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 51:sc= 0.113 USER MOD ----------------------------------------------------------------- ATOM 1105 N ARG B 201 2.112 12.543 -1.591 1.00 0.00 N ATOM 1106 CA ARG B 201 0.793 12.053 -1.165 1.00 0.00 C ATOM 1107 C ARG B 201 1.056 10.848 -0.258 1.00 0.00 C ATOM 1108 O ARG B 201 1.751 9.919 -0.671 1.00 0.00 O ATOM 1109 CB ARG B 201 -0.117 11.726 -2.370 1.00 0.00 C ATOM 1110 CG ARG B 201 -0.233 12.917 -3.343 1.00 0.00 C ATOM 1111 CD ARG B 201 -1.216 12.748 -4.508 1.00 0.00 C ATOM 1112 NE ARG B 201 -0.800 11.724 -5.493 1.00 0.00 N ATOM 1113 CZ ARG B 201 -1.242 11.670 -6.766 1.00 0.00 C ATOM 1114 NH1 ARG B 201 -2.018 12.631 -7.264 1.00 0.00 N ATOM 1115 NH2 ARG B 201 -0.954 10.639 -7.559 1.00 0.00 N ATOM 0 HA ARG B 201 0.242 12.817 -0.617 1.00 0.00 H new ATOM 0 HB2 ARG B 201 0.280 10.861 -2.901 1.00 0.00 H new ATOM 0 HB3 ARG B 201 -1.109 11.452 -2.012 1.00 0.00 H new ATOM 0 HG2 ARG B 201 -0.527 13.798 -2.772 1.00 0.00 H new ATOM 0 HG3 ARG B 201 0.755 13.119 -3.756 1.00 0.00 H new ATOM 0 HD2 ARG B 201 -2.195 12.480 -4.110 1.00 0.00 H new ATOM 0 HD3 ARG B 201 -1.330 13.705 -5.018 1.00 0.00 H new ATOM 0 HE ARG B 201 -0.135 11.013 -5.189 1.00 0.00 H new ATOM 0 HH11 ARG B 201 -2.287 13.423 -6.680 1.00 0.00 H new ATOM 0 HH12 ARG B 201 -2.344 12.575 -8.229 1.00 0.00 H new ATOM 0 HH21 ARG B 201 -0.387 9.867 -7.207 1.00 0.00 H new ATOM 0 HH22 ARG B 201 -1.300 10.621 -8.518 1.00 0.00 H new ATOM 1131 N ARG B 202 0.659 10.911 1.019 1.00 0.00 N ATOM 1132 CA ARG B 202 1.072 9.968 2.065 1.00 0.00 C ATOM 1133 C ARG B 202 0.277 10.318 3.317 1.00 0.00 C ATOM 1134 O ARG B 202 0.551 11.356 3.917 1.00 0.00 O ATOM 1135 CB ARG B 202 2.591 10.078 2.347 1.00 0.00 C ATOM 1136 CG ARG B 202 3.166 8.851 3.070 1.00 0.00 C ATOM 1137 CD ARG B 202 4.637 9.082 3.442 1.00 0.00 C ATOM 1138 NE ARG B 202 5.492 9.185 2.244 1.00 0.00 N ATOM 1139 CZ ARG B 202 6.598 9.930 2.112 1.00 0.00 C ATOM 1140 NH1 ARG B 202 6.990 10.778 3.054 1.00 0.00 N ATOM 1141 NH2 ARG B 202 7.331 9.822 1.017 1.00 0.00 N ATOM 0 H ARG B 202 0.028 11.635 1.361 1.00 0.00 H new ATOM 0 HA ARG B 202 0.879 8.943 1.749 1.00 0.00 H new ATOM 0 HB2 ARG B 202 3.119 10.216 1.404 1.00 0.00 H new ATOM 0 HB3 ARG B 202 2.778 10.967 2.950 1.00 0.00 H new ATOM 0 HG2 ARG B 202 2.586 8.648 3.970 1.00 0.00 H new ATOM 0 HG3 ARG B 202 3.081 7.973 2.430 1.00 0.00 H new ATOM 0 HD2 ARG B 202 4.725 9.995 4.031 1.00 0.00 H new ATOM 0 HD3 ARG B 202 4.987 8.262 4.070 1.00 0.00 H new ATOM 0 HE ARG B 202 5.213 8.633 1.433 1.00 0.00 H new ATOM 0 HH11 ARG B 202 6.444 10.877 3.910 1.00 0.00 H new ATOM 0 HH12 ARG B 202 7.837 11.331 2.922 1.00 0.00 H new ATOM 0 HH21 ARG B 202 7.053 9.175 0.279 1.00 0.00 H new ATOM 0 HH22 ARG B 202 8.174 10.386 0.910 1.00 0.00 H new ATOM 1155 N GLY B 203 -0.740 9.527 3.650 1.00 0.00 N ATOM 1156 CA GLY B 203 -1.635 9.765 4.782 1.00 0.00 C ATOM 1157 C GLY B 203 -1.697 8.568 5.730 1.00 0.00 C ATOM 1158 O GLY B 203 -2.790 8.133 6.084 1.00 0.00 O ATOM 0 H GLY B 203 -0.971 8.682 3.128 1.00 0.00 H new ATOM 0 HA2 GLY B 203 -1.298 10.644 5.331 1.00 0.00 H new ATOM 0 HA3 GLY B 203 -2.636 9.985 4.411 1.00 0.00 H new ATOM 1162 N SER B 204 -0.535 8.021 6.107 1.00 0.00 N ATOM 1163 CA SER B 204 -0.279 7.033 7.152 1.00 0.00 C ATOM 1164 C SER B 204 -1.401 5.991 7.326 1.00 0.00 C ATOM 1165 O SER B 204 -1.927 5.746 8.420 1.00 0.00 O ATOM 1166 CB SER B 204 0.097 7.816 8.413 1.00 0.00 C ATOM 1167 OG SER B 204 0.771 7.015 9.366 1.00 0.00 O ATOM 0 H SER B 204 0.331 8.288 5.640 1.00 0.00 H new ATOM 0 HA SER B 204 0.553 6.386 6.873 1.00 0.00 H new ATOM 0 HB2 SER B 204 0.731 8.659 8.138 1.00 0.00 H new ATOM 0 HB3 SER B 204 -0.806 8.229 8.863 1.00 0.00 H new ATOM 0 HG SER B 204 0.992 7.557 10.152 1.00 0.00 H new ATOM 1173 N ARG B 205 -1.757 5.346 6.214 1.00 0.00 N ATOM 1174 CA ARG B 205 -2.764 4.289 6.147 1.00 0.00 C ATOM 1175 C ARG B 205 -2.280 3.093 6.972 1.00 0.00 C ATOM 1176 O ARG B 205 -1.067 2.862 7.012 1.00 0.00 O ATOM 1177 CB ARG B 205 -2.905 3.819 4.693 1.00 0.00 C ATOM 1178 CG ARG B 205 -3.361 4.881 3.678 1.00 0.00 C ATOM 1179 CD ARG B 205 -2.948 4.467 2.258 1.00 0.00 C ATOM 1180 NE ARG B 205 -1.534 4.778 1.955 1.00 0.00 N ATOM 1181 CZ ARG B 205 -0.487 3.937 1.923 1.00 0.00 C ATOM 1182 NH1 ARG B 205 -0.600 2.667 2.300 1.00 0.00 N ATOM 1183 NH2 ARG B 205 0.697 4.378 1.508 1.00 0.00 N ATOM 0 H ARG B 205 -1.338 5.552 5.307 1.00 0.00 H new ATOM 0 HA ARG B 205 -3.714 4.668 6.525 1.00 0.00 H new ATOM 0 HB2 ARG B 205 -1.944 3.423 4.366 1.00 0.00 H new ATOM 0 HB3 ARG B 205 -3.616 2.993 4.667 1.00 0.00 H new ATOM 0 HG2 ARG B 205 -4.443 5.003 3.729 1.00 0.00 H new ATOM 0 HG3 ARG B 205 -2.919 5.846 3.927 1.00 0.00 H new ATOM 0 HD2 ARG B 205 -3.114 3.397 2.135 1.00 0.00 H new ATOM 0 HD3 ARG B 205 -3.589 4.974 1.537 1.00 0.00 H new ATOM 0 HE ARG B 205 -1.328 5.754 1.744 1.00 0.00 H new ATOM 0 HH11 ARG B 205 -1.499 2.309 2.624 1.00 0.00 H new ATOM 0 HH12 ARG B 205 0.212 2.051 2.265 1.00 0.00 H new ATOM 0 HH21 ARG B 205 0.806 5.349 1.217 1.00 0.00 H new ATOM 0 HH22 ARG B 205 1.496 3.745 1.481 1.00 0.00 H new ATOM 1197 N PRO B 206 -3.164 2.283 7.570 1.00 0.00 N ATOM 1198 CA PRO B 206 -2.740 1.017 8.141 1.00 0.00 C ATOM 1199 C PRO B 206 -2.271 0.056 7.037 1.00 0.00 C ATOM 1200 O PRO B 206 -2.693 0.153 5.880 1.00 0.00 O ATOM 1201 CB PRO B 206 -3.947 0.487 8.922 1.00 0.00 C ATOM 1202 CG PRO B 206 -5.149 1.196 8.293 1.00 0.00 C ATOM 1203 CD PRO B 206 -4.585 2.508 7.757 1.00 0.00 C ATOM 0 HA PRO B 206 -1.884 1.127 8.806 1.00 0.00 H new ATOM 0 HB2 PRO B 206 -4.033 -0.596 8.833 1.00 0.00 H new ATOM 0 HB3 PRO B 206 -3.863 0.714 9.985 1.00 0.00 H new ATOM 0 HG2 PRO B 206 -5.589 0.598 7.495 1.00 0.00 H new ATOM 0 HG3 PRO B 206 -5.934 1.373 9.028 1.00 0.00 H new ATOM 0 HD2 PRO B 206 -5.064 2.784 6.817 1.00 0.00 H new ATOM 0 HD3 PRO B 206 -4.762 3.324 8.457 1.00 0.00 H new ATOM 1211 N SER B 207 -1.405 -0.886 7.407 1.00 0.00 N ATOM 1212 CA SER B 207 -0.914 -1.961 6.564 1.00 0.00 C ATOM 1213 C SER B 207 -2.053 -2.942 6.266 1.00 0.00 C ATOM 1214 O SER B 207 -2.912 -3.145 7.121 1.00 0.00 O ATOM 1215 CB SER B 207 0.251 -2.655 7.293 1.00 0.00 C ATOM 1216 OG SER B 207 0.269 -2.447 8.701 1.00 0.00 O ATOM 0 H SER B 207 -1.012 -0.917 8.348 1.00 0.00 H new ATOM 0 HA SER B 207 -0.554 -1.573 5.611 1.00 0.00 H new ATOM 0 HB2 SER B 207 0.200 -3.726 7.097 1.00 0.00 H new ATOM 0 HB3 SER B 207 1.191 -2.298 6.873 1.00 0.00 H new ATOM 0 HG SER B 207 -0.613 -2.657 9.074 1.00 0.00 H new ATOM 1222 N GLY B 208 -2.059 -3.572 5.087 1.00 0.00 N ATOM 1223 CA GLY B 208 -3.193 -4.309 4.524 1.00 0.00 C ATOM 1224 C GLY B 208 -3.897 -5.247 5.511 1.00 0.00 C ATOM 1225 O GLY B 208 -5.109 -5.148 5.713 1.00 0.00 O ATOM 0 H GLY B 208 -1.242 -3.582 4.476 1.00 0.00 H new ATOM 0 HA2 GLY B 208 -3.921 -3.593 4.141 1.00 0.00 H new ATOM 0 HA3 GLY B 208 -2.843 -4.894 3.673 1.00 0.00 H new ATOM 1229 N ALA B 209 -3.149 -6.145 6.150 1.00 0.00 N ATOM 1230 CA ALA B 209 -3.717 -7.180 7.004 1.00 0.00 C ATOM 1231 C ALA B 209 -4.365 -6.603 8.275 1.00 0.00 C ATOM 1232 O ALA B 209 -5.382 -7.133 8.727 1.00 0.00 O ATOM 1233 CB ALA B 209 -2.633 -8.213 7.323 1.00 0.00 C ATOM 0 H ALA B 209 -2.131 -6.173 6.088 1.00 0.00 H new ATOM 0 HA ALA B 209 -4.528 -7.672 6.467 1.00 0.00 H new ATOM 0 HB1 ALA B 209 -3.049 -8.992 7.962 1.00 0.00 H new ATOM 0 HB2 ALA B 209 -2.271 -8.659 6.396 1.00 0.00 H new ATOM 0 HB3 ALA B 209 -1.806 -7.725 7.838 1.00 0.00 H new ATOM 1239 N GLU B 210 -3.833 -5.507 8.826 1.00 0.00 N ATOM 1240 CA GLU B 210 -4.421 -4.743 9.922 1.00 0.00 C ATOM 1241 C GLU B 210 -5.553 -3.844 9.401 1.00 0.00 C ATOM 1242 O GLU B 210 -6.552 -3.601 10.077 1.00 0.00 O ATOM 1243 CB GLU B 210 -3.299 -3.889 10.536 1.00 0.00 C ATOM 1244 CG GLU B 210 -2.502 -4.629 11.626 1.00 0.00 C ATOM 1245 CD GLU B 210 -3.202 -4.683 12.992 1.00 0.00 C ATOM 1246 OE1 GLU B 210 -4.401 -4.342 13.114 1.00 0.00 O ATOM 1247 OE2 GLU B 210 -2.531 -4.997 14.006 1.00 0.00 O ATOM 0 H GLU B 210 -2.947 -5.116 8.506 1.00 0.00 H new ATOM 0 HA GLU B 210 -4.849 -5.411 10.670 1.00 0.00 H new ATOM 0 HB2 GLU B 210 -2.617 -3.575 9.746 1.00 0.00 H new ATOM 0 HB3 GLU B 210 -3.732 -2.984 10.962 1.00 0.00 H new ATOM 0 HG2 GLU B 210 -2.308 -5.647 11.290 1.00 0.00 H new ATOM 0 HG3 GLU B 210 -1.534 -4.143 11.746 1.00 0.00 H new ATOM 1254 N ARG B 211 -5.442 -3.357 8.167 1.00 0.00 N ATOM 1255 CA ARG B 211 -6.448 -2.549 7.491 1.00 0.00 C ATOM 1256 C ARG B 211 -7.709 -3.369 7.224 1.00 0.00 C ATOM 1257 O ARG B 211 -8.794 -2.799 7.256 1.00 0.00 O ATOM 1258 CB ARG B 211 -5.796 -1.945 6.239 1.00 0.00 C ATOM 1259 CG ARG B 211 -6.666 -0.999 5.405 1.00 0.00 C ATOM 1260 CD ARG B 211 -7.445 -1.715 4.290 1.00 0.00 C ATOM 1261 NE ARG B 211 -7.493 -0.853 3.105 1.00 0.00 N ATOM 1262 CZ ARG B 211 -8.281 0.208 2.929 1.00 0.00 C ATOM 1263 NH1 ARG B 211 -9.369 0.388 3.668 1.00 0.00 N ATOM 1264 NH2 ARG B 211 -7.952 1.095 2.010 1.00 0.00 N ATOM 0 H ARG B 211 -4.617 -3.522 7.591 1.00 0.00 H new ATOM 0 HA ARG B 211 -6.791 -1.723 8.114 1.00 0.00 H new ATOM 0 HB2 ARG B 211 -4.902 -1.403 6.547 1.00 0.00 H new ATOM 0 HB3 ARG B 211 -5.468 -2.762 5.597 1.00 0.00 H new ATOM 0 HG2 ARG B 211 -7.371 -0.490 6.062 1.00 0.00 H new ATOM 0 HG3 ARG B 211 -6.033 -0.231 4.961 1.00 0.00 H new ATOM 0 HD2 ARG B 211 -6.965 -2.663 4.046 1.00 0.00 H new ATOM 0 HD3 ARG B 211 -8.455 -1.947 4.627 1.00 0.00 H new ATOM 0 HE ARG B 211 -6.861 -1.088 2.340 1.00 0.00 H new ATOM 0 HH11 ARG B 211 -9.616 -0.292 4.387 1.00 0.00 H new ATOM 0 HH12 ARG B 211 -9.958 1.207 3.517 1.00 0.00 H new ATOM 0 HH21 ARG B 211 -7.109 0.962 1.451 1.00 0.00 H new ATOM 0 HH22 ARG B 211 -8.540 1.914 1.858 1.00 0.00 H new ATOM 1278 N ARG B 212 -7.627 -4.697 7.105 1.00 0.00 N ATOM 1279 CA ARG B 212 -8.769 -5.615 7.178 1.00 0.00 C ATOM 1280 C ARG B 212 -9.579 -5.424 8.471 1.00 0.00 C ATOM 1281 O ARG B 212 -10.785 -5.681 8.480 1.00 0.00 O ATOM 1282 CB ARG B 212 -8.217 -7.050 7.081 1.00 0.00 C ATOM 1283 CG ARG B 212 -8.803 -7.948 5.987 1.00 0.00 C ATOM 1284 CD ARG B 212 -10.155 -8.590 6.341 1.00 0.00 C ATOM 1285 NE ARG B 212 -10.465 -9.696 5.413 1.00 0.00 N ATOM 1286 CZ ARG B 212 -10.967 -10.901 5.730 1.00 0.00 C ATOM 1287 NH1 ARG B 212 -11.440 -11.161 6.944 1.00 0.00 N ATOM 1288 NH2 ARG B 212 -10.978 -11.883 4.836 1.00 0.00 N ATOM 0 H ARG B 212 -6.740 -5.177 6.951 1.00 0.00 H new ATOM 0 HA ARG B 212 -9.457 -5.410 6.357 1.00 0.00 H new ATOM 0 HB2 ARG B 212 -7.140 -6.989 6.928 1.00 0.00 H new ATOM 0 HB3 ARG B 212 -8.375 -7.540 8.042 1.00 0.00 H new ATOM 0 HG2 ARG B 212 -8.922 -7.359 5.077 1.00 0.00 H new ATOM 0 HG3 ARG B 212 -8.088 -8.739 5.763 1.00 0.00 H new ATOM 0 HD2 ARG B 212 -10.129 -8.964 7.365 1.00 0.00 H new ATOM 0 HD3 ARG B 212 -10.943 -7.839 6.296 1.00 0.00 H new ATOM 0 HE ARG B 212 -10.278 -9.527 4.425 1.00 0.00 H new ATOM 0 HH11 ARG B 212 -11.428 -10.437 7.662 1.00 0.00 H new ATOM 0 HH12 ARG B 212 -11.816 -12.085 7.158 1.00 0.00 H new ATOM 0 HH21 ARG B 212 -10.603 -11.725 3.900 1.00 0.00 H new ATOM 0 HH22 ARG B 212 -11.361 -12.795 5.085 1.00 0.00 H new ATOM 1302 N ARG B 213 -8.956 -4.970 9.565 1.00 0.00 N ATOM 1303 CA ARG B 213 -9.643 -4.620 10.806 1.00 0.00 C ATOM 1304 C ARG B 213 -10.170 -3.186 10.737 1.00 0.00 C ATOM 1305 O ARG B 213 -11.336 -2.966 11.067 1.00 0.00 O ATOM 1306 CB ARG B 213 -8.702 -4.811 12.012 1.00 0.00 C ATOM 1307 CG ARG B 213 -9.502 -5.176 13.271 1.00 0.00 C ATOM 1308 CD ARG B 213 -8.786 -4.756 14.556 1.00 0.00 C ATOM 1309 NE ARG B 213 -8.982 -3.321 14.827 1.00 0.00 N ATOM 1310 CZ ARG B 213 -8.129 -2.498 15.447 1.00 0.00 C ATOM 1311 NH1 ARG B 213 -6.946 -2.914 15.879 1.00 0.00 N ATOM 1312 NH2 ARG B 213 -8.488 -1.240 15.642 1.00 0.00 N ATOM 0 H ARG B 213 -7.946 -4.835 9.610 1.00 0.00 H new ATOM 0 HA ARG B 213 -10.496 -5.286 10.936 1.00 0.00 H new ATOM 0 HB2 ARG B 213 -7.978 -5.596 11.794 1.00 0.00 H new ATOM 0 HB3 ARG B 213 -8.136 -3.896 12.187 1.00 0.00 H new ATOM 0 HG2 ARG B 213 -10.480 -4.696 13.229 1.00 0.00 H new ATOM 0 HG3 ARG B 213 -9.675 -6.252 13.289 1.00 0.00 H new ATOM 0 HD2 ARG B 213 -9.162 -5.342 15.394 1.00 0.00 H new ATOM 0 HD3 ARG B 213 -7.721 -4.971 14.470 1.00 0.00 H new ATOM 0 HE ARG B 213 -9.860 -2.912 14.508 1.00 0.00 H new ATOM 0 HH11 ARG B 213 -6.666 -3.885 15.742 1.00 0.00 H new ATOM 0 HH12 ARG B 213 -6.317 -2.263 16.348 1.00 0.00 H new ATOM 0 HH21 ARG B 213 -9.400 -0.914 15.322 1.00 0.00 H new ATOM 0 HH22 ARG B 213 -7.853 -0.595 16.113 1.00 0.00 H new ATOM 1326 N ARG B 214 -9.362 -2.212 10.289 1.00 0.00 N ATOM 1327 CA ARG B 214 -9.807 -0.814 10.138 1.00 0.00 C ATOM 1328 C ARG B 214 -11.031 -0.723 9.247 1.00 0.00 C ATOM 1329 O ARG B 214 -11.915 0.086 9.501 1.00 0.00 O ATOM 1330 CB ARG B 214 -8.686 0.065 9.550 1.00 0.00 C ATOM 1331 CG ARG B 214 -8.848 1.583 9.753 1.00 0.00 C ATOM 1332 CD ARG B 214 -9.125 2.330 8.449 1.00 0.00 C ATOM 1333 NE ARG B 214 -10.462 1.990 7.969 1.00 0.00 N ATOM 1334 CZ ARG B 214 -10.973 2.226 6.752 1.00 0.00 C ATOM 1335 NH1 ARG B 214 -10.221 2.760 5.800 1.00 0.00 N ATOM 1336 NH2 ARG B 214 -12.232 1.910 6.461 1.00 0.00 N ATOM 0 H ARG B 214 -8.390 -2.367 10.023 1.00 0.00 H new ATOM 0 HA ARG B 214 -10.062 -0.449 11.133 1.00 0.00 H new ATOM 0 HB2 ARG B 214 -7.739 -0.243 9.993 1.00 0.00 H new ATOM 0 HB3 ARG B 214 -8.617 -0.134 8.481 1.00 0.00 H new ATOM 0 HG2 ARG B 214 -9.664 1.766 10.451 1.00 0.00 H new ATOM 0 HG3 ARG B 214 -7.942 1.982 10.210 1.00 0.00 H new ATOM 0 HD2 ARG B 214 -9.047 3.405 8.610 1.00 0.00 H new ATOM 0 HD3 ARG B 214 -8.379 2.065 7.700 1.00 0.00 H new ATOM 0 HE ARG B 214 -11.076 1.520 8.634 1.00 0.00 H new ATOM 0 HH11 ARG B 214 -9.247 2.994 5.991 1.00 0.00 H new ATOM 0 HH12 ARG B 214 -10.617 2.937 4.877 1.00 0.00 H new ATOM 0 HH21 ARG B 214 -12.827 1.480 7.170 1.00 0.00 H new ATOM 0 HH22 ARG B 214 -12.603 2.097 5.529 1.00 0.00 H new ATOM 1350 N ARG B 215 -11.083 -1.541 8.203 1.00 0.00 N ATOM 1351 CA ARG B 215 -12.188 -1.691 7.281 1.00 0.00 C ATOM 1352 C ARG B 215 -13.429 -1.889 8.110 1.00 0.00 C ATOM 1353 O ARG B 215 -14.279 -1.019 8.163 1.00 0.00 O ATOM 1354 CB ARG B 215 -11.831 -2.880 6.392 1.00 0.00 C ATOM 1355 CG ARG B 215 -12.937 -3.447 5.493 1.00 0.00 C ATOM 1356 CD ARG B 215 -12.410 -4.728 4.829 1.00 0.00 C ATOM 1357 NE ARG B 215 -11.137 -4.465 4.157 1.00 0.00 N ATOM 1358 CZ ARG B 215 -10.416 -5.276 3.391 1.00 0.00 C ATOM 1359 NH1 ARG B 215 -10.702 -6.567 3.307 1.00 0.00 N ATOM 1360 NH2 ARG B 215 -9.432 -4.735 2.694 1.00 0.00 N ATOM 0 H ARG B 215 -10.302 -2.154 7.968 1.00 0.00 H new ATOM 0 HA ARG B 215 -12.372 -0.832 6.636 1.00 0.00 H new ATOM 0 HB2 ARG B 215 -10.997 -2.586 5.755 1.00 0.00 H new ATOM 0 HB3 ARG B 215 -11.473 -3.685 7.034 1.00 0.00 H new ATOM 0 HG2 ARG B 215 -13.830 -3.663 6.080 1.00 0.00 H new ATOM 0 HG3 ARG B 215 -13.222 -2.717 4.736 1.00 0.00 H new ATOM 0 HD2 ARG B 215 -12.278 -5.507 5.580 1.00 0.00 H new ATOM 0 HD3 ARG B 215 -13.139 -5.099 4.109 1.00 0.00 H new ATOM 0 HE ARG B 215 -10.751 -3.531 4.296 1.00 0.00 H new ATOM 0 HH11 ARG B 215 -11.486 -6.951 3.835 1.00 0.00 H new ATOM 0 HH12 ARG B 215 -10.139 -7.177 2.714 1.00 0.00 H new ATOM 0 HH21 ARG B 215 -9.253 -3.733 2.758 1.00 0.00 H new ATOM 0 HH22 ARG B 215 -8.852 -5.320 2.092 1.00 0.00 H new ATOM 1374 N ALA B 216 -13.484 -2.975 8.865 1.00 0.00 N ATOM 1375 CA ALA B 216 -14.639 -3.313 9.668 1.00 0.00 C ATOM 1376 C ALA B 216 -14.967 -2.322 10.790 1.00 0.00 C ATOM 1377 O ALA B 216 -16.031 -2.449 11.402 1.00 0.00 O ATOM 1378 CB ALA B 216 -14.389 -4.712 10.225 1.00 0.00 C ATOM 0 H ALA B 216 -12.721 -3.648 8.935 1.00 0.00 H new ATOM 0 HA ALA B 216 -15.521 -3.270 9.029 1.00 0.00 H new ATOM 0 HB1 ALA B 216 -15.236 -5.015 10.841 1.00 0.00 H new ATOM 0 HB2 ALA B 216 -14.269 -5.416 9.401 1.00 0.00 H new ATOM 0 HB3 ALA B 216 -13.483 -4.706 10.831 1.00 0.00 H new ATOM 1384 N ALA B 217 -14.116 -1.332 11.057 1.00 0.00 N ATOM 1385 CA ALA B 217 -14.430 -0.254 11.985 1.00 0.00 C ATOM 1386 C ALA B 217 -15.432 0.720 11.360 1.00 0.00 C ATOM 1387 O ALA B 217 -16.325 1.191 12.069 1.00 0.00 O ATOM 1388 CB ALA B 217 -13.159 0.479 12.427 1.00 0.00 C ATOM 0 H ALA B 217 -13.191 -1.258 10.635 1.00 0.00 H new ATOM 0 HA ALA B 217 -14.887 -0.693 12.872 1.00 0.00 H new ATOM 0 HB1 ALA B 217 -13.422 1.279 13.119 1.00 0.00 H new ATOM 0 HB2 ALA B 217 -12.488 -0.223 12.922 1.00 0.00 H new ATOM 0 HB3 ALA B 217 -12.662 0.903 11.555 1.00 0.00 H new ATOM 1394 N ALA B 218 -15.304 1.003 10.061 1.00 0.00 N ATOM 1395 CA ALA B 218 -16.208 1.803 9.257 1.00 0.00 C ATOM 1396 C ALA B 218 -15.922 1.473 7.789 1.00 0.00 C ATOM 1397 O ALA B 218 -15.124 2.157 7.146 1.00 0.00 O ATOM 1398 CB ALA B 218 -16.027 3.303 9.548 1.00 0.00 C ATOM 0 H ALA B 218 -14.515 0.654 9.517 1.00 0.00 H new ATOM 0 HA ALA B 218 -17.245 1.571 9.497 1.00 0.00 H new ATOM 0 HB1 ALA B 218 -16.717 3.879 8.932 1.00 0.00 H new ATOM 0 HB2 ALA B 218 -16.233 3.497 10.601 1.00 0.00 H new ATOM 0 HB3 ALA B 218 -15.003 3.597 9.318 1.00 0.00 H new ATOM 1404 N ALA B 219 -16.492 0.366 7.304 1.00 0.00 N ATOM 1405 CA ALA B 219 -16.496 0.025 5.887 1.00 0.00 C ATOM 1406 C ALA B 219 -17.615 0.823 5.240 1.00 0.00 C ATOM 1407 O ALA B 219 -18.785 0.405 5.351 1.00 0.00 O ATOM 1408 CB ALA B 219 -16.685 -1.487 5.694 1.00 0.00 C ATOM 1409 OXT ALA B 219 -17.336 1.898 4.665 1.00 0.00 O ATOM 0 H ALA B 219 -16.966 -0.320 7.891 1.00 0.00 H new ATOM 0 HA ALA B 219 -15.544 0.275 5.420 1.00 0.00 H new ATOM 0 HB1 ALA B 219 -16.685 -1.721 4.629 1.00 0.00 H new ATOM 0 HB2 ALA B 219 -15.870 -2.021 6.183 1.00 0.00 H new ATOM 0 HB3 ALA B 219 -17.634 -1.794 6.133 1.00 0.00 H new