008 A 42 LEU HG H 1 1.699 0.008 A 42 LEU C C 13 176.121 0.000 A 42 LEU CA C 13 58.622 0.024 A 42 LEU CB C 13 40.823 0.011 A 42 LEU CDx C 13 22.995 0.073 A 42 LEU CDy C 13 26.451 0.045 A 42 LEU CG C 13 27.409 0.000 A 42 LEU N N 15 130.076 0.028 A 43 SER H H 1 6.961 0.004 A 43 SER HA H 1 3.944 0.006 A 43 SER HB3 H 1 3.792 0.004 A 43 SER C C 13 175.455 0.000 A 43 SER CA C 13 59.442 0.032 A 43 SER CB C 13 61.299 0.023 A 43 SER N N 15 109.703 0.017 A 44 THR H H 1 7.657 0.004 A 44 THR HA H 1 4.519 0.011 A 44 THR HB H 1 4.670 0.006 A 44 THR HG2% H 1 1.218 0.006 A 44 THR C C 13 173.493 0.000 A 44 THR CA C 13 62.076 0.019 A 44 THR CB C 13 69.788 0.031 A 44 THR CG2 C 13 21.059 0.032 A 44 THR N N 15 110.409 0.044 A 45 ILE H H 1 7.089 0.004 A 45 ILE HA H 1 4.325 0.017 A 45 ILE HB H 1 2.323 0.009 A 45 ILE HD1% H 1 0.600 0.009 A 45 ILE HG1y H 1 1.717 0.009 A 45 ILE HG1x H 1 1.095 0.017 A 45 ILE HG2% H 1 0.902 0.008 A 45 ILE C C 13 173.882 0.000 A 45 ILE CA C 13 58.040 0.000 A 45 ILE CB C 13 36.500 0.000 A 45 ILE CD1 C 13 8.980 0.013 A 45 ILE CG1 C 13 27.189 0.127 A 45 ILE CG2 C 13 18.960 0.035 A 45 ILE N N 15 120.972 0.017 A 46 ASP H H 1 9.372 0.004 A 46 ASP HA H 1 4.662 0.006 A 46 ASP HBx H 1 2.418 0.007 A 46 ASP HBy H 1 2.501 0.024 A 46 ASP C C 13 175.424 0.000 A 46 ASP CA C 13 55.017 0.057 A 46 ASP CB C 13 44.583 0.022 A 46 ASP N N 15 126.759 0.046 A 47 LYS H H 1 7.522 0.001 A 47 LYS HA H 1 4.753 0.008 A 47 LYS HBy H 1 1.833 0.007 A 47 LYS HBx H 1 1.682 0.008 A 47 LYS HE3 H 1 2.886 0.037 A 47 LYS HGy H 1 1.324 0.006 A 47 LYS HGx H 1 1.179 0.005 A 47 LYS C C 13 172.574 0.000 A 47 LYS CA C 13 54.615 0.042 A 47 LYS CB C 13 36.196 0.026 A 47 LYS CE C 13 41.891 0.000 A 47 LYS CG C 13 24.024 0.071 A 47 LYS N N 15 111.663 0.022 A 48 LEU H H 1 8.938 0.013 A 48 LEU HA H 1 5.143 0.010 A 48 LEU HBx H 1 1.298 0.008 A 48 LEU HBy H 1 1.830 0.009 A 48 LEU HDx% H 1 1.047 0.013 A 48 LEU HDy% H 1 0.974 0.026 A 48 LEU HG H 1 1.579 0.013 A 48 LEU C C 13 174.770 0.000 A 48 LEU CA C 13 52.936 0.034 A 48 LEU CB C 13 45.580 0.050 A 48 LEU CDx C 13 25.481 0.044 A 48 LEU CDy C 13 27.747 0.069 A 48 LEU CG C 13 27.494 0.054 A 48 LEU N N 15 123.295 0.027 A 49 GLN H H 1 9.246 0.003 A 49 GLN HA H 1 5.512 0.018 A 49 GLN HB3 H 1 1.975 0.014 A 49 GLN HE21 H 1 6.912 0.003 A 49 GLN HE22 H 1 7.815 0.005 A 49 GLN HG3 H 1 2.445 0.013 A 49 GLN C C 13 174.626 0.000 A 49 GLN CA C 13 53.631 0.042 A 49 GLN CB C 13 34.089 0.154 A 49 GLN CD C 13 179.022 0.025 A 49 GLN CG C 13 33.705 0.155 A 49 GLN N N 15 120.979 0.019 A 49 GLN NE2 N 15 112.153 0.157 A 50 ALA H H 1 9.365 0.005 A 50 ALA HA H 1 5.808 0.010 A 50 ALA HB% H 1 1.409 0.006 A 50 ALA C C 13 177.277 0.000 A 50 ALA CA C 13 50.621 0.053 A 50 ALA CB C 13 24.523 0.090 A 50 ALA N N 15 122.440 0.030 A 51 THR H H 1 8.368 0.005 A 51 THR HA H 1 4.615 0.007 A 51 THR HB H 1 4.227 0.007 A 51 THR HG2% H 1 0.800 0.005 A 51 THR CA C 13 59.197 0.023 A 51 THR CB C 13 67.937 0.025 A 51 THR CG2 C 13 23.710 0.124 A 51 THR N N 15 114.289 0.043 A 52 PRO HA H 1 4.531 0.010 A 52 PRO HBy H 1 2.368 0.008 A 52 PRO HBx H 1 1.968 0.009 A 52 PRO HDy H 1 3.780 0.008 A 52 PRO HDx H 1 3.614 0.000 A 52 PRO HG3 H 1 1.954 0.006 A 52 PRO C C 13 178.380 0.000 A 52 PRO CA C 13 62.375 0.050 A 52 PRO CB C 13 32.640 0.000 A 52 PRO CD C 13 50.467 0.011 A 52 PRO CG C 13 27.719 0.066 A 53 ALA H H 1 9.122 0.001 A 53 ALA HA H 1 4.030 0.006 A 53 ALA HB% H 1 1.443 0.006 A 53 ALA C C 13 177.700 0.000 A 53 ALA CA C 13 54.795 0.000 A 53 ALA CB C 13 18.019 0.007 A 53 ALA N N 15 126.235 0.009 A 54 SER H H 1 7.620 0.004 A 54 SER HA H 1 4.238 0.003 A 54 SER HBx H 1 3.795 0.004 A 54 SER HBy H 1 4.040 0.000 A 54 SER C C 13 174.957 0.000 A 54 SER CA C 13 58.260 0.000 A 54 SER CB C 13 63.120 0.000 A 54 SER N N 15 107.216 0.008 A 55 SER H H 1 7.676 0.001 A 55 SER HA H 1 4.469 0.007 A 55 SER HBy H 1 3.975 0.007 A 55 SER HBx H 1 3.882 0.003 A 55 SER C C 13 174.952 0.000 A 55 SER CA C 13 57.500 0.016 A 55 SER CB C 13 63.801 0.046 A 55 SER N N 15 117.523 0.015 A 56 GLU H H 1 8.844 0.002 A 56 GLU HA H 1 4.179 0.003 A 56 GLU HBy H 1 2.132 0.009 A 56 GLU HBx H 1 2.008 0.005 A 56 GLU HGx H 1 2.286 0.008 A 56 GLU HGy H 1 2.376 0.007 A 56 GLU C C 13 177.924 0.000 A 56 GLU CA C 13 57.661 0.004 A 56 GLU CB C 13 29.829 0.010 A 56 GLU CG C 13 36.535 0.070 A 56 GLU N N 15 124.557 0.015 A 57 LYS H H 1 8.259 0.005 A 57 LYS HA H 1 4.296 0.012 A 57 LYS HBx H 1 1.663 0.001 A 57 LYS HBy H 1 1.730 0.003 A 57 LYS HDx H 1 1.576 0.004 A 57 LYS HDy H 1 1.653 0.003 A 57 LYS HEx H 1 2.889 0.004 A 57 LYS HEy H 1 2.930 0.000 A 57 LYS HGy H 1 1.478 0.003 A 57 LYS HGx H 1 1.375 0.009 A 57 LYS C C 13 175.667 0.000 A 57 LYS CA C 13 55.855 0.018 A 57 LYS CB C 13 33.855 0.000 A 57 LYS CD C 13 29.175 0.000 A 57 LYS CE C 13 41.132 0.057 A 57 LYS CG C 13 25.273 0.047 A 57 LYS N N 15 119.220 0.019 A 58 MET H H 1 8.811 0.001 A 58 MET HA H 1 4.288 0.007 A 58 MET HBy H 1 2.419 0.016 A 58 MET HBx H 1 2.090 0.009 A 58 MET HE% H 1 2.133 0.017 A 58 MET HG2 H 1 2.313 0.004 A 58 MET C C 13 174.107 0.000 A 58 MET CA C 13 55.067 0.024 A 58 MET CB C 13 35.381 0.047 A 58 MET CE C 13 19.331 0.086 A 58 MET N N 15 123.270 0.010 A 59 MET H H 1 8.395 0.004 A 59 MET HA H 1 5.873 0.010 A 59 MET HBy H 1 2.293 0.011 A 59 MET HBx H 1 2.006 0.012 A 59 MET HE% H 1 1.849 0.003 A 59 MET HGx H 1 2.377 0.005 A 59 MET HGy H 1 2.812 0.009 A 59 MET C C 13 174.459 0.000 A 59 MET CA C 13 54.903 0.051 A 59 MET CB C 13 39.231 0.089 A 59 MET CE C 13 17.786 0.098 A 59 MET CG C 13 32.485 0.087 A 59 MET N N 15 120.490 0.070 A 60 LEU H H 1 9.103 0.002 A 60 LEU HA H 1 5.664 0.014 A 60 LEU HBx H 1 1.738 0.010 A 60 LEU HBy H 1 1.881 0.006 A 60 LEU HDx% H 1 0.919 0.008 A 60 LEU HDy% H 1 1.085 0.009 A 60 LEU HG H 1 1.915 0.008 A 60 LEU C C 13 175.664 0.000 A 60 LEU CA C 13 53.128 0.010 A 60 LEU CB C 13 47.435 0.057 A 60 LEU CDy C 13 25.658 0.022 A 60 LEU CDx C 13 24.755 0.054 A 60 LEU CG C 13 26.724 0.056 A 60 LEU N N 15 118.105 0.029 A 61 ARG H H 1 9.287 0.003 A 61 ARG HA H 1 5.458 0.011 A 61 ARG HBx H 1 0.954 0.004 A 61 ARG HBy H 1 1.329 0.023 A 61 ARG HG3 H 1 1.318 0.000 A 61 ARG C C 13 173.515 0.000 A 61 ARG CA C 13 54.724 0.042 A 61 ARG CB C 13 35.132 0.000 A 61 ARG N N 15 120.757 0.027 A 62 LEU H H 1 9.307 0.004 A 62 LEU HA H 1 5.029 0.011 A 62 LEU HBx H 1 1.758 0.017 A 62 LEU HBy H 1 1.881 0.027 A 62 LEU HDx% H 1 1.052 0.008 A 62 LEU HDy% H 1 0.932 0.005 A 62 LEU HG H 1 1.859 0.006 A 62 LEU C C 13 175.440 0.000 A 62 LEU CA C 13 54.400 0.000 A 62 LEU CB C 13 43.103 0.031 A 62 LEU CDx C 13 25.364 0.088 A 62 LEU CDy C 13 27.506 0.015 A 62 LEU CG C 13 29.639 0.035 A 62 LEU N N 15 127.139 0.046 A 63 ILE H H 1 8.891 0.005 A 63 ILE HA H 1 4.588 0.007 A 63 ILE HB H 1 1.970 0.013 A 63 ILE HD1% H 1 0.599 0.006 A 63 ILE HG13 H 1 1.228 0.011 A 63 ILE HG2% H 1 1.036 0.006 A 63 ILE C C 13 176.319 0.000 A 63 ILE CA C 13 59.387 0.034 A 63 ILE CB C 13 38.121 0.021 A 63 ILE CD1 C 13 11.641 0.147 A 63 ILE CG2 C 13 17.520 0.092 A 63 ILE N N 15 123.292 0.031 A 64 GLY H H 1 9.356 0.004 A 64 GLY HAy H 1 4.694 0.006 A 64 GLY HAx H 1 4.052 0.018 A 64 GLY C C 13 172.551 0.000 A 64 GLY CA C 13 45.429 0.012 A 64 GLY N N 15 115.565 0.041 A 65 LYS H H 1 8.361 0.003 A 65 LYS HA H 1 4.295 0.006 A 65 LYS HBx H 1 1.593 0.013 A 65 LYS HBy H 1 1.899 0.007 A 65 LYS HD3 H 1 1.603 0.006 A 65 LYS HEy H 1 2.958 0.006 A 65 LYS HEx H 1 2.868 0.002 A 65 LYS HGx H 1 1.216 0.013 A 65 LYS HGy H 1 1.420 0.012 A 65 LYS C C 13 176.205 0.000 A 65 LYS CA C 13 56.588 0.052 A 65 LYS CB C 13 34.353 0.059 A 65 LYS CD C 13 29.539 0.083 A 65 LYS CE C 13 42.329 0.011 A 65 LYS CG C 13 26.427 0.003 A 65 LYS N N 15 119.442 0.040 A 66 VAL H H 1 8.637 0.006 A 66 VAL HA H 1 4.086 0.004 A 66 VAL HB H 1 1.967 0.007 A 66 VAL HGx% H 1 0.838 0.010 A 66 VAL HGy% H 1 0.892 0.020 A 66 VAL C C 13 175.265 0.000 A 66 VAL CA C 13 62.063 0.020 A 66 VAL CB C 13 33.264 0.004 A 66 VAL CGy C 13 21.289 0.037 A 66 VAL CGx C 13 21.049 0.000 A 66 VAL N N 15 122.131 0.009 A 67 ASP H H 1 8.460 0.002 A 67 ASP HA H 1 4.727 0.016 A 67 ASP HBx H 1 2.590 0.009 A 67 ASP HBy H 1 2.818 0.009 A 67 ASP C C 13 176.708 0.000 A 67 ASP CA C 13 53.140 0.000 A 67 ASP CB C 13 40.930 0.000 A 67 ASP N N 15 125.510 0.029 A 68 GLU H H 1 8.752 0.004 A 68 GLU HA H 1 4.088 0.005 A 68 GLU HBy H 1 2.173 0.007 A 68 GLU HBx H 1 2.005 0.008 A 68 GLU HGx H 1 2.247 0.008 A 68 GLU HGy H 1 2.366 0.007 A 68 GLU C C 13 177.451 0.000 A 68 GLU CA C 13 57.855 0.016 A 68 GLU CB C 13 29.677 0.090 A 68 GLU CG C 13 36.465 0.023 A 68 GLU N N 15 124.449 0.014 A 69 SER H H 1 8.497 0.003 A 69 SER HA H 1 4.329 0.004 A 69 SER HBy H 1 3.980 0.020 A 69 SER HBx H 1 3.966 0.019 A 69 SER C C 13 175.277 0.000 A 69 SER CA C 13 60.139 0.004 A 69 SER CB C 13 63.223 0.007 A 69 SER N N 15 115.515 0.020 A 70 LYS H H 1 7.689 0.003 A 70 LYS HA H 1 4.410 0.007 A 70 LYS HBx H 1 1.760 0.010 A 70 LYS HBy H 1 1.941 0.011 A 70 LYS HD3 H 1 1.662 0.009 A 70 LYS HGy H 1 1.464 0.010 A 70 LYS HGx H 1 1.352 0.006 A 70 LYS C C 13 177.124 0.000 A 70 LYS CA C 13 55.324 0.008 A 70 LYS N N 15 121.733 0.022 A 71 LYS H H 1 7.750 0.004 A 71 LYS HA H 1 4.407 0.006 A 71 LYS HD3 H 1 1.675 0.005 A 71 LYS HG3 H 1 1.368 0.008 A 71 LYS C C 13 176.175 0.000 A 71 LYS CA C 13 56.612 0.013 A 71 LYS CD C 13 28.750 0.022 A 71 LYS N N 15 121.012 0.033 A 72 ARG H H 1 8.420 0.002 A 72 ARG HA H 1 4.601 0.012 A 72 ARG HBy H 1 1.889 0.007 A 72 ARG HBx H 1 1.763 0.002 A 72 ARG HD2 H 1 3.206 0.004 A 72 ARG HG3 H 1 1.589 0.005 A 72 ARG C C 13 175.228 0.000 A 72 ARG CA C 13 54.929 0.003 A 72 ARG CB C 13 32.325 0.008 A 72 ARG CD C 13 43.316 0.059 A 72 ARG CG C 13 26.943 0.029 A 72 ARG N N 15 122.064 0.020 A 73 LYS H H 1 8.401 0.002 A 73 LYS HA H 1 4.933 0.018 A 73 LYS HB3 H 1 1.725 0.006 A 73 LYS HD3 H 1 1.614 0.015 A 73 LYS HE3 H 1 2.972 0.000 A 73 LYS HGx H 1 1.316 0.003 A 73 LYS HGy H 1 1.425 0.007 A 73 LYS C C 13 177.010 0.000 A 73 LYS CA C 13 55.205 0.034 A 73 LYS CB C 13 34.680 0.000 A 73 LYS N N 15 121.217 0.023 A 74 ASP H H 1 8.582 0.002 A 74 ASP HA H 1 4.710 0.050 A 74 ASP HBx H 1 2.638 0.004 A 74 ASP HBy H 1 3.171 0.013 A 74 ASP C C 13 177.475 0.000 A 74 ASP CA C 13 52.756 0.018 A 74 ASP CB C 13 41.022 0.021 A 74 ASP N N 15 122.025 0.023 A 75 ASN H H 1 8.433 0.006 A 75 ASN HA H 1 4.536 0.004 A 75 ASN HB2 H 1 2.867 0.006 A 75 ASN HD21 H 1 7.657 0.000 A 75 ASN HD22 H 1 6.960 0.000 A 75 ASN C C 13 175.999 0.000 A 75 ASN CA C 13 54.853 0.000 A 75 ASN CB C 13 38.132 0.013 A 75 ASN CG C 13 177.095 0.008 A 75 ASN N N 15 116.228 0.116 A 75 ASN ND2 N 15 112.592 0.022 A 76 GLU H H 1 8.162 0.001 A 76 GLU HA H 1 4.381 0.008 A 76 GLU HB3 H 1 1.967 0.003 A 76 GLU HG2 H 1 2.225 0.009 A 76 GLU C C 13 176.556 0.000 A 76 GLU CA C 13 56.163 0.000 A 76 GLU CG C 13 36.773 0.005 A 76 GLU N N 15 118.958 0.014 A 77 GLY H H 1 8.106 0.003 A 77 GLY HAx H 1 3.664 0.004 A 77 GLY HAy H 1 4.205 0.007 A 77 GLY C C 13 174.247 0.000 A 77 GLY CA C 13 45.210 0.041 A 77 GLY N N 15 108.062 0.011 A 78 ASN H H 1 8.569 0.004 A 78 ASN HA H 1 4.746 0.003 A 78 ASN HBy H 1 2.857 0.007 A 78 ASN HBx H 1 2.663 0.007 A 78 ASN HD21 H 1 7.070 0.003 A 78 ASN HD22 H 1 8.260 0.004 A 78 ASN C C 13 175.035 0.000 A 78 ASN CA C 13 52.795 0.007 A 78 ASN CB C 13 38.945 0.024 A 78 ASN CG C 13 176.970 0.012 A 78 ASN N N 15 119.929 0.017 A 78 ASN ND2 N 15 117.103 0.183 A 79 GLU H H 1 8.691 0.001 A 79 GLU HA H 1 4.481 0.012 A 79 GLU HB3 H 1 1.932 0.005 A 79 GLU HGx H 1 2.098 0.006 A 79 GLU HGy H 1 2.275 0.003 A 79 GLU C C 13 176.302 0.000 A 79 GLU CA C 13 56.662 0.008 A 79 GLU CB C 13 30.643 0.029 A 79 GLU CG C 13 36.887 0.024 A 79 GLU N N 15 121.658 0.013 A 80 VAL H H 1 8.581 0.010 A 80 VAL HA H 1 4.255 0.008 A 80 VAL HB H 1 1.959 0.008 A 80 VAL HG2% H 1 0.867 0.008 A 80 VAL C C 13 175.544 0.000 A 80 VAL CA C 13 61.293 0.041 A 80 VAL CB C 13 33.543 0.096 A 80 VAL CG2 C 13 20.488 0.027 A 80 VAL N N 15 123.997 0.144 A 81 VAL H H 1 8.407 0.002 A 81 VAL HA H 1 4.426 0.005 A 81 VAL HB H 1 2.039 0.008 A 81 VAL HG2% H 1 0.979 0.010 A 81 VAL CA C 13 59.551 0.032 A 81 VAL CB C 13 32.894 0.000 A 81 VAL CG2 C 13 20.966 0.093 A 81 VAL N N 15 126.545 0.027 A 82 PRO HA H 1 4.432 0.002 A 82 PRO HB2 H 1 2.260 0.000 A 82 PRO HDx H 1 3.632 0.013 A 82 PRO HDy H 1 3.853 0.003 A 82 PRO HGx H 1 1.948 0.001 A 82 PRO HGy H 1 2.040 0.000 A 82 PRO C C 13 176.036 0.000 A 82 PRO CA C 13 62.565 0.021 A 82 PRO CD C 13 51.090 0.002 A 82 PRO CG C 13 27.601 0.001 A 83 LYS H H 1 8.316 0.001 A 83 LYS HA H 1 4.551 0.003 A 83 LYS HB3 H 1 1.796 0.004 A 83 LYS HD3 H 1 1.668 0.000 A 83 LYS HG3 H 1 1.528 0.013 A 83 LYS CA C 13 53.779 0.010 A 83 LYS N N 15 121.727 0.032 A 84 PRO HA H 1 4.293 0.008 A 84 PRO HBy H 1 2.250 0.009 A 84 PRO HBx H 1 1.806 0.002 A 84 PRO HDx H 1 3.619 0.006 A 84 PRO HDy H 1 3.774 0.011 A 84 PRO HG3 H 1 1.942 0.021 A 84 PRO C C 13 176.883 0.000 A 84 PRO CA C 13 62.476 0.010 A 84 PRO CB C 13 32.441 0.039 A 84 PRO CD C 13 50.414 0.053 A 84 PRO CG C 13 27.460 0.000 A 85 GLN H H 1 8.471 0.004 A 85 GLN HA H 1 4.145 0.004 A 85 GLN HBy H 1 1.931 0.014 A 85 GLN HBx H 1 1.841 0.006 A 85 GLN HE21 H 1 7.024 0.001 A 85 GLN HE22 H 1 7.617 0.003 A 85 GLN HGx H 1 2.216 0.008 A 85 GLN HGy H 1 2.339 0.003 A 85 GLN C C 13 175.026 0.000 A 85 GLN CA C 13 56.041 0.007 A 85 GLN CB C 13 29.809 0.000 A 85 GLN CD C 13 180.238 0.012 A 85 GLN CG C 13 34.104 0.014 A 85 GLN N N 15 121.423 0.020 A 85 GLN NE2 N 15 112.539 0.180 A 86 ARG H H 1 8.265 0.004 A 86 ARG HA H 1 5.187 0.007 A 86 ARG HBx H 1 1.349 0.008 A 86 ARG HBy H 1 1.649 0.006 A 86 ARG HDx H 1 2.875 0.007 A 86 ARG HDy H 1 2.976 0.002 A 86 ARG HGx H 1 1.366 0.011 A 86 ARG HGy H 1 1.588 0.007 A 86 ARG C C 13 175.091 0.000 A 86 ARG CA C 13 54.392 0.023 A 86 ARG CB C 13 33.428 0.032 A 86 ARG CD C 13 43.641 0.029 A 86 ARG CG C 13 27.158 0.047 A 86 ARG N N 15 120.972 0.063 A 87 HIS H H 1 8.590 0.003 A 87 HIS HA H 1 4.745 0.010 A 87 HIS HBy H 1 3.215 0.012 A 87 HIS HBx H 1 2.737 0.011 A 87 HIS HD2 H 1 6.680 0.007 A 87 HIS C C 13 173.730 0.000 A 87 HIS CA C 13 54.207 0.019 A 87 HIS CB C 13 33.597 0.074 A 87 HIS CD2 C 13 117.980 0.071 A 87 HIS N N 15 120.390 0.041 A 88 MET H H 1 8.716 0.003 A 88 MET HA H 1 5.320 0.009 A 88 MET HBy H 1 1.918 0.006 A 88 MET HBx H 1 1.567 0.008 A 88 MET HE% H 1 1.903 0.004 A 88 MET HGy H 1 2.356 0.018 A 88 MET HGx H 1 2.322 0.006 A 88 MET C C 13 173.520 0.000 A 88 MET CA C 13 54.782 0.054 A 88 MET CB C 13 35.451 0.030 A 88 MET CE C 13 17.811 0.109 A 88 MET CG C 13 32.500 0.004 A 88 MET N N 15 126.611 0.027 A 89 PHE H H 1 8.989 0.005 A 89 PHE HA H 1 5.210 0.008 A 89 PHE HBx H 1 2.267 0.004 A 89 PHE HBy H 1 2.602 0.019 A 89 PHE HDx H 1 6.838 0.011 A 89 PHE HDy H 1 6.838 0.011 A 89 PHE HEx H 1 6.663 0.007 A 89 PHE HEy H 1 6.663 0.007 A 89 PHE HZ H 1 6.599 0.007 A 89 PHE C C 13 174.448 0.000 A 89 PHE CA C 13 56.452 0.024 A 89 PHE CB C 13 44.088 0.044 A 89 PHE CDx C 13 130.891 0.030 A 89 PHE CDy C 13 130.891 0.030 A 89 PHE CEx C 13 129.986 0.025 A 89 PHE CEy C 13 129.986 0.025 A 89 PHE CZ C 13 127.335 0.017 A 89 PHE N N 15 122.328 0.051 A 90 SER H H 1 8.680 0.004 A 90 SER HA H 1 5.681 0.013 A 90 SER HBx H 1 3.727 0.007 A 90 SER HBy H 1 3.835 0.006 A 90 SER C C 13 173.094 0.000 A 90 SER CA C 13 56.645 0.043 A 90 SER CB C 13 64.824 0.044 A 90 SER N N 15 116.094 0.049 A 91 PHE H H 1 9.050 0.009 A 91 PHE HA H 1 4.894 0.010 A 91 PHE HBy H 1 3.334 0.009 A 91 PHE HBx H 1 2.821 0.009 A 91 PHE HDx H 1 7.507 0.015 A 91 PHE HDy H 1 7.507 0.015 A 91 PHE HEx H 1 7.102 0.012 A 91 PHE HEy H 1 7.102 0.012 A 91 PHE HZ H 1 6.819 0.011 A 91 PHE C C 13 174.500 0.000 A 91 PHE CA C 13 57.402 0.042 A 91 PHE CB C 13 43.327 0.057 A 91 PHE CDx C 13 131.989 0.078 A 91 PHE CDy C 13 131.989 0.078 A 91 PHE CEx C 13 130.151 0.038 A 91 PHE CEy C 13 130.151 0.038 A 91 PHE CZ C 13 126.835 0.044 A 91 PHE N N 15 120.812 0.025 A 92 ASN H H 1 9.135 0.002 A 92 ASN HA H 1 5.102 0.007 A 92 ASN HB2 H 1 2.919 0.006 A 92 ASN HD21 H 1 6.810 0.003 A 92 ASN HD22 H 1 7.607 0.002 A 92 ASN C C 13 174.901 0.000 A 92 ASN CA C 13 52.207 0.004 A 92 ASN CB C 13 39.864 0.010 A 92 ASN CG C 13 177.065 0.011 A 92 ASN N N 15 115.876 0.026 A 92 ASN ND2 N 15 111.099 0.179 A 93 ASN H H 1 7.271 0.002 A 93 ASN HA H 1 4.901 0.007 A 93 ASN HBx H 1 2.859 0.034 A 93 ASN HBy H 1 2.914 0.007 A 93 ASN HD21 H 1 7.911 0.005 A 93 ASN HD22 H 1 7.210 0.003 A 93 ASN C C 13 174.579 0.000 A 93 ASN CA C 13 53.028 0.017 A 93 ASN CB C 13 41.802 0.006 A 93 ASN CG C 13 176.424 0.017 A 93 ASN N N 15 118.335 0.024 A 93 ASN ND2 N 15 113.903 0.174 A 94 ARG H H 1 9.334 0.005 A 94 ARG HA H 1 3.865 0.010 A 94 ARG HBy H 1 1.997 0.006 A 94 ARG HBx H 1 1.820 0.002 A 94 ARG HDy H 1 3.377 0.006 A 94 ARG HDx H 1 3.120 0.006 A 94 ARG HE H 1 7.419 0.005 A 94 ARG HG3 H 1 1.789 0.011 A 94 ARG C C 13 176.782 0.000 A 94 ARG CA C 13 59.051 0.030 A 94 ARG CD C 13 42.507 0.051 A 94 ARG N N 15 129.027 0.028 A 94 ARG NE N 15 109.917 0.020 A 95 THR H H 1 8.000 0.001 A 95 THR HA H 1 4.028 0.009 A 95 THR HB H 1 4.329 0.008 A 95 THR HG2% H 1 1.283 0.008 A 95 THR C C 13 176.742 0.000 A 95 THR CA C 13 66.325 0.007 A 95 THR CB C 13 68.281 0.010 A 95 THR CG2 C 13 22.022 0.016 A 95 THR N N 15 115.756 0.083 A 96 VAL H H 1 7.609 0.003 A 96 VAL HA H 1 3.796 0.011 A 96 VAL HB H 1 2.375 0.011 A 96 VAL HGx% H 1 1.283 0.020 A 96 VAL HGy% H 1 1.236 0.006 A 96 VAL C C 13 177.587 0.000 A 96 VAL CA C 13 65.958 0.044 A 96 VAL CB C 13 32.027 0.025 A 96 VAL CGx C 13 21.448 0.024 A 96 VAL CGy C 13 22.306 0.062 A 96 VAL N N 15 121.852 0.039 A 97 MET H H 1 7.337 0.004 A 97 MET HA H 1 2.337 0.008 A 97 MET HBx H 1 1.947 0.003 A 97 MET HBy H 1 2.340 0.009 A 97 MET HE% H 1 2.074 0.013 A 97 MET HG2 H 1 1.624 0.006 A 97 MET C C 13 177.257 0.000 A 97 MET CE C 13 17.748 0.018 A 97 MET N N 15 117.469 0.025 A 98 ASP H H 1 8.729 0.003 A 98 ASP HA H 1 4.316 0.007 A 98 ASP HBx H 1 2.571 0.005 A 98 ASP HBy H 1 2.740 0.008 A 98 ASP C C 13 178.771 0.000 A 98 ASP CA C 13 57.554 0.011 A 98 ASP CB C 13 39.779 0.000 A 98 ASP N N 15 118.162 0.037 A 99 ASN H H 1 8.104 0.004 A 99 ASN HA H 1 4.469 0.006 A 99 ASN HBx H 1 2.784 0.006 A 99 ASN HBy H 1 3.040 0.007 A 99 ASN HD21 H 1 6.966 0.006 A 99 ASN HD22 H 1 7.469 0.011 A 99 ASN C C 13 178.220 0.000 A 99 ASN CA C 13 56.094 0.022 A 99 ASN CB C 13 38.372 0.042 A 99 ASN CG C 13 176.367 0.002 A 99 ASN N N 15 120.303 0.034 A 99 ASN ND2 N 15 111.373 0.142 A 100 ILE H H 1 8.020 0.004 A 100 ILE HA H 1 3.646 0.005 A 100 ILE HB H 1 1.909 0.009 A 100 ILE HD1% H 1 0.541 0.007 A 100 ILE HG1y H 1 1.593 0.006 A 100 ILE HG1x H 1 1.299 0.021 A 100 ILE HG2% H 1 0.728 0.005 A 100 ILE C C 13 177.361 0.000 A 100 ILE CA C 13 62.746 0.032 A 100 ILE CB C 13 35.702 0.064 A 100 ILE CD1 C 13 9.698 0.020 A 100 ILE CG1 C 13 28.464 0.033 A 100 ILE CG2 C 13 17.358 0.027 A 100 ILE N N 15 121.160 0.048 A 101 LYS H H 1 8.907 0.005 A 101 LYS HA H 1 3.684 0.014 A 101 LYS HBy H 1 2.143 0.013 A 101 LYS HBx H 1 1.909 0.012 A 101 LYS HD3 H 1 1.554 0.022 A 101 LYS HE3 H 1 2.919 0.015 A 101 LYS HG3 H 1 1.365 0.000 A 101 LYS C C 13 177.127 0.000 A 101 LYS CA C 13 60.160 0.028 A 101 LYS CB C 13 32.997 0.045 A 101 LYS CE C 13 41.192 0.000 A 101 LYS N N 15 120.747 0.045 A 102 MET H H 1 8.002 0.004 A 102 MET HA H 1 4.245 0.010 A 102 MET HBx H 1 2.151 0.007 A 102 MET HBy H 1 2.250 0.010 A 102 MET HE% H 1 2.097 0.003 A 102 MET HGx H 1 2.623 0.007 A 102 MET HGy H 1 2.746 0.011 A 102 MET C C 13 178.941 0.000 A 102 MET CA C 13 58.367 0.029 A 102 MET CB C 13 32.055 0.061 A 102 MET CE C 13 16.869 0.092 A 102 MET CG C 13 32.003 0.015 A 102 MET N N 15 116.126 0.022 A 103 THR H H 1 7.694 0.007 A 103 THR HA H 1 3.861 0.006 A 103 THR HB H 1 3.989 0.005 A 103 THR HG2% H 1 0.777 0.004 A 103 THR C C 13 176.493 0.000 A 103 THR CA C 13 66.168 0.015 A 103 THR CB C 13 67.923 0.026 A 103 THR CG2 C 13 22.262 0.026 A 103 THR N N 15 117.988 0.051 A 104 LEU H H 1 8.530 0.005 A 104 LEU HA H 1 3.880 0.012 A 104 LEU HBy H 1 2.154 0.011 A 104 LEU HBx H 1 1.180 0.013 A 104 LEU HDx% H 1 0.758 0.003 A 104 LEU HDy% H 1 0.823 0.004 A 104 LEU HG H 1 1.888 0.000 A 104 LEU C C 13 178.072 0.000 A 104 LEU CA C 13 58.046 0.013 A 104 LEU CB C 13 42.894 0.040 A 104 LEU CDy C 13 26.993 0.041 A 104 LEU CDx C 13 24.802 0.032 A 104 LEU N N 15 119.248 0.060 A 105 GLN H H 1 8.623 0.002 A 105 GLN HA H 1 3.968 0.009 A 105 GLN HBx H 1 2.082 0.014 A 105 GLN HBy H 1 2.182 0.014 A 105 GLN HE21 H 1 7.392 0.001 A 105 GLN HE22 H 1 6.396 0.002 A 105 GLN HG3 H 1 2.370 0.014 A 105 GLN C C 13 178.675 0.000 A 105 GLN CA C 13 59.073 0.060 A 105 GLN CB C 13 27.968 0.088 A 105 GLN CD C 13 178.506 0.013 A 105 GLN CG C 13 32.838 0.079 A 105 GLN N N 15 119.071 0.057 A 105 GLN NE2 N 15 108.447 0.171 A 106 GLN H H 1 7.581 0.007 A 106 GLN HA H 1 4.039 0.007 A 106 GLN HBx H 1 2.165 0.006 A 106 GLN HBy H 1 2.321 0.007 A 106 GLN HE21 H 1 6.830 0.002 A 106 GLN HE22 H 1 7.416 0.004 A 106 GLN HGy H 1 2.619 0.006 A 106 GLN HGx H 1 2.419 0.007 A 106 GLN C C 13 178.677 0.000 A 106 GLN CA C 13 58.715 0.010 A 106 GLN CB C 13 28.464 0.049 A 106 GLN CD C 13 180.227 0.013 A 106 GLN CG C 13 34.056 0.017 A 106 GLN N N 15 117.946 0.020 A 106 GLN NE2 N 15 111.127 0.185 A 107 ILE H H 1 7.801 0.002 A 107 ILE HA H 1 3.465 0.008 A 107 ILE HB H 1 1.689 0.014 A 107 ILE HD1% H 1 0.643 0.005 A 107 ILE HG13 H 1 0.895 0.031 A 107 ILE HG2% H 1 0.824 0.014 A 107 ILE C C 13 177.586 0.000 A 107 ILE CA C 13 65.482 0.036 A 107 ILE CB C 13 39.139 0.008 A 107 ILE CD1 C 13 15.833 0.024 A 107 ILE CG1 C 13 28.770 0.000 A 107 ILE CG2 C 13 19.100 0.022 A 107 ILE N N 15 120.013 0.029 A 108 ILE H H 1 8.734 0.006 A 108 ILE HA H 1 3.784 0.009 A 108 ILE HB H 1 1.883 0.013 A 108 ILE HD1% H 1 0.792 0.006 A 108 ILE HG13 H 1 1.705 0.012 A 108 ILE HG2% H 1 0.926 0.010 A 108 ILE C C 13 179.171 0.000 A 108 ILE CA C 13 65.603 0.062 A 108 ILE CB C 13 38.241 0.047 A 108 ILE CD1 C 13 15.697 0.101 A 108 ILE CG1 C 13 29.476 0.047 A 108 ILE CG2 C 13 17.339 0.081 A 108 ILE N N 15 117.686 0.024 A 109 SER H H 1 7.881 0.003 A 109 SER HA H 1 4.214 0.007 A 109 SER HBx H 1 4.008 0.016 A 109 SER HBy H 1 4.048 0.006 A 109 SER C C 13 176.381 0.000 A 109 SER CA C 13 61.564 0.034 A 109 SER CB C 13 62.831 0.034 A 109 SER N N 15 114.198 0.040 A 110 ARG H H 1 7.550 0.002 A 110 ARG HA H 1 4.137 0.005 A 110 ARG HB2 H 1 1.681 0.004 A 110 ARG HDx H 1 3.011 0.008 A 110 ARG HDy H 1 3.168 0.004 A 110 ARG HE H 1 7.079 0.003 A 110 ARG HGy H 1 1.687 0.008 A 110 ARG HGx H 1 1.552 0.003 A 110 ARG C C 13 178.636 0.000 A 110 ARG CA C 13 58.376 0.013 A 110 ARG CB C 13 29.850 0.040 A 110 ARG CD C 13 43.894 0.065 A 110 ARG CG C 13 27.141 0.016 A 110 ARG N N 15 121.010 0.021 A 110 ARG NE N 15 111.131 0.018 A 111 TYR H H 1 7.496 0.003 A 111 TYR HA H 1 4.795 0.009 A 111 TYR HBx H 1 3.068 0.008 A 111 TYR HBy H 1 3.417 0.008 A 111 TYR HDx H 1 7.103 0.011 A 111 TYR HDy H 1 7.103 0.011 A 111 TYR HEx H 1 6.728 0.014 A 111 TYR HEy H 1 6.728 0.014 A 111 TYR C C 13 176.218 0.000 A 111 TYR CA C 13 57.574 0.034 A 111 TYR CB C 13 37.492 0.045 A 111 TYR CDx C 13 131.845 0.036 A 111 TYR CDy C 13 131.845 0.036 A 111 TYR CEx C 13 117.719 0.000 A 111 TYR CEy C 13 117.719 0.000 A 111 TYR N N 15 117.243 0.024 A 112 LYS H H 1 7.755 0.011 A 112 LYS HA H 1 4.334 0.009 A 112 LYS HB3 H 1 1.960 0.005 A 112 LYS HD3 H 1 1.816 0.004 A 112 LYS HE3 H 1 3.104 0.001 A 112 LYS HGx H 1 1.585 0.006 A 112 LYS HGy H 1 1.694 0.008 A 112 LYS C C 13 177.437 0.000 A 112 LYS CA C 13 57.630 0.063 A 112 LYS CB C 13 32.590 0.000 A 112 LYS CD C 13 29.007 0.046 A 112 LYS CE C 13 41.893 0.033 A 112 LYS CG C 13 24.881 0.052 A 112 LYS N N 15 121.040 0.080 A 113 ASP H H 1 8.246 0.002 A 113 ASP HA H 1 4.637 0.000 A 113 ASP HBx H 1 2.701 0.007 A 113 ASP HBy H 1 2.774 0.012 A 113 ASP C C 13 176.587 0.000 A 113 ASP CB C 13 41.093 0.053 A 113 ASP N N 15 120.593 0.022 A 114 ALA H H 1 8.038 0.002 A 114 ALA HA H 1 4.349 0.011 A 114 ALA HB% H 1 1.491 0.006 A 114 ALA C C 13 178.004 0.000 A 114 ALA CA C 13 52.886 0.002 A 114 ALA CB C 13 19.265 0.017 A 114 ALA N N 15 123.721 0.020 A 115 ASP H H 1 8.254 0.003 A 115 ASP HA H 1 4.639 0.006 A 115 ASP HBy H 1 2.784 0.004 A 115 ASP HBx H 1 2.733 0.011 A 115 ASP C C 13 177.129 0.000 A 115 ASP CA C 13 54.806 0.000 A 115 ASP CB C 13 41.238 0.000 A 115 ASP N N 15 119.260 0.016 A 116 GLY H H 1 8.261 0.002 A 116 GLY HA2 H 1 3.985 0.001 A 116 GLY C C 13 174.403 0.000 A 116 GLY N N 15 108.892 0.016 A 117 ASN H H 1 8.325 0.001 A 117 ASN HA H 1 4.782 0.038 A 117 ASN HB3 H 1 2.847 0.034 A 117 ASN HD21 H 1 7.650 0.000 A 117 ASN HD22 H 1 6.952 0.006 A 117 ASN C C 13 175.393 0.000 A 117 ASN CA C 13 53.211 0.000 A 117 ASN CB C 13 39.177 0.008 A 117 ASN CG C 13 177.343 0.007 A 117 ASN N N 15 118.783 0.010 A 117 ASN ND2 N 15 113.002 0.085 A 118 SER H H 1 8.326 0.002 A 118 SER HA H 1 4.560 0.000 A 118 SER HB2 H 1 3.934 0.000 A 118 SER C C 13 173.822 0.000 A 118 SER CA C 13 58.258 0.000 A 118 SER CB C 13 63.837 0.000 A 118 SER N N 15 116.594 0.002 A 119 SER H H 1 8.020 0.002 A 119 SER HA H 1 4.313 0.000 A 119 SER HB2 H 1 3.881 0.000 A 119 SER CA C 13 59.963 0.000 A 119 SER CB C 13 64.690 0.000 A 119 SER N N 15 123.224 0.024 B 90 TYR H H 1 7.929 0.005 B 90 TYR HA H 1 4.425 0.000 B 90 TYR HBy H 1 3.023 0.000 B 90 TYR HBx H 1 2.883 0.000 B 90 TYR HDx H 1 7.016 0.000 B 90 TYR HDy H 1 7.016 0.000 B 90 TYR HEx H 1 6.714 0.000 B 90 TYR HEy H 1 6.714 0.000 B 90 TYR C C 13 175.731 0.000 B 90 TYR CA C 13 58.120 0.026 B 90 TYR CB C 13 38.465 0.018 B 90 TYR CDx C 13 132.249 0.000 B 90 TYR CDy C 13 132.249 0.000 B 90 TYR CEx C 13 117.801 0.000 B 90 TYR CEy C 13 117.801 0.000 B 90 TYR N N 15 120.385 0.008 B 91 ASP H H 1 8.213 0.005 B 91 ASP HA H 1 4.641 0.000 B 91 ASP HBx H 1 2.554 0.000 B 91 ASP HBy H 1 2.708 0.000 B 91 ASP C C 13 176.346 0.000 B 91 ASP CA C 13 54.487 0.035 B 91 ASP CB C 13 41.223 0.100 B 91 ASP N N 15 120.820 0.026 B 92 SER H H 1 8.009 0.005 B 92 SER HA H 1 4.325 0.000 B 92 SER HBy H 1 3.921 0.000 B 92 SER HBx H 1 3.790 0.000 B 92 SER C C 13 174.955 0.000 B 92 SER CA C 13 59.054 0.033 B 92 SER CB C 13 63.556 0.055 B 92 SER N N 15 115.251 0.007 B 93 GLU H H 1 8.198 0.005 B 93 GLU HA H 1 4.291 0.000 B 93 GLU HBx H 1 1.902 0.000 B 93 GLU HBy H 1 2.005 0.000 B 93 GLU HGx H 1 2.191 0.000 B 93 GLU HGy H 1 2.244 0.000 B 93 GLU C C 13 176.496 0.000 B 93 GLU CA C 13 56.168 0.027 B 93 GLU CB C 13 30.059 0.066 B 93 GLU CG C 13 36.202 0.000 B 93 GLU N N 15 121.662 0.024 B 94 GLU H H 1 8.216 0.005 B 94 GLU HA H 1 4.268 0.000 B 94 GLU HBy H 1 1.843 0.000 B 94 GLU HBx H 1 1.737 0.000 B 94 GLU HGy H 1 2.144 0.000 B 94 GLU HGx H 1 2.037 0.000 B 94 GLU C C 13 174.905 0.000 B 94 GLU CA C 13 56.512 0.072 B 94 GLU CB C 13 30.136 0.072 B 94 GLU CG C 13 36.343 0.000 B 94 GLU N N 15 121.057 0.015 B 95 PHE H H 1 7.733 0.005 B 95 PHE HA H 1 4.398 0.000 B 95 PHE HBx H 1 2.626 0.000 B 95 PHE HBy H 1 2.694 0.000 B 95 PHE HDx H 1 6.907 0.000 B 95 PHE HDy H 1 6.907 0.000 B 95 PHE HEx H 1 7.011 0.000 B 95 PHE HEy H 1 7.011 0.000 B 95 PHE HZ H 1 7.141 0.000 B 95 PHE C C 13 175.244 0.000 B 95 PHE CA C 13 58.260 0.087 B 95 PHE CB C 13 42.915 0.060 B 95 PHE CDx C 13 130.822 0.000 B 95 PHE CDy C 13 130.822 0.000 B 95 PHE CEx C 13 130.482 0.000 B 95 PHE CEy C 13 130.482 0.000 B 95 PHE CZ C 13 128.172 0.000 B 95 PHE N N 15 117.297 0.023 B 96 GLU H H 1 8.962 0.008 B 96 GLU HA H 1 4.749 0.000 B 96 GLU HB3 H 1 2.031 0.000 B 96 GLU HGx H 1 2.163 0.000 B 96 GLU HGy H 1 2.268 0.000 B 96 GLU C C 13 175.769 0.000 B 96 GLU CA C 13 53.648 0.048 B 96 GLU CB C 13 32.696 0.065 B 96 GLU CG C 13 35.444 0.015 B 96 GLU N N 15 119.476 0.054 B 97 ASP H H 1 8.887 0.005 B 97 ASP HA H 1 4.736 0.014 B 97 ASP HBx H 1 2.579 0.014 B 97 ASP HBy H 1 2.716 0.015 B 97 ASP C C 13 176.527 0.000 B 97 ASP CA C 13 55.523 0.066 B 97 ASP CB C 13 40.399 0.098 B 97 ASP N N 15 123.588 0.033 B 98 VAL H H 1 8.583 0.013 B 98 VAL HA H 1 4.276 0.000 B 98 VAL HB H 1 2.015 0.000 B 98 VAL HGx% H 1 0.896 0.000 B 98 VAL HGy% H 1 0.842 0.000 B 98 VAL C C 13 175.878 0.000 B 98 VAL CA C 13 62.119 0.073 B 98 VAL CB C 13 31.604 0.084 B 98 VAL CGx C 13 21.630 0.069 B 98 VAL CGy C 13 21.723 0.162 B 98 VAL N N 15 123.375 0.049 B 99 THR H H 1 8.296 0.005 B 99 THR HA H 1 4.393 0.000 B 99 THR HB H 1 4.302 0.000 B 99 THR HG2% H 1 1.187 0.000 B 99 THR C C 13 173.948 0.000 B 99 THR CA C 13 61.672 0.067 B 99 THR CB C 13 70.234 0.071 B 99 THR CG2 C 13 21.633 0.048 B 99 THR N N 15 118.694 0.011 B 100 ASP H H 1 8.308 0.005 B 100 ASP HA H 1 4.601 0.000 B 100 ASP HBy H 1 2.705 0.000 B 100 ASP HBx H 1 2.606 0.000 B 100 ASP C C 13 176.747 0.000 B 100 ASP CA C 13 54.386 0.016 B 100 ASP CB C 13 41.433 0.023 B 100 ASP N N 15 119.986 0.019 B 101 GLY H H 1 8.342 0.005 B 101 GLY HA2 H 1 3.877 0.000 B 101 GLY C C 13 174.009 0.000 B 101 GLY CA C 13 45.273 0.176 B 101 GLY N N 15 109.026 0.011 B 102 ASN H H 1 8.337 0.005 B 102 ASN HA H 1 4.692 0.000 B 102 ASN HBy H 1 2.782 0.000 B 102 ASN HBx H 1 2.727 0.000 B 102 ASN HD21 H 1 7.550 0.007 B 102 ASN HD22 H 1 6.867 0.004 B 102 ASN C C 13 175.182 0.000 B 102 ASN CA C 13 53.204 0.031 B 102 ASN CB C 13 39.043 0.041 B 102 ASN N N 15 118.494 0.007 B 102 ASN ND2 N 15 112.481 0.056 B 103 GLU H H 1 8.486 0.005 B 103 GLU HA H 1 4.273 0.000 B 103 GLU HBx H 1 1.911 0.000 B 103 GLU HBy H 1 2.018 0.000 B 103 GLU HG2 H 1 2.216 0.000 B 103 GLU C C 13 176.360 0.000 B 103 GLU CA C 13 56.736 0.008 B 103 GLU CB C 13 29.995 0.095 B 103 GLU CG C 13 36.148 0.000 B 103 GLU N N 15 121.383 0.011 B 104 VAL H H 1 8.124 0.005 B 104 VAL HA H 1 4.082 0.000 B 104 VAL HB H 1 2.053 0.000 B 104 VAL HGx% H 1 0.902 0.000 B 104 VAL HGy% H 1 0.901 0.000 B 104 VAL C C 13 175.706 0.000 B 104 VAL CA C 13 61.924 0.035 B 104 VAL CB C 13 32.747 0.040 B 104 VAL CGy C 13 21.264 0.000 B 104 VAL CGx C 13 20.392 0.103 B 104 VAL N N 15 121.271 0.010 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 2 SER H A 1 PRO HA 1.0 1.800 3.400 2 2 A 2 SER H A 1 PRO HBx 1.0 1.800 5.600 3 2 A 2 SER H A 1 PRO HBy 1.0 1.800 5.600 4 3 A 2 SER H A 1 PRO HGy 1.0 1.800 5.600 5 3 A 2 SER H A 1 PRO HGx 1.0 1.800 5.600 6 4 A 2 SER H A 2 SER HBx 1.0 1.800 3.808 7 4 A 2 SER H A 2 SER HBy 1.0 1.800 3.808 8 5 A 2 SER H A 4 SER H 1.0 1.800 5.000 9 6 A 1 PRO HA A 4 SER H 1.0 1.800 5.000 10 7 A 4 SER H A 2 SER HA 1.0 1.800 5.000 11 8 A 4 SER H A 3 HIS HA 1.0 1.800 2.800 12 9 A 4 SER H A 3 HIS HBx 1.0 1.800 5.600 13 9 A 4 SER H A 3 HIS HBy 1.0 1.800 5.600 14 10 A 4 SER H A 4 SER HBx 1.0 1.800 3.808 15 10 A 4 SER H A 4 SER HBy 1.0 1.800 3.808 16 11 A 4 SER H A 17 ALA HA 1.0 1.800 5.000 17 12 A 4 SER H A 100 ILE HD1% 1.0 1.800 6.000 18 13 A 5 GLY H A 4 SER HA 1.0 1.800 2.800 19 14 A 5 GLY H A 4 SER HBx 1.0 1.800 3.808 20 14 A 4 SER HBy A 5 GLY H 1.0 1.800 3.808 21 15 A 5 GLY H A 6 ALA H 1.0 1.800 5.000 22 16 A 5 GLY H A 15 ILE HA 1.0 1.800 5.000 23 17 A 5 GLY H A 16 ILE HA 1.0 1.800 5.000 24 18 A 5 GLY H A 16 ILE HB 1.0 1.800 3.400 25 19 A 5 GLY H A 16 ILE H 1.0 1.800 3.400 26 20 A 17 ALA HA A 5 GLY H 1.0 1.800 5.000 27 21 A 5 GLY H A 17 ALA HB% 1.0 1.800 6.000 28 22 A 100 ILE HD1% A 5 GLY H 1.0 1.800 6.000 29 23 A 6 ALA H A 5 GLY HAy 1.0 1.800 3.136 30 23 A 6 ALA H A 5 GLY HAx 1.0 1.800 3.136 31 24 A 6 ALA H A 6 ALA HB% 1.0 1.800 3.360 32 25 A 6 ALA H A 15 ILE HA 1.0 1.800 5.000 33 26 A 6 ALA H A 16 ILE H 1.0 1.800 5.000 34 27 A 6 ALA H A 96 VAL HGy% 1.0 1.800 4.080 35 28 A 100 ILE HD1% A 6 ALA H 1.0 1.800 6.000 36 29 A 7 ALA H A 6 ALA HA 1.0 1.800 2.800 37 30 A 6 ALA H A 7 ALA H 1.0 1.800 5.000 38 31 A 7 ALA H A 7 ALA HB% 1.0 1.800 4.080 39 32 A 15 ILE HA A 7 ALA H 1.0 1.800 3.400 40 33 A 7 ALA H A 15 ILE HG1x 1.0 1.800 5.600 41 33 A 7 ALA H A 15 ILE HG13 1.0 1.800 5.600 42 34 A 16 ILE HB A 7 ALA H 1.0 1.800 3.400 43 35 A 16 ILE H A 7 ALA H 1.0 1.800 5.000 44 36 A 7 ALA H A 29 TRP HD1 1.0 1.800 5.000 45 37 A 7 ALA H A 29 TRP HE1 1.0 1.800 5.000 46 38 A 8 ILE H A 7 ALA HA 1.0 1.800 2.800 47 39 A 8 ILE H A 8 ILE HB 1.0 1.800 3.400 48 40 A 8 ILE H A 8 ILE HD1% 1.0 1.800 6.000 49 41 A 8 ILE H A 8 ILE HG1y 1.0 1.800 3.808 50 41 A 8 ILE H A 8 ILE HG1x 1.0 1.800 3.808 51 42 A 8 ILE H A 8 ILE HG2% 1.0 1.800 6.000 52 43 A 8 ILE H A 90 SER HBx 1.0 1.800 5.600 53 43 A 8 ILE H A 90 SER HBy 1.0 1.800 5.600 54 44 A 8 ILE H A 91 PHE HA 1.0 1.800 5.000 55 45 A 9 PHE H A 8 ILE HA 1.0 1.800 2.800 56 46 A 8 ILE HB A 9 PHE H 1.0 1.800 5.000 57 47 A 8 ILE HD1% A 9 PHE H 1.0 1.800 6.000 58 48 A 9 PHE H A 8 ILE HG1y 1.0 1.800 5.600 59 48 A 8 ILE HG1x A 9 PHE H 1.0 1.800 5.600 60 49 A 8 ILE HG2% A 9 PHE H 1.0 1.800 4.080 61 50 A 8 ILE H A 9 PHE H 1.0 1.800 5.000 62 51 A 9 PHE H A 9 PHE HD% 1.0 1.800 5.600 63 52 A 9 PHE H A 10 GLU H 1.0 1.800 5.000 64 53 A 9 PHE H A 12 VAL HB 1.0 1.800 5.000 65 54 A 9 PHE H A 13 SER HA 1.0 1.800 5.000 66 55 A 9 PHE H A 14 GLY H 1.0 1.800 5.000 67 56 A 9 PHE H A 29 TRP HH2 1.0 1.800 5.000 68 57 A 9 PHE H A 29 TRP HZ2 1.0 1.800 3.400 69 58 A 9 PHE H A 89 PHE HD% 1.0 1.800 5.600 70 59 A 8 ILE HG2% A 10 GLU H 1.0 1.800 6.000 71 60 A 10 GLU H A 9 PHE HBx 1.0 1.800 5.600 72 60 A 10 GLU H A 9 PHE HBy 1.0 1.800 5.600 73 61 A 9 PHE HD% A 10 GLU H 1.0 1.800 3.808 74 62 A 10 GLU H A 9 PHE HE% 1.0 1.800 5.600 75 63 A 10 GLU H A 10 GLU HBy 1.0 1.800 3.808 76 63 A 10 GLU H A 10 GLU HBx 1.0 1.800 3.808 77 64 A 10 GLU H A 10 GLU HGx 1.0 1.800 3.808 78 64 A 10 GLU H A 10 GLU HGy 1.0 1.800 3.808 79 65 A 8 ILE HG2% A 11 LYS H 1.0 1.800 3.360 80 66 A 11 LYS H A 9 PHE HA 1.0 1.800 5.000 81 67 A 11 LYS H A 10 GLU HA 1.0 1.800 3.400 82 68 A 11 LYS H A 10 GLU HGx 1.0 1.800 5.600 83 68 A 10 GLU HGy A 11 LYS H 1.0 1.800 5.600 84 69 A 11 LYS H A 11 LYS HBy 1.0 1.800 5.600 85 69 A 11 LYS H A 11 LYS HBx 1.0 1.800 5.600 86 70 A 11 LYS H A 11 LYS HGx 1.0 1.800 3.136 87 70 A 11 LYS H A 11 LYS HG3 1.0 1.800 3.136 88 71 A 8 ILE HA A 12 VAL H 1.0 1.800 5.000 89 72 A 8 ILE HG2% A 12 VAL H 1.0 1.800 4.080 90 73 A 9 PHE HA A 12 VAL H 1.0 1.800 5.000 91 74 A 10 GLU HA A 12 VAL H 1.0 1.800 5.000 92 75 A 12 VAL H A 10 GLU HBy 1.0 1.800 5.600 93 75 A 10 GLU HBx A 12 VAL H 1.0 1.800 5.600 94 76 A 10 GLU H A 12 VAL H 1.0 1.800 5.000 95 77 A 12 VAL H A 11 LYS HA 1.0 1.800 3.400 96 78 A 12 VAL H A 11 LYS HBy 1.0 1.800 5.600 97 78 A 11 LYS HBx A 12 VAL H 1.0 1.800 5.600 98 79 A 12 VAL HB A 12 VAL H 1.0 1.800 2.800 99 80 A 12 VAL H A 12 VAL HGx% 1.0 1.800 3.360 100 81 A 13 SER HA A 12 VAL H 1.0 1.800 5.000 101 82 A 12 VAL H A 13 SER H 1.0 1.800 5.000 102 83 A 29 TRP HH2 A 12 VAL H 1.0 1.800 5.000 103 84 A 29 TRP HZ2 A 12 VAL H 1.0 1.800 5.000 104 85 A 8 ILE HD1% A 13 SER H 1.0 1.800 6.000 105 86 A 13 SER H A 8 ILE HG1y 1.0 1.800 5.600 106 86 A 8 ILE HG1x A 13 SER H 1.0 1.800 5.600 107 87 A 8 ILE HG2% A 13 SER H 1.0 1.800 6.000 108 88 A 13 SER H A 12 VAL HA 1.0 1.800 2.800 109 89 A 12 VAL HB A 13 SER H 1.0 1.800 5.000 110 90 A 13 SER H A 12 VAL HGy% 1.0 1.800 3.360 111 91 A 13 SER H A 13 SER HBy 1.0 1.800 3.136 112 91 A 13 SER H A 13 SER HBx 1.0 1.800 3.136 113 92 A 14 GLY H A 13 SER H 1.0 1.800 5.000 114 93 A 29 TRP HZ2 A 13 SER H 1.0 1.800 5.000 115 94 A 8 ILE HA A 14 GLY H 1.0 1.800 3.400 116 95 A 8 ILE HD1% A 14 GLY H 1.0 1.800 6.000 117 96 A 14 GLY H A 8 ILE HG1y 1.0 1.800 5.600 118 96 A 8 ILE HG1x A 14 GLY H 1.0 1.800 5.600 119 97 A 8 ILE HG2% A 14 GLY H 1.0 1.800 6.000 120 98 A 13 SER HA A 14 GLY H 1.0 1.800 2.800 121 99 A 14 GLY H A 13 SER HBy 1.0 1.800 3.808 122 99 A 14 GLY H A 13 SER HBx 1.0 1.800 3.808 123 100 A 29 TRP HD1 A 14 GLY H 1.0 1.800 5.000 124 101 A 14 GLY H A 29 TRP HZ2 1.0 1.800 5.000 125 102 A 15 ILE H A 14 GLY HAy 1.0 1.800 3.808 126 102 A 15 ILE H A 14 GLY HAx 1.0 1.800 3.808 127 103 A 15 ILE H A 15 ILE HB 1.0 1.800 3.400 128 104 A 15 ILE H A 15 ILE HG1x 1.0 1.800 5.600 129 104 A 15 ILE HG13 A 15 ILE H 1.0 1.800 5.600 130 105 A 16 ILE HA A 15 ILE H 1.0 1.800 5.000 131 106 A 16 ILE H A 15 ILE H 1.0 1.800 5.000 132 107 A 15 ILE H A 29 TRP HA 1.0 1.800 5.000 133 108 A 29 TRP HD1 A 15 ILE H 1.0 1.800 5.000 134 109 A 29 TRP HE1 A 15 ILE H 1.0 1.800 5.000 135 110 A 15 ILE H A 30 ARG HBx 1.0 1.800 5.600 136 110 A 15 ILE H A 30 ARG HBy 1.0 1.800 5.600 137 111 A 15 ILE H A 32 THR HA 1.0 1.800 5.000 138 112 A 15 ILE H A 32 THR H 1.0 1.800 5.000 139 113 A 16 ILE H A 7 ALA HB% 1.0 1.800 6.000 140 114 A 15 ILE HA A 16 ILE H 1.0 1.800 2.800 141 115 A 16 ILE HB A 16 ILE H 1.0 1.800 3.400 142 116 A 16 ILE H A 16 ILE HD1% 1.0 1.800 6.000 143 117 A 16 ILE H A 29 TRP HD1 1.0 1.800 5.000 144 118 A 5 GLY H A 17 ALA H 1.0 1.800 5.000 145 119 A 16 ILE HA A 17 ALA H 1.0 1.800 2.800 146 120 A 16 ILE HB A 17 ALA H 1.0 1.800 5.000 147 121 A 16 ILE HD1% A 17 ALA H 1.0 1.800 6.000 148 122 A 17 ALA H A 16 ILE HG1y 1.0 1.800 3.808 149 122 A 17 ALA H A 16 ILE HG1x 1.0 1.800 3.808 150 123 A 16 ILE H A 17 ALA H 1.0 1.800 5.000 151 124 A 17 ALA HB% A 17 ALA H 1.0 1.800 3.360 152 125 A 17 ALA H A 18 ILE H 1.0 1.800 5.000 153 126 A 17 ALA H A 27 LEU HDx% 1.0 1.800 6.000 154 127 A 17 ALA H A 28 THR HB 1.0 1.800 5.000 155 128 A 17 ALA H A 28 THR H 1.0 1.800 3.400 156 129 A 29 TRP HA A 17 ALA H 1.0 1.800 3.400 157 130 A 29 TRP HD1 A 17 ALA H 1.0 1.800 5.000 158 131 A 3 HIS HA A 18 ILE H 1.0 1.800 5.000 159 132 A 18 ILE H A 3 HIS HBx 1.0 1.800 5.600 160 132 A 3 HIS HBy A 18 ILE H 1.0 1.800 5.600 161 133 A 18 ILE H A 3 HIS HD2 1.0 1.800 5.000 162 134 A 4 SER HA A 18 ILE H 1.0 1.800 5.000 163 135 A 18 ILE H A 4 SER HBx 1.0 1.800 5.600 164 135 A 4 SER HBy A 18 ILE H 1.0 1.800 5.600 165 136 A 17 ALA HA A 18 ILE H 1.0 1.800 2.800 166 137 A 17 ALA HB% A 18 ILE H 1.0 1.800 4.080 167 138 A 18 ILE H A 18 ILE HB 1.0 1.800 3.400 168 139 A 18 ILE H A 18 ILE HG1x 1.0 1.800 3.808 169 139 A 18 ILE H A 18 ILE HG1y 1.0 1.800 3.808 170 140 A 100 ILE HD1% A 18 ILE H 1.0 1.800 6.000 171 141 A 19 ASN HD21 A 22 VAL HGy% 1.0 1.800 4.080 172 142 A 19 ASN HD22 A 21 ASP H 1.0 1.800 5.000 173 143 A 22 VAL HGy% A 19 ASN HD22 1.0 1.800 6.000 174 144 A 19 ASN H A 18 ILE HA 1.0 1.800 2.800 175 145 A 18 ILE HB A 19 ASN H 1.0 1.800 5.000 176 146 A 19 ASN H A 18 ILE HG1x 1.0 1.800 5.600 177 146 A 18 ILE HG1y A 19 ASN H 1.0 1.800 5.600 178 147 A 19 ASN H A 18 ILE HG2% 1.0 1.800 4.080 179 148 A 18 ILE H A 19 ASN H 1.0 1.800 5.000 180 149 A 19 ASN H A 19 ASN HBy 1.0 1.800 3.808 181 149 A 19 ASN H A 19 ASN HBx 1.0 1.800 3.808 182 150 A 19 ASN H A 20 GLU H 1.0 1.800 5.000 183 151 A 19 ASN H A 26 GLU H 1.0 1.800 5.000 184 152 A 19 ASN H A 27 LEU HBy 1.0 1.800 5.600 185 152 A 19 ASN H A 27 LEU HBx 1.0 1.800 5.600 186 153 A 3 HIS HD2 A 20 GLU H 1.0 1.800 5.000 187 154 A 20 GLU H A 19 ASN HA 1.0 1.800 2.800 188 155 A 20 GLU H A 19 ASN HBy 1.0 1.800 5.600 189 155 A 19 ASN HBx A 20 GLU H 1.0 1.800 5.600 190 156 A 20 GLU H A 20 GLU HBy 1.0 1.800 3.808 191 156 A 20 GLU H A 20 GLU HBx 1.0 1.800 3.808 192 157 A 20 GLU H A 20 GLU HGx 1.0 1.800 5.600 193 157 A 20 GLU H A 20 GLU HGy 1.0 1.800 5.600 194 158 A 20 GLU H A 21 ASP HA 1.0 1.800 5.000 195 159 A 21 ASP H A 19 ASN HA 1.0 1.800 3.400 196 160 A 21 ASP H A 20 GLU HA 1.0 1.800 3.400 197 161 A 21 ASP H A 20 GLU HBy 1.0 1.800 5.600 198 161 A 21 ASP H A 20 GLU HBx 1.0 1.800 5.600 199 162 A 21 ASP H A 20 GLU HGx 1.0 1.800 5.600 200 162 A 21 ASP H A 20 GLU HGy 1.0 1.800 5.600 201 163 A 21 ASP H A 20 GLU H 1.0 1.800 3.400 202 164 A 21 ASP H A 21 ASP HBx 1.0 1.800 3.136 203 164 A 21 ASP H A 21 ASP HBy 1.0 1.800 3.136 204 165 A 22 VAL HGy% A 21 ASP H 1.0 1.800 4.080 205 166 A 19 ASN HA A 22 VAL H 1.0 1.800 5.000 206 167 A 20 GLU HA A 22 VAL H 1.0 1.800 3.400 207 168 A 22 VAL H A 20 GLU HBy 1.0 1.800 5.600 208 168 A 20 GLU HBx A 22 VAL H 1.0 1.800 5.600 209 169 A 21 ASP HA A 22 VAL H 1.0 1.800 3.400 210 170 A 22 VAL H A 21 ASP HBx 1.0 1.800 3.808 211 170 A 21 ASP HBy A 22 VAL H 1.0 1.800 3.808 212 171 A 22 VAL HGy% A 22 VAL H 1.0 1.800 3.360 213 172 A 22 VAL H A 25 ALA HA 1.0 1.800 5.000 214 173 A 22 VAL H A 25 ALA HB% 1.0 1.800 6.000 215 174 A 26 GLU H A 22 VAL H 1.0 1.800 5.000 216 175 A 23 SER H A 22 VAL HA 1.0 1.800 2.800 217 176 A 23 SER H A 22 VAL HB 1.0 1.800 2.800 218 177 A 22 VAL HGy% A 23 SER H 1.0 1.800 3.360 219 178 A 23 SER H A 23 SER HBy 1.0 1.800 3.808 220 178 A 23 SER H A 23 SER HBx 1.0 1.800 3.808 221 179 A 22 VAL HGy% A 25 ALA H 1.0 1.800 6.000 222 180 A 25 ALA H A 24 PRO HDx 1.0 1.800 5.600 223 180 A 25 ALA H A 24 PRO HD3 1.0 1.800 5.600 224 181 A 25 ALA HB% A 25 ALA H 1.0 1.800 3.360 225 182 A 26 GLU H A 25 ALA H 1.0 1.800 5.000 226 183 A 25 ALA H A 41 VAL HGx% 1.0 1.800 6.000 227 184 A 25 ALA H A 111 TYR HE% 1.0 1.800 5.600 228 185 A 26 GLU H A 19 ASN HBy 1.0 1.800 5.600 229 185 A 19 ASN HBx A 26 GLU H 1.0 1.800 5.600 230 186 A 26 GLU H A 20 GLU HA 1.0 1.800 5.000 231 187 A 26 GLU H A 25 ALA HA 1.0 1.800 2.800 232 188 A 26 GLU H A 25 ALA HB% 1.0 1.800 4.080 233 189 A 26 GLU H A 26 GLU HBx 1.0 1.800 3.808 234 189 A 26 GLU H A 26 GLU HBy 1.0 1.800 3.808 235 190 A 26 GLU H A 26 GLU HGx 1.0 1.800 5.600 236 190 A 26 GLU H A 26 GLU HGy 1.0 1.800 5.600 237 191 A 26 GLU H A 27 LEU H 1.0 1.800 5.000 238 192 A 27 LEU H A 27 LEU HBy 1.0 1.800 3.808 239 192 A 27 LEU HBx A 27 LEU H 1.0 1.800 3.808 240 193 A 27 LEU H A 27 LEU HDy% 1.0 1.800 5.600 241 194 A 28 THR H A 27 LEU H 1.0 1.800 5.000 242 195 A 27 LEU H A 39 THR HA 1.0 1.800 5.000 243 196 A 27 LEU H A 39 THR HG2% 1.0 1.800 6.000 244 197 A 27 LEU H A 40 VAL HGy% 1.0 1.800 6.000 245 198 A 27 LEU H A 41 VAL HA 1.0 1.800 5.000 246 199 A 28 THR H A 18 ILE HA 1.0 1.800 3.400 247 200 A 28 THR H A 18 ILE HG1x 1.0 1.800 5.600 248 200 A 28 THR H A 18 ILE HG1y 1.0 1.800 5.600 249 201 A 28 THR H A 19 ASN H 1.0 1.800 3.400 250 202 A 28 THR H A 27 LEU HA 1.0 1.800 2.800 251 203 A 28 THR HB A 28 THR H 1.0 1.800 3.400 252 204 A 28 THR H A 28 THR HG2% 1.0 1.800 6.000 253 205 A 7 ALA HB% A 29 TRP HE1 1.0 1.800 4.080 254 206 A 29 TRP HE1 A 8 ILE HA 1.0 1.800 3.400 255 207 A 29 TRP HE1 A 12 VAL HGx% 1.0 1.800 6.000 256 208 A 29 TRP HE1 A 13 SER HA 1.0 1.800 5.000 257 209 A 29 TRP HE1 A 13 SER HBy 1.0 1.800 5.600 258 209 A 29 TRP HE1 A 13 SER HBx 1.0 1.800 5.600 259 210 A 29 TRP HE1 A 14 GLY HAy 1.0 1.800 5.600 260 210 A 29 TRP HE1 A 14 GLY HAx 1.0 1.800 5.600 261 211 A 29 TRP HE1 A 16 ILE HG1y 1.0 1.800 5.600 262 211 A 29 TRP HE1 A 16 ILE HG1x 1.0 1.800 5.600 263 212 A 27 LEU HDy% A 29 TRP H 1.0 1.800 5.600 264 213 A 29 TRP H A 28 THR HA 1.0 1.800 2.800 265 214 A 28 THR HB A 29 TRP H 1.0 1.800 5.000 266 215 A 28 THR HG2% A 29 TRP H 1.0 1.800 4.080 267 216 A 29 TRP H A 29 TRP HBx 1.0 1.800 3.808 268 216 A 29 TRP H A 29 TRP HBy 1.0 1.800 3.808 269 217 A 29 TRP HD1 A 29 TRP H 1.0 1.800 5.000 270 218 A 29 TRP H A 29 TRP HE3 1.0 1.800 5.000 271 219 A 29 TRP H A 37 VAL HG2% 1.0 1.800 6.000 272 220 A 29 TRP H A 38 HIS H 1.0 1.800 5.000 273 221 A 39 THR HA A 29 TRP H 1.0 1.800 3.400 274 222 A 30 ARG H A 14 GLY HAy 1.0 1.800 5.600 275 222 A 14 GLY HAx A 30 ARG H 1.0 1.800 5.600 276 223 A 30 ARG H A 15 ILE HG2% 1.0 1.800 6.000 277 224 A 16 ILE HA A 30 ARG H 1.0 1.800 3.400 278 225 A 29 TRP HA A 30 ARG H 1.0 1.800 2.800 279 226 A 30 ARG H A 29 TRP HBx 1.0 1.800 5.600 280 226 A 29 TRP HBy A 30 ARG H 1.0 1.800 5.600 281 227 A 29 TRP HD1 A 30 ARG H 1.0 1.800 5.000 282 228 A 29 TRP H A 30 ARG H 1.0 1.800 5.000 283 229 A 30 ARG H A 30 ARG HA 1.0 1.800 3.400 284 230 A 30 ARG H A 30 ARG HBx 1.0 1.800 3.808 285 230 A 30 ARG HBy A 30 ARG H 1.0 1.800 3.808 286 231 A 30 ARG H A 37 VAL HA 1.0 1.800 5.000 287 232 A 37 VAL HG2% A 30 ARG H 1.0 1.800 6.000 288 233 A 29 TRP HE3 A 31 SER H 1.0 1.800 5.000 289 234 A 29 TRP HH2 A 31 SER H 1.0 1.800 5.000 290 235 A 31 SER H A 29 TRP HZ3 1.0 1.800 5.000 291 236 A 30 ARG HA A 31 SER H 1.0 1.800 2.800 292 237 A 31 SER H A 31 SER HBy 1.0 1.800 3.808 293 237 A 31 SER H A 31 SER HBx 1.0 1.800 3.808 294 238 A 32 THR H A 31 SER H 1.0 1.800 5.000 295 239 A 31 SER H A 36 LYS HBy 1.0 1.800 5.600 296 239 A 31 SER H A 36 LYS HBx 1.0 1.800 5.600 297 240 A 31 SER H A 36 LYS H 1.0 1.800 5.000 298 241 A 37 VAL HA A 31 SER H 1.0 1.800 3.400 299 242 A 31 SER H A 37 VAL HB 1.0 1.800 5.000 300 243 A 37 VAL HG2% A 31 SER H 1.0 1.800 6.000 301 244 A 38 HIS H A 31 SER H 1.0 1.800 5.000 302 245 A 32 THR H A 14 GLY HAy 1.0 1.800 3.136 303 245 A 14 GLY HAx A 32 THR H 1.0 1.800 3.136 304 246 A 32 THR H A 31 SER HBy 1.0 1.800 3.808 305 246 A 32 THR H A 31 SER HBx 1.0 1.800 3.808 306 247 A 32 THR H A 32 THR HG2% 1.0 1.800 4.080 307 248 A 32 THR H A 33 ASP HA 1.0 1.800 5.000 308 249 A 32 THR H A 33 ASP H 1.0 1.800 3.400 309 250 A 12 VAL HGy% A 33 ASP H 1.0 1.800 6.000 310 251 A 33 ASP H A 31 SER HBy 1.0 1.800 5.600 311 251 A 31 SER HBx A 33 ASP H 1.0 1.800 5.600 312 252 A 32 THR HA A 33 ASP H 1.0 1.800 3.400 313 253 A 33 ASP H A 32 THR HB 1.0 1.800 2.800 314 254 A 32 THR HG2% A 33 ASP H 1.0 1.800 6.000 315 255 A 33 ASP HA A 33 ASP H 1.0 1.800 3.400 316 256 A 33 ASP H A 33 ASP HBx 1.0 1.800 3.808 317 256 A 33 ASP H A 33 ASP HBy 1.0 1.800 3.808 318 257 A 33 ASP H A 34 GLY HAy 1.0 1.800 5.600 319 257 A 33 ASP H A 34 GLY HAx 1.0 1.800 5.600 320 258 A 33 ASP H A 34 GLY H 1.0 1.800 3.400 321 259 A 34 GLY H A 31 SER HBy 1.0 1.800 5.600 322 259 A 31 SER HBx A 34 GLY H 1.0 1.800 5.600 323 260 A 32 THR HA A 34 GLY H 1.0 1.800 5.000 324 261 A 32 THR H A 34 GLY H 1.0 1.800 5.000 325 262 A 33 ASP HA A 34 GLY H 1.0 1.800 3.400 326 263 A 34 GLY H A 33 ASP HBx 1.0 1.800 5.600 327 263 A 33 ASP HBy A 34 GLY H 1.0 1.800 5.600 328 264 A 34 GLY H A 34 GLY HAy 1.0 1.800 3.136 329 264 A 34 GLY HAx A 34 GLY H 1.0 1.800 3.136 330 265 A 31 SER H A 35 ASP H 1.0 1.800 5.000 331 266 A 33 ASP HA A 35 ASP H 1.0 1.800 5.000 332 267 A 35 ASP H A 34 GLY HAy 1.0 1.800 3.808 333 267 A 34 GLY HAx A 35 ASP H 1.0 1.800 3.808 334 268 A 34 GLY H A 35 ASP H 1.0 1.800 3.400 335 269 A 35 ASP H A 35 ASP HBx 1.0 1.800 3.136 336 269 A 35 ASP H A 35 ASP HBy 1.0 1.800 3.136 337 270 A 35 ASP H A 36 LYS HBy 1.0 1.800 5.600 338 270 A 36 LYS HBx A 35 ASP H 1.0 1.800 5.600 339 271 A 36 LYS H A 35 ASP H 1.0 1.800 2.800 340 272 A 29 TRP HZ3 A 36 LYS H 1.0 1.800 5.000 341 273 A 36 LYS H A 31 SER HBy 1.0 1.800 3.808 342 273 A 31 SER HBx A 36 LYS H 1.0 1.800 3.808 343 274 A 36 LYS H A 34 GLY HAy 1.0 1.800 5.600 344 274 A 36 LYS H A 34 GLY HAx 1.0 1.800 5.600 345 275 A 36 LYS H A 34 GLY H 1.0 1.800 3.400 346 276 A 36 LYS H A 35 ASP HA 1.0 1.800 3.400 347 277 A 36 LYS H A 35 ASP HBx 1.0 1.800 5.600 348 277 A 36 LYS H A 35 ASP HBy 1.0 1.800 5.600 349 278 A 36 LYS H A 36 LYS HBy 1.0 1.800 3.808 350 278 A 36 LYS HBx A 36 LYS H 1.0 1.800 3.808 351 279 A 36 LYS H A 36 LYS HGy 1.0 1.800 3.808 352 279 A 36 LYS H A 36 LYS HGx 1.0 1.800 3.808 353 280 A 29 TRP HZ3 A 37 VAL H 1.0 1.800 5.000 354 281 A 37 VAL H A 36 LYS HA 1.0 1.800 2.800 355 282 A 37 VAL H A 36 LYS HBy 1.0 1.800 3.808 356 282 A 36 LYS HBx A 37 VAL H 1.0 1.800 3.808 357 283 A 36 LYS H A 37 VAL H 1.0 1.800 5.000 358 284 A 38 HIS H A 37 VAL H 1.0 1.800 5.000 359 285 A 28 THR HG2% A 38 HIS H 1.0 1.800 6.000 360 286 A 38 HIS H A 29 TRP HBx 1.0 1.800 5.600 361 286 A 29 TRP HBy A 38 HIS H 1.0 1.800 5.600 362 287 A 29 TRP HE3 A 38 HIS H 1.0 1.800 3.400 363 288 A 38 HIS H A 29 TRP HZ3 1.0 1.800 5.000 364 289 A 38 HIS H A 30 ARG HA 1.0 1.800 5.000 365 290 A 38 HIS H A 37 VAL HA 1.0 1.800 2.800 366 291 A 38 HIS H A 37 VAL HB 1.0 1.800 5.000 367 292 A 37 VAL HG2% A 38 HIS H 1.0 1.800 4.080 368 293 A 38 HIS H A 39 THR H 1.0 1.800 5.000 369 294 A 39 THR H A 38 HIS HA 1.0 1.800 2.800 370 295 A 39 THR H A 38 HIS HBy 1.0 1.800 5.600 371 295 A 39 THR H A 38 HIS HBx 1.0 1.800 5.600 372 296 A 39 THR H A 39 THR HB 1.0 1.800 3.400 373 297 A 39 THR H A 40 VAL H 1.0 1.800 5.000 374 298 A 40 VAL H A 27 LEU HBy 1.0 1.800 5.600 375 298 A 27 LEU HBx A 40 VAL H 1.0 1.800 5.600 376 299 A 27 LEU HDy% A 40 VAL H 1.0 1.800 5.600 377 300 A 27 LEU H A 40 VAL H 1.0 1.800 5.000 378 301 A 40 VAL H A 40 VAL HB 1.0 1.800 3.400 379 302 A 40 VAL H A 40 VAL HGx% 1.0 1.800 6.000 380 303 A 40 VAL HGy% A 40 VAL H 1.0 1.800 4.080 381 304 A 40 VAL H A 41 VAL H 1.0 1.800 5.000 382 305 A 41 VAL H A 40 VAL HA 1.0 1.800 2.800 383 306 A 40 VAL HB A 41 VAL H 1.0 1.800 5.000 384 307 A 40 VAL HGx% A 41 VAL H 1.0 1.800 4.080 385 308 A 40 VAL HGy% A 41 VAL H 1.0 1.800 4.080 386 309 A 41 VAL H A 41 VAL HB 1.0 1.800 2.800 387 310 A 41 VAL H A 41 VAL HGy% 1.0 1.800 3.360 388 311 A 41 VAL H A 44 THR HG2% 1.0 1.800 6.000 389 312 A 42 LEU H A 26 GLU HA 1.0 1.800 3.400 390 313 A 41 VAL HA A 42 LEU H 1.0 1.800 2.800 391 314 A 41 VAL HB A 42 LEU H 1.0 1.800 5.000 392 315 A 41 VAL HGx% A 42 LEU H 1.0 1.800 4.080 393 316 A 42 LEU H A 42 LEU HBx 1.0 1.800 3.808 394 316 A 42 LEU H A 42 LEU HBy 1.0 1.800 3.808 395 317 A 43 SER H A 24 PRO HBx 1.0 1.800 5.600 396 317 A 43 SER H A 24 PRO HBy 1.0 1.800 5.600 397 318 A 41 VAL HB A 43 SER H 1.0 1.800 5.000 398 319 A 41 VAL HGx% A 43 SER H 1.0 1.800 3.360 399 320 A 43 SER H A 42 LEU HBx 1.0 1.800 5.600 400 320 A 42 LEU HBy A 43 SER H 1.0 1.800 5.600 401 321 A 43 SER H A 42 LEU HDx% 1.0 1.800 6.000 402 322 A 43 SER H A 43 SER HBx 1.0 1.800 3.808 403 322 A 43 SER H A 43 SER HB3 1.0 1.800 3.808 404 323 A 44 THR HG2% A 43 SER H 1.0 1.800 6.000 405 324 A 43 SER H A 45 ILE H 1.0 1.800 5.000 406 325 A 111 TYR HE% A 43 SER H 1.0 1.800 5.600 407 326 A 41 VAL HB A 44 THR H 1.0 1.800 5.000 408 327 A 41 VAL HGx% A 44 THR H 1.0 1.800 4.080 409 328 A 42 LEU H A 44 THR H 1.0 1.800 5.000 410 329 A 44 THR H A 43 SER HA 1.0 1.800 3.400 411 330 A 44 THR H A 43 SER HBx 1.0 1.800 5.600 412 330 A 43 SER HB3 A 44 THR H 1.0 1.800 5.600 413 331 A 43 SER H A 44 THR H 1.0 1.800 3.400 414 332 A 44 THR H A 44 THR HB 1.0 1.800 5.000 415 333 A 44 THR HG2% A 44 THR H 1.0 1.800 3.360 416 334 A 44 THR H A 45 ILE HB 1.0 1.800 5.000 417 335 A 44 THR H A 45 ILE HD1% 1.0 1.800 6.000 418 336 A 44 THR H A 45 ILE HG1y 1.0 1.800 5.600 419 336 A 44 THR H A 45 ILE HG1x 1.0 1.800 5.600 420 337 A 45 ILE H A 44 THR H 1.0 1.800 3.400 421 338 A 40 VAL HGx% A 45 ILE H 1.0 1.800 6.000 422 339 A 42 LEU HDx% A 45 ILE H 1.0 1.800 6.000 423 340 A 45 ILE H A 44 THR HA 1.0 1.800 3.400 424 341 A 45 ILE H A 44 THR HB 1.0 1.800 5.000 425 342 A 44 THR HG2% A 45 ILE H 1.0 1.800 4.080 426 343 A 45 ILE H A 45 ILE HB 1.0 1.800 2.800 427 344 A 45 ILE H A 45 ILE HD1% 1.0 1.800 4.080 428 345 A 45 ILE H A 45 ILE HG1y 1.0 1.800 3.808 429 345 A 45 ILE H A 45 ILE HG1x 1.0 1.800 3.808 430 346 A 45 ILE H A 46 ASP H 1.0 1.800 5.000 431 347 A 46 ASP H A 45 ILE HA 1.0 1.800 3.400 432 348 A 45 ILE HD1% A 46 ASP H 1.0 1.800 6.000 433 349 A 46 ASP H A 45 ILE HG2% 1.0 1.800 4.080 434 350 A 46 ASP H A 46 ASP HBx 1.0 1.800 3.808 435 350 A 46 ASP H A 46 ASP HBy 1.0 1.800 3.808 436 351 A 46 ASP H A 47 LYS H 1.0 1.800 3.400 437 352 A 46 ASP H A 64 GLY HAy 1.0 1.800 5.600 438 352 A 46 ASP H A 64 GLY HAx 1.0 1.800 5.600 439 353 A 45 ILE HA A 47 LYS H 1.0 1.800 5.000 440 354 A 45 ILE HG2% A 47 LYS H 1.0 1.800 4.080 441 355 A 47 LYS H A 46 ASP HBx 1.0 1.800 3.808 442 355 A 46 ASP HBy A 47 LYS H 1.0 1.800 3.808 443 356 A 47 LYS H A 47 LYS HBy 1.0 1.800 3.808 444 356 A 47 LYS H A 47 LYS HBx 1.0 1.800 3.808 445 357 A 47 LYS H A 47 LYS HGy 1.0 1.800 5.600 446 357 A 47 LYS H A 47 LYS HGx 1.0 1.800 5.600 447 358 A 47 LYS H A 62 LEU HA 1.0 1.800 5.000 448 359 A 47 LYS H A 63 ILE HB 1.0 1.800 3.400 449 360 A 47 LYS H A 108 ILE HD1% 1.0 1.800 6.000 450 361 A 48 LEU H A 47 LYS HA 1.0 1.800 2.800 451 362 A 48 LEU H A 47 LYS HBy 1.0 1.800 3.808 452 362 A 47 LYS HBx A 48 LEU H 1.0 1.800 3.808 453 363 A 48 LEU H A 47 LYS HGy 1.0 1.800 5.600 454 363 A 47 LYS HGx A 48 LEU H 1.0 1.800 5.600 455 364 A 48 LEU H A 48 LEU HBx 1.0 1.800 3.808 456 364 A 48 LEU H A 48 LEU HBy 1.0 1.800 3.808 457 365 A 48 LEU H A 48 LEU HG 1.0 1.800 5.000 458 366 A 108 ILE HD1% A 48 LEU H 1.0 1.800 6.000 459 367 A 49 GLN HE21 A 49 GLN HBx 1.0 1.800 5.600 460 367 A 49 GLN HE21 A 49 GLN HB3 1.0 1.800 5.600 461 368 A 49 GLN HE21 A 49 GLN HGx 1.0 1.800 5.600 462 368 A 49 GLN HE21 A 49 GLN HG3 1.0 1.800 5.600 463 369 A 49 GLN HE22 A 49 GLN HBx 1.0 1.800 5.600 464 369 A 49 GLN HB3 A 49 GLN HE22 1.0 1.800 5.600 465 370 A 49 GLN HE21 A 49 GLN HE22 1.0 1.800 3.400 466 371 A 49 GLN HE22 A 49 GLN HGx 1.0 1.800 5.600 467 371 A 49 GLN HG3 A 49 GLN HE22 1.0 1.800 5.600 468 372 A 49 GLN HE22 A 63 ILE HD1% 1.0 1.800 6.000 469 373 A 49 GLN H A 48 LEU HA 1.0 1.800 2.800 470 374 A 49 GLN H A 48 LEU HBx 1.0 1.800 3.808 471 374 A 48 LEU HBy A 49 GLN H 1.0 1.800 3.808 472 375 A 48 LEU HG A 49 GLN H 1.0 1.800 5.000 473 376 A 49 GLN H A 49 GLN HBx 1.0 1.800 3.808 474 376 A 49 GLN HB3 A 49 GLN H 1.0 1.800 3.808 475 377 A 49 GLN H A 49 GLN HGx 1.0 1.800 5.600 476 377 A 49 GLN HG3 A 49 GLN H 1.0 1.800 5.600 477 378 A 49 GLN H A 61 ARG HA 1.0 1.800 5.000 478 379 A 49 GLN H A 61 ARG HBx 1.0 1.800 5.600 479 379 A 49 GLN H A 61 ARG HBy 1.0 1.800 5.600 480 380 A 62 LEU HA A 49 GLN H 1.0 1.800 5.000 481 381 A 49 GLN H A 62 LEU HDx% 1.0 1.800 4.080 482 382 A 50 ALA H A 49 GLN HA 1.0 1.800 2.800 483 383 A 50 ALA H A 49 GLN HBx 1.0 1.800 3.808 484 383 A 49 GLN HB3 A 50 ALA H 1.0 1.800 3.808 485 384 A 50 ALA H A 49 GLN HGx 1.0 1.800 5.600 486 384 A 49 GLN HG3 A 50 ALA H 1.0 1.800 5.600 487 385 A 50 ALA H A 50 ALA HB% 1.0 1.800 4.080 488 386 A 50 ALA H A 51 THR H 1.0 1.800 5.000 489 387 A 51 THR H A 52 PRO HDy 1.0 1.800 5.600 490 387 A 51 THR H A 52 PRO HDx 1.0 1.800 5.600 491 388 A 51 THR H A 59 MET HBy 1.0 1.800 5.600 492 388 A 51 THR H A 59 MET HBx 1.0 1.800 5.600 493 389 A 51 THR H A 60 LEU HA 1.0 1.800 3.400 494 390 A 51 THR H A 60 LEU HDx% 1.0 1.800 6.000 495 391 A 53 ALA H A 52 PRO HA 1.0 1.800 2.800 496 392 A 53 ALA H A 52 PRO HBy 1.0 1.800 5.600 497 392 A 53 ALA H A 52 PRO HBx 1.0 1.800 5.600 498 393 A 53 ALA H A 53 ALA HB% 1.0 1.800 3.360 499 394 A 52 PRO HA A 54 SER H 1.0 1.800 5.000 500 395 A 54 SER H A 52 PRO HBy 1.0 1.800 5.600 501 395 A 52 PRO HBx A 54 SER H 1.0 1.800 5.600 502 396 A 54 SER H A 52 PRO HGx 1.0 1.800 3.808 503 396 A 54 SER H A 52 PRO HG3 1.0 1.800 3.808 504 397 A 53 ALA HB% A 54 SER H 1.0 1.800 4.080 505 398 A 54 SER H A 54 SER HBx 1.0 1.800 3.808 506 398 A 54 SER H A 54 SER HBy 1.0 1.800 3.808 507 399 A 55 SER H A 52 PRO HBy 1.0 1.800 5.600 508 399 A 52 PRO HBx A 55 SER H 1.0 1.800 5.600 509 400 A 55 SER H A 52 PRO HGx 1.0 1.800 3.808 510 400 A 52 PRO HG3 A 55 SER H 1.0 1.800 3.808 511 401 A 53 ALA HB% A 55 SER H 1.0 1.800 6.000 512 402 A 55 SER H A 54 SER HA 1.0 1.800 3.400 513 403 A 55 SER H A 55 SER HBy 1.0 1.800 3.136 514 403 A 55 SER H A 55 SER HBx 1.0 1.800 3.136 515 404 A 55 SER H A 56 GLU H 1.0 1.800 5.000 516 405 A 56 GLU H A 55 SER HA 1.0 1.800 2.800 517 406 A 56 GLU H A 55 SER HBy 1.0 1.800 5.600 518 406 A 55 SER HBx A 56 GLU H 1.0 1.800 5.600 519 407 A 56 GLU H A 56 GLU HBy 1.0 1.800 3.808 520 407 A 56 GLU H A 56 GLU HBx 1.0 1.800 3.808 521 408 A 56 GLU H A 56 GLU HGx 1.0 1.800 5.600 522 408 A 56 GLU H A 56 GLU HGy 1.0 1.800 5.600 523 409 A 55 SER HA A 57 LYS H 1.0 1.800 5.000 524 410 A 57 LYS H A 55 SER HBy 1.0 1.800 5.600 525 410 A 55 SER HBx A 57 LYS H 1.0 1.800 5.600 526 411 A 57 LYS H A 56 GLU HA 1.0 1.800 3.400 527 412 A 57 LYS H A 56 GLU HBy 1.0 1.800 5.600 528 412 A 56 GLU HBx A 57 LYS H 1.0 1.800 5.600 529 413 A 57 LYS H A 56 GLU HGx 1.0 1.800 5.600 530 413 A 56 GLU HGy A 57 LYS H 1.0 1.800 5.600 531 414 A 56 GLU H A 57 LYS H 1.0 1.800 2.800 532 415 A 57 LYS H A 57 LYS HBx 1.0 1.800 3.136 533 415 A 57 LYS H A 57 LYS HBy 1.0 1.800 3.136 534 416 A 57 LYS H A 57 LYS HDx 1.0 1.800 3.136 535 416 A 57 LYS H A 57 LYS HDy 1.0 1.800 3.136 536 417 A 57 LYS H A 57 LYS HGy 1.0 1.800 3.808 537 417 A 57 LYS H A 57 LYS HGx 1.0 1.800 3.808 538 418 A 58 MET H A 57 LYS HA 1.0 1.800 2.800 539 419 A 58 MET H A 57 LYS HBx 1.0 1.800 3.808 540 419 A 57 LYS HBy A 58 MET H 1.0 1.800 3.808 541 420 A 58 MET H A 58 MET HG2 1.0 1.800 3.808 542 420 A 58 MET H A 58 MET HGy 1.0 1.800 3.808 543 421 A 59 MET H A 51 THR HG2% 1.0 1.800 4.080 544 422 A 59 MET H A 59 MET HBy 1.0 1.800 3.808 545 422 A 59 MET HBx A 59 MET H 1.0 1.800 3.808 546 423 A 59 MET H A 90 SER HA 1.0 1.800 5.000 547 424 A 60 LEU H A 59 MET HA 1.0 1.800 2.800 548 425 A 60 LEU H A 59 MET HBy 1.0 1.800 3.808 549 425 A 59 MET HBx A 60 LEU H 1.0 1.800 3.808 550 426 A 60 LEU H A 59 MET HGx 1.0 1.800 5.600 551 426 A 60 LEU H A 59 MET HGy 1.0 1.800 5.600 552 427 A 59 MET H A 60 LEU H 1.0 1.800 5.000 553 428 A 60 LEU H A 60 LEU HBx 1.0 1.800 5.600 554 428 A 60 LEU H A 60 LEU HBy 1.0 1.800 5.600 555 429 A 60 LEU HDx% A 60 LEU H 1.0 1.800 6.000 556 430 A 60 LEU H A 60 LEU HDy% 1.0 1.800 5.600 557 431 A 60 LEU H A 61 ARG H 1.0 1.800 5.000 558 432 A 90 SER HA A 60 LEU H 1.0 1.800 3.400 559 433 A 60 LEU H A 91 PHE HD% 1.0 1.800 5.600 560 434 A 60 LEU H A 91 PHE HE% 1.0 1.800 3.808 561 435 A 60 LEU H A 91 PHE H 1.0 1.800 3.400 562 436 A 49 GLN HA A 61 ARG H 1.0 1.800 5.000 563 437 A 61 ARG H A 50 ALA HA 1.0 1.800 5.000 564 438 A 50 ALA HB% A 61 ARG H 1.0 1.800 6.000 565 439 A 60 LEU HA A 61 ARG H 1.0 1.800 2.800 566 440 A 61 ARG H A 60 LEU HBx 1.0 1.800 5.600 567 440 A 60 LEU HBy A 61 ARG H 1.0 1.800 5.600 568 441 A 61 ARG H A 61 ARG HBx 1.0 1.800 3.808 569 441 A 61 ARG HBy A 61 ARG H 1.0 1.800 3.808 570 442 A 61 ARG H A 61 ARG HGx 1.0 1.800 3.808 571 442 A 61 ARG H A 61 ARG HG3 1.0 1.800 3.808 572 443 A 61 ARG HA A 62 LEU H 1.0 1.800 3.400 573 444 A 62 LEU H A 61 ARG HGx 1.0 1.800 5.600 574 444 A 61 ARG HG3 A 62 LEU H 1.0 1.800 5.600 575 445 A 62 LEU H A 62 LEU HBx 1.0 1.800 5.600 576 445 A 62 LEU H A 62 LEU HBy 1.0 1.800 5.600 577 446 A 62 LEU H A 87 HIS HD2 1.0 1.800 5.000 578 447 A 62 LEU H A 88 MET HA 1.0 1.800 5.000 579 448 A 45 ILE HG2% A 63 ILE H 1.0 1.800 4.080 580 449 A 48 LEU HA A 63 ILE H 1.0 1.800 3.400 581 450 A 62 LEU HA A 63 ILE H 1.0 1.800 2.800 582 451 A 63 ILE HD1% A 63 ILE H 1.0 1.800 4.080 583 452 A 63 ILE H A 63 ILE HG1x 1.0 1.800 3.808 584 452 A 63 ILE H A 63 ILE HG13 1.0 1.800 3.808 585 453 A 45 ILE HA A 64 GLY H 1.0 1.800 5.000 586 454 A 64 GLY H A 63 ILE HA 1.0 1.800 2.800 587 455 A 63 ILE HB A 64 GLY H 1.0 1.800 5.000 588 456 A 63 ILE HD1% A 64 GLY H 1.0 1.800 4.080 589 457 A 64 GLY H A 63 ILE HG2% 1.0 1.800 4.080 590 458 A 64 GLY H A 65 LYS H 1.0 1.800 5.000 591 459 A 64 GLY H A 84 PRO HBy 1.0 1.800 5.600 592 459 A 64 GLY H A 84 PRO HBx 1.0 1.800 5.600 593 460 A 64 GLY H A 86 ARG HA 1.0 1.800 5.000 594 461 A 64 GLY H A 86 ARG HGx 1.0 1.800 5.600 595 461 A 64 GLY H A 86 ARG HGy 1.0 1.800 5.600 596 462 A 44 THR HA A 65 LYS H 1.0 1.800 5.000 597 463 A 44 THR HB A 65 LYS H 1.0 1.800 2.800 598 464 A 65 LYS H A 64 GLY HAy 1.0 1.800 3.808 599 464 A 64 GLY HAx A 65 LYS H 1.0 1.800 3.808 600 465 A 65 LYS H A 65 LYS HBx 1.0 1.800 3.808 601 465 A 65 LYS H A 65 LYS HBy 1.0 1.800 3.808 602 466 A 65 LYS H A 65 LYS HDx 1.0 1.800 3.808 603 466 A 65 LYS H A 65 LYS HD3 1.0 1.800 3.808 604 467 A 66 VAL H A 46 ASP HBx 1.0 1.800 5.600 605 467 A 46 ASP HBy A 66 VAL H 1.0 1.800 5.600 606 468 A 66 VAL H A 65 LYS HA 1.0 1.800 2.800 607 469 A 66 VAL H A 65 LYS HBx 1.0 1.800 3.808 608 469 A 65 LYS HBy A 66 VAL H 1.0 1.800 3.808 609 470 A 66 VAL H A 65 LYS HDx 1.0 1.800 3.808 610 470 A 65 LYS HD3 A 66 VAL H 1.0 1.800 3.808 611 471 A 66 VAL H A 65 LYS HGx 1.0 1.800 3.808 612 471 A 66 VAL H A 65 LYS HGy 1.0 1.800 3.808 613 472 A 65 LYS H A 66 VAL H 1.0 1.800 5.000 614 473 A 66 VAL H A 66 VAL HB 1.0 1.800 2.800 615 474 A 66 VAL HB A 67 ASP H 1.0 1.800 3.400 616 475 A 66 VAL H A 67 ASP H 1.0 1.800 3.400 617 476 A 67 ASP H A 67 ASP HBx 1.0 1.800 3.808 618 476 A 67 ASP H A 67 ASP HBy 1.0 1.800 3.808 619 477 A 67 ASP H A 68 GLU H 1.0 1.800 5.000 620 478 A 68 GLU H A 67 ASP HA 1.0 1.800 2.800 621 479 A 68 GLU H A 67 ASP HBx 1.0 1.800 5.600 622 479 A 67 ASP HBy A 68 GLU H 1.0 1.800 5.600 623 480 A 68 GLU H A 68 GLU HBy 1.0 1.800 3.808 624 480 A 68 GLU H A 68 GLU HBx 1.0 1.800 3.808 625 481 A 68 GLU H A 68 GLU HGx 1.0 1.800 3.808 626 481 A 68 GLU H A 68 GLU HGy 1.0 1.800 3.808 627 482 A 68 GLU H A 70 LYS H 1.0 1.800 5.000 628 483 A 69 SER H A 67 ASP HBx 1.0 1.800 5.600 629 483 A 67 ASP HBy A 69 SER H 1.0 1.800 5.600 630 484 A 69 SER H A 68 GLU HA 1.0 1.800 3.400 631 485 A 69 SER H A 68 GLU HBy 1.0 1.800 5.600 632 485 A 68 GLU HBx A 69 SER H 1.0 1.800 5.600 633 486 A 68 GLU H A 69 SER H 1.0 1.800 2.800 634 487 A 69 SER H A 69 SER HBy 1.0 1.800 3.136 635 487 A 69 SER H A 69 SER HBx 1.0 1.800 3.136 636 488 A 70 LYS H A 67 ASP HBx 1.0 1.800 5.600 637 488 A 67 ASP HBy A 70 LYS H 1.0 1.800 5.600 638 489 A 70 LYS H A 68 GLU HA 1.0 1.800 5.000 639 490 A 70 LYS H A 69 SER HA 1.0 1.800 3.400 640 491 A 70 LYS H A 69 SER HBy 1.0 1.800 5.600 641 491 A 70 LYS H A 69 SER HBx 1.0 1.800 5.600 642 492 A 70 LYS H A 70 LYS HBx 1.0 1.800 3.808 643 492 A 70 LYS H A 70 LYS HBy 1.0 1.800 3.808 644 493 A 70 LYS H A 70 LYS HDx 1.0 1.800 5.600 645 493 A 70 LYS H A 70 LYS HD3 1.0 1.800 5.600 646 494 A 70 LYS H A 70 LYS HGy 1.0 1.800 3.808 647 494 A 70 LYS H A 70 LYS HGx 1.0 1.800 3.808 648 495 A 68 GLU HA A 71 LYS H 1.0 1.800 5.000 649 496 A 71 LYS H A 71 LYS HGx 1.0 1.800 3.808 650 496 A 71 LYS H A 71 LYS HG3 1.0 1.800 3.808 651 497 A 71 LYS H A 72 ARG H 1.0 1.800 5.000 652 498 A 72 ARG H A 71 LYS HA 1.0 1.800 2.800 653 499 A 72 ARG H A 71 LYS HGx 1.0 1.800 5.600 654 499 A 71 LYS HG3 A 72 ARG H 1.0 1.800 5.600 655 500 A 72 ARG H A 72 ARG HBy 1.0 1.800 3.808 656 500 A 72 ARG H A 72 ARG HBx 1.0 1.800 3.808 657 501 A 72 ARG H A 72 ARG HGx 1.0 1.800 3.808 658 501 A 72 ARG H A 72 ARG HG3 1.0 1.800 3.808 659 502 A 72 ARG H A 80 VAL HG2% 1.0 1.800 6.000 660 503 A 72 ARG H A 81 VAL HG2% 1.0 1.800 6.000 661 504 A 73 LYS H A 72 ARG HA 1.0 1.800 2.800 662 505 A 73 LYS H A 72 ARG HBy 1.0 1.800 3.808 663 505 A 72 ARG HBx A 73 LYS H 1.0 1.800 3.808 664 506 A 73 LYS H A 73 LYS HGx 1.0 1.800 5.600 665 506 A 73 LYS H A 73 LYS HGy 1.0 1.800 5.600 666 507 A 74 ASP H A 73 LYS HA 1.0 1.800 2.800 667 508 A 74 ASP H A 73 LYS HBx 1.0 1.800 3.136 668 508 A 74 ASP H A 73 LYS HB3 1.0 1.800 3.136 669 509 A 74 ASP H A 73 LYS HDx 1.0 1.800 5.600 670 509 A 74 ASP H A 73 LYS HD3 1.0 1.800 5.600 671 510 A 74 ASP H A 73 LYS HGx 1.0 1.800 5.600 672 510 A 73 LYS HGy A 74 ASP H 1.0 1.800 5.600 673 511 A 74 ASP H A 74 ASP HBx 1.0 1.800 3.808 674 511 A 74 ASP H A 74 ASP HBy 1.0 1.800 3.808 675 512 A 74 ASP H A 75 ASN H 1.0 1.800 3.400 676 513 A 74 ASP H A 79 GLU HA 1.0 1.800 5.000 677 514 A 75 ASN H A 74 ASP HBx 1.0 1.800 5.600 678 514 A 74 ASP HBy A 75 ASN H 1.0 1.800 5.600 679 515 A 75 ASN H A 75 ASN HB2 1.0 1.800 3.808 680 515 A 75 ASN H A 75 ASN HBy 1.0 1.800 3.808 681 516 A 76 GLU H A 74 ASP HBx 1.0 1.800 5.600 682 516 A 74 ASP HBy A 76 GLU H 1.0 1.800 5.600 683 517 A 76 GLU H A 75 ASN HA 1.0 1.800 3.400 684 518 A 76 GLU H A 75 ASN HB2 1.0 1.800 3.808 685 518 A 75 ASN HBy A 76 GLU H 1.0 1.800 3.808 686 519 A 76 GLU H A 76 GLU HBx 1.0 1.800 3.136 687 519 A 76 GLU H A 76 GLU HB3 1.0 1.800 3.136 688 520 A 76 GLU H A 78 ASN H 1.0 1.800 3.400 689 521 A 77 GLY H A 73 LYS HBx 1.0 1.800 5.600 690 521 A 73 LYS HB3 A 77 GLY H 1.0 1.800 5.600 691 522 A 75 ASN HA A 77 GLY H 1.0 1.800 5.000 692 523 A 77 GLY H A 76 GLU HA 1.0 1.800 3.400 693 524 A 77 GLY H A 76 GLU HBx 1.0 1.800 5.600 694 524 A 76 GLU HB3 A 77 GLY H 1.0 1.800 5.600 695 525 A 77 GLY H A 76 GLU HG2 1.0 1.800 3.808 696 525 A 77 GLY H A 76 GLU HGy 1.0 1.800 3.808 697 526 A 77 GLY H A 77 GLY HAx 1.0 1.800 3.136 698 526 A 77 GLY H A 77 GLY HAy 1.0 1.800 3.136 699 527 A 78 ASN HD21 A 76 GLU HBx 1.0 1.800 5.600 700 527 A 76 GLU HB3 A 78 ASN HD21 1.0 1.800 5.600 701 528 A 78 ASN HD21 A 78 ASN HBy 1.0 1.800 5.600 702 528 A 78 ASN HD21 A 78 ASN HBx 1.0 1.800 5.600 703 529 A 78 ASN HD21 A 78 ASN HD22 1.0 1.800 2.800 704 530 A 78 ASN HD22 A 78 ASN HBy 1.0 1.800 3.808 705 530 A 78 ASN HBx A 78 ASN HD22 1.0 1.800 3.808 706 531 A 78 ASN H A 73 LYS HBx 1.0 1.800 5.600 707 531 A 73 LYS HB3 A 78 ASN H 1.0 1.800 5.600 708 532 A 78 ASN H A 76 GLU HBx 1.0 1.800 5.600 709 532 A 76 GLU HB3 A 78 ASN H 1.0 1.800 5.600 710 533 A 78 ASN H A 77 GLY HAx 1.0 1.800 3.808 711 533 A 78 ASN H A 77 GLY HAy 1.0 1.800 3.808 712 534 A 78 ASN H A 78 ASN HBy 1.0 1.800 3.808 713 534 A 78 ASN H A 78 ASN HBx 1.0 1.800 3.808 714 535 A 79 GLU H A 78 ASN HA 1.0 1.800 2.800 715 536 A 79 GLU H A 78 ASN HBy 1.0 1.800 5.600 716 536 A 78 ASN HBx A 79 GLU H 1.0 1.800 5.600 717 537 A 79 GLU H A 79 GLU HBx 1.0 1.800 3.136 718 537 A 79 GLU H A 79 GLU HB3 1.0 1.800 3.136 719 538 A 79 GLU H A 79 GLU HGx 1.0 1.800 5.600 720 538 A 79 GLU H A 79 GLU HGy 1.0 1.800 5.600 721 539 A 73 LYS HA A 80 VAL H 1.0 1.800 3.400 722 540 A 80 VAL H A 73 LYS HDx 1.0 1.800 5.600 723 540 A 73 LYS HD3 A 80 VAL H 1.0 1.800 5.600 724 541 A 79 GLU HA A 80 VAL H 1.0 1.800 2.800 725 542 A 80 VAL H A 79 GLU HGx 1.0 1.800 5.600 726 542 A 79 GLU HGy A 80 VAL H 1.0 1.800 5.600 727 543 A 80 VAL HG2% A 80 VAL H 1.0 1.800 3.360 728 544 A 81 VAL H A 80 VAL HB 1.0 1.800 3.400 729 545 A 80 VAL HG2% A 81 VAL H 1.0 1.800 3.360 730 546 A 81 VAL H A 81 VAL HB 1.0 1.800 2.800 731 547 A 81 VAL HG2% A 81 VAL H 1.0 1.800 3.360 732 548 A 81 VAL H A 82 PRO HDx 1.0 1.800 5.600 733 548 A 81 VAL H A 82 PRO HDy 1.0 1.800 5.600 734 549 A 80 VAL HG2% A 83 LYS H 1.0 1.800 6.000 735 550 A 83 LYS H A 82 PRO HB2 1.0 1.800 3.808 736 550 A 83 LYS H A 82 PRO HBy 1.0 1.800 3.808 737 551 A 83 LYS H A 82 PRO HDx 1.0 1.800 5.600 738 551 A 82 PRO HDy A 83 LYS H 1.0 1.800 5.600 739 552 A 83 LYS H A 82 PRO HGx 1.0 1.800 5.600 740 552 A 83 LYS H A 82 PRO HGy 1.0 1.800 5.600 741 553 A 83 LYS H A 83 LYS HBx 1.0 1.800 3.136 742 553 A 83 LYS H A 83 LYS HB3 1.0 1.800 3.136 743 554 A 83 LYS H A 83 LYS HDx 1.0 1.800 3.136 744 554 A 83 LYS H A 83 LYS HD3 1.0 1.800 3.136 745 555 A 83 LYS H A 83 LYS HGx 1.0 1.800 3.808 746 555 A 83 LYS H A 83 LYS HG3 1.0 1.800 3.808 747 556 A 85 GLN HE21 A 85 GLN HE22 1.0 1.800 2.800 748 557 A 85 GLN HE21 A 85 GLN HGx 1.0 1.800 5.600 749 557 A 85 GLN HE21 A 85 GLN HGy 1.0 1.800 5.600 750 558 A 85 GLN HE22 A 85 GLN HGx 1.0 1.800 5.600 751 558 A 85 GLN HE22 A 85 GLN HGy 1.0 1.800 5.600 752 559 A 63 ILE HG2% A 85 GLN H 1.0 1.800 6.000 753 560 A 85 GLN H A 84 PRO HA 1.0 1.800 2.800 754 561 A 85 GLN H A 85 GLN HGx 1.0 1.800 3.808 755 561 A 85 GLN HGy A 85 GLN H 1.0 1.800 3.808 756 562 A 86 ARG H A 85 GLN HA 1.0 1.800 2.800 757 563 A 86 ARG H A 85 GLN HBy 1.0 1.800 3.808 758 563 A 86 ARG H A 85 GLN HBx 1.0 1.800 3.808 759 564 A 86 ARG H A 85 GLN HGx 1.0 1.800 5.600 760 564 A 85 GLN HGy A 86 ARG H 1.0 1.800 5.600 761 565 A 85 GLN H A 86 ARG H 1.0 1.800 5.000 762 566 A 86 ARG H A 87 HIS H 1.0 1.800 5.000 763 567 A 61 ARG HA A 87 HIS H 1.0 1.800 5.000 764 568 A 87 HIS H A 62 LEU HBx 1.0 1.800 3.808 765 568 A 62 LEU HBy A 87 HIS H 1.0 1.800 3.808 766 569 A 63 ILE HA A 87 HIS H 1.0 1.800 5.000 767 570 A 86 ARG HA A 87 HIS H 1.0 1.800 2.800 768 571 A 87 HIS H A 87 HIS HBy 1.0 1.800 5.600 769 571 A 87 HIS H A 87 HIS HBx 1.0 1.800 5.600 770 572 A 87 HIS HD2 A 87 HIS H 1.0 1.800 3.400 771 573 A 9 PHE HD% A 88 MET H 1.0 1.800 5.600 772 574 A 9 PHE HE% A 88 MET H 1.0 1.800 3.808 773 575 A 88 MET H A 87 HIS HA 1.0 1.800 2.800 774 576 A 88 MET H A 87 HIS HBy 1.0 1.800 5.600 775 576 A 87 HIS HBx A 88 MET H 1.0 1.800 5.600 776 577 A 88 MET H A 88 MET HBy 1.0 1.800 3.808 777 577 A 88 MET H A 88 MET HBx 1.0 1.800 3.808 778 578 A 88 MET H A 89 PHE H 1.0 1.800 5.000 779 579 A 61 ARG HA A 89 PHE H 1.0 1.800 3.400 780 580 A 62 LEU H A 89 PHE H 1.0 1.800 5.000 781 581 A 88 MET HA A 89 PHE H 1.0 1.800 2.800 782 582 A 89 PHE H A 88 MET HBy 1.0 1.800 5.600 783 582 A 88 MET HBx A 89 PHE H 1.0 1.800 5.600 784 583 A 89 PHE H A 88 MET HGy 1.0 1.800 3.808 785 583 A 89 PHE H A 88 MET HGx 1.0 1.800 3.808 786 584 A 89 PHE H A 89 PHE HBx 1.0 1.800 3.808 787 584 A 89 PHE H A 89 PHE HBy 1.0 1.800 3.808 788 585 A 89 PHE HD% A 89 PHE H 1.0 1.800 3.808 789 586 A 89 PHE H A 89 PHE HE% 1.0 1.800 5.600 790 587 A 91 PHE HE% A 89 PHE H 1.0 1.800 5.600 791 588 A 7 ALA HA A 90 SER H 1.0 1.800 5.000 792 589 A 7 ALA HB% A 90 SER H 1.0 1.800 6.000 793 590 A 8 ILE HB A 90 SER H 1.0 1.800 3.400 794 591 A 8 ILE HD1% A 90 SER H 1.0 1.800 6.000 795 592 A 8 ILE HG2% A 90 SER H 1.0 1.800 6.000 796 593 A 8 ILE H A 90 SER H 1.0 1.800 3.400 797 594 A 9 PHE HA A 90 SER H 1.0 1.800 5.000 798 595 A 90 SER H A 89 PHE HA 1.0 1.800 2.800 799 596 A 90 SER H A 89 PHE HBx 1.0 1.800 3.808 800 596 A 89 PHE HBy A 90 SER H 1.0 1.800 3.808 801 597 A 89 PHE HD% A 90 SER H 1.0 1.800 5.600 802 598 A 89 PHE H A 90 SER H 1.0 1.800 5.000 803 599 A 90 SER H A 90 SER HBx 1.0 1.800 3.808 804 599 A 90 SER HBy A 90 SER H 1.0 1.800 3.808 805 600 A 91 PHE H A 90 SER H 1.0 1.800 5.000 806 601 A 59 MET HA A 91 PHE H 1.0 1.800 5.000 807 602 A 90 SER HA A 91 PHE H 1.0 1.800 2.800 808 603 A 91 PHE H A 90 SER HBx 1.0 1.800 5.600 809 603 A 90 SER HBy A 91 PHE H 1.0 1.800 5.600 810 604 A 91 PHE H A 91 PHE HBy 1.0 1.800 5.600 811 604 A 91 PHE H A 91 PHE HBx 1.0 1.800 5.600 812 605 A 91 PHE HD% A 91 PHE H 1.0 1.800 3.808 813 606 A 91 PHE HE% A 91 PHE H 1.0 1.800 5.600 814 607 A 8 ILE HD1% A 92 ASN HD21 1.0 1.800 6.000 815 608 A 92 ASN HD21 A 92 ASN HB2 1.0 1.800 3.808 816 608 A 92 ASN HD21 A 92 ASN HBy 1.0 1.800 3.808 817 609 A 8 ILE HD1% A 92 ASN HD22 1.0 1.800 6.000 818 610 A 92 ASN HD22 A 92 ASN HB2 1.0 1.800 5.600 819 610 A 92 ASN HBy A 92 ASN HD22 1.0 1.800 5.600 820 611 A 91 PHE HA A 92 ASN H 1.0 1.800 3.400 821 612 A 92 ASN H A 91 PHE HBy 1.0 1.800 5.600 822 612 A 91 PHE HBx A 92 ASN H 1.0 1.800 5.600 823 613 A 91 PHE HD% A 92 ASN H 1.0 1.800 5.600 824 614 A 92 ASN H A 92 ASN HB2 1.0 1.800 3.808 825 614 A 92 ASN HBy A 92 ASN H 1.0 1.800 3.808 826 615 A 93 ASN HD21 A 93 ASN HBx 1.0 1.800 5.600 827 615 A 93 ASN HD21 A 93 ASN HBy 1.0 1.800 5.600 828 616 A 93 ASN HD22 A 93 ASN HBx 1.0 1.800 5.600 829 616 A 93 ASN HBy A 93 ASN HD22 1.0 1.800 5.600 830 617 A 93 ASN HD21 A 93 ASN HD22 1.0 1.800 2.800 831 618 A 93 ASN HD22 A 96 VAL HGx% 1.0 1.800 6.000 832 619 A 93 ASN H A 58 MET HE% 1.0 1.800 6.000 833 620 A 93 ASN H A 91 PHE HBy 1.0 1.800 3.808 834 620 A 91 PHE HBx A 93 ASN H 1.0 1.800 3.808 835 621 A 91 PHE HD% A 93 ASN H 1.0 1.800 5.600 836 622 A 93 ASN H A 92 ASN HA 1.0 1.800 3.400 837 623 A 93 ASN H A 94 ARG H 1.0 1.800 5.000 838 624 A 93 ASN H A 96 VAL HB 1.0 1.800 5.000 839 625 A 96 VAL HGy% A 93 ASN H 1.0 1.800 6.000 840 626 A 94 ARG HE A 94 ARG HBy 1.0 1.800 5.600 841 626 A 94 ARG HE A 94 ARG HBx 1.0 1.800 5.600 842 627 A 94 ARG HE A 94 ARG HGx 1.0 1.800 5.600 843 627 A 94 ARG HE A 94 ARG HG3 1.0 1.800 5.600 844 628 A 58 MET HE% A 94 ARG H 1.0 1.800 6.000 845 629 A 94 ARG H A 93 ASN HA 1.0 1.800 2.800 846 630 A 94 ARG H A 93 ASN HBx 1.0 1.800 5.600 847 630 A 93 ASN HBy A 94 ARG H 1.0 1.800 5.600 848 631 A 94 ARG H A 94 ARG HBy 1.0 1.800 3.808 849 631 A 94 ARG H A 94 ARG HBx 1.0 1.800 3.808 850 632 A 94 ARG H A 94 ARG HGx 1.0 1.800 3.808 851 632 A 94 ARG H A 94 ARG HG3 1.0 1.800 3.808 852 633 A 93 ASN HA A 95 THR H 1.0 1.800 5.000 853 634 A 95 THR H A 93 ASN HBx 1.0 1.800 5.600 854 634 A 93 ASN HBy A 95 THR H 1.0 1.800 5.600 855 635 A 95 THR H A 94 ARG HA 1.0 1.800 5.000 856 636 A 95 THR H A 94 ARG HBy 1.0 1.800 3.808 857 636 A 94 ARG HBx A 95 THR H 1.0 1.800 3.808 858 637 A 95 THR H A 94 ARG HGx 1.0 1.800 3.808 859 637 A 94 ARG HG3 A 95 THR H 1.0 1.800 3.808 860 638 A 94 ARG H A 95 THR H 1.0 1.800 5.000 861 639 A 95 THR H A 95 THR HB 1.0 1.800 2.800 862 640 A 95 THR H A 95 THR HG2% 1.0 1.800 4.080 863 641 A 95 THR H A 96 VAL H 1.0 1.800 3.400 864 642 A 95 THR H A 98 ASP H 1.0 1.800 5.000 865 643 A 96 VAL H A 93 ASN HBx 1.0 1.800 5.600 866 643 A 93 ASN HBy A 96 VAL H 1.0 1.800 5.600 867 644 A 94 ARG H A 96 VAL H 1.0 1.800 5.000 868 645 A 96 VAL H A 95 THR HA 1.0 1.800 5.000 869 646 A 95 THR HB A 96 VAL H 1.0 1.800 3.400 870 647 A 97 MET H A 91 PHE HBy 1.0 1.800 5.600 871 647 A 91 PHE HBx A 97 MET H 1.0 1.800 5.600 872 648 A 91 PHE HD% A 97 MET H 1.0 1.800 3.808 873 649 A 94 ARG HA A 97 MET H 1.0 1.800 5.000 874 650 A 97 MET H A 96 VAL HA 1.0 1.800 5.000 875 651 A 96 VAL H A 97 MET H 1.0 1.800 3.400 876 652 A 97 MET H A 97 MET HBx 1.0 1.800 3.808 877 652 A 97 MET H A 97 MET HBy 1.0 1.800 3.808 878 653 A 97 MET H A 97 MET HG2 1.0 1.800 5.600 879 653 A 97 MET H A 97 MET HGy 1.0 1.800 5.600 880 654 A 98 ASP H A 95 THR HA 1.0 1.800 3.400 881 655 A 95 THR HG2% A 98 ASP H 1.0 1.800 6.000 882 656 A 98 ASP H A 97 MET HA 1.0 1.800 3.400 883 657 A 98 ASP H A 97 MET HBx 1.0 1.800 3.808 884 657 A 98 ASP H A 97 MET HBy 1.0 1.800 3.808 885 658 A 98 ASP H A 97 MET HE% 1.0 1.800 6.000 886 659 A 98 ASP H A 97 MET HG2 1.0 1.800 3.808 887 659 A 98 ASP H A 97 MET HGy 1.0 1.800 3.808 888 660 A 98 ASP H A 98 ASP HBx 1.0 1.800 3.808 889 660 A 98 ASP H A 98 ASP HBy 1.0 1.800 3.808 890 661 A 98 ASP H A 99 ASN H 1.0 1.800 3.400 891 662 A 98 ASP H A 100 ILE H 1.0 1.800 5.000 892 663 A 95 THR HG2% A 99 ASN HD21 1.0 1.800 6.000 893 664 A 99 ASN HD21 A 99 ASN HBx 1.0 1.800 5.600 894 664 A 99 ASN HD21 A 99 ASN HBy 1.0 1.800 5.600 895 665 A 99 ASN H A 99 ASN HD21 1.0 1.800 5.000 896 666 A 95 THR HG2% A 99 ASN HD22 1.0 1.800 6.000 897 667 A 96 VAL HA A 99 ASN HD22 1.0 1.800 5.000 898 668 A 99 ASN HD22 A 99 ASN HBx 1.0 1.800 5.600 899 668 A 99 ASN HBy A 99 ASN HD22 1.0 1.800 5.600 900 669 A 99 ASN HD21 A 99 ASN HD22 1.0 1.800 2.800 901 670 A 99 ASN H A 99 ASN HD22 1.0 1.800 5.000 902 671 A 95 THR HA A 99 ASN H 1.0 1.800 5.000 903 672 A 96 VAL HA A 99 ASN H 1.0 1.800 3.400 904 673 A 97 MET HA A 99 ASN H 1.0 1.800 5.000 905 674 A 99 ASN H A 98 ASP HA 1.0 1.800 5.000 906 675 A 99 ASN H A 98 ASP HBx 1.0 1.800 3.808 907 675 A 98 ASP HBy A 99 ASN H 1.0 1.800 3.808 908 676 A 99 ASN H A 99 ASN HBx 1.0 1.800 3.136 909 676 A 99 ASN H A 99 ASN HBy 1.0 1.800 3.136 910 677 A 99 ASN H A 100 ILE HB 1.0 1.800 5.000 911 678 A 99 ASN H A 101 LYS H 1.0 1.800 5.000 912 679 A 97 MET HA A 100 ILE H 1.0 1.800 5.000 913 680 A 100 ILE H A 99 ASN HA 1.0 1.800 5.000 914 681 A 100 ILE H A 99 ASN HBx 1.0 1.800 5.600 915 681 A 100 ILE H A 99 ASN HBy 1.0 1.800 5.600 916 682 A 100 ILE H A 99 ASN HD21 1.0 1.800 5.000 917 683 A 100 ILE H A 100 ILE HB 1.0 1.800 2.800 918 684 A 100 ILE HD1% A 100 ILE H 1.0 1.800 6.000 919 685 A 60 LEU HDx% A 101 LYS H 1.0 1.800 6.000 920 686 A 60 LEU HDy% A 101 LYS H 1.0 1.800 3.808 921 687 A 98 ASP HA A 101 LYS H 1.0 1.800 5.000 922 688 A 100 ILE HB A 101 LYS H 1.0 1.800 2.800 923 689 A 100 ILE HD1% A 101 LYS H 1.0 1.800 6.000 924 690 A 101 LYS H A 100 ILE HG2% 1.0 1.800 4.080 925 691 A 100 ILE H A 101 LYS H 1.0 1.800 3.400 926 692 A 101 LYS H A 101 LYS HBy 1.0 1.800 3.808 927 692 A 101 LYS H A 101 LYS HBx 1.0 1.800 3.808 928 693 A 101 LYS H A 101 LYS HDx 1.0 1.800 5.600 929 693 A 101 LYS H A 101 LYS HD3 1.0 1.800 5.600 930 694 A 99 ASN HA A 102 MET H 1.0 1.800 5.000 931 695 A 100 ILE HG2% A 102 MET H 1.0 1.800 6.000 932 696 A 102 MET H A 101 LYS HA 1.0 1.800 5.000 933 697 A 102 MET H A 101 LYS HDx 1.0 1.800 5.600 934 697 A 101 LYS HD3 A 102 MET H 1.0 1.800 5.600 935 698 A 102 MET H A 101 LYS HEx 1.0 1.800 5.600 936 698 A 102 MET H A 101 LYS HE3 1.0 1.800 5.600 937 699 A 102 MET H A 101 LYS HGx 1.0 1.800 5.600 938 699 A 102 MET H A 101 LYS HG3 1.0 1.800 5.600 939 700 A 101 LYS H A 102 MET H 1.0 1.800 3.400 940 701 A 102 MET H A 102 MET HBx 1.0 1.800 3.136 941 701 A 102 MET H A 102 MET HBy 1.0 1.800 3.136 942 702 A 102 MET H A 102 MET HGx 1.0 1.800 3.808 943 702 A 102 MET H A 102 MET HGy 1.0 1.800 3.808 944 703 A 102 MET H A 104 LEU H 1.0 1.800 5.000 945 704 A 99 ASN HA A 103 THR H 1.0 1.800 5.000 946 705 A 103 THR H A 100 ILE HA 1.0 1.800 5.000 947 706 A 103 THR H A 102 MET HA 1.0 1.800 3.400 948 707 A 103 THR H A 102 MET HBx 1.0 1.800 3.808 949 707 A 102 MET HBy A 103 THR H 1.0 1.800 3.808 950 708 A 103 THR H A 102 MET HGx 1.0 1.800 5.600 951 708 A 102 MET HGy A 103 THR H 1.0 1.800 5.600 952 709 A 103 THR H A 103 THR HB 1.0 1.800 2.800 953 710 A 103 THR H A 105 GLN H 1.0 1.800 5.000 954 711 A 104 LEU H A 48 LEU HDy% 1.0 1.800 5.600 955 712 A 101 LYS HA A 104 LEU H 1.0 1.800 5.000 956 713 A 104 LEU H A 103 THR HB 1.0 1.800 3.400 957 714 A 104 LEU H A 104 LEU HA 1.0 1.800 2.800 958 715 A 104 LEU H A 104 LEU HBy 1.0 1.800 3.808 959 715 A 104 LEU H A 104 LEU HBx 1.0 1.800 3.808 960 716 A 104 LEU H A 105 GLN H 1.0 1.800 2.800 961 717 A 105 GLN HE21 A 48 LEU HDy% 1.0 1.800 5.600 962 718 A 105 GLN HE21 A 105 GLN HE22 1.0 1.800 2.800 963 719 A 105 GLN HE21 A 105 GLN HGx 1.0 1.800 3.808 964 719 A 105 GLN HE21 A 105 GLN HG3 1.0 1.800 3.808 965 720 A 105 GLN HE22 A 48 LEU HDy% 1.0 1.800 5.600 966 721 A 105 GLN HE22 A 105 GLN HGx 1.0 1.800 3.808 967 721 A 105 GLN HE22 A 105 GLN HG3 1.0 1.800 3.808 968 722 A 101 LYS HA A 105 GLN H 1.0 1.800 5.000 969 723 A 102 MET HA A 105 GLN H 1.0 1.800 5.000 970 724 A 105 GLN H A 104 LEU HG 1.0 1.800 5.000 971 725 A 105 GLN H A 105 GLN HBx 1.0 1.800 3.136 972 725 A 105 GLN H A 105 GLN HBy 1.0 1.800 3.136 973 726 A 105 GLN H A 105 GLN HGx 1.0 1.800 3.808 974 726 A 105 GLN H A 105 GLN HG3 1.0 1.800 3.808 975 727 A 105 GLN H A 106 GLN H 1.0 1.800 3.400 976 728 A 106 GLN HE21 A 106 GLN HGy 1.0 1.800 5.600 977 728 A 106 GLN HE21 A 106 GLN HGx 1.0 1.800 5.600 978 729 A 106 GLN HE22 A 105 GLN HGx 1.0 1.800 5.600 979 729 A 105 GLN HG3 A 106 GLN HE22 1.0 1.800 5.600 980 730 A 106 GLN HE21 A 106 GLN HE22 1.0 1.800 2.800 981 731 A 106 GLN HE22 A 106 GLN HGy 1.0 1.800 5.600 982 731 A 106 GLN HGx A 106 GLN HE22 1.0 1.800 5.600 983 732 A 102 MET HA A 106 GLN H 1.0 1.800 5.000 984 733 A 106 GLN H A 103 THR HA 1.0 1.800 3.400 985 734 A 106 GLN H A 103 THR HG2% 1.0 1.800 6.000 986 735 A 104 LEU H A 106 GLN H 1.0 1.800 5.000 987 736 A 106 GLN H A 105 GLN HA 1.0 1.800 3.400 988 737 A 106 GLN H A 106 GLN HBx 1.0 1.800 3.136 989 737 A 106 GLN H A 106 GLN HBy 1.0 1.800 3.136 990 738 A 106 GLN H A 106 GLN HGy 1.0 1.800 3.808 991 738 A 106 GLN H A 106 GLN HGx 1.0 1.800 3.808 992 739 A 106 GLN H A 107 ILE HB 1.0 1.800 5.000 993 740 A 106 GLN H A 107 ILE HD1% 1.0 1.800 6.000 994 741 A 106 GLN H A 107 ILE HG1x 1.0 1.800 5.600 995 741 A 106 GLN H A 107 ILE HG13 1.0 1.800 5.600 996 742 A 104 LEU HA A 107 ILE H 1.0 1.800 3.400 997 743 A 107 ILE H A 106 GLN HA 1.0 1.800 3.400 998 744 A 107 ILE H A 106 GLN HBx 1.0 1.800 3.808 999 744 A 106 GLN HBy A 107 ILE H 1.0 1.800 3.808 1000 745 A 107 ILE HB A 107 ILE H 1.0 1.800 2.800 1001 746 A 107 ILE HD1% A 107 ILE H 1.0 1.800 4.080 1002 747 A 107 ILE H A 108 ILE H 1.0 1.800 3.400 1003 748 A 105 GLN HA A 108 ILE H 1.0 1.800 5.000 1004 749 A 106 GLN HA A 108 ILE H 1.0 1.800 5.000 1005 750 A 106 GLN H A 108 ILE H 1.0 1.800 5.000 1006 751 A 108 ILE H A 107 ILE HA 1.0 1.800 5.000 1007 752 A 107 ILE HD1% A 108 ILE H 1.0 1.800 6.000 1008 753 A 108 ILE H A 107 ILE HG2% 1.0 1.800 4.080 1009 754 A 108 ILE H A 108 ILE HB 1.0 1.800 2.800 1010 755 A 108 ILE H A 109 SER H 1.0 1.800 3.400 1011 756 A 107 ILE HA A 109 SER H 1.0 1.800 5.000 1012 757 A 109 SER H A 108 ILE HA 1.0 1.800 5.000 1013 758 A 108 ILE HB A 109 SER H 1.0 1.800 3.400 1014 759 A 108 ILE HD1% A 109 SER H 1.0 1.800 6.000 1015 760 A 109 SER H A 108 ILE HG2% 1.0 1.800 4.080 1016 761 A 109 SER H A 109 SER HBx 1.0 1.800 3.136 1017 761 A 109 SER H A 109 SER HBy 1.0 1.800 3.136 1018 762 A 110 ARG HE A 110 ARG HGy 1.0 1.800 5.600 1019 762 A 110 ARG HE A 110 ARG HGx 1.0 1.800 5.600 1020 763 A 107 ILE HA A 110 ARG H 1.0 1.800 5.000 1021 764 A 107 ILE HG2% A 110 ARG H 1.0 1.800 6.000 1022 765 A 108 ILE HA A 110 ARG H 1.0 1.800 5.000 1023 766 A 110 ARG H A 108 ILE HG2% 1.0 1.800 6.000 1024 767 A 108 ILE H A 110 ARG H 1.0 1.800 5.000 1025 768 A 110 ARG H A 109 SER HA 1.0 1.800 3.400 1026 769 A 110 ARG H A 109 SER HBx 1.0 1.800 3.808 1027 769 A 109 SER HBy A 110 ARG H 1.0 1.800 3.808 1028 770 A 110 ARG H A 110 ARG HDx 1.0 1.800 5.600 1029 770 A 110 ARG H A 110 ARG HDy 1.0 1.800 5.600 1030 771 A 110 ARG H A 111 TYR HD% 1.0 1.800 5.600 1031 772 A 110 ARG H A 111 TYR H 1.0 1.800 2.800 1032 773 A 110 ARG H A 112 LYS H 1.0 1.800 5.000 1033 774 A 107 ILE HG2% A 111 TYR H 1.0 1.800 6.000 1034 775 A 108 ILE HA A 111 TYR H 1.0 1.800 5.000 1035 776 A 111 TYR H A 108 ILE HG2% 1.0 1.800 6.000 1036 777 A 109 SER HA A 111 TYR H 1.0 1.800 5.000 1037 778 A 109 SER H A 111 TYR H 1.0 1.800 5.000 1038 779 A 111 TYR H A 110 ARG HGy 1.0 1.800 5.600 1039 779 A 110 ARG HGx A 111 TYR H 1.0 1.800 5.600 1040 780 A 111 TYR H A 111 TYR HBx 1.0 1.800 3.808 1041 780 A 111 TYR H A 111 TYR HBy 1.0 1.800 3.808 1042 781 A 111 TYR HD% A 111 TYR H 1.0 1.800 3.808 1043 782 A 111 TYR HE% A 111 TYR H 1.0 1.800 5.600 1044 783 A 111 TYR H A 112 LYS HA 1.0 1.800 5.000 1045 784 A 111 TYR H A 112 LYS HBx 1.0 1.800 5.600 1046 784 A 111 TYR H A 112 LYS HB3 1.0 1.800 5.600 1047 785 A 111 TYR H A 113 ASP H 1.0 1.800 5.000 1048 786 A 112 LYS H A 109 SER HBx 1.0 1.800 5.600 1049 786 A 109 SER HBy A 112 LYS H 1.0 1.800 5.600 1050 787 A 112 LYS H A 111 TYR HBx 1.0 1.800 5.600 1051 787 A 112 LYS H A 111 TYR HBy 1.0 1.800 5.600 1052 788 A 111 TYR HD% A 112 LYS H 1.0 1.800 5.600 1053 789 A 112 LYS H A 112 LYS HBx 1.0 1.800 3.136 1054 789 A 112 LYS H A 112 LYS HB3 1.0 1.800 3.136 1055 790 A 112 LYS H A 114 ALA H 1.0 1.800 5.000 1056 791 A 112 LYS H A 113 ASP H 1.0 1.800 3.400 1057 792 A 113 ASP H A 113 ASP HBx 1.0 1.800 3.136 1058 792 A 113 ASP H A 113 ASP HBy 1.0 1.800 3.136 1059 793 A 113 ASP H A 114 ALA H 1.0 1.800 3.400 1060 794 A 114 ALA H A 113 ASP HBx 1.0 1.800 3.808 1061 794 A 114 ALA H A 113 ASP HBy 1.0 1.800 3.808 1062 795 A 114 ALA H A 114 ALA HB% 1.0 1.800 3.360 1063 796 A 114 ALA HB% A 115 ASP H 1.0 1.800 3.360 1064 797 A 114 ALA H A 115 ASP H 1.0 1.800 3.400 1065 798 A 115 ASP H A 115 ASP HBy 1.0 1.800 3.136 1066 798 A 115 ASP H A 115 ASP HBx 1.0 1.800 3.136 1067 799 A 2 SER HA A 2 SER HBx 1.0 1.800 3.136 1068 799 A 2 SER HBy A 2 SER HA 1.0 1.800 3.136 1069 800 A 2 SER HA A 99 ASN HBx 1.0 1.800 5.600 1070 800 A 2 SER HA A 99 ASN HBy 1.0 1.800 5.600 1071 801 A 3 HIS HA A 3 HIS HD2 1.0 1.800 5.000 1072 802 A 3 HIS HA A 18 ILE HB 1.0 1.800 5.000 1073 803 A 3 HIS HA A 3 HIS HBx 1.0 1.800 5.600 1074 803 A 3 HIS HA A 3 HIS HBy 1.0 1.800 5.600 1075 804 A 18 ILE HD1% A 3 HIS HBx 1.0 1.800 6.720 1076 804 A 3 HIS HBy A 18 ILE HD1% 1.0 1.800 6.720 1077 805 A 3 HIS HD2 A 3 HIS HBx 1.0 1.800 5.600 1078 805 A 3 HIS HBy A 3 HIS HD2 1.0 1.800 5.600 1079 806 A 4 SER HA A 4 SER HBx 1.0 1.800 3.136 1080 806 A 4 SER HBy A 4 SER HA 1.0 1.800 3.136 1081 807 A 17 ALA HA A 4 SER HA 1.0 1.800 2.800 1082 808 A 4 SER HA A 17 ALA HB% 1.0 1.800 4.080 1083 809 A 100 ILE HD1% A 4 SER HA 1.0 1.800 6.000 1084 810 A 15 ILE HG2% A 4 SER HBx 1.0 1.800 4.570 1085 810 A 4 SER HBy A 15 ILE HG2% 1.0 1.800 4.570 1086 811 A 17 ALA HA A 4 SER HBx 1.0 1.800 3.808 1087 811 A 4 SER HBy A 17 ALA HA 1.0 1.800 3.808 1088 812 A 17 ALA HB% A 4 SER HBx 1.0 1.800 3.763 1089 812 A 4 SER HBy A 17 ALA HB% 1.0 1.800 3.763 1090 813 A 16 ILE HG2% A 5 GLY HAy 1.0 1.800 6.720 1091 813 A 5 GLY HAx A 16 ILE HG2% 1.0 1.800 6.720 1092 814 A 96 VAL HGx% A 5 GLY HAy 1.0 1.800 6.720 1093 814 A 5 GLY HAx A 96 VAL HGx% 1.0 1.800 6.720 1094 815 A 96 VAL HGy% A 5 GLY HAy 1.0 1.800 4.570 1095 815 A 5 GLY HAx A 96 VAL HGy% 1.0 1.800 4.570 1096 816 A 6 ALA HB% A 6 ALA HA 1.0 1.800 3.360 1097 817 A 6 ALA HA A 15 ILE HG1x 1.0 1.800 5.600 1098 817 A 6 ALA HA A 15 ILE HG13 1.0 1.800 5.600 1099 818 A 6 ALA HB% A 7 ALA HA 1.0 1.800 6.000 1100 819 A 15 ILE HA A 6 ALA HB% 1.0 1.800 4.080 1101 820 A 6 ALA HB% A 92 ASN HB2 1.0 1.800 6.720 1102 820 A 6 ALA HB% A 92 ASN HBy 1.0 1.800 6.720 1103 821 A 6 ALA HA A 7 ALA HA 1.0 1.800 5.000 1104 822 A 7 ALA HA A 8 ILE HD1% 1.0 1.800 6.000 1105 823 A 7 ALA HA A 91 PHE HA 1.0 1.800 5.000 1106 824 A 7 ALA HA A 91 PHE HD% 1.0 1.800 5.600 1107 825 A 7 ALA HB% A 7 ALA HA 1.0 1.800 3.360 1108 826 A 7 ALA HB% A 8 ILE HA 1.0 1.800 6.000 1109 827 A 7 ALA HB% A 16 ILE HG1y 1.0 1.800 3.763 1110 827 A 7 ALA HB% A 16 ILE HG1x 1.0 1.800 3.763 1111 828 A 7 ALA HB% A 89 PHE HA 1.0 1.800 6.000 1112 829 A 7 ALA HB% A 89 PHE HBx 1.0 1.800 6.720 1113 829 A 7 ALA HB% A 89 PHE HBy 1.0 1.800 6.720 1114 830 A 7 ALA HB% A 91 PHE HA 1.0 1.800 6.000 1115 831 A 7 ALA HB% A 91 PHE HD% 1.0 1.800 6.720 1116 832 A 7 ALA HB% A 91 PHE HE% 1.0 1.800 4.570 1117 833 A 100 ILE HD1% A 7 ALA HB% 1.0 1.800 7.200 1118 834 A 8 ILE HA A 8 ILE HG1y 1.0 1.800 3.808 1119 834 A 8 ILE HG1x A 8 ILE HA 1.0 1.800 3.808 1120 835 A 8 ILE HG2% A 8 ILE HA 1.0 1.800 3.360 1121 836 A 8 ILE HA A 13 SER HA 1.0 1.800 2.800 1122 837 A 8 ILE HA A 29 TRP HZ2 1.0 1.800 5.000 1123 838 A 8 ILE HB A 90 SER HBx 1.0 1.800 3.808 1124 838 A 8 ILE HB A 90 SER HBy 1.0 1.800 3.808 1125 839 A 8 ILE HD1% A 8 ILE HA 1.0 1.800 4.080 1126 840 A 8 ILE HD1% A 8 ILE HG1y 1.0 1.800 3.763 1127 840 A 8 ILE HD1% A 8 ILE HG1x 1.0 1.800 3.763 1128 841 A 8 ILE HD1% A 13 SER HBy 1.0 1.800 6.720 1129 841 A 8 ILE HD1% A 13 SER HBx 1.0 1.800 6.720 1130 842 A 8 ILE HD1% A 90 SER HBx 1.0 1.800 6.720 1131 842 A 8 ILE HD1% A 90 SER HBy 1.0 1.800 6.720 1132 843 A 8 ILE HD1% A 92 ASN HB2 1.0 1.800 6.720 1133 843 A 8 ILE HD1% A 92 ASN HBy 1.0 1.800 6.720 1134 844 A 8 ILE HB A 8 ILE HG2% 1.0 1.800 3.360 1135 845 A 8 ILE HD1% A 8 ILE HG2% 1.0 1.800 4.032 1136 846 A 8 ILE HG2% A 8 ILE HG1y 1.0 1.800 3.763 1137 846 A 8 ILE HG1x A 8 ILE HG2% 1.0 1.800 3.763 1138 847 A 8 ILE HG2% A 11 LYS HA 1.0 1.800 3.360 1139 848 A 8 ILE HG2% A 11 LYS HGx 1.0 1.800 6.720 1140 848 A 8 ILE HG2% A 11 LYS HG3 1.0 1.800 6.720 1141 849 A 8 ILE HG2% A 90 SER HBx 1.0 1.800 4.570 1142 849 A 8 ILE HG2% A 90 SER HBy 1.0 1.800 4.570 1143 850 A 9 PHE HD% A 9 PHE HA 1.0 1.800 3.808 1144 851 A 9 PHE HE% A 9 PHE HA 1.0 1.800 5.600 1145 852 A 9 PHE HA A 89 PHE HA 1.0 1.800 5.000 1146 853 A 89 PHE HD% A 9 PHE HA 1.0 1.800 5.600 1147 854 A 9 PHE HA A 9 PHE HBx 1.0 1.800 5.600 1148 854 A 9 PHE HBy A 9 PHE HA 1.0 1.800 5.600 1149 855 A 9 PHE HD% A 9 PHE HE% 1.0 1.800 4.265 1150 856 A 9 PHE HE% A 9 PHE HZ 1.0 1.800 3.808 1151 857 A 10 GLU HA A 10 GLU HBy 1.0 1.800 3.808 1152 857 A 10 GLU HBx A 10 GLU HA 1.0 1.800 3.808 1153 858 A 10 GLU HBx A 10 GLU HGx 1.0 1.800 4.265 1154 858 A 10 GLU HBy A 10 GLU HGx 1.0 1.800 4.265 1155 858 A 10 GLU HGy A 10 GLU HBy 1.0 1.800 4.265 1156 858 A 10 GLU HBx A 10 GLU HGy 1.0 1.800 4.265 1157 859 A 9 PHE HE% A 10 GLU HGx 1.0 1.800 6.272 1158 859 A 9 PHE HE% A 10 GLU HGy 1.0 1.800 6.272 1159 860 A 10 GLU HA A 10 GLU HGx 1.0 1.800 3.808 1160 860 A 10 GLU HGy A 10 GLU HA 1.0 1.800 3.808 1161 861 A 11 LYS HA A 11 LYS HBy 1.0 1.800 3.808 1162 861 A 11 LYS HBx A 11 LYS HA 1.0 1.800 3.808 1163 862 A 11 LYS HA A 11 LYS HDx 1.0 1.800 5.600 1164 862 A 11 LYS HA A 11 LYS HDy 1.0 1.800 5.600 1165 863 A 11 LYS HA A 11 LYS HGx 1.0 1.800 3.136 1166 863 A 11 LYS HG3 A 11 LYS HA 1.0 1.800 3.136 1167 864 A 11 LYS HBy A 11 LYS HEx 1.0 1.800 6.272 1168 864 A 11 LYS HBx A 11 LYS HEx 1.0 1.800 6.272 1169 864 A 11 LYS HE3 A 11 LYS HBy 1.0 1.800 6.272 1170 864 A 11 LYS HBx A 11 LYS HE3 1.0 1.800 6.272 1171 865 A 10 GLU HA A 11 LYS HGx 1.0 1.800 5.600 1172 865 A 10 GLU HA A 11 LYS HG3 1.0 1.800 5.600 1173 866 A 11 LYS HBx A 11 LYS HGx 1.0 1.800 4.265 1174 866 A 11 LYS HBy A 11 LYS HGx 1.0 1.800 4.265 1175 866 A 11 LYS HG3 A 11 LYS HBy 1.0 1.800 4.265 1176 866 A 11 LYS HBx A 11 LYS HG3 1.0 1.800 4.265 1177 867 A 11 LYS HDy A 11 LYS HGx 1.0 1.800 3.512 1178 867 A 11 LYS HDx A 11 LYS HGx 1.0 1.800 3.512 1179 867 A 11 LYS HG3 A 11 LYS HDx 1.0 1.800 3.512 1180 867 A 11 LYS HG3 A 11 LYS HDy 1.0 1.800 3.512 1181 868 A 11 LYS HEx A 11 LYS HGx 1.0 1.800 4.265 1182 868 A 11 LYS HE3 A 11 LYS HGx 1.0 1.800 4.265 1183 868 A 11 LYS HG3 A 11 LYS HEx 1.0 1.800 4.265 1184 868 A 11 LYS HG3 A 11 LYS HE3 1.0 1.800 4.265 1185 869 A 8 ILE HG2% A 12 VAL HA 1.0 1.800 6.000 1186 870 A 12 VAL HB A 12 VAL HA 1.0 1.800 5.000 1187 871 A 12 VAL HA A 12 VAL HGy% 1.0 1.800 3.360 1188 872 A 12 VAL HB A 12 VAL HGx% 1.0 1.800 3.360 1189 873 A 12 VAL HB A 29 TRP HH2 1.0 1.800 6.000 1190 874 A 12 VAL HB A 29 TRP HZ2 1.0 1.800 5.000 1191 875 A 29 TRP HH2 A 12 VAL HGx% 1.0 1.800 7.200 1192 876 A 29 TRP HZ2 A 12 VAL HGx% 1.0 1.800 6.000 1193 877 A 12 VAL HGx% A 36 LYS HDx 1.0 1.800 4.570 1194 877 A 12 VAL HGx% A 36 LYS HD3 1.0 1.800 4.570 1195 878 A 12 VAL HB A 12 VAL HGy% 1.0 1.800 3.360 1196 879 A 12 VAL HGx% A 12 VAL HGy% 1.0 1.800 4.032 1197 880 A 29 TRP HH2 A 12 VAL HGy% 1.0 1.800 4.896 1198 881 A 29 TRP HZ2 A 12 VAL HGy% 1.0 1.800 4.080 1199 882 A 12 VAL HGy% A 31 SER HA 1.0 1.800 6.000 1200 883 A 12 VAL HGy% A 31 SER HBy 1.0 1.800 4.570 1201 883 A 12 VAL HGy% A 31 SER HBx 1.0 1.800 4.570 1202 884 A 12 VAL HGy% A 36 LYS HDx 1.0 1.800 4.570 1203 884 A 12 VAL HGy% A 36 LYS HD3 1.0 1.800 4.570 1204 885 A 8 ILE HD1% A 13 SER HA 1.0 1.800 4.080 1205 886 A 13 SER HA A 8 ILE HG1y 1.0 1.800 3.808 1206 886 A 8 ILE HG1x A 13 SER HA 1.0 1.800 3.808 1207 887 A 8 ILE HG2% A 13 SER HA 1.0 1.800 4.080 1208 888 A 13 SER HA A 13 SER HBy 1.0 1.800 3.136 1209 888 A 13 SER HA A 13 SER HBx 1.0 1.800 3.136 1210 889 A 8 ILE HG1y A 13 SER HBy 1.0 1.800 6.272 1211 889 A 8 ILE HG1x A 13 SER HBy 1.0 1.800 6.272 1212 889 A 13 SER HBx A 8 ILE HG1y 1.0 1.800 6.272 1213 889 A 8 ILE HG1x A 13 SER HBx 1.0 1.800 6.272 1214 890 A 15 ILE HA A 6 ALA HA 1.0 1.800 2.800 1215 891 A 15 ILE HA A 7 ALA HB% 1.0 1.800 6.000 1216 892 A 15 ILE HD1% A 5 GLY HAy 1.0 1.800 6.720 1217 892 A 5 GLY HAx A 15 ILE HD1% 1.0 1.800 6.720 1218 893 A 6 ALA HA A 15 ILE HD1% 1.0 1.800 3.360 1219 894 A 6 ALA HB% A 15 ILE HD1% 1.0 1.800 4.896 1220 895 A 15 ILE HA A 15 ILE HD1% 1.0 1.800 3.360 1221 896 A 32 THR HA A 15 ILE HD1% 1.0 1.800 3.360 1222 897 A 15 ILE HA A 15 ILE HG1x 1.0 1.800 5.600 1223 897 A 15 ILE HA A 15 ILE HG13 1.0 1.800 5.600 1224 898 A 4 SER HA A 15 ILE HG2% 1.0 1.800 6.000 1225 899 A 6 ALA HA A 15 ILE HG2% 1.0 1.800 4.080 1226 900 A 6 ALA HB% A 15 ILE HG2% 1.0 1.800 4.896 1227 901 A 15 ILE HA A 15 ILE HG2% 1.0 1.800 3.360 1228 902 A 17 ALA HB% A 15 ILE HG2% 1.0 1.800 4.032 1229 903 A 16 ILE HA A 16 ILE HB 1.0 1.800 3.400 1230 904 A 16 ILE HA A 16 ILE HD1% 1.0 1.800 6.000 1231 905 A 16 ILE HA A 16 ILE HG1y 1.0 1.800 5.600 1232 905 A 16 ILE HA A 16 ILE HG1x 1.0 1.800 5.600 1233 906 A 16 ILE HA A 29 TRP HA 1.0 1.800 3.400 1234 907 A 16 ILE HB A 7 ALA HB% 1.0 1.800 4.080 1235 908 A 16 ILE HB A 16 ILE HD1% 1.0 1.800 4.080 1236 909 A 16 ILE HB A 16 ILE HG1y 1.0 1.800 3.136 1237 909 A 16 ILE HB A 16 ILE HG1x 1.0 1.800 3.136 1238 910 A 16 ILE HB A 29 TRP HA 1.0 1.800 5.000 1239 911 A 16 ILE HB A 29 TRP HD1 1.0 1.800 5.000 1240 912 A 7 ALA HB% A 16 ILE HD1% 1.0 1.800 4.032 1241 913 A 16 ILE HD1% A 16 ILE HG1y 1.0 1.800 4.570 1242 913 A 16 ILE HD1% A 16 ILE HG1x 1.0 1.800 4.570 1243 914 A 16 ILE HD1% A 27 LEU HDx% 1.0 1.800 4.896 1244 915 A 16 ILE HD1% A 27 LEU HDy% 1.0 1.800 4.896 1245 916 A 16 ILE HD1% A 27 LEU HG 1.0 1.800 6.000 1246 917 A 29 TRP HD1 A 16 ILE HD1% 1.0 1.800 6.000 1247 918 A 16 ILE HD1% A 91 PHE HE% 1.0 1.800 6.720 1248 919 A 16 ILE HD1% A 91 PHE HZ 1.0 1.800 6.000 1249 920 A 29 TRP HD1 A 16 ILE HG1y 1.0 1.800 5.600 1250 920 A 29 TRP HD1 A 16 ILE HG1x 1.0 1.800 5.600 1251 921 A 4 SER HA A 16 ILE HG2% 1.0 1.800 4.080 1252 922 A 7 ALA HB% A 16 ILE HG2% 1.0 1.800 4.032 1253 923 A 16 ILE HA A 16 ILE HG2% 1.0 1.800 4.080 1254 924 A 16 ILE HD1% A 16 ILE HG2% 1.0 1.800 4.032 1255 925 A 27 LEU HDy% A 16 ILE HG2% 1.0 1.800 4.032 1256 926 A 16 ILE HG2% A 27 LEU HG 1.0 1.800 3.360 1257 927 A 29 TRP HD1 A 16 ILE HG2% 1.0 1.800 6.000 1258 928 A 16 ILE HG2% A 91 PHE HZ 1.0 1.800 6.000 1259 929 A 17 ALA HA A 17 ALA HB% 1.0 1.800 3.360 1260 930 A 18 ILE HB A 3 HIS HBx 1.0 1.800 5.600 1261 930 A 3 HIS HBy A 18 ILE HB 1.0 1.800 5.600 1262 931 A 3 HIS HD2 A 18 ILE HB 1.0 1.800 5.000 1263 932 A 3 HIS HA A 18 ILE HD1% 1.0 1.800 4.080 1264 933 A 3 HIS HD2 A 18 ILE HD1% 1.0 1.800 6.000 1265 934 A 18 ILE HA A 18 ILE HD1% 1.0 1.800 4.080 1266 935 A 27 LEU HA A 18 ILE HD1% 1.0 1.800 6.000 1267 936 A 100 ILE HD1% A 18 ILE HD1% 1.0 1.800 4.032 1268 937 A 103 THR HB A 18 ILE HD1% 1.0 1.800 4.080 1269 938 A 104 LEU HA A 18 ILE HD1% 1.0 1.800 6.000 1270 939 A 18 ILE HA A 18 ILE HG1x 1.0 1.800 3.808 1271 939 A 18 ILE HG1y A 18 ILE HA 1.0 1.800 3.808 1272 940 A 27 LEU HA A 18 ILE HG1x 1.0 1.800 3.808 1273 940 A 18 ILE HG1y A 27 LEU HA 1.0 1.800 3.808 1274 941 A 103 THR HG2% A 18 ILE HG1x 1.0 1.800 3.763 1275 941 A 18 ILE HG1y A 103 THR HG2% 1.0 1.800 3.763 1276 942 A 3 HIS HA A 18 ILE HG2% 1.0 1.800 6.000 1277 943 A 3 HIS HD2 A 18 ILE HG2% 1.0 1.800 4.080 1278 944 A 18 ILE HG2% A 25 ALA HB% 1.0 1.800 4.032 1279 945 A 18 ILE HG2% A 27 LEU HA 1.0 1.800 6.000 1280 946 A 18 ILE HG2% A 19 ASN HA 1.0 1.800 6.000 1281 947 A 19 ASN HA A 19 ASN HBy 1.0 1.800 3.808 1282 947 A 19 ASN HBx A 19 ASN HA 1.0 1.800 3.808 1283 948 A 22 VAL HGy% A 19 ASN HA 1.0 1.800 6.000 1284 949 A 20 GLU HA A 25 ALA HA 1.0 1.800 3.400 1285 950 A 20 GLU HA A 20 GLU HBy 1.0 1.800 3.808 1286 950 A 20 GLU HBx A 20 GLU HA 1.0 1.800 3.808 1287 951 A 20 GLU HBy A 20 GLU HGx 1.0 1.800 3.512 1288 951 A 20 GLU HBx A 20 GLU HGx 1.0 1.800 3.512 1289 951 A 20 GLU HGy A 20 GLU HBy 1.0 1.800 3.512 1290 951 A 20 GLU HBx A 20 GLU HGy 1.0 1.800 3.512 1291 952 A 3 HIS HD2 A 20 GLU HGx 1.0 1.800 5.600 1292 952 A 3 HIS HD2 A 20 GLU HGy 1.0 1.800 5.600 1293 953 A 18 ILE HD1% A 20 GLU HGx 1.0 1.800 6.720 1294 953 A 20 GLU HGy A 18 ILE HD1% 1.0 1.800 6.720 1295 954 A 20 GLU HA A 20 GLU HGx 1.0 1.800 3.808 1296 954 A 20 GLU HGy A 20 GLU HA 1.0 1.800 3.808 1297 955 A 107 ILE HD1% A 20 GLU HGx 1.0 1.800 6.720 1298 955 A 20 GLU HGy A 107 ILE HD1% 1.0 1.800 6.720 1299 956 A 21 ASP HA A 21 ASP HBx 1.0 1.800 3.136 1300 956 A 21 ASP HA A 21 ASP HBy 1.0 1.800 3.136 1301 957 A 22 VAL HA A 22 VAL HGx% 1.0 1.800 3.360 1302 958 A 22 VAL HA A 22 VAL HB 1.0 1.800 2.800 1303 959 A 22 VAL HB A 22 VAL HGx% 1.0 1.800 3.360 1304 960 A 22 VAL HGy% A 22 VAL HB 1.0 1.800 3.360 1305 961 A 22 VAL HGy% A 25 ALA HB% 1.0 1.800 7.200 1306 962 A 22 VAL HGy% A 26 GLU HGx 1.0 1.800 4.570 1307 962 A 22 VAL HGy% A 26 GLU HGy 1.0 1.800 4.570 1308 963 A 23 SER HA A 23 SER HBy 1.0 1.800 3.808 1309 963 A 23 SER HBx A 23 SER HA 1.0 1.800 3.808 1310 964 A 24 PRO HA A 23 SER HBy 1.0 1.800 5.600 1311 964 A 23 SER HBx A 24 PRO HA 1.0 1.800 5.600 1312 965 A 111 TYR HE% A 24 PRO HA 1.0 1.800 5.600 1313 966 A 24 PRO HA A 24 PRO HBx 1.0 1.800 3.808 1314 966 A 24 PRO HBy A 24 PRO HA 1.0 1.800 3.808 1315 967 A 24 PRO HBy A 24 PRO HDx 1.0 1.800 6.272 1316 967 A 24 PRO HBx A 24 PRO HDx 1.0 1.800 6.272 1317 967 A 24 PRO HD3 A 24 PRO HBx 1.0 1.800 6.272 1318 967 A 24 PRO HD3 A 24 PRO HBy 1.0 1.800 6.272 1319 968 A 24 PRO HDx A 24 PRO HGy 1.0 1.800 3.512 1320 968 A 24 PRO HD3 A 24 PRO HGy 1.0 1.800 3.512 1321 968 A 24 PRO HGx A 24 PRO HDx 1.0 1.800 3.512 1322 968 A 24 PRO HD3 A 24 PRO HGx 1.0 1.800 3.512 1323 969 A 24 PRO HBx A 24 PRO HGy 1.0 1.800 3.512 1324 969 A 24 PRO HBy A 24 PRO HGy 1.0 1.800 3.512 1325 969 A 24 PRO HGx A 24 PRO HBx 1.0 1.800 3.512 1326 969 A 24 PRO HBy A 24 PRO HGx 1.0 1.800 3.512 1327 970 A 22 VAL HGy% A 25 ALA HA 1.0 1.800 3.360 1328 971 A 20 GLU HA A 25 ALA HB% 1.0 1.800 3.360 1329 972 A 25 ALA HB% A 20 GLU HBy 1.0 1.800 6.720 1330 972 A 20 GLU HBx A 25 ALA HB% 1.0 1.800 6.720 1331 973 A 25 ALA HB% A 20 GLU HGx 1.0 1.800 6.720 1332 973 A 20 GLU HGy A 25 ALA HB% 1.0 1.800 6.720 1333 974 A 25 ALA HA A 25 ALA HB% 1.0 1.800 3.360 1334 975 A 25 ALA HB% A 107 ILE HD1% 1.0 1.800 4.896 1335 976 A 25 ALA HB% A 111 TYR HE% 1.0 1.800 6.720 1336 977 A 26 GLU HA A 26 GLU HBx 1.0 1.800 3.808 1337 977 A 26 GLU HBy A 26 GLU HA 1.0 1.800 3.808 1338 978 A 41 VAL HA A 26 GLU HA 1.0 1.800 3.400 1339 979 A 41 VAL HGy% A 26 GLU HA 1.0 1.800 4.080 1340 980 A 26 GLU HBx A 26 GLU HGx 1.0 1.800 4.265 1341 980 A 26 GLU HBy A 26 GLU HGx 1.0 1.800 4.265 1342 980 A 26 GLU HGy A 26 GLU HBx 1.0 1.800 4.265 1343 980 A 26 GLU HBy A 26 GLU HGy 1.0 1.800 4.265 1344 981 A 26 GLU HA A 26 GLU HGx 1.0 1.800 5.600 1345 981 A 26 GLU HGy A 26 GLU HA 1.0 1.800 5.600 1346 982 A 41 VAL HA A 26 GLU HGx 1.0 1.800 5.600 1347 982 A 26 GLU HGy A 41 VAL HA 1.0 1.800 5.600 1348 983 A 18 ILE HA A 27 LEU HA 1.0 1.800 3.400 1349 984 A 27 LEU HA A 27 LEU HG 1.0 1.800 5.000 1350 985 A 27 LEU HA A 42 LEU HDy% 1.0 1.800 4.080 1351 986 A 27 LEU HA A 27 LEU HBy 1.0 1.800 5.600 1352 986 A 27 LEU HBx A 27 LEU HA 1.0 1.800 5.600 1353 987 A 27 LEU HDx% A 27 LEU HBy 1.0 1.800 4.570 1354 987 A 27 LEU HDx% A 27 LEU HBx 1.0 1.800 4.570 1355 988 A 27 LEU HDy% A 27 LEU HBy 1.0 1.800 6.720 1356 988 A 27 LEU HBx A 27 LEU HDy% 1.0 1.800 6.720 1357 989 A 42 LEU HDy% A 27 LEU HBy 1.0 1.800 4.570 1358 989 A 27 LEU HBx A 42 LEU HDy% 1.0 1.800 4.570 1359 990 A 27 LEU HDx% A 27 LEU HA 1.0 1.800 6.000 1360 991 A 27 LEU HDx% A 27 LEU HG 1.0 1.800 3.360 1361 992 A 27 LEU HDx% A 62 LEU HDy% 1.0 1.800 4.032 1362 993 A 27 LEU HDy% A 27 LEU HA 1.0 1.800 6.000 1363 994 A 27 LEU HDx% A 27 LEU HDy% 1.0 1.800 4.032 1364 995 A 27 LEU HDy% A 27 LEU HG 1.0 1.800 3.360 1365 996 A 27 LEU HDy% A 38 HIS HD2 1.0 1.800 6.000 1366 997 A 27 LEU HDy% A 40 VAL HB 1.0 1.800 6.000 1367 998 A 27 LEU HDy% A 40 VAL HGx% 1.0 1.800 4.896 1368 999 A 89 PHE HD% A 27 LEU HDy% 1.0 1.800 6.720 1369 1000 A 27 LEU HDy% A 89 PHE HE% 1.0 1.800 4.570 1370 1001 A 27 LEU HDy% A 89 PHE HZ 1.0 1.800 4.080 1371 1002 A 27 LEU HDy% A 28 THR HA 1.0 1.800 6.000 1372 1003 A 28 THR HB A 28 THR HA 1.0 1.800 3.400 1373 1004 A 28 THR HG2% A 28 THR HA 1.0 1.800 4.080 1374 1005 A 39 THR HA A 28 THR HA 1.0 1.800 2.800 1375 1006 A 17 ALA HB% A 28 THR HB 1.0 1.800 4.080 1376 1007 A 28 THR HB A 28 THR HG2% 1.0 1.800 3.360 1377 1008 A 28 THR HB A 37 VAL HG2% 1.0 1.800 6.000 1378 1009 A 28 THR HB A 39 THR HG2% 1.0 1.800 6.000 1379 1010 A 28 THR HG2% A 37 VAL HA 1.0 1.800 6.000 1380 1011 A 28 THR HG2% A 37 VAL HG2% 1.0 1.800 4.032 1381 1012 A 29 TRP HA A 16 ILE HG1y 1.0 1.800 5.600 1382 1012 A 29 TRP HA A 16 ILE HG1x 1.0 1.800 5.600 1383 1013 A 29 TRP HA A 29 TRP HBx 1.0 1.800 5.600 1384 1013 A 29 TRP HA A 29 TRP HBy 1.0 1.800 5.600 1385 1014 A 7 ALA HB% A 29 TRP HD1 1.0 1.800 6.000 1386 1015 A 16 ILE HA A 29 TRP HD1 1.0 1.800 5.000 1387 1016 A 29 TRP HD1 A 29 TRP HA 1.0 1.800 5.000 1388 1017 A 29 TRP HD1 A 29 TRP HBx 1.0 1.800 5.600 1389 1017 A 29 TRP HD1 A 29 TRP HBy 1.0 1.800 5.600 1390 1018 A 29 TRP HE3 A 29 TRP HZ3 1.0 1.800 5.000 1391 1019 A 29 TRP HH2 A 29 TRP HZ3 1.0 1.800 6.000 1392 1020 A 30 ARG HA A 37 VAL HB 1.0 1.800 5.000 1393 1021 A 30 ARG HA A 30 ARG HBx 1.0 1.800 3.808 1394 1021 A 30 ARG HBy A 30 ARG HA 1.0 1.800 3.808 1395 1022 A 30 ARG HBx A 30 ARG HDy 1.0 1.800 6.272 1396 1022 A 30 ARG HBy A 30 ARG HDy 1.0 1.800 6.272 1397 1022 A 30 ARG HDx A 30 ARG HBx 1.0 1.800 6.272 1398 1022 A 30 ARG HBy A 30 ARG HDx 1.0 1.800 6.272 1399 1023 A 37 VAL HG2% A 30 ARG HDy 1.0 1.800 6.720 1400 1023 A 37 VAL HG2% A 30 ARG HDx 1.0 1.800 6.720 1401 1024 A 30 ARG HA A 30 ARG HGy 1.0 1.800 5.600 1402 1024 A 30 ARG HA A 30 ARG HGx 1.0 1.800 5.600 1403 1025 A 30 ARG HDx A 30 ARG HGy 1.0 1.800 4.265 1404 1025 A 30 ARG HDy A 30 ARG HGy 1.0 1.800 4.265 1405 1025 A 30 ARG HGx A 30 ARG HDy 1.0 1.800 4.265 1406 1025 A 30 ARG HDx A 30 ARG HGx 1.0 1.800 4.265 1407 1026 A 29 TRP HZ2 A 31 SER HA 1.0 1.800 5.000 1408 1027 A 31 SER HA A 31 SER HBy 1.0 1.800 3.136 1409 1027 A 31 SER HBx A 31 SER HA 1.0 1.800 3.136 1410 1028 A 32 THR HA A 32 THR HB 1.0 1.800 2.800 1411 1029 A 32 THR HA A 32 THR HG2% 1.0 1.800 3.360 1412 1030 A 32 THR HG2% A 32 THR HB 1.0 1.800 3.360 1413 1031 A 32 THR HG2% A 15 ILE HD1% 1.0 1.800 4.896 1414 1032 A 32 THR HG2% A 33 ASP HA 1.0 1.800 6.000 1415 1033 A 33 ASP HA A 33 ASP HBx 1.0 1.800 3.136 1416 1033 A 33 ASP HA A 33 ASP HBy 1.0 1.800 3.136 1417 1034 A 35 ASP HA A 35 ASP HBx 1.0 1.800 3.136 1418 1034 A 35 ASP HBy A 35 ASP HA 1.0 1.800 3.136 1419 1035 A 36 LYS HA A 36 LYS HDx 1.0 1.800 5.600 1420 1035 A 36 LYS HA A 36 LYS HD3 1.0 1.800 5.600 1421 1036 A 36 LYS HA A 36 LYS HGy 1.0 1.800 3.808 1422 1036 A 36 LYS HGx A 36 LYS HA 1.0 1.800 3.808 1423 1037 A 37 VAL HG2% A 36 LYS HA 1.0 1.800 6.000 1424 1038 A 31 SER HBy A 36 LYS HBy 1.0 1.800 6.272 1425 1038 A 31 SER HBx A 36 LYS HBy 1.0 1.800 6.272 1426 1038 A 36 LYS HBx A 31 SER HBy 1.0 1.800 6.272 1427 1038 A 31 SER HBx A 36 LYS HBx 1.0 1.800 6.272 1428 1039 A 36 LYS HA A 36 LYS HBy 1.0 1.800 3.808 1429 1039 A 36 LYS HBx A 36 LYS HA 1.0 1.800 3.808 1430 1040 A 36 LYS HD3 A 36 LYS HEx 1.0 1.800 3.512 1431 1040 A 36 LYS HDx A 36 LYS HEx 1.0 1.800 3.512 1432 1040 A 36 LYS HE3 A 36 LYS HDx 1.0 1.800 3.512 1433 1040 A 36 LYS HD3 A 36 LYS HE3 1.0 1.800 3.512 1434 1041 A 12 VAL HGx% A 36 LYS HEx 1.0 1.800 6.720 1435 1041 A 12 VAL HGx% A 36 LYS HE3 1.0 1.800 6.720 1436 1042 A 30 ARG HA A 37 VAL HA 1.0 1.800 2.800 1437 1043 A 37 VAL HA A 30 ARG HBx 1.0 1.800 5.600 1438 1043 A 30 ARG HBy A 37 VAL HA 1.0 1.800 5.600 1439 1044 A 37 VAL HA A 30 ARG HGy 1.0 1.800 5.600 1440 1044 A 37 VAL HA A 30 ARG HGx 1.0 1.800 5.600 1441 1045 A 37 VAL HG2% A 37 VAL HA 1.0 1.800 3.360 1442 1046 A 37 VAL HA A 37 VAL HB 1.0 1.800 3.400 1443 1047 A 37 VAL HG2% A 30 ARG HA 1.0 1.800 4.080 1444 1048 A 37 VAL HG2% A 30 ARG HBx 1.0 1.800 4.570 1445 1048 A 30 ARG HBy A 37 VAL HG2% 1.0 1.800 4.570 1446 1049 A 37 VAL HG2% A 37 VAL HB 1.0 1.800 3.360 1447 1050 A 37 VAL HA A 38 HIS HA 1.0 1.800 5.000 1448 1051 A 38 HIS HA A 38 HIS HBy 1.0 1.800 5.600 1449 1051 A 38 HIS HA A 38 HIS HBx 1.0 1.800 5.600 1450 1052 A 38 HIS HD2 A 38 HIS HBy 1.0 1.800 5.600 1451 1052 A 38 HIS HBx A 38 HIS HD2 1.0 1.800 5.600 1452 1053 A 89 PHE HE% A 38 HIS HD2 1.0 1.800 5.600 1453 1054 A 38 HIS HD2 A 89 PHE HZ 1.0 1.800 5.000 1454 1055 A 28 THR HB A 39 THR HA 1.0 1.800 5.000 1455 1056 A 39 THR HA A 28 THR HG2% 1.0 1.800 4.080 1456 1057 A 39 THR HA A 39 THR HB 1.0 1.800 3.400 1457 1058 A 39 THR HA A 39 THR HG2% 1.0 1.800 3.360 1458 1059 A 28 THR HG2% A 39 THR HB 1.0 1.800 6.000 1459 1060 A 39 THR HG2% A 39 THR HB 1.0 1.800 3.360 1460 1061 A 39 THR HG2% A 28 THR HA 1.0 1.800 6.000 1461 1062 A 39 THR HG2% A 40 VAL HA 1.0 1.800 6.000 1462 1063 A 40 VAL HB A 40 VAL HA 1.0 1.800 5.000 1463 1064 A 27 LEU HDx% A 40 VAL HB 1.0 1.800 6.000 1464 1065 A 40 VAL HGx% A 26 GLU HA 1.0 1.800 6.000 1465 1066 A 40 VAL HGx% A 27 LEU HBy 1.0 1.800 6.720 1466 1066 A 27 LEU HBx A 40 VAL HGx% 1.0 1.800 6.720 1467 1067 A 40 VAL HGx% A 40 VAL HA 1.0 1.800 3.360 1468 1068 A 40 VAL HB A 40 VAL HGx% 1.0 1.800 4.080 1469 1069 A 40 VAL HGx% A 45 ILE HD1% 1.0 1.800 4.032 1470 1070 A 40 VAL HGx% A 62 LEU HDx% 1.0 1.800 4.896 1471 1071 A 40 VAL HGx% A 62 LEU HDy% 1.0 1.800 4.032 1472 1072 A 40 VAL HGx% A 87 HIS HD2 1.0 1.800 6.000 1473 1073 A 40 VAL HGy% A 27 LEU HBy 1.0 1.800 6.720 1474 1073 A 27 LEU HBx A 40 VAL HGy% 1.0 1.800 6.720 1475 1074 A 27 LEU HDx% A 40 VAL HGy% 1.0 1.800 7.200 1476 1075 A 27 LEU HDy% A 40 VAL HGy% 1.0 1.800 4.032 1477 1076 A 40 VAL HGy% A 38 HIS HD2 1.0 1.800 4.080 1478 1077 A 39 THR HA A 40 VAL HGy% 1.0 1.800 6.000 1479 1078 A 40 VAL HGy% A 40 VAL HA 1.0 1.800 3.360 1480 1079 A 40 VAL HGy% A 40 VAL HB 1.0 1.800 4.080 1481 1080 A 40 VAL HGy% A 40 VAL HGx% 1.0 1.800 4.032 1482 1081 A 40 VAL HGy% A 62 LEU HDx% 1.0 1.800 7.200 1483 1082 A 40 VAL HGy% A 87 HIS HD2 1.0 1.800 4.080 1484 1083 A 40 VAL HGy% A 89 PHE HZ 1.0 1.800 6.000 1485 1084 A 41 VAL HA A 26 GLU HBx 1.0 1.800 5.600 1486 1084 A 26 GLU HBy A 41 VAL HA 1.0 1.800 5.600 1487 1085 A 41 VAL HA A 40 VAL HB 1.0 1.800 5.000 1488 1086 A 41 VAL HA A 41 VAL HB 1.0 1.800 5.000 1489 1087 A 41 VAL HA A 41 VAL HGy% 1.0 1.800 3.360 1490 1088 A 41 VAL HB A 41 VAL HGy% 1.0 1.800 3.360 1491 1089 A 41 VAL HGx% A 24 PRO HBx 1.0 1.800 6.720 1492 1089 A 41 VAL HGx% A 24 PRO HBy 1.0 1.800 6.720 1493 1090 A 41 VAL HGx% A 24 PRO HDx 1.0 1.800 6.720 1494 1090 A 24 PRO HD3 A 41 VAL HGx% 1.0 1.800 6.720 1495 1091 A 41 VAL HGx% A 24 PRO HGy 1.0 1.800 3.763 1496 1091 A 41 VAL HGx% A 24 PRO HGx 1.0 1.800 3.763 1497 1092 A 41 VAL HGx% A 26 GLU HA 1.0 1.800 6.000 1498 1093 A 41 VAL HGx% A 41 VAL HA 1.0 1.800 3.360 1499 1094 A 41 VAL HGx% A 41 VAL HB 1.0 1.800 3.360 1500 1095 A 42 LEU HA A 42 LEU HBx 1.0 1.800 5.600 1501 1095 A 42 LEU HBy A 42 LEU HA 1.0 1.800 5.600 1502 1096 A 42 LEU HA A 42 LEU HG 1.0 1.800 5.000 1503 1097 A 42 LEU HDx% A 42 LEU HBx 1.0 1.800 6.720 1504 1097 A 42 LEU HBy A 42 LEU HDx% 1.0 1.800 6.720 1505 1098 A 42 LEU HDy% A 42 LEU HBx 1.0 1.800 4.570 1506 1098 A 42 LEU HBy A 42 LEU HDy% 1.0 1.800 4.570 1507 1099 A 26 GLU HA A 42 LEU HDx% 1.0 1.800 6.000 1508 1100 A 42 LEU HDx% A 27 LEU HBy 1.0 1.800 4.570 1509 1100 A 27 LEU HBx A 42 LEU HDx% 1.0 1.800 4.570 1510 1101 A 40 VAL HGx% A 42 LEU HDx% 1.0 1.800 4.032 1511 1102 A 40 VAL HGy% A 42 LEU HDx% 1.0 1.800 7.200 1512 1103 A 42 LEU HDx% A 42 LEU HA 1.0 1.800 3.360 1513 1104 A 42 LEU HDx% A 42 LEU HG 1.0 1.800 4.080 1514 1105 A 42 LEU HDx% A 62 LEU HDx% 1.0 1.800 4.896 1515 1106 A 42 LEU HDx% A 62 LEU HDy% 1.0 1.800 4.032 1516 1107 A 26 GLU HA A 42 LEU HDy% 1.0 1.800 6.000 1517 1108 A 42 LEU HDy% A 42 LEU HA 1.0 1.800 6.000 1518 1109 A 42 LEU HDy% A 42 LEU HG 1.0 1.800 4.080 1519 1110 A 26 GLU HA A 42 LEU HG 1.0 1.800 5.000 1520 1111 A 43 SER HA A 111 TYR HD% 1.0 1.800 5.600 1521 1112 A 111 TYR HE% A 43 SER HA 1.0 1.800 5.600 1522 1113 A 43 SER HA A 43 SER HBx 1.0 1.800 3.808 1523 1113 A 43 SER HB3 A 43 SER HA 1.0 1.800 3.808 1524 1114 A 44 THR HG2% A 44 THR HA 1.0 1.800 3.360 1525 1115 A 44 THR HA A 65 LYS HDx 1.0 1.800 5.600 1526 1115 A 44 THR HA A 65 LYS HD3 1.0 1.800 5.600 1527 1116 A 44 THR HB A 44 THR HA 1.0 1.800 2.800 1528 1117 A 44 THR HB A 65 LYS HDx 1.0 1.800 5.600 1529 1117 A 44 THR HB A 65 LYS HD3 1.0 1.800 5.600 1530 1118 A 41 VAL HB A 44 THR HG2% 1.0 1.800 4.080 1531 1119 A 41 VAL HGx% A 44 THR HG2% 1.0 1.800 4.032 1532 1120 A 44 THR HG2% A 44 THR HB 1.0 1.800 3.360 1533 1121 A 45 ILE HD1% A 42 LEU HA 1.0 1.800 6.000 1534 1122 A 45 ILE HD1% A 45 ILE HA 1.0 1.800 6.000 1535 1123 A 45 ILE HB A 45 ILE HD1% 1.0 1.800 6.000 1536 1124 A 45 ILE HD1% A 45 ILE HG1y 1.0 1.800 4.570 1537 1124 A 45 ILE HD1% A 45 ILE HG1x 1.0 1.800 4.570 1538 1125 A 45 ILE HD1% A 45 ILE HG2% 1.0 1.800 4.032 1539 1126 A 45 ILE HD1% A 62 LEU HBx 1.0 1.800 6.720 1540 1126 A 45 ILE HD1% A 62 LEU HBy 1.0 1.800 6.720 1541 1127 A 45 ILE HD1% A 62 LEU HG 1.0 1.800 6.000 1542 1128 A 45 ILE HB A 45 ILE HG1y 1.0 1.800 6.000 1543 1128 A 45 ILE HB A 45 ILE HG1x 1.0 1.800 6.000 1544 1129 A 40 VAL HGx% A 45 ILE HG2% 1.0 1.800 7.200 1545 1130 A 45 ILE HA A 45 ILE HG2% 1.0 1.800 4.080 1546 1131 A 45 ILE HB A 45 ILE HG2% 1.0 1.800 4.080 1547 1132 A 45 ILE HG2% A 62 LEU HA 1.0 1.800 6.000 1548 1133 A 45 ILE HG2% A 62 LEU HG 1.0 1.800 4.080 1549 1134 A 46 ASP HA A 46 ASP HBx 1.0 1.800 3.808 1550 1134 A 46 ASP HBy A 46 ASP HA 1.0 1.800 3.808 1551 1135 A 45 ILE HG2% A 47 LYS HA 1.0 1.800 6.000 1552 1136 A 47 LYS HA A 47 LYS HBy 1.0 1.800 3.808 1553 1136 A 47 LYS HBx A 47 LYS HA 1.0 1.800 3.808 1554 1137 A 47 LYS HA A 47 LYS HGy 1.0 1.800 5.600 1555 1137 A 47 LYS HGx A 47 LYS HA 1.0 1.800 5.600 1556 1138 A 108 ILE HD1% A 47 LYS HA 1.0 1.800 6.000 1557 1139 A 47 LYS HBy A 47 LYS HGy 1.0 1.800 6.272 1558 1139 A 47 LYS HBx A 47 LYS HGy 1.0 1.800 6.272 1559 1139 A 47 LYS HGx A 47 LYS HBy 1.0 1.800 6.272 1560 1139 A 47 LYS HBx A 47 LYS HGx 1.0 1.800 6.272 1561 1140 A 63 ILE HB A 47 LYS HBy 1.0 1.800 5.600 1562 1140 A 47 LYS HBx A 63 ILE HB 1.0 1.800 5.600 1563 1141 A 63 ILE HG2% A 47 LYS HBy 1.0 1.800 6.720 1564 1141 A 47 LYS HBx A 63 ILE HG2% 1.0 1.800 6.720 1565 1142 A 47 LYS HEx A 47 LYS HGy 1.0 1.800 6.272 1566 1142 A 47 LYS HE3 A 47 LYS HGy 1.0 1.800 6.272 1567 1142 A 47 LYS HGx A 47 LYS HEx 1.0 1.800 6.272 1568 1142 A 47 LYS HGx A 47 LYS HE3 1.0 1.800 6.272 1569 1143 A 63 ILE HB A 47 LYS HGy 1.0 1.800 5.600 1570 1143 A 47 LYS HGx A 63 ILE HB 1.0 1.800 5.600 1571 1144 A 63 ILE HD1% A 47 LYS HGy 1.0 1.800 6.720 1572 1144 A 47 LYS HGx A 63 ILE HD1% 1.0 1.800 6.720 1573 1145 A 48 LEU HA A 48 LEU HBx 1.0 1.800 5.600 1574 1145 A 48 LEU HBy A 48 LEU HA 1.0 1.800 5.600 1575 1146 A 62 LEU HA A 48 LEU HA 1.0 1.800 5.000 1576 1147 A 48 LEU HA A 62 LEU HDy% 1.0 1.800 6.000 1577 1148 A 48 LEU HG A 48 LEU HBx 1.0 1.800 3.808 1578 1148 A 48 LEU HBy A 48 LEU HG 1.0 1.800 3.808 1579 1149 A 108 ILE HD1% A 48 LEU HBx 1.0 1.800 6.720 1580 1149 A 108 ILE HD1% A 48 LEU HBy 1.0 1.800 6.720 1581 1150 A 48 LEU HG A 48 LEU HDx% 1.0 1.800 3.360 1582 1151 A 105 GLN HBy A 48 LEU HDx% 1.0 1.800 6.720 1583 1151 A 48 LEU HDx% A 105 GLN HBx 1.0 1.800 6.720 1584 1152 A 105 GLN HG3 A 48 LEU HDx% 1.0 1.800 6.720 1585 1152 A 48 LEU HDx% A 105 GLN HGx 1.0 1.800 6.720 1586 1153 A 48 LEU HA A 48 LEU HDy% 1.0 1.800 6.000 1587 1154 A 48 LEU HBx A 48 LEU HDy% 1.0 1.800 4.570 1588 1154 A 48 LEU HBy A 48 LEU HDy% 1.0 1.800 4.570 1589 1155 A 48 LEU HG A 48 LEU HDy% 1.0 1.800 3.360 1590 1156 A 105 GLN HA A 48 LEU HDy% 1.0 1.800 6.000 1591 1157 A 105 GLN HG3 A 48 LEU HDy% 1.0 1.800 6.720 1592 1157 A 48 LEU HDy% A 105 GLN HGx 1.0 1.800 6.720 1593 1158 A 48 LEU HG A 48 LEU HA 1.0 1.800 5.000 1594 1159 A 49 GLN HA A 49 GLN HBx 1.0 1.800 5.600 1595 1159 A 49 GLN HB3 A 49 GLN HA 1.0 1.800 5.600 1596 1160 A 49 GLN HA A 49 GLN HGx 1.0 1.800 5.600 1597 1160 A 49 GLN HG3 A 49 GLN HA 1.0 1.800 5.600 1598 1161 A 49 GLN HBx A 49 GLN HGx 1.0 1.800 6.272 1599 1161 A 49 GLN HB3 A 49 GLN HGx 1.0 1.800 6.272 1600 1161 A 49 GLN HG3 A 49 GLN HBx 1.0 1.800 6.272 1601 1161 A 49 GLN HB3 A 49 GLN HG3 1.0 1.800 6.272 1602 1162 A 50 ALA HB% A 50 ALA HA 1.0 1.800 3.360 1603 1163 A 50 ALA HB% A 60 LEU HA 1.0 1.800 6.000 1604 1164 A 50 ALA HB% A 60 LEU HDx% 1.0 1.800 4.032 1605 1165 A 50 ALA HB% A 101 LYS HEx 1.0 1.800 6.720 1606 1165 A 50 ALA HB% A 101 LYS HE3 1.0 1.800 6.720 1607 1166 A 51 THR HA A 51 THR HB 1.0 1.800 3.400 1608 1167 A 51 THR HA A 52 PRO HDy 1.0 1.800 3.808 1609 1167 A 52 PRO HDx A 51 THR HA 1.0 1.800 3.808 1610 1168 A 51 THR HA A 52 PRO HGx 1.0 1.800 3.808 1611 1168 A 52 PRO HG3 A 51 THR HA 1.0 1.800 3.808 1612 1169 A 51 THR HG2% A 51 THR HB 1.0 1.800 3.360 1613 1170 A 51 THR HB A 52 PRO HDy 1.0 1.800 5.600 1614 1170 A 52 PRO HDx A 51 THR HB 1.0 1.800 5.600 1615 1171 A 51 THR HB A 52 PRO HGx 1.0 1.800 5.600 1616 1171 A 52 PRO HG3 A 51 THR HB 1.0 1.800 5.600 1617 1172 A 51 THR HB A 55 SER HBy 1.0 1.800 5.600 1618 1172 A 55 SER HBx A 51 THR HB 1.0 1.800 5.600 1619 1173 A 51 THR HG2% A 51 THR HA 1.0 1.800 3.360 1620 1174 A 51 THR HG2% A 52 PRO HDy 1.0 1.800 6.720 1621 1174 A 52 PRO HDx A 51 THR HG2% 1.0 1.800 6.720 1622 1175 A 51 THR HG2% A 59 MET HA 1.0 1.800 6.000 1623 1176 A 51 THR HG2% A 59 MET HBy 1.0 1.800 6.720 1624 1176 A 59 MET HBx A 51 THR HG2% 1.0 1.800 6.720 1625 1177 A 51 THR HG2% A 59 MET HE% 1.0 1.800 4.032 1626 1178 A 52 PRO HA A 52 PRO HBy 1.0 1.800 3.808 1627 1178 A 52 PRO HA A 52 PRO HBx 1.0 1.800 3.808 1628 1179 A 52 PRO HA A 52 PRO HGx 1.0 1.800 3.808 1629 1179 A 52 PRO HA A 52 PRO HG3 1.0 1.800 3.808 1630 1180 A 52 PRO HA A 53 ALA HB% 1.0 1.800 6.000 1631 1181 A 53 ALA HB% A 54 SER HA 1.0 1.800 6.000 1632 1182 A 54 SER HA A 54 SER HBx 1.0 1.800 3.136 1633 1182 A 54 SER HBy A 54 SER HA 1.0 1.800 3.136 1634 1183 A 55 SER HA A 55 SER HBy 1.0 1.800 3.136 1635 1183 A 55 SER HBx A 55 SER HA 1.0 1.800 3.136 1636 1184 A 51 THR HG2% A 55 SER HBy 1.0 1.800 4.570 1637 1184 A 55 SER HBx A 51 THR HG2% 1.0 1.800 4.570 1638 1185 A 52 PRO HGx A 55 SER HBy 1.0 1.800 4.265 1639 1185 A 52 PRO HG3 A 55 SER HBy 1.0 1.800 4.265 1640 1185 A 55 SER HBx A 52 PRO HGx 1.0 1.800 4.265 1641 1185 A 52 PRO HG3 A 55 SER HBx 1.0 1.800 4.265 1642 1186 A 56 GLU HA A 56 GLU HBy 1.0 1.800 3.136 1643 1186 A 56 GLU HBx A 56 GLU HA 1.0 1.800 3.136 1644 1187 A 56 GLU HA A 56 GLU HGx 1.0 1.800 3.808 1645 1187 A 56 GLU HGy A 56 GLU HA 1.0 1.800 3.808 1646 1188 A 57 LYS HA A 57 LYS HDx 1.0 1.800 3.808 1647 1188 A 57 LYS HDy A 57 LYS HA 1.0 1.800 3.808 1648 1189 A 57 LYS HA A 57 LYS HEx 1.0 1.800 3.808 1649 1189 A 57 LYS HA A 57 LYS HEy 1.0 1.800 3.808 1650 1190 A 57 LYS HA A 57 LYS HGy 1.0 1.800 3.808 1651 1190 A 57 LYS HGx A 57 LYS HA 1.0 1.800 3.808 1652 1191 A 58 MET HA A 58 MET HBy 1.0 1.800 5.600 1653 1191 A 58 MET HA A 58 MET HBx 1.0 1.800 5.600 1654 1192 A 58 MET HE% A 58 MET HA 1.0 1.800 3.360 1655 1193 A 58 MET HA A 58 MET HG2 1.0 1.800 3.136 1656 1193 A 58 MET HGy A 58 MET HA 1.0 1.800 3.136 1657 1194 A 58 MET HE% A 94 ARG HA 1.0 1.800 6.000 1658 1195 A 59 MET HA A 59 MET HBy 1.0 1.800 5.600 1659 1195 A 59 MET HBx A 59 MET HA 1.0 1.800 5.600 1660 1196 A 59 MET HA A 59 MET HE% 1.0 1.800 6.000 1661 1197 A 59 MET HA A 59 MET HGx 1.0 1.800 5.600 1662 1197 A 59 MET HA A 59 MET HGy 1.0 1.800 5.600 1663 1198 A 90 SER HA A 59 MET HA 1.0 1.800 3.400 1664 1199 A 59 MET HE% A 59 MET HBy 1.0 1.800 6.720 1665 1199 A 59 MET HBx A 59 MET HE% 1.0 1.800 6.720 1666 1200 A 59 MET HE% A 57 LYS HEx 1.0 1.800 6.720 1667 1200 A 59 MET HE% A 57 LYS HEy 1.0 1.800 6.720 1668 1201 A 51 THR HG2% A 59 MET HGx 1.0 1.800 6.720 1669 1201 A 51 THR HG2% A 59 MET HGy 1.0 1.800 6.720 1670 1202 A 59 MET HE% A 59 MET HGx 1.0 1.800 6.720 1671 1202 A 59 MET HGy A 59 MET HE% 1.0 1.800 6.720 1672 1203 A 90 SER HA A 59 MET HGx 1.0 1.800 5.600 1673 1203 A 90 SER HA A 59 MET HGy 1.0 1.800 5.600 1674 1204 A 60 LEU HA A 60 LEU HBx 1.0 1.800 5.600 1675 1204 A 60 LEU HA A 60 LEU HBy 1.0 1.800 5.600 1676 1205 A 60 LEU HDx% A 60 LEU HBx 1.0 1.800 6.720 1677 1205 A 60 LEU HDx% A 60 LEU HBy 1.0 1.800 6.720 1678 1206 A 91 PHE HE% A 60 LEU HBx 1.0 1.800 6.272 1679 1206 A 60 LEU HBy A 91 PHE HE% 1.0 1.800 6.272 1680 1207 A 60 LEU HDx% A 50 ALA HA 1.0 1.800 4.080 1681 1208 A 60 LEU HA A 60 LEU HDx% 1.0 1.800 4.080 1682 1209 A 60 LEU HDx% A 60 LEU HDy% 1.0 1.800 4.032 1683 1210 A 60 LEU HDx% A 60 LEU HG 1.0 1.800 4.080 1684 1211 A 60 LEU HDx% A 91 PHE HE% 1.0 1.800 6.720 1685 1212 A 60 LEU HDx% A 91 PHE HZ 1.0 1.800 6.000 1686 1213 A 60 LEU HDx% A 101 LYS HA 1.0 1.800 6.000 1687 1214 A 50 ALA HB% A 60 LEU HDy% 1.0 1.800 4.896 1688 1215 A 60 LEU HA A 60 LEU HDy% 1.0 1.800 6.000 1689 1216 A 60 LEU HDy% A 91 PHE HE% 1.0 1.800 4.570 1690 1217 A 60 LEU HDy% A 91 PHE HZ 1.0 1.800 6.000 1691 1218 A 60 LEU HDy% A 97 MET HA 1.0 1.800 6.000 1692 1219 A 60 LEU HDy% A 101 LYS HA 1.0 1.800 4.080 1693 1220 A 60 LEU HA A 60 LEU HG 1.0 1.800 5.000 1694 1221 A 60 LEU HDy% A 60 LEU HG 1.0 1.800 4.080 1695 1222 A 91 PHE HE% A 60 LEU HG 1.0 1.800 5.600 1696 1223 A 61 ARG HA A 61 ARG HBx 1.0 1.800 5.600 1697 1223 A 61 ARG HA A 61 ARG HBy 1.0 1.800 5.600 1698 1224 A 61 ARG HA A 62 LEU HDx% 1.0 1.800 6.000 1699 1225 A 61 ARG HA A 88 MET HBy 1.0 1.800 5.600 1700 1225 A 61 ARG HA A 88 MET HBx 1.0 1.800 5.600 1701 1226 A 61 ARG HA A 88 MET HGy 1.0 1.800 5.600 1702 1226 A 61 ARG HA A 88 MET HGx 1.0 1.800 5.600 1703 1227 A 62 LEU HA A 62 LEU HBx 1.0 1.800 5.600 1704 1227 A 62 LEU HA A 62 LEU HBy 1.0 1.800 5.600 1705 1228 A 45 ILE HD1% A 62 LEU HDx% 1.0 1.800 4.896 1706 1229 A 62 LEU HA A 62 LEU HDx% 1.0 1.800 4.080 1707 1230 A 62 LEU HDx% A 62 LEU HBx 1.0 1.800 3.763 1708 1230 A 62 LEU HDx% A 62 LEU HBy 1.0 1.800 3.763 1709 1231 A 62 LEU HDx% A 62 LEU HG 1.0 1.800 3.360 1710 1232 A 89 PHE HD% A 62 LEU HDx% 1.0 1.800 6.720 1711 1233 A 40 VAL HGy% A 62 LEU HDy% 1.0 1.800 7.200 1712 1234 A 62 LEU HA A 62 LEU HDy% 1.0 1.800 4.080 1713 1235 A 62 LEU HDy% A 62 LEU HBx 1.0 1.800 3.763 1714 1235 A 62 LEU HBy A 62 LEU HDy% 1.0 1.800 3.763 1715 1236 A 62 LEU HDx% A 62 LEU HDy% 1.0 1.800 4.032 1716 1237 A 62 LEU HDy% A 62 LEU HG 1.0 1.800 3.360 1717 1238 A 87 HIS HD2 A 62 LEU HDy% 1.0 1.800 4.080 1718 1239 A 48 LEU HA A 62 LEU HG 1.0 1.800 5.000 1719 1240 A 62 LEU HA A 62 LEU HG 1.0 1.800 5.000 1720 1241 A 63 ILE HA A 86 ARG HA 1.0 1.800 3.400 1721 1242 A 63 ILE HA A 86 ARG HGx 1.0 1.800 5.600 1722 1242 A 63 ILE HA A 86 ARG HGy 1.0 1.800 5.600 1723 1243 A 63 ILE HB A 63 ILE HD1% 1.0 1.800 6.000 1724 1244 A 63 ILE HB A 63 ILE HG1x 1.0 1.800 3.808 1725 1244 A 63 ILE HB A 63 ILE HG13 1.0 1.800 3.808 1726 1245 A 63 ILE HB A 63 ILE HG2% 1.0 1.800 3.360 1727 1246 A 63 ILE HD1% A 47 LYS HBy 1.0 1.800 6.720 1728 1246 A 47 LYS HBx A 63 ILE HD1% 1.0 1.800 6.720 1729 1247 A 63 ILE HD1% A 47 LYS HEx 1.0 1.800 6.720 1730 1247 A 63 ILE HD1% A 47 LYS HE3 1.0 1.800 6.720 1731 1248 A 63 ILE HD1% A 63 ILE HA 1.0 1.800 3.360 1732 1249 A 63 ILE HD1% A 63 ILE HG1x 1.0 1.800 3.763 1733 1249 A 63 ILE HD1% A 63 ILE HG13 1.0 1.800 3.763 1734 1250 A 63 ILE HD1% A 63 ILE HG2% 1.0 1.800 4.032 1735 1251 A 63 ILE HD1% A 84 PRO HGx 1.0 1.800 3.763 1736 1251 A 63 ILE HD1% A 84 PRO HG3 1.0 1.800 3.763 1737 1252 A 63 ILE HD1% A 86 ARG HA 1.0 1.800 6.000 1738 1253 A 63 ILE HD1% A 86 ARG HBx 1.0 1.800 6.720 1739 1253 A 63 ILE HD1% A 86 ARG HBy 1.0 1.800 6.720 1740 1254 A 63 ILE HD1% A 86 ARG HDx 1.0 1.800 4.570 1741 1254 A 63 ILE HD1% A 86 ARG HDy 1.0 1.800 4.570 1742 1255 A 63 ILE HD1% A 86 ARG HGx 1.0 1.800 4.570 1743 1255 A 63 ILE HD1% A 86 ARG HGy 1.0 1.800 4.570 1744 1256 A 63 ILE HG2% A 46 ASP HBx 1.0 1.800 6.720 1745 1256 A 46 ASP HBy A 63 ILE HG2% 1.0 1.800 6.720 1746 1257 A 63 ILE HA A 63 ILE HG2% 1.0 1.800 3.360 1747 1258 A 63 ILE HG2% A 63 ILE HG1x 1.0 1.800 3.763 1748 1258 A 63 ILE HG13 A 63 ILE HG2% 1.0 1.800 3.763 1749 1259 A 63 ILE HG2% A 84 PRO HA 1.0 1.800 6.000 1750 1260 A 63 ILE HG2% A 84 PRO HBy 1.0 1.800 4.570 1751 1260 A 63 ILE HG2% A 84 PRO HBx 1.0 1.800 4.570 1752 1261 A 63 ILE HG2% A 84 PRO HGx 1.0 1.800 3.763 1753 1261 A 63 ILE HG2% A 84 PRO HG3 1.0 1.800 3.763 1754 1262 A 63 ILE HG2% A 86 ARG HA 1.0 1.800 6.000 1755 1263 A 63 ILE HG2% A 86 ARG HGx 1.0 1.800 6.720 1756 1263 A 63 ILE HG2% A 86 ARG HGy 1.0 1.800 6.720 1757 1264 A 45 ILE HA A 64 GLY HAy 1.0 1.800 3.808 1758 1264 A 45 ILE HA A 64 GLY HAx 1.0 1.800 3.808 1759 1265 A 45 ILE HD1% A 64 GLY HAy 1.0 1.800 6.720 1760 1265 A 45 ILE HD1% A 64 GLY HAx 1.0 1.800 6.720 1761 1266 A 65 LYS HA A 46 ASP HA 1.0 1.800 5.000 1762 1267 A 65 LYS HA A 46 ASP HBx 1.0 1.800 3.808 1763 1267 A 46 ASP HBy A 65 LYS HA 1.0 1.800 3.808 1764 1268 A 65 LYS HA A 65 LYS HBx 1.0 1.800 5.600 1765 1268 A 65 LYS HBy A 65 LYS HA 1.0 1.800 5.600 1766 1269 A 65 LYS HA A 65 LYS HGx 1.0 1.800 5.600 1767 1269 A 65 LYS HA A 65 LYS HGy 1.0 1.800 5.600 1768 1270 A 65 LYS HBx A 65 LYS HGx 1.0 1.800 6.272 1769 1270 A 65 LYS HGy A 65 LYS HBx 1.0 1.800 6.272 1770 1270 A 65 LYS HBy A 65 LYS HGy 1.0 1.800 6.272 1771 1270 A 65 LYS HBy A 65 LYS HGx 1.0 1.800 6.272 1772 1271 A 65 LYS HA A 65 LYS HDx 1.0 1.800 5.600 1773 1271 A 65 LYS HD3 A 65 LYS HA 1.0 1.800 5.600 1774 1272 A 46 ASP HA A 65 LYS HEy 1.0 1.800 5.600 1775 1272 A 46 ASP HA A 65 LYS HEx 1.0 1.800 5.600 1776 1273 A 65 LYS HA A 65 LYS HEy 1.0 1.800 5.600 1777 1273 A 65 LYS HA A 65 LYS HEx 1.0 1.800 5.600 1778 1274 A 65 LYS HBy A 65 LYS HEy 1.0 1.800 6.272 1779 1274 A 65 LYS HBx A 65 LYS HEy 1.0 1.800 6.272 1780 1274 A 65 LYS HEx A 65 LYS HBx 1.0 1.800 6.272 1781 1274 A 65 LYS HBy A 65 LYS HEx 1.0 1.800 6.272 1782 1275 A 46 ASP HA A 65 LYS HGx 1.0 1.800 5.600 1783 1275 A 65 LYS HGy A 46 ASP HA 1.0 1.800 5.600 1784 1276 A 46 ASP HBx A 65 LYS HGx 1.0 1.800 6.272 1785 1276 A 46 ASP HBy A 65 LYS HGx 1.0 1.800 6.272 1786 1276 A 65 LYS HGy A 46 ASP HBx 1.0 1.800 6.272 1787 1276 A 46 ASP HBy A 65 LYS HGy 1.0 1.800 6.272 1788 1277 A 65 LYS HEy A 65 LYS HGx 1.0 1.800 6.272 1789 1277 A 65 LYS HEx A 65 LYS HGx 1.0 1.800 6.272 1790 1277 A 65 LYS HGy A 65 LYS HEy 1.0 1.800 6.272 1791 1277 A 65 LYS HGy A 65 LYS HEx 1.0 1.800 6.272 1792 1278 A 66 VAL HB A 66 VAL HA 1.0 1.800 2.800 1793 1279 A 66 VAL HB A 84 PRO HA 1.0 1.800 3.400 1794 1280 A 67 ASP HA A 67 ASP HBx 1.0 1.800 3.808 1795 1280 A 67 ASP HBy A 67 ASP HA 1.0 1.800 3.808 1796 1281 A 68 GLU HA A 68 GLU HBy 1.0 1.800 3.808 1797 1281 A 68 GLU HBx A 68 GLU HA 1.0 1.800 3.808 1798 1282 A 68 GLU HA A 81 VAL HG2% 1.0 1.800 6.000 1799 1283 A 68 GLU HA A 68 GLU HGx 1.0 1.800 5.600 1800 1283 A 68 GLU HGy A 68 GLU HA 1.0 1.800 5.600 1801 1284 A 68 GLU HBx A 68 GLU HGx 1.0 1.800 3.512 1802 1284 A 68 GLU HBy A 68 GLU HGx 1.0 1.800 3.512 1803 1284 A 68 GLU HGy A 68 GLU HBy 1.0 1.800 3.512 1804 1284 A 68 GLU HBx A 68 GLU HGy 1.0 1.800 3.512 1805 1285 A 69 SER HA A 69 SER HBy 1.0 1.800 3.136 1806 1285 A 69 SER HBx A 69 SER HA 1.0 1.800 3.136 1807 1286 A 70 LYS HA A 70 LYS HBx 1.0 1.800 3.136 1808 1286 A 70 LYS HBy A 70 LYS HA 1.0 1.800 3.136 1809 1287 A 70 LYS HA A 70 LYS HDx 1.0 1.800 3.136 1810 1287 A 70 LYS HD3 A 70 LYS HA 1.0 1.800 3.136 1811 1288 A 70 LYS HA A 70 LYS HGy 1.0 1.800 3.808 1812 1288 A 70 LYS HGx A 70 LYS HA 1.0 1.800 3.808 1813 1289 A 71 LYS HA A 71 LYS HDx 1.0 1.800 3.808 1814 1289 A 71 LYS HA A 71 LYS HD3 1.0 1.800 3.808 1815 1290 A 71 LYS HA A 71 LYS HGx 1.0 1.800 3.808 1816 1290 A 71 LYS HG3 A 71 LYS HA 1.0 1.800 3.808 1817 1291 A 71 LYS HA A 81 VAL HG2% 1.0 1.800 6.000 1818 1292 A 71 LYS HA A 82 PRO HDx 1.0 1.800 5.600 1819 1292 A 71 LYS HA A 82 PRO HDy 1.0 1.800 5.600 1820 1293 A 72 ARG HA A 72 ARG HBy 1.0 1.800 3.136 1821 1293 A 72 ARG HBx A 72 ARG HA 1.0 1.800 3.136 1822 1294 A 72 ARG HBy A 72 ARG HD2 1.0 1.800 4.265 1823 1294 A 72 ARG HDy A 72 ARG HBy 1.0 1.800 4.265 1824 1294 A 72 ARG HBx A 72 ARG HDy 1.0 1.800 4.265 1825 1294 A 72 ARG HBx A 72 ARG HD2 1.0 1.800 4.265 1826 1295 A 72 ARG HA A 72 ARG HD2 1.0 1.800 5.600 1827 1295 A 72 ARG HA A 72 ARG HDy 1.0 1.800 5.600 1828 1296 A 72 ARG HA A 72 ARG HGx 1.0 1.800 3.808 1829 1296 A 72 ARG HG3 A 72 ARG HA 1.0 1.800 3.808 1830 1297 A 72 ARG HDy A 72 ARG HGx 1.0 1.800 3.512 1831 1297 A 72 ARG HD2 A 72 ARG HGx 1.0 1.800 3.512 1832 1297 A 72 ARG HG3 A 72 ARG HD2 1.0 1.800 3.512 1833 1297 A 72 ARG HG3 A 72 ARG HDy 1.0 1.800 3.512 1834 1298 A 73 LYS HA A 73 LYS HBx 1.0 1.800 3.136 1835 1298 A 73 LYS HA A 73 LYS HB3 1.0 1.800 3.136 1836 1299 A 73 LYS HA A 73 LYS HDx 1.0 1.800 3.808 1837 1299 A 73 LYS HA A 73 LYS HD3 1.0 1.800 3.808 1838 1300 A 73 LYS HA A 73 LYS HGx 1.0 1.800 5.600 1839 1300 A 73 LYS HGy A 73 LYS HA 1.0 1.800 5.600 1840 1301 A 73 LYS HA A 79 GLU HA 1.0 1.800 2.800 1841 1302 A 80 VAL HG2% A 73 LYS HA 1.0 1.800 4.080 1842 1303 A 74 ASP HA A 74 ASP HBx 1.0 1.800 3.136 1843 1303 A 74 ASP HBy A 74 ASP HA 1.0 1.800 3.136 1844 1304 A 80 VAL HG2% A 74 ASP HA 1.0 1.800 4.080 1845 1305 A 80 VAL HG2% A 74 ASP HBx 1.0 1.800 6.720 1846 1305 A 80 VAL HG2% A 74 ASP HBy 1.0 1.800 6.720 1847 1306 A 75 ASN HA A 75 ASN HB2 1.0 1.800 3.136 1848 1306 A 75 ASN HBy A 75 ASN HA 1.0 1.800 3.136 1849 1307 A 75 ASN HB2 A 76 GLU HG2 1.0 1.800 6.272 1850 1307 A 75 ASN HBy A 76 GLU HG2 1.0 1.800 6.272 1851 1307 A 76 GLU HGy A 75 ASN HB2 1.0 1.800 6.272 1852 1307 A 75 ASN HBy A 76 GLU HGy 1.0 1.800 6.272 1853 1308 A 76 GLU HA A 76 GLU HG2 1.0 1.800 3.136 1854 1308 A 76 GLU HA A 76 GLU HGy 1.0 1.800 3.136 1855 1309 A 73 LYS HB3 A 77 GLY HAx 1.0 1.800 6.272 1856 1309 A 73 LYS HBx A 77 GLY HAx 1.0 1.800 6.272 1857 1309 A 77 GLY HAy A 73 LYS HBx 1.0 1.800 6.272 1858 1309 A 73 LYS HB3 A 77 GLY HAy 1.0 1.800 6.272 1859 1310 A 73 LYS HDx A 77 GLY HAx 1.0 1.800 6.272 1860 1310 A 73 LYS HD3 A 77 GLY HAx 1.0 1.800 6.272 1861 1310 A 77 GLY HAy A 73 LYS HDx 1.0 1.800 6.272 1862 1310 A 73 LYS HD3 A 77 GLY HAy 1.0 1.800 6.272 1863 1311 A 78 ASN HA A 78 ASN HBy 1.0 1.800 3.808 1864 1311 A 78 ASN HBx A 78 ASN HA 1.0 1.800 3.808 1865 1312 A 80 VAL HG2% A 78 ASN HBy 1.0 1.800 6.720 1866 1312 A 80 VAL HG2% A 78 ASN HBx 1.0 1.800 6.720 1867 1313 A 79 GLU HA A 73 LYS HGx 1.0 1.800 5.600 1868 1313 A 73 LYS HGy A 79 GLU HA 1.0 1.800 5.600 1869 1314 A 79 GLU HA A 79 GLU HBx 1.0 1.800 3.136 1870 1314 A 79 GLU HA A 79 GLU HB3 1.0 1.800 3.136 1871 1315 A 80 VAL HG2% A 79 GLU HA 1.0 1.800 6.000 1872 1316 A 73 LYS HA A 79 GLU HBx 1.0 1.800 5.600 1873 1316 A 73 LYS HA A 79 GLU HB3 1.0 1.800 5.600 1874 1317 A 73 LYS HEx A 79 GLU HBx 1.0 1.800 6.272 1875 1317 A 73 LYS HE3 A 79 GLU HBx 1.0 1.800 6.272 1876 1317 A 79 GLU HB3 A 73 LYS HEx 1.0 1.800 6.272 1877 1317 A 79 GLU HB3 A 73 LYS HE3 1.0 1.800 6.272 1878 1318 A 79 GLU HBx A 79 GLU HGx 1.0 1.800 3.512 1879 1318 A 79 GLU HGy A 79 GLU HBx 1.0 1.800 3.512 1880 1318 A 79 GLU HB3 A 79 GLU HGy 1.0 1.800 3.512 1881 1318 A 79 GLU HB3 A 79 GLU HGx 1.0 1.800 3.512 1882 1319 A 79 GLU HA A 79 GLU HGx 1.0 1.800 5.600 1883 1319 A 79 GLU HA A 79 GLU HGy 1.0 1.800 5.600 1884 1320 A 80 VAL HB A 80 VAL HA 1.0 1.800 2.800 1885 1321 A 81 VAL HG2% A 80 VAL HA 1.0 1.800 4.080 1886 1322 A 80 VAL HG2% A 80 VAL HB 1.0 1.800 3.360 1887 1323 A 80 VAL HG2% A 72 ARG HD2 1.0 1.800 4.570 1888 1323 A 80 VAL HG2% A 72 ARG HDy 1.0 1.800 4.570 1889 1324 A 80 VAL HG2% A 82 PRO HA 1.0 1.800 6.000 1890 1325 A 81 VAL HA A 71 LYS HGx 1.0 1.800 5.600 1891 1325 A 71 LYS HG3 A 81 VAL HA 1.0 1.800 5.600 1892 1326 A 81 VAL HA A 82 PRO HDx 1.0 1.800 3.136 1893 1326 A 82 PRO HDy A 81 VAL HA 1.0 1.800 3.136 1894 1327 A 81 VAL HG2% A 81 VAL HA 1.0 1.800 3.360 1895 1328 A 81 VAL HG2% A 82 PRO HDx 1.0 1.800 6.720 1896 1328 A 81 VAL HG2% A 82 PRO HDy 1.0 1.800 6.720 1897 1329 A 82 PRO HA A 82 PRO HGx 1.0 1.800 3.808 1898 1329 A 82 PRO HGy A 82 PRO HA 1.0 1.800 3.808 1899 1330 A 83 LYS HA A 83 LYS HBx 1.0 1.800 3.136 1900 1330 A 83 LYS HB3 A 83 LYS HA 1.0 1.800 3.136 1901 1331 A 83 LYS HA A 83 LYS HGx 1.0 1.800 3.808 1902 1331 A 83 LYS HG3 A 83 LYS HA 1.0 1.800 3.808 1903 1332 A 83 LYS HA A 84 PRO HDx 1.0 1.800 3.136 1904 1332 A 83 LYS HA A 84 PRO HDy 1.0 1.800 3.136 1905 1333 A 84 PRO HA A 84 PRO HBy 1.0 1.800 3.136 1906 1333 A 84 PRO HBx A 84 PRO HA 1.0 1.800 3.136 1907 1334 A 84 PRO HA A 84 PRO HGx 1.0 1.800 3.808 1908 1334 A 84 PRO HA A 84 PRO HG3 1.0 1.800 3.808 1909 1335 A 84 PRO HBy A 84 PRO HDx 1.0 1.800 6.272 1910 1335 A 84 PRO HBx A 84 PRO HDx 1.0 1.800 6.272 1911 1335 A 84 PRO HDy A 84 PRO HBy 1.0 1.800 6.272 1912 1335 A 84 PRO HBx A 84 PRO HDy 1.0 1.800 6.272 1913 1336 A 85 GLN HA A 85 GLN HBy 1.0 1.800 3.136 1914 1336 A 85 GLN HA A 85 GLN HBx 1.0 1.800 3.136 1915 1337 A 85 GLN HA A 85 GLN HGx 1.0 1.800 3.808 1916 1337 A 85 GLN HGy A 85 GLN HA 1.0 1.800 3.808 1917 1338 A 85 GLN HBx A 85 GLN HGx 1.0 1.800 4.265 1918 1338 A 85 GLN HBy A 85 GLN HGx 1.0 1.800 4.265 1919 1338 A 85 GLN HGy A 85 GLN HBy 1.0 1.800 4.265 1920 1338 A 85 GLN HGy A 85 GLN HBx 1.0 1.800 4.265 1921 1339 A 86 ARG HA A 86 ARG HBx 1.0 1.800 5.600 1922 1339 A 86 ARG HA A 86 ARG HBy 1.0 1.800 5.600 1923 1340 A 63 ILE HG2% A 86 ARG HDx 1.0 1.800 6.720 1924 1340 A 63 ILE HG2% A 86 ARG HDy 1.0 1.800 6.720 1925 1341 A 9 PHE HE% A 87 HIS HA 1.0 1.800 5.600 1926 1342 A 87 HIS HA A 87 HIS HBy 1.0 1.800 5.600 1927 1342 A 87 HIS HBx A 87 HIS HA 1.0 1.800 5.600 1928 1343 A 45 ILE HD1% A 87 HIS HD2 1.0 1.800 4.080 1929 1344 A 87 HIS HD2 A 62 LEU HBx 1.0 1.800 5.600 1930 1344 A 62 LEU HBy A 87 HIS HD2 1.0 1.800 5.600 1931 1345 A 62 LEU HDx% A 87 HIS HD2 1.0 1.800 6.000 1932 1346 A 87 HIS HD2 A 62 LEU HG 1.0 1.800 5.000 1933 1347 A 87 HIS HD2 A 86 ARG HA 1.0 1.800 5.000 1934 1348 A 87 HIS HD2 A 87 HIS HBy 1.0 1.800 5.600 1935 1348 A 87 HIS HD2 A 87 HIS HBx 1.0 1.800 5.600 1936 1349 A 61 ARG HA A 88 MET HA 1.0 1.800 3.400 1937 1350 A 88 MET HA A 88 MET HGy 1.0 1.800 5.600 1938 1350 A 88 MET HA A 88 MET HGx 1.0 1.800 5.600 1939 1351 A 88 MET HA A 88 MET HBy 1.0 1.800 5.600 1940 1351 A 88 MET HA A 88 MET HBx 1.0 1.800 5.600 1941 1352 A 88 MET HBy A 88 MET HGy 1.0 1.800 4.265 1942 1352 A 88 MET HBx A 88 MET HGy 1.0 1.800 4.265 1943 1352 A 88 MET HGx A 88 MET HBy 1.0 1.800 4.265 1944 1352 A 88 MET HBx A 88 MET HGx 1.0 1.800 4.265 1945 1353 A 88 MET HA A 88 MET HE% 1.0 1.800 6.000 1946 1354 A 88 MET HE% A 88 MET HBy 1.0 1.800 4.570 1947 1354 A 88 MET HBx A 88 MET HE% 1.0 1.800 4.570 1948 1355 A 88 MET HE% A 88 MET HGy 1.0 1.800 3.763 1949 1355 A 88 MET HGx A 88 MET HE% 1.0 1.800 3.763 1950 1356 A 89 PHE HA A 89 PHE HBx 1.0 1.800 5.600 1951 1356 A 89 PHE HBy A 89 PHE HA 1.0 1.800 5.600 1952 1357 A 89 PHE HD% A 16 ILE HD1% 1.0 1.800 6.720 1953 1358 A 89 PHE HD% A 89 PHE HA 1.0 1.800 5.600 1954 1359 A 89 PHE HD% A 89 PHE HBx 1.0 1.800 6.272 1955 1359 A 89 PHE HD% A 89 PHE HBy 1.0 1.800 6.272 1956 1360 A 89 PHE HD% A 89 PHE HE% 1.0 1.800 4.265 1957 1361 A 89 PHE HE% A 29 TRP HBx 1.0 1.800 6.272 1958 1361 A 29 TRP HBy A 89 PHE HE% 1.0 1.800 6.272 1959 1362 A 40 VAL HGy% A 89 PHE HE% 1.0 1.800 6.720 1960 1363 A 62 LEU HDx% A 89 PHE HE% 1.0 1.800 6.720 1961 1364 A 89 PHE HE% A 89 PHE HZ 1.0 1.800 3.808 1962 1365 A 89 PHE HD% A 89 PHE HZ 1.0 1.800 5.600 1963 1366 A 90 SER HA A 90 SER HBx 1.0 1.800 5.600 1964 1366 A 90 SER HBy A 90 SER HA 1.0 1.800 5.600 1965 1367 A 90 SER HA A 91 PHE HD% 1.0 1.800 5.600 1966 1368 A 59 MET HA A 90 SER HBx 1.0 1.800 5.600 1967 1368 A 90 SER HBy A 59 MET HA 1.0 1.800 5.600 1968 1369 A 59 MET HE% A 90 SER HBx 1.0 1.800 6.720 1969 1369 A 90 SER HBy A 59 MET HE% 1.0 1.800 6.720 1970 1370 A 59 MET HGx A 90 SER HBx 1.0 1.800 6.272 1971 1370 A 59 MET HGy A 90 SER HBx 1.0 1.800 6.272 1972 1370 A 90 SER HBy A 59 MET HGx 1.0 1.800 6.272 1973 1370 A 90 SER HBy A 59 MET HGy 1.0 1.800 6.272 1974 1371 A 91 PHE HA A 91 PHE HBy 1.0 1.800 5.600 1975 1371 A 91 PHE HA A 91 PHE HBx 1.0 1.800 5.600 1976 1372 A 59 MET HA A 91 PHE HD% 1.0 1.800 5.600 1977 1373 A 91 PHE HA A 91 PHE HD% 1.0 1.800 5.600 1978 1374 A 91 PHE HD% A 91 PHE HBy 1.0 1.800 6.272 1979 1374 A 91 PHE HD% A 91 PHE HBx 1.0 1.800 6.272 1980 1375 A 91 PHE HD% A 91 PHE HE% 1.0 1.800 4.265 1981 1376 A 91 PHE HE% A 16 ILE HG2% 1.0 1.800 6.720 1982 1377 A 91 PHE HE% A 91 PHE HZ 1.0 1.800 3.808 1983 1378 A 91 PHE HE% A 97 MET HBx 1.0 1.800 6.272 1984 1378 A 91 PHE HE% A 97 MET HBy 1.0 1.800 6.272 1985 1379 A 91 PHE HE% A 100 ILE HB 1.0 1.800 3.808 1986 1380 A 100 ILE HD1% A 91 PHE HE% 1.0 1.800 6.720 1987 1381 A 92 ASN HA A 92 ASN HB2 1.0 1.800 3.136 1988 1381 A 92 ASN HBy A 92 ASN HA 1.0 1.800 3.136 1989 1382 A 93 ASN HA A 93 ASN HBx 1.0 1.800 3.808 1990 1382 A 93 ASN HBy A 93 ASN HA 1.0 1.800 3.808 1991 1383 A 94 ARG HA A 94 ARG HDy 1.0 1.800 5.600 1992 1383 A 94 ARG HA A 94 ARG HDx 1.0 1.800 5.600 1993 1384 A 94 ARG HA A 97 MET HBx 1.0 1.800 5.600 1994 1384 A 94 ARG HA A 97 MET HBy 1.0 1.800 5.600 1995 1385 A 95 THR HB A 95 THR HA 1.0 1.800 2.800 1996 1386 A 95 THR HA A 98 ASP HBx 1.0 1.800 5.600 1997 1386 A 95 THR HA A 98 ASP HBy 1.0 1.800 5.600 1998 1387 A 95 THR HG2% A 95 THR HA 1.0 1.800 3.360 1999 1388 A 95 THR HB A 95 THR HG2% 1.0 1.800 3.360 2000 1389 A 96 VAL HB A 96 VAL HA 1.0 1.800 5.000 2001 1390 A 96 VAL HA A 99 ASN HBx 1.0 1.800 5.600 2002 1390 A 96 VAL HA A 99 ASN HBy 1.0 1.800 5.600 2003 1391 A 96 VAL HB A 93 ASN HBx 1.0 1.800 5.600 2004 1391 A 93 ASN HBy A 96 VAL HB 1.0 1.800 5.600 2005 1392 A 96 VAL HGy% A 96 VAL HB 1.0 1.800 3.360 2006 1393 A 96 VAL HGx% A 93 ASN HA 1.0 1.800 6.000 2007 1394 A 96 VAL HGx% A 93 ASN HBx 1.0 1.800 4.570 2008 1394 A 93 ASN HBy A 96 VAL HGx% 1.0 1.800 4.570 2009 1395 A 96 VAL HGx% A 96 VAL HB 1.0 1.800 3.360 2010 1396 A 6 ALA HB% A 96 VAL HGy% 1.0 1.800 4.896 2011 1397 A 96 VAL HGy% A 91 PHE HD% 1.0 1.800 4.570 2012 1398 A 96 VAL HGy% A 91 PHE HE% 1.0 1.800 6.720 2013 1399 A 96 VAL HGy% A 93 ASN HBx 1.0 1.800 6.720 2014 1399 A 96 VAL HGy% A 93 ASN HBy 1.0 1.800 6.720 2015 1400 A 50 ALA HB% A 97 MET HE% 1.0 1.800 7.200 2016 1401 A 94 ARG HA A 97 MET HE% 1.0 1.800 6.000 2017 1402 A 98 ASP HA A 98 ASP HBx 1.0 1.800 3.808 2018 1402 A 98 ASP HBy A 98 ASP HA 1.0 1.800 3.808 2019 1403 A 98 ASP HA A 101 LYS HBy 1.0 1.800 3.808 2020 1403 A 98 ASP HA A 101 LYS HBx 1.0 1.800 3.808 2021 1404 A 98 ASP HA A 101 LYS HEx 1.0 1.800 5.600 2022 1404 A 98 ASP HA A 101 LYS HE3 1.0 1.800 5.600 2023 1405 A 99 ASN HA A 99 ASN HBx 1.0 1.800 3.808 2024 1405 A 99 ASN HBy A 99 ASN HA 1.0 1.800 3.808 2025 1406 A 99 ASN HA A 102 MET HBx 1.0 1.800 5.600 2026 1406 A 99 ASN HA A 102 MET HBy 1.0 1.800 5.600 2027 1407 A 100 ILE HA A 18 ILE HD1% 1.0 1.800 4.080 2028 1408 A 100 ILE HB A 100 ILE HA 1.0 1.800 5.000 2029 1409 A 100 ILE HA A 100 ILE HG1y 1.0 1.800 5.600 2030 1409 A 100 ILE HA A 100 ILE HG1x 1.0 1.800 5.600 2031 1410 A 100 ILE HB A 100 ILE HG1y 1.0 1.800 5.600 2032 1410 A 100 ILE HB A 100 ILE HG1x 1.0 1.800 5.600 2033 1411 A 3 HIS HA A 100 ILE HD1% 1.0 1.800 6.000 2034 1412 A 100 ILE HD1% A 4 SER HBx 1.0 1.800 6.720 2035 1412 A 4 SER HBy A 100 ILE HD1% 1.0 1.800 6.720 2036 1413 A 100 ILE HD1% A 5 GLY HAy 1.0 1.800 6.720 2037 1413 A 100 ILE HD1% A 5 GLY HAx 1.0 1.800 6.720 2038 1414 A 100 ILE HD1% A 16 ILE HB 1.0 1.800 6.000 2039 1415 A 100 ILE HD1% A 16 ILE HD1% 1.0 1.800 4.896 2040 1416 A 100 ILE HD1% A 91 PHE HZ 1.0 1.800 4.080 2041 1417 A 100 ILE HD1% A 100 ILE HA 1.0 1.800 3.360 2042 1418 A 100 ILE HD1% A 100 ILE HB 1.0 1.800 6.000 2043 1419 A 100 ILE HD1% A 100 ILE HG1y 1.0 1.800 4.570 2044 1419 A 100 ILE HD1% A 100 ILE HG1x 1.0 1.800 4.570 2045 1420 A 16 ILE HD1% A 100 ILE HG2% 1.0 1.800 4.896 2046 1421 A 91 PHE HE% A 100 ILE HG2% 1.0 1.800 6.720 2047 1422 A 100 ILE HG2% A 91 PHE HZ 1.0 1.800 4.080 2048 1423 A 101 LYS HA A 48 LEU HDx% 1.0 1.800 6.000 2049 1424 A 101 LYS HA A 48 LEU HDy% 1.0 1.800 6.000 2050 1425 A 101 LYS HA A 101 LYS HBy 1.0 1.800 3.808 2051 1425 A 101 LYS HBx A 101 LYS HA 1.0 1.800 3.808 2052 1426 A 101 LYS HA A 104 LEU HDy% 1.0 1.800 6.000 2053 1427 A 102 MET HA A 102 MET HBx 1.0 1.800 3.808 2054 1427 A 102 MET HBy A 102 MET HA 1.0 1.800 3.808 2055 1428 A 102 MET HA A 105 GLN HGx 1.0 1.800 5.600 2056 1428 A 102 MET HA A 105 GLN HG3 1.0 1.800 5.600 2057 1429 A 99 ASN HA A 102 MET HE% 1.0 1.800 6.000 2058 1430 A 102 MET HA A 102 MET HE% 1.0 1.800 6.000 2059 1431 A 102 MET HE% A 102 MET HGx 1.0 1.800 6.720 2060 1431 A 102 MET HGy A 102 MET HE% 1.0 1.800 6.720 2061 1432 A 102 MET HA A 102 MET HGx 1.0 1.800 5.600 2062 1432 A 102 MET HGy A 102 MET HA 1.0 1.800 5.600 2063 1433 A 102 MET HBx A 102 MET HGx 1.0 1.800 4.265 2064 1433 A 102 MET HBy A 102 MET HGx 1.0 1.800 4.265 2065 1433 A 102 MET HGy A 102 MET HBx 1.0 1.800 4.265 2066 1433 A 102 MET HBy A 102 MET HGy 1.0 1.800 4.265 2067 1434 A 100 ILE HA A 103 THR HB 1.0 1.800 5.000 2068 1435 A 100 ILE HD1% A 103 THR HB 1.0 1.800 6.000 2069 1436 A 3 HIS HA A 103 THR HG2% 1.0 1.800 6.000 2070 1437 A 3 HIS HD2 A 103 THR HG2% 1.0 1.800 6.000 2071 1438 A 18 ILE HB A 103 THR HG2% 1.0 1.800 6.000 2072 1439 A 100 ILE HD1% A 103 THR HG2% 1.0 1.800 7.200 2073 1440 A 103 THR HA A 103 THR HG2% 1.0 1.800 3.360 2074 1441 A 103 THR HB A 103 THR HG2% 1.0 1.800 3.360 2075 1442 A 103 THR HG2% A 107 ILE HD1% 1.0 1.800 4.032 2076 1443 A 104 LEU HA A 107 ILE HB 1.0 1.800 5.000 2077 1444 A 104 LEU HA A 107 ILE HD1% 1.0 1.800 6.000 2078 1445 A 104 LEU HBx A 48 LEU HDy% 1.0 1.800 6.720 2079 1445 A 48 LEU HDy% A 104 LEU HBy 1.0 1.800 6.720 2080 1446 A 104 LEU HA A 104 LEU HDx% 1.0 1.800 3.360 2081 1447 A 107 ILE HB A 104 LEU HDx% 1.0 1.800 6.000 2082 1448 A 27 LEU HDx% A 104 LEU HDy% 1.0 1.800 4.032 2083 1449 A 27 LEU HDy% A 104 LEU HDy% 1.0 1.800 4.896 2084 1450 A 62 LEU HDx% A 104 LEU HDy% 1.0 1.800 4.032 2085 1451 A 62 LEU HDy% A 104 LEU HDy% 1.0 1.800 4.032 2086 1452 A 105 GLN HA A 108 ILE HB 1.0 1.800 5.000 2087 1453 A 108 ILE HD1% A 105 GLN HA 1.0 1.800 4.080 2088 1454 A 105 GLN HA A 108 ILE HG2% 1.0 1.800 4.080 2089 1455 A 105 GLN HBy A 48 LEU HDy% 1.0 1.800 4.570 2090 1455 A 48 LEU HDy% A 105 GLN HBx 1.0 1.800 4.570 2091 1456 A 102 MET HA A 105 GLN HBx 1.0 1.800 5.600 2092 1456 A 102 MET HA A 105 GLN HBy 1.0 1.800 5.600 2093 1457 A 105 GLN HA A 105 GLN HBx 1.0 1.800 5.600 2094 1457 A 105 GLN HBy A 105 GLN HA 1.0 1.800 5.600 2095 1458 A 105 GLN HA A 105 GLN HGx 1.0 1.800 3.808 2096 1458 A 105 GLN HG3 A 105 GLN HA 1.0 1.800 3.808 2097 1459 A 103 THR HA A 106 GLN HBx 1.0 1.800 5.600 2098 1459 A 103 THR HA A 106 GLN HBy 1.0 1.800 5.600 2099 1460 A 106 GLN HA A 106 GLN HBx 1.0 1.800 3.808 2100 1460 A 106 GLN HBy A 106 GLN HA 1.0 1.800 3.808 2101 1461 A 106 GLN HBy A 106 GLN HGy 1.0 1.800 4.265 2102 1461 A 106 GLN HBx A 106 GLN HGy 1.0 1.800 4.265 2103 1461 A 106 GLN HGx A 106 GLN HBx 1.0 1.800 4.265 2104 1461 A 106 GLN HGx A 106 GLN HBy 1.0 1.800 4.265 2105 1462 A 103 THR HA A 106 GLN HGy 1.0 1.800 5.600 2106 1462 A 106 GLN HGx A 103 THR HA 1.0 1.800 5.600 2107 1463 A 106 GLN HA A 106 GLN HGy 1.0 1.800 3.808 2108 1463 A 106 GLN HGx A 106 GLN HA 1.0 1.800 3.808 2109 1464 A 107 ILE HB A 107 ILE HA 1.0 1.800 5.000 2110 1465 A 107 ILE HA A 110 ARG HGy 1.0 1.800 5.600 2111 1465 A 107 ILE HA A 110 ARG HGx 1.0 1.800 5.600 2112 1466 A 25 ALA HB% A 107 ILE HG2% 1.0 1.800 4.032 2113 1467 A 107 ILE HG2% A 42 LEU HA 1.0 1.800 6.000 2114 1468 A 104 LEU HA A 107 ILE HG2% 1.0 1.800 6.000 2115 1469 A 107 ILE HA A 107 ILE HG2% 1.0 1.800 3.360 2116 1470 A 107 ILE HG2% A 108 ILE HA 1.0 1.800 6.000 2117 1471 A 107 ILE HG2% A 111 TYR HD% 1.0 1.800 6.720 2118 1472 A 111 TYR HE% A 107 ILE HG2% 1.0 1.800 3.763 2119 1473 A 108 ILE HB A 108 ILE HA 1.0 1.800 5.000 2120 1474 A 108 ILE HD1% A 108 ILE HA 1.0 1.800 6.000 2121 1475 A 108 ILE HA A 108 ILE HG13 1.0 1.800 5.600 2122 1475 A 108 ILE HA A 108 ILE HG1x 1.0 1.800 5.600 2123 1476 A 108 ILE HD1% A 108 ILE HB 1.0 1.800 4.080 2124 1477 A 108 ILE HB A 108 ILE HG2% 1.0 1.800 3.360 2125 1478 A 45 ILE HB A 108 ILE HD1% 1.0 1.800 6.000 2126 1479 A 108 ILE HD1% A 48 LEU HA 1.0 1.800 6.000 2127 1480 A 108 ILE HD1% A 48 LEU HDx% 1.0 1.800 4.032 2128 1481 A 108 ILE HD1% A 48 LEU HG 1.0 1.800 6.000 2129 1482 A 108 ILE HD1% A 104 LEU HBy 1.0 1.800 6.720 2130 1482 A 108 ILE HD1% A 104 LEU HBx 1.0 1.800 6.720 2131 1483 A 108 ILE HD1% A 108 ILE HG13 1.0 1.800 3.763 2132 1483 A 108 ILE HD1% A 108 ILE HG1x 1.0 1.800 3.763 2133 1484 A 108 ILE HD1% A 108 ILE HG2% 1.0 1.800 4.032 2134 1485 A 45 ILE HB A 108 ILE HG2% 1.0 1.800 6.000 2135 1486 A 47 LYS HA A 108 ILE HG2% 1.0 1.800 6.000 2136 1487 A 108 ILE HG13 A 108 ILE HG2% 1.0 1.800 3.763 2137 1487 A 108 ILE HG2% A 108 ILE HG1x 1.0 1.800 3.763 2138 1488 A 109 SER HA A 108 ILE HG2% 1.0 1.800 6.000 2139 1489 A 109 SER HBy A 108 ILE HG2% 1.0 1.800 6.720 2140 1489 A 108 ILE HG2% A 109 SER HBx 1.0 1.800 6.720 2141 1490 A 109 SER HA A 109 SER HBx 1.0 1.800 3.136 2142 1490 A 109 SER HBy A 109 SER HA 1.0 1.800 3.136 2143 1491 A 109 SER HA A 112 LYS HBx 1.0 1.800 3.808 2144 1491 A 109 SER HA A 112 LYS HB3 1.0 1.800 3.808 2145 1492 A 109 SER HA A 112 LYS HDx 1.0 1.800 5.600 2146 1492 A 109 SER HA A 112 LYS HD3 1.0 1.800 5.600 2147 1493 A 109 SER HA A 112 LYS HGx 1.0 1.800 5.600 2148 1493 A 109 SER HA A 112 LYS HGy 1.0 1.800 5.600 2149 1494 A 109 SER HBx A 110 ARG HB2 1.0 1.800 6.272 2150 1494 A 109 SER HBy A 110 ARG HB2 1.0 1.800 6.272 2151 1494 A 110 ARG HBy A 109 SER HBx 1.0 1.800 6.272 2152 1494 A 109 SER HBy A 110 ARG HBy 1.0 1.800 6.272 2153 1495 A 109 SER HBy A 112 LYS HBx 1.0 1.800 6.272 2154 1495 A 112 LYS HB3 A 109 SER HBx 1.0 1.800 6.272 2155 1495 A 109 SER HBy A 112 LYS HB3 1.0 1.800 6.272 2156 1495 A 109 SER HBx A 112 LYS HBx 1.0 1.800 6.272 2157 1496 A 110 ARG HA A 110 ARG HB2 1.0 1.800 3.136 2158 1496 A 110 ARG HBy A 110 ARG HA 1.0 1.800 3.136 2159 1497 A 110 ARG HA A 110 ARG HGy 1.0 1.800 3.808 2160 1497 A 110 ARG HGx A 110 ARG HA 1.0 1.800 3.808 2161 1498 A 25 ALA HB% A 110 ARG HDx 1.0 1.800 3.763 2162 1498 A 25 ALA HB% A 110 ARG HDy 1.0 1.800 3.763 2163 1499 A 107 ILE HA A 110 ARG HDx 1.0 1.800 5.600 2164 1499 A 107 ILE HA A 110 ARG HDy 1.0 1.800 5.600 2165 1500 A 107 ILE HG2% A 110 ARG HDx 1.0 1.800 6.720 2166 1500 A 107 ILE HG2% A 110 ARG HDy 1.0 1.800 6.720 2167 1501 A 110 ARG HA A 110 ARG HDx 1.0 1.800 5.600 2168 1501 A 110 ARG HDy A 110 ARG HA 1.0 1.800 5.600 2169 1502 A 111 TYR HE% A 110 ARG HDx 1.0 1.800 6.272 2170 1502 A 111 TYR HE% A 110 ARG HDy 1.0 1.800 6.272 2171 1503 A 111 TYR HA A 111 TYR HBx 1.0 1.800 3.808 2172 1503 A 111 TYR HBy A 111 TYR HA 1.0 1.800 3.808 2173 1504 A 111 TYR HE% A 111 TYR HA 1.0 1.800 5.600 2174 1505 A 114 ALA HB% A 111 TYR HA 1.0 1.800 6.000 2175 1506 A 108 ILE HA A 111 TYR HD% 1.0 1.800 5.600 2176 1507 A 111 TYR HD% A 111 TYR HA 1.0 1.800 3.808 2177 1508 A 111 TYR HD% A 111 TYR HBx 1.0 1.800 6.272 2178 1508 A 111 TYR HD% A 111 TYR HBy 1.0 1.800 6.272 2179 1509 A 111 TYR HE% A 111 TYR HD% 1.0 1.800 3.512 2180 1510 A 112 LYS HA A 112 LYS HBx 1.0 1.800 3.136 2181 1510 A 112 LYS HA A 112 LYS HB3 1.0 1.800 3.136 2182 1511 A 112 LYS HA A 112 LYS HGx 1.0 1.800 3.808 2183 1511 A 112 LYS HA A 112 LYS HGy 1.0 1.800 3.808 2184 1512 A 112 LYS HA A 115 ASP HBy 1.0 1.800 3.808 2185 1512 A 112 LYS HA A 115 ASP HBx 1.0 1.800 3.808 2186 1513 A 112 LYS HB3 A 112 LYS HEx 1.0 1.800 6.272 2187 1513 A 112 LYS HBx A 112 LYS HEx 1.0 1.800 6.272 2188 1513 A 112 LYS HE3 A 112 LYS HBx 1.0 1.800 6.272 2189 1513 A 112 LYS HB3 A 112 LYS HE3 1.0 1.800 6.272 2190 1514 A 112 LYS HBx A 112 LYS HDx 1.0 1.800 3.512 2191 1514 A 112 LYS HB3 A 112 LYS HDx 1.0 1.800 3.512 2192 1514 A 112 LYS HD3 A 112 LYS HBx 1.0 1.800 3.512 2193 1514 A 112 LYS HB3 A 112 LYS HD3 1.0 1.800 3.512 2194 1515 A 112 LYS HDx A 112 LYS HEx 1.0 1.800 3.512 2195 1515 A 112 LYS HD3 A 112 LYS HEx 1.0 1.800 3.512 2196 1515 A 112 LYS HE3 A 112 LYS HDx 1.0 1.800 3.512 2197 1515 A 112 LYS HD3 A 112 LYS HE3 1.0 1.800 3.512 2198 1516 A 112 LYS HD3 A 112 LYS HGx 1.0 1.800 3.512 2199 1516 A 112 LYS HGy A 112 LYS HDx 1.0 1.800 3.512 2200 1516 A 112 LYS HD3 A 112 LYS HGy 1.0 1.800 3.512 2201 1516 A 112 LYS HDx A 112 LYS HGx 1.0 1.800 3.512 2202 1517 A 112 LYS HA A 112 LYS HEx 1.0 1.800 5.600 2203 1517 A 112 LYS HA A 112 LYS HE3 1.0 1.800 5.600 2204 1518 A 112 LYS HGy A 108 ILE HG2% 1.0 1.800 6.720 2205 1518 A 108 ILE HG2% A 112 LYS HGx 1.0 1.800 6.720 2206 1519 A 112 LYS HBx A 112 LYS HGx 1.0 1.800 3.512 2207 1519 A 112 LYS HB3 A 112 LYS HGx 1.0 1.800 3.512 2208 1519 A 112 LYS HGy A 112 LYS HBx 1.0 1.800 3.512 2209 1519 A 112 LYS HB3 A 112 LYS HGy 1.0 1.800 3.512 2210 1520 A 112 LYS HE3 A 112 LYS HGx 1.0 1.800 4.265 2211 1520 A 112 LYS HEx A 112 LYS HGx 1.0 1.800 4.265 2212 1520 A 112 LYS HGy A 112 LYS HEx 1.0 1.800 4.265 2213 1520 A 112 LYS HGy A 112 LYS HE3 1.0 1.800 4.265 2214 1521 A 114 ALA HB% A 114 ALA HA 1.0 1.800 3.360 2215 1522 A 111 TYR HD% A 114 ALA HB% 1.0 1.800 6.720 2216 1523 A 114 ALA HB% A 115 ASP HA 1.0 1.800 6.000 2217 1524 A 115 ASP HA A 115 ASP HBy 1.0 1.800 3.136 2218 1524 A 115 ASP HBx A 115 ASP HA 1.0 1.800 3.136 2219 1525 A 25 ALA H A 24 PRO HA 1.0 1.800 3.000 2220 1526 A 25 ALA H A 24 PRO HBx 1.0 1.992 4.000 2221 1526 A 25 ALA H A 24 PRO HBy 1.0 1.992 4.000 2222 1527 A 50 ALA HB% A 51 THR H 1.0 2.040 3.600 2223 1528 A 51 THR H A 51 THR HG2% 1.0 2.120 4.400 2224 1529 A 55 SER H A 57 LYS H 1.0 2.800 6.000 2225 1530 A 61 ARG H A 49 GLN HBx 1.0 1.992 4.000 2226 1530 A 49 GLN HB3 A 61 ARG H 1.0 1.992 4.000 2227 1531 A 75 ASN H A 74 ASP HA 1.0 1.800 3.000 2228 1532 A 108 ILE H A 108 ILE HG13 1.0 2.064 3.400 2229 1532 A 108 ILE H A 108 ILE HG1x 1.0 2.064 3.400 2230 1533 A 109 SER H A 108 ILE HG13 1.0 1.992 4.000 2231 1533 A 109 SER H A 108 ILE HG1x 1.0 1.992 4.000 2232 1534 A 110 ARG H A 110 ARG HGy 1.0 1.992 4.000 2233 1534 A 110 ARG HGx A 110 ARG H 1.0 1.992 4.000 2234 1535 A 111 TYR H A 110 ARG HB2 1.0 2.064 3.400 2235 1535 A 111 TYR H A 110 ARG HBy 1.0 2.064 3.400 2236 1536 A 109 SER HA A 112 LYS H 1.0 2.000 3.600 2237 1537 A 113 ASP H A 112 LYS HBx 1.0 2.064 3.400 2238 1537 A 112 LYS HB3 A 113 ASP H 1.0 2.064 3.400 2239 1538 A 113 ASP H A 112 LYS HGx 1.0 1.992 4.000 2240 1538 A 113 ASP H A 112 LYS HGy 1.0 1.992 4.000 2241 1539 A 111 TYR HE% A 24 PRO HBx 1.0 2.028 6.500 2242 1539 A 111 TYR HE% A 24 PRO HBy 1.0 2.028 6.500 2243 1540 A 111 TYR HE% A 42 LEU HDx% 1.0 2.230 5.000 2244 1541 A 43 SER HA A 111 TYR HBx 1.0 2.200 6.000 2245 1541 A 43 SER HA A 111 TYR HBy 1.0 2.200 6.000 2246 1542 A 60 LEU HA A 50 ALA HA 1.0 2.200 5.400 2247 1543 A 67 ASP HA A 66 VAL HA 1.0 2.200 5.400 2248 1544 A 108 ILE HA A 108 ILE HG2% 1.0 2.040 3.600 2249 1545 A 108 ILE HA A 111 TYR HBx 1.0 2.200 6.000 2250 1545 A 108 ILE HA A 111 TYR HBy 1.0 2.200 6.000 2251 1546 A 111 TYR HE% A 108 ILE HA 1.0 2.200 6.000 2252 1547 A 107 ILE HA A 110 ARG HB2 1.0 2.200 6.000 2253 1547 A 107 ILE HA A 110 ARG HBy 1.0 2.200 6.000 2254 1548 A 112 LYS HE3 A 108 ILE HG2% 1.0 2.230 5.000 2255 1548 A 108 ILE HG2% A 112 LYS HEx 1.0 2.230 5.000 2256 1549 A 110 ARG HA A 113 ASP HBx 1.0 2.200 6.000 2257 1549 A 113 ASP HBy A 110 ARG HA 1.0 2.200 6.000 2258 1550 A 76 GLU H A 74 ASP HA 1.0 1.800 5.000 2259 1551 A 75 ASN H A 76 GLU H 1.0 1.800 3.400 2260 1552 A 66 VAL H A 66 VAL HGx% 1.0 1.800 4.080 2261 1552 A 66 VAL H A 66 VAL HGy% 1.0 1.800 4.080 2262 1553 A 67 ASP H A 66 VAL HGx% 1.0 1.800 5.000 2263 1553 A 67 ASP H A 66 VAL HGy% 1.0 1.800 5.000 2264 1554 A 66 VAL HA A 66 VAL HGx% 1.0 1.800 3.360 2265 1554 A 66 VAL HA A 66 VAL HGy% 1.0 1.800 3.360 2266 1555 A 66 VAL HB A 66 VAL HGx% 1.0 1.800 3.360 2267 1555 A 66 VAL HB A 66 VAL HGy% 1.0 1.800 3.360 2268 1556 A 83 LYS HA A 66 VAL HGx% 1.0 1.800 6.000 2269 1556 A 83 LYS HA A 66 VAL HGy% 1.0 1.800 6.000 2270 1557 A 84 PRO HA A 66 VAL HGx% 1.0 1.800 6.000 2271 1557 A 84 PRO HA A 66 VAL HGy% 1.0 1.800 6.000 2272 1558 A 66 VAL HGx% A 84 PRO HDx 1.0 1.800 6.720 2273 1558 A 66 VAL HGy% A 84 PRO HDx 1.0 1.800 6.720 2274 1558 A 84 PRO HDy A 66 VAL HGx% 1.0 1.800 6.720 2275 1558 A 84 PRO HDy A 66 VAL HGy% 1.0 1.800 6.720 2276 1559 A 68 GLU HA A 66 VAL HGx% 1.0 1.800 6.000 2277 1559 A 68 GLU HA A 66 VAL HGy% 1.0 1.800 6.000 2278 1560 A 84 PRO HA A 66 VAL HGx% 1.0 1.800 4.080 2279 1560 A 84 PRO HA A 66 VAL HGy% 1.0 1.800 4.080 2280 1561 A 66 VAL HGy% A 84 PRO HBy 1.0 1.800 4.570 2281 1561 A 66 VAL HGx% A 84 PRO HBy 1.0 1.800 4.570 2282 1561 A 84 PRO HBx A 66 VAL HGx% 1.0 1.800 4.570 2283 1561 A 84 PRO HBx A 66 VAL HGy% 1.0 1.800 4.570 2284 1562 A 66 VAL HGy% A 84 PRO HDx 1.0 1.800 6.720 2285 1562 A 66 VAL HGx% A 84 PRO HDx 1.0 1.800 6.720 2286 1562 A 84 PRO HDy A 66 VAL HGx% 1.0 1.800 6.720 2287 1562 A 84 PRO HDy A 66 VAL HGy% 1.0 1.800 6.720 2288 1563 A 84 PRO HA A 66 VAL HA 1.0 1.800 3.400 2289 1564 A 66 VAL HA A 84 PRO HBy 1.0 1.800 5.600 2290 1564 A 84 PRO HBx A 66 VAL HA 1.0 1.800 5.600 2291 1565 A 67 ASP H A 66 VAL HA 1.0 1.800 2.800 2292 1566 A 48 LEU HA B 98 VAL HGx% 1.0 1.800 6.000 2293 1566 A 48 LEU HA B 98 VAL HGy% 1.0 1.800 6.000 2294 1567 A 48 LEU HBx B 98 VAL HGx% 1.0 1.800 6.000 2295 1567 B 98 VAL HGy% A 48 LEU HBx 1.0 1.800 6.000 2296 1567 A 48 LEU HBy B 98 VAL HGy% 1.0 1.800 6.000 2297 1567 A 48 LEU HBy B 98 VAL HGx% 1.0 1.800 6.000 2298 1568 A 48 LEU HG B 98 VAL HGx% 1.0 1.800 6.000 2299 1568 A 48 LEU HG B 98 VAL HGy% 1.0 1.800 6.000 2300 1569 A 48 LEU HDy% B 98 VAL HGx% 1.0 1.800 6.000 2301 1569 B 98 VAL HGy% A 48 LEU HDy% 1.0 1.800 6.000 2302 1569 B 98 VAL HGy% A 48 LEU HDx% 1.0 1.800 6.000 2303 1569 A 48 LEU HDx% B 98 VAL HGx% 1.0 1.800 6.000 2304 1570 A 47 LYS HA B 99 THR HG2% 1.0 1.800 6.000 2305 1571 B 99 THR HG2% A 112 LYS HEx 1.0 1.800 6.000 2306 1571 A 112 LYS HE3 B 99 THR HG2% 1.0 1.800 6.000 2307 1572 B 99 THR HG2% A 112 LYS HDx 1.0 1.800 6.000 2308 1572 A 112 LYS HD3 B 99 THR HG2% 1.0 1.800 6.000 2309 1573 A 88 MET HE% B 95 PHE HD% 1.0 1.800 6.000 2310 1574 A 59 MET HE% B 95 PHE HZ 1.0 1.800 6.000 2311 1575 A 59 MET HE% B 95 PHE HE% 1.0 1.800 6.000 2312 1576 A 88 MET HE% B 95 PHE HE% 1.0 1.800 6.000 2313 1577 A 88 MET HE% B 95 PHE HZ 1.0 1.800 6.000 2314 1578 A 51 THR HG2% B 95 PHE HZ 1.0 1.800 6.000 2315 1579 B 95 PHE HZ A 59 MET HBy 1.0 1.800 6.000 2316 1579 A 59 MET HBx B 95 PHE HZ 1.0 1.800 6.000 2317 1580 B 95 PHE HZ A 59 MET HGx 1.0 1.800 6.000 2318 1580 A 59 MET HGy B 95 PHE HZ 1.0 1.800 6.000 2319 1581 A 59 MET HE% B 95 PHE HBx 1.0 1.800 6.000 2320 1581 A 59 MET HE% B 95 PHE HBy 1.0 1.800 6.000 2321 1582 A 88 MET HE% B 95 PHE HBx 1.0 1.800 6.000 2322 1582 A 88 MET HE% B 95 PHE HBy 1.0 1.800 6.000 2323 1583 A 50 ALA HA B 98 VAL HGx% 1.0 1.800 6.000 2324 1583 A 50 ALA HA B 98 VAL HGy% 1.0 1.800 6.000 2325 1584 A 50 ALA HB% B 98 VAL HGx% 1.0 1.800 6.000 2326 1584 A 50 ALA HB% B 98 VAL HGy% 1.0 1.800 6.000 2327 1585 A 105 GLN HA B 98 VAL HGx% 1.0 1.800 6.000 2328 1585 A 105 GLN HA B 98 VAL HGy% 1.0 1.800 6.000 2329 1586 A 105 GLN HBx B 98 VAL HGx% 1.0 1.800 6.000 2330 1586 A 105 GLN HBy B 98 VAL HGx% 1.0 1.800 6.000 2331 1586 B 98 VAL HGy% A 105 GLN HBx 1.0 1.800 6.000 2332 1586 A 105 GLN HBy B 98 VAL HGy% 1.0 1.800 6.000 2333 1587 A 105 GLN HG3 B 98 VAL HGx% 1.0 1.800 6.000 2334 1587 A 105 GLN HGx B 98 VAL HGx% 1.0 1.800 6.000 2335 1587 B 98 VAL HGy% A 105 GLN HGx 1.0 1.800 6.000 2336 1587 A 105 GLN HG3 B 98 VAL HGy% 1.0 1.800 6.000 2337 1588 B 99 THR HG2% A 108 ILE HG1x 1.0 1.800 6.000 2338 1588 B 99 THR HG2% A 108 ILE HG2% 1.0 1.800 6.000 2339 1588 B 99 THR HG2% A 108 ILE HG13 1.0 1.800 6.000 2340 1589 A 108 ILE HD1% B 99 THR HG2% 1.0 1.800 6.000 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin 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 8 ILE H A 90 SER O 1.0 1.3 2.5 2 2 A 90 SER O A 8 ILE N 1.0 2.3 3.5 3 3 A 15 ILE H A 30 ARG O 1.0 1.3 2.5 4 4 A 30 ARG O A 15 ILE N 1.0 2.3 3.5 5 5 A 16 ILE H A 5 GLY O 1.0 1.3 2.5 6 6 A 5 GLY O A 16 ILE N 1.0 2.3 3.5 7 7 A 17 ALA H A 28 THR O 1.0 1.3 2.5 8 8 A 28 THR O A 17 ALA N 1.0 2.3 3.5 9 9 A 26 GLU H A 19 ASN O 1.0 1.3 2.5 10 10 A 19 ASN O A 26 GLU N 1.0 2.3 3.5 11 11 A 27 LEU H A 40 VAL O 1.0 1.3 2.5 12 12 A 40 VAL O A 27 LEU N 1.0 2.3 3.5 13 13 A 28 THR H A 17 ALA O 1.0 1.3 2.5 14 14 A 17 ALA O A 28 THR N 1.0 2.3 3.5 15 15 A 29 TRP H A 38 HIS O 1.0 1.3 2.5 16 16 A 38 HIS O A 29 TRP N 1.0 2.3 3.5 17 17 A 30 ARG H A 15 ILE O 1.0 1.3 2.5 18 18 A 15 ILE O A 30 ARG N 1.0 2.3 3.5 19 19 A 38 HIS H A 29 TRP O 1.0 1.3 2.5 20 20 A 29 TRP O A 38 HIS N 1.0 2.3 3.5 21 21 A 40 VAL H A 27 LEU O 1.0 1.3 2.5 22 22 A 27 LEU O A 40 VAL N 1.0 2.3 3.5 23 23 A 49 GLN H A 61 ARG O 1.0 1.3 2.5 24 24 A 61 ARG O A 49 GLN N 1.0 2.3 3.5 25 25 A 60 LEU H A 89 PHE O 1.0 1.3 2.5 26 26 A 89 PHE O A 60 LEU N 1.0 2.3 3.5 27 27 A 61 ARG H A 49 GLN O 1.0 1.3 2.5 28 28 A 49 GLN O A 61 ARG N 1.0 2.3 3.5 29 29 A 62 LEU H A 87 HIS O 1.0 1.3 2.5 30 30 A 87 HIS O A 62 LEU N 1.0 2.3 3.5 31 31 A 63 ILE H A 47 LYS O 1.0 1.3 2.5 32 32 A 47 LYS O A 63 ILE N 1.0 2.3 3.5 33 33 A 89 PHE H A 60 LEU O 1.0 1.3 2.5 34 34 A 60 LEU O A 89 PHE N 1.0 2.3 3.5 35 35 A 90 SER H A 8 ILE O 1.0 1.3 2.5 36 36 A 8 ILE O A 90 SER N 1.0 2.3 3.5 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 1 PRO C A 2 SER N A 2 SER CA A 2 SER C 1.0 -116.8 -55.0 PHI 2 2 A 2 SER N A 2 SER CA A 2 SER C A 3 HIS N 1.0 -68.8 30.8 PSI 3 3 A 5 GLY C A 6 ALA N A 6 ALA CA A 6 ALA C 1.0 -120.0 -72.0 PHI 4 4 A 6 ALA N A 6 ALA CA A 6 ALA C A 7 ALA N 1.0 100.0 176.0 PSI 5 5 A 6 ALA C A 7 ALA N A 7 ALA CA A 7 ALA C 1.0 -162.7 -102.7 PHI 6 6 A 7 ALA N A 7 ALA CA A 7 ALA C A 8 ILE N 1.0 111.0 170.6 PSI 7 7 A 7 ALA C A 8 ILE N A 8 ILE CA A 8 ILE C 1.0 -147.6 -78.6 PHI 8 8 A 8 ILE N A 8 ILE CA A 8 ILE C A 9 PHE N 1.0 101.9 145.1 PSI 9 9 A 8 ILE C A 9 PHE N A 9 PHE CA A 9 PHE C 1.0 -172.6 -103.6 PHI 10 10 A 9 PHE N A 9 PHE CA A 9 PHE C A 10 GLU N 1.0 106.0 146.0 PSI 11 11 A 11 LYS C A 12 VAL N A 12 VAL CA A 12 VAL C 1.0 -148.3 -61.9 PHI 12 12 A 12 VAL N A 12 VAL CA A 12 VAL C A 13 SER N 1.0 117.9 157.9 PSI 13 13 A 14 GLY C A 15 ILE N A 15 ILE CA A 15 ILE C 1.0 -140.3 -99.7 PHI 14 14 A 15 ILE N A 15 ILE CA A 15 ILE C A 16 ILE N 1.0 121.4 162.4 PSI 15 15 A 15 ILE C A 16 ILE N A 16 ILE CA A 16 ILE C 1.0 -162.5 -95.5 PHI 16 16 A 16 ILE N A 16 ILE CA A 16 ILE C A 17 ALA N 1.0 110.1 166.1 PSI 17 17 A 16 ILE C A 17 ALA N A 17 ALA CA A 17 ALA C 1.0 -162.1 -82.9 PHI 18 18 A 17 ALA N A 17 ALA CA A 17 ALA C A 18 ILE N 1.0 104.9 163.1 PSI 19 19 A 17 ALA C A 18 ILE N A 18 ILE CA A 18 ILE C 1.0 -143.4 -59.6 PHI 20 20 A 18 ILE N A 18 ILE CA A 18 ILE C A 19 ASN N 1.0 90.3 150.1 PSI 21 21 A 18 ILE C A 19 ASN N A 19 ASN CA A 19 ASN C 1.0 -142.1 -64.1 PHI 22 22 A 19 ASN N A 19 ASN CA A 19 ASN C A 20 GLU N 1.0 92.9 166.7 PSI 23 23 A 25 ALA C A 26 GLU N A 26 GLU CA A 26 GLU C 1.0 -159.0 -111.0 PHI 24 24 A 26 GLU N A 26 GLU CA A 26 GLU C A 27 LEU N 1.0 132.0 172.0 PSI 25 25 A 26 GLU C A 27 LEU N A 27 LEU CA A 27 LEU C 1.0 -156.9 -116.9 PHI 26 26 A 27 LEU N A 27 LEU CA A 27 LEU C A 28 THR N 1.0 110.5 150.5 PSI 27 27 A 27 LEU C A 28 THR N A 28 THR CA A 28 THR C 1.0 -145.0 -69.4 PHI 28 28 A 28 THR N A 28 THR CA A 28 THR C A 29 TRP N 1.0 104.1 144.1 PSI 29 29 A 28 THR C A 29 TRP N A 29 TRP CA A 29 TRP C 1.0 -131.6 -89.6 PHI 30 30 A 29 TRP N A 29 TRP CA A 29 TRP C A 30 ARG N 1.0 110.6 150.6 PSI 31 31 A 29 TRP C A 30 ARG N A 30 ARG CA A 30 ARG C 1.0 -162.3 -82.7 PHI 32 32 A 30 ARG N A 30 ARG CA A 30 ARG C A 31 SER N 1.0 112.9 157.5 PSI 33 33 A 30 ARG C A 31 SER N A 31 SER CA A 31 SER C 1.0 -87.4 -47.4 PHI 34 34 A 31 SER N A 31 SER CA A 31 SER C A 32 THR N 1.0 126.9 168.9 PSI 35 35 A 35 ASP C A 36 LYS N A 36 LYS CA A 36 LYS C 1.0 -177.0 -81.0 PHI 36 36 A 36 LYS N A 36 LYS CA A 36 LYS C A 37 VAL N 1.0 135.0 175.0 PSI 37 37 A 36 LYS C A 37 VAL N A 37 VAL CA A 37 VAL C 1.0 -143.6 -103.6 PHI 38 38 A 37 VAL N A 37 VAL CA A 37 VAL C A 38 HIS N 1.0 109.4 157.4 PSI 39 39 A 37 VAL C A 38 HIS N A 38 HIS CA A 38 HIS C 1.0 -177.2 -81.0 PHI 40 40 A 38 HIS N A 38 HIS CA A 38 HIS C A 39 THR N 1.0 104.3 146.5 PSI 41 41 A 38 HIS C A 39 THR N A 39 THR CA A 39 THR C 1.0 -137.7 -97.7 PHI 42 42 A 39 THR N A 39 THR CA A 39 THR C A 40 VAL N 1.0 102.3 146.7 PSI 43 43 A 39 THR C A 40 VAL N A 40 VAL CA A 40 VAL C 1.0 -149.9 -90.5 PHI 44 44 A 40 VAL N A 40 VAL CA A 40 VAL C A 41 VAL N 1.0 96.3 161.7 PSI 45 45 A 40 VAL C A 41 VAL N A 41 VAL CA A 41 VAL C 1.0 -99.4 -40.6 PHI 46 46 A 41 VAL N A 41 VAL CA A 41 VAL C A 42 LEU N 1.0 90.4 172.0 PSI 47 47 A 41 VAL C A 42 LEU N A 42 LEU CA A 42 LEU C 1.0 -75.0 -34.8 PHI 48 48 A 42 LEU N A 42 LEU CA A 42 LEU C A 43 SER N 1.0 -58.1 -15.9 PSI 49 49 A 46 ASP C A 47 LYS N A 47 LYS CA A 47 LYS C 1.0 -187.0 -119.0 PHI 50 50 A 47 LYS N A 47 LYS CA A 47 LYS C A 48 LEU N 1.0 140.0 180.0 PSI 51 51 A 47 LYS C A 48 LEU N A 48 LEU CA A 48 LEU C 1.0 -149.0 -109.0 PHI 52 52 A 48 LEU N A 48 LEU CA A 48 LEU C A 49 GLN N 1.0 116.4 162.6 PSI 53 53 A 48 LEU C A 49 GLN N A 49 GLN CA A 49 GLN C 1.0 -152.0 -106.2 PHI 54 54 A 49 GLN N A 49 GLN CA A 49 GLN C A 50 ALA N 1.0 131.5 173.9 PSI 55 55 A 49 GLN C A 50 ALA N A 50 ALA CA A 50 ALA C 1.0 -161.5 -104.5 PHI 56 56 A 50 ALA N A 50 ALA CA A 50 ALA C A 51 THR N 1.0 116.6 156.6 PSI 57 57 A 50 ALA C A 51 THR N A 51 THR CA A 51 THR C 1.0 -155.6 -40.8 PHI 58 58 A 51 THR N A 51 THR CA A 51 THR C A 52 PRO N 1.0 99.7 188.9 PSI 59 59 A 51 THR C A 52 PRO N A 52 PRO CA A 52 PRO C 1.0 -82.7 -42.7 PHI 60 60 A 52 PRO N A 52 PRO CA A 52 PRO C A 53 ALA N 1.0 123.2 163.2 PSI 61 61 A 52 PRO C A 53 ALA N A 53 ALA CA A 53 ALA C 1.0 -81.2 -41.2 PHI 62 62 A 53 ALA N A 53 ALA CA A 53 ALA C A 54 SER N 1.0 -46.9 -6.3 PSI 63 63 A 53 ALA C A 54 SER N A 54 SER CA A 54 SER C 1.0 -111.3 -71.3 PHI 64 64 A 54 SER N A 54 SER CA A 54 SER C A 55 SER N 1.0 -21.4 18.6 PSI 65 65 A 54 SER C A 55 SER N A 55 SER CA A 55 SER C 1.0 -166.0 -58.0 PHI 66 66 A 55 SER N A 55 SER CA A 55 SER C A 56 GLU N 1.0 60.0 200.0 PSI 67 67 A 55 SER C A 56 GLU N A 56 GLU CA A 56 GLU C 1.0 -107.0 -43.0 PHI 68 68 A 56 GLU N A 56 GLU CA A 56 GLU C A 57 LYS N 1.0 -52.0 12.0 PSI 69 69 A 56 GLU C A 57 LYS N A 57 LYS CA A 57 LYS C 1.0 -224.0 -84.0 PHI 70 70 A 57 LYS N A 57 LYS CA A 57 LYS C A 58 MET N 1.0 102.0 174.0 PSI 71 71 A 57 LYS C A 58 MET N A 58 MET CA A 58 MET C 1.0 -172.3 -64.3 PHI 72 72 A 58 MET N A 58 MET CA A 58 MET C A 59 MET N 1.0 106.2 167.0 PSI 73 73 A 58 MET C A 59 MET N A 59 MET CA A 59 MET C 1.0 -159.9 -106.9 PHI 74 74 A 59 MET N A 59 MET CA A 59 MET C A 60 LEU N 1.0 139.7 179.7 PSI 75 75 A 59 MET C A 60 LEU N A 60 LEU CA A 60 LEU C 1.0 -170.0 -101.6 PHI 76 76 A 60 LEU N A 60 LEU CA A 60 LEU C A 61 ARG N 1.0 123.7 165.7 PSI 77 77 A 60 LEU C A 61 ARG N A 61 ARG CA A 61 ARG C 1.0 -164.8 -114.4 PHI 78 78 A 61 ARG N A 61 ARG CA A 61 ARG C A 62 LEU N 1.0 113.7 153.7 PSI 79 79 A 61 ARG C A 62 LEU N A 62 LEU CA A 62 LEU C 1.0 -127.8 -80.6 PHI 80 80 A 62 LEU N A 62 LEU CA A 62 LEU C A 63 ILE N 1.0 101.6 141.6 PSI 81 81 A 62 LEU C A 63 ILE N A 63 ILE CA A 63 ILE C 1.0 -150.7 -87.5 PHI 82 82 A 63 ILE N A 63 ILE CA A 63 ILE C A 64 GLY N 1.0 94.6 156.6 PSI 83 83 A 85 GLN C A 86 ARG N A 86 ARG CA A 86 ARG C 1.0 -167.0 -79.2 PHI 84 84 A 86 ARG N A 86 ARG CA A 86 ARG C A 87 HIS N 1.0 109.4 188.2 PSI 85 85 A 86 ARG C A 87 HIS N A 87 HIS CA A 87 HIS C 1.0 -158.8 -93.2 PHI 86 86 A 87 HIS N A 87 HIS CA A 87 HIS C A 88 MET N 1.0 111.2 151.2 PSI 87 87 A 87 HIS C A 88 MET N A 88 MET CA A 88 MET C 1.0 -151.1 -87.3 PHI 88 88 A 88 MET N A 88 MET CA A 88 MET C A 89 PHE N 1.0 110.2 150.2 PSI 89 89 A 88 MET C A 89 PHE N A 89 PHE CA A 89 PHE C 1.0 -162.4 -103.8 PHI 90 90 A 89 PHE N A 89 PHE CA A 89 PHE C A 90 SER N 1.0 130.7 175.3 PSI 91 91 A 89 PHE C A 90 SER N A 90 SER CA A 90 SER C 1.0 -153.3 -77.5 PHI 92 92 A 90 SER N A 90 SER CA A 90 SER C A 91 PHE N 1.0 111.1 173.3 PSI 93 93 A 90 SER C A 91 PHE N A 91 PHE CA A 91 PHE C 1.0 -168.7 -83.3 PHI 94 94 A 91 PHE N A 91 PHE CA A 91 PHE C A 92 ASN N 1.0 134.6 183.6 PSI 95 95 A 94 ARG C A 95 THR N A 95 THR CA A 95 THR C 1.0 -82.7 -42.7 PHI 96 96 A 95 THR N A 95 THR CA A 95 THR C A 96 VAL N 1.0 -59.8 -19.8 PSI 97 97 A 95 THR C A 96 VAL N A 96 VAL CA A 96 VAL C 1.0 -85.0 -45.0 PHI 98 98 A 96 VAL N A 96 VAL CA A 96 VAL C A 97 MET N 1.0 -63.8 -23.8 PSI 99 99 A 96 VAL C A 97 MET N A 97 MET CA A 97 MET C 1.0 -81.1 -41.1 PHI 100 100 A 97 MET N A 97 MET CA A 97 MET C A 98 ASP N 1.0 -62.2 -22.2 PSI 101 101 A 97 MET C A 98 ASP N A 98 ASP CA A 98 ASP C 1.0 -85.0 -45.0 PHI 102 102 A 98 ASP N A 98 ASP CA A 98 ASP C A 99 ASN N 1.0 -59.4 -19.4 PSI 103 103 A 98 ASP C A 99 ASN N A 99 ASN CA A 99 ASN C 1.0 -81.7 -41.7 PHI 104 104 A 99 ASN N A 99 ASN CA A 99 ASN C A 100 ILE N 1.0 -66.3 -26.3 PSI 105 105 A 99 ASN C A 100 ILE N A 100 ILE CA A 100 ILE C 1.0 -86.2 -46.2 PHI 106 106 A 100 ILE N A 100 ILE CA A 100 ILE C A 101 LYS N 1.0 -57.5 -17.5 PSI 107 107 A 100 ILE C A 101 LYS N A 101 LYS CA A 101 LYS C 1.0 -83.6 -43.6 PHI 108 108 A 101 LYS N A 101 LYS CA A 101 LYS C A 102 MET N 1.0 -64.8 -24.8 PSI 109 109 A 101 LYS C A 102 MET N A 102 MET CA A 102 MET C 1.0 -83.4 -43.4 PHI 110 110 A 102 MET N A 102 MET CA A 102 MET C A 103 THR N 1.0 -58.7 -17.1 PSI 111 111 A 102 MET C A 103 THR N A 103 THR CA A 103 THR C 1.0 -84.7 -44.7 PHI 112 112 A 103 THR N A 103 THR CA A 103 THR C A 104 LEU N 1.0 -65.1 -25.1 PSI 113 113 A 103 THR C A 104 LEU N A 104 LEU CA A 104 LEU C 1.0 -83.1 -43.1 PHI 114 114 A 104 LEU N A 104 LEU CA A 104 LEU C A 105 GLN N 1.0 -60.0 -20.0 PSI 115 115 A 104 LEU C A 105 GLN N A 105 GLN CA A 105 GLN C 1.0 -83.2 -43.2 PHI 116 116 A 105 GLN N A 105 GLN CA A 105 GLN C A 106 GLN N 1.0 -63.0 -23.0 PSI 117 117 A 105 GLN C A 106 GLN N A 106 GLN CA A 106 GLN C 1.0 -87.7 -47.7 PHI 118 118 A 106 GLN N A 106 GLN CA A 106 GLN C A 107 ILE N 1.0 -58.9 -18.9 PSI 119 119 A 106 GLN C A 107 ILE N A 107 ILE CA A 107 ILE C 1.0 -85.2 -45.2 PHI 120 120 A 107 ILE N A 107 ILE CA A 107 ILE C A 108 ILE N 1.0 -64.0 -24.0 PSI 121 121 A 107 ILE C A 108 ILE N A 108 ILE CA A 108 ILE C 1.0 -82.5 -42.5 PHI 122 122 A 108 ILE N A 108 ILE CA A 108 ILE C A 109 SER N 1.0 -63.0 -23.0 PSI 123 123 A 108 ILE C A 109 SER N A 109 SER CA A 109 SER C 1.0 -81.8 -41.8 PHI 124 124 A 109 SER N A 109 SER CA A 109 SER C A 110 ARG N 1.0 -62.6 -22.6 PSI 125 125 A 109 SER C A 110 ARG N A 110 ARG CA A 110 ARG C 1.0 -84.6 -44.6 PHI 126 126 A 110 ARG N A 110 ARG CA A 110 ARG C A 111 TYR N 1.0 -59.5 -13.1 PSI 127 127 A 110 ARG C A 111 TYR N A 111 TYR CA A 111 TYR C 1.0 -113.6 -41.2 PHI 128 128 A 111 TYR N A 111 TYR CA A 111 TYR C A 112 LYS N 1.0 -62.5 25.5 PSI 129 129 A 33 ASP N A 33 ASP CA A 33 ASP C A 34 GLY N 1.0 -80.0 -10.0 PSI 130 130 A 34 GLY C A 35 ASP N A 35 ASP CA A 35 ASP C 1.0 -142.0 -42.0 PHI 131 131 B 90 TYR C B 91 ASP N B 91 ASP CA B 91 ASP C 1.0 -90.0 -50.0 PHI 132 132 B 91 ASP N B 91 ASP CA B 91 ASP C B 92 SER N 1.0 -73.0 15.0 PSI 133 133 B 91 ASP C B 92 SER N B 92 SER CA B 92 SER C 1.0 -128.0 -28.0 PHI 134 134 B 92 SER N B 92 SER CA B 92 SER C B 93 GLU N 1.0 -64.0 4.0 PSI 135 135 B 92 SER C B 93 GLU N B 93 GLU CA B 93 GLU C 1.0 -143.0 -39.0 PHI 136 136 B 93 GLU N B 93 GLU CA B 93 GLU C B 94 GLU N 1.0 -67.0 29.0 PSI 137 137 B 93 GLU C B 94 GLU N B 94 GLU CA B 94 GLU C 1.0 -120.0 -64.0 PHI 138 138 B 94 GLU N B 94 GLU CA B 94 GLU C B 95 PHE N 1.0 -63.0 25.0 PSI 139 139 B 94 GLU C B 95 PHE N B 95 PHE CA B 95 PHE C 1.0 -169.0 -69.0 PHI 140 140 B 95 PHE N B 95 PHE CA B 95 PHE C B 96 GLU N 1.0 135.0 175.0 PSI 141 141 B 95 PHE C B 96 GLU N B 96 GLU CA B 96 GLU C 1.0 -146.0 -94.0 PHI 142 142 B 96 GLU N B 96 GLU CA B 96 GLU C B 97 ASP N 1.0 127.0 171.0 PSI 143 143 B 96 GLU C B 97 ASP N B 97 ASP CA B 97 ASP C 1.0 -96.0 -56.0 PHI 144 144 B 97 ASP N B 97 ASP CA B 97 ASP C B 98 VAL N 1.0 118.0 162.0 PSI 145 145 B 97 ASP C B 98 VAL N B 98 VAL CA B 98 VAL C 1.0 -171.0 -43.0 PHI 146 146 B 98 VAL N B 98 VAL CA B 98 VAL C B 99 THR N 1.0 104.0 172.0 PSI 147 147 B 98 VAL C B 99 THR N B 99 THR CA B 99 THR C 1.0 -147.0 -47.0 PHI 148 148 B 99 THR N B 99 THR CA B 99 THR C B 100 ASP N 1.0 99.0 199.0 PSI stop_ save_