3 125 (N_temp, Lch) 123 32.560 1 5e37A ATOM 1001 CA PRO 2 75.872 11.669 39.606 12 GLU ATOM 1002 CA LYS 3 73.455 14.528 38.986 13 GLU ATOM 1003 CA MET 4 71.398 12.621 36.443 14 LEU ATOM 1004 CA THR 5 71.325 9.748 38.926 15 GLU ATOM 1005 CA GLU 6 70.173 12.173 41.711 16 ARG ATOM 1006 CA LEU 7 67.453 13.464 39.427 17 ARG ATOM 1007 CA TYR 8 66.359 10.034 38.405 18 PHE ATOM 1008 CA GLN 9 65.991 8.892 42.041 19 LYS ATOM 1009 CA SER 10 63.890 12.008 42.730 20 MET ATOM 1010 CA LEU 11 61.481 11.160 39.867 21 ALA ATOM 1011 CA ALA 12 61.390 7.579 41.070 22 ASP ATOM 1012 CA ASP 13 62.198 4.544 45.423 25 GLY ATOM 1013 CA LEU 14 61.594 1.318 43.548 26 ASN ATOM 1014 CA ASN 15 64.498 1.706 41.150 27 GLY ATOM 1015 CA ASN 16 62.532 2.882 38.027 28 HIS ATOM 1016 CA VAL 17 59.979 5.471 36.538 29 ILE ATOM 1017 CA ARG 18 56.530 4.063 35.728 30 ASP ATOM 1018 CA PHE 19 53.832 5.674 33.615 31 ARG ATOM 1019 CA SER 20 52.132 7.412 36.527 32 GLU ATOM 1020 CA ALA 21 55.525 8.709 37.970 33 GLU ATOM 1021 CA TYR 22 56.352 9.955 34.527 34 LEU ATOM 1022 CA ARG 23 52.888 11.822 34.384 35 ARG ATOM 1023 CA THR 24 54.040 13.912 37.401 36 ASN ATOM 1024 CA ALA 25 57.549 14.356 36.063 37 LEU ATOM 1025 CA MET 26 56.018 15.820 32.869 38 LEU ATOM 1026 CA LYS 27 53.553 17.965 34.876 39 GLU ATOM 1027 CA LEU 28 56.622 19.516 36.864 40 SER ATOM 1028 CA ARG 29 58.292 22.915 36.934 41 MET ATOM 1029 CA ARG 30 61.972 24.086 37.595 42 GLU ATOM 1030 CA LEU 31 63.564 21.066 35.795 43 SER ATOM 1031 CA GLN 32 61.689 18.472 37.792 44 GLY ATOM 1032 CA LYS 33 62.186 20.139 41.203 45 GLU ATOM 1033 CA ALA 34 58.583 21.344 41.790 46 VAL ATOM 1034 CA LEU 35 55.561 19.029 41.304 47 TYR ATOM 1035 CA CYS 36 52.145 20.580 40.852 48 MET ATOM 1036 CA LEU 37 45.267 18.242 40.077 51 GLN ATOM 1037 CA ASP 38 46.558 16.943 36.794 52 HIS ATOM 1038 CA LEU 39 46.974 19.282 33.878 53 TRP ATOM 1039 CA LEU 40 48.613 17.092 31.137 54 LEU ATOM 1040 CA SER 41 46.270 15.521 28.452 55 PRO ATOM 1041 CA LEU 42 46.522 11.683 28.233 56 GLU ATOM 1042 CA SER 43 47.602 11.865 24.590 57 ASP ATOM 1043 CA ALA 44 50.732 13.666 25.801 58 GLU ATOM 1044 CA ALA 45 51.844 10.952 28.224 59 LEU ATOM 1045 CA CYS 46 51.224 8.211 25.674 60 GLU ATOM 1046 CA ASP 47 53.047 10.362 23.105 61 ARG ATOM 1047 CA ALA 48 56.008 10.501 25.563 62 CYS ATOM 1048 CA LEU 49 56.127 6.752 26.456 63 MET ATOM 1049 CA ASP 50 55.913 5.898 22.697 64 GLU ATOM 1050 CA GLN 51 59.212 7.693 22.032 65 GLN ATOM 1051 CA HIS 52 61.423 7.192 25.147 66 TYR ATOM 1052 CA ASN 53 60.463 3.623 26.091 67 ASP ATOM 1053 CA LEU 54 62.741 2.053 23.419 68 VAL ATOM 1054 CA LYS 55 62.724 -1.591 24.590 69 ASN ATOM 1055 CA ASN 57 58.908 -1.397 25.141 70 LYS ATOM 1056 CA ASP 58 58.628 -2.758 28.764 71 ASP ATOM 1057 CA GLN 59 56.077 0.016 29.765 72 GLY ATOM 1058 CA PRO 60 58.524 1.720 32.122 73 VAL ATOM 1059 CA MET 61 61.316 4.329 31.953 74 ILE ATOM 1060 CA ASP 62 64.799 3.181 32.902 75 SER ATOM 1061 CA ILE 63 67.678 5.435 33.848 76 PHE ATOM 1062 CA LEU 64 69.107 5.257 30.296 77 GLU ATOM 1063 CA GLN 65 65.780 6.129 28.820 78 GLU ATOM 1064 CA ILE 66 65.387 8.977 31.355 79 PHE ATOM 1065 CA ILE 67 68.624 10.588 30.142 80 LYS ATOM 1066 CA ASN 68 67.142 10.976 26.723 81 GLN ATOM 1067 CA CYS 69 64.073 12.737 28.165 82 ILE ATOM 1068 CA LEU 70 66.438 15.179 29.949 83 ILE ATOM 1069 CA THR 71 68.695 15.676 26.885 84 TYR ATOM 1070 CA THR 72 53.782 36.136 33.790 98 SER ATOM 1071 CA ILE 73 54.490 35.105 30.226 99 ALA ATOM 1072 CA TYR 74 50.838 33.971 29.727 100 PHE ATOM 1073 CA ASP 75 49.513 37.240 31.076 101 LYS ATOM 1074 CA ARG 76 51.828 39.219 28.778 102 ALA ATOM 1075 CA LEU 77 50.545 37.347 25.711 103 VAL ATOM 1076 CA GLU 78 46.915 37.647 26.810 104 ASP ATOM 1077 CA GLN 79 46.542 41.229 25.828 105 LYS ATOM 1078 CA GLU 80 42.728 41.262 26.278 106 SER ATOM 1079 CA HIS 81 43.289 40.180 29.940 107 GLY ATOM 1080 CA ASN 82 40.340 37.781 29.893 108 ASN ATOM 1081 CA ASN 83 42.529 34.856 30.983 109 GLY ATOM 1082 CA LEU 84 42.826 32.971 27.673 110 THR ATOM 1083 CA VAL 85 44.991 33.471 24.545 111 ILE ATOM 1084 CA ASN 86 43.219 33.785 21.186 112 GLY ATOM 1085 CA VAL 87 44.621 33.436 17.725 113 ALA ATOM 1086 CA PRO 88 44.600 37.171 17.236 114 THR ATOM 1087 CA LEU 89 46.795 37.439 20.381 115 GLU ATOM 1088 CA CYS 90 49.121 34.774 19.115 116 LEU ATOM 1089 CA VAL 91 49.415 36.629 15.829 117 SER ATOM 1090 CA ASP 92 50.380 39.820 17.615 118 LYS ATOM 1091 CA MET 93 52.979 37.978 19.719 119 LEU ATOM 1092 CA CYS 94 54.686 36.488 16.619 120 PHE ATOM 1093 CA LEU 95 47.952 30.296 12.801 132 LEU ATOM 1094 CA ASN 96 45.579 27.452 11.849 133 VAL ATOM 1095 CA TRP 97 48.483 25.045 12.242 134 ASP ATOM 1096 CA LEU 98 49.431 26.496 15.674 135 LEU ATOM 1097 CA LEU 99 45.854 26.162 16.856 136 MET ATOM 1098 CA ASN 100 45.522 22.606 15.588 137 GLN ATOM 1099 CA VAL 101 48.797 21.676 17.332 138 MET ATOM 1100 CA TYR 102 48.118 23.461 20.655 139 TYR ATOM 1101 CA ASP 103 44.405 24.035 21.049 140 ASP ATOM 1102 CA THR 104 43.935 20.393 21.851 141 LYS ATOM 1103 CA GLY 105 40.476 20.690 23.383 142 ASP ATOM 1104 CA ARG 106 39.054 22.691 20.443 143 ASP ATOM 1105 CA THR 107 38.064 25.586 22.691 144 SER ATOM 1106 CA GLY 108 39.285 28.095 20.150 145 GLY ATOM 1107 CA ARG 109 41.630 29.533 22.774 146 GLN ATOM 1108 CA ILE 110 44.987 28.614 24.247 147 ILE ATOM 1109 CA ARG 111 44.412 28.041 27.949 148 GLU ATOM 1110 CA VAL 112 47.326 27.932 30.397 149 PHE ATOM 1111 CA LEU 113 48.056 24.202 30.191 150 PRO ATOM 1112 CA SER 114 48.209 24.367 26.488 151 GLU ATOM 1113 CA PHE 115 50.554 27.415 26.618 152 PHE ATOM 1114 CA LYS 116 52.891 25.282 28.691 153 LEU ATOM 1115 CA THR 117 53.227 22.775 25.874 154 LEU ATOM 1116 CA GLY 118 54.465 25.627 23.616 155 MET ATOM 1117 CA ILE 119 57.467 25.871 25.952 156 PHE ATOM 1118 CA ILE 120 57.886 22.093 26.347 157 ARG ATOM 1119 CA SER 121 58.087 21.848 22.498 158 ASN ATOM 1120 CA LEU 122 60.347 24.963 22.074 159 SER ATOM 1121 CA CYS 123 57.837 26.887 19.989 160 LEU ATOM 1122 CA LYS 124 58.386 29.664 22.555 161 LEU ATOM 1123 CA ALA 125 61.263 30.447 24.962 162 ASP TER 92 48.040 2 1tuzA ATOM 2001 CA ALA 21 -13.615 -1.139 -2.337 7 LEU ATOM 2002 CA TYR 22 -11.221 -3.857 -3.439 8 ILE ATOM 2003 CA THR 24 -13.417 -6.902 -3.920 9 SER ATOM 2004 CA ALA 25 -12.978 -9.994 -1.738 10 PRO ATOM 2005 CA MET 26 -10.511 -11.186 -4.349 11 SER ATOM 2006 CA LYS 27 -7.806 -8.657 -3.566 12 ASP ATOM 2007 CA LEU 28 -8.667 -8.616 0.120 13 PHE ATOM 2008 CA ARG 29 -8.604 -12.400 0.165 14 ALA ATOM 2009 CA ARG 30 -5.156 -12.603 -1.382 15 GLN ATOM 2010 CA LEU 31 -3.730 -10.001 0.968 16 LEU ATOM 2011 CA GLN 32 -5.797 -11.481 3.773 17 GLN ATOM 2012 CA LYS 33 -4.751 -15.075 3.213 18 LYS ATOM 2013 CA ALA 34 -1.289 -13.644 2.674 19 TYR ATOM 2014 CA LEU 35 -1.074 -11.779 5.960 20 MET ATOM 2015 CA CYS 36 -3.082 -14.531 7.608 21 GLU ATOM 2016 CA LEU 37 -0.022 -16.759 7.617 22 TYR ATOM 2017 CA ASP 38 2.282 -13.794 8.095 23 SER ATOM 2018 CA LEU 39 2.823 -12.107 11.439 24 THR ATOM 2019 CA LEU 40 4.810 -9.095 10.297 25 LYS ATOM 2020 CA SER 41 3.647 -5.512 10.657 26 LYS ATOM 2021 CA LEU 42 3.126 -2.776 8.094 27 VAL ATOM 2022 CA SER 43 4.801 -0.395 10.514 28 SER ATOM 2023 CA ALA 44 7.796 -2.706 10.387 29 ASP ATOM 2024 CA ALA 45 8.137 -2.506 6.623 30 VAL ATOM 2025 CA CYS 46 7.279 1.175 6.813 31 LEU ATOM 2026 CA ASP 47 10.463 1.946 8.709 32 LYS ATOM 2027 CA ALA 48 12.229 -0.287 6.215 33 LEU ATOM 2028 CA LEU 49 11.247 2.136 3.479 34 PHE ATOM 2029 CA ASP 50 11.955 5.018 5.829 35 GLU ATOM 2030 CA GLN 51 15.452 4.180 7.010 36 ASP ATOM 2031 CA ASN 53 15.725 0.590 5.844 37 GLY ATOM 2032 CA LEU 54 17.172 -0.321 2.467 38 GLU ATOM 2033 CA LYS 55 13.723 0.034 0.948 39 MET ATOM 2034 CA GLN 56 14.234 3.739 1.531 40 ALA ATOM 2035 CA ASN 57 11.000 10.017 -2.615 44 GLN ATOM 2036 CA ASP 58 10.856 11.836 0.701 45 GLY ATOM 2037 CA GLN 59 7.545 10.818 2.227 46 ASP ATOM 2038 CA PRO 60 6.178 9.315 -0.967 47 ALA ATOM 2039 CA MET 61 7.078 6.207 -2.931 48 ILE ATOM 2040 CA ASP 62 6.614 5.422 -6.604 49 GLY ATOM 2041 CA ILE 63 4.651 2.570 -8.134 50 TYR ATOM 2042 CA LEU 64 7.596 0.376 -9.047 51 GLU ATOM 2043 CA GLN 65 9.261 0.939 -5.695 52 GLY ATOM 2044 CA ILE 66 5.953 -0.052 -4.145 53 PHE ATOM 2045 CA ILE 67 6.386 -3.480 -5.688 54 GLN ATOM 2046 CA ASN 68 9.220 -4.184 -3.280 55 GLN ATOM 2047 CA CYS 69 6.773 -3.416 -0.497 56 PHE ATOM 2048 CA LEU 70 4.511 -6.317 -1.388 57 LEU ATOM 2049 CA THR 71 7.712 -8.325 -1.618 58 LYS ATOM 2050 CA THR 72 8.864 -7.740 1.939 59 ILE ATOM 2051 CA ILE 73 5.348 -7.130 3.201 60 TYR ATOM 2052 CA TYR 74 3.970 -10.506 2.183 61 LEU ATOM 2053 CA ASP 75 7.566 -11.688 2.161 62 GLU ATOM 2054 CA ARG 76 6.600 -13.055 -1.234 63 VAL ATOM 2055 CA LEU 77 9.147 -13.751 -3.945 64 ASP ATOM 2056 CA ASN 86 6.862 -12.253 -6.564 65 ASN ATOM 2057 CA VAL 87 3.648 -10.287 -6.201 66 VAL ATOM 2058 CA VAL 91 0.897 -10.252 -8.837 67 PRO ATOM 2059 CA ASP 92 0.619 -7.071 -10.870 68 ARG ATOM 2060 CA MET 93 -3.133 -7.568 -10.831 69 HIS ATOM 2061 CA CYS 94 -3.294 -6.925 -7.105 70 LEU ATOM 2062 CA LEU 95 -0.580 -4.299 -7.356 71 SER ATOM 2063 CA ASN 96 -2.879 -2.494 -9.761 72 LEU ATOM 2064 CA TRP 97 -5.854 -2.689 -7.430 73 ALA ATOM 2065 CA LEU 98 -3.443 -1.869 -4.631 74 LEU ATOM 2066 CA LEU 99 -2.452 1.486 -6.076 75 PHE ATOM 2067 CA ASN 100 -5.996 2.214 -7.188 76 GLN ATOM 2068 CA VAL 101 -7.009 1.918 -3.553 77 SER ATOM 2069 CA TYR 102 -4.890 4.911 -2.615 78 PHE ATOM 2070 CA ASP 103 -3.031 7.377 -4.804 79 GLU ATOM 2071 CA THR 104 -1.996 11.009 -5.062 80 THR ATOM 2072 CA GLY 105 -0.553 13.385 -7.630 81 GLY ATOM 2073 CA ARG 106 5.139 11.077 -14.620 90 THR ATOM 2074 CA THR 107 6.873 9.626 -11.585 91 LYS ATOM 2075 CA GLY 108 3.735 9.084 -9.539 92 ASP ATOM 2076 CA ARG 109 4.379 8.848 -5.817 93 VAL ATOM 2077 CA ILE 110 2.060 7.817 -3.008 94 VAL ATOM 2078 CA ARG 111 1.940 8.540 0.705 95 CYS ATOM 2079 CA VAL 112 3.001 5.623 2.871 96 LEU ATOM 2080 CA LEU 113 1.084 6.883 5.881 97 ASN ATOM 2081 CA SER 114 -1.989 6.718 3.678 98 ASP ATOM 2082 CA PHE 115 -1.291 3.143 2.650 99 VAL ATOM 2083 CA LYS 116 -0.224 2.343 6.192 100 SER ATOM 2084 CA THR 117 -3.670 3.476 7.273 101 CYS ATOM 2085 CA GLY 118 -5.589 1.473 4.698 102 TYR ATOM 2086 CA ILE 119 -3.456 -1.566 5.435 103 PHE ATOM 2087 CA ILE 120 -3.868 -0.963 9.149 104 SER ATOM 2088 CA SER 121 -7.506 -1.837 8.577 105 LEU ATOM 2089 CA LEU 122 -6.633 -5.242 7.173 106 LEU ATOM 2090 CA CYS 123 -4.662 -6.327 10.217 107 GLU ATOM 2091 CA LYS 124 -7.244 -4.515 12.309 108 GLY ATOM 2092 CA ALA 125 -7.570 -0.746 12.198 109 GLY TER 85 46.810 3 5x9aA1 ATOM 3001 CA ALA 25 25.830 18.120 21.334 2 GLN ATOM 3002 CA MET 26 29.622 18.360 21.329 3 LYS ATOM 3003 CA LYS 27 29.623 19.323 17.685 4 LEU ATOM 3004 CA LEU 28 27.065 21.997 18.565 5 ALA ATOM 3005 CA ARG 29 29.146 23.293 21.502 6 GLU ATOM 3006 CA ARG 30 32.166 23.463 19.216 7 GLU ATOM 3007 CA LEU 31 30.346 25.057 16.338 8 LEU ATOM 3008 CA GLN 32 28.567 27.693 18.464 9 TYR ATOM 3009 CA LYS 33 30.870 33.327 12.645 13 CYS ATOM 3010 CA ALA 34 27.072 32.758 12.399 14 GLN ATOM 3011 CA LEU 35 25.165 35.504 14.168 15 LYS ATOM 3012 CA CYS 36 21.554 34.436 14.480 16 HIS ATOM 3013 CA LEU 37 21.207 31.006 16.013 17 PHE ATOM 3014 CA ASP 38 21.274 29.791 19.598 18 THR ATOM 3015 CA LEU 39 23.363 26.837 20.510 19 LYS ATOM 3016 CA LEU 40 20.186 24.640 20.731 20 THR ATOM 3017 CA SER 41 19.254 25.879 17.237 21 GLU ATOM 3018 CA LEU 42 22.711 24.995 16.038 22 VAL ATOM 3019 CA SER 43 22.242 21.529 17.416 23 GLU ATOM 3020 CA ALA 44 18.938 21.269 15.479 24 SER ATOM 3021 CA ALA 45 20.686 22.333 12.285 25 LEU ATOM 3022 CA CYS 46 23.439 19.781 12.770 26 ILE ATOM 3023 CA ASP 47 20.867 17.032 13.270 27 ILE ATOM 3024 CA ALA 48 19.006 18.298 10.184 28 CYS ATOM 3025 CA LEU 49 22.149 18.187 8.110 29 TYR ATOM 3026 CA ASP 50 22.932 14.676 9.206 30 LYS ATOM 3027 CA GLN 51 19.306 13.537 8.636 31 ASN ATOM 3028 CA HIS 52 19.623 14.785 5.023 32 LEU ATOM 3029 CA ASN 53 23.093 13.571 4.171 33 LEU ATOM 3030 CA ASN 57 23.288 10.964 1.396 34 GLU ATOM 3031 CA ASP 58 26.984 10.028 1.591 35 GLY ATOM 3032 CA GLN 59 29.557 11.295 4.047 36 LEU ATOM 3033 CA PRO 60 29.297 15.004 2.951 37 LYS ATOM 3034 CA MET 61 26.856 17.533 1.522 38 MET ATOM 3035 CA ASP 62 27.950 17.996 -2.110 39 ASP ATOM 3036 CA ILE 63 26.498 20.207 -4.827 40 ARG ATOM 3037 CA LEU 64 23.868 17.763 -5.986 41 ASN ATOM 3038 CA GLN 65 22.393 17.410 -2.499 42 LEU ATOM 3039 CA ILE 66 22.629 21.159 -1.862 43 PHE ATOM 3040 CA ILE 67 20.835 21.932 -5.100 44 ARG ATOM 3041 CA ASN 68 18.014 19.496 -4.226 45 ASP ATOM 3042 CA CYS 69 17.606 21.310 -0.915 46 ILE ATOM 3043 CA LEU 70 17.461 24.678 -2.639 47 LEU ATOM 3044 CA THR 71 14.994 23.338 -5.207 48 HIS ATOM 3045 CA THR 72 12.665 21.362 -2.848 49 GLN ATOM 3046 CA ILE 73 12.753 23.463 0.330 50 LYS ATOM 3047 CA TYR 74 13.552 26.939 -0.874 51 PHE ATOM 3048 CA ASP 75 11.746 26.996 -4.238 52 ASN ATOM 3049 CA ARG 76 14.716 27.903 -6.429 53 MET ATOM 3050 CA VAL 85 14.370 26.450 -9.955 54 THR ATOM 3051 CA ASN 86 17.225 27.674 -12.100 55 GLU ATOM 3052 CA ASP 92 20.621 26.125 -12.495 56 ASP ATOM 3053 CA MET 93 22.512 29.396 -12.639 57 LEU ATOM 3054 CA CYS 94 20.974 30.694 -9.460 58 LEU ATOM 3055 CA LEU 95 21.464 27.424 -7.561 59 MET ATOM 3056 CA ASN 96 25.116 27.213 -8.665 60 ASP ATOM 3057 CA TRP 97 25.776 30.726 -7.357 61 ARG ATOM 3058 CA LEU 98 24.053 30.053 -3.996 62 VAL ATOM 3059 CA LEU 99 26.121 26.880 -3.609 63 PHE ATOM 3060 CA ASN 100 29.327 28.800 -4.247 64 ARG ATOM 3061 CA VAL 101 28.388 31.415 -1.690 65 ALA ATOM 3062 CA TYR 102 27.730 28.776 0.961 66 PHE ATOM 3063 CA ASP 103 30.907 26.889 -0.018 67 ASP ATOM 3064 CA THR 104 33.230 29.490 1.457 68 LYS ATOM 3065 CA GLY 105 36.437 27.428 1.151 69 ASP ATOM 3066 CA ARG 106 35.628 26.428 -2.436 70 SER ATOM 3067 CA THR 107 36.168 22.704 -1.694 71 ASP ATOM 3068 CA GLY 108 32.905 21.649 -3.377 72 SER ATOM 3069 CA ARG 109 31.240 20.413 -0.144 73 TYR ATOM 3070 CA ILE 110 29.105 22.272 2.377 74 ILE ATOM 3071 CA ARG 111 30.547 21.632 5.770 75 SER ATOM 3072 CA VAL 112 28.455 21.754 8.959 76 LEU ATOM 3073 CA LEU 113 29.856 25.178 9.676 77 THR ATOM 3074 CA SER 114 29.072 26.386 6.234 78 GLU ATOM 3075 CA PHE 115 25.512 25.042 6.447 79 TRP ATOM 3076 CA LYS 116 24.877 26.910 9.708 80 VAL ATOM 3077 CA THR 117 26.585 30.137 8.627 81 GLU ATOM 3078 CA GLY 118 24.926 30.118 5.272 82 GLY ATOM 3079 CA ILE 119 21.514 29.418 6.778 83 LEU ATOM 3080 CA ILE 120 22.059 32.166 9.410 84 SER ATOM 3081 CA SER 121 22.364 34.736 6.643 85 VAL ATOM 3082 CA LEU 122 19.904 33.041 4.495 86 PHE ATOM 3083 CA CYS 123 17.046 32.770 7.007 87 LEU ATOM 3084 CA LYS 124 17.772 35.597 9.487 88 ARG ATOM 3085 CA ALA 125 20.365 37.821 7.878 89 GLY TER