2 119 (N_temp, Lch) 119 269.160 1 2xzmK ATOM 1001 CA LYS 1 -130.067 -24.058-149.169 12 ALA ATOM 1002 CA ARG 2 -132.290 -21.308-147.731 13 ASN ATOM 1003 CA GLN 3 -133.316 -23.046-144.509 14 GLU ATOM 1004 CA VAL 4 -130.869 -22.247-141.690 15 ASN ATOM 1005 CA ALA 5 -130.034 -24.783-138.987 16 VAL ATOM 1006 CA SER 6 -129.060 -23.532-135.563 17 PHE ATOM 1007 CA GLY 7 -126.520 -24.884-133.112 18 GLY ATOM 1008 CA ARG 8 -125.499 -23.149-129.913 19 VAL ATOM 1009 CA ALA 9 -121.710 -23.148-129.582 20 CYS ATOM 1010 CA TYR 10 -120.355 -22.571-126.051 21 HIS ATOM 1011 CA ILE 11 -116.682 -21.496-125.885 22 ILE ATOM 1012 CA HIS 12 -114.744 -21.227-122.623 23 MET ATOM 1013 CA ALA 13 -111.220 -19.770-123.068 24 ALA ATOM 1014 CA SER 14 -108.935 -20.154-119.999 25 THR ATOM 1015 CA TYR 15 -105.211 -19.381-119.934 26 TRP ATOM 1016 CA ASN 16 -104.565 -23.114-119.575 27 ASN ATOM 1017 CA ASN 17 -107.218 -24.936-121.574 28 ASP ATOM 1018 CA THR 18 -109.842 -24.066-124.207 29 THR ATOM 1019 CA ILE 19 -113.275 -25.642-124.784 30 PHE ATOM 1020 CA VAL 20 -115.598 -25.681-127.784 31 ILE ATOM 1021 CA THR 21 -119.073 -27.077-127.337 32 HIS ATOM 1022 CA ILE 22 -122.100 -27.320-129.649 33 VAL ATOM 1023 CA THR 23 -125.632 -28.027-128.517 34 THR ATOM 1024 CA ASP 24 -129.362 -27.697-129.200 35 ASP ATOM 1025 CA PRO 25 -130.611 -24.158-128.761 36 LEU ATOM 1026 CA ASP 26 -131.943 -25.477-125.435 37 SER ATOM 1027 CA GLY 27 -128.508 -26.703-124.446 38 GLY ATOM 1028 CA ASN 28 -129.620 -29.950-122.805 39 ARG ATOM 1029 CA PRO 29 -124.596 -32.399-126.187 41 THR ATOM 1030 CA ILE 30 -123.404 -32.962-129.746 42 LEU ATOM 1031 CA THR 31 -119.845 -31.884-130.496 43 VAL ATOM 1032 CA TRP 32 -117.141 -31.384-127.805 44 ARG ATOM 1033 CA SER 33 -113.540 -30.537-128.811 45 VAL ATOM 1034 CA SER 34 -110.909 -29.241-126.344 46 THR ATOM 1035 CA GLY 35 -107.328 -28.145-126.955 47 GLY ATOM 1036 CA GLY 36 -106.210 -31.124-124.854 48 GLY ATOM 1037 CA VAL 37 -107.594 -33.571-127.415 49 MET ATOM 1038 CA ILE 38 -105.469 -31.606-129.899 50 LYS ATOM 1039 CA GLY 39 -101.875 -31.563-128.585 51 VAL ATOM 1040 CA TYR 40 -99.265 -33.320-126.441 52 LYS ATOM 1041 CA LYS 41 -97.673 -30.662-124.199 53 ALA ATOM 1042 CA GLY 42 -99.825 -29.538-121.235 54 ASP ATOM 1043 CA SER 43 -98.701 -25.948-121.890 55 ARG ATOM 1044 CA ARG 44 -100.147 -26.052-125.360 56 GLU ATOM 1045 CA LYS 45 -103.491 -27.223-123.985 57 GLU ATOM 1046 CA GLY 46 -104.496 -23.564-124.663 58 SER ATOM 1047 CA THR 47 -102.743 -22.442-127.870 59 SER ATOM 1048 CA PRO 48 -104.060 -20.692-131.023 60 PRO ATOM 1049 CA TYR 49 -103.197 -23.883-132.901 61 TYR ATOM 1050 CA ALA 50 -105.195 -26.159-130.565 62 ALA ATOM 1051 CA ALA 51 -108.102 -23.764-131.181 63 ALA ATOM 1052 CA GLN 52 -107.840 -24.083-134.955 64 MET ATOM 1053 CA LEU 53 -107.852 -27.880-134.896 65 GLN ATOM 1054 CA ALA 54 -110.519 -28.242-132.206 66 ALA ATOM 1055 CA ALA 55 -112.518 -25.696-134.205 67 ALA ATOM 1056 CA LEU 56 -112.162 -27.143-137.693 68 ILE ATOM 1057 CA ASP 57 -112.676 -30.586-136.145 69 ASP ATOM 1058 CA ALA 58 -116.149 -29.505-134.997 70 VAL ATOM 1059 CA ALA 59 -117.238 -27.883-138.304 71 VAL ATOM 1060 CA LYS 60 -116.670 -31.153-140.159 72 ASN ATOM 1061 CA LYS 61 -118.664 -33.035-137.529 73 ARG ATOM 1062 CA ALA 62 -121.315 -30.309-137.891 74 CYS ATOM 1063 CA MET 63 -121.888 -30.517-141.664 75 LYS ATOM 1064 CA ALA 64 -122.789 -34.129-140.824 76 GLU ATOM 1065 CA TYR 65 -125.309 -33.099-138.149 77 LEU ATOM 1066 CA GLY 66 -126.657 -31.057-141.066 78 LYS ATOM 1067 CA MET 67 -126.110 -27.813-139.102 79 ILE ATOM 1068 CA GLN 68 -124.623 -24.721-140.745 80 ASN ATOM 1069 CA SER 69 -125.340 -21.862-138.335 81 ALA ATOM 1070 CA VAL 70 -124.010 -21.491-134.837 82 LEU ATOM 1071 CA ASP 71 -124.961 -19.303-131.893 83 HIS ATOM 1072 CA VAL 72 -122.001 -18.344-129.782 84 ILE ATOM 1073 CA ILE 73 -121.942 -18.137-126.012 85 LYS ATOM 1074 CA VAL 74 -118.424 -17.030-125.135 86 LEU ATOM 1075 CA ARG 75 -117.133 -17.215-121.560 87 ARG ATOM 1076 CA GLY 76 -113.944 -17.460-119.506 88 ALA ATOM 1077 CA THR 77 -111.354 -14.271-122.415 97 PRO ATOM 1078 CA GLY 78 -108.368 -16.545-122.895 98 GLY ATOM 1079 CA ALA 79 -106.235 -16.605-126.080 99 PRO ATOM 1080 CA GLY 80 -107.803 -19.583-127.801 100 GLY ATOM 1081 CA ARG 81 -110.921 -17.467-127.932 101 ALA ATOM 1082 CA GLU 82 -110.661 -15.158-130.974 102 GLN ATOM 1083 CA GLN 83 -108.839 -18.101-132.467 103 SER ATOM 1084 CA ALA 84 -111.716 -20.605-132.141 104 ALA ATOM 1085 CA ILE 85 -114.371 -18.340-133.592 105 LEU ATOM 1086 CA ARG 86 -112.092 -17.300-136.457 106 ARG ATOM 1087 CA ALA 87 -111.665 -20.974-137.364 107 ALA ATOM 1088 CA LEU 88 -115.403 -21.696-137.422 108 LEU ATOM 1089 CA GLN 89 -116.052 -18.730-139.724 109 ALA ATOM 1090 CA ALA 90 -113.215 -19.578-142.121 110 ARG ATOM 1091 CA SER 91 -114.067 -23.310-142.399 111 SER ATOM 1092 CA GLY 92 -117.466 -22.230-143.708 112 GLY ATOM 1093 CA LEU 93 -119.886 -22.052-140.778 113 MET ATOM 1094 CA GLN 94 -122.605 -19.442-140.515 114 LYS ATOM 1095 CA VAL 95 -122.660 -17.414-137.273 115 ILE ATOM 1096 CA LYS 96 -125.854 -16.560-135.399 116 GLY ATOM 1097 CA SER 97 -125.990 -14.050-132.583 117 ARG ATOM 1098 CA ILE 98 -122.974 -13.666-130.266 118 ILE ATOM 1099 CA VAL 99 -123.152 -13.348-126.462 119 GLU ATOM 1100 CA ASP 100 -120.560 -12.999-123.705 120 ASP ATOM 1101 CA ASP 101 -121.540 -15.164-120.753 121 VAL ATOM 1102 CA THR 102 -118.623 -14.898-118.397 122 THR ATOM 1103 CA PRO 103 -120.469 -15.123-115.079 123 PRO ATOM 1104 CA VAL 104 -119.793 -11.799-113.348 124 ILE ATOM 1105 CA PRO 105 -120.763 -12.043-109.652 125 PRO ATOM 1106 CA HIS 106 -122.468 -9.373-107.542 126 THR ATOM 1107 CA ASN 107 -120.333 -9.935-104.436 127 ASP ATOM 1108 CA GLY 108 -117.163 -12.013-104.525 128 SER ATOM 1109 CA CYS 109 -115.232 -14.574-102.492 129 THR ATOM 1110 CA ARG 110 -111.562 -14.562-101.429 130 ARG ATOM 1111 CA PRO 111 -109.728 -15.043-104.745 131 ARG ATOM 1112 CA LYS 112 -106.704 -16.978-105.856 132 GLU ATOM 1113 CA LYS 113 -103.757 -16.438-103.554 133 GLY ATOM 1114 CA LYS 114 -104.470 -14.141-100.655 134 GLY ATOM 1115 CA PHE 115 -103.674 -10.672 -99.380 135 ARG ATOM 1116 CA ARG 116 -100.730 -10.440-101.770 136 ARG ATOM 1117 CA LYS 117 -101.320 -13.124-104.428 137 GLY ATOM 1118 CA ALA 118 -98.986 -14.622-107.062 138 ARG ATOM 1119 CA SER 119 -95.619 -13.088-106.129 139 ARG TER 117 263.830 2 5mrcKK ATOM 2001 CA LYS 1 196.007 196.563 303.773 1 LYS ATOM 2002 CA ARG 2 194.014 198.163 300.927 2 GLU ATOM 2003 CA GLN 3 190.744 199.844 301.966 3 GLU ATOM 2004 CA VAL 4 188.773 201.691 299.267 4 VAL ATOM 2005 CA ALA 5 187.657 204.982 300.879 5 VAL ATOM 2006 CA SER 6 185.691 206.436 297.965 6 LYS ATOM 2007 CA GLY 7 185.511 206.408 294.169 7 TYR ATOM 2008 CA ARG 8 186.195 209.387 291.883 8 ILE ATOM 2009 CA ALA 9 184.406 209.758 288.520 9 LEU ATOM 2010 CA TYR 10 186.590 211.893 286.225 10 HIS ATOM 2011 CA ILE 11 185.288 213.293 282.920 11 GLY ATOM 2012 CA HIS 12 187.574 215.162 280.511 12 LYS ATOM 2013 CA ALA 13 185.303 216.716 277.861 13 PHE ATOM 2014 CA SER 14 187.389 218.214 275.044 14 THR ATOM 2015 CA TYR 15 186.216 219.694 271.716 15 LYS ATOM 2016 CA ASN 16 186.750 216.457 269.751 16 ASN ATOM 2017 CA ASN 17 186.346 213.648 272.333 17 ASN ATOM 2018 CA THR 18 185.290 212.636 275.870 18 THR ATOM 2019 CA ILE 19 187.292 210.655 278.450 19 HIS ATOM 2020 CA VAL 20 185.357 209.070 281.314 20 LEU ATOM 2021 CA THR 21 187.425 207.468 284.083 21 THR ATOM 2022 CA ILE 22 186.463 205.637 287.287 22 PHE ATOM 2023 CA THR 23 189.042 205.222 290.049 23 SER ATOM 2024 CA ASP 24 189.177 203.948 293.644 24 SER ATOM 2025 CA PRO 25 190.826 206.005 296.401 25 VAL ATOM 2026 CA ASP 26 192.927 203.271 298.061 26 VAL ATOM 2027 CA GLY 27 193.846 204.016 301.697 27 GLU ATOM 2028 CA ASN 28 196.226 201.684 303.555 28 ASP ATOM 2029 CA PRO 29 192.005 203.263 287.844 47 VAL ATOM 2030 CA ILE 30 189.115 200.784 287.509 48 LYS ATOM 2031 CA THR 31 187.432 201.557 284.166 49 ILE ATOM 2032 CA TRP 32 188.802 204.000 281.601 50 SER ATOM 2033 CA SER 33 186.504 204.962 278.734 51 LEU ATOM 2034 CA SER 34 186.524 207.183 275.660 52 SER ATOM 2035 CA GLY 35 183.594 207.539 273.271 53 THR ATOM 2036 CA GLY 36 185.461 205.751 270.427 54 GLY ATOM 2037 CA VAL 37 185.371 202.617 272.635 55 CYS ATOM 2038 CA ILE 38 181.585 202.686 271.976 56 LEU ATOM 2039 CA GLY 39 182.216 202.455 268.187 57 GLY ATOM 2040 CA TYR 40 182.006 206.169 267.299 58 PHE ATOM 2041 CA LYS 41 184.653 206.809 264.632 59 ARG ATOM 2042 CA GLY 42 186.544 210.040 263.870 60 LYS ATOM 2043 CA SER 43 184.055 212.994 263.939 61 ALA ATOM 2044 CA ARG 44 180.964 211.492 265.624 62 ALA ATOM 2045 CA LYS 45 183.020 210.967 268.820 63 ARG ATOM 2046 CA GLY 46 183.115 214.784 269.283 64 GLY ATOM 2047 CA THR 47 179.303 214.855 269.392 65 GLU ATOM 2048 CA PRO 48 176.705 214.947 272.169 66 TYR ATOM 2049 CA TYR 49 174.929 211.614 271.661 67 GLU ATOM 2050 CA ALA 50 178.198 209.665 271.575 68 ALA ATOM 2051 CA ALA 51 179.265 211.181 274.919 69 ALA ATOM 2052 CA GLN 52 175.875 210.314 276.456 70 PHE ATOM 2053 CA LEU 53 176.225 206.704 275.255 71 GLN ATOM 2054 CA ALA 54 179.740 206.490 276.734 72 THR ATOM 2055 CA ALA 55 178.440 207.841 280.048 73 SER ATOM 2056 CA LEU 56 175.658 205.231 280.026 74 GLY ATOM 2057 CA ASP 57 178.188 202.473 279.289 75 ARG ATOM 2058 CA ALA 58 180.388 203.698 282.142 76 MET ATOM 2059 CA ALA 59 177.388 203.642 284.513 77 PHE ATOM 2060 CA LYS 60 176.533 200.085 283.413 78 GLU ATOM 2061 CA LYS 61 180.138 198.994 284.069 79 LEU ATOM 2062 CA ALA 62 180.054 200.587 287.543 80 ILE ATOM 2063 CA MET 63 176.791 198.766 288.301 81 LYS ATOM 2064 CA ALA 64 178.052 195.364 287.108 82 GLU ATOM 2065 CA TYR 65 181.701 195.392 288.221 83 LYS ATOM 2066 CA GLY 66 180.550 196.328 291.768 84 ASN ATOM 2067 CA MET 67 182.220 199.628 292.677 85 MET ATOM 2068 CA GLN 68 181.338 203.374 298.823 88 LYS ATOM 2069 CA SER 69 180.632 207.031 297.961 89 ASP ATOM 2070 CA VAL 70 181.487 208.668 294.607 90 ILE ATOM 2071 CA ASP 71 183.084 212.043 293.682 91 GLU ATOM 2072 CA VAL 72 182.318 213.589 290.249 92 VAL ATOM 2073 CA ILE 73 184.855 215.931 288.554 93 VAL ATOM 2074 CA VAL 74 185.049 217.536 285.057 94 MET ATOM 2075 CA ARG 75 187.326 219.265 282.507 95 ASP ATOM 2076 CA GLY 76 187.234 221.465 279.364 96 ASP ATOM 2077 CA THR 77 183.496 222.323 278.758 97 PHE ATOM 2078 CA GLY 78 182.809 220.212 275.644 98 GLY ATOM 2079 CA ALA 79 179.422 219.125 274.300 99 LYS ATOM 2080 CA GLY 80 180.138 215.792 275.986 100 GLY ATOM 2081 CA ARG 81 180.207 217.417 279.430 101 ARG ATOM 2082 CA GLU 82 176.588 218.489 278.879 102 ALA ATOM 2083 CA GLN 83 175.750 214.904 277.821 103 ALA ATOM 2084 CA ALA 84 177.424 213.347 280.838 104 PHE ATOM 2085 CA ILE 85 175.576 215.493 283.393 105 ILE ATOM 2086 CA ARG 86 172.240 214.816 281.630 106 SER ATOM 2087 CA ALA 87 172.947 211.063 281.689 107 ALA ATOM 2088 CA LEU 88 173.803 211.248 285.398 108 LEU ATOM 2089 CA GLN 89 170.557 213.140 286.100 109 VAL ATOM 2090 CA ALA 90 168.385 210.650 284.186 110 GLY ATOM 2091 CA SER 91 167.591 206.942 284.524 111 LYS ATOM 2092 CA GLY 92 172.810 207.053 286.034 113 GLY ATOM 2093 CA LEU 93 170.025 206.125 288.479 114 ALA ATOM 2094 CA GLN 94 176.376 207.327 296.071 119 LYS ATOM 2095 CA VAL 95 177.581 210.628 294.486 120 VAL ATOM 2096 CA LYS 96 178.639 212.737 297.501 121 VAL ATOM 2097 CA SER 97 180.170 215.745 295.688 122 LYS ATOM 2098 CA ILE 98 180.458 217.274 292.219 123 ILE ATOM 2099 CA VAL 99 183.650 219.347 291.904 124 SER ATOM 2100 CA ASP 100 185.058 220.903 288.725 125 ASP ATOM 2101 CA ASP 101 188.813 221.110 288.061 126 ALA ATOM 2102 CA THR 102 189.411 222.704 284.634 127 THR ATOM 2103 CA PRO 103 192.998 223.844 284.053 128 LYS ATOM 2104 CA VAL 104 193.798 227.484 283.240 129 LEU ATOM 2105 CA PRO 105 197.083 229.409 282.933 130 LYS ATOM 2106 CA HIS 106 198.193 232.696 284.520 131 PHE ATOM 2107 CA ASN 107 200.291 233.710 281.521 132 GLY ATOM 2108 CA GLY 108 202.345 230.586 280.833 133 GLY ATOM 2109 CA CYS 109 203.202 229.070 277.454 134 VAL ATOM 2110 CA ARG 110 201.971 231.039 274.415 135 ARG ATOM 2111 CA PRO 111 199.072 229.409 272.568 136 SER ATOM 2112 CA LYS 112 198.973 228.787 268.781 137 PRO ATOM 2113 CA LYS 113 198.337 231.677 266.359 138 LYS ATOM 2114 CA LYS 114 194.595 232.242 265.818 139 MET ATOM 2115 CA PHE 115 193.728 230.280 262.650 140 ARG ATOM 2116 CA ARG 116 192.491 232.395 259.720 141 ARG ATOM 2117 CA LYS 117 190.005 230.025 258.010 142 LEU TER