3 103 (N_temp, Lch) 86 290.620 1 3fg2P2 ATOM 1001 CA TRP 9 111.340 134.918 85.505 1 TRP ATOM 1002 CA PHE 10 114.255 136.099 83.379 2 PHE ATOM 1003 CA TRP 11 116.070 135.241 80.154 3 TRP ATOM 1004 CA SER 12 119.335 135.880 78.319 4 SER ATOM 1005 CA ASP 13 120.420 135.363 74.700 5 ASP ATOM 1006 CA GLN 14 124.124 134.567 74.403 6 GLN ATOM 1007 CA TYR 15 125.399 133.695 70.958 7 GLY ATOM 1008 CA GLU 16 123.222 130.862 69.694 8 ASP ATOM 1009 CA ILE 17 122.121 129.716 73.159 9 ASP ATOM 1010 CA GLY 18 118.963 130.798 74.980 10 LYS ATOM 1011 CA LEU 19 118.799 130.879 78.774 11 LEU ATOM 1012 CA LYS 20 115.472 131.001 80.564 12 GLN ATOM 1013 CA MET 21 115.068 131.219 84.318 13 ILE ATOM 1014 CA VAL 22 111.852 130.982 86.295 14 VAL ATOM 1015 CA GLY 23 111.930 131.515 90.056 15 GLY ATOM 1016 CA LEU 24 114.595 132.759 92.486 16 LEU ATOM 1017 CA SER 25 117.476 130.301 93.019 17 THR ATOM 1018 CA GLU 26 119.240 132.020 95.938 18 ALA ATOM 1019 CA GLY 27 120.053 129.589 98.741 19 GLY ATOM 1020 CA TYR 28 119.992 126.524 96.480 20 PHE ATOM 1021 CA ASP 29 121.228 123.366 98.220 21 ASP ATOM 1022 CA ARG 30 120.535 120.792 95.503 22 GLN ATOM 1023 CA ILE 31 120.667 120.935 91.703 23 VAL ATOM 1024 CA ILE 32 119.411 118.271 89.295 24 VAL ATOM 1025 CA VAL 33 120.174 118.227 85.578 25 ILE ATOM 1026 CA ARG 34 117.375 117.334 83.171 26 ARG ATOM 1027 CA GLY 35 118.348 116.690 79.578 27 GLY ATOM 1028 CA SER 36 121.912 116.802 78.277 28 SER ATOM 1029 CA LEU 37 124.651 119.394 78.606 29 VAL ATOM 1030 CA ALA 38 126.496 117.751 75.712 30 ALA ATOM 1031 CA GLN 39 123.394 118.015 73.530 31 GLU ATOM 1032 CA PRO 40 123.190 121.716 74.427 32 ARG ATOM 1033 CA ASP 41 119.636 121.349 75.709 33 SER ATOM 1034 CA PHE 42 119.057 120.818 79.399 34 PHE ATOM 1035 CA SER 43 117.747 122.412 82.565 35 SER ATOM 1036 CA VAL 44 119.047 122.813 86.089 36 ALA ATOM 1037 CA PHE 45 116.257 122.110 88.563 37 PHE ATOM 1038 CA TYR 46 117.237 124.002 91.679 38 CYS ATOM 1039 CA LEU 47 115.996 122.936 95.089 39 TYR ATOM 1040 CA GLN 48 116.172 124.190 98.663 40 LYS ATOM 1041 CA GLY 49 115.072 121.988 101.567 41 ALA ATOM 1042 CA ASP 50 113.521 119.473 99.163 42 GLY ATOM 1043 CA ARG 51 111.362 121.989 97.285 43 LYS ATOM 1044 CA VAL 52 111.807 123.202 93.704 44 LEU ATOM 1045 CA LEU 53 112.681 126.893 93.892 45 ILE ATOM 1046 CA ALA 54 113.630 127.546 90.292 46 GLY ATOM 1047 CA VAL 55 114.455 126.211 86.847 47 ILE ATOM 1048 CA ASP 56 117.302 127.439 84.655 48 GLU ATOM 1049 CA THR 57 116.761 126.128 81.123 49 SER ATOM 1050 CA VAL 58 119.267 126.253 78.265 50 VAL ATOM 1051 CA ASN 59 117.622 125.901 74.842 51 ASN ATOM 1052 CA ARG 60 114.774 123.960 76.468 52 ARG ATOM 1053 CA PRO 61 111.544 125.975 76.349 53 ALA ATOM 1054 CA VAL 62 109.404 123.057 77.546 54 ALA ATOM 1055 CA GLU 63 111.045 122.931 80.974 55 ASP ATOM 1056 CA PHE 64 110.552 126.690 81.351 56 HIS ATOM 1057 CA ASN 65 106.823 126.443 80.617 57 VAL ATOM 1058 CA GLN 66 106.670 123.688 83.235 58 PHE ATOM 1059 CA SER 67 108.154 125.955 85.878 59 GLY ATOM 1060 CA LYS 68 106.093 129.008 84.884 60 ARG ATOM 1061 CA GLN 69 102.969 126.948 85.552 61 LYS ATOM 1062 CA ILE 70 103.982 124.914 88.610 62 ILE ATOM 1063 CA ILE 71 106.059 127.396 90.626 63 LEU ATOM 1064 CA THR 72 103.405 130.094 90.953 64 PRO ATOM 1065 CA ASP 73 101.117 127.413 92.388 65 LEU ATOM 1066 CA ARG 74 103.878 126.688 94.862 66 ASP ATOM 1067 CA LEU 75 103.863 123.063 93.664 67 LYS ATOM 1068 CA PRO 76 106.952 120.948 93.234 68 SER ATOM 1069 CA VAL 77 108.496 117.926 91.560 69 VAL ATOM 1070 CA GLU 78 111.045 115.672 93.225 70 THR ATOM 1071 CA PRO 79 114.744 115.756 92.185 71 PRO ATOM 1072 CA ASN 80 114.285 112.140 91.140 72 GLU ATOM 1073 CA LEU 81 111.399 113.056 88.847 73 GLN ATOM 1074 CA LEU 82 113.196 116.077 87.386 74 ALA ATOM 1075 CA GLY 83 116.059 113.926 86.154 75 ALA ATOM 1076 CA ASP 84 113.736 111.253 84.756 76 ASP ATOM 1077 CA GLU 85 113.079 111.918 81.058 77 LEU ATOM 1078 CA SER 86 110.245 109.391 81.252 78 SER ATOM 1079 CA VAL 87 108.538 111.593 83.841 79 PHE ATOM 1080 CA PRO 88 105.945 113.581 81.881 80 ASP ATOM 1081 CA LEU 89 106.082 117.289 82.714 81 LEU ATOM 1082 CA LYS 90 102.883 118.131 80.817 82 LYS ATOM 1083 CA GLU 91 100.797 115.707 82.853 83 LYS ATOM 1084 CA ILE 92 102.503 116.911 86.014 84 ALA ATOM 1085 CA ILE 93 101.529 120.508 85.235 85 ALA ATOM 1086 CA ALA 94 97.974 119.946 83.982 86 ALA TER 88 149.880 2 2gr3A2 ATOM 2001 CA ALA 7 61.418 19.971 27.081 1 LEU ATOM 2002 CA PRO 8 63.817 19.922 24.100 2 PRO ATOM 2003 CA TRP 9 67.046 17.946 23.941 3 TRP ATOM 2004 CA PHE 10 69.344 16.299 21.458 4 TYR ATOM 2005 CA TRP 11 72.477 14.177 21.179 5 PHE ATOM 2006 CA SER 12 75.316 14.237 18.680 6 SER ATOM 2007 CA ASP 13 78.034 11.630 18.211 7 ASP ATOM 2008 CA GLN 14 81.147 13.277 16.818 8 GLN ATOM 2009 CA TYR 15 84.141 10.933 16.896 9 GLY ATOM 2010 CA GLU 16 85.386 10.725 20.495 10 ALA ATOM 2011 CA ILE 17 82.706 13.221 21.561 11 LEU ATOM 2012 CA GLY 18 79.393 11.920 22.842 12 ARG ATOM 2013 CA LEU 19 77.487 15.192 23.137 13 ILE ATOM 2014 CA LYS 20 74.135 15.662 24.876 14 GLN ATOM 2015 CA MET 21 72.380 19.036 25.064 15 VAL ATOM 2016 CA VAL 22 69.135 19.888 26.835 16 ALA ATOM 2017 CA GLY 23 67.052 23.037 27.008 17 GLY ATOM 2018 CA LEU 24 68.392 26.501 26.259 18 LEU ATOM 2019 CA SER 25 71.916 27.245 25.027 19 ALA ATOM 2020 CA GLU 26 72.274 30.122 27.453 20 SER ATOM 2021 CA GLY 27 70.809 31.987 30.399 21 GLY ATOM 2022 CA TYR 28 72.482 34.524 32.663 22 ASP ATOM 2023 CA ASP 29 74.960 32.057 34.153 23 GLU ATOM 2024 CA ARG 30 76.976 29.017 33.090 24 GLU ATOM 2025 CA ILE 32 78.393 26.541 35.596 25 ILE ATOM 2026 CA VAL 33 81.177 24.203 34.353 26 VAL ATOM 2027 CA ARG 34 81.678 20.775 35.968 27 ARG ATOM 2028 CA GLY 35 84.996 19.133 35.145 28 GLY ATOM 2029 CA SER 36 87.888 20.428 33.069 29 GLU ATOM 2030 CA LEU 37 87.245 21.303 29.432 30 VAL ATOM 2031 CA ALA 38 90.173 19.520 27.806 31 SER ATOM 2032 CA GLN 39 90.177 12.760 27.897 34 ALA ATOM 2033 CA PRO 40 87.202 15.005 27.138 35 PRO ATOM 2034 CA ASP 41 84.608 14.800 29.901 36 LYS ATOM 2035 CA PHE 42 82.603 17.744 31.169 37 PHE ATOM 2036 CA SER 43 79.168 19.121 31.996 38 THR ATOM 2037 CA PHE 45 77.731 22.627 31.469 39 LEU ATOM 2038 CA TYR 46 74.710 23.966 33.338 40 ILE ATOM 2039 CA LEU 47 72.891 27.118 32.158 41 GLU ATOM 2040 CA GLN 48 70.882 29.086 34.696 42 LEU ATOM 2041 CA GLY 49 68.478 32.009 34.554 43 GLN ATOM 2042 CA ASP 50 69.107 30.652 39.716 45 GLY ATOM 2043 CA ARG 51 66.868 28.287 37.734 46 ARG ATOM 2044 CA VAL 52 68.340 25.601 35.481 47 ILE ATOM 2045 CA LEU 53 67.305 26.302 31.866 48 VAL ATOM 2046 CA ALA 54 69.782 24.096 29.997 49 GLY ATOM 2047 CA VAL 55 72.558 21.565 30.325 50 ALA ATOM 2048 CA ASP 56 75.266 19.863 28.298 51 THR ATOM 2049 CA THR 57 77.198 16.662 28.886 52 CYS ATOM 2050 CA VAL 58 80.217 15.598 26.895 53 VAL ATOM 2051 CA ASN 59 81.104 11.965 27.533 54 ASN ATOM 2052 CA ARG 60 79.101 12.236 30.764 55 ASN ATOM 2053 CA PRO 61 75.821 10.414 30.125 56 ALA ATOM 2054 CA VAL 62 75.461 9.562 33.828 57 ARG ATOM 2055 CA GLU 63 74.847 13.233 34.633 58 ASP ATOM 2056 CA PHE 64 72.541 14.012 31.713 59 PHE ATOM 2057 CA ASN 65 69.437 12.167 33.030 60 ALA ATOM 2058 CA GLN 66 69.491 13.905 36.459 61 PRO ATOM 2059 CA SER 67 70.087 17.271 34.761 62 LEU ATOM 2060 CA LYS 68 67.089 16.766 32.451 63 ARG ATOM 2061 CA GLN 69 64.973 16.026 35.532 64 ARG ATOM 2062 CA ILE 70 66.249 19.139 37.321 65 LEU ATOM 2063 CA ILE 71 65.557 21.125 34.127 66 LEU ATOM 2064 CA THR 72 61.969 19.774 33.851 67 ALA ATOM 2065 CA ASP 73 60.941 21.038 37.289 68 VAL ATOM 2066 CA ARG 74 62.867 24.312 36.944 69 GLY ATOM 2067 CA LEU 75 65.138 23.411 39.867 70 ALA ATOM 2068 CA PRO 76 66.975 26.167 41.720 71 LYS ATOM 2069 CA VAL 77 69.893 24.279 43.268 72 PRO ATOM 2070 CA GLU 78 72.731 25.805 45.279 73 ASP ATOM 2071 CA PRO 79 75.148 27.133 42.631 74 ARG ATOM 2072 CA ASN 80 78.146 26.349 44.853 75 ALA ATOM 2073 CA LEU 81 76.952 22.714 45.042 76 ALA ATOM 2074 CA LEU 82 76.390 22.643 41.274 77 LEU ATOM 2075 CA GLY 83 80.024 23.654 40.686 78 ALA ATOM 2076 CA ASP 84 81.393 21.377 43.458 79 ASP ATOM 2077 CA GLU 85 82.860 18.172 41.953 80 PRO ATOM 2078 CA SER 86 81.848 16.387 45.203 81 ALA ATOM 2079 CA VAL 87 78.146 16.823 44.317 82 THR ATOM 2080 CA PRO 88 76.214 13.808 43.019 83 ASP ATOM 2081 CA LEU 89 73.622 15.161 40.576 84 LEU ATOM 2082 CA LYS 90 71.469 12.001 40.714 85 ARG ATOM 2083 CA GLU 91 71.059 12.514 44.465 86 LYS ATOM 2084 CA ILE 92 70.165 16.179 43.853 87 LEU ATOM 2085 CA ILE 93 67.533 15.156 41.264 88 ALA ATOM 2086 CA ALA 94 66.043 12.461 43.528 89 ALA ATOM 2087 CA ALA 95 65.887 14.877 46.497 90 ALA ATOM 2088 CA ALA 96 63.807 17.399 44.539 91 VAL TER 87 192.040 3 3ef6A2 ATOM 3001 CA ALA 7 42.279 -4.509 58.549 1 LEU ATOM 3002 CA PRO 8 39.351 -2.792 56.787 2 PRO ATOM 3003 CA TRP 9 40.210 -1.972 53.162 3 VAL ATOM 3004 CA PHE 10 37.646 -0.476 50.784 4 SER ATOM 3005 CA TRP 11 37.075 1.931 47.884 5 TRP ATOM 3006 CA SER 12 34.305 4.173 46.502 6 THR ATOM 3007 CA ASP 13 33.509 6.091 43.297 7 GLU ATOM 3008 CA GLN 14 31.794 9.371 44.042 8 ILE ATOM 3009 CA TYR 15 31.344 12.506 41.899 9 ALA ATOM 3010 CA GLU 16 33.952 11.343 39.354 10 GLY ATOM 3011 CA ILE 17 36.671 10.647 41.947 11 HIS ATOM 3012 CA GLY 18 38.139 7.402 43.283 12 ARG ATOM 3013 CA LEU 19 38.667 7.113 47.040 13 MET ATOM 3014 CA LYS 20 40.445 4.198 48.662 14 GLN ATOM 3015 CA MET 21 40.456 3.440 52.399 15 MET ATOM 3016 CA VAL 22 42.672 1.378 54.685 16 ALA ATOM 3017 CA GLY 23 41.959 1.177 58.399 17 GLY ATOM 3018 CA LEU 24 39.317 3.285 60.085 18 ASP ATOM 3019 CA SER 25 39.699 7.025 59.394 19 ILE ATOM 3020 CA GLU 26 37.361 7.761 62.326 20 GLU ATOM 3021 CA GLY 27 39.195 7.492 65.625 21 GLY ATOM 3022 CA TYR 28 41.587 9.298 67.954 22 PRO ATOM 3023 CA ASP 29 44.744 11.110 66.825 23 GLY ATOM 3024 CA ARG 30 46.159 13.636 64.356 24 ASP ATOM 3025 CA ILE 31 44.975 14.058 60.773 25 PHE ATOM 3026 CA ILE 32 47.840 14.711 58.366 26 VAL ATOM 3027 CA VAL 33 47.013 15.911 54.815 27 SER ATOM 3028 CA ARG 34 49.275 15.075 51.866 28 ARG ATOM 3029 CA GLY 35 48.277 17.073 48.760 29 GLY ATOM 3030 CA SER 36 44.841 18.592 48.034 30 MET ATOM 3031 CA LEU 37 41.780 16.523 47.015 31 PRO ATOM 3032 CA ALA 38 40.853 17.657 43.488 32 GLY ATOM 3033 CA GLN 39 44.378 18.750 42.615 33 SER ATOM 3034 CA PRO 40 45.881 15.411 41.609 34 GLY ATOM 3035 CA ASP 41 46.881 12.595 44.003 35 ALA ATOM 3036 CA PHE 42 45.950 13.284 47.652 36 ALA ATOM 3037 CA SER 43 46.052 11.378 50.913 37 LEU ATOM 3038 CA VAL 44 44.747 11.824 54.429 38 LEU ATOM 3039 CA PHE 45 46.434 9.960 57.297 39 PHE ATOM 3040 CA TYR 46 45.227 9.405 60.870 40 ARG ATOM 3041 CA LEU 47 48.149 9.113 63.314 41 LEU ATOM 3042 CA GLN 48 47.784 7.973 66.929 42 GLN ATOM 3043 CA GLY 49 50.732 8.078 69.317 43 GLU ATOM 3044 CA ASP 50 53.111 8.720 66.358 44 ARG ATOM 3045 CA ARG 51 51.913 5.738 64.294 45 ARG ATOM 3046 CA VAL 52 49.827 5.641 61.088 46 ILE ATOM 3047 CA LEU 53 46.459 4.040 61.935 47 GLN ATOM 3048 CA ALA 54 44.527 4.682 58.716 48 ALA ATOM 3049 CA VAL 55 44.574 6.392 55.338 49 VAL ATOM 3050 CA ASP 56 42.163 7.753 52.750 50 VAL ATOM 3051 CA THR 57 43.587 8.115 49.249 51 ALA ATOM 3052 CA VAL 58 41.928 10.326 46.630 52 VAL ATOM 3053 CA ASN 59 42.737 9.546 42.987 53 ASP ATOM 3054 CA ARG 60 46.067 8.023 44.068 54 ALA ATOM 3055 CA PRO 61 46.104 4.221 43.482 55 PRO ATOM 3056 CA VAL 62 49.911 3.731 43.545 56 ARG ATOM 3057 CA GLU 63 50.255 5.922 46.636 57 ASP ATOM 3058 CA PHE 64 47.361 4.058 48.304 58 PHE ATOM 3059 CA ASN 65 49.103 0.689 47.773 59 ALA ATOM 3060 CA GLN 66 52.239 2.033 49.514 60 LEU ATOM 3061 CA SER 67 50.206 3.845 52.199 61 ALA ATOM 3062 CA LYS 68 48.328 0.617 52.993 62 THR ATOM 3063 CA GLN 69 51.717 -1.019 53.731 63 ARG ATOM 3064 CA ILE 70 52.370 1.831 56.212 64 LEU ATOM 3065 CA ILE 71 48.976 1.191 57.915 65 VAL ATOM 3066 CA THR 72 49.697 -2.550 58.093 66 GLU ATOM 3067 CA ASP 73 53.094 -1.745 59.632 67 ALA ATOM 3068 CA ARG 74 51.576 0.994 61.816 68 ARG ATOM 3069 CA LEU 75 54.662 2.882 60.688 69 ALA ATOM 3070 CA PRO 76 56.144 5.739 62.656 70 ALA ATOM 3071 CA VAL 77 56.536 8.452 60.028 71 ILE ATOM 3072 CA GLU 78 57.074 12.128 60.910 72 GLU ATOM 3073 CA PRO 79 53.988 14.164 59.875 73 PRO ATOM 3074 CA ASN 80 56.296 16.792 58.340 74 ALA ATOM 3075 CA LEU 81 57.847 14.147 56.082 75 ARG ATOM 3076 CA LEU 82 54.392 12.784 55.101 76 LEU ATOM 3077 CA GLY 83 52.978 16.188 54.147 77 ALA ATOM 3078 CA ASP 84 56.097 17.076 52.101 78 ASP ATOM 3079 CA GLU 85 55.266 16.440 48.438 79 LEU ATOM 3080 CA SER 86 58.993 16.313 47.575 80 SER ATOM 3081 CA VAL 87 59.106 13.058 49.550 81 ASN ATOM 3082 CA PRO 88 57.725 10.148 47.515 82 SER ATOM 3083 CA LEU 89 55.508 7.496 49.155 83 MET ATOM 3084 CA LYS 90 58.056 4.864 48.011 84 ARG ATOM 3085 CA GLU 91 60.727 6.423 50.248 85 ASP ATOM 3086 CA ILE 92 58.502 6.000 53.316 86 PHE ATOM 3087 CA ILE 93 58.190 2.299 52.573 87 VAL TER