USER MOD reduce.3.24.130724 H: found=0, std=0, add=684, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 686 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 375 GLN : amide:sc= -16.9! C(o=-27!,f=-17!) USER MOD Set 1.2: A 381 ASN : amide:sc= -1.26 K(o=-27,f=-17!) USER MOD Set 1.3: A 394 GLN : amide:sc= -9.14! C(o=-27!,f=-17!) USER MOD Set 2.1: A 321 SER OG : rot -150:sc= 0.977 USER MOD Set 2.2: A 325 THR OG1 : rot 180:sc= 0.936 USER MOD Set 3.1: A 311 LYS NZ :NH3+ -166:sc= -0.566 (180deg=-0.989) USER MOD Set 3.2: A 335 THR OG1 : rot -157:sc= -2.37! USER MOD Single : A 303 THR OG1 : rot 180:sc= 0 USER MOD Single : A 304 TYR OH : rot 180:sc= 0 USER MOD Single : A 305 THR OG1 : rot 180:sc= 0.0184 USER MOD Single : A 309 LYS NZ :NH3+ 156:sc= 1.24 (180deg=1.2) USER MOD Single : A 310 THR OG1 : rot -43:sc= 0.245 USER MOD Single : A 313 THR OG1 : rot 180:sc= -0.0447 USER MOD Single : A 315 LYS NZ :NH3+ 169:sc= 1.21 (180deg=1.01) USER MOD Single : A 319 THR OG1 : rot 80:sc= 1.27 USER MOD Single : A 323 HIS : no HD1:sc= 0 X(o=0,f=-0.0057) USER MOD Single : A 328 MET CE :methyl -175:sc= -4.79! (180deg=-4.9!) USER MOD Single : A 333 SER OG : rot 180:sc= 0 USER MOD Single : A 347 HIS : no HE2:sc= -0.72 K(o=-0.72,f=-4.8!) USER MOD Single : A 353 ASN : amide:sc= 1.54 K(o=1.5,f=-8.6!) USER MOD Single : A 356 MET CE :methyl -160:sc= -0.218 (180deg=-0.799) USER MOD Single : A 359 THR OG1 : rot 161:sc= 1.23 USER MOD Single : A 361 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 363 THR OG1 : rot 36:sc= 0.0219 USER MOD Single : A 364 MET CE :methyl -141:sc= -3.15! (180deg=-5.63!) USER MOD Single : A 374 MET CE :methyl -136:sc= -1.77 (180deg=-7.21!) USER MOD Single : A 384 TYR OH : rot 180:sc= 0 USER MOD Single : A 389 ASN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 390 HIS : no HD1:sc= -1.84 K(o=-1.8,f=-2.6!) USER MOD Single : A 391 GLN : amide:sc= -0.0168 K(o=-0.017,f=-2.3!) USER MOD Single : A 395 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 303 18.256 -5.522 -2.152 1.00 0.00 N ATOM 2 CA THR A 303 17.482 -6.189 -3.196 1.00 0.00 C ATOM 3 C THR A 303 16.299 -5.325 -3.668 1.00 0.00 C ATOM 4 O THR A 303 15.142 -5.602 -3.364 1.00 0.00 O ATOM 5 CB THR A 303 16.976 -7.571 -2.700 1.00 0.00 C ATOM 6 OG1 THR A 303 16.155 -8.211 -3.688 1.00 0.00 O ATOM 7 CG2 THR A 303 16.197 -7.437 -1.397 1.00 0.00 C ATOM 0 HA THR A 303 18.144 -6.339 -4.049 1.00 0.00 H new ATOM 0 HB THR A 303 17.856 -8.189 -2.522 1.00 0.00 H new ATOM 0 HG1 THR A 303 15.852 -9.079 -3.349 1.00 0.00 H new ATOM 0 HG21 THR A 303 15.856 -8.421 -1.074 1.00 0.00 H new ATOM 0 HG22 THR A 303 16.842 -7.007 -0.630 1.00 0.00 H new ATOM 0 HG23 THR A 303 15.336 -6.787 -1.553 1.00 0.00 H new ATOM 15 N TYR A 304 16.588 -4.262 -4.406 1.00 0.00 N ATOM 16 CA TYR A 304 15.525 -3.452 -4.979 1.00 0.00 C ATOM 17 C TYR A 304 14.833 -4.245 -6.078 1.00 0.00 C ATOM 18 O TYR A 304 15.488 -4.788 -6.972 1.00 0.00 O ATOM 19 CB TYR A 304 16.060 -2.114 -5.514 1.00 0.00 C ATOM 20 CG TYR A 304 17.024 -2.237 -6.675 1.00 0.00 C ATOM 21 CD1 TYR A 304 18.364 -2.540 -6.464 1.00 0.00 C ATOM 22 CD2 TYR A 304 16.590 -2.051 -7.981 1.00 0.00 C ATOM 23 CE1 TYR A 304 19.243 -2.651 -7.523 1.00 0.00 C ATOM 24 CE2 TYR A 304 17.462 -2.161 -9.043 1.00 0.00 C ATOM 25 CZ TYR A 304 18.786 -2.464 -8.811 1.00 0.00 C ATOM 26 OH TYR A 304 19.657 -2.572 -9.873 1.00 0.00 O ATOM 0 H TYR A 304 17.534 -3.945 -4.619 1.00 0.00 H new ATOM 0 HA TYR A 304 14.804 -3.212 -4.198 1.00 0.00 H new ATOM 0 HB2 TYR A 304 15.216 -1.499 -5.824 1.00 0.00 H new ATOM 0 HB3 TYR A 304 16.558 -1.586 -4.701 1.00 0.00 H new ATOM 0 HD1 TYR A 304 18.723 -2.691 -5.457 1.00 0.00 H new ATOM 0 HD2 TYR A 304 15.552 -1.816 -8.168 1.00 0.00 H new ATOM 0 HE1 TYR A 304 20.282 -2.883 -7.344 1.00 0.00 H new ATOM 0 HE2 TYR A 304 17.109 -2.010 -10.052 1.00 0.00 H new ATOM 0 HH TYR A 304 19.173 -2.412 -10.710 1.00 0.00 H new ATOM 36 N THR A 305 13.516 -4.319 -5.999 1.00 0.00 N ATOM 37 CA THR A 305 12.740 -5.171 -6.882 1.00 0.00 C ATOM 38 C THR A 305 11.274 -5.114 -6.475 1.00 0.00 C ATOM 39 O THR A 305 10.892 -4.273 -5.662 1.00 0.00 O ATOM 40 CB THR A 305 13.262 -6.633 -6.833 1.00 0.00 C ATOM 41 OG1 THR A 305 12.722 -7.394 -7.924 1.00 0.00 O ATOM 42 CG2 THR A 305 12.909 -7.305 -5.509 1.00 0.00 C ATOM 0 H THR A 305 12.958 -3.794 -5.326 1.00 0.00 H new ATOM 0 HA THR A 305 12.844 -4.813 -7.906 1.00 0.00 H new ATOM 0 HB THR A 305 14.348 -6.600 -6.921 1.00 0.00 H new ATOM 0 HG1 THR A 305 13.061 -8.313 -7.881 1.00 0.00 H new ATOM 0 HG21 THR A 305 13.289 -8.327 -5.507 1.00 0.00 H new ATOM 0 HG22 THR A 305 13.360 -6.749 -4.687 1.00 0.00 H new ATOM 0 HG23 THR A 305 11.826 -7.320 -5.386 1.00 0.00 H new ATOM 50 N VAL A 306 10.449 -5.973 -7.050 1.00 0.00 N ATOM 51 CA VAL A 306 9.091 -6.115 -6.577 1.00 0.00 C ATOM 52 C VAL A 306 9.142 -6.914 -5.287 1.00 0.00 C ATOM 53 O VAL A 306 9.395 -8.116 -5.306 1.00 0.00 O ATOM 54 CB VAL A 306 8.187 -6.826 -7.601 1.00 0.00 C ATOM 55 CG1 VAL A 306 6.730 -6.737 -7.176 1.00 0.00 C ATOM 56 CG2 VAL A 306 8.387 -6.237 -8.989 1.00 0.00 C ATOM 0 H VAL A 306 10.696 -6.574 -7.836 1.00 0.00 H new ATOM 0 HA VAL A 306 8.661 -5.126 -6.418 1.00 0.00 H new ATOM 0 HB VAL A 306 8.465 -7.879 -7.638 1.00 0.00 H new ATOM 0 HG11 VAL A 306 6.105 -7.244 -7.911 1.00 0.00 H new ATOM 0 HG12 VAL A 306 6.605 -7.212 -6.203 1.00 0.00 H new ATOM 0 HG13 VAL A 306 6.434 -5.690 -7.109 1.00 0.00 H new ATOM 0 HG21 VAL A 306 7.740 -6.752 -9.699 1.00 0.00 H new ATOM 0 HG22 VAL A 306 8.137 -5.176 -8.974 1.00 0.00 H new ATOM 0 HG23 VAL A 306 9.427 -6.360 -9.290 1.00 0.00 H new ATOM 66 N CYS A 307 8.925 -6.240 -4.171 1.00 0.00 N ATOM 67 CA CYS A 307 9.196 -6.822 -2.862 1.00 0.00 C ATOM 68 C CYS A 307 8.228 -7.935 -2.494 1.00 0.00 C ATOM 69 O CYS A 307 7.099 -8.000 -2.981 1.00 0.00 O ATOM 70 CB CYS A 307 9.159 -5.748 -1.782 1.00 0.00 C ATOM 71 SG CYS A 307 8.292 -4.231 -2.261 1.00 0.00 S ATOM 0 H CYS A 307 8.561 -5.287 -4.142 1.00 0.00 H new ATOM 0 HA CYS A 307 10.192 -7.260 -2.924 1.00 0.00 H new ATOM 0 HB2 CYS A 307 8.680 -6.160 -0.894 1.00 0.00 H new ATOM 0 HB3 CYS A 307 10.182 -5.495 -1.504 1.00 0.00 H new ATOM 76 N ASP A 308 8.707 -8.802 -1.613 1.00 0.00 N ATOM 77 CA ASP A 308 7.936 -9.931 -1.105 1.00 0.00 C ATOM 78 C ASP A 308 6.778 -9.451 -0.253 1.00 0.00 C ATOM 79 O ASP A 308 6.960 -8.725 0.728 1.00 0.00 O ATOM 80 CB ASP A 308 8.837 -10.865 -0.306 1.00 0.00 C ATOM 81 CG ASP A 308 8.066 -11.984 0.353 1.00 0.00 C ATOM 82 OD1 ASP A 308 7.708 -12.959 -0.339 1.00 0.00 O ATOM 83 OD2 ASP A 308 7.819 -11.893 1.565 1.00 0.00 O ATOM 0 H ASP A 308 9.649 -8.742 -1.227 1.00 0.00 H new ATOM 0 HA ASP A 308 7.527 -10.480 -1.953 1.00 0.00 H new ATOM 0 HB2 ASP A 308 9.594 -11.289 -0.966 1.00 0.00 H new ATOM 0 HB3 ASP A 308 9.364 -10.292 0.457 1.00 0.00 H new ATOM 88 N LYS A 309 5.601 -9.862 -0.685 1.00 0.00 N ATOM 89 CA LYS A 309 4.315 -9.449 -0.142 1.00 0.00 C ATOM 90 C LYS A 309 4.249 -9.338 1.379 1.00 0.00 C ATOM 91 O LYS A 309 3.528 -8.489 1.895 1.00 0.00 O ATOM 92 CB LYS A 309 3.257 -10.445 -0.599 1.00 0.00 C ATOM 93 CG LYS A 309 3.576 -11.870 -0.190 1.00 0.00 C ATOM 94 CD LYS A 309 2.354 -12.766 -0.308 1.00 0.00 C ATOM 95 CE LYS A 309 2.576 -14.102 0.382 1.00 0.00 C ATOM 96 NZ LYS A 309 1.292 -14.760 0.737 1.00 0.00 N ATOM 0 H LYS A 309 5.508 -10.522 -1.457 1.00 0.00 H new ATOM 0 HA LYS A 309 4.145 -8.440 -0.519 1.00 0.00 H new ATOM 0 HB2 LYS A 309 2.291 -10.160 -0.182 1.00 0.00 H new ATOM 0 HB3 LYS A 309 3.163 -10.396 -1.684 1.00 0.00 H new ATOM 0 HG2 LYS A 309 4.377 -12.260 -0.818 1.00 0.00 H new ATOM 0 HG3 LYS A 309 3.941 -11.883 0.837 1.00 0.00 H new ATOM 0 HD2 LYS A 309 1.491 -12.267 0.132 1.00 0.00 H new ATOM 0 HD3 LYS A 309 2.123 -12.932 -1.360 1.00 0.00 H new ATOM 0 HE2 LYS A 309 3.152 -14.757 -0.272 1.00 0.00 H new ATOM 0 HE3 LYS A 309 3.169 -13.951 1.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 309 1.439 -15.786 0.818 1.00 0.00 H new ATOM 0 HZ2 LYS A 309 0.950 -14.386 1.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 309 0.587 -14.569 -0.004 1.00 0.00 H new ATOM 110 N THR A 310 4.976 -10.166 2.106 1.00 0.00 N ATOM 111 CA THR A 310 4.725 -10.311 3.524 1.00 0.00 C ATOM 112 C THR A 310 5.814 -9.610 4.342 1.00 0.00 C ATOM 113 O THR A 310 5.966 -9.828 5.545 1.00 0.00 O ATOM 114 CB THR A 310 4.641 -11.811 3.867 1.00 0.00 C ATOM 115 OG1 THR A 310 4.110 -12.013 5.183 1.00 0.00 O ATOM 116 CG2 THR A 310 6.007 -12.461 3.759 1.00 0.00 C ATOM 0 H THR A 310 5.736 -10.741 1.742 1.00 0.00 H new ATOM 0 HA THR A 310 3.777 -9.836 3.779 1.00 0.00 H new ATOM 0 HB THR A 310 3.967 -12.276 3.148 1.00 0.00 H new ATOM 0 HG1 THR A 310 4.519 -11.373 5.802 1.00 0.00 H new ATOM 0 HG21 THR A 310 5.927 -13.520 4.005 1.00 0.00 H new ATOM 0 HG22 THR A 310 6.382 -12.352 2.741 1.00 0.00 H new ATOM 0 HG23 THR A 310 6.695 -11.979 4.453 1.00 0.00 H new ATOM 124 N LYS A 311 6.560 -8.744 3.681 1.00 0.00 N ATOM 125 CA LYS A 311 7.625 -7.999 4.335 1.00 0.00 C ATOM 126 C LYS A 311 7.161 -6.604 4.686 1.00 0.00 C ATOM 127 O LYS A 311 7.865 -5.620 4.454 1.00 0.00 O ATOM 128 CB LYS A 311 8.839 -7.918 3.435 1.00 0.00 C ATOM 129 CG LYS A 311 9.579 -9.229 3.302 1.00 0.00 C ATOM 130 CD LYS A 311 11.056 -8.980 3.076 1.00 0.00 C ATOM 131 CE LYS A 311 11.287 -7.845 2.092 1.00 0.00 C ATOM 132 NZ LYS A 311 10.867 -8.225 0.720 1.00 0.00 N ATOM 0 H LYS A 311 6.449 -8.537 2.688 1.00 0.00 H new ATOM 0 HA LYS A 311 7.892 -8.524 5.252 1.00 0.00 H new ATOM 0 HB2 LYS A 311 8.526 -7.584 2.446 1.00 0.00 H new ATOM 0 HB3 LYS A 311 9.521 -7.163 3.825 1.00 0.00 H new ATOM 0 HG2 LYS A 311 9.438 -9.827 4.203 1.00 0.00 H new ATOM 0 HG3 LYS A 311 9.169 -9.803 2.471 1.00 0.00 H new ATOM 0 HD2 LYS A 311 11.535 -8.742 4.026 1.00 0.00 H new ATOM 0 HD3 LYS A 311 11.526 -9.889 2.701 1.00 0.00 H new ATOM 0 HE2 LYS A 311 10.732 -6.964 2.413 1.00 0.00 H new ATOM 0 HE3 LYS A 311 12.342 -7.573 2.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 311 11.247 -7.538 0.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 311 11.230 -9.173 0.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 311 9.829 -8.230 0.664 1.00 0.00 H new ATOM 146 N PHE A 312 5.995 -6.540 5.281 1.00 0.00 N ATOM 147 CA PHE A 312 5.320 -5.284 5.513 1.00 0.00 C ATOM 148 C PHE A 312 4.666 -5.274 6.876 1.00 0.00 C ATOM 149 O PHE A 312 4.446 -6.327 7.480 1.00 0.00 O ATOM 150 CB PHE A 312 4.267 -5.072 4.436 1.00 0.00 C ATOM 151 CG PHE A 312 4.739 -4.260 3.282 1.00 0.00 C ATOM 152 CD1 PHE A 312 4.620 -2.887 3.306 1.00 0.00 C ATOM 153 CD2 PHE A 312 5.295 -4.870 2.172 1.00 0.00 C ATOM 154 CE1 PHE A 312 5.053 -2.129 2.241 1.00 0.00 C ATOM 155 CE2 PHE A 312 5.729 -4.119 1.104 1.00 0.00 C ATOM 156 CZ PHE A 312 5.605 -2.747 1.139 1.00 0.00 C ATOM 0 H PHE A 312 5.486 -7.357 5.619 1.00 0.00 H new ATOM 0 HA PHE A 312 6.053 -4.478 5.476 1.00 0.00 H new ATOM 0 HB2 PHE A 312 3.934 -6.044 4.072 1.00 0.00 H new ATOM 0 HB3 PHE A 312 3.400 -4.584 4.881 1.00 0.00 H new ATOM 0 HD1 PHE A 312 4.184 -2.402 4.167 1.00 0.00 H new ATOM 0 HD2 PHE A 312 5.389 -5.945 2.143 1.00 0.00 H new ATOM 0 HE1 PHE A 312 4.960 -1.053 2.269 1.00 0.00 H new ATOM 0 HE2 PHE A 312 6.165 -4.603 0.242 1.00 0.00 H new ATOM 0 HZ PHE A 312 5.941 -2.154 0.301 1.00 0.00 H new ATOM 166 N THR A 313 4.372 -4.083 7.361 1.00 0.00 N ATOM 167 CA THR A 313 3.666 -3.926 8.614 1.00 0.00 C ATOM 168 C THR A 313 2.566 -2.889 8.460 1.00 0.00 C ATOM 169 O THR A 313 2.690 -1.963 7.651 1.00 0.00 O ATOM 170 CB THR A 313 4.617 -3.475 9.743 1.00 0.00 C ATOM 171 OG1 THR A 313 5.141 -2.173 9.452 1.00 0.00 O ATOM 172 CG2 THR A 313 5.768 -4.450 9.905 1.00 0.00 C ATOM 0 H THR A 313 4.614 -3.205 6.901 1.00 0.00 H new ATOM 0 HA THR A 313 3.241 -4.894 8.878 1.00 0.00 H new ATOM 0 HB THR A 313 4.047 -3.445 10.672 1.00 0.00 H new ATOM 0 HG1 THR A 313 5.742 -1.893 10.174 1.00 0.00 H new ATOM 0 HG21 THR A 313 6.423 -4.109 10.707 1.00 0.00 H new ATOM 0 HG22 THR A 313 5.377 -5.437 10.151 1.00 0.00 H new ATOM 0 HG23 THR A 313 6.332 -4.505 8.974 1.00 0.00 H new ATOM 180 N TRP A 314 1.494 -3.035 9.224 1.00 0.00 N ATOM 181 CA TRP A 314 0.438 -2.036 9.235 1.00 0.00 C ATOM 182 C TRP A 314 0.864 -0.848 10.079 1.00 0.00 C ATOM 183 O TRP A 314 0.683 -0.832 11.297 1.00 0.00 O ATOM 184 CB TRP A 314 -0.855 -2.609 9.821 1.00 0.00 C ATOM 185 CG TRP A 314 -1.437 -3.749 9.047 1.00 0.00 C ATOM 186 CD1 TRP A 314 -2.382 -3.670 8.068 1.00 0.00 C ATOM 187 CD2 TRP A 314 -1.127 -5.140 9.198 1.00 0.00 C ATOM 188 NE1 TRP A 314 -2.681 -4.925 7.602 1.00 0.00 N ATOM 189 CE2 TRP A 314 -1.922 -5.845 8.276 1.00 0.00 C ATOM 190 CE3 TRP A 314 -0.252 -5.855 10.021 1.00 0.00 C ATOM 191 CZ2 TRP A 314 -1.868 -7.232 8.154 1.00 0.00 C ATOM 192 CZ3 TRP A 314 -0.200 -7.231 9.900 1.00 0.00 C ATOM 193 CH2 TRP A 314 -1.002 -7.907 8.971 1.00 0.00 C ATOM 0 H TRP A 314 1.333 -3.831 9.841 1.00 0.00 H new ATOM 0 HA TRP A 314 0.258 -1.727 8.205 1.00 0.00 H new ATOM 0 HB2 TRP A 314 -0.661 -2.941 10.841 1.00 0.00 H new ATOM 0 HB3 TRP A 314 -1.596 -1.812 9.881 1.00 0.00 H new ATOM 0 HD1 TRP A 314 -2.830 -2.754 7.712 1.00 0.00 H new ATOM 0 HE1 TRP A 314 -3.359 -5.139 6.871 1.00 0.00 H new ATOM 0 HE3 TRP A 314 0.372 -5.342 10.738 1.00 0.00 H new ATOM 0 HZ2 TRP A 314 -2.487 -7.755 7.441 1.00 0.00 H new ATOM 0 HZ3 TRP A 314 0.470 -7.795 10.532 1.00 0.00 H new ATOM 0 HH2 TRP A 314 -0.935 -8.982 8.898 1.00 0.00 H new ATOM 204 N LYS A 315 1.450 0.130 9.427 1.00 0.00 N ATOM 205 CA LYS A 315 1.724 1.403 10.057 1.00 0.00 C ATOM 206 C LYS A 315 0.400 2.120 10.315 1.00 0.00 C ATOM 207 O LYS A 315 0.127 2.581 11.424 1.00 0.00 O ATOM 208 CB LYS A 315 2.636 2.228 9.151 1.00 0.00 C ATOM 209 CG LYS A 315 2.989 3.589 9.696 1.00 0.00 C ATOM 210 CD LYS A 315 3.829 3.510 10.956 1.00 0.00 C ATOM 211 CE LYS A 315 4.389 4.876 11.322 1.00 0.00 C ATOM 212 NZ LYS A 315 3.324 5.910 11.432 1.00 0.00 N ATOM 0 H LYS A 315 1.748 0.068 8.454 1.00 0.00 H new ATOM 0 HA LYS A 315 2.233 1.260 11.010 1.00 0.00 H new ATOM 0 HB2 LYS A 315 3.556 1.670 8.977 1.00 0.00 H new ATOM 0 HB3 LYS A 315 2.150 2.352 8.183 1.00 0.00 H new ATOM 0 HG2 LYS A 315 3.532 4.152 8.936 1.00 0.00 H new ATOM 0 HG3 LYS A 315 2.073 4.141 9.908 1.00 0.00 H new ATOM 0 HD2 LYS A 315 3.223 3.129 11.778 1.00 0.00 H new ATOM 0 HD3 LYS A 315 4.647 2.805 10.809 1.00 0.00 H new ATOM 0 HE2 LYS A 315 4.924 4.806 12.269 1.00 0.00 H new ATOM 0 HE3 LYS A 315 5.114 5.183 10.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 315 3.719 6.771 11.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 315 2.956 6.132 10.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 315 2.551 5.550 12.028 1.00 0.00 H new ATOM 226 N ARG A 316 -0.418 2.182 9.275 1.00 0.00 N ATOM 227 CA ARG A 316 -1.758 2.733 9.348 1.00 0.00 C ATOM 228 C ARG A 316 -2.626 2.056 8.287 1.00 0.00 C ATOM 229 O ARG A 316 -2.272 2.043 7.108 1.00 0.00 O ATOM 230 CB ARG A 316 -1.713 4.246 9.110 1.00 0.00 C ATOM 231 CG ARG A 316 -3.059 4.937 9.249 1.00 0.00 C ATOM 232 CD ARG A 316 -2.979 6.403 8.845 1.00 0.00 C ATOM 233 NE ARG A 316 -1.893 7.106 9.531 1.00 0.00 N ATOM 234 CZ ARG A 316 -1.880 8.418 9.761 1.00 0.00 C ATOM 235 NH1 ARG A 316 -2.900 9.177 9.389 1.00 0.00 N ATOM 236 NH2 ARG A 316 -0.842 8.978 10.367 1.00 0.00 N ATOM 0 H ARG A 316 -0.164 1.846 8.346 1.00 0.00 H new ATOM 0 HA ARG A 316 -2.181 2.552 10.336 1.00 0.00 H new ATOM 0 HB2 ARG A 316 -1.013 4.693 9.816 1.00 0.00 H new ATOM 0 HB3 ARG A 316 -1.322 4.434 8.110 1.00 0.00 H new ATOM 0 HG2 ARG A 316 -3.796 4.427 8.629 1.00 0.00 H new ATOM 0 HG3 ARG A 316 -3.403 4.861 10.280 1.00 0.00 H new ATOM 0 HD2 ARG A 316 -2.832 6.474 7.767 1.00 0.00 H new ATOM 0 HD3 ARG A 316 -3.926 6.893 9.070 1.00 0.00 H new ATOM 0 HE ARG A 316 -1.096 6.556 9.853 1.00 0.00 H new ATOM 0 HH11 ARG A 316 -3.704 8.758 8.922 1.00 0.00 H new ATOM 0 HH12 ARG A 316 -2.881 10.181 9.569 1.00 0.00 H new ATOM 0 HH21 ARG A 316 -0.051 8.404 10.658 1.00 0.00 H new ATOM 0 HH22 ARG A 316 -0.835 9.983 10.542 1.00 0.00 H new ATOM 250 N ALA A 317 -3.747 1.493 8.706 1.00 0.00 N ATOM 251 CA ALA A 317 -4.626 0.756 7.803 1.00 0.00 C ATOM 252 C ALA A 317 -5.433 1.722 6.939 1.00 0.00 C ATOM 253 O ALA A 317 -5.577 2.886 7.316 1.00 0.00 O ATOM 254 CB ALA A 317 -5.542 -0.141 8.614 1.00 0.00 C ATOM 0 H ALA A 317 -4.074 1.531 9.671 1.00 0.00 H new ATOM 0 HA ALA A 317 -4.025 0.137 7.137 1.00 0.00 H new ATOM 0 HB1 ALA A 317 -6.200 -0.693 7.942 1.00 0.00 H new ATOM 0 HB2 ALA A 317 -4.943 -0.844 9.194 1.00 0.00 H new ATOM 0 HB3 ALA A 317 -6.142 0.468 9.290 1.00 0.00 H new ATOM 260 N PRO A 318 -5.943 1.265 5.760 1.00 0.00 N ATOM 261 CA PRO A 318 -6.696 2.108 4.834 1.00 0.00 C ATOM 262 C PRO A 318 -7.617 3.114 5.533 1.00 0.00 C ATOM 263 O PRO A 318 -8.602 2.746 6.174 1.00 0.00 O ATOM 264 CB PRO A 318 -7.507 1.097 4.032 1.00 0.00 C ATOM 265 CG PRO A 318 -6.695 -0.155 4.007 1.00 0.00 C ATOM 266 CD PRO A 318 -5.787 -0.106 5.216 1.00 0.00 C ATOM 0 HA PRO A 318 -6.036 2.732 4.232 1.00 0.00 H new ATOM 0 HB2 PRO A 318 -8.479 0.922 4.493 1.00 0.00 H new ATOM 0 HB3 PRO A 318 -7.694 1.461 3.022 1.00 0.00 H new ATOM 0 HG2 PRO A 318 -7.338 -1.034 4.041 1.00 0.00 H new ATOM 0 HG3 PRO A 318 -6.113 -0.221 3.088 1.00 0.00 H new ATOM 0 HD2 PRO A 318 -6.071 -0.857 5.953 1.00 0.00 H new ATOM 0 HD3 PRO A 318 -4.752 -0.305 4.940 1.00 0.00 H new ATOM 274 N THR A 319 -7.265 4.382 5.405 1.00 0.00 N ATOM 275 CA THR A 319 -7.936 5.464 6.097 1.00 0.00 C ATOM 276 C THR A 319 -8.203 6.633 5.144 1.00 0.00 C ATOM 277 O THR A 319 -7.358 6.981 4.332 1.00 0.00 O ATOM 278 CB THR A 319 -7.054 5.938 7.272 1.00 0.00 C ATOM 279 OG1 THR A 319 -7.058 4.955 8.318 1.00 0.00 O ATOM 280 CG2 THR A 319 -7.507 7.286 7.807 1.00 0.00 C ATOM 0 H THR A 319 -6.496 4.690 4.810 1.00 0.00 H new ATOM 0 HA THR A 319 -8.893 5.104 6.474 1.00 0.00 H new ATOM 0 HB THR A 319 -6.037 6.060 6.899 1.00 0.00 H new ATOM 0 HG1 THR A 319 -6.441 4.229 8.087 1.00 0.00 H new ATOM 0 HG21 THR A 319 -6.862 7.585 8.633 1.00 0.00 H new ATOM 0 HG22 THR A 319 -7.449 8.031 7.013 1.00 0.00 H new ATOM 0 HG23 THR A 319 -8.536 7.211 8.159 1.00 0.00 H new ATOM 288 N ASP A 320 -9.386 7.226 5.252 1.00 0.00 N ATOM 289 CA ASP A 320 -9.761 8.363 4.402 1.00 0.00 C ATOM 290 C ASP A 320 -8.762 9.498 4.577 1.00 0.00 C ATOM 291 O ASP A 320 -8.480 9.928 5.700 1.00 0.00 O ATOM 292 CB ASP A 320 -11.174 8.857 4.735 1.00 0.00 C ATOM 293 CG ASP A 320 -11.481 10.222 4.128 1.00 0.00 C ATOM 294 OD1 ASP A 320 -11.462 10.356 2.886 1.00 0.00 O ATOM 295 OD2 ASP A 320 -11.762 11.167 4.898 1.00 0.00 O ATOM 0 H ASP A 320 -10.105 6.943 5.917 1.00 0.00 H new ATOM 0 HA ASP A 320 -9.750 8.029 3.365 1.00 0.00 H new ATOM 0 HB2 ASP A 320 -11.902 8.131 4.373 1.00 0.00 H new ATOM 0 HB3 ASP A 320 -11.289 8.912 5.818 1.00 0.00 H new ATOM 300 N SER A 321 -8.215 9.959 3.454 1.00 0.00 N ATOM 301 CA SER A 321 -7.238 11.032 3.434 1.00 0.00 C ATOM 302 C SER A 321 -7.846 12.285 4.050 1.00 0.00 C ATOM 303 O SER A 321 -7.209 12.991 4.832 1.00 0.00 O ATOM 304 CB SER A 321 -6.820 11.313 1.978 1.00 0.00 C ATOM 305 OG SER A 321 -7.915 11.830 1.229 1.00 0.00 O ATOM 0 H SER A 321 -8.442 9.593 2.530 1.00 0.00 H new ATOM 0 HA SER A 321 -6.360 10.741 4.011 1.00 0.00 H new ATOM 0 HB2 SER A 321 -5.995 12.025 1.963 1.00 0.00 H new ATOM 0 HB3 SER A 321 -6.458 10.395 1.515 1.00 0.00 H new ATOM 0 HG SER A 321 -7.821 11.569 0.289 1.00 0.00 H new ATOM 311 N GLY A 322 -9.080 12.557 3.655 1.00 0.00 N ATOM 312 CA GLY A 322 -9.821 13.668 4.202 1.00 0.00 C ATOM 313 C GLY A 322 -10.448 14.497 3.106 1.00 0.00 C ATOM 314 O GLY A 322 -11.322 15.326 3.358 1.00 0.00 O ATOM 0 H GLY A 322 -9.586 12.017 2.953 1.00 0.00 H new ATOM 0 HA2 GLY A 322 -10.598 13.297 4.871 1.00 0.00 H new ATOM 0 HA3 GLY A 322 -9.157 14.293 4.800 1.00 0.00 H new ATOM 318 N HIS A 323 -10.010 14.260 1.874 1.00 0.00 N ATOM 319 CA HIS A 323 -10.518 15.005 0.728 1.00 0.00 C ATOM 320 C HIS A 323 -11.288 14.088 -0.210 1.00 0.00 C ATOM 321 O HIS A 323 -11.421 14.377 -1.399 1.00 0.00 O ATOM 322 CB HIS A 323 -9.383 15.697 -0.031 1.00 0.00 C ATOM 323 CG HIS A 323 -8.710 16.780 0.753 1.00 0.00 C ATOM 324 ND1 HIS A 323 -9.349 17.938 1.130 1.00 0.00 N ATOM 325 CD2 HIS A 323 -7.453 16.872 1.240 1.00 0.00 C ATOM 326 CE1 HIS A 323 -8.515 18.696 1.815 1.00 0.00 C ATOM 327 NE2 HIS A 323 -7.354 18.074 1.897 1.00 0.00 N ATOM 0 H HIS A 323 -9.306 13.559 1.644 1.00 0.00 H new ATOM 0 HA HIS A 323 -11.194 15.772 1.106 1.00 0.00 H new ATOM 0 HB2 HIS A 323 -8.641 14.952 -0.316 1.00 0.00 H new ATOM 0 HB3 HIS A 323 -9.780 16.121 -0.954 1.00 0.00 H new ATOM 0 HD2 HIS A 323 -6.670 16.136 1.132 1.00 0.00 H new ATOM 0 HE1 HIS A 323 -8.744 19.663 2.238 1.00 0.00 H new ATOM 0 HE2 HIS A 323 -6.522 18.427 2.370 1.00 0.00 H new ATOM 336 N ASP A 324 -11.727 12.954 0.338 1.00 0.00 N ATOM 337 CA ASP A 324 -12.615 12.015 -0.349 1.00 0.00 C ATOM 338 C ASP A 324 -11.802 11.066 -1.221 1.00 0.00 C ATOM 339 O ASP A 324 -12.150 10.774 -2.369 1.00 0.00 O ATOM 340 CB ASP A 324 -13.700 12.723 -1.170 1.00 0.00 C ATOM 341 CG ASP A 324 -14.671 13.520 -0.315 1.00 0.00 C ATOM 342 OD1 ASP A 324 -15.691 12.950 0.126 1.00 0.00 O ATOM 343 OD2 ASP A 324 -14.429 14.724 -0.091 1.00 0.00 O ATOM 0 H ASP A 324 -11.474 12.659 1.281 1.00 0.00 H new ATOM 0 HA ASP A 324 -13.134 11.439 0.417 1.00 0.00 H new ATOM 0 HB2 ASP A 324 -13.225 13.391 -1.888 1.00 0.00 H new ATOM 0 HB3 ASP A 324 -14.255 11.981 -1.744 1.00 0.00 H new ATOM 348 N THR A 325 -10.716 10.593 -0.631 1.00 0.00 N ATOM 349 CA THR A 325 -9.840 9.586 -1.198 1.00 0.00 C ATOM 350 C THR A 325 -9.222 8.866 -0.019 1.00 0.00 C ATOM 351 O THR A 325 -9.431 9.294 1.109 1.00 0.00 O ATOM 352 CB THR A 325 -8.741 10.191 -2.088 1.00 0.00 C ATOM 353 OG1 THR A 325 -8.202 11.370 -1.481 1.00 0.00 O ATOM 354 CG2 THR A 325 -9.279 10.510 -3.475 1.00 0.00 C ATOM 0 H THR A 325 -10.411 10.913 0.289 1.00 0.00 H new ATOM 0 HA THR A 325 -10.407 8.917 -1.845 1.00 0.00 H new ATOM 0 HB THR A 325 -7.945 9.454 -2.193 1.00 0.00 H new ATOM 0 HG1 THR A 325 -7.503 11.744 -2.057 1.00 0.00 H new ATOM 0 HG21 THR A 325 -8.483 10.937 -4.085 1.00 0.00 H new ATOM 0 HG22 THR A 325 -9.644 9.596 -3.943 1.00 0.00 H new ATOM 0 HG23 THR A 325 -10.096 11.227 -3.392 1.00 0.00 H new ATOM 362 N VAL A 326 -8.484 7.794 -0.217 1.00 0.00 N ATOM 363 CA VAL A 326 -8.025 7.028 0.924 1.00 0.00 C ATOM 364 C VAL A 326 -6.517 6.891 0.939 1.00 0.00 C ATOM 365 O VAL A 326 -5.879 6.781 -0.094 1.00 0.00 O ATOM 366 CB VAL A 326 -8.666 5.632 0.960 1.00 0.00 C ATOM 367 CG1 VAL A 326 -8.944 5.221 2.385 1.00 0.00 C ATOM 368 CG2 VAL A 326 -9.940 5.616 0.153 1.00 0.00 C ATOM 0 H VAL A 326 -8.195 7.440 -1.129 1.00 0.00 H new ATOM 0 HA VAL A 326 -8.333 7.581 1.811 1.00 0.00 H new ATOM 0 HB VAL A 326 -7.969 4.919 0.520 1.00 0.00 H new ATOM 0 HG11 VAL A 326 -9.398 4.230 2.396 1.00 0.00 H new ATOM 0 HG12 VAL A 326 -8.010 5.198 2.946 1.00 0.00 H new ATOM 0 HG13 VAL A 326 -9.625 5.937 2.844 1.00 0.00 H new ATOM 0 HG21 VAL A 326 -10.381 4.620 0.189 1.00 0.00 H new ATOM 0 HG22 VAL A 326 -10.642 6.339 0.568 1.00 0.00 H new ATOM 0 HG23 VAL A 326 -9.719 5.877 -0.882 1.00 0.00 H new ATOM 378 N VAL A 327 -5.968 6.959 2.123 1.00 0.00 N ATOM 379 CA VAL A 327 -4.548 6.771 2.337 1.00 0.00 C ATOM 380 C VAL A 327 -4.298 5.613 3.282 1.00 0.00 C ATOM 381 O VAL A 327 -5.155 5.257 4.084 1.00 0.00 O ATOM 382 CB VAL A 327 -3.918 8.050 2.917 1.00 0.00 C ATOM 383 CG1 VAL A 327 -3.929 9.161 1.879 1.00 0.00 C ATOM 384 CG2 VAL A 327 -4.653 8.477 4.185 1.00 0.00 C ATOM 0 H VAL A 327 -6.494 7.148 2.976 1.00 0.00 H new ATOM 0 HA VAL A 327 -4.089 6.549 1.374 1.00 0.00 H new ATOM 0 HB VAL A 327 -2.881 7.843 3.181 1.00 0.00 H new ATOM 0 HG11 VAL A 327 -3.481 10.059 2.303 1.00 0.00 H new ATOM 0 HG12 VAL A 327 -3.358 8.848 1.005 1.00 0.00 H new ATOM 0 HG13 VAL A 327 -4.957 9.373 1.584 1.00 0.00 H new ATOM 0 HG21 VAL A 327 -4.196 9.383 4.583 1.00 0.00 H new ATOM 0 HG22 VAL A 327 -5.700 8.672 3.951 1.00 0.00 H new ATOM 0 HG23 VAL A 327 -4.589 7.682 4.928 1.00 0.00 H new ATOM 394 N MET A 328 -3.131 5.022 3.185 1.00 0.00 N ATOM 395 CA MET A 328 -2.723 4.011 4.130 1.00 0.00 C ATOM 396 C MET A 328 -1.228 4.125 4.312 1.00 0.00 C ATOM 397 O MET A 328 -0.540 4.681 3.455 1.00 0.00 O ATOM 398 CB MET A 328 -3.113 2.600 3.671 1.00 0.00 C ATOM 399 CG MET A 328 -2.060 1.885 2.839 1.00 0.00 C ATOM 400 SD MET A 328 -2.364 0.114 2.765 1.00 0.00 S ATOM 401 CE MET A 328 -2.278 -0.312 4.503 1.00 0.00 C ATOM 0 H MET A 328 -2.445 5.225 2.458 1.00 0.00 H new ATOM 0 HA MET A 328 -3.237 4.174 5.077 1.00 0.00 H new ATOM 0 HB2 MET A 328 -3.333 1.995 4.551 1.00 0.00 H new ATOM 0 HB3 MET A 328 -4.033 2.664 3.090 1.00 0.00 H new ATOM 0 HG2 MET A 328 -2.053 2.296 1.829 1.00 0.00 H new ATOM 0 HG3 MET A 328 -1.073 2.068 3.265 1.00 0.00 H new ATOM 0 HE1 MET A 328 -2.358 -1.393 4.617 1.00 0.00 H new ATOM 0 HE2 MET A 328 -1.327 0.027 4.914 1.00 0.00 H new ATOM 0 HE3 MET A 328 -3.097 0.171 5.037 1.00 0.00 H new ATOM 411 N GLU A 329 -0.725 3.629 5.418 1.00 0.00 N ATOM 412 CA GLU A 329 0.685 3.768 5.729 1.00 0.00 C ATOM 413 C GLU A 329 1.265 2.397 6.070 1.00 0.00 C ATOM 414 O GLU A 329 0.687 1.657 6.857 1.00 0.00 O ATOM 415 CB GLU A 329 0.835 4.754 6.894 1.00 0.00 C ATOM 416 CG GLU A 329 2.175 5.463 6.959 1.00 0.00 C ATOM 417 CD GLU A 329 2.157 6.626 7.933 1.00 0.00 C ATOM 418 OE1 GLU A 329 2.021 6.390 9.151 1.00 0.00 O ATOM 419 OE2 GLU A 329 2.261 7.786 7.482 1.00 0.00 O ATOM 0 H GLU A 329 -1.268 3.125 6.119 1.00 0.00 H new ATOM 0 HA GLU A 329 1.236 4.158 4.873 1.00 0.00 H new ATOM 0 HB2 GLU A 329 0.047 5.503 6.821 1.00 0.00 H new ATOM 0 HB3 GLU A 329 0.679 4.216 7.829 1.00 0.00 H new ATOM 0 HG2 GLU A 329 2.947 4.753 7.257 1.00 0.00 H new ATOM 0 HG3 GLU A 329 2.442 5.826 5.966 1.00 0.00 H new ATOM 426 N VAL A 330 2.370 2.030 5.443 1.00 0.00 N ATOM 427 CA VAL A 330 2.942 0.697 5.635 1.00 0.00 C ATOM 428 C VAL A 330 4.437 0.735 5.971 1.00 0.00 C ATOM 429 O VAL A 330 5.150 1.649 5.556 1.00 0.00 O ATOM 430 CB VAL A 330 2.723 -0.160 4.371 1.00 0.00 C ATOM 431 CG1 VAL A 330 1.268 -0.582 4.258 1.00 0.00 C ATOM 432 CG2 VAL A 330 3.123 0.621 3.130 1.00 0.00 C ATOM 0 H VAL A 330 2.890 2.627 4.800 1.00 0.00 H new ATOM 0 HA VAL A 330 2.426 0.254 6.487 1.00 0.00 H new ATOM 0 HB VAL A 330 3.345 -1.051 4.452 1.00 0.00 H new ATOM 0 HG11 VAL A 330 1.133 -1.186 3.360 1.00 0.00 H new ATOM 0 HG12 VAL A 330 0.990 -1.167 5.134 1.00 0.00 H new ATOM 0 HG13 VAL A 330 0.636 0.304 4.198 1.00 0.00 H new ATOM 0 HG21 VAL A 330 2.964 0.005 2.245 1.00 0.00 H new ATOM 0 HG22 VAL A 330 2.517 1.524 3.057 1.00 0.00 H new ATOM 0 HG23 VAL A 330 4.176 0.895 3.196 1.00 0.00 H new ATOM 442 N GLY A 331 4.900 -0.255 6.743 1.00 0.00 N ATOM 443 CA GLY A 331 6.318 -0.376 7.060 1.00 0.00 C ATOM 444 C GLY A 331 6.952 -1.564 6.350 1.00 0.00 C ATOM 445 O GLY A 331 6.255 -2.305 5.666 1.00 0.00 O ATOM 0 H GLY A 331 4.312 -0.979 7.156 1.00 0.00 H new ATOM 0 HA2 GLY A 331 6.835 0.539 6.772 1.00 0.00 H new ATOM 0 HA3 GLY A 331 6.442 -0.487 8.137 1.00 0.00 H new ATOM 449 N PHE A 332 8.257 -1.771 6.523 1.00 0.00 N ATOM 450 CA PHE A 332 8.940 -2.860 5.820 1.00 0.00 C ATOM 451 C PHE A 332 9.943 -3.607 6.696 1.00 0.00 C ATOM 452 O PHE A 332 10.403 -3.112 7.726 1.00 0.00 O ATOM 453 CB PHE A 332 9.674 -2.370 4.578 1.00 0.00 C ATOM 454 CG PHE A 332 11.021 -1.739 4.873 1.00 0.00 C ATOM 455 CD1 PHE A 332 11.190 -0.874 5.947 1.00 0.00 C ATOM 456 CD2 PHE A 332 12.121 -2.038 4.093 1.00 0.00 C ATOM 457 CE1 PHE A 332 12.425 -0.326 6.232 1.00 0.00 C ATOM 458 CE2 PHE A 332 13.361 -1.493 4.375 1.00 0.00 C ATOM 459 CZ PHE A 332 13.513 -0.636 5.444 1.00 0.00 C ATOM 0 H PHE A 332 8.855 -1.212 7.132 1.00 0.00 H new ATOM 0 HA PHE A 332 8.140 -3.544 5.537 1.00 0.00 H new ATOM 0 HB2 PHE A 332 9.817 -3.209 3.897 1.00 0.00 H new ATOM 0 HB3 PHE A 332 9.048 -1.643 4.060 1.00 0.00 H new ATOM 0 HD1 PHE A 332 10.342 -0.626 6.569 1.00 0.00 H new ATOM 0 HD2 PHE A 332 12.012 -2.706 3.252 1.00 0.00 H new ATOM 0 HE1 PHE A 332 12.538 0.345 7.071 1.00 0.00 H new ATOM 0 HE2 PHE A 332 14.211 -1.739 3.757 1.00 0.00 H new ATOM 0 HZ PHE A 332 14.481 -0.209 5.663 1.00 0.00 H new ATOM 469 N SER A 333 10.230 -4.825 6.276 1.00 0.00 N ATOM 470 CA SER A 333 11.288 -5.630 6.872 1.00 0.00 C ATOM 471 C SER A 333 12.680 -5.024 6.642 1.00 0.00 C ATOM 472 O SER A 333 13.294 -4.523 7.584 1.00 0.00 O ATOM 473 CB SER A 333 11.228 -7.060 6.330 1.00 0.00 C ATOM 474 OG SER A 333 12.048 -7.929 7.091 1.00 0.00 O ATOM 0 H SER A 333 9.738 -5.287 5.512 1.00 0.00 H new ATOM 0 HA SER A 333 11.121 -5.645 7.949 1.00 0.00 H new ATOM 0 HB2 SER A 333 10.198 -7.417 6.350 1.00 0.00 H new ATOM 0 HB3 SER A 333 11.549 -7.071 5.288 1.00 0.00 H new ATOM 0 HG SER A 333 11.991 -8.836 6.725 1.00 0.00 H new ATOM 480 N GLY A 334 13.186 -5.061 5.404 1.00 0.00 N ATOM 481 CA GLY A 334 14.539 -4.570 5.178 1.00 0.00 C ATOM 482 C GLY A 334 14.924 -4.352 3.713 1.00 0.00 C ATOM 483 O GLY A 334 15.857 -3.603 3.432 1.00 0.00 O ATOM 0 H GLY A 334 12.700 -5.411 4.579 1.00 0.00 H new ATOM 0 HA2 GLY A 334 14.658 -3.627 5.711 1.00 0.00 H new ATOM 0 HA3 GLY A 334 15.242 -5.277 5.619 1.00 0.00 H new ATOM 487 N THR A 335 14.237 -5.028 2.799 1.00 0.00 N ATOM 488 CA THR A 335 14.446 -4.797 1.359 1.00 0.00 C ATOM 489 C THR A 335 14.352 -3.302 1.056 1.00 0.00 C ATOM 490 O THR A 335 13.412 -2.637 1.482 1.00 0.00 O ATOM 491 CB THR A 335 13.399 -5.555 0.514 1.00 0.00 C ATOM 492 OG1 THR A 335 13.626 -6.966 0.630 1.00 0.00 O ATOM 493 CG2 THR A 335 13.435 -5.148 -0.962 1.00 0.00 C ATOM 0 H THR A 335 13.535 -5.735 3.018 1.00 0.00 H new ATOM 0 HA THR A 335 15.437 -5.169 1.098 1.00 0.00 H new ATOM 0 HB THR A 335 12.413 -5.294 0.899 1.00 0.00 H new ATOM 0 HG1 THR A 335 13.239 -7.424 -0.145 1.00 0.00 H new ATOM 0 HG21 THR A 335 12.680 -5.709 -1.513 1.00 0.00 H new ATOM 0 HG22 THR A 335 13.230 -4.081 -1.050 1.00 0.00 H new ATOM 0 HG23 THR A 335 14.420 -5.364 -1.375 1.00 0.00 H new ATOM 501 N ARG A 336 15.340 -2.786 0.316 1.00 0.00 N ATOM 502 CA ARG A 336 15.456 -1.350 0.085 1.00 0.00 C ATOM 503 C ARG A 336 14.318 -0.895 -0.810 1.00 0.00 C ATOM 504 O ARG A 336 13.536 -1.743 -1.242 1.00 0.00 O ATOM 505 CB ARG A 336 16.797 -1.009 -0.582 1.00 0.00 C ATOM 506 CG ARG A 336 16.876 -1.421 -2.046 1.00 0.00 C ATOM 507 CD ARG A 336 17.965 -0.661 -2.791 1.00 0.00 C ATOM 508 NE ARG A 336 17.733 0.785 -2.784 1.00 0.00 N ATOM 509 CZ ARG A 336 17.733 1.553 -3.878 1.00 0.00 C ATOM 510 NH1 ARG A 336 17.973 1.026 -5.075 1.00 0.00 N ATOM 511 NH2 ARG A 336 17.505 2.853 -3.777 1.00 0.00 N ATOM 0 H ARG A 336 16.068 -3.344 -0.131 1.00 0.00 H new ATOM 0 HA ARG A 336 15.408 -0.837 1.046 1.00 0.00 H new ATOM 0 HB2 ARG A 336 16.967 0.065 -0.506 1.00 0.00 H new ATOM 0 HB3 ARG A 336 17.601 -1.499 -0.032 1.00 0.00 H new ATOM 0 HG2 ARG A 336 17.070 -2.492 -2.112 1.00 0.00 H new ATOM 0 HG3 ARG A 336 15.914 -1.241 -2.526 1.00 0.00 H new ATOM 0 HD2 ARG A 336 18.932 -0.875 -2.335 1.00 0.00 H new ATOM 0 HD3 ARG A 336 18.013 -1.015 -3.821 1.00 0.00 H new ATOM 0 HE ARG A 336 17.560 1.236 -1.885 1.00 0.00 H new ATOM 0 HH11 ARG A 336 18.159 0.027 -5.164 1.00 0.00 H new ATOM 0 HH12 ARG A 336 17.971 1.621 -5.904 1.00 0.00 H new ATOM 0 HH21 ARG A 336 17.329 3.270 -2.863 1.00 0.00 H new ATOM 0 HH22 ARG A 336 17.505 3.437 -4.613 1.00 0.00 H new ATOM 525 N PRO A 337 14.208 0.426 -1.106 1.00 0.00 N ATOM 526 CA PRO A 337 13.218 0.957 -2.033 1.00 0.00 C ATOM 527 C PRO A 337 12.816 -0.040 -3.099 1.00 0.00 C ATOM 528 O PRO A 337 13.563 -0.329 -4.038 1.00 0.00 O ATOM 529 CB PRO A 337 13.950 2.155 -2.603 1.00 0.00 C ATOM 530 CG PRO A 337 14.621 2.717 -1.399 1.00 0.00 C ATOM 531 CD PRO A 337 15.020 1.529 -0.548 1.00 0.00 C ATOM 0 HA PRO A 337 12.266 1.204 -1.562 1.00 0.00 H new ATOM 0 HB2 PRO A 337 14.667 1.866 -3.371 1.00 0.00 H new ATOM 0 HB3 PRO A 337 13.266 2.871 -3.059 1.00 0.00 H new ATOM 0 HG2 PRO A 337 15.494 3.307 -1.679 1.00 0.00 H new ATOM 0 HG3 PRO A 337 13.950 3.380 -0.853 1.00 0.00 H new ATOM 0 HD2 PRO A 337 16.087 1.321 -0.622 1.00 0.00 H new ATOM 0 HD3 PRO A 337 14.801 1.697 0.506 1.00 0.00 H new ATOM 539 N CYS A 338 11.624 -0.566 -2.925 1.00 0.00 N ATOM 540 CA CYS A 338 11.124 -1.623 -3.778 1.00 0.00 C ATOM 541 C CYS A 338 9.801 -1.173 -4.332 1.00 0.00 C ATOM 542 O CYS A 338 9.149 -0.304 -3.743 1.00 0.00 O ATOM 543 CB CYS A 338 10.912 -2.914 -3.005 1.00 0.00 C ATOM 544 SG CYS A 338 9.619 -2.794 -1.740 1.00 0.00 S ATOM 0 H CYS A 338 10.976 -0.276 -2.193 1.00 0.00 H new ATOM 0 HA CYS A 338 11.852 -1.817 -4.566 1.00 0.00 H new ATOM 0 HB2 CYS A 338 10.653 -3.709 -3.704 1.00 0.00 H new ATOM 0 HB3 CYS A 338 11.850 -3.202 -2.529 1.00 0.00 H new ATOM 549 N ARG A 339 9.409 -1.704 -5.467 1.00 0.00 N ATOM 550 CA ARG A 339 8.070 -1.459 -5.973 1.00 0.00 C ATOM 551 C ARG A 339 7.042 -2.132 -5.090 1.00 0.00 C ATOM 552 O ARG A 339 7.013 -3.357 -4.976 1.00 0.00 O ATOM 553 CB ARG A 339 7.931 -1.948 -7.420 1.00 0.00 C ATOM 554 CG ARG A 339 8.343 -0.913 -8.458 1.00 0.00 C ATOM 555 CD ARG A 339 9.792 -0.488 -8.298 1.00 0.00 C ATOM 556 NE ARG A 339 10.100 0.719 -9.064 1.00 0.00 N ATOM 557 CZ ARG A 339 10.998 1.631 -8.684 1.00 0.00 C ATOM 558 NH1 ARG A 339 11.718 1.440 -7.584 1.00 0.00 N ATOM 559 NH2 ARG A 339 11.195 2.721 -9.417 1.00 0.00 N ATOM 0 H ARG A 339 9.988 -2.303 -6.055 1.00 0.00 H new ATOM 0 HA ARG A 339 7.895 -0.383 -5.960 1.00 0.00 H new ATOM 0 HB2 ARG A 339 8.539 -2.843 -7.552 1.00 0.00 H new ATOM 0 HB3 ARG A 339 6.895 -2.237 -7.599 1.00 0.00 H new ATOM 0 HG2 ARG A 339 8.194 -1.323 -9.457 1.00 0.00 H new ATOM 0 HG3 ARG A 339 7.698 -0.039 -8.373 1.00 0.00 H new ATOM 0 HD2 ARG A 339 10.003 -0.311 -7.243 1.00 0.00 H new ATOM 0 HD3 ARG A 339 10.445 -1.299 -8.622 1.00 0.00 H new ATOM 0 HE ARG A 339 9.600 0.873 -9.939 1.00 0.00 H new ATOM 0 HH11 ARG A 339 11.585 0.595 -7.028 1.00 0.00 H new ATOM 0 HH12 ARG A 339 12.404 2.138 -7.296 1.00 0.00 H new ATOM 0 HH21 ARG A 339 10.659 2.863 -10.273 1.00 0.00 H new ATOM 0 HH22 ARG A 339 11.882 3.416 -9.124 1.00 0.00 H new ATOM 573 N ILE A 340 6.197 -1.316 -4.483 1.00 0.00 N ATOM 574 CA ILE A 340 5.234 -1.812 -3.517 1.00 0.00 C ATOM 575 C ILE A 340 4.048 -2.443 -4.221 1.00 0.00 C ATOM 576 O ILE A 340 3.353 -1.778 -4.993 1.00 0.00 O ATOM 577 CB ILE A 340 4.739 -0.696 -2.579 1.00 0.00 C ATOM 578 CG1 ILE A 340 5.925 -0.021 -1.907 1.00 0.00 C ATOM 579 CG2 ILE A 340 3.794 -1.260 -1.533 1.00 0.00 C ATOM 580 CD1 ILE A 340 6.861 -0.995 -1.240 1.00 0.00 C ATOM 0 H ILE A 340 6.159 -0.309 -4.642 1.00 0.00 H new ATOM 0 HA ILE A 340 5.743 -2.565 -2.915 1.00 0.00 H new ATOM 0 HB ILE A 340 4.197 0.043 -3.169 1.00 0.00 H new ATOM 0 HG12 ILE A 340 6.478 0.553 -2.651 1.00 0.00 H new ATOM 0 HG13 ILE A 340 5.559 0.688 -1.164 1.00 0.00 H new ATOM 0 HG21 ILE A 340 3.454 -0.457 -0.879 1.00 0.00 H new ATOM 0 HG22 ILE A 340 2.935 -1.714 -2.026 1.00 0.00 H new ATOM 0 HG23 ILE A 340 4.314 -2.014 -0.942 1.00 0.00 H new ATOM 0 HD11 ILE A 340 7.685 -0.450 -0.780 1.00 0.00 H new ATOM 0 HD12 ILE A 340 6.321 -1.552 -0.474 1.00 0.00 H new ATOM 0 HD13 ILE A 340 7.254 -1.689 -1.983 1.00 0.00 H new ATOM 592 N PRO A 341 3.812 -3.741 -3.989 1.00 0.00 N ATOM 593 CA PRO A 341 2.661 -4.427 -4.551 1.00 0.00 C ATOM 594 C PRO A 341 1.390 -4.051 -3.804 1.00 0.00 C ATOM 595 O PRO A 341 0.904 -4.791 -2.950 1.00 0.00 O ATOM 596 CB PRO A 341 3.002 -5.907 -4.357 1.00 0.00 C ATOM 597 CG PRO A 341 3.888 -5.935 -3.159 1.00 0.00 C ATOM 598 CD PRO A 341 4.651 -4.637 -3.168 1.00 0.00 C ATOM 0 HA PRO A 341 2.475 -4.170 -5.594 1.00 0.00 H new ATOM 0 HB2 PRO A 341 2.103 -6.503 -4.199 1.00 0.00 H new ATOM 0 HB3 PRO A 341 3.506 -6.316 -5.233 1.00 0.00 H new ATOM 0 HG2 PRO A 341 3.303 -6.036 -2.245 1.00 0.00 H new ATOM 0 HG3 PRO A 341 4.568 -6.786 -3.198 1.00 0.00 H new ATOM 0 HD2 PRO A 341 4.786 -4.246 -2.160 1.00 0.00 H new ATOM 0 HD3 PRO A 341 5.645 -4.760 -3.598 1.00 0.00 H new ATOM 606 N VAL A 342 0.854 -2.894 -4.137 1.00 0.00 N ATOM 607 CA VAL A 342 -0.352 -2.410 -3.507 1.00 0.00 C ATOM 608 C VAL A 342 -1.525 -2.583 -4.434 1.00 0.00 C ATOM 609 O VAL A 342 -1.552 -2.055 -5.547 1.00 0.00 O ATOM 610 CB VAL A 342 -0.243 -0.939 -3.073 1.00 0.00 C ATOM 611 CG1 VAL A 342 0.518 -0.848 -1.767 1.00 0.00 C ATOM 612 CG2 VAL A 342 0.431 -0.102 -4.149 1.00 0.00 C ATOM 0 H VAL A 342 1.240 -2.270 -4.846 1.00 0.00 H new ATOM 0 HA VAL A 342 -0.500 -3.004 -2.605 1.00 0.00 H new ATOM 0 HB VAL A 342 -1.247 -0.542 -2.927 1.00 0.00 H new ATOM 0 HG11 VAL A 342 0.594 0.196 -1.462 1.00 0.00 H new ATOM 0 HG12 VAL A 342 -0.009 -1.413 -0.999 1.00 0.00 H new ATOM 0 HG13 VAL A 342 1.518 -1.261 -1.899 1.00 0.00 H new ATOM 0 HG21 VAL A 342 0.496 0.934 -3.817 1.00 0.00 H new ATOM 0 HG22 VAL A 342 1.434 -0.487 -4.334 1.00 0.00 H new ATOM 0 HG23 VAL A 342 -0.153 -0.153 -5.068 1.00 0.00 H new ATOM 622 N ARG A 343 -2.469 -3.363 -3.984 1.00 0.00 N ATOM 623 CA ARG A 343 -3.687 -3.577 -4.714 1.00 0.00 C ATOM 624 C ARG A 343 -4.830 -3.495 -3.738 1.00 0.00 C ATOM 625 O ARG A 343 -4.612 -3.312 -2.551 1.00 0.00 O ATOM 626 CB ARG A 343 -3.683 -4.938 -5.395 1.00 0.00 C ATOM 627 CG ARG A 343 -3.714 -6.103 -4.416 1.00 0.00 C ATOM 628 CD ARG A 343 -3.677 -7.434 -5.147 1.00 0.00 C ATOM 629 NE ARG A 343 -3.687 -8.578 -4.235 1.00 0.00 N ATOM 630 CZ ARG A 343 -3.922 -9.832 -4.628 1.00 0.00 C ATOM 631 NH1 ARG A 343 -4.177 -10.088 -5.906 1.00 0.00 N ATOM 632 NH2 ARG A 343 -3.895 -10.825 -3.746 1.00 0.00 N ATOM 0 H ARG A 343 -2.415 -3.869 -3.100 1.00 0.00 H new ATOM 0 HA ARG A 343 -3.787 -2.820 -5.492 1.00 0.00 H new ATOM 0 HB2 ARG A 343 -4.545 -5.007 -6.058 1.00 0.00 H new ATOM 0 HB3 ARG A 343 -2.793 -5.021 -6.019 1.00 0.00 H new ATOM 0 HG2 ARG A 343 -2.864 -6.034 -3.737 1.00 0.00 H new ATOM 0 HG3 ARG A 343 -4.615 -6.045 -3.806 1.00 0.00 H new ATOM 0 HD2 ARG A 343 -4.535 -7.500 -5.816 1.00 0.00 H new ATOM 0 HD3 ARG A 343 -2.783 -7.478 -5.769 1.00 0.00 H new ATOM 0 HE ARG A 343 -3.505 -8.408 -3.246 1.00 0.00 H new ATOM 0 HH11 ARG A 343 -4.193 -9.327 -6.585 1.00 0.00 H new ATOM 0 HH12 ARG A 343 -4.357 -11.045 -6.208 1.00 0.00 H new ATOM 0 HH21 ARG A 343 -3.694 -10.630 -2.765 1.00 0.00 H new ATOM 0 HH22 ARG A 343 -4.075 -11.782 -4.050 1.00 0.00 H new ATOM 646 N ALA A 344 -6.034 -3.622 -4.219 1.00 0.00 N ATOM 647 CA ALA A 344 -7.175 -3.598 -3.345 1.00 0.00 C ATOM 648 C ALA A 344 -8.261 -4.505 -3.869 1.00 0.00 C ATOM 649 O ALA A 344 -8.411 -4.666 -5.073 1.00 0.00 O ATOM 650 CB ALA A 344 -7.675 -2.175 -3.188 1.00 0.00 C ATOM 0 H ALA A 344 -6.252 -3.743 -5.208 1.00 0.00 H new ATOM 0 HA ALA A 344 -6.880 -3.968 -2.363 1.00 0.00 H new ATOM 0 HB1 ALA A 344 -8.540 -2.164 -2.524 1.00 0.00 H new ATOM 0 HB2 ALA A 344 -6.884 -1.556 -2.764 1.00 0.00 H new ATOM 0 HB3 ALA A 344 -7.961 -1.780 -4.163 1.00 0.00 H new ATOM 656 N VAL A 345 -9.007 -5.120 -2.978 1.00 0.00 N ATOM 657 CA VAL A 345 -10.099 -5.976 -3.380 1.00 0.00 C ATOM 658 C VAL A 345 -11.387 -5.423 -2.815 1.00 0.00 C ATOM 659 O VAL A 345 -11.404 -4.832 -1.737 1.00 0.00 O ATOM 660 CB VAL A 345 -9.890 -7.431 -2.905 1.00 0.00 C ATOM 661 CG1 VAL A 345 -8.554 -7.959 -3.393 1.00 0.00 C ATOM 662 CG2 VAL A 345 -9.986 -7.542 -1.395 1.00 0.00 C ATOM 0 H VAL A 345 -8.876 -5.043 -1.969 1.00 0.00 H new ATOM 0 HA VAL A 345 -10.143 -5.995 -4.469 1.00 0.00 H new ATOM 0 HB VAL A 345 -10.687 -8.039 -3.333 1.00 0.00 H new ATOM 0 HG11 VAL A 345 -8.421 -8.985 -3.050 1.00 0.00 H new ATOM 0 HG12 VAL A 345 -8.529 -7.934 -4.482 1.00 0.00 H new ATOM 0 HG13 VAL A 345 -7.751 -7.338 -2.997 1.00 0.00 H new ATOM 0 HG21 VAL A 345 -9.834 -8.579 -1.096 1.00 0.00 H new ATOM 0 HG22 VAL A 345 -9.222 -6.916 -0.935 1.00 0.00 H new ATOM 0 HG23 VAL A 345 -10.972 -7.211 -1.068 1.00 0.00 H new ATOM 672 N ALA A 346 -12.435 -5.526 -3.587 1.00 0.00 N ATOM 673 CA ALA A 346 -13.731 -5.046 -3.166 1.00 0.00 C ATOM 674 C ALA A 346 -14.275 -5.809 -1.964 1.00 0.00 C ATOM 675 O ALA A 346 -14.560 -7.000 -2.055 1.00 0.00 O ATOM 676 CB ALA A 346 -14.683 -5.149 -4.337 1.00 0.00 C ATOM 0 H ALA A 346 -12.420 -5.941 -4.519 1.00 0.00 H new ATOM 0 HA ALA A 346 -13.628 -4.009 -2.847 1.00 0.00 H new ATOM 0 HB1 ALA A 346 -15.668 -4.791 -4.038 1.00 0.00 H new ATOM 0 HB2 ALA A 346 -14.311 -4.542 -5.163 1.00 0.00 H new ATOM 0 HB3 ALA A 346 -14.757 -6.189 -4.656 1.00 0.00 H new ATOM 682 N HIS A 347 -14.420 -5.077 -0.855 1.00 0.00 N ATOM 683 CA HIS A 347 -14.994 -5.596 0.396 1.00 0.00 C ATOM 684 C HIS A 347 -14.491 -7.014 0.703 1.00 0.00 C ATOM 685 O HIS A 347 -15.262 -7.972 0.685 1.00 0.00 O ATOM 686 CB HIS A 347 -16.533 -5.561 0.310 1.00 0.00 C ATOM 687 CG HIS A 347 -17.256 -5.957 1.572 1.00 0.00 C ATOM 688 ND1 HIS A 347 -17.532 -5.079 2.602 1.00 0.00 N ATOM 689 CD2 HIS A 347 -17.784 -7.145 1.952 1.00 0.00 C ATOM 690 CE1 HIS A 347 -18.194 -5.711 3.550 1.00 0.00 C ATOM 691 NE2 HIS A 347 -18.359 -6.964 3.182 1.00 0.00 N ATOM 0 H HIS A 347 -14.140 -4.098 -0.797 1.00 0.00 H new ATOM 0 HA HIS A 347 -14.668 -4.959 1.218 1.00 0.00 H new ATOM 0 HB2 HIS A 347 -16.843 -4.553 0.034 1.00 0.00 H new ATOM 0 HB3 HIS A 347 -16.851 -6.224 -0.495 1.00 0.00 H new ATOM 0 HD1 HIS A 347 -17.265 -4.095 2.625 1.00 0.00 H new ATOM 0 HD2 HIS A 347 -17.757 -8.066 1.389 1.00 0.00 H new ATOM 0 HE1 HIS A 347 -18.543 -5.274 4.474 1.00 0.00 H new ATOM 700 N GLY A 348 -13.201 -7.136 1.016 1.00 0.00 N ATOM 701 CA GLY A 348 -12.596 -8.435 1.269 1.00 0.00 C ATOM 702 C GLY A 348 -12.940 -9.521 0.263 1.00 0.00 C ATOM 703 O GLY A 348 -13.117 -10.676 0.654 1.00 0.00 O ATOM 0 H GLY A 348 -12.558 -6.348 1.099 1.00 0.00 H new ATOM 0 HA2 GLY A 348 -11.513 -8.314 1.292 1.00 0.00 H new ATOM 0 HA3 GLY A 348 -12.900 -8.772 2.260 1.00 0.00 H new ATOM 707 N VAL A 349 -13.009 -9.194 -1.024 1.00 0.00 N ATOM 708 CA VAL A 349 -13.300 -10.189 -2.052 1.00 0.00 C ATOM 709 C VAL A 349 -12.398 -9.922 -3.255 1.00 0.00 C ATOM 710 O VAL A 349 -12.648 -8.997 -4.032 1.00 0.00 O ATOM 711 CB VAL A 349 -14.774 -10.140 -2.533 1.00 0.00 C ATOM 712 CG1 VAL A 349 -15.035 -11.222 -3.572 1.00 0.00 C ATOM 713 CG2 VAL A 349 -15.744 -10.285 -1.370 1.00 0.00 C ATOM 0 H VAL A 349 -12.868 -8.249 -1.380 1.00 0.00 H new ATOM 0 HA VAL A 349 -13.123 -11.172 -1.616 1.00 0.00 H new ATOM 0 HB VAL A 349 -14.938 -9.164 -2.990 1.00 0.00 H new ATOM 0 HG11 VAL A 349 -16.074 -11.171 -3.897 1.00 0.00 H new ATOM 0 HG12 VAL A 349 -14.379 -11.069 -4.429 1.00 0.00 H new ATOM 0 HG13 VAL A 349 -14.839 -12.201 -3.135 1.00 0.00 H new ATOM 0 HG21 VAL A 349 -16.768 -10.246 -1.743 1.00 0.00 H new ATOM 0 HG22 VAL A 349 -15.575 -11.240 -0.872 1.00 0.00 H new ATOM 0 HG23 VAL A 349 -15.585 -9.473 -0.661 1.00 0.00 H new ATOM 723 N PRO A 350 -11.322 -10.702 -3.412 1.00 0.00 N ATOM 724 CA PRO A 350 -10.367 -10.529 -4.510 1.00 0.00 C ATOM 725 C PRO A 350 -10.897 -11.030 -5.848 1.00 0.00 C ATOM 726 O PRO A 350 -10.369 -11.986 -6.422 1.00 0.00 O ATOM 727 CB PRO A 350 -9.150 -11.365 -4.070 1.00 0.00 C ATOM 728 CG PRO A 350 -9.413 -11.716 -2.644 1.00 0.00 C ATOM 729 CD PRO A 350 -10.906 -11.780 -2.514 1.00 0.00 C ATOM 0 HA PRO A 350 -10.144 -9.475 -4.677 1.00 0.00 H new ATOM 0 HB2 PRO A 350 -9.044 -12.260 -4.683 1.00 0.00 H new ATOM 0 HB3 PRO A 350 -8.225 -10.798 -4.172 1.00 0.00 H new ATOM 0 HG2 PRO A 350 -8.956 -12.671 -2.384 1.00 0.00 H new ATOM 0 HG3 PRO A 350 -8.993 -10.968 -1.972 1.00 0.00 H new ATOM 0 HD2 PRO A 350 -11.304 -12.747 -2.822 1.00 0.00 H new ATOM 0 HD3 PRO A 350 -11.236 -11.611 -1.489 1.00 0.00 H new ATOM 737 N GLU A 351 -11.945 -10.394 -6.342 1.00 0.00 N ATOM 738 CA GLU A 351 -12.483 -10.730 -7.641 1.00 0.00 C ATOM 739 C GLU A 351 -11.991 -9.704 -8.649 1.00 0.00 C ATOM 740 O GLU A 351 -11.366 -10.043 -9.653 1.00 0.00 O ATOM 741 CB GLU A 351 -14.013 -10.759 -7.576 1.00 0.00 C ATOM 742 CG GLU A 351 -14.689 -11.067 -8.898 1.00 0.00 C ATOM 743 CD GLU A 351 -14.140 -12.306 -9.574 1.00 0.00 C ATOM 744 OE1 GLU A 351 -14.357 -13.420 -9.057 1.00 0.00 O ATOM 745 OE2 GLU A 351 -13.500 -12.169 -10.638 1.00 0.00 O ATOM 0 H GLU A 351 -12.438 -9.642 -5.860 1.00 0.00 H new ATOM 0 HA GLU A 351 -12.146 -11.719 -7.950 1.00 0.00 H new ATOM 0 HB2 GLU A 351 -14.320 -11.505 -6.842 1.00 0.00 H new ATOM 0 HB3 GLU A 351 -14.368 -9.793 -7.216 1.00 0.00 H new ATOM 0 HG2 GLU A 351 -15.758 -11.196 -8.731 1.00 0.00 H new ATOM 0 HG3 GLU A 351 -14.571 -10.214 -9.566 1.00 0.00 H new ATOM 752 N VAL A 352 -12.266 -8.439 -8.353 1.00 0.00 N ATOM 753 CA VAL A 352 -11.752 -7.335 -9.139 1.00 0.00 C ATOM 754 C VAL A 352 -10.962 -6.366 -8.256 1.00 0.00 C ATOM 755 O VAL A 352 -11.406 -5.983 -7.169 1.00 0.00 O ATOM 756 CB VAL A 352 -12.903 -6.593 -9.861 1.00 0.00 C ATOM 757 CG1 VAL A 352 -13.976 -6.163 -8.871 1.00 0.00 C ATOM 758 CG2 VAL A 352 -12.380 -5.397 -10.645 1.00 0.00 C ATOM 0 H VAL A 352 -12.849 -8.156 -7.565 1.00 0.00 H new ATOM 0 HA VAL A 352 -11.079 -7.741 -9.894 1.00 0.00 H new ATOM 0 HB VAL A 352 -13.353 -7.287 -10.571 1.00 0.00 H new ATOM 0 HG11 VAL A 352 -14.774 -5.644 -9.402 1.00 0.00 H new ATOM 0 HG12 VAL A 352 -14.384 -7.042 -8.372 1.00 0.00 H new ATOM 0 HG13 VAL A 352 -13.539 -5.495 -8.129 1.00 0.00 H new ATOM 0 HG21 VAL A 352 -13.211 -4.896 -11.141 1.00 0.00 H new ATOM 0 HG22 VAL A 352 -11.891 -4.701 -9.964 1.00 0.00 H new ATOM 0 HG23 VAL A 352 -11.663 -5.737 -11.392 1.00 0.00 H new ATOM 768 N ASN A 353 -9.769 -6.023 -8.716 1.00 0.00 N ATOM 769 CA ASN A 353 -8.907 -5.057 -8.037 1.00 0.00 C ATOM 770 C ASN A 353 -9.530 -3.664 -8.061 1.00 0.00 C ATOM 771 O ASN A 353 -9.801 -3.112 -9.128 1.00 0.00 O ATOM 772 CB ASN A 353 -7.521 -5.028 -8.698 1.00 0.00 C ATOM 773 CG ASN A 353 -6.592 -3.986 -8.095 1.00 0.00 C ATOM 774 OD1 ASN A 353 -6.690 -3.648 -6.920 1.00 0.00 O ATOM 775 ND2 ASN A 353 -5.677 -3.472 -8.897 1.00 0.00 N ATOM 0 H ASN A 353 -9.367 -6.405 -9.572 1.00 0.00 H new ATOM 0 HA ASN A 353 -8.798 -5.366 -6.997 1.00 0.00 H new ATOM 0 HB2 ASN A 353 -7.061 -6.012 -8.606 1.00 0.00 H new ATOM 0 HB3 ASN A 353 -7.638 -4.829 -9.763 1.00 0.00 H new ATOM 0 HD21 ASN A 353 -5.025 -2.772 -8.544 1.00 0.00 H new ATOM 0 HD22 ASN A 353 -5.623 -3.775 -9.869 1.00 0.00 H new ATOM 782 N VAL A 354 -9.757 -3.107 -6.878 1.00 0.00 N ATOM 783 CA VAL A 354 -10.371 -1.791 -6.743 1.00 0.00 C ATOM 784 C VAL A 354 -9.336 -0.713 -6.459 1.00 0.00 C ATOM 785 O VAL A 354 -9.687 0.442 -6.227 1.00 0.00 O ATOM 786 CB VAL A 354 -11.425 -1.766 -5.614 1.00 0.00 C ATOM 787 CG1 VAL A 354 -12.604 -2.653 -5.969 1.00 0.00 C ATOM 788 CG2 VAL A 354 -10.814 -2.199 -4.293 1.00 0.00 C ATOM 0 H VAL A 354 -9.523 -3.551 -5.990 1.00 0.00 H new ATOM 0 HA VAL A 354 -10.856 -1.586 -7.697 1.00 0.00 H new ATOM 0 HB VAL A 354 -11.781 -0.742 -5.504 1.00 0.00 H new ATOM 0 HG11 VAL A 354 -13.337 -2.624 -5.163 1.00 0.00 H new ATOM 0 HG12 VAL A 354 -13.064 -2.296 -6.891 1.00 0.00 H new ATOM 0 HG13 VAL A 354 -12.259 -3.678 -6.109 1.00 0.00 H new ATOM 0 HG21 VAL A 354 -11.576 -2.173 -3.514 1.00 0.00 H new ATOM 0 HG22 VAL A 354 -10.425 -3.213 -4.387 1.00 0.00 H new ATOM 0 HG23 VAL A 354 -10.002 -1.522 -4.029 1.00 0.00 H new ATOM 798 N ALA A 355 -8.062 -1.083 -6.459 1.00 0.00 N ATOM 799 CA ALA A 355 -7.002 -0.133 -6.146 1.00 0.00 C ATOM 800 C ALA A 355 -6.787 0.878 -7.264 1.00 0.00 C ATOM 801 O ALA A 355 -5.969 0.671 -8.161 1.00 0.00 O ATOM 802 CB ALA A 355 -5.699 -0.857 -5.845 1.00 0.00 C ATOM 0 H ALA A 355 -7.739 -2.027 -6.671 1.00 0.00 H new ATOM 0 HA ALA A 355 -7.322 0.415 -5.259 1.00 0.00 H new ATOM 0 HB1 ALA A 355 -4.922 -0.128 -5.614 1.00 0.00 H new ATOM 0 HB2 ALA A 355 -5.840 -1.520 -4.991 1.00 0.00 H new ATOM 0 HB3 ALA A 355 -5.399 -1.443 -6.714 1.00 0.00 H new ATOM 808 N MET A 356 -7.542 1.958 -7.213 1.00 0.00 N ATOM 809 CA MET A 356 -7.309 3.101 -8.064 1.00 0.00 C ATOM 810 C MET A 356 -6.519 4.112 -7.255 1.00 0.00 C ATOM 811 O MET A 356 -7.066 4.820 -6.408 1.00 0.00 O ATOM 812 CB MET A 356 -8.644 3.675 -8.550 1.00 0.00 C ATOM 813 CG MET A 356 -8.532 5.032 -9.221 1.00 0.00 C ATOM 814 SD MET A 356 -10.132 5.677 -9.760 1.00 0.00 S ATOM 815 CE MET A 356 -10.642 4.398 -10.907 1.00 0.00 C ATOM 0 H MET A 356 -8.334 2.065 -6.579 1.00 0.00 H new ATOM 0 HA MET A 356 -6.744 2.825 -8.954 1.00 0.00 H new ATOM 0 HB2 MET A 356 -9.095 2.972 -9.251 1.00 0.00 H new ATOM 0 HB3 MET A 356 -9.322 3.757 -7.700 1.00 0.00 H new ATOM 0 HG2 MET A 356 -8.075 5.739 -8.529 1.00 0.00 H new ATOM 0 HG3 MET A 356 -7.868 4.954 -10.082 1.00 0.00 H new ATOM 0 HE1 MET A 356 -11.405 4.794 -11.577 1.00 0.00 H new ATOM 0 HE2 MET A 356 -9.782 4.069 -11.490 1.00 0.00 H new ATOM 0 HE3 MET A 356 -11.049 3.553 -10.352 1.00 0.00 H new ATOM 825 N LEU A 357 -5.225 4.149 -7.491 1.00 0.00 N ATOM 826 CA LEU A 357 -4.318 4.814 -6.583 1.00 0.00 C ATOM 827 C LEU A 357 -4.215 6.300 -6.884 1.00 0.00 C ATOM 828 O LEU A 357 -3.900 6.703 -8.002 1.00 0.00 O ATOM 829 CB LEU A 357 -2.935 4.156 -6.641 1.00 0.00 C ATOM 830 CG LEU A 357 -2.902 2.652 -6.357 1.00 0.00 C ATOM 831 CD1 LEU A 357 -1.465 2.184 -6.179 1.00 0.00 C ATOM 832 CD2 LEU A 357 -3.728 2.316 -5.128 1.00 0.00 C ATOM 0 H LEU A 357 -4.778 3.726 -8.305 1.00 0.00 H new ATOM 0 HA LEU A 357 -4.718 4.711 -5.574 1.00 0.00 H new ATOM 0 HB2 LEU A 357 -2.512 4.329 -7.630 1.00 0.00 H new ATOM 0 HB3 LEU A 357 -2.285 4.657 -5.924 1.00 0.00 H new ATOM 0 HG LEU A 357 -3.338 2.130 -7.209 1.00 0.00 H new ATOM 0 HD11 LEU A 357 -1.454 1.113 -5.977 1.00 0.00 H new ATOM 0 HD12 LEU A 357 -0.901 2.388 -7.089 1.00 0.00 H new ATOM 0 HD13 LEU A 357 -1.010 2.715 -5.343 1.00 0.00 H new ATOM 0 HD21 LEU A 357 -3.689 1.242 -4.946 1.00 0.00 H new ATOM 0 HD22 LEU A 357 -3.326 2.845 -4.264 1.00 0.00 H new ATOM 0 HD23 LEU A 357 -4.762 2.620 -5.291 1.00 0.00 H new ATOM 844 N ILE A 358 -4.520 7.110 -5.869 1.00 0.00 N ATOM 845 CA ILE A 358 -4.345 8.555 -5.949 1.00 0.00 C ATOM 846 C ILE A 358 -2.869 8.863 -6.180 1.00 0.00 C ATOM 847 O ILE A 358 -2.511 9.859 -6.809 1.00 0.00 O ATOM 848 CB ILE A 358 -4.811 9.288 -4.658 1.00 0.00 C ATOM 849 CG1 ILE A 358 -6.085 8.664 -4.061 1.00 0.00 C ATOM 850 CG2 ILE A 358 -5.051 10.760 -4.954 1.00 0.00 C ATOM 851 CD1 ILE A 358 -7.168 8.386 -5.083 1.00 0.00 C ATOM 0 H ILE A 358 -4.892 6.783 -4.977 1.00 0.00 H new ATOM 0 HA ILE A 358 -4.961 8.913 -6.774 1.00 0.00 H new ATOM 0 HB ILE A 358 -4.016 9.182 -3.920 1.00 0.00 H new ATOM 0 HG12 ILE A 358 -5.822 7.731 -3.562 1.00 0.00 H new ATOM 0 HG13 ILE A 358 -6.482 9.333 -3.298 1.00 0.00 H new ATOM 0 HG21 ILE A 358 -5.377 11.265 -4.045 1.00 0.00 H new ATOM 0 HG22 ILE A 358 -4.127 11.215 -5.311 1.00 0.00 H new ATOM 0 HG23 ILE A 358 -5.822 10.856 -5.719 1.00 0.00 H new ATOM 0 HD11 ILE A 358 -8.033 7.947 -4.586 1.00 0.00 H new ATOM 0 HD12 ILE A 358 -7.461 9.318 -5.565 1.00 0.00 H new ATOM 0 HD13 ILE A 358 -6.790 7.692 -5.834 1.00 0.00 H new ATOM 863 N THR A 359 -2.026 7.982 -5.654 1.00 0.00 N ATOM 864 CA THR A 359 -0.589 8.051 -5.844 1.00 0.00 C ATOM 865 C THR A 359 -0.050 6.652 -6.167 1.00 0.00 C ATOM 866 O THR A 359 0.166 5.829 -5.274 1.00 0.00 O ATOM 867 CB THR A 359 0.097 8.636 -4.589 1.00 0.00 C ATOM 868 OG1 THR A 359 -0.209 10.034 -4.477 1.00 0.00 O ATOM 869 CG2 THR A 359 1.605 8.442 -4.626 1.00 0.00 C ATOM 0 H THR A 359 -2.327 7.195 -5.080 1.00 0.00 H new ATOM 0 HA THR A 359 -0.367 8.714 -6.680 1.00 0.00 H new ATOM 0 HB THR A 359 -0.286 8.100 -3.720 1.00 0.00 H new ATOM 0 HG1 THR A 359 -0.042 10.333 -3.559 1.00 0.00 H new ATOM 0 HG21 THR A 359 2.049 8.867 -3.726 1.00 0.00 H new ATOM 0 HG22 THR A 359 1.834 7.377 -4.675 1.00 0.00 H new ATOM 0 HG23 THR A 359 2.015 8.942 -5.504 1.00 0.00 H new ATOM 877 N PRO A 360 0.138 6.358 -7.465 1.00 0.00 N ATOM 878 CA PRO A 360 0.527 5.033 -7.940 1.00 0.00 C ATOM 879 C PRO A 360 2.037 4.837 -8.043 1.00 0.00 C ATOM 880 O PRO A 360 2.531 4.181 -8.964 1.00 0.00 O ATOM 881 CB PRO A 360 -0.117 4.990 -9.322 1.00 0.00 C ATOM 882 CG PRO A 360 -0.075 6.405 -9.807 1.00 0.00 C ATOM 883 CD PRO A 360 -0.037 7.297 -8.586 1.00 0.00 C ATOM 0 HA PRO A 360 0.211 4.244 -7.258 1.00 0.00 H new ATOM 0 HB2 PRO A 360 0.429 4.326 -9.992 1.00 0.00 H new ATOM 0 HB3 PRO A 360 -1.141 4.620 -9.270 1.00 0.00 H new ATOM 0 HG2 PRO A 360 0.802 6.571 -10.432 1.00 0.00 H new ATOM 0 HG3 PRO A 360 -0.949 6.628 -10.419 1.00 0.00 H new ATOM 0 HD2 PRO A 360 0.784 8.012 -8.639 1.00 0.00 H new ATOM 0 HD3 PRO A 360 -0.956 7.874 -8.484 1.00 0.00 H new ATOM 891 N ASN A 361 2.762 5.406 -7.096 1.00 0.00 N ATOM 892 CA ASN A 361 4.208 5.231 -7.027 1.00 0.00 C ATOM 893 C ASN A 361 4.676 5.066 -5.583 1.00 0.00 C ATOM 894 O ASN A 361 5.445 5.887 -5.078 1.00 0.00 O ATOM 895 CB ASN A 361 4.942 6.415 -7.669 1.00 0.00 C ATOM 896 CG ASN A 361 4.801 6.464 -9.178 1.00 0.00 C ATOM 897 OD1 ASN A 361 3.864 7.062 -9.711 1.00 0.00 O ATOM 898 ND2 ASN A 361 5.740 5.848 -9.880 1.00 0.00 N ATOM 0 H ASN A 361 2.374 5.996 -6.360 1.00 0.00 H new ATOM 0 HA ASN A 361 4.447 4.324 -7.582 1.00 0.00 H new ATOM 0 HB2 ASN A 361 4.559 7.343 -7.245 1.00 0.00 H new ATOM 0 HB3 ASN A 361 6.000 6.360 -7.412 1.00 0.00 H new ATOM 0 HD21 ASN A 361 5.704 5.858 -10.899 1.00 0.00 H new ATOM 0 HD22 ASN A 361 6.500 5.364 -9.401 1.00 0.00 H new ATOM 905 N PRO A 362 4.220 4.010 -4.887 1.00 0.00 N ATOM 906 CA PRO A 362 4.662 3.729 -3.531 1.00 0.00 C ATOM 907 C PRO A 362 5.965 2.934 -3.507 1.00 0.00 C ATOM 908 O PRO A 362 6.180 2.028 -4.329 1.00 0.00 O ATOM 909 CB PRO A 362 3.519 2.897 -2.968 1.00 0.00 C ATOM 910 CG PRO A 362 2.997 2.143 -4.143 1.00 0.00 C ATOM 911 CD PRO A 362 3.238 3.010 -5.354 1.00 0.00 C ATOM 0 HA PRO A 362 4.871 4.636 -2.963 1.00 0.00 H new ATOM 0 HB2 PRO A 362 3.866 2.223 -2.185 1.00 0.00 H new ATOM 0 HB3 PRO A 362 2.748 3.528 -2.526 1.00 0.00 H new ATOM 0 HG2 PRO A 362 3.506 1.185 -4.245 1.00 0.00 H new ATOM 0 HG3 PRO A 362 1.935 1.929 -4.025 1.00 0.00 H new ATOM 0 HD2 PRO A 362 3.627 2.429 -6.190 1.00 0.00 H new ATOM 0 HD3 PRO A 362 2.318 3.484 -5.696 1.00 0.00 H new ATOM 919 N THR A 363 6.813 3.247 -2.541 1.00 0.00 N ATOM 920 CA THR A 363 8.106 2.606 -2.412 1.00 0.00 C ATOM 921 C THR A 363 8.421 2.405 -0.940 1.00 0.00 C ATOM 922 O THR A 363 8.239 3.319 -0.142 1.00 0.00 O ATOM 923 CB THR A 363 9.228 3.450 -3.056 1.00 0.00 C ATOM 924 OG1 THR A 363 9.121 4.819 -2.631 1.00 0.00 O ATOM 925 CG2 THR A 363 9.181 3.375 -4.577 1.00 0.00 C ATOM 0 H THR A 363 6.623 3.951 -1.828 1.00 0.00 H new ATOM 0 HA THR A 363 8.060 1.648 -2.930 1.00 0.00 H new ATOM 0 HB THR A 363 10.183 3.040 -2.728 1.00 0.00 H new ATOM 0 HG1 THR A 363 8.822 4.850 -1.698 1.00 0.00 H new ATOM 0 HG21 THR A 363 9.985 3.981 -4.996 1.00 0.00 H new ATOM 0 HG22 THR A 363 9.304 2.339 -4.894 1.00 0.00 H new ATOM 0 HG23 THR A 363 8.221 3.751 -4.930 1.00 0.00 H new ATOM 933 N MET A 364 8.886 1.224 -0.577 1.00 0.00 N ATOM 934 CA MET A 364 9.273 1.012 0.802 1.00 0.00 C ATOM 935 C MET A 364 10.742 1.246 0.892 1.00 0.00 C ATOM 936 O MET A 364 11.528 0.652 0.154 1.00 0.00 O ATOM 937 CB MET A 364 8.871 -0.349 1.398 1.00 0.00 C ATOM 938 CG MET A 364 9.780 -1.512 1.051 1.00 0.00 C ATOM 939 SD MET A 364 9.088 -3.095 1.571 1.00 0.00 S ATOM 940 CE MET A 364 10.476 -4.179 1.286 1.00 0.00 C ATOM 0 H MET A 364 9.002 0.421 -1.196 1.00 0.00 H new ATOM 0 HA MET A 364 8.716 1.719 1.417 1.00 0.00 H new ATOM 0 HB2 MET A 364 8.832 -0.253 2.483 1.00 0.00 H new ATOM 0 HB3 MET A 364 7.862 -0.588 1.063 1.00 0.00 H new ATOM 0 HG2 MET A 364 9.952 -1.528 -0.025 1.00 0.00 H new ATOM 0 HG3 MET A 364 10.750 -1.367 1.527 1.00 0.00 H new ATOM 0 HE1 MET A 364 10.120 -5.128 0.884 1.00 0.00 H new ATOM 0 HE2 MET A 364 11.159 -3.716 0.574 1.00 0.00 H new ATOM 0 HE3 MET A 364 10.998 -4.357 2.226 1.00 0.00 H new ATOM 993 N GLY A 368 10.327 2.282 5.681 1.00 0.00 N ATOM 994 CA GLY A 368 9.116 1.545 5.354 1.00 0.00 C ATOM 995 C GLY A 368 8.464 2.124 4.114 1.00 0.00 C ATOM 996 O GLY A 368 8.965 3.111 3.574 1.00 0.00 O ATOM 0 HA2 GLY A 368 9.355 0.494 5.190 1.00 0.00 H new ATOM 0 HA3 GLY A 368 8.420 1.586 6.192 1.00 0.00 H new ATOM 1000 N GLY A 369 7.396 1.490 3.625 1.00 0.00 N ATOM 1001 CA GLY A 369 6.635 2.041 2.504 1.00 0.00 C ATOM 1002 C GLY A 369 6.210 3.477 2.708 1.00 0.00 C ATOM 1003 O GLY A 369 6.251 4.281 1.777 1.00 0.00 O ATOM 0 H GLY A 369 7.042 0.603 3.984 1.00 0.00 H new ATOM 0 HA2 GLY A 369 7.238 1.975 1.599 1.00 0.00 H new ATOM 0 HA3 GLY A 369 5.748 1.428 2.342 1.00 0.00 H new ATOM 1007 N GLY A 370 5.789 3.800 3.916 1.00 0.00 N ATOM 1008 CA GLY A 370 5.338 5.138 4.193 1.00 0.00 C ATOM 1009 C GLY A 370 3.896 5.333 3.788 1.00 0.00 C ATOM 1010 O GLY A 370 3.033 4.539 4.152 1.00 0.00 O ATOM 0 H GLY A 370 5.752 3.159 4.708 1.00 0.00 H new ATOM 0 HA2 GLY A 370 5.449 5.347 5.257 1.00 0.00 H new ATOM 0 HA3 GLY A 370 5.966 5.852 3.660 1.00 0.00 H new ATOM 1014 N PHE A 371 3.647 6.356 2.996 1.00 0.00 N ATOM 1015 CA PHE A 371 2.282 6.733 2.660 1.00 0.00 C ATOM 1016 C PHE A 371 1.887 6.264 1.267 1.00 0.00 C ATOM 1017 O PHE A 371 2.677 6.320 0.323 1.00 0.00 O ATOM 1018 CB PHE A 371 2.089 8.250 2.768 1.00 0.00 C ATOM 1019 CG PHE A 371 2.945 9.059 1.827 1.00 0.00 C ATOM 1020 CD1 PHE A 371 4.270 9.333 2.127 1.00 0.00 C ATOM 1021 CD2 PHE A 371 2.417 9.547 0.641 1.00 0.00 C ATOM 1022 CE1 PHE A 371 5.052 10.073 1.261 1.00 0.00 C ATOM 1023 CE2 PHE A 371 3.195 10.288 -0.228 1.00 0.00 C ATOM 1024 CZ PHE A 371 4.514 10.552 0.083 1.00 0.00 C ATOM 0 H PHE A 371 4.367 6.942 2.572 1.00 0.00 H new ATOM 0 HA PHE A 371 1.633 6.237 3.381 1.00 0.00 H new ATOM 0 HB2 PHE A 371 1.042 8.484 2.578 1.00 0.00 H new ATOM 0 HB3 PHE A 371 2.304 8.559 3.791 1.00 0.00 H new ATOM 0 HD1 PHE A 371 4.696 8.964 3.048 1.00 0.00 H new ATOM 0 HD2 PHE A 371 1.385 9.345 0.394 1.00 0.00 H new ATOM 0 HE1 PHE A 371 6.084 10.277 1.505 1.00 0.00 H new ATOM 0 HE2 PHE A 371 2.772 10.660 -1.149 1.00 0.00 H new ATOM 0 HZ PHE A 371 5.124 11.132 -0.594 1.00 0.00 H new ATOM 1034 N ILE A 372 0.657 5.786 1.158 1.00 0.00 N ATOM 1035 CA ILE A 372 0.095 5.382 -0.118 1.00 0.00 C ATOM 1036 C ILE A 372 -1.285 5.995 -0.269 1.00 0.00 C ATOM 1037 O ILE A 372 -1.934 6.302 0.731 1.00 0.00 O ATOM 1038 CB ILE A 372 -0.033 3.853 -0.234 1.00 0.00 C ATOM 1039 CG1 ILE A 372 0.873 3.157 0.779 1.00 0.00 C ATOM 1040 CG2 ILE A 372 0.315 3.417 -1.645 1.00 0.00 C ATOM 1041 CD1 ILE A 372 0.737 1.654 0.775 1.00 0.00 C ATOM 0 H ILE A 372 0.024 5.668 1.949 1.00 0.00 H new ATOM 0 HA ILE A 372 0.769 5.729 -0.902 1.00 0.00 H new ATOM 0 HB ILE A 372 -1.063 3.568 -0.017 1.00 0.00 H new ATOM 0 HG12 ILE A 372 1.910 3.421 0.569 1.00 0.00 H new ATOM 0 HG13 ILE A 372 0.645 3.532 1.777 1.00 0.00 H new ATOM 0 HG21 ILE A 372 0.223 2.334 -1.724 1.00 0.00 H new ATOM 0 HG22 ILE A 372 -0.367 3.891 -2.351 1.00 0.00 H new ATOM 0 HG23 ILE A 372 1.339 3.712 -1.875 1.00 0.00 H new ATOM 0 HD11 ILE A 372 1.409 1.226 1.519 1.00 0.00 H new ATOM 0 HD12 ILE A 372 -0.291 1.381 1.015 1.00 0.00 H new ATOM 0 HD13 ILE A 372 0.994 1.268 -0.211 1.00 0.00 H new ATOM 1053 N GLU A 373 -1.739 6.167 -1.502 1.00 0.00 N ATOM 1054 CA GLU A 373 -3.032 6.786 -1.740 1.00 0.00 C ATOM 1055 C GLU A 373 -3.830 5.979 -2.757 1.00 0.00 C ATOM 1056 O GLU A 373 -3.329 5.647 -3.828 1.00 0.00 O ATOM 1057 CB GLU A 373 -2.847 8.228 -2.204 1.00 0.00 C ATOM 1058 CG GLU A 373 -2.081 9.081 -1.206 1.00 0.00 C ATOM 1059 CD GLU A 373 -1.938 10.521 -1.639 1.00 0.00 C ATOM 1060 OE1 GLU A 373 -2.917 11.277 -1.517 1.00 0.00 O ATOM 1061 OE2 GLU A 373 -0.841 10.907 -2.097 1.00 0.00 O ATOM 0 H GLU A 373 -1.236 5.889 -2.345 1.00 0.00 H new ATOM 0 HA GLU A 373 -3.595 6.798 -0.807 1.00 0.00 H new ATOM 0 HB2 GLU A 373 -2.319 8.232 -3.157 1.00 0.00 H new ATOM 0 HB3 GLU A 373 -3.825 8.675 -2.380 1.00 0.00 H new ATOM 0 HG2 GLU A 373 -2.590 9.047 -0.243 1.00 0.00 H new ATOM 0 HG3 GLU A 373 -1.090 8.653 -1.058 1.00 0.00 H new ATOM 1068 N MET A 374 -5.059 5.653 -2.389 1.00 0.00 N ATOM 1069 CA MET A 374 -5.925 4.778 -3.171 1.00 0.00 C ATOM 1070 C MET A 374 -7.380 5.185 -3.003 1.00 0.00 C ATOM 1071 O MET A 374 -7.700 5.956 -2.109 1.00 0.00 O ATOM 1072 CB MET A 374 -5.747 3.325 -2.706 1.00 0.00 C ATOM 1073 CG MET A 374 -5.816 3.156 -1.199 1.00 0.00 C ATOM 1074 SD MET A 374 -4.278 3.606 -0.367 1.00 0.00 S ATOM 1075 CE MET A 374 -3.149 2.416 -1.087 1.00 0.00 C ATOM 0 H MET A 374 -5.490 5.991 -1.529 1.00 0.00 H new ATOM 0 HA MET A 374 -5.651 4.865 -4.222 1.00 0.00 H new ATOM 0 HB2 MET A 374 -6.517 2.708 -3.168 1.00 0.00 H new ATOM 0 HB3 MET A 374 -4.786 2.954 -3.061 1.00 0.00 H new ATOM 0 HG2 MET A 374 -6.627 3.769 -0.807 1.00 0.00 H new ATOM 0 HG3 MET A 374 -6.059 2.119 -0.966 1.00 0.00 H new ATOM 0 HE1 MET A 374 -2.517 1.995 -0.305 1.00 0.00 H new ATOM 0 HE2 MET A 374 -3.717 1.617 -1.563 1.00 0.00 H new ATOM 0 HE3 MET A 374 -2.525 2.911 -1.831 1.00 0.00 H new ATOM 1085 N GLN A 375 -8.250 4.674 -3.869 1.00 0.00 N ATOM 1086 CA GLN A 375 -9.687 4.913 -3.766 1.00 0.00 C ATOM 1087 C GLN A 375 -10.418 4.205 -4.908 1.00 0.00 C ATOM 1088 O GLN A 375 -9.794 3.598 -5.775 1.00 0.00 O ATOM 1089 CB GLN A 375 -9.988 6.429 -3.740 1.00 0.00 C ATOM 1090 CG GLN A 375 -11.446 6.858 -3.481 1.00 0.00 C ATOM 1091 CD GLN A 375 -12.168 6.156 -2.319 1.00 0.00 C ATOM 1092 OE1 GLN A 375 -12.953 6.785 -1.616 1.00 0.00 O ATOM 1093 NE2 GLN A 375 -11.956 4.852 -2.137 1.00 0.00 N ATOM 0 H GLN A 375 -7.982 4.086 -4.658 1.00 0.00 H new ATOM 0 HA GLN A 375 -10.052 4.497 -2.827 1.00 0.00 H new ATOM 0 HB2 GLN A 375 -9.362 6.884 -2.973 1.00 0.00 H new ATOM 0 HB3 GLN A 375 -9.677 6.851 -4.696 1.00 0.00 H new ATOM 0 HG2 GLN A 375 -11.458 7.931 -3.292 1.00 0.00 H new ATOM 0 HG3 GLN A 375 -12.019 6.688 -4.392 1.00 0.00 H new ATOM 0 HE21 GLN A 375 -11.298 4.354 -2.736 1.00 0.00 H new ATOM 0 HE22 GLN A 375 -12.452 4.353 -1.399 1.00 0.00 H new ATOM 1102 N LEU A 376 -11.736 4.268 -4.858 1.00 0.00 N ATOM 1103 CA LEU A 376 -12.629 3.618 -5.790 1.00 0.00 C ATOM 1104 C LEU A 376 -13.989 4.258 -5.521 1.00 0.00 C ATOM 1105 O LEU A 376 -14.243 4.623 -4.374 1.00 0.00 O ATOM 1106 CB LEU A 376 -12.640 2.099 -5.512 1.00 0.00 C ATOM 1107 CG LEU A 376 -13.147 1.177 -6.634 1.00 0.00 C ATOM 1108 CD1 LEU A 376 -14.664 1.214 -6.747 1.00 0.00 C ATOM 1109 CD2 LEU A 376 -12.500 1.542 -7.962 1.00 0.00 C ATOM 0 H LEU A 376 -12.230 4.795 -4.137 1.00 0.00 H new ATOM 0 HA LEU A 376 -12.337 3.738 -6.833 1.00 0.00 H new ATOM 0 HB2 LEU A 376 -11.624 1.795 -5.260 1.00 0.00 H new ATOM 0 HB3 LEU A 376 -13.254 1.923 -4.628 1.00 0.00 H new ATOM 0 HG LEU A 376 -12.861 0.157 -6.377 1.00 0.00 H new ATOM 0 HD11 LEU A 376 -14.985 0.551 -7.550 1.00 0.00 H new ATOM 0 HD12 LEU A 376 -15.107 0.886 -5.806 1.00 0.00 H new ATOM 0 HD13 LEU A 376 -14.988 2.232 -6.966 1.00 0.00 H new ATOM 0 HD21 LEU A 376 -12.872 0.878 -8.743 1.00 0.00 H new ATOM 0 HD22 LEU A 376 -12.746 2.573 -8.215 1.00 0.00 H new ATOM 0 HD23 LEU A 376 -11.418 1.436 -7.881 1.00 0.00 H new ATOM 1121 N PRO A 377 -14.831 4.499 -6.546 1.00 0.00 N ATOM 1122 CA PRO A 377 -16.197 5.003 -6.346 1.00 0.00 C ATOM 1123 C PRO A 377 -16.864 4.421 -5.091 1.00 0.00 C ATOM 1124 O PRO A 377 -16.808 3.210 -4.868 1.00 0.00 O ATOM 1125 CB PRO A 377 -16.896 4.528 -7.615 1.00 0.00 C ATOM 1126 CG PRO A 377 -15.841 4.595 -8.669 1.00 0.00 C ATOM 1127 CD PRO A 377 -14.519 4.341 -7.979 1.00 0.00 C ATOM 0 HA PRO A 377 -16.235 6.081 -6.188 1.00 0.00 H new ATOM 0 HB2 PRO A 377 -17.280 3.514 -7.501 1.00 0.00 H new ATOM 0 HB3 PRO A 377 -17.746 5.165 -7.862 1.00 0.00 H new ATOM 0 HG2 PRO A 377 -16.022 3.851 -9.445 1.00 0.00 H new ATOM 0 HG3 PRO A 377 -15.842 5.570 -9.156 1.00 0.00 H new ATOM 0 HD2 PRO A 377 -14.139 3.343 -8.198 1.00 0.00 H new ATOM 0 HD3 PRO A 377 -13.757 5.050 -8.303 1.00 0.00 H new ATOM 1135 N PRO A 378 -17.520 5.300 -4.279 1.00 0.00 N ATOM 1136 CA PRO A 378 -18.084 4.968 -2.962 1.00 0.00 C ATOM 1137 C PRO A 378 -18.626 3.551 -2.855 1.00 0.00 C ATOM 1138 O PRO A 378 -19.354 3.076 -3.735 1.00 0.00 O ATOM 1139 CB PRO A 378 -19.218 5.978 -2.836 1.00 0.00 C ATOM 1140 CG PRO A 378 -18.727 7.192 -3.553 1.00 0.00 C ATOM 1141 CD PRO A 378 -17.707 6.731 -4.571 1.00 0.00 C ATOM 0 HA PRO A 378 -17.327 5.013 -2.179 1.00 0.00 H new ATOM 0 HB2 PRO A 378 -20.137 5.599 -3.283 1.00 0.00 H new ATOM 0 HB3 PRO A 378 -19.438 6.197 -1.791 1.00 0.00 H new ATOM 0 HG2 PRO A 378 -19.552 7.709 -4.043 1.00 0.00 H new ATOM 0 HG3 PRO A 378 -18.279 7.897 -2.853 1.00 0.00 H new ATOM 0 HD2 PRO A 378 -18.064 6.886 -5.589 1.00 0.00 H new ATOM 0 HD3 PRO A 378 -16.772 7.282 -4.474 1.00 0.00 H new ATOM 1149 N GLY A 379 -18.303 2.901 -1.745 1.00 0.00 N ATOM 1150 CA GLY A 379 -18.485 1.477 -1.622 1.00 0.00 C ATOM 1151 C GLY A 379 -17.497 0.906 -0.625 1.00 0.00 C ATOM 1152 O GLY A 379 -16.831 1.656 0.094 1.00 0.00 O ATOM 0 H GLY A 379 -17.912 3.349 -0.916 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -19.504 1.260 -1.300 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -18.349 1.001 -2.593 1.00 0.00 H new ATOM 1156 N ASP A 380 -17.386 -0.406 -0.574 1.00 0.00 N ATOM 1157 CA ASP A 380 -16.454 -1.053 0.338 1.00 0.00 C ATOM 1158 C ASP A 380 -15.210 -1.507 -0.400 1.00 0.00 C ATOM 1159 O ASP A 380 -15.297 -2.171 -1.434 1.00 0.00 O ATOM 1160 CB ASP A 380 -17.105 -2.255 1.006 1.00 0.00 C ATOM 1161 CG ASP A 380 -17.882 -1.905 2.257 1.00 0.00 C ATOM 1162 OD1 ASP A 380 -18.864 -1.139 2.171 1.00 0.00 O ATOM 1163 OD2 ASP A 380 -17.529 -2.434 3.333 1.00 0.00 O ATOM 0 H ASP A 380 -17.928 -1.048 -1.152 1.00 0.00 H new ATOM 0 HA ASP A 380 -16.174 -0.325 1.099 1.00 0.00 H new ATOM 0 HB2 ASP A 380 -17.776 -2.737 0.294 1.00 0.00 H new ATOM 0 HB3 ASP A 380 -16.333 -2.982 1.259 1.00 0.00 H new ATOM 1168 N ASN A 381 -14.051 -1.173 0.140 1.00 0.00 N ATOM 1169 CA ASN A 381 -12.796 -1.569 -0.469 1.00 0.00 C ATOM 1170 C ASN A 381 -11.841 -2.063 0.618 1.00 0.00 C ATOM 1171 O ASN A 381 -12.140 -1.958 1.801 1.00 0.00 O ATOM 1172 CB ASN A 381 -12.188 -0.395 -1.245 1.00 0.00 C ATOM 1173 CG ASN A 381 -13.128 0.156 -2.303 1.00 0.00 C ATOM 1174 OD1 ASN A 381 -13.063 -0.226 -3.464 1.00 0.00 O ATOM 1175 ND2 ASN A 381 -14.035 1.029 -1.897 1.00 0.00 N ATOM 0 H ASN A 381 -13.954 -0.629 0.998 1.00 0.00 H new ATOM 0 HA ASN A 381 -12.972 -2.379 -1.176 1.00 0.00 H new ATOM 0 HB2 ASN A 381 -11.927 0.400 -0.547 1.00 0.00 H new ATOM 0 HB3 ASN A 381 -11.262 -0.719 -1.720 1.00 0.00 H new ATOM 0 HD21 ASN A 381 -14.711 1.407 -2.560 1.00 0.00 H new ATOM 0 HD22 ASN A 381 -14.058 1.324 -0.921 1.00 0.00 H new ATOM 1182 N ILE A 382 -10.728 -2.652 0.224 1.00 0.00 N ATOM 1183 CA ILE A 382 -9.673 -3.029 1.167 1.00 0.00 C ATOM 1184 C ILE A 382 -8.365 -3.142 0.420 1.00 0.00 C ATOM 1185 O ILE A 382 -8.351 -3.601 -0.714 1.00 0.00 O ATOM 1186 CB ILE A 382 -10.003 -4.357 1.917 1.00 0.00 C ATOM 1187 CG1 ILE A 382 -8.747 -5.109 2.392 1.00 0.00 C ATOM 1188 CG2 ILE A 382 -10.806 -5.260 1.038 1.00 0.00 C ATOM 1189 CD1 ILE A 382 -8.126 -5.984 1.327 1.00 0.00 C ATOM 0 H ILE A 382 -10.523 -2.884 -0.748 1.00 0.00 H new ATOM 0 HA ILE A 382 -9.596 -2.254 1.930 1.00 0.00 H new ATOM 0 HB ILE A 382 -10.574 -4.075 2.802 1.00 0.00 H new ATOM 0 HG12 ILE A 382 -8.007 -4.385 2.732 1.00 0.00 H new ATOM 0 HG13 ILE A 382 -9.007 -5.727 3.252 1.00 0.00 H new ATOM 0 HG21 ILE A 382 -11.030 -6.183 1.572 1.00 0.00 H new ATOM 0 HG22 ILE A 382 -11.737 -4.765 0.762 1.00 0.00 H new ATOM 0 HG23 ILE A 382 -10.237 -5.491 0.137 1.00 0.00 H new ATOM 0 HD11 ILE A 382 -7.246 -6.482 1.733 1.00 0.00 H new ATOM 0 HD12 ILE A 382 -8.850 -6.732 1.003 1.00 0.00 H new ATOM 0 HD13 ILE A 382 -7.834 -5.369 0.476 1.00 0.00 H new ATOM 1201 N ILE A 383 -7.272 -2.754 1.052 1.00 0.00 N ATOM 1202 CA ILE A 383 -5.983 -2.770 0.378 1.00 0.00 C ATOM 1203 C ILE A 383 -5.185 -4.004 0.779 1.00 0.00 C ATOM 1204 O ILE A 383 -5.117 -4.360 1.963 1.00 0.00 O ATOM 1205 CB ILE A 383 -5.151 -1.508 0.686 1.00 0.00 C ATOM 1206 CG1 ILE A 383 -5.983 -0.249 0.458 1.00 0.00 C ATOM 1207 CG2 ILE A 383 -3.905 -1.465 -0.184 1.00 0.00 C ATOM 1208 CD1 ILE A 383 -5.422 0.954 1.171 1.00 0.00 C ATOM 0 H ILE A 383 -7.248 -2.428 2.018 1.00 0.00 H new ATOM 0 HA ILE A 383 -6.188 -2.792 -0.692 1.00 0.00 H new ATOM 0 HB ILE A 383 -4.850 -1.548 1.733 1.00 0.00 H new ATOM 0 HG12 ILE A 383 -6.035 -0.041 -0.611 1.00 0.00 H new ATOM 0 HG13 ILE A 383 -7.003 -0.426 0.799 1.00 0.00 H new ATOM 0 HG21 ILE A 383 -3.331 -0.568 0.047 1.00 0.00 H new ATOM 0 HG22 ILE A 383 -3.295 -2.347 0.011 1.00 0.00 H new ATOM 0 HG23 ILE A 383 -4.195 -1.449 -1.235 1.00 0.00 H new ATOM 0 HD11 ILE A 383 -6.053 1.821 0.974 1.00 0.00 H new ATOM 0 HD12 ILE A 383 -5.395 0.761 2.243 1.00 0.00 H new ATOM 0 HD13 ILE A 383 -4.412 1.151 0.812 1.00 0.00 H new ATOM 1220 N TYR A 384 -4.635 -4.665 -0.228 1.00 0.00 N ATOM 1221 CA TYR A 384 -3.666 -5.728 -0.043 1.00 0.00 C ATOM 1222 C TYR A 384 -2.284 -5.208 -0.388 1.00 0.00 C ATOM 1223 O TYR A 384 -1.921 -5.141 -1.566 1.00 0.00 O ATOM 1224 CB TYR A 384 -3.963 -6.931 -0.945 1.00 0.00 C ATOM 1225 CG TYR A 384 -4.955 -7.923 -0.391 1.00 0.00 C ATOM 1226 CD1 TYR A 384 -4.720 -8.568 0.813 1.00 0.00 C ATOM 1227 CD2 TYR A 384 -6.110 -8.237 -1.088 1.00 0.00 C ATOM 1228 CE1 TYR A 384 -5.613 -9.499 1.309 1.00 0.00 C ATOM 1229 CE2 TYR A 384 -7.010 -9.163 -0.597 1.00 0.00 C ATOM 1230 CZ TYR A 384 -6.757 -9.791 0.600 1.00 0.00 C ATOM 1231 OH TYR A 384 -7.649 -10.721 1.083 1.00 0.00 O ATOM 0 H TYR A 384 -4.853 -4.475 -1.206 1.00 0.00 H new ATOM 0 HA TYR A 384 -3.721 -6.049 0.997 1.00 0.00 H new ATOM 0 HB2 TYR A 384 -4.337 -6.564 -1.901 1.00 0.00 H new ATOM 0 HB3 TYR A 384 -3.027 -7.452 -1.147 1.00 0.00 H new ATOM 0 HD1 TYR A 384 -3.825 -8.340 1.372 1.00 0.00 H new ATOM 0 HD2 TYR A 384 -6.310 -7.750 -2.031 1.00 0.00 H new ATOM 0 HE1 TYR A 384 -5.415 -9.995 2.248 1.00 0.00 H new ATOM 0 HE2 TYR A 384 -7.908 -9.393 -1.151 1.00 0.00 H new ATOM 0 HH TYR A 384 -8.402 -10.806 0.461 1.00 0.00 H new ATOM 1241 N VAL A 385 -1.528 -4.809 0.617 1.00 0.00 N ATOM 1242 CA VAL A 385 -0.146 -4.425 0.402 1.00 0.00 C ATOM 1243 C VAL A 385 0.691 -5.683 0.410 1.00 0.00 C ATOM 1244 O VAL A 385 1.276 -6.055 1.428 1.00 0.00 O ATOM 1245 CB VAL A 385 0.367 -3.451 1.477 1.00 0.00 C ATOM 1246 CG1 VAL A 385 1.690 -2.837 1.052 1.00 0.00 C ATOM 1247 CG2 VAL A 385 -0.659 -2.370 1.740 1.00 0.00 C ATOM 0 H VAL A 385 -1.845 -4.742 1.584 1.00 0.00 H new ATOM 0 HA VAL A 385 -0.073 -3.905 -0.553 1.00 0.00 H new ATOM 0 HB VAL A 385 0.528 -4.008 2.400 1.00 0.00 H new ATOM 0 HG11 VAL A 385 2.038 -2.151 1.824 1.00 0.00 H new ATOM 0 HG12 VAL A 385 2.428 -3.626 0.909 1.00 0.00 H new ATOM 0 HG13 VAL A 385 1.555 -2.293 0.117 1.00 0.00 H new ATOM 0 HG21 VAL A 385 -0.282 -1.688 2.503 1.00 0.00 H new ATOM 0 HG22 VAL A 385 -0.848 -1.816 0.820 1.00 0.00 H new ATOM 0 HG23 VAL A 385 -1.587 -2.825 2.087 1.00 0.00 H new ATOM 1257 N GLY A 386 0.731 -6.341 -0.730 1.00 0.00 N ATOM 1258 CA GLY A 386 1.241 -7.680 -0.777 1.00 0.00 C ATOM 1259 C GLY A 386 0.384 -8.622 0.042 1.00 0.00 C ATOM 1260 O GLY A 386 -0.742 -8.939 -0.347 1.00 0.00 O ATOM 0 H GLY A 386 0.417 -5.967 -1.626 1.00 0.00 H new ATOM 0 HA2 GLY A 386 1.276 -8.022 -1.811 1.00 0.00 H new ATOM 0 HA3 GLY A 386 2.264 -7.696 -0.401 1.00 0.00 H new ATOM 1264 N ASP A 387 0.918 -9.074 1.170 1.00 0.00 N ATOM 1265 CA ASP A 387 0.177 -9.950 2.066 1.00 0.00 C ATOM 1266 C ASP A 387 -0.536 -9.144 3.149 1.00 0.00 C ATOM 1267 O ASP A 387 -1.384 -9.673 3.869 1.00 0.00 O ATOM 1268 CB ASP A 387 1.114 -10.982 2.700 1.00 0.00 C ATOM 1269 CG ASP A 387 0.371 -12.191 3.227 1.00 0.00 C ATOM 1270 OD1 ASP A 387 0.020 -13.074 2.414 1.00 0.00 O ATOM 1271 OD2 ASP A 387 0.145 -12.276 4.450 1.00 0.00 O ATOM 0 H ASP A 387 1.861 -8.848 1.485 1.00 0.00 H new ATOM 0 HA ASP A 387 -0.577 -10.476 1.480 1.00 0.00 H new ATOM 0 HB2 ASP A 387 1.848 -11.304 1.961 1.00 0.00 H new ATOM 0 HB3 ASP A 387 1.666 -10.515 3.515 1.00 0.00 H new ATOM 1276 N LEU A 388 -0.198 -7.861 3.261 1.00 0.00 N ATOM 1277 CA LEU A 388 -0.899 -6.984 4.190 1.00 0.00 C ATOM 1278 C LEU A 388 -2.314 -6.767 3.681 1.00 0.00 C ATOM 1279 O LEU A 388 -2.558 -6.804 2.477 1.00 0.00 O ATOM 1280 CB LEU A 388 -0.197 -5.629 4.321 1.00 0.00 C ATOM 1281 CG LEU A 388 0.256 -5.225 5.733 1.00 0.00 C ATOM 1282 CD1 LEU A 388 1.322 -6.165 6.259 1.00 0.00 C ATOM 1283 CD2 LEU A 388 0.780 -3.808 5.717 1.00 0.00 C ATOM 0 H LEU A 388 0.547 -7.412 2.727 1.00 0.00 H new ATOM 0 HA LEU A 388 -0.908 -7.456 5.173 1.00 0.00 H new ATOM 0 HB2 LEU A 388 0.678 -5.634 3.670 1.00 0.00 H new ATOM 0 HB3 LEU A 388 -0.870 -4.858 3.945 1.00 0.00 H new ATOM 0 HG LEU A 388 -0.606 -5.287 6.397 1.00 0.00 H new ATOM 0 HD11 LEU A 388 1.621 -5.852 7.259 1.00 0.00 H new ATOM 0 HD12 LEU A 388 0.925 -7.179 6.299 1.00 0.00 H new ATOM 0 HD13 LEU A 388 2.188 -6.140 5.597 1.00 0.00 H new ATOM 0 HD21 LEU A 388 1.100 -3.527 6.720 1.00 0.00 H new ATOM 0 HD22 LEU A 388 1.627 -3.741 5.034 1.00 0.00 H new ATOM 0 HD23 LEU A 388 -0.008 -3.132 5.385 1.00 0.00 H new ATOM 1295 N ASN A 389 -3.238 -6.530 4.586 1.00 0.00 N ATOM 1296 CA ASN A 389 -4.630 -6.347 4.207 1.00 0.00 C ATOM 1297 C ASN A 389 -5.363 -5.556 5.259 1.00 0.00 C ATOM 1298 O ASN A 389 -4.987 -5.577 6.428 1.00 0.00 O ATOM 1299 CB ASN A 389 -5.337 -7.694 4.007 1.00 0.00 C ATOM 1300 CG ASN A 389 -5.415 -8.523 5.277 1.00 0.00 C ATOM 1301 OD1 ASN A 389 -6.393 -8.447 6.022 1.00 0.00 O ATOM 1302 ND2 ASN A 389 -4.389 -9.319 5.533 1.00 0.00 N ATOM 0 H ASN A 389 -3.056 -6.459 5.587 1.00 0.00 H new ATOM 0 HA ASN A 389 -4.641 -5.802 3.263 1.00 0.00 H new ATOM 0 HB2 ASN A 389 -6.346 -7.516 3.635 1.00 0.00 H new ATOM 0 HB3 ASN A 389 -4.810 -8.263 3.241 1.00 0.00 H new ATOM 0 HD21 ASN A 389 -4.390 -9.898 6.373 1.00 0.00 H new ATOM 0 HD22 ASN A 389 -3.597 -9.353 4.891 1.00 0.00 H new ATOM 1309 N HIS A 390 -6.396 -4.849 4.842 1.00 0.00 N ATOM 1310 CA HIS A 390 -7.286 -4.193 5.786 1.00 0.00 C ATOM 1311 C HIS A 390 -8.465 -3.573 5.061 1.00 0.00 C ATOM 1312 O HIS A 390 -8.293 -2.700 4.208 1.00 0.00 O ATOM 1313 CB HIS A 390 -6.570 -3.140 6.623 1.00 0.00 C ATOM 1314 CG HIS A 390 -7.168 -3.014 7.989 1.00 0.00 C ATOM 1315 ND1 HIS A 390 -8.093 -2.050 8.331 1.00 0.00 N ATOM 1316 CD2 HIS A 390 -6.982 -3.763 9.100 1.00 0.00 C ATOM 1317 CE1 HIS A 390 -8.448 -2.216 9.591 1.00 0.00 C ATOM 1318 NE2 HIS A 390 -7.789 -3.247 10.079 1.00 0.00 N ATOM 0 H HIS A 390 -6.640 -4.713 3.861 1.00 0.00 H new ATOM 0 HA HIS A 390 -7.647 -4.961 6.470 1.00 0.00 H new ATOM 0 HB2 HIS A 390 -5.515 -3.401 6.711 1.00 0.00 H new ATOM 0 HB3 HIS A 390 -6.619 -2.177 6.115 1.00 0.00 H new ATOM 0 HD2 HIS A 390 -6.320 -4.611 9.197 1.00 0.00 H new ATOM 0 HE1 HIS A 390 -9.159 -1.609 10.131 1.00 0.00 H new ATOM 0 HE2 HIS A 390 -7.867 -3.603 11.032 1.00 0.00 H new ATOM 1327 N GLN A 391 -9.650 -4.076 5.366 1.00 0.00 N ATOM 1328 CA GLN A 391 -10.875 -3.605 4.757 1.00 0.00 C ATOM 1329 C GLN A 391 -11.352 -2.309 5.397 1.00 0.00 C ATOM 1330 O GLN A 391 -11.040 -2.015 6.554 1.00 0.00 O ATOM 1331 CB GLN A 391 -11.952 -4.683 4.875 1.00 0.00 C ATOM 1332 CG GLN A 391 -13.146 -4.473 3.961 1.00 0.00 C ATOM 1333 CD GLN A 391 -14.265 -5.441 4.265 1.00 0.00 C ATOM 1334 OE1 GLN A 391 -14.318 -6.542 3.719 1.00 0.00 O ATOM 1335 NE2 GLN A 391 -15.170 -5.041 5.137 1.00 0.00 N ATOM 0 H GLN A 391 -9.786 -4.825 6.045 1.00 0.00 H new ATOM 0 HA GLN A 391 -10.679 -3.399 3.705 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -11.506 -5.652 4.654 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -12.301 -4.721 5.907 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -13.510 -3.451 4.069 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -12.834 -4.593 2.923 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -15.091 -4.120 5.568 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -15.949 -5.653 5.380 1.00 0.00 H new ATOM 1344 N TRP A 392 -12.107 -1.549 4.622 1.00 0.00 N ATOM 1345 CA TRP A 392 -12.658 -0.285 5.058 1.00 0.00 C ATOM 1346 C TRP A 392 -13.772 0.108 4.096 1.00 0.00 C ATOM 1347 O TRP A 392 -13.767 -0.291 2.932 1.00 0.00 O ATOM 1348 CB TRP A 392 -11.574 0.805 5.122 1.00 0.00 C ATOM 1349 CG TRP A 392 -11.460 1.641 3.880 1.00 0.00 C ATOM 1350 CD1 TRP A 392 -12.017 2.869 3.677 1.00 0.00 C ATOM 1351 CD2 TRP A 392 -10.747 1.321 2.679 1.00 0.00 C ATOM 1352 NE1 TRP A 392 -11.704 3.326 2.424 1.00 0.00 N ATOM 1353 CE2 TRP A 392 -10.923 2.395 1.792 1.00 0.00 C ATOM 1354 CE3 TRP A 392 -9.978 0.233 2.266 1.00 0.00 C ATOM 1355 CZ2 TRP A 392 -10.360 2.412 0.519 1.00 0.00 C ATOM 1356 CZ3 TRP A 392 -9.417 0.254 1.004 1.00 0.00 C ATOM 1357 CH2 TRP A 392 -9.610 1.337 0.144 1.00 0.00 C ATOM 0 H TRP A 392 -12.355 -1.798 3.664 1.00 0.00 H new ATOM 0 HA TRP A 392 -13.059 -0.389 6.066 1.00 0.00 H new ATOM 0 HB2 TRP A 392 -11.784 1.460 5.968 1.00 0.00 H new ATOM 0 HB3 TRP A 392 -10.611 0.332 5.316 1.00 0.00 H new ATOM 0 HD1 TRP A 392 -12.617 3.403 4.399 1.00 0.00 H new ATOM 0 HE1 TRP A 392 -12.004 4.216 2.026 1.00 0.00 H new ATOM 0 HE3 TRP A 392 -9.824 -0.611 2.922 1.00 0.00 H new ATOM 0 HZ2 TRP A 392 -10.512 3.248 -0.148 1.00 0.00 H new ATOM 0 HZ3 TRP A 392 -8.818 -0.583 0.676 1.00 0.00 H new ATOM 0 HH2 TRP A 392 -9.157 1.323 -0.836 1.00 0.00 H new ATOM 1368 N PHE A 393 -14.737 0.863 4.564 1.00 0.00 N ATOM 1369 CA PHE A 393 -15.800 1.305 3.695 1.00 0.00 C ATOM 1370 C PHE A 393 -15.662 2.800 3.476 1.00 0.00 C ATOM 1371 O PHE A 393 -15.566 3.570 4.435 1.00 0.00 O ATOM 1372 CB PHE A 393 -17.174 0.944 4.273 1.00 0.00 C ATOM 1373 CG PHE A 393 -17.460 1.501 5.643 1.00 0.00 C ATOM 1374 CD1 PHE A 393 -17.025 0.841 6.783 1.00 0.00 C ATOM 1375 CD2 PHE A 393 -18.178 2.676 5.789 1.00 0.00 C ATOM 1376 CE1 PHE A 393 -17.295 1.348 8.038 1.00 0.00 C ATOM 1377 CE2 PHE A 393 -18.451 3.186 7.042 1.00 0.00 C ATOM 1378 CZ PHE A 393 -18.011 2.519 8.168 1.00 0.00 C ATOM 0 H PHE A 393 -14.808 1.181 5.531 1.00 0.00 H new ATOM 0 HA PHE A 393 -15.722 0.795 2.735 1.00 0.00 H new ATOM 0 HB2 PHE A 393 -17.943 1.298 3.587 1.00 0.00 H new ATOM 0 HB3 PHE A 393 -17.259 -0.142 4.315 1.00 0.00 H new ATOM 0 HD1 PHE A 393 -16.469 -0.080 6.687 1.00 0.00 H new ATOM 0 HD2 PHE A 393 -18.529 3.200 4.912 1.00 0.00 H new ATOM 0 HE1 PHE A 393 -16.946 0.828 8.918 1.00 0.00 H new ATOM 0 HE2 PHE A 393 -19.008 4.106 7.142 1.00 0.00 H new ATOM 0 HZ PHE A 393 -18.227 2.914 9.150 1.00 0.00 H new ATOM 1388 N GLN A 394 -15.606 3.222 2.224 1.00 0.00 N ATOM 1389 CA GLN A 394 -15.439 4.628 1.924 1.00 0.00 C ATOM 1390 C GLN A 394 -16.767 5.203 1.463 1.00 0.00 C ATOM 1391 O GLN A 394 -17.357 4.749 0.482 1.00 0.00 O ATOM 1392 CB GLN A 394 -14.307 4.888 0.911 1.00 0.00 C ATOM 1393 CG GLN A 394 -14.174 3.891 -0.238 1.00 0.00 C ATOM 1394 CD GLN A 394 -15.128 4.196 -1.363 1.00 0.00 C ATOM 1395 OE1 GLN A 394 -15.547 3.308 -2.094 1.00 0.00 O ATOM 1396 NE2 GLN A 394 -15.483 5.465 -1.492 1.00 0.00 N ATOM 0 H GLN A 394 -15.673 2.615 1.407 1.00 0.00 H new ATOM 0 HA GLN A 394 -15.130 5.141 2.835 1.00 0.00 H new ATOM 0 HB2 GLN A 394 -14.453 5.881 0.485 1.00 0.00 H new ATOM 0 HB3 GLN A 394 -13.362 4.910 1.454 1.00 0.00 H new ATOM 0 HG2 GLN A 394 -13.152 3.907 -0.615 1.00 0.00 H new ATOM 0 HG3 GLN A 394 -14.361 2.883 0.133 1.00 0.00 H new ATOM 0 HE21 GLN A 394 -15.105 6.167 -0.856 1.00 0.00 H new ATOM 0 HE22 GLN A 394 -16.135 5.740 -2.227 1.00 0.00 H new ATOM 1405 N LYS A 395 -17.236 6.184 2.202 1.00 0.00 N ATOM 1406 CA LYS A 395 -18.594 6.688 2.061 1.00 0.00 C ATOM 1407 C LYS A 395 -18.816 7.810 3.065 1.00 0.00 C ATOM 1408 O LYS A 395 -18.749 7.534 4.277 1.00 0.00 O ATOM 1409 CB LYS A 395 -19.598 5.537 2.285 1.00 0.00 C ATOM 1410 CG LYS A 395 -21.063 5.949 2.321 1.00 0.00 C ATOM 1411 CD LYS A 395 -21.543 6.173 3.747 1.00 0.00 C ATOM 1412 CE LYS A 395 -23.014 6.538 3.792 1.00 0.00 C ATOM 1413 NZ LYS A 395 -23.488 6.761 5.184 1.00 0.00 N ATOM 1414 OXT LYS A 395 -19.042 8.960 2.643 1.00 0.00 O ATOM 0 H LYS A 395 -16.689 6.659 2.920 1.00 0.00 H new ATOM 0 HA LYS A 395 -18.746 7.083 1.057 1.00 0.00 H new ATOM 0 HB2 LYS A 395 -19.464 4.801 1.492 1.00 0.00 H new ATOM 0 HB3 LYS A 395 -19.354 5.042 3.225 1.00 0.00 H new ATOM 0 HG2 LYS A 395 -21.200 6.862 1.742 1.00 0.00 H new ATOM 0 HG3 LYS A 395 -21.671 5.178 1.848 1.00 0.00 H new ATOM 0 HD2 LYS A 395 -21.374 5.270 4.334 1.00 0.00 H new ATOM 0 HD3 LYS A 395 -20.956 6.968 4.208 1.00 0.00 H new ATOM 0 HE2 LYS A 395 -23.183 7.439 3.202 1.00 0.00 H new ATOM 0 HE3 LYS A 395 -23.600 5.742 3.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 -24.498 7.008 5.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 -23.351 5.893 5.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 -22.947 7.538 5.615 1.00 0.00 H new