data_nef_c17991_2lkg save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 17992 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 MET start . . 2 A 2 ALA middle . . 3 A 3 HIS middle . . 4 A 4 HIS middle . . 5 A 5 HIS middle . . 6 A 6 HIS middle . . 7 A 7 HIS middle . . 8 A 8 HIS middle . . 9 A 9 ALA middle . . 10 A 10 MET middle . . 11 A 11 VAL middle . . 12 A 12 ILE middle . . 13 A 13 ASP middle . . 14 A 14 HIS middle . . 15 A 15 ILE middle . . 16 A 16 LEU middle . . 17 A 17 LYS middle . . 18 A 18 CYS middle . . 19 A 19 VAL middle . . 20 A 20 PHE middle . . 21 A 21 ASP middle . . 22 A 22 LYS middle . . 23 A 23 ILE middle . . 24 A 24 CYS middle . . 25 A 25 LYS middle . . 26 A 26 ILE middle . . 27 A 27 GLY middle . false 28 A 28 THR middle . . 29 A 29 GLU middle . . 30 A 30 SER middle . . 31 A 31 VAL middle . . 32 A 32 GLU middle . . 33 A 33 ALA middle . . 34 A 34 GLY middle . false 35 A 35 ARG middle . . 36 A 36 LEU middle . . 37 A 37 ILE middle . . 38 A 38 GLU middle . . 39 A 39 LEU middle . . 40 A 40 SER middle . . 41 A 41 GLN middle . . 42 A 42 GLU middle . . 43 A 43 GLY middle . false 44 A 44 GLY middle . false 45 A 45 GLY middle . false 46 A 46 GLY middle . false 47 A 47 GLY middle . false 48 A 48 GLY middle . false 49 A 49 PRO middle . false 50 A 50 LEU middle . . 51 A 51 TYR middle . . 52 A 52 PHE middle . . 53 A 53 VAL middle . . 54 A 54 VAL middle . . 55 A 55 ASN middle . . 56 A 56 VAL middle . . 57 A 57 ILE middle . . 58 A 58 GLU middle . . 59 A 59 PRO middle . false 60 A 60 CYS middle . . 61 A 61 LYS middle . . 62 A 62 LYS middle . . 63 A 63 PHE middle . . 64 A 64 SER middle . . 65 A 65 GLU middle . . 66 A 66 LEU middle . . 67 A 67 THR middle . . 68 A 68 GLY middle . false 69 A 69 LEU middle . . 70 A 70 VAL middle . . 71 A 71 PHE middle . . 72 A 72 TYR middle . . 73 A 73 LEU middle . . 74 A 74 PRO middle . false 75 A 75 THR middle . . 76 A 76 ASP middle . . 77 A 77 SER middle . . 78 A 78 GLY middle . false 79 A 79 GLU middle . . 80 A 80 LYS middle . . 81 A 81 MET middle . . 82 A 82 THR middle . . 83 A 83 GLU middle . . 84 A 84 SER middle . . 85 A 85 LYS middle . . 86 A 86 SER middle . . 87 A 87 VAL middle . . 88 A 88 LEU middle . . 89 A 89 LYS middle . . 90 A 90 SER middle . . 91 A 91 LEU middle . . 92 A 92 THR middle . . 93 A 93 GLU middle . . 94 A 94 LYS middle . . 95 A 95 LEU middle . . 96 A 96 LYS middle . . 97 A 97 LYS middle . . 98 A 98 ILE middle . . 99 A 99 VAL middle . . 100 A 100 GLU middle . . 101 A 101 LEU middle . . 102 A 102 ILE middle . . 103 A 103 PRO middle . false 104 A 104 SER middle . . 105 A 105 THR middle . . 106 A 106 SER middle . . 107 A 107 SER middle . . 108 A 108 ALA middle . . 109 A 109 VAL middle . . 110 A 110 PRO middle . false 111 A 111 LEU middle . . 112 A 112 ILE middle . . 113 A 113 GLY middle . false 114 A 114 LYS middle . . 115 A 115 TYR middle . . 116 A 116 MET middle . . 117 A 117 LEU middle . . 118 A 118 PHE middle . . 119 A 119 THR middle . . 120 A 120 LYS middle . . 121 A 121 GLU middle . . 122 A 122 PHE middle . . 123 A 123 VAL middle . . 124 A 124 GLU middle . . 125 A 125 SER middle . . 126 A 126 SER middle . . 127 A 127 ILE middle . . 128 A 128 LYS middle . . 129 A 129 ILE middle . . 130 A 130 THR middle . . 131 A 131 GLU middle . . 132 A 132 GLU middle . . 133 A 133 VAL middle . . 134 A 134 ILE middle . . 135 A 135 ASN middle . . 136 A 136 THR middle . . 137 A 137 HIS middle . . 138 A 138 HIS middle . . 139 A 139 ARG middle . . 140 A 140 SER end . . stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 8 HIS H H 1 8.686 0.000 A 8 HIS HA H 1 4.738 0.018 A 8 HIS HBx H 1 3.242 0.024 A 8 HIS HBy H 1 3.242 0.024 A 8 HIS HD2 H 1 7.314 0.014 A 8 HIS CA C 13 55.776 0.204 A 8 HIS CB C 13 29.344 0.132 A 9 ALA H H 1 8.457 0.020 A 9 ALA HA H 1 4.387 0.016 A 9 ALA HB% H 1 1.519 0.009 A 9 ALA CA C 13 53.287 0.080 A 9 ALA CB C 13 19.175 0.124 A 9 ALA N N 15 124.079 0.045 A 10 MET H H 1 8.545 0.022 A 10 MET HA H 1 4.390 0.009 A 10 MET HBx H 1 2.181 0.022 A 10 MET HBy H 1 2.181 0.022 A 10 MET HE% H 1 2.154 0.005 A 10 MET HGx H 1 2.699 0.015 A 10 MET HGy H 1 2.699 0.015 A 10 MET CA C 13 57.753 0.196 A 10 MET CB C 13 32.355 0.049 A 10 MET CE C 13 17.151 0.097 A 10 MET CG C 13 32.609 0.060 A 10 MET N N 15 120.430 0.102 A 11 VAL H H 1 8.339 0.022 A 11 VAL HA H 1 4.016 0.020 A 11 VAL HB H 1 2.256 0.021 A 11 VAL HGy% H 1 1.067 0.030 A 11 VAL CA C 13 65.271 0.037 A 11 VAL CB C 13 31.611 0.000 A 11 VAL CGy C 13 21.471 0.002 A 11 VAL N N 15 119.159 0.075 A 12 ILE H H 1 7.705 0.017 A 12 ILE HA H 1 3.953 0.019 A 12 ILE HB H 1 1.731 0.012 A 12 ILE HD1% H 1 0.919 0.018 A 12 ILE HG1x H 1 1.295 0.013 A 12 ILE HG1y H 1 1.295 0.013 A 12 ILE HG2% H 1 0.993 0.017 A 12 ILE CA C 13 64.334 0.023 A 12 ILE CB C 13 37.496 0.000 A 12 ILE CD1 C 13 13.210 0.063 A 12 ILE CG2 C 13 17.866 0.000 A 12 ILE N N 15 119.461 0.096 A 13 ASP H H 1 8.172 0.013 A 13 ASP HA H 1 4.384 0.000 A 13 ASP HBx H 1 2.902 0.010 A 13 ASP HBy H 1 2.902 0.010 A 13 ASP CA C 13 57.524 0.084 A 13 ASP CB C 13 39.412 0.125 A 13 ASP N N 15 119.460 0.050 A 14 HIS H H 1 8.138 0.009 A 14 HIS HA H 1 4.540 0.019 A 14 HIS HBx H 1 3.499 0.013 A 14 HIS HBy H 1 3.499 0.013 A 14 HIS HD2 H 1 7.351 0.000 A 14 HIS CA C 13 58.748 0.012 A 14 HIS CB C 13 28.652 0.207 A 14 HIS N N 15 116.421 0.098 A 15 ILE H H 1 8.224 0.016 A 15 ILE HA H 1 3.808 0.014 A 15 ILE HB H 1 2.064 0.000 A 15 ILE HG1x H 1 1.290 0.006 A 15 ILE HG1y H 1 1.290 0.006 A 15 ILE HG2% H 1 1.021 0.000 A 15 ILE CA C 13 65.404 0.030 A 15 ILE CB C 13 37.787 0.000 A 15 ILE N N 15 119.970 0.104 A 16 LEU H H 1 8.480 0.005 A 16 LEU HA H 1 3.992 0.003 A 16 LEU HBx H 1 2.005 0.014 A 16 LEU HBy H 1 2.005 0.014 A 16 LEU HDx% H 1 0.935 0.020 A 16 LEU HDy% H 1 0.935 0.020 A 16 LEU HG H 1 1.492 0.027 A 16 LEU CA C 13 58.786 0.257 A 16 LEU N N 15 118.635 0.084 A 17 LYS H H 1 8.098 0.011 A 17 LYS HA H 1 4.094 0.017 A 17 LYS HBx H 1 2.055 0.000 A 17 LYS HBy H 1 2.055 0.000 A 17 LYS HEx H 1 3.304 0.005 A 17 LYS HEy H 1 3.304 0.005 A 17 LYS CA C 13 59.882 0.116 A 17 LYS CB C 13 32.216 0.000 A 17 LYS N N 15 118.257 0.117 A 18 CYS H H 1 7.899 0.010 A 18 CYS HA H 1 4.329 0.007 A 18 CYS HBx H 1 3.031 0.016 A 18 CYS HBy H 1 3.031 0.016 A 18 CYS CA C 13 63.218 0.091 A 18 CYS CB C 13 26.822 0.137 A 18 CYS N N 15 117.220 0.079 A 19 VAL H H 1 8.352 0.020 A 19 VAL HA H 1 3.725 0.021 A 19 VAL HB H 1 2.337 0.024 A 19 VAL HGx% H 1 1.248 0.002 A 19 VAL HGy% H 1 1.009 0.011 A 19 VAL CA C 13 67.080 0.045 A 19 VAL CB C 13 32.057 0.319 A 19 VAL CGy C 13 23.643 0.000 A 19 VAL CGx C 13 21.713 0.028 A 19 VAL N N 15 118.929 0.086 A 20 PHE H H 1 8.791 0.016 A 20 PHE HA H 1 4.274 0.015 A 20 PHE HBx H 1 3.298 0.019 A 20 PHE HBy H 1 3.298 0.019 A 20 PHE HDx H 1 7.279 0.011 A 20 PHE HDy H 1 7.279 0.011 A 20 PHE CA C 13 61.626 0.142 A 20 PHE CB C 13 39.080 0.000 A 20 PHE N N 15 120.244 0.076 A 21 ASP H H 1 8.705 0.027 A 21 ASP HA H 1 4.363 0.005 A 21 ASP HBx H 1 2.819 0.009 A 21 ASP HBy H 1 2.819 0.009 A 21 ASP CA C 13 57.517 0.098 A 21 ASP CB C 13 40.068 0.094 A 21 ASP N N 15 118.761 0.159 A 22 LYS H H 1 7.810 0.012 A 22 LYS HA H 1 4.194 0.019 A 22 LYS HBx H 1 2.053 0.029 A 22 LYS HBy H 1 2.053 0.029 A 22 LYS HEx H 1 3.047 0.009 A 22 LYS HEy H 1 3.047 0.009 A 22 LYS HGx H 1 1.506 0.003 A 22 LYS HGy H 1 1.506 0.003 A 22 LYS CA C 13 58.593 0.025 A 22 LYS CB C 13 32.299 0.000 A 22 LYS CE C 13 42.268 0.010 A 22 LYS CG C 13 25.433 0.185 A 22 LYS N N 15 118.200 0.060 A 23 ILE H H 1 8.351 0.006 A 23 ILE HA H 1 3.781 0.010 A 23 ILE HB H 1 1.815 0.017 A 23 ILE HD1% H 1 0.914 0.013 A 23 ILE HG1x H 1 1.228 0.013 A 23 ILE HG1y H 1 1.228 0.013 A 23 ILE HG2% H 1 0.971 0.010 A 23 ILE CA C 13 65.096 0.037 A 23 ILE CD1 C 13 13.498 0.108 A 23 ILE CG1 C 13 23.768 0.000 A 23 ILE CG2 C 13 18.110 0.049 A 23 ILE N N 15 118.534 0.132 A 24 CYS H H 1 8.203 0.009 A 24 CYS HA H 1 4.049 0.021 A 24 CYS HBx H 1 2.872 0.017 A 24 CYS HBy H 1 2.872 0.017 A 24 CYS CA C 13 63.499 0.133 A 24 CYS CB C 13 26.626 0.000 A 24 CYS N N 15 117.155 0.079 A 25 LYS H H 1 7.760 0.015 A 25 LYS HBx H 1 2.033 0.000 A 25 LYS HBy H 1 2.033 0.000 A 25 LYS CA C 13 58.762 0.026 A 25 LYS CB C 13 32.385 0.000 A 25 LYS N N 15 119.995 0.093 A 26 ILE H H 1 8.055 0.020 A 26 ILE HA H 1 3.974 0.011 A 26 ILE HB H 1 1.838 0.025 A 26 ILE HD1% H 1 0.927 0.000 A 26 ILE HG1x H 1 1.310 0.004 A 26 ILE HG1y H 1 1.310 0.004 A 26 ILE HG2% H 1 0.973 0.004 A 26 ILE CA C 13 64.106 0.052 A 26 ILE CB C 13 37.556 0.000 A 26 ILE CD1 C 13 13.606 0.000 A 26 ILE CG2 C 13 17.914 0.245 A 26 ILE N N 15 119.168 0.153 A 27 GLY H H 1 8.568 0.013 A 27 GLY HAx H 1 3.894 0.016 A 27 GLY HAy H 1 3.894 0.016 A 27 GLY CA C 13 46.989 0.164 A 27 GLY N N 15 108.257 0.073 A 28 THR H H 1 8.059 0.010 A 28 THR HA H 1 3.912 0.004 A 28 THR HB H 1 4.305 0.000 A 28 THR HG2% H 1 1.349 0.000 A 28 THR CA C 13 64.717 0.136 A 28 THR CB C 13 69.375 0.000 A 28 THR N N 15 112.727 0.088 A 29 GLU H H 1 8.113 0.001 A 29 GLU HBx H 1 2.204 0.005 A 29 GLU HBy H 1 2.204 0.005 A 29 GLU HGx H 1 2.542 0.003 A 29 GLU HGy H 1 2.542 0.003 A 29 GLU CA C 13 57.604 0.090 A 29 GLU CB C 13 29.093 0.000 A 29 GLU CG C 13 34.741 0.000 A 29 GLU N N 15 120.068 0.013 A 30 SER H H 1 8.060 0.008 A 30 SER HA H 1 4.374 0.005 A 30 SER HBx H 1 4.105 0.000 A 30 SER HBy H 1 4.105 0.000 A 30 SER CA C 13 60.353 0.122 A 30 SER N N 15 114.882 0.100 A 31 VAL H H 1 8.127 0.024 A 31 VAL HA H 1 4.017 0.027 A 31 VAL HB H 1 2.263 0.007 A 31 VAL HGy% H 1 1.065 0.027 A 31 VAL CA C 13 64.627 0.087 A 31 VAL CB C 13 31.985 0.018 A 31 VAL CGy C 13 21.471 0.002 A 31 VAL N N 15 122.098 0.204 A 32 GLU H H 1 8.243 0.013 A 32 GLU HA H 1 4.318 0.001 A 32 GLU HBx H 1 2.152 0.013 A 32 GLU HBy H 1 2.152 0.013 A 32 GLU HGx H 1 2.521 0.010 A 32 GLU HGy H 1 2.521 0.010 A 32 GLU CA C 13 57.887 0.074 A 32 GLU CB C 13 28.653 0.000 A 32 GLU CG C 13 34.680 0.061 A 32 GLU N N 15 120.280 0.176 A 33 ALA H H 1 8.218 0.006 A 33 ALA HA H 1 4.189 0.015 A 33 ALA HB% H 1 1.560 0.003 A 33 ALA CA C 13 54.724 0.045 A 33 ALA CB C 13 18.728 0.028 A 33 ALA N N 15 121.715 0.097 A 34 GLY H H 1 8.308 0.010 A 34 GLY HAx H 1 3.975 0.017 A 34 GLY HAy H 1 3.975 0.017 A 34 GLY CA C 13 47.074 0.029 A 34 GLY N N 15 104.656 0.034 A 35 ARG H H 1 7.975 0.022 A 35 ARG HA H 1 4.276 0.014 A 35 ARG HBx H 1 1.999 0.034 A 35 ARG HBy H 1 1.999 0.034 A 35 ARG HDx H 1 3.286 0.018 A 35 ARG HDy H 1 3.286 0.018 A 35 ARG HE H 1 7.419 0.040 A 35 ARG HGx H 1 1.745 0.003 A 35 ARG HGy H 1 1.745 0.003 A 35 ARG HH1x H 1 6.812 0.000 A 35 ARG CA C 13 58.025 0.163 A 35 ARG CB C 13 30.289 0.061 A 35 ARG CD C 13 43.441 0.069 A 35 ARG CG C 13 27.554 0.273 A 35 ARG N N 15 119.958 0.067 A 35 ARG NE N 15 84.953 0.120 A 35 ARG NHx N 15 87.786 0.000 A 36 LEU H H 1 7.958 0.017 A 36 LEU HA H 1 4.224 0.015 A 36 LEU HBy H 1 1.936 0.004 A 36 LEU HBx H 1 1.692 0.021 A 36 LEU HDx% H 1 0.969 0.007 A 36 LEU HDy% H 1 0.969 0.007 A 36 LEU CA C 13 57.803 0.253 A 36 LEU CB C 13 42.193 0.118 A 36 LEU N N 15 118.931 0.081 A 37 ILE H H 1 7.904 0.010 A 37 ILE HA H 1 3.931 0.017 A 37 ILE HB H 1 2.027 0.008 A 37 ILE HD1% H 1 0.917 0.000 A 37 ILE HG1x H 1 1.274 0.021 A 37 ILE HG1y H 1 1.274 0.021 A 37 ILE HG2% H 1 0.971 0.011 A 37 ILE CA C 13 63.859 0.009 A 37 ILE CB C 13 38.039 0.073 A 37 ILE CD1 C 13 13.499 0.000 A 37 ILE CG2 C 13 17.705 0.124 A 37 ILE N N 15 118.087 0.180 A 38 GLU H H 1 8.041 0.015 A 38 GLU HA H 1 4.231 0.016 A 38 GLU HBx H 1 2.202 0.016 A 38 GLU HBy H 1 2.202 0.016 A 38 GLU HGx H 1 2.479 0.007 A 38 GLU HGy H 1 2.479 0.007 A 38 GLU CA C 13 58.445 0.189 A 38 GLU CB C 13 29.011 0.000 A 38 GLU CG C 13 34.741 0.000 A 38 GLU N N 15 120.989 0.048 A 39 LEU H H 1 8.173 0.010 A 39 LEU HA H 1 4.271 0.009 A 39 LEU HBy H 1 1.886 0.017 A 39 LEU HBx H 1 1.704 0.027 A 39 LEU HDx% H 1 0.964 0.006 A 39 LEU HDy% H 1 0.964 0.006 A 39 LEU CA C 13 57.411 0.288 A 39 LEU CB C 13 42.295 0.000 A 39 LEU N N 15 120.111 0.043 A 40 SER H H 1 8.031 0.009 A 40 SER HA H 1 4.312 0.016 A 40 SER HBx H 1 4.025 0.021 A 40 SER HBy H 1 4.025 0.021 A 40 SER CA C 13 60.406 0.056 A 40 SER CB C 13 63.646 0.181 A 40 SER N N 15 113.806 0.059 A 41 GLN H H 1 7.956 0.011 A 41 GLN HA H 1 4.396 0.017 A 41 GLN HBx H 1 2.188 0.027 A 41 GLN HBy H 1 2.188 0.027 A 41 GLN HE2y H 1 7.370 0.024 A 41 GLN HE2x H 1 6.803 0.023 A 41 GLN HGy H 1 2.494 0.012 A 41 GLN HGx H 1 2.455 0.000 A 41 GLN CA C 13 56.601 0.161 A 41 GLN CB C 13 29.385 0.031 A 41 GLN CG C 13 34.212 0.047 A 41 GLN N N 15 120.139 0.056 A 41 GLN NE2 N 15 111.168 0.122 A 42 GLU H H 1 8.114 0.017 A 42 GLU HA H 1 4.373 0.010 A 42 GLU HBx H 1 2.181 0.011 A 42 GLU HBy H 1 2.181 0.011 A 42 GLU HGx H 1 2.509 0.015 A 42 GLU HGy H 1 2.509 0.015 A 42 GLU CA C 13 57.089 0.076 A 42 GLU CB C 13 29.355 0.000 A 42 GLU CG C 13 34.440 0.000 A 42 GLU N N 15 119.728 0.060 A 43 GLY H H 1 8.325 0.013 A 43 GLY HAx H 1 4.027 0.003 A 43 GLY HAy H 1 4.027 0.003 A 43 GLY CA C 13 45.623 0.027 A 43 GLY N N 15 108.655 0.046 A 44 GLY H H 1 8.105 0.004 A 44 GLY HAx H 1 3.953 0.005 A 44 GLY HAy H 1 3.953 0.005 A 44 GLY CA C 13 45.487 0.000 A 44 GLY N N 15 107.872 0.054 A 48 GLY HAx H 1 3.965 0.008 A 48 GLY HAy H 1 3.965 0.008 A 48 GLY CA C 13 45.395 0.000 A 49 PRO HA H 1 4.469 0.020 A 49 PRO HBy H 1 2.365 0.010 A 49 PRO HBx H 1 2.113 0.010 A 49 PRO HDx H 1 3.787 0.012 A 49 PRO HDy H 1 3.787 0.012 A 49 PRO HGx H 1 2.101 0.013 A 49 PRO HGy H 1 2.101 0.013 A 49 PRO CA C 13 65.430 0.146 A 49 PRO CB C 13 32.321 0.031 A 49 PRO CD C 13 50.049 0.204 A 49 PRO CG C 13 27.479 0.000 A 50 LEU H H 1 8.336 0.014 A 50 LEU HA H 1 4.202 0.013 A 50 LEU HBx H 1 1.732 0.018 A 50 LEU HBy H 1 1.732 0.018 A 50 LEU HDx% H 1 0.981 0.011 A 50 LEU HDy% H 1 0.981 0.011 A 50 LEU HG H 1 1.717 0.000 A 50 LEU CA C 13 57.549 0.180 A 50 LEU CB C 13 41.699 0.180 A 50 LEU CDx C 13 24.852 0.263 A 50 LEU CG C 13 27.976 0.000 A 50 LEU N N 15 116.864 0.048 A 51 TYR H H 1 7.765 0.009 A 51 TYR HA H 1 4.165 0.016 A 51 TYR HBx H 1 3.115 0.012 A 51 TYR HBy H 1 3.115 0.012 A 51 TYR HDx H 1 7.071 0.007 A 51 TYR HDy H 1 7.071 0.007 A 51 TYR CA C 13 61.034 0.162 A 51 TYR CB C 13 38.484 0.283 A 51 TYR N N 15 118.433 0.110 A 52 PHE H H 1 7.873 0.021 A 52 PHE HA H 1 4.260 0.015 A 52 PHE HBx H 1 3.272 0.016 A 52 PHE HBy H 1 3.272 0.016 A 52 PHE HDx H 1 7.272 0.013 A 52 PHE HDy H 1 7.272 0.013 A 52 PHE HEx H 1 7.013 0.000 A 52 PHE HEy H 1 7.013 0.000 A 52 PHE CA C 13 61.251 0.243 A 52 PHE CB C 13 39.319 0.055 A 52 PHE N N 15 117.945 0.105 A 53 VAL H H 1 7.864 0.006 A 53 VAL HA H 1 3.652 0.024 A 53 VAL HB H 1 2.284 0.019 A 53 VAL HGy% H 1 1.052 0.008 A 53 VAL CA C 13 66.298 0.228 A 53 VAL CB C 13 31.810 0.000 A 53 VAL CGy C 13 22.074 0.000 A 53 VAL N N 15 117.468 0.131 A 54 VAL H H 1 7.958 0.010 A 54 VAL HA H 1 3.702 0.009 A 54 VAL HB H 1 2.122 0.012 A 54 VAL HGy% H 1 0.989 0.016 A 54 VAL CA C 13 66.067 0.192 A 54 VAL CB C 13 31.801 0.151 A 54 VAL CGy C 13 21.650 0.026 A 54 VAL N N 15 116.929 0.109 A 55 ASN H H 1 7.823 0.012 A 55 ASN HA H 1 4.630 0.022 A 55 ASN HBx H 1 2.663 0.028 A 55 ASN HBy H 1 2.663 0.028 A 55 ASN HD2y H 1 7.045 0.009 A 55 ASN HD2x H 1 6.669 0.009 A 55 ASN CA C 13 55.460 0.005 A 55 ASN CB C 13 39.929 0.476 A 55 ASN N N 15 115.543 0.076 A 55 ASN ND2 N 15 112.546 0.013 A 56 VAL H H 1 7.664 0.014 A 56 VAL HA H 1 4.097 0.011 A 56 VAL HB H 1 2.111 0.022 A 56 VAL HGy% H 1 0.915 0.010 A 56 VAL CA C 13 64.139 0.161 A 56 VAL CB C 13 32.003 0.084 A 56 VAL CGy C 13 21.569 0.126 A 56 VAL N N 15 116.125 0.057 A 57 ILE H H 1 7.587 0.015 A 57 ILE HA H 1 4.009 0.009 A 57 ILE HB H 1 1.638 0.017 A 57 ILE HD1% H 1 0.907 0.000 A 57 ILE HG1x H 1 1.309 0.011 A 57 ILE HG1y H 1 1.309 0.011 A 57 ILE HG2% H 1 0.947 0.017 A 57 ILE CA C 13 63.550 0.014 A 57 ILE CB C 13 37.763 0.000 A 57 ILE CD1 C 13 13.027 0.000 A 57 ILE N N 15 116.872 0.095 A 58 GLU H H 1 8.114 0.014 A 58 GLU HA H 1 4.199 0.003 A 58 GLU HBx H 1 2.186 0.008 A 58 GLU HBy H 1 2.186 0.008 A 58 GLU HGx H 1 2.428 0.023 A 58 GLU HGy H 1 2.428 0.023 A 58 GLU CA C 13 60.305 0.000 A 58 GLU CG C 13 34.345 0.285 A 58 GLU N N 15 118.190 0.103 A 59 PRO HA H 1 4.509 0.018 A 59 PRO HDx H 1 3.901 0.006 A 59 PRO HDy H 1 3.901 0.006 A 59 PRO HGx H 1 2.088 0.009 A 59 PRO HGy H 1 2.088 0.009 A 59 PRO CA C 13 65.562 0.034 A 59 PRO CB C 13 31.466 0.000 A 59 PRO CG C 13 27.636 0.249 A 60 CYS H H 1 7.913 0.010 A 60 CYS HA H 1 4.268 0.011 A 60 CYS HBy H 1 3.197 0.006 A 60 CYS HBx H 1 2.992 0.036 A 60 CYS CA C 13 62.113 0.056 A 60 CYS CB C 13 26.990 0.082 A 60 CYS N N 15 115.035 0.080 A 61 LYS H H 1 8.197 0.009 A 61 LYS HA H 1 4.272 0.002 A 61 LYS HBx H 1 1.940 0.020 A 61 LYS HBy H 1 1.940 0.020 A 61 LYS HEx H 1 2.922 0.114 A 61 LYS HEy H 1 2.922 0.114 A 61 LYS HGx H 1 1.505 0.005 A 61 LYS HGy H 1 1.505 0.005 A 61 LYS CA C 13 59.089 0.010 A 61 LYS CB C 13 32.428 0.000 A 61 LYS CG C 13 25.430 0.103 A 61 LYS N N 15 121.184 0.158 A 62 LYS H H 1 7.982 0.002 A 62 LYS CA C 13 57.844 0.073 A 62 LYS CB C 13 32.090 0.000 A 62 LYS N N 15 118.253 0.073 A 63 PHE H H 1 8.155 0.016 A 63 PHE HA H 1 4.255 0.004 A 63 PHE HBx H 1 3.324 0.019 A 63 PHE HBy H 1 3.324 0.019 A 63 PHE HDx H 1 7.280 0.005 A 63 PHE HDy H 1 7.280 0.005 A 63 PHE CA C 13 60.534 0.001 A 63 PHE CB C 13 39.150 0.086 A 63 PHE N N 15 118.763 0.110 A 64 SER H H 1 8.218 0.006 A 64 SER HA H 1 4.268 0.008 A 64 SER HBx H 1 4.054 0.029 A 64 SER HBy H 1 4.054 0.029 A 64 SER CA C 13 61.588 0.078 A 64 SER CB C 13 63.175 0.000 A 64 SER N N 15 114.881 0.100 A 65 GLU H H 1 8.067 0.013 A 65 GLU HA H 1 4.284 0.012 A 65 GLU HBx H 1 2.227 0.029 A 65 GLU HBy H 1 2.227 0.029 A 65 GLU HGx H 1 2.509 0.013 A 65 GLU HGy H 1 2.509 0.013 A 65 GLU CA C 13 58.211 0.043 A 65 GLU CB C 13 28.962 0.120 A 65 GLU CG C 13 34.535 0.103 A 65 GLU N N 15 120.937 0.034 A 66 LEU H H 1 8.003 0.012 A 66 LEU HA H 1 4.263 0.020 A 66 LEU HBx H 1 1.880 0.007 A 66 LEU HBy H 1 1.880 0.007 A 66 LEU HDx% H 1 0.965 0.012 A 66 LEU HDy% H 1 0.965 0.012 A 66 LEU HG H 1 1.854 0.012 A 66 LEU CA C 13 57.222 0.046 A 66 LEU CB C 13 42.325 0.000 A 66 LEU CDx C 13 24.361 0.185 A 66 LEU CG C 13 27.146 0.107 A 66 LEU N N 15 118.904 0.088 A 67 THR H H 1 7.783 0.013 A 67 THR HA H 1 4.043 0.002 A 67 THR HB H 1 4.258 0.015 A 67 THR HG2% H 1 1.167 0.028 A 67 THR CA C 13 64.579 0.073 A 67 THR CB C 13 69.410 0.090 A 67 THR CG2 C 13 22.984 0.030 A 67 THR N N 15 108.190 0.090 A 68 GLY H H 1 7.964 0.010 A 68 GLY HAx H 1 4.066 0.007 A 68 GLY HAy H 1 4.066 0.007 A 68 GLY CA C 13 46.244 0.023 A 68 GLY N N 15 108.141 0.067 A 69 LEU H H 1 7.749 0.021 A 69 LEU HA H 1 4.352 0.014 A 69 LEU HBy H 1 1.890 0.010 A 69 LEU HBx H 1 1.613 0.015 A 69 LEU HDx% H 1 0.979 0.009 A 69 LEU HDy% H 1 0.979 0.009 A 69 LEU HG H 1 1.841 0.000 A 69 LEU CA C 13 56.486 0.246 A 69 LEU CB C 13 42.374 0.075 A 69 LEU CG C 13 27.384 0.000 A 69 LEU N N 15 120.124 0.048 A 70 VAL H H 1 7.607 0.016 A 70 VAL HA H 1 3.935 0.019 A 70 VAL HB H 1 2.064 0.012 A 70 VAL HGy% H 1 0.838 0.037 A 70 VAL CA C 13 63.630 0.223 A 70 VAL CB C 13 32.264 0.066 A 70 VAL CGy C 13 21.275 0.146 A 70 VAL N N 15 115.546 0.162 A 71 PHE H H 1 7.618 0.011 A 71 PHE HA H 1 4.558 0.011 A 71 PHE HBx H 1 3.120 0.022 A 71 PHE HBy H 1 3.120 0.022 A 71 PHE HDx H 1 7.216 0.009 A 71 PHE HDy H 1 7.216 0.009 A 71 PHE CA C 13 58.547 0.032 A 71 PHE CB C 13 39.300 0.000 A 71 PHE N N 15 119.035 0.084 A 72 TYR H H 1 7.740 0.016 A 72 TYR HA H 1 4.579 0.013 A 72 TYR HBy H 1 3.133 0.054 A 72 TYR HBx H 1 2.956 0.016 A 72 TYR HDx H 1 7.205 0.011 A 72 TYR HDy H 1 7.205 0.011 A 72 TYR HEx H 1 6.918 0.012 A 72 TYR HEy H 1 6.918 0.012 A 72 TYR CA C 13 58.097 0.025 A 72 TYR CB C 13 39.244 0.135 A 72 TYR N N 15 118.365 0.027 A 73 LEU H H 1 7.713 0.011 A 73 LEU HA H 1 4.575 0.012 A 73 LEU HBy H 1 1.822 0.006 A 73 LEU HBx H 1 1.582 0.007 A 73 LEU HDx% H 1 0.991 0.002 A 73 LEU HDy% H 1 0.991 0.002 A 73 LEU CA C 13 53.549 0.000 A 73 LEU CB C 13 42.081 0.095 A 73 LEU N N 15 121.184 0.065 A 74 PRO HA H 1 4.638 0.001 A 74 PRO HBy H 1 2.404 0.011 A 74 PRO HBx H 1 2.115 0.025 A 74 PRO HDx H 1 3.618 0.005 A 74 PRO HDy H 1 3.618 0.005 A 74 PRO HGx H 1 2.080 0.000 A 74 PRO HGy H 1 2.080 0.000 A 74 PRO CA C 13 63.204 0.078 A 74 PRO CB C 13 31.681 0.000 A 74 PRO CD C 13 50.295 0.112 A 74 PRO CG C 13 27.397 0.000 A 75 THR H H 1 8.217 0.022 A 75 THR HA H 1 4.339 0.009 A 75 THR HB H 1 4.346 0.008 A 75 THR HG2% H 1 1.306 0.006 A 75 THR CA C 13 62.684 0.122 A 75 THR CG2 C 13 21.678 0.000 A 75 THR N N 15 113.231 0.095 A 76 ASP H H 1 8.406 0.008 A 76 ASP HA H 1 4.790 0.012 A 76 ASP HBx H 1 2.866 0.010 A 76 ASP HBy H 1 2.866 0.010 A 76 ASP CA C 13 54.239 0.022 A 76 ASP CB C 13 40.315 0.097 A 76 ASP N N 15 120.892 0.060 A 77 SER H H 1 8.238 0.018 A 77 SER HA H 1 4.345 0.012 A 77 SER HBx H 1 3.954 0.018 A 77 SER HBy H 1 3.954 0.018 A 77 SER CA C 13 60.528 0.271 A 77 SER CB C 13 63.812 0.174 A 77 SER N N 15 115.861 0.126 A 78 GLY H H 1 8.570 0.018 A 78 GLY HAx H 1 4.025 0.016 A 78 GLY HAy H 1 4.025 0.016 A 78 GLY CA C 13 46.653 0.032 A 78 GLY N N 15 110.440 0.055 A 79 GLU H H 1 8.237 0.010 A 79 GLU HA H 1 4.320 0.007 A 79 GLU HBx H 1 2.166 0.016 A 79 GLU HBy H 1 2.166 0.016 A 79 GLU HGx H 1 2.450 0.014 A 79 GLU HGy H 1 2.450 0.014 A 79 GLU CA C 13 58.018 0.223 A 79 GLU CB C 13 29.082 0.075 A 79 GLU CG C 13 34.654 0.026 A 79 GLU N N 15 121.242 0.167 A 80 LYS H H 1 8.252 0.009 A 80 LYS HA H 1 4.319 0.008 A 80 LYS HBx H 1 1.952 0.007 A 80 LYS HBy H 1 1.952 0.007 A 80 LYS HEx H 1 3.041 0.010 A 80 LYS HEy H 1 3.041 0.010 A 80 LYS HGx H 1 1.600 0.014 A 80 LYS HGy H 1 1.600 0.014 A 80 LYS CA C 13 57.881 0.309 A 80 LYS CB C 13 32.746 0.000 A 80 LYS CG C 13 25.264 0.011 A 80 LYS N N 15 119.708 0.183 A 81 MET H H 1 8.419 0.022 A 81 MET HA H 1 4.367 0.016 A 81 MET HBx H 1 2.226 0.008 A 81 MET HBy H 1 2.226 0.008 A 81 MET HE% H 1 2.130 0.004 A 81 MET HGx H 1 2.646 0.015 A 81 MET HGy H 1 2.646 0.015 A 81 MET CA C 13 57.845 0.093 A 81 MET CB C 13 32.658 0.249 A 81 MET CE C 13 17.400 0.026 A 81 MET CG C 13 32.713 0.000 A 81 MET N N 15 119.849 0.174 A 82 THR H H 1 8.115 0.015 A 82 THR HA H 1 4.132 0.032 A 82 THR HB H 1 4.375 0.008 A 82 THR HG2% H 1 1.325 0.014 A 82 THR CA C 13 65.377 0.027 A 82 THR CB C 13 69.035 0.132 A 82 THR CG2 C 13 22.026 0.063 A 82 THR N N 15 114.947 0.200 A 83 GLU H H 1 8.336 0.011 A 83 GLU HA H 1 4.373 0.006 A 83 GLU HBx H 1 2.228 0.014 A 83 GLU HBy H 1 2.228 0.014 A 83 GLU HGx H 1 2.535 0.013 A 83 GLU HGy H 1 2.535 0.013 A 83 GLU CA C 13 58.064 0.026 A 83 GLU CB C 13 28.942 0.000 A 83 GLU CG C 13 34.741 0.000 A 83 GLU N N 15 121.416 0.071 A 84 SER H H 1 8.191 0.007 A 84 SER HA H 1 4.278 0.009 A 84 SER HBx H 1 4.029 0.010 A 84 SER HBy H 1 4.029 0.010 A 84 SER CA C 13 61.685 0.120 A 84 SER N N 15 115.783 0.074 A 85 LYS H H 1 8.113 0.007 A 85 LYS HA H 1 4.085 0.004 A 85 LYS HBx H 1 1.997 0.022 A 85 LYS HBy H 1 1.997 0.022 A 85 LYS HGx H 1 1.700 0.104 A 85 LYS HGy H 1 1.700 0.104 A 85 LYS CA C 13 59.788 0.017 A 85 LYS CB C 13 32.430 0.000 A 85 LYS CG C 13 25.292 0.000 A 85 LYS N N 15 121.318 0.079 A 86 SER H H 1 8.066 0.007 A 86 SER HA H 1 4.389 0.008 A 86 SER HBx H 1 4.103 0.002 A 86 SER HBy H 1 4.103 0.002 A 86 SER CA C 13 61.437 0.056 A 86 SER CB C 13 63.116 0.000 A 86 SER N N 15 115.042 0.076 A 87 VAL H H 1 8.103 0.016 A 87 VAL HA H 1 4.380 0.000 A 87 VAL HB H 1 2.272 0.013 A 87 VAL HGy% H 1 1.096 0.000 A 87 VAL CA C 13 66.123 0.065 A 87 VAL CB C 13 31.379 0.000 A 87 VAL CGy C 13 21.954 0.000 A 87 VAL N N 15 122.920 0.163 A 88 LEU H H 1 8.146 0.009 A 88 LEU HA H 1 4.122 0.008 A 88 LEU HBx H 1 1.893 0.004 A 88 LEU HBy H 1 1.893 0.004 A 88 LEU HDy% H 1 1.020 0.021 A 88 LEU HG H 1 1.854 0.002 A 88 LEU CA C 13 57.906 0.244 A 88 LEU CB C 13 41.944 0.263 A 88 LEU CDy C 13 21.553 0.129 A 88 LEU CG C 13 27.306 0.072 A 88 LEU N N 15 119.501 0.099 A 89 LYS H H 1 8.245 0.006 A 89 LYS HA H 1 4.095 0.001 A 89 LYS HBx H 1 2.018 0.008 A 89 LYS HBy H 1 2.018 0.008 A 89 LYS HEx H 1 3.029 0.009 A 89 LYS HEy H 1 3.029 0.009 A 89 LYS CA C 13 59.887 0.021 A 89 LYS CB C 13 32.226 0.000 A 89 LYS CE C 13 42.289 0.000 A 89 LYS N N 15 120.285 0.077 A 90 SER H H 1 8.037 0.015 A 90 SER HA H 1 4.362 0.006 A 90 SER CA C 13 61.815 0.264 A 90 SER N N 15 115.131 0.071 A 91 LEU H H 1 8.445 0.008 A 91 LEU HA H 1 4.148 0.009 A 91 LEU HBy H 1 1.968 0.009 A 91 LEU HBx H 1 1.760 0.008 A 91 LEU HDx% H 1 0.974 0.005 A 91 LEU HDy% H 1 0.974 0.005 A 91 LEU CA C 13 58.413 0.010 A 91 LEU CB C 13 42.175 0.000 A 91 LEU N N 15 120.855 0.069 A 92 THR H H 1 8.383 0.006 A 92 THR HA H 1 3.904 0.011 A 92 THR HB H 1 4.361 0.020 A 92 THR HG2% H 1 1.329 0.018 A 92 THR CA C 13 67.390 0.201 A 92 THR CB C 13 69.367 0.535 A 92 THR CG2 C 13 21.678 0.000 A 92 THR N N 15 112.933 0.107 A 93 GLU H H 1 7.971 0.015 A 93 GLU HBx H 1 2.223 0.015 A 93 GLU HBy H 1 2.223 0.015 A 93 GLU HGx H 1 2.506 0.008 A 93 GLU HGy H 1 2.506 0.008 A 93 GLU CA C 13 59.487 0.010 A 93 GLU CB C 13 29.145 0.000 A 93 GLU CG C 13 34.741 0.000 A 93 GLU N N 15 120.387 0.153 A 94 LYS H H 1 7.804 0.008 A 94 LYS HA H 1 4.166 0.008 A 94 LYS HBx H 1 2.143 0.019 A 94 LYS HBy H 1 2.143 0.019 A 94 LYS HEx H 1 3.057 0.000 A 94 LYS HEy H 1 3.057 0.000 A 94 LYS HGx H 1 1.625 0.001 A 94 LYS HGy H 1 1.625 0.001 A 94 LYS CA C 13 59.046 0.025 A 94 LYS CB C 13 32.347 0.000 A 94 LYS CE C 13 42.280 0.000 A 94 LYS CG C 13 25.403 0.178 A 94 LYS N N 15 118.470 0.087 A 95 LEU H H 1 8.256 0.013 A 95 LEU HA H 1 4.159 0.010 A 95 LEU HBy H 1 1.935 0.008 A 95 LEU HBx H 1 1.737 0.008 A 95 LEU HDy% H 1 0.965 0.006 A 95 LEU CA C 13 57.877 0.002 A 95 LEU CB C 13 41.949 0.000 A 95 LEU CDy C 13 21.407 0.051 A 95 LEU N N 15 118.397 0.096 A 96 LYS H H 1 8.105 0.015 A 96 LYS HA H 1 3.940 0.024 A 96 LYS HBx H 1 2.006 0.007 A 96 LYS HBy H 1 2.006 0.007 A 96 LYS HGx H 1 1.593 0.001 A 96 LYS HGy H 1 1.593 0.001 A 96 LYS CA C 13 60.282 0.133 A 96 LYS CB C 13 32.349 0.039 A 96 LYS CG C 13 25.347 0.164 A 96 LYS N N 15 117.747 0.120 A 97 LYS H H 1 7.520 0.016 A 97 LYS HA H 1 4.167 0.011 A 97 LYS HBx H 1 2.019 0.012 A 97 LYS HBy H 1 2.019 0.012 A 97 LYS HEx H 1 3.053 0.009 A 97 LYS HEy H 1 3.053 0.009 A 97 LYS HGx H 1 1.694 0.015 A 97 LYS HGy H 1 1.694 0.015 A 97 LYS CA C 13 58.543 0.133 A 97 LYS CB C 13 32.151 0.056 A 97 LYS CE C 13 42.130 0.060 A 97 LYS CG C 13 25.432 0.191 A 97 LYS N N 15 116.451 0.052 A 98 ILE H H 1 7.782 0.014 A 98 ILE HA H 1 3.930 0.021 A 98 ILE HB H 1 2.115 0.017 A 98 ILE HD1% H 1 0.958 0.000 A 98 ILE HG1x H 1 1.320 0.017 A 98 ILE HG1y H 1 1.320 0.017 A 98 ILE HG2% H 1 0.986 0.018 A 98 ILE CA C 13 64.299 0.250 A 98 ILE CB C 13 37.749 0.000 A 98 ILE CD1 C 13 13.384 0.000 A 98 ILE CG2 C 13 17.734 0.047 A 98 ILE N N 15 117.587 0.154 A 99 VAL H H 1 7.917 0.015 A 99 VAL HA H 1 3.825 0.027 A 99 VAL HB H 1 2.292 0.014 A 99 VAL HGy% H 1 1.082 0.021 A 99 VAL CA C 13 65.963 0.089 A 99 VAL CB C 13 31.482 0.176 A 99 VAL CGy C 13 21.954 0.000 A 99 VAL N N 15 116.989 0.057 A 100 GLU H H 1 7.702 0.010 A 100 GLU HA H 1 4.213 0.006 A 100 GLU HBx H 1 2.266 0.005 A 100 GLU HBy H 1 2.266 0.005 A 100 GLU HGx H 1 2.650 0.033 A 100 GLU HGy H 1 2.650 0.033 A 100 GLU CA C 13 57.974 0.120 A 100 GLU CB C 13 28.923 0.000 A 100 GLU CG C 13 34.825 0.127 A 100 GLU N N 15 116.782 0.059 A 101 LEU H H 1 7.751 0.014 A 101 LEU HA H 1 4.155 0.018 A 101 LEU HBy H 1 2.028 0.007 A 101 LEU HBx H 1 1.720 0.021 A 101 LEU HDx% H 1 0.980 0.013 A 101 LEU HDy% H 1 0.980 0.013 A 101 LEU CA C 13 55.736 0.010 A 101 LEU CB C 13 43.039 0.000 A 101 LEU CDx C 13 24.208 0.000 A 101 LEU N N 15 118.218 0.070 A 102 ILE H H 1 7.559 0.011 A 102 ILE HA H 1 3.727 0.011 A 102 ILE HB H 1 2.091 0.015 A 102 ILE HD1% H 1 0.981 0.000 A 102 ILE HG1x H 1 1.244 0.008 A 102 ILE HG1y H 1 1.244 0.008 A 102 ILE HG2% H 1 1.030 0.013 A 102 ILE CA C 13 61.809 0.000 A 102 ILE CD1 C 13 13.159 0.000 A 102 ILE CG2 C 13 17.551 0.027 A 102 ILE N N 15 119.412 0.078 A 103 PRO HA H 1 4.587 0.014 A 103 PRO HBy H 1 2.391 0.023 A 103 PRO HBx H 1 2.083 0.012 A 103 PRO HDx H 1 3.623 0.008 A 103 PRO HDy H 1 3.623 0.008 A 103 PRO HGx H 1 2.078 0.002 A 103 PRO HGy H 1 2.078 0.002 A 103 PRO CA C 13 64.289 0.100 A 103 PRO CB C 13 31.886 0.053 A 103 PRO CD C 13 50.316 0.109 A 103 PRO CG C 13 27.476 0.123 A 104 SER H H 1 8.100 0.016 A 104 SER HA H 1 4.571 0.016 A 104 SER HBx H 1 4.057 0.007 A 104 SER HBy H 1 4.057 0.007 A 104 SER CA C 13 59.286 0.067 A 104 SER CB C 13 63.849 0.000 A 104 SER N N 15 112.794 0.173 A 105 THR H H 1 8.186 0.004 A 105 THR HA H 1 4.318 0.015 A 105 THR HB H 1 4.008 0.014 A 105 THR HG2% H 1 1.321 0.004 A 105 THR CA C 13 64.056 0.018 A 105 THR CB C 13 69.861 0.000 A 105 THR N N 15 114.655 0.044 A 106 SER H H 1 8.200 0.016 A 106 SER HA H 1 4.344 0.007 A 106 SER HBx H 1 4.038 0.003 A 106 SER HBy H 1 4.038 0.003 A 106 SER CA C 13 60.864 0.273 A 106 SER CB C 13 63.462 0.097 A 106 SER N N 15 116.165 0.082 A 107 SER H H 1 8.114 0.014 A 107 SER HA H 1 4.413 0.013 A 107 SER HBx H 1 4.002 0.022 A 107 SER HBy H 1 4.002 0.022 A 107 SER CA C 13 60.051 0.033 A 107 SER CB C 13 63.921 0.071 A 107 SER N N 15 116.732 0.068 A 108 ALA H H 1 8.022 0.009 A 108 ALA HA H 1 4.434 0.021 A 108 ALA HB% H 1 1.546 0.007 A 108 ALA CA C 13 53.482 0.335 A 108 ALA CB C 13 19.331 0.281 A 108 ALA N N 15 122.523 0.066 A 109 VAL H H 1 7.829 0.008 A 109 VAL HA H 1 3.788 0.020 A 109 VAL HB H 1 2.382 0.011 A 109 VAL HGx% H 1 1.126 0.016 A 109 VAL HGy% H 1 1.126 0.016 A 109 VAL CA C 13 66.835 0.000 A 109 VAL CGy C 13 21.954 0.000 A 109 VAL N N 15 117.146 0.053 A 110 PRO HA H 1 4.480 0.008 A 110 PRO HBx H 1 2.394 0.006 A 110 PRO HBy H 1 2.394 0.006 A 110 PRO HGx H 1 2.098 0.004 A 110 PRO HGy H 1 2.098 0.004 A 110 PRO CA C 13 65.445 0.059 A 110 PRO CB C 13 31.379 0.000 A 110 PRO CG C 13 27.746 0.000 A 111 LEU H H 1 7.538 0.014 A 111 LEU HA H 1 4.213 0.008 A 111 LEU HBy H 1 1.969 0.036 A 111 LEU HBx H 1 1.769 0.028 A 111 LEU HDx% H 1 1.055 0.001 A 111 LEU HDy% H 1 1.055 0.001 A 111 LEU CA C 13 57.782 0.032 A 111 LEU CB C 13 42.448 0.212 A 111 LEU CDx C 13 25.117 0.060 A 111 LEU N N 15 117.393 0.161 A 112 ILE H H 1 8.118 0.013 A 112 ILE HA H 1 4.001 0.012 A 112 ILE HB H 1 2.132 0.008 A 112 ILE HD1% H 1 0.985 0.000 A 112 ILE HG1x H 1 1.298 0.010 A 112 ILE HG1y H 1 1.298 0.010 A 112 ILE HG2% H 1 1.036 0.008 A 112 ILE CA C 13 64.626 0.056 A 112 ILE CD1 C 13 13.159 0.000 A 112 ILE CG2 C 13 17.787 0.205 A 112 ILE N N 15 117.001 0.141 A 113 GLY H H 1 8.409 0.020 A 113 GLY HAx H 1 3.871 0.011 A 113 GLY HAy H 1 3.871 0.011 A 113 GLY CA C 13 47.772 0.074 A 113 GLY N N 15 106.840 0.048 A 114 LYS H H 1 7.847 0.008 A 114 LYS HA H 1 4.120 0.001 A 114 LYS HBx H 1 1.796 0.012 A 114 LYS HBy H 1 1.796 0.012 A 114 LYS HEx H 1 3.051 0.000 A 114 LYS HEy H 1 3.051 0.000 A 114 LYS CA C 13 59.138 0.002 A 114 LYS N N 15 120.736 0.132 A 115 TYR H H 1 7.891 0.011 A 115 TYR HA H 1 4.272 0.004 A 115 TYR HBx H 1 3.246 0.021 A 115 TYR HBy H 1 3.246 0.021 A 115 TYR HDx H 1 7.160 0.018 A 115 TYR HDy H 1 7.160 0.018 A 115 TYR HEx H 1 6.788 0.002 A 115 TYR HEy H 1 6.788 0.002 A 115 TYR CA C 13 60.430 0.000 A 115 TYR CEx C 13 117.385 0.103 A 115 TYR N N 15 117.055 0.089 A 116 MET H H 1 8.170 0.003 A 116 MET HBx H 1 2.083 0.000 A 116 MET HBy H 1 2.083 0.000 A 116 MET HE% H 1 2.124 0.004 A 116 MET HGx H 1 2.701 0.000 A 116 MET HGy H 1 2.701 0.000 A 116 MET CE C 13 17.428 0.027 A 116 MET CG C 13 32.732 0.000 A 117 LEU H H 1 7.781 0.009 A 117 LEU HA H 1 3.909 0.000 A 117 LEU HBx H 1 1.804 0.000 A 117 LEU HBy H 1 1.804 0.000 A 117 LEU HDx% H 1 0.982 0.000 A 117 LEU HDy% H 1 0.982 0.000 A 117 LEU HG H 1 1.744 0.042 A 117 LEU CA C 13 58.594 0.000 A 117 LEU CB C 13 41.336 0.000 A 117 LEU CG C 13 27.891 0.974 A 117 LEU N N 15 117.768 0.114 A 118 PHE H H 1 8.024 0.008 A 118 PHE HA H 1 4.428 0.012 A 118 PHE HBx H 1 3.342 0.016 A 118 PHE HBy H 1 3.342 0.016 A 118 PHE HDx H 1 7.286 0.002 A 118 PHE HDy H 1 7.286 0.002 A 118 PHE CA C 13 60.735 0.301 A 118 PHE N N 15 118.204 0.087 A 119 THR H H 1 8.171 0.008 A 119 THR HA H 1 3.972 0.023 A 119 THR HB H 1 4.539 0.013 A 119 THR HG2% H 1 1.309 0.008 A 119 THR CA C 13 67.518 0.005 A 119 THR CB C 13 69.194 0.000 A 119 THR CG2 C 13 20.450 0.000 A 119 THR N N 15 114.941 0.206 A 120 LYS H H 1 8.359 0.015 A 120 LYS HA H 1 3.980 0.007 A 120 LYS HBx H 1 1.876 0.018 A 120 LYS HBy H 1 1.876 0.018 A 120 LYS HGx H 1 1.521 0.000 A 120 LYS HGy H 1 1.521 0.000 A 120 LYS CA C 13 60.810 0.041 A 120 LYS CB C 13 32.515 0.000 A 120 LYS CG C 13 25.015 0.000 A 120 LYS N N 15 121.758 0.105 A 121 GLU H H 1 8.222 0.012 A 121 GLU HA H 1 4.214 0.013 A 121 GLU HBy H 1 2.279 0.003 A 121 GLU HBx H 1 2.182 0.002 A 121 GLU HGx H 1 2.598 0.017 A 121 GLU HGy H 1 2.598 0.017 A 121 GLU CA C 13 59.240 0.071 A 121 GLU CB C 13 28.383 0.000 A 121 GLU CG C 13 35.329 0.000 A 121 GLU N N 15 117.504 0.084 A 122 PHE H H 1 8.562 0.016 A 122 PHE HA H 1 4.294 0.010 A 122 PHE HBx H 1 3.217 0.018 A 122 PHE HBy H 1 3.217 0.018 A 122 PHE HDx H 1 7.215 0.005 A 122 PHE HDy H 1 7.215 0.005 A 122 PHE CA C 13 61.574 0.052 A 122 PHE CB C 13 39.359 0.000 A 122 PHE N N 15 121.586 0.114 A 123 VAL H H 1 8.784 0.019 A 123 VAL HA H 1 3.516 0.011 A 123 VAL HB H 1 2.356 0.009 A 123 VAL HGx% H 1 1.268 0.006 A 123 VAL HGy% H 1 1.032 0.012 A 123 VAL CA C 13 67.608 0.138 A 123 VAL CB C 13 31.461 0.000 A 123 VAL CGy C 13 23.596 0.202 A 123 VAL CGx C 13 21.867 0.087 A 123 VAL N N 15 121.558 0.136 A 124 GLU H H 1 8.564 0.008 A 124 GLU HA H 1 4.042 0.000 A 124 GLU HBx H 1 2.361 0.042 A 124 GLU HBy H 1 2.361 0.042 A 124 GLU HGx H 1 2.712 0.013 A 124 GLU HGy H 1 2.712 0.013 A 124 GLU CA C 13 60.207 0.073 A 124 GLU CB C 13 28.425 0.000 A 124 GLU CG C 13 34.727 0.014 A 124 GLU N N 15 118.314 0.094 A 125 SER H H 1 8.348 0.019 A 125 SER HA H 1 4.265 0.015 A 125 SER CA C 13 62.342 0.013 A 125 SER CB C 13 63.162 0.000 A 125 SER N N 15 114.779 0.149 A 126 SER H H 1 8.144 0.004 A 126 SER HA H 1 4.069 0.006 A 126 SER HBx H 1 3.649 0.008 A 126 SER HBy H 1 3.649 0.008 A 126 SER CA C 13 62.846 0.338 A 126 SER N N 15 118.464 0.034 A 127 ILE H H 1 8.280 0.008 A 127 ILE HA H 1 3.681 0.023 A 127 ILE HB H 1 2.000 0.021 A 127 ILE HD1% H 1 0.910 0.006 A 127 ILE HG1x H 1 1.294 0.013 A 127 ILE HG1y H 1 1.294 0.013 A 127 ILE HG2% H 1 0.951 0.011 A 127 ILE CA C 13 65.641 0.066 A 127 ILE CB C 13 38.034 0.000 A 127 ILE CD1 C 13 13.637 0.117 A 127 ILE CG2 C 13 17.573 0.000 A 127 ILE N N 15 124.705 0.092 A 128 LYS H H 1 7.741 0.015 A 128 LYS HBx H 1 1.757 0.008 A 128 LYS HBy H 1 1.757 0.008 A 128 LYS HGx H 1 1.529 0.000 A 128 LYS HGy H 1 1.529 0.000 A 128 LYS CA C 13 59.885 0.031 A 128 LYS CB C 13 32.248 0.000 A 128 LYS CG C 13 25.040 0.000 A 128 LYS N N 15 119.907 0.136 A 129 ILE H H 1 8.215 0.010 A 129 ILE HA H 1 4.107 0.006 A 129 ILE HB H 1 1.966 0.018 A 129 ILE HD1% H 1 0.956 0.007 A 129 ILE HG2% H 1 0.974 0.015 A 129 ILE CA C 13 64.392 0.342 A 129 ILE CB C 13 38.050 0.000 A 129 ILE CD1 C 13 13.603 0.000 A 129 ILE CG2 C 13 17.706 0.000 A 129 ILE N N 15 118.807 0.090 A 130 THR H H 1 7.988 0.010 A 130 THR HA H 1 3.921 0.000 A 130 THR HB H 1 4.313 0.013 A 130 THR HG1 H 1 1.222 0.000 A 130 THR HG2% H 1 1.248 0.014 A 130 THR CA C 13 68.210 0.250 A 130 THR CG2 C 13 21.678 0.000 A 130 THR N N 15 117.328 0.107 A 131 GLU H H 1 8.439 0.008 A 131 GLU HA H 1 3.978 0.016 A 131 GLU HBx H 1 2.382 0.009 A 131 GLU HBy H 1 2.382 0.009 A 131 GLU HGx H 1 2.716 0.008 A 131 GLU HGy H 1 2.716 0.008 A 131 GLU CA C 13 59.600 0.138 A 131 GLU CG C 13 34.723 0.018 A 131 GLU N N 15 118.968 0.054 A 132 GLU H H 1 7.987 0.009 A 132 GLU HA H 1 4.226 0.000 A 132 GLU HBx H 1 2.255 0.000 A 132 GLU HBy H 1 2.255 0.000 A 132 GLU HGx H 1 2.668 0.002 A 132 GLU HGy H 1 2.668 0.002 A 132 GLU CA C 13 59.267 0.093 A 132 GLU CB C 13 28.619 0.000 A 132 GLU CG C 13 34.674 0.076 A 132 GLU N N 15 118.712 0.023 A 133 VAL H H 1 8.341 0.004 A 133 VAL HA H 1 3.867 0.015 A 133 VAL HB H 1 2.355 0.003 A 133 VAL HGx% H 1 1.201 0.003 A 133 VAL HGy% H 1 0.998 0.020 A 133 VAL CA C 13 66.330 0.234 A 133 VAL CB C 13 32.156 0.076 A 133 VAL CGy C 13 21.954 0.000 A 133 VAL N N 15 120.060 0.095 A 134 ILE H H 1 8.331 0.009 A 134 ILE HA H 1 3.860 0.014 A 134 ILE HB H 1 1.815 0.009 A 134 ILE HD1% H 1 0.961 0.020 A 134 ILE HG2% H 1 0.994 0.006 A 134 ILE CA C 13 65.184 0.013 A 134 ILE CB C 13 37.902 0.000 A 134 ILE CD1 C 13 13.334 0.193 A 134 ILE CG2 C 13 17.748 0.125 A 134 ILE N N 15 119.699 0.132 A 135 ASN H H 1 8.318 0.013 A 135 ASN HA H 1 4.675 0.005 A 135 ASN HBx H 1 2.970 0.010 A 135 ASN HBy H 1 2.970 0.010 A 135 ASN HD2y H 1 7.598 0.003 A 135 ASN HD2x H 1 6.898 0.004 A 135 ASN CA C 13 55.505 0.015 A 135 ASN CB C 13 39.127 0.079 A 135 ASN N N 15 117.396 0.089 A 135 ASN ND2 N 15 111.636 0.038 A 136 THR H H 1 8.006 0.009 A 136 THR HA H 1 4.308 0.006 A 136 THR HB H 1 4.679 0.000 A 136 THR HG2% H 1 1.299 0.007 A 136 THR CA C 13 63.872 0.032 A 136 THR CB C 13 69.779 0.000 A 136 THR CG2 C 13 21.903 0.000 A 136 THR N N 15 111.419 0.047 A 137 HIS H H 1 8.013 0.013 A 137 HIS HA H 1 4.703 0.016 A 137 HIS HBy H 1 3.457 0.033 A 137 HIS HBx H 1 3.208 0.017 A 137 HIS CA C 13 56.460 0.014 A 137 HIS CB C 13 28.712 0.341 A 137 HIS N N 15 118.612 0.150 A 138 HIS H H 1 8.169 0.017 A 138 HIS HA H 1 4.826 0.011 A 138 HIS HBy H 1 3.398 0.026 A 138 HIS HBx H 1 3.278 0.010 A 138 HIS HD2 H 1 7.311 0.002 A 138 HIS CA C 13 55.514 0.145 A 138 HIS CB C 13 29.246 0.085 A 138 HIS N N 15 118.709 0.024 A 139 ARG H H 1 8.419 0.013 A 139 ARG HA H 1 4.566 0.020 A 139 ARG HBx H 1 1.860 0.018 A 139 ARG HBy H 1 1.860 0.018 A 139 ARG HDx H 1 3.283 0.010 A 139 ARG HDy H 1 3.283 0.010 A 139 ARG HGx H 1 1.938 0.000 A 139 ARG HGy H 1 1.938 0.000 A 139 ARG CA C 13 56.394 0.082 A 139 ARG CB C 13 31.021 0.030 A 139 ARG CD C 13 43.423 0.073 A 139 ARG CG C 13 26.951 0.000 A 139 ARG N N 15 123.025 0.070 A 140 SER H H 1 8.017 0.011 A 140 SER HA H 1 4.445 0.020 A 140 SER HBx H 1 3.976 0.033 A 140 SER HBy H 1 3.976 0.033 A 140 SER CA C 13 60.821 0.000 A 140 SER N N 15 122.549 0.046 stop_ save_ save_DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_4 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 60 CYS HG A 27 GLY H 1.0 . 15.00 2 2 A 68 GLY H A 20 PHE HD% 1.0 . 5.13 3 2 A 20 PHE HE% A 68 GLY H 1.0 . 5.13 4 3 A 20 PHE HE% A 68 GLY HAx 1.0 . 4.15 5 3 A 20 PHE HD% A 68 GLY HAx 1.0 . 4.15 6 3 A 68 GLY HAy A 20 PHE HD% 1.0 . 4.15 7 3 A 20 PHE HE% A 68 GLY HAy 1.0 . 4.15 8 4 A 16 LEU HA A 71 PHE HBx 1.0 . 4.24 9 4 A 16 LEU HA A 71 PHE HBy 1.0 . 4.24 10 5 A 12 ILE HG2% A 72 TYR HE% 1.0 . 4.50 11 5 A 12 ILE HG2% A 72 TYR HD% 1.0 . 4.50 12 6 A 52 PHE HD% A 31 VAL HG11 1.0 . 3.48 13 6 A 52 PHE HE% A 31 VAL HG11 1.0 . 3.48 14 6 A 31 VAL HGy% A 52 PHE HE% 1.0 . 3.48 15 6 A 31 VAL HGy% A 52 PHE HD% 1.0 . 3.48 16 7 A 20 PHE HE% A 64 SER HBx 1.0 . 5.00 17 7 A 20 PHE HD% A 64 SER HBx 1.0 . 5.00 18 7 A 64 SER HBy A 20 PHE HD% 1.0 . 5.00 19 7 A 20 PHE HE% A 64 SER HBy 1.0 . 5.00 20 8 A 72 TYR HE% A 13 ASP HBx 1.0 . 4.50 21 8 A 72 TYR HE% A 13 ASP HBy 1.0 . 4.50 22 9 A 63 PHE HE% A 87 VAL HGy% 1.0 . 3.50 23 9 A 63 PHE HD% A 87 VAL HGy% 1.0 . 3.50 24 10 A 69 LEU HDx% A 80 LYS HGx 1.0 . 3.81 25 10 A 69 LEU HDy% A 80 LYS HGx 1.0 . 3.81 26 10 A 80 LYS HGy A 69 LEU HDx% 1.0 . 3.81 27 10 A 69 LEU HDy% A 80 LYS HGy 1.0 . 3.81 28 11 A 51 TYR HE% A 95 LEU HD11 1.0 . 3.50 29 11 A 95 LEU HDy% A 51 TYR HE% 1.0 . 3.50 30 12 A 51 TYR HE% A 98 ILE HG1x 1.0 . 3.50 31 12 A 51 TYR HE% A 98 ILE HG1y 1.0 . 3.50 32 13 A 102 ILE HD1% A 47 GLY H 1.0 . 4.00 33 14 A 63 PHE HE% A 84 SER HBx 1.0 . 4.38 34 14 A 63 PHE HD% A 84 SER HBx 1.0 . 4.38 35 14 A 84 SER HBy A 63 PHE HD% 1.0 . 4.38 36 14 A 63 PHE HE% A 84 SER HBy 1.0 . 4.38 37 15 A 116 MET HE% A 95 LEU HD11 1.0 . 3.50 38 15 A 95 LEU HDy% A 116 MET HE% 1.0 . 3.50 39 16 A 116 MET HE% A 95 LEU HD11 1.0 . 3.50 40 16 A 95 LEU HDy% A 116 MET HE% 1.0 . 3.50 41 17 A 123 VAL HGx% A 88 LEU HD11 1.0 . 2.56 42 17 A 88 LEU HDy% A 123 VAL HGx% 1.0 . 2.56 43 18 A 116 MET HE% A 96 LYS HGx 1.0 . 3.13 44 18 A 116 MET HE% A 96 LYS HGy 1.0 . 3.13 45 19 A 116 MET HE% A 96 LYS HEx 1.0 . 3.06 46 19 A 116 MET HE% A 96 LYS HEy 1.0 . 3.06 47 20 A 116 MET HE% A 92 THR HG2% 1.0 . 3.50 48 21 A 116 MET HE% A 95 LEU HD11 1.0 . 3.50 49 21 A 95 LEU HDy% A 116 MET HE% 1.0 . 3.50 50 22 A 122 PHE HD% A 23 ILE HG1x 1.0 . 4.20 51 22 A 122 PHE HD% A 23 ILE HG1y 1.0 . 4.20 52 23 A 12 ILE HD1% A 133 VAL HGx% 1.0 . 3.00 53 24 A 41 GLN HE2x A 111 LEU HDx% 1.0 . 3.98 54 24 A 41 GLN HE2x A 111 LEU HDy% 1.0 . 3.98 55 25 A 41 GLN HE2x A 108 ALA HB% 1.0 . 4.94 56 26 A 108 ALA HB% A 41 GLN HGx 1.0 . 3.23 57 27 A 33 ALA HB% A 115 TYR HBx 1.0 . 4.22 58 27 A 115 TYR HBy A 33 ALA HB% 1.0 . 4.22 59 28 A 19 VAL HGy% A 125 SER HBx 1.0 . 2.73 60 28 A 19 VAL HGx% A 125 SER HBx 1.0 . 2.73 61 28 A 125 SER HBy A 19 VAL HGy% 1.0 . 2.73 62 28 A 125 SER HBy A 19 VAL HGx% 1.0 . 2.73 63 29 A 19 VAL HB A 129 ILE HD1% 1.0 . 2.90 64 30 A 129 ILE HB A 19 VAL HGy% 1.0 . 4.16 65 30 A 19 VAL HGx% A 129 ILE HB 1.0 . 4.16 66 31 A 129 ILE HB A 15 ILE HG2% 1.0 . 4.16 67 32 A 115 TYR HE% A 37 ILE HG1x 1.0 . 4.50 68 32 A 37 ILE HG1y A 115 TYR HE% 1.0 . 4.50 69 33 A 26 ILE HG2% A 118 PHE HD% 1.0 . 4.50 70 33 A 118 PHE HE% A 26 ILE HG2% 1.0 . 4.50 71 34 A 26 ILE HD1% A 118 PHE HD% 1.0 . 3.67 72 34 A 118 PHE HE% A 26 ILE HD1% 1.0 . 3.67 73 35 A 108 ALA HB% A 37 ILE HG2% 1.0 . 4.50 74 36 A 122 PHE HD% A 19 VAL HGy% 1.0 . 3.83 75 36 A 122 PHE HD% A 19 VAL HGx% 1.0 . 3.83 76 36 A 122 PHE HE% A 19 VAL HGy% 1.0 . 3.83 77 36 A 19 VAL HGx% A 122 PHE HE% 1.0 . 3.83 78 37 A 105 THR HG2% A 43 GLY H 1.0 . 4.00 79 38 A 115 TYR HE% A 30 SER HA 1.0 . 4.03 80 38 A 30 SER HA A 115 TYR HD% 1.0 . 4.03 81 39 A 51 TYR HE% A 48 GLY H 1.0 . 4.67 82 39 A 48 GLY H A 51 TYR HD% 1.0 . 4.67 83 40 A 48 GLY H A 51 TYR HBx 1.0 . 3.79 84 40 A 48 GLY H A 51 TYR HBy 1.0 . 3.79 85 41 A 48 GLY H A 50 LEU HDx% 1.0 . 4.00 86 41 A 48 GLY H A 50 LEU HDy% 1.0 . 4.00 87 42 A 115 TYR H A 114 LYS HEx 1.0 . 4.33 88 42 A 115 TYR H A 114 LYS HEy 1.0 . 4.33 89 43 A 118 PHE HD% A 114 LYS HEx 1.0 . 4.01 90 43 A 114 LYS HEy A 118 PHE HD% 1.0 . 4.01 91 43 A 118 PHE HE% A 114 LYS HEx 1.0 . 4.01 92 43 A 118 PHE HE% A 114 LYS HEy 1.0 . 4.01 93 44 A 115 TYR HE% A 114 LYS HEy 1.0 . 4.09 94 44 A 115 TYR HE% A 114 LYS HEx 1.0 . 4.09 95 44 A 115 TYR HD% A 114 LYS HEx 1.0 . 4.09 96 44 A 114 LYS HEy A 115 TYR HD% 1.0 . 4.09 97 45 A 115 TYR HE% A 111 LEU HDx% 1.0 . 3.98 98 45 A 111 LEU HDy% A 115 TYR HE% 1.0 . 3.98 99 45 A 111 LEU HDy% A 115 TYR HD% 1.0 . 3.98 100 45 A 115 TYR HD% A 111 LEU HDx% 1.0 . 3.98 101 46 A 111 LEU HDy% A 114 LYS HEx 1.0 . 3.72 102 46 A 111 LEU HDx% A 114 LYS HEx 1.0 . 3.72 103 46 A 114 LYS HEy A 111 LEU HDx% 1.0 . 3.72 104 46 A 111 LEU HDy% A 114 LYS HEy 1.0 . 3.72 105 47 A 37 ILE HA A 36 LEU H 1.0 . 4.93 106 48 A 130 THR HA A 132 GLU H 1.0 . 3.42 107 49 A 12 ILE HD1% A 9 ALA H 1.0 . 4.54 108 50 A 108 ALA HB% A 111 LEU H 1.0 . 4.43 109 51 A 135 ASN H A 134 ILE HG1x 1.0 . 4.06 110 51 A 134 ILE HG1y A 135 ASN H 1.0 . 4.06 111 52 A 89 LYS H A 89 LYS HA 1.0 . 3.78 112 53 A 92 THR HG2% A 96 LYS HEx 1.0 . 3.31 113 53 A 96 LYS HEy A 92 THR HG2% 1.0 . 3.31 114 54 A 35 ARG HE A 38 GLU HGx 1.0 . 5.00 115 54 A 38 GLU HGy A 35 ARG HE 1.0 . 5.00 116 55 A 119 THR H A 118 PHE HA 1.0 . 3.93 117 56 A 70 VAL HA A 71 PHE H 1.0 . 3.76 118 57 A 97 LYS HA A 97 LYS H 1.0 . 3.60 119 58 A 55 ASN HA A 56 VAL H 1.0 . 3.98 120 59 A 126 SER HA A 127 ILE H 1.0 . 4.03 121 60 A 91 LEU HA A 92 THR H 1.0 . 3.69 122 61 A 19 VAL HA A 20 PHE H 1.0 . 4.46 123 62 A 77 SER HA A 78 GLY H 1.0 . 3.60 124 63 A 123 VAL HA A 124 GLU H 1.0 . 4.65 125 64 A 15 ILE HA A 16 LEU H 1.0 . 4.40 126 65 A 112 ILE HA A 113 GLY H 1.0 . 3.75 127 66 A 49 PRO HA A 50 LEU H 1.0 . 3.82 128 67 A 104 SER HA A 105 THR H 1.0 . 3.79 129 68 A 84 SER HA A 85 LYS H 1.0 . 3.46 130 69 A 36 LEU HA A 37 ILE H 1.0 . 3.51 131 70 A 54 VAL HA A 55 ASN H 1.0 . 3.91 132 71 A 66 LEU HA A 67 THR H 1.0 . 3.72 133 72 A 99 VAL HA A 100 GLU H 1.0 . 4.37 134 73 A 69 LEU HA A 70 VAL H 1.0 . 3.56 135 74 A 101 LEU HA A 102 ILE H 1.0 . 3.81 136 75 A 97 LYS H A 96 LYS HA 1.0 . 4.29 137 76 A 111 LEU H A 110 PRO HA 1.0 . 4.42 138 77 A 30 SER HA A 31 VAL H 1.0 . 3.89 139 78 A 97 LYS HA A 98 ILE H 1.0 . 3.72 140 79 A 120 LYS HA A 121 GLU H 1.0 . 4.15 141 80 A 135 ASN H A 134 ILE HA 1.0 . 4.02 142 81 A 137 HIS HA A 138 HIS H 1.0 . 3.63 143 82 A 12 ILE HA A 13 ASP H 1.0 . 3.77 144 83 A 108 ALA HA A 109 VAL H 1.0 . 4.01 145 84 A 116 MET H A 116 MET HBx 1.0 . 4.00 146 84 A 116 MET H A 116 MET HBy 1.0 . 4.00 147 85 A 69 LEU HG A 80 LYS HGx 1.0 . 2.66 148 85 A 80 LYS HGy A 69 LEU HG 1.0 . 2.66 149 86 A 60 CYS HBx A 57 ILE HA 1.0 . 4.41 150 87 A 80 LYS HA A 83 GLU HBx 1.0 . 3.32 151 87 A 83 GLU HBy A 80 LYS HA 1.0 . 3.32 152 88 A 90 SER HA A 93 GLU HBx 1.0 . 3.48 153 88 A 93 GLU HBy A 90 SER HA 1.0 . 3.48 154 89 A 118 PHE HA A 121 GLU HBx 1.0 . 4.11 155 90 A 81 MET HA A 84 SER HBx 1.0 . 3.01 156 90 A 84 SER HBy A 81 MET HA 1.0 . 3.01 157 91 A 130 THR HA A 133 VAL HB 1.0 . 3.39 158 92 A 51 TYR HA A 54 VAL HB 1.0 . 3.61 159 93 A 85 LYS HA A 88 LEU HBx 1.0 . 4.02 160 93 A 85 LYS HA A 88 LEU HBy 1.0 . 4.02 161 94 A 68 GLY HAy A 71 PHE HBx 1.0 . 4.19 162 94 A 68 GLY HAx A 71 PHE HBx 1.0 . 4.19 163 94 A 71 PHE HBy A 68 GLY HAx 1.0 . 4.19 164 94 A 68 GLY HAy A 71 PHE HBy 1.0 . 4.19 165 95 A 108 ALA HA A 111 LEU HBx 1.0 . 4.16 166 96 A 113 GLY H A 110 PRO HA 1.0 . 4.08 167 97 A 67 THR HA A 70 VAL HB 1.0 . 3.28 168 98 A 95 LEU HA A 98 ILE HB 1.0 . 3.74 169 99 A 70 VAL HA A 74 PRO HA 1.0 . 3.07 170 100 A 59 PRO HA A 62 LYS HBx 1.0 . 3.50 171 100 A 59 PRO HA A 62 LYS HBy 1.0 . 3.50 172 101 A 21 ASP HA A 24 CYS HBx 1.0 . 3.51 173 101 A 21 ASP HA A 24 CYS HBy 1.0 . 3.51 174 102 A 111 LEU H A 110 PRO HBx 1.0 . 4.74 175 102 A 111 LEU H A 110 PRO HBy 1.0 . 4.74 176 103 A 9 ALA HA A 10 MET H 1.0 . 3.88 177 104 A 13 ASP H A 9 ALA HA 1.0 . 4.47 178 105 A 9 ALA H A 9 ALA HA 1.0 . 4.09 179 106 A 10 MET H A 10 MET HA 1.0 . 3.88 180 107 A 13 ASP H A 10 MET HA 1.0 . 3.90 181 108 A 9 ALA H A 10 MET HA 1.0 . 4.51 182 109 A 12 ILE H A 10 MET HBx 1.0 . 4.56 183 109 A 10 MET HBy A 12 ILE H 1.0 . 4.56 184 110 A 12 ILE HA A 15 ILE H 1.0 . 4.04 185 111 A 11 VAL H A 12 ILE HB 1.0 . 4.18 186 112 A 11 VAL H A 12 ILE HB 1.0 . 4.18 187 113 A 12 ILE HG2% A 11 VAL H 1.0 . 4.57 188 114 A 13 ASP H A 13 ASP HA 1.0 . 3.50 189 115 A 13 ASP H A 11 VAL H 1.0 . 4.49 190 116 A 17 LYS HA A 19 VAL H 1.0 . 4.40 191 117 A 20 PHE HD% A 24 CYS H 1.0 . 4.48 192 118 A 20 PHE H A 21 ASP HA 1.0 . 4.90 193 119 A 17 LYS HA A 21 ASP HBx 1.0 . 4.10 194 119 A 17 LYS HA A 21 ASP HBy 1.0 . 4.10 195 120 A 22 LYS HA A 22 LYS HEx 1.0 . 2.56 196 120 A 22 LYS HA A 22 LYS HEy 1.0 . 2.56 197 121 A 22 LYS HA A 23 ILE H 1.0 . 4.03 198 122 A 27 GLY H A 26 ILE HA 1.0 . 3.54 199 123 A 26 ILE HA A 26 ILE HB 1.0 . 4.11 200 124 A 25 LYS H A 26 ILE H 1.0 . 4.54 201 125 A 30 SER HA A 33 ALA H 1.0 . 3.50 202 126 A 31 VAL HA A 32 GLU H 1.0 . 3.32 203 127 A 31 VAL HB A 32 GLU HA 1.0 . 4.46 204 128 A 30 SER HA A 32 GLU H 1.0 . 4.40 205 129 A 32 GLU H A 34 GLY H 1.0 . 3.37 206 130 A 36 LEU H A 32 GLU HBx 1.0 . 4.53 207 130 A 36 LEU H A 32 GLU HBy 1.0 . 4.53 208 131 A 33 ALA H A 33 ALA HA 1.0 . 4.25 209 132 A 30 SER HA A 33 ALA H 1.0 . 3.66 210 133 A 33 ALA H A 35 ARG H 1.0 . 4.37 211 134 A 33 ALA H A 34 GLY HAx 1.0 . 4.53 212 134 A 33 ALA H A 34 GLY HAy 1.0 . 4.53 213 135 A 35 ARG HE A 35 ARG HA 1.0 . 4.16 214 136 A 36 LEU H A 35 ARG HA 1.0 . 4.18 215 137 A 35 ARG HDx A 38 GLU HBx 1.0 . 4.19 216 137 A 35 ARG HDy A 38 GLU HBx 1.0 . 4.19 217 137 A 38 GLU HBy A 35 ARG HDx 1.0 . 4.19 218 137 A 35 ARG HDy A 38 GLU HBy 1.0 . 4.19 219 138 A 36 LEU H A 33 ALA H 1.0 . 4.71 220 139 A 37 ILE H A 34 GLY HAx 1.0 . 4.38 221 139 A 37 ILE H A 34 GLY HAy 1.0 . 4.38 222 140 A 37 ILE HG2% A 41 GLN HE2y 1.0 . 4.28 223 141 A 40 SER H A 41 GLN HGy 1.0 . 4.18 224 141 A 41 GLN HGx A 40 SER H 1.0 . 4.18 225 142 A 35 ARG HA A 39 LEU H 1.0 . 3.72 226 143 A 37 ILE H A 39 LEU H 1.0 . 5.11 227 144 A 40 SER H A 39 LEU HDx% 1.0 . 3.86 228 144 A 40 SER H A 39 LEU HDy% 1.0 . 3.86 229 145 A 42 GLU H A 40 SER HBx 1.0 . 4.74 230 145 A 40 SER HBy A 42 GLU H 1.0 . 4.74 231 146 A 42 GLU H A 40 SER HBx 1.0 . 4.69 232 146 A 40 SER HBy A 42 GLU H 1.0 . 4.69 233 147 A 41 GLN HE2x A 37 ILE HG2% 1.0 . 3.90 234 148 A 40 SER H A 41 GLN HBx 1.0 . 5.08 235 148 A 40 SER H A 41 GLN HBy 1.0 . 5.08 236 149 A 43 GLY H A 41 GLN HBx 1.0 . 4.81 237 149 A 43 GLY H A 41 GLN HBy 1.0 . 4.81 238 150 A 40 SER H A 41 GLN HGy 1.0 . 3.94 239 150 A 41 GLN HGx A 40 SER H 1.0 . 3.94 240 151 A 42 GLU HA A 44 GLY H 1.0 . 4.21 241 152 A 43 GLY H A 42 GLU HBx 1.0 . 4.02 242 152 A 43 GLY H A 42 GLU HBy 1.0 . 4.02 243 153 A 43 GLY H A 42 GLU HGx 1.0 . 4.26 244 153 A 43 GLY H A 42 GLU HGy 1.0 . 4.26 245 154 A 42 GLU H A 43 GLY HAx 1.0 . 3.85 246 154 A 42 GLU H A 43 GLY HAy 1.0 . 3.85 247 155 A 42 GLU H A 43 GLY HAx 1.0 . 3.60 248 155 A 42 GLU H A 43 GLY HAy 1.0 . 3.60 249 156 A 43 GLY H A 43 GLY HAx 1.0 . 4.79 250 156 A 43 GLY H A 43 GLY HAy 1.0 . 4.79 251 157 A 50 LEU H A 51 TYR HBx 1.0 . 4.07 252 157 A 51 TYR HBy A 50 LEU H 1.0 . 4.07 253 158 A 52 PHE HE% A 53 VAL H 1.0 . 4.87 254 159 A 55 ASN H A 55 ASN HD2x 1.0 . 4.49 255 160 A 54 VAL HA A 58 GLU H 1.0 . 4.56 256 161 A 54 VAL HB A 54 VAL H 1.0 . 4.20 257 162 A 54 VAL HB A 54 VAL H 1.0 . 4.30 258 163 A 54 VAL H A 52 PHE HA 1.0 . 4.36 259 164 A 56 VAL H A 56 VAL HG11 1.0 . 3.45 260 164 A 56 VAL H A 56 VAL HGy% 1.0 . 3.45 261 165 A 53 VAL HA A 57 ILE HB 1.0 . 4.51 262 166 A 58 GLU HA A 61 LYS H 1.0 . 3.94 263 167 A 56 VAL H A 58 GLU H 1.0 . 4.64 264 168 A 60 CYS HA A 60 CYS HBy 1.0 . 3.46 265 169 A 62 LYS H A 63 PHE H 1.0 . 5.11 266 170 A 60 CYS HA A 63 PHE HBx 1.0 . 3.68 267 170 A 60 CYS HA A 63 PHE HBy 1.0 . 3.68 268 171 A 66 LEU H A 64 SER HBx 1.0 . 4.49 269 171 A 64 SER HBy A 66 LEU H 1.0 . 4.49 270 172 A 63 PHE H A 65 GLU H 1.0 . 4.30 271 173 A 68 GLY H A 69 LEU HA 1.0 . 4.74 272 174 A 67 THR H A 69 LEU H 1.0 . 4.12 273 175 A 75 THR HA A 76 ASP HBx 1.0 . 4.35 274 175 A 75 THR HA A 76 ASP HBy 1.0 . 4.35 275 176 A 75 THR HB A 76 ASP HBx 1.0 . 3.74 276 176 A 76 ASP HBy A 75 THR HB 1.0 . 3.74 277 177 A 75 THR H A 75 THR HG2% 1.0 . 3.88 278 178 A 75 THR HA A 76 ASP HBx 1.0 . 4.42 279 178 A 75 THR HA A 76 ASP HBy 1.0 . 4.42 280 179 A 75 THR HA A 76 ASP HBx 1.0 . 4.39 281 179 A 75 THR HA A 76 ASP HBy 1.0 . 4.39 282 180 A 77 SER HA A 76 ASP HBx 1.0 . 4.83 283 180 A 77 SER HA A 76 ASP HBy 1.0 . 4.83 284 181 A 78 GLY H A 79 GLU H 1.0 . 4.54 285 182 A 79 GLU HA A 76 ASP HBx 1.0 . 3.74 286 182 A 76 ASP HBy A 79 GLU HA 1.0 . 3.74 287 183 A 78 GLY H A 79 GLU HBx 1.0 . 3.79 288 183 A 78 GLY H A 79 GLU HBy 1.0 . 3.79 289 184 A 79 GLU HA A 79 GLU HGx 1.0 . 3.89 290 184 A 79 GLU HA A 79 GLU HGy 1.0 . 3.89 291 185 A 80 LYS HA A 80 LYS HEx 1.0 . 4.00 292 185 A 80 LYS HA A 80 LYS HEy 1.0 . 4.00 293 186 A 80 LYS HA A 80 LYS HEx 1.0 . 4.31 294 186 A 80 LYS HA A 80 LYS HEy 1.0 . 4.31 295 187 A 85 LYS H A 82 THR HG2% 1.0 . 5.18 296 188 A 85 LYS H A 82 THR HG2% 1.0 . 5.19 297 189 A 82 THR H A 83 GLU H 1.0 . 4.80 298 190 A 84 SER HA A 84 SER HBx 1.0 . 3.36 299 190 A 84 SER HBy A 84 SER HA 1.0 . 3.36 300 191 A 86 SER HA A 88 LEU H 1.0 . 4.40 301 192 A 88 LEU H A 87 VAL HA 1.0 . 3.50 302 193 A 84 SER HA A 87 VAL HB 1.0 . 4.42 303 194 A 85 LYS HA A 88 LEU HG 1.0 . 3.76 304 195 A 89 LYS HA A 89 LYS HEx 1.0 . 4.10 305 195 A 89 LYS HA A 89 LYS HEy 1.0 . 4.10 306 196 A 90 SER HA A 90 SER H 1.0 . 3.94 307 197 A 90 SER HA A 90 SER H 1.0 . 3.34 308 198 A 88 LEU HA A 91 LEU HBy 1.0 . 3.74 309 199 A 90 SER H A 91 LEU HBx 1.0 . 4.23 310 200 A 89 LYS H A 91 LEU H 1.0 . 3.72 311 201 A 92 THR HG2% A 95 LEU H 1.0 . 4.49 312 202 A 92 THR HG2% A 95 LEU H 1.0 . 4.56 313 203 A 94 LYS HA A 94 LYS HEx 1.0 . 2.56 314 203 A 94 LYS HA A 94 LYS HEy 1.0 . 2.56 315 204 A 95 LEU H A 94 LYS HBx 1.0 . 4.22 316 204 A 95 LEU H A 94 LYS HBy 1.0 . 4.22 317 205 A 95 LEU H A 94 LYS H 1.0 . 4.72 318 206 A 98 ILE H A 96 LYS H 1.0 . 4.54 319 207 A 100 GLU H A 97 LYS HBx 1.0 . 4.31 320 207 A 100 GLU H A 97 LYS HBy 1.0 . 4.31 321 208 A 98 ILE H A 99 VAL H 1.0 . 4.04 322 209 A 100 GLU H A 101 LEU HBy 1.0 . 4.04 323 210 A 102 ILE HD1% A 101 LEU H 1.0 . 4.51 324 211 A 99 VAL H A 101 LEU H 1.0 . 4.04 325 212 A 109 VAL H A 107 SER H 1.0 . 4.64 326 213 A 109 VAL H A 107 SER HBx 1.0 . 4.52 327 213 A 109 VAL H A 107 SER HBy 1.0 . 4.52 328 214 A 112 ILE HG1y A 116 MET HGx 1.0 . 3.31 329 214 A 112 ILE HG1x A 116 MET HGx 1.0 . 3.31 330 214 A 116 MET HGy A 112 ILE HG1x 1.0 . 3.31 331 214 A 112 ILE HG1y A 116 MET HGy 1.0 . 3.31 332 215 A 100 GLU HA A 97 LYS HEx 1.0 . 3.86 333 215 A 97 LYS HEy A 100 GLU HA 1.0 . 3.86 334 216 A 115 TYR H A 114 LYS H 1.0 . 2.60 335 217 A 126 SER H A 123 VAL HGy% 1.0 . 4.01 336 217 A 123 VAL HGx% A 126 SER H 1.0 . 4.01 337 218 A 127 ILE HB A 130 THR HG1 1.0 . 4.54 338 219 A 125 SER HA A 128 LYS HBx 1.0 . 4.34 339 219 A 125 SER HA A 128 LYS HBy 1.0 . 4.34 340 220 A 135 ASN HA A 136 THR H 1.0 . 4.00 341 221 A 136 THR H A 136 THR HB 1.0 . 4.00 342 222 A 139 ARG H A 138 HIS HBy 1.0 . 3.70 343 223 A 134 ILE HD1% A 138 HIS HBx 1.0 . 3.77 344 224 A 139 ARG H A 138 HIS HBx 1.0 . 3.34 345 225 A 139 ARG H A 138 HIS HBx 1.0 . 3.43 346 226 A 139 ARG H A 139 ARG HDx 1.0 . 3.34 347 226 A 139 ARG H A 139 ARG HDy 1.0 . 3.34 348 227 A 139 ARG H A 139 ARG HDx 1.0 . 3.43 349 227 A 139 ARG H A 139 ARG HDy 1.0 . 3.43 350 228 A 60 CYS HBy A 57 ILE HG2% 1.0 . 3.25 351 229 A 10 MET HA A 12 ILE H 1.0 . 4.96 352 230 A 134 ILE HA A 136 THR H 1.0 . 4.14 353 231 A 20 PHE HD% A 19 VAL HGy% 1.0 . 4.14 354 231 A 19 VAL HGx% A 20 PHE HD% 1.0 . 4.14 355 232 A 8 HIS H A 8 HIS HBx 1.0 . 3.70 356 232 A 8 HIS H A 8 HIS HBy 1.0 . 3.70 357 233 A 8 HIS HA A 8 HIS HBx 1.0 . 2.64 358 233 A 8 HIS HBy A 8 HIS HA 1.0 . 2.64 359 234 A 9 ALA H A 8 HIS HA 1.0 . 3.32 360 235 A 9 ALA HA A 8 HIS HA 1.0 . 4.61 361 236 A 8 HIS HD2 A 8 HIS HBx 1.0 . 3.35 362 236 A 8 HIS HBy A 8 HIS HD2 1.0 . 3.35 363 237 A 9 ALA H A 8 HIS HBx 1.0 . 3.54 364 237 A 9 ALA H A 8 HIS HBy 1.0 . 3.54 365 238 A 9 ALA HB% A 8 HIS HBx 1.0 . 4.38 366 238 A 8 HIS HBy A 9 ALA HB% 1.0 . 4.38 367 239 A 9 ALA H A 9 ALA HA 1.0 . 3.68 368 240 A 9 ALA HA A 10 MET H 1.0 . 3.56 369 241 A 9 ALA HA A 12 ILE H 1.0 . 4.41 370 242 A 10 MET H A 9 ALA HB% 1.0 . 3.92 371 243 A 9 ALA HB% A 10 MET HGx 1.0 . 4.00 372 243 A 9 ALA HB% A 10 MET HGy 1.0 . 4.00 373 244 A 11 VAL H A 9 ALA HB% 1.0 . 4.69 374 245 A 13 ASP H A 9 ALA HB% 1.0 . 4.71 375 246 A 9 ALA HB% A 13 ASP HBx 1.0 . 4.81 376 246 A 13 ASP HBy A 9 ALA HB% 1.0 . 4.81 377 247 A 10 MET H A 10 MET HA 1.0 . 3.96 378 248 A 10 MET H A 10 MET HBx 1.0 . 3.44 379 248 A 10 MET H A 10 MET HBy 1.0 . 3.44 380 249 A 10 MET H A 10 MET HBx 1.0 . 4.35 381 249 A 10 MET H A 10 MET HBy 1.0 . 4.35 382 250 A 10 MET H A 10 MET HE% 1.0 . 3.76 383 251 A 10 MET H A 10 MET HGx 1.0 . 3.55 384 251 A 10 MET H A 10 MET HGy 1.0 . 3.55 385 252 A 10 MET H A 10 MET HGx 1.0 . 4.21 386 252 A 10 MET H A 10 MET HGy 1.0 . 4.21 387 253 A 10 MET H A 11 VAL H 1.0 . 3.92 388 254 A 10 MET H A 11 VAL HGy% 1.0 . 4.67 389 254 A 10 MET H A 11 VAL HG11 1.0 . 4.67 390 255 A 10 MET HA A 10 MET HE% 1.0 . 3.50 391 256 A 10 MET HA A 10 MET HGx 1.0 . 3.36 392 256 A 10 MET HA A 10 MET HGy 1.0 . 3.36 393 257 A 10 MET HA A 11 VAL H 1.0 . 3.52 394 258 A 10 MET HA A 13 ASP HBx 1.0 . 3.84 395 258 A 13 ASP HBy A 10 MET HA 1.0 . 3.84 396 259 A 10 MET HBy A 10 MET HGx 1.0 . 2.74 397 259 A 10 MET HBx A 10 MET HGx 1.0 . 2.74 398 259 A 10 MET HGy A 10 MET HBx 1.0 . 2.74 399 259 A 10 MET HBy A 10 MET HGy 1.0 . 2.74 400 260 A 10 MET HE% A 10 MET HGx 1.0 . 2.93 401 260 A 10 MET HGy A 10 MET HE% 1.0 . 2.93 402 261 A 11 VAL H A 10 MET HGx 1.0 . 4.70 403 261 A 11 VAL H A 10 MET HGy 1.0 . 4.70 404 262 A 10 MET HGx A 11 VAL HGy% 1.0 . 4.78 405 262 A 10 MET HGy A 11 VAL HGy% 1.0 . 4.78 406 262 A 11 VAL HG11 A 10 MET HGx 1.0 . 4.78 407 262 A 10 MET HGy A 11 VAL HG11 1.0 . 4.78 408 263 A 10 MET H A 11 VAL H 1.0 . 4.33 409 264 A 11 VAL H A 11 VAL HB 1.0 . 3.63 410 265 A 11 VAL H A 11 VAL HGy% 1.0 . 3.01 411 265 A 11 VAL H A 11 VAL HG11 1.0 . 3.01 412 266 A 12 ILE H A 11 VAL H 1.0 . 3.97 413 267 A 13 ASP H A 11 VAL H 1.0 . 4.24 414 268 A 11 VAL HA A 14 HIS HBx 1.0 . 4.26 415 268 A 11 VAL HA A 14 HIS HBy 1.0 . 4.26 416 269 A 11 VAL HB A 11 VAL HGy% 1.0 . 2.40 417 270 A 11 VAL HB A 14 HIS H 1.0 . 5.50 418 271 A 12 ILE H A 12 ILE HB 1.0 . 4.12 419 272 A 12 ILE H A 12 ILE HG1x 1.0 . 4.21 420 272 A 12 ILE H A 12 ILE HG1y 1.0 . 4.21 421 273 A 12 ILE HG2% A 12 ILE H 1.0 . 3.66 422 274 A 13 ASP H A 12 ILE H 1.0 . 3.94 423 275 A 13 ASP H A 12 ILE H 1.0 . 4.00 424 276 A 12 ILE H A 13 ASP HBx 1.0 . 4.77 425 276 A 13 ASP HBy A 12 ILE H 1.0 . 4.77 426 277 A 12 ILE HD1% A 12 ILE HA 1.0 . 2.76 427 278 A 12 ILE HG2% A 12 ILE HA 1.0 . 3.66 428 279 A 12 ILE HD1% A 12 ILE HB 1.0 . 2.65 429 280 A 13 ASP H A 12 ILE HG1x 1.0 . 4.11 430 280 A 13 ASP H A 12 ILE HG1y 1.0 . 4.11 431 281 A 12 ILE HG2% A 12 ILE HG1x 1.0 . 2.63 432 281 A 12 ILE HG2% A 12 ILE HG1y 1.0 . 2.63 433 282 A 12 ILE HG2% A 13 ASP H 1.0 . 2.78 434 283 A 12 ILE HG2% A 13 ASP HBx 1.0 . 4.50 435 283 A 12 ILE HG2% A 13 ASP HBy 1.0 . 4.50 436 284 A 13 ASP H A 13 ASP HBx 1.0 . 3.48 437 284 A 13 ASP HBy A 13 ASP H 1.0 . 3.48 438 285 A 16 LEU H A 13 ASP HA 1.0 . 3.96 439 286 A 14 HIS H A 13 ASP HBx 1.0 . 3.86 440 286 A 13 ASP HBy A 14 HIS H 1.0 . 3.86 441 287 A 14 HIS H A 14 HIS HBx 1.0 . 3.57 442 287 A 14 HIS HBy A 14 HIS H 1.0 . 3.57 443 288 A 16 LEU H A 14 HIS H 1.0 . 4.53 444 289 A 15 ILE H A 14 HIS HBx 1.0 . 3.90 445 289 A 15 ILE H A 14 HIS HBy 1.0 . 3.90 446 290 A 14 HIS HBy A 15 ILE HG1x 1.0 . 4.69 447 290 A 14 HIS HBx A 15 ILE HG1x 1.0 . 4.69 448 290 A 15 ILE HG1y A 14 HIS HBx 1.0 . 4.69 449 290 A 14 HIS HBy A 15 ILE HG1y 1.0 . 4.69 450 291 A 15 ILE HG2% A 14 HIS HBx 1.0 . 5.22 451 291 A 15 ILE HG2% A 14 HIS HBy 1.0 . 5.22 452 292 A 16 LEU H A 14 HIS HBx 1.0 . 4.96 453 292 A 16 LEU H A 14 HIS HBy 1.0 . 4.96 454 293 A 17 LYS H A 14 HIS HBx 1.0 . 5.17 455 293 A 14 HIS HBy A 17 LYS H 1.0 . 5.17 456 294 A 15 ILE H A 15 ILE HG1x 1.0 . 3.62 457 294 A 15 ILE H A 15 ILE HG1y 1.0 . 3.62 458 295 A 15 ILE HG2% A 15 ILE H 1.0 . 4.02 459 296 A 16 LEU H A 15 ILE H 1.0 . 3.81 460 297 A 16 LEU H A 15 ILE H 1.0 . 4.21 461 298 A 16 LEU H A 16 LEU HG 1.0 . 4.60 462 299 A 16 LEU H A 16 LEU HBx 1.0 . 3.36 463 299 A 16 LEU H A 16 LEU HBy 1.0 . 3.36 464 300 A 16 LEU H A 16 LEU HDx% 1.0 . 3.66 465 300 A 16 LEU H A 16 LEU HDy% 1.0 . 3.66 466 301 A 16 LEU H A 17 LYS H 1.0 . 3.80 467 302 A 16 LEU H A 18 CYS H 1.0 . 4.21 468 303 A 16 LEU HA A 16 LEU HDx% 1.0 . 3.91 469 303 A 16 LEU HA A 16 LEU HDy% 1.0 . 3.91 470 304 A 16 LEU HA A 18 CYS H 1.0 . 4.60 471 305 A 17 LYS H A 16 LEU HG 1.0 . 4.50 472 306 A 17 LYS H A 16 LEU HBx 1.0 . 3.75 473 306 A 17 LYS H A 16 LEU HBy 1.0 . 3.75 474 307 A 17 LYS H A 16 LEU HDx% 1.0 . 4.09 475 307 A 17 LYS H A 16 LEU HDy% 1.0 . 4.09 476 308 A 17 LYS H A 17 LYS HBx 1.0 . 3.91 477 308 A 17 LYS H A 17 LYS HBy 1.0 . 3.91 478 309 A 17 LYS H A 17 LYS HEx 1.0 . 4.85 479 309 A 17 LYS H A 17 LYS HEy 1.0 . 4.85 480 310 A 17 LYS H A 18 CYS H 1.0 . 4.33 481 311 A 17 LYS HA A 17 LYS HEx 1.0 . 4.73 482 311 A 17 LYS HA A 17 LYS HEy 1.0 . 4.73 483 312 A 20 PHE H A 17 LYS HA 1.0 . 4.31 484 313 A 17 LYS HA A 20 PHE HBx 1.0 . 5.00 485 313 A 17 LYS HA A 20 PHE HBy 1.0 . 5.00 486 314 A 18 CYS H A 17 LYS HBx 1.0 . 3.42 487 314 A 18 CYS H A 17 LYS HBy 1.0 . 3.42 488 315 A 20 PHE H A 17 LYS HBx 1.0 . 4.95 489 315 A 20 PHE H A 17 LYS HBy 1.0 . 4.95 490 316 A 18 CYS H A 18 CYS HBx 1.0 . 3.71 491 316 A 18 CYS H A 18 CYS HBy 1.0 . 3.71 492 317 A 19 VAL H A 18 CYS H 1.0 . 3.96 493 318 A 19 VAL H A 18 CYS HBx 1.0 . 3.86 494 318 A 19 VAL H A 18 CYS HBy 1.0 . 3.86 495 319 A 19 VAL HA A 18 CYS HBx 1.0 . 4.73 496 319 A 19 VAL HA A 18 CYS HBy 1.0 . 4.73 497 320 A 21 ASP H A 18 CYS HBx 1.0 . 5.09 498 320 A 18 CYS HBy A 21 ASP H 1.0 . 5.09 499 321 A 19 VAL HB A 19 VAL H 1.0 . 3.69 500 322 A 19 VAL HGx% A 19 VAL H 1.0 . 4.11 501 323 A 19 VAL H A 19 VAL HGy% 1.0 . 4.11 502 324 A 19 VAL H A 19 VAL HGy% 1.0 . 3.15 503 324 A 19 VAL HGx% A 19 VAL H 1.0 . 3.15 504 325 A 20 PHE H A 19 VAL H 1.0 . 3.96 505 326 A 19 VAL H A 21 ASP H 1.0 . 4.33 506 327 A 19 VAL HB A 19 VAL HGy% 1.0 . 2.44 507 328 A 19 VAL HB A 20 PHE H 1.0 . 4.01 508 329 A 20 PHE H A 19 VAL HGy% 1.0 . 3.35 509 329 A 19 VAL HGx% A 20 PHE H 1.0 . 3.35 510 330 A 20 PHE H A 19 VAL H 1.0 . 4.04 511 331 A 20 PHE H A 19 VAL H 1.0 . 4.33 512 332 A 20 PHE H A 20 PHE HBx 1.0 . 3.37 513 332 A 20 PHE H A 20 PHE HBy 1.0 . 3.37 514 333 A 20 PHE H A 20 PHE HD% 1.0 . 4.14 515 334 A 20 PHE HD% A 20 PHE HA 1.0 . 3.72 516 335 A 23 ILE H A 20 PHE HA 1.0 . 3.92 517 336 A 20 PHE HA A 23 ILE HB 1.0 . 4.28 518 337 A 20 PHE HA A 23 ILE HD1% 1.0 . 3.69 519 338 A 19 VAL HB A 20 PHE HBx 1.0 . 4.82 520 338 A 19 VAL HB A 20 PHE HBy 1.0 . 4.82 521 339 A 21 ASP H A 20 PHE HBx 1.0 . 3.90 522 339 A 20 PHE HBy A 21 ASP H 1.0 . 3.90 523 340 A 21 ASP H A 20 PHE HBx 1.0 . 4.01 524 340 A 20 PHE HBy A 21 ASP H 1.0 . 4.01 525 341 A 21 ASP HA A 20 PHE HBx 1.0 . 4.39 526 341 A 21 ASP HA A 20 PHE HBy 1.0 . 4.39 527 342 A 23 ILE HD1% A 20 PHE HBx 1.0 . 3.77 528 342 A 20 PHE HBy A 23 ILE HD1% 1.0 . 3.77 529 343 A 20 PHE HD% A 21 ASP H 1.0 . 4.87 530 344 A 20 PHE HD% A 23 ILE HD1% 1.0 . 3.29 531 345 A 21 ASP H A 20 PHE HA 1.0 . 4.30 532 346 A 21 ASP H A 21 ASP HBx 1.0 . 4.04 533 346 A 21 ASP HBy A 21 ASP H 1.0 . 4.04 534 347 A 21 ASP H A 22 LYS H 1.0 . 4.55 535 348 A 23 ILE H A 21 ASP H 1.0 . 5.24 536 349 A 21 ASP HA A 21 ASP H 1.0 . 4.52 537 350 A 21 ASP HA A 24 CYS H 1.0 . 4.12 538 351 A 21 ASP H A 21 ASP HBx 1.0 . 4.04 539 351 A 21 ASP HBy A 21 ASP H 1.0 . 4.04 540 352 A 21 ASP H A 21 ASP HBx 1.0 . 4.14 541 352 A 21 ASP HBy A 21 ASP H 1.0 . 4.14 542 353 A 22 LYS H A 21 ASP HBx 1.0 . 4.72 543 353 A 21 ASP HBy A 22 LYS H 1.0 . 4.72 544 354 A 22 LYS H A 22 LYS HBx 1.0 . 3.54 545 354 A 22 LYS H A 22 LYS HBy 1.0 . 3.54 546 355 A 22 LYS H A 22 LYS HEx 1.0 . 3.33 547 355 A 22 LYS HEy A 22 LYS H 1.0 . 3.33 548 356 A 23 ILE H A 22 LYS H 1.0 . 3.83 549 357 A 24 CYS H A 22 LYS H 1.0 . 4.25 550 358 A 22 LYS HA A 22 LYS HEx 1.0 . 4.34 551 358 A 22 LYS HA A 22 LYS HEy 1.0 . 4.34 552 359 A 22 LYS HBx A 22 LYS HEx 1.0 . 2.40 553 359 A 22 LYS HBy A 22 LYS HEx 1.0 . 2.40 554 359 A 22 LYS HEy A 22 LYS HBx 1.0 . 2.40 555 359 A 22 LYS HEy A 22 LYS HBy 1.0 . 2.40 556 360 A 23 ILE H A 22 LYS HBx 1.0 . 3.45 557 360 A 23 ILE H A 22 LYS HBy 1.0 . 3.45 558 361 A 23 ILE H A 23 ILE HB 1.0 . 3.74 559 362 A 23 ILE H A 23 ILE HG1x 1.0 . 3.67 560 362 A 23 ILE HG1y A 23 ILE H 1.0 . 3.67 561 363 A 23 ILE H A 23 ILE HG2% 1.0 . 3.83 562 364 A 23 ILE HG2% A 23 ILE HA 1.0 . 3.16 563 365 A 24 CYS H A 23 ILE HB 1.0 . 4.23 564 366 A 24 CYS H A 23 ILE HG2% 1.0 . 4.03 565 367 A 24 CYS H A 24 CYS HBx 1.0 . 3.96 566 367 A 24 CYS HBy A 24 CYS H 1.0 . 3.96 567 368 A 24 CYS H A 25 LYS H 1.0 . 3.87 568 369 A 26 ILE H A 24 CYS HA 1.0 . 5.22 569 370 A 25 LYS H A 24 CYS HBx 1.0 . 4.76 570 370 A 24 CYS HBy A 25 LYS H 1.0 . 4.76 571 371 A 25 LYS H A 26 ILE H 1.0 . 4.23 572 372 A 26 ILE HB A 26 ILE H 1.0 . 3.76 573 373 A 26 ILE HB A 26 ILE H 1.0 . 5.18 574 374 A 26 ILE H A 26 ILE HG1x 1.0 . 4.09 575 374 A 26 ILE H A 26 ILE HG1y 1.0 . 4.09 576 375 A 26 ILE HG2% A 26 ILE H 1.0 . 3.37 577 376 A 27 GLY H A 26 ILE H 1.0 . 4.02 578 377 A 27 GLY H A 26 ILE H 1.0 . 4.44 579 378 A 26 ILE HA A 26 ILE HG1x 1.0 . 3.98 580 378 A 26 ILE HA A 26 ILE HG1y 1.0 . 3.98 581 379 A 26 ILE HG2% A 26 ILE HA 1.0 . 3.79 582 380 A 26 ILE HA A 29 GLU HBx 1.0 . 3.32 583 380 A 26 ILE HA A 29 GLU HBy 1.0 . 3.32 584 381 A 26 ILE HA A 29 GLU HGx 1.0 . 3.30 585 381 A 26 ILE HA A 29 GLU HGy 1.0 . 3.30 586 382 A 27 GLY H A 26 ILE HD1% 1.0 . 5.48 587 383 A 27 GLY H A 26 ILE HG1x 1.0 . 4.64 588 383 A 27 GLY H A 26 ILE HG1y 1.0 . 4.64 589 384 A 26 ILE HG1y A 27 GLY HAx 1.0 . 5.31 590 384 A 26 ILE HG1x A 27 GLY HAx 1.0 . 5.31 591 384 A 27 GLY HAy A 26 ILE HG1x 1.0 . 5.31 592 384 A 26 ILE HG1y A 27 GLY HAy 1.0 . 5.31 593 385 A 27 GLY H A 26 ILE HG2% 1.0 . 4.57 594 386 A 27 GLY H A 28 THR H 1.0 . 4.27 595 387 A 28 THR H A 28 THR HB 1.0 . 4.16 596 388 A 28 THR H A 28 THR HG2% 1.0 . 4.26 597 389 A 29 GLU H A 29 GLU HBx 1.0 . 2.78 598 389 A 29 GLU HBy A 29 GLU H 1.0 . 2.78 599 390 A 29 GLU H A 29 GLU HGx 1.0 . 2.81 600 390 A 29 GLU HGy A 29 GLU H 1.0 . 2.81 601 391 A 29 GLU H A 30 SER H 1.0 . 2.55 602 392 A 30 SER H A 29 GLU HBx 1.0 . 3.33 603 392 A 29 GLU HBy A 30 SER H 1.0 . 3.33 604 393 A 30 SER H A 29 GLU HGx 1.0 . 4.28 605 393 A 29 GLU HGy A 30 SER H 1.0 . 4.28 606 394 A 30 SER H A 30 SER HBx 1.0 . 2.84 607 394 A 30 SER H A 30 SER HBy 1.0 . 2.84 608 395 A 30 SER H A 31 VAL HG11 1.0 . 4.19 609 395 A 31 VAL HGy% A 30 SER H 1.0 . 4.19 610 396 A 31 VAL H A 30 SER HBx 1.0 . 4.16 611 396 A 31 VAL H A 30 SER HBy 1.0 . 4.16 612 397 A 31 VAL H A 31 VAL HB 1.0 . 3.10 613 398 A 31 VAL H A 31 VAL HB 1.0 . 3.80 614 399 A 31 VAL H A 31 VAL HG11 1.0 . 3.51 615 399 A 31 VAL HGy% A 31 VAL H 1.0 . 3.51 616 400 A 31 VAL H A 31 VAL HA 1.0 . 3.50 617 401 A 31 VAL HB A 28 THR HA 1.0 . 4.18 618 402 A 31 VAL H A 31 VAL HB 1.0 . 3.95 619 403 A 32 GLU H A 32 GLU HBx 1.0 . 2.97 620 403 A 32 GLU H A 32 GLU HBy 1.0 . 2.97 621 404 A 32 GLU H A 32 GLU HGx 1.0 . 3.77 622 404 A 32 GLU H A 32 GLU HGy 1.0 . 3.77 623 405 A 32 GLU HA A 32 GLU HBx 1.0 . 3.02 624 405 A 32 GLU HA A 32 GLU HBy 1.0 . 3.02 625 406 A 33 ALA H A 32 GLU HBx 1.0 . 2.87 626 406 A 33 ALA H A 32 GLU HBy 1.0 . 2.87 627 407 A 33 ALA HA A 32 GLU HBx 1.0 . 4.30 628 407 A 32 GLU HBy A 33 ALA HA 1.0 . 4.30 629 408 A 33 ALA HB% A 32 GLU HBx 1.0 . 3.79 630 408 A 33 ALA HB% A 32 GLU HBy 1.0 . 3.79 631 409 A 36 LEU H A 32 GLU HBx 1.0 . 5.07 632 409 A 36 LEU H A 32 GLU HBy 1.0 . 5.07 633 410 A 36 LEU HBy A 32 GLU HBx 1.0 . 3.98 634 410 A 32 GLU HBy A 36 LEU HBy 1.0 . 3.98 635 411 A 33 ALA HA A 32 GLU HGx 1.0 . 5.50 636 411 A 33 ALA HA A 32 GLU HGy 1.0 . 5.50 637 412 A 33 ALA HB% A 33 ALA H 1.0 . 2.69 638 413 A 33 ALA H A 33 ALA HA 1.0 . 3.52 639 414 A 36 LEU H A 33 ALA HA 1.0 . 4.49 640 415 A 33 ALA HA A 36 LEU HBy 1.0 . 4.00 641 416 A 33 ALA HA A 36 LEU HDx% 1.0 . 4.09 642 416 A 33 ALA HA A 36 LEU HDy% 1.0 . 4.09 643 417 A 37 ILE H A 33 ALA HA 1.0 . 3.53 644 418 A 33 ALA HA A 37 ILE HG1x 1.0 . 4.69 645 418 A 37 ILE HG1y A 33 ALA HA 1.0 . 4.69 646 419 A 33 ALA HB% A 34 GLY H 1.0 . 3.30 647 420 A 34 GLY H A 35 ARG H 1.0 . 3.35 648 421 A 34 GLY H A 35 ARG HBx 1.0 . 5.50 649 421 A 34 GLY H A 35 ARG HBy 1.0 . 5.50 650 422 A 35 ARG H A 34 GLY HAx 1.0 . 2.81 651 422 A 35 ARG H A 34 GLY HAy 1.0 . 2.81 652 423 A 35 ARG HE A 34 GLY HAx 1.0 . 5.50 653 423 A 35 ARG HE A 34 GLY HAy 1.0 . 5.50 654 424 A 34 GLY HAy A 38 GLU HBx 1.0 . 4.79 655 424 A 34 GLY HAx A 38 GLU HBx 1.0 . 4.79 656 424 A 38 GLU HBy A 34 GLY HAx 1.0 . 4.79 657 424 A 34 GLY HAy A 38 GLU HBy 1.0 . 4.79 658 425 A 35 ARG H A 35 ARG HA 1.0 . 2.88 659 426 A 35 ARG H A 35 ARG HA 1.0 . 3.61 660 427 A 35 ARG HE A 35 ARG H 1.0 . 4.34 661 428 A 35 ARG H A 35 ARG HBx 1.0 . 3.02 662 428 A 35 ARG H A 35 ARG HBy 1.0 . 3.02 663 429 A 35 ARG H A 35 ARG HDx 1.0 . 3.58 664 429 A 35 ARG H A 35 ARG HDy 1.0 . 3.58 665 430 A 35 ARG HA A 35 ARG HDx 1.0 . 3.98 666 430 A 35 ARG HA A 35 ARG HDy 1.0 . 3.98 667 431 A 35 ARG HA A 38 GLU H 1.0 . 3.86 668 432 A 35 ARG HA A 38 GLU HBx 1.0 . 2.85 669 432 A 35 ARG HA A 38 GLU HBy 1.0 . 2.85 670 433 A 35 ARG HE A 35 ARG HBx 1.0 . 4.11 671 433 A 35 ARG HE A 35 ARG HBy 1.0 . 4.11 672 434 A 35 ARG HBy A 35 ARG HDx 1.0 . 3.57 673 434 A 35 ARG HBx A 35 ARG HDx 1.0 . 3.57 674 434 A 35 ARG HDy A 35 ARG HBx 1.0 . 3.57 675 434 A 35 ARG HDy A 35 ARG HBy 1.0 . 3.57 676 435 A 35 ARG HH1% A 35 ARG HDx 1.0 . 3.40 677 435 A 35 ARG HDy A 35 ARG HH1% 1.0 . 3.40 678 436 A 36 LEU H A 35 ARG HDx 1.0 . 4.42 679 436 A 36 LEU H A 35 ARG HDy 1.0 . 4.42 680 437 A 36 LEU H A 36 LEU HA 1.0 . 2.96 681 438 A 36 LEU H A 36 LEU HBy 1.0 . 2.66 682 439 A 36 LEU H A 36 LEU HBx 1.0 . 3.39 683 440 A 36 LEU H A 36 LEU HBx 1.0 . 3.51 684 441 A 36 LEU H A 36 LEU HDx% 1.0 . 2.67 685 441 A 36 LEU H A 36 LEU HDy% 1.0 . 2.67 686 442 A 36 LEU H A 38 GLU HBx 1.0 . 5.34 687 442 A 36 LEU H A 38 GLU HBy 1.0 . 5.34 688 443 A 36 LEU HA A 36 LEU HBx 1.0 . 2.78 689 444 A 36 LEU HA A 36 LEU HDx% 1.0 . 2.86 690 444 A 36 LEU HA A 36 LEU HDy% 1.0 . 2.86 691 445 A 37 ILE H A 36 LEU HBy 1.0 . 4.35 692 446 A 36 LEU HBx A 36 LEU HDx% 1.0 . 2.89 693 446 A 36 LEU HDy% A 36 LEU HBx 1.0 . 2.89 694 447 A 37 ILE H A 36 LEU HBx 1.0 . 3.52 695 448 A 37 ILE H A 37 ILE HB 1.0 . 3.07 696 449 A 37 ILE H A 37 ILE HG1x 1.0 . 3.83 697 449 A 37 ILE HG1y A 37 ILE H 1.0 . 3.83 698 450 A 37 ILE H A 37 ILE HD1% 1.0 . 3.28 699 451 A 37 ILE HA A 37 ILE HD1% 1.0 . 2.99 700 452 A 37 ILE HA A 37 ILE HG1x 1.0 . 3.95 701 452 A 37 ILE HG1y A 37 ILE HA 1.0 . 3.95 702 453 A 37 ILE HA A 38 GLU H 1.0 . 3.49 703 454 A 38 GLU H A 37 ILE HB 1.0 . 3.86 704 455 A 38 GLU H A 37 ILE HG1x 1.0 . 4.79 705 455 A 37 ILE HG1y A 38 GLU H 1.0 . 4.79 706 456 A 37 ILE HG2% A 38 GLU H 1.0 . 2.82 707 457 A 37 ILE HG2% A 38 GLU HA 1.0 . 2.98 708 458 A 38 GLU H A 38 GLU HBx 1.0 . 2.86 709 458 A 38 GLU HBy A 38 GLU H 1.0 . 2.86 710 459 A 38 GLU HA A 38 GLU HBx 1.0 . 2.72 711 459 A 38 GLU HBy A 38 GLU HA 1.0 . 2.72 712 460 A 38 GLU HA A 38 GLU HGx 1.0 . 2.93 713 460 A 38 GLU HGy A 38 GLU HA 1.0 . 2.93 714 461 A 38 GLU HBy A 38 GLU HGx 1.0 . 2.70 715 461 A 38 GLU HBx A 38 GLU HGx 1.0 . 2.70 716 461 A 38 GLU HGy A 38 GLU HBx 1.0 . 2.70 717 461 A 38 GLU HGy A 38 GLU HBy 1.0 . 2.70 718 462 A 39 LEU H A 38 GLU HBx 1.0 . 2.88 719 462 A 38 GLU HBy A 39 LEU H 1.0 . 2.88 720 463 A 38 GLU H A 38 GLU HGx 1.0 . 3.46 721 463 A 38 GLU HGy A 38 GLU H 1.0 . 3.46 722 464 A 39 LEU H A 38 GLU HGx 1.0 . 3.84 723 464 A 38 GLU HGy A 39 LEU H 1.0 . 3.84 724 465 A 39 LEU H A 39 LEU HA 1.0 . 2.92 725 466 A 39 LEU H A 39 LEU HA 1.0 . 3.18 726 467 A 39 LEU H A 39 LEU HBy 1.0 . 2.66 727 468 A 39 LEU H A 39 LEU HBx 1.0 . 3.51 728 469 A 39 LEU H A 39 LEU HDx% 1.0 . 2.76 729 469 A 39 LEU H A 39 LEU HDy% 1.0 . 2.76 730 470 A 39 LEU HA A 39 LEU HDx% 1.0 . 2.90 731 470 A 39 LEU HDy% A 39 LEU HA 1.0 . 2.90 732 471 A 40 SER H A 39 LEU HBy 1.0 . 3.14 733 472 A 39 LEU HBy A 40 SER HA 1.0 . 5.06 734 473 A 36 LEU HA A 39 LEU HBx 1.0 . 4.50 735 474 A 39 LEU HA A 39 LEU HBx 1.0 . 2.95 736 475 A 39 LEU HBx A 39 LEU HDx% 1.0 . 3.09 737 475 A 39 LEU HDy% A 39 LEU HBx 1.0 . 3.09 738 476 A 40 SER H A 39 LEU HBx 1.0 . 3.39 739 477 A 40 SER H A 39 LEU HDx% 1.0 . 4.21 740 477 A 40 SER H A 39 LEU HDy% 1.0 . 4.21 741 478 A 40 SER H A 40 SER HBx 1.0 . 2.64 742 478 A 40 SER H A 40 SER HBy 1.0 . 2.64 743 479 A 40 SER H A 41 GLN HBx 1.0 . 5.43 744 479 A 40 SER H A 41 GLN HBy 1.0 . 5.43 745 480 A 40 SER H A 41 GLN HGy 1.0 . 5.03 746 480 A 41 GLN HGx A 40 SER H 1.0 . 5.03 747 481 A 41 GLN H A 40 SER HBx 1.0 . 3.39 748 481 A 40 SER HBy A 41 GLN H 1.0 . 3.39 749 482 A 41 GLN H A 41 GLN HBx 1.0 . 3.22 750 482 A 41 GLN HBy A 41 GLN H 1.0 . 3.22 751 483 A 41 GLN H A 41 GLN HGy 1.0 . 3.18 752 483 A 41 GLN HGx A 41 GLN H 1.0 . 3.18 753 484 A 41 GLN HE2y A 41 GLN HA 1.0 . 4.94 754 484 A 41 GLN HE2x A 41 GLN HA 1.0 . 4.94 755 485 A 41 GLN HA A 41 GLN HGy 1.0 . 3.30 756 485 A 41 GLN HGx A 41 GLN HA 1.0 . 3.30 757 486 A 37 ILE HG2% A 41 GLN HE2y 1.0 . 3.45 758 487 A 41 GLN HE2x A 37 ILE HG2% 1.0 . 3.90 759 488 A 41 GLN HE2x A 41 GLN HBx 1.0 . 4.79 760 488 A 41 GLN HE2x A 41 GLN HBy 1.0 . 4.79 761 489 A 41 GLN HBy A 41 GLN HGy 1.0 . 2.86 762 489 A 41 GLN HBx A 41 GLN HGy 1.0 . 2.86 763 489 A 41 GLN HGx A 41 GLN HBx 1.0 . 2.86 764 489 A 41 GLN HGx A 41 GLN HBy 1.0 . 2.86 765 490 A 41 GLN HE2y A 41 GLN HGy 1.0 . 3.79 766 490 A 41 GLN HE2y A 41 GLN HGx 1.0 . 3.79 767 491 A 41 GLN HE2x A 41 GLN HGy 1.0 . 3.79 768 491 A 41 GLN HE2x A 41 GLN HGx 1.0 . 3.79 769 492 A 43 GLY H A 41 GLN HGy 1.0 . 5.35 770 492 A 43 GLY H A 41 GLN HGx 1.0 . 5.35 771 493 A 42 GLU H A 42 GLU HBx 1.0 . 3.48 772 493 A 42 GLU H A 42 GLU HBy 1.0 . 3.48 773 494 A 43 GLY H A 42 GLU H 1.0 . 2.87 774 495 A 43 GLY H A 42 GLU H 1.0 . 3.40 775 496 A 42 GLU HA A 42 GLU HBx 1.0 . 2.56 776 496 A 42 GLU HA A 42 GLU HBy 1.0 . 2.56 777 497 A 42 GLU HA A 42 GLU HGx 1.0 . 3.34 778 497 A 42 GLU HA A 42 GLU HGy 1.0 . 3.34 779 498 A 43 GLY H A 42 GLU HA 1.0 . 3.46 780 499 A 42 GLU HA A 44 GLY H 1.0 . 5.50 781 500 A 43 GLY H A 42 GLU HBx 1.0 . 4.07 782 500 A 43 GLY H A 42 GLU HBy 1.0 . 4.07 783 501 A 42 GLU HBx A 43 GLY HAx 1.0 . 4.44 784 501 A 42 GLU HBy A 43 GLY HAx 1.0 . 4.44 785 501 A 43 GLY HAy A 42 GLU HBx 1.0 . 4.44 786 501 A 42 GLU HBy A 43 GLY HAy 1.0 . 4.44 787 502 A 44 GLY H A 42 GLU HBx 1.0 . 5.21 788 502 A 44 GLY H A 42 GLU HBy 1.0 . 5.21 789 503 A 43 GLY H A 42 GLU HGx 1.0 . 5.50 790 503 A 43 GLY H A 42 GLU HGy 1.0 . 5.50 791 504 A 43 GLY H A 43 GLY HAx 1.0 . 2.40 792 504 A 43 GLY H A 43 GLY HAy 1.0 . 2.40 793 505 A 43 GLY H A 44 GLY H 1.0 . 2.84 794 506 A 44 GLY H A 44 GLY HAx 1.0 . 2.40 795 506 A 44 GLY H A 44 GLY HAy 1.0 . 2.40 796 507 A 50 LEU H A 48 GLY HAx 1.0 . 3.32 797 507 A 50 LEU H A 48 GLY HAy 1.0 . 3.32 798 508 A 48 GLY HAx A 50 LEU HBx 1.0 . 4.15 799 508 A 48 GLY HAy A 50 LEU HBx 1.0 . 4.15 800 508 A 50 LEU HBy A 48 GLY HAx 1.0 . 4.15 801 508 A 48 GLY HAy A 50 LEU HBy 1.0 . 4.15 802 509 A 48 GLY HAx A 50 LEU HDx% 1.0 . 4.01 803 509 A 48 GLY HAy A 50 LEU HDx% 1.0 . 4.01 804 509 A 50 LEU HDy% A 48 GLY HAx 1.0 . 4.01 805 509 A 50 LEU HDy% A 48 GLY HAy 1.0 . 4.01 806 510 A 49 PRO HA A 52 PHE H 1.0 . 4.24 807 511 A 49 PRO HA A 52 PHE HBx 1.0 . 4.44 808 511 A 49 PRO HA A 52 PHE HBy 1.0 . 4.44 809 512 A 50 LEU H A 49 PRO HBy 1.0 . 4.46 810 513 A 50 LEU H A 49 PRO HBx 1.0 . 4.46 811 514 A 50 LEU H A 49 PRO HBx 1.0 . 3.72 812 514 A 50 LEU H A 49 PRO HBy 1.0 . 3.72 813 515 A 52 PHE H A 49 PRO HBx 1.0 . 5.10 814 515 A 52 PHE H A 49 PRO HBy 1.0 . 5.10 815 516 A 49 PRO HBy A 52 PHE HBx 1.0 . 5.30 816 516 A 49 PRO HBx A 52 PHE HBx 1.0 . 5.30 817 516 A 52 PHE HBy A 49 PRO HBx 1.0 . 5.30 818 516 A 52 PHE HBy A 49 PRO HBy 1.0 . 5.30 819 517 A 48 GLY H A 49 PRO HDx 1.0 . 4.46 820 517 A 48 GLY H A 49 PRO HDy 1.0 . 4.46 821 518 A 50 LEU H A 50 LEU HBx 1.0 . 2.71 822 518 A 50 LEU H A 50 LEU HBy 1.0 . 2.71 823 519 A 50 LEU H A 50 LEU HDx% 1.0 . 3.14 824 519 A 50 LEU HDy% A 50 LEU H 1.0 . 3.14 825 520 A 50 LEU H A 51 TYR H 1.0 . 3.25 826 521 A 50 LEU H A 51 TYR H 1.0 . 3.28 827 522 A 50 LEU H A 51 TYR HBx 1.0 . 4.75 828 522 A 51 TYR HBy A 50 LEU H 1.0 . 4.75 829 523 A 50 LEU HA A 50 LEU HDx% 1.0 . 2.40 830 523 A 50 LEU HDy% A 50 LEU HA 1.0 . 2.40 831 524 A 50 LEU HA A 51 TYR HBx 1.0 . 5.50 832 524 A 51 TYR HBy A 50 LEU HA 1.0 . 5.50 833 525 A 50 LEU HA A 52 PHE HBx 1.0 . 5.06 834 525 A 52 PHE HBy A 50 LEU HA 1.0 . 5.06 835 526 A 54 VAL H A 50 LEU HA 1.0 . 5.06 836 527 A 50 LEU HBx A 50 LEU HDx% 1.0 . 2.40 837 527 A 50 LEU HBy A 50 LEU HDx% 1.0 . 2.40 838 527 A 50 LEU HDy% A 50 LEU HBx 1.0 . 2.40 839 527 A 50 LEU HDy% A 50 LEU HBy 1.0 . 2.40 840 528 A 51 TYR H A 50 LEU HBx 1.0 . 3.14 841 528 A 50 LEU HBy A 51 TYR H 1.0 . 3.14 842 529 A 52 PHE H A 50 LEU HBx 1.0 . 5.02 843 529 A 50 LEU HBy A 52 PHE H 1.0 . 5.02 844 530 A 53 VAL H A 50 LEU HBx 1.0 . 4.95 845 530 A 53 VAL H A 50 LEU HBy 1.0 . 4.95 846 531 A 54 VAL H A 50 LEU HBx 1.0 . 4.94 847 531 A 54 VAL H A 50 LEU HBy 1.0 . 4.94 848 532 A 51 TYR H A 51 TYR HBx 1.0 . 2.72 849 532 A 51 TYR HBy A 51 TYR H 1.0 . 2.72 850 533 A 51 TYR H A 51 TYR HD% 1.0 . 4.27 851 534 A 51 TYR HA A 51 TYR HD% 1.0 . 3.96 852 535 A 51 TYR HA A 54 VAL H 1.0 . 3.67 853 536 A 55 ASN H A 51 TYR HA 1.0 . 4.54 854 537 A 52 PHE H A 51 TYR HD% 1.0 . 4.57 855 538 A 51 TYR HA A 52 PHE H 1.0 . 3.63 856 539 A 52 PHE HA A 52 PHE H 1.0 . 3.55 857 540 A 52 PHE H A 52 PHE HBx 1.0 . 3.21 858 540 A 52 PHE H A 52 PHE HBy 1.0 . 3.21 859 541 A 52 PHE H A 52 PHE HD% 1.0 . 4.28 860 542 A 52 PHE HA A 52 PHE HD% 1.0 . 3.89 861 543 A 55 ASN H A 52 PHE HA 1.0 . 4.07 862 544 A 52 PHE HA A 55 ASN HBx 1.0 . 4.45 863 544 A 52 PHE HA A 55 ASN HBy 1.0 . 4.45 864 545 A 52 PHE HA A 55 ASN HD2y 1.0 . 4.61 865 545 A 55 ASN HD2x A 52 PHE HA 1.0 . 4.61 866 546 A 56 VAL H A 52 PHE HA 1.0 . 5.32 867 547 A 53 VAL H A 52 PHE HBx 1.0 . 3.72 868 547 A 53 VAL H A 52 PHE HBy 1.0 . 3.72 869 548 A 54 VAL H A 52 PHE HBx 1.0 . 4.97 870 548 A 54 VAL H A 52 PHE HBy 1.0 . 4.97 871 549 A 53 VAL H A 52 PHE HD% 1.0 . 4.31 872 550 A 52 PHE HD% A 56 VAL HB 1.0 . 5.50 873 551 A 53 VAL H A 53 VAL HB 1.0 . 3.74 874 552 A 53 VAL H A 53 VAL HG11 1.0 . 3.73 875 552 A 53 VAL H A 53 VAL HGy% 1.0 . 3.73 876 553 A 54 VAL HB A 53 VAL H 1.0 . 4.83 877 554 A 56 VAL H A 53 VAL HA 1.0 . 3.92 878 555 A 53 VAL HA A 56 VAL HB 1.0 . 4.10 879 556 A 53 VAL HA A 56 VAL HG11 1.0 . 3.30 880 556 A 56 VAL HGy% A 53 VAL HA 1.0 . 3.30 881 557 A 53 VAL HA A 57 ILE H 1.0 . 4.37 882 558 A 53 VAL HA A 57 ILE HB 1.0 . 5.50 883 559 A 54 VAL H A 53 VAL HB 1.0 . 3.64 884 560 A 54 VAL H A 53 VAL HG11 1.0 . 3.31 885 560 A 54 VAL H A 53 VAL HGy% 1.0 . 3.31 886 561 A 54 VAL HA A 53 VAL HG11 1.0 . 3.32 887 561 A 54 VAL HA A 53 VAL HGy% 1.0 . 3.32 888 562 A 54 VAL HB A 54 VAL H 1.0 . 3.37 889 563 A 54 VAL H A 54 VAL HGy% 1.0 . 2.77 890 563 A 54 VAL H A 54 VAL HG11 1.0 . 2.77 891 564 A 54 VAL HA A 54 VAL HG11 1.0 . 3.26 892 565 A 54 VAL HA A 57 ILE H 1.0 . 3.96 893 566 A 54 VAL HA A 57 ILE HB 1.0 . 4.47 894 567 A 54 VAL HA A 58 GLU H 1.0 . 4.06 895 568 A 55 ASN H A 54 VAL HB 1.0 . 3.95 896 569 A 55 ASN H A 54 VAL HGy% 1.0 . 3.31 897 569 A 55 ASN H A 54 VAL HG11 1.0 . 3.31 898 570 A 55 ASN HA A 54 VAL HGy% 1.0 . 3.33 899 570 A 55 ASN HA A 54 VAL HG11 1.0 . 3.33 900 571 A 55 ASN H A 51 TYR HA 1.0 . 3.73 901 572 A 55 ASN H A 55 ASN HD2y 1.0 . 4.61 902 573 A 55 ASN H A 55 ASN HD2x 1.0 . 4.61 903 574 A 55 ASN H A 55 ASN HBx 1.0 . 3.31 904 574 A 55 ASN H A 55 ASN HBy 1.0 . 3.31 905 575 A 55 ASN HA A 55 ASN HBx 1.0 . 4.38 906 575 A 55 ASN HA A 55 ASN HBy 1.0 . 4.38 907 576 A 55 ASN HA A 55 ASN HD2y 1.0 . 4.57 908 576 A 55 ASN HA A 55 ASN HD2x 1.0 . 4.57 909 577 A 55 ASN HA A 58 GLU H 1.0 . 4.73 910 578 A 55 ASN H A 55 ASN HBx 1.0 . 3.51 911 578 A 55 ASN H A 55 ASN HBy 1.0 . 3.51 912 579 A 56 VAL H A 55 ASN HBx 1.0 . 3.93 913 579 A 56 VAL H A 55 ASN HBy 1.0 . 3.93 914 580 A 56 VAL H A 56 VAL HB 1.0 . 3.30 915 581 A 56 VAL H A 56 VAL HB 1.0 . 3.33 916 582 A 56 VAL H A 56 VAL HG11 1.0 . 2.67 917 582 A 56 VAL H A 56 VAL HGy% 1.0 . 2.67 918 583 A 56 VAL H A 57 ILE HB 1.0 . 4.61 919 584 A 56 VAL H A 57 ILE HG1x 1.0 . 4.22 920 584 A 56 VAL H A 57 ILE HG1y 1.0 . 4.22 921 585 A 56 VAL HA A 56 VAL HG11 1.0 . 3.09 922 585 A 56 VAL HGy% A 56 VAL HA 1.0 . 3.09 923 586 A 58 GLU H A 56 VAL HA 1.0 . 4.45 924 587 A 56 VAL HA A 60 CYS H 1.0 . 4.93 925 588 A 56 VAL HB A 56 VAL HG11 1.0 . 2.47 926 588 A 56 VAL HGy% A 56 VAL HB 1.0 . 2.47 927 589 A 56 VAL HB A 57 ILE H 1.0 . 4.05 928 590 A 57 ILE H A 56 VAL HG11 1.0 . 4.10 929 590 A 56 VAL HGy% A 57 ILE H 1.0 . 4.10 930 591 A 57 ILE HB A 57 ILE H 1.0 . 3.75 931 592 A 57 ILE H A 57 ILE HD1% 1.0 . 3.89 932 593 A 57 ILE H A 57 ILE HG1x 1.0 . 3.63 933 593 A 57 ILE H A 57 ILE HG1y 1.0 . 3.63 934 594 A 58 GLU H A 57 ILE H 1.0 . 3.81 935 595 A 58 GLU H A 57 ILE H 1.0 . 3.87 936 596 A 57 ILE HA A 57 ILE HG1x 1.0 . 3.08 937 596 A 57 ILE HA A 57 ILE HG1y 1.0 . 3.08 938 597 A 58 GLU H A 57 ILE HB 1.0 . 4.22 939 598 A 58 GLU H A 57 ILE HG1x 1.0 . 4.26 940 598 A 58 GLU H A 57 ILE HG1y 1.0 . 4.26 941 599 A 58 GLU H A 57 ILE HG2% 1.0 . 3.87 942 600 A 58 GLU H A 58 GLU HBx 1.0 . 3.41 943 600 A 58 GLU H A 58 GLU HBy 1.0 . 3.41 944 601 A 58 GLU H A 58 GLU HGx 1.0 . 4.00 945 601 A 58 GLU H A 58 GLU HGy 1.0 . 4.00 946 602 A 58 GLU H A 60 CYS H 1.0 . 4.24 947 603 A 61 LYS H A 60 CYS H 1.0 . 3.94 948 604 A 60 CYS H A 61 LYS HBx 1.0 . 4.52 949 604 A 60 CYS H A 61 LYS HBy 1.0 . 4.52 950 605 A 61 LYS H A 60 CYS HA 1.0 . 3.52 951 606 A 60 CYS HA A 63 PHE H 1.0 . 3.39 952 607 A 60 CYS HBx A 60 CYS H 1.0 . 4.50 953 608 A 60 CYS HBx A 60 CYS HA 1.0 . 4.08 954 609 A 61 LYS H A 61 LYS HBx 1.0 . 3.82 955 609 A 61 LYS H A 61 LYS HBy 1.0 . 3.82 956 610 A 61 LYS H A 62 LYS H 1.0 . 3.92 957 611 A 64 SER H A 61 LYS HBx 1.0 . 4.50 958 611 A 61 LYS HBy A 64 SER H 1.0 . 4.50 959 612 A 62 LYS H A 63 PHE H 1.0 . 4.49 960 613 A 63 PHE H A 63 PHE HBx 1.0 . 3.49 961 613 A 63 PHE H A 63 PHE HBy 1.0 . 3.49 962 614 A 63 PHE H A 63 PHE HBx 1.0 . 4.13 963 614 A 63 PHE H A 63 PHE HBy 1.0 . 4.13 964 615 A 63 PHE H A 63 PHE HD% 1.0 . 4.42 965 616 A 63 PHE HD% A 63 PHE HA 1.0 . 4.07 966 617 A 66 LEU H A 63 PHE HA 1.0 . 4.15 967 618 A 63 PHE HA A 66 LEU HG 1.0 . 3.88 968 619 A 64 SER H A 63 PHE HBx 1.0 . 3.99 969 619 A 63 PHE HBy A 64 SER H 1.0 . 3.99 970 620 A 64 SER H A 63 PHE HD% 1.0 . 4.32 971 621 A 66 LEU H A 63 PHE HD% 1.0 . 5.36 972 622 A 63 PHE HD% A 66 LEU HG 1.0 . 4.43 973 623 A 63 PHE HD% A 67 THR HG2% 1.0 . 4.20 974 623 A 63 PHE HE% A 67 THR HG2% 1.0 . 4.20 975 624 A 64 SER H A 64 SER HBx 1.0 . 3.35 976 624 A 64 SER HBy A 64 SER H 1.0 . 3.35 977 625 A 66 LEU H A 64 SER H 1.0 . 4.27 978 626 A 66 LEU H A 64 SER HA 1.0 . 4.40 979 627 A 65 GLU H A 65 GLU HBx 1.0 . 3.20 980 627 A 65 GLU H A 65 GLU HBy 1.0 . 3.20 981 628 A 65 GLU H A 65 GLU HGx 1.0 . 3.04 982 628 A 65 GLU H A 65 GLU HGy 1.0 . 3.04 983 629 A 66 LEU H A 65 GLU H 1.0 . 2.70 984 630 A 65 GLU HA A 65 GLU HGx 1.0 . 2.74 985 630 A 65 GLU HGy A 65 GLU HA 1.0 . 2.74 986 631 A 68 GLY H A 65 GLU HA 1.0 . 3.58 987 632 A 66 LEU H A 65 GLU HBx 1.0 . 3.14 988 632 A 66 LEU H A 65 GLU HBy 1.0 . 3.14 989 633 A 66 LEU H A 65 GLU HBx 1.0 . 3.18 990 633 A 66 LEU H A 65 GLU HBy 1.0 . 3.18 991 634 A 66 LEU H A 65 GLU HGx 1.0 . 4.30 992 634 A 66 LEU H A 65 GLU HGy 1.0 . 4.30 993 635 A 66 LEU HA A 66 LEU H 1.0 . 2.83 994 636 A 66 LEU H A 66 LEU HG 1.0 . 3.11 995 637 A 66 LEU H A 66 LEU HBx 1.0 . 3.04 996 637 A 66 LEU H A 66 LEU HBy 1.0 . 3.04 997 638 A 66 LEU H A 66 LEU HDx% 1.0 . 3.13 998 638 A 66 LEU H A 66 LEU HDy% 1.0 . 3.13 999 639 A 67 THR H A 66 LEU H 1.0 . 3.24 1000 640 A 67 THR H A 66 LEU H 1.0 . 3.31 1001 641 A 66 LEU HA A 66 LEU HBx 1.0 . 2.71 1002 641 A 66 LEU HA A 66 LEU HBy 1.0 . 2.71 1003 642 A 66 LEU HA A 66 LEU HDx% 1.0 . 3.20 1004 642 A 66 LEU HA A 66 LEU HDy% 1.0 . 3.20 1005 643 A 68 GLY H A 66 LEU HA 1.0 . 4.53 1006 644 A 67 THR H A 66 LEU HG 1.0 . 4.36 1007 645 A 66 LEU HBx A 66 LEU HDx% 1.0 . 2.57 1008 645 A 66 LEU HBy A 66 LEU HDx% 1.0 . 2.57 1009 645 A 66 LEU HDy% A 66 LEU HBx 1.0 . 2.57 1010 645 A 66 LEU HBy A 66 LEU HDy% 1.0 . 2.57 1011 646 A 67 THR H A 66 LEU HBx 1.0 . 3.98 1012 646 A 67 THR H A 66 LEU HBy 1.0 . 3.98 1013 647 A 67 THR HA A 66 LEU HBx 1.0 . 4.69 1014 647 A 67 THR HA A 66 LEU HBy 1.0 . 4.69 1015 648 A 67 THR H A 67 THR HB 1.0 . 3.74 1016 649 A 67 THR H A 67 THR HG2% 1.0 . 3.97 1017 650 A 68 GLY H A 67 THR H 1.0 . 3.24 1018 651 A 67 THR HA A 69 LEU H 1.0 . 4.39 1019 652 A 68 GLY H A 67 THR HB 1.0 . 4.27 1020 653 A 67 THR H A 67 THR HG2% 1.0 . 3.65 1021 654 A 68 GLY H A 67 THR HG2% 1.0 . 3.98 1022 655 A 68 GLY H A 68 GLY HAx 1.0 . 2.88 1023 655 A 68 GLY H A 68 GLY HAy 1.0 . 2.88 1024 656 A 68 GLY H A 69 LEU H 1.0 . 3.28 1025 657 A 68 GLY H A 69 LEU HBy 1.0 . 5.34 1026 657 A 68 GLY H A 69 LEU HBx 1.0 . 5.34 1027 658 A 68 GLY H A 70 VAL H 1.0 . 4.51 1028 659 A 69 LEU H A 68 GLY HAx 1.0 . 3.19 1029 659 A 68 GLY HAy A 69 LEU H 1.0 . 3.19 1030 660 A 69 LEU HA A 69 LEU H 1.0 . 3.42 1031 661 A 69 LEU HA A 69 LEU H 1.0 . 3.50 1032 662 A 69 LEU H A 69 LEU HBy 1.0 . 3.55 1033 663 A 69 LEU H A 69 LEU HBx 1.0 . 3.55 1034 664 A 69 LEU H A 69 LEU HBy 1.0 . 2.81 1035 664 A 69 LEU H A 69 LEU HBx 1.0 . 2.81 1036 665 A 69 LEU H A 69 LEU HDx% 1.0 . 3.80 1037 665 A 69 LEU HDy% A 69 LEU H 1.0 . 3.80 1038 666 A 69 LEU HA A 69 LEU HDx% 1.0 . 3.00 1039 666 A 69 LEU HDy% A 69 LEU HA 1.0 . 3.00 1040 667 A 71 PHE H A 69 LEU HA 1.0 . 4.73 1041 668 A 69 LEU HA A 72 TYR HBy 1.0 . 3.88 1042 668 A 69 LEU HA A 72 TYR HBx 1.0 . 3.88 1043 669 A 69 LEU HA A 72 TYR HD% 1.0 . 4.28 1044 670 A 66 LEU HA A 69 LEU HBy 1.0 . 2.84 1045 671 A 70 VAL H A 69 LEU HBy 1.0 . 4.19 1046 672 A 70 VAL H A 69 LEU HBx 1.0 . 4.19 1047 673 A 70 VAL H A 69 LEU HBy 1.0 . 3.40 1048 673 A 70 VAL H A 69 LEU HBx 1.0 . 3.40 1049 674 A 70 VAL HA A 69 LEU HBy 1.0 . 4.44 1050 674 A 70 VAL HA A 69 LEU HBx 1.0 . 4.44 1051 675 A 69 LEU HBx A 72 TYR HBy 1.0 . 5.12 1052 675 A 69 LEU HBy A 72 TYR HBy 1.0 . 5.12 1053 675 A 72 TYR HBx A 69 LEU HBy 1.0 . 5.12 1054 675 A 69 LEU HBx A 72 TYR HBx 1.0 . 5.12 1055 676 A 69 LEU HA A 69 LEU HDx% 1.0 . 2.95 1056 676 A 69 LEU HDy% A 69 LEU HA 1.0 . 2.95 1057 677 A 69 LEU HDx% A 72 TYR HBy 1.0 . 4.10 1058 677 A 72 TYR HBx A 69 LEU HDx% 1.0 . 4.10 1059 677 A 69 LEU HDy% A 72 TYR HBx 1.0 . 4.10 1060 677 A 69 LEU HDy% A 72 TYR HBy 1.0 . 4.10 1061 678 A 70 VAL H A 70 VAL HB 1.0 . 3.61 1062 679 A 70 VAL H A 70 VAL HGy% 1.0 . 3.21 1063 680 A 70 VAL H A 71 PHE HD% 1.0 . 4.56 1064 681 A 70 VAL H A 72 TYR HBy 1.0 . 5.18 1065 681 A 70 VAL H A 72 TYR HBx 1.0 . 5.18 1066 682 A 70 VAL HA A 72 TYR H 1.0 . 4.71 1067 683 A 70 VAL HA A 73 LEU H 1.0 . 4.34 1068 684 A 70 VAL HA A 73 LEU H 1.0 . 4.34 1069 685 A 71 PHE H A 70 VAL HB 1.0 . 4.50 1070 686 A 70 VAL H A 70 VAL HGy% 1.0 . 3.02 1071 687 A 70 VAL H A 70 VAL HGy% 1.0 . 3.23 1072 688 A 71 PHE H A 70 VAL HGy% 1.0 . 3.20 1073 688 A 71 PHE H A 70 VAL HG11 1.0 . 3.20 1074 689 A 71 PHE HA A 70 VAL HGy% 1.0 . 3.91 1075 689 A 70 VAL HG11 A 71 PHE HA 1.0 . 3.91 1076 690 A 70 VAL HG11 A 71 PHE HBx 1.0 . 4.49 1077 690 A 71 PHE HBy A 70 VAL HGy% 1.0 . 4.49 1078 690 A 71 PHE HBy A 70 VAL HG11 1.0 . 4.49 1079 690 A 70 VAL HGy% A 71 PHE HBx 1.0 . 4.49 1080 691 A 71 PHE HD% A 70 VAL HGy% 1.0 . 3.76 1081 691 A 71 PHE HD% A 70 VAL HG11 1.0 . 3.76 1082 692 A 71 PHE H A 71 PHE HBx 1.0 . 3.84 1083 692 A 71 PHE HBy A 71 PHE H 1.0 . 3.84 1084 693 A 71 PHE H A 71 PHE HD% 1.0 . 4.39 1085 694 A 71 PHE H A 72 TYR HBy 1.0 . 4.57 1086 694 A 71 PHE H A 72 TYR HBx 1.0 . 4.57 1087 695 A 72 TYR H A 71 PHE HBx 1.0 . 4.11 1088 695 A 71 PHE HBy A 72 TYR H 1.0 . 4.11 1089 696 A 71 PHE HD% A 72 TYR H 1.0 . 4.68 1090 697 A 72 TYR H A 72 TYR HA 1.0 . 2.93 1091 698 A 72 TYR HBx A 72 TYR H 1.0 . 3.40 1092 699 A 72 TYR H A 72 TYR HBy 1.0 . 2.95 1093 699 A 72 TYR HBx A 72 TYR H 1.0 . 2.95 1094 700 A 72 TYR HD% A 72 TYR H 1.0 . 4.89 1095 701 A 72 TYR H A 73 LEU H 1.0 . 3.04 1096 702 A 72 TYR H A 72 TYR HBy 1.0 . 3.31 1097 703 A 73 LEU H A 72 TYR HBy 1.0 . 4.63 1098 704 A 73 LEU H A 72 TYR HBy 1.0 . 3.32 1099 704 A 72 TYR HBx A 73 LEU H 1.0 . 3.32 1100 705 A 72 TYR HD% A 73 LEU H 1.0 . 4.76 1101 706 A 73 LEU H A 73 LEU HBy 1.0 . 4.03 1102 707 A 73 LEU H A 73 LEU HBx 1.0 . 4.03 1103 708 A 73 LEU H A 73 LEU HBy 1.0 . 3.19 1104 708 A 73 LEU H A 73 LEU HBx 1.0 . 3.19 1105 709 A 73 LEU H A 73 LEU HDx% 1.0 . 4.06 1106 709 A 73 LEU H A 73 LEU HDy% 1.0 . 4.06 1107 710 A 73 LEU H A 74 PRO HDx 1.0 . 4.79 1108 710 A 73 LEU H A 74 PRO HDy 1.0 . 4.79 1109 711 A 73 LEU HA A 74 PRO HDx 1.0 . 3.69 1110 711 A 74 PRO HDy A 73 LEU HA 1.0 . 3.69 1111 712 A 74 PRO HDy A 73 LEU HBy 1.0 . 4.39 1112 712 A 73 LEU HBy A 74 PRO HDx 1.0 . 4.39 1113 713 A 73 LEU HBx A 74 PRO HDy 1.0 . 4.39 1114 713 A 73 LEU HBx A 74 PRO HDx 1.0 . 4.39 1115 714 A 73 LEU HDy% A 74 PRO HDx 1.0 . 3.83 1116 714 A 73 LEU HDx% A 74 PRO HDx 1.0 . 3.83 1117 714 A 74 PRO HDy A 73 LEU HDx% 1.0 . 3.83 1118 714 A 73 LEU HDy% A 74 PRO HDy 1.0 . 3.83 1119 715 A 74 PRO HA A 75 THR H 1.0 . 3.07 1120 716 A 75 THR H A 74 PRO HBy 1.0 . 4.00 1121 717 A 75 THR H A 74 PRO HBx 1.0 . 4.00 1122 718 A 75 THR H A 74 PRO HBx 1.0 . 3.32 1123 718 A 75 THR H A 74 PRO HBy 1.0 . 3.32 1124 719 A 76 ASP H A 74 PRO HBx 1.0 . 3.58 1125 719 A 74 PRO HBy A 76 ASP H 1.0 . 3.58 1126 720 A 75 THR HB A 75 THR H 1.0 . 3.87 1127 721 A 75 THR H A 75 THR HG2% 1.0 . 4.07 1128 722 A 75 THR H A 76 ASP H 1.0 . 3.38 1129 723 A 75 THR H A 76 ASP H 1.0 . 3.76 1130 724 A 75 THR HA A 75 THR HG2% 1.0 . 3.33 1131 725 A 75 THR HA A 76 ASP H 1.0 . 3.49 1132 726 A 75 THR HG2% A 76 ASP H 1.0 . 4.04 1133 727 A 75 THR HG2% A 76 ASP HBx 1.0 . 5.10 1134 727 A 76 ASP HBy A 75 THR HG2% 1.0 . 5.10 1135 728 A 75 THR H A 76 ASP H 1.0 . 3.51 1136 729 A 76 ASP H A 76 ASP HBx 1.0 . 3.31 1137 729 A 76 ASP HBy A 76 ASP H 1.0 . 3.31 1138 730 A 76 ASP HA A 77 SER H 1.0 . 2.88 1139 731 A 78 GLY H A 76 ASP HA 1.0 . 4.16 1140 732 A 79 GLU H A 76 ASP HA 1.0 . 4.57 1141 733 A 77 SER H A 76 ASP HBx 1.0 . 4.00 1142 733 A 76 ASP HBy A 77 SER H 1.0 . 4.00 1143 734 A 79 GLU H A 76 ASP HBx 1.0 . 3.72 1144 734 A 76 ASP HBy A 79 GLU H 1.0 . 3.72 1145 735 A 76 ASP HBy A 79 GLU HBx 1.0 . 3.95 1146 735 A 76 ASP HBx A 79 GLU HBx 1.0 . 3.95 1147 735 A 79 GLU HBy A 76 ASP HBx 1.0 . 3.95 1148 735 A 76 ASP HBy A 79 GLU HBy 1.0 . 3.95 1149 736 A 76 ASP HBy A 79 GLU HGx 1.0 . 4.36 1150 736 A 76 ASP HBx A 79 GLU HGx 1.0 . 4.36 1151 736 A 79 GLU HGy A 76 ASP HBx 1.0 . 4.36 1152 736 A 76 ASP HBy A 79 GLU HGy 1.0 . 4.36 1153 737 A 77 SER HA A 77 SER H 1.0 . 3.18 1154 738 A 77 SER HA A 77 SER H 1.0 . 3.37 1155 739 A 77 SER H A 77 SER HBx 1.0 . 2.76 1156 739 A 77 SER H A 77 SER HBy 1.0 . 2.76 1157 740 A 78 GLY H A 77 SER H 1.0 . 3.55 1158 741 A 77 SER HA A 77 SER HBx 1.0 . 2.66 1159 741 A 77 SER HA A 77 SER HBy 1.0 . 2.66 1160 742 A 78 GLY H A 77 SER HBx 1.0 . 3.89 1161 742 A 78 GLY H A 77 SER HBy 1.0 . 3.89 1162 743 A 78 GLY H A 78 GLY HAx 1.0 . 2.88 1163 743 A 78 GLY H A 78 GLY HAy 1.0 . 2.88 1164 744 A 78 GLY H A 79 GLU H 1.0 . 3.05 1165 745 A 78 GLY H A 79 GLU H 1.0 . 3.25 1166 746 A 78 GLY H A 79 GLU HBx 1.0 . 4.39 1167 746 A 78 GLY H A 79 GLU HBy 1.0 . 4.39 1168 747 A 79 GLU H A 78 GLY HAx 1.0 . 2.99 1169 747 A 79 GLU H A 78 GLY HAy 1.0 . 2.99 1170 748 A 78 GLY HAx A 80 LYS HBx 1.0 . 4.94 1171 748 A 78 GLY HAy A 80 LYS HBx 1.0 . 4.94 1172 748 A 80 LYS HBy A 78 GLY HAx 1.0 . 4.94 1173 748 A 78 GLY HAy A 80 LYS HBy 1.0 . 4.94 1174 749 A 81 MET H A 78 GLY HAx 1.0 . 4.24 1175 749 A 78 GLY HAy A 81 MET H 1.0 . 4.24 1176 750 A 79 GLU H A 79 GLU HA 1.0 . 2.93 1177 751 A 79 GLU H A 79 GLU HA 1.0 . 2.94 1178 752 A 79 GLU H A 79 GLU HBx 1.0 . 2.75 1179 752 A 79 GLU H A 79 GLU HBy 1.0 . 2.75 1180 753 A 79 GLU H A 79 GLU HGx 1.0 . 3.15 1181 753 A 79 GLU H A 79 GLU HGy 1.0 . 3.15 1182 754 A 79 GLU HA A 79 GLU HBx 1.0 . 2.79 1183 754 A 79 GLU HA A 79 GLU HBy 1.0 . 2.79 1184 755 A 79 GLU HA A 79 GLU HGx 1.0 . 2.60 1185 755 A 79 GLU HA A 79 GLU HGy 1.0 . 2.60 1186 756 A 79 GLU HBx A 79 GLU HGx 1.0 . 2.54 1187 756 A 79 GLU HBy A 79 GLU HGx 1.0 . 2.54 1188 756 A 79 GLU HGy A 79 GLU HBx 1.0 . 2.54 1189 756 A 79 GLU HBy A 79 GLU HGy 1.0 . 2.54 1190 757 A 80 LYS H A 80 LYS HBx 1.0 . 3.08 1191 757 A 80 LYS HBy A 80 LYS H 1.0 . 3.08 1192 758 A 80 LYS H A 80 LYS HEx 1.0 . 5.44 1193 758 A 80 LYS HEy A 80 LYS H 1.0 . 5.44 1194 759 A 80 LYS H A 80 LYS HGx 1.0 . 3.28 1195 759 A 80 LYS HGy A 80 LYS H 1.0 . 3.28 1196 760 A 81 MET H A 80 LYS H 1.0 . 3.19 1197 761 A 81 MET H A 80 LYS HBx 1.0 . 3.65 1198 761 A 80 LYS HBy A 81 MET H 1.0 . 3.65 1199 762 A 80 LYS HBy A 81 MET HGx 1.0 . 4.26 1200 762 A 81 MET HGy A 80 LYS HBx 1.0 . 4.26 1201 762 A 80 LYS HBy A 81 MET HGy 1.0 . 4.26 1202 762 A 80 LYS HBx A 81 MET HGx 1.0 . 4.26 1203 763 A 81 MET H A 80 LYS HGx 1.0 . 4.54 1204 763 A 80 LYS HGy A 81 MET H 1.0 . 4.54 1205 764 A 81 MET H A 81 MET HBx 1.0 . 2.98 1206 764 A 81 MET H A 81 MET HBy 1.0 . 2.98 1207 765 A 81 MET HE% A 81 MET H 1.0 . 3.65 1208 766 A 81 MET H A 81 MET HGx 1.0 . 3.50 1209 766 A 81 MET H A 81 MET HGy 1.0 . 3.50 1210 767 A 82 THR H A 81 MET H 1.0 . 3.10 1211 768 A 82 THR H A 81 MET H 1.0 . 3.10 1212 769 A 81 MET HA A 84 SER H 1.0 . 3.91 1213 770 A 82 THR H A 81 MET HBx 1.0 . 3.06 1214 770 A 82 THR H A 81 MET HBy 1.0 . 3.06 1215 771 A 82 THR HB A 81 MET HBx 1.0 . 4.13 1216 771 A 81 MET HBy A 82 THR HB 1.0 . 4.13 1217 772 A 81 MET HE% A 81 MET HGx 1.0 . 3.26 1218 772 A 81 MET HE% A 81 MET HGy 1.0 . 3.26 1219 773 A 82 THR H A 81 MET HGx 1.0 . 3.74 1220 773 A 82 THR H A 81 MET HGy 1.0 . 3.74 1221 774 A 82 THR H A 82 THR HA 1.0 . 4.32 1222 775 A 82 THR H A 82 THR HB 1.0 . 2.92 1223 776 A 82 THR HG2% A 82 THR H 1.0 . 2.57 1224 777 A 82 THR H A 83 GLU H 1.0 . 3.10 1225 778 A 82 THR H A 83 GLU H 1.0 . 3.65 1226 779 A 83 GLU H A 82 THR HA 1.0 . 3.57 1227 780 A 82 THR HG2% A 83 GLU H 1.0 . 3.72 1228 781 A 83 GLU H A 83 GLU HA 1.0 . 2.92 1229 782 A 83 GLU H A 83 GLU HBx 1.0 . 3.14 1230 782 A 83 GLU HBy A 83 GLU H 1.0 . 3.14 1231 783 A 83 GLU H A 83 GLU HGx 1.0 . 3.94 1232 783 A 83 GLU H A 83 GLU HGy 1.0 . 3.94 1233 784 A 83 GLU HA A 83 GLU HBx 1.0 . 2.58 1234 784 A 83 GLU HBy A 83 GLU HA 1.0 . 2.58 1235 785 A 83 GLU HA A 83 GLU HGx 1.0 . 2.79 1236 785 A 83 GLU HA A 83 GLU HGy 1.0 . 2.79 1237 786 A 83 GLU HA A 86 SER HBx 1.0 . 3.34 1238 786 A 83 GLU HA A 86 SER HBy 1.0 . 3.34 1239 787 A 84 SER H A 83 GLU HBx 1.0 . 3.72 1240 787 A 83 GLU HBy A 84 SER H 1.0 . 3.72 1241 788 A 84 SER HA A 83 GLU HBx 1.0 . 4.15 1242 788 A 84 SER HA A 83 GLU HBy 1.0 . 4.15 1243 789 A 84 SER H A 83 GLU HGx 1.0 . 4.27 1244 789 A 84 SER H A 83 GLU HGy 1.0 . 4.27 1245 790 A 84 SER H A 84 SER HBx 1.0 . 3.10 1246 790 A 84 SER HBy A 84 SER H 1.0 . 3.10 1247 791 A 85 LYS H A 85 LYS HBx 1.0 . 3.43 1248 791 A 85 LYS H A 85 LYS HBy 1.0 . 3.43 1249 792 A 85 LYS H A 85 LYS HGx 1.0 . 3.96 1250 792 A 85 LYS H A 85 LYS HGy 1.0 . 3.96 1251 793 A 86 SER H A 85 LYS HBx 1.0 . 3.54 1252 793 A 85 LYS HBy A 86 SER H 1.0 . 3.54 1253 794 A 86 SER HA A 85 LYS HBx 1.0 . 4.76 1254 794 A 86 SER HA A 85 LYS HBy 1.0 . 4.76 1255 795 A 87 VAL H A 85 LYS HBx 1.0 . 4.81 1256 795 A 85 LYS HBy A 87 VAL H 1.0 . 4.81 1257 796 A 86 SER H A 85 LYS HGx 1.0 . 4.21 1258 796 A 85 LYS HGy A 86 SER H 1.0 . 4.21 1259 797 A 86 SER H A 86 SER HBx 1.0 . 3.26 1260 797 A 86 SER HBy A 86 SER H 1.0 . 3.26 1261 798 A 87 VAL H A 87 VAL HGy% 1.0 . 4.06 1262 798 A 87 VAL H A 87 VAL HG11 1.0 . 4.06 1263 799 A 88 LEU H A 87 VAL H 1.0 . 3.69 1264 800 A 87 VAL H A 88 LEU HBx 1.0 . 4.57 1265 800 A 88 LEU HBy A 87 VAL H 1.0 . 4.57 1266 801 A 84 SER HA A 87 VAL HB 1.0 . 3.89 1267 802 A 88 LEU H A 88 LEU HBx 1.0 . 3.13 1268 802 A 88 LEU HBy A 88 LEU H 1.0 . 3.13 1269 803 A 88 LEU H A 88 LEU HD11 1.0 . 3.45 1270 803 A 88 LEU HDy% A 88 LEU H 1.0 . 3.45 1271 804 A 88 LEU HA A 88 LEU HD11 1.0 . 3.50 1272 804 A 88 LEU HDy% A 88 LEU HA 1.0 . 3.50 1273 805 A 88 LEU HBy A 88 LEU HD11 1.0 . 3.15 1274 805 A 88 LEU HDy% A 88 LEU HBx 1.0 . 3.15 1275 805 A 88 LEU HDy% A 88 LEU HBy 1.0 . 3.15 1276 805 A 88 LEU HBx A 88 LEU HD11 1.0 . 3.15 1277 806 A 89 LYS H A 88 LEU HD11 1.0 . 4.49 1278 806 A 88 LEU HDy% A 89 LYS H 1.0 . 4.49 1279 807 A 89 LYS H A 89 LYS HEx 1.0 . 5.50 1280 807 A 89 LYS H A 89 LYS HEy 1.0 . 5.50 1281 808 A 89 LYS H A 90 SER H 1.0 . 3.68 1282 809 A 89 LYS HA A 89 LYS HEx 1.0 . 4.95 1283 809 A 89 LYS HA A 89 LYS HEy 1.0 . 4.95 1284 810 A 89 LYS HBx A 89 LYS HEx 1.0 . 3.66 1285 810 A 89 LYS HBy A 89 LYS HEx 1.0 . 3.66 1286 810 A 89 LYS HEy A 89 LYS HBx 1.0 . 3.66 1287 810 A 89 LYS HEy A 89 LYS HBy 1.0 . 3.66 1288 811 A 90 SER H A 89 LYS HBx 1.0 . 4.13 1289 811 A 90 SER H A 89 LYS HBy 1.0 . 4.13 1290 812 A 90 SER HA A 89 LYS HBx 1.0 . 5.15 1291 812 A 90 SER HA A 89 LYS HBy 1.0 . 5.15 1292 813 A 90 SER H A 91 LEU H 1.0 . 3.65 1293 814 A 92 THR H A 90 SER H 1.0 . 4.51 1294 815 A 91 LEU H A 91 LEU HBy 1.0 . 3.53 1295 816 A 91 LEU H A 91 LEU HBx 1.0 . 3.53 1296 817 A 91 LEU H A 91 LEU HBy 1.0 . 2.99 1297 817 A 91 LEU H A 91 LEU HBx 1.0 . 2.99 1298 818 A 91 LEU H A 91 LEU HDx% 1.0 . 3.75 1299 818 A 91 LEU H A 91 LEU HDy% 1.0 . 3.75 1300 819 A 92 THR HG2% A 91 LEU H 1.0 . 4.14 1301 820 A 91 LEU HA A 91 LEU HDx% 1.0 . 3.11 1302 820 A 91 LEU HA A 91 LEU HDy% 1.0 . 3.11 1303 821 A 92 THR HG2% A 91 LEU HA 1.0 . 5.02 1304 822 A 92 THR H A 91 LEU HBy 1.0 . 4.09 1305 823 A 92 THR H A 91 LEU HBx 1.0 . 4.09 1306 824 A 92 THR H A 91 LEU HBy 1.0 . 3.37 1307 824 A 92 THR H A 91 LEU HBx 1.0 . 3.37 1308 825 A 92 THR HB A 91 LEU HBy 1.0 . 5.34 1309 825 A 91 LEU HBx A 92 THR HB 1.0 . 5.34 1310 826 A 92 THR H A 91 LEU HDx% 1.0 . 3.49 1311 826 A 92 THR H A 91 LEU HDy% 1.0 . 3.49 1312 827 A 92 THR HA A 91 LEU HDx% 1.0 . 4.26 1313 827 A 91 LEU HDy% A 92 THR HA 1.0 . 4.26 1314 828 A 92 THR H A 92 THR HB 1.0 . 3.15 1315 829 A 92 THR HG2% A 92 THR H 1.0 . 3.33 1316 830 A 92 THR H A 93 GLU H 1.0 . 3.62 1317 831 A 92 THR H A 93 GLU HBx 1.0 . 4.64 1318 831 A 92 THR H A 93 GLU HBy 1.0 . 4.64 1319 832 A 92 THR HG2% A 92 THR HA 1.0 . 4.05 1320 833 A 95 LEU H A 92 THR HA 1.0 . 3.97 1321 834 A 92 THR HA A 95 LEU HBy 1.0 . 4.15 1322 834 A 92 THR HA A 95 LEU HBx 1.0 . 4.15 1323 835 A 96 LYS H A 92 THR HA 1.0 . 4.33 1324 836 A 92 THR HG2% A 93 GLU H 1.0 . 4.00 1325 837 A 92 THR HG2% A 93 GLU HBx 1.0 . 4.08 1326 837 A 92 THR HG2% A 93 GLU HBy 1.0 . 4.08 1327 838 A 92 THR HG2% A 94 LYS H 1.0 . 4.51 1328 839 A 92 THR H A 93 GLU H 1.0 . 3.80 1329 840 A 93 GLU H A 93 GLU HBx 1.0 . 3.17 1330 840 A 93 GLU HBy A 93 GLU H 1.0 . 3.17 1331 841 A 93 GLU H A 93 GLU HGx 1.0 . 3.61 1332 841 A 93 GLU H A 93 GLU HGy 1.0 . 3.61 1333 842 A 94 LYS H A 93 GLU H 1.0 . 3.78 1334 843 A 95 LEU H A 93 GLU H 1.0 . 4.21 1335 844 A 90 SER HA A 93 GLU HBx 1.0 . 4.13 1336 844 A 93 GLU HBy A 90 SER HA 1.0 . 4.13 1337 845 A 93 GLU HBx A 93 GLU HGx 1.0 . 2.85 1338 845 A 93 GLU HBy A 93 GLU HGx 1.0 . 2.85 1339 845 A 93 GLU HGy A 93 GLU HBx 1.0 . 2.85 1340 845 A 93 GLU HBy A 93 GLU HGy 1.0 . 2.85 1341 846 A 94 LYS H A 93 GLU HBx 1.0 . 3.86 1342 846 A 93 GLU HBy A 94 LYS H 1.0 . 3.86 1343 847 A 94 LYS H A 94 LYS HBx 1.0 . 3.55 1344 847 A 94 LYS HBy A 94 LYS H 1.0 . 3.55 1345 848 A 95 LEU H A 94 LYS H 1.0 . 3.75 1346 849 A 94 LYS H A 96 LYS H 1.0 . 4.59 1347 850 A 97 LYS H A 94 LYS HA 1.0 . 4.35 1348 851 A 95 LEU H A 94 LYS HBx 1.0 . 3.74 1349 851 A 95 LEU H A 94 LYS HBy 1.0 . 3.74 1350 852 A 95 LEU H A 94 LYS H 1.0 . 3.78 1351 853 A 95 LEU H A 95 LEU HBy 1.0 . 3.57 1352 854 A 95 LEU H A 95 LEU HBx 1.0 . 3.57 1353 855 A 95 LEU H A 95 LEU HBy 1.0 . 3.08 1354 855 A 95 LEU H A 95 LEU HBx 1.0 . 3.08 1355 856 A 95 LEU H A 95 LEU HD11 1.0 . 4.24 1356 856 A 95 LEU HDy% A 95 LEU H 1.0 . 4.24 1357 857 A 98 ILE H A 95 LEU HA 1.0 . 3.59 1358 858 A 96 LYS H A 95 LEU HBy 1.0 . 3.51 1359 858 A 96 LYS H A 95 LEU HBx 1.0 . 3.51 1360 859 A 96 LYS HA A 95 LEU HBy 1.0 . 4.68 1361 859 A 96 LYS HA A 95 LEU HBx 1.0 . 4.68 1362 860 A 96 LYS H A 96 LYS HBx 1.0 . 3.19 1363 860 A 96 LYS H A 96 LYS HBy 1.0 . 3.19 1364 861 A 97 LYS H A 96 LYS H 1.0 . 3.87 1365 862 A 98 ILE H A 96 LYS H 1.0 . 4.47 1366 863 A 96 LYS HA A 96 LYS H 1.0 . 4.07 1367 864 A 96 LYS HA A 99 VAL H 1.0 . 4.50 1368 865 A 97 LYS H A 96 LYS HBx 1.0 . 3.55 1369 865 A 97 LYS H A 96 LYS HBy 1.0 . 3.55 1370 866 A 97 LYS H A 97 LYS HBx 1.0 . 3.66 1371 866 A 97 LYS H A 97 LYS HBy 1.0 . 3.66 1372 867 A 97 LYS H A 97 LYS HGx 1.0 . 3.33 1373 867 A 97 LYS H A 97 LYS HGy 1.0 . 3.33 1374 868 A 97 LYS H A 98 ILE H 1.0 . 3.71 1375 869 A 97 LYS H A 99 VAL H 1.0 . 4.42 1376 870 A 97 LYS HA A 100 GLU HBx 1.0 . 4.03 1377 870 A 97 LYS HA A 100 GLU HBy 1.0 . 4.03 1378 871 A 97 LYS HA A 97 LYS HBx 1.0 . 2.96 1379 871 A 97 LYS HA A 97 LYS HBy 1.0 . 2.96 1380 872 A 97 LYS HA A 99 VAL H 1.0 . 4.40 1381 873 A 100 GLU H A 97 LYS HBx 1.0 . 5.12 1382 873 A 100 GLU H A 97 LYS HBy 1.0 . 5.12 1383 874 A 98 ILE H A 98 ILE HB 1.0 . 3.70 1384 875 A 98 ILE H A 98 ILE HD1% 1.0 . 3.82 1385 876 A 98 ILE H A 98 ILE HG1x 1.0 . 3.95 1386 876 A 98 ILE HG1y A 98 ILE H 1.0 . 3.95 1387 877 A 98 ILE H A 98 ILE HG2% 1.0 . 3.78 1388 878 A 100 GLU H A 98 ILE HA 1.0 . 4.46 1389 879 A 31 VAL HB A 28 THR HA 1.0 . 4.18 1390 880 A 101 LEU H A 98 ILE HA 1.0 . 4.58 1391 881 A 98 ILE HD1% A 98 ILE HA 1.0 . 3.43 1392 882 A 98 ILE HG2% A 98 ILE HA 1.0 . 3.13 1393 883 A 98 ILE HB A 98 ILE HD1% 1.0 . 3.04 1394 884 A 98 ILE HB A 99 VAL H 1.0 . 4.70 1395 885 A 100 GLU H A 98 ILE HG1x 1.0 . 5.50 1396 885 A 98 ILE HG1y A 100 GLU H 1.0 . 5.50 1397 886 A 101 LEU H A 98 ILE HG1x 1.0 . 3.47 1398 886 A 98 ILE HG1y A 101 LEU H 1.0 . 3.47 1399 887 A 101 LEU H A 98 ILE HG1x 1.0 . 3.81 1400 887 A 98 ILE HG1y A 101 LEU H 1.0 . 3.81 1401 888 A 97 LYS H A 98 ILE HG2% 1.0 . 5.08 1402 889 A 98 ILE HG2% A 98 ILE HG1x 1.0 . 2.93 1403 889 A 98 ILE HG1y A 98 ILE HG2% 1.0 . 2.93 1404 890 A 100 GLU H A 99 VAL H 1.0 . 3.57 1405 891 A 100 GLU H A 99 VAL H 1.0 . 3.88 1406 892 A 99 VAL H A 99 VAL HB 1.0 . 3.33 1407 893 A 99 VAL H A 99 VAL HG11 1.0 . 2.81 1408 893 A 99 VAL H A 99 VAL HGy% 1.0 . 2.81 1409 894 A 99 VAL HA A 103 PRO HDx 1.0 . 3.50 1410 894 A 99 VAL HA A 103 PRO HDy 1.0 . 3.50 1411 895 A 100 GLU H A 99 VAL HG11 1.0 . 3.94 1412 895 A 100 GLU H A 99 VAL HGy% 1.0 . 3.94 1413 896 A 100 GLU H A 100 GLU HBx 1.0 . 3.34 1414 896 A 100 GLU H A 100 GLU HBy 1.0 . 3.34 1415 897 A 100 GLU H A 100 GLU HGx 1.0 . 4.00 1416 897 A 100 GLU H A 100 GLU HGy 1.0 . 4.00 1417 898 A 100 GLU H A 100 GLU HGx 1.0 . 4.07 1418 898 A 100 GLU H A 100 GLU HGy 1.0 . 4.07 1419 899 A 100 GLU H A 101 LEU H 1.0 . 3.29 1420 900 A 100 GLU H A 101 LEU HBy 1.0 . 5.34 1421 900 A 100 GLU H A 101 LEU HBx 1.0 . 5.34 1422 901 A 100 GLU HA A 100 GLU HBx 1.0 . 2.95 1423 901 A 100 GLU HA A 100 GLU HBy 1.0 . 2.95 1424 902 A 100 GLU HA A 100 GLU HGx 1.0 . 3.45 1425 902 A 100 GLU HA A 100 GLU HGy 1.0 . 3.45 1426 903 A 100 GLU H A 100 GLU HGx 1.0 . 4.03 1427 903 A 100 GLU H A 100 GLU HGy 1.0 . 4.03 1428 904 A 101 LEU H A 100 GLU HGx 1.0 . 4.56 1429 904 A 101 LEU H A 100 GLU HGy 1.0 . 4.56 1430 905 A 101 LEU H A 101 LEU HBy 1.0 . 3.00 1431 905 A 101 LEU H A 101 LEU HBx 1.0 . 3.00 1432 906 A 101 LEU H A 101 LEU HDx% 1.0 . 3.09 1433 906 A 101 LEU H A 101 LEU HDy% 1.0 . 3.09 1434 907 A 102 ILE H A 101 LEU H 1.0 . 3.62 1435 908 A 101 LEU H A 103 PRO HDx 1.0 . 4.78 1436 908 A 101 LEU H A 103 PRO HDy 1.0 . 4.78 1437 909 A 98 ILE HA A 101 LEU HBx 1.0 . 3.97 1438 910 A 102 ILE H A 101 LEU HBy 1.0 . 4.21 1439 910 A 102 ILE H A 101 LEU HBx 1.0 . 4.21 1440 911 A 102 ILE H A 101 LEU HDx% 1.0 . 4.62 1441 911 A 102 ILE H A 101 LEU HDy% 1.0 . 4.62 1442 912 A 102 ILE H A 102 ILE HB 1.0 . 3.90 1443 913 A 102 ILE HD1% A 102 ILE H 1.0 . 4.62 1444 914 A 102 ILE H A 102 ILE HG1x 1.0 . 3.77 1445 914 A 102 ILE H A 102 ILE HG1y 1.0 . 3.77 1446 915 A 102 ILE H A 102 ILE HG2% 1.0 . 4.31 1447 916 A 102 ILE HG2% A 102 ILE HA 1.0 . 3.38 1448 917 A 102 ILE HA A 104 SER H 1.0 . 4.81 1449 918 A 102 ILE HD1% A 102 ILE HB 1.0 . 3.41 1450 919 A 102 ILE HB A 104 SER H 1.0 . 4.07 1451 920 A 102 ILE HG2% A 104 SER H 1.0 . 4.08 1452 921 A 104 SER H A 103 PRO HA 1.0 . 3.52 1453 922 A 104 SER H A 103 PRO HBy 1.0 . 4.34 1454 923 A 104 SER H A 103 PRO HBy 1.0 . 4.17 1455 924 A 104 SER H A 104 SER HBx 1.0 . 3.02 1456 924 A 104 SER H A 104 SER HBy 1.0 . 3.02 1457 925 A 105 THR H A 104 SER HBx 1.0 . 3.77 1458 925 A 105 THR H A 104 SER HBy 1.0 . 3.77 1459 926 A 105 THR HG2% A 105 THR H 1.0 . 3.78 1460 927 A 105 THR H A 106 SER H 1.0 . 2.70 1461 928 A 106 SER H A 105 THR HA 1.0 . 3.57 1462 929 A 105 THR HG2% A 106 SER H 1.0 . 4.22 1463 930 A 106 SER H A 106 SER HBx 1.0 . 2.96 1464 930 A 106 SER H A 106 SER HBy 1.0 . 2.96 1465 931 A 106 SER H A 106 SER HBx 1.0 . 3.35 1466 931 A 106 SER H A 106 SER HBy 1.0 . 3.35 1467 932 A 107 SER H A 106 SER HBx 1.0 . 3.51 1468 932 A 107 SER H A 106 SER HBy 1.0 . 3.51 1469 933 A 107 SER H A 107 SER HBx 1.0 . 2.95 1470 933 A 107 SER H A 107 SER HBy 1.0 . 2.95 1471 934 A 108 ALA HB% A 107 SER H 1.0 . 4.30 1472 935 A 109 VAL H A 107 SER H 1.0 . 4.71 1473 936 A 109 VAL H A 107 SER HA 1.0 . 4.25 1474 937 A 108 ALA H A 107 SER HBx 1.0 . 3.59 1475 937 A 107 SER HBy A 108 ALA H 1.0 . 3.59 1476 938 A 108 ALA HB% A 108 ALA H 1.0 . 2.89 1477 939 A 109 VAL H A 108 ALA H 1.0 . 3.60 1478 940 A 108 ALA H A 109 VAL HB 1.0 . 4.47 1479 941 A 108 ALA H A 109 VAL HGy% 1.0 . 4.50 1480 942 A 108 ALA HB% A 109 VAL H 1.0 . 3.68 1481 943 A 109 VAL H A 109 VAL HB 1.0 . 3.50 1482 944 A 109 VAL H A 109 VAL HGy% 1.0 . 3.10 1483 945 A 111 LEU H A 109 VAL H 1.0 . 4.48 1484 946 A 111 LEU H A 109 VAL HA 1.0 . 4.70 1485 947 A 109 VAL HB A 106 SER HA 1.0 . 4.18 1486 948 A 111 LEU H A 111 LEU HBy 1.0 . 3.80 1487 949 A 111 LEU H A 111 LEU HBx 1.0 . 3.80 1488 950 A 111 LEU H A 111 LEU HBx 1.0 . 4.42 1489 951 A 111 LEU H A 111 LEU HBy 1.0 . 3.30 1490 951 A 111 LEU H A 111 LEU HBx 1.0 . 3.30 1491 952 A 111 LEU H A 111 LEU HDx% 1.0 . 3.97 1492 952 A 111 LEU HDy% A 111 LEU H 1.0 . 3.97 1493 953 A 111 LEU H A 112 ILE H 1.0 . 4.02 1494 954 A 111 LEU HA A 111 LEU HBy 1.0 . 2.62 1495 954 A 111 LEU HBx A 111 LEU HA 1.0 . 2.62 1496 955 A 111 LEU HA A 111 LEU HDx% 1.0 . 3.58 1497 955 A 111 LEU HDy% A 111 LEU HA 1.0 . 3.58 1498 956 A 111 LEU H A 111 LEU HBy 1.0 . 4.25 1499 957 A 112 ILE H A 111 LEU HBy 1.0 . 4.04 1500 958 A 111 LEU HBx A 112 ILE H 1.0 . 4.04 1501 959 A 112 ILE H A 111 LEU HBy 1.0 . 3.42 1502 959 A 111 LEU HBx A 112 ILE H 1.0 . 3.42 1503 960 A 112 ILE HA A 111 LEU HBy 1.0 . 4.91 1504 960 A 112 ILE HA A 111 LEU HBx 1.0 . 4.91 1505 961 A 113 GLY H A 111 LEU HBy 1.0 . 5.34 1506 961 A 113 GLY H A 111 LEU HBx 1.0 . 5.34 1507 962 A 114 LYS H A 111 LEU HDx% 1.0 . 5.27 1508 962 A 111 LEU HDy% A 114 LYS H 1.0 . 5.27 1509 963 A 112 ILE H A 112 ILE HB 1.0 . 3.68 1510 964 A 112 ILE H A 112 ILE HG1x 1.0 . 4.08 1511 964 A 112 ILE HG1y A 112 ILE H 1.0 . 4.08 1512 965 A 112 ILE H A 112 ILE HG2% 1.0 . 3.45 1513 966 A 113 GLY H A 112 ILE H 1.0 . 4.21 1514 967 A 114 LYS H A 112 ILE H 1.0 . 4.65 1515 968 A 112 ILE HA A 112 ILE HG2% 1.0 . 3.75 1516 969 A 112 ILE HA A 114 LYS HBx 1.0 . 5.50 1517 969 A 112 ILE HA A 114 LYS HBy 1.0 . 5.50 1518 970 A 112 ILE HB A 112 ILE HD1% 1.0 . 3.32 1519 971 A 113 GLY H A 112 ILE HB 1.0 . 4.27 1520 972 A 113 GLY H A 112 ILE HG1x 1.0 . 4.31 1521 972 A 113 GLY H A 112 ILE HG1y 1.0 . 4.31 1522 973 A 114 LYS H A 112 ILE HG1x 1.0 . 5.39 1523 973 A 112 ILE HG1y A 114 LYS H 1.0 . 5.39 1524 974 A 112 ILE HG2% A 112 ILE HG1x 1.0 . 2.56 1525 974 A 112 ILE HG1y A 112 ILE HG2% 1.0 . 2.56 1526 975 A 113 GLY H A 112 ILE HG2% 1.0 . 4.18 1527 976 A 114 LYS H A 112 ILE HG2% 1.0 . 5.50 1528 977 A 113 GLY H A 112 ILE H 1.0 . 3.92 1529 978 A 113 GLY H A 114 LYS H 1.0 . 4.12 1530 979 A 113 GLY H A 114 LYS HBx 1.0 . 4.78 1531 979 A 113 GLY H A 114 LYS HBy 1.0 . 4.78 1532 980 A 114 LYS H A 114 LYS HBx 1.0 . 3.69 1533 980 A 114 LYS H A 114 LYS HBy 1.0 . 3.69 1534 981 A 115 TYR H A 115 TYR HBx 1.0 . 3.85 1535 981 A 115 TYR HBy A 115 TYR H 1.0 . 3.85 1536 982 A 115 TYR H A 115 TYR HD% 1.0 . 4.21 1537 983 A 115 TYR HD% A 115 TYR HA 1.0 . 4.33 1538 984 A 116 MET HE% A 117 LEU H 1.0 . 4.44 1539 985 A 116 MET HE% A 116 MET HGx 1.0 . 3.42 1540 985 A 116 MET HE% A 116 MET HGy 1.0 . 3.42 1541 986 A 117 LEU H A 117 LEU HBx 1.0 . 3.48 1542 986 A 117 LEU H A 117 LEU HBy 1.0 . 3.48 1543 987 A 117 LEU H A 117 LEU HDx% 1.0 . 4.59 1544 987 A 117 LEU H A 117 LEU HDy% 1.0 . 4.59 1545 988 A 121 GLU H A 117 LEU HA 1.0 . 4.16 1546 989 A 121 GLU H A 117 LEU HBx 1.0 . 5.30 1547 989 A 121 GLU H A 117 LEU HBy 1.0 . 5.30 1548 990 A 121 GLU H A 117 LEU HDx% 1.0 . 4.88 1549 990 A 121 GLU H A 117 LEU HDy% 1.0 . 4.88 1550 991 A 118 PHE H A 118 PHE HBx 1.0 . 3.57 1551 991 A 118 PHE H A 118 PHE HBy 1.0 . 3.57 1552 992 A 118 PHE H A 118 PHE HD% 1.0 . 4.25 1553 993 A 119 THR H A 118 PHE H 1.0 . 4.63 1554 994 A 118 PHE HA A 118 PHE HD% 1.0 . 4.29 1555 995 A 115 TYR HA A 118 PHE HBx 1.0 . 3.80 1556 995 A 115 TYR HA A 118 PHE HBy 1.0 . 3.80 1557 996 A 118 PHE HA A 118 PHE HBx 1.0 . 3.91 1558 996 A 118 PHE HA A 118 PHE HBy 1.0 . 3.91 1559 997 A 119 THR H A 118 PHE HBx 1.0 . 4.14 1560 997 A 119 THR H A 118 PHE HBy 1.0 . 4.14 1561 998 A 119 THR H A 119 THR HB 1.0 . 3.87 1562 999 A 119 THR H A 119 THR HG2% 1.0 . 4.05 1563 1000 A 119 THR H A 120 LYS H 1.0 . 3.23 1564 1001 A 119 THR H A 122 PHE HBx 1.0 . 5.13 1565 1001 A 119 THR H A 122 PHE HBy 1.0 . 5.13 1566 1002 A 119 THR HA A 122 PHE H 1.0 . 4.80 1567 1003 A 119 THR HG2% A 120 LYS H 1.0 . 4.11 1568 1004 A 121 GLU H A 119 THR HG2% 1.0 . 5.50 1569 1005 A 119 THR HG2% A 122 PHE H 1.0 . 5.05 1570 1006 A 119 THR HG2% A 122 PHE HBx 1.0 . 4.75 1571 1006 A 119 THR HG2% A 122 PHE HBy 1.0 . 4.75 1572 1007 A 120 LYS H A 122 PHE H 1.0 . 4.25 1573 1008 A 120 LYS HA A 123 VAL H 1.0 . 4.56 1574 1009 A 120 LYS H A 120 LYS HBx 1.0 . 4.28 1575 1009 A 120 LYS H A 120 LYS HBy 1.0 . 4.28 1576 1010 A 121 GLU H A 120 LYS HBx 1.0 . 3.74 1577 1010 A 121 GLU H A 120 LYS HBy 1.0 . 3.74 1578 1011 A 120 LYS HBy A 121 GLU HGx 1.0 . 4.79 1579 1011 A 120 LYS HBx A 121 GLU HGx 1.0 . 4.79 1580 1011 A 121 GLU HGy A 120 LYS HBx 1.0 . 4.79 1581 1011 A 120 LYS HBy A 121 GLU HGy 1.0 . 4.79 1582 1012 A 121 GLU H A 121 GLU HBy 1.0 . 3.69 1583 1013 A 121 GLU H A 121 GLU HBx 1.0 . 3.69 1584 1014 A 121 GLU H A 121 GLU HBx 1.0 . 3.19 1585 1014 A 121 GLU H A 121 GLU HBy 1.0 . 3.19 1586 1015 A 121 GLU H A 121 GLU HGx 1.0 . 3.89 1587 1015 A 121 GLU H A 121 GLU HGy 1.0 . 3.89 1588 1016 A 121 GLU H A 122 PHE H 1.0 . 4.48 1589 1017 A 121 GLU H A 123 VAL HGy% 1.0 . 4.28 1590 1017 A 121 GLU H A 123 VAL HGx% 1.0 . 4.28 1591 1018 A 121 GLU HA A 121 GLU HGx 1.0 . 3.49 1592 1018 A 121 GLU HGy A 121 GLU HA 1.0 . 3.49 1593 1019 A 124 GLU H A 121 GLU HA 1.0 . 4.73 1594 1020 A 121 GLU HA A 124 GLU HBx 1.0 . 4.30 1595 1020 A 121 GLU HA A 124 GLU HBy 1.0 . 4.30 1596 1021 A 122 PHE H A 121 GLU HBx 1.0 . 4.10 1597 1021 A 122 PHE H A 121 GLU HBy 1.0 . 4.10 1598 1022 A 122 PHE HA A 121 GLU HBx 1.0 . 4.28 1599 1022 A 121 GLU HBy A 122 PHE HA 1.0 . 4.28 1600 1023 A 122 PHE HA A 121 GLU HGx 1.0 . 5.03 1601 1023 A 121 GLU HGy A 122 PHE HA 1.0 . 5.03 1602 1024 A 121 GLU H A 122 PHE H 1.0 . 4.10 1603 1025 A 122 PHE H A 122 PHE HBx 1.0 . 3.96 1604 1025 A 122 PHE HBy A 122 PHE H 1.0 . 3.96 1605 1026 A 122 PHE H A 123 VAL H 1.0 . 4.27 1606 1027 A 122 PHE H A 123 VAL HGy% 1.0 . 4.51 1607 1027 A 123 VAL HGx% A 122 PHE H 1.0 . 4.51 1608 1028 A 122 PHE HD% A 122 PHE HA 1.0 . 3.90 1609 1029 A 123 VAL H A 122 PHE HBx 1.0 . 4.24 1610 1029 A 122 PHE HBy A 123 VAL H 1.0 . 4.24 1611 1030 A 123 VAL HB A 122 PHE HBx 1.0 . 5.19 1612 1030 A 122 PHE HBy A 123 VAL HB 1.0 . 5.19 1613 1031 A 122 PHE HBy A 123 VAL HGy% 1.0 . 4.14 1614 1031 A 123 VAL HGx% A 122 PHE HBx 1.0 . 4.14 1615 1031 A 123 VAL HGx% A 122 PHE HBy 1.0 . 4.14 1616 1031 A 122 PHE HBx A 123 VAL HGy% 1.0 . 4.14 1617 1032 A 122 PHE HD% A 123 VAL H 1.0 . 4.50 1618 1033 A 123 VAL H A 123 VAL HB 1.0 . 3.88 1619 1034 A 123 VAL H A 123 VAL HB 1.0 . 4.62 1620 1035 A 123 VAL HGx% A 123 VAL H 1.0 . 4.07 1621 1036 A 123 VAL H A 123 VAL HGy% 1.0 . 4.07 1622 1037 A 123 VAL H A 123 VAL HGy% 1.0 . 3.32 1623 1037 A 123 VAL HGx% A 123 VAL H 1.0 . 3.32 1624 1038 A 124 GLU H A 123 VAL H 1.0 . 4.22 1625 1039 A 124 GLU H A 123 VAL H 1.0 . 4.55 1626 1040 A 123 VAL H A 125 SER H 1.0 . 4.31 1627 1041 A 124 GLU H A 123 VAL HGx% 1.0 . 4.70 1628 1042 A 124 GLU H A 123 VAL HGy% 1.0 . 4.70 1629 1043 A 124 GLU H A 123 VAL HGy% 1.0 . 4.12 1630 1043 A 124 GLU H A 123 VAL HGx% 1.0 . 4.12 1631 1044 A 124 GLU H A 124 GLU HGx 1.0 . 4.27 1632 1044 A 124 GLU H A 124 GLU HGy 1.0 . 4.27 1633 1045 A 124 GLU H A 125 SER H 1.0 . 4.09 1634 1046 A 124 GLU H A 126 SER H 1.0 . 4.79 1635 1047 A 124 GLU H A 124 GLU HBx 1.0 . 3.66 1636 1047 A 124 GLU H A 124 GLU HBy 1.0 . 3.66 1637 1048 A 125 SER H A 124 GLU HBx 1.0 . 4.41 1638 1048 A 124 GLU HBy A 125 SER H 1.0 . 4.41 1639 1049 A 127 ILE HD1% A 124 GLU HBx 1.0 . 3.69 1640 1049 A 124 GLU HBy A 127 ILE HD1% 1.0 . 3.69 1641 1050 A 127 ILE HD1% A 124 GLU HGx 1.0 . 3.55 1642 1050 A 124 GLU HGy A 127 ILE HD1% 1.0 . 3.55 1643 1051 A 124 GLU H A 125 SER H 1.0 . 4.22 1644 1052 A 126 SER H A 126 SER HBx 1.0 . 3.87 1645 1052 A 126 SER H A 126 SER HBy 1.0 . 3.87 1646 1053 A 127 ILE H A 126 SER HBx 1.0 . 4.80 1647 1053 A 127 ILE H A 126 SER HBy 1.0 . 4.80 1648 1054 A 127 ILE H A 127 ILE HB 1.0 . 3.73 1649 1055 A 127 ILE H A 127 ILE HB 1.0 . 3.98 1650 1056 A 127 ILE H A 127 ILE HD1% 1.0 . 3.67 1651 1057 A 127 ILE H A 127 ILE HG1x 1.0 . 4.12 1652 1057 A 127 ILE H A 127 ILE HG1y 1.0 . 4.12 1653 1058 A 127 ILE H A 127 ILE HG2% 1.0 . 3.80 1654 1059 A 127 ILE H A 128 LYS H 1.0 . 4.23 1655 1060 A 127 ILE HB A 127 ILE HD1% 1.0 . 2.43 1656 1061 A 127 ILE HB A 128 LYS HBx 1.0 . 5.10 1657 1061 A 127 ILE HB A 128 LYS HBy 1.0 . 5.10 1658 1062 A 128 LYS H A 127 ILE HG1x 1.0 . 5.04 1659 1062 A 127 ILE HG1y A 128 LYS H 1.0 . 5.04 1660 1063 A 127 ILE HG2% A 128 LYS H 1.0 . 4.25 1661 1064 A 128 LYS H A 129 ILE H 1.0 . 4.13 1662 1065 A 129 ILE H A 128 LYS HBx 1.0 . 3.92 1663 1065 A 128 LYS HBy A 129 ILE H 1.0 . 3.92 1664 1066 A 130 THR H A 128 LYS HBx 1.0 . 5.06 1665 1066 A 128 LYS HBy A 130 THR H 1.0 . 5.06 1666 1067 A 129 ILE HB A 129 ILE H 1.0 . 3.74 1667 1068 A 129 ILE HD1% A 129 ILE H 1.0 . 3.97 1668 1069 A 129 ILE H A 129 ILE HG2% 1.0 . 4.00 1669 1070 A 129 ILE H A 130 THR H 1.0 . 4.14 1670 1071 A 129 ILE HD1% A 129 ILE HB 1.0 . 3.85 1671 1072 A 129 ILE HB A 130 THR H 1.0 . 4.10 1672 1073 A 129 ILE HB A 126 SER HA 1.0 . 4.42 1673 1074 A 130 THR H A 129 ILE HG2% 1.0 . 4.24 1674 1075 A 129 ILE HG2% A 131 GLU H 1.0 . 4.60 1675 1076 A 130 THR H A 130 THR HB 1.0 . 3.79 1676 1077 A 130 THR HG1 A 130 THR H 1.0 . 3.99 1677 1078 A 130 THR H A 130 THR HG2% 1.0 . 3.77 1678 1079 A 130 THR H A 131 GLU H 1.0 . 4.04 1679 1080 A 131 GLU H A 130 THR HB 1.0 . 4.00 1680 1081 A 130 THR HB A 131 GLU HA 1.0 . 4.67 1681 1082 A 130 THR HG1 A 131 GLU H 1.0 . 4.68 1682 1083 A 131 GLU H A 130 THR HG2% 1.0 . 4.39 1683 1084 A 131 GLU H A 131 GLU HBx 1.0 . 3.57 1684 1084 A 131 GLU H A 131 GLU HBy 1.0 . 3.57 1685 1085 A 131 GLU H A 131 GLU HGx 1.0 . 4.12 1686 1085 A 131 GLU H A 131 GLU HGy 1.0 . 4.12 1687 1086 A 132 GLU H A 131 GLU H 1.0 . 4.29 1688 1087 A 132 GLU H A 132 GLU HBx 1.0 . 3.14 1689 1087 A 132 GLU H A 132 GLU HBy 1.0 . 3.14 1690 1088 A 132 GLU H A 133 VAL H 1.0 . 3.57 1691 1089 A 132 GLU HA A 135 ASN HD2y 1.0 . 4.90 1692 1090 A 132 GLU HA A 135 ASN HBx 1.0 . 4.32 1693 1090 A 132 GLU HA A 135 ASN HBy 1.0 . 4.32 1694 1091 A 129 ILE HA A 132 GLU HBx 1.0 . 4.31 1695 1091 A 132 GLU HBy A 129 ILE HA 1.0 . 4.31 1696 1092 A 133 VAL HB A 133 VAL H 1.0 . 3.89 1697 1093 A 133 VAL H A 133 VAL HGx% 1.0 . 3.98 1698 1094 A 133 VAL H A 133 VAL HGy% 1.0 . 3.98 1699 1095 A 133 VAL H A 133 VAL HGy% 1.0 . 3.25 1700 1095 A 133 VAL H A 133 VAL HGx% 1.0 . 3.25 1701 1096 A 132 GLU HA A 135 ASN HBx 1.0 . 4.50 1702 1096 A 132 GLU HA A 135 ASN HBy 1.0 . 4.50 1703 1097 A 136 THR H A 133 VAL HA 1.0 . 4.24 1704 1098 A 133 VAL HB A 134 ILE H 1.0 . 4.30 1705 1099 A 133 VAL HGx% A 134 ILE H 1.0 . 4.42 1706 1100 A 134 ILE H A 133 VAL HGy% 1.0 . 4.42 1707 1101 A 136 THR H A 133 VAL HGy% 1.0 . 4.50 1708 1102 A 134 ILE H A 133 VAL HGy% 1.0 . 3.85 1709 1102 A 133 VAL HGx% A 134 ILE H 1.0 . 3.85 1710 1103 A 133 VAL HA A 134 ILE H 1.0 . 4.27 1711 1104 A 134 ILE H A 134 ILE HB 1.0 . 4.08 1712 1105 A 134 ILE H A 134 ILE HG2% 1.0 . 4.09 1713 1106 A 134 ILE H A 135 ASN HBx 1.0 . 4.87 1714 1106 A 135 ASN HBy A 134 ILE H 1.0 . 4.87 1715 1107 A 134 ILE HA A 137 HIS H 1.0 . 4.47 1716 1108 A 135 ASN HA A 134 ILE HD1% 1.0 . 4.79 1717 1109 A 134 ILE HD1% A 138 HIS HBx 1.0 . 4.30 1718 1110 A 135 ASN H A 134 ILE HG2% 1.0 . 4.18 1719 1111 A 135 ASN H A 135 ASN HD2y 1.0 . 4.47 1720 1112 A 135 ASN H A 135 ASN HBx 1.0 . 3.33 1721 1112 A 135 ASN H A 135 ASN HBy 1.0 . 3.33 1722 1113 A 135 ASN H A 136 THR H 1.0 . 3.61 1723 1114 A 135 ASN H A 136 THR H 1.0 . 3.61 1724 1115 A 135 ASN HA A 135 ASN HD2y 1.0 . 4.23 1725 1116 A 135 ASN HD2x A 136 THR HG2% 1.0 . 4.32 1726 1117 A 135 ASN HD2y A 135 ASN HBx 1.0 . 3.50 1727 1117 A 135 ASN HD2y A 135 ASN HBy 1.0 . 3.50 1728 1118 A 135 ASN HD2x A 135 ASN HBx 1.0 . 4.09 1729 1118 A 135 ASN HBy A 135 ASN HD2x 1.0 . 4.09 1730 1119 A 136 THR H A 135 ASN HBx 1.0 . 3.51 1731 1119 A 136 THR H A 135 ASN HBy 1.0 . 3.51 1732 1120 A 136 THR HA A 135 ASN HBx 1.0 . 4.84 1733 1120 A 135 ASN HBy A 136 THR HA 1.0 . 4.84 1734 1121 A 136 THR H A 136 THR HB 1.0 . 4.06 1735 1122 A 136 THR H A 136 THR HG2% 1.0 . 3.40 1736 1123 A 136 THR HA A 139 ARG HDx 1.0 . 4.64 1737 1123 A 139 ARG HDy A 136 THR HA 1.0 . 4.64 1738 1124 A 136 THR HB A 139 ARG HDx 1.0 . 5.25 1739 1124 A 136 THR HB A 139 ARG HDy 1.0 . 5.25 1740 1125 A 136 THR HG2% A 139 ARG HBx 1.0 . 3.68 1741 1125 A 136 THR HG2% A 139 ARG HBy 1.0 . 3.68 1742 1126 A 136 THR HG2% A 139 ARG HDx 1.0 . 3.36 1743 1126 A 139 ARG HDy A 136 THR HG2% 1.0 . 3.36 1744 1127 A 137 HIS H A 137 HIS HBy 1.0 . 3.87 1745 1128 A 137 HIS H A 137 HIS HBx 1.0 . 3.87 1746 1129 A 137 HIS H A 137 HIS HBx 1.0 . 3.20 1747 1129 A 137 HIS H A 137 HIS HBy 1.0 . 3.20 1748 1130 A 137 HIS H A 137 HIS HBy 1.0 . 3.57 1749 1131 A 138 HIS H A 138 HIS HBy 1.0 . 3.77 1750 1132 A 138 HIS H A 138 HIS HBx 1.0 . 3.77 1751 1133 A 138 HIS H A 138 HIS HD2 1.0 . 5.08 1752 1134 A 138 HIS H A 138 HIS HBx 1.0 . 3.03 1753 1134 A 138 HIS H A 138 HIS HBy 1.0 . 3.03 1754 1135 A 138 HIS H A 139 ARG H 1.0 . 3.53 1755 1136 A 138 HIS H A 139 ARG H 1.0 . 4.18 1756 1137 A 139 ARG H A 138 HIS HA 1.0 . 3.57 1757 1138 A 138 HIS HBy A 138 HIS HA 1.0 . 3.80 1758 1139 A 139 ARG H A 138 HIS HBx 1.0 . 4.19 1759 1139 A 139 ARG H A 138 HIS HBy 1.0 . 4.19 1760 1140 A 139 ARG H A 138 HIS HBx 1.0 . 4.13 1761 1141 A 139 ARG H A 139 ARG HBx 1.0 . 3.00 1762 1141 A 139 ARG H A 139 ARG HBy 1.0 . 3.00 1763 1142 A 139 ARG H A 139 ARG HDx 1.0 . 5.50 1764 1142 A 139 ARG H A 139 ARG HDy 1.0 . 5.50 1765 1143 A 139 ARG H A 139 ARG HGx 1.0 . 4.22 1766 1143 A 139 ARG H A 139 ARG HGy 1.0 . 4.22 1767 1144 A 139 ARG H A 140 SER H 1.0 . 3.25 1768 1145 A 139 ARG H A 140 SER H 1.0 . 3.68 1769 1146 A 139 ARG HBx A 139 ARG HDx 1.0 . 3.91 1770 1146 A 139 ARG HDy A 139 ARG HBx 1.0 . 3.91 1771 1146 A 139 ARG HDy A 139 ARG HBy 1.0 . 3.91 1772 1146 A 139 ARG HBy A 139 ARG HDx 1.0 . 3.91 1773 1147 A 140 SER H A 139 ARG HBx 1.0 . 3.16 1774 1147 A 139 ARG HBy A 140 SER H 1.0 . 3.16 1775 1148 A 140 SER H A 139 ARG HDx 1.0 . 4.08 1776 1148 A 139 ARG HDy A 140 SER H 1.0 . 4.08 1777 1149 A 140 SER H A 140 SER HBx 1.0 . 2.99 1778 1149 A 140 SER H A 140 SER HBy 1.0 . 2.99 1779 1150 A 140 SER H A 140 SER HBx 1.0 . 3.59 1780 1150 A 140 SER H A 140 SER HBy 1.0 . 3.59 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type upper-bound-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 13 ASP H A 9 ALA O 1.0 . 1.79 2 2 A 9 ALA O A 13 ASP N 1.0 . 2.68 3 3 A 33 ALA H A 29 GLU O 1.0 . 1.79 4 4 A 29 GLU O A 33 ALA N 1.0 . 2.68 5 5 A 34 GLY H A 30 SER O 1.0 . 1.79 6 6 A 30 SER O A 34 GLY N 1.0 . 2.68 7 7 A 40 SER H A 36 LEU O 1.0 . 1.79 8 8 A 36 LEU O A 40 SER N 1.0 . 2.68 9 9 A 41 GLN H A 37 ILE O 1.0 . 1.79 10 10 A 37 ILE O A 41 GLN N 1.0 . 2.68 11 11 A 42 GLU H A 38 GLU O 1.0 . 1.79 12 12 A 38 GLU O A 42 GLU N 1.0 . 2.68 13 13 A 64 SER H A 60 CYS O 1.0 . 1.79 14 14 A 60 CYS O A 64 SER N 1.0 . 2.68 15 15 A 66 LEU H A 62 LYS O 1.0 . 1.79 16 16 A 62 LYS O A 66 LEU N 1.0 . 2.68 17 17 A 70 VAL H A 66 LEU O 1.0 . 1.79 18 18 A 66 LEU O A 70 VAL N 1.0 . 2.68 19 19 A 90 SER H A 86 SER O 1.0 . 1.79 20 20 A 86 SER O A 90 SER N 1.0 . 2.68 21 21 A 92 THR H A 88 LEU O 1.0 . 1.79 22 22 A 88 LEU O A 92 THR N 1.0 . 2.68 23 23 A 98 ILE H A 94 LYS O 1.0 . 1.79 24 24 A 94 LYS O A 98 ILE N 1.0 . 2.68 25 25 A 56 VAL H A 52 PHE O 1.0 . 1.79 26 26 A 52 PHE O A 56 VAL N 1.0 . 2.68 27 27 A 68 GLY H A 64 SER O 1.0 . 1.79 28 28 A 64 SER O A 68 GLY N 1.0 . 2.68 29 29 A 69 LEU H A 65 GLU O 1.0 . 1.79 30 30 A 65 GLU O A 69 LEU N 1.0 . 2.68 31 31 A 72 TYR H A 68 GLY O 1.0 . 1.79 32 32 A 68 GLY O A 72 TYR N 1.0 . 2.68 33 33 A 86 SER H A 82 THR O 1.0 . 1.79 34 34 A 82 THR O A 86 SER N 1.0 . 2.68 35 35 A 93 GLU H A 89 LYS O 1.0 . 1.79 36 36 A 89 LYS O A 93 GLU N 1.0 . 2.68 37 37 A 97 LYS H A 93 GLU O 1.0 . 1.79 38 38 A 93 GLU O A 97 LYS N 1.0 . 2.68 39 39 A 100 GLU H A 96 LYS O 1.0 . 1.79 40 40 A 96 LYS O A 100 GLU N 1.0 . 2.68 41 41 A 101 LEU H A 97 LYS O 1.0 . 1.79 42 42 A 97 LYS O A 101 LEU N 1.0 . 2.68 43 43 A 118 PHE H A 114 LYS O 1.0 . 1.79 44 44 A 114 LYS O A 118 PHE N 1.0 . 2.68 45 45 A 111 LEU H A 107 SER O 1.0 . 1.79 46 46 A 107 SER O A 111 LEU N 1.0 . 2.68 47 47 A 113 GLY H A 109 VAL O 1.0 . 1.79 48 48 A 109 VAL O A 113 GLY N 1.0 . 2.68 49 49 A 115 TYR H A 111 LEU O 1.0 . 1.79 50 50 A 111 LEU O A 115 TYR N 1.0 . 2.68 51 51 A 119 THR H A 115 TYR O 1.0 . 1.79 52 52 A 115 TYR O A 119 THR N 1.0 . 2.68 53 53 A 122 PHE H A 118 PHE O 1.0 . 1.79 54 54 A 118 PHE O A 122 PHE N 1.0 . 2.68 55 55 A 124 GLU H A 120 LYS O 1.0 . 1.79 56 56 A 120 LYS O A 124 GLU N 1.0 . 2.68 57 57 A 131 GLU H A 127 ILE O 1.0 . 1.79 58 58 A 127 ILE O A 131 GLU N 1.0 . 2.68 59 59 A 136 THR H A 132 GLU O 1.0 . 1.79 60 60 A 132 GLU O A 136 THR N 1.0 . 2.68 61 61 A 137 HIS H A 133 VAL O 1.0 . 1.79 62 62 A 133 VAL O A 137 HIS N 1.0 . 2.68 63 63 A 138 HIS H A 134 ILE O 1.0 . 1.79 64 64 A 134 ILE O A 138 HIS N 1.0 . 2.68 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 9 ALA C A 10 MET N A 10 MET CA A 10 MET C 1.0 -83.00 -43.00 PHI 2 2 A 10 MET N A 10 MET CA A 10 MET C A 11 VAL N 1.0 -60.00 -20.00 PSI 3 3 A 10 MET C A 11 VAL N A 11 VAL CA A 11 VAL C 1.0 -89.00 -49.00 PHI 4 4 A 11 VAL N A 11 VAL CA A 11 VAL C A 12 ILE N 1.0 -58.00 -18.00 PSI 5 5 A 11 VAL C A 12 ILE N A 12 ILE CA A 12 ILE C 1.0 -83.00 -43.00 PHI 6 6 A 12 ILE N A 12 ILE CA A 12 ILE C A 13 ASP N 1.0 -61.00 -21.00 PSI 7 7 A 12 ILE C A 13 ASP N A 13 ASP CA A 13 ASP C 1.0 -86.00 -46.00 PHI 8 8 A 13 ASP N A 13 ASP CA A 13 ASP C A 14 HIS N 1.0 -58.00 -18.00 PSI 9 9 A 13 ASP C A 14 HIS N A 14 HIS CA A 14 HIS C 1.0 -84.00 -44.00 PHI 10 10 A 14 HIS N A 14 HIS CA A 14 HIS C A 15 ILE N 1.0 -60.00 -20.00 PSI 11 11 A 14 HIS C A 15 ILE N A 15 ILE CA A 15 ILE C 1.0 -87.00 -47.00 PHI 12 12 A 15 ILE N A 15 ILE CA A 15 ILE C A 16 LEU N 1.0 -65.00 -25.00 PSI 13 13 A 15 ILE C A 16 LEU N A 16 LEU CA A 16 LEU C 1.0 -82.00 -42.00 PHI 14 14 A 16 LEU N A 16 LEU CA A 16 LEU C A 17 LYS N 1.0 -63.00 -23.00 PSI 15 15 A 16 LEU C A 17 LYS N A 17 LYS CA A 17 LYS C 1.0 -85.00 -45.00 PHI 16 16 A 17 LYS N A 17 LYS CA A 17 LYS C A 18 CYS N 1.0 -59.00 -19.00 PSI 17 17 A 17 LYS C A 18 CYS N A 18 CYS CA A 18 CYS C 1.0 -84.00 -44.00 PHI 18 18 A 18 CYS N A 18 CYS CA A 18 CYS C A 19 VAL N 1.0 -59.00 -19.00 PSI 19 19 A 18 CYS C A 19 VAL N A 19 VAL CA A 19 VAL C 1.0 -88.00 -48.00 PHI 20 20 A 19 VAL N A 19 VAL CA A 19 VAL C A 20 PHE N 1.0 -64.00 -24.00 PSI 21 21 A 19 VAL C A 20 PHE N A 20 PHE CA A 20 PHE C 1.0 -80.00 -40.00 PHI 22 22 A 20 PHE N A 20 PHE CA A 20 PHE C A 21 ASP N 1.0 -59.00 -19.00 PSI 23 23 A 20 PHE C A 21 ASP N A 21 ASP CA A 21 ASP C 1.0 -85.00 -45.00 PHI 24 24 A 21 ASP N A 21 ASP CA A 21 ASP C A 22 LYS N 1.0 -58.00 -18.00 PSI 25 25 A 21 ASP C A 22 LYS N A 22 LYS CA A 22 LYS C 1.0 -85.00 -45.00 PHI 26 26 A 22 LYS N A 22 LYS CA A 22 LYS C A 23 ILE N 1.0 -60.00 -20.00 PSI 27 27 A 22 LYS C A 23 ILE N A 23 ILE CA A 23 ILE C 1.0 -83.00 -43.00 PHI 28 28 A 23 ILE N A 23 ILE CA A 23 ILE C A 24 CYS N 1.0 -62.00 -22.00 PSI 29 29 A 23 ILE C A 24 CYS N A 24 CYS CA A 24 CYS C 1.0 -81.00 -41.00 PHI 30 30 A 24 CYS N A 24 CYS CA A 24 CYS C A 25 LYS N 1.0 -61.00 -21.00 PSI 31 31 A 24 CYS C A 25 LYS N A 25 LYS CA A 25 LYS C 1.0 -85.00 -45.00 PHI 32 32 A 25 LYS N A 25 LYS CA A 25 LYS C A 26 ILE N 1.0 -59.00 -19.00 PSI 33 33 A 25 LYS C A 26 ILE N A 26 ILE CA A 26 ILE C 1.0 -86.00 -46.00 PHI 34 34 A 26 ILE N A 26 ILE CA A 26 ILE C A 27 GLY N 1.0 -60.00 -20.00 PSI 35 35 A 26 ILE C A 27 GLY N A 27 GLY CA A 27 GLY C 1.0 -84.00 -44.00 PHI 36 36 A 27 GLY N A 27 GLY CA A 27 GLY C A 28 THR N 1.0 -56.00 -16.00 PSI 37 37 A 27 GLY C A 28 THR N A 28 THR CA A 28 THR C 1.0 -92.00 -52.00 PHI 38 38 A 28 THR N A 28 THR CA A 28 THR C A 29 GLU N 1.0 -61.00 -21.00 PSI 39 39 A 28 THR C A 29 GLU N A 29 GLU CA A 29 GLU C 1.0 -84.00 -44.00 PHI 40 40 A 29 GLU N A 29 GLU CA A 29 GLU C A 30 SER N 1.0 -58.00 -18.00 PSI 41 41 A 29 GLU C A 30 SER N A 30 SER CA A 30 SER C 1.0 -82.00 -42.00 PHI 42 42 A 30 SER N A 30 SER CA A 30 SER C A 31 VAL N 1.0 -58.00 -18.00 PSI 43 43 A 30 SER C A 31 VAL N A 31 VAL CA A 31 VAL C 1.0 -89.00 -49.00 PHI 44 44 A 31 VAL N A 31 VAL CA A 31 VAL C A 32 GLU N 1.0 -61.00 -21.00 PSI 45 45 A 31 VAL C A 32 GLU N A 32 GLU CA A 32 GLU C 1.0 -85.00 -45.00 PHI 46 46 A 32 GLU N A 32 GLU CA A 32 GLU C A 33 ALA N 1.0 -59.00 -19.00 PSI 47 47 A 32 GLU C A 33 ALA N A 33 ALA CA A 33 ALA C 1.0 -83.00 -43.00 PHI 48 48 A 33 ALA N A 33 ALA CA A 33 ALA C A 34 GLY N 1.0 -57.00 -17.00 PSI 49 49 A 33 ALA C A 34 GLY N A 34 GLY CA A 34 GLY C 1.0 -85.00 -45.00 PHI 50 50 A 34 GLY N A 34 GLY CA A 34 GLY C A 35 ARG N 1.0 -58.00 -18.00 PSI 51 51 A 34 GLY C A 35 ARG N A 35 ARG CA A 35 ARG C 1.0 -87.00 -47.00 PHI 52 52 A 35 ARG N A 35 ARG CA A 35 ARG C A 36 LEU N 1.0 -55.00 -15.00 PSI 53 53 A 35 ARG C A 36 LEU N A 36 LEU CA A 36 LEU C 1.0 -84.00 -44.00 PHI 54 54 A 36 LEU N A 36 LEU CA A 36 LEU C A 37 ILE N 1.0 -58.00 -18.00 PSI 55 55 A 36 LEU C A 37 ILE N A 37 ILE CA A 37 ILE C 1.0 -90.00 -50.00 PHI 56 56 A 37 ILE N A 37 ILE CA A 37 ILE C A 38 GLU N 1.0 -53.00 -13.00 PSI 57 57 A 37 ILE C A 38 GLU N A 38 GLU CA A 38 GLU C 1.0 -86.00 -46.00 PHI 58 58 A 38 GLU N A 38 GLU CA A 38 GLU C A 39 LEU N 1.0 -59.00 -19.00 PSI 59 59 A 38 GLU C A 39 LEU N A 39 LEU CA A 39 LEU C 1.0 -82.00 -42.00 PHI 60 60 A 39 LEU N A 39 LEU CA A 39 LEU C A 40 SER N 1.0 -57.00 -17.00 PSI 61 61 A 49 PRO N A 49 PRO CA A 49 PRO C A 50 LEU N 1.0 -51.00 -11.00 PSI 62 62 A 49 PRO C A 50 LEU N A 50 LEU CA A 50 LEU C 1.0 -83.00 -43.00 PHI 63 63 A 50 LEU N A 50 LEU CA A 50 LEU C A 51 TYR N 1.0 -62.00 -22.00 PSI 64 64 A 50 LEU C A 51 TYR N A 51 TYR CA A 51 TYR C 1.0 -84.00 -44.00 PHI 65 65 A 51 TYR N A 51 TYR CA A 51 TYR C A 52 PHE N 1.0 -63.00 -23.00 PSI 66 66 A 51 TYR C A 52 PHE N A 52 PHE CA A 52 PHE C 1.0 -87.00 -47.00 PHI 67 67 A 52 PHE N A 52 PHE CA A 52 PHE C A 53 VAL N 1.0 -62.00 -22.00 PSI 68 68 A 52 PHE C A 53 VAL N A 53 VAL CA A 53 VAL C 1.0 -88.00 -48.00 PHI 69 69 A 53 VAL N A 53 VAL CA A 53 VAL C A 54 VAL N 1.0 -65.00 -25.00 PSI 70 70 A 53 VAL C A 54 VAL N A 54 VAL CA A 54 VAL C 1.0 -87.00 -47.00 PHI 71 71 A 54 VAL N A 54 VAL CA A 54 VAL C A 55 ASN N 1.0 -61.00 -21.00 PSI 72 72 A 54 VAL C A 55 ASN N A 55 ASN CA A 55 ASN C 1.0 -89.00 -49.00 PHI 73 73 A 55 ASN N A 55 ASN CA A 55 ASN C A 56 VAL N 1.0 -65.00 -25.00 PSI 74 74 A 55 ASN C A 56 VAL N A 56 VAL CA A 56 VAL C 1.0 -99.00 -59.00 PHI 75 75 A 56 VAL N A 56 VAL CA A 56 VAL C A 57 ILE N 1.0 -48.00 -8.00 PSI 76 76 A 56 VAL C A 57 ILE N A 57 ILE CA A 57 ILE C 1.0 -91.00 -51.00 PHI 77 77 A 57 ILE N A 57 ILE CA A 57 ILE C A 58 GLU N 1.0 -56.00 -16.00 PSI 78 78 A 57 ILE C A 58 GLU N A 58 GLU CA A 58 GLU C 1.0 -81.00 -41.00 PHI 79 79 A 58 GLU N A 58 GLU CA A 58 GLU C A 59 PRO N 1.0 -61.00 -21.00 PSI 80 80 A 59 PRO N A 59 PRO CA A 59 PRO C A 60 CYS N 1.0 -53.00 -13.00 PSI 81 81 A 59 PRO C A 60 CYS N A 60 CYS CA A 60 CYS C 1.0 -85.00 -45.00 PHI 82 82 A 60 CYS N A 60 CYS CA A 60 CYS C A 61 LYS N 1.0 -57.00 -17.00 PSI 83 83 A 60 CYS C A 61 LYS N A 61 LYS CA A 61 LYS C 1.0 -84.00 -44.00 PHI 84 84 A 61 LYS N A 61 LYS CA A 61 LYS C A 62 LYS N 1.0 -62.00 -22.00 PSI 85 85 A 61 LYS C A 62 LYS N A 62 LYS CA A 62 LYS C 1.0 -88.00 -48.00 PHI 86 86 A 62 LYS N A 62 LYS CA A 62 LYS C A 63 PHE N 1.0 -52.00 -12.00 PSI 87 87 A 62 LYS C A 63 PHE N A 63 PHE CA A 63 PHE C 1.0 -85.00 -45.00 PHI 88 88 A 63 PHE N A 63 PHE CA A 63 PHE C A 64 SER N 1.0 -65.00 -25.00 PSI 89 89 A 63 PHE C A 64 SER N A 64 SER CA A 64 SER C 1.0 -83.00 -43.00 PHI 90 90 A 64 SER N A 64 SER CA A 64 SER C A 65 GLU N 1.0 -63.00 -23.00 PSI 91 91 A 64 SER C A 65 GLU N A 65 GLU CA A 65 GLU C 1.0 -87.00 -47.00 PHI 92 92 A 65 GLU N A 65 GLU CA A 65 GLU C A 66 LEU N 1.0 -61.00 -21.00 PSI 93 93 A 65 GLU C A 66 LEU N A 66 LEU CA A 66 LEU C 1.0 -86.00 -46.00 PHI 94 94 A 66 LEU N A 66 LEU CA A 66 LEU C A 67 THR N 1.0 -57.00 -17.00 PSI 95 95 A 66 LEU C A 67 THR N A 67 THR CA A 67 THR C 1.0 -103.00 -63.00 PHI 96 96 A 67 THR N A 67 THR CA A 67 THR C A 68 GLY N 1.0 -45.00 7.00 PSI 97 97 A 68 GLY C A 69 LEU N A 69 LEU CA A 69 LEU C 1.0 -91.00 -51.00 PHI 98 98 A 69 LEU N A 69 LEU CA A 69 LEU C A 70 VAL N 1.0 -48.00 -8.00 PSI 99 99 A 69 LEU C A 70 VAL N A 70 VAL CA A 70 VAL C 1.0 -95.00 -55.00 PHI 100 100 A 70 VAL N A 70 VAL CA A 70 VAL C A 71 PHE N 1.0 -47.00 -7.00 PSI 101 101 A 70 VAL C A 71 PHE N A 71 PHE CA A 71 PHE C 1.0 -107.00 -67.00 PHI 102 102 A 71 PHE N A 71 PHE CA A 71 PHE C A 72 TYR N 1.0 -39.00 1.00 PSI 103 103 A 79 GLU C A 80 LYS N A 80 LYS CA A 80 LYS C 1.0 -81.00 -41.00 PHI 104 104 A 80 LYS N A 80 LYS CA A 80 LYS C A 81 MET N 1.0 -60.00 -20.00 PSI 105 105 A 80 LYS C A 81 MET N A 81 MET CA A 81 MET C 1.0 -85.00 -45.00 PHI 106 106 A 81 MET N A 81 MET CA A 81 MET C A 82 THR N 1.0 -61.00 -21.00 PSI 107 107 A 81 MET C A 82 THR N A 82 THR CA A 82 THR C 1.0 -81.00 -41.00 PHI 108 108 A 82 THR N A 82 THR CA A 82 THR C A 83 GLU N 1.0 -61.00 -21.00 PSI 109 109 A 82 THR C A 83 GLU N A 83 GLU CA A 83 GLU C 1.0 -88.00 -48.00 PHI 110 110 A 83 GLU N A 83 GLU CA A 83 GLU C A 84 SER N 1.0 -60.00 -20.00 PSI 111 111 A 83 GLU C A 84 SER N A 84 SER CA A 84 SER C 1.0 -85.00 -45.00 PHI 112 112 A 84 SER N A 84 SER CA A 84 SER C A 85 LYS N 1.0 -61.00 -21.00 PSI 113 113 A 84 SER C A 85 LYS N A 85 LYS CA A 85 LYS C 1.0 -85.00 -45.00 PHI 114 114 A 85 LYS N A 85 LYS CA A 85 LYS C A 86 SER N 1.0 -60.00 -20.00 PSI 115 115 A 85 LYS C A 86 SER N A 86 SER CA A 86 SER C 1.0 -87.00 -47.00 PHI 116 116 A 86 SER N A 86 SER CA A 86 SER C A 87 VAL N 1.0 -58.00 -18.00 PSI 117 117 A 86 SER C A 87 VAL N A 87 VAL CA A 87 VAL C 1.0 -87.00 -47.00 PHI 118 118 A 87 VAL N A 87 VAL CA A 87 VAL C A 88 LEU N 1.0 -63.00 -23.00 PSI 119 119 A 87 VAL C A 88 LEU N A 88 LEU CA A 88 LEU C 1.0 -86.00 -46.00 PHI 120 120 A 88 LEU N A 88 LEU CA A 88 LEU C A 89 LYS N 1.0 -59.00 -19.00 PSI 121 121 A 88 LEU C A 89 LYS N A 89 LYS CA A 89 LYS C 1.0 -84.00 -44.00 PHI 122 122 A 89 LYS N A 89 LYS CA A 89 LYS C A 90 SER N 1.0 -60.00 -20.00 PSI 123 123 A 89 LYS C A 90 SER N A 90 SER CA A 90 SER C 1.0 -87.00 -47.00 PHI 124 124 A 90 SER N A 90 SER CA A 90 SER C A 91 LEU N 1.0 -60.00 -20.00 PSI 125 125 A 90 SER C A 91 LEU N A 91 LEU CA A 91 LEU C 1.0 -84.00 -44.00 PHI 126 126 A 91 LEU N A 91 LEU CA A 91 LEU C A 92 THR N 1.0 -61.00 -21.00 PSI 127 127 A 91 LEU C A 92 THR N A 92 THR CA A 92 THR C 1.0 -84.00 -44.00 PHI 128 128 A 92 THR N A 92 THR CA A 92 THR C A 93 GLU N 1.0 -62.00 -22.00 PSI 129 129 A 92 THR C A 93 GLU N A 93 GLU CA A 93 GLU C 1.0 -81.00 -41.00 PHI 130 130 A 93 GLU N A 93 GLU CA A 93 GLU C A 94 LYS N 1.0 -61.00 -21.00 PSI 131 131 A 93 GLU C A 94 LYS N A 94 LYS CA A 94 LYS C 1.0 -83.57 -43.57 PHI 132 132 A 94 LYS N A 94 LYS CA A 94 LYS C A 95 LEU N 1.0 -63.08 -23.08 PSI 133 133 A 94 LYS C A 95 LEU N A 95 LEU CA A 95 LEU C 1.0 -83.00 -43.00 PHI 134 134 A 95 LEU N A 95 LEU CA A 95 LEU C A 96 LYS N 1.0 -63.00 -23.00 PSI 135 135 A 95 LEU C A 96 LYS N A 96 LYS CA A 96 LYS C 1.0 -83.00 -43.00 PHI 136 136 A 96 LYS N A 96 LYS CA A 96 LYS C A 97 LYS N 1.0 -63.00 -23.00 PSI 137 137 A 96 LYS C A 97 LYS N A 97 LYS CA A 97 LYS C 1.0 -84.00 -44.00 PHI 138 138 A 97 LYS N A 97 LYS CA A 97 LYS C A 98 ILE N 1.0 -53.00 -13.00 PSI 139 139 A 97 LYS C A 98 ILE N A 98 ILE CA A 98 ILE C 1.0 -89.00 -49.00 PHI 140 140 A 98 ILE N A 98 ILE CA A 98 ILE C A 99 VAL N 1.0 -59.00 -19.00 PSI 141 141 A 98 ILE C A 99 VAL N A 99 VAL CA A 99 VAL C 1.0 -86.00 -46.00 PHI 142 142 A 99 VAL N A 99 VAL CA A 99 VAL C A 100 GLU N 1.0 -56.00 -16.00 PSI 143 143 A 99 VAL C A 100 GLU N A 100 GLU CA A 100 GLU C 1.0 -88.00 -48.00 PHI 144 144 A 100 GLU N A 100 GLU CA A 100 GLU C A 101 LEU N 1.0 -54.00 -14.00 PSI 145 145 A 100 GLU C A 101 LEU N A 101 LEU CA A 101 LEU C 1.0 -103.00 -63.00 PHI 146 146 A 101 LEU N A 101 LEU CA A 101 LEU C A 102 ILE N 1.0 -53.00 -9.00 PSI 147 147 A 103 PRO C A 104 SER N A 104 SER CA A 104 SER C 1.0 -110.00 -70.00 PHI 148 148 A 104 SER N A 104 SER CA A 104 SER C A 105 THR N 1.0 -35.00 5.00 PSI 149 149 A 104 SER C A 105 THR N A 105 THR CA A 105 THR C 1.0 -90.00 -50.00 PHI 150 150 A 105 THR N A 105 THR CA A 105 THR C A 106 SER N 1.0 -57.00 -17.00 PSI 151 151 A 105 THR C A 106 SER N A 106 SER CA A 106 SER C 1.0 -83.00 -43.00 PHI 152 152 A 106 SER N A 106 SER CA A 106 SER C A 107 SER N 1.0 -56.00 -16.00 PSI 153 153 A 106 SER C A 107 SER N A 107 SER CA A 107 SER C 1.0 -87.00 -47.00 PHI 154 154 A 107 SER N A 107 SER CA A 107 SER C A 108 ALA N 1.0 -57.00 -17.00 PSI 155 155 A 107 SER C A 108 ALA N A 108 ALA CA A 108 ALA C 1.0 -85.00 -45.00 PHI 156 156 A 108 ALA N A 108 ALA CA A 108 ALA C A 109 VAL N 1.0 -57.00 -17.00 PSI 157 157 A 108 ALA C A 109 VAL N A 109 VAL CA A 109 VAL C 1.0 -84.00 -44.00 PHI 158 158 A 109 VAL N A 109 VAL CA A 109 VAL C A 110 PRO N 1.0 -61.00 -21.00 PSI 159 159 A 110 PRO N A 110 PRO CA A 110 PRO C A 111 LEU N 1.0 -53.00 -13.00 PSI 160 160 A 110 PRO C A 111 LEU N A 111 LEU CA A 111 LEU C 1.0 -84.00 -44.00 PHI 161 161 A 111 LEU N A 111 LEU CA A 111 LEU C A 112 ILE N 1.0 -61.00 -21.00 PSI 162 162 A 111 LEU C A 112 ILE N A 112 ILE CA A 112 ILE C 1.0 -89.00 -49.00 PHI 163 163 A 112 ILE N A 112 ILE CA A 112 ILE C A 113 GLY N 1.0 -63.00 -23.00 PSI 164 164 A 112 ILE C A 113 GLY N A 113 GLY CA A 113 GLY C 1.0 -85.00 -45.00 PHI 165 165 A 113 GLY N A 113 GLY CA A 113 GLY C A 114 LYS N 1.0 -60.00 -20.00 PSI 166 166 A 113 GLY C A 114 LYS N A 114 LYS CA A 114 LYS C 1.0 -86.78 -46.78 PHI 167 167 A 114 LYS N A 114 LYS CA A 114 LYS C A 115 TYR N 1.0 -57.95 -17.95 PSI 168 168 A 114 LYS C A 115 TYR N A 115 TYR CA A 115 TYR C 1.0 -85.00 -45.00 PHI 169 169 A 115 TYR N A 115 TYR CA A 115 TYR C A 116 MET N 1.0 -59.00 -19.00 PSI 170 170 A 115 TYR C A 116 MET N A 116 MET CA A 116 MET C 1.0 -81.00 -41.00 PHI 171 171 A 116 MET N A 116 MET CA A 116 MET C A 117 LEU N 1.0 -65.00 -25.00 PSI 172 172 A 116 MET C A 117 LEU N A 117 LEU CA A 117 LEU C 1.0 -81.00 -41.00 PHI 173 173 A 117 LEU N A 117 LEU CA A 117 LEU C A 118 PHE N 1.0 -65.00 -25.00 PSI 174 174 A 117 LEU C A 118 PHE N A 118 PHE CA A 118 PHE C 1.0 -85.00 -45.00 PHI 175 175 A 118 PHE N A 118 PHE CA A 118 PHE C A 119 THR N 1.0 -62.00 -22.00 PSI 176 176 A 118 PHE C A 119 THR N A 119 THR CA A 119 THR C 1.0 -87.00 -47.00 PHI 177 177 A 119 THR N A 119 THR CA A 119 THR C A 120 LYS N 1.0 -64.00 -24.00 PSI 178 178 A 119 THR C A 120 LYS N A 120 LYS CA A 120 LYS C 1.0 -82.00 -42.00 PHI 179 179 A 120 LYS N A 120 LYS CA A 120 LYS C A 121 GLU N 1.0 -61.00 -21.00 PSI 180 180 A 120 LYS C A 121 GLU N A 121 GLU CA A 121 GLU C 1.0 -86.00 -46.00 PHI 181 181 A 121 GLU N A 121 GLU CA A 121 GLU C A 122 PHE N 1.0 -57.00 -17.00 PSI 182 182 A 121 GLU C A 122 PHE N A 122 PHE CA A 122 PHE C 1.0 -86.00 -46.00 PHI 183 183 A 122 PHE N A 122 PHE CA A 122 PHE C A 123 VAL N 1.0 -61.00 -21.00 PSI 184 184 A 122 PHE C A 123 VAL N A 123 VAL CA A 123 VAL C 1.0 -85.00 -45.00 PHI 185 185 A 123 VAL N A 123 VAL CA A 123 VAL C A 124 GLU N 1.0 -63.00 -23.00 PSI 186 186 A 123 VAL C A 124 GLU N A 124 GLU CA A 124 GLU C 1.0 -81.00 -41.00 PHI 187 187 A 124 GLU N A 124 GLU CA A 124 GLU C A 125 SER N 1.0 -60.00 -20.00 PSI 188 188 A 124 GLU C A 125 SER N A 125 SER CA A 125 SER C 1.0 -85.00 -45.00 PHI 189 189 A 125 SER N A 125 SER CA A 125 SER C A 126 SER N 1.0 -60.00 -20.00 PSI 190 190 A 125 SER C A 126 SER N A 126 SER CA A 126 SER C 1.0 -85.50 -45.50 PHI 191 191 A 126 SER N A 126 SER CA A 126 SER C A 127 ILE N 1.0 -56.50 -16.50 PSI 192 192 A 126 SER C A 127 ILE N A 127 ILE CA A 127 ILE C 1.0 -84.00 -44.00 PHI 193 193 A 127 ILE N A 127 ILE CA A 127 ILE C A 128 LYS N 1.0 -64.00 -24.00 PSI 194 194 A 127 ILE C A 128 LYS N A 128 LYS CA A 128 LYS C 1.0 -86.00 -46.00 PHI 195 195 A 128 LYS N A 128 LYS CA A 128 LYS C A 129 ILE N 1.0 -58.00 -18.00 PSI 196 196 A 128 LYS C A 129 ILE N A 129 ILE CA A 129 ILE C 1.0 -85.00 -45.00 PHI 197 197 A 129 ILE N A 129 ILE CA A 129 ILE C A 130 THR N 1.0 -65.00 -25.00 PSI 198 198 A 129 ILE C A 130 THR N A 130 THR CA A 130 THR C 1.0 -84.00 -44.00 PHI 199 199 A 130 THR N A 130 THR CA A 130 THR C A 131 GLU N 1.0 -63.00 -23.00 PSI 200 200 A 130 THR C A 131 GLU N A 131 GLU CA A 131 GLU C 1.0 -84.00 -44.00 PHI 201 201 A 131 GLU N A 131 GLU CA A 131 GLU C A 132 GLU N 1.0 -59.00 -19.00 PSI 202 202 A 131 GLU C A 132 GLU N A 132 GLU CA A 132 GLU C 1.0 -84.00 -44.00 PHI 203 203 A 132 GLU N A 132 GLU CA A 132 GLU C A 133 VAL N 1.0 -60.00 -20.00 PSI 204 204 A 132 GLU C A 133 VAL N A 133 VAL CA A 133 VAL C 1.0 -88.00 -48.00 PHI 205 205 A 133 VAL N A 133 VAL CA A 133 VAL C A 134 ILE N 1.0 -59.00 -19.00 PSI 206 206 A 133 VAL C A 134 ILE N A 134 ILE CA A 134 ILE C 1.0 -85.00 -45.00 PHI 207 207 A 134 ILE N A 134 ILE CA A 134 ILE C A 135 ASN N 1.0 -63.00 -23.00 PSI 208 208 A 134 ILE C A 135 ASN N A 135 ASN CA A 135 ASN C 1.0 -88.00 -48.00 PHI 209 209 A 135 ASN N A 135 ASN CA A 135 ASN C A 136 THR N 1.0 -54.00 -14.00 PSI 210 210 A 135 ASN C A 136 THR N A 136 THR CA A 136 THR C 1.0 -96.00 -56.00 PHI 211 211 A 136 THR N A 136 THR CA A 136 THR C A 137 HIS N 1.0 -44.00 -4.00 PSI stop_ save_