data_nef_c15671_2k17 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 15670 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 2 21 CYS SG 3 2 ZN ZN 2 24 CYS SG 3 2 ZN ZN 2 36 CYS SG 3 1 ZN ZN 2 39 CYS SG 3 1 ZN ZN 2 44 HIS ND1 3 2 ZN ZN 2 47 CYS SG 3 2 ZN ZN 2 62 CYS SG 3 1 ZN ZN 2 65 CYS SG 3 1 ZN ZN 1 3 THR C 1 4 M3L N 1 4 M3L C 1 5 GLN N stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 P 1 ALA start . . 2 P 2 ARG middle . . 3 P 3 THR middle -OXT . 4 P 4 M3L middle -H2,-OXT . 5 P 5 GLN middle -H2 . 6 P 6 THR middle . . 7 P 7 ALA middle . . 8 P 8 ARG middle . . 9 P 9 LYS middle . . 10 P 10 SER middle . . 11 P 11 THR middle . . 12 P 12 GLY middle . false 13 P 13 GLY end . false 14 A 850 GLY start . false 15 A 851 SER middle . . 16 A 852 HIS middle . . 17 A 853 MET middle . . 18 A 854 ALA middle . . 19 A 855 MET middle . . 20 A 856 ALA middle . . 21 A 857 TYR middle . . 22 A 858 VAL middle . . 23 A 859 ILE middle . . 24 A 860 ARG middle . . 25 A 861 ASP middle . . 26 A 862 GLU middle . . 27 A 863 TRP middle . . 28 A 864 GLY middle . false 29 A 865 ASN middle . . 30 A 866 GLN middle . . 31 A 867 ILE middle . . 32 A 868 TRP middle . . 33 A 869 ILE middle . . 34 A 870 CYS middle -HG . 35 A 871 PRO middle . false 36 A 872 GLY middle . false 37 A 873 CYS middle -HG . 38 A 874 ASN middle . . 39 A 875 LYS middle . . 40 A 876 PRO middle . false 41 A 877 ASP middle . . 42 A 878 ASP middle . . 43 A 879 GLY middle . false 44 A 880 SER middle . . 45 A 881 PRO middle . false 46 A 882 MET middle . . 47 A 883 ILE middle . . 48 A 884 GLY middle . false 49 A 885 CYS middle -HG . 50 A 886 ASP middle . . 51 A 887 ASP middle . . 52 A 888 CYS middle -HG . 53 A 889 ASP middle . . 54 A 890 ASP middle . . 55 A 891 TRP middle . . 56 A 892 TYR middle . . 57 A 893 HIS middle -HD1 . 58 A 894 TRP middle . . 59 A 895 PRO middle . false 60 A 896 CYS middle -HG . 61 A 897 VAL middle . . 62 A 898 GLY middle . false 63 A 899 ILE middle . . 64 A 900 MET middle . . 65 A 901 ALA middle . . 66 A 902 ALA middle . . 67 A 903 PRO middle . false 68 A 904 PRO middle . false 69 A 905 GLU middle . . 70 A 906 GLU middle . . 71 A 907 MET middle . . 72 A 908 GLN middle . . 73 A 909 TRP middle . . 74 A 910 PHE middle . . 75 A 911 CYS middle -HG . 76 A 912 PRO middle . false 77 A 913 LYS middle . . 78 A 914 CYS middle -HG . 79 A 915 ALA middle . . 80 A 916 ASN middle . . 81 A 917 LYS middle . . 82 A 918 ILE middle . . 83 A 919 LYS middle . . 84 A 920 LYS middle . . 85 A 921 ASP middle . . 86 A 922 LYS middle . . 87 A 923 LYS middle . . 88 A 924 HIS end . . 89 B 1 ZN . . . 90 B 2 ZN . . . 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 P 1 ALA H1 H 1 10.497 0.007 P 1 ALA HA H 1 4.337 0.002 P 1 ALA HB% H 1 1.481 0.003 P 2 ARG H H 1 8.465 0.000 P 2 ARG HA H 1 4.724 0.001 P 2 ARG HBy H 1 1.794 0.001 P 2 ARG HBx H 1 1.764 0.006 P 2 ARG HDx H 1 3.332 0.002 P 2 ARG HDy H 1 3.332 0.002 P 2 ARG HE H 1 6.944 0.002 P 2 ARG HGx H 1 1.836 0.004 P 2 ARG HGy H 1 1.836 0.004 P 3 THR H H 1 8.441 0.004 P 3 THR HA H 1 5.763 0.005 P 3 THR HB H 1 4.701 0.002 P 3 THR HG2% H 1 1.239 0.003 P 4 M3L H H 1 8.482 0.004 P 4 M3L HA H 1 4.756 0.004 P 4 M3L HBy H 1 1.558 0.005 P 4 M3L HBx H 1 1.438 0.006 P 4 M3L HDx H 1 0.750 0.001 P 4 M3L HDy H 1 0.814 0.003 P 4 M3L HEy H 1 1.737 0.000 P 4 M3L HEx H 1 1.165 0.000 P 4 M3L HGy H 1 1.123 0.000 P 4 M3L HGx H 1 0.976 0.002 P 4 M3L HM1% H 1 1.338 0.004 P 4 M3L HM2% H 1 1.338 0.004 P 4 M3L HM3% H 1 1.338 0.004 P 5 GLN H H 1 8.271 0.003 P 5 GLN HA H 1 4.187 0.003 P 5 GLN HBy H 1 1.984 0.002 P 5 GLN HBx H 1 1.834 0.001 P 5 GLN HE2x H 1 6.924 0.002 P 5 GLN HE2y H 1 7.531 0.004 P 5 GLN HGx H 1 2.091 0.002 P 5 GLN HGy H 1 2.091 0.002 P 6 THR H H 1 9.051 0.003 P 6 THR HA H 1 4.198 0.005 P 6 THR HB H 1 4.128 0.010 P 6 THR HG2% H 1 1.179 0.003 P 7 ALA H H 1 8.480 0.006 P 7 ALA HA H 1 4.316 0.005 P 7 ALA HB% H 1 1.370 0.003 P 8 ARG H H 1 8.364 0.010 P 8 ARG HA H 1 4.314 0.004 P 8 ARG HBx H 1 1.745 0.004 P 8 ARG HBy H 1 1.837 0.002 P 8 ARG HDx H 1 3.190 0.007 P 8 ARG HDy H 1 3.190 0.007 P 8 ARG HE H 1 7.207 0.000 P 8 ARG HGx H 1 1.634 0.007 P 8 ARG HGy H 1 1.634 0.007 P 9 LYS H H 1 8.484 0.000 P 9 LYS HA H 1 4.352 0.000 P 9 LYS HBx H 1 1.739 0.003 P 9 LYS HBy H 1 1.845 0.005 P 9 LYS HDx H 1 1.689 0.009 P 9 LYS HDy H 1 1.689 0.009 P 9 LYS HEx H 1 2.988 0.002 P 9 LYS HEy H 1 2.988 0.002 P 9 LYS HGx H 1 1.447 0.000 P 9 LYS HGy H 1 1.447 0.000 P 10 SER H H 1 8.526 0.000 P 10 SER HA H 1 4.541 0.008 P 10 SER HBx H 1 3.877 0.003 P 10 SER HBy H 1 3.938 0.005 P 11 THR H H 1 8.323 0.000 P 11 THR HA H 1 4.410 0.000 P 11 THR HB H 1 4.324 0.000 P 11 THR HG2% H 1 1.232 0.001 P 12 GLY H H 1 8.489 0.001 P 12 GLY HAy H 1 4.035 0.000 P 12 GLY HAx H 1 4.000 0.000 P 13 GLY H H 1 8.369 0.000 P 13 GLY HAx H 1 3.939 0.000 P 13 GLY HAy H 1 3.939 0.000 A 850 GLY HAx H 1 3.902 0.002 A 850 GLY HAy H 1 3.902 0.002 A 850 GLY CA C 13 43.693 0.001 A 851 SER HA H 1 4.523 0.003 A 851 SER HBx H 1 3.865 0.006 A 851 SER HBy H 1 3.865 0.006 A 851 SER CA C 13 58.400 0.012 A 851 SER CB C 13 63.991 0.000 A 852 HIS HA H 1 4.690 0.003 A 852 HIS HBx H 1 3.142 0.004 A 852 HIS HBy H 1 3.209 0.004 A 852 HIS HD2 H 1 7.117 0.007 A 852 HIS HE1 H 1 8.060 0.005 A 852 HIS CA C 13 56.420 0.008 A 852 HIS CB C 13 30.354 0.098 A 852 HIS CD2 C 13 119.994 0.000 A 852 HIS CE1 C 13 138.066 0.000 A 853 MET H H 1 8.381 0.000 A 853 MET HA H 1 4.446 0.003 A 853 MET CA C 13 55.618 0.120 A 853 MET CB C 13 32.684 0.000 A 853 MET N N 15 122.067 0.009 A 854 ALA H H 1 8.389 0.006 A 854 ALA HA H 1 4.338 0.004 A 854 ALA HB% H 1 1.422 0.001 A 854 ALA CA C 13 52.657 0.006 A 854 ALA CB C 13 19.185 0.110 A 854 ALA N N 15 125.650 0.036 A 855 MET H H 1 8.325 0.005 A 855 MET HA H 1 4.433 0.006 A 855 MET HBy H 1 2.044 0.001 A 855 MET HBx H 1 1.966 0.004 A 855 MET HGx H 1 2.507 0.000 A 855 MET HGy H 1 2.507 0.000 A 855 MET CA C 13 55.336 0.078 A 855 MET CB C 13 32.906 0.136 A 855 MET N N 15 119.690 0.020 A 856 ALA H H 1 8.132 0.005 A 856 ALA HA H 1 4.285 0.006 A 856 ALA HB% H 1 1.326 0.001 A 856 ALA CA C 13 52.588 0.039 A 856 ALA CB C 13 19.739 0.139 A 856 ALA N N 15 124.523 0.030 A 857 TYR H H 1 8.503 0.005 A 857 TYR HA H 1 4.531 0.003 A 857 TYR HBx H 1 2.858 0.004 A 857 TYR HBy H 1 3.654 0.005 A 857 TYR HDx H 1 7.063 0.003 A 857 TYR HDy H 1 7.063 0.003 A 857 TYR HEx H 1 6.853 0.002 A 857 TYR HEy H 1 6.853 0.002 A 857 TYR CA C 13 58.131 0.080 A 857 TYR CB C 13 37.735 0.070 A 857 TYR CDx C 13 133.206 0.005 A 857 TYR CEx C 13 118.161 0.024 A 857 TYR N N 15 118.674 0.022 A 858 VAL H H 1 7.320 0.003 A 858 VAL HA H 1 4.361 0.005 A 858 VAL HB H 1 1.673 0.002 A 858 VAL HGx% H 1 0.492 0.001 A 858 VAL HGy% H 1 0.365 0.001 A 858 VAL CA C 13 61.519 0.115 A 858 VAL CB C 13 33.707 0.038 A 858 VAL CGx C 13 20.364 0.008 A 858 VAL CGy C 13 20.558 0.015 A 858 VAL N N 15 119.301 0.034 A 859 ILE H H 1 8.669 0.004 A 859 ILE HA H 1 4.366 0.005 A 859 ILE HB H 1 1.849 0.002 A 859 ILE HD1% H 1 0.805 0.002 A 859 ILE HG1y H 1 1.331 0.004 A 859 ILE HG1x H 1 1.037 0.006 A 859 ILE HG2% H 1 0.809 0.002 A 859 ILE CA C 13 60.094 0.078 A 859 ILE CB C 13 40.242 0.115 A 859 ILE CD1 C 13 13.278 0.004 A 859 ILE CG1 C 13 26.911 0.065 A 859 ILE CG2 C 13 17.757 0.031 A 859 ILE N N 15 124.599 0.031 A 860 ARG H H 1 8.199 0.005 A 860 ARG HA H 1 5.160 0.003 A 860 ARG HBx H 1 1.588 0.002 A 860 ARG HBy H 1 1.588 0.002 A 860 ARG HDx H 1 3.038 0.004 A 860 ARG HDy H 1 3.038 0.004 A 860 ARG HGy H 1 1.465 0.006 A 860 ARG HGx H 1 1.390 0.001 A 860 ARG CA C 13 54.230 0.084 A 860 ARG CB C 13 33.050 0.040 A 860 ARG CD C 13 43.329 0.011 A 860 ARG CG C 13 27.668 0.027 A 860 ARG N N 15 122.178 0.022 A 861 ASP H H 1 8.546 0.004 A 861 ASP HA H 1 4.613 0.002 A 861 ASP HBx H 1 2.724 0.005 A 861 ASP HBy H 1 3.304 0.002 A 861 ASP CA C 13 52.663 0.014 A 861 ASP CB C 13 41.515 0.050 A 861 ASP N N 15 122.441 0.037 A 862 GLU H H 1 8.918 0.004 A 862 GLU HA H 1 3.942 0.004 A 862 GLU HBy H 1 1.513 0.002 A 862 GLU HBx H 1 1.412 0.004 A 862 GLU HGx H 1 1.253 0.010 A 862 GLU HGy H 1 1.253 0.010 A 862 GLU CA C 13 58.121 0.043 A 862 GLU CB C 13 28.675 0.084 A 862 GLU CG C 13 34.895 0.022 A 862 GLU N N 15 117.521 0.040 A 863 TRP H H 1 8.001 0.005 A 863 TRP HA H 1 4.760 0.004 A 863 TRP HBx H 1 3.179 0.003 A 863 TRP HBy H 1 3.556 0.002 A 863 TRP HD1 H 1 7.257 0.003 A 863 TRP HE1 H 1 10.070 0.003 A 863 TRP HE3 H 1 7.665 0.003 A 863 TRP HH2 H 1 7.220 0.004 A 863 TRP HZ2 H 1 7.461 0.006 A 863 TRP HZ3 H 1 7.169 0.003 A 863 TRP CA C 13 57.033 0.026 A 863 TRP CB C 13 29.102 0.079 A 863 TRP CD1 C 13 126.963 0.061 A 863 TRP CE3 C 13 120.733 0.000 A 863 TRP CH2 C 13 124.748 0.000 A 863 TRP CZ2 C 13 114.733 0.088 A 863 TRP CZ3 C 13 122.149 0.000 A 863 TRP N N 15 120.482 0.021 A 863 TRP NE1 N 15 129.131 0.009 A 864 GLY H H 1 8.114 0.006 A 864 GLY HAy H 1 4.327 0.005 A 864 GLY HAx H 1 3.630 0.001 A 864 GLY CA C 13 45.312 0.021 A 864 GLY N N 15 107.765 0.022 A 865 ASN H H 1 8.840 0.005 A 865 ASN HA H 1 4.766 0.005 A 865 ASN HBy H 1 3.031 0.003 A 865 ASN HBx H 1 2.722 0.003 A 865 ASN HD2y H 1 8.848 0.001 A 865 ASN HD2x H 1 7.281 0.001 A 865 ASN CA C 13 53.269 0.027 A 865 ASN CB C 13 38.815 0.030 A 865 ASN N N 15 121.269 0.024 A 865 ASN ND2 N 15 118.532 0.014 A 866 GLN H H 1 8.663 0.009 A 866 GLN HA H 1 4.565 0.007 A 866 GLN HBx H 1 1.467 0.003 A 866 GLN HBy H 1 1.782 0.004 A 866 GLN HE2x H 1 6.804 0.005 A 866 GLN HE2y H 1 6.856 0.005 A 866 GLN HGx H 1 1.550 0.008 A 866 GLN HGy H 1 2.061 0.004 A 866 GLN CA C 13 56.172 0.086 A 866 GLN CB C 13 30.152 0.082 A 866 GLN CG C 13 34.373 0.031 A 866 GLN N N 15 121.423 0.023 A 866 GLN NE2 N 15 111.320 0.024 A 867 ILE H H 1 8.560 0.005 A 867 ILE HA H 1 4.481 0.003 A 867 ILE HB H 1 1.700 0.003 A 867 ILE HD1% H 1 0.857 0.004 A 867 ILE HG1y H 1 1.435 0.003 A 867 ILE HG1x H 1 1.132 0.002 A 867 ILE HG2% H 1 0.972 0.002 A 867 ILE CA C 13 60.093 0.077 A 867 ILE CB C 13 40.590 0.073 A 867 ILE CD1 C 13 13.233 0.013 A 867 ILE CG1 C 13 27.220 0.010 A 867 ILE CG2 C 13 17.644 0.020 A 867 ILE N N 15 124.635 0.020 A 868 TRP H H 1 8.948 0.004 A 868 TRP HA H 1 4.803 0.009 A 868 TRP HBx H 1 2.813 0.004 A 868 TRP HBy H 1 3.046 0.003 A 868 TRP HD1 H 1 7.764 0.004 A 868 TRP HE1 H 1 10.571 0.004 A 868 TRP HE3 H 1 7.865 0.003 A 868 TRP HH2 H 1 7.154 0.003 A 868 TRP HZ2 H 1 7.456 0.006 A 868 TRP HZ3 H 1 7.119 0.004 A 868 TRP CA C 13 59.161 0.088 A 868 TRP CB C 13 31.670 0.063 A 868 TRP CD1 C 13 128.404 0.049 A 868 TRP CE3 C 13 122.105 0.000 A 868 TRP CH2 C 13 124.440 0.000 A 868 TRP CZ2 C 13 114.674 0.063 A 868 TRP N N 15 127.871 0.033 A 868 TRP NE1 N 15 130.308 0.013 A 869 ILE H H 1 8.702 0.004 A 869 ILE HA H 1 4.087 0.004 A 869 ILE HB H 1 1.794 0.002 A 869 ILE HD1% H 1 0.636 0.003 A 869 ILE HG1y H 1 1.329 0.003 A 869 ILE HG1x H 1 1.086 0.004 A 869 ILE HG2% H 1 0.627 0.002 A 869 ILE CA C 13 58.467 0.007 A 869 ILE CB C 13 39.108 0.007 A 869 ILE CD1 C 13 11.278 0.024 A 869 ILE CG1 C 13 27.142 0.023 A 869 ILE CG2 C 13 17.153 0.020 A 869 ILE N N 15 121.947 0.057 A 870 CYS H H 1 7.979 0.004 A 870 CYS HA H 1 5.252 0.003 A 870 CYS HBx H 1 1.941 0.004 A 870 CYS HBy H 1 3.568 0.004 A 870 CYS CA C 13 55.646 0.026 A 870 CYS CB C 13 32.443 0.014 A 870 CYS N N 15 130.140 0.020 A 871 PRO HA H 1 4.208 0.003 A 871 PRO HBy H 1 1.989 0.005 A 871 PRO HBx H 1 1.711 0.004 A 871 PRO HDx H 1 1.518 0.003 A 871 PRO HDy H 1 4.408 0.006 A 871 PRO HGy H 1 1.459 0.005 A 871 PRO HGx H 1 1.101 0.003 A 871 PRO CA C 13 63.157 0.086 A 871 PRO CB C 13 31.835 0.087 A 871 PRO CD C 13 50.768 0.015 A 871 PRO CG C 13 27.879 0.002 A 872 GLY H H 1 8.790 0.008 A 872 GLY HAy H 1 4.271 0.002 A 872 GLY HAx H 1 3.859 0.003 A 872 GLY CA C 13 46.228 0.043 A 872 GLY N N 15 108.005 0.013 A 873 CYS H H 1 7.686 0.005 A 873 CYS HA H 1 5.079 0.004 A 873 CYS HBx H 1 3.224 0.001 A 873 CYS HBy H 1 3.259 0.003 A 873 CYS CA C 13 57.457 0.067 A 873 CYS CB C 13 32.356 0.079 A 873 CYS N N 15 116.674 0.038 A 874 ASN H H 1 8.949 0.006 A 874 ASN HA H 1 4.413 0.003 A 874 ASN HBx H 1 2.925 0.003 A 874 ASN HBy H 1 3.170 0.003 A 874 ASN HD2y H 1 7.502 0.001 A 874 ASN HD2x H 1 6.784 0.002 A 874 ASN CA C 13 55.424 0.086 A 874 ASN CB C 13 37.901 0.070 A 874 ASN N N 15 120.353 0.021 A 874 ASN ND2 N 15 112.094 0.028 A 875 LYS H H 1 8.581 0.005 A 875 LYS HA H 1 5.040 0.004 A 875 LYS HBy H 1 2.421 0.005 A 875 LYS HBx H 1 2.093 0.004 A 875 LYS HDx H 1 1.762 0.005 A 875 LYS HDy H 1 1.762 0.005 A 875 LYS HEx H 1 3.079 0.004 A 875 LYS HEy H 1 3.079 0.004 A 875 LYS HGx H 1 1.491 0.007 A 875 LYS HGy H 1 1.668 0.004 A 875 LYS CA C 13 53.909 0.021 A 875 LYS CB C 13 33.027 0.051 A 875 LYS CD C 13 28.988 0.036 A 875 LYS CE C 13 42.451 0.049 A 875 LYS CG C 13 25.017 0.015 A 875 LYS N N 15 119.499 0.020 A 876 PRO HA H 1 5.087 0.003 A 876 PRO HBy H 1 2.207 0.004 A 876 PRO HBx H 1 2.047 0.004 A 876 PRO HDy H 1 3.840 0.002 A 876 PRO HDx H 1 3.748 0.002 A 876 PRO HGx H 1 1.978 0.003 A 876 PRO HGy H 1 1.978 0.003 A 876 PRO CA C 13 62.288 0.012 A 876 PRO CB C 13 33.497 0.044 A 876 PRO CD C 13 50.954 0.007 A 876 PRO CG C 13 27.200 0.004 A 877 ASP H H 1 8.251 0.005 A 877 ASP HA H 1 4.559 0.007 A 877 ASP HBx H 1 2.589 0.003 A 877 ASP HBy H 1 3.025 0.009 A 877 ASP CA C 13 54.850 0.021 A 877 ASP CB C 13 42.555 0.089 A 877 ASP N N 15 119.646 0.041 A 878 ASP H H 1 9.437 0.005 A 878 ASP HA H 1 4.843 0.007 A 878 ASP HBy H 1 3.166 0.003 A 878 ASP HBx H 1 2.596 0.002 A 878 ASP CA C 13 52.561 0.049 A 878 ASP CB C 13 41.321 0.021 A 878 ASP N N 15 130.400 0.039 A 879 GLY H H 1 8.731 0.008 A 879 GLY HAy H 1 4.378 0.001 A 879 GLY HAx H 1 3.783 0.003 A 879 GLY CA C 13 45.369 0.032 A 879 GLY N N 15 110.921 0.005 A 880 SER H H 1 8.334 0.004 A 880 SER HA H 1 4.594 0.002 A 880 SER HBx H 1 3.955 0.003 A 880 SER HBy H 1 4.068 0.002 A 880 SER CA C 13 58.218 0.009 A 880 SER CB C 13 61.164 0.032 A 880 SER N N 15 118.131 0.042 A 881 PRO HA H 1 4.488 0.004 A 881 PRO HBy H 1 0.295 0.002 A 881 PRO HBx H 1 -0.158 0.003 A 881 PRO HDy H 1 3.621 0.004 A 881 PRO HDx H 1 3.468 0.005 A 881 PRO HGx H 1 1.308 0.002 A 881 PRO HGy H 1 1.352 0.002 A 881 PRO CA C 13 64.383 0.042 A 881 PRO CB C 13 30.222 0.040 A 881 PRO CD C 13 50.044 0.024 A 881 PRO CG C 13 27.680 0.010 A 882 MET H H 1 8.637 0.003 A 882 MET HA H 1 5.717 0.003 A 882 MET HBy H 1 2.370 0.005 A 882 MET HBx H 1 1.787 0.005 A 882 MET HE% H 1 1.437 0.001 A 882 MET HGx H 1 1.939 0.004 A 882 MET HGy H 1 2.993 0.002 A 882 MET CA C 13 54.753 0.035 A 882 MET CB C 13 42.358 0.024 A 882 MET CE C 13 17.741 0.005 A 882 MET CG C 13 34.667 0.035 A 882 MET N N 15 119.268 0.053 A 883 ILE H H 1 9.824 0.009 A 883 ILE HA H 1 5.199 0.002 A 883 ILE HB H 1 1.146 0.003 A 883 ILE HD1% H 1 -0.399 0.003 A 883 ILE HG1y H 1 1.345 0.000 A 883 ILE HG1x H 1 0.362 0.003 A 883 ILE HG2% H 1 -0.274 0.005 A 883 ILE CA C 13 59.472 0.126 A 883 ILE CB C 13 43.191 0.025 A 883 ILE CD1 C 13 14.845 0.011 A 883 ILE CG1 C 13 27.352 0.014 A 883 ILE CG2 C 13 12.685 0.011 A 883 ILE N N 15 125.246 0.048 A 884 GLY H H 1 7.558 0.005 A 884 GLY HAy H 1 3.697 0.003 A 884 GLY HAx H 1 1.044 0.003 A 884 GLY CA C 13 42.848 0.030 A 884 GLY N N 15 115.216 0.048 A 885 CYS H H 1 8.724 0.004 A 885 CYS HA H 1 4.547 0.004 A 885 CYS HBy H 1 3.526 0.006 A 885 CYS HBx H 1 2.834 0.004 A 885 CYS CA C 13 60.279 0.054 A 885 CYS CB C 13 31.492 0.114 A 885 CYS N N 15 126.228 0.040 A 886 ASP H H 1 9.144 0.005 A 886 ASP HA H 1 4.739 0.005 A 886 ASP HBx H 1 1.890 0.002 A 886 ASP HBy H 1 2.749 0.003 A 886 ASP CA C 13 57.594 0.095 A 886 ASP CB C 13 41.263 0.034 A 886 ASP N N 15 129.754 0.029 A 887 ASP H H 1 9.652 0.006 A 887 ASP HA H 1 5.155 0.003 A 887 ASP HBx H 1 2.649 0.007 A 887 ASP HBy H 1 3.795 0.002 A 887 ASP CA C 13 56.255 0.127 A 887 ASP CB C 13 43.317 0.041 A 887 ASP N N 15 123.885 0.019 A 888 CYS H H 1 8.257 0.006 A 888 CYS HA H 1 4.697 0.005 A 888 CYS HBy H 1 3.298 0.002 A 888 CYS HBx H 1 2.768 0.004 A 888 CYS CA C 13 60.392 0.043 A 888 CYS CB C 13 32.199 0.053 A 888 CYS N N 15 119.447 0.032 A 889 ASP H H 1 7.874 0.004 A 889 ASP HA H 1 4.973 0.010 A 889 ASP HBy H 1 3.349 0.004 A 889 ASP HBx H 1 2.649 0.007 A 889 ASP CA C 13 56.256 0.171 A 889 ASP CB C 13 42.159 0.026 A 889 ASP N N 15 119.322 0.013 A 890 ASP H H 1 8.736 0.004 A 890 ASP HA H 1 5.204 0.004 A 890 ASP HBx H 1 2.583 0.005 A 890 ASP HBy H 1 3.054 0.002 A 890 ASP CA C 13 56.153 0.136 A 890 ASP CB C 13 42.613 0.090 A 890 ASP N N 15 120.665 0.025 A 891 TRP H H 1 9.211 0.004 A 891 TRP HA H 1 5.402 0.003 A 891 TRP HBy H 1 2.846 0.004 A 891 TRP HBx H 1 2.713 0.008 A 891 TRP HD1 H 1 7.420 0.004 A 891 TRP HE1 H 1 10.001 0.003 A 891 TRP HE3 H 1 7.028 0.002 A 891 TRP HH2 H 1 6.778 0.005 A 891 TRP HZ2 H 1 7.287 0.003 A 891 TRP HZ3 H 1 6.557 0.003 A 891 TRP CA C 13 56.738 0.022 A 891 TRP CB C 13 31.376 0.081 A 891 TRP CD1 C 13 128.786 0.064 A 891 TRP CE3 C 13 119.012 0.010 A 891 TRP CH2 C 13 123.612 0.039 A 891 TRP CZ2 C 13 114.588 0.047 A 891 TRP CZ3 C 13 121.730 0.024 A 891 TRP N N 15 120.295 0.028 A 891 TRP NE1 N 15 130.833 0.010 A 892 TYR H H 1 9.187 0.006 A 892 TYR HA H 1 5.724 0.005 A 892 TYR HBy H 1 2.962 0.005 A 892 TYR HBx H 1 2.683 0.007 A 892 TYR HDx H 1 7.020 0.000 A 892 TYR HDy H 1 7.020 0.000 A 892 TYR HEx H 1 6.851 0.000 A 892 TYR HEy H 1 6.851 0.000 A 892 TYR CA C 13 54.706 0.014 A 892 TYR CB C 13 43.418 0.098 A 892 TYR N N 15 116.363 0.036 A 893 HIS H H 1 9.252 0.005 A 893 HIS HA H 1 5.046 0.002 A 893 HIS HBy H 1 4.406 0.004 A 893 HIS HBx H 1 3.771 0.006 A 893 HIS HD2 H 1 7.570 0.003 A 893 HIS HE1 H 1 7.521 0.002 A 893 HIS HE2 H 1 10.577 0.004 A 893 HIS CA C 13 58.476 0.018 A 893 HIS CB C 13 31.256 0.051 A 893 HIS CD2 C 13 119.379 0.001 A 893 HIS CE1 C 13 139.470 0.010 A 893 HIS N N 15 120.765 0.046 A 893 HIS ND1 N 15 164.391 0.000 A 894 TRP H H 1 8.283 0.005 A 894 TRP HA H 1 4.421 0.003 A 894 TRP HBy H 1 3.819 0.003 A 894 TRP HBx H 1 3.186 0.002 A 894 TRP HD1 H 1 6.453 0.006 A 894 TRP HE1 H 1 8.001 0.002 A 894 TRP HE3 H 1 7.303 0.004 A 894 TRP HH2 H 1 7.245 0.003 A 894 TRP HZ2 H 1 7.168 0.003 A 894 TRP HZ3 H 1 7.008 0.003 A 894 TRP CA C 13 61.077 0.021 A 894 TRP CB C 13 25.480 0.018 A 894 TRP CD1 C 13 120.913 0.000 A 894 TRP CE3 C 13 121.764 0.011 A 894 TRP CH2 C 13 125.900 0.144 A 894 TRP CZ2 C 13 112.254 0.069 A 894 TRP CZ3 C 13 121.635 0.084 A 894 TRP N N 15 122.268 0.037 A 894 TRP NE1 N 15 121.998 0.008 A 895 PRO HA H 1 4.534 0.004 A 895 PRO HBx H 1 2.081 0.003 A 895 PRO HBy H 1 2.467 0.004 A 895 PRO HDy H 1 4.252 0.003 A 895 PRO HDx H 1 4.028 0.005 A 895 PRO HGx H 1 2.143 0.003 A 895 PRO HGy H 1 2.220 0.004 A 895 PRO CA C 13 65.799 0.014 A 895 PRO CB C 13 30.719 0.093 A 895 PRO CD C 13 50.999 0.012 A 895 PRO CG C 13 28.395 0.071 A 896 CYS H H 1 7.303 0.006 A 896 CYS HA H 1 4.283 0.004 A 896 CYS HBy H 1 3.623 0.003 A 896 CYS HBx H 1 3.281 0.003 A 896 CYS CA C 13 62.965 0.044 A 896 CYS CB C 13 29.062 0.103 A 896 CYS N N 15 117.589 0.028 A 897 VAL H H 1 7.589 0.006 A 897 VAL HA H 1 4.730 0.004 A 897 VAL HB H 1 2.762 0.003 A 897 VAL HGx% H 1 0.719 0.002 A 897 VAL HGy% H 1 0.721 0.001 A 897 VAL CA C 13 60.135 0.065 A 897 VAL CB C 13 31.672 0.133 A 897 VAL CGy C 13 23.843 0.013 A 897 VAL CGx C 13 18.168 0.027 A 897 VAL N N 15 108.649 0.027 A 898 GLY H H 1 7.504 0.008 A 898 GLY HAy H 1 3.998 0.002 A 898 GLY HAx H 1 3.856 0.003 A 898 GLY CA C 13 47.008 0.025 A 898 GLY N N 15 108.886 0.010 A 899 ILE H H 1 7.803 0.006 A 899 ILE HA H 1 4.095 0.004 A 899 ILE HB H 1 1.359 0.004 A 899 ILE HD1% H 1 0.131 0.002 A 899 ILE HG1y H 1 0.957 0.004 A 899 ILE HG1x H 1 0.768 0.004 A 899 ILE HG2% H 1 -0.136 0.002 A 899 ILE CA C 13 59.671 0.063 A 899 ILE CB C 13 37.790 0.063 A 899 ILE CD1 C 13 11.016 0.008 A 899 ILE CG1 C 13 26.560 0.017 A 899 ILE CG2 C 13 16.298 0.010 A 899 ILE N N 15 120.019 0.027 A 900 MET H H 1 8.755 0.006 A 900 MET HA H 1 4.715 0.004 A 900 MET HBy H 1 2.199 0.003 A 900 MET HBx H 1 1.916 0.003 A 900 MET HGx H 1 2.479 0.002 A 900 MET HGy H 1 2.634 0.004 A 900 MET CA C 13 54.754 0.031 A 900 MET CB C 13 33.662 0.087 A 900 MET CG C 13 32.262 0.051 A 900 MET N N 15 123.503 0.065 A 901 ALA H H 1 7.262 0.010 A 901 ALA HA H 1 4.371 0.004 A 901 ALA HB% H 1 1.252 0.001 A 901 ALA CA C 13 50.607 0.047 A 901 ALA CB C 13 21.427 0.124 A 901 ALA N N 15 121.425 0.032 A 902 ALA H H 1 8.562 0.006 A 902 ALA HA H 1 3.522 0.004 A 902 ALA HB% H 1 1.368 0.002 A 902 ALA CA C 13 50.709 0.008 A 902 ALA CB C 13 17.455 0.009 A 902 ALA N N 15 124.289 0.021 A 903 PRO HA H 1 4.622 0.002 A 903 PRO HBx H 1 1.603 0.005 A 903 PRO HBy H 1 2.457 0.001 A 903 PRO HDx H 1 3.068 0.004 A 903 PRO HDy H 1 3.168 0.003 A 903 PRO HGx H 1 1.526 0.005 A 903 PRO HGy H 1 1.639 0.007 A 903 PRO CA C 13 61.157 0.012 A 903 PRO CB C 13 30.282 0.025 A 903 PRO CD C 13 49.895 0.012 A 903 PRO CG C 13 27.127 0.026 A 904 PRO HA H 1 4.403 0.003 A 904 PRO HBx H 1 1.787 0.004 A 904 PRO HBy H 1 2.493 0.002 A 904 PRO HDy H 1 3.838 0.005 A 904 PRO HDx H 1 3.585 0.003 A 904 PRO HGx H 1 2.052 0.004 A 904 PRO HGy H 1 2.136 0.004 A 904 PRO CA C 13 63.536 0.079 A 904 PRO CB C 13 32.123 0.083 A 904 PRO CD C 13 50.455 0.010 A 904 PRO CG C 13 28.081 0.061 A 905 GLU H H 1 8.845 0.005 A 905 GLU HA H 1 3.967 0.004 A 905 GLU HBy H 1 2.101 0.005 A 905 GLU HBx H 1 2.062 0.003 A 905 GLU HGy H 1 2.425 0.007 A 905 GLU HGx H 1 2.386 0.006 A 905 GLU CA C 13 60.127 0.041 A 905 GLU CB C 13 29.892 0.060 A 905 GLU CG C 13 36.588 0.004 A 905 GLU N N 15 124.405 0.025 A 906 GLU H H 1 9.241 0.004 A 906 GLU HA H 1 4.245 0.003 A 906 GLU HBx H 1 2.041 0.004 A 906 GLU HBy H 1 2.133 0.002 A 906 GLU HGy H 1 2.338 0.005 A 906 GLU HGx H 1 2.233 0.005 A 906 GLU CA C 13 57.285 0.049 A 906 GLU CB C 13 28.748 0.108 A 906 GLU CG C 13 36.051 0.022 A 906 GLU N N 15 115.138 0.034 A 907 MET H H 1 7.633 0.005 A 907 MET HA H 1 4.439 0.005 A 907 MET HBx H 1 2.009 0.003 A 907 MET HBy H 1 2.110 0.004 A 907 MET HGx H 1 2.685 0.002 A 907 MET HGy H 1 2.685 0.002 A 907 MET CA C 13 55.462 0.091 A 907 MET CB C 13 34.392 0.070 A 907 MET CG C 13 31.946 0.017 A 907 MET N N 15 121.244 0.027 A 908 GLN H H 1 8.635 0.003 A 908 GLN HA H 1 4.378 0.005 A 908 GLN HBy H 1 1.908 0.003 A 908 GLN HBx H 1 1.722 0.003 A 908 GLN HE2x H 1 6.994 0.002 A 908 GLN HE2y H 1 7.660 0.003 A 908 GLN HGy H 1 2.432 0.005 A 908 GLN HGx H 1 2.231 0.002 A 908 GLN CA C 13 56.224 0.077 A 908 GLN CB C 13 31.529 0.068 A 908 GLN CG C 13 35.323 0.019 A 908 GLN N N 15 125.641 0.023 A 908 GLN NE2 N 15 112.467 0.018 A 909 TRP H H 1 8.831 0.007 A 909 TRP HA H 1 4.363 0.003 A 909 TRP HBx H 1 2.577 0.002 A 909 TRP HBy H 1 3.180 0.004 A 909 TRP HD1 H 1 7.138 0.003 A 909 TRP HE1 H 1 10.010 0.003 A 909 TRP HE3 H 1 7.213 0.002 A 909 TRP HH2 H 1 6.177 0.002 A 909 TRP HZ2 H 1 6.942 0.002 A 909 TRP HZ3 H 1 6.572 0.001 A 909 TRP CA C 13 59.309 0.159 A 909 TRP CB C 13 31.758 0.033 A 909 TRP CD1 C 13 126.094 0.000 A 909 TRP CE3 C 13 122.189 0.000 A 909 TRP CH2 C 13 122.576 0.001 A 909 TRP CZ2 C 13 113.609 0.000 A 909 TRP CZ3 C 13 120.058 0.000 A 909 TRP N N 15 123.177 0.036 A 909 TRP NE1 N 15 128.884 0.009 A 910 PHE H H 1 6.678 0.006 A 910 PHE HA H 1 5.253 0.003 A 910 PHE HBy H 1 2.547 0.004 A 910 PHE HBx H 1 2.222 0.005 A 910 PHE HDx H 1 7.023 0.003 A 910 PHE HDy H 1 7.023 0.003 A 910 PHE HEx H 1 7.072 0.002 A 910 PHE HEy H 1 7.072 0.002 A 910 PHE HZ H 1 7.147 0.000 A 910 PHE CA C 13 54.405 0.098 A 910 PHE CB C 13 41.554 0.034 A 910 PHE CDx C 13 132.002 0.000 A 910 PHE CEx C 13 131.122 0.000 A 910 PHE CZ C 13 129.618 0.000 A 910 PHE N N 15 123.023 0.033 A 911 CYS H H 1 9.316 0.004 A 911 CYS HA H 1 3.678 0.004 A 911 CYS HBy H 1 3.166 0.003 A 911 CYS HBx H 1 2.505 0.005 A 911 CYS CA C 13 56.862 0.034 A 911 CYS CB C 13 30.054 0.038 A 911 CYS N N 15 126.265 0.046 A 912 PRO HA H 1 4.121 0.003 A 912 PRO HBx H 1 1.912 0.004 A 912 PRO HBy H 1 2.402 0.004 A 912 PRO HDx H 1 3.319 0.003 A 912 PRO HDy H 1 3.319 0.003 A 912 PRO HGx H 1 1.993 0.003 A 912 PRO HGy H 1 2.112 0.002 A 912 PRO CA C 13 65.685 0.038 A 912 PRO CB C 13 32.121 0.071 A 912 PRO CD C 13 49.557 0.007 A 912 PRO CG C 13 27.902 0.040 A 913 LYS H H 1 7.974 0.004 A 913 LYS HA H 1 4.196 0.004 A 913 LYS HBx H 1 1.983 0.003 A 913 LYS HBy H 1 2.026 0.007 A 913 LYS HDy H 1 1.884 0.003 A 913 LYS HDx H 1 1.800 0.003 A 913 LYS HEx H 1 3.099 0.002 A 913 LYS HEy H 1 3.099 0.002 A 913 LYS HGx H 1 1.438 0.004 A 913 LYS HGy H 1 1.630 0.004 A 913 LYS CA C 13 59.319 0.112 A 913 LYS CB C 13 32.890 0.095 A 913 LYS CD C 13 29.295 0.006 A 913 LYS CE C 13 42.363 0.037 A 913 LYS CG C 13 25.207 0.034 A 913 LYS N N 15 117.227 0.029 A 914 CYS H H 1 8.485 0.004 A 914 CYS HA H 1 3.934 0.004 A 914 CYS HBy H 1 3.031 0.002 A 914 CYS HBx H 1 2.835 0.004 A 914 CYS CA C 13 63.786 0.083 A 914 CYS CB C 13 30.060 0.052 A 914 CYS N N 15 125.213 0.026 A 915 ALA H H 1 8.986 0.004 A 915 ALA HA H 1 3.789 0.002 A 915 ALA HB% H 1 1.192 0.002 A 915 ALA CA C 13 54.454 0.077 A 915 ALA CB C 13 18.212 0.116 A 915 ALA N N 15 121.721 0.027 A 916 ASN H H 1 7.519 0.005 A 916 ASN HA H 1 4.605 0.002 A 916 ASN HBx H 1 2.746 0.003 A 916 ASN HBy H 1 2.839 0.003 A 916 ASN HD2y H 1 7.685 0.002 A 916 ASN HD2x H 1 6.941 0.002 A 916 ASN CA C 13 54.089 0.140 A 916 ASN CB C 13 38.909 0.018 A 916 ASN N N 15 114.095 0.018 A 916 ASN ND2 N 15 113.490 0.021 A 917 LYS H H 1 7.432 0.006 A 917 LYS HA H 1 4.121 0.003 A 917 LYS HBx H 1 1.770 0.005 A 917 LYS HBy H 1 1.831 0.001 A 917 LYS HDx H 1 1.680 0.003 A 917 LYS HDy H 1 1.680 0.003 A 917 LYS HEx H 1 2.943 0.004 A 917 LYS HEy H 1 2.943 0.004 A 917 LYS HGy H 1 1.502 0.003 A 917 LYS HGx H 1 1.380 0.002 A 917 LYS CA C 13 57.788 0.125 A 917 LYS CB C 13 32.826 0.071 A 917 LYS CD C 13 29.539 0.018 A 917 LYS CE C 13 42.073 0.024 A 917 LYS CG C 13 25.018 0.043 A 917 LYS N N 15 119.975 0.022 A 918 ILE H H 1 7.815 0.007 A 918 ILE HA H 1 3.937 0.005 A 918 ILE HB H 1 1.747 0.003 A 918 ILE HD1% H 1 0.571 0.003 A 918 ILE HG1y H 1 1.366 0.003 A 918 ILE HG1x H 1 1.038 0.003 A 918 ILE HG2% H 1 0.785 0.002 A 918 ILE CA C 13 61.939 0.064 A 918 ILE CB C 13 38.220 0.106 A 918 ILE CD1 C 13 12.633 0.030 A 918 ILE CG1 C 13 27.691 0.030 A 918 ILE CG2 C 13 17.379 0.028 A 918 ILE N N 15 120.156 0.033 A 919 LYS H H 1 8.082 0.004 A 919 LYS HA H 1 4.246 0.004 A 919 LYS HBx H 1 1.769 0.000 A 919 LYS HBy H 1 1.817 0.000 A 919 LYS HDx H 1 1.657 0.000 A 919 LYS HDy H 1 1.657 0.000 A 919 LYS HGx H 1 1.396 0.000 A 919 LYS HGy H 1 1.396 0.000 A 919 LYS CA C 13 56.573 0.055 A 919 LYS CB C 13 32.658 0.000 A 919 LYS N N 15 124.303 0.029 A 920 LYS H H 1 8.231 0.005 A 920 LYS HA H 1 4.259 0.001 A 920 LYS HBx H 1 1.758 0.003 A 920 LYS HBy H 1 1.830 0.000 A 920 LYS HDx H 1 1.651 0.002 A 920 LYS HDy H 1 1.651 0.002 A 920 LYS HEx H 1 2.946 0.000 A 920 LYS HEy H 1 2.946 0.000 A 920 LYS HGx H 1 1.413 0.002 A 920 LYS HGy H 1 1.428 0.000 A 920 LYS CA C 13 56.642 0.087 A 920 LYS CB C 13 32.898 0.100 A 920 LYS CD C 13 29.105 0.004 A 920 LYS N N 15 122.199 0.024 A 921 ASP H H 1 8.324 0.005 A 921 ASP HA H 1 4.580 0.004 A 921 ASP HBx H 1 2.631 0.003 A 921 ASP HBy H 1 2.696 0.002 A 921 ASP CA C 13 54.474 0.047 A 921 ASP CB C 13 41.286 0.023 A 921 ASP N N 15 121.108 0.037 A 922 LYS H H 1 8.172 0.006 A 922 LYS HA H 1 4.301 0.002 A 922 LYS HBx H 1 1.749 0.000 A 922 LYS HBy H 1 1.839 0.000 A 922 LYS HGx H 1 1.420 0.000 A 922 LYS HGy H 1 1.420 0.000 A 922 LYS CA C 13 56.301 0.087 A 922 LYS CB C 13 32.889 0.000 A 922 LYS N N 15 121.367 0.028 A 923 LYS H H 1 8.353 0.006 A 923 LYS HA H 1 4.269 0.007 A 923 LYS HBx H 1 1.757 0.006 A 923 LYS HBy H 1 1.827 0.000 A 923 LYS HGx H 1 1.426 0.000 A 923 LYS HGy H 1 1.426 0.000 A 923 LYS CA C 13 56.487 0.092 A 923 LYS CB C 13 32.904 0.076 A 923 LYS N N 15 122.924 0.019 A 924 HIS H H 1 8.013 0.005 A 924 HIS HA H 1 4.457 0.002 A 924 HIS HBx H 1 3.066 0.002 A 924 HIS HBy H 1 3.220 0.003 A 924 HIS HD2 H 1 7.148 0.006 A 924 HIS HE1 H 1 8.259 0.006 A 924 HIS CA C 13 57.306 0.017 A 924 HIS CB C 13 30.681 0.046 A 924 HIS CD2 C 13 120.069 0.000 A 924 HIS CE1 C 13 136.973 0.000 A 924 HIS N N 15 125.131 0.048 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 893 HIS HE1 A 875 LYS HBx 1.0 0.0 3.68 2 1 A 875 LYS HBy A 893 HIS HE1 1.0 0.0 3.68 3 2 A 862 GLU H A 861 ASP HBy 1.0 0.0 3.04 4 2 A 861 ASP HBx A 862 GLU H 1.0 0.0 3.04 5 3 A 859 ILE H A 867 ILE HG2% 1.0 0.0 4.66 6 4 A 863 TRP H A 865 ASN H 1.0 0.0 3.79 7 5 A 876 PRO HDy A 875 LYS HGy 1.0 0.0 4.08 8 5 A 875 LYS HGx A 876 PRO HDy 1.0 0.0 4.08 9 6 A 863 TRP H A 861 ASP HBy 1.0 0.0 3.96 10 6 A 861 ASP HBx A 863 TRP H 1.0 0.0 3.96 11 7 A 897 VAL HB A 898 GLY H 1.0 0.0 4.53 12 8 A 876 PRO HDx A 875 LYS HGy 1.0 0.0 4.40 13 8 A 875 LYS HGx A 876 PRO HDx 1.0 0.0 4.40 14 9 A 865 ASN H A 861 ASP HBy 1.0 0.0 3.95 15 9 A 861 ASP HBx A 865 ASN H 1.0 0.0 3.95 16 10 A 918 ILE H A 919 LYS H 1.0 0.0 3.49 17 11 A 893 HIS HE1 A 875 LYS HGy 1.0 0.0 5.34 18 11 A 893 HIS HE1 A 875 LYS HGx 1.0 0.0 5.34 19 12 A 918 ILE H A 917 LYS H 1.0 0.0 3.29 20 13 A 876 PRO HA A 877 ASP HBy 1.0 0.0 4.77 21 13 A 876 PRO HA A 877 ASP HBx 1.0 0.0 4.77 22 14 A 899 ILE H A 899 ILE HG1x 1.0 0.0 4.07 23 15 A 877 ASP H A 876 PRO HBx 1.0 0.0 3.32 24 15 A 876 PRO HBy A 877 ASP H 1.0 0.0 3.32 25 16 A 897 VAL H A 899 ILE HB 1.0 0.0 4.85 26 17 A 877 ASP H A 877 ASP HBy 1.0 0.0 3.05 27 17 A 877 ASP HBx A 877 ASP H 1.0 0.0 3.05 28 18 A 917 LYS H A 914 CYS HA 1.0 0.0 3.90 29 19 A 879 GLY H A 877 ASP HBy 1.0 0.0 3.84 30 19 A 877 ASP HBx A 879 GLY H 1.0 0.0 3.84 31 20 A 917 LYS H A 915 ALA HA 1.0 0.0 4.52 32 21 A 882 MET HE% A 877 ASP HBy 1.0 0.0 3.12 33 21 A 877 ASP HBx A 882 MET HE% 1.0 0.0 3.12 34 22 A 918 ILE H A 918 ILE HD1% 1.0 0.0 4.05 35 23 A 920 LYS H A 920 LYS HBx 1.0 0.0 4.09 36 24 A 921 ASP H A 921 ASP HBx 1.0 0.0 4.00 37 25 A 872 GLY HAx A 874 ASN H 1.0 0.0 4.58 38 26 A 898 GLY H A 896 CYS H 1.0 0.0 4.18 39 27 A 863 TRP H A 862 GLU HBy 1.0 0.0 4.27 40 28 A 911 CYS HBy A 914 CYS H 1.0 0.0 4.49 41 29 A 871 PRO HGy A 892 TYR HE% 1.0 0.0 4.44 42 30 A 911 CYS HBx A 913 LYS H 1.0 0.0 4.68 43 31 A 883 ILE HD1% A 903 PRO HGx 1.0 0.0 4.12 44 32 A 866 GLN H A 866 GLN HBx 1.0 0.0 3.51 45 33 A 856 ALA H A 855 MET HBy 1.0 0.0 4.70 46 34 A 899 ILE HG1x A 883 ILE HD1% 1.0 0.0 4.15 47 35 A 860 ARG H A 860 ARG HGy 1.0 0.0 3.98 48 36 A 890 ASP H A 889 ASP HBx 1.0 0.0 4.79 49 37 A 883 ILE HD1% A 884 GLY H 1.0 0.0 4.33 50 38 A 882 MET HE% A 892 TYR H 1.0 0.0 4.27 51 39 A 882 MET HE% A 882 MET HGy 1.0 0.0 4.43 52 40 A 859 ILE H A 859 ILE HD1% 1.0 0.0 4.30 53 41 A 867 ILE H A 867 ILE HG1y 1.0 0.0 3.83 54 42 A 859 ILE HD1% A 859 ILE HA 1.0 0.0 4.34 55 43 A 867 ILE HG2% A 867 ILE H 1.0 0.0 4.06 56 44 P 9 LYS H P 9 LYS HGy 1.0 0.0 4.13 57 44 P 9 LYS H P 9 LYS HGx 1.0 0.0 4.13 58 45 A 867 ILE H A 867 ILE HD1% 1.0 0.0 4.73 59 46 A 867 ILE HG2% A 877 ASP H 1.0 0.0 4.05 60 47 A 882 MET HE% A 868 TRP HE3 1.0 0.0 5.50 61 48 A 867 ILE HD1% A 861 ASP HBy 1.0 0.0 4.23 62 49 A 867 ILE HG2% A 861 ASP HBy 1.0 0.0 4.77 63 49 A 861 ASP HBx A 867 ILE HG2% 1.0 0.0 4.77 64 50 A 882 MET HE% A 893 HIS HD2 1.0 0.0 4.00 65 51 A 867 ILE HD1% A 865 ASN HBy 1.0 0.0 4.26 66 52 A 867 ILE HG1y A 861 ASP HBy 1.0 0.0 3.45 67 52 A 861 ASP HBx A 867 ILE HG1y 1.0 0.0 3.45 68 53 A 860 ARG H A 859 ILE HG2% 1.0 0.0 3.79 69 54 A 893 HIS HE1 A 882 MET HE% 1.0 0.0 4.61 70 55 A 884 GLY H A 883 ILE HG2% 1.0 0.0 4.14 71 56 A 867 ILE HG1x A 861 ASP HBy 1.0 0.0 4.48 72 56 A 861 ASP HBx A 867 ILE HG1x 1.0 0.0 4.48 73 57 A 859 ILE HG2% A 858 VAL H 1.0 0.0 4.54 74 58 A 883 ILE HG2% A 909 TRP HZ2 1.0 0.0 4.39 75 59 A 867 ILE HD1% A 861 ASP HBy 1.0 0.0 3.47 76 59 A 861 ASP HBx A 867 ILE HD1% 1.0 0.0 3.47 77 60 A 859 ILE HG2% A 857 TYR HD% 1.0 0.0 5.50 78 61 A 863 TRP H A 862 GLU HBx 1.0 0.0 3.72 79 61 A 863 TRP H A 862 GLU HBy 1.0 0.0 3.72 80 62 A 897 VAL H A 897 VAL HGy% 1.0 0.0 3.06 81 63 A 864 GLY H A 862 GLU HBx 1.0 0.0 5.34 82 63 A 862 GLU HBy A 864 GLY H 1.0 0.0 5.34 83 64 A 898 GLY H A 897 VAL HGy% 1.0 0.0 3.72 84 65 A 917 LYS H A 916 ASN HBy 1.0 0.0 4.06 85 66 A 878 ASP H A 879 GLY HAx 1.0 0.0 4.58 86 66 A 878 ASP H A 879 GLY HAy 1.0 0.0 4.58 87 67 A 863 TRP H A 864 GLY HAx 1.0 0.0 4.75 88 67 A 863 TRP H A 864 GLY HAy 1.0 0.0 4.75 89 68 A 896 CYS H A 897 VAL HGy% 1.0 0.0 3.75 90 69 A 854 ALA HA A 855 MET H 1.0 0.0 3.14 91 70 A 879 GLY H A 878 ASP HBy 1.0 0.0 4.45 92 70 A 879 GLY H A 878 ASP HBx 1.0 0.0 4.45 93 71 A 863 TRP HBx A 865 ASN HD2x 1.0 0.0 3.73 94 71 A 863 TRP HBx A 865 ASN HD2y 1.0 0.0 3.73 95 72 A 897 VAL HGy% A 893 HIS H 1.0 0.0 5.42 96 73 A 874 ASN H A 872 GLY H 1.0 0.0 4.26 97 74 A 880 SER H A 880 SER HBx 1.0 0.0 3.40 98 74 A 880 SER H A 880 SER HBy 1.0 0.0 3.40 99 75 A 863 TRP HBy A 865 ASN HD2y 1.0 0.0 4.50 100 75 A 863 TRP HBy A 865 ASN HD2x 1.0 0.0 4.50 101 76 A 872 GLY H A 871 PRO HDy 1.0 0.0 4.35 102 77 A 880 SER H A 881 PRO HDx 1.0 0.0 4.88 103 77 A 880 SER H A 881 PRO HDy 1.0 0.0 4.88 104 78 A 865 ASN H A 865 ASN HD2y 1.0 0.0 4.12 105 78 A 865 ASN H A 865 ASN HD2x 1.0 0.0 4.12 106 79 A 876 PRO HDy A 875 LYS H 1.0 0.0 4.82 107 80 A 880 SER HA A 881 PRO HDx 1.0 0.0 2.91 108 80 A 881 PRO HDy A 880 SER HA 1.0 0.0 2.91 109 81 A 875 LYS H A 870 CYS HBy 1.0 0.0 4.03 110 82 A 880 SER HBx A 881 PRO HDx 1.0 0.0 3.14 111 82 A 880 SER HBy A 881 PRO HDx 1.0 0.0 3.14 112 82 A 881 PRO HDy A 880 SER HBx 1.0 0.0 3.14 113 82 A 880 SER HBy A 881 PRO HDy 1.0 0.0 3.14 114 83 A 875 LYS H A 875 LYS HDx 1.0 0.0 4.50 115 83 A 875 LYS H A 875 LYS HDy 1.0 0.0 4.50 116 84 A 894 TRP HE3 A 881 PRO HGy 1.0 0.0 4.48 117 84 A 881 PRO HGx A 894 TRP HE3 1.0 0.0 4.48 118 85 A 894 TRP HZ3 A 881 PRO HGy 1.0 0.0 3.80 119 85 A 881 PRO HGx A 894 TRP HZ3 1.0 0.0 3.80 120 86 A 864 GLY H A 860 ARG HDx 1.0 0.0 5.26 121 86 A 864 GLY H A 860 ARG HDy 1.0 0.0 5.26 122 87 A 888 CYS H A 888 CYS HBx 1.0 0.0 3.42 123 87 A 888 CYS H A 888 CYS HBy 1.0 0.0 3.42 124 88 A 865 ASN HBy A 864 GLY H 1.0 0.0 5.50 125 89 A 889 ASP H A 888 CYS HBx 1.0 0.0 3.78 126 89 A 888 CYS HBy A 889 ASP H 1.0 0.0 3.78 127 90 A 918 ILE H A 917 LYS HBy 1.0 0.0 4.30 128 91 A 920 LYS HEy A 920 LYS HBx 1.0 0.0 4.94 129 91 A 920 LYS HBx A 920 LYS HEx 1.0 0.0 4.94 130 92 A 913 LYS H A 913 LYS HBx 1.0 0.0 3.81 131 93 A 920 LYS H A 920 LYS HBy 1.0 0.0 4.09 132 94 A 918 ILE H A 917 LYS HBx 1.0 0.0 4.30 133 95 A 855 MET H A 854 ALA HB% 1.0 0.0 4.00 134 96 P 1 ALA HA A 909 TRP HBy 1.0 0.0 4.38 135 97 A 856 ALA H A 854 ALA HB% 1.0 0.0 4.75 136 98 A 910 PHE HBx A 914 CYS HBx 1.0 0.0 4.32 137 99 A 883 ILE HG2% A 894 TRP HA 1.0 0.0 4.31 138 100 A 862 GLU H A 862 GLU HBx 1.0 0.0 3.60 139 101 A 896 CYS H A 893 HIS HBx 1.0 0.0 3.78 140 102 A 911 CYS HBx A 885 CYS HBy 1.0 0.0 4.37 141 103 A 883 ILE HG2% A 909 TRP HE3 1.0 0.0 4.30 142 104 P 7 ALA H P 7 ALA HB% 1.0 0.0 3.40 143 105 A 881 PRO HBy A 894 TRP HE1 1.0 0.0 4.54 144 106 A 914 CYS HA A 917 LYS HDx 1.0 0.0 4.01 145 106 A 914 CYS HA A 917 LYS HDy 1.0 0.0 4.01 146 107 A 883 ILE HG2% A 882 MET HA 1.0 0.0 4.16 147 108 A 894 TRP HH2 A 902 ALA HB% 1.0 0.0 3.39 148 109 A 883 ILE HG2% A 894 TRP HE1 1.0 0.0 4.21 149 110 A 906 GLU H A 906 GLU HBx 1.0 0.0 4.06 150 111 A 918 ILE HD1% A 915 ALA HB% 1.0 0.0 4.61 151 112 A 902 ALA HB% A 894 TRP HZ2 1.0 0.0 3.53 152 113 A 868 TRP HBy A 869 ILE H 1.0 0.0 4.23 153 114 A 857 TYR HA A 869 ILE HD1% 1.0 0.0 5.14 154 115 A 875 LYS H A 869 ILE HG2% 1.0 0.0 3.76 155 116 A 899 ILE HB A 900 MET H 1.0 0.0 4.32 156 117 A 876 PRO HA A 869 ILE H 1.0 0.0 4.83 157 118 A 876 PRO HDx A 869 ILE HD1% 1.0 0.0 4.52 158 119 A 877 ASP H A 869 ILE HD1% 1.0 0.0 4.01 159 120 A 894 TRP HE1 A 883 ILE HG1x 1.0 0.0 4.93 160 121 A 869 ILE H A 868 TRP HA 1.0 0.0 3.21 161 122 A 859 ILE HG2% A 869 ILE HD1% 1.0 0.0 4.60 162 123 A 869 ILE HG2% A 870 CYS H 1.0 0.0 3.29 163 124 A 918 ILE H A 918 ILE HG1y 1.0 0.0 3.55 164 125 A 915 ALA H A 916 ASN H 1.0 0.0 3.43 165 126 A 859 ILE HD1% A 869 ILE HD1% 1.0 0.0 4.78 166 127 A 869 ILE HG2% A 873 CYS H 1.0 0.0 5.45 167 128 A 900 MET H A 901 ALA H 1.0 0.0 3.06 168 129 A 899 ILE HD1% A 909 TRP HE1 1.0 0.0 3.70 169 130 A 857 TYR HD% A 869 ILE HG2% 1.0 0.0 3.37 170 131 A 901 ALA H A 902 ALA H 1.0 0.0 4.58 171 132 A 900 MET H A 899 ILE HD1% 1.0 0.0 4.30 172 133 A 869 ILE HG2% A 857 TYR HE% 1.0 0.0 3.82 173 134 A 918 ILE HD1% A 910 PHE HD% 1.0 0.0 5.34 174 135 A 868 TRP HZ2 A 858 VAL HGx% 1.0 0.0 4.72 175 136 A 864 GLY H A 862 GLU HA 1.0 0.0 4.40 176 137 A 890 ASP H A 888 CYS HBx 1.0 0.0 4.49 177 137 A 890 ASP H A 888 CYS HBy 1.0 0.0 4.49 178 138 A 858 VAL H A 858 VAL HGx% 1.0 0.0 4.03 179 139 A 858 VAL H A 857 TYR HD% 1.0 0.0 4.80 180 140 A 889 ASP H A 889 ASP HBx 1.0 0.0 3.53 181 140 A 889 ASP H A 889 ASP HBy 1.0 0.0 3.53 182 141 A 866 GLN HE2y A 858 VAL HGx% 1.0 0.0 4.71 183 142 A 858 VAL H A 856 ALA HA 1.0 0.0 4.62 184 143 A 890 ASP H A 889 ASP HBx 1.0 0.0 4.06 185 143 A 890 ASP H A 889 ASP HBy 1.0 0.0 4.06 186 144 A 858 VAL H A 857 TYR HBx 1.0 0.0 4.30 187 145 A 890 ASP H A 890 ASP HBy 1.0 0.0 3.17 188 145 A 890 ASP H A 890 ASP HBx 1.0 0.0 3.17 189 146 A 856 ALA H A 857 TYR H 1.0 0.0 4.45 190 147 A 891 TRP H A 890 ASP HBy 1.0 0.0 3.43 191 147 A 890 ASP HBx A 891 TRP H 1.0 0.0 3.43 192 148 A 858 VAL H A 857 TYR H 1.0 0.0 3.43 193 149 A 892 TYR HE% A 913 LYS HBy 1.0 0.0 5.08 194 149 A 892 TYR HE% A 913 LYS HBx 1.0 0.0 5.08 195 150 A 886 ASP H A 909 TRP H 1.0 0.0 4.77 196 151 A 916 ASN HBx A 916 ASN HD2y 1.0 0.0 3.17 197 151 A 916 ASN HBy A 916 ASN HD2y 1.0 0.0 3.17 198 151 A 916 ASN HD2x A 916 ASN HBy 1.0 0.0 3.17 199 151 A 916 ASN HBx A 916 ASN HD2x 1.0 0.0 3.17 200 152 A 895 PRO HA A 898 GLY HAy 1.0 0.0 4.84 201 152 A 895 PRO HA A 898 GLY HAx 1.0 0.0 4.84 202 153 A 878 ASP H A 880 SER H 1.0 0.0 3.68 203 154 A 917 LYS H A 916 ASN HBy 1.0 0.0 3.55 204 154 A 917 LYS H A 916 ASN HBx 1.0 0.0 3.55 205 155 A 897 VAL H A 898 GLY HAy 1.0 0.0 5.01 206 155 A 897 VAL H A 898 GLY HAx 1.0 0.0 5.01 207 156 A 896 CYS H A 893 HIS H 1.0 0.0 4.75 208 157 A 917 LYS HEx A 918 ILE HG1y 1.0 0.0 4.00 209 157 A 917 LYS HEy A 918 ILE HG1y 1.0 0.0 4.00 210 157 A 918 ILE HG1x A 917 LYS HEx 1.0 0.0 4.00 211 157 A 917 LYS HEy A 918 ILE HG1x 1.0 0.0 4.00 212 158 A 897 VAL HGy% A 898 GLY HAy 1.0 0.0 4.51 213 158 A 897 VAL HGy% A 898 GLY HAx 1.0 0.0 4.51 214 159 A 897 VAL H A 896 CYS H 1.0 0.0 3.20 215 160 A 918 ILE H A 918 ILE HG1y 1.0 0.0 2.97 216 160 A 918 ILE H A 918 ILE HG1x 1.0 0.0 2.97 217 161 A 899 ILE HA A 898 GLY HAy 1.0 0.0 4.43 218 161 A 898 GLY HAx A 899 ILE HA 1.0 0.0 4.43 219 162 A 918 ILE HA A 918 ILE HG1y 1.0 0.0 3.38 220 162 A 918 ILE HG1x A 918 ILE HA 1.0 0.0 3.38 221 163 A 918 ILE HG2% A 918 ILE HG1y 1.0 0.0 3.23 222 163 A 918 ILE HG1x A 918 ILE HG2% 1.0 0.0 3.23 223 164 A 919 LYS H A 918 ILE HG1y 1.0 0.0 4.28 224 164 A 919 LYS H A 918 ILE HG1x 1.0 0.0 4.28 225 165 A 875 LYS HA A 876 PRO HGx 1.0 0.0 4.11 226 165 A 875 LYS HA A 876 PRO HGy 1.0 0.0 4.11 227 166 A 919 LYS H A 919 LYS HBy 1.0 0.0 3.30 228 166 A 919 LYS H A 919 LYS HBx 1.0 0.0 3.30 229 167 A 867 ILE HB A 859 ILE HG1x 1.0 0.0 4.13 230 168 A 919 LYS H A 920 LYS HBy 1.0 0.0 4.80 231 168 A 919 LYS H A 920 LYS HBx 1.0 0.0 4.80 232 169 A 897 VAL H A 897 VAL HGx% 1.0 0.0 4.01 233 170 A 919 LYS H A 920 LYS HGx 1.0 0.0 4.30 234 170 A 919 LYS H A 920 LYS HGy 1.0 0.0 4.30 235 171 A 896 CYS H A 897 VAL HGx% 1.0 0.0 4.65 236 172 A 909 TRP HZ2 A 897 VAL HGx% 1.0 0.0 3.40 237 173 A 884 GLY H A 883 ILE HG1x 1.0 0.0 3.82 238 174 A 858 VAL H A 858 VAL HGy% 1.0 0.0 4.03 239 175 A 858 VAL H A 856 ALA HB% 1.0 0.0 3.92 240 176 A 859 ILE H A 858 VAL HGx% 1.0 0.0 4.19 241 177 A 899 ILE HD1% A 903 PRO HDy 1.0 0.0 4.09 242 178 A 857 TYR HD% A 856 ALA HB% 1.0 0.0 5.13 243 179 A 899 ILE HD1% A 903 PRO HGy 1.0 0.0 4.25 244 180 A 915 ALA HB% A 912 PRO HA 1.0 0.0 3.49 245 181 A 897 VAL HGy% A 899 ILE HD1% 1.0 0.0 3.28 246 182 A 899 ILE HB A 897 VAL HGy% 1.0 0.0 3.89 247 183 A 899 ILE H A 899 ILE HD1% 1.0 0.0 4.15 248 184 A 859 ILE H A 859 ILE HG1y 1.0 0.0 3.69 249 185 A 855 MET HA A 855 MET HGx 1.0 0.0 3.95 250 185 A 855 MET HA A 855 MET HGy 1.0 0.0 3.95 251 186 A 859 ILE H A 858 VAL HGy% 1.0 0.0 4.19 252 187 A 857 TYR H A 856 ALA HB% 1.0 0.0 3.54 253 188 A 865 ASN H A 865 ASN HBx 1.0 0.0 4.21 254 189 A 867 ILE H A 858 VAL HGy% 1.0 0.0 5.50 255 190 A 862 GLU H A 862 GLU HGx 1.0 0.0 3.48 256 190 A 862 GLU H A 862 GLU HGy 1.0 0.0 3.48 257 191 A 906 GLU H A 905 GLU HBy 1.0 0.0 4.43 258 192 A 884 GLY H A 883 ILE HG1y 1.0 0.0 4.09 259 193 A 863 TRP HE3 A 862 GLU HGx 1.0 0.0 4.61 260 193 A 862 GLU HGy A 863 TRP HE3 1.0 0.0 4.61 261 194 A 867 ILE HG2% A 869 ILE HD1% 1.0 0.0 3.56 262 195 A 900 MET H A 899 ILE HG2% 1.0 0.0 3.92 263 196 A 863 TRP HZ2 A 862 GLU HGx 1.0 0.0 4.54 264 196 A 862 GLU HGy A 863 TRP HZ2 1.0 0.0 4.54 265 197 P 5 GLN HA A 881 PRO HA 1.0 0.0 4.27 266 198 A 899 ILE H A 899 ILE HG2% 1.0 0.0 3.91 267 199 A 876 PRO HA A 869 ILE HA 1.0 0.0 3.44 268 200 A 901 ALA H A 899 ILE HG2% 1.0 0.0 3.28 269 201 A 881 PRO HBy A 894 TRP HZ2 1.0 0.0 4.85 270 202 A 881 PRO HBy A 894 TRP H 1.0 0.0 5.50 271 203 A 896 CYS H A 895 PRO HDx 1.0 0.0 4.34 272 204 A 899 ILE HA A 900 MET HBx 1.0 0.0 4.70 273 204 A 899 ILE HA A 900 MET HBy 1.0 0.0 4.70 274 205 A 899 ILE HG2% A 894 TRP H 1.0 0.0 5.50 275 206 A 896 CYS H A 895 PRO HGx 1.0 0.0 3.73 276 207 A 899 ILE HA A 900 MET HGy 1.0 0.0 4.63 277 207 A 899 ILE HA A 900 MET HGx 1.0 0.0 4.63 278 208 A 892 TYR H A 883 ILE HG2% 1.0 0.0 4.03 279 209 A 862 GLU H A 861 ASP H 1.0 0.0 4.48 280 210 A 900 MET H A 900 MET HBx 1.0 0.0 3.48 281 210 A 900 MET H A 900 MET HBy 1.0 0.0 3.48 282 211 A 862 GLU H A 864 GLY H 1.0 0.0 4.44 283 212 A 901 ALA H A 900 MET HBx 1.0 0.0 3.68 284 212 A 901 ALA H A 900 MET HBy 1.0 0.0 3.68 285 213 A 897 VAL HB A 909 TRP HE1 1.0 0.0 4.60 286 214 A 901 ALA HB% A 900 MET HBx 1.0 0.0 4.46 287 214 A 900 MET HBy A 901 ALA HB% 1.0 0.0 4.46 288 215 A 870 CYS HBy A 873 CYS H 1.0 0.0 4.36 289 216 A 903 PRO HA A 904 PRO HGy 1.0 0.0 4.15 290 216 A 903 PRO HA A 904 PRO HGx 1.0 0.0 4.15 291 217 A 869 ILE H A 868 TRP H 1.0 0.0 4.61 292 218 A 920 LYS H A 919 LYS HBy 1.0 0.0 3.93 293 218 A 920 LYS H A 919 LYS HBx 1.0 0.0 3.93 294 219 A 904 PRO HDy A 903 PRO HBy 1.0 0.0 3.60 295 219 A 903 PRO HBx A 904 PRO HDy 1.0 0.0 3.60 296 220 A 868 TRP H A 867 ILE HB 1.0 0.0 4.53 297 221 A 920 LYS H A 920 LYS HBy 1.0 0.0 3.44 298 221 A 920 LYS H A 920 LYS HBx 1.0 0.0 3.44 299 222 A 906 GLU H A 904 PRO HGy 1.0 0.0 4.32 300 222 A 906 GLU H A 904 PRO HGx 1.0 0.0 4.32 301 223 A 867 ILE HG1y A 868 TRP H 1.0 0.0 5.50 302 224 A 920 LYS H A 920 LYS HGx 1.0 0.0 3.88 303 224 A 920 LYS H A 920 LYS HGy 1.0 0.0 3.88 304 225 A 905 GLU H A 905 GLU HGx 1.0 0.0 3.37 305 225 A 905 GLU H A 905 GLU HGy 1.0 0.0 3.37 306 226 A 882 MET HE% A 868 TRP H 1.0 0.0 5.50 307 227 A 921 ASP H A 920 LYS HBy 1.0 0.0 3.84 308 227 A 921 ASP H A 920 LYS HBx 1.0 0.0 3.84 309 228 A 905 GLU H A 906 GLU HGx 1.0 0.0 4.65 310 228 A 905 GLU H A 906 GLU HGy 1.0 0.0 4.65 311 229 A 921 ASP H A 921 ASP HBy 1.0 0.0 3.46 312 229 A 921 ASP H A 921 ASP HBx 1.0 0.0 3.46 313 230 A 922 LYS H A 922 LYS HBx 1.0 0.0 3.47 314 230 A 922 LYS H A 922 LYS HBy 1.0 0.0 3.47 315 231 A 923 LYS H A 922 LYS HBx 1.0 0.0 4.39 316 231 A 922 LYS HBy A 923 LYS H 1.0 0.0 4.39 317 232 A 897 VAL HGy% A 892 TYR HBx 1.0 0.0 4.38 318 233 A 923 LYS HA A 924 HIS HBx 1.0 0.0 4.41 319 233 A 923 LYS HA A 924 HIS HBy 1.0 0.0 4.41 320 234 A 859 ILE HG2% A 867 ILE HB 1.0 0.0 5.07 321 235 A 924 HIS H A 924 HIS HBx 1.0 0.0 3.65 322 235 A 924 HIS HBy A 924 HIS H 1.0 0.0 3.65 323 236 A 882 MET HE% A 893 HIS H 1.0 0.0 4.16 324 237 A 882 MET HE% A 870 CYS H 1.0 0.0 4.26 325 238 A 882 MET HE% A 892 TYR HA 1.0 0.0 3.99 326 239 A 894 TRP HZ3 A 901 ALA HB% 1.0 0.0 4.49 327 240 A 882 MET HE% A 893 HIS HA 1.0 0.0 4.02 328 241 A 882 MET HE% A 877 ASP HA 1.0 0.0 3.68 329 242 A 919 LYS H A 918 ILE HA 1.0 0.0 3.51 330 243 P 11 THR HG2% P 12 GLY H 1.0 0.0 4.67 331 244 A 882 MET HE% A 891 TRP HBy 1.0 0.0 3.70 332 245 A 867 ILE HG2% A 876 PRO HGx 1.0 0.0 3.91 333 245 A 867 ILE HG2% A 876 PRO HGy 1.0 0.0 3.91 334 246 A 894 TRP HE1 P 3 THR HG2% 1.0 0.0 3.37 335 247 A 882 MET HE% A 882 MET HBy 1.0 0.0 3.79 336 248 A 903 PRO HA A 904 PRO HDy 1.0 0.0 3.23 337 249 A 863 TRP H A 862 GLU HGx 1.0 0.0 3.62 338 249 A 863 TRP H A 862 GLU HGy 1.0 0.0 3.62 339 250 A 867 ILE HG2% A 867 ILE HG1y 1.0 0.0 3.36 340 251 A 903 PRO HA A 904 PRO HDx 1.0 0.0 3.60 341 252 A 894 TRP HZ2 P 3 THR HG2% 1.0 0.0 3.22 342 253 A 903 PRO HA A 904 PRO HGy 1.0 0.0 4.74 343 254 A 883 ILE HG2% A 894 TRP H 1.0 0.0 4.85 344 255 A 891 TRP HZ3 P 3 THR HG2% 1.0 0.0 4.26 345 256 A 899 ILE HB A 894 TRP HA 1.0 0.0 3.95 346 257 A 883 ILE HG2% A 909 TRP HZ3 1.0 0.0 4.30 347 258 P 3 THR HG2% A 894 TRP HD1 1.0 0.0 4.62 348 259 P 3 THR HA A 883 ILE HA 1.0 0.0 4.01 349 260 A 883 ILE HD1% A 894 TRP HE1 1.0 0.0 4.20 350 261 A 915 ALA HB% A 915 ALA H 1.0 0.0 2.86 351 262 A 883 ILE HD1% A 883 ILE HA 1.0 0.0 4.15 352 263 A 899 ILE HD1% A 894 TRP HD1 1.0 0.0 5.19 353 264 P 7 ALA H P 6 THR HG2% 1.0 0.0 4.26 354 265 A 893 HIS HA A 882 MET HGx 1.0 0.0 4.00 355 266 A 883 ILE HG1y A 909 TRP HZ3 1.0 0.0 4.98 356 267 A 877 ASP H A 869 ILE HA 1.0 0.0 4.24 357 268 A 883 ILE HG2% A 891 TRP HE3 1.0 0.0 5.50 358 269 A 883 ILE HG2% A 892 TYR HD% 1.0 0.0 5.50 359 270 A 894 TRP HE1 A 899 ILE HD1% 1.0 0.0 5.29 360 271 A 867 ILE H A 868 TRP H 1.0 0.0 4.59 361 272 A 905 GLU HA A 905 GLU HGx 1.0 0.0 3.64 362 272 A 905 GLU HGy A 905 GLU HA 1.0 0.0 3.64 363 273 A 883 ILE HD1% A 909 TRP HE1 1.0 0.0 4.83 364 274 A 867 ILE HD1% A 868 TRP H 1.0 0.0 4.34 365 275 A 906 GLU H A 905 GLU HBx 1.0 0.0 3.77 366 275 A 906 GLU H A 905 GLU HBy 1.0 0.0 3.77 367 276 A 883 ILE HG1x A 883 ILE H 1.0 0.0 4.76 368 277 A 867 ILE H A 860 ARG HA 1.0 0.0 4.10 369 278 A 906 GLU H A 905 GLU HGx 1.0 0.0 4.14 370 278 A 906 GLU H A 905 GLU HGy 1.0 0.0 4.14 371 279 A 859 ILE H A 867 ILE H 1.0 0.0 3.64 372 280 A 906 GLU H A 906 GLU HBy 1.0 0.0 3.19 373 280 A 906 GLU H A 906 GLU HBx 1.0 0.0 3.19 374 281 A 867 ILE H A 866 GLN HGy 1.0 0.0 5.04 375 282 A 906 GLU HA A 906 GLU HGx 1.0 0.0 3.47 376 282 A 906 GLU HGy A 906 GLU HA 1.0 0.0 3.47 377 283 A 877 ASP H A 882 MET HE% 1.0 0.0 4.76 378 284 A 907 MET H A 906 GLU HGx 1.0 0.0 4.11 379 284 A 906 GLU HGy A 907 MET H 1.0 0.0 4.11 380 285 A 896 CYS H A 895 PRO HBx 1.0 0.0 3.90 381 286 A 908 GLN H A 908 GLN HGx 1.0 0.0 3.38 382 286 A 908 GLN H A 908 GLN HGy 1.0 0.0 3.38 383 287 A 898 GLY H A 897 VAL H 1.0 0.0 3.23 384 288 A 909 TRP H A 908 GLN HGx 1.0 0.0 4.43 385 288 A 909 TRP H A 908 GLN HGy 1.0 0.0 4.43 386 289 A 917 LYS H A 916 ASN H 1.0 0.0 3.34 387 290 A 910 PHE HE% A 908 GLN HGx 1.0 0.0 4.80 388 290 A 908 GLN HGy A 910 PHE HE% 1.0 0.0 4.80 389 291 A 921 ASP H A 921 ASP HBy 1.0 0.0 4.00 390 292 A 910 PHE HZ A 908 GLN HGx 1.0 0.0 4.80 391 292 A 908 GLN HGy A 910 PHE HZ 1.0 0.0 4.80 392 293 A 911 CYS HA A 912 PRO HDx 1.0 0.0 3.49 393 293 A 911 CYS HA A 912 PRO HDy 1.0 0.0 3.49 394 294 A 860 ARG HA A 866 GLN HA 1.0 0.0 3.91 395 295 A 870 CYS HA A 871 PRO HDy 1.0 0.0 3.63 396 296 A 877 ASP HA A 893 HIS HE2 1.0 0.0 4.15 397 297 A 897 VAL HGx% A 892 TYR HA 1.0 0.0 4.60 398 298 P 3 THR HG2% A 883 ILE H 1.0 0.0 5.00 399 299 A 915 ALA HA A 910 PHE HBx 1.0 0.0 4.89 400 300 A 882 MET HE% A 878 ASP H 1.0 0.0 5.02 401 301 A 915 ALA HA A 914 CYS HBx 1.0 0.0 4.39 402 302 A 893 HIS HA A 894 TRP HD1 1.0 0.0 4.45 403 303 A 915 ALA HB% A 911 CYS H 1.0 0.0 5.44 404 304 A 876 PRO HDx A 875 LYS HA 1.0 0.0 3.38 405 305 A 909 TRP HA A 910 PHE HBy 1.0 0.0 4.64 406 306 A 886 ASP HBy A 887 ASP H 1.0 0.0 4.95 407 307 A 875 LYS HA A 875 LYS HDx 1.0 0.0 4.31 408 307 A 875 LYS HDy A 875 LYS HA 1.0 0.0 4.31 409 308 A 885 CYS HA A 886 ASP HBx 1.0 0.0 4.47 410 309 A 883 ILE H A 891 TRP HBx 1.0 0.0 5.50 411 310 A 869 ILE HG2% A 875 LYS HA 1.0 0.0 4.38 412 311 A 903 PRO HA A 904 PRO HGx 1.0 0.0 4.74 413 312 A 885 CYS HBy A 887 ASP H 1.0 0.0 5.33 414 313 A 897 VAL HGx% A 896 CYS HA 1.0 0.0 5.13 415 314 A 888 CYS H A 887 ASP H 1.0 0.0 3.41 416 315 A 914 CYS HBx A 887 ASP H 1.0 0.0 5.50 417 316 A 897 VAL HGy% A 896 CYS HA 1.0 0.0 5.50 418 317 A 889 ASP H A 887 ASP H 1.0 0.0 4.47 419 318 A 886 ASP H A 885 CYS HBx 1.0 0.0 4.95 420 319 A 919 LYS H A 919 LYS HBy 1.0 0.0 3.84 421 320 A 905 GLU HA A 904 PRO HA 1.0 0.0 4.41 422 321 A 913 LYS H A 912 PRO HBy 1.0 0.0 3.80 423 321 A 913 LYS H A 912 PRO HBx 1.0 0.0 3.80 424 322 A 879 GLY H A 878 ASP H 1.0 0.0 3.15 425 323 A 911 CYS H A 887 ASP HBy 1.0 0.0 5.38 426 324 A 917 LYS H A 917 LYS HBx 1.0 0.0 3.70 427 325 A 894 TRP HA A 882 MET HA 1.0 0.0 5.21 428 326 A 915 ALA HB% A 912 PRO HBy 1.0 0.0 4.79 429 326 A 915 ALA HB% A 912 PRO HBx 1.0 0.0 4.79 430 327 A 893 HIS HD2 A 878 ASP H 1.0 0.0 4.77 431 328 A 894 TRP HA A 883 ILE H 1.0 0.0 4.91 432 329 A 855 MET H A 855 MET HBy 1.0 0.0 4.12 433 330 A 894 TRP HA A 899 ILE HG2% 1.0 0.0 4.49 434 331 A 913 LYS H A 913 LYS HBy 1.0 0.0 3.06 435 331 A 913 LYS H A 913 LYS HBx 1.0 0.0 3.06 436 332 A 910 PHE HD% A 911 CYS H 1.0 0.0 4.41 437 333 A 877 ASP H A 876 PRO HGx 1.0 0.0 4.06 438 333 A 877 ASP H A 876 PRO HGy 1.0 0.0 4.06 439 334 A 893 HIS HBy A 896 CYS HBy 1.0 0.0 4.51 440 335 A 913 LYS H A 913 LYS HGy 1.0 0.0 3.56 441 335 A 913 LYS H A 913 LYS HGx 1.0 0.0 3.56 442 336 A 890 ASP H A 891 TRP H 1.0 0.0 4.42 443 337 A 899 ILE H A 899 ILE HG1y 1.0 0.0 3.71 444 338 A 913 LYS H A 913 LYS HDy 1.0 0.0 5.00 445 338 A 913 LYS H A 913 LYS HDx 1.0 0.0 5.00 446 339 A 915 ALA H A 911 CYS H 1.0 0.0 5.28 447 340 A 899 ILE H A 897 VAL HGy% 1.0 0.0 3.58 448 341 A 913 LYS H A 916 ASN HBy 1.0 0.0 5.26 449 341 A 913 LYS H A 916 ASN HBx 1.0 0.0 5.26 450 342 A 914 CYS H A 915 ALA H 1.0 0.0 3.18 451 343 A 905 GLU H A 907 MET H 1.0 0.0 4.47 452 344 A 913 LYS HA A 913 LYS HGy 1.0 0.0 3.57 453 344 A 913 LYS HGx A 913 LYS HA 1.0 0.0 3.57 454 345 A 913 LYS H A 915 ALA H 1.0 0.0 4.14 455 346 A 866 GLN HE2y A 858 VAL HGy% 1.0 0.0 4.71 456 347 A 913 LYS HA A 913 LYS HDy 1.0 0.0 4.40 457 347 A 913 LYS HDx A 913 LYS HA 1.0 0.0 4.40 458 348 A 877 ASP H A 868 TRP H 1.0 0.0 4.74 459 349 A 866 GLN HE2x A 858 VAL HGx% 1.0 0.0 4.34 460 350 A 913 LYS HA A 916 ASN HBy 1.0 0.0 4.16 461 350 A 916 ASN HBx A 913 LYS HA 1.0 0.0 4.16 462 351 A 861 ASP H A 861 ASP HBy 1.0 0.0 4.07 463 352 A 913 LYS HA A 916 ASN HD2y 1.0 0.0 5.18 464 352 A 916 ASN HD2x A 913 LYS HA 1.0 0.0 5.18 465 353 A 896 CYS H A 895 PRO HDy 1.0 0.0 4.31 466 354 A 893 HIS HBx A 895 PRO HDy 1.0 0.0 3.93 467 355 A 895 PRO HDx A 894 TRP HBy 1.0 0.0 3.90 468 356 A 876 PRO HDy A 875 LYS HA 1.0 0.0 3.45 469 357 A 875 LYS HBy A 876 PRO HDy 1.0 0.0 4.05 470 358 A 866 GLN H A 865 ASN HA 1.0 0.0 2.93 471 359 A 903 PRO HDy A 902 ALA HA 1.0 0.0 3.29 472 360 A 903 PRO HBx A 904 PRO HDy 1.0 0.0 4.27 473 361 A 911 CYS HBx A 885 CYS HBx 1.0 0.0 4.99 474 362 P 2 ARG HA P 3 THR H 1.0 0.0 3.19 475 363 A 881 PRO HDy A 880 SER HBx 1.0 0.0 4.21 476 364 A 914 CYS HA A 917 LYS HGx 1.0 0.0 4.75 477 365 A 911 CYS H A 910 PHE HA 1.0 0.0 3.18 478 366 A 880 SER HBx A 881 PRO HDx 1.0 0.0 4.21 479 367 A 914 CYS HA A 917 LYS HBy 1.0 0.0 4.57 480 368 A 891 TRP H A 890 ASP HA 1.0 0.0 3.11 481 369 A 914 CYS HA A 917 LYS HEx 1.0 0.0 3.86 482 369 A 914 CYS HA A 917 LYS HEy 1.0 0.0 3.86 483 370 A 882 MET HGx A 891 TRP HE3 1.0 0.0 5.50 484 371 A 872 GLY H A 870 CYS HA 1.0 0.0 4.62 485 372 A 879 GLY H A 877 ASP HBy 1.0 0.0 4.71 486 373 A 874 ASN H A 873 CYS H 1.0 0.0 3.04 487 374 A 890 ASP H A 891 TRP HA 1.0 0.0 5.11 488 375 A 883 ILE HG1x A 884 GLY HAx 1.0 0.0 5.20 489 376 A 862 GLU H A 863 TRP H 1.0 0.0 3.56 490 377 A 892 TYR H A 891 TRP HA 1.0 0.0 3.20 491 378 A 914 CYS H A 915 ALA HB% 1.0 0.0 4.33 492 379 A 864 GLY HAy A 860 ARG HBy 1.0 0.0 4.55 493 379 A 864 GLY HAy A 860 ARG HBx 1.0 0.0 4.55 494 380 A 913 LYS HBx A 913 LYS HEx 1.0 0.0 4.26 495 380 A 913 LYS HBy A 913 LYS HEx 1.0 0.0 4.26 496 380 A 913 LYS HEy A 913 LYS HBy 1.0 0.0 4.26 497 380 A 913 LYS HBx A 913 LYS HEy 1.0 0.0 4.26 498 381 A 906 GLU H A 905 GLU H 1.0 0.0 3.54 499 382 A 893 HIS HA A 883 ILE H 1.0 0.0 4.92 500 383 A 872 GLY HAy A 896 CYS HBx 1.0 0.0 5.48 501 384 A 914 CYS H A 913 LYS HBy 1.0 0.0 3.26 502 384 A 914 CYS H A 913 LYS HBx 1.0 0.0 3.26 503 385 A 865 ASN H A 861 ASP H 1.0 0.0 3.70 504 386 A 894 TRP H A 893 HIS HA 1.0 0.0 3.31 505 387 A 866 GLN HGx A 858 VAL HGy% 1.0 0.0 4.64 506 388 A 915 ALA H A 913 LYS HBy 1.0 0.0 5.34 507 388 A 915 ALA H A 913 LYS HBx 1.0 0.0 5.34 508 389 A 865 ASN H A 864 GLY H 1.0 0.0 3.22 509 390 A 897 VAL H A 896 CYS HBx 1.0 0.0 4.47 510 391 A 899 ILE HG2% A 901 ALA HA 1.0 0.0 4.20 511 392 A 913 LYS HEx A 913 LYS HGy 1.0 0.0 3.37 512 392 A 913 LYS HEy A 913 LYS HGy 1.0 0.0 3.37 513 392 A 913 LYS HGx A 913 LYS HEx 1.0 0.0 3.37 514 392 A 913 LYS HGx A 913 LYS HEy 1.0 0.0 3.37 515 393 A 909 TRP H A 910 PHE HZ 1.0 0.0 4.84 516 394 A 893 HIS HBx A 894 TRP H 1.0 0.0 4.14 517 395 A 914 CYS H A 913 LYS HGy 1.0 0.0 5.08 518 395 A 914 CYS H A 913 LYS HGx 1.0 0.0 5.08 519 396 A 872 GLY H A 873 CYS H 1.0 0.0 3.40 520 397 A 875 LYS H A 874 ASN HBy 1.0 0.0 4.92 521 398 A 915 ALA HA A 918 ILE HG1y 1.0 0.0 3.67 522 398 A 915 ALA HA A 918 ILE HG1x 1.0 0.0 3.67 523 399 A 890 ASP H A 888 CYS H 1.0 0.0 4.85 524 400 A 905 GLU H A 905 GLU HBy 1.0 0.0 3.68 525 401 A 915 ALA HB% A 916 ASN HBy 1.0 0.0 4.57 526 401 A 915 ALA HB% A 916 ASN HBx 1.0 0.0 4.57 527 402 A 911 CYS H A 885 CYS H 1.0 0.0 5.50 528 403 A 913 LYS H A 912 PRO HBx 1.0 0.0 4.52 529 404 A 916 ASN H A 916 ASN HBy 1.0 0.0 3.06 530 404 A 916 ASN H A 916 ASN HBx 1.0 0.0 3.06 531 405 A 879 GLY H A 880 SER H 1.0 0.0 3.39 532 406 A 909 TRP H A 908 GLN H 1.0 0.0 4.63 533 407 A 916 ASN H A 918 ILE HG1y 1.0 0.0 4.27 534 407 A 916 ASN H A 918 ILE HG1x 1.0 0.0 4.27 535 408 A 916 ASN HA A 916 ASN HD2y 1.0 0.0 4.51 536 408 A 916 ASN HD2x A 916 ASN HA 1.0 0.0 4.51 537 409 A 915 ALA HA A 917 LYS HEx 1.0 0.0 4.87 538 409 A 915 ALA HA A 917 LYS HEy 1.0 0.0 4.87 539 410 A 867 ILE HB A 859 ILE HG1y 1.0 0.0 4.13 540 411 A 857 TYR HA A 869 ILE HB 1.0 0.0 4.15 541 412 A 899 ILE H A 899 ILE HB 1.0 0.0 4.02 542 413 A 909 TRP H A 886 ASP HBy 1.0 0.0 5.26 543 414 A 876 PRO HA A 877 ASP H 1.0 0.0 3.24 544 415 A 883 ILE HG2% A 909 TRP HH2 1.0 0.0 4.45 545 416 A 876 PRO HA A 870 CYS H 1.0 0.0 3.81 546 417 A 883 ILE HG2% A 892 TYR HBx 1.0 0.0 4.78 547 418 A 919 LYS H A 918 ILE HG2% 1.0 0.0 4.09 548 419 A 893 HIS HD2 A 893 HIS HA 1.0 0.0 4.09 549 420 A 883 ILE HG2% A 885 CYS HBy 1.0 0.0 4.70 550 421 A 883 ILE HG1x A 903 PRO HDy 1.0 0.0 5.50 551 422 A 896 CYS H A 893 HIS HBy 1.0 0.0 3.51 552 423 A 901 ALA H A 899 ILE HD1% 1.0 0.0 4.42 553 424 A 883 ILE HG2% A 899 ILE HG1y 1.0 0.0 4.52 554 425 A 910 PHE HD% A 910 PHE HA 1.0 0.0 3.84 555 426 A 869 ILE HD1% A 876 PRO HBx 1.0 0.0 3.99 556 427 A 882 MET HE% A 868 TRP HBy 1.0 0.0 3.76 557 428 A 891 TRP HZ3 A 883 ILE HA 1.0 0.0 4.11 558 429 A 867 ILE HG2% A 876 PRO HA 1.0 0.0 4.43 559 430 A 890 ASP H A 889 ASP H 1.0 0.0 3.55 560 431 A 892 TYR HA A 892 TYR HD% 1.0 0.0 4.63 561 432 A 867 ILE HG2% A 877 ASP HBx 1.0 0.0 4.65 562 433 A 869 ILE H A 870 CYS H 1.0 0.0 4.62 563 434 A 882 MET HA A 893 HIS HA 1.0 0.0 3.89 564 435 A 914 CYS HA A 916 ASN H 1.0 0.0 4.49 565 436 A 867 ILE HG2% A 868 TRP HBx 1.0 0.0 5.04 566 437 A 859 ILE H A 858 VAL H 1.0 0.0 4.66 567 438 A 914 CYS H A 913 LYS HBx 1.0 0.0 3.80 568 439 A 868 TRP HZ2 A 858 VAL HGy% 1.0 0.0 4.72 569 440 A 907 MET H A 908 GLN H 1.0 0.0 4.60 570 441 A 914 CYS H A 912 PRO HA 1.0 0.0 5.24 571 442 A 923 LYS HA A 924 HIS H 1.0 0.0 3.28 572 443 A 868 TRP HA A 858 VAL HGy% 1.0 0.0 4.58 573 444 A 874 ASN H A 875 LYS H 1.0 0.0 3.39 574 445 A 859 ILE H A 860 ARG H 1.0 0.0 4.47 575 446 A 868 TRP HD1 A 858 VAL HGx% 1.0 0.0 4.96 576 447 A 875 LYS H A 873 CYS H 1.0 0.0 4.05 577 448 A 856 ALA H A 855 MET H 1.0 0.0 4.17 578 449 A 894 TRP HH2 A 902 ALA H 1.0 0.0 3.64 579 450 A 905 GLU H A 904 PRO HBy 1.0 0.0 3.94 580 451 A 894 TRP HZ2 A 902 ALA H 1.0 0.0 4.52 581 452 A 905 GLU H A 905 GLU HBx 1.0 0.0 3.68 582 453 A 860 ARG H A 861 ASP H 1.0 0.0 4.61 583 454 A 902 ALA H A 901 ALA HA 1.0 0.0 2.97 584 455 A 857 TYR HD% A 857 TYR H 1.0 0.0 3.80 585 456 A 902 ALA H A 901 ALA HB% 1.0 0.0 3.10 586 457 A 883 ILE HG2% A 883 ILE HG1x 1.0 0.0 3.90 587 458 A 902 ALA H A 899 ILE HG2% 1.0 0.0 4.79 588 459 A 899 ILE HB A 883 ILE HG2% 1.0 0.0 4.40 589 460 A 883 ILE HG2% P 3 THR HG2% 1.0 0.0 4.41 590 461 A 883 ILE HG2% A 883 ILE HG1y 1.0 0.0 3.75 591 462 A 859 ILE HD1% A 859 ILE HB 1.0 0.0 3.26 592 463 A 918 ILE HD1% A 918 ILE HB 1.0 0.0 3.31 593 464 A 883 ILE HG1y P 1 ALA HB% 1.0 0.0 3.96 594 465 A 897 VAL HGx% A 897 VAL HA 1.0 0.0 3.27 595 466 P 2 ARG HA P 2 ARG HGx 1.0 0.0 3.43 596 466 P 2 ARG HA P 2 ARG HGy 1.0 0.0 3.43 597 467 A 869 ILE HD1% A 867 ILE HB 1.0 0.0 4.34 598 468 A 860 ARG H A 859 ILE HD1% 1.0 0.0 4.44 599 469 A 874 ASN H A 869 ILE HG2% 1.0 0.0 4.52 600 470 A 857 TYR HA A 869 ILE HG2% 1.0 0.0 4.83 601 471 A 897 VAL HGy% A 892 TYR HBy 1.0 0.0 3.92 602 472 A 894 TRP H A 896 CYS HBy 1.0 0.0 4.98 603 473 A 883 ILE HG2% A 897 VAL HGx% 1.0 0.0 4.43 604 474 A 914 CYS H A 912 PRO HDx 1.0 0.0 4.79 605 474 A 914 CYS H A 912 PRO HDy 1.0 0.0 4.79 606 475 A 867 ILE HG2% A 877 ASP HBy 1.0 0.0 4.65 607 476 A 868 TRP HA A 858 VAL HGx% 1.0 0.0 4.58 608 477 A 900 MET H A 900 MET HGy 1.0 0.0 3.99 609 478 A 882 MET HE% A 891 TRP HA 1.0 0.0 4.43 610 479 A 866 GLN HGx A 858 VAL HGx% 1.0 0.0 4.64 611 480 A 921 ASP HBx A 922 LYS H 1.0 0.0 4.91 612 481 A 899 ILE HD1% A 903 PRO HDx 1.0 0.0 4.58 613 482 A 866 GLN HBy A 858 VAL HGx% 1.0 0.0 4.48 614 483 A 922 LYS H A 921 ASP HBy 1.0 0.0 4.91 615 484 A 883 ILE HD1% A 903 PRO HDy 1.0 0.0 4.51 616 485 A 868 TRP HA A 858 VAL HA 1.0 0.0 4.03 617 486 A 861 ASP HBx A 864 GLY H 1.0 0.0 5.01 618 487 A 857 TYR HE% A 871 PRO HBy 1.0 0.0 5.20 619 488 A 914 CYS H A 911 CYS H 1.0 0.0 4.59 620 489 A 856 ALA H A 855 MET HGx 1.0 0.0 4.92 621 489 A 856 ALA H A 855 MET HGy 1.0 0.0 4.92 622 490 A 857 TYR HD% A 869 ILE HD1% 1.0 0.0 4.85 623 491 A 914 CYS H A 913 LYS H 1.0 0.0 3.12 624 492 A 905 GLU H A 905 GLU HGx 1.0 0.0 3.90 625 493 A 883 ILE HG1y P 3 THR HG2% 1.0 0.0 4.65 626 494 A 914 CYS H A 916 ASN H 1.0 0.0 4.49 627 495 A 867 ILE H A 866 GLN HGx 1.0 0.0 4.11 628 496 P 3 THR HG2% A 883 ILE HB 1.0 0.0 4.05 629 497 A 888 CYS H A 889 ASP H 1.0 0.0 3.50 630 498 P 8 ARG H P 8 ARG HGy 1.0 0.0 4.91 631 498 P 8 ARG H P 8 ARG HGx 1.0 0.0 4.91 632 499 A 883 ILE HD1% P 1 ALA HA 1.0 0.0 4.85 633 500 A 877 ASP H A 878 ASP H 1.0 0.0 4.71 634 501 A 859 ILE HD1% A 867 ILE HB 1.0 0.0 4.39 635 502 A 863 TRP H A 864 GLY H 1.0 0.0 2.90 636 503 A 863 TRP H A 863 TRP HE3 1.0 0.0 4.04 637 504 A 875 LYS H A 870 CYS H 1.0 0.0 4.27 638 505 A 893 HIS HE1 A 870 CYS H 1.0 0.0 3.94 639 506 A 867 ILE HG1y A 866 GLN HA 1.0 0.0 4.21 640 507 A 899 ILE H A 897 VAL H 1.0 0.0 3.90 641 508 A 867 ILE HG2% A 867 ILE HA 1.0 0.0 3.45 642 509 A 907 MET HA A 907 MET HGx 1.0 0.0 3.45 643 509 A 907 MET HA A 907 MET HGy 1.0 0.0 3.45 644 510 A 897 VAL HGy% A 894 TRP HA 1.0 0.0 3.53 645 511 A 869 ILE HG2% A 874 ASN HA 1.0 0.0 3.19 646 512 A 908 GLN HA A 908 GLN HGx 1.0 0.0 3.72 647 513 A 859 ILE HA A 859 ILE HG2% 1.0 0.0 3.14 648 514 P 6 THR HG2% P 6 THR HA 1.0 0.0 3.34 649 515 A 869 ILE HG2% A 869 ILE HA 1.0 0.0 3.41 650 516 A 914 CYS HA A 917 LYS HGy 1.0 0.0 3.70 651 517 A 883 ILE HD1% A 902 ALA HA 1.0 0.0 4.82 652 518 A 876 PRO HDy A 869 ILE HG2% 1.0 0.0 4.94 653 519 A 876 PRO HDy A 869 ILE HD1% 1.0 0.0 5.42 654 520 A 885 CYS HBy A 911 CYS HA 1.0 0.0 5.19 655 521 A 862 GLU HA A 861 ASP HA 1.0 0.0 4.53 656 522 A 917 LYS H A 915 ALA HB% 1.0 0.0 5.05 657 523 A 861 ASP HA A 862 GLU HGx 1.0 0.0 4.64 658 523 A 862 GLU HGy A 861 ASP HA 1.0 0.0 4.64 659 524 A 888 CYS HBy A 889 ASP H 1.0 0.0 4.40 660 525 A 871 PRO HGy A 870 CYS HA 1.0 0.0 4.60 661 526 A 873 CYS H A 873 CYS HBx 1.0 0.0 3.95 662 527 A 891 TRP HE3 A 891 TRP HA 1.0 0.0 4.78 663 528 A 860 ARG HA A 860 ARG HDx 1.0 0.0 4.28 664 528 A 860 ARG HDy A 860 ARG HA 1.0 0.0 4.28 665 529 A 864 GLY H A 863 TRP HBy 1.0 0.0 4.42 666 530 A 892 TYR HD% A 891 TRP HA 1.0 0.0 5.34 667 531 A 862 GLU HA A 862 GLU HGx 1.0 0.0 3.73 668 531 A 862 GLU HA A 862 GLU HGy 1.0 0.0 3.73 669 532 A 918 ILE H A 915 ALA HA 1.0 0.0 4.20 670 533 A 910 PHE HE% A 887 ASP HA 1.0 0.0 4.49 671 534 A 866 GLN HA A 866 GLN HGx 1.0 0.0 4.21 672 535 A 892 TYR H A 883 ILE H 1.0 0.0 3.79 673 536 A 867 ILE HD1% A 867 ILE HB 1.0 0.0 3.51 674 537 A 898 GLY H A 899 ILE H 1.0 0.0 3.41 675 538 A 894 TRP H A 883 ILE H 1.0 0.0 4.94 676 539 A 867 ILE HG2% A 867 ILE HD1% 1.0 0.0 3.27 677 540 A 891 TRP H A 868 TRP HD1 1.0 0.0 4.25 678 541 A 910 PHE HE% A 887 ASP H 1.0 0.0 4.52 679 542 A 867 ILE HG2% A 867 ILE HG1x 1.0 0.0 3.39 680 543 A 868 TRP H A 868 TRP HD1 1.0 0.0 5.23 681 544 A 910 PHE HD% A 887 ASP H 1.0 0.0 4.00 682 545 A 869 ILE HD1% A 869 ILE HA 1.0 0.0 3.53 683 546 A 868 TRP HD1 A 891 TRP HD1 1.0 0.0 3.64 684 547 A 886 ASP H A 887 ASP H 1.0 0.0 3.95 685 548 A 869 ILE HD1% A 869 ILE HB 1.0 0.0 3.66 686 549 A 864 GLY H A 863 TRP HE3 1.0 0.0 5.26 687 550 A 869 ILE HG2% A 869 ILE HG1x 1.0 0.0 3.63 688 551 A 909 TRP H A 908 GLN HE2x 1.0 0.0 4.25 689 552 A 884 GLY H A 885 CYS H 1.0 0.0 4.73 690 553 A 893 HIS HE1 A 875 LYS H 1.0 0.0 4.09 691 554 A 917 LYS H A 915 ALA H 1.0 0.0 4.69 692 555 A 918 ILE HA A 918 ILE HG2% 1.0 0.0 3.29 693 556 A 891 TRP H A 891 TRP HD1 1.0 0.0 3.89 694 557 A 876 PRO HDy A 875 LYS HBx 1.0 0.0 4.05 695 558 A 881 PRO HDy A 880 SER HA 1.0 0.0 3.40 696 559 A 880 SER HA A 881 PRO HDx 1.0 0.0 3.40 697 560 P 2 ARG HBx P 2 ARG HDy 1.0 0.0 3.10 698 560 P 2 ARG HBx P 2 ARG HDx 1.0 0.0 3.10 699 561 A 899 ILE HB A 894 TRP HBx 1.0 0.0 3.06 700 562 A 875 LYS HEx A 875 LYS HGy 1.0 0.0 3.40 701 562 A 875 LYS HEy A 875 LYS HGy 1.0 0.0 3.40 702 563 A 860 ARG HBx A 860 ARG HDx 1.0 0.0 3.15 703 563 A 860 ARG HBy A 860 ARG HDx 1.0 0.0 3.15 704 563 A 860 ARG HDy A 860 ARG HBx 1.0 0.0 3.15 705 563 A 860 ARG HDy A 860 ARG HBy 1.0 0.0 3.15 706 564 A 897 VAL HGx% A 892 TYR HBx 1.0 0.0 3.43 707 565 A 897 VAL HGx% A 892 TYR HBy 1.0 0.0 3.49 708 566 A 875 LYS HDy A 875 LYS HBx 1.0 0.0 3.83 709 566 A 875 LYS HBx A 875 LYS HDx 1.0 0.0 3.83 710 567 A 882 MET HE% A 870 CYS HBx 1.0 0.0 3.49 711 568 A 882 MET HE% A 882 MET HGx 1.0 0.0 3.65 712 569 A 891 TRP HA A 884 GLY HAy 1.0 0.0 3.93 713 570 A 892 TYR H A 891 TRP HBx 1.0 0.0 4.24 714 571 A 896 CYS H A 894 TRP H 1.0 0.0 4.50 715 572 A 897 VAL HGy% A 897 VAL HA 1.0 0.0 4.20 716 573 A 899 ILE H A 896 CYS H 1.0 0.0 4.72 717 574 A 899 ILE HD1% A 899 ILE HA 1.0 0.0 3.49 718 575 A 894 TRP HH2 A 902 ALA HA 1.0 0.0 3.87 719 576 A 891 TRP HE3 A 883 ILE H 1.0 0.0 4.25 720 577 A 866 GLN HBx A 868 TRP HZ3 1.0 0.0 4.10 721 578 A 899 ILE HA A 899 ILE HG2% 1.0 0.0 3.54 722 579 A 892 TYR H A 892 TYR HD% 1.0 0.0 4.12 723 580 A 909 TRP H P 1 ALA HB% 1.0 0.0 3.94 724 581 A 899 ILE HG1x A 899 ILE HG2% 1.0 0.0 3.63 725 582 A 894 TRP HZ3 A 902 ALA H 1.0 0.0 4.46 726 583 A 891 TRP HZ3 P 2 ARG HGx 1.0 0.0 4.92 727 583 A 891 TRP HZ3 P 2 ARG HGy 1.0 0.0 4.92 728 584 A 905 GLU HA A 905 GLU HGx 1.0 0.0 4.18 729 585 A 910 PHE HD% A 910 PHE H 1.0 0.0 3.58 730 586 A 891 TRP HH2 P 2 ARG HGx 1.0 0.0 3.58 731 586 A 891 TRP HH2 P 2 ARG HGy 1.0 0.0 3.58 732 587 A 867 ILE H A 866 GLN HBy 1.0 0.0 4.13 733 588 P 1 ALA HB% A 909 TRP HBx 1.0 0.0 3.39 734 589 A 867 ILE H A 859 ILE HB 1.0 0.0 5.50 735 590 A 892 TYR H A 909 TRP HZ3 1.0 0.0 4.98 736 591 A 909 TRP HBy P 1 ALA HB% 1.0 0.0 3.42 737 592 A 867 ILE HG1x A 861 ASP H 1.0 0.0 4.88 738 593 P 3 THR HG2% A 902 ALA HA 1.0 0.0 4.02 739 594 A 876 PRO HDx A 869 ILE HG2% 1.0 0.0 4.38 740 595 A 867 ILE H A 859 ILE HG2% 1.0 0.0 5.50 741 596 A 884 GLY H A 891 TRP HZ3 1.0 0.0 4.38 742 597 P 5 GLN HA A 882 MET H 1.0 0.0 4.58 743 598 A 897 VAL HGy% A 893 HIS HBx 1.0 0.0 5.47 744 599 A 859 ILE HD1% A 867 ILE H 1.0 0.0 5.50 745 600 P 8 ARG HA P 8 ARG HGy 1.0 0.0 3.77 746 600 P 8 ARG HGx P 8 ARG HA 1.0 0.0 3.77 747 601 A 897 VAL HGx% A 911 CYS HA 1.0 0.0 4.21 748 602 A 865 ASN HBy A 861 ASP H 1.0 0.0 4.43 749 603 A 869 ILE HG2% A 857 TYR HBy 1.0 0.0 4.75 750 604 P 3 THR H P 2 ARG HBx 1.0 0.0 4.22 751 605 A 869 ILE HD1% A 857 TYR HBy 1.0 0.0 5.18 752 606 A 854 ALA HB% A 854 ALA H 1.0 0.0 3.77 753 607 A 897 VAL HGx% A 896 CYS HBy 1.0 0.0 4.49 754 608 A 897 VAL HGy% A 896 CYS HBy 1.0 0.0 4.90 755 609 A 897 VAL HGy% A 894 TRP H 1.0 0.0 4.71 756 610 A 870 CYS HBy A 869 ILE HG2% 1.0 0.0 4.66 757 611 A 899 ILE HD1% A 902 ALA HA 1.0 0.0 5.11 758 612 A 897 VAL HGx% A 912 PRO HDx 1.0 0.0 3.72 759 612 A 897 VAL HGx% A 912 PRO HDy 1.0 0.0 3.72 760 613 A 906 GLU HA A 906 GLU HGx 1.0 0.0 3.98 761 614 A 913 LYS HGx A 913 LYS HA 1.0 0.0 4.20 762 615 A 913 LYS HA A 913 LYS HGy 1.0 0.0 4.20 763 616 A 913 LYS HEx A 913 LYS HGy 1.0 0.0 4.09 764 616 A 913 LYS HEy A 913 LYS HGy 1.0 0.0 4.09 765 617 A 917 LYS HGy A 917 LYS HA 1.0 0.0 4.06 766 618 A 894 TRP HD1 A 883 ILE H 1.0 0.0 4.09 767 619 A 917 LYS HGx A 917 LYS HA 1.0 0.0 3.70 768 620 A 894 TRP H A 894 TRP HD1 1.0 0.0 3.72 769 621 A 884 GLY H P 3 THR HA 1.0 0.0 4.48 770 622 A 917 LYS HGy A 917 LYS HDx 1.0 0.0 2.93 771 622 A 917 LYS HDy A 917 LYS HGy 1.0 0.0 2.93 772 623 A 891 TRP HH2 P 2 ARG HBx 1.0 0.0 4.05 773 624 A 917 LYS HBy A 917 LYS HEx 1.0 0.0 4.28 774 624 A 917 LYS HBy A 917 LYS HEy 1.0 0.0 4.28 775 625 A 882 MET HA A 883 ILE H 1.0 0.0 3.50 776 626 A 917 LYS HBx A 917 LYS HEx 1.0 0.0 4.02 777 626 A 917 LYS HBx A 917 LYS HEy 1.0 0.0 4.02 778 627 A 893 HIS H A 892 TYR HA 1.0 0.0 3.19 779 628 A 918 ILE HD1% A 918 ILE HG2% 1.0 0.0 3.26 780 629 A 882 MET HA A 894 TRP H 1.0 0.0 3.85 781 630 A 860 ARG H A 859 ILE HB 1.0 0.0 3.28 782 631 A 894 TRP HE1 A 882 MET HA 1.0 0.0 4.53 783 632 A 856 ALA H A 855 MET HBx 1.0 0.0 4.70 784 633 A 893 HIS HD2 A 894 TRP H 1.0 0.0 4.80 785 634 A 897 VAL HB A 909 TRP HZ2 1.0 0.0 3.41 786 635 A 919 LYS H A 918 ILE HB 1.0 0.0 3.38 787 636 A 888 CYS H A 886 ASP H 1.0 0.0 4.97 788 637 A 909 TRP HZ2 A 897 VAL HGy% 1.0 0.0 3.04 789 638 A 869 ILE HG2% A 874 ASN HBy 1.0 0.0 5.13 790 639 A 894 TRP HE1 A 881 PRO HBx 1.0 0.0 5.21 791 640 A 899 ILE HD1% A 909 TRP HD1 1.0 0.0 3.94 792 641 A 904 PRO HDy A 903 PRO HBy 1.0 0.0 4.27 793 642 A 899 ILE HB A 894 TRP HE1 1.0 0.0 5.32 794 643 A 883 ILE HD1% A 909 TRP HD1 1.0 0.0 4.05 795 644 A 900 MET HGx A 900 MET HA 1.0 0.0 4.16 796 645 A 863 TRP H A 861 ASP HBy 1.0 0.0 4.61 797 646 A 900 MET HA A 900 MET HGy 1.0 0.0 4.16 798 647 A 913 LYS H A 912 PRO HGy 1.0 0.0 4.69 799 648 A 867 ILE HG1x A 867 ILE HA 1.0 0.0 3.92 800 649 A 889 ASP H A 889 ASP HBx 1.0 0.0 4.07 801 650 A 899 ILE HA A 899 ILE HG1y 1.0 0.0 4.02 802 651 A 918 ILE H A 917 LYS HGy 1.0 0.0 4.67 803 652 A 899 ILE HG1x A 899 ILE HA 1.0 0.0 4.22 804 653 A 915 ALA HB% A 916 ASN H 1.0 0.0 3.51 805 654 A 897 VAL HGy% A 899 ILE HA 1.0 0.0 4.58 806 655 A 918 ILE HG2% A 919 LYS HA 1.0 0.0 4.27 807 656 A 869 ILE HG2% A 871 PRO HA 1.0 0.0 4.28 808 657 A 918 ILE HG2% A 918 ILE HG1y 1.0 0.0 3.99 809 658 A 918 ILE HG1x A 918 ILE HG2% 1.0 0.0 3.99 810 659 A 919 LYS HA A 919 LYS HDx 1.0 0.0 4.75 811 659 A 919 LYS HA A 919 LYS HDy 1.0 0.0 4.75 812 660 A 919 LYS HA A 919 LYS HGx 1.0 0.0 3.76 813 660 A 919 LYS HA A 919 LYS HGy 1.0 0.0 3.76 814 661 A 923 LYS HA A 923 LYS HGx 1.0 0.0 3.93 815 661 A 923 LYS HA A 923 LYS HGy 1.0 0.0 3.93 816 662 A 886 ASP H A 885 CYS H 1.0 0.0 4.65 817 663 A 920 LYS HA A 920 LYS HDx 1.0 0.0 4.29 818 663 A 920 LYS HA A 920 LYS HDy 1.0 0.0 4.29 819 664 A 864 GLY H A 861 ASP H 1.0 0.0 4.06 820 665 A 863 TRP HBy A 863 TRP HD1 1.0 0.0 3.69 821 666 A 922 LYS HA A 922 LYS HGx 1.0 0.0 4.08 822 666 A 922 LYS HA A 922 LYS HGy 1.0 0.0 4.08 823 667 A 867 ILE H A 868 TRP HE3 1.0 0.0 5.35 824 668 A 890 ASP HA A 891 TRP HD1 1.0 0.0 4.18 825 669 A 859 ILE HG2% A 857 TYR HA 1.0 0.0 4.54 826 670 A 917 LYS H A 916 ASN HBx 1.0 0.0 4.06 827 671 A 868 TRP HE1 A 891 TRP HD1 1.0 0.0 3.66 828 672 A 864 GLY H A 862 GLU HGx 1.0 0.0 4.40 829 672 A 864 GLY H A 862 GLU HGy 1.0 0.0 4.40 830 673 A 911 CYS HBy A 909 TRP HZ2 1.0 0.0 4.89 831 674 A 891 TRP HE1 A 868 TRP HE1 1.0 0.0 5.07 832 675 A 872 GLY HAx A 896 CYS HBx 1.0 0.0 4.50 833 676 A 909 TRP HZ2 A 911 CYS HA 1.0 0.0 4.16 834 677 A 890 ASP HA A 868 TRP HD1 1.0 0.0 5.07 835 678 A 916 ASN H A 917 LYS HGy 1.0 0.0 4.46 836 679 A 891 TRP HZ3 A 884 GLY HAy 1.0 0.0 4.89 837 680 A 891 TRP HBy A 868 TRP HD1 1.0 0.0 4.38 838 681 A 893 HIS HE1 A 869 ILE HG2% 1.0 0.0 5.50 839 682 A 911 CYS HA A 909 TRP HH2 1.0 0.0 3.90 840 683 A 863 TRP H A 863 TRP HD1 1.0 0.0 3.93 841 684 A 917 LYS H A 917 LYS HDx 1.0 0.0 4.15 842 684 A 917 LYS H A 917 LYS HDy 1.0 0.0 4.15 843 685 A 909 TRP HH2 A 912 PRO HDx 1.0 0.0 4.23 844 685 A 912 PRO HDy A 909 TRP HH2 1.0 0.0 4.23 845 686 A 882 MET HA A 894 TRP HD1 1.0 0.0 3.86 846 687 A 918 ILE HD1% A 918 ILE HA 1.0 0.0 4.02 847 688 P 2 ARG HBx A 891 TRP HZ2 1.0 0.0 4.46 848 689 A 909 TRP HH2 A 892 TYR HBy 1.0 0.0 4.46 849 690 A 894 TRP HA A 894 TRP HD1 1.0 0.0 3.68 850 691 A 915 ALA HA A 918 ILE HD1% 1.0 0.0 4.14 851 692 A 901 ALA H A 901 ALA HB% 1.0 0.0 3.16 852 693 A 894 TRP HD1 A 883 ILE HB 1.0 0.0 3.91 853 694 P 3 THR HG2% P 3 THR HA 1.0 0.0 3.45 854 695 A 909 TRP HE3 P 1 ALA HB% 1.0 0.0 4.55 855 696 A 917 LYS HA A 917 LYS HDx 1.0 0.0 4.38 856 696 A 917 LYS HDy A 917 LYS HA 1.0 0.0 4.38 857 697 A 894 TRP HZ2 A 881 PRO HBx 1.0 0.0 4.67 858 698 A 918 ILE HG1x A 918 ILE HA 1.0 0.0 3.89 859 699 A 866 GLN HGy A 868 TRP HH2 1.0 0.0 5.25 860 700 A 899 ILE HB A 894 TRP HBy 1.0 0.0 4.22 861 701 A 910 PHE HD% A 908 GLN HBy 1.0 0.0 5.01 862 702 A 891 TRP HZ3 A 884 GLY HAx 1.0 0.0 4.68 863 703 A 915 ALA HA A 918 ILE HB 1.0 0.0 4.18 864 704 A 882 MET HE% A 891 TRP HE3 1.0 0.0 4.09 865 705 A 891 TRP HH2 P 2 ARG HBy 1.0 0.0 3.75 866 706 A 876 PRO HDy A 875 LYS HGy 1.0 0.0 4.67 867 707 A 910 PHE HE% A 908 GLN HBx 1.0 0.0 3.89 868 708 A 903 PRO HGx A 904 PRO HDy 1.0 0.0 4.64 869 709 A 866 GLN HGx A 868 TRP HH2 1.0 0.0 5.50 870 710 A 869 ILE HB A 857 TYR HBy 1.0 0.0 4.06 871 711 A 915 ALA HB% A 910 PHE H 1.0 0.0 4.92 872 712 A 884 GLY H P 2 ARG HGx 1.0 0.0 5.13 873 712 A 884 GLY H P 2 ARG HGy 1.0 0.0 5.13 874 713 A 873 CYS H A 875 LYS HDx 1.0 0.0 5.50 875 713 A 875 LYS HDy A 873 CYS H 1.0 0.0 5.50 876 714 A 882 MET HGy A 891 TRP HZ3 1.0 0.0 5.50 877 715 A 899 ILE HG1x A 909 TRP HD1 1.0 0.0 5.50 878 716 A 867 ILE HG2% A 868 TRP HE3 1.0 0.0 5.37 879 717 A 872 GLY HAx A 896 CYS HBy 1.0 0.0 5.22 880 718 A 903 PRO HGx A 899 ILE HG2% 1.0 0.0 5.21 881 719 A 905 GLU H A 904 PRO HBx 1.0 0.0 3.93 882 720 A 903 PRO HGy A 899 ILE HG2% 1.0 0.0 4.80 883 721 A 882 MET HE% A 883 ILE HG2% 1.0 0.0 5.48 884 722 A 911 CYS HBx A 909 TRP HH2 1.0 0.0 4.58 885 723 A 899 ILE HG2% P 1 ALA HB% 1.0 0.0 5.01 886 724 A 911 CYS HBy A 909 TRP HH2 1.0 0.0 4.54 887 725 A 883 ILE HG2% A 894 TRP HD1 1.0 0.0 3.55 888 726 A 899 ILE HD1% A 899 ILE HG2% 1.0 0.0 2.95 889 727 A 883 ILE H A 882 MET HBx 1.0 0.0 3.87 890 728 A 883 ILE HD1% A 894 TRP HD1 1.0 0.0 4.78 891 729 A 883 ILE HD1% A 899 ILE HG2% 1.0 0.0 3.82 892 730 A 882 MET HE% A 883 ILE H 1.0 0.0 4.51 893 731 A 899 ILE HG2% A 894 TRP HD1 1.0 0.0 4.56 894 732 A 883 ILE HG2% A 899 ILE HG2% 1.0 0.0 3.81 895 733 A 878 ASP H A 877 ASP HBy 1.0 0.0 4.60 896 734 A 892 TYR HA A 870 CYS HA 1.0 0.0 4.14 897 735 A 909 TRP HZ2 A 899 ILE HD1% 1.0 0.0 5.02 898 736 A 906 GLU H A 904 PRO HBy 1.0 0.0 4.39 899 737 A 882 MET HGy A 882 MET HA 1.0 0.0 4.21 900 738 A 866 GLN HBx A 866 GLN HE2x 1.0 0.0 4.44 901 739 A 906 GLU H A 905 GLU HGy 1.0 0.0 5.01 902 740 A 909 TRP HE3 A 885 CYS HA 1.0 0.0 3.39 903 741 A 892 TYR H A 897 VAL HGx% 1.0 0.0 4.54 904 742 A 909 TRP HZ3 A 885 CYS HA 1.0 0.0 4.20 905 743 A 874 ASN H A 874 ASN HBy 1.0 0.0 4.17 906 744 A 909 TRP HZ3 A 885 CYS H 1.0 0.0 4.48 907 745 A 903 PRO HBx A 904 PRO HDx 1.0 0.0 3.85 908 746 A 866 GLN HE2x A 858 VAL HGy% 1.0 0.0 4.34 909 747 A 868 TRP HBy A 868 TRP H 1.0 0.0 3.66 910 748 A 909 TRP HZ3 A 911 CYS H 1.0 0.0 4.61 911 749 A 875 LYS HGx A 876 PRO HDy 1.0 0.0 4.67 912 750 A 891 TRP HZ3 A 882 MET HBy 1.0 0.0 4.51 913 751 A 911 CYS H A 910 PHE H 1.0 0.0 4.69 914 752 A 893 HIS HBx A 895 PRO HGy 1.0 0.0 4.02 915 753 A 897 VAL HGx% A 909 TRP HZ3 1.0 0.0 4.52 916 754 A 906 GLU HGy A 906 GLU HA 1.0 0.0 3.98 917 755 A 897 VAL HGy% A 909 TRP HZ3 1.0 0.0 5.11 918 756 A 905 GLU HGy A 905 GLU HA 1.0 0.0 4.18 919 757 A 897 VAL HGy% A 894 TRP HD1 1.0 0.0 4.46 920 758 A 904 PRO HDx A 903 PRO HBy 1.0 0.0 3.85 921 759 A 897 VAL HGx% A 909 TRP HH2 1.0 0.0 3.48 922 760 A 918 ILE HD1% A 910 PHE HE% 1.0 0.0 5.50 923 761 A 911 CYS HBx A 912 PRO HDx 1.0 0.0 3.90 924 761 A 911 CYS HBx A 912 PRO HDy 1.0 0.0 3.90 925 762 A 868 TRP HE1 A 858 VAL HGx% 1.0 0.0 4.95 926 763 A 897 VAL HB A 912 PRO HDx 1.0 0.0 3.34 927 763 A 897 VAL HB A 912 PRO HDy 1.0 0.0 3.34 928 764 A 863 TRP HD1 A 863 TRP HA 1.0 0.0 4.90 929 765 A 902 ALA HA A 903 PRO HDx 1.0 0.0 3.19 930 766 A 883 ILE HG2% A 909 TRP HBy 1.0 0.0 5.18 931 767 A 895 PRO HDx A 894 TRP HBx 1.0 0.0 3.87 932 768 A 899 ILE HG1x A 894 TRP HBx 1.0 0.0 5.50 933 769 A 899 ILE HG1x A 903 PRO HDy 1.0 0.0 5.50 934 770 A 898 GLY H A 899 ILE HA 1.0 0.0 4.82 935 771 A 891 TRP HE1 A 884 GLY HAy 1.0 0.0 5.35 936 772 A 875 LYS HGx A 875 LYS HEy 1.0 0.0 3.40 937 772 A 875 LYS HGx A 875 LYS HEx 1.0 0.0 3.40 938 773 A 902 ALA HB% A 903 PRO HDx 1.0 0.0 3.49 939 774 A 894 TRP HZ2 A 899 ILE HG2% 1.0 0.0 5.01 940 775 A 883 ILE HD1% A 903 PRO HGy 1.0 0.0 3.68 941 776 A 913 LYS HGx A 913 LYS HEx 1.0 0.0 4.09 942 776 A 913 LYS HGx A 913 LYS HEy 1.0 0.0 4.09 943 777 A 910 PHE HBx A 911 CYS H 1.0 0.0 3.63 944 778 A 869 ILE HD1% A 868 TRP H 1.0 0.0 4.94 945 779 A 860 ARG HBx A 864 GLY HAx 1.0 0.0 4.55 946 779 A 860 ARG HBy A 864 GLY HAx 1.0 0.0 4.55 947 780 A 909 TRP H A 909 TRP HBx 1.0 0.0 3.95 948 781 A 909 TRP HE3 A 886 ASP H 1.0 0.0 4.19 949 782 A 875 LYS HBy A 875 LYS HDy 1.0 0.0 3.83 950 782 A 875 LYS HBy A 875 LYS HDx 1.0 0.0 3.83 951 783 A 865 ASN H A 860 ARG HBx 1.0 0.0 4.48 952 783 A 865 ASN H A 860 ARG HBy 1.0 0.0 4.48 953 784 A 909 TRP HE3 A 910 PHE HA 1.0 0.0 4.99 954 785 P 8 ARG H P 7 ALA HA 1.0 0.0 3.44 955 786 A 900 MET H A 901 ALA HB% 1.0 0.0 4.48 956 787 A 909 TRP HZ3 A 910 PHE HA 1.0 0.0 4.85 957 788 A 877 ASP HBx A 879 GLY H 1.0 0.0 4.71 958 789 A 909 TRP HZ3 A 884 GLY HAy 1.0 0.0 4.97 959 790 A 869 ILE H A 869 ILE HD1% 1.0 0.0 3.82 960 791 A 909 TRP HZ3 A 911 CYS HA 1.0 0.0 4.92 961 792 A 868 TRP HE1 A 858 VAL HGy% 1.0 0.0 4.95 962 793 A 859 ILE H A 859 ILE HG2% 1.0 0.0 3.66 963 794 A 909 TRP HZ3 A 885 CYS HBx 1.0 0.0 4.67 964 795 A 882 MET HE% A 893 HIS HE2 1.0 0.0 4.15 965 796 A 882 MET HBy A 882 MET H 1.0 0.0 3.29 966 797 A 911 CYS HBx A 909 TRP HZ3 1.0 0.0 4.37 967 798 A 897 VAL HGy% A 909 TRP HE1 1.0 0.0 4.11 968 799 A 882 MET H A 881 PRO HBx 1.0 0.0 4.22 969 800 A 885 CYS HBy A 909 TRP HZ3 1.0 0.0 4.10 970 801 A 880 SER HBy A 881 PRO HDx 1.0 0.0 4.21 971 802 P 2 ARG HBy P 1 ALA H1 1.0 0.0 4.63 972 803 A 875 LYS H A 875 LYS HBx 1.0 0.0 3.94 973 804 A 909 TRP HE3 A 883 ILE HG1y 1.0 0.0 4.18 974 805 A 861 ASP HBx A 867 ILE HD1% 1.0 0.0 4.23 975 806 A 883 ILE HD1% A 909 TRP HE3 1.0 0.0 4.30 976 807 A 867 ILE HG2% A 876 PRO HBy 1.0 0.0 3.73 977 808 A 893 HIS HE2 A 870 CYS HBx 1.0 0.0 5.13 978 809 A 876 PRO HBy A 869 ILE HD1% 1.0 0.0 3.99 979 810 A 882 MET HGx A 893 HIS HE2 1.0 0.0 5.50 980 811 A 869 ILE HD1% A 876 PRO HGx 1.0 0.0 3.46 981 811 A 869 ILE HD1% A 876 PRO HGy 1.0 0.0 3.46 982 812 A 897 VAL HGy% A 883 ILE H 1.0 0.0 4.78 983 813 A 915 ALA HB% A 910 PHE HBy 1.0 0.0 3.47 984 814 A 894 TRP HE1 A 899 ILE HG2% 1.0 0.0 4.86 985 815 A 886 ASP HBx A 908 GLN HBx 1.0 0.0 4.44 986 816 A 899 ILE HB A 899 ILE HD1% 1.0 0.0 3.55 987 817 A 891 TRP HA A 884 GLY HAx 1.0 0.0 4.22 988 818 A 916 ASN HBx A 913 LYS HA 1.0 0.0 4.77 989 819 A 869 ILE HG2% A 869 ILE HG1y 1.0 0.0 3.63 990 820 A 913 LYS HA A 916 ASN HBy 1.0 0.0 4.77 991 821 A 897 VAL HGy% A 899 ILE HG2% 1.0 0.0 3.94 992 822 A 909 TRP HBy A 909 TRP HZ3 1.0 0.0 5.39 993 823 A 883 ILE HG2% A 899 ILE HD1% 1.0 0.0 3.57 994 824 A 911 CYS HBy A 909 TRP HZ3 1.0 0.0 5.50 995 825 A 885 CYS HBy A 909 TRP HE3 1.0 0.0 4.76 996 826 A 889 ASP H A 888 CYS HBx 1.0 0.0 4.40 997 827 A 889 ASP H A 889 ASP HBy 1.0 0.0 4.07 998 828 A 864 GLY H A 861 ASP HBy 1.0 0.0 5.01 999 829 A 888 CYS H A 914 CYS HBx 1.0 0.0 4.26 1000 830 A 910 PHE H A 909 TRP HBx 1.0 0.0 4.08 1001 831 A 894 TRP HZ3 A 901 ALA HA 1.0 0.0 3.51 1002 832 A 910 PHE HD% A 909 TRP HA 1.0 0.0 3.94 1003 833 A 894 TRP HZ3 A 881 PRO HBy 1.0 0.0 4.89 1004 834 A 863 TRP HE3 A 863 TRP HA 1.0 0.0 5.00 1005 835 A 885 CYS HBy A 910 PHE HA 1.0 0.0 4.41 1006 836 A 868 TRP HE3 A 868 TRP H 1.0 0.0 3.40 1007 837 A 870 CYS HA A 871 PRO HDx 1.0 0.0 3.63 1008 838 A 873 CYS H A 871 PRO HA 1.0 0.0 4.71 1009 839 A 868 TRP HE3 A 867 ILE HA 1.0 0.0 3.69 1010 840 A 882 MET HE% A 870 CYS HA 1.0 0.0 4.41 1011 841 A 916 ASN H A 913 LYS HA 1.0 0.0 4.46 1012 842 A 883 ILE HD1% A 899 ILE HD1% 1.0 0.0 3.26 1013 843 A 883 ILE HG1x A 883 ILE HA 1.0 0.0 3.70 1014 844 A 915 ALA H A 912 PRO HA 1.0 0.0 4.13 1015 845 A 882 MET HA A 882 MET HGx 1.0 0.0 3.98 1016 846 A 883 ILE HD1% A 883 ILE HG2% 1.0 0.0 3.14 1017 847 P 3 THR HG2% A 883 ILE HA 1.0 0.0 3.66 1018 848 A 918 ILE H A 917 LYS HA 1.0 0.0 3.45 1019 849 A 892 TYR HA A 870 CYS HBx 1.0 0.0 4.38 1020 850 A 883 ILE HD1% A 899 ILE HG1y 1.0 0.0 4.77 1021 851 A 883 ILE HA A 884 GLY HAx 1.0 0.0 4.59 1022 852 A 916 ASN H A 912 PRO HA 1.0 0.0 4.46 1023 853 A 868 TRP HD1 A 858 VAL HGy% 1.0 0.0 4.96 1024 854 A 860 ARG HA A 860 ARG HGy 1.0 0.0 3.86 1025 855 A 901 ALA H A 899 ILE HA 1.0 0.0 3.96 1026 856 A 894 TRP HE1 A 883 ILE HG1y 1.0 0.0 5.50 1027 857 A 860 ARG HA A 860 ARG HGx 1.0 0.0 3.86 1028 858 A 900 MET H A 899 ILE HA 1.0 0.0 3.18 1029 859 A 866 GLN HBx A 866 GLN HE2y 1.0 0.0 4.93 1030 860 A 876 PRO HA A 869 ILE HG1x 1.0 0.0 4.87 1031 861 A 870 CYS H A 869 ILE HA 1.0 0.0 3.21 1032 862 A 890 ASP H A 889 ASP HBy 1.0 0.0 4.79 1033 863 A 906 GLU H A 905 GLU HGx 1.0 0.0 5.01 1034 864 A 882 MET HGy A 893 HIS HA 1.0 0.0 4.41 1035 865 A 880 SER H A 880 SER HBy 1.0 0.0 3.90 1036 866 A 870 CYS HA A 871 PRO HGx 1.0 0.0 4.47 1037 867 A 915 ALA H A 914 CYS HBy 1.0 0.0 3.90 1038 868 A 894 TRP H A 895 PRO HDx 1.0 0.0 3.96 1039 869 A 866 GLN HGy A 866 GLN HA 1.0 0.0 3.90 1040 870 A 883 ILE H A 882 MET H 1.0 0.0 4.92 1041 871 A 908 GLN HGy A 908 GLN HA 1.0 0.0 3.72 1042 872 P 8 ARG HDy P 8 ARG HBy 1.0 0.0 3.83 1043 872 P 8 ARG HBy P 8 ARG HDx 1.0 0.0 3.83 1044 873 P 8 ARG HDy P 8 ARG HBx 1.0 0.0 3.83 1045 873 P 8 ARG HBx P 8 ARG HDx 1.0 0.0 3.83 1046 874 A 874 ASN H A 870 CYS HBy 1.0 0.0 4.80 1047 875 A 892 TYR HE% A 913 LYS HEx 1.0 0.0 5.15 1048 875 A 892 TYR HE% A 913 LYS HEy 1.0 0.0 5.15 1049 876 A 891 TRP HH2 P 3 THR HA 1.0 0.0 4.75 1050 877 A 891 TRP HZ3 P 3 THR HA 1.0 0.0 3.81 1051 878 A 909 TRP HA A 909 TRP HD1 1.0 0.0 3.72 1052 879 A 910 PHE HZ A 886 ASP HBy 1.0 0.0 4.07 1053 880 A 862 GLU H A 861 ASP HA 1.0 0.0 3.21 1054 881 A 919 LYS H A 916 ASN HA 1.0 0.0 4.59 1055 882 A 863 TRP H A 861 ASP HA 1.0 0.0 4.52 1056 883 A 875 LYS HA A 875 LYS HGy 1.0 0.0 4.13 1057 884 A 918 ILE H A 916 ASN HA 1.0 0.0 4.52 1058 885 A 875 LYS HGx A 875 LYS HA 1.0 0.0 4.13 1059 886 A 894 TRP HE3 A 895 PRO HDx 1.0 0.0 4.58 1060 887 A 878 ASP H A 877 ASP HA 1.0 0.0 3.11 1061 888 A 869 ILE HG2% A 870 CYS HA 1.0 0.0 4.72 1062 889 A 876 PRO HDx A 875 LYS H 1.0 0.0 5.17 1063 890 A 879 GLY H A 877 ASP HA 1.0 0.0 3.98 1064 891 A 894 TRP HE1 A 883 ILE HA 1.0 0.0 4.42 1065 892 A 883 ILE HG2% A 883 ILE HA 1.0 0.0 4.15 1066 893 A 894 TRP HE3 A 894 TRP HBy 1.0 0.0 3.71 1067 894 A 867 ILE H A 866 GLN HA 1.0 0.0 2.95 1068 895 A 883 ILE HA A 891 TRP HE3 1.0 0.0 4.50 1069 896 A 883 ILE HG1y A 883 ILE HA 1.0 0.0 4.18 1070 897 A 887 ASP H A 887 ASP HBy 1.0 0.0 3.85 1071 898 A 911 CYS H A 885 CYS HA 1.0 0.0 4.24 1072 899 A 894 TRP HZ2 P 3 THR HB 1.0 0.0 3.80 1073 900 A 876 PRO HA A 869 ILE HD1% 1.0 0.0 3.36 1074 901 A 915 ALA HA A 914 CYS H 1.0 0.0 5.18 1075 902 A 894 TRP HZ3 A 900 MET HA 1.0 0.0 4.75 1076 903 A 899 ILE HG2% A 903 PRO HDx 1.0 0.0 4.52 1077 904 A 888 CYS H A 887 ASP HBy 1.0 0.0 3.29 1078 905 A 909 TRP HZ3 A 892 TYR HBy 1.0 0.0 4.96 1079 906 A 858 VAL HA A 858 VAL HGx% 1.0 0.0 3.54 1080 907 A 910 PHE HD% A 887 ASP HBy 1.0 0.0 3.80 1081 908 A 870 CYS H A 870 CYS HBx 1.0 0.0 3.31 1082 909 A 858 VAL HA A 858 VAL HGy% 1.0 0.0 3.54 1083 910 A 878 ASP H A 879 GLY HAx 1.0 0.0 5.31 1084 911 A 863 TRP HBy A 863 TRP HE3 1.0 0.0 3.78 1085 912 A 882 MET HE% A 891 TRP HZ3 1.0 0.0 5.50 1086 913 A 871 PRO HGx A 890 ASP HBy 1.0 0.0 5.50 1087 914 A 910 PHE HE% A 887 ASP HBy 1.0 0.0 4.28 1088 915 A 868 TRP H A 868 TRP HBx 1.0 0.0 3.51 1089 916 A 867 ILE H A 858 VAL HGx% 1.0 0.0 5.50 1090 917 A 893 HIS H A 893 HIS HBx 1.0 0.0 4.12 1091 918 A 868 TRP HE3 A 868 TRP HBx 1.0 0.0 3.76 1092 919 A 907 MET H P 1 ALA HB% 1.0 0.0 5.07 1093 920 A 868 TRP HBy A 868 TRP HD1 1.0 0.0 3.71 1094 921 A 899 ILE HB A 909 TRP HZ2 1.0 0.0 5.38 1095 922 A 874 ASN H A 874 ASN HBx 1.0 0.0 4.17 1096 923 A 882 MET HE% A 882 MET HBx 1.0 0.0 3.62 1097 924 A 884 GLY H A 883 ILE HA 1.0 0.0 3.43 1098 925 A 883 ILE HD1% P 1 ALA HB% 1.0 0.0 3.21 1099 926 A 883 ILE HG2% A 883 ILE H 1.0 0.0 3.37 1100 927 A 882 MET HE% A 891 TRP HBx 1.0 0.0 3.52 1101 928 A 886 ASP H A 885 CYS HA 1.0 0.0 3.25 1102 929 A 887 ASP H A 885 CYS HA 1.0 0.0 4.65 1103 930 A 899 ILE H A 895 PRO HA 1.0 0.0 4.28 1104 931 A 897 VAL H A 895 PRO HA 1.0 0.0 4.54 1105 932 A 898 GLY H A 895 PRO HA 1.0 0.0 3.77 1106 933 A 890 ASP HBx A 871 PRO HGx 1.0 0.0 5.50 1107 934 A 857 TYR HD% A 857 TYR HA 1.0 0.0 3.44 1108 935 A 897 VAL HGy% A 894 TRP HBx 1.0 0.0 4.83 1109 936 A 892 TYR H A 884 GLY HAy 1.0 0.0 4.26 1110 937 A 857 TYR HA A 857 TYR HE% 1.0 0.0 4.59 1111 938 A 909 TRP HBy A 883 ILE HG1y 1.0 0.0 4.64 1112 939 A 897 VAL H A 896 CYS HBy 1.0 0.0 4.38 1113 940 A 881 PRO HA A 882 MET H 1.0 0.0 2.94 1114 941 P 1 ALA HA A 883 ILE HG1y 1.0 0.0 5.48 1115 942 A 893 HIS H A 896 CYS HBy 1.0 0.0 4.19 1116 943 A 868 TRP H A 867 ILE HA 1.0 0.0 2.99 1117 944 A 899 ILE HG2% A 894 TRP HBx 1.0 0.0 4.20 1118 945 A 870 CYS HBy A 870 CYS H 1.0 0.0 3.35 1119 946 A 908 GLN H A 907 MET HA 1.0 0.0 2.82 1120 947 A 903 PRO HDy A 899 ILE HG2% 1.0 0.0 4.45 1121 948 A 893 HIS HE1 A 870 CYS HBy 1.0 0.0 3.69 1122 949 A 915 ALA HA A 910 PHE HBy 1.0 0.0 4.43 1123 950 A 865 ASN H A 863 TRP HBy 1.0 0.0 5.16 1124 951 A 914 CYS HA A 917 LYS HBx 1.0 0.0 5.50 1125 952 A 911 CYS H A 885 CYS HBx 1.0 0.0 4.58 1126 953 A 917 LYS HBx A 918 ILE HA 1.0 0.0 5.50 1127 954 A 885 CYS HBx A 885 CYS H 1.0 0.0 3.87 1128 955 A 893 HIS H A 893 HIS HBy 1.0 0.0 3.60 1129 956 A 920 LYS HEy A 920 LYS HBy 1.0 0.0 4.94 1130 956 A 920 LYS HBy A 920 LYS HEx 1.0 0.0 4.94 1131 957 A 888 CYS H A 885 CYS HBx 1.0 0.0 4.21 1132 958 A 909 TRP HE3 A 909 TRP HBx 1.0 0.0 4.16 1133 959 A 889 ASP H A 885 CYS HBx 1.0 0.0 3.92 1134 960 A 910 PHE HBx A 910 PHE H 1.0 0.0 3.92 1135 961 A 919 LYS H A 919 LYS HBx 1.0 0.0 3.84 1136 962 A 895 PRO HDy A 894 TRP HBx 1.0 0.0 3.97 1137 963 A 883 ILE HG2% P 1 ALA HB% 1.0 0.0 4.77 1138 964 A 897 VAL HB A 909 TRP HH2 1.0 0.0 4.93 1139 965 A 899 ILE HD1% P 1 ALA HB% 1.0 0.0 4.36 1140 966 A 897 VAL HGx% A 912 PRO HGx 1.0 0.0 3.94 1141 967 A 866 GLN HBy A 858 VAL HGy% 1.0 0.0 4.48 1142 968 A 897 VAL HGx% A 912 PRO HGy 1.0 0.0 3.95 1143 969 A 869 ILE HG2% A 874 ASN HBx 1.0 0.0 5.13 1144 970 A 870 CYS HBy A 892 TYR HA 1.0 0.0 4.93 1145 971 A 911 CYS HBx A 897 VAL HGx% 1.0 0.0 4.58 1146 972 A 876 PRO HA A 869 ILE HG1y 1.0 0.0 4.87 1147 973 A 867 ILE HG2% A 876 PRO HBx 1.0 0.0 3.73 1148 974 A 867 ILE HD1% A 861 ASP HA 1.0 0.0 4.72 1149 975 A 867 ILE HD1% A 867 ILE HA 1.0 0.0 3.98 1150 976 A 857 TYR HBx A 869 ILE HB 1.0 0.0 4.77 1151 977 A 882 MET HBy A 891 TRP HBx 1.0 0.0 5.11 1152 978 A 856 ALA H A 855 MET HA 1.0 0.0 3.01 1153 979 A 894 TRP HA A 894 TRP HE1 1.0 0.0 4.66 1154 980 A 899 ILE H A 894 TRP HA 1.0 0.0 4.19 1155 981 A 897 VAL H A 894 TRP HA 1.0 0.0 4.06 1156 982 A 873 CYS H A 874 ASN HA 1.0 0.0 4.21 1157 983 A 867 ILE HB A 858 VAL HA 1.0 0.0 5.10 1158 984 A 909 TRP HA A 908 GLN HBx 1.0 0.0 5.46 1159 985 A 894 TRP HZ2 A 902 ALA HA 1.0 0.0 4.32 1160 986 A 905 GLU H A 904 PRO HA 1.0 0.0 2.84 1161 987 A 903 PRO HGx A 902 ALA HA 1.0 0.0 4.59 1162 988 A 910 PHE HD% A 885 CYS HBx 1.0 0.0 5.50 1163 989 A 909 TRP H A 908 GLN HA 1.0 0.0 3.20 1164 990 A 903 PRO HGy A 902 ALA HA 1.0 0.0 4.47 1165 991 A 894 TRP HZ3 A 902 ALA HA 1.0 0.0 5.50 1166 992 A 878 ASP H A 879 GLY HAy 1.0 0.0 5.31 1167 993 A 917 LYS HGy A 917 LYS HEx 1.0 0.0 3.80 1168 993 A 917 LYS HEy A 917 LYS HGy 1.0 0.0 3.80 1169 994 A 891 TRP HH2 P 2 ARG HDy 1.0 0.0 4.63 1170 994 A 891 TRP HH2 P 2 ARG HDx 1.0 0.0 4.63 1171 995 A 910 PHE HE% A 909 TRP HA 1.0 0.0 4.61 1172 996 A 882 MET HE% A 870 CYS HBy 1.0 0.0 4.39 1173 997 A 911 CYS H A 912 PRO HDx 1.0 0.0 4.66 1174 997 A 912 PRO HDy A 911 CYS H 1.0 0.0 4.66 1175 998 A 917 LYS HGx A 917 LYS HEx 1.0 0.0 3.52 1176 998 A 917 LYS HEy A 917 LYS HGx 1.0 0.0 3.52 1177 999 A 862 GLU H A 861 ASP HBy 1.0 0.0 3.69 1178 1000 A 910 PHE HBx A 887 ASP HBy 1.0 0.0 4.36 1179 1001 A 913 LYS H A 912 PRO HDx 1.0 0.0 4.05 1180 1001 A 913 LYS H A 912 PRO HDy 1.0 0.0 4.05 1181 1002 A 899 ILE HG2% A 899 ILE HG1y 1.0 0.0 3.66 1182 1003 A 888 CYS H A 888 CYS HBy 1.0 0.0 3.97 1183 1004 A 897 VAL HGx% A 896 CYS HBx 1.0 0.0 3.77 1184 1005 A 899 ILE HG2% P 3 THR HG2% 1.0 0.0 4.13 1185 1006 A 893 HIS H A 896 CYS HBx 1.0 0.0 4.64 1186 1007 A 911 CYS HBy A 897 VAL HGx% 1.0 0.0 4.31 1187 1008 A 896 CYS H A 896 CYS HBx 1.0 0.0 3.74 1188 1009 A 892 TYR HBx A 909 TRP HH2 1.0 0.0 5.25 1189 1010 A 910 PHE HD% A 886 ASP HBx 1.0 0.0 4.31 1190 1011 A 887 ASP HBy A 914 CYS HBy 1.0 0.0 4.06 1191 1012 A 914 CYS HBx A 887 ASP HBy 1.0 0.0 4.23 1192 1013 A 869 ILE H A 857 TYR HBy 1.0 0.0 4.09 1193 1014 A 886 ASP H A 910 PHE HA 1.0 0.0 4.12 1194 1015 A 857 TYR HD% A 869 ILE H 1.0 0.0 4.77 1195 1016 A 886 ASP H A 910 PHE HBy 1.0 0.0 5.50 1196 1017 A 857 TYR HE% A 874 ASN HA 1.0 0.0 5.43 1197 1018 A 910 PHE HD% A 886 ASP H 1.0 0.0 4.40 1198 1019 A 888 CYS H A 910 PHE HD% 1.0 0.0 4.72 1199 1020 A 859 ILE H A 869 ILE HD1% 1.0 0.0 4.53 1200 1021 A 910 PHE HBx A 915 ALA HB% 1.0 0.0 3.78 1201 1022 A 914 CYS HBx A 915 ALA HB% 1.0 0.0 4.59 1202 1023 A 869 ILE H A 869 ILE HG1y 1.0 0.0 4.37 1203 1024 A 866 GLN HBx A 868 TRP HH2 1.0 0.0 4.16 1204 1025 A 859 ILE H A 858 VAL HA 1.0 0.0 2.86 1205 1026 A 860 ARG H A 859 ILE HA 1.0 0.0 2.96 1206 1027 A 856 ALA HA A 857 TYR H 1.0 0.0 3.08 1207 1028 A 898 GLY H A 896 CYS HA 1.0 0.0 4.80 1208 1029 A 857 TYR HD% A 856 ALA HA 1.0 0.0 4.56 1209 1030 A 899 ILE HG2% A 901 ALA HB% 1.0 0.0 4.72 1210 1031 A 921 ASP H A 920 LYS HA 1.0 0.0 3.46 1211 1032 A 883 ILE HG2% A 892 TYR HBy 1.0 0.0 4.04 1212 1033 A 894 TRP H A 894 TRP HBx 1.0 0.0 3.88 1213 1034 A 918 ILE H A 919 LYS HA 1.0 0.0 5.50 1214 1035 A 883 ILE HG2% A 897 VAL HGy% 1.0 0.0 3.15 1215 1036 A 864 GLY H A 863 TRP HBx 1.0 0.0 4.36 1216 1037 A 874 ASN H A 871 PRO HA 1.0 0.0 4.14 1217 1038 A 883 ILE HD1% A 909 TRP HBy 1.0 0.0 3.78 1218 1039 A 865 ASN H A 863 TRP HBx 1.0 0.0 3.92 1219 1040 A 857 TYR HD% A 871 PRO HA 1.0 0.0 5.03 1220 1041 A 883 ILE HD1% A 903 PRO HDx 1.0 0.0 4.18 1221 1042 A 863 TRP HBx A 865 ASN HD2y 1.0 0.0 4.26 1222 1043 A 857 TYR HE% A 871 PRO HA 1.0 0.0 3.81 1223 1044 A 883 ILE HD1% A 909 TRP HBx 1.0 0.0 3.91 1224 1045 A 863 TRP H A 863 TRP HBx 1.0 0.0 3.41 1225 1046 A 883 ILE HD1% P 3 THR HG2% 1.0 0.0 3.36 1226 1047 A 863 TRP HBx A 863 TRP HD1 1.0 0.0 3.70 1227 1048 A 883 ILE HD1% A 883 ILE HB 1.0 0.0 3.44 1228 1049 A 863 TRP HBx A 865 ASN HD2x 1.0 0.0 4.26 1229 1050 A 883 ILE HD1% A 897 VAL HGy% 1.0 0.0 4.17 1230 1051 A 911 CYS HBy A 911 CYS H 1.0 0.0 3.95 1231 1052 A 888 CYS H A 910 PHE HE% 1.0 0.0 5.50 1232 1053 A 903 PRO HGx A 899 ILE HD1% 1.0 0.0 4.49 1233 1054 A 902 ALA H A 903 PRO HDy 1.0 0.0 5.33 1234 1055 A 857 TYR HD% A 870 CYS H 1.0 0.0 5.50 1235 1056 A 864 GLY H A 863 TRP HD1 1.0 0.0 5.50 1236 1057 A 897 VAL HGx% A 892 TYR HD% 1.0 0.0 4.04 1237 1058 A 899 ILE HG1x A 883 ILE HG2% 1.0 0.0 3.99 1238 1059 A 899 ILE HD1% A 883 ILE HG1y 1.0 0.0 4.71 1239 1060 A 866 GLN HBy A 868 TRP HZ3 1.0 0.0 4.04 1240 1061 A 891 TRP HE3 A 884 GLY HAx 1.0 0.0 4.58 1241 1062 A 910 PHE HD% A 908 GLN HBx 1.0 0.0 4.56 1242 1063 A 899 ILE HB A 894 TRP HD1 1.0 0.0 4.72 1243 1064 A 908 GLN HBx A 908 GLN HE2y 1.0 0.0 4.48 1244 1065 A 868 TRP HE3 A 866 GLN HBy 1.0 0.0 4.64 1245 1066 A 885 CYS HBy A 886 ASP H 1.0 0.0 4.33 1246 1067 A 882 MET HGy A 882 MET H 1.0 0.0 4.02 1247 1068 A 894 TRP HE3 A 894 TRP HBx 1.0 0.0 3.71 1248 1069 A 891 TRP HE3 A 891 TRP HBx 1.0 0.0 3.53 1249 1070 A 913 LYS H A 914 CYS HBy 1.0 0.0 4.67 1250 1071 A 869 ILE H A 868 TRP HD1 1.0 0.0 4.86 1251 1072 A 891 TRP H A 890 ASP HBy 1.0 0.0 3.91 1252 1073 A 890 ASP H A 890 ASP HBy 1.0 0.0 3.87 1253 1074 A 919 LYS H A 917 LYS HA 1.0 0.0 4.33 1254 1075 A 865 ASN H A 865 ASN HBy 1.0 0.0 3.22 1255 1076 A 886 ASP HBx A 908 GLN HE2x 1.0 0.0 4.44 1256 1077 A 865 ASN HBy A 865 ASN HD2y 1.0 0.0 3.60 1257 1078 A 899 ILE H A 900 MET H 1.0 0.0 4.84 1258 1079 A 866 GLN H A 865 ASN HBy 1.0 0.0 4.09 1259 1080 A 909 TRP H A 886 ASP HBx 1.0 0.0 4.42 1260 1081 A 914 CYS H A 914 CYS HBy 1.0 0.0 3.71 1261 1082 A 909 TRP HZ3 A 910 PHE H 1.0 0.0 5.50 1262 1083 A 906 GLU H A 906 GLU HGy 1.0 0.0 3.94 1263 1084 A 877 ASP H A 877 ASP HBy 1.0 0.0 3.66 1264 1085 A 909 TRP H A 910 PHE H 1.0 0.0 4.51 1265 1086 A 911 CYS H A 910 PHE HBy 1.0 0.0 4.40 1266 1087 A 860 ARG H A 860 ARG HDx 1.0 0.0 4.53 1267 1087 A 860 ARG H A 860 ARG HDy 1.0 0.0 4.53 1268 1088 A 910 PHE H A 909 TRP HD1 1.0 0.0 4.03 1269 1089 A 906 GLU H A 906 GLU HGx 1.0 0.0 3.94 1270 1090 A 865 ASN HBy A 865 ASN HD2x 1.0 0.0 3.60 1271 1091 A 909 TRP HA A 910 PHE H 1.0 0.0 2.92 1272 1092 A 915 ALA H A 910 PHE HBy 1.0 0.0 4.68 1273 1093 A 911 CYS H A 914 CYS HBy 1.0 0.0 4.19 1274 1094 A 909 TRP HBy A 910 PHE H 1.0 0.0 4.05 1275 1095 A 869 ILE H A 857 TYR HBx 1.0 0.0 4.60 1276 1096 A 876 PRO HBy A 877 ASP H 1.0 0.0 3.79 1277 1097 A 866 GLN HE2x A 868 TRP HE1 1.0 0.0 5.50 1278 1098 A 869 ILE H A 868 TRP HBx 1.0 0.0 4.59 1279 1099 A 896 CYS H A 895 PRO HGy 1.0 0.0 4.51 1280 1100 P 3 THR HA A 883 ILE HB 1.0 0.0 4.96 1281 1101 A 901 ALA H A 900 MET HBy 1.0 0.0 4.23 1282 1102 A 884 GLY H P 3 THR HG2% 1.0 0.0 4.30 1283 1103 A 900 MET H A 900 MET HBy 1.0 0.0 4.05 1284 1104 A 868 TRP H A 868 TRP HZ3 1.0 0.0 4.84 1285 1105 P 3 THR HG2% A 903 PRO HDx 1.0 0.0 3.67 1286 1106 A 906 GLU H A 906 GLU HBy 1.0 0.0 4.06 1287 1107 A 909 TRP HE1 A 910 PHE H 1.0 0.0 4.91 1288 1108 A 903 PRO HDy P 3 THR HG2% 1.0 0.0 3.75 1289 1109 A 908 GLN H A 907 MET HBy 1.0 0.0 3.97 1290 1110 A 859 ILE H A 867 ILE HD1% 1.0 0.0 5.50 1291 1111 A 866 GLN H A 867 ILE HD1% 1.0 0.0 5.50 1292 1112 A 891 TRP HH2 P 2 ARG H 1.0 0.0 5.50 1293 1113 A 893 HIS H A 892 TYR HBy 1.0 0.0 4.25 1294 1114 A 892 TYR H A 892 TYR HBy 1.0 0.0 3.64 1295 1115 A 858 VAL H A 857 TYR HBy 1.0 0.0 4.01 1296 1116 A 882 MET HBy A 883 ILE HA 1.0 0.0 4.91 1297 1117 A 910 PHE HA A 914 CYS HBy 1.0 0.0 4.62 1298 1118 A 880 SER HBy A 881 PRO HDy 1.0 0.0 4.21 1299 1119 A 910 PHE HD% A 914 CYS HBy 1.0 0.0 4.29 1300 1120 A 882 MET HGy A 883 ILE H 1.0 0.0 5.21 1301 1121 A 861 ASP H A 860 ARG HA 1.0 0.0 2.96 1302 1122 A 882 MET HGy A 893 HIS HD2 1.0 0.0 4.25 1303 1123 A 894 TRP H A 895 PRO HDy 1.0 0.0 4.09 1304 1124 A 893 HIS H A 892 TYR HBx 1.0 0.0 3.89 1305 1125 A 894 TRP H A 894 TRP HBy 1.0 0.0 3.91 1306 1126 A 892 TYR H A 892 TYR HBx 1.0 0.0 4.02 1307 1127 A 895 PRO HA A 894 TRP H 1.0 0.0 5.50 1308 1128 A 914 CYS H A 917 LYS HEx 1.0 0.0 5.50 1309 1128 A 914 CYS H A 917 LYS HEy 1.0 0.0 5.50 1310 1129 A 919 LYS H A 920 LYS H 1.0 0.0 4.34 1311 1130 A 909 TRP HZ2 A 912 PRO HGy 1.0 0.0 5.40 1312 1131 A 875 LYS H A 874 ASN HBx 1.0 0.0 4.92 1313 1132 A 894 TRP HE1 P 3 THR HB 1.0 0.0 3.99 1314 1133 A 891 TRP H A 891 TRP HBx 1.0 0.0 3.82 1315 1134 A 894 TRP HE1 P 3 THR HA 1.0 0.0 4.59 1316 1135 A 906 GLU H A 905 GLU HBx 1.0 0.0 4.43 1317 1136 A 857 TYR HBx A 857 TYR H 1.0 0.0 3.33 1318 1137 P 3 THR HB A 882 MET H 1.0 0.0 5.19 1319 1138 A 877 ASP H A 876 PRO HBx 1.0 0.0 3.79 1320 1139 A 885 CYS HBy A 911 CYS H 1.0 0.0 3.65 1321 1140 A 867 ILE H A 858 VAL HA 1.0 0.0 4.80 1322 1141 A 892 TYR HE% A 871 PRO HGx 1.0 0.0 4.95 1323 1142 A 914 CYS H A 913 LYS HBy 1.0 0.0 3.80 1324 1143 A 867 ILE H A 859 ILE HA 1.0 0.0 5.39 1325 1144 A 884 GLY H P 2 ARG HBy 1.0 0.0 4.64 1326 1145 A 913 LYS H A 913 LYS HBy 1.0 0.0 3.81 1327 1146 A 894 TRP HE1 A 882 MET H 1.0 0.0 4.61 1328 1147 A 908 GLN H A 907 MET HBx 1.0 0.0 3.97 1329 1148 A 882 MET HBy A 891 TRP HE3 1.0 0.0 3.53 1330 1149 A 913 LYS H A 912 PRO HGx 1.0 0.0 3.23 1331 1150 A 912 PRO HA A 911 CYS HA 1.0 0.0 4.46 1332 1151 A 892 TYR H A 882 MET HBy 1.0 0.0 5.33 1333 1152 A 893 HIS H A 870 CYS HBx 1.0 0.0 3.89 1334 1153 A 918 ILE HA A 917 LYS HGx 1.0 0.0 4.04 1335 1154 A 894 TRP HE3 A 899 ILE HG2% 1.0 0.0 3.67 1336 1155 A 873 CYS H A 870 CYS HBx 1.0 0.0 5.02 1337 1156 A 918 ILE HA A 918 ILE HG1y 1.0 0.0 3.89 1338 1157 A 894 TRP HE3 A 900 MET HA 1.0 0.0 4.08 1339 1158 P 1 ALA HB% A 908 GLN HA 1.0 0.0 3.72 1340 1159 A 894 TRP HE1 A 902 ALA HB% 1.0 0.0 4.29 1341 1160 A 891 TRP HH2 P 3 THR H 1.0 0.0 4.85 1342 1161 A 914 CYS HBx A 915 ALA H 1.0 0.0 3.77 1343 1162 A 885 CYS HBy A 885 CYS H 1.0 0.0 3.68 1344 1163 A 869 ILE H A 858 VAL HA 1.0 0.0 4.47 1345 1164 A 888 CYS H A 888 CYS HBx 1.0 0.0 3.97 1346 1165 A 859 ILE H A 867 ILE HA 1.0 0.0 4.96 1347 1166 A 887 ASP H A 886 ASP HBx 1.0 0.0 4.66 1348 1167 A 867 ILE HD1% A 861 ASP H 1.0 0.0 4.32 1349 1168 A 897 VAL HB A 899 ILE H 1.0 0.0 4.65 1350 1169 A 855 MET H A 855 MET HBx 1.0 0.0 4.12 1351 1170 A 910 PHE HZ A 886 ASP HBx 1.0 0.0 4.39 1352 1171 A 855 MET H A 855 MET HGx 1.0 0.0 4.23 1353 1171 A 855 MET H A 855 MET HGy 1.0 0.0 4.23 1354 1172 A 893 HIS HE1 A 870 CYS HBx 1.0 0.0 3.76 1355 1173 A 910 PHE HE% A 886 ASP HBx 1.0 0.0 4.07 1356 1174 A 856 ALA H A 856 ALA HB% 1.0 0.0 3.09 1357 1175 A 882 MET HGx A 883 ILE H 1.0 0.0 4.58 1358 1176 A 886 ASP H A 886 ASP HBx 1.0 0.0 3.72 1359 1177 A 857 TYR H A 857 TYR HBy 1.0 0.0 4.02 1360 1178 A 893 HIS HD2 A 882 MET HGx 1.0 0.0 3.96 1361 1179 A 861 ASP HBx A 862 GLU H 1.0 0.0 3.69 1362 1180 A 857 TYR HE% A 857 TYR H 1.0 0.0 5.40 1363 1181 A 900 MET H A 900 MET HBx 1.0 0.0 4.05 1364 1182 A 866 GLN H A 865 ASN HBx 1.0 0.0 3.67 1365 1183 A 858 VAL H A 858 VAL HB 1.0 0.0 3.60 1366 1184 A 901 ALA H A 900 MET HBx 1.0 0.0 4.23 1367 1185 A 859 ILE H A 859 ILE HB 1.0 0.0 4.01 1368 1186 A 908 GLN H A 908 GLN HBy 1.0 0.0 3.43 1369 1187 A 909 TRP H A 908 GLN HBy 1.0 0.0 3.68 1370 1188 A 910 PHE HE% A 886 ASP HBy 1.0 0.0 3.81 1371 1189 A 910 PHE HD% A 886 ASP HBy 1.0 0.0 4.36 1372 1190 P 5 GLN HBx P 5 GLN HE2x 1.0 0.0 3.70 1373 1190 P 5 GLN HE2x P 5 GLN HBy 1.0 0.0 3.70 1374 1190 P 5 GLN HBx P 5 GLN HE2y 1.0 0.0 3.70 1375 1190 P 5 GLN HE2y P 5 GLN HBy 1.0 0.0 3.70 1376 1191 A 886 ASP H A 886 ASP HBy 1.0 0.0 3.53 1377 1192 A 881 PRO HA P 5 GLN HBy 1.0 0.0 4.45 1378 1192 A 881 PRO HA P 5 GLN HBx 1.0 0.0 4.45 1379 1193 P 5 GLN HGx P 5 GLN HE2x 1.0 0.0 3.37 1380 1193 P 5 GLN HGx P 5 GLN HE2y 1.0 0.0 3.37 1381 1193 P 5 GLN HE2y P 5 GLN HGy 1.0 0.0 3.37 1382 1193 P 5 GLN HE2x P 5 GLN HGy 1.0 0.0 3.37 1383 1194 P 8 ARG HBx P 8 ARG HDx 1.0 0.0 3.34 1384 1194 P 8 ARG HBy P 8 ARG HDx 1.0 0.0 3.34 1385 1194 P 8 ARG HDy P 8 ARG HBy 1.0 0.0 3.34 1386 1194 P 8 ARG HDy P 8 ARG HBx 1.0 0.0 3.34 1387 1195 A 855 MET H A 855 MET HBx 1.0 0.0 3.48 1388 1195 A 855 MET H A 855 MET HBy 1.0 0.0 3.48 1389 1196 A 865 ASN HBx A 865 ASN HD2y 1.0 0.0 3.58 1390 1196 A 865 ASN HBx A 865 ASN HD2x 1.0 0.0 3.58 1391 1197 A 856 ALA H A 855 MET HBx 1.0 0.0 4.11 1392 1197 A 856 ALA H A 855 MET HBy 1.0 0.0 4.11 1393 1198 A 867 ILE HG2% A 877 ASP HBy 1.0 0.0 3.92 1394 1198 A 867 ILE HG2% A 877 ASP HBx 1.0 0.0 3.92 1395 1199 A 856 ALA HB% A 858 VAL HGy% 1.0 0.0 4.22 1396 1199 A 856 ALA HB% A 858 VAL HGx% 1.0 0.0 4.22 1397 1200 A 868 TRP H A 877 ASP HBy 1.0 0.0 4.98 1398 1200 A 877 ASP HBx A 868 TRP H 1.0 0.0 4.98 1399 1201 A 857 TYR H A 858 VAL HGy% 1.0 0.0 4.83 1400 1201 A 857 TYR H A 858 VAL HGx% 1.0 0.0 4.83 1401 1202 A 869 ILE H A 869 ILE HG1y 1.0 0.0 3.63 1402 1202 A 869 ILE H A 869 ILE HG1x 1.0 0.0 3.63 1403 1203 A 857 TYR HD% A 869 ILE HG1y 1.0 0.0 3.89 1404 1203 A 857 TYR HD% A 869 ILE HG1x 1.0 0.0 3.89 1405 1204 A 869 ILE HA A 876 PRO HBx 1.0 0.0 4.12 1406 1204 A 876 PRO HBy A 869 ILE HA 1.0 0.0 4.12 1407 1205 A 869 ILE HG2% A 869 ILE HG1y 1.0 0.0 2.99 1408 1205 A 869 ILE HG2% A 869 ILE HG1x 1.0 0.0 2.99 1409 1206 A 869 ILE HG2% A 874 ASN HBy 1.0 0.0 4.28 1410 1206 A 869 ILE HG2% A 874 ASN HBx 1.0 0.0 4.28 1411 1207 A 869 ILE HG2% A 874 ASN HD2y 1.0 0.0 5.34 1412 1207 A 869 ILE HG2% A 874 ASN HD2x 1.0 0.0 5.34 1413 1208 A 869 ILE HG2% A 875 LYS HBx 1.0 0.0 4.84 1414 1208 A 875 LYS HBy A 869 ILE HG2% 1.0 0.0 4.84 1415 1209 A 876 PRO HA A 869 ILE HG1y 1.0 0.0 4.26 1416 1209 A 876 PRO HA A 869 ILE HG1x 1.0 0.0 4.26 1417 1210 A 861 ASP HBx A 863 TRP H 1.0 0.0 4.61 1418 1211 A 891 TRP H A 891 TRP HBy 1.0 0.0 3.40 1419 1212 A 860 ARG H A 860 ARG HGx 1.0 0.0 3.98 1420 1213 A 908 GLN H A 907 MET HGx 1.0 0.0 3.61 1421 1213 A 908 GLN H A 907 MET HGy 1.0 0.0 3.61 1422 1214 A 860 ARG H A 860 ARG HBx 1.0 0.0 3.37 1423 1214 A 860 ARG H A 860 ARG HBy 1.0 0.0 3.37 1424 1215 A 907 MET H A 907 MET HGx 1.0 0.0 4.09 1425 1215 A 907 MET H A 907 MET HGy 1.0 0.0 4.09 1426 1216 A 861 ASP HBx A 861 ASP H 1.0 0.0 4.07 1427 1217 A 887 ASP H A 887 ASP HBx 1.0 0.0 3.86 1428 1218 A 862 GLU H A 862 GLU HBy 1.0 0.0 3.60 1429 1219 A 888 CYS H A 887 ASP HBx 1.0 0.0 3.60 1430 1220 A 863 TRP H A 862 GLU HBx 1.0 0.0 4.27 1431 1221 P 3 THR H P 2 ARG HGx 1.0 0.0 4.22 1432 1221 P 3 THR H P 2 ARG HGy 1.0 0.0 4.22 1433 1222 A 910 PHE HE% A 887 ASP HBx 1.0 0.0 3.71 1434 1223 A 863 TRP H A 863 TRP HBy 1.0 0.0 3.71 1435 1224 A 891 TRP HZ2 P 2 ARG HGx 1.0 0.0 4.05 1436 1224 P 2 ARG HGy A 891 TRP HZ2 1.0 0.0 4.05 1437 1225 A 910 PHE HD% A 887 ASP HBx 1.0 0.0 3.51 1438 1226 A 863 TRP HE1 A 862 GLU HGx 1.0 0.0 4.31 1439 1226 A 862 GLU HGy A 863 TRP HE1 1.0 0.0 4.31 1440 1227 A 906 GLU H A 904 PRO HBx 1.0 0.0 4.20 1441 1228 A 877 ASP HBx A 878 ASP H 1.0 0.0 4.60 1442 1229 A 866 GLN H A 866 GLN HGx 1.0 0.0 4.23 1443 1230 A 869 ILE H A 869 ILE HB 1.0 0.0 3.41 1444 1231 A 890 ASP HBx A 891 TRP H 1.0 0.0 3.91 1445 1232 A 873 CYS H A 873 CYS HBy 1.0 0.0 3.95 1446 1233 A 870 CYS H A 869 ILE HB 1.0 0.0 4.91 1447 1234 A 877 ASP HBx A 877 ASP H 1.0 0.0 3.66 1448 1235 A 884 GLY H P 2 ARG HBx 1.0 0.0 4.43 1449 1236 A 891 TRP HZ2 P 2 ARG HBy 1.0 0.0 4.78 1450 1237 A 866 GLN HBy A 868 TRP HH2 1.0 0.0 4.15 1451 1238 A 857 TYR HE% A 869 ILE HG1y 1.0 0.0 5.34 1452 1238 A 857 TYR HE% A 869 ILE HG1x 1.0 0.0 5.34 1453 1239 A 857 TYR HD% A 869 ILE HB 1.0 0.0 3.38 1454 1240 A 857 TYR HE% A 871 PRO HBx 1.0 0.0 4.39 1455 1240 A 857 TYR HE% A 871 PRO HBy 1.0 0.0 4.39 1456 1241 A 866 GLN HE2x A 866 GLN HBy 1.0 0.0 4.07 1457 1242 A 858 VAL H A 858 VAL HGy% 1.0 0.0 3.39 1458 1242 A 858 VAL H A 858 VAL HGx% 1.0 0.0 3.39 1459 1243 A 858 VAL HA A 859 ILE HG1y 1.0 0.0 4.25 1460 1243 A 858 VAL HA A 859 ILE HG1x 1.0 0.0 4.25 1461 1244 A 859 ILE H A 858 VAL HGy% 1.0 0.0 3.41 1462 1244 A 859 ILE H A 858 VAL HGx% 1.0 0.0 3.41 1463 1245 A 859 ILE HG2% A 858 VAL HGy% 1.0 0.0 4.27 1464 1245 A 859 ILE HG2% A 858 VAL HGx% 1.0 0.0 4.27 1465 1246 A 869 ILE HD1% A 876 PRO HBx 1.0 0.0 3.34 1466 1246 A 876 PRO HBy A 869 ILE HD1% 1.0 0.0 3.34 1467 1247 A 860 ARG H A 858 VAL HGy% 1.0 0.0 5.25 1468 1247 A 860 ARG H A 858 VAL HGx% 1.0 0.0 5.25 1469 1248 A 870 CYS HA A 871 PRO HBx 1.0 0.0 4.86 1470 1248 A 870 CYS HA A 871 PRO HBy 1.0 0.0 4.86 1471 1249 A 866 GLN HA A 858 VAL HGy% 1.0 0.0 4.18 1472 1249 A 866 GLN HA A 858 VAL HGx% 1.0 0.0 4.18 1473 1250 A 872 GLY H A 871 PRO HBx 1.0 0.0 4.00 1474 1250 A 872 GLY H A 871 PRO HBy 1.0 0.0 4.00 1475 1251 A 866 GLN HBx A 858 VAL HGy% 1.0 0.0 3.63 1476 1251 A 866 GLN HBx A 858 VAL HGx% 1.0 0.0 3.63 1477 1252 A 892 TYR HE% A 871 PRO HBx 1.0 0.0 5.34 1478 1252 A 892 TYR HE% A 871 PRO HBy 1.0 0.0 5.34 1479 1253 A 866 GLN HBy A 858 VAL HGy% 1.0 0.0 3.72 1480 1253 A 866 GLN HBy A 858 VAL HGx% 1.0 0.0 3.72 1481 1254 A 872 GLY H A 871 PRO HDy 1.0 0.0 3.80 1482 1254 A 872 GLY H A 871 PRO HDx 1.0 0.0 3.80 1483 1255 A 874 ASN H A 871 PRO HDy 1.0 0.0 5.27 1484 1255 A 874 ASN H A 871 PRO HDx 1.0 0.0 5.27 1485 1256 A 892 TYR HA A 871 PRO HDy 1.0 0.0 4.46 1486 1256 A 892 TYR HA A 871 PRO HDx 1.0 0.0 4.46 1487 1257 A 892 TYR HE% A 871 PRO HDy 1.0 0.0 4.67 1488 1257 A 892 TYR HE% A 871 PRO HDx 1.0 0.0 4.67 1489 1258 A 873 CYS HBx A 875 LYS HGy 1.0 0.0 4.68 1490 1258 A 873 CYS HBy A 875 LYS HGy 1.0 0.0 4.68 1491 1258 A 875 LYS HGx A 873 CYS HBy 1.0 0.0 4.68 1492 1258 A 875 LYS HGx A 873 CYS HBx 1.0 0.0 4.68 1493 1259 A 873 CYS HBy A 875 LYS HDx 1.0 0.0 4.53 1494 1259 A 873 CYS HBx A 875 LYS HDx 1.0 0.0 4.53 1495 1259 A 875 LYS HDy A 873 CYS HBy 1.0 0.0 4.53 1496 1259 A 875 LYS HDy A 873 CYS HBx 1.0 0.0 4.53 1497 1260 A 910 PHE HBx A 915 ALA H 1.0 0.0 4.31 1498 1261 A 914 CYS H A 910 PHE HBx 1.0 0.0 4.66 1499 1262 A 880 SER H A 880 SER HBx 1.0 0.0 3.90 1500 1263 A 911 CYS HBx A 911 CYS H 1.0 0.0 3.56 1501 1264 A 890 ASP H A 890 ASP HBx 1.0 0.0 3.87 1502 1265 A 900 MET H A 900 MET HGx 1.0 0.0 3.99 1503 1266 A 896 CYS H A 896 CYS HBy 1.0 0.0 3.51 1504 1267 A 896 CYS H A 895 PRO HBy 1.0 0.0 4.49 1505 1268 A 902 ALA HB% A 902 ALA H 1.0 0.0 2.87 1506 1269 A 908 GLN H A 908 GLN HGy 1.0 0.0 4.24 1507 1270 A 905 GLU H A 905 GLU HGy 1.0 0.0 3.90 1508 1271 A 857 TYR HE% A 869 ILE HB 1.0 0.0 4.60 1509 1272 A 875 LYS HBy A 875 LYS H 1.0 0.0 3.94 1510 1273 A 907 MET H A 907 MET HBx 1.0 0.0 3.21 1511 1274 A 882 MET HBy A 883 ILE H 1.0 0.0 4.10 1512 1275 A 913 LYS H A 912 PRO HBy 1.0 0.0 4.52 1513 1276 A 907 MET H A 907 MET HBy 1.0 0.0 3.21 1514 1277 A 866 GLN H A 866 GLN HBy 1.0 0.0 3.66 1515 1278 A 892 TYR H A 882 MET HBx 1.0 0.0 4.44 1516 1279 A 908 GLN H A 908 GLN HGx 1.0 0.0 4.24 1517 1280 A 891 TRP HE3 A 882 MET HBx 1.0 0.0 3.68 1518 1281 A 908 GLN HE2x A 908 GLN HBy 1.0 0.0 4.57 1519 1282 A 893 HIS HE1 A 875 LYS HDx 1.0 0.0 5.32 1520 1282 A 893 HIS HE1 A 875 LYS HDy 1.0 0.0 5.32 1521 1283 A 909 TRP HBy A 909 TRP H 1.0 0.0 3.97 1522 1284 A 917 LYS HBy A 916 ASN H 1.0 0.0 5.50 1523 1285 P 2 ARG HBx P 2 ARG HE 1.0 0.0 4.53 1524 1286 A 891 TRP HZ3 P 2 ARG HBx 1.0 0.0 4.90 1525 1287 A 866 GLN HGx A 858 VAL HGy% 1.0 0.0 3.79 1526 1287 A 866 GLN HGx A 858 VAL HGx% 1.0 0.0 3.79 1527 1288 A 910 PHE HZ A 908 GLN HBx 1.0 0.0 4.07 1528 1289 A 866 GLN HGy A 858 VAL HGy% 1.0 0.0 3.81 1529 1289 A 866 GLN HGy A 858 VAL HGx% 1.0 0.0 3.81 1530 1290 A 909 TRP H A 908 GLN HBx 1.0 0.0 3.65 1531 1291 A 866 GLN HE2x A 858 VAL HGy% 1.0 0.0 3.82 1532 1291 A 866 GLN HE2x A 858 VAL HGx% 1.0 0.0 3.82 1533 1292 A 866 GLN HE2y A 858 VAL HGy% 1.0 0.0 4.04 1534 1292 A 866 GLN HE2y A 858 VAL HGx% 1.0 0.0 4.04 1535 1293 A 867 ILE H A 858 VAL HGy% 1.0 0.0 4.08 1536 1293 A 867 ILE H A 858 VAL HGx% 1.0 0.0 4.08 1537 1294 A 868 TRP HA A 858 VAL HGy% 1.0 0.0 3.89 1538 1294 A 868 TRP HA A 858 VAL HGx% 1.0 0.0 3.89 1539 1295 A 865 ASN H A 866 GLN H 1.0 0.0 4.63 1540 1296 A 874 ASN H A 874 ASN HBy 1.0 0.0 3.63 1541 1296 A 874 ASN H A 874 ASN HBx 1.0 0.0 3.63 1542 1297 A 868 TRP HD1 A 858 VAL HGy% 1.0 0.0 4.14 1543 1297 A 868 TRP HD1 A 858 VAL HGx% 1.0 0.0 4.14 1544 1298 A 906 GLU H A 907 MET H 1.0 0.0 3.27 1545 1299 A 874 ASN HA A 874 ASN HD2y 1.0 0.0 4.43 1546 1299 A 874 ASN HA A 874 ASN HD2x 1.0 0.0 4.43 1547 1300 A 868 TRP HE1 A 858 VAL HGy% 1.0 0.0 3.95 1548 1300 A 868 TRP HE1 A 858 VAL HGx% 1.0 0.0 3.95 1549 1301 A 905 GLU HA A 907 MET H 1.0 0.0 4.27 1550 1302 A 874 ASN HBy A 874 ASN HD2y 1.0 0.0 3.08 1551 1302 A 874 ASN HBx A 874 ASN HD2y 1.0 0.0 3.08 1552 1302 A 874 ASN HD2x A 874 ASN HBy 1.0 0.0 3.08 1553 1302 A 874 ASN HBx A 874 ASN HD2x 1.0 0.0 3.08 1554 1303 A 868 TRP HZ2 A 858 VAL HGy% 1.0 0.0 3.98 1555 1303 A 868 TRP HZ2 A 858 VAL HGx% 1.0 0.0 3.98 1556 1304 A 907 MET H A 904 PRO HBy 1.0 0.0 4.63 1557 1305 A 875 LYS H A 874 ASN HBy 1.0 0.0 4.27 1558 1305 A 875 LYS H A 874 ASN HBx 1.0 0.0 4.27 1559 1306 A 859 ILE HG2% A 859 ILE HG1y 1.0 0.0 3.02 1560 1306 A 859 ILE HG2% A 859 ILE HG1x 1.0 0.0 3.02 1561 1307 A 907 MET H A 904 PRO HBx 1.0 0.0 3.89 1562 1308 A 875 LYS H A 875 LYS HBx 1.0 0.0 3.34 1563 1308 A 875 LYS HBy A 875 LYS H 1.0 0.0 3.34 1564 1309 A 921 ASP H A 920 LYS HBy 1.0 0.0 4.41 1565 1310 A 875 LYS H A 875 LYS HGy 1.0 0.0 3.74 1566 1310 A 875 LYS HGx A 875 LYS H 1.0 0.0 3.74 1567 1311 A 921 ASP H A 920 LYS HBx 1.0 0.0 4.41 1568 1312 A 875 LYS HA A 875 LYS HGy 1.0 0.0 3.53 1569 1312 A 875 LYS HGx A 875 LYS HA 1.0 0.0 3.53 1570 1313 A 893 HIS H A 897 VAL HGx% 1.0 0.0 4.45 1571 1314 A 875 LYS HBy A 875 LYS HDx 1.0 0.0 3.35 1572 1314 A 875 LYS HBx A 875 LYS HDx 1.0 0.0 3.35 1573 1314 A 875 LYS HDy A 875 LYS HBx 1.0 0.0 3.35 1574 1314 A 875 LYS HBy A 875 LYS HDy 1.0 0.0 3.35 1575 1315 A 893 HIS H A 894 TRP H 1.0 0.0 4.81 1576 1316 A 875 LYS HBy A 875 LYS HEx 1.0 0.0 4.20 1577 1316 A 875 LYS HBx A 875 LYS HEx 1.0 0.0 4.20 1578 1316 A 875 LYS HEy A 875 LYS HBx 1.0 0.0 4.20 1579 1316 A 875 LYS HBy A 875 LYS HEy 1.0 0.0 4.20 1580 1317 A 893 HIS H A 870 CYS HBy 1.0 0.0 4.36 1581 1318 A 876 PRO HDy A 875 LYS HBx 1.0 0.0 3.35 1582 1318 A 875 LYS HBy A 876 PRO HDy 1.0 0.0 3.35 1583 1319 A 910 PHE HBy A 910 PHE H 1.0 0.0 3.63 1584 1320 A 914 CYS H A 914 CYS HBx 1.0 0.0 3.59 1585 1321 A 916 ASN H A 916 ASN HBx 1.0 0.0 3.58 1586 1322 A 916 ASN H A 916 ASN HBy 1.0 0.0 3.58 1587 1323 A 917 LYS H A 917 LYS HBy 1.0 0.0 3.12 1588 1324 A 908 GLN H A 908 GLN HBx 1.0 0.0 3.91 1589 1325 A 917 LYS H A 917 LYS HGy 1.0 0.0 3.54 1590 1326 A 867 ILE H A 867 ILE HB 1.0 0.0 3.46 1591 1327 A 917 LYS H A 917 LYS HGx 1.0 0.0 3.86 1592 1328 A 867 ILE HG2% A 869 ILE H 1.0 0.0 4.50 1593 1329 A 857 TYR HE% A 871 PRO HBx 1.0 0.0 5.20 1594 1330 A 917 LYS H A 917 LYS HEx 1.0 0.0 4.49 1595 1330 A 917 LYS H A 917 LYS HEy 1.0 0.0 4.49 1596 1331 A 867 ILE HG2% A 869 ILE HA 1.0 0.0 4.29 1597 1332 A 859 ILE H A 867 ILE HB 1.0 0.0 3.84 1598 1333 A 918 ILE H A 918 ILE HB 1.0 0.0 2.93 1599 1334 A 902 ALA HB% A 901 ALA HA 1.0 0.0 4.23 1600 1335 P 9 LYS H P 8 ARG HGy 1.0 0.0 5.16 1601 1335 P 9 LYS H P 8 ARG HGx 1.0 0.0 5.16 1602 1336 A 918 ILE H A 918 ILE HG1x 1.0 0.0 3.55 1603 1337 A 902 ALA HB% A 903 PRO HDy 1.0 0.0 4.20 1604 1338 A 861 ASP H A 860 ARG HBx 1.0 0.0 3.48 1605 1338 A 861 ASP H A 860 ARG HBy 1.0 0.0 3.48 1606 1339 A 918 ILE H A 918 ILE HG2% 1.0 0.0 3.94 1607 1340 A 915 ALA HB% A 910 PHE HD% 1.0 0.0 4.53 1608 1341 A 864 GLY H A 860 ARG HBx 1.0 0.0 4.42 1609 1341 A 864 GLY H A 860 ARG HBy 1.0 0.0 4.42 1610 1342 A 869 ILE H A 869 ILE HG2% 1.0 0.0 4.26 1611 1343 A 894 TRP HE1 A 883 ILE HB 1.0 0.0 3.51 1612 1344 A 866 GLN H A 866 GLN HGy 1.0 0.0 3.97 1613 1345 A 876 PRO HA A 869 ILE HG2% 1.0 0.0 3.96 1614 1346 A 860 ARG H A 859 ILE HG1y 1.0 0.0 3.93 1615 1346 A 860 ARG H A 859 ILE HG1x 1.0 0.0 3.93 1616 1347 A 884 GLY H A 883 ILE HB 1.0 0.0 4.37 1617 1348 A 903 PRO HGy A 909 TRP HD1 1.0 0.0 4.78 1618 1349 A 899 ILE HG2% A 894 TRP HBy 1.0 0.0 4.47 1619 1350 A 867 ILE H A 859 ILE HG1y 1.0 0.0 4.61 1620 1350 A 867 ILE H A 859 ILE HG1x 1.0 0.0 4.61 1621 1351 A 867 ILE H A 867 ILE HG1x 1.0 0.0 4.12 1622 1352 A 872 GLY H A 871 PRO HDx 1.0 0.0 4.35 1623 1353 A 899 ILE HG2% A 902 ALA HA 1.0 0.0 4.27 1624 1354 A 860 ARG HBx A 864 GLY HAx 1.0 0.0 3.68 1625 1354 A 860 ARG HBy A 864 GLY HAx 1.0 0.0 3.68 1626 1354 A 864 GLY HAy A 860 ARG HBx 1.0 0.0 3.68 1627 1354 A 864 GLY HAy A 860 ARG HBy 1.0 0.0 3.68 1628 1355 A 894 TRP HZ3 A 899 ILE HG2% 1.0 0.0 4.35 1629 1356 A 861 ASP H A 860 ARG HGx 1.0 0.0 4.05 1630 1356 A 861 ASP H A 860 ARG HGy 1.0 0.0 4.05 1631 1357 A 869 ILE H A 869 ILE HG1x 1.0 0.0 4.37 1632 1358 A 864 GLY H A 860 ARG HGx 1.0 0.0 5.06 1633 1358 A 864 GLY H A 860 ARG HGy 1.0 0.0 5.06 1634 1359 A 859 ILE H A 859 ILE HG1x 1.0 0.0 3.69 1635 1360 A 860 ARG HDy A 864 GLY HAx 1.0 0.0 3.76 1636 1360 A 864 GLY HAy A 860 ARG HDx 1.0 0.0 3.76 1637 1360 A 864 GLY HAy A 860 ARG HDy 1.0 0.0 3.76 1638 1360 A 860 ARG HDx A 864 GLY HAx 1.0 0.0 3.76 1639 1361 A 890 ASP H A 885 CYS HBx 1.0 0.0 3.78 1640 1362 A 876 PRO HDx A 875 LYS HBx 1.0 0.0 3.82 1641 1362 A 875 LYS HBy A 876 PRO HDx 1.0 0.0 3.82 1642 1363 A 861 ASP H A 861 ASP HBy 1.0 0.0 3.37 1643 1363 A 861 ASP HBx A 861 ASP H 1.0 0.0 3.37 1644 1364 A 867 ILE HG2% A 868 TRP H 1.0 0.0 3.64 1645 1365 A 890 ASP H A 885 CYS HBy 1.0 0.0 4.17 1646 1366 A 888 CYS SG A 885 CYS SG 1.0 4.0 4.00 1647 1367 A 911 CYS SG A 885 CYS SG 1.0 4.0 4.00 1648 1368 A 914 CYS SG A 885 CYS SG 1.0 4.0 4.00 1649 1369 A 911 CYS SG A 888 CYS SG 1.0 4.0 4.00 1650 1370 A 914 CYS SG A 888 CYS SG 1.0 4.0 4.00 1651 1371 A 914 CYS SG A 911 CYS SG 1.0 4.0 4.00 1652 1372 A 870 CYS SG A 873 CYS SG 1.0 4.0 4.00 1653 1373 A 870 CYS SG A 893 HIS ND1 1.0 3.8 3.80 1654 1374 A 870 CYS SG A 896 CYS SG 1.0 4.0 4.00 1655 1375 A 873 CYS SG A 893 HIS ND1 1.0 3.8 3.80 1656 1376 A 873 CYS SG A 896 CYS SG 1.0 4.0 4.00 1657 1377 A 896 CYS SG A 893 HIS ND1 1.0 3.8 3.80 1658 1378 P 1 ALA H1 P 2 ARG H 1.0 0.0 5.72 1659 1379 P 2 ARG HA P 1 ALA H1 1.0 0.0 5.17 1660 1380 P 2 ARG HBx P 1 ALA H1 1.0 0.0 4.93 1661 1381 P 1 ALA H1 P 2 ARG HDy 1.0 0.0 5.71 1662 1381 P 2 ARG HDx P 1 ALA H1 1.0 0.0 5.71 1663 1382 P 1 ALA H1 P 2 ARG HGx 1.0 0.0 4.56 1664 1382 P 2 ARG HGy P 1 ALA H1 1.0 0.0 4.56 1665 1383 P 1 ALA HB% P 2 ARG H 1.0 0.0 5.00 1666 1384 P 2 ARG HA P 1 ALA HB% 1.0 0.0 4.94 1667 1385 P 3 THR HA P 1 ALA HB% 1.0 0.0 5.78 1668 1386 A 883 ILE HA P 1 ALA HB% 1.0 0.0 5.48 1669 1387 P 1 ALA HB% A 883 ILE HB 1.0 0.0 4.60 1670 1388 A 883 ILE HG1x P 1 ALA HB% 1.0 0.0 4.73 1671 1389 A 885 CYS HA P 1 ALA HB% 1.0 0.0 5.50 1672 1390 A 902 ALA HA P 1 ALA HB% 1.0 0.0 5.25 1673 1391 A 903 PRO HA P 1 ALA HB% 1.0 0.0 5.32 1674 1392 P 1 ALA HB% A 903 PRO HBy 1.0 0.0 4.65 1675 1393 P 1 ALA HB% A 903 PRO HDx 1.0 0.0 4.31 1676 1394 A 903 PRO HDy P 1 ALA HB% 1.0 0.0 4.04 1677 1395 A 904 PRO HDy P 1 ALA HB% 1.0 0.0 5.57 1678 1396 A 904 PRO HDx P 1 ALA HB% 1.0 0.0 5.63 1679 1397 A 905 GLU HA P 1 ALA HB% 1.0 0.0 5.43 1680 1398 P 1 ALA HB% A 907 MET HBx 1.0 0.0 5.05 1681 1399 P 1 ALA HB% A 907 MET HBy 1.0 0.0 4.71 1682 1400 P 1 ALA HB% A 907 MET HGx 1.0 0.0 4.98 1683 1400 P 1 ALA HB% A 907 MET HGy 1.0 0.0 4.98 1684 1401 P 1 ALA HB% A 909 TRP HD1 1.0 0.0 5.03 1685 1402 P 1 ALA HB% A 910 PHE H 1.0 0.0 5.67 1686 1403 P 2 ARG HBy P 2 ARG H 1.0 0.0 4.57 1687 1404 P 2 ARG HBx P 2 ARG H 1.0 0.0 4.51 1688 1405 P 2 ARG H P 2 ARG HGx 1.0 0.0 4.30 1689 1405 P 2 ARG HGy P 2 ARG H 1.0 0.0 4.30 1690 1406 P 2 ARG HA P 2 ARG HBy 1.0 0.0 4.58 1691 1407 P 2 ARG HBy P 2 ARG HE 1.0 0.0 5.27 1692 1408 P 2 ARG HBy P 2 ARG HDy 1.0 0.0 4.46 1693 1408 P 2 ARG HDx P 2 ARG HBy 1.0 0.0 4.46 1694 1409 P 2 ARG HA P 2 ARG HBx 1.0 0.0 4.57 1695 1410 P 2 ARG HA P 2 ARG HDx 1.0 0.0 5.37 1696 1411 P 2 ARG HDx P 2 ARG HBy 1.0 0.0 4.46 1697 1412 P 2 ARG HBx P 2 ARG HDx 1.0 0.0 4.43 1698 1413 P 2 ARG HGy P 2 ARG HDx 1.0 0.0 4.19 1699 1413 P 2 ARG HDx P 2 ARG HGx 1.0 0.0 4.19 1700 1414 P 2 ARG HA P 2 ARG HDy 1.0 0.0 5.45 1701 1415 P 2 ARG HBy P 2 ARG HDy 1.0 0.0 4.68 1702 1416 P 2 ARG HBx P 2 ARG HDy 1.0 0.0 4.70 1703 1417 P 2 ARG HGy P 2 ARG HDy 1.0 0.0 4.40 1704 1417 P 2 ARG HDy P 2 ARG HGx 1.0 0.0 4.40 1705 1418 P 2 ARG HA P 2 ARG HE 1.0 0.0 5.45 1706 1419 P 2 ARG HDx P 2 ARG HE 1.0 0.0 4.56 1707 1420 P 2 ARG HE P 2 ARG HDy 1.0 0.0 4.58 1708 1421 P 2 ARG HE P 2 ARG HGx 1.0 0.0 4.58 1709 1421 P 2 ARG HGy P 2 ARG HE 1.0 0.0 4.58 1710 1422 P 2 ARG HDx P 2 ARG HGx 1.0 0.0 4.03 1711 1422 P 2 ARG HGy P 2 ARG HDy 1.0 0.0 4.03 1712 1422 P 2 ARG HGy P 2 ARG HDx 1.0 0.0 4.03 1713 1422 P 2 ARG HDy P 2 ARG HGx 1.0 0.0 4.03 1714 1423 P 2 ARG HDx A 891 TRP HZ2 1.0 0.0 5.67 1715 1424 A 891 TRP HZ2 P 2 ARG HDy 1.0 0.0 5.81 1716 1425 P 3 THR H P 2 ARG HDy 1.0 0.0 5.70 1717 1425 P 3 THR H P 2 ARG HDx 1.0 0.0 5.70 1718 1426 P 3 THR HA P 3 THR H 1.0 0.0 4.27 1719 1427 P 3 THR HA P 3 THR HB 1.0 0.0 4.52 1720 1428 P 3 THR HG2% P 3 THR H 1.0 0.0 3.85 1721 1429 P 3 THR HG2% P 3 THR HB 1.0 0.0 3.48 1722 1430 A 883 ILE HG1y P 3 THR HA 1.0 0.0 5.52 1723 1431 A 883 ILE HG1x P 3 THR HG2% 1.0 0.0 4.40 1724 1432 A 891 TRP HZ3 P 3 THR H 1.0 0.0 5.24 1725 1433 P 3 THR HA A 891 TRP HE3 1.0 0.0 6.28 1726 1434 A 894 TRP HZ2 P 3 THR HA 1.0 0.0 6.14 1727 1435 A 894 TRP HH2 P 3 THR HG2% 1.0 0.0 4.72 1728 1436 P 5 GLN HA P 5 GLN H 1.0 0.0 4.60 1729 1437 P 5 GLN H P 5 GLN HBy 1.0 0.0 5.22 1730 1438 P 5 GLN HBx P 5 GLN H 1.0 0.0 5.08 1731 1439 P 5 GLN HGx P 5 GLN H 1.0 0.0 5.15 1732 1440 P 5 GLN HA P 5 GLN HBy 1.0 0.0 4.16 1733 1441 P 5 GLN HBx P 5 GLN HBy 1.0 0.0 3.42 1734 1442 P 5 GLN HE2x P 5 GLN HBy 1.0 0.0 6.10 1735 1443 P 5 GLN HA P 5 GLN HBx 1.0 0.0 4.14 1736 1444 P 5 GLN HA P 5 GLN HE2y 1.0 0.0 5.76 1737 1445 P 5 GLN HE2y P 5 GLN HBy 1.0 0.0 4.88 1738 1446 P 5 GLN HBx P 5 GLN HE2y 1.0 0.0 4.73 1739 1447 P 5 GLN HE2x P 5 GLN HE2y 1.0 0.0 2.95 1740 1448 P 5 GLN HGx P 5 GLN HE2y 1.0 0.0 4.38 1741 1449 P 5 GLN HE2y P 5 GLN HGy 1.0 0.0 4.42 1742 1450 P 5 GLN HA P 5 GLN HGx 1.0 0.0 4.52 1743 1451 P 5 GLN HGx P 5 GLN HBy 1.0 0.0 3.78 1744 1452 P 5 GLN HBx P 5 GLN HGx 1.0 0.0 4.14 1745 1453 P 5 GLN HGx P 5 GLN HE2x 1.0 0.0 5.32 1746 1454 P 5 GLN H P 5 GLN HGy 1.0 0.0 5.28 1747 1455 P 5 GLN HA P 5 GLN HGy 1.0 0.0 4.34 1748 1456 P 5 GLN HBy P 5 GLN HGy 1.0 0.0 3.62 1749 1457 P 5 GLN HBx P 5 GLN HGy 1.0 0.0 3.88 1750 1458 P 5 GLN HE2x P 5 GLN HGy 1.0 0.0 5.47 1751 1459 P 5 GLN H P 6 THR H 1.0 0.0 5.82 1752 1460 P 6 THR H P 5 GLN HBy 1.0 0.0 5.21 1753 1461 P 5 GLN HBx P 6 THR H 1.0 0.0 5.08 1754 1462 P 5 GLN HGx P 6 THR H 1.0 0.0 5.84 1755 1463 P 6 THR H P 5 GLN HGy 1.0 0.0 5.50 1756 1464 P 7 ALA H P 5 GLN HBy 1.0 0.0 6.05 1757 1465 P 7 ALA HB% P 5 GLN HE2y 1.0 0.0 5.15 1758 1466 P 7 ALA H P 5 GLN HGx 1.0 0.0 5.72 1759 1467 P 7 ALA H P 5 GLN HGy 1.0 0.0 5.76 1760 1468 A 880 SER HA P 5 GLN HE2y 1.0 0.0 5.70 1761 1469 A 881 PRO HA P 5 GLN HBy 1.0 0.0 5.03 1762 1470 A 881 PRO HBy P 5 GLN HBy 1.0 0.0 5.71 1763 1471 A 881 PRO HGx P 5 GLN HBy 1.0 0.0 5.09 1764 1472 P 5 GLN HBy A 881 PRO HGy 1.0 0.0 5.41 1765 1473 A 881 PRO HA P 5 GLN HBx 1.0 0.0 5.06 1766 1474 A 881 PRO HDy P 5 GLN HE2y 1.0 0.0 5.81 1767 1475 A 881 PRO HGx P 5 GLN HGx 1.0 0.0 5.62 1768 1476 P 5 GLN HGx A 881 PRO HGy 1.0 0.0 5.26 1769 1477 A 881 PRO HA P 5 GLN HGy 1.0 0.0 5.40 1770 1478 A 881 PRO HBx P 5 GLN HGy 1.0 0.0 6.20 1771 1479 A 881 PRO HDy P 5 GLN HGy 1.0 0.0 5.80 1772 1480 A 881 PRO HGx P 5 GLN HGy 1.0 0.0 5.32 1773 1481 P 5 GLN HGy A 881 PRO HGy 1.0 0.0 5.03 1774 1482 A 882 MET H P 5 GLN HBy 1.0 0.0 5.96 1775 1483 A 882 MET H P 5 GLN HBx 1.0 0.0 5.89 1776 1484 A 882 MET H P 5 GLN HGx 1.0 0.0 6.06 1777 1485 A 882 MET H P 5 GLN HGy 1.0 0.0 5.87 1778 1486 P 5 GLN HA P 6 THR H 1.0 0.0 4.07 1779 1487 P 6 THR HA P 6 THR H 1.0 0.0 4.07 1780 1488 P 6 THR H P 6 THR HB 1.0 0.0 4.81 1781 1489 P 6 THR HA P 6 THR HB 1.0 0.0 3.92 1782 1490 P 6 THR HG2% P 6 THR H 1.0 0.0 4.23 1783 1491 P 6 THR HG2% P 6 THR HB 1.0 0.0 3.15 1784 1492 P 7 ALA HB% P 6 THR H 1.0 0.0 6.11 1785 1493 P 7 ALA HB% P 6 THR HB 1.0 0.0 5.85 1786 1494 P 6 THR HB A 879 GLY HAx 1.0 0.0 6.12 1787 1495 A 879 GLY HAy P 6 THR HG2% 1.0 0.0 4.94 1788 1496 P 6 THR HG2% A 879 GLY HAx 1.0 0.0 5.04 1789 1497 P 7 ALA H P 6 THR H 1.0 0.0 5.20 1790 1498 P 7 ALA H P 6 THR HA 1.0 0.0 3.62 1791 1499 P 7 ALA H P 6 THR HB 1.0 0.0 4.68 1792 1500 P 7 ALA HB% P 6 THR HA 1.0 0.0 4.45 1793 1501 P 7 ALA H P 7 ALA HA 1.0 0.0 4.04 1794 1502 P 7 ALA HB% P 7 ALA HA 1.0 0.0 3.03 1795 1503 P 7 ALA HB% P 8 ARG H 1.0 0.0 4.07 1796 1504 P 7 ALA H A 879 GLY HAx 1.0 0.0 5.81 1797 1505 P 6 THR HG2% P 8 ARG H 1.0 0.0 5.51 1798 1506 P 8 ARG H P 8 ARG HA 1.0 0.0 3.30 1799 1507 P 8 ARG H P 8 ARG HBx 1.0 0.0 4.08 1800 1508 P 8 ARG H P 8 ARG HBy 1.0 0.0 4.35 1801 1509 P 8 ARG H P 8 ARG HGx 1.0 0.0 4.76 1802 1510 P 8 ARG H P 8 ARG HGy 1.0 0.0 4.70 1803 1511 P 8 ARG H P 8 ARG HDx 1.0 0.0 5.57 1804 1511 P 8 ARG H P 8 ARG HDy 1.0 0.0 5.57 1805 1512 P 8 ARG HA P 8 ARG HBx 1.0 0.0 4.06 1806 1513 P 8 ARG HA P 8 ARG HBy 1.0 0.0 4.05 1807 1514 P 8 ARG HE P 8 ARG HDx 1.0 0.0 5.19 1808 1514 P 8 ARG HDy P 8 ARG HE 1.0 0.0 5.19 1809 1515 P 8 ARG HGx P 8 ARG HA 1.0 0.0 4.50 1810 1516 P 8 ARG HGx P 8 ARG HBx 1.0 0.0 3.93 1811 1517 P 8 ARG HGx P 8 ARG HBy 1.0 0.0 3.62 1812 1518 P 8 ARG HA P 8 ARG HGy 1.0 0.0 4.58 1813 1519 P 8 ARG HBx P 8 ARG HGy 1.0 0.0 3.79 1814 1520 P 8 ARG HBy P 8 ARG HGy 1.0 0.0 3.88 1815 1521 P 8 ARG HA P 8 ARG HDx 1.0 0.0 4.50 1816 1521 P 8 ARG HA P 8 ARG HDy 1.0 0.0 4.50 1817 1522 P 8 ARG HGx P 8 ARG HDy 1.0 0.0 3.87 1818 1522 P 8 ARG HGx P 8 ARG HDx 1.0 0.0 3.87 1819 1523 P 8 ARG HDy P 8 ARG HGy 1.0 0.0 3.68 1820 1523 P 8 ARG HDx P 8 ARG HGy 1.0 0.0 3.68 1821 1524 P 9 LYS H P 7 ALA HB% 1.0 0.0 4.28 1822 1525 P 9 LYS H P 8 ARG HA 1.0 0.0 3.80 1823 1526 P 9 LYS H P 8 ARG HGx 1.0 0.0 5.69 1824 1527 P 9 LYS H P 8 ARG HGy 1.0 0.0 5.57 1825 1528 P 9 LYS H P 9 LYS HA 1.0 0.0 4.88 1826 1529 P 9 LYS H P 9 LYS HBx 1.0 0.0 4.22 1827 1530 P 9 LYS H P 9 LYS HBy 1.0 0.0 4.38 1828 1531 P 9 LYS HA P 9 LYS HEx 1.0 0.0 6.01 1829 1531 P 9 LYS HA P 9 LYS HEy 1.0 0.0 6.01 1830 1532 P 9 LYS HA P 9 LYS HBx 1.0 0.0 4.31 1831 1533 P 9 LYS HA P 9 LYS HBy 1.0 0.0 4.21 1832 1534 P 9 LYS HGx P 9 LYS HBx 1.0 0.0 4.08 1833 1535 P 9 LYS HGx P 9 LYS HBy 1.0 0.0 4.12 1834 1536 P 9 LYS HGx P 9 LYS HDy 1.0 0.0 3.43 1835 1536 P 9 LYS HGx P 9 LYS HDx 1.0 0.0 3.43 1836 1537 P 9 LYS HGx P 9 LYS HEy 1.0 0.0 5.36 1837 1537 P 9 LYS HGx P 9 LYS HEx 1.0 0.0 5.36 1838 1538 P 9 LYS HA P 9 LYS HGy 1.0 0.0 4.63 1839 1539 P 9 LYS HBx P 9 LYS HGy 1.0 0.0 4.13 1840 1540 P 9 LYS HBy P 9 LYS HGy 1.0 0.0 4.51 1841 1541 P 9 LYS HDy P 9 LYS HGy 1.0 0.0 3.94 1842 1541 P 9 LYS HDx P 9 LYS HGy 1.0 0.0 3.94 1843 1542 P 9 LYS HA P 9 LYS HDx 1.0 0.0 5.27 1844 1542 P 9 LYS HA P 9 LYS HDy 1.0 0.0 5.27 1845 1543 P 9 LYS HEy P 9 LYS HGy 1.0 0.0 5.07 1846 1543 P 9 LYS HEx P 9 LYS HGy 1.0 0.0 5.07 1847 1544 P 9 LYS HDx P 9 LYS HEx 1.0 0.0 3.08 1848 1544 P 9 LYS HDy P 9 LYS HEx 1.0 0.0 3.08 1849 1544 P 9 LYS HEy P 9 LYS HDx 1.0 0.0 3.08 1850 1544 P 9 LYS HEy P 9 LYS HDy 1.0 0.0 3.08 1851 1545 P 10 SER H P 10 SER HA 1.0 0.0 5.95 1852 1546 P 10 SER HA P 10 SER HBx 1.0 0.0 4.59 1853 1547 P 10 SER HA P 10 SER HBy 1.0 0.0 4.57 1854 1548 P 10 SER HBx P 10 SER HBy 1.0 0.0 2.90 1855 1549 P 10 SER HA P 11 THR H 1.0 0.0 5.60 1856 1550 P 11 THR H P 11 THR HA 1.0 0.0 5.53 1857 1551 P 11 THR H P 11 THR HB 1.0 0.0 6.11 1858 1552 P 11 THR HA P 11 THR HB 1.0 0.0 5.17 1859 1553 P 11 THR HG2% P 11 THR HA 1.0 0.0 4.55 1860 1554 P 11 THR HG2% P 11 THR HB 1.0 0.0 3.61 1861 1555 P 12 GLY H P 11 THR HA 1.0 0.0 5.67 1862 1556 P 12 GLY H P 12 GLY HAy 1.0 0.0 4.95 1863 1557 P 12 GLY H P 12 GLY HAx 1.0 0.0 4.88 1864 1558 P 12 GLY HAy P 12 GLY HAx 1.0 0.0 2.72 1865 1559 P 13 GLY H P 13 GLY HAx 1.0 0.0 8.39 1866 1559 P 13 GLY H P 13 GLY HAy 1.0 0.0 8.39 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _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 857 TYR C A 858 VAL N A 858 VAL CA A 858 VAL C 1.0 -167.0 -59.0 PHI 2 2 A 858 VAL N A 858 VAL CA A 858 VAL C A 859 ILE N 1.0 97.0 187.0 PSI 3 3 A 858 VAL C A 859 ILE N A 859 ILE CA A 859 ILE C 1.0 -157.0 -65.0 PHI 4 4 A 859 ILE N A 859 ILE CA A 859 ILE C A 860 ARG N 1.0 102.0 170.0 PSI 5 5 A 859 ILE C A 860 ARG N A 860 ARG CA A 860 ARG C 1.0 -158.0 -86.0 PHI 6 6 A 860 ARG N A 860 ARG CA A 860 ARG C A 861 ASP N 1.0 109.0 177.0 PSI 7 7 A 860 ARG C A 861 ASP N A 861 ASP CA A 861 ASP C 1.0 -109.0 -51.0 PHI 8 8 A 861 ASP N A 861 ASP CA A 861 ASP C A 862 GLU N 1.0 118.0 198.0 PSI 9 9 A 861 ASP C A 862 GLU N A 862 GLU CA A 862 GLU C 1.0 -95.0 -33.0 PHI 10 10 A 862 GLU N A 862 GLU CA A 862 GLU C A 863 TRP N 1.0 -65.0 19.0 PSI 11 11 A 865 ASN C A 866 GLN N A 866 GLN CA A 866 GLN C 1.0 -138.0 -60.0 PHI 12 12 A 866 GLN N A 866 GLN CA A 866 GLN C A 867 ILE N 1.0 88.0 164.0 PSI 13 13 A 866 GLN C A 867 ILE N A 867 ILE CA A 867 ILE C 1.0 -149.0 -77.0 PHI 14 14 A 867 ILE N A 867 ILE CA A 867 ILE C A 868 TRP N 1.0 97.0 153.0 PSI 15 15 A 867 ILE C A 868 TRP N A 868 TRP CA A 868 TRP C 1.0 -131.0 -57.0 PHI 16 16 A 868 TRP N A 868 TRP CA A 868 TRP C A 869 ILE N 1.0 107.0 169.0 PSI 17 17 A 868 TRP C A 869 ILE N A 869 ILE CA A 869 ILE C 1.0 -152.0 -66.0 PHI 18 18 A 869 ILE N A 869 ILE CA A 869 ILE C A 870 CYS N 1.0 98.0 160.0 PSI 19 19 A 869 ILE C A 870 CYS N A 870 CYS CA A 870 CYS C 1.0 -148.0 -54.0 PHI 20 20 A 870 CYS N A 870 CYS CA A 870 CYS C A 871 PRO N 1.0 82.0 180.0 PSI 21 21 A 874 ASN C A 875 LYS N A 875 LYS CA A 875 LYS C 1.0 -155.0 -75.0 PHI 22 22 A 875 LYS N A 875 LYS CA A 875 LYS C A 876 PRO N 1.0 83.0 183.0 PSI 23 23 A 876 PRO N A 876 PRO CA A 876 PRO C A 877 ASP N 1.0 116.0 178.0 PSI 24 24 A 876 PRO C A 877 ASP N A 877 ASP CA A 877 ASP C 1.0 -187.0 -73.0 PHI 25 25 A 877 ASP N A 877 ASP CA A 877 ASP C A 878 ASP N 1.0 96.0 168.0 PSI 26 26 A 881 PRO C A 882 MET N A 882 MET CA A 882 MET C 1.0 -171.0 -99.0 PHI 27 27 A 882 MET N A 882 MET CA A 882 MET C A 883 ILE N 1.0 124.0 188.0 PSI 28 28 A 882 MET C A 883 ILE N A 883 ILE CA A 883 ILE C 1.0 -159.0 -67.0 PHI 29 29 A 883 ILE N A 883 ILE CA A 883 ILE C A 884 GLY N 1.0 95.0 181.0 PSI 30 30 A 890 ASP C A 891 TRP N A 891 TRP CA A 891 TRP C 1.0 -166.0 -70.0 PHI 31 31 A 891 TRP N A 891 TRP CA A 891 TRP C A 892 TYR N 1.0 110.0 186.0 PSI 32 32 A 891 TRP C A 892 TYR N A 892 TYR CA A 892 TYR C 1.0 -155.0 -91.0 PHI 33 33 A 892 TYR N A 892 TYR CA A 892 TYR C A 893 HIS N 1.0 117.0 179.0 PSI 34 34 A 892 TYR C A 893 HIS N A 893 HIS CA A 893 HIS C 1.0 -161.0 -45.0 PHI 35 35 A 893 HIS N A 893 HIS CA A 893 HIS C A 894 TRP N 1.0 96.0 182.0 PSI 36 36 A 893 HIS C A 894 TRP N A 894 TRP CA A 894 TRP C 1.0 -94.0 -26.0 PHI 37 37 A 894 TRP N A 894 TRP CA A 894 TRP C A 895 PRO N 1.0 -72.0 -14.0 PSI 38 38 A 895 PRO N A 895 PRO CA A 895 PRO C A 896 CYS N 1.0 -61.0 -5.0 PSI 39 39 A 895 PRO C A 896 CYS N A 896 CYS CA A 896 CYS C 1.0 -93.0 -39.0 PHI 40 40 A 896 CYS N A 896 CYS CA A 896 CYS C A 897 VAL N 1.0 -59.0 -1.0 PSI 41 41 A 896 CYS C A 897 VAL N A 897 VAL CA A 897 VAL C 1.0 -137.0 -65.0 PHI 42 42 A 897 VAL N A 897 VAL CA A 897 VAL C A 898 GLY N 1.0 -36.0 48.0 PSI 43 43 A 900 MET C A 901 ALA N A 901 ALA CA A 901 ALA C 1.0 -139.0 -61.0 PHI 44 44 A 901 ALA N A 901 ALA CA A 901 ALA C A 902 ALA N 1.0 110.0 174.0 PSI 45 45 A 903 PRO N A 903 PRO CA A 903 PRO C A 904 PRO N 1.0 111.0 183.0 PSI 46 46 A 904 PRO N A 904 PRO CA A 904 PRO C A 905 GLU N 1.0 117.0 177.0 PSI 47 47 A 904 PRO C A 905 GLU N A 905 GLU CA A 905 GLU C 1.0 -83.0 -33.0 PHI 48 48 A 905 GLU N A 905 GLU CA A 905 GLU C A 906 GLU N 1.0 -60.0 -2.0 PSI 49 49 A 905 GLU C A 906 GLU N A 906 GLU CA A 906 GLU C 1.0 -109.0 -51.0 PHI 50 50 A 906 GLU N A 906 GLU CA A 906 GLU C A 907 MET N 1.0 -46.0 26.0 PSI 51 51 A 909 TRP C A 910 PHE N A 910 PHE CA A 910 PHE C 1.0 -154.0 -80.0 PHI 52 52 A 910 PHE N A 910 PHE CA A 910 PHE C A 911 CYS N 1.0 101.0 171.0 PSI 53 53 A 910 PHE C A 911 CYS N A 911 CYS CA A 911 CYS C 1.0 -132.0 -42.0 PHI 54 54 A 911 CYS N A 911 CYS CA A 911 CYS C A 912 PRO N 1.0 85.0 175.0 PSI 55 55 A 912 PRO C A 913 LYS N A 913 LYS CA A 913 LYS C 1.0 -97.0 -43.0 PHI 56 56 A 913 LYS N A 913 LYS CA A 913 LYS C A 914 CYS N 1.0 -69.0 -5.0 PSI 57 57 A 913 LYS C A 914 CYS N A 914 CYS CA A 914 CYS C 1.0 -86.0 -36.0 PHI 58 58 A 914 CYS N A 914 CYS CA A 914 CYS C A 915 ALA N 1.0 -77.0 -21.0 PSI 59 59 A 914 CYS C A 915 ALA N A 915 ALA CA A 915 ALA C 1.0 -84.0 -36.0 PHI 60 60 A 915 ALA N A 915 ALA CA A 915 ALA C A 916 ASN N 1.0 -66.0 -16.0 PSI 61 61 A 915 ALA C A 916 ASN N A 916 ASN CA A 916 ASN C 1.0 -106.0 -46.0 PHI 62 62 A 916 ASN N A 916 ASN CA A 916 ASN C A 917 LYS N 1.0 -64.0 8.0 PSI 63 63 A 916 ASN C A 917 LYS N A 917 LYS CA A 917 LYS C 1.0 -102.0 -36.0 PHI 64 64 A 917 LYS N A 917 LYS CA A 917 LYS C A 918 ILE N 1.0 -69.0 -3.0 PSI 65 65 P 1 ALA C P 2 ARG N P 2 ARG CA P 2 ARG C 1.0 -180.0 -50.0 PHI 66 66 P 2 ARG N P 2 ARG CA P 2 ARG C P 3 THR N 1.0 60.0 180.0 PSI 67 67 P 2 ARG C P 3 THR N P 3 THR CA P 3 THR C 1.0 -180.0 -50.0 PHI stop_ save_