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 152:sc= 1.2 USER MOD ----------------------------------------------------------------- ATOM 1105 N ARG B 201 2.070 14.181 2.765 1.00 0.00 N ATOM 1106 CA ARG B 201 1.119 13.520 1.864 1.00 0.00 C ATOM 1107 C ARG B 201 1.203 12.023 2.128 1.00 0.00 C ATOM 1108 O ARG B 201 2.311 11.503 2.257 1.00 0.00 O ATOM 1109 CB ARG B 201 1.392 13.793 0.370 1.00 0.00 C ATOM 1110 CG ARG B 201 0.878 15.146 -0.160 1.00 0.00 C ATOM 1111 CD ARG B 201 1.112 15.211 -1.683 1.00 0.00 C ATOM 1112 NE ARG B 201 0.689 16.487 -2.299 1.00 0.00 N ATOM 1113 CZ ARG B 201 -0.531 16.765 -2.798 1.00 0.00 C ATOM 1114 NH1 ARG B 201 -1.555 15.932 -2.601 1.00 0.00 N ATOM 1115 NH2 ARG B 201 -0.748 17.905 -3.453 1.00 0.00 N ATOM 0 HA ARG B 201 0.126 13.921 2.068 1.00 0.00 H new ATOM 0 HB2 ARG B 201 2.467 13.740 0.199 1.00 0.00 H new ATOM 0 HB3 ARG B 201 0.936 12.995 -0.217 1.00 0.00 H new ATOM 0 HG2 ARG B 201 -0.183 15.259 0.063 1.00 0.00 H new ATOM 0 HG3 ARG B 201 1.397 15.966 0.336 1.00 0.00 H new ATOM 0 HD2 ARG B 201 2.172 15.055 -1.885 1.00 0.00 H new ATOM 0 HD3 ARG B 201 0.572 14.392 -2.159 1.00 0.00 H new ATOM 0 HE ARG B 201 1.388 17.228 -2.351 1.00 0.00 H new ATOM 0 HH11 ARG B 201 -1.419 15.073 -2.067 1.00 0.00 H new ATOM 0 HH12 ARG B 201 -2.474 16.154 -2.984 1.00 0.00 H new ATOM 0 HH21 ARG B 201 0.012 18.573 -3.579 1.00 0.00 H new ATOM 0 HH22 ARG B 201 -1.674 18.109 -3.828 1.00 0.00 H new ATOM 1131 N ARG B 202 0.058 11.331 2.148 1.00 0.00 N ATOM 1132 CA ARG B 202 -0.037 9.869 2.187 1.00 0.00 C ATOM 1133 C ARG B 202 0.706 9.266 3.384 1.00 0.00 C ATOM 1134 O ARG B 202 1.146 8.120 3.336 1.00 0.00 O ATOM 1135 CB ARG B 202 0.325 9.300 0.795 1.00 0.00 C ATOM 1136 CG ARG B 202 -0.105 7.837 0.584 1.00 0.00 C ATOM 1137 CD ARG B 202 -0.394 7.484 -0.886 1.00 0.00 C ATOM 1138 NE ARG B 202 0.664 7.862 -1.848 1.00 0.00 N ATOM 1139 CZ ARG B 202 1.931 7.433 -1.902 1.00 0.00 C ATOM 1140 NH1 ARG B 202 2.414 6.602 -0.986 1.00 0.00 N ATOM 1141 NH2 ARG B 202 2.707 7.845 -2.891 1.00 0.00 N ATOM 0 H ARG B 202 -0.854 11.787 2.137 1.00 0.00 H new ATOM 0 HA ARG B 202 -1.065 9.559 2.378 1.00 0.00 H new ATOM 0 HB2 ARG B 202 -0.142 9.919 0.029 1.00 0.00 H new ATOM 0 HB3 ARG B 202 1.403 9.375 0.653 1.00 0.00 H new ATOM 0 HG2 ARG B 202 0.679 7.179 0.959 1.00 0.00 H new ATOM 0 HG3 ARG B 202 -0.997 7.640 1.178 1.00 0.00 H new ATOM 0 HD2 ARG B 202 -0.560 6.409 -0.958 1.00 0.00 H new ATOM 0 HD3 ARG B 202 -1.323 7.971 -1.183 1.00 0.00 H new ATOM 0 HE ARG B 202 0.393 8.537 -2.563 1.00 0.00 H new ATOM 0 HH11 ARG B 202 1.817 6.280 -0.224 1.00 0.00 H new ATOM 0 HH12 ARG B 202 3.382 6.286 -1.044 1.00 0.00 H new ATOM 0 HH21 ARG B 202 2.338 8.480 -3.598 1.00 0.00 H new ATOM 0 HH22 ARG B 202 3.675 7.527 -2.946 1.00 0.00 H new ATOM 1155 N GLY B 203 0.778 10.001 4.498 1.00 0.00 N ATOM 1156 CA GLY B 203 1.422 9.569 5.735 1.00 0.00 C ATOM 1157 C GLY B 203 0.727 8.397 6.443 1.00 0.00 C ATOM 1158 O GLY B 203 1.085 8.086 7.577 1.00 0.00 O ATOM 0 H GLY B 203 0.378 10.937 4.562 1.00 0.00 H new ATOM 0 HA2 GLY B 203 2.450 9.284 5.513 1.00 0.00 H new ATOM 0 HA3 GLY B 203 1.467 10.415 6.420 1.00 0.00 H new ATOM 1162 N SER B 204 -0.272 7.757 5.832 1.00 0.00 N ATOM 1163 CA SER B 204 -0.984 6.610 6.366 1.00 0.00 C ATOM 1164 C SER B 204 -1.128 5.594 5.229 1.00 0.00 C ATOM 1165 O SER B 204 -2.186 5.457 4.613 1.00 0.00 O ATOM 1166 CB SER B 204 -2.304 7.093 6.984 1.00 0.00 C ATOM 1167 OG SER B 204 -2.890 6.104 7.809 1.00 0.00 O ATOM 0 H SER B 204 -0.616 8.041 4.915 1.00 0.00 H new ATOM 0 HA SER B 204 -0.455 6.106 7.175 1.00 0.00 H new ATOM 0 HB2 SER B 204 -2.123 7.994 7.570 1.00 0.00 H new ATOM 0 HB3 SER B 204 -3.000 7.363 6.190 1.00 0.00 H new ATOM 0 HG SER B 204 -3.727 6.447 8.186 1.00 0.00 H new ATOM 1173 N ARG B 205 -0.031 4.903 4.906 1.00 0.00 N ATOM 1174 CA ARG B 205 -0.073 3.721 4.046 1.00 0.00 C ATOM 1175 C ARG B 205 -0.818 2.613 4.803 1.00 0.00 C ATOM 1176 O ARG B 205 -0.448 2.351 5.954 1.00 0.00 O ATOM 1177 CB ARG B 205 1.348 3.323 3.589 1.00 0.00 C ATOM 1178 CG ARG B 205 2.347 2.953 4.703 1.00 0.00 C ATOM 1179 CD ARG B 205 2.392 1.452 5.022 1.00 0.00 C ATOM 1180 NE ARG B 205 3.335 0.722 4.162 1.00 0.00 N ATOM 1181 CZ ARG B 205 3.624 -0.578 4.278 1.00 0.00 C ATOM 1182 NH1 ARG B 205 3.005 -1.346 5.165 1.00 0.00 N ATOM 1183 NH2 ARG B 205 4.569 -1.138 3.538 1.00 0.00 N ATOM 0 H ARG B 205 0.904 5.146 5.232 1.00 0.00 H new ATOM 0 HA ARG B 205 -0.617 3.922 3.123 1.00 0.00 H new ATOM 0 HB2 ARG B 205 1.264 2.474 2.910 1.00 0.00 H new ATOM 0 HB3 ARG B 205 1.767 4.150 3.015 1.00 0.00 H new ATOM 0 HG2 ARG B 205 3.343 3.282 4.409 1.00 0.00 H new ATOM 0 HG3 ARG B 205 2.085 3.500 5.609 1.00 0.00 H new ATOM 0 HD2 ARG B 205 2.675 1.314 6.065 1.00 0.00 H new ATOM 0 HD3 ARG B 205 1.395 1.029 4.904 1.00 0.00 H new ATOM 0 HE ARG B 205 3.803 1.246 3.423 1.00 0.00 H new ATOM 0 HH11 ARG B 205 2.292 -0.947 5.776 1.00 0.00 H new ATOM 0 HH12 ARG B 205 3.242 -2.336 5.236 1.00 0.00 H new ATOM 0 HH21 ARG B 205 5.090 -0.576 2.865 1.00 0.00 H new ATOM 0 HH22 ARG B 205 4.775 -2.132 3.641 1.00 0.00 H new ATOM 1197 N PRO B 206 -1.864 1.983 4.242 1.00 0.00 N ATOM 1198 CA PRO B 206 -2.508 0.840 4.874 1.00 0.00 C ATOM 1199 C PRO B 206 -1.607 -0.394 4.761 1.00 0.00 C ATOM 1200 O PRO B 206 -0.704 -0.439 3.920 1.00 0.00 O ATOM 1201 CB PRO B 206 -3.819 0.648 4.107 1.00 0.00 C ATOM 1202 CG PRO B 206 -3.452 1.106 2.698 1.00 0.00 C ATOM 1203 CD PRO B 206 -2.486 2.260 2.956 1.00 0.00 C ATOM 0 HA PRO B 206 -2.691 0.994 5.937 1.00 0.00 H new ATOM 0 HB2 PRO B 206 -4.149 -0.391 4.122 1.00 0.00 H new ATOM 0 HB3 PRO B 206 -4.627 1.245 4.530 1.00 0.00 H new ATOM 0 HG2 PRO B 206 -2.983 0.308 2.123 1.00 0.00 H new ATOM 0 HG3 PRO B 206 -4.329 1.430 2.137 1.00 0.00 H new ATOM 0 HD2 PRO B 206 -1.737 2.326 2.167 1.00 0.00 H new ATOM 0 HD3 PRO B 206 -3.014 3.214 2.975 1.00 0.00 H new ATOM 1211 N SER B 207 -1.890 -1.426 5.550 1.00 0.00 N ATOM 1212 CA SER B 207 -1.414 -2.765 5.384 1.00 0.00 C ATOM 1213 C SER B 207 -2.633 -3.577 4.948 1.00 0.00 C ATOM 1214 O SER B 207 -3.693 -3.429 5.561 1.00 0.00 O ATOM 1215 CB SER B 207 -0.849 -3.226 6.731 1.00 0.00 C ATOM 1216 OG SER B 207 -0.730 -2.210 7.729 1.00 0.00 O ATOM 0 H SER B 207 -2.494 -1.328 6.366 1.00 0.00 H new ATOM 0 HA SER B 207 -0.621 -2.873 4.644 1.00 0.00 H new ATOM 0 HB2 SER B 207 -1.487 -4.020 7.120 1.00 0.00 H new ATOM 0 HB3 SER B 207 0.136 -3.662 6.562 1.00 0.00 H new ATOM 0 HG SER B 207 -0.812 -2.614 8.618 1.00 0.00 H new ATOM 1222 N GLY B 208 -2.528 -4.383 3.891 1.00 0.00 N ATOM 1223 CA GLY B 208 -3.692 -4.853 3.146 1.00 0.00 C ATOM 1224 C GLY B 208 -4.732 -5.525 4.032 1.00 0.00 C ATOM 1225 O GLY B 208 -5.843 -5.018 4.188 1.00 0.00 O ATOM 0 H GLY B 208 -1.638 -4.726 3.530 1.00 0.00 H new ATOM 0 HA2 GLY B 208 -4.152 -4.010 2.631 1.00 0.00 H new ATOM 0 HA3 GLY B 208 -3.367 -5.556 2.379 1.00 0.00 H new ATOM 1229 N ALA B 209 -4.361 -6.638 4.660 1.00 0.00 N ATOM 1230 CA ALA B 209 -5.253 -7.367 5.550 1.00 0.00 C ATOM 1231 C ALA B 209 -5.444 -6.661 6.900 1.00 0.00 C ATOM 1232 O ALA B 209 -6.344 -7.024 7.657 1.00 0.00 O ATOM 1233 CB ALA B 209 -4.724 -8.789 5.746 1.00 0.00 C ATOM 0 H ALA B 209 -3.436 -7.057 4.565 1.00 0.00 H new ATOM 0 HA ALA B 209 -6.237 -7.404 5.083 1.00 0.00 H new ATOM 0 HB1 ALA B 209 -5.391 -9.337 6.412 1.00 0.00 H new ATOM 0 HB2 ALA B 209 -4.677 -9.296 4.782 1.00 0.00 H new ATOM 0 HB3 ALA B 209 -3.726 -8.749 6.183 1.00 0.00 H new ATOM 1239 N GLU B 210 -4.633 -5.656 7.240 1.00 0.00 N ATOM 1240 CA GLU B 210 -4.827 -4.861 8.450 1.00 0.00 C ATOM 1241 C GLU B 210 -5.968 -3.854 8.282 1.00 0.00 C ATOM 1242 O GLU B 210 -6.599 -3.448 9.266 1.00 0.00 O ATOM 1243 CB GLU B 210 -3.530 -4.128 8.800 1.00 0.00 C ATOM 1244 CG GLU B 210 -3.652 -3.409 10.141 1.00 0.00 C ATOM 1245 CD GLU B 210 -2.323 -3.232 10.855 1.00 0.00 C ATOM 1246 OE1 GLU B 210 -1.303 -2.893 10.210 1.00 0.00 O ATOM 1247 OE2 GLU B 210 -2.307 -3.435 12.090 1.00 0.00 O ATOM 0 H GLU B 210 -3.826 -5.373 6.684 1.00 0.00 H new ATOM 0 HA GLU B 210 -5.096 -5.538 9.261 1.00 0.00 H new ATOM 0 HB2 GLU B 210 -2.705 -4.840 8.839 1.00 0.00 H new ATOM 0 HB3 GLU B 210 -3.293 -3.407 8.017 1.00 0.00 H new ATOM 0 HG2 GLU B 210 -4.102 -2.430 9.980 1.00 0.00 H new ATOM 0 HG3 GLU B 210 -4.330 -3.970 10.785 1.00 0.00 H new ATOM 1254 N ARG B 211 -6.270 -3.460 7.043 1.00 0.00 N ATOM 1255 CA ARG B 211 -7.332 -2.511 6.749 1.00 0.00 C ATOM 1256 C ARG B 211 -8.693 -3.043 7.212 1.00 0.00 C ATOM 1257 O ARG B 211 -9.535 -2.259 7.642 1.00 0.00 O ATOM 1258 CB ARG B 211 -7.271 -2.186 5.250 1.00 0.00 C ATOM 1259 CG ARG B 211 -8.152 -1.009 4.816 1.00 0.00 C ATOM 1260 CD ARG B 211 -7.664 0.319 5.408 1.00 0.00 C ATOM 1261 NE ARG B 211 -8.341 1.466 4.792 1.00 0.00 N ATOM 1262 CZ ARG B 211 -7.938 2.740 4.848 1.00 0.00 C ATOM 1263 NH1 ARG B 211 -6.923 3.106 5.629 1.00 0.00 N ATOM 1264 NH2 ARG B 211 -8.555 3.652 4.114 1.00 0.00 N ATOM 0 H ARG B 211 -5.778 -3.796 6.215 1.00 0.00 H new ATOM 0 HA ARG B 211 -7.193 -1.584 7.305 1.00 0.00 H new ATOM 0 HB2 ARG B 211 -6.238 -1.968 4.981 1.00 0.00 H new ATOM 0 HB3 ARG B 211 -7.567 -3.071 4.687 1.00 0.00 H new ATOM 0 HG2 ARG B 211 -8.157 -0.941 3.728 1.00 0.00 H new ATOM 0 HG3 ARG B 211 -9.180 -1.190 5.129 1.00 0.00 H new ATOM 0 HD2 ARG B 211 -7.841 0.326 6.483 1.00 0.00 H new ATOM 0 HD3 ARG B 211 -6.588 0.410 5.262 1.00 0.00 H new ATOM 0 HE ARG B 211 -9.198 1.274 4.273 1.00 0.00 H new ATOM 0 HH11 ARG B 211 -6.440 2.410 6.197 1.00 0.00 H new ATOM 0 HH12 ARG B 211 -6.629 4.082 5.659 1.00 0.00 H new ATOM 0 HH21 ARG B 211 -9.332 3.381 3.511 1.00 0.00 H new ATOM 0 HH22 ARG B 211 -8.254 4.626 4.151 1.00 0.00 H new ATOM 1278 N ARG B 212 -8.886 -4.364 7.292 1.00 0.00 N ATOM 1279 CA ARG B 212 -10.049 -5.001 7.870 1.00 0.00 C ATOM 1280 C ARG B 212 -10.262 -4.612 9.335 1.00 0.00 C ATOM 1281 O ARG B 212 -11.410 -4.541 9.775 1.00 0.00 O ATOM 1282 CB ARG B 212 -9.827 -6.509 7.707 1.00 0.00 C ATOM 1283 CG ARG B 212 -10.718 -7.130 6.632 1.00 0.00 C ATOM 1284 CD ARG B 212 -10.338 -8.604 6.475 1.00 0.00 C ATOM 1285 NE ARG B 212 -11.182 -9.322 5.505 1.00 0.00 N ATOM 1286 CZ ARG B 212 -10.960 -10.586 5.120 1.00 0.00 C ATOM 1287 NH1 ARG B 212 -9.771 -11.139 5.331 1.00 0.00 N ATOM 1288 NH2 ARG B 212 -11.923 -11.290 4.537 1.00 0.00 N ATOM 0 H ARG B 212 -8.203 -5.035 6.939 1.00 0.00 H new ATOM 0 HA ARG B 212 -10.958 -4.676 7.363 1.00 0.00 H new ATOM 0 HB2 ARG B 212 -8.782 -6.692 7.456 1.00 0.00 H new ATOM 0 HB3 ARG B 212 -10.017 -7.004 8.659 1.00 0.00 H new ATOM 0 HG2 ARG B 212 -11.768 -7.038 6.911 1.00 0.00 H new ATOM 0 HG3 ARG B 212 -10.592 -6.604 5.686 1.00 0.00 H new ATOM 0 HD2 ARG B 212 -9.297 -8.672 6.161 1.00 0.00 H new ATOM 0 HD3 ARG B 212 -10.411 -9.096 7.445 1.00 0.00 H new ATOM 0 HE ARG B 212 -11.980 -8.830 5.104 1.00 0.00 H new ATOM 0 HH11 ARG B 212 -9.032 -10.602 5.784 1.00 0.00 H new ATOM 0 HH12 ARG B 212 -9.597 -12.101 5.040 1.00 0.00 H new ATOM 0 HH21 ARG B 212 -12.839 -10.869 4.380 1.00 0.00 H new ATOM 0 HH22 ARG B 212 -11.747 -12.252 4.246 1.00 0.00 H new ATOM 1302 N ARG B 213 -9.201 -4.344 10.106 1.00 0.00 N ATOM 1303 CA ARG B 213 -9.347 -3.848 11.478 1.00 0.00 C ATOM 1304 C ARG B 213 -9.689 -2.360 11.484 1.00 0.00 C ATOM 1305 O ARG B 213 -10.415 -1.904 12.366 1.00 0.00 O ATOM 1306 CB ARG B 213 -8.093 -4.134 12.326 1.00 0.00 C ATOM 1307 CG ARG B 213 -7.722 -5.627 12.356 1.00 0.00 C ATOM 1308 CD ARG B 213 -7.263 -6.112 13.738 1.00 0.00 C ATOM 1309 NE ARG B 213 -5.947 -5.581 14.134 1.00 0.00 N ATOM 1310 CZ ARG B 213 -5.571 -5.156 15.347 1.00 0.00 C ATOM 1311 NH1 ARG B 213 -6.453 -4.909 16.313 1.00 0.00 N ATOM 1312 NH2 ARG B 213 -4.275 -5.003 15.591 1.00 0.00 N ATOM 0 H ARG B 213 -8.234 -4.462 9.803 1.00 0.00 H new ATOM 0 HA ARG B 213 -10.175 -4.389 11.936 1.00 0.00 H new ATOM 0 HB2 ARG B 213 -7.253 -3.563 11.929 1.00 0.00 H new ATOM 0 HB3 ARG B 213 -8.262 -3.786 13.345 1.00 0.00 H new ATOM 0 HG2 ARG B 213 -8.584 -6.215 12.040 1.00 0.00 H new ATOM 0 HG3 ARG B 213 -6.928 -5.811 11.632 1.00 0.00 H new ATOM 0 HD2 ARG B 213 -8.004 -5.820 14.482 1.00 0.00 H new ATOM 0 HD3 ARG B 213 -7.223 -7.201 13.738 1.00 0.00 H new ATOM 0 HE ARG B 213 -5.241 -5.531 13.400 1.00 0.00 H new ATOM 0 HH11 ARG B 213 -7.449 -5.043 16.140 1.00 0.00 H new ATOM 0 HH12 ARG B 213 -6.132 -4.586 17.226 1.00 0.00 H new ATOM 0 HH21 ARG B 213 -3.591 -5.208 14.862 1.00 0.00 H new ATOM 0 HH22 ARG B 213 -3.963 -4.680 16.507 1.00 0.00 H new ATOM 1326 N ARG B 214 -9.266 -1.602 10.466 1.00 0.00 N ATOM 1327 CA ARG B 214 -9.653 -0.200 10.308 1.00 0.00 C ATOM 1328 C ARG B 214 -11.172 -0.070 10.215 1.00 0.00 C ATOM 1329 O ARG B 214 -11.725 0.892 10.736 1.00 0.00 O ATOM 1330 CB ARG B 214 -8.957 0.420 9.080 1.00 0.00 C ATOM 1331 CG ARG B 214 -8.447 1.848 9.315 1.00 0.00 C ATOM 1332 CD ARG B 214 -9.512 2.932 9.493 1.00 0.00 C ATOM 1333 NE ARG B 214 -10.317 3.126 8.274 1.00 0.00 N ATOM 1334 CZ ARG B 214 -10.345 4.221 7.502 1.00 0.00 C ATOM 1335 NH1 ARG B 214 -9.824 5.369 7.927 1.00 0.00 N ATOM 1336 NH2 ARG B 214 -10.888 4.147 6.294 1.00 0.00 N ATOM 0 H ARG B 214 -8.647 -1.945 9.731 1.00 0.00 H new ATOM 0 HA ARG B 214 -9.326 0.353 11.188 1.00 0.00 H new ATOM 0 HB2 ARG B 214 -8.118 -0.213 8.791 1.00 0.00 H new ATOM 0 HB3 ARG B 214 -9.655 0.426 8.243 1.00 0.00 H new ATOM 0 HG2 ARG B 214 -7.814 1.843 10.202 1.00 0.00 H new ATOM 0 HG3 ARG B 214 -7.813 2.127 8.473 1.00 0.00 H new ATOM 0 HD2 ARG B 214 -10.168 2.662 10.321 1.00 0.00 H new ATOM 0 HD3 ARG B 214 -9.030 3.872 9.762 1.00 0.00 H new ATOM 0 HE ARG B 214 -10.913 2.349 7.989 1.00 0.00 H new ATOM 0 HH11 ARG B 214 -9.396 5.424 8.851 1.00 0.00 H new ATOM 0 HH12 ARG B 214 -9.852 6.194 7.329 1.00 0.00 H new ATOM 0 HH21 ARG B 214 -11.278 3.264 5.963 1.00 0.00 H new ATOM 0 HH22 ARG B 214 -10.916 4.973 5.696 1.00 0.00 H new ATOM 1350 N ARG B 215 -11.868 -1.065 9.658 1.00 0.00 N ATOM 1351 CA ARG B 215 -13.327 -1.055 9.575 1.00 0.00 C ATOM 1352 C ARG B 215 -13.922 -0.949 10.966 1.00 0.00 C ATOM 1353 O ARG B 215 -14.785 -0.106 11.210 1.00 0.00 O ATOM 1354 CB ARG B 215 -13.853 -2.310 8.872 1.00 0.00 C ATOM 1355 CG ARG B 215 -13.197 -2.543 7.509 1.00 0.00 C ATOM 1356 CD ARG B 215 -13.802 -3.778 6.851 1.00 0.00 C ATOM 1357 NE ARG B 215 -15.047 -3.451 6.141 1.00 0.00 N ATOM 1358 CZ ARG B 215 -15.827 -4.324 5.501 1.00 0.00 C ATOM 1359 NH1 ARG B 215 -15.531 -5.618 5.509 1.00 0.00 N ATOM 1360 NH2 ARG B 215 -16.893 -3.878 4.856 1.00 0.00 N ATOM 0 H ARG B 215 -11.436 -1.896 9.254 1.00 0.00 H new ATOM 0 HA ARG B 215 -13.628 -0.189 8.985 1.00 0.00 H new ATOM 0 HB2 ARG B 215 -13.678 -3.178 9.508 1.00 0.00 H new ATOM 0 HB3 ARG B 215 -14.932 -2.223 8.741 1.00 0.00 H new ATOM 0 HG2 ARG B 215 -13.342 -1.671 6.871 1.00 0.00 H new ATOM 0 HG3 ARG B 215 -12.122 -2.674 7.630 1.00 0.00 H new ATOM 0 HD2 ARG B 215 -13.085 -4.208 6.152 1.00 0.00 H new ATOM 0 HD3 ARG B 215 -14.002 -4.535 7.609 1.00 0.00 H new ATOM 0 HE ARG B 215 -15.339 -2.474 6.137 1.00 0.00 H new ATOM 0 HH11 ARG B 215 -14.704 -5.949 6.006 1.00 0.00 H new ATOM 0 HH12 ARG B 215 -16.131 -6.281 5.018 1.00 0.00 H new ATOM 0 HH21 ARG B 215 -17.107 -2.881 4.853 1.00 0.00 H new ATOM 0 HH22 ARG B 215 -17.500 -4.531 4.361 1.00 0.00 H new ATOM 1374 N ALA B 216 -13.437 -1.785 11.884 1.00 0.00 N ATOM 1375 CA ALA B 216 -13.896 -1.809 13.260 1.00 0.00 C ATOM 1376 C ALA B 216 -13.543 -0.538 14.021 1.00 0.00 C ATOM 1377 O ALA B 216 -14.241 -0.143 14.956 1.00 0.00 O ATOM 1378 CB ALA B 216 -13.308 -3.032 13.955 1.00 0.00 C ATOM 0 H ALA B 216 -12.707 -2.469 11.684 1.00 0.00 H new ATOM 0 HA ALA B 216 -14.984 -1.866 13.252 1.00 0.00 H new ATOM 0 HB1 ALA B 216 -13.647 -3.060 14.991 1.00 0.00 H new ATOM 0 HB2 ALA B 216 -13.637 -3.935 13.441 1.00 0.00 H new ATOM 0 HB3 ALA B 216 -12.220 -2.976 13.931 1.00 0.00 H new ATOM 1384 N ALA B 217 -12.441 0.071 13.612 1.00 0.00 N ATOM 1385 CA ALA B 217 -11.891 1.311 14.143 1.00 0.00 C ATOM 1386 C ALA B 217 -12.691 2.534 13.674 1.00 0.00 C ATOM 1387 O ALA B 217 -12.782 3.519 14.411 1.00 0.00 O ATOM 1388 CB ALA B 217 -10.418 1.437 13.747 1.00 0.00 C ATOM 0 H ALA B 217 -11.872 -0.309 12.856 1.00 0.00 H new ATOM 0 HA ALA B 217 -11.965 1.278 15.230 1.00 0.00 H new ATOM 0 HB1 ALA B 217 -10.012 2.366 14.147 1.00 0.00 H new ATOM 0 HB2 ALA B 217 -9.859 0.593 14.151 1.00 0.00 H new ATOM 0 HB3 ALA B 217 -10.332 1.442 12.660 1.00 0.00 H new ATOM 1394 N ALA B 218 -13.274 2.497 12.473 1.00 0.00 N ATOM 1395 CA ALA B 218 -14.234 3.469 11.997 1.00 0.00 C ATOM 1396 C ALA B 218 -15.587 3.279 12.695 1.00 0.00 C ATOM 1397 O ALA B 218 -16.232 4.271 13.040 1.00 0.00 O ATOM 1398 CB ALA B 218 -14.360 3.375 10.473 1.00 0.00 C ATOM 0 H ALA B 218 -13.078 1.763 11.792 1.00 0.00 H new ATOM 0 HA ALA B 218 -13.883 4.471 12.243 1.00 0.00 H new ATOM 0 HB1 ALA B 218 -15.085 4.110 10.122 1.00 0.00 H new ATOM 0 HB2 ALA B 218 -13.391 3.573 10.015 1.00 0.00 H new ATOM 0 HB3 ALA B 218 -14.694 2.375 10.197 1.00 0.00 H new ATOM 1404 N ALA B 219 -15.996 2.018 12.885 1.00 0.00 N ATOM 1405 CA ALA B 219 -17.260 1.582 13.469 1.00 0.00 C ATOM 1406 C ALA B 219 -17.334 1.830 14.974 1.00 0.00 C ATOM 1407 O ALA B 219 -18.400 1.530 15.568 1.00 0.00 O ATOM 1408 CB ALA B 219 -17.432 0.088 13.171 1.00 0.00 C ATOM 1409 OXT ALA B 219 -16.367 2.328 15.588 1.00 0.00 O ATOM 0 H ALA B 219 -15.411 1.227 12.615 1.00 0.00 H new ATOM 0 HA ALA B 219 -18.064 2.167 13.023 1.00 0.00 H new ATOM 0 HB1 ALA B 219 -18.372 -0.262 13.598 1.00 0.00 H new ATOM 0 HB2 ALA B 219 -17.443 -0.069 12.092 1.00 0.00 H new ATOM 0 HB3 ALA B 219 -16.604 -0.468 13.610 1.00 0.00 H new