USER MOD reduce.3.24.130724 H: found=0, std=0, add=745, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 748 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 Set 1.1: A 61 LYS NZ :NH3+ 179:sc= 1.05 (180deg=0.234) USER MOD Set 1.2: A 93 TYR OH : rot 180:sc= 0.741 USER MOD Set 2.1: A 68 MET CE :methyl 174:sc= -0.0632 (180deg=-0.115) USER MOD Set 2.2: A 74 CYS SG : rot 119:sc= 0.365 USER MOD Set 3.1: A 47 LYS NZ :NH3+ 162:sc= 1.05 (180deg=0) USER MOD Set 3.2: A 62 THR OG1 : rot 180:sc= 0.909 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 MET CE :methyl 142:sc= -1.18 (180deg=-3.78!) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 82:sc= 1.25 USER MOD Single : A 45 MET CE :methyl -169:sc= -0.394 (180deg=-0.545) USER MOD Single : A 49 LYS NZ :NH3+ -146:sc= 1.26 (180deg=0.936) USER MOD Single : A 50 LYS NZ :NH3+ -165:sc=-0.00673 (180deg=-0.123) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl -147:sc= -0.0593 (180deg=-0.208) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 171:sc= 1.05 (180deg=0.818) USER MOD Single : A 98 SER OG : rot 180:sc= 0.729 USER MOD Single : A 109 THR OG1 : rot -20:sc= 0.74 USER MOD Single : A 110 GLN : amide:sc= -0.34 X(o=-0.34,f=-0.34) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 217 N ILE A 14 -6.692 8.067 -4.091 1.00 0.00 N ATOM 218 CA ILE A 14 -6.222 7.839 -5.454 1.00 0.00 C ATOM 219 C ILE A 14 -7.253 6.961 -6.170 1.00 0.00 C ATOM 220 O ILE A 14 -7.798 7.356 -7.204 1.00 0.00 O ATOM 221 CB ILE A 14 -4.789 7.240 -5.415 1.00 0.00 C ATOM 222 CG1 ILE A 14 -3.761 8.326 -5.022 1.00 0.00 C ATOM 223 CG2 ILE A 14 -4.373 6.597 -6.750 1.00 0.00 C ATOM 224 CD1 ILE A 14 -2.416 7.763 -4.543 1.00 0.00 C ATOM 0 HA ILE A 14 -6.138 8.766 -6.022 1.00 0.00 H new ATOM 0 HB ILE A 14 -4.804 6.451 -4.663 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -3.587 8.976 -5.880 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -4.186 8.947 -4.233 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -3.363 6.196 -6.662 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -5.063 5.790 -6.996 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -4.397 7.349 -7.539 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -1.748 8.585 -4.286 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -2.576 7.137 -3.665 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -1.968 7.167 -5.337 1.00 0.00 H new ATOM 236 N GLU A 15 -7.557 5.801 -5.589 1.00 0.00 N ATOM 237 CA GLU A 15 -8.418 4.795 -6.189 1.00 0.00 C ATOM 238 C GLU A 15 -9.847 5.308 -6.423 1.00 0.00 C ATOM 239 O GLU A 15 -10.457 4.937 -7.424 1.00 0.00 O ATOM 240 CB GLU A 15 -8.398 3.561 -5.270 1.00 0.00 C ATOM 241 CG GLU A 15 -9.383 2.464 -5.687 1.00 0.00 C ATOM 242 CD GLU A 15 -9.203 1.193 -4.838 1.00 0.00 C ATOM 243 OE1 GLU A 15 -9.763 1.113 -3.721 1.00 0.00 O ATOM 244 OE2 GLU A 15 -8.515 0.249 -5.289 1.00 0.00 O ATOM 0 H GLU A 15 -7.203 5.534 -4.671 1.00 0.00 H new ATOM 0 HA GLU A 15 -8.043 4.536 -7.179 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -7.390 3.146 -5.257 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -8.627 3.874 -4.251 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -10.404 2.831 -5.583 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -9.237 2.223 -6.740 1.00 0.00 H new ATOM 251 N THR A 16 -10.378 6.151 -5.533 1.00 0.00 N ATOM 252 CA THR A 16 -11.793 6.526 -5.541 1.00 0.00 C ATOM 253 C THR A 16 -12.062 7.921 -6.125 1.00 0.00 C ATOM 254 O THR A 16 -13.218 8.217 -6.434 1.00 0.00 O ATOM 255 CB THR A 16 -12.401 6.362 -4.133 1.00 0.00 C ATOM 256 OG1 THR A 16 -11.714 7.127 -3.163 1.00 0.00 O ATOM 257 CG2 THR A 16 -12.414 4.896 -3.679 1.00 0.00 C ATOM 0 H THR A 16 -9.839 6.592 -4.788 1.00 0.00 H new ATOM 0 HA THR A 16 -12.295 5.837 -6.220 1.00 0.00 H new ATOM 0 HB THR A 16 -13.426 6.724 -4.214 1.00 0.00 H new ATOM 0 HG1 THR A 16 -12.132 6.996 -2.287 1.00 0.00 H new ATOM 0 HG21 THR A 16 -12.850 4.828 -2.683 1.00 0.00 H new ATOM 0 HG22 THR A 16 -13.007 4.304 -4.376 1.00 0.00 H new ATOM 0 HG23 THR A 16 -11.394 4.513 -3.655 1.00 0.00 H new ATOM 265 N GLU A 17 -11.037 8.762 -6.326 1.00 0.00 N ATOM 266 CA GLU A 17 -11.233 10.144 -6.780 1.00 0.00 C ATOM 267 C GLU A 17 -10.237 10.590 -7.857 1.00 0.00 C ATOM 268 O GLU A 17 -10.509 11.594 -8.519 1.00 0.00 O ATOM 269 CB GLU A 17 -11.198 11.121 -5.588 1.00 0.00 C ATOM 270 CG GLU A 17 -12.351 10.904 -4.598 1.00 0.00 C ATOM 271 CD GLU A 17 -12.412 12.025 -3.550 1.00 0.00 C ATOM 272 OE1 GLU A 17 -13.111 13.040 -3.778 1.00 0.00 O ATOM 273 OE2 GLU A 17 -11.786 11.887 -2.476 1.00 0.00 O ATOM 0 H GLU A 17 -10.060 8.506 -6.180 1.00 0.00 H new ATOM 0 HA GLU A 17 -12.219 10.165 -7.245 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -10.250 11.010 -5.062 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -11.236 12.144 -5.963 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -13.295 10.861 -5.141 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -12.227 9.943 -4.098 1.00 0.00 H new ATOM 280 N ILE A 18 -9.130 9.871 -8.089 1.00 0.00 N ATOM 281 CA ILE A 18 -8.100 10.307 -9.040 1.00 0.00 C ATOM 282 C ILE A 18 -8.112 9.387 -10.262 1.00 0.00 C ATOM 283 O ILE A 18 -8.178 9.882 -11.385 1.00 0.00 O ATOM 284 CB ILE A 18 -6.712 10.413 -8.360 1.00 0.00 C ATOM 285 CG1 ILE A 18 -6.811 11.275 -7.074 1.00 0.00 C ATOM 286 CG2 ILE A 18 -5.678 10.996 -9.339 1.00 0.00 C ATOM 287 CD1 ILE A 18 -5.480 11.650 -6.413 1.00 0.00 C ATOM 0 H ILE A 18 -8.925 8.983 -7.630 1.00 0.00 H new ATOM 0 HA ILE A 18 -8.326 11.314 -9.389 1.00 0.00 H new ATOM 0 HB ILE A 18 -6.380 9.414 -8.076 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -7.345 12.194 -7.316 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -7.417 10.737 -6.345 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.708 11.064 -8.846 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.597 10.348 -10.211 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -5.995 11.990 -9.654 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -5.672 12.252 -5.525 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -4.947 10.743 -6.129 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -4.874 12.223 -7.115 1.00 0.00 H new ATOM 299 N ILE A 19 -8.126 8.065 -10.069 1.00 0.00 N ATOM 300 CA ILE A 19 -8.061 7.087 -11.161 1.00 0.00 C ATOM 301 C ILE A 19 -9.295 6.170 -11.190 1.00 0.00 C ATOM 302 O ILE A 19 -9.300 5.164 -11.895 1.00 0.00 O ATOM 303 CB ILE A 19 -6.720 6.340 -11.124 1.00 0.00 C ATOM 304 CG1 ILE A 19 -6.532 5.646 -9.765 1.00 0.00 C ATOM 305 CG2 ILE A 19 -5.562 7.305 -11.458 1.00 0.00 C ATOM 306 CD1 ILE A 19 -5.384 4.656 -9.812 1.00 0.00 C ATOM 0 H ILE A 19 -8.183 7.639 -9.144 1.00 0.00 H new ATOM 0 HA ILE A 19 -8.095 7.616 -12.113 1.00 0.00 H new ATOM 0 HB ILE A 19 -6.719 5.559 -11.885 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.341 6.393 -8.995 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.451 5.130 -9.487 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.617 6.763 -11.428 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -5.711 7.721 -12.455 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.540 8.113 -10.727 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -5.274 4.180 -8.838 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -5.590 3.896 -10.566 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -4.462 5.179 -10.066 1.00 0.00 H new ATOM 318 N VAL A 20 -10.354 6.522 -10.455 1.00 0.00 N ATOM 319 CA VAL A 20 -11.598 5.756 -10.375 1.00 0.00 C ATOM 320 C VAL A 20 -12.209 5.477 -11.759 1.00 0.00 C ATOM 321 O VAL A 20 -12.766 4.401 -11.983 1.00 0.00 O ATOM 322 CB VAL A 20 -12.559 6.491 -9.415 1.00 0.00 C ATOM 323 CG1 VAL A 20 -13.072 7.841 -9.945 1.00 0.00 C ATOM 324 CG2 VAL A 20 -13.738 5.611 -8.981 1.00 0.00 C ATOM 0 H VAL A 20 -10.369 7.368 -9.886 1.00 0.00 H new ATOM 0 HA VAL A 20 -11.393 4.764 -9.972 1.00 0.00 H new ATOM 0 HB VAL A 20 -11.945 6.711 -8.541 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -13.740 8.290 -9.210 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -12.227 8.507 -10.122 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -13.612 7.684 -10.878 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -14.384 6.174 -8.307 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -14.307 5.307 -9.859 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -13.362 4.726 -8.468 1.00 0.00 H new ATOM 334 N ASP A 21 -12.080 6.423 -12.696 1.00 0.00 N ATOM 335 CA ASP A 21 -12.658 6.328 -14.038 1.00 0.00 C ATOM 336 C ASP A 21 -11.668 5.726 -15.047 1.00 0.00 C ATOM 337 O ASP A 21 -12.028 5.481 -16.200 1.00 0.00 O ATOM 338 CB ASP A 21 -13.101 7.731 -14.480 1.00 0.00 C ATOM 339 CG ASP A 21 -13.853 7.722 -15.822 1.00 0.00 C ATOM 340 OD1 ASP A 21 -14.935 7.099 -15.912 1.00 0.00 O ATOM 341 OD2 ASP A 21 -13.404 8.396 -16.778 1.00 0.00 O ATOM 0 H ASP A 21 -11.563 7.288 -12.539 1.00 0.00 H new ATOM 0 HA ASP A 21 -13.517 5.657 -14.006 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -13.742 8.164 -13.712 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -12.225 8.374 -14.564 1.00 0.00 H new ATOM 346 N ALA A 22 -10.412 5.498 -14.639 1.00 0.00 N ATOM 347 CA ALA A 22 -9.365 5.023 -15.533 1.00 0.00 C ATOM 348 C ALA A 22 -9.535 3.532 -15.864 1.00 0.00 C ATOM 349 O ALA A 22 -10.270 2.807 -15.189 1.00 0.00 O ATOM 350 CB ALA A 22 -7.983 5.303 -14.933 1.00 0.00 C ATOM 0 H ALA A 22 -10.100 5.640 -13.678 1.00 0.00 H new ATOM 0 HA ALA A 22 -9.451 5.571 -16.471 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -7.211 4.942 -15.613 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -7.862 6.376 -14.783 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -7.891 4.790 -13.975 1.00 0.00 H new ATOM 356 N GLU A 23 -8.816 3.073 -16.894 1.00 0.00 N ATOM 357 CA GLU A 23 -8.913 1.710 -17.420 1.00 0.00 C ATOM 358 C GLU A 23 -7.573 1.211 -17.991 1.00 0.00 C ATOM 359 O GLU A 23 -7.298 0.012 -17.944 1.00 0.00 O ATOM 360 CB GLU A 23 -10.023 1.686 -18.489 1.00 0.00 C ATOM 361 CG GLU A 23 -10.374 0.273 -18.975 1.00 0.00 C ATOM 362 CD GLU A 23 -11.578 0.289 -19.934 1.00 0.00 C ATOM 363 OE1 GLU A 23 -11.383 0.419 -21.164 1.00 0.00 O ATOM 364 OE2 GLU A 23 -12.734 0.148 -19.473 1.00 0.00 O ATOM 0 H GLU A 23 -8.139 3.650 -17.393 1.00 0.00 H new ATOM 0 HA GLU A 23 -9.162 1.028 -16.607 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -10.919 2.155 -18.082 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -9.708 2.287 -19.342 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -9.512 -0.164 -19.479 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -10.598 -0.362 -18.118 1.00 0.00 H new ATOM 371 N ASP A 24 -6.706 2.110 -18.473 1.00 0.00 N ATOM 372 CA ASP A 24 -5.367 1.800 -18.985 1.00 0.00 C ATOM 373 C ASP A 24 -4.461 2.994 -18.685 1.00 0.00 C ATOM 374 O ASP A 24 -4.939 4.025 -18.211 1.00 0.00 O ATOM 375 CB ASP A 24 -5.420 1.524 -20.498 1.00 0.00 C ATOM 376 CG ASP A 24 -4.161 0.842 -21.070 1.00 0.00 C ATOM 377 OD1 ASP A 24 -3.257 0.447 -20.301 1.00 0.00 O ATOM 378 OD2 ASP A 24 -4.078 0.698 -22.310 1.00 0.00 O ATOM 0 H ASP A 24 -6.925 3.105 -18.518 1.00 0.00 H new ATOM 0 HA ASP A 24 -4.976 0.904 -18.503 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -6.285 0.896 -20.709 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -5.576 2.468 -21.021 1.00 0.00 H new ATOM 383 N LYS A 25 -3.164 2.886 -18.957 1.00 0.00 N ATOM 384 CA LYS A 25 -2.144 3.853 -18.558 1.00 0.00 C ATOM 385 C LYS A 25 -2.409 5.280 -19.036 1.00 0.00 C ATOM 386 O LYS A 25 -2.151 6.229 -18.297 1.00 0.00 O ATOM 387 CB LYS A 25 -0.781 3.318 -19.014 1.00 0.00 C ATOM 388 CG LYS A 25 -0.584 3.268 -20.545 1.00 0.00 C ATOM 389 CD LYS A 25 0.378 2.153 -20.982 1.00 0.00 C ATOM 390 CE LYS A 25 1.684 2.106 -20.177 1.00 0.00 C ATOM 391 NZ LYS A 25 2.604 3.231 -20.489 1.00 0.00 N ATOM 0 H LYS A 25 -2.780 2.098 -19.478 1.00 0.00 H new ATOM 0 HA LYS A 25 -2.165 3.947 -17.472 1.00 0.00 H new ATOM 0 HB2 LYS A 25 0.001 3.941 -18.581 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -0.648 2.314 -18.612 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -1.550 3.118 -21.027 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -0.201 4.229 -20.890 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -0.129 1.193 -20.889 1.00 0.00 H new ATOM 0 HD3 LYS A 25 0.618 2.286 -22.037 1.00 0.00 H new ATOM 0 HE2 LYS A 25 1.448 2.122 -19.113 1.00 0.00 H new ATOM 0 HE3 LYS A 25 2.193 1.163 -20.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 3.467 3.144 -19.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 2.856 3.204 -21.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 2.134 4.134 -20.273 1.00 0.00 H new ATOM 405 N GLU A 26 -2.963 5.438 -20.239 1.00 0.00 N ATOM 406 CA GLU A 26 -3.322 6.749 -20.774 1.00 0.00 C ATOM 407 C GLU A 26 -4.482 7.334 -19.964 1.00 0.00 C ATOM 408 O GLU A 26 -4.500 8.527 -19.665 1.00 0.00 O ATOM 409 CB GLU A 26 -3.704 6.619 -22.256 1.00 0.00 C ATOM 410 CG GLU A 26 -2.482 6.318 -23.137 1.00 0.00 C ATOM 411 CD GLU A 26 -2.869 6.204 -24.623 1.00 0.00 C ATOM 412 OE1 GLU A 26 -3.268 5.105 -25.072 1.00 0.00 O ATOM 413 OE2 GLU A 26 -2.754 7.205 -25.366 1.00 0.00 O ATOM 0 H GLU A 26 -3.174 4.662 -20.867 1.00 0.00 H new ATOM 0 HA GLU A 26 -2.468 7.422 -20.696 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -4.441 5.824 -22.373 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -4.175 7.543 -22.592 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -1.740 7.107 -23.013 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -2.017 5.388 -22.809 1.00 0.00 H new ATOM 420 N GLU A 27 -5.432 6.494 -19.552 1.00 0.00 N ATOM 421 CA GLU A 27 -6.564 6.921 -18.746 1.00 0.00 C ATOM 422 C GLU A 27 -6.115 7.217 -17.314 1.00 0.00 C ATOM 423 O GLU A 27 -6.636 8.150 -16.708 1.00 0.00 O ATOM 424 CB GLU A 27 -7.674 5.863 -18.758 1.00 0.00 C ATOM 425 CG GLU A 27 -8.094 5.371 -20.153 1.00 0.00 C ATOM 426 CD GLU A 27 -8.526 6.508 -21.099 1.00 0.00 C ATOM 427 OE1 GLU A 27 -9.401 7.322 -20.728 1.00 0.00 O ATOM 428 OE2 GLU A 27 -8.021 6.574 -22.243 1.00 0.00 O ATOM 0 H GLU A 27 -5.433 5.498 -19.771 1.00 0.00 H new ATOM 0 HA GLU A 27 -6.968 7.836 -19.179 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -7.343 5.005 -18.172 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -8.550 6.273 -18.256 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -7.263 4.829 -20.604 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -8.917 4.663 -20.048 1.00 0.00 H new ATOM 435 N ARG A 28 -5.133 6.483 -16.767 1.00 0.00 N ATOM 436 CA ARG A 28 -4.563 6.833 -15.463 1.00 0.00 C ATOM 437 C ARG A 28 -3.903 8.205 -15.555 1.00 0.00 C ATOM 438 O ARG A 28 -4.119 9.030 -14.668 1.00 0.00 O ATOM 439 CB ARG A 28 -3.564 5.780 -14.935 1.00 0.00 C ATOM 440 CG ARG A 28 -4.204 4.657 -14.098 1.00 0.00 C ATOM 441 CD ARG A 28 -4.762 3.475 -14.896 1.00 0.00 C ATOM 442 NE ARG A 28 -3.693 2.577 -15.364 1.00 0.00 N ATOM 443 CZ ARG A 28 -3.827 1.300 -15.731 1.00 0.00 C ATOM 444 NH1 ARG A 28 -5.009 0.690 -15.705 1.00 0.00 N ATOM 445 NH2 ARG A 28 -2.743 0.657 -16.136 1.00 0.00 N ATOM 0 H ARG A 28 -4.724 5.656 -17.202 1.00 0.00 H new ATOM 0 HA ARG A 28 -5.381 6.858 -14.743 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -3.044 5.333 -15.783 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -2.811 6.284 -14.329 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -3.459 4.280 -13.397 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -5.012 5.085 -13.504 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -5.461 2.915 -14.275 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -5.324 3.848 -15.752 1.00 0.00 H new ATOM 0 HE ARG A 28 -2.753 2.971 -15.413 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -5.839 1.199 -15.400 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -5.085 -0.286 -15.990 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -1.844 1.138 -16.160 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -2.807 -0.319 -16.424 1.00 0.00 H new ATOM 459 N ALA A 29 -3.147 8.475 -16.623 1.00 0.00 N ATOM 460 CA ALA A 29 -2.527 9.773 -16.831 1.00 0.00 C ATOM 461 C ALA A 29 -3.592 10.870 -16.898 1.00 0.00 C ATOM 462 O ALA A 29 -3.443 11.896 -16.239 1.00 0.00 O ATOM 463 CB ALA A 29 -1.650 9.730 -18.086 1.00 0.00 C ATOM 0 H ALA A 29 -2.952 7.799 -17.361 1.00 0.00 H new ATOM 0 HA ALA A 29 -1.882 10.013 -15.986 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -1.186 10.705 -18.240 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -0.874 8.975 -17.962 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -2.265 9.480 -18.951 1.00 0.00 H new ATOM 469 N MET A 30 -4.697 10.643 -17.618 1.00 0.00 N ATOM 470 CA MET A 30 -5.809 11.589 -17.652 1.00 0.00 C ATOM 471 C MET A 30 -6.453 11.771 -16.278 1.00 0.00 C ATOM 472 O MET A 30 -6.747 12.903 -15.907 1.00 0.00 O ATOM 473 CB MET A 30 -6.848 11.190 -18.705 1.00 0.00 C ATOM 474 CG MET A 30 -6.341 11.371 -20.142 1.00 0.00 C ATOM 475 SD MET A 30 -5.963 13.073 -20.668 1.00 0.00 S ATOM 476 CE MET A 30 -4.230 13.262 -20.155 1.00 0.00 C ATOM 0 H MET A 30 -4.841 9.808 -18.186 1.00 0.00 H new ATOM 0 HA MET A 30 -5.395 12.555 -17.940 1.00 0.00 H new ATOM 0 HB2 MET A 30 -7.130 10.148 -18.553 1.00 0.00 H new ATOM 0 HB3 MET A 30 -7.748 11.788 -18.565 1.00 0.00 H new ATOM 0 HG2 MET A 30 -5.440 10.769 -20.263 1.00 0.00 H new ATOM 0 HG3 MET A 30 -7.090 10.964 -20.821 1.00 0.00 H new ATOM 0 HE1 MET A 30 -3.690 13.840 -20.905 1.00 0.00 H new ATOM 0 HE2 MET A 30 -4.189 13.781 -19.198 1.00 0.00 H new ATOM 0 HE3 MET A 30 -3.771 12.278 -20.055 1.00 0.00 H new ATOM 486 N GLY A 31 -6.627 10.703 -15.498 1.00 0.00 N ATOM 487 CA GLY A 31 -7.184 10.787 -14.156 1.00 0.00 C ATOM 488 C GLY A 31 -6.351 11.716 -13.271 1.00 0.00 C ATOM 489 O GLY A 31 -6.878 12.677 -12.701 1.00 0.00 O ATOM 0 H GLY A 31 -6.383 9.755 -15.784 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.210 11.152 -14.207 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -7.221 9.793 -13.711 1.00 0.00 H new ATOM 493 N TRP A 32 -5.034 11.486 -13.226 1.00 0.00 N ATOM 494 CA TRP A 32 -4.112 12.355 -12.507 1.00 0.00 C ATOM 495 C TRP A 32 -4.166 13.786 -13.042 1.00 0.00 C ATOM 496 O TRP A 32 -4.256 14.722 -12.247 1.00 0.00 O ATOM 497 CB TRP A 32 -2.685 11.796 -12.578 1.00 0.00 C ATOM 498 CG TRP A 32 -2.410 10.698 -11.600 1.00 0.00 C ATOM 499 CD1 TRP A 32 -2.370 9.374 -11.863 1.00 0.00 C ATOM 500 CD2 TRP A 32 -2.138 10.823 -10.171 1.00 0.00 C ATOM 501 NE1 TRP A 32 -2.086 8.675 -10.710 1.00 0.00 N ATOM 502 CE2 TRP A 32 -1.959 9.516 -9.626 1.00 0.00 C ATOM 503 CE3 TRP A 32 -2.024 11.913 -9.281 1.00 0.00 C ATOM 504 CZ2 TRP A 32 -1.703 9.303 -8.263 1.00 0.00 C ATOM 505 CZ3 TRP A 32 -1.755 11.711 -7.915 1.00 0.00 C ATOM 506 CH2 TRP A 32 -1.598 10.410 -7.406 1.00 0.00 C ATOM 0 H TRP A 32 -4.585 10.695 -13.686 1.00 0.00 H new ATOM 0 HA TRP A 32 -4.420 12.384 -11.462 1.00 0.00 H new ATOM 0 HB2 TRP A 32 -2.502 11.424 -13.586 1.00 0.00 H new ATOM 0 HB3 TRP A 32 -1.979 12.608 -12.404 1.00 0.00 H new ATOM 0 HD1 TRP A 32 -2.536 8.929 -12.833 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -1.983 7.661 -10.665 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -2.145 12.919 -9.655 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -1.588 8.300 -7.878 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -1.669 12.560 -7.254 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -1.397 10.262 -6.355 1.00 0.00 H new ATOM 517 N TYR A 33 -4.149 13.962 -14.366 1.00 0.00 N ATOM 518 CA TYR A 33 -4.140 15.270 -14.997 1.00 0.00 C ATOM 519 C TYR A 33 -5.380 16.063 -14.596 1.00 0.00 C ATOM 520 O TYR A 33 -5.245 17.204 -14.162 1.00 0.00 O ATOM 521 CB TYR A 33 -4.043 15.098 -16.520 1.00 0.00 C ATOM 522 CG TYR A 33 -4.367 16.332 -17.340 1.00 0.00 C ATOM 523 CD1 TYR A 33 -3.669 17.536 -17.138 1.00 0.00 C ATOM 524 CD2 TYR A 33 -5.401 16.280 -18.292 1.00 0.00 C ATOM 525 CE1 TYR A 33 -4.006 18.685 -17.873 1.00 0.00 C ATOM 526 CE2 TYR A 33 -5.769 17.432 -19.006 1.00 0.00 C ATOM 527 CZ TYR A 33 -5.064 18.642 -18.809 1.00 0.00 C ATOM 528 OH TYR A 33 -5.402 19.768 -19.501 1.00 0.00 O ATOM 0 H TYR A 33 -4.141 13.188 -15.030 1.00 0.00 H new ATOM 0 HA TYR A 33 -3.272 15.836 -14.659 1.00 0.00 H new ATOM 0 HB2 TYR A 33 -3.032 14.774 -16.768 1.00 0.00 H new ATOM 0 HB3 TYR A 33 -4.717 14.296 -16.821 1.00 0.00 H new ATOM 0 HD1 TYR A 33 -2.869 17.578 -16.414 1.00 0.00 H new ATOM 0 HD2 TYR A 33 -5.915 15.348 -18.475 1.00 0.00 H new ATOM 0 HE1 TYR A 33 -3.456 19.602 -17.723 1.00 0.00 H new ATOM 0 HE2 TYR A 33 -6.591 17.394 -19.706 1.00 0.00 H new ATOM 0 HH TYR A 33 -6.148 19.569 -20.105 1.00 0.00 H new ATOM 538 N TYR A 34 -6.574 15.471 -14.688 1.00 0.00 N ATOM 539 CA TYR A 34 -7.815 16.167 -14.388 1.00 0.00 C ATOM 540 C TYR A 34 -7.873 16.549 -12.908 1.00 0.00 C ATOM 541 O TYR A 34 -8.302 17.655 -12.580 1.00 0.00 O ATOM 542 CB TYR A 34 -9.019 15.281 -14.746 1.00 0.00 C ATOM 543 CG TYR A 34 -9.180 14.827 -16.193 1.00 0.00 C ATOM 544 CD1 TYR A 34 -8.522 15.464 -17.270 1.00 0.00 C ATOM 545 CD2 TYR A 34 -10.035 13.738 -16.456 1.00 0.00 C ATOM 546 CE1 TYR A 34 -8.737 15.026 -18.590 1.00 0.00 C ATOM 547 CE2 TYR A 34 -10.247 13.291 -17.771 1.00 0.00 C ATOM 548 CZ TYR A 34 -9.601 13.938 -18.848 1.00 0.00 C ATOM 549 OH TYR A 34 -9.817 13.500 -20.120 1.00 0.00 O ATOM 0 H TYR A 34 -6.701 14.500 -14.972 1.00 0.00 H new ATOM 0 HA TYR A 34 -7.851 17.078 -14.986 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -8.972 14.389 -14.121 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -9.923 15.820 -14.465 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -7.852 16.289 -17.079 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -10.533 13.241 -15.637 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -8.240 15.524 -19.409 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -10.903 12.454 -17.958 1.00 0.00 H new ATOM 0 HH TYR A 34 -10.439 12.743 -20.104 1.00 0.00 H new ATOM 559 N TYR A 35 -7.442 15.657 -12.010 1.00 0.00 N ATOM 560 CA TYR A 35 -7.497 15.919 -10.579 1.00 0.00 C ATOM 561 C TYR A 35 -6.542 17.056 -10.203 1.00 0.00 C ATOM 562 O TYR A 35 -6.928 17.981 -9.486 1.00 0.00 O ATOM 563 CB TYR A 35 -7.172 14.633 -9.813 1.00 0.00 C ATOM 564 CG TYR A 35 -7.461 14.731 -8.328 1.00 0.00 C ATOM 565 CD1 TYR A 35 -8.776 14.547 -7.859 1.00 0.00 C ATOM 566 CD2 TYR A 35 -6.422 14.996 -7.416 1.00 0.00 C ATOM 567 CE1 TYR A 35 -9.053 14.620 -6.482 1.00 0.00 C ATOM 568 CE2 TYR A 35 -6.691 15.075 -6.038 1.00 0.00 C ATOM 569 CZ TYR A 35 -8.011 14.885 -5.564 1.00 0.00 C ATOM 570 OH TYR A 35 -8.291 14.948 -4.231 1.00 0.00 O ATOM 0 H TYR A 35 -7.051 14.747 -12.256 1.00 0.00 H new ATOM 0 HA TYR A 35 -8.503 16.238 -10.306 1.00 0.00 H new ATOM 0 HB2 TYR A 35 -7.750 13.811 -10.235 1.00 0.00 H new ATOM 0 HB3 TYR A 35 -6.119 14.389 -9.956 1.00 0.00 H new ATOM 0 HD1 TYR A 35 -9.574 14.349 -8.559 1.00 0.00 H new ATOM 0 HD2 TYR A 35 -5.414 15.139 -7.776 1.00 0.00 H new ATOM 0 HE1 TYR A 35 -10.062 14.474 -6.126 1.00 0.00 H new ATOM 0 HE2 TYR A 35 -5.891 15.280 -5.342 1.00 0.00 H new ATOM 0 HH TYR A 35 -7.469 15.137 -3.733 1.00 0.00 H new ATOM 580 N LEU A 36 -5.306 17.026 -10.708 1.00 0.00 N ATOM 581 CA LEU A 36 -4.319 18.064 -10.431 1.00 0.00 C ATOM 582 C LEU A 36 -4.763 19.381 -11.066 1.00 0.00 C ATOM 583 O LEU A 36 -4.666 20.414 -10.411 1.00 0.00 O ATOM 584 CB LEU A 36 -2.929 17.630 -10.929 1.00 0.00 C ATOM 585 CG LEU A 36 -2.059 16.918 -9.871 1.00 0.00 C ATOM 586 CD1 LEU A 36 -2.775 15.806 -9.095 1.00 0.00 C ATOM 587 CD2 LEU A 36 -0.829 16.320 -10.561 1.00 0.00 C ATOM 0 H LEU A 36 -4.966 16.283 -11.318 1.00 0.00 H new ATOM 0 HA LEU A 36 -4.245 18.217 -9.354 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -3.055 16.965 -11.783 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -2.395 18.510 -11.287 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.794 17.680 -9.138 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -2.087 15.363 -8.375 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.632 16.224 -8.568 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.116 15.039 -9.790 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.207 15.814 -9.822 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.149 15.603 -11.318 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -0.255 17.116 -11.035 1.00 0.00 H new ATOM 599 N ASP A 37 -5.317 19.358 -12.280 1.00 0.00 N ATOM 600 CA ASP A 37 -5.852 20.547 -12.944 1.00 0.00 C ATOM 601 C ASP A 37 -6.977 21.189 -12.128 1.00 0.00 C ATOM 602 O ASP A 37 -7.087 22.415 -12.089 1.00 0.00 O ATOM 603 CB ASP A 37 -6.353 20.181 -14.347 1.00 0.00 C ATOM 604 CG ASP A 37 -7.089 21.348 -15.026 1.00 0.00 C ATOM 605 OD1 ASP A 37 -6.425 22.206 -15.647 1.00 0.00 O ATOM 606 OD2 ASP A 37 -8.340 21.384 -14.991 1.00 0.00 O ATOM 0 H ASP A 37 -5.407 18.506 -12.834 1.00 0.00 H new ATOM 0 HA ASP A 37 -5.047 21.278 -13.028 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -5.508 19.879 -14.965 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -7.021 19.323 -14.279 1.00 0.00 H new ATOM 611 N ASP A 38 -7.781 20.376 -11.438 1.00 0.00 N ATOM 612 CA ASP A 38 -8.855 20.857 -10.568 1.00 0.00 C ATOM 613 C ASP A 38 -8.333 21.345 -9.209 1.00 0.00 C ATOM 614 O ASP A 38 -8.998 22.144 -8.548 1.00 0.00 O ATOM 615 CB ASP A 38 -9.889 19.743 -10.362 1.00 0.00 C ATOM 616 CG ASP A 38 -11.062 20.209 -9.483 1.00 0.00 C ATOM 617 OD1 ASP A 38 -11.869 21.050 -9.941 1.00 0.00 O ATOM 618 OD2 ASP A 38 -11.221 19.698 -8.351 1.00 0.00 O ATOM 0 H ASP A 38 -7.704 19.359 -11.468 1.00 0.00 H new ATOM 0 HA ASP A 38 -9.318 21.712 -11.061 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -10.268 19.415 -11.330 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -9.408 18.881 -9.899 1.00 0.00 H new ATOM 623 N THR A 39 -7.145 20.898 -8.793 1.00 0.00 N ATOM 624 CA THR A 39 -6.643 21.117 -7.438 1.00 0.00 C ATOM 625 C THR A 39 -5.640 22.274 -7.371 1.00 0.00 C ATOM 626 O THR A 39 -5.709 23.094 -6.453 1.00 0.00 O ATOM 627 CB THR A 39 -6.007 19.808 -6.936 1.00 0.00 C ATOM 628 OG1 THR A 39 -6.970 18.774 -6.911 1.00 0.00 O ATOM 629 CG2 THR A 39 -5.405 19.966 -5.539 1.00 0.00 C ATOM 0 H THR A 39 -6.505 20.373 -9.389 1.00 0.00 H new ATOM 0 HA THR A 39 -7.477 21.400 -6.796 1.00 0.00 H new ATOM 0 HB THR A 39 -5.205 19.554 -7.629 1.00 0.00 H new ATOM 0 HG1 THR A 39 -7.071 18.399 -7.811 1.00 0.00 H new ATOM 0 HG21 THR A 39 -4.967 19.019 -5.222 1.00 0.00 H new ATOM 0 HG22 THR A 39 -4.632 20.734 -5.561 1.00 0.00 H new ATOM 0 HG23 THR A 39 -6.186 20.257 -4.837 1.00 0.00 H new ATOM 637 N LEU A 40 -4.687 22.322 -8.302 1.00 0.00 N ATOM 638 CA LEU A 40 -3.551 23.232 -8.246 1.00 0.00 C ATOM 639 C LEU A 40 -4.051 24.655 -8.516 1.00 0.00 C ATOM 640 O LEU A 40 -4.684 24.914 -9.541 1.00 0.00 O ATOM 641 CB LEU A 40 -2.499 22.821 -9.293 1.00 0.00 C ATOM 642 CG LEU A 40 -1.847 21.433 -9.101 1.00 0.00 C ATOM 643 CD1 LEU A 40 -1.171 21.006 -10.410 1.00 0.00 C ATOM 644 CD2 LEU A 40 -0.798 21.377 -7.991 1.00 0.00 C ATOM 0 H LEU A 40 -4.686 21.720 -9.126 1.00 0.00 H new ATOM 0 HA LEU A 40 -3.085 23.191 -7.261 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -2.968 22.846 -10.277 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.709 23.572 -9.297 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.657 20.763 -8.812 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.710 20.027 -10.279 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.916 20.953 -11.204 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.406 21.734 -10.679 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -0.392 20.368 -7.925 1.00 0.00 H new ATOM 0 HD22 LEU A 40 0.006 22.078 -8.215 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -1.259 21.646 -7.041 1.00 0.00 H new ATOM 656 N GLU A 41 -3.744 25.591 -7.621 1.00 0.00 N ATOM 657 CA GLU A 41 -4.195 26.983 -7.666 1.00 0.00 C ATOM 658 C GLU A 41 -3.248 27.826 -8.542 1.00 0.00 C ATOM 659 O GLU A 41 -2.823 28.915 -8.151 1.00 0.00 O ATOM 660 CB GLU A 41 -4.323 27.536 -6.229 1.00 0.00 C ATOM 661 CG GLU A 41 -5.428 26.867 -5.393 1.00 0.00 C ATOM 662 CD GLU A 41 -6.838 27.261 -5.873 1.00 0.00 C ATOM 663 OE1 GLU A 41 -7.382 28.282 -5.392 1.00 0.00 O ATOM 664 OE2 GLU A 41 -7.428 26.557 -6.723 1.00 0.00 O ATOM 0 H GLU A 41 -3.152 25.395 -6.814 1.00 0.00 H new ATOM 0 HA GLU A 41 -5.181 27.037 -8.127 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -3.369 27.411 -5.717 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -4.519 28.607 -6.280 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -5.317 25.784 -5.447 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -5.310 27.148 -4.346 1.00 0.00 H new ATOM 671 N PHE A 42 -2.853 27.307 -9.710 1.00 0.00 N ATOM 672 CA PHE A 42 -2.049 28.063 -10.670 1.00 0.00 C ATOM 673 C PHE A 42 -2.826 29.291 -11.195 1.00 0.00 C ATOM 674 O PHE A 42 -4.063 29.271 -11.188 1.00 0.00 O ATOM 675 CB PHE A 42 -1.544 27.139 -11.791 1.00 0.00 C ATOM 676 CG PHE A 42 -2.569 26.217 -12.426 1.00 0.00 C ATOM 677 CD1 PHE A 42 -3.584 26.734 -13.253 1.00 0.00 C ATOM 678 CD2 PHE A 42 -2.459 24.824 -12.245 1.00 0.00 C ATOM 679 CE1 PHE A 42 -4.512 25.867 -13.857 1.00 0.00 C ATOM 680 CE2 PHE A 42 -3.390 23.959 -12.844 1.00 0.00 C ATOM 681 CZ PHE A 42 -4.420 24.481 -13.643 1.00 0.00 C ATOM 0 H PHE A 42 -3.080 26.360 -10.012 1.00 0.00 H new ATOM 0 HA PHE A 42 -1.166 28.457 -10.167 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -1.112 27.760 -12.576 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -0.737 26.526 -11.390 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -3.650 27.798 -13.424 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -1.657 24.420 -11.644 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -5.295 26.266 -14.485 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -3.314 22.893 -12.690 1.00 0.00 H new ATOM 0 HZ PHE A 42 -5.142 23.817 -14.094 1.00 0.00 H new ATOM 691 N PRO A 43 -2.149 30.346 -11.693 1.00 0.00 N ATOM 692 CA PRO A 43 -0.697 30.509 -11.722 1.00 0.00 C ATOM 693 C PRO A 43 -0.118 30.684 -10.311 1.00 0.00 C ATOM 694 O PRO A 43 -0.758 31.275 -9.438 1.00 0.00 O ATOM 695 CB PRO A 43 -0.436 31.737 -12.600 1.00 0.00 C ATOM 696 CG PRO A 43 -1.702 32.574 -12.430 1.00 0.00 C ATOM 697 CD PRO A 43 -2.795 31.517 -12.269 1.00 0.00 C ATOM 0 HA PRO A 43 -0.206 29.623 -12.125 1.00 0.00 H new ATOM 0 HB2 PRO A 43 0.451 32.281 -12.275 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -0.276 31.459 -13.642 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -1.640 33.227 -11.559 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -1.883 33.213 -13.295 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -3.593 31.879 -11.621 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -3.249 31.277 -13.231 1.00 0.00 H new ATOM 705 N PHE A 44 1.092 30.164 -10.089 1.00 0.00 N ATOM 706 CA PHE A 44 1.798 30.238 -8.811 1.00 0.00 C ATOM 707 C PHE A 44 3.306 30.311 -9.067 1.00 0.00 C ATOM 708 O PHE A 44 3.752 30.063 -10.183 1.00 0.00 O ATOM 709 CB PHE A 44 1.410 29.050 -7.905 1.00 0.00 C ATOM 710 CG PHE A 44 1.768 27.644 -8.375 1.00 0.00 C ATOM 711 CD1 PHE A 44 3.101 27.204 -8.325 1.00 0.00 C ATOM 712 CD2 PHE A 44 0.769 26.727 -8.756 1.00 0.00 C ATOM 713 CE1 PHE A 44 3.448 25.890 -8.670 1.00 0.00 C ATOM 714 CE2 PHE A 44 1.111 25.411 -9.123 1.00 0.00 C ATOM 715 CZ PHE A 44 2.451 24.990 -9.081 1.00 0.00 C ATOM 0 H PHE A 44 1.618 29.669 -10.810 1.00 0.00 H new ATOM 0 HA PHE A 44 1.505 31.143 -8.279 1.00 0.00 H new ATOM 0 HB2 PHE A 44 1.876 29.206 -6.932 1.00 0.00 H new ATOM 0 HB3 PHE A 44 0.332 29.086 -7.751 1.00 0.00 H new ATOM 0 HD1 PHE A 44 3.874 27.891 -8.015 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -0.266 27.035 -8.767 1.00 0.00 H new ATOM 0 HE1 PHE A 44 4.479 25.571 -8.620 1.00 0.00 H new ATOM 0 HE2 PHE A 44 0.340 24.723 -9.438 1.00 0.00 H new ATOM 0 HZ PHE A 44 2.713 23.981 -9.363 1.00 0.00 H new ATOM 725 N MET A 45 4.111 30.643 -8.059 1.00 0.00 N ATOM 726 CA MET A 45 5.570 30.710 -8.190 1.00 0.00 C ATOM 727 C MET A 45 6.170 29.371 -7.754 1.00 0.00 C ATOM 728 O MET A 45 5.673 28.775 -6.799 1.00 0.00 O ATOM 729 CB MET A 45 6.068 31.848 -7.288 1.00 0.00 C ATOM 730 CG MET A 45 7.576 32.072 -7.393 1.00 0.00 C ATOM 731 SD MET A 45 8.206 33.264 -6.188 1.00 0.00 S ATOM 732 CE MET A 45 9.960 33.097 -6.582 1.00 0.00 C ATOM 0 H MET A 45 3.771 30.874 -7.125 1.00 0.00 H new ATOM 0 HA MET A 45 5.869 30.902 -9.221 1.00 0.00 H new ATOM 0 HB2 MET A 45 5.549 32.769 -7.554 1.00 0.00 H new ATOM 0 HB3 MET A 45 5.810 31.624 -6.253 1.00 0.00 H new ATOM 0 HG2 MET A 45 8.088 31.120 -7.254 1.00 0.00 H new ATOM 0 HG3 MET A 45 7.816 32.420 -8.398 1.00 0.00 H new ATOM 0 HE1 MET A 45 10.554 33.603 -5.821 1.00 0.00 H new ATOM 0 HE2 MET A 45 10.228 32.041 -6.608 1.00 0.00 H new ATOM 0 HE3 MET A 45 10.159 33.546 -7.555 1.00 0.00 H new ATOM 742 N GLY A 46 7.257 28.900 -8.370 1.00 0.00 N ATOM 743 CA GLY A 46 7.940 27.705 -7.908 1.00 0.00 C ATOM 744 C GLY A 46 9.412 27.729 -8.272 1.00 0.00 C ATOM 745 O GLY A 46 9.884 28.597 -9.008 1.00 0.00 O ATOM 0 H GLY A 46 7.678 29.334 -9.191 1.00 0.00 H new ATOM 0 HA2 GLY A 46 7.833 27.619 -6.827 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.470 26.824 -8.346 1.00 0.00 H new ATOM 749 N LYS A 47 10.150 26.769 -7.730 1.00 0.00 N ATOM 750 CA LYS A 47 11.520 26.503 -8.140 1.00 0.00 C ATOM 751 C LYS A 47 11.470 25.293 -9.063 1.00 0.00 C ATOM 752 O LYS A 47 10.937 24.248 -8.682 1.00 0.00 O ATOM 753 CB LYS A 47 12.408 26.222 -6.911 1.00 0.00 C ATOM 754 CG LYS A 47 13.910 26.310 -7.235 1.00 0.00 C ATOM 755 CD LYS A 47 14.418 27.753 -7.415 1.00 0.00 C ATOM 756 CE LYS A 47 14.486 28.520 -6.084 1.00 0.00 C ATOM 757 NZ LYS A 47 15.205 29.812 -6.221 1.00 0.00 N ATOM 0 H LYS A 47 9.813 26.152 -6.991 1.00 0.00 H new ATOM 0 HA LYS A 47 11.952 27.363 -8.652 1.00 0.00 H new ATOM 0 HB2 LYS A 47 12.168 26.935 -6.123 1.00 0.00 H new ATOM 0 HB3 LYS A 47 12.181 25.229 -6.523 1.00 0.00 H new ATOM 0 HG2 LYS A 47 14.475 25.832 -6.434 1.00 0.00 H new ATOM 0 HG3 LYS A 47 14.110 25.747 -8.146 1.00 0.00 H new ATOM 0 HD2 LYS A 47 15.408 27.733 -7.871 1.00 0.00 H new ATOM 0 HD3 LYS A 47 13.761 28.284 -8.104 1.00 0.00 H new ATOM 0 HE2 LYS A 47 13.475 28.705 -5.720 1.00 0.00 H new ATOM 0 HE3 LYS A 47 14.986 27.905 -5.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 14.973 30.425 -5.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 16.230 29.638 -6.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 14.916 30.278 -7.104 1.00 0.00 H new ATOM 771 N TRP A 48 12.000 25.431 -10.274 1.00 0.00 N ATOM 772 CA TRP A 48 12.228 24.307 -11.161 1.00 0.00 C ATOM 773 C TRP A 48 13.545 23.708 -10.672 1.00 0.00 C ATOM 774 O TRP A 48 14.619 24.271 -10.891 1.00 0.00 O ATOM 775 CB TRP A 48 12.268 24.763 -12.631 1.00 0.00 C ATOM 776 CG TRP A 48 12.374 23.684 -13.674 1.00 0.00 C ATOM 777 CD1 TRP A 48 12.483 22.357 -13.442 1.00 0.00 C ATOM 778 CD2 TRP A 48 12.363 23.813 -15.132 1.00 0.00 C ATOM 779 NE1 TRP A 48 12.582 21.668 -14.629 1.00 0.00 N ATOM 780 CE2 TRP A 48 12.530 22.517 -15.710 1.00 0.00 C ATOM 781 CE3 TRP A 48 12.203 24.891 -16.030 1.00 0.00 C ATOM 782 CZ2 TRP A 48 12.576 22.309 -17.097 1.00 0.00 C ATOM 783 CZ3 TRP A 48 12.220 24.691 -17.425 1.00 0.00 C ATOM 784 CH2 TRP A 48 12.418 23.406 -17.959 1.00 0.00 C ATOM 0 H TRP A 48 12.283 26.330 -10.664 1.00 0.00 H new ATOM 0 HA TRP A 48 11.430 23.565 -11.136 1.00 0.00 H new ATOM 0 HB2 TRP A 48 11.366 25.342 -12.832 1.00 0.00 H new ATOM 0 HB3 TRP A 48 13.114 25.439 -12.754 1.00 0.00 H new ATOM 0 HD1 TRP A 48 12.491 21.901 -12.463 1.00 0.00 H new ATOM 0 HE1 TRP A 48 12.681 20.655 -14.699 1.00 0.00 H new ATOM 0 HE3 TRP A 48 12.065 25.889 -15.640 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 12.731 21.318 -17.496 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 12.080 25.531 -18.089 1.00 0.00 H new ATOM 0 HH2 TRP A 48 12.449 23.263 -19.029 1.00 0.00 H new ATOM 795 N LYS A 49 13.455 22.600 -9.941 1.00 0.00 N ATOM 796 CA LYS A 49 14.564 21.791 -9.454 1.00 0.00 C ATOM 797 C LYS A 49 14.895 20.798 -10.571 1.00 0.00 C ATOM 798 O LYS A 49 14.638 19.597 -10.465 1.00 0.00 O ATOM 799 CB LYS A 49 14.116 21.092 -8.158 1.00 0.00 C ATOM 800 CG LYS A 49 13.885 22.090 -7.011 1.00 0.00 C ATOM 801 CD LYS A 49 13.204 21.427 -5.810 1.00 0.00 C ATOM 802 CE LYS A 49 14.124 20.484 -5.027 1.00 0.00 C ATOM 803 NZ LYS A 49 13.385 19.776 -3.952 1.00 0.00 N ATOM 0 H LYS A 49 12.551 22.222 -9.657 1.00 0.00 H new ATOM 0 HA LYS A 49 15.454 22.374 -9.218 1.00 0.00 H new ATOM 0 HB2 LYS A 49 13.197 20.537 -8.345 1.00 0.00 H new ATOM 0 HB3 LYS A 49 14.872 20.366 -7.859 1.00 0.00 H new ATOM 0 HG2 LYS A 49 14.840 22.513 -6.700 1.00 0.00 H new ATOM 0 HG3 LYS A 49 13.270 22.917 -7.367 1.00 0.00 H new ATOM 0 HD2 LYS A 49 12.835 22.202 -5.138 1.00 0.00 H new ATOM 0 HD3 LYS A 49 12.336 20.868 -6.158 1.00 0.00 H new ATOM 0 HE2 LYS A 49 14.566 19.756 -5.707 1.00 0.00 H new ATOM 0 HE3 LYS A 49 14.946 21.053 -4.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 14.013 19.631 -3.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 12.565 20.346 -3.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 13.058 18.854 -4.305 1.00 0.00 H new ATOM 817 N LYS A 50 15.344 21.338 -11.700 1.00 0.00 N ATOM 818 CA LYS A 50 15.587 20.575 -12.913 1.00 0.00 C ATOM 819 C LYS A 50 16.681 19.554 -12.623 1.00 0.00 C ATOM 820 O LYS A 50 17.699 19.922 -12.035 1.00 0.00 O ATOM 821 CB LYS A 50 15.999 21.526 -14.046 1.00 0.00 C ATOM 822 CG LYS A 50 16.009 20.780 -15.387 1.00 0.00 C ATOM 823 CD LYS A 50 16.633 21.617 -16.507 1.00 0.00 C ATOM 824 CE LYS A 50 17.026 20.722 -17.693 1.00 0.00 C ATOM 825 NZ LYS A 50 18.223 19.885 -17.403 1.00 0.00 N ATOM 0 H LYS A 50 15.551 22.332 -11.796 1.00 0.00 H new ATOM 0 HA LYS A 50 14.684 20.052 -13.229 1.00 0.00 H new ATOM 0 HB2 LYS A 50 15.307 22.367 -14.094 1.00 0.00 H new ATOM 0 HB3 LYS A 50 16.988 21.938 -13.843 1.00 0.00 H new ATOM 0 HG2 LYS A 50 16.564 19.848 -15.279 1.00 0.00 H new ATOM 0 HG3 LYS A 50 14.988 20.513 -15.660 1.00 0.00 H new ATOM 0 HD2 LYS A 50 15.926 22.378 -16.837 1.00 0.00 H new ATOM 0 HD3 LYS A 50 17.513 22.140 -16.131 1.00 0.00 H new ATOM 0 HE2 LYS A 50 16.187 20.075 -17.949 1.00 0.00 H new ATOM 0 HE3 LYS A 50 17.225 21.346 -18.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 18.599 19.498 -18.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 18.951 20.468 -16.944 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 17.955 19.104 -16.771 1.00 0.00 H new ATOM 957 N ILE A 58 20.671 18.072 -9.085 1.00 0.00 N ATOM 958 CA ILE A 58 19.606 19.050 -9.284 1.00 0.00 C ATOM 959 C ILE A 58 20.272 20.406 -9.542 1.00 0.00 C ATOM 960 O ILE A 58 21.245 20.777 -8.880 1.00 0.00 O ATOM 961 CB ILE A 58 18.693 19.055 -8.031 1.00 0.00 C ATOM 962 CG1 ILE A 58 17.953 17.710 -7.816 1.00 0.00 C ATOM 963 CG2 ILE A 58 17.683 20.215 -8.025 1.00 0.00 C ATOM 964 CD1 ILE A 58 16.852 17.383 -8.833 1.00 0.00 C ATOM 0 HA ILE A 58 18.973 18.810 -10.138 1.00 0.00 H new ATOM 0 HB ILE A 58 19.377 19.202 -7.195 1.00 0.00 H new ATOM 0 HG12 ILE A 58 18.688 16.906 -7.834 1.00 0.00 H new ATOM 0 HG13 ILE A 58 17.511 17.716 -6.820 1.00 0.00 H new ATOM 0 HG21 ILE A 58 17.074 20.163 -7.123 1.00 0.00 H new ATOM 0 HG22 ILE A 58 18.219 21.164 -8.047 1.00 0.00 H new ATOM 0 HG23 ILE A 58 17.039 20.142 -8.902 1.00 0.00 H new ATOM 0 HD11 ILE A 58 16.403 16.421 -8.586 1.00 0.00 H new ATOM 0 HD12 ILE A 58 16.087 18.159 -8.803 1.00 0.00 H new ATOM 0 HD13 ILE A 58 17.283 17.336 -9.833 1.00 0.00 H new ATOM 976 N GLU A 59 19.695 21.143 -10.484 1.00 0.00 N ATOM 977 CA GLU A 59 19.962 22.534 -10.800 1.00 0.00 C ATOM 978 C GLU A 59 18.667 23.267 -10.425 1.00 0.00 C ATOM 979 O GLU A 59 17.583 22.684 -10.494 1.00 0.00 O ATOM 980 CB GLU A 59 20.258 22.678 -12.306 1.00 0.00 C ATOM 981 CG GLU A 59 21.601 22.077 -12.756 1.00 0.00 C ATOM 982 CD GLU A 59 22.800 22.941 -12.320 1.00 0.00 C ATOM 983 OE1 GLU A 59 23.210 23.842 -13.088 1.00 0.00 O ATOM 984 OE2 GLU A 59 23.358 22.728 -11.221 1.00 0.00 O ATOM 0 H GLU A 59 18.975 20.750 -11.090 1.00 0.00 H new ATOM 0 HA GLU A 59 20.825 22.934 -10.268 1.00 0.00 H new ATOM 0 HB2 GLU A 59 19.455 22.201 -12.868 1.00 0.00 H new ATOM 0 HB3 GLU A 59 20.243 23.736 -12.566 1.00 0.00 H new ATOM 0 HG2 GLU A 59 21.707 21.075 -12.340 1.00 0.00 H new ATOM 0 HG3 GLU A 59 21.605 21.973 -13.841 1.00 0.00 H new ATOM 991 N GLU A 60 18.746 24.532 -10.015 1.00 0.00 N ATOM 992 CA GLU A 60 17.606 25.240 -9.437 1.00 0.00 C ATOM 993 C GLU A 60 17.414 26.563 -10.168 1.00 0.00 C ATOM 994 O GLU A 60 18.352 27.358 -10.283 1.00 0.00 O ATOM 995 CB GLU A 60 17.827 25.453 -7.932 1.00 0.00 C ATOM 996 CG GLU A 60 17.777 24.129 -7.161 1.00 0.00 C ATOM 997 CD GLU A 60 17.945 24.348 -5.648 1.00 0.00 C ATOM 998 OE1 GLU A 60 16.933 24.542 -4.938 1.00 0.00 O ATOM 999 OE2 GLU A 60 19.093 24.317 -5.147 1.00 0.00 O ATOM 0 H GLU A 60 19.597 25.092 -10.074 1.00 0.00 H new ATOM 0 HA GLU A 60 16.699 24.647 -9.556 1.00 0.00 H new ATOM 0 HB2 GLU A 60 18.792 25.933 -7.770 1.00 0.00 H new ATOM 0 HB3 GLU A 60 17.065 26.130 -7.544 1.00 0.00 H new ATOM 0 HG2 GLU A 60 16.827 23.631 -7.354 1.00 0.00 H new ATOM 0 HG3 GLU A 60 18.563 23.467 -7.523 1.00 0.00 H new ATOM 1006 N LYS A 61 16.193 26.798 -10.658 1.00 0.00 N ATOM 1007 CA LYS A 61 15.841 27.978 -11.444 1.00 0.00 C ATOM 1008 C LYS A 61 14.490 28.479 -10.958 1.00 0.00 C ATOM 1009 O LYS A 61 13.564 27.684 -10.805 1.00 0.00 O ATOM 1010 CB LYS A 61 15.806 27.557 -12.921 1.00 0.00 C ATOM 1011 CG LYS A 61 15.471 28.703 -13.889 1.00 0.00 C ATOM 1012 CD LYS A 61 15.674 28.291 -15.357 1.00 0.00 C ATOM 1013 CE LYS A 61 14.830 27.064 -15.740 1.00 0.00 C ATOM 1014 NZ LYS A 61 15.034 26.656 -17.151 1.00 0.00 N ATOM 0 H LYS A 61 15.410 26.160 -10.515 1.00 0.00 H new ATOM 0 HA LYS A 61 16.562 28.788 -11.332 1.00 0.00 H new ATOM 0 HB2 LYS A 61 16.775 27.138 -13.192 1.00 0.00 H new ATOM 0 HB3 LYS A 61 15.069 26.763 -13.045 1.00 0.00 H new ATOM 0 HG2 LYS A 61 14.437 29.015 -13.739 1.00 0.00 H new ATOM 0 HG3 LYS A 61 16.100 29.564 -13.663 1.00 0.00 H new ATOM 0 HD2 LYS A 61 15.412 29.126 -16.006 1.00 0.00 H new ATOM 0 HD3 LYS A 61 16.728 28.072 -15.528 1.00 0.00 H new ATOM 0 HE2 LYS A 61 15.085 26.232 -15.084 1.00 0.00 H new ATOM 0 HE3 LYS A 61 13.775 27.287 -15.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 14.457 25.815 -17.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 14.750 27.433 -17.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 16.038 26.433 -17.306 1.00 0.00 H new ATOM 1028 N THR A 62 14.369 29.766 -10.667 1.00 0.00 N ATOM 1029 CA THR A 62 13.142 30.345 -10.140 1.00 0.00 C ATOM 1030 C THR A 62 12.181 30.602 -11.303 1.00 0.00 C ATOM 1031 O THR A 62 12.564 31.231 -12.294 1.00 0.00 O ATOM 1032 CB THR A 62 13.509 31.624 -9.376 1.00 0.00 C ATOM 1033 OG1 THR A 62 14.627 31.380 -8.538 1.00 0.00 O ATOM 1034 CG2 THR A 62 12.363 32.063 -8.476 1.00 0.00 C ATOM 0 H THR A 62 15.123 30.441 -10.791 1.00 0.00 H new ATOM 0 HA THR A 62 12.637 29.673 -9.446 1.00 0.00 H new ATOM 0 HB THR A 62 13.729 32.396 -10.113 1.00 0.00 H new ATOM 0 HG1 THR A 62 14.858 32.200 -8.054 1.00 0.00 H new ATOM 0 HG21 THR A 62 12.646 32.972 -7.944 1.00 0.00 H new ATOM 0 HG22 THR A 62 11.478 32.258 -9.082 1.00 0.00 H new ATOM 0 HG23 THR A 62 12.143 31.275 -7.756 1.00 0.00 H new ATOM 1042 N VAL A 63 10.936 30.128 -11.204 1.00 0.00 N ATOM 1043 CA VAL A 63 9.996 30.159 -12.313 1.00 0.00 C ATOM 1044 C VAL A 63 8.602 30.551 -11.825 1.00 0.00 C ATOM 1045 O VAL A 63 8.230 30.351 -10.667 1.00 0.00 O ATOM 1046 CB VAL A 63 9.964 28.804 -13.064 1.00 0.00 C ATOM 1047 CG1 VAL A 63 11.328 28.391 -13.639 1.00 0.00 C ATOM 1048 CG2 VAL A 63 9.448 27.633 -12.215 1.00 0.00 C ATOM 0 H VAL A 63 10.558 29.714 -10.352 1.00 0.00 H new ATOM 0 HA VAL A 63 10.335 30.916 -13.020 1.00 0.00 H new ATOM 0 HB VAL A 63 9.263 28.996 -13.876 1.00 0.00 H new ATOM 0 HG11 VAL A 63 11.232 27.434 -14.151 1.00 0.00 H new ATOM 0 HG12 VAL A 63 11.669 29.148 -14.345 1.00 0.00 H new ATOM 0 HG13 VAL A 63 12.051 28.298 -12.829 1.00 0.00 H new ATOM 0 HG21 VAL A 63 9.456 26.720 -12.811 1.00 0.00 H new ATOM 0 HG22 VAL A 63 10.091 27.504 -11.345 1.00 0.00 H new ATOM 0 HG23 VAL A 63 8.430 27.843 -11.886 1.00 0.00 H new ATOM 1058 N GLU A 64 7.823 31.112 -12.735 1.00 0.00 N ATOM 1059 CA GLU A 64 6.403 31.349 -12.566 1.00 0.00 C ATOM 1060 C GLU A 64 5.748 30.185 -13.307 1.00 0.00 C ATOM 1061 O GLU A 64 6.084 29.926 -14.460 1.00 0.00 O ATOM 1062 CB GLU A 64 6.024 32.720 -13.149 1.00 0.00 C ATOM 1063 CG GLU A 64 4.523 33.000 -12.989 1.00 0.00 C ATOM 1064 CD GLU A 64 4.174 34.448 -13.377 1.00 0.00 C ATOM 1065 OE1 GLU A 64 4.017 34.744 -14.583 1.00 0.00 O ATOM 1066 OE2 GLU A 64 4.036 35.305 -12.474 1.00 0.00 O ATOM 0 H GLU A 64 8.175 31.424 -13.640 1.00 0.00 H new ATOM 0 HA GLU A 64 6.080 31.385 -11.525 1.00 0.00 H new ATOM 0 HB2 GLU A 64 6.597 33.501 -12.649 1.00 0.00 H new ATOM 0 HB3 GLU A 64 6.292 32.755 -14.205 1.00 0.00 H new ATOM 0 HG2 GLU A 64 3.955 32.309 -13.611 1.00 0.00 H new ATOM 0 HG3 GLU A 64 4.226 32.817 -11.956 1.00 0.00 H new ATOM 1073 N VAL A 65 4.869 29.448 -12.641 1.00 0.00 N ATOM 1074 CA VAL A 65 4.167 28.292 -13.172 1.00 0.00 C ATOM 1075 C VAL A 65 2.812 28.806 -13.644 1.00 0.00 C ATOM 1076 O VAL A 65 2.000 29.249 -12.831 1.00 0.00 O ATOM 1077 CB VAL A 65 4.050 27.204 -12.081 1.00 0.00 C ATOM 1078 CG1 VAL A 65 3.365 25.947 -12.635 1.00 0.00 C ATOM 1079 CG2 VAL A 65 5.435 26.821 -11.526 1.00 0.00 C ATOM 0 H VAL A 65 4.616 29.650 -11.674 1.00 0.00 H new ATOM 0 HA VAL A 65 4.693 27.824 -14.004 1.00 0.00 H new ATOM 0 HB VAL A 65 3.446 27.619 -11.274 1.00 0.00 H new ATOM 0 HG11 VAL A 65 3.294 25.195 -11.849 1.00 0.00 H new ATOM 0 HG12 VAL A 65 2.365 26.202 -12.985 1.00 0.00 H new ATOM 0 HG13 VAL A 65 3.949 25.550 -13.465 1.00 0.00 H new ATOM 0 HG21 VAL A 65 5.321 26.054 -10.760 1.00 0.00 H new ATOM 0 HG22 VAL A 65 6.057 26.437 -12.334 1.00 0.00 H new ATOM 0 HG23 VAL A 65 5.908 27.701 -11.090 1.00 0.00 H new ATOM 1089 N LEU A 66 2.590 28.804 -14.959 1.00 0.00 N ATOM 1090 CA LEU A 66 1.389 29.368 -15.566 1.00 0.00 C ATOM 1091 C LEU A 66 0.200 28.434 -15.350 1.00 0.00 C ATOM 1092 O LEU A 66 -0.913 28.903 -15.112 1.00 0.00 O ATOM 1093 CB LEU A 66 1.586 29.589 -17.080 1.00 0.00 C ATOM 1094 CG LEU A 66 2.493 30.757 -17.515 1.00 0.00 C ATOM 1095 CD1 LEU A 66 1.999 32.110 -16.989 1.00 0.00 C ATOM 1096 CD2 LEU A 66 3.959 30.557 -17.118 1.00 0.00 C ATOM 0 H LEU A 66 3.244 28.408 -15.635 1.00 0.00 H new ATOM 0 HA LEU A 66 1.195 30.329 -15.089 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.993 28.671 -17.504 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.604 29.740 -17.529 1.00 0.00 H new ATOM 0 HG LEU A 66 2.436 30.764 -18.603 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.673 32.899 -17.324 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.996 32.304 -17.369 1.00 0.00 H new ATOM 0 HD13 LEU A 66 1.976 32.090 -15.899 1.00 0.00 H new ATOM 0 HD21 LEU A 66 4.546 31.412 -17.452 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.033 30.467 -16.034 1.00 0.00 H new ATOM 0 HD23 LEU A 66 4.342 29.650 -17.585 1.00 0.00 H new ATOM 1108 N GLY A 67 0.425 27.122 -15.436 1.00 0.00 N ATOM 1109 CA GLY A 67 -0.596 26.104 -15.327 1.00 0.00 C ATOM 1110 C GLY A 67 -0.031 24.790 -15.838 1.00 0.00 C ATOM 1111 O GLY A 67 1.123 24.723 -16.273 1.00 0.00 O ATOM 0 H GLY A 67 1.357 26.736 -15.589 1.00 0.00 H new ATOM 0 HA2 GLY A 67 -0.916 26.000 -14.290 1.00 0.00 H new ATOM 0 HA3 GLY A 67 -1.475 26.387 -15.905 1.00 0.00 H new ATOM 1115 N MET A 68 -0.834 23.734 -15.774 1.00 0.00 N ATOM 1116 CA MET A 68 -0.478 22.454 -16.377 1.00 0.00 C ATOM 1117 C MET A 68 -0.379 22.598 -17.897 1.00 0.00 C ATOM 1118 O MET A 68 -1.054 23.432 -18.508 1.00 0.00 O ATOM 1119 CB MET A 68 -1.464 21.349 -15.979 1.00 0.00 C ATOM 1120 CG MET A 68 -1.355 21.047 -14.481 1.00 0.00 C ATOM 1121 SD MET A 68 -2.364 19.651 -13.932 1.00 0.00 S ATOM 1122 CE MET A 68 -1.248 18.275 -14.310 1.00 0.00 C ATOM 0 H MET A 68 -1.741 23.739 -15.308 1.00 0.00 H new ATOM 0 HA MET A 68 0.499 22.156 -15.996 1.00 0.00 H new ATOM 0 HB2 MET A 68 -2.481 21.657 -16.221 1.00 0.00 H new ATOM 0 HB3 MET A 68 -1.259 20.446 -16.554 1.00 0.00 H new ATOM 0 HG2 MET A 68 -0.312 20.845 -14.237 1.00 0.00 H new ATOM 0 HG3 MET A 68 -1.647 21.935 -13.920 1.00 0.00 H new ATOM 0 HE1 MET A 68 -1.676 17.346 -13.933 1.00 0.00 H new ATOM 0 HE2 MET A 68 -1.114 18.201 -15.389 1.00 0.00 H new ATOM 0 HE3 MET A 68 -0.282 18.449 -13.835 1.00 0.00 H new ATOM 1132 N ALA A 69 0.468 21.762 -18.497 1.00 0.00 N ATOM 1133 CA ALA A 69 0.560 21.584 -19.940 1.00 0.00 C ATOM 1134 C ALA A 69 -0.780 21.048 -20.490 1.00 0.00 C ATOM 1135 O ALA A 69 -1.607 20.567 -19.708 1.00 0.00 O ATOM 1136 CB ALA A 69 1.716 20.612 -20.205 1.00 0.00 C ATOM 0 H ALA A 69 1.123 21.177 -17.978 1.00 0.00 H new ATOM 0 HA ALA A 69 0.755 22.529 -20.448 1.00 0.00 H new ATOM 0 HB1 ALA A 69 1.818 20.452 -21.278 1.00 0.00 H new ATOM 0 HB2 ALA A 69 2.642 21.032 -19.811 1.00 0.00 H new ATOM 0 HB3 ALA A 69 1.511 19.661 -19.714 1.00 0.00 H new ATOM 1142 N PRO A 70 -1.016 21.090 -21.815 1.00 0.00 N ATOM 1143 CA PRO A 70 -2.212 20.496 -22.403 1.00 0.00 C ATOM 1144 C PRO A 70 -2.255 18.979 -22.184 1.00 0.00 C ATOM 1145 O PRO A 70 -1.240 18.331 -21.902 1.00 0.00 O ATOM 1146 CB PRO A 70 -2.181 20.874 -23.889 1.00 0.00 C ATOM 1147 CG PRO A 70 -0.702 21.133 -24.167 1.00 0.00 C ATOM 1148 CD PRO A 70 -0.209 21.724 -22.848 1.00 0.00 C ATOM 0 HA PRO A 70 -3.119 20.871 -21.930 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -2.571 20.071 -24.514 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -2.787 21.758 -24.090 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -0.172 20.216 -24.423 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -0.561 21.824 -24.998 1.00 0.00 H new ATOM 0 HD2 PRO A 70 0.851 21.521 -22.698 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -0.331 22.807 -22.833 1.00 0.00 H new ATOM 1156 N ASP A 71 -3.440 18.399 -22.382 1.00 0.00 N ATOM 1157 CA ASP A 71 -3.678 16.962 -22.254 1.00 0.00 C ATOM 1158 C ASP A 71 -2.786 16.143 -23.191 1.00 0.00 C ATOM 1159 O ASP A 71 -2.422 15.021 -22.854 1.00 0.00 O ATOM 1160 CB ASP A 71 -5.157 16.623 -22.494 1.00 0.00 C ATOM 1161 CG ASP A 71 -5.519 16.495 -23.984 1.00 0.00 C ATOM 1162 OD1 ASP A 71 -5.616 17.536 -24.672 1.00 0.00 O ATOM 1163 OD2 ASP A 71 -5.750 15.364 -24.466 1.00 0.00 O ATOM 0 H ASP A 71 -4.275 18.925 -22.640 1.00 0.00 H new ATOM 0 HA ASP A 71 -3.418 16.690 -21.231 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -5.395 15.687 -21.988 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -5.778 17.396 -22.042 1.00 0.00 H new ATOM 1168 N ASP A 72 -2.382 16.711 -24.332 1.00 0.00 N ATOM 1169 CA ASP A 72 -1.507 16.046 -25.298 1.00 0.00 C ATOM 1170 C ASP A 72 -0.135 15.721 -24.697 1.00 0.00 C ATOM 1171 O ASP A 72 0.472 14.707 -25.043 1.00 0.00 O ATOM 1172 CB ASP A 72 -1.341 16.926 -26.540 1.00 0.00 C ATOM 1173 CG ASP A 72 -0.447 16.246 -27.590 1.00 0.00 C ATOM 1174 OD1 ASP A 72 -0.871 15.228 -28.183 1.00 0.00 O ATOM 1175 OD2 ASP A 72 0.660 16.757 -27.871 1.00 0.00 O ATOM 0 H ASP A 72 -2.656 17.653 -24.612 1.00 0.00 H new ATOM 0 HA ASP A 72 -1.975 15.102 -25.577 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -2.319 17.136 -26.973 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -0.906 17.884 -26.254 1.00 0.00 H new ATOM 1180 N GLU A 73 0.331 16.552 -23.760 1.00 0.00 N ATOM 1181 CA GLU A 73 1.544 16.298 -22.991 1.00 0.00 C ATOM 1182 C GLU A 73 1.186 15.452 -21.767 1.00 0.00 C ATOM 1183 O GLU A 73 1.870 14.470 -21.466 1.00 0.00 O ATOM 1184 CB GLU A 73 2.175 17.629 -22.547 1.00 0.00 C ATOM 1185 CG GLU A 73 2.721 18.485 -23.700 1.00 0.00 C ATOM 1186 CD GLU A 73 3.969 17.862 -24.356 1.00 0.00 C ATOM 1187 OE1 GLU A 73 5.102 18.160 -23.916 1.00 0.00 O ATOM 1188 OE2 GLU A 73 3.836 17.094 -25.335 1.00 0.00 O ATOM 0 H GLU A 73 -0.131 17.428 -23.515 1.00 0.00 H new ATOM 0 HA GLU A 73 2.265 15.763 -23.608 1.00 0.00 H new ATOM 0 HB2 GLU A 73 1.429 18.207 -22.002 1.00 0.00 H new ATOM 0 HB3 GLU A 73 2.986 17.419 -21.850 1.00 0.00 H new ATOM 0 HG2 GLU A 73 1.944 18.613 -24.453 1.00 0.00 H new ATOM 0 HG3 GLU A 73 2.969 19.478 -23.326 1.00 0.00 H new ATOM 1195 N CYS A 74 0.086 15.787 -21.081 1.00 0.00 N ATOM 1196 CA CYS A 74 -0.281 15.158 -19.815 1.00 0.00 C ATOM 1197 C CYS A 74 -0.778 13.710 -19.943 1.00 0.00 C ATOM 1198 O CYS A 74 -1.152 13.096 -18.946 1.00 0.00 O ATOM 1199 CB CYS A 74 -1.242 16.042 -19.018 1.00 0.00 C ATOM 1200 SG CYS A 74 -0.465 17.653 -18.704 1.00 0.00 S ATOM 0 H CYS A 74 -0.572 16.502 -21.392 1.00 0.00 H new ATOM 0 HA CYS A 74 0.645 15.071 -19.247 1.00 0.00 H new ATOM 0 HB2 CYS A 74 -2.172 16.176 -19.570 1.00 0.00 H new ATOM 0 HB3 CYS A 74 -1.498 15.560 -18.075 1.00 0.00 H new ATOM 0 HG CYS A 74 -1.181 18.593 -19.245 1.00 0.00 H new ATOM 1206 N LEU A 75 -0.777 13.156 -21.155 1.00 0.00 N ATOM 1207 CA LEU A 75 -1.007 11.741 -21.435 1.00 0.00 C ATOM 1208 C LEU A 75 0.247 10.916 -21.136 1.00 0.00 C ATOM 1209 O LEU A 75 0.148 9.699 -20.979 1.00 0.00 O ATOM 1210 CB LEU A 75 -1.376 11.561 -22.921 1.00 0.00 C ATOM 1211 CG LEU A 75 -2.879 11.726 -23.207 1.00 0.00 C ATOM 1212 CD1 LEU A 75 -3.103 11.952 -24.705 1.00 0.00 C ATOM 1213 CD2 LEU A 75 -3.671 10.491 -22.758 1.00 0.00 C ATOM 0 H LEU A 75 -0.610 13.702 -22.000 1.00 0.00 H new ATOM 0 HA LEU A 75 -1.821 11.395 -20.798 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -0.820 12.286 -23.515 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -1.059 10.571 -23.248 1.00 0.00 H new ATOM 0 HG LEU A 75 -3.234 12.589 -22.643 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -4.169 12.068 -24.900 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.576 12.853 -25.020 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.723 11.096 -25.263 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -4.729 10.639 -22.974 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -3.311 9.613 -23.294 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -3.537 10.342 -21.687 1.00 0.00 H new ATOM 1225 N LYS A 76 1.420 11.555 -21.085 1.00 0.00 N ATOM 1226 CA LYS A 76 2.709 10.872 -21.022 1.00 0.00 C ATOM 1227 C LYS A 76 3.300 11.002 -19.625 1.00 0.00 C ATOM 1228 O LYS A 76 3.829 10.025 -19.098 1.00 0.00 O ATOM 1229 CB LYS A 76 3.665 11.466 -22.071 1.00 0.00 C ATOM 1230 CG LYS A 76 3.133 11.341 -23.510 1.00 0.00 C ATOM 1231 CD LYS A 76 4.120 11.954 -24.515 1.00 0.00 C ATOM 1232 CE LYS A 76 3.570 11.957 -25.950 1.00 0.00 C ATOM 1233 NZ LYS A 76 3.445 10.596 -26.532 1.00 0.00 N ATOM 0 H LYS A 76 1.498 12.572 -21.086 1.00 0.00 H new ATOM 0 HA LYS A 76 2.566 9.813 -21.239 1.00 0.00 H new ATOM 0 HB2 LYS A 76 3.837 12.518 -21.843 1.00 0.00 H new ATOM 0 HB3 LYS A 76 4.630 10.963 -22.001 1.00 0.00 H new ATOM 0 HG2 LYS A 76 2.968 10.291 -23.751 1.00 0.00 H new ATOM 0 HG3 LYS A 76 2.168 11.842 -23.590 1.00 0.00 H new ATOM 0 HD2 LYS A 76 4.351 12.976 -24.215 1.00 0.00 H new ATOM 0 HD3 LYS A 76 5.055 11.395 -24.489 1.00 0.00 H new ATOM 0 HE2 LYS A 76 2.592 12.439 -25.956 1.00 0.00 H new ATOM 0 HE3 LYS A 76 4.225 12.557 -26.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 3.069 10.665 -27.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 4.380 10.141 -26.555 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 2.798 10.027 -25.949 1.00 0.00 H new ATOM 1247 N ASP A 77 3.198 12.187 -19.023 1.00 0.00 N ATOM 1248 CA ASP A 77 3.699 12.498 -17.682 1.00 0.00 C ATOM 1249 C ASP A 77 3.061 13.820 -17.246 1.00 0.00 C ATOM 1250 O ASP A 77 2.481 14.508 -18.084 1.00 0.00 O ATOM 1251 CB ASP A 77 5.234 12.618 -17.700 1.00 0.00 C ATOM 1252 CG ASP A 77 5.846 12.757 -16.301 1.00 0.00 C ATOM 1253 OD1 ASP A 77 5.176 12.390 -15.310 1.00 0.00 O ATOM 1254 OD2 ASP A 77 7.018 13.184 -16.205 1.00 0.00 O ATOM 0 H ASP A 77 2.749 12.986 -19.471 1.00 0.00 H new ATOM 0 HA ASP A 77 3.439 11.704 -16.982 1.00 0.00 H new ATOM 0 HB2 ASP A 77 5.655 11.739 -18.188 1.00 0.00 H new ATOM 0 HB3 ASP A 77 5.517 13.482 -18.301 1.00 0.00 H new ATOM 1259 N MET A 78 3.127 14.201 -15.970 1.00 0.00 N ATOM 1260 CA MET A 78 2.582 15.480 -15.521 1.00 0.00 C ATOM 1261 C MET A 78 3.582 16.584 -15.871 1.00 0.00 C ATOM 1262 O MET A 78 4.748 16.530 -15.466 1.00 0.00 O ATOM 1263 CB MET A 78 2.290 15.460 -14.013 1.00 0.00 C ATOM 1264 CG MET A 78 1.181 14.477 -13.615 1.00 0.00 C ATOM 1265 SD MET A 78 -0.452 14.745 -14.368 1.00 0.00 S ATOM 1266 CE MET A 78 -0.436 13.443 -15.632 1.00 0.00 C ATOM 0 H MET A 78 3.552 13.642 -15.231 1.00 0.00 H new ATOM 0 HA MET A 78 1.635 15.669 -16.026 1.00 0.00 H new ATOM 0 HB2 MET A 78 3.203 15.200 -13.478 1.00 0.00 H new ATOM 0 HB3 MET A 78 2.007 16.463 -13.693 1.00 0.00 H new ATOM 0 HG2 MET A 78 1.512 13.470 -13.868 1.00 0.00 H new ATOM 0 HG3 MET A 78 1.067 14.513 -12.532 1.00 0.00 H new ATOM 0 HE1 MET A 78 -0.993 13.778 -16.507 1.00 0.00 H new ATOM 0 HE2 MET A 78 0.593 13.226 -15.918 1.00 0.00 H new ATOM 0 HE3 MET A 78 -0.899 12.541 -15.231 1.00 0.00 H new ATOM 1276 N TYR A 79 3.118 17.611 -16.584 1.00 0.00 N ATOM 1277 CA TYR A 79 3.937 18.717 -17.066 1.00 0.00 C ATOM 1278 C TYR A 79 3.217 20.038 -16.800 1.00 0.00 C ATOM 1279 O TYR A 79 1.991 20.076 -16.665 1.00 0.00 O ATOM 1280 CB TYR A 79 4.196 18.571 -18.574 1.00 0.00 C ATOM 1281 CG TYR A 79 5.059 17.410 -19.032 1.00 0.00 C ATOM 1282 CD1 TYR A 79 6.461 17.478 -18.923 1.00 0.00 C ATOM 1283 CD2 TYR A 79 4.464 16.309 -19.676 1.00 0.00 C ATOM 1284 CE1 TYR A 79 7.264 16.459 -19.466 1.00 0.00 C ATOM 1285 CE2 TYR A 79 5.258 15.291 -20.228 1.00 0.00 C ATOM 1286 CZ TYR A 79 6.666 15.360 -20.124 1.00 0.00 C ATOM 1287 OH TYR A 79 7.457 14.382 -20.652 1.00 0.00 O ATOM 0 H TYR A 79 2.136 17.696 -16.848 1.00 0.00 H new ATOM 0 HA TYR A 79 4.892 18.705 -16.540 1.00 0.00 H new ATOM 0 HB2 TYR A 79 3.231 18.489 -19.074 1.00 0.00 H new ATOM 0 HB3 TYR A 79 4.660 19.493 -18.925 1.00 0.00 H new ATOM 0 HD1 TYR A 79 6.922 18.316 -18.421 1.00 0.00 H new ATOM 0 HD2 TYR A 79 3.388 16.247 -19.746 1.00 0.00 H new ATOM 0 HE1 TYR A 79 8.339 16.516 -19.380 1.00 0.00 H new ATOM 0 HE2 TYR A 79 4.793 14.456 -20.732 1.00 0.00 H new ATOM 0 HH TYR A 79 6.895 13.696 -21.069 1.00 0.00 H new ATOM 1297 N VAL A 80 3.982 21.125 -16.763 1.00 0.00 N ATOM 1298 CA VAL A 80 3.516 22.461 -16.432 1.00 0.00 C ATOM 1299 C VAL A 80 4.229 23.448 -17.346 1.00 0.00 C ATOM 1300 O VAL A 80 5.412 23.281 -17.645 1.00 0.00 O ATOM 1301 CB VAL A 80 3.764 22.779 -14.940 1.00 0.00 C ATOM 1302 CG1 VAL A 80 2.666 22.198 -14.040 1.00 0.00 C ATOM 1303 CG2 VAL A 80 5.126 22.297 -14.410 1.00 0.00 C ATOM 0 H VAL A 80 4.980 21.095 -16.971 1.00 0.00 H new ATOM 0 HA VAL A 80 2.440 22.535 -16.588 1.00 0.00 H new ATOM 0 HB VAL A 80 3.753 23.868 -14.898 1.00 0.00 H new ATOM 0 HG11 VAL A 80 2.880 22.445 -13.000 1.00 0.00 H new ATOM 0 HG12 VAL A 80 1.702 22.621 -14.323 1.00 0.00 H new ATOM 0 HG13 VAL A 80 2.635 21.115 -14.157 1.00 0.00 H new ATOM 0 HG21 VAL A 80 5.220 22.560 -13.356 1.00 0.00 H new ATOM 0 HG22 VAL A 80 5.198 21.215 -14.522 1.00 0.00 H new ATOM 0 HG23 VAL A 80 5.926 22.774 -14.976 1.00 0.00 H new ATOM 1313 N GLU A 81 3.506 24.465 -17.805 1.00 0.00 N ATOM 1314 CA GLU A 81 4.085 25.581 -18.526 1.00 0.00 C ATOM 1315 C GLU A 81 4.681 26.511 -17.474 1.00 0.00 C ATOM 1316 O GLU A 81 4.014 26.839 -16.486 1.00 0.00 O ATOM 1317 CB GLU A 81 3.014 26.299 -19.359 1.00 0.00 C ATOM 1318 CG GLU A 81 2.525 25.430 -20.526 1.00 0.00 C ATOM 1319 CD GLU A 81 1.560 26.207 -21.440 1.00 0.00 C ATOM 1320 OE1 GLU A 81 0.345 26.269 -21.144 1.00 0.00 O ATOM 1321 OE2 GLU A 81 2.003 26.749 -22.478 1.00 0.00 O ATOM 0 H GLU A 81 2.496 24.533 -17.683 1.00 0.00 H new ATOM 0 HA GLU A 81 4.852 25.247 -19.225 1.00 0.00 H new ATOM 0 HB2 GLU A 81 2.170 26.559 -18.720 1.00 0.00 H new ATOM 0 HB3 GLU A 81 3.420 27.233 -19.746 1.00 0.00 H new ATOM 0 HG2 GLU A 81 3.380 25.084 -21.107 1.00 0.00 H new ATOM 0 HG3 GLU A 81 2.025 24.543 -20.137 1.00 0.00 H new ATOM 1328 N VAL A 82 5.925 26.937 -17.673 1.00 0.00 N ATOM 1329 CA VAL A 82 6.659 27.754 -16.723 1.00 0.00 C ATOM 1330 C VAL A 82 7.417 28.848 -17.476 1.00 0.00 C ATOM 1331 O VAL A 82 7.820 28.656 -18.625 1.00 0.00 O ATOM 1332 CB VAL A 82 7.584 26.886 -15.835 1.00 0.00 C ATOM 1333 CG1 VAL A 82 6.842 25.736 -15.137 1.00 0.00 C ATOM 1334 CG2 VAL A 82 8.787 26.289 -16.582 1.00 0.00 C ATOM 0 H VAL A 82 6.457 26.718 -18.515 1.00 0.00 H new ATOM 0 HA VAL A 82 5.960 28.239 -16.041 1.00 0.00 H new ATOM 0 HB VAL A 82 7.950 27.594 -15.091 1.00 0.00 H new ATOM 0 HG11 VAL A 82 7.545 25.165 -14.530 1.00 0.00 H new ATOM 0 HG12 VAL A 82 6.058 26.143 -14.498 1.00 0.00 H new ATOM 0 HG13 VAL A 82 6.396 25.083 -15.887 1.00 0.00 H new ATOM 0 HG21 VAL A 82 9.386 25.695 -15.892 1.00 0.00 H new ATOM 0 HG22 VAL A 82 8.433 25.654 -17.394 1.00 0.00 H new ATOM 0 HG23 VAL A 82 9.397 27.094 -16.991 1.00 0.00 H new ATOM 1344 N ALA A 83 7.642 29.984 -16.823 1.00 0.00 N ATOM 1345 CA ALA A 83 8.400 31.107 -17.346 1.00 0.00 C ATOM 1346 C ALA A 83 9.531 31.365 -16.364 1.00 0.00 C ATOM 1347 O ALA A 83 9.291 31.494 -15.163 1.00 0.00 O ATOM 1348 CB ALA A 83 7.498 32.337 -17.477 1.00 0.00 C ATOM 0 H ALA A 83 7.287 30.150 -15.881 1.00 0.00 H new ATOM 0 HA ALA A 83 8.796 30.891 -18.339 1.00 0.00 H new ATOM 0 HB1 ALA A 83 8.077 33.173 -17.870 1.00 0.00 H new ATOM 0 HB2 ALA A 83 6.675 32.114 -18.156 1.00 0.00 H new ATOM 0 HB3 ALA A 83 7.098 32.601 -16.498 1.00 0.00 H new ATOM 1354 N ASP A 84 10.761 31.405 -16.865 1.00 0.00 N ATOM 1355 CA ASP A 84 11.928 31.711 -16.040 1.00 0.00 C ATOM 1356 C ASP A 84 11.865 33.163 -15.568 1.00 0.00 C ATOM 1357 O ASP A 84 11.841 34.079 -16.390 1.00 0.00 O ATOM 1358 CB ASP A 84 13.223 31.441 -16.808 1.00 0.00 C ATOM 1359 CG ASP A 84 14.401 32.159 -16.146 1.00 0.00 C ATOM 1360 OD1 ASP A 84 14.691 31.872 -14.966 1.00 0.00 O ATOM 1361 OD2 ASP A 84 14.986 33.050 -16.797 1.00 0.00 O ATOM 0 H ASP A 84 10.978 31.228 -17.846 1.00 0.00 H new ATOM 0 HA ASP A 84 11.920 31.060 -15.166 1.00 0.00 H new ATOM 0 HB2 ASP A 84 13.416 30.369 -16.841 1.00 0.00 H new ATOM 0 HB3 ASP A 84 13.118 31.778 -17.839 1.00 0.00 H new ATOM 1366 N ILE A 85 11.845 33.373 -14.251 1.00 0.00 N ATOM 1367 CA ILE A 85 11.830 34.705 -13.650 1.00 0.00 C ATOM 1368 C ILE A 85 13.265 35.272 -13.633 1.00 0.00 C ATOM 1369 O ILE A 85 13.445 36.491 -13.624 1.00 0.00 O ATOM 1370 CB ILE A 85 11.187 34.647 -12.236 1.00 0.00 C ATOM 1371 CG1 ILE A 85 9.772 34.014 -12.268 1.00 0.00 C ATOM 1372 CG2 ILE A 85 11.069 36.043 -11.596 1.00 0.00 C ATOM 1373 CD1 ILE A 85 9.119 33.839 -10.887 1.00 0.00 C ATOM 0 H ILE A 85 11.839 32.616 -13.567 1.00 0.00 H new ATOM 0 HA ILE A 85 11.216 35.382 -14.244 1.00 0.00 H new ATOM 0 HB ILE A 85 11.855 34.026 -11.639 1.00 0.00 H new ATOM 0 HG12 ILE A 85 9.124 34.636 -12.886 1.00 0.00 H new ATOM 0 HG13 ILE A 85 9.835 33.039 -12.752 1.00 0.00 H new ATOM 0 HG21 ILE A 85 10.614 35.954 -10.609 1.00 0.00 H new ATOM 0 HG22 ILE A 85 12.061 36.484 -11.500 1.00 0.00 H new ATOM 0 HG23 ILE A 85 10.448 36.680 -12.225 1.00 0.00 H new ATOM 0 HD11 ILE A 85 8.133 33.390 -11.005 1.00 0.00 H new ATOM 0 HD12 ILE A 85 9.741 33.191 -10.270 1.00 0.00 H new ATOM 0 HD13 ILE A 85 9.019 34.812 -10.406 1.00 0.00 H new ATOM 1457 N VAL A 92 7.894 31.655 -22.277 1.00 0.00 N ATOM 1458 CA VAL A 92 7.417 30.501 -21.522 1.00 0.00 C ATOM 1459 C VAL A 92 7.856 29.216 -22.240 1.00 0.00 C ATOM 1460 O VAL A 92 7.920 29.172 -23.472 1.00 0.00 O ATOM 1461 CB VAL A 92 5.870 30.582 -21.416 1.00 0.00 C ATOM 1462 CG1 VAL A 92 5.297 29.627 -20.361 1.00 0.00 C ATOM 1463 CG2 VAL A 92 5.328 31.993 -21.103 1.00 0.00 C ATOM 0 HA VAL A 92 7.838 30.494 -20.517 1.00 0.00 H new ATOM 0 HB VAL A 92 5.540 30.292 -22.414 1.00 0.00 H new ATOM 0 HG11 VAL A 92 4.212 29.727 -20.331 1.00 0.00 H new ATOM 0 HG12 VAL A 92 5.560 28.601 -20.618 1.00 0.00 H new ATOM 0 HG13 VAL A 92 5.711 29.874 -19.383 1.00 0.00 H new ATOM 0 HG21 VAL A 92 4.240 31.961 -21.046 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.731 32.334 -20.149 1.00 0.00 H new ATOM 0 HG23 VAL A 92 5.630 32.682 -21.892 1.00 0.00 H new ATOM 1473 N TYR A 93 8.129 28.170 -21.462 1.00 0.00 N ATOM 1474 CA TYR A 93 8.408 26.810 -21.920 1.00 0.00 C ATOM 1475 C TYR A 93 7.763 25.811 -20.944 1.00 0.00 C ATOM 1476 O TYR A 93 6.840 26.187 -20.223 1.00 0.00 O ATOM 1477 CB TYR A 93 9.915 26.606 -22.209 1.00 0.00 C ATOM 1478 CG TYR A 93 10.978 27.179 -21.275 1.00 0.00 C ATOM 1479 CD1 TYR A 93 10.734 27.488 -19.920 1.00 0.00 C ATOM 1480 CD2 TYR A 93 12.265 27.396 -21.807 1.00 0.00 C ATOM 1481 CE1 TYR A 93 11.751 28.051 -19.124 1.00 0.00 C ATOM 1482 CE2 TYR A 93 13.291 27.936 -21.013 1.00 0.00 C ATOM 1483 CZ TYR A 93 13.036 28.271 -19.667 1.00 0.00 C ATOM 1484 OH TYR A 93 14.028 28.790 -18.890 1.00 0.00 O ATOM 0 H TYR A 93 8.163 28.252 -20.446 1.00 0.00 H new ATOM 0 HA TYR A 93 7.945 26.620 -22.889 1.00 0.00 H new ATOM 0 HB2 TYR A 93 10.087 25.531 -22.267 1.00 0.00 H new ATOM 0 HB3 TYR A 93 10.108 27.014 -23.201 1.00 0.00 H new ATOM 0 HD1 TYR A 93 9.763 27.292 -19.491 1.00 0.00 H new ATOM 0 HD2 TYR A 93 12.465 27.144 -22.838 1.00 0.00 H new ATOM 0 HE1 TYR A 93 11.548 28.315 -18.097 1.00 0.00 H new ATOM 0 HE2 TYR A 93 14.273 28.094 -21.433 1.00 0.00 H new ATOM 0 HH TYR A 93 14.848 28.875 -19.420 1.00 0.00 H new ATOM 1494 N THR A 94 8.187 24.547 -20.931 1.00 0.00 N ATOM 1495 CA THR A 94 7.504 23.474 -20.206 1.00 0.00 C ATOM 1496 C THR A 94 8.510 22.719 -19.332 1.00 0.00 C ATOM 1497 O THR A 94 9.660 22.515 -19.732 1.00 0.00 O ATOM 1498 CB THR A 94 6.778 22.549 -21.210 1.00 0.00 C ATOM 1499 OG1 THR A 94 6.113 23.298 -22.215 1.00 0.00 O ATOM 1500 CG2 THR A 94 5.721 21.666 -20.541 1.00 0.00 C ATOM 0 H THR A 94 9.022 24.236 -21.428 1.00 0.00 H new ATOM 0 HA THR A 94 6.747 23.889 -19.541 1.00 0.00 H new ATOM 0 HB THR A 94 7.561 21.925 -21.639 1.00 0.00 H new ATOM 0 HG1 THR A 94 5.665 22.687 -22.836 1.00 0.00 H new ATOM 0 HG21 THR A 94 5.243 21.038 -21.293 1.00 0.00 H new ATOM 0 HG22 THR A 94 6.196 21.035 -19.790 1.00 0.00 H new ATOM 0 HG23 THR A 94 4.970 22.296 -20.064 1.00 0.00 H new ATOM 1508 N ALA A 95 8.056 22.297 -18.151 1.00 0.00 N ATOM 1509 CA ALA A 95 8.814 21.545 -17.163 1.00 0.00 C ATOM 1510 C ALA A 95 7.973 20.358 -16.696 1.00 0.00 C ATOM 1511 O ALA A 95 6.744 20.384 -16.785 1.00 0.00 O ATOM 1512 CB ALA A 95 9.142 22.464 -15.979 1.00 0.00 C ATOM 0 H ALA A 95 7.100 22.483 -17.847 1.00 0.00 H new ATOM 0 HA ALA A 95 9.745 21.177 -17.595 1.00 0.00 H new ATOM 0 HB1 ALA A 95 9.710 21.908 -15.233 1.00 0.00 H new ATOM 0 HB2 ALA A 95 9.733 23.311 -16.328 1.00 0.00 H new ATOM 0 HB3 ALA A 95 8.216 22.827 -15.533 1.00 0.00 H new ATOM 1518 N LYS A 96 8.622 19.313 -16.178 1.00 0.00 N ATOM 1519 CA LYS A 96 7.931 18.225 -15.508 1.00 0.00 C ATOM 1520 C LYS A 96 7.446 18.767 -14.175 1.00 0.00 C ATOM 1521 O LYS A 96 8.214 19.417 -13.462 1.00 0.00 O ATOM 1522 CB LYS A 96 8.901 17.061 -15.258 1.00 0.00 C ATOM 1523 CG LYS A 96 9.345 16.347 -16.544 1.00 0.00 C ATOM 1524 CD LYS A 96 10.509 15.387 -16.257 1.00 0.00 C ATOM 1525 CE LYS A 96 11.850 16.139 -16.207 1.00 0.00 C ATOM 1526 NZ LYS A 96 12.860 15.443 -15.375 1.00 0.00 N ATOM 0 H LYS A 96 9.635 19.203 -16.214 1.00 0.00 H new ATOM 0 HA LYS A 96 7.104 17.860 -16.116 1.00 0.00 H new ATOM 0 HB2 LYS A 96 9.782 17.438 -14.738 1.00 0.00 H new ATOM 0 HB3 LYS A 96 8.425 16.338 -14.596 1.00 0.00 H new ATOM 0 HG2 LYS A 96 8.506 15.794 -16.967 1.00 0.00 H new ATOM 0 HG3 LYS A 96 9.649 17.083 -17.288 1.00 0.00 H new ATOM 0 HD2 LYS A 96 10.339 14.878 -15.308 1.00 0.00 H new ATOM 0 HD3 LYS A 96 10.549 14.618 -17.029 1.00 0.00 H new ATOM 0 HE2 LYS A 96 12.236 16.255 -17.220 1.00 0.00 H new ATOM 0 HE3 LYS A 96 11.686 17.141 -15.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 13.785 15.903 -15.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.577 15.489 -14.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 12.927 14.448 -15.671 1.00 0.00 H new ATOM 1540 N LEU A 97 6.218 18.432 -13.786 1.00 0.00 N ATOM 1541 CA LEU A 97 5.747 18.702 -12.428 1.00 0.00 C ATOM 1542 C LEU A 97 6.650 17.961 -11.428 1.00 0.00 C ATOM 1543 O LEU A 97 6.881 18.439 -10.321 1.00 0.00 O ATOM 1544 CB LEU A 97 4.281 18.262 -12.286 1.00 0.00 C ATOM 1545 CG LEU A 97 3.660 18.591 -10.911 1.00 0.00 C ATOM 1546 CD1 LEU A 97 3.622 20.100 -10.638 1.00 0.00 C ATOM 1547 CD2 LEU A 97 2.233 18.040 -10.863 1.00 0.00 C ATOM 0 H LEU A 97 5.533 17.975 -14.388 1.00 0.00 H new ATOM 0 HA LEU A 97 5.797 19.771 -12.220 1.00 0.00 H new ATOM 0 HB2 LEU A 97 3.690 18.743 -13.065 1.00 0.00 H new ATOM 0 HB3 LEU A 97 4.216 17.187 -12.455 1.00 0.00 H new ATOM 0 HG LEU A 97 4.284 18.129 -10.146 1.00 0.00 H new ATOM 0 HD11 LEU A 97 3.177 20.282 -9.660 1.00 0.00 H new ATOM 0 HD12 LEU A 97 4.636 20.498 -10.655 1.00 0.00 H new ATOM 0 HD13 LEU A 97 3.025 20.594 -11.405 1.00 0.00 H new ATOM 0 HD21 LEU A 97 1.787 18.268 -9.895 1.00 0.00 H new ATOM 0 HD22 LEU A 97 1.639 18.499 -11.653 1.00 0.00 H new ATOM 0 HD23 LEU A 97 2.255 16.960 -11.007 1.00 0.00 H new ATOM 1559 N SER A 98 7.217 16.829 -11.855 1.00 0.00 N ATOM 1560 CA SER A 98 8.162 16.013 -11.105 1.00 0.00 C ATOM 1561 C SER A 98 9.467 16.751 -10.762 1.00 0.00 C ATOM 1562 O SER A 98 10.198 16.311 -9.875 1.00 0.00 O ATOM 1563 CB SER A 98 8.461 14.769 -11.949 1.00 0.00 C ATOM 1564 OG SER A 98 7.243 14.205 -12.413 1.00 0.00 O ATOM 0 H SER A 98 7.017 16.443 -12.778 1.00 0.00 H new ATOM 0 HA SER A 98 7.713 15.753 -10.146 1.00 0.00 H new ATOM 0 HB2 SER A 98 9.096 15.034 -12.794 1.00 0.00 H new ATOM 0 HB3 SER A 98 9.010 14.038 -11.356 1.00 0.00 H new ATOM 0 HG SER A 98 7.435 13.411 -12.954 1.00 0.00 H new ATOM 1570 N ASP A 99 9.750 17.878 -11.423 1.00 0.00 N ATOM 1571 CA ASP A 99 10.969 18.663 -11.236 1.00 0.00 C ATOM 1572 C ASP A 99 10.599 20.033 -10.651 1.00 0.00 C ATOM 1573 O ASP A 99 11.433 20.930 -10.622 1.00 0.00 O ATOM 1574 CB ASP A 99 11.745 18.800 -12.567 1.00 0.00 C ATOM 1575 CG ASP A 99 12.582 17.576 -12.974 1.00 0.00 C ATOM 1576 OD1 ASP A 99 12.093 16.426 -12.892 1.00 0.00 O ATOM 1577 OD2 ASP A 99 13.706 17.770 -13.492 1.00 0.00 O ATOM 0 H ASP A 99 9.121 18.277 -12.119 1.00 0.00 H new ATOM 0 HA ASP A 99 11.630 18.151 -10.536 1.00 0.00 H new ATOM 0 HB2 ASP A 99 11.031 19.011 -13.363 1.00 0.00 H new ATOM 0 HB3 ASP A 99 12.407 19.663 -12.494 1.00 0.00 H new ATOM 1582 N ILE A 100 9.368 20.236 -10.174 1.00 0.00 N ATOM 1583 CA ILE A 100 8.899 21.513 -9.640 1.00 0.00 C ATOM 1584 C ILE A 100 8.625 21.356 -8.151 1.00 0.00 C ATOM 1585 O ILE A 100 8.165 20.316 -7.673 1.00 0.00 O ATOM 1586 CB ILE A 100 7.681 22.010 -10.461 1.00 0.00 C ATOM 1587 CG1 ILE A 100 8.204 22.704 -11.735 1.00 0.00 C ATOM 1588 CG2 ILE A 100 6.675 22.911 -9.711 1.00 0.00 C ATOM 1589 CD1 ILE A 100 8.550 24.188 -11.616 1.00 0.00 C ATOM 0 H ILE A 100 8.659 19.503 -10.149 1.00 0.00 H new ATOM 0 HA ILE A 100 9.660 22.288 -9.738 1.00 0.00 H new ATOM 0 HB ILE A 100 7.092 21.123 -10.696 1.00 0.00 H new ATOM 0 HG12 ILE A 100 9.095 22.173 -12.070 1.00 0.00 H new ATOM 0 HG13 ILE A 100 7.453 22.591 -12.517 1.00 0.00 H new ATOM 0 HG21 ILE A 100 5.868 23.195 -10.386 1.00 0.00 H new ATOM 0 HG22 ILE A 100 6.263 22.367 -8.861 1.00 0.00 H new ATOM 0 HG23 ILE A 100 7.184 23.807 -9.356 1.00 0.00 H new ATOM 0 HD11 ILE A 100 8.905 24.557 -12.578 1.00 0.00 H new ATOM 0 HD12 ILE A 100 7.662 24.746 -11.319 1.00 0.00 H new ATOM 0 HD13 ILE A 100 9.330 24.321 -10.866 1.00 0.00 H new ATOM 1601 N GLU A 101 8.882 22.445 -7.439 1.00 0.00 N ATOM 1602 CA GLU A 101 8.536 22.630 -6.039 1.00 0.00 C ATOM 1603 C GLU A 101 7.908 24.018 -5.942 1.00 0.00 C ATOM 1604 O GLU A 101 8.570 25.019 -6.221 1.00 0.00 O ATOM 1605 CB GLU A 101 9.799 22.476 -5.177 1.00 0.00 C ATOM 1606 CG GLU A 101 9.509 22.577 -3.674 1.00 0.00 C ATOM 1607 CD GLU A 101 10.797 22.464 -2.838 1.00 0.00 C ATOM 1608 OE1 GLU A 101 11.424 21.380 -2.819 1.00 0.00 O ATOM 1609 OE2 GLU A 101 11.185 23.455 -2.177 1.00 0.00 O ATOM 0 H GLU A 101 9.356 23.255 -7.838 1.00 0.00 H new ATOM 0 HA GLU A 101 7.829 21.887 -5.670 1.00 0.00 H new ATOM 0 HB2 GLU A 101 10.263 21.513 -5.389 1.00 0.00 H new ATOM 0 HB3 GLU A 101 10.520 23.245 -5.456 1.00 0.00 H new ATOM 0 HG2 GLU A 101 9.019 23.527 -3.461 1.00 0.00 H new ATOM 0 HG3 GLU A 101 8.816 21.788 -3.383 1.00 0.00 H new ATOM 1616 N ALA A 102 6.615 24.090 -5.622 1.00 0.00 N ATOM 1617 CA ALA A 102 5.919 25.366 -5.523 1.00 0.00 C ATOM 1618 C ALA A 102 6.403 26.139 -4.297 1.00 0.00 C ATOM 1619 O ALA A 102 6.794 25.556 -3.282 1.00 0.00 O ATOM 1620 CB ALA A 102 4.411 25.145 -5.443 1.00 0.00 C ATOM 0 H ALA A 102 6.031 23.276 -5.427 1.00 0.00 H new ATOM 0 HA ALA A 102 6.139 25.951 -6.416 1.00 0.00 H new ATOM 0 HB1 ALA A 102 3.906 26.108 -5.369 1.00 0.00 H new ATOM 0 HB2 ALA A 102 4.072 24.624 -6.338 1.00 0.00 H new ATOM 0 HB3 ALA A 102 4.177 24.545 -4.564 1.00 0.00 H new ATOM 1626 N ILE A 103 6.309 27.461 -4.393 1.00 0.00 N ATOM 1627 CA ILE A 103 6.729 28.410 -3.372 1.00 0.00 C ATOM 1628 C ILE A 103 5.487 29.205 -2.957 1.00 0.00 C ATOM 1629 O ILE A 103 4.759 29.719 -3.808 1.00 0.00 O ATOM 1630 CB ILE A 103 7.855 29.314 -3.933 1.00 0.00 C ATOM 1631 CG1 ILE A 103 9.121 28.502 -4.305 1.00 0.00 C ATOM 1632 CG2 ILE A 103 8.239 30.415 -2.928 1.00 0.00 C ATOM 1633 CD1 ILE A 103 10.111 29.294 -5.169 1.00 0.00 C ATOM 0 H ILE A 103 5.922 27.918 -5.219 1.00 0.00 H new ATOM 0 HA ILE A 103 7.141 27.911 -2.495 1.00 0.00 H new ATOM 0 HB ILE A 103 7.458 29.773 -4.839 1.00 0.00 H new ATOM 0 HG12 ILE A 103 9.621 28.181 -3.391 1.00 0.00 H new ATOM 0 HG13 ILE A 103 8.823 27.600 -4.839 1.00 0.00 H new ATOM 0 HG21 ILE A 103 9.031 31.033 -3.350 1.00 0.00 H new ATOM 0 HG22 ILE A 103 7.368 31.036 -2.718 1.00 0.00 H new ATOM 0 HG23 ILE A 103 8.590 29.957 -2.003 1.00 0.00 H new ATOM 0 HD11 ILE A 103 10.976 28.671 -5.396 1.00 0.00 H new ATOM 0 HD12 ILE A 103 9.625 29.592 -6.098 1.00 0.00 H new ATOM 0 HD13 ILE A 103 10.436 30.183 -4.628 1.00 0.00 H new ATOM 1645 N ASP A 104 5.289 29.328 -1.639 1.00 0.00 N ATOM 1646 CA ASP A 104 4.252 30.143 -0.994 1.00 0.00 C ATOM 1647 C ASP A 104 2.854 29.941 -1.607 1.00 0.00 C ATOM 1648 O ASP A 104 2.094 30.890 -1.816 1.00 0.00 O ATOM 1649 CB ASP A 104 4.703 31.613 -0.942 1.00 0.00 C ATOM 1650 CG ASP A 104 3.767 32.493 -0.091 1.00 0.00 C ATOM 1651 OD1 ASP A 104 3.397 32.091 1.036 1.00 0.00 O ATOM 1652 OD2 ASP A 104 3.445 33.627 -0.514 1.00 0.00 O ATOM 0 H ASP A 104 5.875 28.839 -0.962 1.00 0.00 H new ATOM 0 HA ASP A 104 4.135 29.799 0.034 1.00 0.00 H new ATOM 0 HB2 ASP A 104 5.713 31.665 -0.535 1.00 0.00 H new ATOM 0 HB3 ASP A 104 4.747 32.011 -1.956 1.00 0.00 H new ATOM 1657 N VAL A 105 2.530 28.690 -1.949 1.00 0.00 N ATOM 1658 CA VAL A 105 1.290 28.333 -2.634 1.00 0.00 C ATOM 1659 C VAL A 105 0.227 27.882 -1.617 1.00 0.00 C ATOM 1660 O VAL A 105 0.516 27.764 -0.421 1.00 0.00 O ATOM 1661 CB VAL A 105 1.618 27.316 -3.750 1.00 0.00 C ATOM 1662 CG1 VAL A 105 1.819 25.872 -3.263 1.00 0.00 C ATOM 1663 CG2 VAL A 105 0.612 27.413 -4.897 1.00 0.00 C ATOM 0 H VAL A 105 3.131 27.889 -1.754 1.00 0.00 H new ATOM 0 HA VAL A 105 0.840 29.193 -3.130 1.00 0.00 H new ATOM 0 HB VAL A 105 2.597 27.604 -4.132 1.00 0.00 H new ATOM 0 HG11 VAL A 105 2.045 25.229 -4.114 1.00 0.00 H new ATOM 0 HG12 VAL A 105 2.646 25.839 -2.554 1.00 0.00 H new ATOM 0 HG13 VAL A 105 0.909 25.522 -2.776 1.00 0.00 H new ATOM 0 HG21 VAL A 105 0.868 26.686 -5.668 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -0.390 27.206 -4.521 1.00 0.00 H new ATOM 0 HG23 VAL A 105 0.640 28.417 -5.321 1.00 0.00 H new ATOM 1673 N ASP A 106 -1.010 27.654 -2.075 1.00 0.00 N ATOM 1674 CA ASP A 106 -2.083 27.157 -1.216 1.00 0.00 C ATOM 1675 C ASP A 106 -1.769 25.747 -0.729 1.00 0.00 C ATOM 1676 O ASP A 106 -1.023 24.988 -1.353 1.00 0.00 O ATOM 1677 CB ASP A 106 -3.432 27.131 -1.941 1.00 0.00 C ATOM 1678 CG ASP A 106 -4.607 26.870 -0.987 1.00 0.00 C ATOM 1679 OD1 ASP A 106 -5.045 27.815 -0.294 1.00 0.00 O ATOM 1680 OD2 ASP A 106 -5.061 25.708 -0.901 1.00 0.00 O ATOM 0 H ASP A 106 -1.290 27.808 -3.044 1.00 0.00 H new ATOM 0 HA ASP A 106 -2.151 27.843 -0.371 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -3.586 28.083 -2.450 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -3.413 26.358 -2.709 1.00 0.00 H new ATOM 1685 N ASP A 107 -2.417 25.380 0.363 1.00 0.00 N ATOM 1686 CA ASP A 107 -2.230 24.103 1.037 1.00 0.00 C ATOM 1687 C ASP A 107 -2.593 22.946 0.113 1.00 0.00 C ATOM 1688 O ASP A 107 -1.852 21.969 0.045 1.00 0.00 O ATOM 1689 CB ASP A 107 -3.084 24.052 2.306 1.00 0.00 C ATOM 1690 CG ASP A 107 -2.957 22.687 3.002 1.00 0.00 C ATOM 1691 OD1 ASP A 107 -1.910 22.427 3.637 1.00 0.00 O ATOM 1692 OD2 ASP A 107 -3.925 21.896 2.968 1.00 0.00 O ATOM 0 H ASP A 107 -3.107 25.977 0.819 1.00 0.00 H new ATOM 0 HA ASP A 107 -1.179 24.007 1.310 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -2.774 24.843 2.989 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -4.128 24.240 2.054 1.00 0.00 H new ATOM 1697 N ASP A 108 -3.685 23.060 -0.648 1.00 0.00 N ATOM 1698 CA ASP A 108 -4.160 21.964 -1.487 1.00 0.00 C ATOM 1699 C ASP A 108 -3.272 21.807 -2.729 1.00 0.00 C ATOM 1700 O ASP A 108 -3.096 20.701 -3.240 1.00 0.00 O ATOM 1701 CB ASP A 108 -5.630 22.214 -1.863 1.00 0.00 C ATOM 1702 CG ASP A 108 -6.421 20.940 -2.213 1.00 0.00 C ATOM 1703 OD1 ASP A 108 -6.016 19.814 -1.845 1.00 0.00 O ATOM 1704 OD2 ASP A 108 -7.525 21.076 -2.789 1.00 0.00 O ATOM 0 H ASP A 108 -4.256 23.904 -0.698 1.00 0.00 H new ATOM 0 HA ASP A 108 -4.100 21.027 -0.934 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -6.124 22.718 -1.032 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.664 22.894 -2.714 1.00 0.00 H new ATOM 1709 N THR A 109 -2.646 22.903 -3.178 1.00 0.00 N ATOM 1710 CA THR A 109 -1.660 22.872 -4.258 1.00 0.00 C ATOM 1711 C THR A 109 -0.401 22.167 -3.748 1.00 0.00 C ATOM 1712 O THR A 109 0.096 21.250 -4.405 1.00 0.00 O ATOM 1713 CB THR A 109 -1.370 24.308 -4.744 1.00 0.00 C ATOM 1714 OG1 THR A 109 -2.593 24.938 -5.064 1.00 0.00 O ATOM 1715 CG2 THR A 109 -0.530 24.363 -6.019 1.00 0.00 C ATOM 0 H THR A 109 -2.812 23.836 -2.800 1.00 0.00 H new ATOM 0 HA THR A 109 -2.041 22.316 -5.115 1.00 0.00 H new ATOM 0 HB THR A 109 -0.824 24.794 -3.935 1.00 0.00 H new ATOM 0 HG1 THR A 109 -3.282 24.257 -5.215 1.00 0.00 H new ATOM 0 HG21 THR A 109 -0.366 25.403 -6.302 1.00 0.00 H new ATOM 0 HG22 THR A 109 0.430 23.879 -5.843 1.00 0.00 H new ATOM 0 HG23 THR A 109 -1.055 23.847 -6.823 1.00 0.00 H new ATOM 1723 N GLN A 110 0.084 22.545 -2.559 1.00 0.00 N ATOM 1724 CA GLN A 110 1.266 21.938 -1.968 1.00 0.00 C ATOM 1725 C GLN A 110 1.018 20.440 -1.752 1.00 0.00 C ATOM 1726 O GLN A 110 1.861 19.628 -2.120 1.00 0.00 O ATOM 1727 CB GLN A 110 1.634 22.675 -0.664 1.00 0.00 C ATOM 1728 CG GLN A 110 3.135 22.623 -0.337 1.00 0.00 C ATOM 1729 CD GLN A 110 3.669 21.203 -0.141 1.00 0.00 C ATOM 1730 OE1 GLN A 110 3.340 20.524 0.828 1.00 0.00 O ATOM 1731 NE2 GLN A 110 4.493 20.720 -1.060 1.00 0.00 N ATOM 0 H GLN A 110 -0.336 23.278 -1.987 1.00 0.00 H new ATOM 0 HA GLN A 110 2.119 22.032 -2.640 1.00 0.00 H new ATOM 0 HB2 GLN A 110 1.323 23.717 -0.744 1.00 0.00 H new ATOM 0 HB3 GLN A 110 1.074 22.237 0.163 1.00 0.00 H new ATOM 0 HG2 GLN A 110 3.691 23.104 -1.142 1.00 0.00 H new ATOM 0 HG3 GLN A 110 3.322 23.201 0.568 1.00 0.00 H new ATOM 0 HE21 GLN A 110 4.758 21.295 -1.860 1.00 0.00 H new ATOM 0 HE22 GLN A 110 4.862 19.774 -0.967 1.00 0.00 H new ATOM 1740 N GLU A 111 -0.147 20.059 -1.226 1.00 0.00 N ATOM 1741 CA GLU A 111 -0.493 18.664 -0.982 1.00 0.00 C ATOM 1742 C GLU A 111 -0.497 17.854 -2.275 1.00 0.00 C ATOM 1743 O GLU A 111 0.050 16.753 -2.289 1.00 0.00 O ATOM 1744 CB GLU A 111 -1.854 18.573 -0.277 1.00 0.00 C ATOM 1745 CG GLU A 111 -1.750 18.896 1.222 1.00 0.00 C ATOM 1746 CD GLU A 111 -1.065 17.800 2.059 1.00 0.00 C ATOM 1747 OE1 GLU A 111 -0.722 16.722 1.522 1.00 0.00 O ATOM 1748 OE2 GLU A 111 -0.920 17.969 3.290 1.00 0.00 O ATOM 0 H GLU A 111 -0.879 20.716 -0.957 1.00 0.00 H new ATOM 0 HA GLU A 111 0.269 18.235 -0.332 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -2.553 19.263 -0.749 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -2.262 17.570 -0.404 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -1.198 19.828 1.344 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -2.752 19.065 1.616 1.00 0.00 H new ATOM 1755 N ALA A 112 -1.054 18.385 -3.367 1.00 0.00 N ATOM 1756 CA ALA A 112 -1.054 17.692 -4.650 1.00 0.00 C ATOM 1757 C ALA A 112 0.374 17.481 -5.167 1.00 0.00 C ATOM 1758 O ALA A 112 0.692 16.406 -5.676 1.00 0.00 O ATOM 1759 CB ALA A 112 -1.881 18.489 -5.658 1.00 0.00 C ATOM 0 H ALA A 112 -1.511 19.297 -3.384 1.00 0.00 H new ATOM 0 HA ALA A 112 -1.501 16.707 -4.516 1.00 0.00 H new ATOM 0 HB1 ALA A 112 -1.882 17.972 -6.618 1.00 0.00 H new ATOM 0 HB2 ALA A 112 -2.905 18.583 -5.296 1.00 0.00 H new ATOM 0 HB3 ALA A 112 -1.447 19.481 -5.781 1.00 0.00 H new ATOM 1765 N ILE A 113 1.240 18.488 -5.026 1.00 0.00 N ATOM 1766 CA ILE A 113 2.633 18.402 -5.452 1.00 0.00 C ATOM 1767 C ILE A 113 3.366 17.369 -4.595 1.00 0.00 C ATOM 1768 O ILE A 113 4.011 16.478 -5.142 1.00 0.00 O ATOM 1769 CB ILE A 113 3.276 19.800 -5.380 1.00 0.00 C ATOM 1770 CG1 ILE A 113 2.658 20.694 -6.475 1.00 0.00 C ATOM 1771 CG2 ILE A 113 4.809 19.753 -5.523 1.00 0.00 C ATOM 1772 CD1 ILE A 113 2.827 22.174 -6.155 1.00 0.00 C ATOM 0 H ILE A 113 0.991 19.386 -4.612 1.00 0.00 H new ATOM 0 HA ILE A 113 2.700 18.067 -6.487 1.00 0.00 H new ATOM 0 HB ILE A 113 3.070 20.216 -4.394 1.00 0.00 H new ATOM 0 HG12 ILE A 113 3.128 20.473 -7.433 1.00 0.00 H new ATOM 0 HG13 ILE A 113 1.598 20.463 -6.579 1.00 0.00 H new ATOM 0 HG21 ILE A 113 5.211 20.765 -5.465 1.00 0.00 H new ATOM 0 HG22 ILE A 113 5.231 19.148 -4.720 1.00 0.00 H new ATOM 0 HG23 ILE A 113 5.071 19.313 -6.485 1.00 0.00 H new ATOM 0 HD11 ILE A 113 2.379 22.771 -6.949 1.00 0.00 H new ATOM 0 HD12 ILE A 113 2.335 22.400 -5.209 1.00 0.00 H new ATOM 0 HD13 ILE A 113 3.888 22.411 -6.077 1.00 0.00 H new ATOM 1784 N ALA A 114 3.254 17.459 -3.268 1.00 0.00 N ATOM 1785 CA ALA A 114 3.863 16.502 -2.352 1.00 0.00 C ATOM 1786 C ALA A 114 3.408 15.080 -2.687 1.00 0.00 C ATOM 1787 O ALA A 114 4.223 14.162 -2.736 1.00 0.00 O ATOM 1788 CB ALA A 114 3.502 16.856 -0.905 1.00 0.00 C ATOM 0 H ALA A 114 2.735 18.202 -2.800 1.00 0.00 H new ATOM 0 HA ALA A 114 4.946 16.550 -2.462 1.00 0.00 H new ATOM 0 HB1 ALA A 114 3.962 16.135 -0.229 1.00 0.00 H new ATOM 0 HB2 ALA A 114 3.868 17.856 -0.673 1.00 0.00 H new ATOM 0 HB3 ALA A 114 2.419 16.829 -0.783 1.00 0.00 H new ATOM 1794 N ASP A 115 2.118 14.906 -2.973 1.00 0.00 N ATOM 1795 CA ASP A 115 1.562 13.601 -3.312 1.00 0.00 C ATOM 1796 C ASP A 115 2.126 13.067 -4.629 1.00 0.00 C ATOM 1797 O ASP A 115 2.413 11.874 -4.751 1.00 0.00 O ATOM 1798 CB ASP A 115 0.037 13.658 -3.376 1.00 0.00 C ATOM 1799 CG ASP A 115 -0.538 12.249 -3.225 1.00 0.00 C ATOM 1800 OD1 ASP A 115 -0.483 11.730 -2.086 1.00 0.00 O ATOM 1801 OD2 ASP A 115 -1.085 11.705 -4.207 1.00 0.00 O ATOM 0 H ASP A 115 1.434 15.663 -2.976 1.00 0.00 H new ATOM 0 HA ASP A 115 1.855 12.912 -2.520 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -0.346 14.304 -2.586 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -0.281 14.091 -4.324 1.00 0.00 H new ATOM 1806 N TRP A 116 2.352 13.951 -5.604 1.00 0.00 N ATOM 1807 CA TRP A 116 3.008 13.588 -6.848 1.00 0.00 C ATOM 1808 C TRP A 116 4.475 13.216 -6.601 1.00 0.00 C ATOM 1809 O TRP A 116 4.987 12.290 -7.228 1.00 0.00 O ATOM 1810 CB TRP A 116 2.885 14.724 -7.871 1.00 0.00 C ATOM 1811 CG TRP A 116 3.373 14.329 -9.226 1.00 0.00 C ATOM 1812 CD1 TRP A 116 4.528 14.729 -9.804 1.00 0.00 C ATOM 1813 CD2 TRP A 116 2.788 13.351 -10.136 1.00 0.00 C ATOM 1814 NE1 TRP A 116 4.713 14.051 -10.991 1.00 0.00 N ATOM 1815 CE2 TRP A 116 3.671 13.182 -11.243 1.00 0.00 C ATOM 1816 CE3 TRP A 116 1.618 12.559 -10.114 1.00 0.00 C ATOM 1817 CZ2 TRP A 116 3.401 12.271 -12.272 1.00 0.00 C ATOM 1818 CZ3 TRP A 116 1.344 11.639 -11.143 1.00 0.00 C ATOM 1819 CH2 TRP A 116 2.235 11.492 -12.219 1.00 0.00 C ATOM 0 H TRP A 116 2.084 14.933 -5.547 1.00 0.00 H new ATOM 0 HA TRP A 116 2.510 12.710 -7.259 1.00 0.00 H new ATOM 0 HB2 TRP A 116 1.843 15.035 -7.940 1.00 0.00 H new ATOM 0 HB3 TRP A 116 3.452 15.587 -7.521 1.00 0.00 H new ATOM 0 HD1 TRP A 116 5.203 15.467 -9.398 1.00 0.00 H new ATOM 0 HE1 TRP A 116 5.518 14.176 -11.605 1.00 0.00 H new ATOM 0 HE3 TRP A 116 0.923 12.661 -9.294 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 4.086 12.169 -13.101 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 0.444 11.043 -11.105 1.00 0.00 H new ATOM 0 HH2 TRP A 116 2.023 10.781 -13.004 1.00 0.00 H new ATOM 1830 N LEU A 117 5.160 13.885 -5.669 1.00 0.00 N ATOM 1831 CA LEU A 117 6.532 13.542 -5.308 1.00 0.00 C ATOM 1832 C LEU A 117 6.593 12.173 -4.619 1.00 0.00 C ATOM 1833 O LEU A 117 7.574 11.456 -4.818 1.00 0.00 O ATOM 1834 CB LEU A 117 7.174 14.643 -4.445 1.00 0.00 C ATOM 1835 CG LEU A 117 7.404 15.976 -5.189 1.00 0.00 C ATOM 1836 CD1 LEU A 117 7.834 17.060 -4.195 1.00 0.00 C ATOM 1837 CD2 LEU A 117 8.454 15.859 -6.301 1.00 0.00 C ATOM 0 H LEU A 117 4.779 14.675 -5.148 1.00 0.00 H new ATOM 0 HA LEU A 117 7.114 13.472 -6.227 1.00 0.00 H new ATOM 0 HB2 LEU A 117 6.538 14.828 -3.579 1.00 0.00 H new ATOM 0 HB3 LEU A 117 8.130 14.281 -4.066 1.00 0.00 H new ATOM 0 HG LEU A 117 6.458 16.245 -5.659 1.00 0.00 H new ATOM 0 HD11 LEU A 117 7.995 17.998 -4.727 1.00 0.00 H new ATOM 0 HD12 LEU A 117 7.054 17.196 -3.446 1.00 0.00 H new ATOM 0 HD13 LEU A 117 8.759 16.758 -3.705 1.00 0.00 H new ATOM 0 HD21 LEU A 117 8.575 16.825 -6.790 1.00 0.00 H new ATOM 0 HD22 LEU A 117 9.406 15.548 -5.871 1.00 0.00 H new ATOM 0 HD23 LEU A 117 8.128 15.120 -7.033 1.00 0.00 H new ATOM 1849 N TYR A 118 5.558 11.762 -3.873 1.00 0.00 N ATOM 1850 CA TYR A 118 5.477 10.396 -3.353 1.00 0.00 C ATOM 1851 C TYR A 118 5.433 9.413 -4.523 1.00 0.00 C ATOM 1852 O TYR A 118 6.227 8.478 -4.577 1.00 0.00 O ATOM 1853 CB TYR A 118 4.241 10.181 -2.456 1.00 0.00 C ATOM 1854 CG TYR A 118 4.030 11.118 -1.277 1.00 0.00 C ATOM 1855 CD1 TYR A 118 5.099 11.805 -0.667 1.00 0.00 C ATOM 1856 CD2 TYR A 118 2.719 11.308 -0.798 1.00 0.00 C ATOM 1857 CE1 TYR A 118 4.850 12.713 0.377 1.00 0.00 C ATOM 1858 CE2 TYR A 118 2.457 12.227 0.232 1.00 0.00 C ATOM 1859 CZ TYR A 118 3.529 12.940 0.822 1.00 0.00 C ATOM 1860 OH TYR A 118 3.311 13.853 1.811 1.00 0.00 O ATOM 0 H TYR A 118 4.769 12.356 -3.618 1.00 0.00 H new ATOM 0 HA TYR A 118 6.361 10.224 -2.738 1.00 0.00 H new ATOM 0 HB2 TYR A 118 3.356 10.241 -3.090 1.00 0.00 H new ATOM 0 HB3 TYR A 118 4.286 9.164 -2.067 1.00 0.00 H new ATOM 0 HD1 TYR A 118 6.111 11.634 -1.002 1.00 0.00 H new ATOM 0 HD2 TYR A 118 1.906 10.741 -1.227 1.00 0.00 H new ATOM 0 HE1 TYR A 118 5.672 13.239 0.840 1.00 0.00 H new ATOM 0 HE2 TYR A 118 1.445 12.389 0.572 1.00 0.00 H new ATOM 0 HH TYR A 118 2.352 13.899 2.008 1.00 0.00 H new ATOM 1870 N TRP A 119 4.532 9.637 -5.482 1.00 0.00 N ATOM 1871 CA TRP A 119 4.373 8.804 -6.670 1.00 0.00 C ATOM 1872 C TRP A 119 5.674 8.724 -7.481 1.00 0.00 C ATOM 1873 O TRP A 119 6.057 7.641 -7.933 1.00 0.00 O ATOM 1874 CB TRP A 119 3.195 9.372 -7.471 1.00 0.00 C ATOM 1875 CG TRP A 119 3.022 8.882 -8.870 1.00 0.00 C ATOM 1876 CD1 TRP A 119 3.766 9.274 -9.927 1.00 0.00 C ATOM 1877 CD2 TRP A 119 2.013 7.977 -9.411 1.00 0.00 C ATOM 1878 NE1 TRP A 119 3.313 8.661 -11.069 1.00 0.00 N ATOM 1879 CE2 TRP A 119 2.206 7.881 -10.821 1.00 0.00 C ATOM 1880 CE3 TRP A 119 0.941 7.243 -8.859 1.00 0.00 C ATOM 1881 CZ2 TRP A 119 1.366 7.116 -11.639 1.00 0.00 C ATOM 1882 CZ3 TRP A 119 0.080 6.486 -9.676 1.00 0.00 C ATOM 1883 CH2 TRP A 119 0.285 6.427 -11.066 1.00 0.00 C ATOM 0 H TRP A 119 3.880 10.420 -5.451 1.00 0.00 H new ATOM 0 HA TRP A 119 4.154 7.772 -6.395 1.00 0.00 H new ATOM 0 HB2 TRP A 119 2.278 9.157 -6.922 1.00 0.00 H new ATOM 0 HB3 TRP A 119 3.300 10.456 -7.503 1.00 0.00 H new ATOM 0 HD1 TRP A 119 4.594 9.966 -9.881 1.00 0.00 H new ATOM 0 HE1 TRP A 119 3.743 8.770 -11.987 1.00 0.00 H new ATOM 0 HE3 TRP A 119 0.779 7.263 -7.791 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 1.548 7.056 -12.702 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -0.744 5.947 -9.232 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -0.386 5.855 -11.690 1.00 0.00 H new ATOM 1894 N LEU A 120 6.384 9.846 -7.626 1.00 0.00 N ATOM 1895 CA LEU A 120 7.672 9.923 -8.301 1.00 0.00 C ATOM 1896 C LEU A 120 8.693 9.023 -7.605 1.00 0.00 C ATOM 1897 O LEU A 120 9.305 8.178 -8.257 1.00 0.00 O ATOM 1898 CB LEU A 120 8.114 11.397 -8.305 1.00 0.00 C ATOM 1899 CG LEU A 120 9.469 11.698 -8.969 1.00 0.00 C ATOM 1900 CD1 LEU A 120 9.455 11.400 -10.470 1.00 0.00 C ATOM 1901 CD2 LEU A 120 9.789 13.178 -8.741 1.00 0.00 C ATOM 0 H LEU A 120 6.066 10.746 -7.266 1.00 0.00 H new ATOM 0 HA LEU A 120 7.593 9.568 -9.329 1.00 0.00 H new ATOM 0 HB2 LEU A 120 7.347 11.983 -8.811 1.00 0.00 H new ATOM 0 HB3 LEU A 120 8.153 11.746 -7.273 1.00 0.00 H new ATOM 0 HG LEU A 120 10.228 11.056 -8.523 1.00 0.00 H new ATOM 0 HD11 LEU A 120 10.432 11.628 -10.895 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.226 10.346 -10.630 1.00 0.00 H new ATOM 0 HD13 LEU A 120 8.696 12.014 -10.956 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.747 13.419 -9.203 1.00 0.00 H new ATOM 0 HD22 LEU A 120 9.007 13.792 -9.187 1.00 0.00 H new ATOM 0 HD23 LEU A 120 9.842 13.378 -7.671 1.00 0.00 H new ATOM 1913 N ALA A 121 8.840 9.156 -6.282 1.00 0.00 N ATOM 1914 CA ALA A 121 9.757 8.333 -5.499 1.00 0.00 C ATOM 1915 C ALA A 121 9.359 6.848 -5.526 1.00 0.00 C ATOM 1916 O ALA A 121 10.228 5.975 -5.478 1.00 0.00 O ATOM 1917 CB ALA A 121 9.806 8.862 -4.063 1.00 0.00 C ATOM 0 H ALA A 121 8.324 9.839 -5.727 1.00 0.00 H new ATOM 0 HA ALA A 121 10.750 8.399 -5.945 1.00 0.00 H new ATOM 0 HB1 ALA A 121 10.489 8.251 -3.473 1.00 0.00 H new ATOM 0 HB2 ALA A 121 10.154 9.895 -4.067 1.00 0.00 H new ATOM 0 HB3 ALA A 121 8.809 8.817 -3.625 1.00 0.00 H new ATOM 1923 N ARG A 122 8.059 6.549 -5.632 1.00 0.00 N ATOM 1924 CA ARG A 122 7.518 5.190 -5.734 1.00 0.00 C ATOM 1925 C ARG A 122 7.673 4.597 -7.138 1.00 0.00 C ATOM 1926 O ARG A 122 7.264 3.453 -7.348 1.00 0.00 O ATOM 1927 CB ARG A 122 6.046 5.193 -5.284 1.00 0.00 C ATOM 1928 CG ARG A 122 5.908 5.379 -3.768 1.00 0.00 C ATOM 1929 CD ARG A 122 4.462 5.648 -3.341 1.00 0.00 C ATOM 1930 NE ARG A 122 3.608 4.464 -3.533 1.00 0.00 N ATOM 1931 CZ ARG A 122 2.288 4.410 -3.314 1.00 0.00 C ATOM 1932 NH1 ARG A 122 1.611 5.494 -2.948 1.00 0.00 N ATOM 1933 NH2 ARG A 122 1.642 3.262 -3.470 1.00 0.00 N ATOM 0 H ARG A 122 7.334 7.267 -5.650 1.00 0.00 H new ATOM 0 HA ARG A 122 8.097 4.545 -5.073 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.512 5.993 -5.797 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.575 4.255 -5.578 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.273 4.486 -3.261 1.00 0.00 H new ATOM 0 HG3 ARG A 122 6.539 6.208 -3.448 1.00 0.00 H new ATOM 0 HD2 ARG A 122 4.442 5.945 -2.293 1.00 0.00 H new ATOM 0 HD3 ARG A 122 4.062 6.483 -3.917 1.00 0.00 H new ATOM 0 HE ARG A 122 4.061 3.611 -3.861 1.00 0.00 H new ATOM 0 HH11 ARG A 122 2.097 6.383 -2.830 1.00 0.00 H new ATOM 0 HH12 ARG A 122 0.606 5.437 -2.785 1.00 0.00 H new ATOM 0 HH21 ARG A 122 2.151 2.425 -3.756 1.00 0.00 H new ATOM 0 HH22 ARG A 122 0.637 3.216 -3.304 1.00 0.00 H new