From cc4815517439d37026158a8e85259c31894a479b Mon Sep 17 00:00:00 2001 From: Jan Kosinski Date: Sun, 5 Nov 2023 17:47:14 +0100 Subject: [PATCH] Added the failing gappy PDB custom template + minor fix in test_features_with_templates.py tearDown --- .../true_multimer/fastas/GAPPY_PDB_B.fasta | 4 + .../true_multimer/features/GAPPY_PDB_B | 1 + .../true_multimer/templates/GAPPY_PDB.pdb | 1571 +++++++++++++++++ test/test_features_with_templates.py | 7 +- 4 files changed, 1581 insertions(+), 2 deletions(-) create mode 100755 test/test_data/true_multimer/fastas/GAPPY_PDB_B.fasta create mode 120000 test/test_data/true_multimer/features/GAPPY_PDB_B create mode 100644 test/test_data/true_multimer/templates/GAPPY_PDB.pdb diff --git a/test/test_data/true_multimer/fastas/GAPPY_PDB_B.fasta b/test/test_data/true_multimer/fastas/GAPPY_PDB_B.fasta new file mode 100755 index 00000000..6849d88a --- /dev/null +++ b/test/test_data/true_multimer/fastas/GAPPY_PDB_B.fasta @@ -0,0 +1,4 @@ +>GAPPY_PDB_B +ISASDLALLTRQLATLVAAALPLEEALDAVAKQSEKPKLSALMAAVRAKVVEGHSLAEAM +GNFPGSFERLYCAMVAAGEASGHLDAVLNRLADYTEQRQQMRSRIQQ + diff --git a/test/test_data/true_multimer/features/GAPPY_PDB_B b/test/test_data/true_multimer/features/GAPPY_PDB_B new file mode 120000 index 00000000..0e16add4 --- /dev/null +++ b/test/test_data/true_multimer/features/GAPPY_PDB_B @@ -0,0 +1 @@ +RANdom_name1_.7-1_0_B/ \ No newline at end of file diff --git a/test/test_data/true_multimer/templates/GAPPY_PDB.pdb b/test/test_data/true_multimer/templates/GAPPY_PDB.pdb new file mode 100644 index 00000000..5f97cd6d --- /dev/null +++ b/test/test_data/true_multimer/templates/GAPPY_PDB.pdb @@ -0,0 +1,1571 @@ +ATOM 825 N ILE B 65 47.863 38.499 13.664 1.00 78.40 N +ATOM 826 CA ILE B 65 46.815 37.660 12.992 1.00 71.54 C +ATOM 827 C ILE B 65 45.377 37.939 13.445 1.00 65.80 C +ATOM 828 O ILE B 65 45.095 38.390 14.565 1.00 61.59 O +ATOM 829 CB ILE B 65 47.075 36.153 13.152 1.00 66.09 C +ATOM 830 CG1 ILE B 65 46.994 35.724 14.641 1.00 60.72 C +ATOM 831 CG2 ILE B 65 48.398 35.791 12.499 1.00 65.53 C +ATOM 832 CD1 ILE B 65 46.221 34.449 14.855 1.00 52.74 C +ATOM 833 N SER B 66 44.469 37.628 12.546 1.00 60.42 N +ATOM 834 CA SER B 66 43.092 38.033 12.695 1.00 61.40 C +ATOM 835 C SER B 66 42.354 37.059 13.607 1.00 62.02 C +ATOM 836 O SER B 66 42.881 35.997 13.973 1.00 67.59 O +ATOM 837 CB SER B 66 42.422 38.067 11.328 1.00 58.40 C +ATOM 838 OG SER B 66 42.007 36.781 10.963 1.00 56.98 O +ATOM 839 N ALA B 67 41.131 37.423 13.939 1.00 55.76 N +ATOM 840 CA ALA B 67 40.249 36.592 14.748 1.00 61.78 C +ATOM 841 C ALA B 67 39.878 35.305 14.011 1.00 57.14 C +ATOM 842 O ALA B 67 39.922 34.227 14.613 1.00 49.76 O +ATOM 843 CB ALA B 67 38.989 37.358 15.154 1.00 60.48 C +ATOM 844 N SER B 68 39.545 35.412 12.723 1.00 50.54 N +ATOM 845 CA SER B 68 39.203 34.233 11.940 1.00 52.24 C +ATOM 846 C SER B 68 40.420 33.295 11.704 1.00 45.47 C +ATOM 847 O SER B 68 40.251 32.090 11.665 1.00 41.22 O +ATOM 848 CB SER B 68 38.486 34.590 10.641 1.00 53.81 C +ATOM 849 OG SER B 68 39.426 35.171 9.788 1.00 61.40 O +ATOM 850 N ASP B 69 41.620 33.855 11.671 1.00 44.12 N +ATOM 851 CA ASP B 69 42.839 33.075 11.554 1.00 46.93 C +ATOM 852 C ASP B 69 43.097 32.278 12.829 1.00 42.78 C +ATOM 853 O ASP B 69 43.384 31.077 12.759 1.00 40.41 O +ATOM 854 CB ASP B 69 44.032 33.985 11.216 1.00 52.14 C +ATOM 855 CG ASP B 69 44.020 34.449 9.730 1.00 73.51 C +ATOM 856 OD1 ASP B 69 43.786 33.602 8.810 1.00 75.12 O +ATOM 857 OD2 ASP B 69 44.283 35.655 9.487 1.00 86.28 O +ATOM 887 N THR B 74 43.286 27.256 15.939 1.00 31.60 N +ATOM 888 CA THR B 74 42.951 26.630 17.200 1.00 30.60 C +ATOM 889 C THR B 74 42.095 25.410 16.940 1.00 29.16 C +ATOM 890 O THR B 74 42.279 24.373 17.587 1.00 28.87 O +ATOM 891 CB THR B 74 42.200 27.620 18.169 1.00 33.65 C +ATOM 892 OG1 THR B 74 42.932 28.840 18.267 1.00 36.12 O +ATOM 893 CG2 THR B 74 42.086 27.052 19.557 1.00 36.70 C +ATOM 894 N ARG B 75 41.128 25.523 16.028 1.00 26.86 N +ATOM 895 CA ARG B 75 40.292 24.373 15.707 1.00 27.84 C +ATOM 896 C ARG B 75 41.178 23.235 15.098 1.00 28.01 C +ATOM 897 O ARG B 75 41.066 22.097 15.453 1.00 28.48 O +ATOM 898 CB ARG B 75 39.256 24.796 14.710 1.00 28.16 C +ATOM 899 CG ARG B 75 38.286 23.760 14.181 1.00 28.93 C +ATOM 900 CD ARG B 75 37.624 22.844 15.185 1.00 34.66 C +ATOM 901 NE ARG B 75 36.627 23.574 15.988 1.00 35.42 N +ATOM 902 CZ ARG B 75 36.192 23.195 17.192 1.00 32.85 C +ATOM 903 NH1 ARG B 75 36.564 22.049 17.752 1.00 31.97 N +ATOM 904 NH2 ARG B 75 35.324 23.952 17.821 1.00 36.33 N +ATOM 905 N GLN B 76 42.067 23.599 14.204 1.00 27.15 N +ATOM 906 CA GLN B 76 42.959 22.616 13.494 1.00 27.97 C +ATOM 907 C GLN B 76 43.834 21.959 14.527 1.00 27.10 C +ATOM 908 O GLN B 76 43.824 20.757 14.635 1.00 26.36 O +ATOM 909 CB GLN B 76 43.812 23.310 12.472 1.00 27.71 C +ATOM 910 CG GLN B 76 43.075 23.691 11.228 1.00 26.30 C +ATOM 911 CD GLN B 76 43.900 24.519 10.295 1.00 30.18 C +ATOM 912 OE1 GLN B 76 44.688 25.417 10.716 1.00 34.48 O +ATOM 913 NE2 GLN B 76 43.595 24.364 9.014 1.00 27.21 N +ATOM 914 N LEU B 77 44.465 22.780 15.370 1.00 31.12 N +ATOM 915 CA LEU B 77 45.297 22.290 16.427 1.00 31.03 C +ATOM 916 C LEU B 77 44.584 21.427 17.423 1.00 30.02 C +ATOM 917 O LEU B 77 45.093 20.369 17.787 1.00 30.95 O +ATOM 918 CB LEU B 77 46.015 23.444 17.120 1.00 33.67 C +ATOM 919 CG LEU B 77 47.220 23.041 17.961 1.00 37.99 C +ATOM 920 CD1 LEU B 77 48.321 22.349 17.128 1.00 43.84 C +ATOM 921 CD2 LEU B 77 47.735 24.302 18.647 1.00 38.73 C +ATOM 922 N ALA B 78 43.408 21.836 17.890 1.00 30.54 N +ATOM 923 CA ALA B 78 42.601 20.949 18.733 1.00 30.30 C +ATOM 924 C ALA B 78 42.295 19.619 18.110 1.00 28.12 C +ATOM 925 O ALA B 78 42.216 18.607 18.817 1.00 28.91 O +ATOM 926 CB ALA B 78 41.278 21.605 19.119 1.00 31.86 C +ATOM 927 N THR B 79 42.059 19.594 16.810 1.00 26.92 N +ATOM 928 CA THR B 79 41.616 18.367 16.179 1.00 31.05 C +ATOM 929 C THR B 79 42.798 17.395 16.129 1.00 29.50 C +ATOM 930 O THR B 79 42.653 16.197 16.407 1.00 28.33 O +ATOM 931 CB THR B 79 41.056 18.626 14.751 1.00 33.81 C +ATOM 932 OG1 THR B 79 39.981 19.542 14.825 1.00 35.08 O +ATOM 933 CG2 THR B 79 40.574 17.396 14.110 1.00 28.90 C +ATOM 934 N LEU B 80 43.978 17.918 15.852 1.00 32.35 N +ATOM 935 CA LEU B 80 45.177 17.056 15.708 1.00 34.18 C +ATOM 936 C LEU B 80 45.737 16.551 17.052 1.00 36.07 C +ATOM 937 O LEU B 80 46.149 15.375 17.177 1.00 31.88 O +ATOM 938 CB LEU B 80 46.245 17.783 14.903 1.00 33.40 C +ATOM 939 CG LEU B 80 45.854 18.177 13.494 1.00 36.22 C +ATOM 940 CD1 LEU B 80 46.852 19.136 12.926 1.00 39.53 C +ATOM 941 CD2 LEU B 80 45.766 16.982 12.585 1.00 39.87 C +ATOM 942 N VAL B 81 45.759 17.439 18.033 1.00 32.58 N +ATOM 943 CA VAL B 81 46.184 17.074 19.381 1.00 34.95 C +ATOM 944 C VAL B 81 45.231 16.042 19.944 1.00 35.09 C +ATOM 945 O VAL B 81 45.682 15.033 20.492 1.00 36.93 O +ATOM 946 CB VAL B 81 46.291 18.290 20.304 1.00 32.86 C +ATOM 947 CG1 VAL B 81 46.459 17.881 21.762 1.00 37.31 C +ATOM 948 CG2 VAL B 81 47.441 19.208 19.826 1.00 34.84 C +ATOM 949 N ALA B 82 43.931 16.232 19.738 1.00 33.82 N +ATOM 950 CA ALA B 82 42.934 15.230 20.144 1.00 33.58 C +ATOM 951 C ALA B 82 43.057 13.898 19.448 1.00 35.61 C +ATOM 952 O ALA B 82 42.620 12.909 19.965 1.00 34.21 O +ATOM 953 CB ALA B 82 41.515 15.771 19.929 1.00 36.08 C +ATOM 954 N ALA B 83 43.524 13.897 18.199 1.00 37.08 N +ATOM 955 CA ALA B 83 43.796 12.691 17.499 1.00 34.13 C +ATOM 956 C ALA B 83 45.113 11.995 17.933 1.00 34.55 C +ATOM 957 O ALA B 83 45.507 11.043 17.321 1.00 37.04 O +ATOM 958 CB ALA B 83 43.807 12.947 15.964 1.00 35.69 C +ATOM 959 N ALA B 84 45.805 12.538 18.920 1.00 40.50 N +ATOM 960 CA ALA B 84 47.040 12.021 19.501 1.00 49.05 C +ATOM 961 C ALA B 84 48.259 12.214 18.629 1.00 46.61 C +ATOM 962 O ALA B 84 49.238 11.503 18.821 1.00 49.64 O +ATOM 963 CB ALA B 84 46.896 10.544 19.969 1.00 45.77 C +ATOM 964 N LEU B 85 48.245 13.180 17.710 1.00 42.03 N +ATOM 965 CA LEU B 85 49.497 13.593 17.105 1.00 43.50 C +ATOM 966 C LEU B 85 50.375 14.280 18.134 1.00 44.77 C +ATOM 967 O LEU B 85 49.903 15.148 18.856 1.00 46.85 O +ATOM 968 CB LEU B 85 49.355 14.527 15.928 1.00 40.95 C +ATOM 969 CG LEU B 85 49.134 13.867 14.596 1.00 44.92 C +ATOM 970 CD1 LEU B 85 47.748 13.231 14.583 1.00 49.72 C +ATOM 971 CD2 LEU B 85 49.277 14.885 13.488 1.00 42.79 C +ATOM 972 N PRO B 86 51.683 13.925 18.165 1.00 44.91 N +ATOM 973 CA PRO B 86 52.613 14.701 18.957 1.00 41.82 C +ATOM 974 C PRO B 86 52.543 16.156 18.655 1.00 39.74 C +ATOM 975 O PRO B 86 52.330 16.563 17.482 1.00 39.23 O +ATOM 976 CB PRO B 86 53.983 14.132 18.551 1.00 46.20 C +ATOM 977 CG PRO B 86 53.692 12.696 18.292 1.00 43.87 C +ATOM 978 CD PRO B 86 52.335 12.715 17.612 1.00 46.36 C +ATOM 979 N LEU B 87 52.701 16.944 19.710 1.00 37.55 N +ATOM 980 CA LEU B 87 52.512 18.370 19.595 1.00 47.69 C +ATOM 981 C LEU B 87 53.353 18.933 18.447 1.00 47.69 C +ATOM 982 O LEU B 87 52.852 19.761 17.691 1.00 44.66 O +ATOM 983 CB LEU B 87 52.774 19.075 20.927 1.00 48.98 C +ATOM 984 CG LEU B 87 52.643 20.590 21.002 1.00 50.19 C +ATOM 985 CD1 LEU B 87 51.304 21.122 20.493 1.00 53.12 C +ATOM 986 CD2 LEU B 87 52.864 20.970 22.432 1.00 54.25 C +ATOM 987 N GLU B 88 54.597 18.470 18.277 1.00 43.39 N +ATOM 988 CA GLU B 88 55.449 19.045 17.216 1.00 45.81 C +ATOM 989 C GLU B 88 54.962 18.644 15.821 1.00 33.34 C +ATOM 990 O GLU B 88 55.055 19.396 14.926 1.00 37.14 O +ATOM 991 CB GLU B 88 56.946 18.752 17.426 1.00 52.82 C +ATOM 992 CG GLU B 88 57.539 17.602 16.603 1.00 63.88 C +ATOM 993 CD GLU B 88 57.374 16.239 17.233 1.00 74.82 C +ATOM 994 OE1 GLU B 88 57.169 16.179 18.465 1.00 70.27 O +ATOM 995 OE2 GLU B 88 57.467 15.226 16.482 1.00 82.86 O +ATOM 996 N GLU B 89 54.437 17.440 15.638 1.00 33.86 N +ATOM 997 CA GLU B 89 53.783 17.078 14.382 1.00 38.41 C +ATOM 998 C GLU B 89 52.464 17.883 14.134 1.00 35.18 C +ATOM 999 O GLU B 89 52.162 18.262 13.001 1.00 37.11 O +ATOM 1000 CB GLU B 89 53.448 15.603 14.364 1.00 41.88 C +ATOM 1001 CG GLU B 89 54.685 14.717 14.249 1.00 56.04 C +ATOM 1002 CD GLU B 89 54.374 13.218 14.366 1.00 62.13 C +ATOM 1003 OE1 GLU B 89 53.272 12.772 13.944 1.00 68.19 O +ATOM 1004 OE2 GLU B 89 55.244 12.499 14.912 1.00 74.48 O +ATOM 1005 N ALA B 90 51.723 18.163 15.201 1.00 34.42 N +ATOM 1006 CA ALA B 90 50.445 18.933 15.113 1.00 35.41 C +ATOM 1007 C ALA B 90 50.696 20.331 14.650 1.00 29.14 C +ATOM 1008 O ALA B 90 50.076 20.807 13.667 1.00 29.85 O +ATOM 1009 CB ALA B 90 49.756 18.926 16.463 1.00 37.63 C +ATOM 1010 N LEU B 91 51.672 20.987 15.283 1.00 31.81 N +ATOM 1011 CA LEU B 91 52.087 22.346 14.874 1.00 31.32 C +ATOM 1012 C LEU B 91 52.614 22.412 13.437 1.00 35.12 C +ATOM 1013 O LEU B 91 52.240 23.298 12.666 1.00 37.17 O +ATOM 1014 CB LEU B 91 53.160 22.883 15.843 1.00 38.45 C +ATOM 1015 CG LEU B 91 52.643 23.163 17.270 1.00 38.50 C +ATOM 1016 CD1 LEU B 91 53.726 23.243 18.352 1.00 38.29 C +ATOM 1017 CD2 LEU B 91 51.768 24.432 17.246 1.00 35.18 C +ATOM 1018 N ASP B 92 53.508 21.481 13.060 1.00 37.89 N +ATOM 1019 CA ASP B 92 53.911 21.331 11.645 1.00 35.25 C +ATOM 1020 C ASP B 92 52.750 21.211 10.722 1.00 35.09 C +ATOM 1021 O ASP B 92 52.691 21.887 9.687 1.00 37.63 O +ATOM 1022 CB ASP B 92 54.648 19.976 11.434 1.00 44.66 C +ATOM 1023 CG ASP B 92 56.133 20.122 11.195 1.00 45.06 C +ATOM 1024 OD1 ASP B 92 56.683 21.235 11.318 1.00 49.22 O +ATOM 1025 OD2 ASP B 92 56.722 19.073 10.882 1.00 61.76 O +ATOM 1026 N ALA B 93 51.840 20.280 11.056 1.00 30.78 N +ATOM 1027 CA ALA B 93 50.725 20.023 10.193 1.00 32.17 C +ATOM 1028 C ALA B 93 49.883 21.313 10.009 1.00 35.14 C +ATOM 1029 O ALA B 93 49.433 21.620 8.892 1.00 34.33 O +ATOM 1030 CB ALA B 93 49.913 18.827 10.704 1.00 29.12 C +ATOM 1031 N VAL B 94 49.748 22.115 11.067 1.00 35.70 N +ATOM 1032 CA VAL B 94 48.956 23.329 10.966 1.00 36.66 C +ATOM 1033 C VAL B 94 49.720 24.412 10.177 1.00 44.75 C +ATOM 1034 O VAL B 94 49.104 25.214 9.433 1.00 40.04 O +ATOM 1035 CB VAL B 94 48.586 23.877 12.365 1.00 39.20 C +ATOM 1036 CG1 VAL B 94 47.890 25.233 12.247 1.00 40.06 C +ATOM 1037 CG2 VAL B 94 47.718 22.874 13.135 1.00 39.30 C +ATOM 1038 N ALA B 95 51.041 24.478 10.382 1.00 41.33 N +ATOM 1039 CA ALA B 95 51.869 25.364 9.534 1.00 45.26 C +ATOM 1040 C ALA B 95 51.798 24.992 8.043 1.00 44.17 C +ATOM 1041 O ALA B 95 51.762 25.871 7.206 1.00 54.54 O +ATOM 1042 CB ALA B 95 53.314 25.404 10.015 1.00 42.68 C +ATOM 1043 N LYS B 96 51.715 23.704 7.732 1.00 42.93 N +ATOM 1044 CA LYS B 96 51.614 23.229 6.321 1.00 49.49 C +ATOM 1045 C LYS B 96 50.298 23.541 5.650 1.00 48.47 C +ATOM 1046 O LYS B 96 50.237 23.713 4.436 1.00 45.10 O +ATOM 1047 CB LYS B 96 51.772 21.706 6.239 1.00 48.78 C +ATOM 1048 CG LYS B 96 53.150 21.237 5.933 1.00 56.68 C +ATOM 1049 CD LYS B 96 53.233 19.726 6.140 1.00 62.01 C +ATOM 1050 CE LYS B 96 54.154 19.078 5.135 1.00 68.88 C +ATOM 1051 NZ LYS B 96 54.378 17.636 5.433 1.00 72.20 N +ATOM 1052 N GLN B 97 49.231 23.515 6.426 1.00 45.41 N +ATOM 1053 CA GLN B 97 47.894 23.679 5.901 1.00 47.85 C +ATOM 1054 C GLN B 97 47.498 25.146 5.775 1.00 47.12 C +ATOM 1055 O GLN B 97 46.519 25.441 5.119 1.00 51.35 O +ATOM 1056 CB GLN B 97 46.892 22.911 6.787 1.00 55.10 C +ATOM 1057 CG GLN B 97 47.114 21.406 6.777 1.00 49.87 C +ATOM 1058 CD GLN B 97 46.067 20.662 7.609 1.00 53.04 C +ATOM 1059 OE1 GLN B 97 44.881 20.984 7.532 1.00 48.91 O +ATOM 1060 NE2 GLN B 97 46.492 19.599 8.352 1.00 51.95 N +ATOM 1061 N SER B 98 48.265 26.074 6.328 1.00 51.97 N +ATOM 1062 CA SER B 98 47.940 27.484 6.155 1.00 59.63 C +ATOM 1063 C SER B 98 48.209 28.079 4.736 1.00 68.19 C +ATOM 1064 O SER B 98 49.289 27.907 4.160 1.00 60.58 O +ATOM 1065 CB SER B 98 48.656 28.317 7.207 1.00 64.16 C +ATOM 1066 OG SER B 98 48.490 29.705 6.919 1.00 71.03 O +ATOM 1067 N GLU B 99 47.200 28.810 4.236 1.00 76.65 N +ATOM 1068 CA GLU B 99 47.271 29.604 3.009 1.00 75.08 C +ATOM 1069 C GLU B 99 47.973 30.926 3.245 1.00 75.21 C +ATOM 1070 O GLU B 99 48.319 31.593 2.295 1.00 79.47 O +ATOM 1071 CB GLU B 99 45.872 29.948 2.443 1.00 75.09 C +ATOM 1072 CG GLU B 99 44.809 28.852 2.446 1.00 84.16 C +ATOM 1073 CD GLU B 99 45.330 27.497 2.012 1.00 95.80 C +ATOM 1074 OE1 GLU B 99 46.324 27.437 1.252 1.00101.94 O +ATOM 1075 OE2 GLU B 99 44.731 26.482 2.425 1.00 97.25 O +ATOM 1076 N LYS B 100 48.155 31.345 4.489 1.00 72.31 N +ATOM 1077 CA LYS B 100 48.806 32.626 4.745 1.00 72.64 C +ATOM 1078 C LYS B 100 50.204 32.353 5.237 1.00 64.15 C +ATOM 1079 O LYS B 100 50.382 31.669 6.223 1.00 57.62 O +ATOM 1080 CB LYS B 100 48.002 33.441 5.755 1.00 76.33 C +ATOM 1081 CG LYS B 100 46.550 33.634 5.334 1.00 80.70 C +ATOM 1082 CD LYS B 100 45.891 34.781 6.077 1.00 83.69 C +ATOM 1083 CE LYS B 100 44.403 34.816 5.774 1.00 84.84 C +ATOM 1084 NZ LYS B 100 43.709 35.911 6.508 1.00 86.51 N +ATOM 1085 N PRO B 101 51.218 32.870 4.544 1.00 68.16 N +ATOM 1086 CA PRO B 101 52.568 32.668 5.093 1.00 67.39 C +ATOM 1087 C PRO B 101 52.769 33.258 6.503 1.00 63.01 C +ATOM 1088 O PRO B 101 53.588 32.729 7.261 1.00 66.77 O +ATOM 1089 CB PRO B 101 53.473 33.351 4.064 1.00 68.95 C +ATOM 1090 CG PRO B 101 52.714 33.214 2.780 1.00 72.06 C +ATOM 1091 CD PRO B 101 51.258 33.376 3.165 1.00 72.10 C +ATOM 1092 N LYS B 102 52.020 34.306 6.864 1.00 63.46 N +ATOM 1093 CA LYS B 102 52.077 34.855 8.235 1.00 65.97 C +ATOM 1094 C LYS B 102 51.521 33.865 9.287 1.00 63.46 C +ATOM 1095 O LYS B 102 52.139 33.680 10.328 1.00 68.22 O +ATOM 1096 CB LYS B 102 51.413 36.253 8.336 1.00 73.15 C +ATOM 1097 CG LYS B 102 49.898 36.295 8.161 1.00 77.14 C +ATOM 1098 CD LYS B 102 49.319 37.674 8.429 1.00 82.35 C +ATOM 1099 CE LYS B 102 47.864 37.730 7.991 1.00 81.34 C +ATOM 1100 NZ LYS B 102 47.254 38.996 8.457 1.00 87.09 N +ATOM 1101 N LEU B 103 50.396 33.205 8.994 1.00 62.02 N +ATOM 1102 CA LEU B 103 49.894 32.111 9.846 1.00 62.54 C +ATOM 1103 C LEU B 103 50.872 30.954 9.997 1.00 56.23 C +ATOM 1104 O LEU B 103 51.071 30.468 11.114 1.00 52.62 O +ATOM 1105 CB LEU B 103 48.625 31.496 9.293 1.00 67.60 C +ATOM 1106 CG LEU B 103 47.345 31.943 9.965 1.00 83.44 C +ATOM 1107 CD1 LEU B 103 46.953 33.296 9.363 1.00 80.50 C +ATOM 1108 CD2 LEU B 103 46.263 30.851 9.823 1.00 83.52 C +ATOM 1109 N SER B 104 51.450 30.516 8.868 1.00 55.09 N +ATOM 1110 CA SER B 104 52.426 29.392 8.827 1.00 48.82 C +ATOM 1111 C SER B 104 53.668 29.691 9.596 1.00 49.43 C +ATOM 1112 O SER B 104 54.166 28.845 10.372 1.00 51.77 O +ATOM 1113 CB SER B 104 52.816 29.077 7.386 1.00 52.14 C +ATOM 1114 OG SER B 104 51.655 28.829 6.623 1.00 53.01 O +ATOM 1115 N ALA B 105 54.179 30.907 9.386 1.00 52.69 N +ATOM 1116 CA ALA B 105 55.357 31.410 10.108 1.00 47.57 C +ATOM 1117 C ALA B 105 55.156 31.472 11.628 1.00 44.20 C +ATOM 1118 O ALA B 105 55.975 30.942 12.419 1.00 52.02 O +ATOM 1119 CB ALA B 105 55.710 32.789 9.569 1.00 52.44 C +ATOM 1120 N LEU B 106 54.053 32.080 12.052 1.00 51.24 N +ATOM 1121 CA LEU B 106 53.672 32.066 13.492 1.00 51.92 C +ATOM 1122 C LEU B 106 53.736 30.656 14.058 1.00 47.72 C +ATOM 1123 O LEU B 106 54.413 30.416 15.061 1.00 51.51 O +ATOM 1124 CB LEU B 106 52.259 32.610 13.711 1.00 51.83 C +ATOM 1125 CG LEU B 106 51.748 32.451 15.164 1.00 50.79 C +ATOM 1126 CD1 LEU B 106 52.609 33.232 16.133 1.00 51.81 C +ATOM 1127 CD2 LEU B 106 50.289 32.865 15.235 1.00 56.34 C +ATOM 1128 N MET B 107 53.056 29.730 13.383 1.00 46.22 N +ATOM 1129 CA MET B 107 52.995 28.330 13.833 1.00 46.88 C +ATOM 1130 C MET B 107 54.320 27.615 13.802 1.00 48.52 C +ATOM 1131 O MET B 107 54.654 26.860 14.745 1.00 43.91 O +ATOM 1132 CB MET B 107 51.947 27.539 13.042 1.00 49.00 C +ATOM 1133 CG MET B 107 50.522 28.091 13.156 1.00 57.55 C +ATOM 1134 SD MET B 107 49.658 27.665 14.684 1.00 62.93 S +ATOM 1135 CE MET B 107 50.498 28.588 15.930 1.00 52.83 C +ATOM 1136 N ALA B 108 55.096 27.848 12.744 1.00 50.75 N +ATOM 1137 CA ALA B 108 56.497 27.389 12.727 1.00 49.33 C +ATOM 1138 C ALA B 108 57.334 27.966 13.896 1.00 45.20 C +ATOM 1139 O ALA B 108 58.181 27.248 14.515 1.00 42.12 O +ATOM 1140 CB ALA B 108 57.146 27.754 11.393 1.00 54.69 C +ATOM 1141 N ALA B 109 57.127 29.257 14.186 1.00 50.91 N +ATOM 1142 CA ALA B 109 57.830 29.918 15.332 1.00 56.83 C +ATOM 1143 C ALA B 109 57.449 29.329 16.726 1.00 57.16 C +ATOM 1144 O ALA B 109 58.307 29.036 17.583 1.00 50.20 O +ATOM 1145 CB ALA B 109 57.589 31.405 15.289 1.00 54.73 C +ATOM 1146 N VAL B 110 56.150 29.070 16.900 1.00 52.58 N +ATOM 1147 CA VAL B 110 55.664 28.448 18.112 1.00 43.60 C +ATOM 1148 C VAL B 110 56.308 27.088 18.180 1.00 43.54 C +ATOM 1149 O VAL B 110 56.867 26.716 19.213 1.00 51.31 O +ATOM 1150 CB VAL B 110 54.117 28.353 18.085 1.00 46.26 C +ATOM 1151 CG1 VAL B 110 53.587 27.414 19.140 1.00 47.49 C +ATOM 1152 CG2 VAL B 110 53.488 29.730 18.183 1.00 44.38 C +ATOM 1153 N ARG B 111 56.268 26.339 17.076 1.00 42.58 N +ATOM 1154 CA ARG B 111 56.912 24.989 17.044 1.00 47.24 C +ATOM 1155 C ARG B 111 58.422 25.009 17.385 1.00 47.06 C +ATOM 1156 O ARG B 111 58.935 24.091 18.075 1.00 45.07 O +ATOM 1157 CB ARG B 111 56.691 24.315 15.681 1.00 44.40 C +ATOM 1158 CG ARG B 111 57.209 22.892 15.620 1.00 43.15 C +ATOM 1159 CD ARG B 111 57.146 22.320 14.214 1.00 41.51 C +ATOM 1160 NE ARG B 111 57.613 20.939 14.265 1.00 43.96 N +ATOM 1161 CZ ARG B 111 58.909 20.591 14.278 1.00 41.32 C +ATOM 1162 NH1 ARG B 111 59.238 19.326 14.358 1.00 37.23 N +ATOM 1163 NH2 ARG B 111 59.875 21.513 14.261 1.00 39.56 N +ATOM 1164 N ALA B 112 59.108 26.050 16.903 1.00 51.36 N +ATOM 1165 CA ALA B 112 60.543 26.250 17.167 1.00 50.98 C +ATOM 1166 C ALA B 112 60.831 26.270 18.668 1.00 58.41 C +ATOM 1167 O ALA B 112 61.716 25.568 19.173 1.00 57.83 O +ATOM 1168 CB ALA B 112 61.010 27.547 16.526 1.00 49.34 C +ATOM 1169 N LYS B 113 60.041 27.066 19.381 1.00 58.28 N +ATOM 1170 CA LYS B 113 60.175 27.193 20.833 1.00 52.40 C +ATOM 1171 C LYS B 113 59.857 25.881 21.513 1.00 48.18 C +ATOM 1172 O LYS B 113 60.512 25.466 22.468 1.00 45.50 O +ATOM 1173 CB LYS B 113 59.256 28.321 21.333 1.00 59.81 C +ATOM 1174 CG LYS B 113 59.540 29.744 20.786 1.00 62.67 C +ATOM 1175 CD LYS B 113 60.813 30.385 21.381 1.00 75.06 C +ATOM 1176 CE LYS B 113 61.105 31.786 20.822 1.00 77.06 C +ATOM 1177 NZ LYS B 113 61.952 31.773 19.597 1.00 81.88 N +ATOM 1178 N VAL B 114 58.860 25.182 20.983 1.00 52.52 N +ATOM 1179 CA VAL B 114 58.481 23.897 21.544 1.00 49.85 C +ATOM 1180 C VAL B 114 59.555 22.851 21.273 1.00 54.95 C +ATOM 1181 O VAL B 114 59.743 21.935 22.101 1.00 61.43 O +ATOM 1182 CB VAL B 114 57.104 23.398 21.015 1.00 44.50 C +ATOM 1183 CG1 VAL B 114 56.805 22.019 21.535 1.00 44.97 C +ATOM 1184 CG2 VAL B 114 55.977 24.306 21.476 1.00 52.31 C +ATOM 1185 N VAL B 115 60.232 22.922 20.122 1.00 61.02 N +ATOM 1186 CA VAL B 115 61.333 21.947 19.906 1.00 70.67 C +ATOM 1187 C VAL B 115 62.539 22.304 20.760 1.00 69.49 C +ATOM 1188 O VAL B 115 63.167 21.397 21.272 1.00 63.33 O +ATOM 1189 CB VAL B 115 61.725 21.648 18.435 1.00 65.12 C +ATOM 1190 CG1 VAL B 115 60.560 20.963 17.742 1.00 68.30 C +ATOM 1191 CG2 VAL B 115 62.195 22.883 17.689 1.00 69.96 C +ATOM 1192 N GLU B 116 62.794 23.605 20.969 1.00 75.56 N +ATOM 1193 CA GLU B 116 63.747 24.079 22.002 1.00 73.62 C +ATOM 1194 C GLU B 116 63.346 23.741 23.469 1.00 74.28 C +ATOM 1195 O GLU B 116 63.929 24.306 24.380 1.00 74.40 O +ATOM 1196 CB GLU B 116 63.951 25.603 21.906 1.00 77.23 C +ATOM 1197 CG GLU B 116 64.620 26.161 20.647 1.00 84.60 C +ATOM 1198 CD GLU B 116 64.681 27.699 20.649 1.00 92.64 C +ATOM 1199 OE1 GLU B 116 63.844 28.369 21.313 1.00 93.15 O +ATOM 1200 OE2 GLU B 116 65.581 28.261 19.988 1.00106.56 O +ATOM 1201 N GLY B 117 62.353 22.876 23.711 1.00 76.91 N +ATOM 1202 CA GLY B 117 61.987 22.435 25.073 1.00 77.72 C +ATOM 1203 C GLY B 117 60.956 23.251 25.881 1.00 77.91 C +ATOM 1204 O GLY B 117 60.519 22.802 26.943 1.00 85.36 O +ATOM 1205 N HIS B 118 60.554 24.430 25.407 1.00 74.47 N +ATOM 1206 CA HIS B 118 59.505 25.209 26.082 1.00 68.94 C +ATOM 1207 C HIS B 118 58.113 24.530 26.047 1.00 65.03 C +ATOM 1208 O HIS B 118 57.864 23.587 25.264 1.00 62.07 O +ATOM 1209 CB HIS B 118 59.402 26.599 25.470 1.00 75.25 C +ATOM 1210 CG HIS B 118 60.690 27.367 25.489 1.00 88.16 C +ATOM 1211 ND1 HIS B 118 60.891 28.503 24.731 1.00100.07 N +ATOM 1212 CD2 HIS B 118 61.849 27.150 26.156 1.00 91.70 C +ATOM 1213 CE1 HIS B 118 62.112 28.961 24.938 1.00 97.20 C +ATOM 1214 NE2 HIS B 118 62.716 28.154 25.796 1.00102.82 N +ATOM 1215 N SER B 119 57.217 25.007 26.917 1.00 53.94 N +ATOM 1216 CA SER B 119 55.822 24.573 26.925 1.00 48.50 C +ATOM 1217 C SER B 119 55.141 25.254 25.787 1.00 41.47 C +ATOM 1218 O SER B 119 55.561 26.343 25.349 1.00 49.76 O +ATOM 1219 CB SER B 119 55.133 25.023 28.222 1.00 51.25 C +ATOM 1220 OG SER B 119 54.999 26.463 28.248 1.00 54.83 O +ATOM 1221 N LEU B 120 54.035 24.685 25.333 1.00 47.62 N +ATOM 1222 CA LEU B 120 53.203 25.362 24.312 1.00 47.11 C +ATOM 1223 C LEU B 120 52.780 26.738 24.760 1.00 44.46 C +ATOM 1224 O LEU B 120 52.816 27.717 23.986 1.00 48.61 O +ATOM 1225 CB LEU B 120 51.965 24.536 23.997 1.00 49.78 C +ATOM 1226 CG LEU B 120 51.131 25.121 22.861 1.00 49.94 C +ATOM 1227 CD1 LEU B 120 51.983 25.242 21.600 1.00 50.86 C +ATOM 1228 CD2 LEU B 120 49.906 24.246 22.627 1.00 45.34 C +ATOM 1229 N ALA B 121 52.376 26.796 26.026 1.00 47.49 N +ATOM 1230 CA ALA B 121 51.978 28.038 26.689 1.00 48.70 C +ATOM 1231 C ALA B 121 53.097 29.072 26.674 1.00 45.30 C +ATOM 1232 O ALA B 121 52.877 30.196 26.289 1.00 46.46 O +ATOM 1233 CB ALA B 121 51.561 27.745 28.117 1.00 46.54 C +ATOM 1234 N GLU B 122 54.313 28.696 27.045 1.00 55.53 N +ATOM 1235 CA GLU B 122 55.407 29.676 26.933 1.00 61.70 C +ATOM 1236 C GLU B 122 55.690 30.032 25.473 1.00 60.26 C +ATOM 1237 O GLU B 122 55.855 31.217 25.131 1.00 60.05 O +ATOM 1238 CB GLU B 122 56.683 29.219 27.626 1.00 68.56 C +ATOM 1239 CG GLU B 122 57.768 30.293 27.499 1.00 77.67 C +ATOM 1240 CD GLU B 122 58.951 30.138 28.437 1.00 85.40 C +ATOM 1241 OE1 GLU B 122 58.872 29.331 29.390 1.00 85.50 O +ATOM 1242 OE2 GLU B 122 59.964 30.853 28.206 1.00 83.28 O +ATOM 1243 N ALA B 123 55.723 29.012 24.609 1.00 56.90 N +ATOM 1244 CA ALA B 123 55.957 29.250 23.192 1.00 49.21 C +ATOM 1245 C ALA B 123 54.992 30.283 22.646 1.00 45.54 C +ATOM 1246 O ALA B 123 55.405 31.256 21.994 1.00 56.25 O +ATOM 1247 CB ALA B 123 55.838 27.932 22.419 1.00 52.30 C +ATOM 1248 N MET B 124 53.691 30.068 22.881 1.00 48.78 N +ATOM 1249 CA MET B 124 52.635 31.004 22.398 1.00 50.50 C +ATOM 1250 C MET B 124 52.829 32.331 23.067 1.00 47.17 C +ATOM 1251 O MET B 124 52.639 33.357 22.454 1.00 48.06 O +ATOM 1252 CB MET B 124 51.214 30.529 22.719 1.00 48.09 C +ATOM 1253 CG MET B 124 50.691 29.469 21.775 1.00 55.29 C +ATOM 1254 SD MET B 124 49.350 28.431 22.425 1.00 49.80 S +ATOM 1255 CE MET B 124 48.708 27.814 20.875 1.00 53.76 C +ATOM 1256 N GLY B 125 53.190 32.282 24.335 1.00 51.77 N +ATOM 1257 CA GLY B 125 53.443 33.486 25.105 1.00 62.84 C +ATOM 1258 C GLY B 125 54.388 34.503 24.484 1.00 61.31 C +ATOM 1259 O GLY B 125 54.286 35.678 24.799 1.00 61.28 O +ATOM 1260 N ASN B 126 55.296 34.067 23.603 1.00 60.88 N +ATOM 1261 CA ASN B 126 56.200 35.006 22.898 1.00 57.46 C +ATOM 1262 C ASN B 126 55.501 35.792 21.846 1.00 56.81 C +ATOM 1263 O ASN B 126 56.113 36.682 21.283 1.00 62.04 O +ATOM 1264 CB ASN B 126 57.399 34.300 22.232 1.00 61.58 C +ATOM 1265 CG ASN B 126 58.290 33.606 23.232 1.00 64.59 C +ATOM 1266 OD1 ASN B 126 58.026 32.489 23.636 1.00 69.90 O +ATOM 1267 ND2 ASN B 126 59.345 34.274 23.639 1.00 71.24 N +ATOM 1268 N PHE B 127 54.235 35.487 21.543 1.00 54.27 N +ATOM 1269 CA PHE B 127 53.529 36.208 20.502 1.00 52.08 C +ATOM 1270 C PHE B 127 52.234 36.778 21.060 1.00 60.69 C +ATOM 1271 O PHE B 127 51.141 36.415 20.598 1.00 56.36 O +ATOM 1272 CB PHE B 127 53.335 35.297 19.268 1.00 56.80 C +ATOM 1273 CG PHE B 127 54.600 34.591 18.862 1.00 54.33 C +ATOM 1274 CD1 PHE B 127 55.548 35.240 18.065 1.00 58.52 C +ATOM 1275 CD2 PHE B 127 54.895 33.333 19.365 1.00 56.76 C +ATOM 1276 CE1 PHE B 127 56.738 34.623 17.731 1.00 55.67 C +ATOM 1277 CE2 PHE B 127 56.084 32.697 19.028 1.00 59.99 C +ATOM 1278 CZ PHE B 127 57.009 33.349 18.219 1.00 59.50 C +ATOM 1279 N PRO B 128 52.349 37.719 22.046 1.00 65.12 N +ATOM 1280 CA PRO B 128 51.156 38.269 22.705 1.00 59.89 C +ATOM 1281 C PRO B 128 50.283 39.058 21.771 1.00 54.73 C +ATOM 1282 O PRO B 128 49.117 39.252 22.071 1.00 64.68 O +ATOM 1283 CB PRO B 128 51.730 39.155 23.825 1.00 62.00 C +ATOM 1284 CG PRO B 128 53.105 39.496 23.384 1.00 63.78 C +ATOM 1285 CD PRO B 128 53.584 38.304 22.610 1.00 65.87 C +ATOM 1286 N GLY B 129 50.810 39.460 20.624 1.00 59.10 N +ATOM 1287 CA GLY B 129 49.978 39.981 19.540 1.00 57.35 C +ATOM 1288 C GLY B 129 49.018 38.978 18.900 1.00 58.26 C +ATOM 1289 O GLY B 129 48.120 39.388 18.143 1.00 59.76 O +ATOM 1290 N SER B 130 49.194 37.680 19.171 1.00 51.75 N +ATOM 1291 CA SER B 130 48.301 36.631 18.613 1.00 53.45 C +ATOM 1292 C SER B 130 47.586 35.775 19.645 1.00 47.97 C +ATOM 1293 O SER B 130 46.424 35.450 19.469 1.00 54.95 O +ATOM 1294 CB SER B 130 49.132 35.720 17.718 1.00 52.90 C +ATOM 1295 OG SER B 130 49.530 36.423 16.579 1.00 53.15 O +ATOM 1296 N PHE B 131 48.325 35.385 20.675 1.00 44.81 N +ATOM 1297 CA PHE B 131 47.844 34.588 21.764 1.00 50.57 C +ATOM 1298 C PHE B 131 47.679 35.424 23.035 1.00 48.47 C +ATOM 1299 O PHE B 131 48.642 35.688 23.728 1.00 52.95 O +ATOM 1300 CB PHE B 131 48.805 33.413 22.004 1.00 44.74 C +ATOM 1301 CG PHE B 131 49.012 32.585 20.788 1.00 46.17 C +ATOM 1302 CD1 PHE B 131 48.015 31.772 20.331 1.00 42.96 C +ATOM 1303 CD2 PHE B 131 50.204 32.663 20.080 1.00 51.34 C +ATOM 1304 CE1 PHE B 131 48.180 31.022 19.186 1.00 54.40 C +ATOM 1305 CE2 PHE B 131 50.398 31.901 18.955 1.00 53.47 C +ATOM 1306 CZ PHE B 131 49.394 31.075 18.499 1.00 51.13 C +ATOM 1307 N GLU B 132 46.451 35.855 23.300 1.00 53.95 N +ATOM 1308 CA GLU B 132 46.149 36.661 24.482 1.00 53.25 C +ATOM 1309 C GLU B 132 46.483 35.909 25.764 1.00 51.18 C +ATOM 1310 O GLU B 132 46.715 34.678 25.766 1.00 48.72 O +ATOM 1311 CB GLU B 132 44.706 37.166 24.472 1.00 58.27 C +ATOM 1312 CG GLU B 132 43.627 36.090 24.478 1.00 57.66 C +ATOM 1313 CD GLU B 132 42.223 36.617 24.718 1.00 60.40 C +ATOM 1314 OE1 GLU B 132 42.035 37.322 25.728 1.00 60.55 O +ATOM 1315 OE2 GLU B 132 41.304 36.303 23.925 1.00 69.20 O +ATOM 1316 N ARG B 133 46.576 36.658 26.859 1.00 48.72 N +ATOM 1317 CA ARG B 133 47.028 36.098 28.124 1.00 49.35 C +ATOM 1318 C ARG B 133 46.111 34.974 28.607 1.00 38.86 C +ATOM 1319 O ARG B 133 46.533 33.984 29.234 1.00 47.13 O +ATOM 1320 CB ARG B 133 47.130 37.207 29.189 1.00 59.41 C +ATOM 1321 CG ARG B 133 47.942 36.794 30.420 1.00 71.37 C +ATOM 1322 CD ARG B 133 47.473 37.485 31.711 1.00 80.67 C +ATOM 1323 NE ARG B 133 47.986 36.793 32.902 1.00 78.17 N +ATOM 1324 CZ ARG B 133 47.434 35.726 33.490 1.00 74.18 C +ATOM 1325 NH1 ARG B 133 46.294 35.177 33.056 1.00 83.37 N +ATOM 1326 NH2 ARG B 133 48.021 35.203 34.555 1.00 69.08 N +ATOM 1327 N LEU B 134 44.835 35.135 28.370 1.00 41.55 N +ATOM 1328 CA LEU B 134 43.874 34.120 28.800 1.00 48.05 C +ATOM 1329 C LEU B 134 44.050 32.800 28.025 1.00 42.52 C +ATOM 1330 O LEU B 134 43.832 31.718 28.552 1.00 42.07 O +ATOM 1331 CB LEU B 134 42.453 34.653 28.581 1.00 52.63 C +ATOM 1332 CG LEU B 134 41.309 33.749 29.050 1.00 62.09 C +ATOM 1333 CD1 LEU B 134 41.539 33.228 30.483 1.00 67.69 C +ATOM 1334 CD2 LEU B 134 39.997 34.509 28.919 1.00 63.03 C +ATOM 1335 N TYR B 135 44.374 32.925 26.747 1.00 47.49 N +ATOM 1336 CA TYR B 135 44.546 31.774 25.853 1.00 40.73 C +ATOM 1337 C TYR B 135 45.733 30.948 26.389 1.00 37.38 C +ATOM 1338 O TYR B 135 45.610 29.712 26.655 1.00 36.51 O +ATOM 1339 CB TYR B 135 44.713 32.329 24.430 1.00 42.30 C +ATOM 1340 CG TYR B 135 44.715 31.299 23.267 1.00 46.50 C +ATOM 1341 CD1 TYR B 135 45.787 30.413 23.091 1.00 45.86 C +ATOM 1342 CD2 TYR B 135 43.678 31.264 22.330 1.00 38.42 C +ATOM 1343 CE1 TYR B 135 45.806 29.492 22.026 1.00 48.17 C +ATOM 1344 CE2 TYR B 135 43.704 30.373 21.270 1.00 42.92 C +ATOM 1345 CZ TYR B 135 44.767 29.472 21.131 1.00 45.96 C +ATOM 1346 OH TYR B 135 44.813 28.602 20.073 1.00 45.38 O +ATOM 1347 N CYS B 136 46.837 31.647 26.657 1.00 38.57 N +ATOM 1348 CA CYS B 136 48.053 31.028 27.165 1.00 41.30 C +ATOM 1349 C CYS B 136 47.849 30.353 28.494 1.00 47.10 C +ATOM 1350 O CYS B 136 48.224 29.161 28.661 1.00 43.42 O +ATOM 1351 CB CYS B 136 49.202 32.048 27.248 1.00 47.49 C +ATOM 1352 SG CYS B 136 49.678 32.729 25.643 1.00 55.56 S +ATOM 1353 N ALA B 137 47.189 31.080 29.419 1.00 48.55 N +ATOM 1354 CA ALA B 137 46.906 30.531 30.754 1.00 41.26 C +ATOM 1355 C ALA B 137 46.052 29.300 30.651 1.00 38.72 C +ATOM 1356 O ALA B 137 46.326 28.286 31.330 1.00 42.18 O +ATOM 1357 CB ALA B 137 46.243 31.587 31.656 1.00 48.84 C +ATOM 1358 N MET B 138 45.068 29.295 29.753 1.00 37.82 N +ATOM 1359 CA MET B 138 44.298 28.047 29.542 1.00 39.25 C +ATOM 1360 C MET B 138 45.229 26.897 29.051 1.00 37.87 C +ATOM 1361 O MET B 138 45.229 25.814 29.591 1.00 40.77 O +ATOM 1362 CB MET B 138 43.141 28.280 28.562 1.00 48.81 C +ATOM 1363 CG MET B 138 41.967 29.130 29.114 1.00 48.21 C +ATOM 1364 SD MET B 138 40.966 28.211 30.311 1.00 51.50 S +ATOM 1365 CE MET B 138 40.093 27.147 29.173 1.00 53.78 C +ATOM 1366 N VAL B 139 46.032 27.163 28.042 1.00 42.66 N +ATOM 1367 CA VAL B 139 46.993 26.150 27.516 1.00 45.56 C +ATOM 1368 C VAL B 139 47.955 25.634 28.615 1.00 40.38 C +ATOM 1369 O VAL B 139 48.072 24.411 28.843 1.00 37.42 O +ATOM 1370 CB VAL B 139 47.766 26.753 26.298 1.00 46.00 C +ATOM 1371 CG1 VAL B 139 48.954 25.870 25.892 1.00 44.66 C +ATOM 1372 CG2 VAL B 139 46.788 26.959 25.115 1.00 43.07 C +ATOM 1373 N ALA B 140 48.586 26.585 29.315 1.00 44.57 N +ATOM 1374 CA ALA B 140 49.450 26.294 30.489 1.00 44.98 C +ATOM 1375 C ALA B 140 48.738 25.344 31.423 1.00 49.63 C +ATOM 1376 O ALA B 140 49.257 24.288 31.767 1.00 52.47 O +ATOM 1377 CB ALA B 140 49.838 27.587 31.225 1.00 43.20 C +ATOM 1378 N ALA B 141 47.491 25.679 31.766 1.00 54.67 N +ATOM 1379 CA ALA B 141 46.733 24.876 32.713 1.00 52.79 C +ATOM 1380 C ALA B 141 46.417 23.480 32.198 1.00 53.91 C +ATOM 1381 O ALA B 141 46.479 22.501 32.937 1.00 54.63 O +ATOM 1382 CB ALA B 141 45.451 25.613 33.071 1.00 54.89 C +ATOM 1383 N GLY B 142 46.060 23.375 30.919 1.00 53.50 N +ATOM 1384 CA GLY B 142 45.815 22.063 30.319 1.00 43.32 C +ATOM 1385 C GLY B 142 47.068 21.220 30.221 1.00 44.21 C +ATOM 1386 O GLY B 142 47.011 19.974 30.328 1.00 47.57 O +ATOM 1387 N GLU B 143 48.190 21.886 29.955 1.00 47.09 N +ATOM 1388 CA GLU B 143 49.502 21.211 29.974 1.00 55.64 C +ATOM 1389 C GLU B 143 49.789 20.686 31.365 1.00 61.48 C +ATOM 1390 O GLU B 143 50.142 19.527 31.509 1.00 63.50 O +ATOM 1391 CB GLU B 143 50.656 22.120 29.513 1.00 49.68 C +ATOM 1392 CG GLU B 143 50.673 22.381 28.020 1.00 52.76 C +ATOM 1393 CD GLU B 143 51.844 23.259 27.601 1.00 55.34 C +ATOM 1394 OE1 GLU B 143 51.867 24.474 27.914 1.00 52.87 O +ATOM 1395 OE2 GLU B 143 52.784 22.726 26.958 1.00 64.03 O +ATOM 1396 N ALA B 144 49.624 21.531 32.378 1.00 63.89 N +ATOM 1397 CA ALA B 144 49.760 21.075 33.777 1.00 66.23 C +ATOM 1398 C ALA B 144 48.894 19.860 34.100 1.00 60.85 C +ATOM 1399 O ALA B 144 49.353 18.938 34.729 1.00 76.69 O +ATOM 1400 CB ALA B 144 49.459 22.195 34.749 1.00 65.12 C +ATOM 1401 N SER B 145 47.670 19.817 33.633 1.00 62.32 N +ATOM 1402 CA SER B 145 46.734 18.778 34.061 1.00 58.42 C +ATOM 1403 C SER B 145 46.745 17.529 33.190 1.00 63.73 C +ATOM 1404 O SER B 145 45.975 16.584 33.435 1.00 61.12 O +ATOM 1405 CB SER B 145 45.306 19.355 34.094 1.00 65.65 C +ATOM 1406 OG SER B 145 44.518 18.932 32.983 1.00 59.73 O +ATOM 1407 N GLY B 146 47.567 17.528 32.139 1.00 63.01 N +ATOM 1408 CA GLY B 146 47.504 16.466 31.143 1.00 54.43 C +ATOM 1409 C GLY B 146 46.244 16.485 30.306 1.00 51.32 C +ATOM 1410 O GLY B 146 45.822 15.437 29.776 1.00 51.96 O +ATOM 1411 N HIS B 147 45.639 17.660 30.150 1.00 51.58 N +ATOM 1412 CA HIS B 147 44.426 17.761 29.316 1.00 58.17 C +ATOM 1413 C HIS B 147 44.481 18.891 28.282 1.00 53.50 C +ATOM 1414 O HIS B 147 43.469 19.546 28.041 1.00 50.72 O +ATOM 1415 CB HIS B 147 43.176 17.928 30.198 1.00 66.51 C +ATOM 1416 CG HIS B 147 42.876 16.739 31.043 1.00 70.75 C +ATOM 1417 ND1 HIS B 147 43.033 16.741 32.411 1.00 72.92 N +ATOM 1418 CD2 HIS B 147 42.437 15.503 30.712 1.00 72.80 C +ATOM 1419 CE1 HIS B 147 42.696 15.556 32.889 1.00 70.61 C +ATOM 1420 NE2 HIS B 147 42.336 14.787 31.879 1.00 72.11 N +ATOM 1421 N LEU B 148 45.642 19.101 27.659 1.00 50.24 N +ATOM 1422 CA LEU B 148 45.753 20.049 26.550 1.00 47.68 C +ATOM 1423 C LEU B 148 44.680 19.782 25.517 1.00 42.25 C +ATOM 1424 O LEU B 148 44.059 20.703 25.092 1.00 38.10 O +ATOM 1425 CB LEU B 148 47.116 20.022 25.888 1.00 49.31 C +ATOM 1426 CG LEU B 148 47.400 21.160 24.918 1.00 45.59 C +ATOM 1427 CD1 LEU B 148 47.524 22.527 25.576 1.00 46.62 C +ATOM 1428 CD2 LEU B 148 48.703 20.849 24.210 1.00 50.65 C +ATOM 1429 N ASP B 149 44.391 18.530 25.188 1.00 42.68 N +ATOM 1430 CA ASP B 149 43.359 18.277 24.203 1.00 45.45 C +ATOM 1431 C ASP B 149 42.006 18.917 24.569 1.00 48.73 C +ATOM 1432 O ASP B 149 41.394 19.619 23.723 1.00 35.53 O +ATOM 1433 CB ASP B 149 43.247 16.794 23.813 1.00 52.51 C +ATOM 1434 CG ASP B 149 42.786 15.877 24.947 1.00 64.19 C +ATOM 1435 OD1 ASP B 149 42.919 16.215 26.159 1.00 61.79 O +ATOM 1436 OD2 ASP B 149 42.295 14.775 24.577 1.00 66.77 O +ATOM 1437 N ALA B 150 41.568 18.742 25.836 1.00 44.75 N +ATOM 1438 CA ALA B 150 40.304 19.310 26.271 1.00 40.86 C +ATOM 1439 C ALA B 150 40.348 20.836 26.287 1.00 40.29 C +ATOM 1440 O ALA B 150 39.380 21.486 25.917 1.00 39.96 O +ATOM 1441 CB ALA B 150 39.922 18.776 27.656 1.00 48.00 C +ATOM 1442 N VAL B 151 41.477 21.398 26.700 1.00 40.82 N +ATOM 1443 CA VAL B 151 41.662 22.864 26.750 1.00 42.56 C +ATOM 1444 C VAL B 151 41.635 23.510 25.335 1.00 41.02 C +ATOM 1445 O VAL B 151 41.040 24.585 25.100 1.00 36.84 O +ATOM 1446 CB VAL B 151 42.928 23.192 27.566 1.00 41.98 C +ATOM 1447 CG1 VAL B 151 43.567 24.502 27.209 1.00 45.39 C +ATOM 1448 CG2 VAL B 151 42.585 23.224 29.035 1.00 46.25 C +ATOM 1449 N LEU B 152 42.252 22.855 24.377 1.00 33.69 N +ATOM 1450 CA LEU B 152 42.241 23.409 23.019 1.00 35.10 C +ATOM 1451 C LEU B 152 40.848 23.350 22.377 1.00 33.96 C +ATOM 1452 O LEU B 152 40.511 24.246 21.631 1.00 31.62 O +ATOM 1453 CB LEU B 152 43.231 22.667 22.153 1.00 35.00 C +ATOM 1454 CG LEU B 152 44.684 22.937 22.469 1.00 34.68 C +ATOM 1455 CD1 LEU B 152 45.550 21.914 21.670 1.00 37.81 C +ATOM 1456 CD2 LEU B 152 45.069 24.396 22.170 1.00 32.75 C +ATOM 1457 N ASN B 153 40.083 22.283 22.634 1.00 32.29 N +ATOM 1458 CA ASN B 153 38.682 22.206 22.198 1.00 36.14 C +ATOM 1459 C ASN B 153 37.871 23.375 22.765 1.00 39.97 C +ATOM 1460 O ASN B 153 37.120 24.061 22.011 1.00 37.01 O +ATOM 1461 CB ASN B 153 38.034 20.852 22.516 1.00 40.12 C +ATOM 1462 CG ASN B 153 36.692 20.641 21.772 1.00 61.02 C +ATOM 1463 OD1 ASN B 153 36.205 21.490 20.973 1.00 57.27 O +ATOM 1464 ND2 ASN B 153 36.068 19.501 22.050 1.00 71.12 N +ATOM 1465 N ARG B 154 38.079 23.687 24.043 1.00 37.70 N +ATOM 1466 CA ARG B 154 37.357 24.813 24.660 1.00 43.39 C +ATOM 1467 C ARG B 154 37.790 26.114 24.017 1.00 40.94 C +ATOM 1468 O ARG B 154 36.945 26.955 23.679 1.00 35.17 O +ATOM 1469 CB ARG B 154 37.554 24.844 26.196 1.00 51.01 C +ATOM 1470 CG ARG B 154 37.109 26.115 26.935 1.00 66.55 C +ATOM 1471 CD ARG B 154 35.593 26.198 27.192 1.00 78.50 C +ATOM 1472 NE ARG B 154 35.137 27.597 27.396 1.00 86.29 N +ATOM 1473 CZ ARG B 154 34.513 28.373 26.494 1.00 88.19 C +ATOM 1474 NH1 ARG B 154 34.213 27.915 25.273 1.00 81.01 N +ATOM 1475 NH2 ARG B 154 34.160 29.628 26.815 1.00 84.39 N +ATOM 1476 N LEU B 155 39.094 26.279 23.797 1.00 37.55 N +ATOM 1477 CA LEU B 155 39.596 27.507 23.145 1.00 34.03 C +ATOM 1478 C LEU B 155 39.144 27.597 21.691 1.00 33.42 C +ATOM 1479 O LEU B 155 38.985 28.710 21.096 1.00 33.40 O +ATOM 1480 CB LEU B 155 41.128 27.579 23.212 1.00 34.06 C +ATOM 1481 CG LEU B 155 41.756 27.893 24.587 1.00 38.37 C +ATOM 1482 CD1 LEU B 155 43.291 27.776 24.523 1.00 36.58 C +ATOM 1483 CD2 LEU B 155 41.365 29.277 25.068 1.00 38.46 C +ATOM 1484 N ALA B 156 38.972 26.439 21.100 1.00 33.86 N +ATOM 1485 CA ALA B 156 38.473 26.376 19.709 1.00 36.25 C +ATOM 1486 C ALA B 156 37.020 26.832 19.647 1.00 42.15 C +ATOM 1487 O ALA B 156 36.699 27.653 18.797 1.00 34.54 O +ATOM 1488 CB ALA B 156 38.639 24.997 19.155 1.00 33.31 C +ATOM 1489 N ASP B 157 36.164 26.343 20.563 1.00 41.18 N +ATOM 1490 CA ASP B 157 34.840 27.006 20.768 1.00 44.56 C +ATOM 1491 C ASP B 157 34.904 28.535 21.075 1.00 43.49 C +ATOM 1492 O ASP B 157 34.320 29.345 20.373 1.00 46.19 O +ATOM 1493 CB ASP B 157 34.033 26.289 21.833 1.00 45.39 C +ATOM 1494 CG ASP B 157 33.595 24.888 21.392 1.00 52.65 C +ATOM 1495 OD1 ASP B 157 33.888 24.460 20.267 1.00 55.58 O +ATOM 1496 OD2 ASP B 157 32.950 24.182 22.178 1.00 62.47 O +ATOM 1497 N TYR B 158 35.648 28.949 22.084 1.00 38.54 N +ATOM 1498 CA TYR B 158 35.810 30.369 22.328 1.00 41.95 C +ATOM 1499 C TYR B 158 36.181 31.212 21.101 1.00 46.40 C +ATOM 1500 O TYR B 158 35.505 32.214 20.781 1.00 40.29 O +ATOM 1501 CB TYR B 158 36.806 30.575 23.451 1.00 40.00 C +ATOM 1502 CG TYR B 158 37.208 31.961 23.675 1.00 45.74 C +ATOM 1503 CD1 TYR B 158 36.295 32.904 24.143 1.00 46.55 C +ATOM 1504 CD2 TYR B 158 38.527 32.354 23.467 1.00 46.13 C +ATOM 1505 CE1 TYR B 158 36.689 34.204 24.356 1.00 44.13 C +ATOM 1506 CE2 TYR B 158 38.937 33.637 23.708 1.00 50.92 C +ATOM 1507 CZ TYR B 158 38.019 34.563 24.160 1.00 54.97 C +ATOM 1508 OH TYR B 158 38.469 35.851 24.385 1.00 60.70 O +ATOM 1509 N THR B 159 37.268 30.837 20.438 1.00 39.69 N +ATOM 1510 CA THR B 159 37.743 31.597 19.274 1.00 38.02 C +ATOM 1511 C THR B 159 36.710 31.556 18.121 1.00 38.96 C +ATOM 1512 O THR B 159 36.648 32.490 17.375 1.00 39.31 O +ATOM 1513 CB THR B 159 39.161 31.128 18.817 1.00 37.31 C +ATOM 1514 OG1 THR B 159 39.175 29.713 18.599 1.00 34.43 O +ATOM 1515 CG2 THR B 159 40.153 31.453 19.859 1.00 33.89 C +ATOM 1516 N GLU B 160 35.920 30.490 17.981 1.00 37.13 N +ATOM 1517 CA GLU B 160 34.889 30.470 16.946 1.00 48.77 C +ATOM 1518 C GLU B 160 33.723 31.421 17.262 1.00 52.90 C +ATOM 1519 O GLU B 160 33.104 31.997 16.334 1.00 46.49 O +ATOM 1520 CB GLU B 160 34.294 29.075 16.742 1.00 52.67 C +ATOM 1521 CG GLU B 160 34.906 28.322 15.568 1.00 67.41 C +ATOM 1522 CD GLU B 160 34.655 26.811 15.617 1.00 69.41 C +ATOM 1523 OE1 GLU B 160 35.474 26.022 15.058 1.00 60.48 O +ATOM 1524 OE2 GLU B 160 33.604 26.437 16.193 1.00 73.44 O +ATOM 1525 N GLN B 161 33.404 31.512 18.558 1.00 51.66 N +ATOM 1526 CA GLN B 161 32.328 32.368 19.057 1.00 50.85 C +ATOM 1527 C GLN B 161 32.704 33.797 18.753 1.00 43.36 C +ATOM 1528 O GLN B 161 31.961 34.489 18.094 1.00 42.79 O +ATOM 1529 CB GLN B 161 32.074 32.134 20.556 1.00 59.29 C +ATOM 1530 CG GLN B 161 31.007 31.091 20.898 1.00 68.05 C +ATOM 1531 CD GLN B 161 31.041 29.813 20.033 1.00 81.34 C +ATOM 1532 OE1 GLN B 161 31.648 28.793 20.400 1.00 93.90 O +ATOM 1533 NE2 GLN B 161 30.363 29.860 18.887 1.00 95.89 N +ATOM 1534 N ARG B 162 33.912 34.178 19.129 1.00 45.35 N +ATOM 1535 CA ARG B 162 34.471 35.488 18.838 1.00 46.11 C +ATOM 1536 C ARG B 162 34.482 35.830 17.382 1.00 57.70 C +ATOM 1537 O ARG B 162 34.061 36.894 16.978 1.00 61.39 O +ATOM 1538 CB ARG B 162 35.908 35.581 19.365 1.00 47.85 C +ATOM 1539 CG ARG B 162 36.066 36.750 20.275 1.00 51.24 C +ATOM 1540 CD ARG B 162 37.385 36.841 21.001 1.00 51.65 C +ATOM 1541 NE ARG B 162 37.693 38.256 21.254 1.00 58.76 N +ATOM 1542 CZ ARG B 162 38.081 39.127 20.312 1.00 67.22 C +ATOM 1543 NH1 ARG B 162 38.243 38.753 19.036 1.00 76.81 N +ATOM 1544 NH2 ARG B 162 38.326 40.382 20.635 1.00 65.92 N +ATOM 1545 N GLN B 163 35.017 34.925 16.581 1.00 59.25 N +ATOM 1546 CA GLN B 163 35.054 35.116 15.125 1.00 58.28 C +ATOM 1547 C GLN B 163 33.667 35.371 14.530 1.00 48.39 C +ATOM 1548 O GLN B 163 33.517 36.242 13.717 1.00 49.45 O +ATOM 1549 CB GLN B 163 35.702 33.883 14.434 1.00 53.79 C +ATOM 1550 CG GLN B 163 35.984 34.103 12.952 1.00 65.41 C +ATOM 1551 CD GLN B 163 34.928 33.568 12.032 1.00 69.50 C +ATOM 1552 OE1 GLN B 163 33.921 32.995 12.466 1.00 81.08 O +ATOM 1553 NE2 GLN B 163 35.169 33.716 10.725 1.00 89.51 N +ATOM 1554 N GLN B 164 32.668 34.593 14.916 1.00 48.25 N +ATOM 1555 CA GLN B 164 31.356 34.766 14.330 1.00 57.01 C +ATOM 1556 C GLN B 164 30.584 36.042 14.852 1.00 55.87 C +ATOM 1557 O GLN B 164 29.553 36.421 14.304 1.00 54.30 O +ATOM 1558 CB GLN B 164 30.551 33.458 14.433 1.00 57.78 C +ATOM 1559 CG GLN B 164 29.923 33.173 15.770 1.00 69.36 C +ATOM 1560 CD GLN B 164 28.616 32.397 15.664 1.00 81.81 C +ATOM 1561 OE1 GLN B 164 27.829 32.599 14.737 1.00 80.95 O +ATOM 1562 NE2 GLN B 164 28.361 31.528 16.650 1.00 94.70 N +ATOM 1563 N MET B 165 31.077 36.669 15.911 1.00 54.65 N +ATOM 1564 CA MET B 165 30.635 38.016 16.288 1.00 58.97 C +ATOM 1565 C MET B 165 31.225 39.039 15.325 1.00 58.33 C +ATOM 1566 O MET B 165 30.476 39.806 14.748 1.00 57.94 O +ATOM 1567 CB MET B 165 31.017 38.383 17.733 1.00 51.73 C +ATOM 1568 CG MET B 165 30.249 37.571 18.773 1.00 55.61 C +ATOM 1569 SD MET B 165 30.278 38.264 20.455 1.00 56.60 S +ATOM 1570 CE MET B 165 31.982 38.227 20.915 1.00 54.59 C +ATOM 1571 N ARG B 166 32.544 39.044 15.139 1.00 61.90 N +ATOM 1572 CA ARG B 166 33.193 39.991 14.185 1.00 65.70 C +ATOM 1573 C ARG B 166 32.734 39.800 12.750 1.00 64.28 C +ATOM 1574 O ARG B 166 33.016 40.638 11.916 1.00 62.97 O +ATOM 1575 CB ARG B 166 34.714 39.882 14.212 1.00 67.86 C +ATOM 1576 CG ARG B 166 35.395 41.131 13.695 1.00 73.87 C +ATOM 1577 CD ARG B 166 36.866 41.184 14.100 1.00 84.20 C +ATOM 1578 NE ARG B 166 37.114 41.340 15.548 1.00 84.39 N +ATOM 1579 CZ ARG B 166 38.327 41.473 16.107 1.00 74.73 C +ATOM 1580 NH1 ARG B 166 39.419 41.479 15.367 1.00 83.72 N +ATOM 1581 NH2 ARG B 166 38.459 41.629 17.411 1.00 69.63 N +ATOM 1582 N SER B 167 32.060 38.677 12.495 1.00 65.76 N +ATOM 1583 CA SER B 167 31.407 38.351 11.246 1.00 69.33 C +ATOM 1584 C SER B 167 29.977 38.870 11.185 1.00 72.90 C +ATOM 1585 O SER B 167 29.582 39.340 10.124 1.00 71.57 O +ATOM 1586 CB SER B 167 31.431 36.821 11.006 1.00 78.01 C +ATOM 1587 OG SER B 167 30.168 36.318 10.582 1.00 82.49 O +ATOM 1588 N ARG B 168 29.195 38.773 12.274 1.00 75.92 N +ATOM 1589 CA ARG B 168 27.859 39.435 12.311 1.00 81.77 C +ATOM 1590 C ARG B 168 27.989 40.933 12.023 1.00 82.65 C +ATOM 1591 O ARG B 168 27.202 41.485 11.259 1.00 79.21 O +ATOM 1592 CB ARG B 168 27.062 39.197 13.604 1.00 85.28 C +ATOM 1593 CG ARG B 168 25.743 38.460 13.362 1.00 97.43 C +ATOM 1594 CD ARG B 168 25.126 37.852 14.621 1.00108.71 C +ATOM 1595 NE ARG B 168 25.745 36.560 14.985 1.00115.17 N +ATOM 1596 CZ ARG B 168 26.179 36.186 16.205 1.00118.68 C +ATOM 1597 NH1 ARG B 168 26.732 34.986 16.351 1.00118.88 N +ATOM 1598 NH2 ARG B 168 26.067 36.963 17.287 1.00110.02 N +ATOM 1599 N ILE B 169 29.028 41.561 12.569 1.00 81.63 N +ATOM 1600 CA ILE B 169 29.273 42.986 12.332 1.00 76.60 C +ATOM 1601 C ILE B 169 29.850 43.250 10.945 1.00 83.32 C +ATOM 1602 O ILE B 169 29.443 44.206 10.301 1.00 84.05 O +ATOM 1603 CB ILE B 169 30.109 43.651 13.464 1.00 66.39 C +ATOM 1604 CG1 ILE B 169 31.652 43.515 13.292 1.00 68.82 C +ATOM 1605 CG2 ILE B 169 29.621 43.174 14.835 1.00 61.08 C +ATOM 1606 CD1 ILE B 169 32.386 44.724 12.702 1.00 60.33 C +ATOM 1607 N GLN B 170 30.755 42.381 10.485 1.00 92.32 N +ATOM 1608 CA GLN B 170 31.524 42.575 9.242 1.00 95.42 C +ATOM 1609 C GLN B 170 30.641 42.865 8.010 1.00105.80 C +ATOM 1610 O GLN B 170 31.084 43.557 7.092 1.00121.34 O +ATOM 1611 CB GLN B 170 32.431 41.356 8.967 1.00 98.30 C +ATOM 1612 CG GLN B 170 33.724 41.641 8.211 1.00104.36 C +ATOM 1613 CD GLN B 170 33.563 41.594 6.689 1.00109.71 C +ATOM 1614 OE1 GLN B 170 33.245 40.552 6.112 1.00115.36 O +ATOM 1615 NE2 GLN B 170 33.796 42.726 6.033 1.00105.18 N +ATOM 1616 N GLN B 171 29.416 42.330 7.984 1.00108.19 N +ATOM 1617 CA GLN B 171 28.406 42.714 6.990 1.00101.31 C +ATOM 1618 C GLN B 171 27.164 43.169 7.727 1.00 88.79 C +ATOM 1619 O GLN B 171 26.157 43.469 7.106 1.00 90.06 O +ATOM 1620 CB GLN B 171 28.061 41.552 6.051 1.00105.22 C +ATOM 1621 CG GLN B 171 29.243 40.910 5.312 1.00110.36 C +ATOM 1622 CD GLN B 171 29.542 39.472 5.750 1.00119.41 C +ATOM 1623 OE1 GLN B 171 28.648 38.626 5.815 1.00124.15 O +ATOM 1624 NE2 GLN B 171 30.807 39.189 6.032 1.00117.78 N +ATOM 825 N ILE C 65 38.499 47.863 34.334 1.00 78.40 N +ATOM 826 CA ILE C 65 37.660 46.815 35.006 1.00 71.54 C +ATOM 827 C ILE C 65 37.939 45.377 34.553 1.00 65.80 C +ATOM 828 O ILE C 65 38.390 45.095 33.433 1.00 61.59 O +ATOM 829 CB ILE C 65 36.153 47.075 34.846 1.00 66.09 C +ATOM 830 CG1 ILE C 65 35.724 46.994 33.357 1.00 60.72 C +ATOM 831 CG2 ILE C 65 35.791 48.398 35.499 1.00 65.53 C +ATOM 832 CD1 ILE C 65 34.449 46.221 33.143 1.00 52.74 C +ATOM 833 N SER C 66 37.628 44.469 35.452 1.00 60.42 N +ATOM 834 CA SER C 66 38.033 43.092 35.303 1.00 61.40 C +ATOM 835 C SER C 66 37.059 42.354 34.391 1.00 62.02 C +ATOM 836 O SER C 66 35.997 42.881 34.025 1.00 67.59 O +ATOM 837 CB SER C 66 38.067 42.422 36.670 1.00 58.40 C +ATOM 838 OG SER C 66 36.781 42.007 37.035 1.00 56.98 O +ATOM 839 N ALA C 67 37.423 41.131 34.059 1.00 55.76 N +ATOM 840 CA ALA C 67 36.592 40.249 33.250 1.00 61.78 C +ATOM 841 C ALA C 67 35.305 39.878 33.987 1.00 57.14 C +ATOM 842 O ALA C 67 34.227 39.922 33.385 1.00 49.76 O +ATOM 843 CB ALA C 67 37.358 38.989 32.844 1.00 60.48 C +ATOM 844 N SER C 68 35.412 39.545 35.275 1.00 50.54 N +ATOM 845 CA SER C 68 34.233 39.203 36.058 1.00 52.24 C +ATOM 846 C SER C 68 33.295 40.420 36.294 1.00 45.47 C +ATOM 847 O SER C 68 32.090 40.251 36.333 1.00 41.22 O +ATOM 848 CB SER C 68 34.590 38.486 37.357 1.00 53.81 C +ATOM 849 OG SER C 68 35.171 39.426 38.210 1.00 61.40 O +ATOM 850 N ASP C 69 33.855 41.620 36.327 1.00 44.12 N +ATOM 851 CA ASP C 69 33.075 42.839 36.444 1.00 46.93 C +ATOM 852 C ASP C 69 32.278 43.097 35.169 1.00 42.78 C +ATOM 853 O ASP C 69 31.077 43.384 35.239 1.00 40.41 O +ATOM 854 CB ASP C 69 33.985 44.032 36.782 1.00 52.14 C +ATOM 855 CG ASP C 69 34.449 44.020 38.268 1.00 73.51 C +ATOM 856 OD1 ASP C 69 33.602 43.786 39.188 1.00 75.12 O +ATOM 857 OD2 ASP C 69 35.655 44.283 38.511 1.00 86.28 O +ATOM 858 N LEU C 70 32.936 42.947 34.023 1.00 41.58 N +ATOM 859 CA LEU C 70 32.316 43.168 32.734 1.00 39.93 C +ATOM 860 C LEU C 70 31.203 42.139 32.473 1.00 40.77 C +ATOM 861 O LEU C 70 30.122 42.494 31.989 1.00 36.81 O +ATOM 862 CB LEU C 70 33.351 43.130 31.609 1.00 42.83 C +ATOM 863 CG LEU C 70 32.783 43.347 30.181 1.00 44.89 C +ATOM 864 CD1 LEU C 70 32.368 44.790 30.011 1.00 43.31 C +ATOM 865 CD2 LEU C 70 33.781 42.939 29.103 1.00 40.63 C +ATOM 866 N ALA C 71 31.463 40.884 32.790 1.00 35.32 N +ATOM 867 CA ALA C 71 30.450 39.874 32.762 1.00 36.62 C +ATOM 868 C ALA C 71 29.204 40.221 33.631 1.00 34.39 C +ATOM 869 O ALA C 71 28.094 39.925 33.275 1.00 29.95 O +ATOM 870 CB ALA C 71 31.037 38.536 33.255 1.00 36.30 C +ATOM 871 N LEU C 72 29.422 40.715 34.826 1.00 36.37 N +ATOM 872 CA LEU C 72 28.312 40.995 35.739 1.00 33.96 C +ATOM 873 C LEU C 72 27.494 42.121 35.143 1.00 29.31 C +ATOM 874 O LEU C 72 26.285 42.022 34.997 1.00 34.09 O +ATOM 875 CB LEU C 72 28.846 41.365 37.135 1.00 36.33 C +ATOM 876 CG LEU C 72 27.787 41.829 38.134 1.00 36.63 C +ATOM 877 CD1 LEU C 72 26.857 40.661 38.447 1.00 36.00 C +ATOM 878 CD2 LEU C 72 28.484 42.308 39.389 1.00 38.15 C +ATOM 879 N LEU C 73 28.147 43.185 34.770 1.00 28.98 N +ATOM 880 CA LEU C 73 27.453 44.336 34.254 1.00 38.06 C +ATOM 881 C LEU C 73 26.705 44.124 32.943 1.00 37.74 C +ATOM 882 O LEU C 73 25.638 44.719 32.761 1.00 35.83 O +ATOM 883 CB LEU C 73 28.376 45.578 34.225 1.00 43.59 C +ATOM 884 CG LEU C 73 29.220 45.968 33.022 1.00 50.24 C +ATOM 885 CD1 LEU C 73 28.397 46.569 31.863 1.00 56.17 C +ATOM 886 CD2 LEU C 73 30.317 46.962 33.495 1.00 46.73 C +ATOM 887 N THR C 74 27.256 43.286 32.059 1.00 31.60 N +ATOM 888 CA THR C 74 26.630 42.951 30.798 1.00 30.60 C +ATOM 889 C THR C 74 25.410 42.095 31.058 1.00 29.16 C +ATOM 890 O THR C 74 24.373 42.279 30.411 1.00 28.87 O +ATOM 891 CB THR C 74 27.620 42.200 29.829 1.00 33.65 C +ATOM 892 OG1 THR C 74 28.840 42.932 29.731 1.00 36.12 O +ATOM 893 CG2 THR C 74 27.052 42.086 28.441 1.00 36.70 C +ATOM 894 N ARG C 75 25.523 41.128 31.970 1.00 26.86 N +ATOM 895 CA ARG C 75 24.373 40.292 32.291 1.00 27.84 C +ATOM 896 C ARG C 75 23.235 41.178 32.900 1.00 28.01 C +ATOM 897 O ARG C 75 22.097 41.066 32.545 1.00 28.48 O +ATOM 898 CB ARG C 75 24.796 39.256 33.288 1.00 28.16 C +ATOM 899 CG ARG C 75 23.760 38.286 33.817 1.00 28.93 C +ATOM 900 CD ARG C 75 22.844 37.624 32.813 1.00 34.66 C +ATOM 901 NE ARG C 75 23.574 36.627 32.010 1.00 35.42 N +ATOM 902 CZ ARG C 75 23.195 36.192 30.806 1.00 32.85 C +ATOM 903 NH1 ARG C 75 22.049 36.564 30.246 1.00 31.97 N +ATOM 904 NH2 ARG C 75 23.952 35.324 30.177 1.00 36.33 N +ATOM 905 N GLN C 76 23.599 42.067 33.794 1.00 27.15 N +ATOM 906 CA GLN C 76 22.616 42.959 34.504 1.00 27.97 C +ATOM 907 C GLN C 76 21.959 43.834 33.471 1.00 27.10 C +ATOM 908 O GLN C 76 20.757 43.824 33.363 1.00 26.36 O +ATOM 909 CB GLN C 76 23.310 43.812 35.526 1.00 27.71 C +ATOM 910 CG GLN C 76 23.691 43.075 36.770 1.00 26.30 C +ATOM 911 CD GLN C 76 24.519 43.900 37.703 1.00 30.18 C +ATOM 912 OE1 GLN C 76 25.417 44.688 37.282 1.00 34.48 O +ATOM 913 NE2 GLN C 76 24.364 43.595 38.984 1.00 27.21 N +ATOM 914 N LEU C 77 22.780 44.465 32.628 1.00 31.12 N +ATOM 915 CA LEU C 77 22.290 45.297 31.571 1.00 31.03 C +ATOM 916 C LEU C 77 21.427 44.584 30.575 1.00 30.02 C +ATOM 917 O LEU C 77 20.369 45.093 30.211 1.00 30.95 O +ATOM 918 CB LEU C 77 23.444 46.015 30.878 1.00 33.67 C +ATOM 919 CG LEU C 77 23.041 47.220 30.037 1.00 37.99 C +ATOM 920 CD1 LEU C 77 22.349 48.321 30.870 1.00 43.84 C +ATOM 921 CD2 LEU C 77 24.302 47.735 29.351 1.00 38.73 C +ATOM 922 N ALA C 78 21.836 43.408 30.108 1.00 30.54 N +ATOM 923 CA ALA C 78 20.949 42.601 29.265 1.00 30.30 C +ATOM 924 C ALA C 78 19.619 42.295 29.888 1.00 28.12 C +ATOM 925 O ALA C 78 18.607 42.216 29.181 1.00 28.91 O +ATOM 926 CB ALA C 78 21.605 41.278 28.879 1.00 31.86 C +ATOM 927 N THR C 79 19.594 42.059 31.188 1.00 26.92 N +ATOM 928 CA THR C 79 18.367 41.616 31.819 1.00 31.05 C +ATOM 929 C THR C 79 17.395 42.798 31.869 1.00 29.50 C +ATOM 930 O THR C 79 16.197 42.653 31.591 1.00 28.33 O +ATOM 931 CB THR C 79 18.626 41.056 33.247 1.00 33.81 C +ATOM 932 OG1 THR C 79 19.542 39.981 33.173 1.00 35.08 O +ATOM 933 CG2 THR C 79 17.396 40.574 33.888 1.00 28.90 C +ATOM 934 N LEU C 80 17.918 43.978 32.146 1.00 32.35 N +ATOM 935 CA LEU C 80 17.056 45.177 32.290 1.00 34.18 C +ATOM 936 C LEU C 80 16.551 45.737 30.946 1.00 36.07 C +ATOM 937 O LEU C 80 15.375 46.149 30.821 1.00 31.88 O +ATOM 938 CB LEU C 80 17.783 46.245 33.095 1.00 33.40 C +ATOM 939 CG LEU C 80 18.177 45.854 34.504 1.00 36.22 C +ATOM 940 CD1 LEU C 80 19.136 46.852 35.072 1.00 39.53 C +ATOM 941 CD2 LEU C 80 16.982 45.766 35.413 1.00 39.87 C +ATOM 942 N VAL C 81 17.439 45.759 29.965 1.00 32.58 N +ATOM 943 CA VAL C 81 17.074 46.184 28.617 1.00 34.95 C +ATOM 944 C VAL C 81 16.042 45.231 28.054 1.00 35.09 C +ATOM 945 O VAL C 81 15.033 45.682 27.506 1.00 36.93 O +ATOM 946 CB VAL C 81 18.290 46.291 27.694 1.00 32.86 C +ATOM 947 CG1 VAL C 81 17.881 46.459 26.236 1.00 37.31 C +ATOM 948 CG2 VAL C 81 19.208 47.441 28.172 1.00 34.84 C +ATOM 949 N ALA C 82 16.232 43.931 28.260 1.00 33.82 N +ATOM 950 CA ALA C 82 15.230 42.934 27.854 1.00 33.58 C +ATOM 951 C ALA C 82 13.898 43.057 28.550 1.00 35.61 C +ATOM 952 O ALA C 82 12.909 42.620 28.033 1.00 34.21 O +ATOM 953 CB ALA C 82 15.771 41.515 28.069 1.00 36.08 C +ATOM 954 N ALA C 83 13.897 43.524 29.799 1.00 37.08 N +ATOM 955 CA ALA C 83 12.691 43.796 30.499 1.00 34.13 C +ATOM 956 C ALA C 83 11.995 45.113 30.065 1.00 34.55 C +ATOM 957 O ALA C 83 11.043 45.507 30.677 1.00 37.04 O +ATOM 958 CB ALA C 83 12.947 43.807 32.034 1.00 35.69 C +ATOM 959 N ALA C 84 12.538 45.805 29.078 1.00 40.50 N +ATOM 960 CA ALA C 84 12.021 47.040 28.497 1.00 49.05 C +ATOM 961 C ALA C 84 12.214 48.259 29.369 1.00 46.61 C +ATOM 962 O ALA C 84 11.503 49.238 29.177 1.00 49.64 O +ATOM 963 CB ALA C 84 10.544 46.896 28.029 1.00 45.77 C +ATOM 964 N LEU C 85 13.180 48.245 30.288 1.00 42.03 N +ATOM 965 CA LEU C 85 13.593 49.497 30.893 1.00 43.50 C +ATOM 966 C LEU C 85 14.280 50.375 29.864 1.00 44.77 C +ATOM 967 O LEU C 85 15.148 49.903 29.142 1.00 46.85 O +ATOM 968 CB LEU C 85 14.527 49.355 32.070 1.00 40.95 C +ATOM 969 CG LEU C 85 13.867 49.134 33.402 1.00 44.92 C +ATOM 970 CD1 LEU C 85 13.231 47.748 33.415 1.00 49.72 C +ATOM 971 CD2 LEU C 85 14.885 49.277 34.510 1.00 42.79 C +ATOM 972 N PRO C 86 13.925 51.683 29.833 1.00 44.91 N +ATOM 973 CA PRO C 86 14.701 52.613 29.041 1.00 41.82 C +ATOM 974 C PRO C 86 16.156 52.543 29.343 1.00 39.74 C +ATOM 975 O PRO C 86 16.563 52.330 30.516 1.00 39.23 O +ATOM 976 CB PRO C 86 14.132 53.983 29.447 1.00 46.20 C +ATOM 977 CG PRO C 86 12.696 53.692 29.706 1.00 43.87 C +ATOM 978 CD PRO C 86 12.715 52.335 30.386 1.00 46.36 C +ATOM 979 N LEU C 87 16.944 52.701 28.288 1.00 37.55 N +ATOM 980 CA LEU C 87 18.370 52.512 28.403 1.00 47.69 C +ATOM 981 C LEU C 87 18.933 53.353 29.551 1.00 47.69 C +ATOM 982 O LEU C 87 19.761 52.852 30.307 1.00 44.66 O +ATOM 983 CB LEU C 87 19.075 52.774 27.071 1.00 48.98 C +ATOM 984 CG LEU C 87 20.590 52.643 26.996 1.00 50.19 C +ATOM 985 CD1 LEU C 87 21.122 51.304 27.505 1.00 53.12 C +ATOM 986 CD2 LEU C 87 20.970 52.864 25.566 1.00 54.25 C +ATOM 987 N GLU C 88 18.470 54.597 29.721 1.00 43.39 N +ATOM 988 CA GLU C 88 19.045 55.449 30.782 1.00 45.81 C +ATOM 989 C GLU C 88 18.644 54.962 32.177 1.00 33.34 C +ATOM 990 O GLU C 88 19.396 55.055 33.072 1.00 37.14 O +ATOM 991 CB GLU C 88 18.752 56.946 30.572 1.00 52.82 C +ATOM 992 CG GLU C 88 17.602 57.539 31.395 1.00 63.88 C +ATOM 993 CD GLU C 88 16.239 57.374 30.765 1.00 74.82 C +ATOM 994 OE1 GLU C 88 16.179 57.169 29.533 1.00 70.27 O +ATOM 995 OE2 GLU C 88 15.226 57.467 31.516 1.00 82.86 O +ATOM 996 N GLU C 89 17.440 54.437 32.360 1.00 33.86 N +ATOM 997 CA GLU C 89 17.078 53.783 33.616 1.00 38.41 C +ATOM 998 C GLU C 89 17.883 52.464 33.864 1.00 35.18 C +ATOM 999 O GLU C 89 18.262 52.162 34.997 1.00 37.11 O +ATOM 1000 CB GLU C 89 15.603 53.448 33.634 1.00 41.88 C +ATOM 1001 CG GLU C 89 14.717 54.685 33.749 1.00 56.04 C +ATOM 1002 CD GLU C 89 13.218 54.374 33.632 1.00 62.13 C +ATOM 1003 OE1 GLU C 89 12.772 53.272 34.054 1.00 68.19 O +ATOM 1004 OE2 GLU C 89 12.499 55.244 33.086 1.00 74.48 O +ATOM 1005 N ALA C 90 18.163 51.723 32.797 1.00 34.42 N +ATOM 1006 CA ALA C 90 18.933 50.445 32.885 1.00 35.41 C +ATOM 1007 C ALA C 90 20.331 50.696 33.348 1.00 29.14 C +ATOM 1008 O ALA C 90 20.807 50.076 34.331 1.00 29.85 O +ATOM 1009 CB ALA C 90 18.926 49.756 31.535 1.00 37.63 C +ATOM 1010 N LEU C 91 20.987 51.672 32.715 1.00 31.81 N +ATOM 1011 CA LEU C 91 22.346 52.087 33.124 1.00 31.32 C +ATOM 1012 C LEU C 91 22.412 52.614 34.561 1.00 35.12 C +ATOM 1013 O LEU C 91 23.298 52.240 35.332 1.00 37.17 O +ATOM 1014 CB LEU C 91 22.883 53.160 32.155 1.00 38.45 C +ATOM 1015 CG LEU C 91 23.163 52.643 30.728 1.00 38.50 C +ATOM 1016 CD1 LEU C 91 23.243 53.726 29.646 1.00 38.29 C +ATOM 1017 CD2 LEU C 91 24.432 51.768 30.752 1.00 35.18 C +ATOM 1018 N ASP C 92 21.481 53.508 34.938 1.00 37.89 N +ATOM 1019 CA ASP C 92 21.331 53.911 36.353 1.00 35.25 C +ATOM 1020 C ASP C 92 21.211 52.750 37.276 1.00 35.09 C +ATOM 1021 O ASP C 92 21.887 52.691 38.311 1.00 37.63 O +ATOM 1022 CB ASP C 92 19.976 54.648 36.564 1.00 44.66 C +ATOM 1023 CG ASP C 92 20.122 56.133 36.803 1.00 45.06 C +ATOM 1024 OD1 ASP C 92 21.235 56.683 36.680 1.00 49.22 O +ATOM 1025 OD2 ASP C 92 19.073 56.722 37.116 1.00 61.76 O +ATOM 1026 N ALA C 93 20.280 51.840 36.942 1.00 30.78 N +ATOM 1027 CA ALA C 93 20.023 50.725 37.805 1.00 32.17 C +ATOM 1028 C ALA C 93 21.313 49.883 37.989 1.00 35.14 C +ATOM 1029 O ALA C 93 21.620 49.433 39.106 1.00 34.33 O +ATOM 1030 CB ALA C 93 18.827 49.913 37.294 1.00 29.12 C +ATOM 1031 N VAL C 94 22.115 49.748 36.931 1.00 35.70 N +ATOM 1032 CA VAL C 94 23.329 48.956 37.032 1.00 36.66 C +ATOM 1033 C VAL C 94 24.412 49.720 37.821 1.00 44.75 C +ATOM 1034 O VAL C 94 25.214 49.104 38.565 1.00 40.04 O +ATOM 1035 CB VAL C 94 23.877 48.586 35.633 1.00 39.20 C +ATOM 1036 CG1 VAL C 94 25.233 47.890 35.751 1.00 40.06 C +ATOM 1037 CG2 VAL C 94 22.874 47.718 34.863 1.00 39.30 C +ATOM 1038 N ALA C 95 24.478 51.041 37.616 1.00 41.33 N +ATOM 1039 CA ALA C 95 25.364 51.869 38.464 1.00 45.26 C +ATOM 1040 C ALA C 95 24.992 51.798 39.955 1.00 44.17 C +ATOM 1041 O ALA C 95 25.871 51.762 40.792 1.00 54.54 O +ATOM 1042 CB ALA C 95 25.404 53.314 37.983 1.00 42.68 C +ATOM 1043 N LYS C 96 23.704 51.715 40.266 1.00 42.93 N +ATOM 1044 CA LYS C 96 23.229 51.614 41.677 1.00 49.49 C +ATOM 1045 C LYS C 96 23.541 50.298 42.348 1.00 48.47 C +ATOM 1046 O LYS C 96 23.713 50.237 43.562 1.00 45.10 O +ATOM 1047 CB LYS C 96 21.706 51.772 41.759 1.00 48.78 C +ATOM 1048 CG LYS C 96 21.237 53.150 42.065 1.00 56.68 C +ATOM 1049 CD LYS C 96 19.726 53.233 41.858 1.00 62.01 C +ATOM 1050 CE LYS C 96 19.078 54.154 42.863 1.00 68.88 C +ATOM 1051 NZ LYS C 96 17.636 54.378 42.565 1.00 72.20 N +ATOM 1052 N GLN C 97 23.515 49.231 41.572 1.00 45.41 N +ATOM 1053 CA GLN C 97 23.679 47.894 42.097 1.00 47.85 C +ATOM 1054 C GLN C 97 25.146 47.498 42.223 1.00 47.12 C +ATOM 1055 O GLN C 97 25.441 46.519 42.879 1.00 51.35 O +ATOM 1056 CB GLN C 97 22.911 46.892 41.211 1.00 55.10 C +ATOM 1057 CG GLN C 97 21.406 47.114 41.221 1.00 49.87 C +ATOM 1058 CD GLN C 97 20.662 46.067 40.389 1.00 53.04 C +ATOM 1059 OE1 GLN C 97 20.984 44.881 40.466 1.00 48.91 O +ATOM 1060 NE2 GLN C 97 19.599 46.492 39.646 1.00 51.95 N +ATOM 1061 N SER C 98 26.074 48.265 41.670 1.00 51.97 N +ATOM 1062 CA SER C 98 27.484 47.940 41.843 1.00 59.63 C +ATOM 1063 C SER C 98 28.079 48.209 43.262 1.00 68.19 C +ATOM 1064 O SER C 98 27.907 49.289 43.838 1.00 60.58 O +ATOM 1065 CB SER C 98 28.317 48.656 40.791 1.00 64.16 C +ATOM 1066 OG SER C 98 29.705 48.490 41.079 1.00 71.03 O +ATOM 1067 N GLU C 99 28.810 47.200 43.762 1.00 76.65 N +ATOM 1068 CA GLU C 99 29.604 47.271 44.989 1.00 75.08 C +ATOM 1069 C GLU C 99 30.926 47.973 44.753 1.00 75.21 C +ATOM 1070 O GLU C 99 31.593 48.319 45.703 1.00 79.47 O +ATOM 1071 CB GLU C 99 29.948 45.872 45.555 1.00 75.09 C +ATOM 1072 CG GLU C 99 28.852 44.809 45.552 1.00 84.16 C +ATOM 1073 CD GLU C 99 27.497 45.330 45.986 1.00 95.80 C +ATOM 1074 OE1 GLU C 99 27.437 46.324 46.746 1.00101.94 O +ATOM 1075 OE2 GLU C 99 26.482 44.731 45.573 1.00 97.25 O +ATOM 1076 N LYS C 100 31.345 48.155 43.509 1.00 72.31 N +ATOM 1077 CA LYS C 100 32.626 48.806 43.253 1.00 72.64 C +ATOM 1078 C LYS C 100 32.353 50.204 42.761 1.00 64.15 C +ATOM 1079 O LYS C 100 31.669 50.382 41.775 1.00 57.62 O +ATOM 1080 CB LYS C 100 33.441 48.002 42.243 1.00 76.33 C +ATOM 1081 CG LYS C 100 33.634 46.550 42.664 1.00 80.70 C +ATOM 1082 CD LYS C 100 34.781 45.891 41.921 1.00 83.69 C +ATOM 1083 CE LYS C 100 34.816 44.403 42.224 1.00 84.84 C +ATOM 1084 NZ LYS C 100 35.911 43.709 41.490 1.00 86.51 N +ATOM 1085 N PRO C 101 32.870 51.218 43.454 1.00 68.16 N +ATOM 1086 CA PRO C 101 32.668 52.568 42.905 1.00 67.39 C +ATOM 1087 C PRO C 101 33.258 52.769 41.495 1.00 63.01 C +ATOM 1088 O PRO C 101 32.729 53.588 40.737 1.00 66.77 O +ATOM 1089 CB PRO C 101 33.351 53.473 43.934 1.00 68.95 C +ATOM 1090 CG PRO C 101 33.214 52.714 45.218 1.00 72.06 C +ATOM 1091 CD PRO C 101 33.376 51.258 44.833 1.00 72.10 C +ATOM 1092 N LYS C 102 34.306 52.020 41.134 1.00 63.46 N +ATOM 1093 CA LYS C 102 34.855 52.077 39.763 1.00 65.97 C +ATOM 1094 C LYS C 102 33.865 51.521 38.711 1.00 63.46 C +ATOM 1095 O LYS C 102 33.680 52.139 37.670 1.00 68.22 O +ATOM 1096 CB LYS C 102 36.253 51.413 39.662 1.00 73.15 C +ATOM 1097 CG LYS C 102 36.295 49.898 39.837 1.00 77.14 C +ATOM 1098 CD LYS C 102 37.674 49.319 39.569 1.00 82.35 C +ATOM 1099 CE LYS C 102 37.730 47.864 40.007 1.00 81.34 C +ATOM 1100 NZ LYS C 102 38.996 47.254 39.541 1.00 87.09 N +ATOM 1101 N LEU C 103 33.205 50.396 39.004 1.00 62.02 N +ATOM 1102 CA LEU C 103 32.111 49.894 38.152 1.00 62.54 C +ATOM 1103 C LEU C 103 30.954 50.872 38.001 1.00 56.23 C +ATOM 1104 O LEU C 103 30.468 51.071 36.884 1.00 52.62 O +ATOM 1105 CB LEU C 103 31.496 48.625 38.705 1.00 67.60 C +ATOM 1106 CG LEU C 103 31.943 47.345 38.033 1.00 83.44 C +ATOM 1107 CD1 LEU C 103 33.296 46.953 38.635 1.00 80.50 C +ATOM 1108 CD2 LEU C 103 30.851 46.263 38.175 1.00 83.52 C +ATOM 1109 N SER C 104 30.516 51.450 39.130 1.00 55.09 N +ATOM 1110 CA SER C 104 29.392 52.426 39.171 1.00 48.82 C +ATOM 1111 C SER C 104 29.691 53.668 38.402 1.00 49.43 C +ATOM 1112 O SER C 104 28.845 54.166 37.626 1.00 51.77 O +ATOM 1113 CB SER C 104 29.077 52.816 40.612 1.00 52.14 C +ATOM 1114 OG SER C 104 28.829 51.655 41.375 1.00 53.01 O +ATOM 1115 N ALA C 105 30.907 54.179 38.612 1.00 52.69 N +ATOM 1116 CA ALA C 105 31.410 55.357 37.890 1.00 47.57 C +ATOM 1117 C ALA C 105 31.472 55.156 36.370 1.00 44.20 C +ATOM 1118 O ALA C 105 30.942 55.975 35.579 1.00 52.02 O +ATOM 1119 CB ALA C 105 32.789 55.710 38.429 1.00 52.44 C +ATOM 1120 N LEU C 106 32.080 54.053 35.946 1.00 51.24 N +ATOM 1121 CA LEU C 106 32.066 53.672 34.506 1.00 51.92 C +ATOM 1122 C LEU C 106 30.656 53.736 33.940 1.00 47.72 C +ATOM 1123 O LEU C 106 30.416 54.413 32.937 1.00 51.51 O +ATOM 1124 CB LEU C 106 32.610 52.259 34.287 1.00 51.83 C +ATOM 1125 CG LEU C 106 32.451 51.748 32.834 1.00 50.79 C +ATOM 1126 CD1 LEU C 106 33.232 52.609 31.865 1.00 51.81 C +ATOM 1127 CD2 LEU C 106 32.865 50.289 32.763 1.00 56.34 C +ATOM 1128 N MET C 107 29.730 53.056 34.615 1.00 46.22 N +ATOM 1129 CA MET C 107 28.330 52.995 34.165 1.00 46.88 C +ATOM 1130 C MET C 107 27.615 54.320 34.196 1.00 48.52 C +ATOM 1131 O MET C 107 26.860 54.654 33.253 1.00 43.91 O +ATOM 1132 CB MET C 107 27.539 51.947 34.956 1.00 49.00 C +ATOM 1133 CG MET C 107 28.091 50.522 34.842 1.00 57.55 C +ATOM 1134 SD MET C 107 27.665 49.658 33.314 1.00 62.93 S +ATOM 1135 CE MET C 107 28.588 50.498 32.068 1.00 52.83 C +ATOM 1136 N ALA C 108 27.848 55.096 35.254 1.00 50.75 N +ATOM 1137 CA ALA C 108 27.389 56.497 35.271 1.00 49.33 C +ATOM 1138 C ALA C 108 27.966 57.334 34.102 1.00 45.20 C +ATOM 1139 O ALA C 108 27.248 58.181 33.483 1.00 42.12 O +ATOM 1140 CB ALA C 108 27.754 57.146 36.605 1.00 54.69 C +ATOM 1141 N ALA C 109 29.257 57.127 33.812 1.00 50.91 N +ATOM 1142 CA ALA C 109 29.918 57.830 32.666 1.00 56.83 C +ATOM 1143 C ALA C 109 29.329 57.449 31.272 1.00 57.16 C +ATOM 1144 O ALA C 109 29.036 58.307 30.415 1.00 50.20 O +ATOM 1145 CB ALA C 109 31.405 57.589 32.709 1.00 54.73 C +ATOM 1146 N VAL C 110 29.070 56.150 31.098 1.00 52.58 N +ATOM 1147 CA VAL C 110 28.448 55.664 29.886 1.00 43.60 C +ATOM 1148 C VAL C 110 27.088 56.308 29.818 1.00 43.54 C +ATOM 1149 O VAL C 110 26.716 56.867 28.785 1.00 51.31 O +ATOM 1150 CB VAL C 110 28.353 54.117 29.913 1.00 46.26 C +ATOM 1151 CG1 VAL C 110 27.414 53.587 28.858 1.00 47.49 C +ATOM 1152 CG2 VAL C 110 29.730 53.488 29.815 1.00 44.38 C +ATOM 1153 N ARG C 111 26.339 56.268 30.922 1.00 42.58 N +ATOM 1154 CA ARG C 111 24.989 56.912 30.954 1.00 47.24 C +ATOM 1155 C ARG C 111 25.009 58.422 30.613 1.00 47.06 C +ATOM 1156 O ARG C 111 24.091 58.935 29.923 1.00 45.07 O +ATOM 1157 CB ARG C 111 24.315 56.691 32.317 1.00 44.40 C +ATOM 1158 CG ARG C 111 22.892 57.209 32.378 1.00 43.15 C +ATOM 1159 CD ARG C 111 22.320 57.146 33.784 1.00 41.51 C +ATOM 1160 NE ARG C 111 20.939 57.613 33.733 1.00 43.96 N +ATOM 1161 CZ ARG C 111 20.591 58.909 33.720 1.00 41.32 C +ATOM 1162 NH1 ARG C 111 19.326 59.238 33.640 1.00 37.23 N +ATOM 1163 NH2 ARG C 111 21.513 59.875 33.737 1.00 39.56 N +ATOM 1164 N ALA C 112 26.050 59.108 31.095 1.00 51.36 N +ATOM 1165 CA ALA C 112 26.250 60.543 30.831 1.00 50.98 C +ATOM 1166 C ALA C 112 26.270 60.831 29.330 1.00 58.41 C +ATOM 1167 O ALA C 112 25.568 61.716 28.825 1.00 57.83 O +ATOM 1168 CB ALA C 112 27.547 61.010 31.472 1.00 49.34 C +ATOM 1169 N LYS C 113 27.066 60.041 28.617 1.00 58.28 N +ATOM 1170 CA LYS C 113 27.193 60.175 27.165 1.00 52.40 C +ATOM 1171 C LYS C 113 25.881 59.857 26.485 1.00 48.18 C +ATOM 1172 O LYS C 113 25.466 60.512 25.530 1.00 45.50 O +ATOM 1173 CB LYS C 113 28.321 59.256 26.665 1.00 59.81 C +ATOM 1174 CG LYS C 113 29.744 59.540 27.212 1.00 62.67 C +ATOM 1175 CD LYS C 113 30.385 60.813 26.617 1.00 75.06 C +ATOM 1176 CE LYS C 113 31.786 61.105 27.176 1.00 77.06 C +ATOM 1177 NZ LYS C 113 31.773 61.952 28.401 1.00 81.88 N +ATOM 1178 N VAL C 114 25.182 58.860 27.015 1.00 52.52 N +ATOM 1179 CA VAL C 114 23.897 58.481 26.454 1.00 49.85 C +ATOM 1180 C VAL C 114 22.851 59.555 26.725 1.00 54.95 C +ATOM 1181 O VAL C 114 21.935 59.743 25.897 1.00 61.43 O +ATOM 1182 CB VAL C 114 23.398 57.104 26.983 1.00 44.50 C +ATOM 1183 CG1 VAL C 114 22.019 56.805 26.463 1.00 44.97 C +ATOM 1184 CG2 VAL C 114 24.306 55.977 26.522 1.00 52.31 C +ATOM 1185 N VAL C 115 22.922 60.232 27.876 1.00 61.02 N +ATOM 1186 CA VAL C 115 21.947 61.333 28.092 1.00 70.67 C +ATOM 1187 C VAL C 115 22.304 62.539 27.238 1.00 69.49 C +ATOM 1188 O VAL C 115 21.397 63.167 26.726 1.00 63.33 O +ATOM 1189 CB VAL C 115 21.648 61.725 29.563 1.00 65.12 C +ATOM 1190 CG1 VAL C 115 20.963 60.560 30.256 1.00 68.30 C +ATOM 1191 CG2 VAL C 115 22.883 62.195 30.309 1.00 69.96 C +ATOM 1192 N GLU C 116 23.605 62.794 27.029 1.00 75.56 N +ATOM 1193 CA GLU C 116 24.079 63.747 25.996 1.00 73.62 C +ATOM 1194 C GLU C 116 23.741 63.346 24.529 1.00 74.28 C +ATOM 1195 O GLU C 116 24.306 63.929 23.618 1.00 74.40 O +ATOM 1196 CB GLU C 116 25.603 63.951 26.092 1.00 77.23 C +ATOM 1197 CG GLU C 116 26.161 64.620 27.351 1.00 84.60 C +ATOM 1198 CD GLU C 116 27.699 64.681 27.349 1.00 92.64 C +ATOM 1199 OE1 GLU C 116 28.369 63.844 26.685 1.00 93.15 O +ATOM 1200 OE2 GLU C 116 28.261 65.581 28.010 1.00106.56 O +ATOM 1201 N GLY C 117 22.876 62.353 24.287 1.00 76.91 N +ATOM 1202 CA GLY C 117 22.435 61.987 22.925 1.00 77.72 C +ATOM 1203 C GLY C 117 23.251 60.956 22.117 1.00 77.91 C +ATOM 1204 O GLY C 117 22.802 60.519 21.055 1.00 85.36 O +ATOM 1205 N HIS C 118 24.430 60.554 22.591 1.00 74.47 N +ATOM 1206 CA HIS C 118 25.209 59.505 21.916 1.00 68.94 C +ATOM 1207 C HIS C 118 24.530 58.113 21.951 1.00 65.03 C +ATOM 1208 O HIS C 118 23.587 57.864 22.734 1.00 62.07 O +ATOM 1209 CB HIS C 118 26.599 59.402 22.528 1.00 75.25 C +ATOM 1210 CG HIS C 118 27.367 60.690 22.509 1.00 88.16 C +ATOM 1211 ND1 HIS C 118 28.503 60.891 23.267 1.00100.07 N +ATOM 1212 CD2 HIS C 118 27.150 61.849 21.842 1.00 91.70 C +ATOM 1213 CE1 HIS C 118 28.961 62.112 23.060 1.00 97.20 C +ATOM 1214 NE2 HIS C 118 28.154 62.716 22.202 1.00102.82 N +ATOM 1215 N SER C 119 25.007 57.217 21.081 1.00 53.94 N +ATOM 1216 CA SER C 119 24.573 55.822 21.073 1.00 48.50 C +ATOM 1217 C SER C 119 25.254 55.141 22.211 1.00 41.47 C +ATOM 1218 O SER C 119 26.343 55.561 22.649 1.00 49.76 O +ATOM 1219 CB SER C 119 25.023 55.133 19.776 1.00 51.25 C +ATOM 1220 OG SER C 119 26.463 54.999 19.750 1.00 54.83 O +ATOM 1221 N LEU C 120 24.685 54.035 22.665 1.00 47.62 N +ATOM 1222 CA LEU C 120 25.362 53.203 23.686 1.00 47.11 C +ATOM 1223 C LEU C 120 26.738 52.780 23.238 1.00 44.46 C +ATOM 1224 O LEU C 120 27.717 52.816 24.012 1.00 48.61 O +ATOM 1225 CB LEU C 120 24.536 51.965 24.001 1.00 49.78 C +ATOM 1226 CG LEU C 120 25.121 51.131 25.137 1.00 49.94 C +ATOM 1227 CD1 LEU C 120 25.242 51.983 26.398 1.00 50.86 C +ATOM 1228 CD2 LEU C 120 24.246 49.906 25.371 1.00 45.34 C +ATOM 1229 N ALA C 121 26.796 52.376 21.972 1.00 47.49 N +ATOM 1230 CA ALA C 121 28.038 51.978 21.309 1.00 48.70 C +ATOM 1231 C ALA C 121 29.072 53.097 21.324 1.00 45.30 C +ATOM 1232 O ALA C 121 30.196 52.877 21.709 1.00 46.46 O +ATOM 1233 CB ALA C 121 27.745 51.561 19.881 1.00 46.54 C +ATOM 1234 N GLU C 122 28.696 54.313 20.953 1.00 55.53 N +ATOM 1235 CA GLU C 122 29.676 55.407 21.065 1.00 61.70 C +ATOM 1236 C GLU C 122 30.032 55.690 22.525 1.00 60.26 C +ATOM 1237 O GLU C 122 31.217 55.855 22.867 1.00 60.05 O +ATOM 1238 CB GLU C 122 29.219 56.683 20.372 1.00 68.56 C +ATOM 1239 CG GLU C 122 30.293 57.768 20.499 1.00 77.67 C +ATOM 1240 CD GLU C 122 30.138 58.951 19.561 1.00 85.40 C +ATOM 1241 OE1 GLU C 122 29.331 58.872 18.608 1.00 85.50 O +ATOM 1242 OE2 GLU C 122 30.853 59.964 19.792 1.00 83.28 O +ATOM 1243 N ALA C 123 29.012 55.723 23.389 1.00 56.90 N +ATOM 1244 CA ALA C 123 29.250 55.957 24.806 1.00 49.21 C +ATOM 1245 C ALA C 123 30.283 54.992 25.352 1.00 45.54 C +ATOM 1246 O ALA C 123 31.256 55.405 26.004 1.00 56.25 O +ATOM 1247 CB ALA C 123 27.932 55.838 25.579 1.00 52.30 C +ATOM 1248 N MET C 124 30.068 53.691 25.117 1.00 48.78 N +ATOM 1249 CA MET C 124 31.004 52.635 25.600 1.00 50.50 C +ATOM 1250 C MET C 124 32.331 52.829 24.931 1.00 47.17 C +ATOM 1251 O MET C 124 33.357 52.639 25.544 1.00 48.06 O +ATOM 1252 CB MET C 124 30.529 51.214 25.279 1.00 48.09 C +ATOM 1253 CG MET C 124 29.469 50.691 26.223 1.00 55.29 C +ATOM 1254 SD MET C 124 28.431 49.350 25.573 1.00 49.80 S +ATOM 1255 CE MET C 124 27.814 48.708 27.123 1.00 53.76 C +ATOM 1256 N GLY C 125 32.282 53.190 23.663 1.00 51.77 N +ATOM 1257 CA GLY C 125 33.486 53.443 22.893 1.00 62.84 C +ATOM 1258 C GLY C 125 34.503 54.388 23.514 1.00 61.31 C +ATOM 1259 O GLY C 125 35.678 54.286 23.199 1.00 61.28 O +ATOM 1260 N ASN C 126 34.067 55.296 24.395 1.00 60.88 N +ATOM 1261 CA ASN C 126 35.006 56.200 25.100 1.00 57.46 C +ATOM 1262 C ASN C 126 35.792 55.501 26.152 1.00 56.81 C +ATOM 1263 O ASN C 126 36.682 56.113 26.715 1.00 62.04 O +ATOM 1264 CB ASN C 126 34.300 57.399 25.766 1.00 61.58 C +ATOM 1265 CG ASN C 126 33.606 58.290 24.766 1.00 64.59 C +ATOM 1266 OD1 ASN C 126 32.489 58.026 24.362 1.00 69.90 O +ATOM 1267 ND2 ASN C 126 34.274 59.345 24.359 1.00 71.24 N +ATOM 1268 N PHE C 127 35.487 54.235 26.455 1.00 54.27 N +ATOM 1269 CA PHE C 127 36.208 53.529 27.496 1.00 52.08 C +ATOM 1270 C PHE C 127 36.778 52.234 26.938 1.00 60.69 C +ATOM 1271 O PHE C 127 36.415 51.141 27.400 1.00 56.36 O +ATOM 1272 CB PHE C 127 35.297 53.335 28.730 1.00 56.80 C +ATOM 1273 CG PHE C 127 34.591 54.600 29.136 1.00 54.33 C +ATOM 1274 CD1 PHE C 127 35.240 55.548 29.933 1.00 58.52 C +ATOM 1275 CD2 PHE C 127 33.333 54.895 28.633 1.00 56.76 C +ATOM 1276 CE1 PHE C 127 34.623 56.738 30.267 1.00 55.67 C +ATOM 1277 CE2 PHE C 127 32.697 56.084 28.970 1.00 59.99 C +ATOM 1278 CZ PHE C 127 33.349 57.009 29.779 1.00 59.50 C +ATOM 1279 N PRO C 128 37.719 52.349 25.952 1.00 65.12 N +ATOM 1280 CA PRO C 128 38.269 51.156 25.293 1.00 59.89 C +ATOM 1281 C PRO C 128 39.058 50.283 26.227 1.00 54.73 C +ATOM 1282 O PRO C 128 39.252 49.117 25.927 1.00 64.68 O +ATOM 1283 CB PRO C 128 39.155 51.730 24.173 1.00 62.00 C +ATOM 1284 CG PRO C 128 39.496 53.105 24.614 1.00 63.78 C +ATOM 1285 CD PRO C 128 38.304 53.584 25.388 1.00 65.87 C +ATOM 1286 N GLY C 129 39.460 50.810 27.374 1.00 59.10 N +ATOM 1287 CA GLY C 129 39.981 49.978 28.458 1.00 57.35 C +ATOM 1288 C GLY C 129 38.978 49.018 29.098 1.00 58.26 C +ATOM 1289 O GLY C 129 39.388 48.120 29.855 1.00 59.76 O +ATOM 1290 N SER C 130 37.680 49.194 28.827 1.00 51.75 N +ATOM 1291 CA SER C 130 36.631 48.301 29.385 1.00 53.45 C +ATOM 1292 C SER C 130 35.775 47.586 28.353 1.00 47.97 C +ATOM 1293 O SER C 130 35.450 46.424 28.529 1.00 54.95 O +ATOM 1294 CB SER C 130 35.720 49.132 30.280 1.00 52.90 C +ATOM 1295 OG SER C 130 36.423 49.530 31.419 1.00 53.15 O +ATOM 1296 N PHE C 131 35.385 48.325 27.323 1.00 44.81 N +ATOM 1297 CA PHE C 131 34.588 47.844 26.234 1.00 50.57 C +ATOM 1298 C PHE C 131 35.424 47.679 24.963 1.00 48.47 C +ATOM 1299 O PHE C 131 35.688 48.642 24.270 1.00 52.95 O +ATOM 1300 CB PHE C 131 33.413 48.805 25.994 1.00 44.74 C +ATOM 1301 CG PHE C 131 32.585 49.012 27.210 1.00 46.17 C +ATOM 1302 CD1 PHE C 131 31.772 48.015 27.667 1.00 42.96 C +ATOM 1303 CD2 PHE C 131 32.663 50.204 27.918 1.00 51.34 C +ATOM 1304 CE1 PHE C 131 31.022 48.180 28.812 1.00 54.40 C +ATOM 1305 CE2 PHE C 131 31.901 50.398 29.043 1.00 53.47 C +ATOM 1306 CZ PHE C 131 31.075 49.394 29.499 1.00 51.13 C +ATOM 1307 N GLU C 132 35.855 46.451 24.698 1.00 53.95 N +ATOM 1308 CA GLU C 132 36.661 46.149 23.516 1.00 53.25 C +ATOM 1309 C GLU C 132 35.909 46.483 22.234 1.00 51.18 C +ATOM 1310 O GLU C 132 34.678 46.715 22.232 1.00 48.72 O +ATOM 1311 CB GLU C 132 37.166 44.706 23.526 1.00 58.27 C +ATOM 1312 CG GLU C 132 36.090 43.627 23.520 1.00 57.66 C +ATOM 1313 CD GLU C 132 36.617 42.223 23.280 1.00 60.40 C +ATOM 1314 OE1 GLU C 132 37.322 42.035 22.270 1.00 60.55 O +ATOM 1315 OE2 GLU C 132 36.303 41.304 24.073 1.00 69.20 O +ATOM 1316 N ARG C 133 36.658 46.576 21.139 1.00 48.72 N +ATOM 1317 CA ARG C 133 36.098 47.028 19.874 1.00 49.35 C +ATOM 1318 C ARG C 133 34.974 46.111 19.391 1.00 38.86 C +ATOM 1319 O ARG C 133 33.984 46.533 18.764 1.00 47.13 O +ATOM 1320 CB ARG C 133 37.207 47.130 18.809 1.00 59.41 C +ATOM 1321 CG ARG C 133 36.794 47.942 17.578 1.00 71.37 C +ATOM 1322 CD ARG C 133 37.485 47.473 16.287 1.00 80.67 C +ATOM 1323 NE ARG C 133 36.793 47.986 15.096 1.00 78.17 N +ATOM 1324 CZ ARG C 133 35.726 47.434 14.508 1.00 74.18 C +ATOM 1325 NH1 ARG C 133 35.177 46.294 14.942 1.00 83.37 N +ATOM 1326 NH2 ARG C 133 35.203 48.021 13.443 1.00 69.08 N +ATOM 1327 N LEU C 134 35.135 44.835 19.628 1.00 41.55 N +ATOM 1328 CA LEU C 134 34.120 43.874 19.198 1.00 48.05 C +ATOM 1329 C LEU C 134 32.800 44.050 19.973 1.00 42.52 C +ATOM 1330 O LEU C 134 31.718 43.832 19.446 1.00 42.07 O +ATOM 1331 CB LEU C 134 34.653 42.453 19.417 1.00 52.63 C +ATOM 1332 CG LEU C 134 33.749 41.309 18.948 1.00 62.09 C +ATOM 1333 CD1 LEU C 134 33.228 41.539 17.515 1.00 67.69 C +ATOM 1334 CD2 LEU C 134 34.509 39.997 19.079 1.00 63.03 C +ATOM 1335 N TYR C 135 32.925 44.374 21.251 1.00 47.49 N +ATOM 1336 CA TYR C 135 31.774 44.546 22.145 1.00 40.73 C +ATOM 1337 C TYR C 135 30.948 45.733 21.609 1.00 37.38 C +ATOM 1338 O TYR C 135 29.712 45.610 21.343 1.00 36.51 O +ATOM 1339 CB TYR C 135 32.329 44.713 23.568 1.00 42.30 C +ATOM 1340 CG TYR C 135 31.299 44.715 24.731 1.00 46.50 C +ATOM 1341 CD1 TYR C 135 30.413 45.787 24.907 1.00 45.86 C +ATOM 1342 CD2 TYR C 135 31.264 43.678 25.668 1.00 38.42 C +ATOM 1343 CE1 TYR C 135 29.492 45.806 25.972 1.00 48.17 C +ATOM 1344 CE2 TYR C 135 30.373 43.704 26.728 1.00 42.92 C +ATOM 1345 CZ TYR C 135 29.472 44.767 26.867 1.00 45.96 C +ATOM 1346 OH TYR C 135 28.602 44.813 27.925 1.00 45.38 O +ATOM 1347 N CYS C 136 31.647 46.837 21.341 1.00 38.57 N +ATOM 1348 CA CYS C 136 31.028 48.053 20.833 1.00 41.30 C +ATOM 1349 C CYS C 136 30.353 47.849 19.504 1.00 47.10 C +ATOM 1350 O CYS C 136 29.161 48.224 19.337 1.00 43.42 O +ATOM 1351 CB CYS C 136 32.048 49.202 20.750 1.00 47.49 C +ATOM 1352 SG CYS C 136 32.729 49.678 22.355 1.00 55.56 S +ATOM 1353 N ALA C 137 31.080 47.189 18.579 1.00 48.55 N +ATOM 1354 CA ALA C 137 30.531 46.906 17.244 1.00 41.26 C +ATOM 1355 C ALA C 137 29.300 46.052 17.347 1.00 38.72 C +ATOM 1356 O ALA C 137 28.286 46.326 16.668 1.00 42.18 O +ATOM 1357 CB ALA C 137 31.587 46.243 16.342 1.00 48.84 C +ATOM 1358 N MET C 138 29.295 45.068 18.245 1.00 37.82 N +ATOM 1359 CA MET C 138 28.047 44.298 18.456 1.00 39.25 C +ATOM 1360 C MET C 138 26.897 45.229 18.947 1.00 37.87 C +ATOM 1361 O MET C 138 25.814 45.229 18.407 1.00 40.77 O +ATOM 1362 CB MET C 138 28.280 43.141 19.436 1.00 48.81 C +ATOM 1363 CG MET C 138 29.130 41.967 18.884 1.00 48.21 C +ATOM 1364 SD MET C 138 28.211 40.966 17.687 1.00 51.50 S +ATOM 1365 CE MET C 138 27.147 40.093 18.825 1.00 53.78 C +ATOM 1366 N VAL C 139 27.163 46.032 19.956 1.00 42.66 N +ATOM 1367 CA VAL C 139 26.150 46.993 20.482 1.00 45.56 C +ATOM 1368 C VAL C 139 25.634 47.955 19.383 1.00 40.38 C +ATOM 1369 O VAL C 139 24.411 48.072 19.155 1.00 37.42 O +ATOM 1370 CB VAL C 139 26.753 47.766 21.700 1.00 46.00 C +ATOM 1371 CG1 VAL C 139 25.870 48.954 22.106 1.00 44.66 C +ATOM 1372 CG2 VAL C 139 26.959 46.788 22.883 1.00 43.07 C +ATOM 1373 N ALA C 140 26.585 48.586 18.683 1.00 44.57 N +ATOM 1374 CA ALA C 140 26.294 49.450 17.509 1.00 44.98 C +ATOM 1375 C ALA C 140 25.344 48.738 16.575 1.00 49.63 C +ATOM 1376 O ALA C 140 24.288 49.257 16.231 1.00 52.47 O +ATOM 1377 CB ALA C 140 27.587 49.838 16.773 1.00 43.20 C +ATOM 1378 N ALA C 141 25.679 47.491 16.232 1.00 54.67 N +ATOM 1379 CA ALA C 141 24.876 46.733 15.285 1.00 52.79 C +ATOM 1380 C ALA C 141 23.480 46.417 15.800 1.00 53.91 C +ATOM 1381 O ALA C 141 22.501 46.479 15.061 1.00 54.63 O +ATOM 1382 CB ALA C 141 25.613 45.451 14.927 1.00 54.89 C +ATOM 1383 N GLY C 142 23.375 46.060 17.079 1.00 53.50 N +ATOM 1384 CA GLY C 142 22.063 45.815 17.679 1.00 43.32 C +ATOM 1385 C GLY C 142 21.220 47.068 17.777 1.00 44.21 C +ATOM 1386 O GLY C 142 19.974 47.011 17.670 1.00 47.57 O +ATOM 1387 N GLU C 143 21.886 48.190 18.043 1.00 47.09 N +ATOM 1388 CA GLU C 143 21.211 49.502 18.024 1.00 55.64 C +ATOM 1389 C GLU C 143 20.686 49.789 16.633 1.00 61.48 C +ATOM 1390 O GLU C 143 19.527 50.142 16.489 1.00 63.50 O +ATOM 1391 CB GLU C 143 22.120 50.656 18.485 1.00 49.68 C +ATOM 1392 CG GLU C 143 22.381 50.673 19.978 1.00 52.76 C +ATOM 1393 CD GLU C 143 23.259 51.844 20.397 1.00 55.34 C +ATOM 1394 OE1 GLU C 143 24.474 51.867 20.084 1.00 52.87 O +ATOM 1395 OE2 GLU C 143 22.726 52.784 21.040 1.00 64.03 O +ATOM 1396 N ALA C 144 21.531 49.624 15.620 1.00 63.89 N +ATOM 1397 CA ALA C 144 21.075 49.760 14.221 1.00 66.23 C +ATOM 1398 C ALA C 144 19.860 48.894 13.898 1.00 60.85 C +ATOM 1399 O ALA C 144 18.938 49.353 13.269 1.00 76.69 O +ATOM 1400 CB ALA C 144 22.195 49.459 13.249 1.00 65.12 C +ATOM 1401 N SER C 145 19.817 47.670 14.365 1.00 62.32 N +ATOM 1402 CA SER C 145 18.778 46.734 13.937 1.00 58.42 C +ATOM 1403 C SER C 145 17.529 46.745 14.808 1.00 63.73 C +ATOM 1404 O SER C 145 16.584 45.975 14.563 1.00 61.12 O +ATOM 1405 CB SER C 145 19.355 45.306 13.904 1.00 65.65 C +ATOM 1406 OG SER C 145 18.932 44.518 15.015 1.00 59.73 O +ATOM 1407 N GLY C 146 17.528 47.567 15.859 1.00 63.01 N +ATOM 1408 CA GLY C 146 16.466 47.504 16.855 1.00 54.43 C +ATOM 1409 C GLY C 146 16.485 46.244 17.692 1.00 51.32 C +ATOM 1410 O GLY C 146 15.437 45.822 18.222 1.00 51.96 O +ATOM 1411 N HIS C 147 17.660 45.639 17.848 1.00 51.58 N +ATOM 1412 CA HIS C 147 17.761 44.426 18.682 1.00 58.17 C +ATOM 1413 C HIS C 147 18.891 44.481 19.716 1.00 53.50 C +ATOM 1414 O HIS C 147 19.546 43.469 19.957 1.00 50.72 O +ATOM 1415 CB HIS C 147 17.928 43.176 17.800 1.00 66.51 C +ATOM 1416 CG HIS C 147 16.739 42.876 16.955 1.00 70.75 C +ATOM 1417 ND1 HIS C 147 16.741 43.033 15.587 1.00 72.92 N +ATOM 1418 CD2 HIS C 147 15.503 42.437 17.286 1.00 72.80 C +ATOM 1419 CE1 HIS C 147 15.556 42.696 15.109 1.00 70.61 C +ATOM 1420 NE2 HIS C 147 14.787 42.336 16.119 1.00 72.11 N +ATOM 1421 N LEU C 148 19.101 45.642 20.339 1.00 50.24 N +ATOM 1422 CA LEU C 148 20.049 45.753 21.448 1.00 47.68 C +ATOM 1423 C LEU C 148 19.782 44.680 22.481 1.00 42.25 C +ATOM 1424 O LEU C 148 20.703 44.059 22.906 1.00 38.10 O +ATOM 1425 CB LEU C 148 20.022 47.116 22.110 1.00 49.31 C +ATOM 1426 CG LEU C 148 21.160 47.400 23.080 1.00 45.59 C +ATOM 1427 CD1 LEU C 148 22.527 47.524 22.422 1.00 46.62 C +ATOM 1428 CD2 LEU C 148 20.849 48.703 23.788 1.00 50.65 C +ATOM 1429 N ASP C 149 18.530 44.391 22.810 1.00 42.68 N +ATOM 1430 CA ASP C 149 18.277 43.359 23.795 1.00 45.45 C +ATOM 1431 C ASP C 149 18.917 42.006 23.429 1.00 48.73 C +ATOM 1432 O ASP C 149 19.619 41.394 24.275 1.00 35.53 O +ATOM 1433 CB ASP C 149 16.794 43.247 24.185 1.00 52.51 C +ATOM 1434 CG ASP C 149 15.877 42.786 23.051 1.00 64.19 C +ATOM 1435 OD1 ASP C 149 16.215 42.919 21.839 1.00 61.79 O +ATOM 1436 OD2 ASP C 149 14.775 42.295 23.421 1.00 66.77 O +ATOM 1437 N ALA C 150 18.742 41.568 22.162 1.00 44.75 N +ATOM 1438 CA ALA C 150 19.310 40.304 21.727 1.00 40.86 C +ATOM 1439 C ALA C 150 20.836 40.348 21.711 1.00 40.29 C +ATOM 1440 O ALA C 150 21.486 39.380 22.081 1.00 39.96 O +ATOM 1441 CB ALA C 150 18.776 39.922 20.342 1.00 48.00 C +ATOM 1442 N VAL C 151 21.398 41.477 21.298 1.00 40.82 N +ATOM 1443 CA VAL C 151 22.864 41.662 21.248 1.00 42.56 C +ATOM 1444 C VAL C 151 23.510 41.635 22.663 1.00 41.02 C +ATOM 1445 O VAL C 151 24.585 41.040 22.898 1.00 36.84 O +ATOM 1446 CB VAL C 151 23.192 42.928 20.432 1.00 41.98 C +ATOM 1447 CG1 VAL C 151 24.502 43.567 20.789 1.00 45.39 C +ATOM 1448 CG2 VAL C 151 23.224 42.585 18.963 1.00 46.25 C +ATOM 1449 N LEU C 152 22.855 42.252 23.621 1.00 33.69 N +ATOM 1450 CA LEU C 152 23.409 42.241 24.979 1.00 35.10 C +ATOM 1451 C LEU C 152 23.350 40.848 25.621 1.00 33.96 C +ATOM 1452 O LEU C 152 24.246 40.511 26.367 1.00 31.62 O +ATOM 1453 CB LEU C 152 22.667 43.231 25.845 1.00 35.00 C +ATOM 1454 CG LEU C 152 22.937 44.684 25.529 1.00 34.68 C +ATOM 1455 CD1 LEU C 152 21.914 45.550 26.328 1.00 37.81 C +ATOM 1456 CD2 LEU C 152 24.396 45.069 25.828 1.00 32.75 C +ATOM 1457 N ASN C 153 22.283 40.083 25.364 1.00 32.29 N +ATOM 1458 CA ASN C 153 22.206 38.682 25.800 1.00 36.14 C +ATOM 1459 C ASN C 153 23.375 37.871 25.233 1.00 39.97 C +ATOM 1460 O ASN C 153 24.061 37.120 25.987 1.00 37.01 O +ATOM 1461 CB ASN C 153 20.852 38.034 25.482 1.00 40.12 C +ATOM 1462 CG ASN C 153 20.641 36.692 26.226 1.00 61.02 C +ATOM 1463 OD1 ASN C 153 21.490 36.205 27.025 1.00 57.27 O +ATOM 1464 ND2 ASN C 153 19.501 36.068 25.948 1.00 71.12 N +ATOM 1465 N ARG C 154 23.687 38.079 23.955 1.00 37.70 N +ATOM 1466 CA ARG C 154 24.813 37.357 23.338 1.00 43.39 C +ATOM 1467 C ARG C 154 26.114 37.790 23.981 1.00 40.94 C +ATOM 1468 O ARG C 154 26.955 36.945 24.319 1.00 35.17 O +ATOM 1469 CB ARG C 154 24.844 37.554 21.802 1.00 51.01 C +ATOM 1470 CG ARG C 154 26.115 37.109 21.063 1.00 66.55 C +ATOM 1471 CD ARG C 154 26.198 35.593 20.806 1.00 78.50 C +ATOM 1472 NE ARG C 154 27.597 35.137 20.602 1.00 86.29 N +ATOM 1473 CZ ARG C 154 28.373 34.513 21.504 1.00 88.19 C +ATOM 1474 NH1 ARG C 154 27.915 34.213 22.725 1.00 81.01 N +ATOM 1475 NH2 ARG C 154 29.628 34.160 21.183 1.00 84.39 N +ATOM 1476 N LEU C 155 26.279 39.094 24.201 1.00 37.55 N +ATOM 1477 CA LEU C 155 27.507 39.596 24.853 1.00 34.03 C +ATOM 1478 C LEU C 155 27.597 39.144 26.307 1.00 33.42 C +ATOM 1479 O LEU C 155 28.710 38.985 26.902 1.00 33.40 O +ATOM 1480 CB LEU C 155 27.579 41.128 24.786 1.00 34.06 C +ATOM 1481 CG LEU C 155 27.893 41.756 23.411 1.00 38.37 C +ATOM 1482 CD1 LEU C 155 27.776 43.291 23.475 1.00 36.58 C +ATOM 1483 CD2 LEU C 155 29.277 41.365 22.930 1.00 38.46 C +ATOM 1484 N ALA C 156 26.439 38.972 26.898 1.00 33.86 N +ATOM 1485 CA ALA C 156 26.376 38.473 28.289 1.00 36.25 C +ATOM 1486 C ALA C 156 26.832 37.020 28.351 1.00 42.15 C +ATOM 1487 O ALA C 156 27.653 36.699 29.201 1.00 34.54 O +ATOM 1488 CB ALA C 156 24.997 38.639 28.843 1.00 33.31 C +ATOM 1489 N ASP C 157 26.343 36.164 27.435 1.00 41.18 N +ATOM 1490 CA ASP C 157 27.006 34.840 27.230 1.00 44.56 C +ATOM 1491 C ASP C 157 28.535 34.904 26.923 1.00 43.49 C +ATOM 1492 O ASP C 157 29.345 34.320 27.625 1.00 46.19 O +ATOM 1493 CB ASP C 157 26.289 34.033 26.165 1.00 45.39 C +ATOM 1494 CG ASP C 157 24.888 33.595 26.606 1.00 52.65 C +ATOM 1495 OD1 ASP C 157 24.460 33.888 27.731 1.00 55.58 O +ATOM 1496 OD2 ASP C 157 24.182 32.950 25.820 1.00 62.47 O +ATOM 1497 N TYR C 158 28.949 35.648 25.914 1.00 38.54 N +ATOM 1498 CA TYR C 158 30.369 35.810 25.670 1.00 41.95 C +ATOM 1499 C TYR C 158 31.212 36.181 26.897 1.00 46.40 C +ATOM 1500 O TYR C 158 32.214 35.505 27.217 1.00 40.29 O +ATOM 1501 CB TYR C 158 30.575 36.806 24.547 1.00 40.00 C +ATOM 1502 CG TYR C 158 31.961 37.208 24.323 1.00 45.74 C +ATOM 1503 CD1 TYR C 158 32.904 36.295 23.855 1.00 46.55 C +ATOM 1504 CD2 TYR C 158 32.354 38.527 24.531 1.00 46.13 C +ATOM 1505 CE1 TYR C 158 34.204 36.689 23.642 1.00 44.13 C +ATOM 1506 CE2 TYR C 158 33.637 38.937 24.290 1.00 50.92 C +ATOM 1507 CZ TYR C 158 34.563 38.019 23.838 1.00 54.97 C +ATOM 1508 OH TYR C 158 35.851 38.469 23.613 1.00 60.70 O +ATOM 1509 N THR C 159 30.837 37.268 27.560 1.00 39.69 N +ATOM 1510 CA THR C 159 31.597 37.743 28.724 1.00 38.02 C +ATOM 1511 C THR C 159 31.556 36.710 29.877 1.00 38.96 C +ATOM 1512 O THR C 159 32.490 36.648 30.623 1.00 39.31 O +ATOM 1513 CB THR C 159 31.128 39.161 29.181 1.00 37.31 C +ATOM 1514 OG1 THR C 159 29.713 39.175 29.399 1.00 34.43 O +ATOM 1515 CG2 THR C 159 31.453 40.153 28.139 1.00 33.89 C +ATOM 1516 N GLU C 160 30.490 35.920 30.017 1.00 37.13 N +ATOM 1517 CA GLU C 160 30.470 34.889 31.052 1.00 48.77 C +ATOM 1518 C GLU C 160 31.421 33.723 30.736 1.00 52.90 C +ATOM 1519 O GLU C 160 31.997 33.104 31.664 1.00 46.49 O +ATOM 1520 CB GLU C 160 29.075 34.294 31.256 1.00 52.67 C +ATOM 1521 CG GLU C 160 28.322 34.906 32.430 1.00 67.41 C +ATOM 1522 CD GLU C 160 26.811 34.655 32.381 1.00 69.41 C +ATOM 1523 OE1 GLU C 160 26.022 35.474 32.940 1.00 60.48 O +ATOM 1524 OE2 GLU C 160 26.437 33.604 31.805 1.00 73.44 O +ATOM 1525 N GLN C 161 31.512 33.404 29.440 1.00 51.66 N +ATOM 1526 CA GLN C 161 32.368 32.328 28.941 1.00 50.85 C +ATOM 1527 C GLN C 161 33.797 32.704 29.245 1.00 43.36 C +ATOM 1528 O GLN C 161 34.489 31.961 29.904 1.00 42.79 O +ATOM 1529 CB GLN C 161 32.134 32.074 27.442 1.00 59.29 C +ATOM 1530 CG GLN C 161 31.091 31.007 27.100 1.00 68.05 C +ATOM 1531 CD GLN C 161 29.813 31.041 27.965 1.00 81.34 C +ATOM 1532 OE1 GLN C 161 28.793 31.648 27.598 1.00 93.90 O +ATOM 1533 NE2 GLN C 161 29.860 30.363 29.111 1.00 95.89 N +ATOM 1534 N ARG C 162 34.178 33.912 28.869 1.00 45.35 N +ATOM 1535 CA ARG C 162 35.488 34.471 29.160 1.00 46.11 C +ATOM 1536 C ARG C 162 35.830 34.482 30.616 1.00 57.70 C +ATOM 1537 O ARG C 162 36.894 34.061 31.020 1.00 61.39 O +ATOM 1538 CB ARG C 162 35.581 35.908 28.633 1.00 47.85 C +ATOM 1539 CG ARG C 162 36.750 36.066 27.723 1.00 51.24 C +ATOM 1540 CD ARG C 162 36.841 37.385 26.997 1.00 51.65 C +ATOM 1541 NE ARG C 162 38.256 37.693 26.744 1.00 58.76 N +ATOM 1542 CZ ARG C 162 39.127 38.081 27.686 1.00 67.22 C +ATOM 1543 NH1 ARG C 162 38.753 38.243 28.962 1.00 76.81 N +ATOM 1544 NH2 ARG C 162 40.382 38.326 27.363 1.00 65.92 N +ATOM 1545 N GLN C 163 34.925 35.017 31.417 1.00 59.25 N +ATOM 1546 CA GLN C 163 35.116 35.054 32.873 1.00 58.28 C +ATOM 1547 C GLN C 163 35.371 33.667 33.468 1.00 48.39 C +ATOM 1548 O GLN C 163 36.242 33.517 34.281 1.00 49.45 O +ATOM 1549 CB GLN C 163 33.883 35.702 33.564 1.00 53.79 C +ATOM 1550 CG GLN C 163 34.103 35.984 35.046 1.00 65.41 C +ATOM 1551 CD GLN C 163 33.568 34.928 35.966 1.00 69.50 C +ATOM 1552 OE1 GLN C 163 32.995 33.921 35.532 1.00 81.08 O +ATOM 1553 NE2 GLN C 163 33.716 35.169 37.273 1.00 89.51 N +ATOM 1554 N GLN C 164 34.593 32.668 33.082 1.00 48.25 N +ATOM 1555 CA GLN C 164 34.766 31.356 33.668 1.00 57.01 C +ATOM 1556 C GLN C 164 36.042 30.584 33.146 1.00 55.87 C +ATOM 1557 O GLN C 164 36.421 29.553 33.694 1.00 54.30 O +ATOM 1558 CB GLN C 164 33.458 30.551 33.565 1.00 57.78 C +ATOM 1559 CG GLN C 164 33.173 29.923 32.228 1.00 69.36 C +ATOM 1560 CD GLN C 164 32.397 28.616 32.334 1.00 81.81 C +ATOM 1561 OE1 GLN C 164 32.599 27.829 33.261 1.00 80.95 O +ATOM 1562 NE2 GLN C 164 31.528 28.361 31.348 1.00 94.70 N +ATOM 1563 N MET C 165 36.669 31.077 32.087 1.00 54.65 N +ATOM 1564 CA MET C 165 38.016 30.635 31.710 1.00 58.97 C +ATOM 1565 C MET C 165 39.039 31.225 32.673 1.00 58.33 C +ATOM 1566 O MET C 165 39.806 30.476 33.250 1.00 57.94 O +ATOM 1567 CB MET C 165 38.383 31.017 30.265 1.00 51.73 C +ATOM 1568 CG MET C 165 37.571 30.249 29.225 1.00 55.61 C +ATOM 1569 SD MET C 165 38.264 30.278 27.543 1.00 56.60 S +ATOM 1570 CE MET C 165 38.227 31.982 27.083 1.00 54.59 C +ATOM 1571 N ARG C 166 39.044 32.544 32.859 1.00 61.90 N +ATOM 1572 CA ARG C 166 39.991 33.193 33.813 1.00 65.70 C +ATOM 1573 C ARG C 166 39.800 32.734 35.248 1.00 64.28 C +ATOM 1574 O ARG C 166 40.638 33.016 36.082 1.00 62.97 O +ATOM 1575 CB ARG C 166 39.882 34.714 33.786 1.00 67.86 C +ATOM 1576 CG ARG C 166 41.131 35.395 34.303 1.00 73.87 C +ATOM 1577 CD ARG C 166 41.184 36.866 33.898 1.00 84.20 C +ATOM 1578 NE ARG C 166 41.340 37.114 32.450 1.00 84.39 N +ATOM 1579 CZ ARG C 166 41.473 38.327 31.891 1.00 74.73 C +ATOM 1580 NH1 ARG C 166 41.479 39.419 32.631 1.00 83.72 N +ATOM 1581 NH2 ARG C 166 41.629 38.459 30.587 1.00 69.63 N +ATOM 1582 N SER C 167 38.677 32.060 35.503 1.00 65.76 N +ATOM 1583 CA SER C 167 38.351 31.407 36.752 1.00 69.33 C +ATOM 1584 C SER C 167 38.870 29.977 36.813 1.00 72.90 C +ATOM 1585 O SER C 167 39.340 29.582 37.874 1.00 71.57 O +ATOM 1586 CB SER C 167 36.821 31.431 36.992 1.00 78.01 C +ATOM 1587 OG SER C 167 36.318 30.168 37.416 1.00 82.49 O +ATOM 1588 N ARG C 168 38.773 29.195 35.724 1.00 75.92 N +ATOM 1589 CA ARG C 168 39.435 27.859 35.687 1.00 81.77 C +ATOM 1590 C ARG C 168 40.933 27.989 35.975 1.00 82.65 C +ATOM 1591 O ARG C 168 41.485 27.202 36.739 1.00 79.21 O +ATOM 1592 CB ARG C 168 39.197 27.062 34.394 1.00 85.28 C +ATOM 1593 CG ARG C 168 38.460 25.743 34.636 1.00 97.43 C +ATOM 1594 CD ARG C 168 37.852 25.126 33.377 1.00108.71 C +ATOM 1595 NE ARG C 168 36.560 25.745 33.013 1.00115.17 N +ATOM 1596 CZ ARG C 168 36.186 26.179 31.793 1.00118.68 C +ATOM 1597 NH1 ARG C 168 34.986 26.732 31.647 1.00118.88 N +ATOM 1598 NH2 ARG C 168 36.963 26.067 30.711 1.00110.02 N +ATOM 1599 N ILE C 169 41.561 29.028 35.429 1.00 81.63 N +ATOM 1600 CA ILE C 169 42.986 29.273 35.666 1.00 76.60 C +ATOM 1601 C ILE C 169 43.250 29.850 37.053 1.00 83.32 C +ATOM 1602 O ILE C 169 44.206 29.443 37.697 1.00 84.05 O +ATOM 1603 CB ILE C 169 43.651 30.109 34.534 1.00 66.39 C +ATOM 1604 CG1 ILE C 169 43.515 31.652 34.706 1.00 68.82 C +ATOM 1605 CG2 ILE C 169 43.174 29.621 33.163 1.00 61.08 C +ATOM 1606 CD1 ILE C 169 44.724 32.386 35.296 1.00 60.33 C +ATOM 1607 N GLN C 170 42.381 30.755 37.513 1.00 92.32 N +ATOM 1608 CA GLN C 170 42.575 31.524 38.756 1.00 95.42 C +ATOM 1609 C GLN C 170 42.865 30.641 39.988 1.00105.80 C +ATOM 1610 O GLN C 170 43.557 31.084 40.906 1.00121.34 O +ATOM 1611 CB GLN C 170 41.356 32.431 39.031 1.00 98.30 C +ATOM 1612 CG GLN C 170 41.641 33.724 39.787 1.00104.36 C +ATOM 1613 CD GLN C 170 41.594 33.563 41.309 1.00109.71 C +ATOM 1614 OE1 GLN C 170 40.552 33.245 41.886 1.00115.36 O +ATOM 1615 NE2 GLN C 170 42.726 33.796 41.965 1.00105.18 N +ATOM 1616 N GLN C 171 42.330 29.416 40.014 1.00108.19 N +ATOM 1617 CA GLN C 171 42.714 28.406 41.008 1.00101.31 C +ATOM 1618 C GLN C 171 43.169 27.164 40.271 1.00 88.79 C +ATOM 1619 O GLN C 171 43.469 26.157 40.892 1.00 90.06 O +ATOM 1620 CB GLN C 171 41.552 28.061 41.947 1.00105.22 C +ATOM 1621 CG GLN C 171 40.910 29.243 42.686 1.00110.36 C +ATOM 1622 CD GLN C 171 39.472 29.542 42.248 1.00119.41 C +ATOM 1623 OE1 GLN C 171 38.626 28.648 42.183 1.00124.15 O +ATOM 1624 NE2 GLN C 171 39.189 30.807 41.966 1.00117.78 N diff --git a/test/test_features_with_templates.py b/test/test_features_with_templates.py index 262783cb..06e59f29 100644 --- a/test/test_features_with_templates.py +++ b/test/test_features_with_templates.py @@ -20,7 +20,8 @@ def tearDown(self): # Clean up any files or directories created during testing sto_files = list((self.TEST_DATA_DIR / 'features').glob('*/pdb_hits.sto')) for sto_file in sto_files: - sto_file.unlink() + if sto_file.exists(): + sto_file.unlink() desc_file = self.TEST_DATA_DIR / 'description.csv' if desc_file.exists(): desc_file.unlink() @@ -59,7 +60,7 @@ def run_features_generation(self, file_name, chain_id, file_extension): '--description_file', f"{self.TEST_DATA_DIR}/description.csv", '--output_dir', f"{self.TEST_DATA_DIR}/features", ] - + print(" ".join(cmd)) # Check the output subprocess.run(cmd, check=True) assert pkl_path.exists() @@ -122,6 +123,8 @@ def test_3b_bizarre_filename(self): def test_4c_bizarre_filename(self): self.run_features_generation('RANdom_name1_.7-1_0', 'C', 'pdb') + def test_4c_gappy_pdb(self): + self.run_features_generation('GAPPY_PDB', 'B', 'pdb') if __name__ == '__main__': absltest.main()