USER MOD reduce.3.24.130724 H: found=0, std=0, add=157, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 160 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : B 204 SER OG : rot 180:sc= 0 USER MOD Single : B 207 SER OG : rot 180:sc= 0.115 USER MOD ----------------------------------------------------------------- ATOM 1105 N ARG B 201 3.790 13.848 3.313 1.00 0.00 N ATOM 1106 CA ARG B 201 2.401 13.388 3.426 1.00 0.00 C ATOM 1107 C ARG B 201 2.351 11.863 3.375 1.00 0.00 C ATOM 1108 O ARG B 201 3.300 11.246 2.894 1.00 0.00 O ATOM 1109 CB ARG B 201 1.490 14.015 2.347 1.00 0.00 C ATOM 1110 CG ARG B 201 1.958 13.855 0.887 1.00 0.00 C ATOM 1111 CD ARG B 201 2.709 15.083 0.349 1.00 0.00 C ATOM 1112 NE ARG B 201 1.794 16.178 -0.040 1.00 0.00 N ATOM 1113 CZ ARG B 201 2.033 17.494 0.095 1.00 0.00 C ATOM 1114 NH1 ARG B 201 2.958 17.938 0.948 1.00 0.00 N ATOM 1115 NH2 ARG B 201 1.332 18.354 -0.645 1.00 0.00 N ATOM 0 HA ARG B 201 2.015 13.721 4.389 1.00 0.00 H new ATOM 0 HB2 ARG B 201 0.497 13.575 2.439 1.00 0.00 H new ATOM 0 HB3 ARG B 201 1.388 15.079 2.560 1.00 0.00 H new ATOM 0 HG2 ARG B 201 2.606 12.982 0.815 1.00 0.00 H new ATOM 0 HG3 ARG B 201 1.091 13.662 0.254 1.00 0.00 H new ATOM 0 HD2 ARG B 201 3.401 15.444 1.110 1.00 0.00 H new ATOM 0 HD3 ARG B 201 3.308 14.790 -0.513 1.00 0.00 H new ATOM 0 HE ARG B 201 0.899 15.910 -0.449 1.00 0.00 H new ATOM 0 HH11 ARG B 201 3.495 17.276 1.508 1.00 0.00 H new ATOM 0 HH12 ARG B 201 3.128 18.939 1.040 1.00 0.00 H new ATOM 0 HH21 ARG B 201 0.629 18.009 -1.299 1.00 0.00 H new ATOM 0 HH22 ARG B 201 1.499 19.356 -0.557 1.00 0.00 H new ATOM 1131 N ARG B 202 1.219 11.312 3.809 1.00 0.00 N ATOM 1132 CA ARG B 202 0.694 9.969 3.633 1.00 0.00 C ATOM 1133 C ARG B 202 1.739 8.879 3.892 1.00 0.00 C ATOM 1134 O ARG B 202 2.254 8.271 2.960 1.00 0.00 O ATOM 1135 CB ARG B 202 -0.002 9.875 2.254 1.00 0.00 C ATOM 1136 CG ARG B 202 -1.303 9.069 2.338 1.00 0.00 C ATOM 1137 CD ARG B 202 -2.489 9.989 2.688 1.00 0.00 C ATOM 1138 NE ARG B 202 -3.664 9.256 3.183 1.00 0.00 N ATOM 1139 CZ ARG B 202 -4.303 8.227 2.620 1.00 0.00 C ATOM 1140 NH1 ARG B 202 -4.017 7.791 1.399 1.00 0.00 N ATOM 1141 NH2 ARG B 202 -5.251 7.646 3.332 1.00 0.00 N ATOM 0 H ARG B 202 0.571 11.873 4.362 1.00 0.00 H new ATOM 0 HA ARG B 202 -0.060 9.776 4.396 1.00 0.00 H new ATOM 0 HB2 ARG B 202 -0.217 10.878 1.884 1.00 0.00 H new ATOM 0 HB3 ARG B 202 0.672 9.408 1.536 1.00 0.00 H new ATOM 0 HG2 ARG B 202 -1.491 8.571 1.387 1.00 0.00 H new ATOM 0 HG3 ARG B 202 -1.206 8.289 3.093 1.00 0.00 H new ATOM 0 HD2 ARG B 202 -2.172 10.708 3.444 1.00 0.00 H new ATOM 0 HD3 ARG B 202 -2.771 10.560 1.803 1.00 0.00 H new ATOM 0 HE ARG B 202 -4.041 9.576 4.075 1.00 0.00 H new ATOM 0 HH11 ARG B 202 -3.285 8.246 0.854 1.00 0.00 H new ATOM 0 HH12 ARG B 202 -4.530 7.001 1.006 1.00 0.00 H new ATOM 0 HH21 ARG B 202 -5.467 7.987 4.269 1.00 0.00 H new ATOM 0 HH22 ARG B 202 -5.768 6.856 2.945 1.00 0.00 H new ATOM 1155 N GLY B 203 2.044 8.602 5.162 1.00 0.00 N ATOM 1156 CA GLY B 203 3.049 7.603 5.502 1.00 0.00 C ATOM 1157 C GLY B 203 2.883 7.094 6.924 1.00 0.00 C ATOM 1158 O GLY B 203 3.534 7.593 7.837 1.00 0.00 O ATOM 0 H GLY B 203 1.609 9.055 5.966 1.00 0.00 H new ATOM 0 HA2 GLY B 203 2.979 6.767 4.807 1.00 0.00 H new ATOM 0 HA3 GLY B 203 4.043 8.034 5.384 1.00 0.00 H new ATOM 1162 N SER B 204 2.000 6.119 7.134 1.00 0.00 N ATOM 1163 CA SER B 204 1.853 5.348 8.328 1.00 0.00 C ATOM 1164 C SER B 204 2.025 3.871 7.912 1.00 0.00 C ATOM 1165 O SER B 204 3.070 3.549 7.354 1.00 0.00 O ATOM 1166 CB SER B 204 0.490 5.778 8.843 1.00 0.00 C ATOM 1167 OG SER B 204 0.623 6.908 9.684 1.00 0.00 O ATOM 0 H SER B 204 1.332 5.843 6.415 1.00 0.00 H new ATOM 0 HA SER B 204 2.572 5.489 9.135 1.00 0.00 H new ATOM 0 HB2 SER B 204 -0.166 6.014 8.005 1.00 0.00 H new ATOM 0 HB3 SER B 204 0.025 4.959 9.392 1.00 0.00 H new ATOM 0 HG SER B 204 -0.261 7.179 10.010 1.00 0.00 H new ATOM 1173 N ARG B 205 1.051 2.982 8.137 1.00 0.00 N ATOM 1174 CA ARG B 205 1.054 1.583 7.688 1.00 0.00 C ATOM 1175 C ARG B 205 -0.354 1.227 7.200 1.00 0.00 C ATOM 1176 O ARG B 205 -1.132 0.630 7.955 1.00 0.00 O ATOM 1177 CB ARG B 205 1.525 0.637 8.817 1.00 0.00 C ATOM 1178 CG ARG B 205 3.052 0.470 8.870 1.00 0.00 C ATOM 1179 CD ARG B 205 3.568 -0.630 7.927 1.00 0.00 C ATOM 1180 NE ARG B 205 3.275 -1.974 8.455 1.00 0.00 N ATOM 1181 CZ ARG B 205 3.573 -3.153 7.897 1.00 0.00 C ATOM 1182 NH1 ARG B 205 4.089 -3.227 6.675 1.00 0.00 N ATOM 1183 NH2 ARG B 205 3.355 -4.254 8.609 1.00 0.00 N ATOM 0 H ARG B 205 0.207 3.225 8.656 1.00 0.00 H new ATOM 0 HA ARG B 205 1.760 1.459 6.867 1.00 0.00 H new ATOM 0 HB2 ARG B 205 1.175 1.022 9.775 1.00 0.00 H new ATOM 0 HB3 ARG B 205 1.064 -0.341 8.679 1.00 0.00 H new ATOM 0 HG2 ARG B 205 3.525 1.417 8.609 1.00 0.00 H new ATOM 0 HG3 ARG B 205 3.351 0.235 9.892 1.00 0.00 H new ATOM 0 HD2 ARG B 205 3.108 -0.515 6.946 1.00 0.00 H new ATOM 0 HD3 ARG B 205 4.644 -0.518 7.790 1.00 0.00 H new ATOM 0 HE ARG B 205 2.788 -2.010 9.351 1.00 0.00 H new ATOM 0 HH11 ARG B 205 4.265 -2.375 6.143 1.00 0.00 H new ATOM 0 HH12 ARG B 205 4.309 -4.136 6.268 1.00 0.00 H new ATOM 0 HH21 ARG B 205 2.971 -4.184 9.551 1.00 0.00 H new ATOM 0 HH22 ARG B 205 3.571 -5.169 8.213 1.00 0.00 H new ATOM 1197 N PRO B 206 -0.758 1.651 5.991 1.00 0.00 N ATOM 1198 CA PRO B 206 -2.036 1.261 5.413 1.00 0.00 C ATOM 1199 C PRO B 206 -1.993 -0.173 4.839 1.00 0.00 C ATOM 1200 O PRO B 206 -2.666 -0.442 3.844 1.00 0.00 O ATOM 1201 CB PRO B 206 -2.335 2.356 4.377 1.00 0.00 C ATOM 1202 CG PRO B 206 -0.958 2.799 3.894 1.00 0.00 C ATOM 1203 CD PRO B 206 -0.058 2.582 5.112 1.00 0.00 C ATOM 0 HA PRO B 206 -2.840 1.202 6.146 1.00 0.00 H new ATOM 0 HB2 PRO B 206 -2.941 1.973 3.556 1.00 0.00 H new ATOM 0 HB3 PRO B 206 -2.887 3.184 4.821 1.00 0.00 H new ATOM 0 HG2 PRO B 206 -0.625 2.209 3.040 1.00 0.00 H new ATOM 0 HG3 PRO B 206 -0.961 3.843 3.579 1.00 0.00 H new ATOM 0 HD2 PRO B 206 0.909 2.178 4.812 1.00 0.00 H new ATOM 0 HD3 PRO B 206 0.136 3.525 5.623 1.00 0.00 H new ATOM 1211 N SER B 207 -1.232 -1.098 5.436 1.00 0.00 N ATOM 1212 CA SER B 207 -0.878 -2.395 4.891 1.00 0.00 C ATOM 1213 C SER B 207 -2.156 -3.219 4.761 1.00 0.00 C ATOM 1214 O SER B 207 -2.872 -3.315 5.748 1.00 0.00 O ATOM 1215 CB SER B 207 0.155 -3.044 5.839 1.00 0.00 C ATOM 1216 OG SER B 207 0.020 -2.622 7.195 1.00 0.00 O ATOM 0 H SER B 207 -0.830 -0.944 6.361 1.00 0.00 H new ATOM 0 HA SER B 207 -0.426 -2.323 3.902 1.00 0.00 H new ATOM 0 HB2 SER B 207 0.051 -4.128 5.791 1.00 0.00 H new ATOM 0 HB3 SER B 207 1.159 -2.804 5.490 1.00 0.00 H new ATOM 0 HG SER B 207 0.698 -3.067 7.745 1.00 0.00 H new ATOM 1222 N GLY B 208 -2.480 -3.785 3.594 1.00 0.00 N ATOM 1223 CA GLY B 208 -3.820 -4.243 3.218 1.00 0.00 C ATOM 1224 C GLY B 208 -4.543 -4.985 4.339 1.00 0.00 C ATOM 1225 O GLY B 208 -5.539 -4.498 4.885 1.00 0.00 O ATOM 0 H GLY B 208 -1.791 -3.942 2.859 1.00 0.00 H new ATOM 0 HA2 GLY B 208 -4.418 -3.383 2.916 1.00 0.00 H new ATOM 0 HA3 GLY B 208 -3.742 -4.898 2.350 1.00 0.00 H new ATOM 1229 N ALA B 209 -3.997 -6.143 4.721 1.00 0.00 N ATOM 1230 CA ALA B 209 -4.599 -6.995 5.743 1.00 0.00 C ATOM 1231 C ALA B 209 -4.654 -6.326 7.125 1.00 0.00 C ATOM 1232 O ALA B 209 -5.507 -6.699 7.933 1.00 0.00 O ATOM 1233 CB ALA B 209 -3.846 -8.328 5.834 1.00 0.00 C ATOM 0 H ALA B 209 -3.130 -6.512 4.331 1.00 0.00 H new ATOM 0 HA ALA B 209 -5.629 -7.173 5.435 1.00 0.00 H new ATOM 0 HB1 ALA B 209 -4.305 -8.954 6.600 1.00 0.00 H new ATOM 0 HB2 ALA B 209 -3.893 -8.839 4.872 1.00 0.00 H new ATOM 0 HB3 ALA B 209 -2.804 -8.140 6.095 1.00 0.00 H new ATOM 1239 N GLU B 210 -3.782 -5.351 7.414 1.00 0.00 N ATOM 1240 CA GLU B 210 -3.759 -4.630 8.680 1.00 0.00 C ATOM 1241 C GLU B 210 -4.783 -3.494 8.657 1.00 0.00 C ATOM 1242 O GLU B 210 -5.480 -3.225 9.640 1.00 0.00 O ATOM 1243 CB GLU B 210 -2.356 -4.044 8.909 1.00 0.00 C ATOM 1244 CG GLU B 210 -2.102 -3.939 10.412 1.00 0.00 C ATOM 1245 CD GLU B 210 -0.708 -3.419 10.761 1.00 0.00 C ATOM 1246 OE1 GLU B 210 0.298 -3.932 10.210 1.00 0.00 O ATOM 1247 OE2 GLU B 210 -0.612 -2.550 11.657 1.00 0.00 O ATOM 0 H GLU B 210 -3.064 -5.041 6.760 1.00 0.00 H new ATOM 0 HA GLU B 210 -4.008 -5.320 9.486 1.00 0.00 H new ATOM 0 HB2 GLU B 210 -1.602 -4.678 8.443 1.00 0.00 H new ATOM 0 HB3 GLU B 210 -2.278 -3.061 8.444 1.00 0.00 H new ATOM 0 HG2 GLU B 210 -2.848 -3.278 10.853 1.00 0.00 H new ATOM 0 HG3 GLU B 210 -2.238 -4.921 10.865 1.00 0.00 H new ATOM 1254 N ARG B 211 -4.887 -2.811 7.517 1.00 0.00 N ATOM 1255 CA ARG B 211 -5.839 -1.751 7.271 1.00 0.00 C ATOM 1256 C ARG B 211 -7.229 -2.317 7.414 1.00 0.00 C ATOM 1257 O ARG B 211 -8.060 -1.625 7.981 1.00 0.00 O ATOM 1258 CB ARG B 211 -5.608 -1.125 5.883 1.00 0.00 C ATOM 1259 CG ARG B 211 -5.431 0.394 5.983 1.00 0.00 C ATOM 1260 CD ARG B 211 -6.717 1.210 6.223 1.00 0.00 C ATOM 1261 NE ARG B 211 -7.390 1.618 4.980 1.00 0.00 N ATOM 1262 CZ ARG B 211 -6.905 2.414 4.018 1.00 0.00 C ATOM 1263 NH1 ARG B 211 -5.721 3.005 4.158 1.00 0.00 N ATOM 1264 NH2 ARG B 211 -7.617 2.596 2.911 1.00 0.00 N ATOM 0 H ARG B 211 -4.284 -2.995 6.715 1.00 0.00 H new ATOM 0 HA ARG B 211 -5.709 -0.949 7.998 1.00 0.00 H new ATOM 0 HB2 ARG B 211 -4.724 -1.567 5.424 1.00 0.00 H new ATOM 0 HB3 ARG B 211 -6.453 -1.353 5.233 1.00 0.00 H new ATOM 0 HG2 ARG B 211 -4.733 0.606 6.793 1.00 0.00 H new ATOM 0 HG3 ARG B 211 -4.967 0.747 5.062 1.00 0.00 H new ATOM 0 HD2 ARG B 211 -7.407 0.618 6.824 1.00 0.00 H new ATOM 0 HD3 ARG B 211 -6.471 2.099 6.803 1.00 0.00 H new ATOM 0 HE ARG B 211 -8.332 1.254 4.834 1.00 0.00 H new ATOM 0 HH11 ARG B 211 -5.173 2.854 5.005 1.00 0.00 H new ATOM 0 HH12 ARG B 211 -5.362 3.609 3.419 1.00 0.00 H new ATOM 0 HH21 ARG B 211 -8.519 2.133 2.803 1.00 0.00 H new ATOM 0 HH22 ARG B 211 -7.261 3.199 2.169 1.00 0.00 H new ATOM 1278 N ARG B 212 -7.487 -3.561 6.995 1.00 0.00 N ATOM 1279 CA ARG B 212 -8.739 -4.270 7.182 1.00 0.00 C ATOM 1280 C ARG B 212 -9.306 -4.086 8.585 1.00 0.00 C ATOM 1281 O ARG B 212 -10.483 -3.764 8.726 1.00 0.00 O ATOM 1282 CB ARG B 212 -8.473 -5.742 6.834 1.00 0.00 C ATOM 1283 CG ARG B 212 -9.644 -6.370 6.088 1.00 0.00 C ATOM 1284 CD ARG B 212 -10.701 -7.020 6.991 1.00 0.00 C ATOM 1285 NE ARG B 212 -10.162 -8.262 7.566 1.00 0.00 N ATOM 1286 CZ ARG B 212 -10.765 -9.451 7.616 1.00 0.00 C ATOM 1287 NH1 ARG B 212 -12.087 -9.561 7.504 1.00 0.00 N ATOM 1288 NH2 ARG B 212 -10.016 -10.530 7.801 1.00 0.00 N ATOM 0 H ARG B 212 -6.793 -4.117 6.496 1.00 0.00 H new ATOM 0 HA ARG B 212 -9.510 -3.865 6.526 1.00 0.00 H new ATOM 0 HB2 ARG B 212 -7.573 -5.814 6.223 1.00 0.00 H new ATOM 0 HB3 ARG B 212 -8.283 -6.303 7.749 1.00 0.00 H new ATOM 0 HG2 ARG B 212 -10.125 -5.603 5.482 1.00 0.00 H new ATOM 0 HG3 ARG B 212 -9.258 -7.124 5.401 1.00 0.00 H new ATOM 0 HD2 ARG B 212 -10.986 -6.332 7.787 1.00 0.00 H new ATOM 0 HD3 ARG B 212 -11.602 -7.234 6.417 1.00 0.00 H new ATOM 0 HE ARG B 212 -9.227 -8.208 7.970 1.00 0.00 H new ATOM 0 HH11 ARG B 212 -12.659 -8.726 7.377 1.00 0.00 H new ATOM 0 HH12 ARG B 212 -12.528 -10.480 7.545 1.00 0.00 H new ATOM 0 HH21 ARG B 212 -9.005 -10.438 7.901 1.00 0.00 H new ATOM 0 HH22 ARG B 212 -10.451 -11.452 7.843 1.00 0.00 H new ATOM 1302 N ARG B 213 -8.475 -4.226 9.620 1.00 0.00 N ATOM 1303 CA ARG B 213 -8.907 -4.079 11.011 1.00 0.00 C ATOM 1304 C ARG B 213 -9.359 -2.646 11.326 1.00 0.00 C ATOM 1305 O ARG B 213 -10.253 -2.458 12.152 1.00 0.00 O ATOM 1306 CB ARG B 213 -7.758 -4.554 11.920 1.00 0.00 C ATOM 1307 CG ARG B 213 -8.081 -4.655 13.415 1.00 0.00 C ATOM 1308 CD ARG B 213 -9.243 -5.601 13.736 1.00 0.00 C ATOM 1309 NE ARG B 213 -9.276 -5.907 15.177 1.00 0.00 N ATOM 1310 CZ ARG B 213 -8.951 -7.065 15.771 1.00 0.00 C ATOM 1311 NH1 ARG B 213 -8.607 -8.137 15.066 1.00 0.00 N ATOM 1312 NH2 ARG B 213 -8.966 -7.146 17.096 1.00 0.00 N ATOM 0 H ARG B 213 -7.484 -4.444 9.517 1.00 0.00 H new ATOM 0 HA ARG B 213 -9.786 -4.697 11.193 1.00 0.00 H new ATOM 0 HB2 ARG B 213 -7.428 -5.533 11.573 1.00 0.00 H new ATOM 0 HB3 ARG B 213 -6.917 -3.872 11.796 1.00 0.00 H new ATOM 0 HG2 ARG B 213 -7.192 -4.994 13.947 1.00 0.00 H new ATOM 0 HG3 ARG B 213 -8.319 -3.661 13.793 1.00 0.00 H new ATOM 0 HD2 ARG B 213 -10.185 -5.145 13.433 1.00 0.00 H new ATOM 0 HD3 ARG B 213 -9.137 -6.523 13.165 1.00 0.00 H new ATOM 0 HE ARG B 213 -9.580 -5.153 15.793 1.00 0.00 H new ATOM 0 HH11 ARG B 213 -8.585 -8.092 14.047 1.00 0.00 H new ATOM 0 HH12 ARG B 213 -8.364 -9.005 15.543 1.00 0.00 H new ATOM 0 HH21 ARG B 213 -9.223 -6.332 17.654 1.00 0.00 H new ATOM 0 HH22 ARG B 213 -8.720 -8.023 17.556 1.00 0.00 H new ATOM 1326 N ARG B 214 -8.771 -1.632 10.684 1.00 0.00 N ATOM 1327 CA ARG B 214 -9.199 -0.238 10.790 1.00 0.00 C ATOM 1328 C ARG B 214 -10.409 0.047 9.905 1.00 0.00 C ATOM 1329 O ARG B 214 -11.300 0.764 10.345 1.00 0.00 O ATOM 1330 CB ARG B 214 -8.014 0.692 10.473 1.00 0.00 C ATOM 1331 CG ARG B 214 -8.409 2.180 10.512 1.00 0.00 C ATOM 1332 CD ARG B 214 -7.345 3.063 11.173 1.00 0.00 C ATOM 1333 NE ARG B 214 -7.150 2.692 12.585 1.00 0.00 N ATOM 1334 CZ ARG B 214 -7.972 2.939 13.611 1.00 0.00 C ATOM 1335 NH1 ARG B 214 -9.104 3.618 13.450 1.00 0.00 N ATOM 1336 NH2 ARG B 214 -7.673 2.481 14.818 1.00 0.00 N ATOM 0 H ARG B 214 -7.970 -1.762 10.066 1.00 0.00 H new ATOM 0 HA ARG B 214 -9.520 -0.044 11.813 1.00 0.00 H new ATOM 0 HB2 ARG B 214 -7.213 0.513 11.190 1.00 0.00 H new ATOM 0 HB3 ARG B 214 -7.619 0.449 9.486 1.00 0.00 H new ATOM 0 HG2 ARG B 214 -8.584 2.531 9.495 1.00 0.00 H new ATOM 0 HG3 ARG B 214 -9.349 2.287 11.053 1.00 0.00 H new ATOM 0 HD2 ARG B 214 -6.402 2.966 10.635 1.00 0.00 H new ATOM 0 HD3 ARG B 214 -7.644 4.109 11.107 1.00 0.00 H new ATOM 0 HE ARG B 214 -6.290 2.189 12.806 1.00 0.00 H new ATOM 0 HH11 ARG B 214 -9.364 3.965 12.527 1.00 0.00 H new ATOM 0 HH12 ARG B 214 -9.712 3.792 14.250 1.00 0.00 H new ATOM 0 HH21 ARG B 214 -6.819 1.942 14.962 1.00 0.00 H new ATOM 0 HH22 ARG B 214 -8.297 2.667 15.603 1.00 0.00 H new ATOM 1350 N ARG B 215 -10.494 -0.524 8.702 1.00 0.00 N ATOM 1351 CA ARG B 215 -11.661 -0.368 7.832 1.00 0.00 C ATOM 1352 C ARG B 215 -12.897 -0.849 8.599 1.00 0.00 C ATOM 1353 O ARG B 215 -13.869 -0.118 8.772 1.00 0.00 O ATOM 1354 CB ARG B 215 -11.469 -1.094 6.481 1.00 0.00 C ATOM 1355 CG ARG B 215 -10.088 -0.892 5.810 1.00 0.00 C ATOM 1356 CD ARG B 215 -10.161 -0.736 4.293 1.00 0.00 C ATOM 1357 NE ARG B 215 -8.857 -0.813 3.594 1.00 0.00 N ATOM 1358 CZ ARG B 215 -8.732 -0.833 2.255 1.00 0.00 C ATOM 1359 NH1 ARG B 215 -9.816 -0.752 1.492 1.00 0.00 N ATOM 1360 NH2 ARG B 215 -7.541 -0.919 1.667 1.00 0.00 N ATOM 0 H ARG B 215 -9.757 -1.106 8.304 1.00 0.00 H new ATOM 0 HA ARG B 215 -11.796 0.682 7.572 1.00 0.00 H new ATOM 0 HB2 ARG B 215 -11.626 -2.161 6.636 1.00 0.00 H new ATOM 0 HB3 ARG B 215 -12.242 -0.754 5.792 1.00 0.00 H new ATOM 0 HG2 ARG B 215 -9.613 -0.008 6.235 1.00 0.00 H new ATOM 0 HG3 ARG B 215 -9.450 -1.743 6.049 1.00 0.00 H new ATOM 0 HD2 ARG B 215 -10.817 -1.510 3.894 1.00 0.00 H new ATOM 0 HD3 ARG B 215 -10.624 0.224 4.063 1.00 0.00 H new ATOM 0 HE ARG B 215 -8.008 -0.853 4.159 1.00 0.00 H new ATOM 0 HH11 ARG B 215 -10.738 -0.675 1.922 1.00 0.00 H new ATOM 0 HH12 ARG B 215 -9.727 -0.767 0.476 1.00 0.00 H new ATOM 0 HH21 ARG B 215 -6.695 -0.972 2.234 1.00 0.00 H new ATOM 0 HH22 ARG B 215 -7.474 -0.932 0.649 1.00 0.00 H new ATOM 1374 N ALA B 216 -12.784 -2.030 9.206 1.00 0.00 N ATOM 1375 CA ALA B 216 -13.731 -2.620 10.146 1.00 0.00 C ATOM 1376 C ALA B 216 -13.848 -1.879 11.497 1.00 0.00 C ATOM 1377 O ALA B 216 -14.386 -2.458 12.445 1.00 0.00 O ATOM 1378 CB ALA B 216 -13.330 -4.087 10.364 1.00 0.00 C ATOM 0 H ALA B 216 -11.979 -2.635 9.043 1.00 0.00 H new ATOM 0 HA ALA B 216 -14.724 -2.536 9.704 1.00 0.00 H new ATOM 0 HB1 ALA B 216 -14.023 -4.553 11.064 1.00 0.00 H new ATOM 0 HB2 ALA B 216 -13.363 -4.618 9.413 1.00 0.00 H new ATOM 0 HB3 ALA B 216 -12.319 -4.131 10.770 1.00 0.00 H new ATOM 1384 N ALA B 217 -13.344 -0.647 11.634 1.00 0.00 N ATOM 1385 CA ALA B 217 -13.663 0.265 12.729 1.00 0.00 C ATOM 1386 C ALA B 217 -14.539 1.435 12.262 1.00 0.00 C ATOM 1387 O ALA B 217 -15.216 2.050 13.092 1.00 0.00 O ATOM 1388 CB ALA B 217 -12.381 0.802 13.374 1.00 0.00 C ATOM 0 H ALA B 217 -12.685 -0.250 10.965 1.00 0.00 H new ATOM 0 HA ALA B 217 -14.228 -0.304 13.467 1.00 0.00 H new ATOM 0 HB1 ALA B 217 -12.639 1.480 14.188 1.00 0.00 H new ATOM 0 HB2 ALA B 217 -11.795 -0.029 13.766 1.00 0.00 H new ATOM 0 HB3 ALA B 217 -11.795 1.338 12.627 1.00 0.00 H new ATOM 1394 N ALA B 218 -14.557 1.760 10.965 1.00 0.00 N ATOM 1395 CA ALA B 218 -15.498 2.712 10.411 1.00 0.00 C ATOM 1396 C ALA B 218 -16.919 2.170 10.532 1.00 0.00 C ATOM 1397 O ALA B 218 -17.783 2.883 11.039 1.00 0.00 O ATOM 1398 CB ALA B 218 -15.153 3.046 8.967 1.00 0.00 C ATOM 0 H ALA B 218 -13.915 1.365 10.278 1.00 0.00 H new ATOM 0 HA ALA B 218 -15.434 3.639 10.981 1.00 0.00 H new ATOM 0 HB1 ALA B 218 -15.876 3.763 8.577 1.00 0.00 H new ATOM 0 HB2 ALA B 218 -14.153 3.478 8.922 1.00 0.00 H new ATOM 0 HB3 ALA B 218 -15.183 2.137 8.366 1.00 0.00 H new ATOM 1404 N ALA B 219 -17.132 0.914 10.110 1.00 0.00 N ATOM 1405 CA ALA B 219 -18.405 0.205 10.181 1.00 0.00 C ATOM 1406 C ALA B 219 -18.982 0.301 11.584 1.00 0.00 C ATOM 1407 O ALA B 219 -18.298 -0.147 12.531 1.00 0.00 O ATOM 1408 CB ALA B 219 -18.198 -1.258 9.768 1.00 0.00 C ATOM 1409 OXT ALA B 219 -20.097 0.834 11.747 1.00 0.00 O ATOM 0 H ALA B 219 -16.390 0.349 9.696 1.00 0.00 H new ATOM 0 HA ALA B 219 -19.117 0.664 9.495 1.00 0.00 H new ATOM 0 HB1 ALA B 219 -19.149 -1.789 9.821 1.00 0.00 H new ATOM 0 HB2 ALA B 219 -17.816 -1.298 8.748 1.00 0.00 H new ATOM 0 HB3 ALA B 219 -17.482 -1.728 10.442 1.00 0.00 H new