USER MOD reduce.3.24.130724 H: found=0, std=0, add=668, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 669 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 21 CYS SG : rot -125:sc= -1.58 USER MOD Set 1.2: A 51 TYR OH : rot 180:sc= 0.0881 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot 180:sc= -0.697 USER MOD Single : A 29 HIS : no HD1:sc= 0 X(o=0,f=-0.078) USER MOD Single : A 30 SER OG : rot 180:sc= 0.0195 USER MOD Single : A 35 GLN : amide:sc= 0.166 K(o=0.17,f=-5.5!) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -0.287 X(o=-0.29,f=-0.015) USER MOD Single : A 41 GLN : amide:sc= -0.234 K(o=-0.23,f=-0.94) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 HIS : no HD1:sc= -0.454 X(o=-0.45,f=-0.03) USER MOD Single : A 64 LYS NZ :NH3+ -137:sc= -0.342 (180deg=-1.12) USER MOD Single : A 65 ASN : amide:sc= -0.0082 X(o=-0.0082,f=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= -0.605 K(o=-0.6,f=-1.2) USER MOD Single : A 100 GLN : amide:sc=-0.000769 X(o=-0.00077,f=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 HIS : no HD1:sc= -0.0102 X(o=-0.01,f=-0.32) USER MOD Single : A 108 ASN : amide:sc= -0.319 K(o=-0.32,f=-2.7!) USER MOD Single : A 109 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 111 GLN :FLIP amide:sc= -4.15! C(o=-5.5!,f=-4.2!) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 TYR OH : rot 102:sc= 1.21 USER MOD Single : A 117 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 120 THR OG1 : rot 180:sc= -0.054 USER MOD Single : A 121 THR OG1 : rot 52:sc= 1.1 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot -72:sc= -0.59! USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 140 N VAL A 13 -59.600 -3.854 6.532 1.00 0.00 N ATOM 141 CA VAL A 13 -59.216 -2.491 6.856 1.00 0.00 C ATOM 142 C VAL A 13 -59.697 -2.152 8.268 1.00 0.00 C ATOM 143 O VAL A 13 -60.665 -2.734 8.754 1.00 0.00 O ATOM 144 CB VAL A 13 -59.755 -1.529 5.795 1.00 0.00 C ATOM 145 CG1 VAL A 13 -59.867 -0.107 6.349 1.00 0.00 C ATOM 146 CG2 VAL A 13 -58.886 -1.559 4.536 1.00 0.00 C ATOM 0 HA VAL A 13 -58.131 -2.388 6.848 1.00 0.00 H new ATOM 0 HB VAL A 13 -60.756 -1.861 5.520 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -60.252 0.556 5.574 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -60.545 -0.101 7.202 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -58.883 0.239 6.666 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -59.291 -0.867 3.798 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -57.868 -1.264 4.790 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -58.880 -2.567 4.122 1.00 0.00 H new ATOM 156 N GLU A 14 -58.998 -1.213 8.888 1.00 0.00 N ATOM 157 CA GLU A 14 -59.341 -0.790 10.235 1.00 0.00 C ATOM 158 C GLU A 14 -59.763 0.681 10.239 1.00 0.00 C ATOM 159 O GLU A 14 -59.061 1.533 9.695 1.00 0.00 O ATOM 160 CB GLU A 14 -58.177 -1.029 11.198 1.00 0.00 C ATOM 161 CG GLU A 14 -57.878 -2.523 11.337 1.00 0.00 C ATOM 162 CD GLU A 14 -57.261 -2.834 12.703 1.00 0.00 C ATOM 163 OE1 GLU A 14 -58.051 -3.098 13.635 1.00 0.00 O ATOM 164 OE2 GLU A 14 -56.014 -2.800 12.783 1.00 0.00 O ATOM 0 H GLU A 14 -58.195 -0.733 8.482 1.00 0.00 H new ATOM 0 HA GLU A 14 -60.183 -1.390 10.579 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -57.290 -0.509 10.837 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -58.417 -0.610 12.175 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -58.797 -3.095 11.210 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -57.196 -2.836 10.546 1.00 0.00 H new ATOM 171 N ILE A 15 -60.907 0.934 10.857 1.00 0.00 N ATOM 172 CA ILE A 15 -61.431 2.287 10.938 1.00 0.00 C ATOM 173 C ILE A 15 -60.726 3.034 12.072 1.00 0.00 C ATOM 174 O ILE A 15 -60.319 2.428 13.061 1.00 0.00 O ATOM 175 CB ILE A 15 -62.955 2.265 11.071 1.00 0.00 C ATOM 176 CG1 ILE A 15 -63.580 1.308 10.054 1.00 0.00 C ATOM 177 CG2 ILE A 15 -63.535 3.676 10.962 1.00 0.00 C ATOM 178 CD1 ILE A 15 -63.222 1.717 8.624 1.00 0.00 C ATOM 0 H ILE A 15 -61.486 0.225 11.307 1.00 0.00 H new ATOM 0 HA ILE A 15 -61.223 2.832 10.017 1.00 0.00 H new ATOM 0 HB ILE A 15 -63.206 1.890 12.063 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -63.232 0.293 10.243 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -64.663 1.301 10.174 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -64.620 3.632 11.060 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -63.124 4.301 11.755 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -63.275 4.102 9.993 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -63.679 1.020 7.921 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -63.593 2.724 8.430 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -62.139 1.699 8.501 1.00 0.00 H new ATOM 190 N GLY A 16 -60.603 4.341 11.889 1.00 0.00 N ATOM 191 CA GLY A 16 -59.954 5.178 12.884 1.00 0.00 C ATOM 192 C GLY A 16 -58.472 5.372 12.555 1.00 0.00 C ATOM 193 O GLY A 16 -57.896 6.415 12.861 1.00 0.00 O ATOM 0 H GLY A 16 -60.942 4.840 11.067 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -60.450 6.147 12.929 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -60.055 4.723 13.869 1.00 0.00 H new ATOM 197 N GLU A 17 -57.898 4.352 11.935 1.00 0.00 N ATOM 198 CA GLU A 17 -56.494 4.397 11.561 1.00 0.00 C ATOM 199 C GLU A 17 -56.322 5.146 10.238 1.00 0.00 C ATOM 200 O GLU A 17 -57.289 5.353 9.507 1.00 0.00 O ATOM 201 CB GLU A 17 -55.904 2.988 11.475 1.00 0.00 C ATOM 202 CG GLU A 17 -55.417 2.513 12.845 1.00 0.00 C ATOM 203 CD GLU A 17 -56.132 1.227 13.265 1.00 0.00 C ATOM 204 OE1 GLU A 17 -55.843 0.186 12.637 1.00 0.00 O ATOM 205 OE2 GLU A 17 -56.952 1.315 14.205 1.00 0.00 O ATOM 0 H GLU A 17 -58.379 3.489 11.682 1.00 0.00 H new ATOM 0 HA GLU A 17 -55.948 4.936 12.335 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -56.656 2.298 11.093 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -55.075 2.980 10.767 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -54.341 2.341 12.813 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -55.594 3.291 13.588 1.00 0.00 H new ATOM 212 N THR A 18 -55.083 5.532 9.971 1.00 0.00 N ATOM 213 CA THR A 18 -54.771 6.253 8.748 1.00 0.00 C ATOM 214 C THR A 18 -54.044 5.338 7.760 1.00 0.00 C ATOM 215 O THR A 18 -53.204 4.533 8.157 1.00 0.00 O ATOM 216 CB THR A 18 -53.967 7.499 9.127 1.00 0.00 C ATOM 217 OG1 THR A 18 -54.589 7.964 10.321 1.00 0.00 O ATOM 218 CG2 THR A 18 -54.163 8.646 8.134 1.00 0.00 C ATOM 0 H THR A 18 -54.283 5.359 10.580 1.00 0.00 H new ATOM 0 HA THR A 18 -55.678 6.576 8.236 1.00 0.00 H new ATOM 0 HB THR A 18 -52.909 7.244 9.184 1.00 0.00 H new ATOM 0 HG1 THR A 18 -54.129 8.769 10.637 1.00 0.00 H new ATOM 0 HG21 THR A 18 -53.571 9.505 8.449 1.00 0.00 H new ATOM 0 HG22 THR A 18 -53.841 8.328 7.142 1.00 0.00 H new ATOM 0 HG23 THR A 18 -55.217 8.923 8.102 1.00 0.00 H new ATOM 226 N TYR A 19 -54.395 5.494 6.492 1.00 0.00 N ATOM 227 CA TYR A 19 -53.788 4.692 5.443 1.00 0.00 C ATOM 228 C TYR A 19 -53.366 5.565 4.260 1.00 0.00 C ATOM 229 O TYR A 19 -53.804 6.708 4.140 1.00 0.00 O ATOM 230 CB TYR A 19 -54.869 3.713 4.981 1.00 0.00 C ATOM 231 CG TYR A 19 -55.268 2.681 6.037 1.00 0.00 C ATOM 232 CD1 TYR A 19 -55.878 3.090 7.205 1.00 0.00 C ATOM 233 CD2 TYR A 19 -55.017 1.341 5.822 1.00 0.00 C ATOM 234 CE1 TYR A 19 -56.253 2.119 8.200 1.00 0.00 C ATOM 235 CE2 TYR A 19 -55.392 0.370 6.817 1.00 0.00 C ATOM 236 CZ TYR A 19 -55.992 0.807 7.956 1.00 0.00 C ATOM 237 OH TYR A 19 -56.346 -0.111 8.896 1.00 0.00 O ATOM 0 H TYR A 19 -55.092 6.164 6.167 1.00 0.00 H new ATOM 0 HA TYR A 19 -52.897 4.185 5.814 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -55.754 4.277 4.687 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -54.515 3.190 4.093 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -56.074 4.139 7.373 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -54.539 1.021 4.908 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -56.731 2.426 9.119 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -55.201 -0.682 6.662 1.00 0.00 H new ATOM 0 HH TYR A 19 -56.100 -1.008 8.587 1.00 0.00 H new ATOM 247 N LEU A 20 -52.521 4.993 3.415 1.00 0.00 N ATOM 248 CA LEU A 20 -52.035 5.705 2.245 1.00 0.00 C ATOM 249 C LEU A 20 -53.048 5.559 1.108 1.00 0.00 C ATOM 250 O LEU A 20 -53.257 4.461 0.596 1.00 0.00 O ATOM 251 CB LEU A 20 -50.626 5.235 1.878 1.00 0.00 C ATOM 252 CG LEU A 20 -49.577 5.330 2.988 1.00 0.00 C ATOM 253 CD1 LEU A 20 -49.397 6.777 3.450 1.00 0.00 C ATOM 254 CD2 LEU A 20 -49.922 4.396 4.150 1.00 0.00 C ATOM 0 H LEU A 20 -52.160 4.044 3.517 1.00 0.00 H new ATOM 0 HA LEU A 20 -51.945 6.770 2.457 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -50.685 4.198 1.549 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -50.279 5.821 1.027 1.00 0.00 H new ATOM 0 HG LEU A 20 -48.620 5.000 2.583 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -48.646 6.816 4.239 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -49.072 7.390 2.609 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -50.344 7.158 3.831 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -49.161 4.483 4.925 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -50.893 4.671 4.562 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -49.959 3.367 3.791 1.00 0.00 H new ATOM 266 N CYS A 21 -53.650 6.683 0.746 1.00 0.00 N ATOM 267 CA CYS A 21 -54.636 6.693 -0.321 1.00 0.00 C ATOM 268 C CYS A 21 -53.967 7.229 -1.588 1.00 0.00 C ATOM 269 O CYS A 21 -53.267 8.240 -1.545 1.00 0.00 O ATOM 270 CB CYS A 21 -55.873 7.509 0.060 1.00 0.00 C ATOM 271 SG CYS A 21 -57.186 7.279 -1.195 1.00 0.00 S ATOM 0 H CYS A 21 -53.474 7.593 1.173 1.00 0.00 H new ATOM 0 HA CYS A 21 -54.992 5.678 -0.501 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -56.236 7.198 1.040 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -55.613 8.565 0.137 1.00 0.00 H new ATOM 0 HG CYS A 21 -57.560 8.438 -1.649 1.00 0.00 H new ATOM 277 N ARG A 22 -54.205 6.528 -2.687 1.00 0.00 N ATOM 278 CA ARG A 22 -53.634 6.920 -3.964 1.00 0.00 C ATOM 279 C ARG A 22 -54.110 8.322 -4.350 1.00 0.00 C ATOM 280 O ARG A 22 -55.283 8.651 -4.183 1.00 0.00 O ATOM 281 CB ARG A 22 -54.023 5.935 -5.068 1.00 0.00 C ATOM 282 CG ARG A 22 -53.046 6.013 -6.242 1.00 0.00 C ATOM 283 CD ARG A 22 -52.588 4.616 -6.668 1.00 0.00 C ATOM 284 NE ARG A 22 -52.224 4.618 -8.102 1.00 0.00 N ATOM 285 CZ ARG A 22 -51.581 3.616 -8.716 1.00 0.00 C ATOM 286 NH1 ARG A 22 -51.227 2.524 -8.023 1.00 0.00 N ATOM 287 NH2 ARG A 22 -51.291 3.704 -10.021 1.00 0.00 N ATOM 0 H ARG A 22 -54.786 5.690 -2.719 1.00 0.00 H new ATOM 0 HA ARG A 22 -52.549 6.917 -3.857 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -54.036 4.921 -4.668 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -55.033 6.153 -5.416 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -53.523 6.516 -7.084 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -52.181 6.613 -5.961 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -51.733 4.306 -6.068 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -53.383 3.893 -6.487 1.00 0.00 H new ATOM 0 HE ARG A 22 -52.479 5.434 -8.658 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -51.447 2.457 -7.029 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -50.737 1.760 -8.490 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -51.560 4.535 -10.548 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -50.801 2.940 -10.487 1.00 0.00 H new ATOM 376 N TRP A 28 -48.571 8.833 -3.030 1.00 0.00 N ATOM 377 CA TRP A 28 -49.693 8.475 -2.179 1.00 0.00 C ATOM 378 C TRP A 28 -49.781 9.507 -1.054 1.00 0.00 C ATOM 379 O TRP A 28 -48.814 10.217 -0.780 1.00 0.00 O ATOM 380 CB TRP A 28 -49.554 7.040 -1.665 1.00 0.00 C ATOM 381 CG TRP A 28 -49.889 5.971 -2.706 1.00 0.00 C ATOM 382 CD1 TRP A 28 -49.504 5.919 -3.989 1.00 0.00 C ATOM 383 CD2 TRP A 28 -50.697 4.793 -2.500 1.00 0.00 C ATOM 384 NE1 TRP A 28 -50.004 4.799 -4.622 1.00 0.00 N ATOM 385 CE2 TRP A 28 -50.752 4.092 -3.688 1.00 0.00 C ATOM 386 CE3 TRP A 28 -51.360 4.335 -1.348 1.00 0.00 C ATOM 387 CZ2 TRP A 28 -51.458 2.893 -3.838 1.00 0.00 C ATOM 388 CZ3 TRP A 28 -52.061 3.135 -1.515 1.00 0.00 C ATOM 389 CH2 TRP A 28 -52.126 2.417 -2.704 1.00 0.00 C ATOM 0 HA TRP A 28 -50.626 8.494 -2.742 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -48.532 6.887 -1.318 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -50.207 6.909 -0.802 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -48.881 6.660 -4.467 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -49.852 4.538 -5.596 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -51.331 4.867 -0.409 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -51.486 2.363 -4.779 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -52.589 2.739 -0.660 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -52.689 1.497 -2.752 1.00 0.00 H new ATOM 400 N HIS A 29 -50.950 9.559 -0.432 1.00 0.00 N ATOM 401 CA HIS A 29 -51.178 10.494 0.657 1.00 0.00 C ATOM 402 C HIS A 29 -51.932 9.790 1.787 1.00 0.00 C ATOM 403 O HIS A 29 -52.916 9.095 1.542 1.00 0.00 O ATOM 404 CB HIS A 29 -51.896 11.748 0.156 1.00 0.00 C ATOM 405 CG HIS A 29 -50.978 12.776 -0.462 1.00 0.00 C ATOM 406 ND1 HIS A 29 -50.028 13.468 0.269 1.00 0.00 N ATOM 407 CD2 HIS A 29 -50.873 13.220 -1.747 1.00 0.00 C ATOM 408 CE1 HIS A 29 -49.388 14.290 -0.549 1.00 0.00 C ATOM 409 NE2 HIS A 29 -49.913 14.135 -1.798 1.00 0.00 N ATOM 0 H HIS A 29 -51.750 8.969 -0.662 1.00 0.00 H new ATOM 0 HA HIS A 29 -50.222 10.831 1.059 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -52.645 11.456 -0.580 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -52.429 12.206 0.989 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -51.470 12.884 -2.582 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -48.590 14.965 -0.275 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -49.617 14.639 -2.634 1.00 0.00 H new ATOM 417 N SER A 30 -51.441 9.996 3.000 1.00 0.00 N ATOM 418 CA SER A 30 -52.056 9.390 4.169 1.00 0.00 C ATOM 419 C SER A 30 -53.451 9.980 4.391 1.00 0.00 C ATOM 420 O SER A 30 -53.625 11.197 4.367 1.00 0.00 O ATOM 421 CB SER A 30 -51.190 9.592 5.414 1.00 0.00 C ATOM 422 OG SER A 30 -49.800 9.597 5.102 1.00 0.00 O ATOM 0 H SER A 30 -50.624 10.574 3.199 1.00 0.00 H new ATOM 0 HA SER A 30 -52.145 8.318 3.992 1.00 0.00 H new ATOM 0 HB2 SER A 30 -51.457 10.534 5.893 1.00 0.00 H new ATOM 0 HB3 SER A 30 -51.397 8.799 6.133 1.00 0.00 H new ATOM 0 HG SER A 30 -49.281 9.730 5.923 1.00 0.00 H new ATOM 428 N ALA A 31 -54.408 9.089 4.603 1.00 0.00 N ATOM 429 CA ALA A 31 -55.782 9.506 4.829 1.00 0.00 C ATOM 430 C ALA A 31 -56.356 8.731 6.017 1.00 0.00 C ATOM 431 O ALA A 31 -55.862 7.659 6.361 1.00 0.00 O ATOM 432 CB ALA A 31 -56.595 9.300 3.550 1.00 0.00 C ATOM 0 H ALA A 31 -54.260 8.080 4.623 1.00 0.00 H new ATOM 0 HA ALA A 31 -55.826 10.567 5.075 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -57.625 9.613 3.719 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -56.163 9.894 2.745 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -56.577 8.246 3.273 1.00 0.00 H new ATOM 438 N GLU A 32 -57.392 9.305 6.611 1.00 0.00 N ATOM 439 CA GLU A 32 -58.039 8.681 7.753 1.00 0.00 C ATOM 440 C GLU A 32 -59.306 7.947 7.309 1.00 0.00 C ATOM 441 O GLU A 32 -60.185 8.539 6.685 1.00 0.00 O ATOM 442 CB GLU A 32 -58.356 9.715 8.836 1.00 0.00 C ATOM 443 CG GLU A 32 -59.779 10.254 8.680 1.00 0.00 C ATOM 444 CD GLU A 32 -59.995 11.492 9.553 1.00 0.00 C ATOM 445 OE1 GLU A 32 -58.997 11.943 10.155 1.00 0.00 O ATOM 446 OE2 GLU A 32 -61.154 11.959 9.599 1.00 0.00 O ATOM 0 H GLU A 32 -57.799 10.195 6.323 1.00 0.00 H new ATOM 0 HA GLU A 32 -57.351 7.952 8.182 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -58.241 9.262 9.821 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -57.643 10.538 8.778 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -59.964 10.504 7.635 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -60.497 9.481 8.955 1.00 0.00 H new ATOM 453 N VAL A 33 -59.359 6.667 7.649 1.00 0.00 N ATOM 454 CA VAL A 33 -60.504 5.845 7.293 1.00 0.00 C ATOM 455 C VAL A 33 -61.660 6.148 8.249 1.00 0.00 C ATOM 456 O VAL A 33 -61.771 5.533 9.308 1.00 0.00 O ATOM 457 CB VAL A 33 -60.105 4.368 7.286 1.00 0.00 C ATOM 458 CG1 VAL A 33 -61.294 3.482 6.908 1.00 0.00 C ATOM 459 CG2 VAL A 33 -58.920 4.125 6.349 1.00 0.00 C ATOM 0 H VAL A 33 -58.628 6.179 8.167 1.00 0.00 H new ATOM 0 HA VAL A 33 -60.845 6.080 6.285 1.00 0.00 H new ATOM 0 HB VAL A 33 -59.794 4.099 8.296 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -60.984 2.437 6.910 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -62.098 3.624 7.631 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -61.648 3.753 5.914 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -58.656 3.067 6.362 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -59.192 4.418 5.335 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -58.066 4.716 6.681 1.00 0.00 H new ATOM 469 N ILE A 34 -62.491 7.095 7.840 1.00 0.00 N ATOM 470 CA ILE A 34 -63.635 7.487 8.647 1.00 0.00 C ATOM 471 C ILE A 34 -64.478 6.250 8.963 1.00 0.00 C ATOM 472 O ILE A 34 -64.639 5.885 10.127 1.00 0.00 O ATOM 473 CB ILE A 34 -64.419 8.605 7.958 1.00 0.00 C ATOM 474 CG1 ILE A 34 -63.480 9.705 7.458 1.00 0.00 C ATOM 475 CG2 ILE A 34 -65.510 9.157 8.877 1.00 0.00 C ATOM 476 CD1 ILE A 34 -64.099 11.089 7.662 1.00 0.00 C ATOM 0 H ILE A 34 -62.395 7.603 6.960 1.00 0.00 H new ATOM 0 HA ILE A 34 -63.305 7.901 9.600 1.00 0.00 H new ATOM 0 HB ILE A 34 -64.917 8.184 7.084 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -62.530 9.646 7.989 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -63.265 9.551 6.401 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -66.052 9.950 8.362 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -66.202 8.357 9.142 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -65.055 9.557 9.783 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -63.411 11.852 7.298 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -65.037 11.153 7.110 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -64.291 11.249 8.723 1.00 0.00 H new ATOM 488 N GLN A 35 -64.993 5.638 7.907 1.00 0.00 N ATOM 489 CA GLN A 35 -65.815 4.450 8.057 1.00 0.00 C ATOM 490 C GLN A 35 -65.718 3.575 6.805 1.00 0.00 C ATOM 491 O GLN A 35 -64.949 3.874 5.893 1.00 0.00 O ATOM 492 CB GLN A 35 -67.269 4.823 8.354 1.00 0.00 C ATOM 493 CG GLN A 35 -67.550 4.782 9.857 1.00 0.00 C ATOM 494 CD GLN A 35 -67.759 3.344 10.336 1.00 0.00 C ATOM 495 OE1 GLN A 35 -67.375 2.384 9.688 1.00 0.00 O ATOM 496 NE2 GLN A 35 -68.387 3.249 11.505 1.00 0.00 N ATOM 0 H GLN A 35 -64.857 5.943 6.943 1.00 0.00 H new ATOM 0 HA GLN A 35 -65.440 3.878 8.906 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -67.478 5.821 7.969 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -67.938 4.135 7.837 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -66.718 5.232 10.399 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -68.436 5.376 10.081 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -68.682 4.093 11.996 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -68.574 2.332 11.911 1.00 0.00 H new ATOM 505 N SER A 36 -66.509 2.512 6.802 1.00 0.00 N ATOM 506 CA SER A 36 -66.522 1.592 5.678 1.00 0.00 C ATOM 507 C SER A 36 -67.964 1.284 5.270 1.00 0.00 C ATOM 508 O SER A 36 -68.885 1.438 6.070 1.00 0.00 O ATOM 509 CB SER A 36 -65.778 0.299 6.016 1.00 0.00 C ATOM 510 OG SER A 36 -66.456 -0.462 7.012 1.00 0.00 O ATOM 0 H SER A 36 -67.146 2.268 7.561 1.00 0.00 H new ATOM 0 HA SER A 36 -66.008 2.067 4.842 1.00 0.00 H new ATOM 0 HB2 SER A 36 -65.667 -0.302 5.113 1.00 0.00 H new ATOM 0 HB3 SER A 36 -64.774 0.539 6.364 1.00 0.00 H new ATOM 0 HG SER A 36 -65.950 -1.280 7.199 1.00 0.00 H new ATOM 516 N ARG A 37 -68.114 0.854 4.026 1.00 0.00 N ATOM 517 CA ARG A 37 -69.429 0.523 3.502 1.00 0.00 C ATOM 518 C ARG A 37 -69.299 -0.393 2.284 1.00 0.00 C ATOM 519 O ARG A 37 -68.252 -0.432 1.640 1.00 0.00 O ATOM 520 CB ARG A 37 -70.197 1.785 3.104 1.00 0.00 C ATOM 521 CG ARG A 37 -69.628 2.390 1.819 1.00 0.00 C ATOM 522 CD ARG A 37 -70.416 3.635 1.404 1.00 0.00 C ATOM 523 NE ARG A 37 -71.501 3.259 0.470 1.00 0.00 N ATOM 524 CZ ARG A 37 -72.392 4.124 -0.033 1.00 0.00 C ATOM 525 NH1 ARG A 37 -72.332 5.419 0.304 1.00 0.00 N ATOM 526 NH2 ARG A 37 -73.342 3.694 -0.874 1.00 0.00 N ATOM 0 H ARG A 37 -67.347 0.727 3.365 1.00 0.00 H new ATOM 0 HA ARG A 37 -69.981 0.010 4.290 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -71.250 1.544 2.962 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -70.143 2.517 3.910 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -68.580 2.651 1.968 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -69.661 1.651 1.019 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -70.835 4.121 2.285 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -69.750 4.356 0.930 1.00 0.00 H new ATOM 0 HE ARG A 37 -71.575 2.280 0.192 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -71.608 5.747 0.943 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -73.010 6.078 -0.079 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -73.387 2.708 -1.131 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -74.020 4.353 -1.257 1.00 0.00 H new ATOM 540 N VAL A 38 -70.379 -1.108 2.003 1.00 0.00 N ATOM 541 CA VAL A 38 -70.400 -2.021 0.873 1.00 0.00 C ATOM 542 C VAL A 38 -71.391 -1.508 -0.173 1.00 0.00 C ATOM 543 O VAL A 38 -72.481 -1.052 0.170 1.00 0.00 O ATOM 544 CB VAL A 38 -70.715 -3.439 1.352 1.00 0.00 C ATOM 545 CG1 VAL A 38 -71.371 -4.260 0.240 1.00 0.00 C ATOM 546 CG2 VAL A 38 -69.457 -4.133 1.877 1.00 0.00 C ATOM 0 H VAL A 38 -71.246 -1.073 2.539 1.00 0.00 H new ATOM 0 HA VAL A 38 -69.420 -2.064 0.398 1.00 0.00 H new ATOM 0 HB VAL A 38 -71.424 -3.364 2.176 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -71.585 -5.264 0.607 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -72.300 -3.780 -0.067 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -70.696 -4.321 -0.614 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -69.709 -5.139 2.211 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -68.714 -4.190 1.081 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -69.050 -3.565 2.713 1.00 0.00 H new ATOM 556 N ASN A 39 -70.978 -1.601 -1.429 1.00 0.00 N ATOM 557 CA ASN A 39 -71.817 -1.152 -2.528 1.00 0.00 C ATOM 558 C ASN A 39 -72.530 -2.357 -3.144 1.00 0.00 C ATOM 559 O ASN A 39 -71.887 -3.253 -3.689 1.00 0.00 O ATOM 560 CB ASN A 39 -70.981 -0.487 -3.623 1.00 0.00 C ATOM 561 CG ASN A 39 -70.958 1.033 -3.449 1.00 0.00 C ATOM 562 OD1 ASN A 39 -70.800 1.557 -2.358 1.00 0.00 O ATOM 563 ND2 ASN A 39 -71.126 1.709 -4.582 1.00 0.00 N ATOM 0 H ASN A 39 -70.074 -1.980 -1.710 1.00 0.00 H new ATOM 0 HA ASN A 39 -72.533 -0.431 -2.133 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -69.963 -0.875 -3.594 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -71.391 -0.738 -4.601 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -71.128 2.729 -4.572 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -71.253 1.207 -5.461 1.00 0.00 H new ATOM 570 N ASP A 40 -73.851 -2.341 -3.037 1.00 0.00 N ATOM 571 CA ASP A 40 -74.659 -3.421 -3.577 1.00 0.00 C ATOM 572 C ASP A 40 -74.774 -3.257 -5.093 1.00 0.00 C ATOM 573 O ASP A 40 -74.530 -4.200 -5.844 1.00 0.00 O ATOM 574 CB ASP A 40 -76.072 -3.398 -2.990 1.00 0.00 C ATOM 575 CG ASP A 40 -76.313 -4.387 -1.847 1.00 0.00 C ATOM 576 OD1 ASP A 40 -75.305 -4.823 -1.251 1.00 0.00 O ATOM 577 OD2 ASP A 40 -77.501 -4.684 -1.595 1.00 0.00 O ATOM 0 H ASP A 40 -74.382 -1.597 -2.584 1.00 0.00 H new ATOM 0 HA ASP A 40 -74.177 -4.364 -3.320 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -76.283 -2.391 -2.630 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -76.784 -3.607 -3.788 1.00 0.00 H new ATOM 582 N GLN A 41 -75.147 -2.052 -5.499 1.00 0.00 N ATOM 583 CA GLN A 41 -75.298 -1.752 -6.913 1.00 0.00 C ATOM 584 C GLN A 41 -74.036 -2.155 -7.679 1.00 0.00 C ATOM 585 O GLN A 41 -74.113 -2.863 -8.682 1.00 0.00 O ATOM 586 CB GLN A 41 -75.620 -0.272 -7.129 1.00 0.00 C ATOM 587 CG GLN A 41 -76.992 0.080 -6.548 1.00 0.00 C ATOM 588 CD GLN A 41 -78.117 -0.489 -7.416 1.00 0.00 C ATOM 589 OE1 GLN A 41 -78.462 -1.656 -7.343 1.00 0.00 O ATOM 590 NE2 GLN A 41 -78.667 0.400 -8.239 1.00 0.00 N ATOM 0 H GLN A 41 -75.349 -1.272 -4.874 1.00 0.00 H new ATOM 0 HA GLN A 41 -76.136 -2.332 -7.299 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -74.853 0.343 -6.659 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -75.603 -0.044 -8.195 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -77.074 -0.314 -5.535 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -77.094 1.163 -6.478 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -78.330 1.363 -8.249 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -79.426 0.119 -8.860 1.00 0.00 H new ATOM 599 N GLU A 42 -72.903 -1.687 -7.177 1.00 0.00 N ATOM 600 CA GLU A 42 -71.626 -1.990 -7.801 1.00 0.00 C ATOM 601 C GLU A 42 -71.144 -3.379 -7.377 1.00 0.00 C ATOM 602 O GLU A 42 -70.648 -4.145 -8.201 1.00 0.00 O ATOM 603 CB GLU A 42 -70.584 -0.922 -7.463 1.00 0.00 C ATOM 604 CG GLU A 42 -70.437 0.082 -8.609 1.00 0.00 C ATOM 605 CD GLU A 42 -69.377 -0.381 -9.611 1.00 0.00 C ATOM 606 OE1 GLU A 42 -68.314 -0.842 -9.140 1.00 0.00 O ATOM 607 OE2 GLU A 42 -69.653 -0.263 -10.824 1.00 0.00 O ATOM 0 H GLU A 42 -72.842 -1.100 -6.345 1.00 0.00 H new ATOM 0 HA GLU A 42 -71.763 -1.989 -8.882 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -70.876 -0.399 -6.552 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -69.623 -1.396 -7.265 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -71.394 0.203 -9.116 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -70.163 1.058 -8.209 1.00 0.00 H new ATOM 614 N GLY A 43 -71.308 -3.661 -6.093 1.00 0.00 N ATOM 615 CA GLY A 43 -70.896 -4.944 -5.550 1.00 0.00 C ATOM 616 C GLY A 43 -69.425 -4.915 -5.131 1.00 0.00 C ATOM 617 O GLY A 43 -68.642 -5.771 -5.541 1.00 0.00 O ATOM 0 H GLY A 43 -71.721 -3.023 -5.413 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -71.518 -5.196 -4.691 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -71.050 -5.725 -6.295 1.00 0.00 H new ATOM 621 N ARG A 44 -69.094 -3.922 -4.319 1.00 0.00 N ATOM 622 CA ARG A 44 -67.730 -3.771 -3.839 1.00 0.00 C ATOM 623 C ARG A 44 -67.711 -2.959 -2.543 1.00 0.00 C ATOM 624 O ARG A 44 -68.698 -2.312 -2.196 1.00 0.00 O ATOM 625 CB ARG A 44 -66.854 -3.074 -4.882 1.00 0.00 C ATOM 626 CG ARG A 44 -67.344 -1.649 -5.147 1.00 0.00 C ATOM 627 CD ARG A 44 -66.567 -1.007 -6.298 1.00 0.00 C ATOM 628 NE ARG A 44 -66.928 0.423 -6.417 1.00 0.00 N ATOM 629 CZ ARG A 44 -66.465 1.238 -7.374 1.00 0.00 C ATOM 630 NH1 ARG A 44 -65.619 0.769 -8.302 1.00 0.00 N ATOM 631 NH2 ARG A 44 -66.847 2.522 -7.404 1.00 0.00 N ATOM 0 H ARG A 44 -69.746 -3.214 -3.981 1.00 0.00 H new ATOM 0 HA ARG A 44 -67.331 -4.768 -3.653 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -65.821 -3.048 -4.536 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -66.865 -3.645 -5.811 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -68.407 -1.665 -5.386 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -67.229 -1.047 -4.245 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -65.496 -1.107 -6.125 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -66.789 -1.525 -7.231 1.00 0.00 H new ATOM 0 HE ARG A 44 -67.570 0.813 -5.727 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -65.328 -0.208 -8.279 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -65.266 1.389 -9.031 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -67.491 2.879 -6.698 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -66.494 3.142 -8.133 1.00 0.00 H new ATOM 645 N GLU A 45 -66.576 -3.019 -1.861 1.00 0.00 N ATOM 646 CA GLU A 45 -66.415 -2.297 -0.611 1.00 0.00 C ATOM 647 C GLU A 45 -66.025 -0.843 -0.883 1.00 0.00 C ATOM 648 O GLU A 45 -65.633 -0.500 -1.998 1.00 0.00 O ATOM 649 CB GLU A 45 -65.385 -2.982 0.289 1.00 0.00 C ATOM 650 CG GLU A 45 -65.893 -4.344 0.767 1.00 0.00 C ATOM 651 CD GLU A 45 -64.743 -5.205 1.293 1.00 0.00 C ATOM 652 OE1 GLU A 45 -64.242 -4.874 2.390 1.00 0.00 O ATOM 653 OE2 GLU A 45 -64.390 -6.174 0.587 1.00 0.00 O ATOM 0 H GLU A 45 -65.759 -3.557 -2.151 1.00 0.00 H new ATOM 0 HA GLU A 45 -67.370 -2.304 -0.085 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -64.449 -3.110 -0.255 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -65.170 -2.348 1.149 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -66.636 -4.204 1.552 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -66.391 -4.859 -0.054 1.00 0.00 H new ATOM 660 N GLU A 46 -66.145 -0.027 0.154 1.00 0.00 N ATOM 661 CA GLU A 46 -65.809 1.382 0.040 1.00 0.00 C ATOM 662 C GLU A 46 -65.425 1.948 1.409 1.00 0.00 C ATOM 663 O GLU A 46 -66.140 1.749 2.390 1.00 0.00 O ATOM 664 CB GLU A 46 -66.965 2.173 -0.575 1.00 0.00 C ATOM 665 CG GLU A 46 -66.595 2.692 -1.966 1.00 0.00 C ATOM 666 CD GLU A 46 -67.792 3.370 -2.635 1.00 0.00 C ATOM 667 OE1 GLU A 46 -68.453 4.171 -1.939 1.00 0.00 O ATOM 668 OE2 GLU A 46 -68.020 3.073 -3.828 1.00 0.00 O ATOM 0 H GLU A 46 -66.470 -0.315 1.077 1.00 0.00 H new ATOM 0 HA GLU A 46 -64.951 1.479 -0.626 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -67.849 1.539 -0.643 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -67.223 3.011 0.073 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -65.770 3.399 -1.886 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -66.248 1.865 -2.586 1.00 0.00 H new ATOM 675 N PHE A 47 -64.297 2.642 1.431 1.00 0.00 N ATOM 676 CA PHE A 47 -63.809 3.238 2.663 1.00 0.00 C ATOM 677 C PHE A 47 -63.740 4.762 2.545 1.00 0.00 C ATOM 678 O PHE A 47 -63.076 5.290 1.654 1.00 0.00 O ATOM 679 CB PHE A 47 -62.399 2.693 2.896 1.00 0.00 C ATOM 680 CG PHE A 47 -62.338 1.172 3.054 1.00 0.00 C ATOM 681 CD1 PHE A 47 -62.930 0.575 4.123 1.00 0.00 C ATOM 682 CD2 PHE A 47 -61.692 0.417 2.125 1.00 0.00 C ATOM 683 CE1 PHE A 47 -62.874 -0.836 4.270 1.00 0.00 C ATOM 684 CE2 PHE A 47 -61.636 -0.994 2.272 1.00 0.00 C ATOM 685 CZ PHE A 47 -62.228 -1.591 3.341 1.00 0.00 C ATOM 0 H PHE A 47 -63.707 2.805 0.615 1.00 0.00 H new ATOM 0 HA PHE A 47 -64.481 2.994 3.486 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -61.764 2.987 2.060 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -61.984 3.158 3.790 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -63.443 1.175 4.860 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -61.222 0.891 1.276 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -63.344 -1.310 5.119 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -61.123 -1.594 1.535 1.00 0.00 H new ATOM 0 HZ PHE A 47 -62.185 -2.664 3.452 1.00 0.00 H new ATOM 695 N TYR A 48 -64.436 5.426 3.456 1.00 0.00 N ATOM 696 CA TYR A 48 -64.462 6.879 3.465 1.00 0.00 C ATOM 697 C TYR A 48 -63.179 7.447 4.077 1.00 0.00 C ATOM 698 O TYR A 48 -63.081 7.597 5.294 1.00 0.00 O ATOM 699 CB TYR A 48 -65.650 7.274 4.345 1.00 0.00 C ATOM 700 CG TYR A 48 -66.218 8.661 4.037 1.00 0.00 C ATOM 701 CD1 TYR A 48 -66.462 9.032 2.730 1.00 0.00 C ATOM 702 CD2 TYR A 48 -66.487 9.540 5.066 1.00 0.00 C ATOM 703 CE1 TYR A 48 -66.997 10.338 2.441 1.00 0.00 C ATOM 704 CE2 TYR A 48 -67.022 10.846 4.777 1.00 0.00 C ATOM 705 CZ TYR A 48 -67.250 11.180 3.478 1.00 0.00 C ATOM 706 OH TYR A 48 -67.755 12.413 3.205 1.00 0.00 O ATOM 0 H TYR A 48 -64.986 4.985 4.193 1.00 0.00 H new ATOM 0 HA TYR A 48 -64.546 7.267 2.450 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -66.441 6.534 4.224 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -65.341 7.243 5.390 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -66.252 8.344 1.925 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -66.296 9.249 6.088 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -67.193 10.641 1.423 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -67.237 11.544 5.573 1.00 0.00 H new ATOM 0 HH TYR A 48 -67.887 12.905 4.042 1.00 0.00 H new ATOM 716 N VAL A 49 -62.228 7.747 3.205 1.00 0.00 N ATOM 717 CA VAL A 49 -60.956 8.294 3.643 1.00 0.00 C ATOM 718 C VAL A 49 -60.995 9.819 3.526 1.00 0.00 C ATOM 719 O VAL A 49 -61.472 10.357 2.528 1.00 0.00 O ATOM 720 CB VAL A 49 -59.812 7.663 2.848 1.00 0.00 C ATOM 721 CG1 VAL A 49 -59.879 6.135 2.910 1.00 0.00 C ATOM 722 CG2 VAL A 49 -59.815 8.154 1.399 1.00 0.00 C ATOM 0 H VAL A 49 -62.313 7.621 2.196 1.00 0.00 H new ATOM 0 HA VAL A 49 -60.777 8.052 4.691 1.00 0.00 H new ATOM 0 HB VAL A 49 -58.873 7.976 3.305 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -59.055 5.711 2.337 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -59.805 5.809 3.948 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -60.826 5.795 2.490 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -58.992 7.690 0.856 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -60.759 7.885 0.926 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -59.696 9.237 1.382 1.00 0.00 H new ATOM 732 N HIS A 50 -60.486 10.474 4.560 1.00 0.00 N ATOM 733 CA HIS A 50 -60.456 11.926 4.586 1.00 0.00 C ATOM 734 C HIS A 50 -59.006 12.411 4.543 1.00 0.00 C ATOM 735 O HIS A 50 -58.204 12.058 5.406 1.00 0.00 O ATOM 736 CB HIS A 50 -61.225 12.464 5.794 1.00 0.00 C ATOM 737 CG HIS A 50 -61.175 13.967 5.935 1.00 0.00 C ATOM 738 ND1 HIS A 50 -62.265 14.780 5.679 1.00 0.00 N ATOM 739 CD2 HIS A 50 -60.156 14.793 6.308 1.00 0.00 C ATOM 740 CE1 HIS A 50 -61.907 16.038 5.891 1.00 0.00 C ATOM 741 NE2 HIS A 50 -60.599 16.044 6.280 1.00 0.00 N ATOM 0 H HIS A 50 -60.091 10.025 5.386 1.00 0.00 H new ATOM 0 HA HIS A 50 -60.960 12.319 3.703 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -62.266 12.151 5.717 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -60.822 12.011 6.700 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -59.158 14.482 6.580 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -62.539 16.906 5.776 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -60.052 16.873 6.511 1.00 0.00 H new ATOM 749 N TYR A 51 -58.713 13.212 3.529 1.00 0.00 N ATOM 750 CA TYR A 51 -57.373 13.749 3.362 1.00 0.00 C ATOM 751 C TYR A 51 -57.091 14.848 4.388 1.00 0.00 C ATOM 752 O TYR A 51 -57.272 16.030 4.103 1.00 0.00 O ATOM 753 CB TYR A 51 -57.334 14.356 1.958 1.00 0.00 C ATOM 754 CG TYR A 51 -57.503 13.334 0.833 1.00 0.00 C ATOM 755 CD1 TYR A 51 -56.576 12.325 0.672 1.00 0.00 C ATOM 756 CD2 TYR A 51 -58.583 13.421 -0.022 1.00 0.00 C ATOM 757 CE1 TYR A 51 -56.735 11.363 -0.387 1.00 0.00 C ATOM 758 CE2 TYR A 51 -58.742 12.459 -1.082 1.00 0.00 C ATOM 759 CZ TYR A 51 -57.810 11.477 -1.212 1.00 0.00 C ATOM 760 OH TYR A 51 -57.961 10.568 -2.213 1.00 0.00 O ATOM 0 H TYR A 51 -59.381 13.502 2.815 1.00 0.00 H new ATOM 0 HA TYR A 51 -56.626 12.967 3.500 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -58.121 15.105 1.875 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -56.385 14.875 1.824 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -55.731 12.257 1.341 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -59.309 14.211 0.104 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -56.016 10.568 -0.523 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -59.582 12.516 -1.758 1.00 0.00 H new ATOM 0 HH TYR A 51 -58.774 10.773 -2.721 1.00 0.00 H new ATOM 770 N VAL A 52 -56.651 14.418 5.562 1.00 0.00 N ATOM 771 CA VAL A 52 -56.342 15.350 6.633 1.00 0.00 C ATOM 772 C VAL A 52 -55.231 16.296 6.174 1.00 0.00 C ATOM 773 O VAL A 52 -54.156 15.850 5.775 1.00 0.00 O ATOM 774 CB VAL A 52 -55.986 14.584 7.908 1.00 0.00 C ATOM 775 CG1 VAL A 52 -57.055 13.540 8.237 1.00 0.00 C ATOM 776 CG2 VAL A 52 -54.605 13.935 7.790 1.00 0.00 C ATOM 0 H VAL A 52 -56.501 13.436 5.795 1.00 0.00 H new ATOM 0 HA VAL A 52 -57.213 15.961 6.870 1.00 0.00 H new ATOM 0 HB VAL A 52 -55.952 15.299 8.730 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -56.777 13.010 9.148 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -58.015 14.036 8.384 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -57.136 12.830 7.414 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -54.376 13.397 8.710 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -54.601 13.239 6.951 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -53.853 14.707 7.625 1.00 0.00 H new ATOM 906 N GLU A 60 -64.120 11.255 -0.280 1.00 0.00 N ATOM 907 CA GLU A 60 -64.728 10.234 -1.116 1.00 0.00 C ATOM 908 C GLU A 60 -64.358 8.840 -0.604 1.00 0.00 C ATOM 909 O GLU A 60 -63.385 8.683 0.132 1.00 0.00 O ATOM 910 CB GLU A 60 -64.317 10.407 -2.580 1.00 0.00 C ATOM 911 CG GLU A 60 -62.802 10.275 -2.743 1.00 0.00 C ATOM 912 CD GLU A 60 -62.293 11.168 -3.877 1.00 0.00 C ATOM 913 OE1 GLU A 60 -62.787 10.984 -5.010 1.00 0.00 O ATOM 914 OE2 GLU A 60 -61.421 12.015 -3.584 1.00 0.00 O ATOM 0 HA GLU A 60 -65.811 10.345 -1.062 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -64.819 9.659 -3.193 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -64.641 11.384 -2.940 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -62.307 10.547 -1.811 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -62.544 9.236 -2.949 1.00 0.00 H new ATOM 921 N TRP A 61 -65.155 7.863 -1.014 1.00 0.00 N ATOM 922 CA TRP A 61 -64.924 6.488 -0.605 1.00 0.00 C ATOM 923 C TRP A 61 -63.803 5.919 -1.477 1.00 0.00 C ATOM 924 O TRP A 61 -63.585 6.381 -2.596 1.00 0.00 O ATOM 925 CB TRP A 61 -66.214 5.670 -0.680 1.00 0.00 C ATOM 926 CG TRP A 61 -67.403 6.315 0.035 1.00 0.00 C ATOM 927 CD1 TRP A 61 -68.170 7.328 -0.390 1.00 0.00 C ATOM 928 CD2 TRP A 61 -67.932 5.948 1.326 1.00 0.00 C ATOM 929 NE1 TRP A 61 -69.152 7.639 0.529 1.00 0.00 N ATOM 930 CE2 TRP A 61 -69.002 6.773 1.606 1.00 0.00 C ATOM 931 CE3 TRP A 61 -67.520 4.951 2.228 1.00 0.00 C ATOM 932 CZ2 TRP A 61 -69.749 6.687 2.787 1.00 0.00 C ATOM 933 CZ3 TRP A 61 -68.277 4.878 3.404 1.00 0.00 C ATOM 934 CH2 TRP A 61 -69.356 5.701 3.700 1.00 0.00 C ATOM 0 H TRP A 61 -65.961 7.997 -1.625 1.00 0.00 H new ATOM 0 HA TRP A 61 -64.611 6.442 0.438 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -66.473 5.515 -1.727 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -66.034 4.686 -0.248 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -68.037 7.837 -1.333 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -69.858 8.370 0.435 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -66.686 4.294 2.030 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -70.583 7.345 2.983 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -68.002 4.129 4.132 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -69.890 5.581 4.631 1.00 0.00 H new ATOM 945 N VAL A 62 -63.121 4.922 -0.932 1.00 0.00 N ATOM 946 CA VAL A 62 -62.028 4.284 -1.646 1.00 0.00 C ATOM 947 C VAL A 62 -62.052 2.780 -1.368 1.00 0.00 C ATOM 948 O VAL A 62 -62.632 2.337 -0.378 1.00 0.00 O ATOM 949 CB VAL A 62 -60.700 4.941 -1.265 1.00 0.00 C ATOM 950 CG1 VAL A 62 -60.727 6.443 -1.558 1.00 0.00 C ATOM 951 CG2 VAL A 62 -60.357 4.676 0.202 1.00 0.00 C ATOM 0 H VAL A 62 -63.304 4.540 -0.004 1.00 0.00 H new ATOM 0 HA VAL A 62 -62.145 4.418 -2.721 1.00 0.00 H new ATOM 0 HB VAL A 62 -59.918 4.493 -1.878 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -59.771 6.886 -1.278 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -60.903 6.603 -2.622 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -61.526 6.912 -0.983 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -59.408 5.154 0.446 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -61.143 5.083 0.839 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -60.275 3.602 0.368 1.00 0.00 H new ATOM 961 N ASP A 63 -61.414 2.035 -2.259 1.00 0.00 N ATOM 962 CA ASP A 63 -61.355 0.590 -2.122 1.00 0.00 C ATOM 963 C ASP A 63 -59.946 0.181 -1.687 1.00 0.00 C ATOM 964 O ASP A 63 -58.981 0.899 -1.941 1.00 0.00 O ATOM 965 CB ASP A 63 -61.659 -0.102 -3.452 1.00 0.00 C ATOM 966 CG ASP A 63 -63.125 -0.485 -3.661 1.00 0.00 C ATOM 967 OD1 ASP A 63 -63.908 0.429 -3.999 1.00 0.00 O ATOM 968 OD2 ASP A 63 -63.430 -1.684 -3.479 1.00 0.00 O ATOM 0 H ASP A 63 -60.933 2.406 -3.079 1.00 0.00 H new ATOM 0 HA ASP A 63 -62.097 0.290 -1.382 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -61.351 0.556 -4.265 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -61.050 -1.003 -3.523 1.00 0.00 H new ATOM 973 N LYS A 64 -59.873 -0.973 -1.039 1.00 0.00 N ATOM 974 CA LYS A 64 -58.599 -1.487 -0.567 1.00 0.00 C ATOM 975 C LYS A 64 -57.526 -1.231 -1.627 1.00 0.00 C ATOM 976 O LYS A 64 -56.399 -0.864 -1.299 1.00 0.00 O ATOM 977 CB LYS A 64 -58.729 -2.957 -0.166 1.00 0.00 C ATOM 978 CG LYS A 64 -58.120 -3.206 1.215 1.00 0.00 C ATOM 979 CD LYS A 64 -58.935 -4.239 1.996 1.00 0.00 C ATOM 980 CE LYS A 64 -60.308 -3.681 2.375 1.00 0.00 C ATOM 981 NZ LYS A 64 -61.031 -4.634 3.247 1.00 0.00 N ATOM 0 H LYS A 64 -60.676 -1.566 -0.830 1.00 0.00 H new ATOM 0 HA LYS A 64 -58.288 -0.961 0.336 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -59.780 -3.244 -0.161 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -58.231 -3.584 -0.905 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -57.093 -3.555 1.106 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -58.081 -2.271 1.773 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -59.058 -5.140 1.395 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -58.394 -4.528 2.897 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -60.190 -2.726 2.888 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -60.891 -3.489 1.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -62.024 -4.697 2.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -60.588 -5.572 3.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -60.990 -4.303 4.232 1.00 0.00 H new ATOM 995 N ASN A 65 -57.915 -1.435 -2.877 1.00 0.00 N ATOM 996 CA ASN A 65 -57.000 -1.232 -3.988 1.00 0.00 C ATOM 997 C ASN A 65 -56.409 0.177 -3.905 1.00 0.00 C ATOM 998 O ASN A 65 -55.193 0.348 -3.964 1.00 0.00 O ATOM 999 CB ASN A 65 -57.725 -1.362 -5.329 1.00 0.00 C ATOM 1000 CG ASN A 65 -57.476 -2.735 -5.956 1.00 0.00 C ATOM 1001 OD1 ASN A 65 -56.393 -3.045 -6.425 1.00 0.00 O ATOM 1002 ND2 ASN A 65 -58.536 -3.538 -5.939 1.00 0.00 N ATOM 0 H ASN A 65 -58.851 -1.739 -3.145 1.00 0.00 H new ATOM 0 HA ASN A 65 -56.219 -1.990 -3.925 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -58.795 -1.213 -5.184 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -57.384 -0.581 -6.008 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -58.472 -4.476 -6.334 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -59.413 -3.216 -5.531 1.00 0.00 H new ATOM 1009 N ARG A 66 -57.298 1.150 -3.769 1.00 0.00 N ATOM 1010 CA ARG A 66 -56.880 2.539 -3.676 1.00 0.00 C ATOM 1011 C ARG A 66 -56.151 2.787 -2.354 1.00 0.00 C ATOM 1012 O ARG A 66 -55.475 3.802 -2.195 1.00 0.00 O ATOM 1013 CB ARG A 66 -58.079 3.483 -3.775 1.00 0.00 C ATOM 1014 CG ARG A 66 -58.481 3.708 -5.234 1.00 0.00 C ATOM 1015 CD ARG A 66 -60.002 3.801 -5.375 1.00 0.00 C ATOM 1016 NE ARG A 66 -60.352 4.603 -6.569 1.00 0.00 N ATOM 1017 CZ ARG A 66 -61.597 4.993 -6.873 1.00 0.00 C ATOM 1018 NH1 ARG A 66 -62.618 4.659 -6.073 1.00 0.00 N ATOM 1019 NH2 ARG A 66 -61.820 5.719 -7.978 1.00 0.00 N ATOM 0 H ARG A 66 -58.306 1.004 -3.721 1.00 0.00 H new ATOM 0 HA ARG A 66 -56.206 2.739 -4.509 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -58.921 3.066 -3.222 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -57.834 4.438 -3.310 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -58.021 4.624 -5.605 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -58.104 2.891 -5.849 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -60.429 2.802 -5.460 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -60.431 4.256 -4.482 1.00 0.00 H new ATOM 0 HE ARG A 66 -59.598 4.876 -7.200 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -62.448 4.108 -5.232 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -63.566 4.956 -6.305 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -61.042 5.974 -8.586 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -62.768 6.016 -8.210 1.00 0.00 H new ATOM 1033 N LEU A 67 -56.314 1.842 -1.439 1.00 0.00 N ATOM 1034 CA LEU A 67 -55.680 1.946 -0.136 1.00 0.00 C ATOM 1035 C LEU A 67 -54.433 1.061 -0.108 1.00 0.00 C ATOM 1036 O LEU A 67 -54.243 0.222 -0.988 1.00 0.00 O ATOM 1037 CB LEU A 67 -56.684 1.628 0.975 1.00 0.00 C ATOM 1038 CG LEU A 67 -57.746 2.696 1.245 1.00 0.00 C ATOM 1039 CD1 LEU A 67 -58.868 2.143 2.125 1.00 0.00 C ATOM 1040 CD2 LEU A 67 -57.116 3.956 1.842 1.00 0.00 C ATOM 0 H LEU A 67 -56.876 1.001 -1.575 1.00 0.00 H new ATOM 0 HA LEU A 67 -55.350 2.969 0.046 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -57.190 0.696 0.724 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -56.131 1.452 1.898 1.00 0.00 H new ATOM 0 HG LEU A 67 -58.195 2.981 0.293 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -59.609 2.922 2.302 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -59.341 1.299 1.624 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -58.454 1.813 3.078 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -57.892 4.699 2.024 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -56.624 3.706 2.782 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -56.382 4.361 1.145 1.00 0.00 H new ATOM 1052 N ALA A 68 -53.614 1.278 0.911 1.00 0.00 N ATOM 1053 CA ALA A 68 -52.390 0.511 1.064 1.00 0.00 C ATOM 1054 C ALA A 68 -52.331 -0.071 2.478 1.00 0.00 C ATOM 1055 O ALA A 68 -52.062 0.648 3.438 1.00 0.00 O ATOM 1056 CB ALA A 68 -51.186 1.401 0.750 1.00 0.00 C ATOM 0 H ALA A 68 -53.775 1.974 1.639 1.00 0.00 H new ATOM 0 HA ALA A 68 -52.370 -0.323 0.363 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -50.268 0.825 0.865 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -51.260 1.765 -0.275 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -51.171 2.248 1.436 1.00 0.00 H new ATOM 1062 N LEU A 69 -52.589 -1.369 2.560 1.00 0.00 N ATOM 1063 CA LEU A 69 -52.569 -2.055 3.841 1.00 0.00 C ATOM 1064 C LEU A 69 -51.426 -3.072 3.852 1.00 0.00 C ATOM 1065 O LEU A 69 -51.552 -4.160 3.292 1.00 0.00 O ATOM 1066 CB LEU A 69 -53.939 -2.667 4.142 1.00 0.00 C ATOM 1067 CG LEU A 69 -54.882 -2.821 2.947 1.00 0.00 C ATOM 1068 CD1 LEU A 69 -56.116 -3.642 3.325 1.00 0.00 C ATOM 1069 CD2 LEU A 69 -55.258 -1.456 2.366 1.00 0.00 C ATOM 0 H LEU A 69 -52.813 -1.962 1.761 1.00 0.00 H new ATOM 0 HA LEU A 69 -52.376 -1.349 4.649 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -53.786 -3.650 4.588 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -54.433 -2.050 4.893 1.00 0.00 H new ATOM 0 HG LEU A 69 -54.357 -3.370 2.166 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -56.770 -3.736 2.458 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -55.806 -4.633 3.656 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -56.653 -3.142 4.131 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -55.929 -1.594 1.518 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -55.757 -0.860 3.130 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -54.356 -0.940 2.035 1.00 0.00 H new ATOM 1464 N ARG A 94 -15.793 -2.143 19.355 1.00 0.00 N ATOM 1465 CA ARG A 94 -14.732 -1.787 18.429 1.00 0.00 C ATOM 1466 C ARG A 94 -13.470 -2.599 18.729 1.00 0.00 C ATOM 1467 O ARG A 94 -13.272 -3.051 19.856 1.00 0.00 O ATOM 1468 CB ARG A 94 -14.402 -0.295 18.516 1.00 0.00 C ATOM 1469 CG ARG A 94 -14.749 0.420 17.209 1.00 0.00 C ATOM 1470 CD ARG A 94 -13.846 1.637 16.994 1.00 0.00 C ATOM 1471 NE ARG A 94 -14.552 2.870 17.410 1.00 0.00 N ATOM 1472 CZ ARG A 94 -14.161 4.108 17.077 1.00 0.00 C ATOM 1473 NH1 ARG A 94 -13.069 4.285 16.322 1.00 0.00 N ATOM 1474 NH2 ARG A 94 -14.863 5.168 17.499 1.00 0.00 N ATOM 0 HA ARG A 94 -15.082 -2.012 17.422 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -14.955 0.156 19.340 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -13.342 -0.165 18.735 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -14.640 -0.270 16.373 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -15.792 0.735 17.229 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -12.926 1.524 17.567 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -13.561 1.708 15.944 1.00 0.00 H new ATOM 0 HE ARG A 94 -15.388 2.771 17.986 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -12.535 3.478 16.000 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -12.771 5.227 16.069 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -15.695 5.033 18.074 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -14.566 6.110 17.246 1.00 0.00 H new ATOM 1488 N LYS A 95 -12.650 -2.760 17.701 1.00 0.00 N ATOM 1489 CA LYS A 95 -11.413 -3.510 17.840 1.00 0.00 C ATOM 1490 C LYS A 95 -10.567 -3.328 16.579 1.00 0.00 C ATOM 1491 O LYS A 95 -10.643 -4.137 15.655 1.00 0.00 O ATOM 1492 CB LYS A 95 -11.709 -4.973 18.177 1.00 0.00 C ATOM 1493 CG LYS A 95 -10.416 -5.745 18.447 1.00 0.00 C ATOM 1494 CD LYS A 95 -10.239 -6.886 17.443 1.00 0.00 C ATOM 1495 CE LYS A 95 -9.594 -8.105 18.106 1.00 0.00 C ATOM 1496 NZ LYS A 95 -10.616 -9.133 18.406 1.00 0.00 N ATOM 0 H LYS A 95 -12.818 -2.384 16.768 1.00 0.00 H new ATOM 0 HA LYS A 95 -10.827 -3.127 18.675 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -12.357 -5.025 19.052 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -12.249 -5.438 17.352 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -9.564 -5.067 18.387 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -10.433 -6.147 19.460 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -11.208 -7.164 17.028 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -9.620 -6.550 16.611 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -8.831 -8.523 17.449 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -9.092 -7.803 19.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -10.162 -9.953 18.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -11.329 -8.736 19.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -11.076 -9.433 17.523 1.00 0.00 H new ATOM 1510 N ILE A 96 -9.780 -2.262 16.581 1.00 0.00 N ATOM 1511 CA ILE A 96 -8.921 -1.964 15.448 1.00 0.00 C ATOM 1512 C ILE A 96 -7.903 -3.094 15.274 1.00 0.00 C ATOM 1513 O ILE A 96 -7.784 -3.965 16.135 1.00 0.00 O ATOM 1514 CB ILE A 96 -8.284 -0.582 15.608 1.00 0.00 C ATOM 1515 CG1 ILE A 96 -7.611 -0.136 14.308 1.00 0.00 C ATOM 1516 CG2 ILE A 96 -7.316 -0.558 16.792 1.00 0.00 C ATOM 1517 CD1 ILE A 96 -7.394 1.379 14.296 1.00 0.00 C ATOM 0 H ILE A 96 -9.719 -1.594 17.349 1.00 0.00 H new ATOM 0 HA ILE A 96 -9.505 -1.916 14.529 1.00 0.00 H new ATOM 0 HB ILE A 96 -9.075 0.136 15.825 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -6.654 -0.645 14.196 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -8.227 -0.426 13.457 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -6.877 0.436 16.883 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -7.855 -0.802 17.707 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -6.525 -1.290 16.630 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -6.914 1.670 13.362 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -8.355 1.885 14.384 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -6.757 1.662 15.134 1.00 0.00 H new ATOM 1529 N THR A 97 -7.196 -3.043 14.156 1.00 0.00 N ATOM 1530 CA THR A 97 -6.192 -4.051 13.858 1.00 0.00 C ATOM 1531 C THR A 97 -5.301 -3.592 12.703 1.00 0.00 C ATOM 1532 O THR A 97 -5.738 -2.830 11.842 1.00 0.00 O ATOM 1533 CB THR A 97 -6.916 -5.370 13.580 1.00 0.00 C ATOM 1534 OG1 THR A 97 -5.862 -6.309 13.381 1.00 0.00 O ATOM 1535 CG2 THR A 97 -7.662 -5.359 12.244 1.00 0.00 C ATOM 0 H THR A 97 -7.298 -2.319 13.444 1.00 0.00 H new ATOM 0 HA THR A 97 -5.521 -4.203 14.703 1.00 0.00 H new ATOM 0 HB THR A 97 -7.620 -5.574 14.387 1.00 0.00 H new ATOM 0 HG1 THR A 97 -6.242 -7.193 13.196 1.00 0.00 H new ATOM 0 HG21 THR A 97 -8.158 -6.318 12.096 1.00 0.00 H new ATOM 0 HG22 THR A 97 -8.406 -4.563 12.249 1.00 0.00 H new ATOM 0 HG23 THR A 97 -6.954 -5.188 11.433 1.00 0.00 H new ATOM 1543 N ARG A 98 -4.067 -4.074 12.722 1.00 0.00 N ATOM 1544 CA ARG A 98 -3.110 -3.723 11.687 1.00 0.00 C ATOM 1545 C ARG A 98 -1.763 -4.395 11.959 1.00 0.00 C ATOM 1546 O ARG A 98 -1.507 -4.853 13.071 1.00 0.00 O ATOM 1547 CB ARG A 98 -2.910 -2.208 11.613 1.00 0.00 C ATOM 1548 CG ARG A 98 -2.328 -1.667 12.920 1.00 0.00 C ATOM 1549 CD ARG A 98 -2.234 -0.140 12.889 1.00 0.00 C ATOM 1550 NE ARG A 98 -0.828 0.284 13.074 1.00 0.00 N ATOM 1551 CZ ARG A 98 -0.425 1.562 13.090 1.00 0.00 C ATOM 1552 NH1 ARG A 98 -1.318 2.548 12.931 1.00 0.00 N ATOM 1553 NH2 ARG A 98 0.872 1.853 13.263 1.00 0.00 N ATOM 0 H ARG A 98 -3.708 -4.705 13.438 1.00 0.00 H new ATOM 0 HA ARG A 98 -3.509 -4.073 10.735 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -2.243 -1.966 10.786 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -3.863 -1.721 11.406 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -2.953 -1.979 13.757 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -1.338 -2.092 13.085 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -2.614 0.237 11.940 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -2.858 0.287 13.674 1.00 0.00 H new ATOM 0 HE ARG A 98 -0.122 -0.442 13.197 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -2.305 2.326 12.798 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -1.011 3.521 12.943 1.00 0.00 H new ATOM 0 HH21 ARG A 98 1.552 1.102 13.382 1.00 0.00 H new ATOM 0 HH22 ARG A 98 1.179 2.826 13.275 1.00 0.00 H new ATOM 1567 N ASN A 99 -0.937 -4.434 10.923 1.00 0.00 N ATOM 1568 CA ASN A 99 0.377 -5.043 11.036 1.00 0.00 C ATOM 1569 C ASN A 99 1.016 -5.129 9.649 1.00 0.00 C ATOM 1570 O ASN A 99 0.325 -5.353 8.656 1.00 0.00 O ATOM 1571 CB ASN A 99 0.280 -6.462 11.601 1.00 0.00 C ATOM 1572 CG ASN A 99 0.856 -6.529 13.016 1.00 0.00 C ATOM 1573 OD1 ASN A 99 1.825 -5.868 13.352 1.00 0.00 O ATOM 1574 ND2 ASN A 99 0.208 -7.363 13.825 1.00 0.00 N ATOM 0 H ASN A 99 -1.153 -4.054 10.002 1.00 0.00 H new ATOM 0 HA ASN A 99 0.977 -4.428 11.707 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -0.762 -6.782 11.613 1.00 0.00 H new ATOM 0 HB3 ASN A 99 0.818 -7.153 10.952 1.00 0.00 H new ATOM 0 HD21 ASN A 99 0.516 -7.479 14.791 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -0.596 -7.887 13.480 1.00 0.00 H new ATOM 1581 N GLN A 100 2.328 -4.946 9.624 1.00 0.00 N ATOM 1582 CA GLN A 100 3.068 -5.000 8.374 1.00 0.00 C ATOM 1583 C GLN A 100 4.570 -4.895 8.642 1.00 0.00 C ATOM 1584 O GLN A 100 4.986 -4.349 9.663 1.00 0.00 O ATOM 1585 CB GLN A 100 2.604 -3.902 7.415 1.00 0.00 C ATOM 1586 CG GLN A 100 2.255 -4.484 6.043 1.00 0.00 C ATOM 1587 CD GLN A 100 1.798 -3.385 5.081 1.00 0.00 C ATOM 1588 OE1 GLN A 100 2.549 -2.498 4.711 1.00 0.00 O ATOM 1589 NE2 GLN A 100 0.529 -3.494 4.699 1.00 0.00 N ATOM 0 H GLN A 100 2.898 -4.760 10.449 1.00 0.00 H new ATOM 0 HA GLN A 100 2.870 -5.960 7.898 1.00 0.00 H new ATOM 0 HB2 GLN A 100 1.734 -3.395 7.831 1.00 0.00 H new ATOM 0 HB3 GLN A 100 3.388 -3.153 7.307 1.00 0.00 H new ATOM 0 HG2 GLN A 100 3.124 -4.996 5.629 1.00 0.00 H new ATOM 0 HG3 GLN A 100 1.467 -5.229 6.150 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -0.044 -4.262 5.047 1.00 0.00 H new ATOM 0 HE22 GLN A 100 0.129 -2.809 4.057 1.00 0.00 H new ATOM 1598 N LYS A 101 5.344 -5.426 7.707 1.00 0.00 N ATOM 1599 CA LYS A 101 6.792 -5.399 7.829 1.00 0.00 C ATOM 1600 C LYS A 101 7.413 -6.148 6.649 1.00 0.00 C ATOM 1601 O LYS A 101 6.722 -6.877 5.939 1.00 0.00 O ATOM 1602 CB LYS A 101 7.224 -5.935 9.195 1.00 0.00 C ATOM 1603 CG LYS A 101 8.145 -4.943 9.908 1.00 0.00 C ATOM 1604 CD LYS A 101 7.930 -4.985 11.422 1.00 0.00 C ATOM 1605 CE LYS A 101 8.389 -3.680 12.077 1.00 0.00 C ATOM 1606 NZ LYS A 101 8.360 -3.803 13.552 1.00 0.00 N ATOM 0 H LYS A 101 4.996 -5.878 6.861 1.00 0.00 H new ATOM 0 HA LYS A 101 7.160 -4.374 7.784 1.00 0.00 H new ATOM 0 HB2 LYS A 101 6.344 -6.126 9.809 1.00 0.00 H new ATOM 0 HB3 LYS A 101 7.738 -6.888 9.070 1.00 0.00 H new ATOM 0 HG2 LYS A 101 9.185 -5.177 9.678 1.00 0.00 H new ATOM 0 HG3 LYS A 101 7.956 -3.935 9.538 1.00 0.00 H new ATOM 0 HD2 LYS A 101 6.875 -5.154 11.639 1.00 0.00 H new ATOM 0 HD3 LYS A 101 8.481 -5.823 11.848 1.00 0.00 H new ATOM 0 HE2 LYS A 101 9.398 -3.435 11.746 1.00 0.00 H new ATOM 0 HE3 LYS A 101 7.743 -2.861 11.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 8.674 -2.909 13.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 7.391 -4.015 13.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 8.995 -4.571 13.849 1.00 0.00 H new ATOM 1620 N ARG A 102 8.711 -5.944 6.476 1.00 0.00 N ATOM 1621 CA ARG A 102 9.433 -6.592 5.395 1.00 0.00 C ATOM 1622 C ARG A 102 10.915 -6.213 5.444 1.00 0.00 C ATOM 1623 O ARG A 102 11.274 -5.166 5.980 1.00 0.00 O ATOM 1624 CB ARG A 102 8.857 -6.196 4.033 1.00 0.00 C ATOM 1625 CG ARG A 102 8.966 -7.350 3.035 1.00 0.00 C ATOM 1626 CD ARG A 102 7.908 -8.419 3.316 1.00 0.00 C ATOM 1627 NE ARG A 102 8.501 -9.768 3.173 1.00 0.00 N ATOM 1628 CZ ARG A 102 7.889 -10.900 3.545 1.00 0.00 C ATOM 1629 NH1 ARG A 102 6.663 -10.854 4.084 1.00 0.00 N ATOM 1630 NH2 ARG A 102 8.503 -12.080 3.377 1.00 0.00 N ATOM 0 H ARG A 102 9.281 -5.339 7.067 1.00 0.00 H new ATOM 0 HA ARG A 102 9.326 -7.669 5.523 1.00 0.00 H new ATOM 0 HB2 ARG A 102 7.812 -5.906 4.146 1.00 0.00 H new ATOM 0 HB3 ARG A 102 9.389 -5.326 3.648 1.00 0.00 H new ATOM 0 HG2 ARG A 102 8.845 -6.971 2.020 1.00 0.00 H new ATOM 0 HG3 ARG A 102 9.960 -7.793 3.093 1.00 0.00 H new ATOM 0 HD2 ARG A 102 7.510 -8.293 4.323 1.00 0.00 H new ATOM 0 HD3 ARG A 102 7.072 -8.305 2.626 1.00 0.00 H new ATOM 0 HE ARG A 102 9.433 -9.840 2.766 1.00 0.00 H new ATOM 0 HH11 ARG A 102 6.195 -9.957 4.211 1.00 0.00 H new ATOM 0 HH12 ARG A 102 6.198 -11.716 4.367 1.00 0.00 H new ATOM 0 HH21 ARG A 102 9.436 -12.116 2.966 1.00 0.00 H new ATOM 0 HH22 ARG A 102 8.037 -12.942 3.660 1.00 0.00 H new ATOM 1644 N LYS A 103 11.735 -7.085 4.877 1.00 0.00 N ATOM 1645 CA LYS A 103 13.169 -6.856 4.849 1.00 0.00 C ATOM 1646 C LYS A 103 13.840 -7.947 4.013 1.00 0.00 C ATOM 1647 O LYS A 103 13.230 -8.974 3.721 1.00 0.00 O ATOM 1648 CB LYS A 103 13.721 -6.744 6.272 1.00 0.00 C ATOM 1649 CG LYS A 103 13.723 -8.107 6.967 1.00 0.00 C ATOM 1650 CD LYS A 103 14.656 -8.103 8.180 1.00 0.00 C ATOM 1651 CE LYS A 103 13.901 -8.489 9.454 1.00 0.00 C ATOM 1652 NZ LYS A 103 14.839 -9.009 10.474 1.00 0.00 N ATOM 0 H LYS A 103 11.433 -7.952 4.433 1.00 0.00 H new ATOM 0 HA LYS A 103 13.393 -5.904 4.369 1.00 0.00 H new ATOM 0 HB2 LYS A 103 14.735 -6.345 6.242 1.00 0.00 H new ATOM 0 HB3 LYS A 103 13.118 -6.040 6.846 1.00 0.00 H new ATOM 0 HG2 LYS A 103 12.711 -8.359 7.283 1.00 0.00 H new ATOM 0 HG3 LYS A 103 14.039 -8.877 6.264 1.00 0.00 H new ATOM 0 HD2 LYS A 103 15.477 -8.801 8.014 1.00 0.00 H new ATOM 0 HD3 LYS A 103 15.098 -7.114 8.300 1.00 0.00 H new ATOM 0 HE2 LYS A 103 13.371 -7.621 9.847 1.00 0.00 H new ATOM 0 HE3 LYS A 103 13.149 -9.244 9.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 14.311 -9.266 11.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 15.326 -9.849 10.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 15.541 -8.277 10.706 1.00 0.00 H new ATOM 1666 N HIS A 104 15.088 -7.687 3.651 1.00 0.00 N ATOM 1667 CA HIS A 104 15.849 -8.634 2.854 1.00 0.00 C ATOM 1668 C HIS A 104 17.323 -8.224 2.838 1.00 0.00 C ATOM 1669 O HIS A 104 17.647 -7.054 3.031 1.00 0.00 O ATOM 1670 CB HIS A 104 15.254 -8.763 1.450 1.00 0.00 C ATOM 1671 CG HIS A 104 15.311 -7.491 0.639 1.00 0.00 C ATOM 1672 ND1 HIS A 104 16.452 -7.076 -0.026 1.00 0.00 N ATOM 1673 CD2 HIS A 104 14.357 -6.548 0.392 1.00 0.00 C ATOM 1674 CE1 HIS A 104 16.186 -5.933 -0.640 1.00 0.00 C ATOM 1675 NE2 HIS A 104 14.887 -5.607 -0.380 1.00 0.00 N ATOM 0 H HIS A 104 15.591 -6.834 3.895 1.00 0.00 H new ATOM 0 HA HIS A 104 15.789 -9.625 3.304 1.00 0.00 H new ATOM 0 HB2 HIS A 104 15.785 -9.548 0.912 1.00 0.00 H new ATOM 0 HB3 HIS A 104 14.215 -9.081 1.535 1.00 0.00 H new ATOM 0 HD2 HIS A 104 13.342 -6.564 0.762 1.00 0.00 H new ATOM 0 HE1 HIS A 104 16.876 -5.360 -1.241 1.00 0.00 H new ATOM 0 HE2 HIS A 104 14.403 -4.777 -0.722 1.00 0.00 H new ATOM 1683 N ASP A 105 18.175 -9.211 2.605 1.00 0.00 N ATOM 1684 CA ASP A 105 19.607 -8.968 2.562 1.00 0.00 C ATOM 1685 C ASP A 105 20.349 -10.305 2.617 1.00 0.00 C ATOM 1686 O ASP A 105 20.205 -11.061 3.577 1.00 0.00 O ATOM 1687 CB ASP A 105 20.060 -8.127 3.757 1.00 0.00 C ATOM 1688 CG ASP A 105 20.728 -6.799 3.397 1.00 0.00 C ATOM 1689 OD1 ASP A 105 21.112 -6.658 2.216 1.00 0.00 O ATOM 1690 OD2 ASP A 105 20.839 -5.954 4.311 1.00 0.00 O ATOM 0 H ASP A 105 17.902 -10.180 2.444 1.00 0.00 H new ATOM 0 HA ASP A 105 19.830 -8.432 1.639 1.00 0.00 H new ATOM 0 HB2 ASP A 105 19.194 -7.922 4.387 1.00 0.00 H new ATOM 0 HB3 ASP A 105 20.756 -8.716 4.354 1.00 0.00 H new ATOM 1695 N GLU A 106 21.127 -10.558 1.574 1.00 0.00 N ATOM 1696 CA GLU A 106 21.891 -11.790 1.491 1.00 0.00 C ATOM 1697 C GLU A 106 22.847 -11.743 0.297 1.00 0.00 C ATOM 1698 O GLU A 106 22.674 -10.930 -0.609 1.00 0.00 O ATOM 1699 CB GLU A 106 20.965 -13.005 1.404 1.00 0.00 C ATOM 1700 CG GLU A 106 21.704 -14.287 1.791 1.00 0.00 C ATOM 1701 CD GLU A 106 22.390 -14.135 3.150 1.00 0.00 C ATOM 1702 OE1 GLU A 106 21.652 -13.951 4.142 1.00 0.00 O ATOM 1703 OE2 GLU A 106 23.638 -14.206 3.167 1.00 0.00 O ATOM 0 H GLU A 106 21.244 -9.930 0.779 1.00 0.00 H new ATOM 0 HA GLU A 106 22.482 -11.889 2.401 1.00 0.00 H new ATOM 0 HB2 GLU A 106 20.109 -12.862 2.063 1.00 0.00 H new ATOM 0 HB3 GLU A 106 20.575 -13.098 0.390 1.00 0.00 H new ATOM 0 HG2 GLU A 106 21.002 -15.120 1.825 1.00 0.00 H new ATOM 0 HG3 GLU A 106 22.446 -14.527 1.030 1.00 0.00 H new ATOM 1710 N ILE A 107 23.836 -12.624 0.336 1.00 0.00 N ATOM 1711 CA ILE A 107 24.820 -12.693 -0.731 1.00 0.00 C ATOM 1712 C ILE A 107 25.616 -11.387 -0.769 1.00 0.00 C ATOM 1713 O ILE A 107 25.040 -10.309 -0.905 1.00 0.00 O ATOM 1714 CB ILE A 107 24.146 -13.042 -2.059 1.00 0.00 C ATOM 1715 CG1 ILE A 107 23.424 -14.388 -1.971 1.00 0.00 C ATOM 1716 CG2 ILE A 107 25.152 -13.005 -3.211 1.00 0.00 C ATOM 1717 CD1 ILE A 107 22.040 -14.312 -2.619 1.00 0.00 C ATOM 0 H ILE A 107 23.977 -13.296 1.090 1.00 0.00 H new ATOM 0 HA ILE A 107 25.533 -13.496 -0.542 1.00 0.00 H new ATOM 0 HB ILE A 107 23.390 -12.285 -2.267 1.00 0.00 H new ATOM 0 HG12 ILE A 107 24.019 -15.157 -2.465 1.00 0.00 H new ATOM 0 HG13 ILE A 107 23.325 -14.684 -0.927 1.00 0.00 H new ATOM 0 HG21 ILE A 107 24.647 -13.257 -4.143 1.00 0.00 H new ATOM 0 HG22 ILE A 107 25.580 -12.005 -3.289 1.00 0.00 H new ATOM 0 HG23 ILE A 107 25.947 -13.726 -3.023 1.00 0.00 H new ATOM 0 HD11 ILE A 107 21.549 -15.282 -2.543 1.00 0.00 H new ATOM 0 HD12 ILE A 107 21.440 -13.560 -2.107 1.00 0.00 H new ATOM 0 HD13 ILE A 107 22.144 -14.040 -3.669 1.00 0.00 H new ATOM 1729 N ASN A 108 26.928 -11.527 -0.647 1.00 0.00 N ATOM 1730 CA ASN A 108 27.809 -10.372 -0.667 1.00 0.00 C ATOM 1731 C ASN A 108 29.220 -10.806 -0.265 1.00 0.00 C ATOM 1732 O ASN A 108 29.555 -10.822 0.918 1.00 0.00 O ATOM 1733 CB ASN A 108 27.341 -9.306 0.326 1.00 0.00 C ATOM 1734 CG ASN A 108 27.179 -7.949 -0.362 1.00 0.00 C ATOM 1735 OD1 ASN A 108 27.540 -7.760 -1.512 1.00 0.00 O ATOM 1736 ND2 ASN A 108 26.619 -7.018 0.405 1.00 0.00 N ATOM 0 H ASN A 108 27.402 -12.423 -0.534 1.00 0.00 H new ATOM 0 HA ASN A 108 27.798 -9.956 -1.674 1.00 0.00 H new ATOM 0 HB2 ASN A 108 26.392 -9.608 0.769 1.00 0.00 H new ATOM 0 HB3 ASN A 108 28.061 -9.221 1.140 1.00 0.00 H new ATOM 0 HD21 ASN A 108 26.468 -6.078 0.038 1.00 0.00 H new ATOM 0 HD22 ASN A 108 26.340 -7.244 1.360 1.00 0.00 H new ATOM 1743 N HIS A 109 30.009 -11.147 -1.274 1.00 0.00 N ATOM 1744 CA HIS A 109 31.376 -11.580 -1.041 1.00 0.00 C ATOM 1745 C HIS A 109 32.074 -11.819 -2.381 1.00 0.00 C ATOM 1746 O HIS A 109 31.433 -12.195 -3.361 1.00 0.00 O ATOM 1747 CB HIS A 109 31.410 -12.807 -0.128 1.00 0.00 C ATOM 1748 CG HIS A 109 32.690 -12.952 0.660 1.00 0.00 C ATOM 1749 ND1 HIS A 109 32.894 -12.331 1.880 1.00 0.00 N ATOM 1750 CD2 HIS A 109 33.829 -13.652 0.389 1.00 0.00 C ATOM 1751 CE1 HIS A 109 34.104 -12.650 2.314 1.00 0.00 C ATOM 1752 NE2 HIS A 109 34.682 -13.469 1.389 1.00 0.00 N ATOM 0 H HIS A 109 29.727 -11.132 -2.254 1.00 0.00 H new ATOM 0 HA HIS A 109 31.925 -10.796 -0.519 1.00 0.00 H new ATOM 0 HB2 HIS A 109 30.572 -12.753 0.567 1.00 0.00 H new ATOM 0 HB3 HIS A 109 31.265 -13.702 -0.734 1.00 0.00 H new ATOM 0 HD2 HIS A 109 34.007 -14.253 -0.490 1.00 0.00 H new ATOM 0 HE1 HIS A 109 34.554 -12.320 3.238 1.00 0.00 H new ATOM 0 HE2 HIS A 109 35.616 -13.874 1.455 1.00 0.00 H new ATOM 1760 N VAL A 110 33.379 -11.590 -2.381 1.00 0.00 N ATOM 1761 CA VAL A 110 34.171 -11.775 -3.585 1.00 0.00 C ATOM 1762 C VAL A 110 35.294 -12.776 -3.303 1.00 0.00 C ATOM 1763 O VAL A 110 35.581 -13.082 -2.146 1.00 0.00 O ATOM 1764 CB VAL A 110 34.687 -10.425 -4.086 1.00 0.00 C ATOM 1765 CG1 VAL A 110 36.089 -10.138 -3.543 1.00 0.00 C ATOM 1766 CG2 VAL A 110 34.668 -10.362 -5.614 1.00 0.00 C ATOM 0 H VAL A 110 33.908 -11.278 -1.566 1.00 0.00 H new ATOM 0 HA VAL A 110 33.557 -12.190 -4.385 1.00 0.00 H new ATOM 0 HB VAL A 110 34.017 -9.651 -3.711 1.00 0.00 H new ATOM 0 HG11 VAL A 110 36.432 -9.172 -3.914 1.00 0.00 H new ATOM 0 HG12 VAL A 110 36.060 -10.119 -2.454 1.00 0.00 H new ATOM 0 HG13 VAL A 110 36.774 -10.918 -3.874 1.00 0.00 H new ATOM 0 HG21 VAL A 110 35.040 -9.392 -5.943 1.00 0.00 H new ATOM 0 HG22 VAL A 110 35.303 -11.150 -6.019 1.00 0.00 H new ATOM 0 HG23 VAL A 110 33.647 -10.499 -5.971 1.00 0.00 H new ATOM 1776 N GLN A 111 35.897 -13.260 -4.379 1.00 0.00 N ATOM 1777 CA GLN A 111 36.981 -14.220 -4.261 1.00 0.00 C ATOM 1778 C GLN A 111 38.276 -13.630 -4.822 1.00 0.00 C ATOM 1779 O GLN A 111 38.276 -12.524 -5.363 1.00 0.00 O ATOM 1780 CB GLN A 111 36.628 -15.533 -4.962 1.00 0.00 C ATOM 1781 CG GLN A 111 36.409 -15.314 -6.460 1.00 0.00 C ATOM 1782 CD GLN A 111 37.735 -15.049 -7.176 1.00 0.00 C ATOM 1783 OE1 GLN A 111 37.914 -13.780 -7.531 1.00 0.00 O flip ATOM 1784 NE2 GLN A 111 38.542 -15.938 -7.391 1.00 0.00 N flip ATOM 0 H GLN A 111 35.655 -13.005 -5.337 1.00 0.00 H new ATOM 0 HA GLN A 111 37.133 -14.439 -3.204 1.00 0.00 H new ATOM 0 HB2 GLN A 111 37.429 -16.257 -4.810 1.00 0.00 H new ATOM 0 HB3 GLN A 111 35.727 -15.956 -4.517 1.00 0.00 H new ATOM 0 HG2 GLN A 111 35.927 -16.191 -6.893 1.00 0.00 H new ATOM 0 HG3 GLN A 111 35.734 -14.472 -6.613 1.00 0.00 H new ATOM 0 HE21 GLN A 111 38.342 -16.892 -7.091 1.00 0.00 H new ATOM 0 HE22 GLN A 111 39.417 -15.727 -7.870 1.00 0.00 H new ATOM 1793 N LYS A 112 39.349 -14.393 -4.675 1.00 0.00 N ATOM 1794 CA LYS A 112 40.648 -13.959 -5.160 1.00 0.00 C ATOM 1795 C LYS A 112 41.670 -15.076 -4.938 1.00 0.00 C ATOM 1796 O LYS A 112 42.089 -15.323 -3.808 1.00 0.00 O ATOM 1797 CB LYS A 112 41.043 -12.628 -4.518 1.00 0.00 C ATOM 1798 CG LYS A 112 41.972 -11.830 -5.435 1.00 0.00 C ATOM 1799 CD LYS A 112 43.239 -11.401 -4.693 1.00 0.00 C ATOM 1800 CE LYS A 112 44.351 -11.028 -5.676 1.00 0.00 C ATOM 1801 NZ LYS A 112 45.667 -11.469 -5.162 1.00 0.00 N ATOM 0 H LYS A 112 39.345 -15.309 -4.227 1.00 0.00 H new ATOM 0 HA LYS A 112 40.610 -13.770 -6.233 1.00 0.00 H new ATOM 0 HB2 LYS A 112 40.148 -12.044 -4.304 1.00 0.00 H new ATOM 0 HB3 LYS A 112 41.538 -12.813 -3.565 1.00 0.00 H new ATOM 0 HG2 LYS A 112 42.241 -12.434 -6.301 1.00 0.00 H new ATOM 0 HG3 LYS A 112 41.450 -10.950 -5.810 1.00 0.00 H new ATOM 0 HD2 LYS A 112 43.017 -10.550 -4.049 1.00 0.00 H new ATOM 0 HD3 LYS A 112 43.577 -12.210 -4.046 1.00 0.00 H new ATOM 0 HE2 LYS A 112 44.159 -11.490 -6.644 1.00 0.00 H new ATOM 0 HE3 LYS A 112 44.358 -9.949 -5.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 46.410 -11.208 -5.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 45.855 -11.008 -4.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 45.662 -12.501 -5.034 1.00 0.00 H new ATOM 1829 N TYR A 114 45.404 -17.033 -6.057 1.00 0.00 N ATOM 1830 CA TYR A 114 46.756 -16.704 -6.475 1.00 0.00 C ATOM 1831 C TYR A 114 47.761 -17.722 -5.933 1.00 0.00 C ATOM 1832 O TYR A 114 47.577 -18.261 -4.842 1.00 0.00 O ATOM 1833 CB TYR A 114 47.061 -15.332 -5.872 1.00 0.00 C ATOM 1834 CG TYR A 114 48.409 -14.748 -6.303 1.00 0.00 C ATOM 1835 CD1 TYR A 114 49.577 -15.227 -5.747 1.00 0.00 C ATOM 1836 CD2 TYR A 114 48.455 -13.743 -7.248 1.00 0.00 C ATOM 1837 CE1 TYR A 114 50.845 -14.678 -6.153 1.00 0.00 C ATOM 1838 CE2 TYR A 114 49.722 -13.194 -7.654 1.00 0.00 C ATOM 1839 CZ TYR A 114 50.855 -13.689 -7.086 1.00 0.00 C ATOM 1840 OH TYR A 114 52.052 -13.170 -7.470 1.00 0.00 O ATOM 0 HA TYR A 114 46.834 -16.709 -7.562 1.00 0.00 H new ATOM 0 HB2 TYR A 114 46.269 -14.638 -6.154 1.00 0.00 H new ATOM 0 HB3 TYR A 114 47.042 -15.412 -4.785 1.00 0.00 H new ATOM 0 HD1 TYR A 114 49.541 -16.013 -5.008 1.00 0.00 H new ATOM 0 HD2 TYR A 114 47.540 -13.369 -7.683 1.00 0.00 H new ATOM 0 HE1 TYR A 114 51.767 -15.044 -5.726 1.00 0.00 H new ATOM 0 HE2 TYR A 114 49.772 -12.407 -8.392 1.00 0.00 H new ATOM 0 HH TYR A 114 52.310 -13.549 -8.336 1.00 0.00 H new ATOM 1850 N ALA A 115 48.802 -17.954 -6.718 1.00 0.00 N ATOM 1851 CA ALA A 115 49.837 -18.898 -6.330 1.00 0.00 C ATOM 1852 C ALA A 115 50.941 -18.901 -7.390 1.00 0.00 C ATOM 1853 O ALA A 115 50.747 -19.412 -8.492 1.00 0.00 O ATOM 1854 CB ALA A 115 49.216 -20.282 -6.130 1.00 0.00 C ATOM 0 H ALA A 115 48.952 -17.505 -7.621 1.00 0.00 H new ATOM 0 HA ALA A 115 50.290 -18.604 -5.383 1.00 0.00 H new ATOM 0 HB1 ALA A 115 49.992 -20.990 -5.839 1.00 0.00 H new ATOM 0 HB2 ALA A 115 48.459 -20.231 -5.348 1.00 0.00 H new ATOM 0 HB3 ALA A 115 48.754 -20.612 -7.061 1.00 0.00 H new ATOM 1860 N GLU A 116 52.075 -18.326 -7.018 1.00 0.00 N ATOM 1861 CA GLU A 116 53.210 -18.256 -7.923 1.00 0.00 C ATOM 1862 C GLU A 116 54.490 -18.686 -7.203 1.00 0.00 C ATOM 1863 O GLU A 116 55.124 -17.881 -6.523 1.00 0.00 O ATOM 1864 CB GLU A 116 53.357 -16.851 -8.511 1.00 0.00 C ATOM 1865 CG GLU A 116 52.678 -16.755 -9.878 1.00 0.00 C ATOM 1866 CD GLU A 116 52.154 -15.340 -10.132 1.00 0.00 C ATOM 1867 OE1 GLU A 116 52.896 -14.392 -9.796 1.00 0.00 O ATOM 1868 OE2 GLU A 116 51.024 -15.239 -10.657 1.00 0.00 O ATOM 0 H GLU A 116 52.232 -17.904 -6.103 1.00 0.00 H new ATOM 0 HA GLU A 116 53.033 -18.943 -8.750 1.00 0.00 H new ATOM 0 HB2 GLU A 116 52.918 -16.121 -7.831 1.00 0.00 H new ATOM 0 HB3 GLU A 116 54.414 -16.602 -8.608 1.00 0.00 H new ATOM 0 HG2 GLU A 116 53.386 -17.030 -10.660 1.00 0.00 H new ATOM 0 HG3 GLU A 116 51.854 -17.467 -9.929 1.00 0.00 H new ATOM 1875 N MET A 117 54.831 -19.955 -7.377 1.00 0.00 N ATOM 1876 CA MET A 117 56.023 -20.501 -6.752 1.00 0.00 C ATOM 1877 C MET A 117 57.033 -20.961 -7.806 1.00 0.00 C ATOM 1878 O MET A 117 56.718 -21.007 -8.994 1.00 0.00 O ATOM 1879 CB MET A 117 55.637 -21.685 -5.864 1.00 0.00 C ATOM 1880 CG MET A 117 54.990 -21.206 -4.562 1.00 0.00 C ATOM 1881 SD MET A 117 53.332 -20.629 -4.882 1.00 0.00 S ATOM 1882 CE MET A 117 53.287 -19.205 -3.806 1.00 0.00 C ATOM 0 H MET A 117 54.302 -20.620 -7.942 1.00 0.00 H new ATOM 0 HA MET A 117 56.485 -19.719 -6.150 1.00 0.00 H new ATOM 0 HB2 MET A 117 54.946 -22.336 -6.400 1.00 0.00 H new ATOM 0 HB3 MET A 117 56.523 -22.278 -5.637 1.00 0.00 H new ATOM 0 HG2 MET A 117 54.967 -22.019 -3.837 1.00 0.00 H new ATOM 0 HG3 MET A 117 55.585 -20.405 -4.124 1.00 0.00 H new ATOM 0 HE1 MET A 117 52.313 -18.722 -3.883 1.00 0.00 H new ATOM 0 HE2 MET A 117 53.455 -19.521 -2.777 1.00 0.00 H new ATOM 0 HE3 MET A 117 54.065 -18.501 -4.101 1.00 0.00 H new ATOM 1892 N ASP A 118 58.226 -21.291 -7.333 1.00 0.00 N ATOM 1893 CA ASP A 118 59.283 -21.746 -8.220 1.00 0.00 C ATOM 1894 C ASP A 118 60.479 -22.208 -7.385 1.00 0.00 C ATOM 1895 O ASP A 118 61.029 -21.436 -6.601 1.00 0.00 O ATOM 1896 CB ASP A 118 59.755 -20.617 -9.138 1.00 0.00 C ATOM 1897 CG ASP A 118 59.790 -19.230 -8.493 1.00 0.00 C ATOM 1898 OD1 ASP A 118 60.263 -19.153 -7.338 1.00 0.00 O ATOM 1899 OD2 ASP A 118 59.343 -18.278 -9.169 1.00 0.00 O ATOM 0 H ASP A 118 58.484 -21.252 -6.347 1.00 0.00 H new ATOM 0 HA ASP A 118 58.888 -22.562 -8.826 1.00 0.00 H new ATOM 0 HB2 ASP A 118 60.754 -20.858 -9.500 1.00 0.00 H new ATOM 0 HB3 ASP A 118 59.101 -20.580 -10.009 1.00 0.00 H new ATOM 1904 N PRO A 119 60.856 -23.499 -7.586 1.00 0.00 N ATOM 1905 CA PRO A 119 61.976 -24.073 -6.861 1.00 0.00 C ATOM 1906 C PRO A 119 63.308 -23.562 -7.415 1.00 0.00 C ATOM 1907 O PRO A 119 63.971 -22.739 -6.786 1.00 0.00 O ATOM 1908 CB PRO A 119 61.810 -25.577 -7.007 1.00 0.00 C ATOM 1909 CG PRO A 119 60.876 -25.780 -8.189 1.00 0.00 C ATOM 1910 CD PRO A 119 60.227 -24.443 -8.506 1.00 0.00 C ATOM 0 HA PRO A 119 61.987 -23.787 -5.809 1.00 0.00 H new ATOM 0 HB2 PRO A 119 62.771 -26.061 -7.181 1.00 0.00 H new ATOM 0 HB3 PRO A 119 61.393 -26.014 -6.100 1.00 0.00 H new ATOM 0 HG2 PRO A 119 61.428 -26.150 -9.053 1.00 0.00 H new ATOM 0 HG3 PRO A 119 60.117 -26.526 -7.952 1.00 0.00 H new ATOM 0 HD2 PRO A 119 60.396 -24.157 -9.544 1.00 0.00 H new ATOM 0 HD3 PRO A 119 59.148 -24.481 -8.358 1.00 0.00 H new ATOM 1918 N THR A 120 63.659 -24.071 -8.587 1.00 0.00 N ATOM 1919 CA THR A 120 64.899 -23.676 -9.233 1.00 0.00 C ATOM 1920 C THR A 120 64.863 -24.033 -10.721 1.00 0.00 C ATOM 1921 O THR A 120 64.053 -24.856 -11.146 1.00 0.00 O ATOM 1922 CB THR A 120 66.056 -24.335 -8.479 1.00 0.00 C ATOM 1923 OG1 THR A 120 67.221 -23.726 -9.029 1.00 0.00 O ATOM 1924 CG2 THR A 120 66.212 -25.817 -8.825 1.00 0.00 C ATOM 0 H THR A 120 63.106 -24.753 -9.106 1.00 0.00 H new ATOM 0 HA THR A 120 65.039 -22.596 -9.193 1.00 0.00 H new ATOM 0 HB THR A 120 65.897 -24.227 -7.406 1.00 0.00 H new ATOM 0 HG1 THR A 120 68.019 -24.094 -8.595 1.00 0.00 H new ATOM 0 HG21 THR A 120 67.047 -26.236 -8.263 1.00 0.00 H new ATOM 0 HG22 THR A 120 65.297 -26.349 -8.566 1.00 0.00 H new ATOM 0 HG23 THR A 120 66.404 -25.923 -9.893 1.00 0.00 H new ATOM 1932 N THR A 121 65.749 -23.395 -11.471 1.00 0.00 N ATOM 1933 CA THR A 121 65.828 -23.634 -12.902 1.00 0.00 C ATOM 1934 C THR A 121 67.289 -23.715 -13.349 1.00 0.00 C ATOM 1935 O THR A 121 67.939 -22.690 -13.547 1.00 0.00 O ATOM 1936 CB THR A 121 65.036 -22.534 -13.610 1.00 0.00 C ATOM 1937 OG1 THR A 121 65.784 -21.348 -13.354 1.00 0.00 O ATOM 1938 CG2 THR A 121 63.682 -22.269 -12.950 1.00 0.00 C ATOM 0 H THR A 121 66.418 -22.713 -11.115 1.00 0.00 H new ATOM 0 HA THR A 121 65.386 -24.594 -13.168 1.00 0.00 H new ATOM 0 HB THR A 121 64.883 -22.812 -14.653 1.00 0.00 H new ATOM 0 HG1 THR A 121 66.719 -21.490 -13.609 1.00 0.00 H new ATOM 0 HG21 THR A 121 63.161 -21.480 -13.492 1.00 0.00 H new ATOM 0 HG22 THR A 121 63.083 -23.179 -12.970 1.00 0.00 H new ATOM 0 HG23 THR A 121 63.836 -21.959 -11.916 1.00 0.00 H new ATOM 1946 N ALA A 122 67.763 -24.944 -13.495 1.00 0.00 N ATOM 1947 CA ALA A 122 69.135 -25.172 -13.915 1.00 0.00 C ATOM 1948 C ALA A 122 69.437 -26.671 -13.863 1.00 0.00 C ATOM 1949 O ALA A 122 68.619 -27.457 -13.386 1.00 0.00 O ATOM 1950 CB ALA A 122 70.082 -24.356 -13.032 1.00 0.00 C ATOM 0 H ALA A 122 67.221 -25.792 -13.330 1.00 0.00 H new ATOM 0 HA ALA A 122 69.281 -24.841 -14.943 1.00 0.00 H new ATOM 0 HB1 ALA A 122 71.111 -24.527 -13.347 1.00 0.00 H new ATOM 0 HB2 ALA A 122 69.845 -23.296 -13.126 1.00 0.00 H new ATOM 0 HB3 ALA A 122 69.965 -24.663 -11.993 1.00 0.00 H new ATOM 1956 N ALA A 123 70.614 -27.023 -14.360 1.00 0.00 N ATOM 1957 CA ALA A 123 71.034 -28.414 -14.376 1.00 0.00 C ATOM 1958 C ALA A 123 72.544 -28.489 -14.138 1.00 0.00 C ATOM 1959 O ALA A 123 73.191 -27.468 -13.910 1.00 0.00 O ATOM 1960 CB ALA A 123 70.620 -29.057 -15.701 1.00 0.00 C ATOM 0 H ALA A 123 71.290 -26.369 -14.755 1.00 0.00 H new ATOM 0 HA ALA A 123 70.546 -28.972 -13.577 1.00 0.00 H new ATOM 0 HB1 ALA A 123 70.935 -30.100 -15.713 1.00 0.00 H new ATOM 0 HB2 ALA A 123 69.537 -29.004 -15.808 1.00 0.00 H new ATOM 0 HB3 ALA A 123 71.093 -28.526 -16.527 1.00 0.00 H new ATOM 1966 N LEU A 124 73.060 -29.707 -14.200 1.00 0.00 N ATOM 1967 CA LEU A 124 74.481 -29.929 -13.994 1.00 0.00 C ATOM 1968 C LEU A 124 75.106 -30.445 -15.292 1.00 0.00 C ATOM 1969 O LEU A 124 75.239 -29.699 -16.261 1.00 0.00 O ATOM 1970 CB LEU A 124 74.712 -30.848 -12.792 1.00 0.00 C ATOM 1971 CG LEU A 124 73.714 -31.996 -12.625 1.00 0.00 C ATOM 1972 CD1 LEU A 124 74.423 -33.279 -12.187 1.00 0.00 C ATOM 1973 CD2 LEU A 124 72.588 -31.608 -11.665 1.00 0.00 C ATOM 0 H LEU A 124 72.520 -30.551 -14.390 1.00 0.00 H new ATOM 0 HA LEU A 124 74.981 -28.992 -13.750 1.00 0.00 H new ATOM 0 HB2 LEU A 124 75.713 -31.272 -12.871 1.00 0.00 H new ATOM 0 HB3 LEU A 124 74.693 -30.241 -11.887 1.00 0.00 H new ATOM 0 HG LEU A 124 73.257 -32.195 -13.594 1.00 0.00 H new ATOM 0 HD11 LEU A 124 73.691 -34.079 -12.076 1.00 0.00 H new ATOM 0 HD12 LEU A 124 75.159 -33.563 -12.939 1.00 0.00 H new ATOM 0 HD13 LEU A 124 74.924 -33.110 -11.234 1.00 0.00 H new ATOM 0 HD21 LEU A 124 71.893 -32.441 -11.564 1.00 0.00 H new ATOM 0 HD22 LEU A 124 73.009 -31.366 -10.689 1.00 0.00 H new ATOM 0 HD23 LEU A 124 72.059 -30.739 -12.057 1.00 0.00 H new ATOM 1985 N GLU A 125 75.472 -31.719 -15.269 1.00 0.00 N ATOM 1986 CA GLU A 125 76.079 -32.343 -16.432 1.00 0.00 C ATOM 1987 C GLU A 125 77.468 -31.753 -16.687 1.00 0.00 C ATOM 1988 O GLU A 125 77.640 -30.536 -16.675 1.00 0.00 O ATOM 1989 CB GLU A 125 75.185 -32.194 -17.664 1.00 0.00 C ATOM 1990 CG GLU A 125 75.762 -32.961 -18.856 1.00 0.00 C ATOM 1991 CD GLU A 125 75.106 -34.336 -18.993 1.00 0.00 C ATOM 1992 OE1 GLU A 125 73.856 -34.373 -18.974 1.00 0.00 O ATOM 1993 OE2 GLU A 125 75.868 -35.320 -19.112 1.00 0.00 O ATOM 0 H GLU A 125 75.360 -32.335 -14.464 1.00 0.00 H new ATOM 0 HA GLU A 125 76.190 -33.409 -16.232 1.00 0.00 H new ATOM 0 HB2 GLU A 125 74.185 -32.564 -17.439 1.00 0.00 H new ATOM 0 HB3 GLU A 125 75.085 -31.139 -17.920 1.00 0.00 H new ATOM 0 HG2 GLU A 125 75.608 -32.388 -19.770 1.00 0.00 H new ATOM 0 HG3 GLU A 125 76.838 -33.079 -18.731 1.00 0.00 H new ATOM 2000 N LYS A 126 78.422 -32.645 -16.912 1.00 0.00 N ATOM 2001 CA LYS A 126 79.790 -32.227 -17.169 1.00 0.00 C ATOM 2002 C LYS A 126 80.599 -33.426 -17.670 1.00 0.00 C ATOM 2003 O LYS A 126 80.051 -34.509 -17.868 1.00 0.00 O ATOM 2004 CB LYS A 126 80.388 -31.556 -15.931 1.00 0.00 C ATOM 2005 CG LYS A 126 80.384 -30.033 -16.078 1.00 0.00 C ATOM 2006 CD LYS A 126 81.807 -29.493 -16.230 1.00 0.00 C ATOM 2007 CE LYS A 126 82.275 -29.581 -17.684 1.00 0.00 C ATOM 2008 NZ LYS A 126 82.222 -28.249 -18.327 1.00 0.00 N ATOM 0 H LYS A 126 78.275 -33.654 -16.922 1.00 0.00 H new ATOM 0 HA LYS A 126 79.816 -31.472 -17.955 1.00 0.00 H new ATOM 0 HB2 LYS A 126 79.818 -31.841 -15.047 1.00 0.00 H new ATOM 0 HB3 LYS A 126 81.408 -31.908 -15.779 1.00 0.00 H new ATOM 0 HG2 LYS A 126 79.789 -29.749 -16.946 1.00 0.00 H new ATOM 0 HG3 LYS A 126 79.911 -29.581 -15.206 1.00 0.00 H new ATOM 0 HD2 LYS A 126 81.844 -28.457 -15.894 1.00 0.00 H new ATOM 0 HD3 LYS A 126 82.485 -30.059 -15.591 1.00 0.00 H new ATOM 0 HE2 LYS A 126 83.293 -29.969 -17.722 1.00 0.00 H new ATOM 0 HE3 LYS A 126 81.646 -30.282 -18.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 82.543 -28.327 -19.313 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 81.245 -27.893 -18.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 82.841 -27.590 -17.812 1.00 0.00 H new ATOM 2022 N GLU A 127 81.889 -33.191 -17.859 1.00 0.00 N ATOM 2023 CA GLU A 127 82.778 -34.238 -18.332 1.00 0.00 C ATOM 2024 C GLU A 127 84.237 -33.846 -18.088 1.00 0.00 C ATOM 2025 O GLU A 127 84.590 -32.671 -18.171 1.00 0.00 O ATOM 2026 CB GLU A 127 82.532 -34.540 -19.812 1.00 0.00 C ATOM 2027 CG GLU A 127 82.959 -33.361 -20.690 1.00 0.00 C ATOM 2028 CD GLU A 127 82.019 -33.201 -21.886 1.00 0.00 C ATOM 2029 OE1 GLU A 127 80.799 -33.086 -21.638 1.00 0.00 O ATOM 2030 OE2 GLU A 127 82.541 -33.196 -23.022 1.00 0.00 O ATOM 0 H GLU A 127 82.340 -32.291 -17.693 1.00 0.00 H new ATOM 0 HA GLU A 127 82.567 -35.148 -17.770 1.00 0.00 H new ATOM 0 HB2 GLU A 127 83.086 -35.433 -20.102 1.00 0.00 H new ATOM 0 HB3 GLU A 127 81.475 -34.754 -19.973 1.00 0.00 H new ATOM 0 HG2 GLU A 127 82.961 -32.445 -20.099 1.00 0.00 H new ATOM 0 HG3 GLU A 127 83.979 -33.516 -21.042 1.00 0.00 H new ATOM 2037 N SER A 128 85.045 -34.853 -17.791 1.00 0.00 N ATOM 2038 CA SER A 128 86.458 -34.628 -17.534 1.00 0.00 C ATOM 2039 C SER A 128 87.166 -35.964 -17.300 1.00 0.00 C ATOM 2040 O SER A 128 86.630 -36.846 -16.632 1.00 0.00 O ATOM 2041 CB SER A 128 86.658 -33.703 -16.332 1.00 0.00 C ATOM 2042 OG SER A 128 86.115 -34.257 -15.136 1.00 0.00 O ATOM 0 H SER A 128 84.749 -35.827 -17.723 1.00 0.00 H new ATOM 0 HA SER A 128 86.892 -34.142 -18.408 1.00 0.00 H new ATOM 0 HB2 SER A 128 87.722 -33.514 -16.193 1.00 0.00 H new ATOM 0 HB3 SER A 128 86.187 -32.741 -16.533 1.00 0.00 H new ATOM 0 HG SER A 128 86.264 -33.638 -14.391 1.00 0.00 H new ATOM 2048 N GLY A 129 88.360 -36.070 -17.864 1.00 0.00 N ATOM 2049 CA GLY A 129 89.148 -37.284 -17.726 1.00 0.00 C ATOM 2050 C GLY A 129 90.543 -37.103 -18.327 1.00 0.00 C ATOM 2051 O GLY A 129 90.744 -36.258 -19.197 1.00 0.00 O ATOM 0 H GLY A 129 88.801 -35.336 -18.417 1.00 0.00 H new ATOM 0 HA2 GLY A 129 89.234 -37.548 -16.672 1.00 0.00 H new ATOM 0 HA3 GLY A 129 88.639 -38.111 -18.222 1.00 0.00 H new ATOM 2055 N PRO A 130 91.497 -37.933 -17.825 1.00 0.00 N ATOM 2056 CA PRO A 130 92.868 -37.874 -18.303 1.00 0.00 C ATOM 2057 C PRO A 130 92.993 -38.510 -19.688 1.00 0.00 C ATOM 2058 O PRO A 130 91.993 -38.898 -20.290 1.00 0.00 O ATOM 2059 CB PRO A 130 93.685 -38.593 -17.242 1.00 0.00 C ATOM 2060 CG PRO A 130 92.695 -39.429 -16.448 1.00 0.00 C ATOM 2061 CD PRO A 130 91.296 -38.947 -16.793 1.00 0.00 C ATOM 0 HA PRO A 130 93.224 -36.853 -18.436 1.00 0.00 H new ATOM 0 HB2 PRO A 130 94.450 -39.222 -17.698 1.00 0.00 H new ATOM 0 HB3 PRO A 130 94.200 -37.881 -16.597 1.00 0.00 H new ATOM 0 HG2 PRO A 130 92.806 -40.486 -16.692 1.00 0.00 H new ATOM 0 HG3 PRO A 130 92.881 -39.328 -15.379 1.00 0.00 H new ATOM 0 HD2 PRO A 130 90.674 -39.765 -17.157 1.00 0.00 H new ATOM 0 HD3 PRO A 130 90.794 -38.529 -15.920 1.00 0.00 H new ATOM 2069 N SER A 131 94.231 -38.598 -20.154 1.00 0.00 N ATOM 2070 CA SER A 131 94.500 -39.181 -21.458 1.00 0.00 C ATOM 2071 C SER A 131 95.555 -40.281 -21.330 1.00 0.00 C ATOM 2072 O SER A 131 95.267 -41.453 -21.568 1.00 0.00 O ATOM 2073 CB SER A 131 94.962 -38.115 -22.453 1.00 0.00 C ATOM 2074 OG SER A 131 96.321 -37.741 -22.242 1.00 0.00 O ATOM 0 H SER A 131 95.058 -38.275 -19.652 1.00 0.00 H new ATOM 0 HA SER A 131 93.575 -39.615 -21.837 1.00 0.00 H new ATOM 0 HB2 SER A 131 94.843 -38.492 -23.469 1.00 0.00 H new ATOM 0 HB3 SER A 131 94.326 -37.235 -22.363 1.00 0.00 H new ATOM 0 HG SER A 131 96.390 -37.208 -21.423 1.00 0.00 H new ATOM 2080 N SER A 132 96.756 -39.865 -20.956 1.00 0.00 N ATOM 2081 CA SER A 132 97.856 -40.801 -20.795 1.00 0.00 C ATOM 2082 C SER A 132 99.051 -40.098 -20.148 1.00 0.00 C ATOM 2083 O SER A 132 99.129 -38.870 -20.150 1.00 0.00 O ATOM 2084 CB SER A 132 98.262 -41.411 -22.138 1.00 0.00 C ATOM 2085 OG SER A 132 98.927 -42.661 -21.977 1.00 0.00 O ATOM 0 H SER A 132 96.992 -38.892 -20.760 1.00 0.00 H new ATOM 0 HA SER A 132 97.523 -41.611 -20.145 1.00 0.00 H new ATOM 0 HB2 SER A 132 97.375 -41.549 -22.756 1.00 0.00 H new ATOM 0 HB3 SER A 132 98.916 -40.718 -22.668 1.00 0.00 H new ATOM 0 HG SER A 132 99.168 -43.019 -22.857 1.00 0.00 H new ATOM 2091 N GLY A 133 99.953 -40.906 -19.612 1.00 0.00 N ATOM 2092 CA GLY A 133 101.141 -40.376 -18.963 1.00 0.00 C ATOM 2093 C GLY A 133 102.229 -40.056 -19.990 1.00 0.00 C ATOM 2094 O GLY A 133 103.339 -39.672 -19.624 1.00 0.00 O ATOM 0 H GLY A 133 99.886 -41.924 -19.613 1.00 0.00 H new ATOM 0 HA2 GLY A 133 100.884 -39.475 -18.407 1.00 0.00 H new ATOM 0 HA3 GLY A 133 101.519 -41.100 -18.241 1.00 0.00 H new