2 124 (N_temp, Lch) 123 181.660 1 2criA ATOM 1001 CA SER 1 17.862 4.730 -9.862 9 ALA ATOM 1002 CA VAL 2 17.812 1.259 -8.309 10 LYS ATOM 1003 CA PRO 3 14.330 -0.232 -7.946 11 HIS ATOM 1004 CA PRO 4 13.157 -3.830 -8.336 12 GLU ATOM 1005 CA GLY 5 9.446 -3.880 -9.172 13 GLN ATOM 1006 CA ASP 6 7.310 -6.463 -10.969 14 ILE ATOM 1007 CA ILE 7 3.944 -4.692 -11.005 15 LEU ATOM 1008 CA ASN 8 3.658 -1.741 -13.389 16 VAL ATOM 1009 CA THR 9 1.754 1.017 -11.591 17 LEU ATOM 1010 CA GLN 10 -0.517 3.283 -13.635 18 ASP ATOM 1011 CA PRO 11 0.025 6.036 -13.778 19 PRO ATOM 1012 CA GLY 12 3.617 4.860 -13.182 20 PRO ATOM 1013 CA SER 13 4.880 8.439 -12.923 21 SER ATOM 1014 CA LYS 14 2.376 10.268 -10.721 22 ASP ATOM 1015 CA ILE 15 -1.265 9.780 -9.733 23 LEU ATOM 1016 CA VAL 16 -3.313 12.878 -10.552 24 LYS ATOM 1017 CA PHE 17 -6.314 13.824 -8.413 25 PHE ATOM 1018 CA ASN 18 -9.423 15.489 -9.839 26 LYS ATOM 1019 CA ALA 19 -10.852 18.012 -7.395 27 GLY ATOM 1020 CA PRO 20 -12.500 19.811 -6.004 28 PRO ATOM 1021 CA TYR 21 -10.750 19.610 -2.633 29 PHE ATOM 1022 CA ASP 22 -13.635 21.002 -0.583 30 THR ATOM 1023 CA ASP 23 -15.527 17.774 -1.263 31 ASP ATOM 1024 CA LYS 24 -15.057 14.007 -1.503 32 VAL ATOM 1025 CA HIS 25 -12.570 13.135 -4.245 33 VAL ATOM 1026 CA THR 26 -12.371 10.043 -6.449 34 THR ATOM 1027 CA TYR 27 -9.151 8.807 -8.050 35 THR ATOM 1028 CA HIS 28 -8.783 5.436 -9.772 36 ASN ATOM 1029 CA ILE 29 -5.359 3.782 -9.659 37 LEU ATOM 1030 CA LYS 30 -4.605 1.306 -12.447 38 LYS ATOM 1031 CA ILE 31 -2.205 -1.524 -11.609 39 LEU ATOM 1032 CA THR 32 -0.817 -3.536 -14.524 40 GLN ATOM 1033 CA ASN 33 0.802 -6.935 -13.981 41 ASN ATOM 1034 CA ALA 34 3.360 -7.936 -16.646 42 PRO ATOM 1035 CA GLY 35 4.272 -11.094 -14.733 43 SER ATOM 1036 CA GLY 36 2.475 -14.389 -15.350 44 ASP ATOM 1037 CA ARG 37 1.934 -15.225 -11.679 45 ARG ATOM 1038 CA ARG 38 -0.320 -13.956 -8.889 46 LYS ATOM 1039 CA ILE 39 1.039 -10.983 -6.942 47 VAL ATOM 1040 CA GLY 40 -0.022 -9.346 -3.678 48 CYS ATOM 1041 CA TRP 41 -0.057 -5.563 -3.279 49 PHE ATOM 1042 CA ALA 42 -0.261 -3.510 -0.083 50 LYS ATOM 1043 CA ILE 43 -1.505 0.065 -0.457 51 VAL ATOM 1044 CA LYS 44 0.181 2.323 2.097 52 LYS ATOM 1045 CA THR 45 0.287 6.123 2.221 53 THR ATOM 1046 CA THR 46 1.621 8.795 4.575 54 THR ATOM 1047 CA ASN 47 -1.915 10.130 4.993 55 ALA ATOM 1048 CA MET 48 -4.086 7.077 5.772 56 PRO ATOM 1049 CA ARG 49 -6.454 9.418 7.608 57 ARG ATOM 1050 CA ARG 50 -7.251 11.579 4.581 58 ARG ATOM 1051 CA LEU 51 -7.221 8.685 2.113 59 TYR ATOM 1052 CA GLY 52 -9.716 5.874 1.527 60 CYS ATOM 1053 CA VAL 53 -8.346 3.114 -0.703 61 VAL ATOM 1054 CA ASP 54 -10.586 0.187 -1.638 62 ARG ATOM 1055 CA PRO 55 -9.731 -2.464 -2.006 63 PRO ATOM 1056 CA PRO 56 -6.899 -1.617 0.388 64 ASN ATOM 1057 CA SER 57 -5.184 -4.826 -0.721 65 SER ATOM 1058 CA GLY 58 -5.479 -7.971 -2.819 66 GLY ATOM 1059 CA VAL 59 -3.920 -9.984 -5.634 67 ILE ATOM 1060 CA LEU 60 -3.694 -8.865 -9.261 68 ILE ATOM 1061 CA ASP 61 -4.191 -11.763 -11.673 69 ASP ATOM 1062 CA PRO 62 -1.279 -12.423 -14.068 70 PRO ATOM 1063 CA SER 63 -1.528 -10.331 -17.220 71 GLY ATOM 1064 CA GLU 64 -4.395 -8.153 -16.017 72 SER ATOM 1065 CA LYS 65 -5.109 -4.644 -14.736 73 ILE ATOM 1066 CA VAL 66 -6.882 -3.657 -11.519 74 VAL ATOM 1067 CA LEU 67 -8.701 -0.390 -10.829 75 THR ATOM 1068 CA MET 68 -8.360 0.688 -7.198 76 VAL ATOM 1069 CA ALA 69 -10.648 3.386 -5.801 77 SER ATOM 1070 CA VAL 70 -8.701 6.034 -3.887 78 VAL ATOM 1071 CA SER 71 -11.136 8.514 -2.342 79 MET ATOM 1072 CA CYS 72 -9.588 11.668 -0.884 80 LEU ATOM 1073 CA ASP 73 -11.366 13.184 2.118 81 GLN ATOM 1074 CA THR 74 -12.321 16.875 1.789 82 PRO ATOM 1075 CA PHE 75 -9.801 19.104 3.564 83 PHE ATOM 1076 CA ASN 76 -8.510 22.681 3.484 84 ASP ATOM 1077 CA ALA 77 -6.128 22.519 0.523 85 TYR ATOM 1078 CA ALA 78 -3.458 25.206 0.190 86 ASP ATOM 1079 CA THR 79 -2.123 26.589 -3.120 87 PRO ATOM 1080 CA GLU 80 1.339 26.948 -1.584 88 ASN ATOM 1081 CA ASP 81 1.478 23.412 -0.189 89 GLU ATOM 1082 CA LEU 82 4.842 21.660 0.106 90 LYS ATOM 1083 CA ASN 83 5.797 18.391 -1.588 91 SER ATOM 1084 CA ASN 84 5.600 16.320 1.597 92 LYS ATOM 1085 CA ASP 85 2.793 13.787 1.173 93 HIS ATOM 1086 CA ARG 86 3.868 10.581 -0.570 94 LYS ATOM 1087 CA ILE 87 2.346 7.339 -1.852 95 PHE ATOM 1088 CA CYS 88 4.283 4.087 -1.476 96 MET ATOM 1089 CA ILE 89 2.845 0.920 -3.017 97 VAL ATOM 1090 CA GLU 90 4.169 -2.480 -1.946 98 GLN ATOM 1091 CA TRP 91 4.107 -5.515 -4.237 99 THR ATOM 1092 CA THR 92 5.249 -9.120 -3.840 100 ILE ATOM 1093 CA ASN 93 4.614 -12.407 -5.647 101 PHE ATOM 1094 CA THR 94 2.126 -14.823 -4.086 102 ALA ATOM 1095 CA PRO 95 2.905 -18.394 -2.953 103 PRO ATOM 1096 CA ASP 96 1.267 -21.559 -4.348 104 PRO ATOM 1097 CA GLY 97 -0.656 -22.034 -1.101 105 ASN ATOM 1098 CA ALA 98 -1.402 -18.346 -0.550 106 ILE ATOM 1099 CA LYS 100 -4.167 -18.711 2.037 107 SER ATOM 1100 CA GLN 101 -3.575 -16.156 4.791 108 ASP ATOM 1101 CA PHE 102 -2.436 -12.731 3.591 109 MET ATOM 1102 CA ARG 103 -1.725 -11.355 7.065 110 GLU ATOM 1103 CA ARG 104 0.734 -14.243 7.349 111 ALA ATOM 1104 CA GLU 105 2.417 -13.519 4.015 112 VAL ATOM 1105 CA TRP 106 3.002 -9.790 4.474 113 TRP ATOM 1106 CA PHE 107 4.243 -10.661 7.962 114 LYS ATOM 1107 CA GLN 108 6.700 -13.399 6.996 115 GLU ATOM 1108 CA GLY 109 7.849 -11.282 4.052 116 ALA ATOM 1109 CA ASP 110 11.147 -9.564 4.855 117 LYS ATOM 1110 CA GLY 111 14.808 -7.054 2.032 119 ASP ATOM 1111 CA MET 112 12.577 -8.929 -0.413 120 GLU ATOM 1112 CA VAL 113 9.470 -6.734 -0.358 121 LEU ATOM 1113 CA ARG 114 9.326 -4.540 -3.462 122 MET ATOM 1114 CA ARG 115 8.031 -0.976 -3.164 123 ASP ATOM 1115 CA LYS 116 7.487 2.009 -5.458 124 SER ATOM 1116 CA ASN 117 7.855 5.747 -4.857 125 LYS ATOM 1117 CA LEU 118 4.812 7.630 -6.149 126 LEU ATOM 1118 CA PRO 119 3.523 11.165 -5.598 127 ARG ATOM 1119 CA ILE 120 -0.115 12.275 -5.502 128 CYS ATOM 1120 CA GLU 121 -0.837 15.458 -7.456 129 VAL ATOM 1121 CA TYR 122 -3.931 17.448 -6.496 130 PHE ATOM 1122 CA ASN 123 -5.572 19.035 -9.539 131 GLU ATOM 1123 CA LEU 124 -8.562 21.362 -9.878 132 MET TER 121 154.660 2 1wicA ATOM 2001 CA SER 1 0.736 -1.984 -9.430 13 VAL ATOM 2002 CA VAL 2 4.219 -3.152 -8.520 14 PHE ATOM 2003 CA PRO 3 4.319 -6.605 -10.068 15 LYS ATOM 2004 CA PRO 4 6.102 -8.323 -7.205 16 GLY ATOM 2005 CA GLY 5 7.755 -11.743 -7.509 17 PRO ATOM 2006 CA ASP 6 5.977 -12.785 -4.334 18 LEU ATOM 2007 CA ILE 7 3.321 -10.358 -3.160 19 LEU ATOM 2008 CA ASN 8 1.911 -7.663 -5.413 20 HIS ATOM 2009 CA THR 9 1.547 -4.077 -4.259 21 ILE ATOM 2010 CA GLN 10 -1.347 -1.838 -5.228 22 SER ATOM 2011 CA PRO 11 -1.004 0.757 -6.100 23 PRO ATOM 2012 CA GLY 12 2.571 0.588 -7.332 24 ALA ATOM 2013 CA SER 13 4.132 3.755 -5.968 25 GLU ATOM 2014 CA LYS 14 1.460 6.431 -5.817 26 GLU ATOM 2015 CA ILE 15 -0.745 7.145 -2.825 27 LEU ATOM 2016 CA VAL 16 -3.650 9.558 -3.079 28 TYR ATOM 2017 CA PHE 17 -5.297 10.388 0.226 29 PHE ATOM 2018 CA ASN 18 -8.566 11.756 -1.103 30 GLY ATOM 2019 CA ALA 19 -11.460 10.030 -2.828 31 SER ATOM 2020 CA PRO 20 -14.070 11.591 -5.081 32 ILE ATOM 2021 CA TYR 21 -16.377 11.191 -2.107 33 GLU ATOM 2022 CA ASP 22 -16.513 13.940 0.491 34 SER ATOM 2023 CA ASP 23 -16.242 11.339 3.228 35 GLY ATOM 2024 CA LYS 24 -12.884 10.101 4.458 36 GLU ATOM 2025 CA HIS 25 -9.496 10.559 2.833 37 LYS ATOM 2026 CA THR 26 -7.956 7.163 3.482 38 LYS ATOM 2027 CA TYR 27 -6.065 5.035 0.988 39 THR ATOM 2028 CA HIS 28 -6.511 1.293 0.629 40 LEU ATOM 2029 CA ILE 29 -3.585 -0.818 -0.514 41 ILE ATOM 2030 CA LYS 30 -4.084 -4.085 -2.359 42 VAL ATOM 2031 CA ILE 31 -1.741 -7.048 -2.114 43 LEU ATOM 2032 CA THR 32 -2.159 -9.777 -4.703 44 THR ATOM 2033 CA ASN 33 -0.269 -12.917 -3.761 45 ASN ATOM 2034 CA ALA 34 0.778 -14.215 -7.159 46 VAL ATOM 2035 CA GLY 35 2.795 -17.017 -5.606 47 THR ATOM 2036 CA GLY 36 1.067 -20.313 -4.916 48 LYS ATOM 2037 CA ARG 37 2.240 -20.200 -1.319 49 ASN ATOM 2038 CA ARG 38 1.424 -18.096 1.719 50 ILE ATOM 2039 CA ILE 39 3.201 -14.759 1.891 51 VAL ATOM 2040 CA GLY 40 3.660 -12.828 5.114 52 ALA ATOM 2041 CA TRP 41 3.352 -9.119 4.422 53 PHE ATOM 2042 CA ALA 42 3.938 -6.158 6.705 54 LYS ATOM 2043 CA ILE 43 3.192 -2.467 6.322 55 VAL ATOM 2044 CA LYS 44 5.606 0.098 7.707 56 ARG ATOM 2045 CA THR 45 6.221 3.829 7.547 57 THR ATOM 2046 CA THR 46 8.447 6.616 8.814 58 THR ATOM 2047 CA ASN 47 5.485 7.676 10.918 59 ALA ATOM 2048 CA MET 48 3.380 4.679 11.969 60 PRO ATOM 2049 CA ARG 49 2.191 6.666 14.963 61 GLU ATOM 2050 CA ARG 50 0.588 9.110 12.558 62 LYS ATOM 2051 CA LEU 51 -0.893 6.933 9.840 63 TYR ATOM 2052 CA GLY 52 -3.304 4.145 10.700 64 ARG ATOM 2053 CA VAL 53 -2.124 1.126 8.745 65 VAL ATOM 2054 CA ASP 54 -4.154 -2.044 9.151 66 LYS ATOM 2055 CA PRO 55 -3.667 -4.721 8.698 67 PRO ATOM 2056 CA PRO 56 -0.007 -3.927 9.240 68 SER ATOM 2057 CA SER 57 0.958 -7.418 10.340 69 ASN ATOM 2058 CA GLY 58 -0.564 -10.388 8.554 70 SER ATOM 2059 CA VAL 59 -0.321 -12.684 5.555 71 SER ATOM 2060 CA LEU 60 -2.100 -13.206 2.255 72 CYS ATOM 2061 CA ASP 61 -3.013 -16.679 1.059 73 ASP ATOM 2062 CA PRO 62 -1.889 -17.715 -2.431 74 PRO ATOM 2063 CA SER 63 -4.304 -16.570 -5.111 75 GLY ATOM 2064 CA GLU 64 -5.976 -14.010 -2.880 76 ALA ATOM 2065 CA LYS 65 -5.847 -10.252 -2.451 77 SER ATOM 2066 CA VAL 66 -5.657 -8.419 0.855 78 ILE ATOM 2067 CA LEU 67 -6.716 -4.916 1.821 79 ASP ATOM 2068 CA MET 68 -4.563 -2.513 3.801 80 ILE ATOM 2069 CA ALA 69 -6.235 0.670 4.982 81 ILE ATOM 2070 CA VAL 70 -4.131 3.765 5.543 82 VAL ATOM 2071 CA SER 71 -5.776 6.653 7.355 83 SER ATOM 2072 CA CYS 72 -3.867 9.614 8.806 84 PRO ATOM 2073 CA ASP 73 -4.454 11.103 12.236 85 HIS ATOM 2074 CA THR 74 -7.707 12.959 12.778 86 GLY ATOM 2075 CA PHE 75 -5.845 16.222 13.236 87 GLY ATOM 2076 CA ASN 76 -2.817 16.494 10.982 88 LEU ATOM 2077 CA ALA 77 -2.737 16.073 7.221 89 THR ATOM 2078 CA ASP 81 -0.977 14.086 4.523 90 VAL ATOM 2079 CA LEU 82 2.627 15.226 4.350 91 SER ATOM 2080 CA ASN 83 5.173 14.794 1.583 92 ALA ATOM 2081 CA ASN 84 8.204 13.414 3.381 93 GLN ATOM 2082 CA ASP 85 5.889 10.697 4.640 94 ASP ATOM 2083 CA ARG 86 6.756 7.344 3.112 95 ARG ATOM 2084 CA ILE 87 5.163 3.922 3.383 96 PHE ATOM 2085 CA CYS 88 6.769 0.498 3.248 97 LEU ATOM 2086 CA ILE 89 5.315 -2.916 2.501 98 ILE ATOM 2087 CA GLU 90 7.040 -6.208 3.214 99 MET ATOM 2088 CA TRP 91 6.405 -9.551 1.557 100 ALA ATOM 2089 CA THR 92 8.195 -12.845 2.080 101 ALA ATOM 2090 CA ASN 93 7.222 -16.286 0.840 102 GLU ATOM 2091 CA THR 94 6.550 -18.680 3.693 103 MET ATOM 2092 CA PRO 95 7.227 -22.400 3.857 104 GLU ATOM 2093 CA ASP 96 4.492 -24.916 3.133 105 GLN ATOM 2094 CA GLY 97 1.793 -24.787 5.784 106 SER ATOM 2095 CA ALA 98 -0.956 -15.031 13.454 110 GLY ATOM 2096 CA ALA 99 1.197 -12.798 15.668 111 PRO ATOM 2097 CA LYS 100 3.225 -15.865 16.566 112 ALA ATOM 2098 CA GLN 101 3.753 -17.848 13.386 113 GLU ATOM 2099 CA PHE 102 4.623 -14.539 11.767 114 LEU ATOM 2100 CA ARG 103 7.044 -13.370 14.431 115 SER ATOM 2101 CA ARG 104 8.628 -16.734 13.724 116 GLN ATOM 2102 CA GLU 105 8.580 -16.600 9.942 117 PHE ATOM 2103 CA TRP 106 9.947 -13.076 10.139 118 TRP ATOM 2104 CA PHE 107 12.633 -14.647 12.294 119 LYS ATOM 2105 CA GLN 108 13.404 -17.441 9.861 120 GLU ATOM 2106 CA GLY 109 12.959 -15.484 6.652 121 VAL ATOM 2107 CA ASP 110 15.955 -9.874 5.118 123 ARG ATOM 2108 CA GLY 111 17.364 -10.934 1.769 124 ASN ATOM 2109 CA MET 112 14.146 -12.845 1.205 125 LYS ATOM 2110 CA VAL 113 12.080 -10.080 2.759 126 VAL ATOM 2111 CA ARG 114 10.748 -8.015 -0.119 127 MET ATOM 2112 CA ARG 115 10.332 -4.389 0.885 128 GLU ATOM 2113 CA LYS 116 8.263 -2.012 -1.211 129 HIS ATOM 2114 CA ASN 117 8.258 1.685 -0.401 130 ARG ATOM 2115 CA LEU 118 5.230 3.682 -1.482 131 LEU ATOM 2116 CA PRO 119 4.936 7.394 -2.161 132 ARG ATOM 2117 CA ILE 120 2.275 9.982 -1.423 133 CYS ATOM 2118 CA GLU 121 1.053 12.138 -4.284 134 HIS ATOM 2119 CA TYR 122 0.216 15.186 -2.202 135 THR ATOM 2120 CA ASN 123 -2.786 16.841 -3.805 136 VAL ATOM 2121 CA LEU 124 -2.420 20.539 -4.521 137 GLU TER