3 145 (N_temp, Lch) 115 39.430 1 1m5hA2 ATOM 1001 CA MET 1 13.722 94.867 4.672 1 MET ATOM 1002 CA GLU 2 15.586 91.605 4.025 2 LYS ATOM 1003 CA ILE 3 19.168 90.707 4.914 3 VAL ATOM 1004 CA ASN 4 20.404 87.290 3.811 4 ASN ATOM 1005 CA GLY 5 16.742 86.380 3.353 5 GLY ATOM 1006 CA VAL 6 15.774 87.260 6.928 6 VAL ATOM 1007 CA GLU 7 13.232 89.981 7.762 7 GLU ATOM 1008 CA ILE 8 14.913 92.988 9.393 8 VAL ATOM 1009 CA GLU 9 12.495 95.467 10.943 9 GLU ATOM 1010 CA ASP 10 13.073 99.072 9.870 10 GLU ATOM 1011 CA THR 11 13.484 100.495 13.381 11 THR ATOM 1012 CA TYR 12 16.400 101.799 15.458 12 PHE ATOM 1013 CA ALA 13 18.616 101.201 18.480 13 ALA ATOM 1014 CA GLU 14 18.799 104.008 21.038 14 GLU ATOM 1015 CA ALA 15 22.123 104.341 22.883 15 ALA ATOM 1016 CA PHE 16 23.631 106.604 25.565 16 PHE ATOM 1017 CA PRO 17 26.778 108.594 26.375 17 ASP ATOM 1018 CA ILE 18 28.613 105.074 23.539 18 ILE ATOM 1019 CA LYS 19 26.806 102.450 25.613 19 ALA ATOM 1020 CA ILE 20 23.720 100.518 24.558 20 GLY ATOM 1021 CA ALA 21 24.177 99.772 20.873 21 GLY ATOM 1022 CA ARG 22 22.021 96.737 20.130 22 ASN ATOM 1023 CA VAL 23 19.761 94.561 17.989 23 PHE ATOM 1024 CA LEU 24 17.459 91.613 18.838 24 PHE ATOM 1025 CA ILE 25 17.470 88.095 17.418 25 ILE ATOM 1026 CA THR 26 14.138 86.247 17.264 26 MET ATOM 1027 CA ALA 27 14.006 82.522 16.438 27 ALA ATOM 1028 CA ALA 28 11.769 79.439 16.333 28 GLU ATOM 1029 CA THR 29 13.716 77.730 19.158 29 THR ATOM 1030 CA LYS 30 15.954 78.780 22.067 30 GLN ATOM 1031 CA ARG 31 18.978 76.962 20.608 31 PRO ATOM 1032 CA TRP 32 18.423 78.673 17.231 32 SER ATOM 1033 CA ALA 33 18.408 82.189 18.657 33 ALA ATOM 1034 CA LEU 34 21.381 81.332 20.901 34 LEU ATOM 1035 CA VAL 35 23.578 79.954 18.098 35 ALA ATOM 1036 CA ALA 36 22.680 83.088 16.117 36 ALA ATOM 1037 CA ALA 37 23.721 85.409 18.952 37 ALA ATOM 1038 CA THR 38 26.903 83.343 19.501 38 LYS ATOM 1039 CA GLU 39 27.886 83.706 15.851 39 ALA ATOM 1040 CA ALA 40 27.211 87.454 16.138 40 ALA ATOM 1041 CA THR 41 30.011 93.177 24.146 52 THR ATOM 1042 CA GLY 42 29.747 93.483 28.002 53 PRO ATOM 1043 CA PHE 43 27.126 90.864 28.842 54 PHE ATOM 1044 CA ALA 44 28.009 87.217 29.743 55 PRO ATOM 1045 CA THR 45 29.695 85.718 26.691 56 GLY ATOM 1046 CA SER 46 28.565 88.981 25.131 57 GLY ATOM 1047 CA VAL 47 24.905 87.887 25.053 58 ILE ATOM 1048 CA ILE 48 21.806 89.251 26.806 59 VAL ATOM 1049 CA MET 49 19.231 86.592 27.686 60 ALA ATOM 1050 CA CYS 50 17.109 88.826 29.905 61 SER ATOM 1051 CA PRO 51 16.317 92.226 28.421 62 GLY ATOM 1052 CA ALA 52 14.511 94.951 30.348 63 SER ATOM 1053 CA GLU 53 12.205 97.965 30.440 64 LYS ATOM 1054 CA ALA 54 12.873 101.125 32.457 65 VAL ATOM 1055 CA GLY 55 10.553 100.824 35.453 66 GLY ATOM 1056 CA ILE 56 7.857 98.277 36.307 67 ALA ATOM 1057 CA GLU 57 4.094 97.864 35.860 68 ASN ATOM 1058 CA ARG 58 6.417 96.485 41.498 70 TYR ATOM 1059 CA LEU 59 6.980 100.247 41.309 71 LYS ATOM 1060 CA ALA 60 11.824 98.518 41.078 73 LEU ATOM 1061 CA SER 61 14.125 100.597 38.873 74 LYS ATOM 1062 CA PRO 62 13.838 98.107 36.003 75 ALA ATOM 1063 CA SER 63 12.139 94.783 35.210 76 SER ATOM 1064 CA GLU 64 -0.928 86.595 28.042 88 GLN ATOM 1065 CA THR 65 0.784 89.986 27.601 89 VAL ATOM 1066 CA PRO 66 -1.857 91.586 25.316 90 GLU ATOM 1067 CA ASP 67 0.710 93.927 23.807 91 GLY ATOM 1068 CA GLY 68 3.415 91.404 22.940 92 THR ATOM 1069 CA ARG 69 5.894 92.177 20.142 93 GLN ATOM 1070 CA PRO 70 3.410 83.703 16.752 96 ALA ATOM 1071 CA GLY 71 6.297 81.485 15.627 97 GLY ATOM 1072 CA VAL 72 9.058 82.879 17.856 98 VAL ATOM 1073 CA TYR 73 9.945 80.936 20.993 99 LYS ATOM 1074 CA VAL 74 23.523 91.799 21.700 104 ILE ATOM 1075 CA GLN 75 24.623 94.918 23.574 105 VAL ATOM 1076 CA ILE 76 27.426 96.955 22.028 106 ILE ATOM 1077 CA CYS 77 29.665 99.584 23.681 107 ASN ATOM 1078 CA THR 78 32.307 101.505 21.732 108 GLY ATOM 1079 CA PHE 79 34.494 104.543 21.148 109 LEU ATOM 1080 CA LYS 80 32.290 106.154 18.471 110 ASN ATOM 1081 CA TYR 81 29.160 105.893 16.327 111 ALA ATOM 1082 CA GLU 82 30.880 104.514 13.218 112 ASP ATOM 1083 CA ALA 83 32.170 101.598 15.342 113 ALA ATOM 1084 CA LEU 84 28.761 100.762 16.852 114 ILE ATOM 1085 CA GLU 85 27.212 100.751 13.355 115 LYS ATOM 1086 CA GLU 86 29.949 98.506 11.946 116 GLU ATOM 1087 CA GLN 87 29.477 96.166 14.914 117 ALA ATOM 1088 CA LEU 88 25.692 96.144 14.488 118 THR ATOM 1089 CA LEU 89 25.987 95.386 10.743 119 ARG ATOM 1090 CA GLU 90 28.600 92.680 11.303 120 VAL ATOM 1091 CA ARG 91 26.563 90.986 14.019 121 GLY ATOM 1092 CA ILE 92 23.275 90.916 12.113 122 ILE ATOM 1093 CA GLY 93 24.905 89.519 8.957 123 LEU ATOM 1094 CA GLN 94 26.455 86.633 10.881 124 ALA ATOM 1095 CA ALA 103 23.270 85.966 12.862 125 ALA ATOM 1096 CA VAL 104 21.111 85.675 9.756 126 THR ATOM 1097 CA PHE 105 23.282 82.731 8.680 127 LYS ATOM 1098 CA ASN 106 18.797 78.238 10.581 129 PRO ATOM 1099 CA GLY 107 15.666 79.045 12.551 130 GLY ATOM 1100 CA LEU 108 16.116 82.814 12.829 131 VAL ATOM 1101 CA PRO 109 12.775 84.501 12.163 132 VAL ATOM 1102 CA GLU 110 13.202 88.243 12.635 133 LYS ATOM 1103 CA ALA 111 15.756 90.921 13.484 134 ILE ATOM 1104 CA LYS 113 14.941 94.175 15.301 135 THR ATOM 1105 CA GLN 114 16.355 96.441 18.005 136 ALA ATOM 1106 CA ASP 115 15.544 98.120 21.293 137 GLY ATOM 1107 CA ASN 116 14.923 101.811 21.823 138 ASN ATOM 1108 CA VAL 117 13.010 104.286 23.968 139 TYR ATOM 1109 CA GLY 118 10.890 106.303 21.567 140 GLY ATOM 1110 CA PHE 119 13.954 108.381 20.765 141 GLY ATOM 1111 CA LYS 120 13.813 110.447 23.943 142 LYS ATOM 1112 CA LEU 121 16.016 108.875 26.642 143 LEU ATOM 1113 CA LYS 122 19.190 108.174 24.661 144 GLY ATOM 1114 CA PHE 123 21.099 110.573 22.409 145 LYS ATOM 1115 CA PHE 124 22.502 108.022 19.955 146 HIS TER 122 189.240 2 2fhkA2 ATOM 2001 CA MET 1 0.111 55.125 98.746 1 MET ATOM 2002 CA GLU 2 -1.450 55.478 95.276 2 GLU ATOM 2003 CA ILE 3 -2.386 58.498 93.157 3 ILE ATOM 2004 CA ASN 4 -4.906 57.528 90.452 4 ASN ATOM 2005 CA GLY 5 -3.744 53.900 90.811 5 GLY ATOM 2006 CA VAL 6 -0.056 54.866 90.544 6 VAL ATOM 2007 CA GLU 7 2.285 53.652 93.302 7 GLU ATOM 2008 CA ILE 8 4.085 56.416 95.211 8 ILE ATOM 2009 CA GLU 9 7.313 54.990 96.614 9 GLU ATOM 2010 CA ASP 10 8.083 55.791 100.246 10 ASP ATOM 2011 CA THR 11 11.379 57.541 99.475 11 THR ATOM 2012 CA TYR 12 12.799 61.048 99.189 12 PHE ATOM 2013 CA ALA 13 14.521 63.497 96.865 13 ALA ATOM 2014 CA GLU 14 17.872 64.663 98.205 14 GLU ATOM 2015 CA ALA 15 18.497 68.282 97.252 15 ALA ATOM 2016 CA PHE 16 21.206 70.886 97.886 16 PHE ATOM 2017 CA PRO 17 21.776 74.506 98.809 17 GLU ATOM 2018 CA ILE 18 17.393 74.569 96.653 18 VAL ATOM 2019 CA LYS 19 18.840 72.504 93.801 19 ALA ATOM 2020 CA ILE 20 18.111 68.943 92.775 20 GLY ATOM 2021 CA ALA 21 14.518 68.414 93.876 21 GLY ATOM 2022 CA ARG 22 13.356 65.466 91.798 22 ASN ATOM 2023 CA VAL 23 11.067 62.559 91.049 23 PHE ATOM 2024 CA LEU 24 11.217 59.555 88.751 24 TYR ATOM 2025 CA ILE 25 8.402 58.503 86.452 25 ILE ATOM 2026 CA THR 26 8.431 54.749 85.865 26 MET ATOM 2027 CA ALA 27 6.327 53.809 82.857 27 ALA ATOM 2028 CA ALA 28 5.230 50.794 80.776 28 GLU ATOM 2029 CA THR 29 6.923 52.295 77.681 29 SER ATOM 2030 CA LYS 30 6.681 63.703 81.990 37 ALA ATOM 2031 CA ARG 31 5.485 66.552 79.733 38 GLU ATOM 2032 CA TRP 32 2.191 66.801 81.684 39 ALA ATOM 2033 CA ALA 33 4.305 67.110 84.876 40 ALA ATOM 2034 CA LEU 34 6.387 69.919 83.349 41 VAL ATOM 2035 CA VAL 35 3.246 71.755 82.156 42 ASP ATOM 2036 CA ALA 36 2.204 71.703 85.842 43 ALA ATOM 2037 CA ALA 37 5.601 72.884 87.087 44 ILE ATOM 2038 CA THR 38 5.326 75.829 84.645 45 LYS ATOM 2039 CA GLU 39 2.705 77.367 86.949 46 GLY ATOM 2040 CA ALA 40 4.741 77.157 90.180 47 VAL ATOM 2041 CA THR 41 6.479 80.520 90.740 48 GLU ATOM 2042 CA GLY 42 10.080 80.416 91.996 49 GLY ATOM 2043 CA PHE 43 16.913 69.917 81.641 54 PHE ATOM 2044 CA ALA 44 15.705 69.862 77.985 55 PRO ATOM 2045 CA THR 45 11.926 70.371 78.105 56 GLY ATOM 2046 CA SER 46 12.371 70.012 81.873 57 GLY ATOM 2047 CA VAL 47 12.990 66.277 81.471 58 ILE ATOM 2048 CA ILE 48 16.040 64.057 82.088 59 VAL ATOM 2049 CA MET 49 16.329 61.006 79.831 60 ALA ATOM 2050 CA CYS 50 19.735 60.066 81.267 61 SER ATOM 2051 CA PRO 51 19.723 60.261 85.088 62 ALA ATOM 2052 CA ALA 52 23.173 59.824 86.618 63 SER ATOM 2053 CA GLU 53 24.920 58.413 89.703 64 LYS ATOM 2054 CA ALA 54 27.988 59.763 91.508 65 VAL ATOM 2055 CA GLY 55 31.249 58.534 89.978 66 GLY ATOM 2056 CA ILE 56 31.753 55.334 88.000 67 SER ATOM 2057 CA GLU 57 32.037 51.665 88.974 68 LYS ATOM 2058 CA ARG 58 34.417 50.806 86.123 69 GLN ATOM 2059 CA LEU 59 36.357 54.043 85.536 70 TYR ATOM 2060 CA ALA 60 34.340 60.142 85.532 73 LEU ATOM 2061 CA SER 61 32.545 62.435 88.040 74 PRO ATOM 2062 CA PRO 62 29.205 60.834 87.044 75 ALA ATOM 2063 CA SER 63 19.998 50.471 88.592 80 ALA ATOM 2064 CA GLU 64 17.211 52.261 86.685 81 TYR ATOM 2065 CA THR 65 18.312 51.272 83.146 82 CYS ATOM 2066 CA PRO 66 15.721 48.999 81.394 83 PRO ATOM 2067 CA ASP 67 18.300 47.474 78.992 84 THR ATOM 2068 CA GLY 68 20.705 46.579 81.819 85 VAL ATOM 2069 CA ARG 69 20.376 42.906 82.886 86 GLU ATOM 2070 CA VAL 72 20.687 43.477 86.652 87 ASP ATOM 2071 CA TYR 73 18.435 46.563 86.999 88 ASN ATOM 2072 CA ILE 76 16.224 47.200 90.043 89 GLU ATOM 2073 CA CYS 77 13.127 48.161 88.048 90 LEU ATOM 2074 CA THR 78 9.630 46.851 88.922 91 PRO ATOM 2075 CA PHE 79 8.189 44.352 86.442 92 GLU ATOM 2076 CA LYS 80 6.321 46.102 83.626 93 GLY ATOM 2077 CA TYR 81 8.640 49.140 83.768 94 VAL ATOM 2078 CA GLU 82 10.255 49.667 80.353 95 LYS ATOM 2079 CA ALA 83 11.151 53.376 80.623 96 CYS ATOM 2080 CA LEU 84 12.179 55.816 83.349 97 VAL ATOM 2081 CA GLU 85 12.286 59.629 83.153 98 TYR ATOM 2082 CA GLU 86 13.470 62.020 85.851 99 GLU ATOM 2083 CA GLN 87 12.234 65.571 86.467 100 ILE ATOM 2084 CA LEU 88 14.825 67.774 88.193 101 VAL ATOM 2085 CA LEU 89 13.642 70.951 89.911 102 ILE ATOM 2086 CA GLU 90 15.529 73.948 91.294 103 ASN ATOM 2087 CA ARG 91 13.801 76.683 93.302 104 GLY ATOM 2088 CA ILE 92 14.099 79.850 95.376 105 LEU ATOM 2089 CA GLY 93 13.301 77.867 98.536 106 ASN ATOM 2090 CA GLN 94 12.274 74.410 99.754 107 GLU ATOM 2091 CA CYS 95 8.535 75.272 99.536 108 GLU ATOM 2092 CA VAL 96 8.758 76.166 95.825 109 ALA ATOM 2093 CA LEU 97 10.533 72.864 95.086 110 VAL ATOM 2094 CA THR 98 8.022 70.884 97.190 111 LYS ATOM 2095 CA ALA 99 5.074 72.464 95.348 112 GLU ATOM 2096 CA PRO 100 6.644 71.762 91.931 113 ALA ATOM 2097 CA THR 101 7.239 68.146 92.980 114 MET ATOM 2098 CA THR 102 -0.104 65.693 86.672 120 ALA ATOM 2099 CA ALA 103 2.049 62.703 85.670 121 ALA ATOM 2100 CA VAL 104 -0.249 60.225 87.478 122 CYS ATOM 2101 CA PHE 105 -3.227 61.407 85.384 123 GLN ATOM 2102 CA ASN 106 -1.924 56.479 81.084 125 PRO ATOM 2103 CA GLY 107 0.708 53.758 81.474 126 GLY ATOM 2104 CA LEU 108 2.504 55.105 84.560 127 VAL ATOM 2105 CA PRO 109 3.545 52.276 86.916 128 VAL ATOM 2106 CA GLU 110 5.116 54.130 89.857 129 LYS ATOM 2107 CA ALA 111 6.732 57.334 91.117 130 ILE ATOM 2108 CA LYS 113 10.136 57.285 92.813 131 SER ATOM 2109 CA GLN 114 12.787 59.858 93.682 132 ALA ATOM 2110 CA ASP 115 16.566 60.137 93.542 133 GLY ATOM 2111 CA ASN 116 18.639 60.463 96.691 134 ASN ATOM 2112 CA VAL 117 22.118 59.750 98.100 135 PHE ATOM 2113 CA GLY 118 20.971 58.064 101.322 136 GLY ATOM 2114 CA PHE 119 21.056 61.376 103.215 137 GLY ATOM 2115 CA LYS 120 24.861 61.561 103.051 138 LYS ATOM 2116 CA LEU 121 25.246 64.510 100.657 139 LEU ATOM 2117 CA LYS 122 22.377 67.038 100.573 140 GLY ATOM 2118 CA PHE 123 20.950 69.675 102.913 141 GLN ATOM 2119 CA PHE 124 17.321 68.880 102.041 142 TYR ATOM 2120 CA ALA 125 15.236 65.721 101.981 143 GLU ATOM 2121 CA ASP 126 11.792 65.968 100.411 144 ILE ATOM 2122 CA GLY 127 9.799 62.845 101.238 145 HIS TER 72 45.170 3 1m5hA2 ATOM 3001 CA ALA 52 20.404 87.290 3.811 4 ASN ATOM 3002 CA GLU 53 16.742 86.380 3.353 5 GLY ATOM 3003 CA ALA 54 15.774 87.260 6.928 6 VAL ATOM 3004 CA GLY 55 13.232 89.981 7.762 7 GLU ATOM 3005 CA ILE 56 14.913 92.988 9.393 8 VAL ATOM 3006 CA GLU 57 12.495 95.467 10.943 9 GLU ATOM 3007 CA ARG 58 13.073 99.072 9.870 10 GLU ATOM 3008 CA LEU 59 13.484 100.495 13.381 11 THR ATOM 3009 CA ALA 60 16.400 101.799 15.458 12 PHE ATOM 3010 CA SER 61 18.616 101.201 18.480 13 ALA ATOM 3011 CA PRO 62 18.799 104.008 21.038 14 GLU ATOM 3012 CA SER 63 22.123 104.341 22.883 15 ALA ATOM 3013 CA ASP 67 23.631 106.604 25.565 16 PHE ATOM 3014 CA GLY 68 26.778 108.594 26.375 17 ASP ATOM 3015 CA ARG 69 28.613 105.074 23.539 18 ILE ATOM 3016 CA PRO 70 26.806 102.450 25.613 19 ALA ATOM 3017 CA GLY 71 23.720 100.518 24.558 20 GLY ATOM 3018 CA VAL 72 24.177 99.772 20.873 21 GLY ATOM 3019 CA TYR 73 22.021 96.737 20.130 22 ASN ATOM 3020 CA VAL 74 19.761 94.561 17.989 23 PHE ATOM 3021 CA GLN 75 17.459 91.613 18.838 24 PHE ATOM 3022 CA ILE 76 17.470 88.095 17.418 25 ILE ATOM 3023 CA CYS 77 14.138 86.247 17.264 26 MET ATOM 3024 CA THR 78 14.006 82.522 16.438 27 ALA ATOM 3025 CA PHE 79 11.769 79.439 16.333 28 GLU ATOM 3026 CA LYS 80 13.716 77.730 19.158 29 THR ATOM 3027 CA TYR 81 15.954 78.780 22.067 30 GLN ATOM 3028 CA GLU 82 18.978 76.962 20.608 31 PRO ATOM 3029 CA ALA 83 18.423 78.673 17.231 32 SER ATOM 3030 CA LEU 84 18.408 82.189 18.657 33 ALA ATOM 3031 CA GLU 85 21.381 81.332 20.901 34 LEU ATOM 3032 CA GLU 86 23.578 79.954 18.098 35 ALA ATOM 3033 CA GLN 87 22.680 83.088 16.117 36 ALA ATOM 3034 CA LEU 88 23.721 85.409 18.952 37 ALA ATOM 3035 CA LEU 89 26.903 83.343 19.501 38 LYS ATOM 3036 CA GLU 90 27.886 83.706 15.851 39 ALA ATOM 3037 CA ALA 103 27.211 87.454 16.138 40 ALA ATOM 3038 CA VAL 104 29.487 87.807 19.171 41 VAL ATOM 3039 CA ASN 106 32.283 85.911 17.397 42 ASP ATOM 3040 CA GLY 107 31.783 88.172 14.376 43 ALA ATOM 3041 CA GLN 114 31.883 91.303 16.534 44 ILE ATOM 3042 CA ASP 115 35.007 90.173 18.422 45 SER ATOM 3043 CA ASN 116 36.969 91.102 15.271 46 ASP ATOM 3044 CA VAL 117 35.524 94.653 15.117 47 VAL ATOM 3045 CA GLY 118 37.913 97.320 16.390 48 GLU ATOM 3046 CA PHE 119 36.820 99.800 19.068 49 GLY ATOM 3047 CA LYS 120 33.830 97.827 20.400 50 VAL ATOM 3048 CA LEU 121 32.990 95.351 23.190 51 ILE ATOM 3049 CA LYS 122 30.011 93.177 24.146 52 THR ATOM 3050 CA PHE 123 29.747 93.483 28.002 53 PRO ATOM 3051 CA PHE 124 27.126 90.864 28.842 54 PHE ATOM 3052 CA ALA 125 28.009 87.217 29.743 55 PRO ATOM 3053 CA ASP 126 29.695 85.718 26.691 56 GLY ATOM 3054 CA GLY 127 28.565 88.981 25.131 57 GLY ATOM 3055 CA MET 128 24.905 87.887 25.053 58 ILE ATOM 3056 CA GLU 129 21.806 89.251 26.806 59 VAL ATOM 3057 CA SER 130 19.231 86.592 27.686 60 ALA ATOM 3058 CA GLU 131 17.109 88.826 29.905 61 SER ATOM 3059 CA THR 132 16.317 92.226 28.421 62 GLY ATOM 3060 CA GLN 133 14.511 94.951 30.348 63 SER ATOM 3061 CA ILE 134 12.205 97.965 30.440 64 LYS ATOM 3062 CA ALA 135 12.873 101.125 32.457 65 VAL ATOM 3063 CA GLY 136 10.553 100.824 35.453 66 GLY ATOM 3064 CA ARG 137 7.857 98.277 36.307 67 ALA ATOM 3065 CA LYS 138 3.402 96.142 39.170 69 LYS ATOM 3066 CA VAL 139 6.417 96.485 41.498 70 TYR ATOM 3067 CA TYR 140 6.980 100.247 41.309 71 LYS ATOM 3068 CA LYS 141 9.825 100.184 43.851 72 PHE ATOM 3069 CA VAL 142 11.824 98.518 41.078 73 LEU ATOM 3070 CA PRO 143 14.125 100.597 38.873 74 LYS ATOM 3071 CA ILE 144 13.838 98.107 36.003 75 ALA ATOM 3072 CA MET 145 12.139 94.783 35.210 76 SER TER