USER MOD reduce.3.24.130724 H: found=0, std=0, add=668, rem=0, adj=19 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 -52:sc= 0.524 USER MOD Set 1.2: A 51 TYR OH : rot 30:sc= 0.953 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot -138:sc= 0.0268 USER MOD Single : A 29 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 35 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -0.0125 X(o=-0.012,f=-0.025) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 HIS : no HD1:sc= -0.11 X(o=-0.11,f=0) USER MOD Single : A 64 LYS NZ :NH3+ 165:sc= 0.0326 (180deg=0.0102) USER MOD Single : A 65 ASN : amide:sc=-0.00573 X(o=-0.0057,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= -0.161 USER MOD Single : A 99 ASN : amide:sc= -0.473 K(o=-0.47,f=-2.4!) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,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 X(o=0,f=0) USER MOD Single : A 108 ASN : amide:sc=-0.00504 X(o=-0.005,f=-0.0026) USER MOD Single : A 109 HIS :FLIP no HD1:sc= -1.02 F(o=-3.2!,f=-1) USER MOD Single : A 111 GLN :FLIP amide:sc= -3.62! C(o=-4.4!,f=-3.6!) USER MOD Single : A 112 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0152) USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 MET CE :methyl -115:sc= -2.92 (180deg=-6.03!) USER MOD Single : A 120 THR OG1 : rot 180:sc= -0.187 USER MOD Single : A 121 THR OG1 : rot -13:sc= 0.599 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 SER OG : rot 60:sc= 0.00164 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 140 N VAL A 13 -59.291 -3.929 6.387 1.00 0.00 N ATOM 141 CA VAL A 13 -59.153 -2.513 6.677 1.00 0.00 C ATOM 142 C VAL A 13 -59.699 -2.227 8.078 1.00 0.00 C ATOM 143 O VAL A 13 -60.625 -2.895 8.535 1.00 0.00 O ATOM 144 CB VAL A 13 -59.840 -1.686 5.588 1.00 0.00 C ATOM 145 CG1 VAL A 13 -60.243 -0.308 6.118 1.00 0.00 C ATOM 146 CG2 VAL A 13 -58.947 -1.558 4.352 1.00 0.00 C ATOM 0 HA VAL A 13 -58.102 -2.224 6.672 1.00 0.00 H new ATOM 0 HB VAL A 13 -60.749 -2.210 5.292 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -60.729 0.259 5.324 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -60.933 -0.427 6.954 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -59.355 0.227 6.454 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -59.459 -0.966 3.593 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -58.013 -1.067 4.627 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -58.732 -2.550 3.954 1.00 0.00 H new ATOM 156 N GLU A 14 -59.102 -1.235 8.720 1.00 0.00 N ATOM 157 CA GLU A 14 -59.516 -0.853 10.060 1.00 0.00 C ATOM 158 C GLU A 14 -59.914 0.624 10.091 1.00 0.00 C ATOM 159 O GLU A 14 -59.299 1.451 9.419 1.00 0.00 O ATOM 160 CB GLU A 14 -58.414 -1.146 11.079 1.00 0.00 C ATOM 161 CG GLU A 14 -58.068 -2.636 11.100 1.00 0.00 C ATOM 162 CD GLU A 14 -56.555 -2.849 11.018 1.00 0.00 C ATOM 163 OE1 GLU A 14 -55.952 -2.278 10.084 1.00 0.00 O ATOM 164 OE2 GLU A 14 -56.037 -3.578 11.891 1.00 0.00 O ATOM 0 H GLU A 14 -58.334 -0.683 8.338 1.00 0.00 H new ATOM 0 HA GLU A 14 -60.386 -1.449 10.335 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -57.524 -0.566 10.834 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -58.738 -0.830 12.071 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -58.454 -3.090 12.013 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -58.555 -3.138 10.264 1.00 0.00 H new ATOM 171 N ILE A 15 -60.940 0.911 10.879 1.00 0.00 N ATOM 172 CA ILE A 15 -61.428 2.274 11.007 1.00 0.00 C ATOM 173 C ILE A 15 -60.716 2.957 12.176 1.00 0.00 C ATOM 174 O ILE A 15 -60.316 2.298 13.135 1.00 0.00 O ATOM 175 CB ILE A 15 -62.953 2.289 11.122 1.00 0.00 C ATOM 176 CG1 ILE A 15 -63.586 1.292 10.149 1.00 0.00 C ATOM 177 CG2 ILE A 15 -63.503 3.704 10.931 1.00 0.00 C ATOM 178 CD1 ILE A 15 -63.470 1.785 8.705 1.00 0.00 C ATOM 0 H ILE A 15 -61.447 0.223 11.435 1.00 0.00 H new ATOM 0 HA ILE A 15 -61.194 2.848 10.111 1.00 0.00 H new ATOM 0 HB ILE A 15 -63.223 1.972 12.129 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -63.097 0.323 10.246 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -64.636 1.146 10.404 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -64.589 3.687 11.017 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -63.088 4.362 11.695 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -63.223 4.073 9.944 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -63.928 1.058 8.034 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -63.981 2.743 8.605 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -62.418 1.906 8.445 1.00 0.00 H new ATOM 190 N GLY A 16 -60.580 4.270 12.059 1.00 0.00 N ATOM 191 CA GLY A 16 -59.924 5.050 13.094 1.00 0.00 C ATOM 192 C GLY A 16 -58.437 5.233 12.784 1.00 0.00 C ATOM 193 O GLY A 16 -57.810 6.176 13.264 1.00 0.00 O ATOM 0 H GLY A 16 -60.913 4.813 11.263 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -60.404 6.025 13.179 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -60.040 4.553 14.057 1.00 0.00 H new ATOM 197 N GLU A 17 -57.915 4.316 11.982 1.00 0.00 N ATOM 198 CA GLU A 17 -56.514 4.364 11.601 1.00 0.00 C ATOM 199 C GLU A 17 -56.344 5.153 10.301 1.00 0.00 C ATOM 200 O GLU A 17 -57.318 5.415 9.598 1.00 0.00 O ATOM 201 CB GLU A 17 -55.933 2.955 11.467 1.00 0.00 C ATOM 202 CG GLU A 17 -54.925 2.670 12.582 1.00 0.00 C ATOM 203 CD GLU A 17 -53.855 3.761 12.647 1.00 0.00 C ATOM 204 OE1 GLU A 17 -53.077 3.851 11.672 1.00 0.00 O ATOM 205 OE2 GLU A 17 -53.839 4.481 13.669 1.00 0.00 O ATOM 0 H GLU A 17 -58.438 3.535 11.586 1.00 0.00 H new ATOM 0 HA GLU A 17 -55.961 4.876 12.389 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -56.738 2.221 11.503 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -55.448 2.849 10.497 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -55.444 2.607 13.539 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -54.453 1.703 12.411 1.00 0.00 H new ATOM 212 N THR A 18 -55.099 5.509 10.021 1.00 0.00 N ATOM 213 CA THR A 18 -54.788 6.262 8.818 1.00 0.00 C ATOM 214 C THR A 18 -54.105 5.362 7.786 1.00 0.00 C ATOM 215 O THR A 18 -53.182 4.621 8.119 1.00 0.00 O ATOM 216 CB THR A 18 -53.944 7.472 9.223 1.00 0.00 C ATOM 217 OG1 THR A 18 -54.750 8.154 10.180 1.00 0.00 O ATOM 218 CG2 THR A 18 -53.784 8.482 8.084 1.00 0.00 C ATOM 0 H THR A 18 -54.293 5.290 10.607 1.00 0.00 H new ATOM 0 HA THR A 18 -55.694 6.627 8.334 1.00 0.00 H new ATOM 0 HB THR A 18 -52.961 7.135 9.550 1.00 0.00 H new ATOM 0 HG1 THR A 18 -54.277 8.952 10.497 1.00 0.00 H new ATOM 0 HG21 THR A 18 -53.177 9.321 8.424 1.00 0.00 H new ATOM 0 HG22 THR A 18 -53.295 8.001 7.237 1.00 0.00 H new ATOM 0 HG23 THR A 18 -54.766 8.845 7.779 1.00 0.00 H new ATOM 226 N TYR A 19 -54.586 5.457 6.555 1.00 0.00 N ATOM 227 CA TYR A 19 -54.034 4.660 5.473 1.00 0.00 C ATOM 228 C TYR A 19 -53.635 5.545 4.290 1.00 0.00 C ATOM 229 O TYR A 19 -54.127 6.664 4.153 1.00 0.00 O ATOM 230 CB TYR A 19 -55.152 3.714 5.032 1.00 0.00 C ATOM 231 CG TYR A 19 -55.526 2.663 6.080 1.00 0.00 C ATOM 232 CD1 TYR A 19 -56.090 3.053 7.278 1.00 0.00 C ATOM 233 CD2 TYR A 19 -55.301 1.325 5.826 1.00 0.00 C ATOM 234 CE1 TYR A 19 -56.442 2.064 8.264 1.00 0.00 C ATOM 235 CE2 TYR A 19 -55.653 0.336 6.812 1.00 0.00 C ATOM 236 CZ TYR A 19 -56.206 0.755 7.982 1.00 0.00 C ATOM 237 OH TYR A 19 -56.539 -0.180 8.913 1.00 0.00 O ATOM 0 H TYR A 19 -55.352 6.074 6.283 1.00 0.00 H new ATOM 0 HA TYR A 19 -53.143 4.127 5.805 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -56.037 4.302 4.790 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -54.846 3.207 4.117 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -56.267 4.100 7.476 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -54.861 1.020 4.888 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -56.883 2.355 9.206 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -55.482 -0.714 6.627 1.00 0.00 H new ATOM 0 HH TYR A 19 -55.827 -0.851 8.972 1.00 0.00 H new ATOM 247 N LEU A 20 -52.747 5.009 3.465 1.00 0.00 N ATOM 248 CA LEU A 20 -52.276 5.736 2.298 1.00 0.00 C ATOM 249 C LEU A 20 -53.242 5.503 1.134 1.00 0.00 C ATOM 250 O LEU A 20 -53.489 4.362 0.747 1.00 0.00 O ATOM 251 CB LEU A 20 -50.828 5.359 1.980 1.00 0.00 C ATOM 252 CG LEU A 20 -49.831 5.493 3.133 1.00 0.00 C ATOM 253 CD1 LEU A 20 -49.783 6.931 3.652 1.00 0.00 C ATOM 254 CD2 LEU A 20 -50.144 4.492 4.247 1.00 0.00 C ATOM 0 H LEU A 20 -52.342 4.080 3.582 1.00 0.00 H new ATOM 0 HA LEU A 20 -52.266 6.808 2.495 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -50.811 4.327 1.629 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -50.484 5.982 1.154 1.00 0.00 H new ATOM 0 HG LEU A 20 -48.837 5.254 2.755 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -49.067 6.999 4.471 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -49.477 7.599 2.846 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -50.771 7.222 4.009 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -49.421 4.608 5.054 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -51.148 4.676 4.630 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -50.087 3.478 3.852 1.00 0.00 H new ATOM 266 N CYS A 21 -53.761 6.603 0.609 1.00 0.00 N ATOM 267 CA CYS A 21 -54.694 6.534 -0.503 1.00 0.00 C ATOM 268 C CYS A 21 -53.983 7.039 -1.759 1.00 0.00 C ATOM 269 O CYS A 21 -53.392 8.118 -1.751 1.00 0.00 O ATOM 270 CB CYS A 21 -55.975 7.320 -0.217 1.00 0.00 C ATOM 271 SG CYS A 21 -57.068 7.291 -1.684 1.00 0.00 S ATOM 0 H CYS A 21 -53.553 7.548 0.933 1.00 0.00 H new ATOM 0 HA CYS A 21 -55.007 5.501 -0.655 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -56.492 6.889 0.640 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -55.729 8.350 0.043 1.00 0.00 H new ATOM 0 HG CYS A 21 -56.398 7.668 -2.732 1.00 0.00 H new ATOM 277 N ARG A 22 -54.063 6.235 -2.810 1.00 0.00 N ATOM 278 CA ARG A 22 -53.434 6.588 -4.071 1.00 0.00 C ATOM 279 C ARG A 22 -53.971 7.929 -4.576 1.00 0.00 C ATOM 280 O ARG A 22 -55.166 8.200 -4.476 1.00 0.00 O ATOM 281 CB ARG A 22 -53.686 5.514 -5.131 1.00 0.00 C ATOM 282 CG ARG A 22 -52.446 5.301 -6.002 1.00 0.00 C ATOM 283 CD ARG A 22 -52.219 3.813 -6.277 1.00 0.00 C ATOM 284 NE ARG A 22 -52.063 3.585 -7.731 1.00 0.00 N ATOM 285 CZ ARG A 22 -50.942 3.848 -8.417 1.00 0.00 C ATOM 286 NH1 ARG A 22 -49.872 4.348 -7.784 1.00 0.00 N ATOM 287 NH2 ARG A 22 -50.891 3.610 -9.734 1.00 0.00 N ATOM 0 H ARG A 22 -54.554 5.341 -2.814 1.00 0.00 H new ATOM 0 HA ARG A 22 -52.361 6.666 -3.896 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -53.960 4.577 -4.646 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -54.529 5.807 -5.757 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -52.563 5.835 -6.945 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -51.571 5.720 -5.505 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -51.330 3.469 -5.749 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -53.060 3.232 -5.898 1.00 0.00 H new ATOM 0 HE ARG A 22 -52.858 3.204 -8.243 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -49.911 4.528 -6.781 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -49.019 4.548 -8.305 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -51.705 3.229 -10.215 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -50.038 3.810 -10.256 1.00 0.00 H new ATOM 376 N TRP A 28 -48.725 8.942 -2.961 1.00 0.00 N ATOM 377 CA TRP A 28 -49.823 8.608 -2.069 1.00 0.00 C ATOM 378 C TRP A 28 -49.961 9.736 -1.046 1.00 0.00 C ATOM 379 O TRP A 28 -49.009 10.473 -0.797 1.00 0.00 O ATOM 380 CB TRP A 28 -49.608 7.237 -1.424 1.00 0.00 C ATOM 381 CG TRP A 28 -49.654 6.070 -2.411 1.00 0.00 C ATOM 382 CD1 TRP A 28 -49.036 5.967 -3.596 1.00 0.00 C ATOM 383 CD2 TRP A 28 -50.384 4.836 -2.250 1.00 0.00 C ATOM 384 NE1 TRP A 28 -49.314 4.761 -4.208 1.00 0.00 N ATOM 385 CE2 TRP A 28 -50.160 4.052 -3.364 1.00 0.00 C ATOM 386 CE3 TRP A 28 -51.207 4.396 -1.199 1.00 0.00 C ATOM 387 CZ2 TRP A 28 -50.722 2.781 -3.532 1.00 0.00 C ATOM 388 CZ3 TRP A 28 -51.762 3.124 -1.383 1.00 0.00 C ATOM 389 CH2 TRP A 28 -51.546 2.322 -2.497 1.00 0.00 C ATOM 0 HA TRP A 28 -50.758 8.525 -2.623 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -48.643 7.233 -0.917 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -50.370 7.083 -0.660 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -48.401 6.731 -4.019 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -48.963 4.448 -5.113 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -51.396 4.992 -0.319 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -50.530 2.186 -4.413 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -52.403 2.739 -0.604 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -52.011 1.350 -2.564 1.00 0.00 H new ATOM 400 N HIS A 29 -51.155 9.835 -0.479 1.00 0.00 N ATOM 401 CA HIS A 29 -51.429 10.861 0.513 1.00 0.00 C ATOM 402 C HIS A 29 -52.220 10.255 1.673 1.00 0.00 C ATOM 403 O HIS A 29 -53.319 9.737 1.478 1.00 0.00 O ATOM 404 CB HIS A 29 -52.138 12.058 -0.126 1.00 0.00 C ATOM 405 CG HIS A 29 -51.230 12.943 -0.947 1.00 0.00 C ATOM 406 ND1 HIS A 29 -50.242 13.732 -0.383 1.00 0.00 N ATOM 407 CD2 HIS A 29 -51.170 13.154 -2.293 1.00 0.00 C ATOM 408 CE1 HIS A 29 -49.623 14.385 -1.355 1.00 0.00 C ATOM 409 NE2 HIS A 29 -50.200 14.025 -2.538 1.00 0.00 N ATOM 0 H HIS A 29 -51.943 9.222 -0.688 1.00 0.00 H new ATOM 0 HA HIS A 29 -50.491 11.241 0.918 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -52.944 11.693 -0.762 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -52.598 12.657 0.660 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -51.805 12.691 -3.034 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -48.805 15.080 -1.233 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -49.930 14.369 -3.459 1.00 0.00 H new ATOM 417 N SER A 30 -51.630 10.339 2.857 1.00 0.00 N ATOM 418 CA SER A 30 -52.266 9.805 4.049 1.00 0.00 C ATOM 419 C SER A 30 -53.735 10.227 4.093 1.00 0.00 C ATOM 420 O SER A 30 -54.073 11.351 3.724 1.00 0.00 O ATOM 421 CB SER A 30 -51.542 10.269 5.314 1.00 0.00 C ATOM 422 OG SER A 30 -51.257 11.666 5.284 1.00 0.00 O ATOM 0 H SER A 30 -50.719 10.769 3.016 1.00 0.00 H new ATOM 0 HA SER A 30 -52.209 8.717 4.008 1.00 0.00 H new ATOM 0 HB2 SER A 30 -52.155 10.043 6.186 1.00 0.00 H new ATOM 0 HB3 SER A 30 -50.612 9.711 5.425 1.00 0.00 H new ATOM 0 HG SER A 30 -50.796 11.924 6.110 1.00 0.00 H new ATOM 428 N ALA A 31 -54.570 9.305 4.548 1.00 0.00 N ATOM 429 CA ALA A 31 -55.996 9.568 4.645 1.00 0.00 C ATOM 430 C ALA A 31 -56.592 8.715 5.767 1.00 0.00 C ATOM 431 O ALA A 31 -56.430 7.496 5.778 1.00 0.00 O ATOM 432 CB ALA A 31 -56.658 9.298 3.292 1.00 0.00 C ATOM 0 H ALA A 31 -54.286 8.374 4.854 1.00 0.00 H new ATOM 0 HA ALA A 31 -56.178 10.614 4.894 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -57.728 9.495 3.364 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -56.219 9.949 2.536 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -56.499 8.257 3.011 1.00 0.00 H new ATOM 438 N GLU A 32 -57.271 9.390 6.683 1.00 0.00 N ATOM 439 CA GLU A 32 -57.892 8.710 7.806 1.00 0.00 C ATOM 440 C GLU A 32 -59.177 8.010 7.358 1.00 0.00 C ATOM 441 O GLU A 32 -60.031 8.622 6.718 1.00 0.00 O ATOM 442 CB GLU A 32 -58.170 9.684 8.952 1.00 0.00 C ATOM 443 CG GLU A 32 -59.256 10.690 8.566 1.00 0.00 C ATOM 444 CD GLU A 32 -59.644 11.564 9.760 1.00 0.00 C ATOM 445 OE1 GLU A 32 -59.775 10.991 10.864 1.00 0.00 O ATOM 446 OE2 GLU A 32 -59.802 12.785 9.543 1.00 0.00 O ATOM 0 H GLU A 32 -57.404 10.401 6.670 1.00 0.00 H new ATOM 0 HA GLU A 32 -57.199 7.954 8.176 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -58.481 9.130 9.838 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -57.254 10.214 9.213 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -58.900 11.320 7.751 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -60.134 10.159 8.199 1.00 0.00 H new ATOM 453 N VAL A 33 -59.274 6.737 7.712 1.00 0.00 N ATOM 454 CA VAL A 33 -60.440 5.947 7.354 1.00 0.00 C ATOM 455 C VAL A 33 -61.585 6.272 8.316 1.00 0.00 C ATOM 456 O VAL A 33 -61.617 5.772 9.439 1.00 0.00 O ATOM 457 CB VAL A 33 -60.079 4.460 7.334 1.00 0.00 C ATOM 458 CG1 VAL A 33 -61.334 3.594 7.206 1.00 0.00 C ATOM 459 CG2 VAL A 33 -59.084 4.153 6.214 1.00 0.00 C ATOM 0 H VAL A 33 -58.564 6.233 8.243 1.00 0.00 H new ATOM 0 HA VAL A 33 -60.778 6.199 6.349 1.00 0.00 H new ATOM 0 HB VAL A 33 -59.600 4.218 8.283 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -61.050 2.542 7.194 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -61.994 3.782 8.053 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -61.853 3.840 6.280 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -58.844 3.090 6.222 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -59.525 4.419 5.253 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -58.173 4.732 6.368 1.00 0.00 H new ATOM 469 N ILE A 34 -62.496 7.107 7.840 1.00 0.00 N ATOM 470 CA ILE A 34 -63.640 7.505 8.643 1.00 0.00 C ATOM 471 C ILE A 34 -64.481 6.269 8.971 1.00 0.00 C ATOM 472 O ILE A 34 -64.630 5.906 10.137 1.00 0.00 O ATOM 473 CB ILE A 34 -64.425 8.616 7.945 1.00 0.00 C ATOM 474 CG1 ILE A 34 -63.503 9.769 7.542 1.00 0.00 C ATOM 475 CG2 ILE A 34 -65.592 9.092 8.813 1.00 0.00 C ATOM 476 CD1 ILE A 34 -63.477 10.853 8.621 1.00 0.00 C ATOM 0 H ILE A 34 -62.466 7.519 6.908 1.00 0.00 H new ATOM 0 HA ILE A 34 -63.311 7.929 9.592 1.00 0.00 H new ATOM 0 HB ILE A 34 -64.851 8.209 7.028 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -62.494 9.392 7.376 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -63.842 10.198 6.599 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -66.134 9.882 8.293 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -66.266 8.257 9.007 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -65.209 9.476 9.759 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -62.814 11.661 8.310 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -64.483 11.245 8.767 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -63.115 10.427 9.556 1.00 0.00 H new ATOM 488 N GLN A 35 -65.011 5.658 7.921 1.00 0.00 N ATOM 489 CA GLN A 35 -65.833 4.472 8.082 1.00 0.00 C ATOM 490 C GLN A 35 -65.775 3.609 6.820 1.00 0.00 C ATOM 491 O GLN A 35 -65.033 3.917 5.888 1.00 0.00 O ATOM 492 CB GLN A 35 -67.277 4.847 8.423 1.00 0.00 C ATOM 493 CG GLN A 35 -67.539 4.715 9.924 1.00 0.00 C ATOM 494 CD GLN A 35 -67.858 3.266 10.299 1.00 0.00 C ATOM 495 OE1 GLN A 35 -66.999 2.498 10.700 1.00 0.00 O ATOM 496 NE2 GLN A 35 -69.137 2.937 10.147 1.00 0.00 N ATOM 0 H GLN A 35 -64.887 5.963 6.956 1.00 0.00 H new ATOM 0 HA GLN A 35 -65.437 3.891 8.914 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -67.475 5.870 8.104 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -67.963 4.203 7.873 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -66.666 5.055 10.481 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -68.370 5.360 10.210 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -69.805 3.629 9.807 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -69.451 1.993 10.371 1.00 0.00 H new ATOM 505 N SER A 36 -66.566 2.547 6.830 1.00 0.00 N ATOM 506 CA SER A 36 -66.613 1.638 5.698 1.00 0.00 C ATOM 507 C SER A 36 -68.058 1.463 5.227 1.00 0.00 C ATOM 508 O SER A 36 -68.995 1.781 5.957 1.00 0.00 O ATOM 509 CB SER A 36 -66.004 0.280 6.055 1.00 0.00 C ATOM 510 OG SER A 36 -66.829 -0.456 6.953 1.00 0.00 O ATOM 0 H SER A 36 -67.180 2.295 7.605 1.00 0.00 H new ATOM 0 HA SER A 36 -66.023 2.069 4.889 1.00 0.00 H new ATOM 0 HB2 SER A 36 -65.852 -0.300 5.145 1.00 0.00 H new ATOM 0 HB3 SER A 36 -65.023 0.430 6.505 1.00 0.00 H new ATOM 0 HG SER A 36 -66.406 -1.317 7.155 1.00 0.00 H new ATOM 516 N ARG A 37 -68.193 0.958 4.009 1.00 0.00 N ATOM 517 CA ARG A 37 -69.508 0.738 3.432 1.00 0.00 C ATOM 518 C ARG A 37 -69.419 -0.258 2.273 1.00 0.00 C ATOM 519 O ARG A 37 -68.336 -0.508 1.747 1.00 0.00 O ATOM 520 CB ARG A 37 -70.114 2.048 2.924 1.00 0.00 C ATOM 521 CG ARG A 37 -69.416 2.515 1.646 1.00 0.00 C ATOM 522 CD ARG A 37 -70.091 3.766 1.079 1.00 0.00 C ATOM 523 NE ARG A 37 -71.057 3.386 0.024 1.00 0.00 N ATOM 524 CZ ARG A 37 -71.890 4.247 -0.577 1.00 0.00 C ATOM 525 NH1 ARG A 37 -71.879 5.542 -0.231 1.00 0.00 N ATOM 526 NH2 ARG A 37 -72.733 3.813 -1.524 1.00 0.00 N ATOM 0 H ARG A 37 -67.413 0.695 3.406 1.00 0.00 H new ATOM 0 HA ARG A 37 -70.150 0.334 4.215 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -71.178 1.910 2.732 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -70.026 2.816 3.692 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -68.368 2.727 1.856 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -69.437 1.717 0.903 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -70.603 4.305 1.876 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -69.339 4.441 0.669 1.00 0.00 H new ATOM 0 HE ARG A 37 -71.091 2.408 -0.264 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -71.237 5.872 0.489 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -72.513 6.197 -0.688 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -72.741 2.828 -1.787 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -73.367 4.468 -1.981 1.00 0.00 H new ATOM 540 N VAL A 38 -70.573 -0.798 1.910 1.00 0.00 N ATOM 541 CA VAL A 38 -70.639 -1.761 0.823 1.00 0.00 C ATOM 542 C VAL A 38 -71.637 -1.270 -0.227 1.00 0.00 C ATOM 543 O VAL A 38 -72.696 -0.744 0.115 1.00 0.00 O ATOM 544 CB VAL A 38 -70.981 -3.147 1.372 1.00 0.00 C ATOM 545 CG1 VAL A 38 -71.666 -4.005 0.306 1.00 0.00 C ATOM 546 CG2 VAL A 38 -69.734 -3.844 1.918 1.00 0.00 C ATOM 0 H VAL A 38 -71.469 -0.587 2.349 1.00 0.00 H new ATOM 0 HA VAL A 38 -69.670 -1.851 0.333 1.00 0.00 H new ATOM 0 HB VAL A 38 -71.680 -3.017 2.198 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -71.898 -4.985 0.722 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -72.587 -3.519 -0.015 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -71.001 -4.122 -0.549 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -70.006 -4.827 2.302 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -69.001 -3.956 1.119 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -69.306 -3.246 2.722 1.00 0.00 H new ATOM 556 N ASN A 39 -71.266 -1.458 -1.485 1.00 0.00 N ATOM 557 CA ASN A 39 -72.116 -1.042 -2.587 1.00 0.00 C ATOM 558 C ASN A 39 -72.898 -2.249 -3.107 1.00 0.00 C ATOM 559 O ASN A 39 -72.307 -3.227 -3.561 1.00 0.00 O ATOM 560 CB ASN A 39 -71.284 -0.484 -3.744 1.00 0.00 C ATOM 561 CG ASN A 39 -71.205 1.043 -3.677 1.00 0.00 C ATOM 562 OD1 ASN A 39 -70.757 1.625 -2.703 1.00 0.00 O ATOM 563 ND2 ASN A 39 -71.666 1.656 -4.763 1.00 0.00 N ATOM 0 H ASN A 39 -70.387 -1.893 -1.765 1.00 0.00 H new ATOM 0 HA ASN A 39 -72.789 -0.267 -2.219 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -70.279 -0.905 -3.710 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -71.725 -0.787 -4.693 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -71.658 2.675 -4.816 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -72.027 1.108 -5.543 1.00 0.00 H new ATOM 570 N ASP A 40 -74.216 -2.140 -3.023 1.00 0.00 N ATOM 571 CA ASP A 40 -75.086 -3.211 -3.479 1.00 0.00 C ATOM 572 C ASP A 40 -75.313 -3.071 -4.986 1.00 0.00 C ATOM 573 O ASP A 40 -75.685 -4.035 -5.653 1.00 0.00 O ATOM 574 CB ASP A 40 -76.449 -3.147 -2.787 1.00 0.00 C ATOM 575 CG ASP A 40 -76.555 -3.952 -1.491 1.00 0.00 C ATOM 576 OD1 ASP A 40 -75.565 -4.646 -1.171 1.00 0.00 O ATOM 577 OD2 ASP A 40 -77.623 -3.856 -0.849 1.00 0.00 O ATOM 0 H ASP A 40 -74.702 -1.327 -2.646 1.00 0.00 H new ATOM 0 HA ASP A 40 -74.606 -4.160 -3.241 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -76.680 -2.104 -2.569 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -77.209 -3.504 -3.482 1.00 0.00 H new ATOM 582 N GLN A 41 -75.081 -1.862 -5.477 1.00 0.00 N ATOM 583 CA GLN A 41 -75.256 -1.583 -6.892 1.00 0.00 C ATOM 584 C GLN A 41 -74.024 -2.037 -7.679 1.00 0.00 C ATOM 585 O GLN A 41 -74.135 -2.845 -8.599 1.00 0.00 O ATOM 586 CB GLN A 41 -75.540 -0.099 -7.127 1.00 0.00 C ATOM 587 CG GLN A 41 -74.916 0.378 -8.440 1.00 0.00 C ATOM 588 CD GLN A 41 -75.364 1.802 -8.775 1.00 0.00 C ATOM 589 OE1 GLN A 41 -75.459 2.668 -7.921 1.00 0.00 O ATOM 590 NE2 GLN A 41 -75.635 1.995 -10.063 1.00 0.00 N ATOM 0 H GLN A 41 -74.773 -1.065 -4.920 1.00 0.00 H new ATOM 0 HA GLN A 41 -76.119 -2.145 -7.249 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -76.617 0.070 -7.150 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -75.143 0.487 -6.298 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -73.829 0.343 -8.364 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -75.201 -0.296 -9.248 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -75.535 1.226 -10.726 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -75.943 2.912 -10.388 1.00 0.00 H new ATOM 599 N GLU A 42 -72.879 -1.497 -7.287 1.00 0.00 N ATOM 600 CA GLU A 42 -71.629 -1.837 -7.944 1.00 0.00 C ATOM 601 C GLU A 42 -71.138 -3.208 -7.476 1.00 0.00 C ATOM 602 O GLU A 42 -70.487 -3.929 -8.230 1.00 0.00 O ATOM 603 CB GLU A 42 -70.569 -0.761 -7.695 1.00 0.00 C ATOM 604 CG GLU A 42 -70.452 0.181 -8.895 1.00 0.00 C ATOM 605 CD GLU A 42 -69.357 -0.287 -9.855 1.00 0.00 C ATOM 606 OE1 GLU A 42 -68.198 -0.378 -9.393 1.00 0.00 O ATOM 607 OE2 GLU A 42 -69.702 -0.544 -11.028 1.00 0.00 O ATOM 0 H GLU A 42 -72.791 -0.827 -6.523 1.00 0.00 H new ATOM 0 HA GLU A 42 -71.807 -1.884 -9.018 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -70.828 -0.190 -6.804 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -69.605 -1.232 -7.503 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -71.406 0.227 -9.420 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -70.230 1.191 -8.549 1.00 0.00 H new ATOM 614 N GLY A 43 -71.469 -3.527 -6.233 1.00 0.00 N ATOM 615 CA GLY A 43 -71.071 -4.799 -5.656 1.00 0.00 C ATOM 616 C GLY A 43 -69.583 -4.797 -5.298 1.00 0.00 C ATOM 617 O GLY A 43 -68.826 -5.644 -5.771 1.00 0.00 O ATOM 0 H GLY A 43 -72.008 -2.926 -5.610 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -71.663 -4.999 -4.763 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -71.278 -5.603 -6.362 1.00 0.00 H new ATOM 621 N ARG A 44 -69.208 -3.836 -4.467 1.00 0.00 N ATOM 622 CA ARG A 44 -67.824 -3.712 -4.041 1.00 0.00 C ATOM 623 C ARG A 44 -67.747 -3.009 -2.685 1.00 0.00 C ATOM 624 O ARG A 44 -68.707 -2.369 -2.258 1.00 0.00 O ATOM 625 CB ARG A 44 -67.002 -2.925 -5.064 1.00 0.00 C ATOM 626 CG ARG A 44 -66.882 -3.695 -6.380 1.00 0.00 C ATOM 627 CD ARG A 44 -65.810 -3.077 -7.281 1.00 0.00 C ATOM 628 NE ARG A 44 -65.995 -3.535 -8.676 1.00 0.00 N ATOM 629 CZ ARG A 44 -65.346 -3.019 -9.728 1.00 0.00 C ATOM 630 NH1 ARG A 44 -64.466 -2.024 -9.551 1.00 0.00 N ATOM 631 NH2 ARG A 44 -65.578 -3.497 -10.959 1.00 0.00 N ATOM 0 H ARG A 44 -69.839 -3.135 -4.077 1.00 0.00 H new ATOM 0 HA ARG A 44 -67.411 -4.717 -3.956 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -67.471 -1.958 -5.246 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -66.008 -2.727 -4.662 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -66.634 -4.736 -6.175 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -67.842 -3.692 -6.896 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -65.868 -1.989 -7.236 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -64.819 -3.358 -6.926 1.00 0.00 H new ATOM 0 HE ARG A 44 -66.658 -4.291 -8.847 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -64.290 -1.659 -8.615 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -63.972 -1.631 -10.352 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -66.249 -4.253 -11.094 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -65.084 -3.104 -11.760 1.00 0.00 H new ATOM 645 N GLU A 45 -66.596 -3.151 -2.045 1.00 0.00 N ATOM 646 CA GLU A 45 -66.381 -2.537 -0.746 1.00 0.00 C ATOM 647 C GLU A 45 -65.670 -1.192 -0.905 1.00 0.00 C ATOM 648 O GLU A 45 -64.981 -0.964 -1.899 1.00 0.00 O ATOM 649 CB GLU A 45 -65.592 -3.469 0.177 1.00 0.00 C ATOM 650 CG GLU A 45 -66.392 -4.735 0.491 1.00 0.00 C ATOM 651 CD GLU A 45 -65.544 -5.989 0.268 1.00 0.00 C ATOM 652 OE1 GLU A 45 -65.502 -6.446 -0.894 1.00 0.00 O ATOM 653 OE2 GLU A 45 -64.956 -6.461 1.265 1.00 0.00 O ATOM 0 H GLU A 45 -65.802 -3.683 -2.402 1.00 0.00 H new ATOM 0 HA GLU A 45 -67.353 -2.359 -0.285 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -64.647 -3.739 -0.294 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -65.349 -2.949 1.104 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -66.737 -4.704 1.524 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -67.279 -4.775 -0.141 1.00 0.00 H new ATOM 660 N GLU A 46 -65.860 -0.337 0.089 1.00 0.00 N ATOM 661 CA GLU A 46 -65.245 0.980 0.071 1.00 0.00 C ATOM 662 C GLU A 46 -64.997 1.468 1.500 1.00 0.00 C ATOM 663 O GLU A 46 -65.435 0.838 2.461 1.00 0.00 O ATOM 664 CB GLU A 46 -66.105 1.976 -0.708 1.00 0.00 C ATOM 665 CG GLU A 46 -65.507 2.256 -2.088 1.00 0.00 C ATOM 666 CD GLU A 46 -66.607 2.433 -3.137 1.00 0.00 C ATOM 667 OE1 GLU A 46 -67.057 1.394 -3.667 1.00 0.00 O ATOM 668 OE2 GLU A 46 -66.973 3.602 -3.384 1.00 0.00 O ATOM 0 H GLU A 46 -66.431 -0.530 0.912 1.00 0.00 H new ATOM 0 HA GLU A 46 -64.284 0.905 -0.439 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -67.115 1.581 -0.819 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -66.187 2.907 -0.148 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -64.892 3.155 -2.046 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -64.852 1.434 -2.378 1.00 0.00 H new ATOM 675 N PHE A 47 -64.295 2.588 1.595 1.00 0.00 N ATOM 676 CA PHE A 47 -63.984 3.169 2.889 1.00 0.00 C ATOM 677 C PHE A 47 -63.825 4.687 2.786 1.00 0.00 C ATOM 678 O PHE A 47 -63.006 5.177 2.010 1.00 0.00 O ATOM 679 CB PHE A 47 -62.657 2.559 3.346 1.00 0.00 C ATOM 680 CG PHE A 47 -62.708 1.045 3.556 1.00 0.00 C ATOM 681 CD1 PHE A 47 -62.422 0.205 2.525 1.00 0.00 C ATOM 682 CD2 PHE A 47 -63.039 0.538 4.774 1.00 0.00 C ATOM 683 CE1 PHE A 47 -62.469 -1.201 2.720 1.00 0.00 C ATOM 684 CE2 PHE A 47 -63.086 -0.868 4.969 1.00 0.00 C ATOM 685 CZ PHE A 47 -62.800 -1.707 3.938 1.00 0.00 C ATOM 0 H PHE A 47 -63.933 3.108 0.796 1.00 0.00 H new ATOM 0 HA PHE A 47 -64.791 2.963 3.592 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -61.890 2.787 2.606 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -62.352 3.035 4.278 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -62.159 0.607 1.558 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -63.266 1.205 5.593 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -62.242 -1.868 1.901 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -63.349 -1.271 5.936 1.00 0.00 H new ATOM 0 HZ PHE A 47 -62.836 -2.776 4.087 1.00 0.00 H new ATOM 695 N TYR A 48 -64.621 5.389 3.579 1.00 0.00 N ATOM 696 CA TYR A 48 -64.579 6.842 3.586 1.00 0.00 C ATOM 697 C TYR A 48 -63.290 7.350 4.235 1.00 0.00 C ATOM 698 O TYR A 48 -63.214 7.476 5.457 1.00 0.00 O ATOM 699 CB TYR A 48 -65.773 7.294 4.428 1.00 0.00 C ATOM 700 CG TYR A 48 -66.190 8.746 4.186 1.00 0.00 C ATOM 701 CD1 TYR A 48 -66.267 9.237 2.899 1.00 0.00 C ATOM 702 CD2 TYR A 48 -66.490 9.565 5.256 1.00 0.00 C ATOM 703 CE1 TYR A 48 -66.659 10.604 2.672 1.00 0.00 C ATOM 704 CE2 TYR A 48 -66.882 10.932 5.029 1.00 0.00 C ATOM 705 CZ TYR A 48 -66.948 11.384 3.748 1.00 0.00 C ATOM 706 OH TYR A 48 -67.319 12.674 3.534 1.00 0.00 O ATOM 0 H TYR A 48 -65.299 4.979 4.221 1.00 0.00 H new ATOM 0 HA TYR A 48 -64.613 7.232 2.569 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -66.621 6.643 4.216 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -65.529 7.168 5.483 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -66.033 8.596 2.062 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -66.431 9.181 6.263 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -66.722 11.001 1.670 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -67.118 11.584 5.857 1.00 0.00 H new ATOM 0 HH TYR A 48 -67.496 13.110 4.393 1.00 0.00 H new ATOM 716 N VAL A 49 -62.308 7.628 3.390 1.00 0.00 N ATOM 717 CA VAL A 49 -61.027 8.119 3.867 1.00 0.00 C ATOM 718 C VAL A 49 -61.001 9.645 3.766 1.00 0.00 C ATOM 719 O VAL A 49 -61.482 10.214 2.787 1.00 0.00 O ATOM 720 CB VAL A 49 -59.889 7.449 3.094 1.00 0.00 C ATOM 721 CG1 VAL A 49 -60.088 5.934 3.029 1.00 0.00 C ATOM 722 CG2 VAL A 49 -59.755 8.045 1.691 1.00 0.00 C ATOM 0 H VAL A 49 -62.374 7.522 2.378 1.00 0.00 H new ATOM 0 HA VAL A 49 -60.886 7.860 4.916 1.00 0.00 H new ATOM 0 HB VAL A 49 -58.960 7.642 3.631 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -59.266 5.482 2.474 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -60.111 5.526 4.040 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -61.030 5.712 2.527 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -58.939 7.552 1.162 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -60.685 7.897 1.142 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -59.545 9.112 1.767 1.00 0.00 H new ATOM 732 N HIS A 50 -60.436 10.265 4.791 1.00 0.00 N ATOM 733 CA HIS A 50 -60.341 11.715 4.830 1.00 0.00 C ATOM 734 C HIS A 50 -58.880 12.138 4.667 1.00 0.00 C ATOM 735 O HIS A 50 -58.018 11.714 5.435 1.00 0.00 O ATOM 736 CB HIS A 50 -60.980 12.267 6.106 1.00 0.00 C ATOM 737 CG HIS A 50 -60.727 13.738 6.332 1.00 0.00 C ATOM 738 ND1 HIS A 50 -61.617 14.721 5.936 1.00 0.00 N ATOM 739 CD2 HIS A 50 -59.677 14.382 6.918 1.00 0.00 C ATOM 740 CE1 HIS A 50 -61.115 15.900 6.272 1.00 0.00 C ATOM 741 NE2 HIS A 50 -59.912 15.688 6.880 1.00 0.00 N ATOM 0 H HIS A 50 -60.039 9.790 5.602 1.00 0.00 H new ATOM 0 HA HIS A 50 -60.901 12.143 3.999 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -62.056 12.096 6.065 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -60.601 11.708 6.961 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -58.803 13.910 7.341 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -61.577 16.860 6.096 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -59.295 16.413 7.245 1.00 0.00 H new ATOM 749 N TYR A 51 -58.647 12.969 3.662 1.00 0.00 N ATOM 750 CA TYR A 51 -57.305 13.455 3.389 1.00 0.00 C ATOM 751 C TYR A 51 -56.938 14.609 4.324 1.00 0.00 C ATOM 752 O TYR A 51 -57.219 15.769 4.025 1.00 0.00 O ATOM 753 CB TYR A 51 -57.328 13.970 1.948 1.00 0.00 C ATOM 754 CG TYR A 51 -57.521 12.873 0.899 1.00 0.00 C ATOM 755 CD1 TYR A 51 -56.481 12.020 0.593 1.00 0.00 C ATOM 756 CD2 TYR A 51 -58.736 12.738 0.258 1.00 0.00 C ATOM 757 CE1 TYR A 51 -56.663 10.988 -0.395 1.00 0.00 C ATOM 758 CE2 TYR A 51 -58.918 11.706 -0.730 1.00 0.00 C ATOM 759 CZ TYR A 51 -57.872 10.882 -1.007 1.00 0.00 C ATOM 760 OH TYR A 51 -58.044 9.907 -1.940 1.00 0.00 O ATOM 0 H TYR A 51 -59.365 13.318 3.027 1.00 0.00 H new ATOM 0 HA TYR A 51 -56.572 12.662 3.538 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -58.130 14.701 1.847 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -56.393 14.493 1.745 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -55.530 12.126 1.094 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -59.550 13.406 0.497 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -55.857 10.314 -0.644 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -59.863 11.589 -1.239 1.00 0.00 H new ATOM 0 HH TYR A 51 -57.471 9.142 -1.723 1.00 0.00 H new ATOM 770 N VAL A 52 -56.317 14.251 5.438 1.00 0.00 N ATOM 771 CA VAL A 52 -55.909 15.242 6.419 1.00 0.00 C ATOM 772 C VAL A 52 -55.112 16.346 5.721 1.00 0.00 C ATOM 773 O VAL A 52 -55.216 17.517 6.086 1.00 0.00 O ATOM 774 CB VAL A 52 -55.131 14.568 7.551 1.00 0.00 C ATOM 775 CG1 VAL A 52 -55.916 13.390 8.130 1.00 0.00 C ATOM 776 CG2 VAL A 52 -53.746 14.124 7.076 1.00 0.00 C ATOM 0 H VAL A 52 -56.086 13.288 5.683 1.00 0.00 H new ATOM 0 HA VAL A 52 -56.782 15.710 6.875 1.00 0.00 H new ATOM 0 HB VAL A 52 -54.993 15.301 8.346 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -55.341 12.929 8.933 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -56.868 13.746 8.524 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -56.100 12.655 7.346 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -53.214 13.648 7.900 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -53.853 13.415 6.255 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -53.183 14.992 6.734 1.00 0.00 H new ATOM 906 N GLU A 60 -64.059 11.440 0.169 1.00 0.00 N ATOM 907 CA GLU A 60 -64.716 10.440 -0.655 1.00 0.00 C ATOM 908 C GLU A 60 -64.297 9.035 -0.218 1.00 0.00 C ATOM 909 O GLU A 60 -63.334 8.874 0.530 1.00 0.00 O ATOM 910 CB GLU A 60 -64.414 10.666 -2.138 1.00 0.00 C ATOM 911 CG GLU A 60 -62.948 10.364 -2.451 1.00 0.00 C ATOM 912 CD GLU A 60 -62.739 10.160 -3.953 1.00 0.00 C ATOM 913 OE1 GLU A 60 -63.199 11.038 -4.715 1.00 0.00 O ATOM 914 OE2 GLU A 60 -62.125 9.130 -4.306 1.00 0.00 O ATOM 0 HA GLU A 60 -65.793 10.536 -0.519 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -65.058 10.029 -2.745 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -64.642 11.698 -2.406 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -62.321 11.184 -2.101 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -62.634 9.470 -1.912 1.00 0.00 H new ATOM 921 N TRP A 61 -65.040 8.052 -0.705 1.00 0.00 N ATOM 922 CA TRP A 61 -64.758 6.665 -0.375 1.00 0.00 C ATOM 923 C TRP A 61 -63.695 6.154 -1.349 1.00 0.00 C ATOM 924 O TRP A 61 -63.548 6.687 -2.448 1.00 0.00 O ATOM 925 CB TRP A 61 -66.037 5.826 -0.391 1.00 0.00 C ATOM 926 CG TRP A 61 -67.215 6.473 0.340 1.00 0.00 C ATOM 927 CD1 TRP A 61 -67.942 7.532 -0.041 1.00 0.00 C ATOM 928 CD2 TRP A 61 -67.776 6.057 1.603 1.00 0.00 C ATOM 929 NE1 TRP A 61 -68.927 7.828 0.879 1.00 0.00 N ATOM 930 CE2 TRP A 61 -68.823 6.902 1.911 1.00 0.00 C ATOM 931 CE3 TRP A 61 -67.412 5.001 2.457 1.00 0.00 C ATOM 932 CZ2 TRP A 61 -69.591 6.779 3.075 1.00 0.00 C ATOM 933 CZ3 TRP A 61 -68.189 4.891 3.616 1.00 0.00 C ATOM 934 CH2 TRP A 61 -69.246 5.734 3.941 1.00 0.00 C ATOM 0 H TRP A 61 -65.838 8.189 -1.326 1.00 0.00 H new ATOM 0 HA TRP A 61 -64.369 6.582 0.640 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -66.323 5.639 -1.426 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -65.829 4.857 0.063 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -67.778 8.085 -0.954 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -69.606 8.586 0.814 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -66.597 4.328 2.236 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -70.406 7.454 3.293 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -67.951 4.095 4.306 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -69.798 5.584 4.857 1.00 0.00 H new ATOM 945 N VAL A 62 -62.981 5.127 -0.911 1.00 0.00 N ATOM 946 CA VAL A 62 -61.937 4.538 -1.731 1.00 0.00 C ATOM 947 C VAL A 62 -62.058 3.014 -1.687 1.00 0.00 C ATOM 948 O VAL A 62 -62.959 2.478 -1.044 1.00 0.00 O ATOM 949 CB VAL A 62 -60.566 5.043 -1.275 1.00 0.00 C ATOM 950 CG1 VAL A 62 -60.583 6.558 -1.063 1.00 0.00 C ATOM 951 CG2 VAL A 62 -60.109 4.317 -0.008 1.00 0.00 C ATOM 0 H VAL A 62 -63.105 4.688 0.001 1.00 0.00 H new ATOM 0 HA VAL A 62 -62.051 4.843 -2.771 1.00 0.00 H new ATOM 0 HB VAL A 62 -59.848 4.823 -2.065 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -59.597 6.891 -0.739 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -60.845 7.053 -1.998 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -61.320 6.810 -0.300 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -59.132 4.694 0.295 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -60.829 4.491 0.791 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -60.039 3.248 -0.207 1.00 0.00 H new ATOM 961 N ASP A 63 -61.136 2.358 -2.377 1.00 0.00 N ATOM 962 CA ASP A 63 -61.129 0.906 -2.424 1.00 0.00 C ATOM 963 C ASP A 63 -59.901 0.383 -1.677 1.00 0.00 C ATOM 964 O ASP A 63 -58.973 1.139 -1.393 1.00 0.00 O ATOM 965 CB ASP A 63 -61.054 0.402 -3.867 1.00 0.00 C ATOM 966 CG ASP A 63 -62.247 0.782 -4.747 1.00 0.00 C ATOM 967 OD1 ASP A 63 -62.785 1.889 -4.526 1.00 0.00 O ATOM 968 OD2 ASP A 63 -62.593 -0.042 -5.621 1.00 0.00 O ATOM 0 H ASP A 63 -60.389 2.806 -2.908 1.00 0.00 H new ATOM 0 HA ASP A 63 -62.051 0.549 -1.965 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -60.145 0.791 -4.325 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -60.964 -0.684 -3.853 1.00 0.00 H new ATOM 973 N LYS A 64 -59.935 -0.908 -1.379 1.00 0.00 N ATOM 974 CA LYS A 64 -58.836 -1.541 -0.670 1.00 0.00 C ATOM 975 C LYS A 64 -57.564 -1.439 -1.513 1.00 0.00 C ATOM 976 O LYS A 64 -56.478 -1.212 -0.981 1.00 0.00 O ATOM 977 CB LYS A 64 -59.204 -2.975 -0.283 1.00 0.00 C ATOM 978 CG LYS A 64 -60.407 -2.997 0.662 1.00 0.00 C ATOM 979 CD LYS A 64 -60.451 -4.300 1.464 1.00 0.00 C ATOM 980 CE LYS A 64 -60.314 -4.026 2.963 1.00 0.00 C ATOM 981 NZ LYS A 64 -61.058 -5.039 3.744 1.00 0.00 N ATOM 0 H LYS A 64 -60.706 -1.532 -1.616 1.00 0.00 H new ATOM 0 HA LYS A 64 -58.639 -1.022 0.268 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -59.431 -3.550 -1.180 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -58.352 -3.456 0.197 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -60.354 -2.148 1.344 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -61.327 -2.888 0.088 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -61.390 -4.819 1.270 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -59.648 -4.960 1.136 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -59.262 -4.040 3.247 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -60.693 -3.030 3.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -60.757 -5.000 4.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -62.078 -4.844 3.683 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -60.863 -5.986 3.360 1.00 0.00 H new ATOM 995 N ASN A 65 -57.739 -1.612 -2.815 1.00 0.00 N ATOM 996 CA ASN A 65 -56.619 -1.541 -3.737 1.00 0.00 C ATOM 997 C ASN A 65 -56.032 -0.129 -3.713 1.00 0.00 C ATOM 998 O ASN A 65 -54.816 0.041 -3.639 1.00 0.00 O ATOM 999 CB ASN A 65 -57.064 -1.844 -5.169 1.00 0.00 C ATOM 1000 CG ASN A 65 -55.987 -2.624 -5.925 1.00 0.00 C ATOM 1001 OD1 ASN A 65 -55.757 -3.800 -5.694 1.00 0.00 O ATOM 1002 ND2 ASN A 65 -55.340 -1.906 -6.839 1.00 0.00 N ATOM 0 H ASN A 65 -58.640 -1.801 -3.253 1.00 0.00 H new ATOM 0 HA ASN A 65 -55.879 -2.279 -3.426 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -57.990 -2.419 -5.152 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -57.277 -0.912 -5.692 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -54.602 -2.336 -7.397 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -55.582 -0.926 -6.982 1.00 0.00 H new ATOM 1009 N ARG A 66 -56.924 0.849 -3.778 1.00 0.00 N ATOM 1010 CA ARG A 66 -56.509 2.242 -3.764 1.00 0.00 C ATOM 1011 C ARG A 66 -55.717 2.548 -2.492 1.00 0.00 C ATOM 1012 O ARG A 66 -54.892 3.460 -2.475 1.00 0.00 O ATOM 1013 CB ARG A 66 -57.718 3.177 -3.841 1.00 0.00 C ATOM 1014 CG ARG A 66 -58.306 3.199 -5.254 1.00 0.00 C ATOM 1015 CD ARG A 66 -59.353 4.305 -5.395 1.00 0.00 C ATOM 1016 NE ARG A 66 -60.420 3.876 -6.326 1.00 0.00 N ATOM 1017 CZ ARG A 66 -61.294 4.711 -6.903 1.00 0.00 C ATOM 1018 NH1 ARG A 66 -61.234 6.025 -6.648 1.00 0.00 N ATOM 1019 NH2 ARG A 66 -62.229 4.233 -7.735 1.00 0.00 N ATOM 0 H ARG A 66 -57.932 0.705 -3.840 1.00 0.00 H new ATOM 0 HA ARG A 66 -55.878 2.409 -4.637 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -58.479 2.852 -3.132 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -57.422 4.185 -3.551 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -57.509 3.353 -5.981 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -58.759 2.233 -5.478 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -59.782 4.538 -4.420 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -58.883 5.217 -5.763 1.00 0.00 H new ATOM 0 HE ARG A 66 -60.495 2.882 -6.542 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -60.523 6.390 -6.014 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -61.900 6.661 -7.088 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -62.276 3.233 -7.929 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -62.894 4.869 -8.174 1.00 0.00 H new ATOM 1033 N LEU A 67 -55.995 1.768 -1.458 1.00 0.00 N ATOM 1034 CA LEU A 67 -55.318 1.944 -0.184 1.00 0.00 C ATOM 1035 C LEU A 67 -54.066 1.065 -0.151 1.00 0.00 C ATOM 1036 O LEU A 67 -53.815 0.301 -1.081 1.00 0.00 O ATOM 1037 CB LEU A 67 -56.282 1.685 0.975 1.00 0.00 C ATOM 1038 CG LEU A 67 -57.558 2.529 0.988 1.00 0.00 C ATOM 1039 CD1 LEU A 67 -58.748 1.716 1.502 1.00 0.00 C ATOM 1040 CD2 LEU A 67 -57.355 3.817 1.788 1.00 0.00 C ATOM 0 H LEU A 67 -56.680 1.012 -1.476 1.00 0.00 H new ATOM 0 HA LEU A 67 -54.987 2.976 -0.068 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -56.566 0.633 0.957 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -55.748 1.855 1.910 1.00 0.00 H new ATOM 0 HG LEU A 67 -57.786 2.820 -0.038 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -59.642 2.339 1.501 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -58.906 0.854 0.855 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -58.544 1.375 2.517 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -58.277 4.399 1.781 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -57.090 3.569 2.816 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -56.553 4.403 1.338 1.00 0.00 H new ATOM 1052 N ALA A 68 -53.313 1.204 0.931 1.00 0.00 N ATOM 1053 CA ALA A 68 -52.094 0.432 1.097 1.00 0.00 C ATOM 1054 C ALA A 68 -52.259 -0.526 2.278 1.00 0.00 C ATOM 1055 O ALA A 68 -52.219 -0.106 3.434 1.00 0.00 O ATOM 1056 CB ALA A 68 -50.909 1.382 1.278 1.00 0.00 C ATOM 0 H ALA A 68 -53.524 1.839 1.700 1.00 0.00 H new ATOM 0 HA ALA A 68 -51.897 -0.170 0.210 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -49.994 0.803 1.403 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -50.817 2.021 0.400 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -51.070 2.000 2.161 1.00 0.00 H new ATOM 1062 N LEU A 69 -52.441 -1.797 1.948 1.00 0.00 N ATOM 1063 CA LEU A 69 -52.612 -2.818 2.967 1.00 0.00 C ATOM 1064 C LEU A 69 -51.419 -3.775 2.930 1.00 0.00 C ATOM 1065 O LEU A 69 -51.368 -4.678 2.096 1.00 0.00 O ATOM 1066 CB LEU A 69 -53.964 -3.515 2.806 1.00 0.00 C ATOM 1067 CG LEU A 69 -55.167 -2.599 2.569 1.00 0.00 C ATOM 1068 CD1 LEU A 69 -56.219 -3.288 1.698 1.00 0.00 C ATOM 1069 CD2 LEU A 69 -55.752 -2.109 3.895 1.00 0.00 C ATOM 0 H LEU A 69 -52.474 -2.142 0.989 1.00 0.00 H new ATOM 0 HA LEU A 69 -52.628 -2.366 3.959 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -53.894 -4.213 1.971 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -54.154 -4.107 3.701 1.00 0.00 H new ATOM 0 HG LEU A 69 -54.824 -1.720 2.023 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -57.063 -2.615 1.546 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -55.781 -3.545 0.734 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -56.564 -4.196 2.193 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -56.605 -1.460 3.698 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -56.076 -2.964 4.488 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -54.992 -1.553 4.444 1.00 0.00 H new ATOM 1464 N ARG A 94 -14.498 16.638 -9.272 1.00 0.00 N ATOM 1465 CA ARG A 94 -13.148 17.059 -9.606 1.00 0.00 C ATOM 1466 C ARG A 94 -13.108 18.569 -9.849 1.00 0.00 C ATOM 1467 O ARG A 94 -14.150 19.203 -10.013 1.00 0.00 O ATOM 1468 CB ARG A 94 -12.638 16.335 -10.853 1.00 0.00 C ATOM 1469 CG ARG A 94 -11.282 15.676 -10.589 1.00 0.00 C ATOM 1470 CD ARG A 94 -11.048 14.502 -11.542 1.00 0.00 C ATOM 1471 NE ARG A 94 -10.245 13.457 -10.869 1.00 0.00 N ATOM 1472 CZ ARG A 94 -10.727 12.618 -9.943 1.00 0.00 C ATOM 1473 NH1 ARG A 94 -12.013 12.697 -9.572 1.00 0.00 N ATOM 1474 NH2 ARG A 94 -9.925 11.701 -9.386 1.00 0.00 N ATOM 0 HA ARG A 94 -12.504 16.806 -8.764 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -13.360 15.578 -11.160 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -12.548 17.042 -11.677 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -10.487 16.411 -10.710 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -11.238 15.326 -9.558 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -12.004 14.088 -11.863 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -10.533 14.847 -12.438 1.00 0.00 H new ATOM 0 HE ARG A 94 -9.262 13.370 -11.127 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -12.624 13.396 -9.995 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -12.381 12.058 -8.867 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -8.946 11.641 -9.667 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -10.293 11.062 -8.681 1.00 0.00 H new ATOM 1488 N LYS A 95 -11.896 19.103 -9.864 1.00 0.00 N ATOM 1489 CA LYS A 95 -11.707 20.526 -10.084 1.00 0.00 C ATOM 1490 C LYS A 95 -10.244 20.793 -10.443 1.00 0.00 C ATOM 1491 O LYS A 95 -9.337 20.262 -9.803 1.00 0.00 O ATOM 1492 CB LYS A 95 -12.199 21.325 -8.876 1.00 0.00 C ATOM 1493 CG LYS A 95 -11.256 21.153 -7.683 1.00 0.00 C ATOM 1494 CD LYS A 95 -11.542 22.198 -6.603 1.00 0.00 C ATOM 1495 CE LYS A 95 -10.348 22.351 -5.659 1.00 0.00 C ATOM 1496 NZ LYS A 95 -9.400 23.361 -6.181 1.00 0.00 N ATOM 0 H LYS A 95 -11.034 18.575 -9.727 1.00 0.00 H new ATOM 0 HA LYS A 95 -12.309 20.864 -10.927 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -12.270 22.381 -9.138 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -13.201 20.996 -8.602 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -11.371 20.153 -7.266 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -10.222 21.243 -8.016 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -11.766 23.157 -7.070 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -12.425 21.906 -6.034 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -10.695 22.647 -4.669 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -9.841 21.393 -5.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -8.596 23.452 -5.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -9.055 23.063 -7.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -9.882 24.278 -6.266 1.00 0.00 H new ATOM 1510 N ILE A 96 -10.058 21.616 -11.465 1.00 0.00 N ATOM 1511 CA ILE A 96 -8.721 21.959 -11.916 1.00 0.00 C ATOM 1512 C ILE A 96 -8.444 23.431 -11.605 1.00 0.00 C ATOM 1513 O ILE A 96 -9.371 24.203 -11.362 1.00 0.00 O ATOM 1514 CB ILE A 96 -8.545 21.599 -13.393 1.00 0.00 C ATOM 1515 CG1 ILE A 96 -8.487 20.082 -13.584 1.00 0.00 C ATOM 1516 CG2 ILE A 96 -7.320 22.298 -13.985 1.00 0.00 C ATOM 1517 CD1 ILE A 96 -9.620 19.601 -14.493 1.00 0.00 C ATOM 0 H ILE A 96 -10.812 22.055 -11.993 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.976 21.373 -11.378 1.00 0.00 H new ATOM 0 HB ILE A 96 -9.417 21.959 -13.939 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.526 19.803 -14.016 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -8.558 19.587 -12.616 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -7.218 22.025 -15.035 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -7.441 23.378 -13.901 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -6.427 21.990 -13.441 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -9.556 18.519 -14.613 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -10.580 19.861 -14.047 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -9.532 20.080 -15.468 1.00 0.00 H new ATOM 1529 N THR A 97 -7.166 23.777 -11.623 1.00 0.00 N ATOM 1530 CA THR A 97 -6.756 25.143 -11.345 1.00 0.00 C ATOM 1531 C THR A 97 -5.324 25.379 -11.831 1.00 0.00 C ATOM 1532 O THR A 97 -4.639 24.441 -12.236 1.00 0.00 O ATOM 1533 CB THR A 97 -6.939 25.397 -9.848 1.00 0.00 C ATOM 1534 OG1 THR A 97 -6.655 26.785 -9.694 1.00 0.00 O ATOM 1535 CG2 THR A 97 -5.870 24.702 -9.001 1.00 0.00 C ATOM 0 H THR A 97 -6.400 23.135 -11.826 1.00 0.00 H new ATOM 0 HA THR A 97 -7.373 25.859 -11.888 1.00 0.00 H new ATOM 0 HB THR A 97 -7.927 25.054 -9.540 1.00 0.00 H new ATOM 0 HG1 THR A 97 -6.752 27.036 -8.752 1.00 0.00 H new ATOM 0 HG21 THR A 97 -6.046 24.915 -7.947 1.00 0.00 H new ATOM 0 HG22 THR A 97 -5.917 23.626 -9.167 1.00 0.00 H new ATOM 0 HG23 THR A 97 -4.884 25.070 -9.286 1.00 0.00 H new ATOM 1543 N ARG A 98 -4.915 26.638 -11.775 1.00 0.00 N ATOM 1544 CA ARG A 98 -3.577 27.010 -12.205 1.00 0.00 C ATOM 1545 C ARG A 98 -3.290 28.469 -11.845 1.00 0.00 C ATOM 1546 O ARG A 98 -4.189 29.197 -11.426 1.00 0.00 O ATOM 1547 CB ARG A 98 -3.411 26.822 -13.714 1.00 0.00 C ATOM 1548 CG ARG A 98 -2.915 25.411 -14.039 1.00 0.00 C ATOM 1549 CD ARG A 98 -1.788 25.451 -15.073 1.00 0.00 C ATOM 1550 NE ARG A 98 -0.479 25.292 -14.401 1.00 0.00 N ATOM 1551 CZ ARG A 98 0.693 25.218 -15.046 1.00 0.00 C ATOM 1552 NH1 ARG A 98 0.727 25.289 -16.384 1.00 0.00 N ATOM 1553 NH2 ARG A 98 1.831 25.074 -14.354 1.00 0.00 N ATOM 0 H ARG A 98 -5.486 27.413 -11.439 1.00 0.00 H new ATOM 0 HA ARG A 98 -2.870 26.359 -11.690 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -4.363 27.001 -14.213 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -2.705 27.558 -14.100 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -2.561 24.927 -13.129 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -3.741 24.810 -14.419 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -1.928 24.657 -15.807 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -1.815 26.396 -15.616 1.00 0.00 H new ATOM 0 HE ARG A 98 -0.468 25.235 -13.383 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -0.139 25.399 -16.911 1.00 0.00 H new ATOM 0 HH12 ARG A 98 1.619 25.233 -16.875 1.00 0.00 H new ATOM 0 HH21 ARG A 98 1.805 25.021 -13.336 1.00 0.00 H new ATOM 0 HH22 ARG A 98 2.723 25.018 -14.845 1.00 0.00 H new ATOM 1567 N ASN A 99 -2.034 28.853 -12.021 1.00 0.00 N ATOM 1568 CA ASN A 99 -1.618 30.212 -11.720 1.00 0.00 C ATOM 1569 C ASN A 99 -0.352 30.540 -12.513 1.00 0.00 C ATOM 1570 O ASN A 99 0.219 29.669 -13.168 1.00 0.00 O ATOM 1571 CB ASN A 99 -1.299 30.374 -10.233 1.00 0.00 C ATOM 1572 CG ASN A 99 -0.351 29.274 -9.752 1.00 0.00 C ATOM 1573 OD1 ASN A 99 0.402 28.691 -10.515 1.00 0.00 O ATOM 1574 ND2 ASN A 99 -0.428 29.024 -8.448 1.00 0.00 N ATOM 0 H ASN A 99 -1.291 28.247 -12.368 1.00 0.00 H new ATOM 0 HA ASN A 99 -2.435 30.882 -11.989 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -0.847 31.350 -10.059 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -2.222 30.342 -9.654 1.00 0.00 H new ATOM 0 HD21 ASN A 99 0.165 28.307 -8.030 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -1.080 29.549 -7.866 1.00 0.00 H new ATOM 1581 N GLN A 100 0.051 31.800 -12.429 1.00 0.00 N ATOM 1582 CA GLN A 100 1.239 32.254 -13.131 1.00 0.00 C ATOM 1583 C GLN A 100 1.889 33.416 -12.378 1.00 0.00 C ATOM 1584 O GLN A 100 1.314 33.943 -11.427 1.00 0.00 O ATOM 1585 CB GLN A 100 0.907 32.651 -14.571 1.00 0.00 C ATOM 1586 CG GLN A 100 1.759 31.862 -15.568 1.00 0.00 C ATOM 1587 CD GLN A 100 1.708 32.500 -16.958 1.00 0.00 C ATOM 1588 OE1 GLN A 100 0.653 32.788 -17.498 1.00 0.00 O ATOM 1589 NE2 GLN A 100 2.903 32.702 -17.504 1.00 0.00 N ATOM 0 H GLN A 100 -0.424 32.520 -11.885 1.00 0.00 H new ATOM 0 HA GLN A 100 1.951 31.429 -13.171 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -0.150 32.470 -14.767 1.00 0.00 H new ATOM 0 HB3 GLN A 100 1.078 33.719 -14.706 1.00 0.00 H new ATOM 0 HG2 GLN A 100 2.791 31.823 -15.219 1.00 0.00 H new ATOM 0 HG3 GLN A 100 1.402 30.833 -15.623 1.00 0.00 H new ATOM 0 HE21 GLN A 100 3.747 32.437 -16.996 1.00 0.00 H new ATOM 0 HE22 GLN A 100 2.976 33.122 -18.431 1.00 0.00 H new ATOM 1598 N LYS A 101 3.079 33.782 -12.832 1.00 0.00 N ATOM 1599 CA LYS A 101 3.813 34.872 -12.212 1.00 0.00 C ATOM 1600 C LYS A 101 4.714 35.534 -13.257 1.00 0.00 C ATOM 1601 O LYS A 101 5.284 34.854 -14.110 1.00 0.00 O ATOM 1602 CB LYS A 101 4.567 34.376 -10.976 1.00 0.00 C ATOM 1603 CG LYS A 101 4.090 35.101 -9.716 1.00 0.00 C ATOM 1604 CD LYS A 101 5.259 35.387 -8.772 1.00 0.00 C ATOM 1605 CE LYS A 101 4.976 36.615 -7.904 1.00 0.00 C ATOM 1606 NZ LYS A 101 6.241 37.262 -7.493 1.00 0.00 N ATOM 0 H LYS A 101 3.553 33.343 -13.622 1.00 0.00 H new ATOM 0 HA LYS A 101 3.126 35.637 -11.852 1.00 0.00 H new ATOM 0 HB2 LYS A 101 4.418 33.302 -10.861 1.00 0.00 H new ATOM 0 HB3 LYS A 101 5.637 34.536 -11.109 1.00 0.00 H new ATOM 0 HG2 LYS A 101 3.604 36.037 -9.993 1.00 0.00 H new ATOM 0 HG3 LYS A 101 3.344 34.494 -9.203 1.00 0.00 H new ATOM 0 HD2 LYS A 101 5.437 34.520 -8.135 1.00 0.00 H new ATOM 0 HD3 LYS A 101 6.168 35.549 -9.352 1.00 0.00 H new ATOM 0 HE2 LYS A 101 4.361 37.325 -8.457 1.00 0.00 H new ATOM 0 HE3 LYS A 101 4.408 36.321 -7.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 6.031 38.093 -6.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 6.814 36.588 -6.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 6.769 37.560 -8.338 1.00 0.00 H new ATOM 1620 N ARG A 102 4.813 36.851 -13.158 1.00 0.00 N ATOM 1621 CA ARG A 102 5.635 37.612 -14.084 1.00 0.00 C ATOM 1622 C ARG A 102 6.501 38.617 -13.323 1.00 0.00 C ATOM 1623 O ARG A 102 6.329 38.804 -12.119 1.00 0.00 O ATOM 1624 CB ARG A 102 4.770 38.360 -15.100 1.00 0.00 C ATOM 1625 CG ARG A 102 3.812 39.326 -14.399 1.00 0.00 C ATOM 1626 CD ARG A 102 4.423 40.725 -14.294 1.00 0.00 C ATOM 1627 NE ARG A 102 3.413 41.682 -13.792 1.00 0.00 N ATOM 1628 CZ ARG A 102 2.380 42.133 -14.517 1.00 0.00 C ATOM 1629 NH1 ARG A 102 2.215 41.716 -15.780 1.00 0.00 N ATOM 1630 NH2 ARG A 102 1.512 43.001 -13.980 1.00 0.00 N ATOM 0 H ARG A 102 4.338 37.411 -12.451 1.00 0.00 H new ATOM 0 HA ARG A 102 6.274 36.908 -14.616 1.00 0.00 H new ATOM 0 HB2 ARG A 102 5.408 38.912 -15.790 1.00 0.00 H new ATOM 0 HB3 ARG A 102 4.201 37.645 -15.695 1.00 0.00 H new ATOM 0 HG2 ARG A 102 2.873 39.376 -14.950 1.00 0.00 H new ATOM 0 HG3 ARG A 102 3.578 38.952 -13.402 1.00 0.00 H new ATOM 0 HD2 ARG A 102 5.283 40.706 -13.624 1.00 0.00 H new ATOM 0 HD3 ARG A 102 4.787 41.046 -15.270 1.00 0.00 H new ATOM 0 HE ARG A 102 3.509 42.020 -12.834 1.00 0.00 H new ATOM 0 HH11 ARG A 102 2.876 41.055 -16.189 1.00 0.00 H new ATOM 0 HH12 ARG A 102 1.429 42.059 -16.332 1.00 0.00 H new ATOM 0 HH21 ARG A 102 1.637 43.319 -13.019 1.00 0.00 H new ATOM 0 HH22 ARG A 102 0.726 43.344 -14.532 1.00 0.00 H new ATOM 1644 N LYS A 103 7.413 39.239 -14.056 1.00 0.00 N ATOM 1645 CA LYS A 103 8.307 40.220 -13.465 1.00 0.00 C ATOM 1646 C LYS A 103 8.750 41.213 -14.541 1.00 0.00 C ATOM 1647 O LYS A 103 8.408 41.058 -15.712 1.00 0.00 O ATOM 1648 CB LYS A 103 9.469 39.526 -12.752 1.00 0.00 C ATOM 1649 CG LYS A 103 10.447 38.920 -13.760 1.00 0.00 C ATOM 1650 CD LYS A 103 11.536 38.113 -13.050 1.00 0.00 C ATOM 1651 CE LYS A 103 12.883 38.835 -13.115 1.00 0.00 C ATOM 1652 NZ LYS A 103 13.800 38.317 -12.075 1.00 0.00 N ATOM 0 H LYS A 103 7.552 39.082 -15.054 1.00 0.00 H new ATOM 0 HA LYS A 103 7.789 40.793 -12.696 1.00 0.00 H new ATOM 0 HB2 LYS A 103 9.992 40.243 -12.118 1.00 0.00 H new ATOM 0 HB3 LYS A 103 9.084 38.744 -12.098 1.00 0.00 H new ATOM 0 HG2 LYS A 103 9.907 38.276 -14.454 1.00 0.00 H new ATOM 0 HG3 LYS A 103 10.904 39.714 -14.351 1.00 0.00 H new ATOM 0 HD2 LYS A 103 11.255 37.953 -12.009 1.00 0.00 H new ATOM 0 HD3 LYS A 103 11.624 37.129 -13.511 1.00 0.00 H new ATOM 0 HE2 LYS A 103 13.328 38.699 -14.101 1.00 0.00 H new ATOM 0 HE3 LYS A 103 12.735 39.906 -12.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 14.710 38.818 -12.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 13.381 38.469 -11.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 13.955 37.300 -12.224 1.00 0.00 H new ATOM 1666 N HIS A 104 9.505 42.211 -14.105 1.00 0.00 N ATOM 1667 CA HIS A 104 9.999 43.229 -15.017 1.00 0.00 C ATOM 1668 C HIS A 104 11.118 44.023 -14.341 1.00 0.00 C ATOM 1669 O HIS A 104 11.405 43.820 -13.162 1.00 0.00 O ATOM 1670 CB HIS A 104 8.855 44.118 -15.510 1.00 0.00 C ATOM 1671 CG HIS A 104 8.290 45.034 -14.451 1.00 0.00 C ATOM 1672 ND1 HIS A 104 7.261 44.658 -13.605 1.00 0.00 N ATOM 1673 CD2 HIS A 104 8.621 46.313 -14.109 1.00 0.00 C ATOM 1674 CE1 HIS A 104 6.992 45.672 -12.796 1.00 0.00 C ATOM 1675 NE2 HIS A 104 7.836 46.697 -13.110 1.00 0.00 N ATOM 0 H HIS A 104 9.787 42.336 -13.133 1.00 0.00 H new ATOM 0 HA HIS A 104 10.421 42.755 -15.903 1.00 0.00 H new ATOM 0 HB2 HIS A 104 9.211 44.721 -16.345 1.00 0.00 H new ATOM 0 HB3 HIS A 104 8.055 43.484 -15.893 1.00 0.00 H new ATOM 0 HD2 HIS A 104 9.391 46.911 -14.573 1.00 0.00 H new ATOM 0 HE1 HIS A 104 6.237 45.685 -12.024 1.00 0.00 H new ATOM 0 HE2 HIS A 104 7.860 47.608 -12.652 1.00 0.00 H new ATOM 1683 N ASP A 105 11.722 44.911 -15.118 1.00 0.00 N ATOM 1684 CA ASP A 105 12.804 45.737 -14.609 1.00 0.00 C ATOM 1685 C ASP A 105 13.202 46.761 -15.674 1.00 0.00 C ATOM 1686 O ASP A 105 12.813 46.638 -16.835 1.00 0.00 O ATOM 1687 CB ASP A 105 14.036 44.891 -14.283 1.00 0.00 C ATOM 1688 CG ASP A 105 14.812 44.383 -15.500 1.00 0.00 C ATOM 1689 OD1 ASP A 105 14.471 43.275 -15.969 1.00 0.00 O ATOM 1690 OD2 ASP A 105 15.729 45.113 -15.934 1.00 0.00 O ATOM 0 H ASP A 105 11.483 45.076 -16.096 1.00 0.00 H new ATOM 0 HA ASP A 105 12.454 46.229 -13.702 1.00 0.00 H new ATOM 0 HB2 ASP A 105 14.710 45.481 -13.662 1.00 0.00 H new ATOM 0 HB3 ASP A 105 13.722 44.034 -13.687 1.00 0.00 H new ATOM 1695 N GLU A 106 13.972 47.749 -15.241 1.00 0.00 N ATOM 1696 CA GLU A 106 14.427 48.793 -16.143 1.00 0.00 C ATOM 1697 C GLU A 106 15.696 49.450 -15.597 1.00 0.00 C ATOM 1698 O GLU A 106 15.793 49.724 -14.402 1.00 0.00 O ATOM 1699 CB GLU A 106 13.329 49.832 -16.376 1.00 0.00 C ATOM 1700 CG GLU A 106 13.642 50.696 -17.600 1.00 0.00 C ATOM 1701 CD GLU A 106 13.062 52.103 -17.441 1.00 0.00 C ATOM 1702 OE1 GLU A 106 13.634 52.865 -16.632 1.00 0.00 O ATOM 1703 OE2 GLU A 106 12.059 52.385 -18.131 1.00 0.00 O ATOM 0 H GLU A 106 14.292 47.848 -14.278 1.00 0.00 H new ATOM 0 HA GLU A 106 14.662 48.338 -17.105 1.00 0.00 H new ATOM 0 HB2 GLU A 106 12.372 49.330 -16.516 1.00 0.00 H new ATOM 0 HB3 GLU A 106 13.230 50.466 -15.495 1.00 0.00 H new ATOM 0 HG2 GLU A 106 14.721 50.757 -17.740 1.00 0.00 H new ATOM 0 HG3 GLU A 106 13.231 50.228 -18.495 1.00 0.00 H new ATOM 1710 N ILE A 107 16.638 49.684 -16.499 1.00 0.00 N ATOM 1711 CA ILE A 107 17.897 50.304 -16.123 1.00 0.00 C ATOM 1712 C ILE A 107 17.691 51.811 -15.962 1.00 0.00 C ATOM 1713 O ILE A 107 16.580 52.311 -16.134 1.00 0.00 O ATOM 1714 CB ILE A 107 18.995 49.936 -17.123 1.00 0.00 C ATOM 1715 CG1 ILE A 107 18.664 50.465 -18.520 1.00 0.00 C ATOM 1716 CG2 ILE A 107 19.251 48.428 -17.127 1.00 0.00 C ATOM 1717 CD1 ILE A 107 19.445 51.745 -18.821 1.00 0.00 C ATOM 0 H ILE A 107 16.554 49.455 -17.489 1.00 0.00 H new ATOM 0 HA ILE A 107 18.236 49.924 -15.159 1.00 0.00 H new ATOM 0 HB ILE A 107 19.920 50.418 -16.807 1.00 0.00 H new ATOM 0 HG12 ILE A 107 18.901 49.706 -19.266 1.00 0.00 H new ATOM 0 HG13 ILE A 107 17.594 50.661 -18.594 1.00 0.00 H new ATOM 0 HG21 ILE A 107 20.036 48.194 -17.846 1.00 0.00 H new ATOM 0 HG22 ILE A 107 19.564 48.109 -16.133 1.00 0.00 H new ATOM 0 HG23 ILE A 107 18.336 47.904 -17.405 1.00 0.00 H new ATOM 0 HD11 ILE A 107 19.191 52.100 -19.820 1.00 0.00 H new ATOM 0 HD12 ILE A 107 19.187 52.509 -18.088 1.00 0.00 H new ATOM 0 HD13 ILE A 107 20.514 51.539 -18.770 1.00 0.00 H new ATOM 1729 N ASN A 108 18.779 52.493 -15.635 1.00 0.00 N ATOM 1730 CA ASN A 108 18.731 53.934 -15.449 1.00 0.00 C ATOM 1731 C ASN A 108 20.066 54.544 -15.880 1.00 0.00 C ATOM 1732 O ASN A 108 21.035 53.823 -16.114 1.00 0.00 O ATOM 1733 CB ASN A 108 18.500 54.292 -13.980 1.00 0.00 C ATOM 1734 CG ASN A 108 17.350 55.291 -13.834 1.00 0.00 C ATOM 1735 OD1 ASN A 108 16.198 54.994 -14.104 1.00 0.00 O ATOM 1736 ND2 ASN A 108 17.725 56.488 -13.393 1.00 0.00 N ATOM 0 H ASN A 108 19.699 52.075 -15.494 1.00 0.00 H new ATOM 0 HA ASN A 108 17.909 54.324 -16.049 1.00 0.00 H new ATOM 0 HB2 ASN A 108 18.276 53.389 -13.413 1.00 0.00 H new ATOM 0 HB3 ASN A 108 19.411 54.716 -13.558 1.00 0.00 H new ATOM 0 HD21 ASN A 108 17.031 57.224 -13.262 1.00 0.00 H new ATOM 0 HD22 ASN A 108 18.707 56.670 -13.186 1.00 0.00 H new ATOM 1743 N HIS A 109 20.075 55.865 -15.973 1.00 0.00 N ATOM 1744 CA HIS A 109 21.275 56.580 -16.372 1.00 0.00 C ATOM 1745 C HIS A 109 21.147 58.055 -15.984 1.00 0.00 C ATOM 1746 O HIS A 109 20.060 58.627 -16.055 1.00 0.00 O ATOM 1747 CB HIS A 109 21.556 56.381 -17.862 1.00 0.00 C ATOM 1748 CG HIS A 109 20.993 57.471 -18.744 1.00 0.00 C ATOM 1749 ND1 HIS A 109 21.215 58.817 -18.749 1.00 0.00 N flip ATOM 1750 CD2 HIS A 109 20.089 57.220 -19.761 1.00 0.00 C flip ATOM 1751 CE1 HIS A 109 20.487 59.358 -19.718 1.00 0.00 C flip ATOM 1752 NE2 HIS A 109 19.788 58.370 -20.346 1.00 0.00 N flip ATOM 0 H HIS A 109 19.269 56.460 -15.779 1.00 0.00 H new ATOM 0 HA HIS A 109 22.137 56.175 -15.842 1.00 0.00 H new ATOM 0 HB2 HIS A 109 22.634 56.325 -18.014 1.00 0.00 H new ATOM 0 HB3 HIS A 109 21.140 55.423 -18.175 1.00 0.00 H new ATOM 0 HD2 HIS A 109 19.696 56.251 -20.032 1.00 0.00 H new ATOM 0 HE1 HIS A 109 20.454 60.408 -19.968 1.00 0.00 H new ATOM 0 HE2 HIS A 109 19.146 58.494 -21.129 1.00 0.00 H new ATOM 1760 N VAL A 110 22.272 58.627 -15.582 1.00 0.00 N ATOM 1761 CA VAL A 110 22.299 60.024 -15.183 1.00 0.00 C ATOM 1762 C VAL A 110 22.854 60.868 -16.332 1.00 0.00 C ATOM 1763 O VAL A 110 23.608 60.369 -17.166 1.00 0.00 O ATOM 1764 CB VAL A 110 23.097 60.183 -13.887 1.00 0.00 C ATOM 1765 CG1 VAL A 110 23.465 61.648 -13.645 1.00 0.00 C ATOM 1766 CG2 VAL A 110 22.327 59.607 -12.696 1.00 0.00 C ATOM 0 H VAL A 110 23.171 58.149 -15.524 1.00 0.00 H new ATOM 0 HA VAL A 110 21.290 60.380 -14.975 1.00 0.00 H new ATOM 0 HB VAL A 110 24.024 59.619 -13.993 1.00 0.00 H new ATOM 0 HG11 VAL A 110 24.032 61.732 -12.718 1.00 0.00 H new ATOM 0 HG12 VAL A 110 24.071 62.013 -14.475 1.00 0.00 H new ATOM 0 HG13 VAL A 110 22.555 62.244 -13.570 1.00 0.00 H new ATOM 0 HG21 VAL A 110 22.916 59.732 -11.787 1.00 0.00 H new ATOM 0 HG22 VAL A 110 21.377 60.131 -12.589 1.00 0.00 H new ATOM 0 HG23 VAL A 110 22.139 58.546 -12.863 1.00 0.00 H new ATOM 1776 N GLN A 111 22.458 62.132 -16.341 1.00 0.00 N ATOM 1777 CA GLN A 111 22.906 63.050 -17.374 1.00 0.00 C ATOM 1778 C GLN A 111 24.422 63.236 -17.298 1.00 0.00 C ATOM 1779 O GLN A 111 25.076 62.679 -16.418 1.00 0.00 O ATOM 1780 CB GLN A 111 22.182 64.394 -17.265 1.00 0.00 C ATOM 1781 CG GLN A 111 22.438 65.045 -15.904 1.00 0.00 C ATOM 1782 CD GLN A 111 23.896 65.487 -15.773 1.00 0.00 C ATOM 1783 OE1 GLN A 111 24.301 66.310 -16.736 1.00 0.00 O flip ATOM 1784 NE2 GLN A 111 24.607 65.106 -14.858 1.00 0.00 N flip ATOM 0 H GLN A 111 21.831 62.542 -15.649 1.00 0.00 H new ATOM 0 HA GLN A 111 22.661 62.620 -18.345 1.00 0.00 H new ATOM 0 HB2 GLN A 111 22.520 65.059 -18.060 1.00 0.00 H new ATOM 0 HB3 GLN A 111 21.111 64.247 -17.406 1.00 0.00 H new ATOM 0 HG2 GLN A 111 21.781 65.906 -15.779 1.00 0.00 H new ATOM 0 HG3 GLN A 111 22.195 64.341 -15.109 1.00 0.00 H new ATOM 0 HE21 GLN A 111 24.233 64.473 -14.151 1.00 0.00 H new ATOM 0 HE22 GLN A 111 25.576 65.420 -14.800 1.00 0.00 H new ATOM 1793 N LYS A 112 24.938 64.021 -18.233 1.00 0.00 N ATOM 1794 CA LYS A 112 26.365 64.287 -18.283 1.00 0.00 C ATOM 1795 C LYS A 112 26.618 65.535 -19.131 1.00 0.00 C ATOM 1796 O LYS A 112 26.123 65.639 -20.252 1.00 0.00 O ATOM 1797 CB LYS A 112 27.124 63.050 -18.768 1.00 0.00 C ATOM 1798 CG LYS A 112 28.345 62.775 -17.887 1.00 0.00 C ATOM 1799 CD LYS A 112 29.557 62.388 -18.736 1.00 0.00 C ATOM 1800 CE LYS A 112 30.839 63.010 -18.178 1.00 0.00 C ATOM 1801 NZ LYS A 112 31.148 62.450 -16.843 1.00 0.00 N ATOM 0 H LYS A 112 24.393 64.481 -18.962 1.00 0.00 H new ATOM 0 HA LYS A 112 26.748 64.497 -17.284 1.00 0.00 H new ATOM 0 HB2 LYS A 112 26.461 62.185 -18.757 1.00 0.00 H new ATOM 0 HB3 LYS A 112 27.441 63.195 -19.801 1.00 0.00 H new ATOM 0 HG2 LYS A 112 28.578 63.661 -17.296 1.00 0.00 H new ATOM 0 HG3 LYS A 112 28.118 61.973 -17.184 1.00 0.00 H new ATOM 0 HD2 LYS A 112 29.656 61.303 -18.761 1.00 0.00 H new ATOM 0 HD3 LYS A 112 29.406 62.718 -19.764 1.00 0.00 H new ATOM 0 HE2 LYS A 112 31.669 62.821 -18.859 1.00 0.00 H new ATOM 0 HE3 LYS A 112 30.725 64.092 -18.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 32.056 62.832 -16.508 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 30.395 62.710 -16.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 31.211 61.414 -16.907 1.00 0.00 H new ATOM 1829 N TYR A 114 29.462 69.342 -19.369 1.00 0.00 N ATOM 1830 CA TYR A 114 30.751 69.936 -19.059 1.00 0.00 C ATOM 1831 C TYR A 114 30.676 71.463 -19.101 1.00 0.00 C ATOM 1832 O TYR A 114 29.657 72.027 -19.494 1.00 0.00 O ATOM 1833 CB TYR A 114 31.710 69.454 -20.150 1.00 0.00 C ATOM 1834 CG TYR A 114 31.628 70.258 -21.449 1.00 0.00 C ATOM 1835 CD1 TYR A 114 32.362 71.419 -21.590 1.00 0.00 C ATOM 1836 CD2 TYR A 114 30.821 69.822 -22.480 1.00 0.00 C ATOM 1837 CE1 TYR A 114 32.285 72.175 -22.813 1.00 0.00 C ATOM 1838 CE2 TYR A 114 30.744 70.579 -23.703 1.00 0.00 C ATOM 1839 CZ TYR A 114 31.480 71.718 -23.809 1.00 0.00 C ATOM 1840 OH TYR A 114 31.407 72.432 -24.964 1.00 0.00 O ATOM 0 HA TYR A 114 31.076 69.648 -18.059 1.00 0.00 H new ATOM 0 HB2 TYR A 114 32.730 69.501 -19.769 1.00 0.00 H new ATOM 0 HB3 TYR A 114 31.499 68.407 -20.369 1.00 0.00 H new ATOM 0 HD1 TYR A 114 32.994 71.760 -20.783 1.00 0.00 H new ATOM 0 HD2 TYR A 114 30.247 68.914 -22.370 1.00 0.00 H new ATOM 0 HE1 TYR A 114 32.854 73.085 -22.936 1.00 0.00 H new ATOM 0 HE2 TYR A 114 30.116 70.250 -24.518 1.00 0.00 H new ATOM 0 HH TYR A 114 30.795 71.986 -25.586 1.00 0.00 H new ATOM 1850 N ALA A 115 31.769 72.089 -18.689 1.00 0.00 N ATOM 1851 CA ALA A 115 31.840 73.540 -18.675 1.00 0.00 C ATOM 1852 C ALA A 115 33.188 73.987 -19.244 1.00 0.00 C ATOM 1853 O ALA A 115 34.173 73.255 -19.163 1.00 0.00 O ATOM 1854 CB ALA A 115 31.611 74.048 -17.250 1.00 0.00 C ATOM 0 H ALA A 115 32.612 71.618 -18.362 1.00 0.00 H new ATOM 0 HA ALA A 115 31.059 73.968 -19.304 1.00 0.00 H new ATOM 0 HB1 ALA A 115 31.664 75.137 -17.239 1.00 0.00 H new ATOM 0 HB2 ALA A 115 30.628 73.729 -16.904 1.00 0.00 H new ATOM 0 HB3 ALA A 115 32.378 73.641 -16.591 1.00 0.00 H new ATOM 1860 N GLU A 116 33.189 75.186 -19.807 1.00 0.00 N ATOM 1861 CA GLU A 116 34.400 75.739 -20.390 1.00 0.00 C ATOM 1862 C GLU A 116 34.709 77.105 -19.774 1.00 0.00 C ATOM 1863 O GLU A 116 33.800 77.887 -19.502 1.00 0.00 O ATOM 1864 CB GLU A 116 34.280 75.838 -21.912 1.00 0.00 C ATOM 1865 CG GLU A 116 33.165 76.805 -22.313 1.00 0.00 C ATOM 1866 CD GLU A 116 31.918 76.045 -22.771 1.00 0.00 C ATOM 1867 OE1 GLU A 116 31.139 75.644 -21.880 1.00 0.00 O ATOM 1868 OE2 GLU A 116 31.773 75.883 -24.002 1.00 0.00 O ATOM 0 H GLU A 116 32.370 75.791 -19.872 1.00 0.00 H new ATOM 0 HA GLU A 116 35.228 75.066 -20.167 1.00 0.00 H new ATOM 0 HB2 GLU A 116 35.227 76.175 -22.334 1.00 0.00 H new ATOM 0 HB3 GLU A 116 34.078 74.851 -22.329 1.00 0.00 H new ATOM 0 HG2 GLU A 116 32.914 77.447 -21.468 1.00 0.00 H new ATOM 0 HG3 GLU A 116 33.514 77.455 -23.115 1.00 0.00 H new ATOM 1875 N MET A 117 35.995 77.349 -19.572 1.00 0.00 N ATOM 1876 CA MET A 117 36.436 78.607 -18.994 1.00 0.00 C ATOM 1877 C MET A 117 37.179 79.456 -20.028 1.00 0.00 C ATOM 1878 O MET A 117 37.536 78.966 -21.098 1.00 0.00 O ATOM 1879 CB MET A 117 37.359 78.328 -17.806 1.00 0.00 C ATOM 1880 CG MET A 117 36.576 77.739 -16.630 1.00 0.00 C ATOM 1881 SD MET A 117 36.777 75.966 -16.589 1.00 0.00 S ATOM 1882 CE MET A 117 35.123 75.455 -17.022 1.00 0.00 C ATOM 0 H MET A 117 36.746 76.697 -19.798 1.00 0.00 H new ATOM 0 HA MET A 117 35.557 79.159 -18.662 1.00 0.00 H new ATOM 0 HB2 MET A 117 38.146 77.636 -18.107 1.00 0.00 H new ATOM 0 HB3 MET A 117 37.848 79.252 -17.496 1.00 0.00 H new ATOM 0 HG2 MET A 117 36.927 78.175 -15.694 1.00 0.00 H new ATOM 0 HG3 MET A 117 35.520 77.991 -16.723 1.00 0.00 H new ATOM 0 HE1 MET A 117 34.673 74.929 -16.180 1.00 0.00 H new ATOM 0 HE2 MET A 117 34.523 76.332 -17.265 1.00 0.00 H new ATOM 0 HE3 MET A 117 35.162 74.791 -17.886 1.00 0.00 H new ATOM 1892 N ASP A 118 37.389 80.715 -19.672 1.00 0.00 N ATOM 1893 CA ASP A 118 38.082 81.637 -20.556 1.00 0.00 C ATOM 1894 C ASP A 118 39.587 81.371 -20.484 1.00 0.00 C ATOM 1895 O ASP A 118 40.115 81.060 -19.417 1.00 0.00 O ATOM 1896 CB ASP A 118 37.837 83.088 -20.140 1.00 0.00 C ATOM 1897 CG ASP A 118 38.421 84.140 -21.086 1.00 0.00 C ATOM 1898 OD1 ASP A 118 39.643 84.382 -20.980 1.00 0.00 O ATOM 1899 OD2 ASP A 118 37.633 84.677 -21.893 1.00 0.00 O ATOM 0 H ASP A 118 37.091 81.118 -18.784 1.00 0.00 H new ATOM 0 HA ASP A 118 37.704 81.484 -21.567 1.00 0.00 H new ATOM 0 HB2 ASP A 118 36.762 83.250 -20.059 1.00 0.00 H new ATOM 0 HB3 ASP A 118 38.258 83.241 -19.146 1.00 0.00 H new ATOM 1904 N PRO A 119 40.252 81.508 -21.662 1.00 0.00 N ATOM 1905 CA PRO A 119 41.686 81.287 -21.742 1.00 0.00 C ATOM 1906 C PRO A 119 42.457 82.459 -21.131 1.00 0.00 C ATOM 1907 O PRO A 119 43.191 82.285 -20.159 1.00 0.00 O ATOM 1908 CB PRO A 119 41.972 81.095 -23.222 1.00 0.00 C ATOM 1909 CG PRO A 119 40.775 81.675 -23.957 1.00 0.00 C ATOM 1910 CD PRO A 119 39.659 81.876 -22.944 1.00 0.00 C ATOM 0 HA PRO A 119 42.010 80.417 -21.171 1.00 0.00 H new ATOM 0 HB2 PRO A 119 42.892 81.604 -23.511 1.00 0.00 H new ATOM 0 HB3 PRO A 119 42.103 80.040 -23.461 1.00 0.00 H new ATOM 0 HG2 PRO A 119 41.038 82.622 -24.428 1.00 0.00 H new ATOM 0 HG3 PRO A 119 40.453 81.003 -24.752 1.00 0.00 H new ATOM 0 HD2 PRO A 119 39.311 82.909 -22.938 1.00 0.00 H new ATOM 0 HD3 PRO A 119 38.797 81.251 -23.176 1.00 0.00 H new ATOM 1918 N THR A 120 42.263 83.627 -21.725 1.00 0.00 N ATOM 1919 CA THR A 120 42.931 84.828 -21.252 1.00 0.00 C ATOM 1920 C THR A 120 42.289 86.073 -21.867 1.00 0.00 C ATOM 1921 O THR A 120 41.482 85.968 -22.789 1.00 0.00 O ATOM 1922 CB THR A 120 44.422 84.694 -21.566 1.00 0.00 C ATOM 1923 OG1 THR A 120 45.016 85.816 -20.918 1.00 0.00 O ATOM 1924 CG2 THR A 120 44.730 84.916 -23.049 1.00 0.00 C ATOM 0 H THR A 120 41.653 83.768 -22.530 1.00 0.00 H new ATOM 0 HA THR A 120 42.821 84.944 -20.174 1.00 0.00 H new ATOM 0 HB THR A 120 44.768 83.705 -21.266 1.00 0.00 H new ATOM 0 HG1 THR A 120 45.984 85.806 -21.069 1.00 0.00 H new ATOM 0 HG21 THR A 120 45.802 84.810 -23.218 1.00 0.00 H new ATOM 0 HG22 THR A 120 44.194 84.179 -23.646 1.00 0.00 H new ATOM 0 HG23 THR A 120 44.414 85.918 -23.340 1.00 0.00 H new ATOM 1932 N THR A 121 42.672 87.222 -21.331 1.00 0.00 N ATOM 1933 CA THR A 121 42.144 88.486 -21.815 1.00 0.00 C ATOM 1934 C THR A 121 43.079 89.636 -21.435 1.00 0.00 C ATOM 1935 O THR A 121 43.740 89.587 -20.399 1.00 0.00 O ATOM 1936 CB THR A 121 40.726 88.649 -21.263 1.00 0.00 C ATOM 1937 OG1 THR A 121 39.958 87.697 -21.994 1.00 0.00 O ATOM 1938 CG2 THR A 121 40.103 89.996 -21.637 1.00 0.00 C ATOM 0 H THR A 121 43.342 87.304 -20.566 1.00 0.00 H new ATOM 0 HA THR A 121 42.089 88.500 -22.904 1.00 0.00 H new ATOM 0 HB THR A 121 40.745 88.547 -20.178 1.00 0.00 H new ATOM 0 HG1 THR A 121 40.477 87.377 -22.761 1.00 0.00 H new ATOM 0 HG21 THR A 121 39.098 90.060 -21.221 1.00 0.00 H new ATOM 0 HG22 THR A 121 40.714 90.804 -21.235 1.00 0.00 H new ATOM 0 HG23 THR A 121 40.053 90.085 -22.722 1.00 0.00 H new ATOM 1946 N ALA A 122 43.105 90.644 -22.295 1.00 0.00 N ATOM 1947 CA ALA A 122 43.949 91.804 -22.063 1.00 0.00 C ATOM 1948 C ALA A 122 43.804 92.778 -23.234 1.00 0.00 C ATOM 1949 O ALA A 122 43.098 92.491 -24.200 1.00 0.00 O ATOM 1950 CB ALA A 122 45.396 91.350 -21.857 1.00 0.00 C ATOM 0 H ALA A 122 42.555 90.681 -23.153 1.00 0.00 H new ATOM 0 HA ALA A 122 43.640 92.328 -21.159 1.00 0.00 H new ATOM 0 HB1 ALA A 122 46.029 92.220 -21.683 1.00 0.00 H new ATOM 0 HB2 ALA A 122 45.449 90.684 -20.996 1.00 0.00 H new ATOM 0 HB3 ALA A 122 45.742 90.822 -22.746 1.00 0.00 H new ATOM 1956 N ALA A 123 44.483 93.908 -23.110 1.00 0.00 N ATOM 1957 CA ALA A 123 44.438 94.926 -24.146 1.00 0.00 C ATOM 1958 C ALA A 123 45.863 95.386 -24.465 1.00 0.00 C ATOM 1959 O ALA A 123 46.831 94.791 -23.994 1.00 0.00 O ATOM 1960 CB ALA A 123 43.541 96.079 -23.691 1.00 0.00 C ATOM 0 H ALA A 123 45.068 94.142 -22.308 1.00 0.00 H new ATOM 0 HA ALA A 123 44.009 94.522 -25.063 1.00 0.00 H new ATOM 0 HB1 ALA A 123 43.507 96.842 -24.468 1.00 0.00 H new ATOM 0 HB2 ALA A 123 42.534 95.705 -23.506 1.00 0.00 H new ATOM 0 HB3 ALA A 123 43.942 96.512 -22.774 1.00 0.00 H new ATOM 1966 N LEU A 124 45.945 96.441 -25.262 1.00 0.00 N ATOM 1967 CA LEU A 124 47.235 96.987 -25.649 1.00 0.00 C ATOM 1968 C LEU A 124 47.425 98.353 -24.986 1.00 0.00 C ATOM 1969 O LEU A 124 47.583 98.440 -23.769 1.00 0.00 O ATOM 1970 CB LEU A 124 47.367 97.020 -27.173 1.00 0.00 C ATOM 1971 CG LEU A 124 46.154 97.549 -27.940 1.00 0.00 C ATOM 1972 CD1 LEU A 124 46.588 98.470 -29.083 1.00 0.00 C ATOM 1973 CD2 LEU A 124 45.273 96.400 -28.433 1.00 0.00 C ATOM 0 H LEU A 124 45.140 96.932 -25.650 1.00 0.00 H new ATOM 0 HA LEU A 124 48.042 96.345 -25.296 1.00 0.00 H new ATOM 0 HB2 LEU A 124 48.230 97.634 -27.430 1.00 0.00 H new ATOM 0 HB3 LEU A 124 47.580 96.009 -27.521 1.00 0.00 H new ATOM 0 HG LEU A 124 45.551 98.146 -27.256 1.00 0.00 H new ATOM 0 HD11 LEU A 124 45.707 98.833 -29.613 1.00 0.00 H new ATOM 0 HD12 LEU A 124 47.142 99.317 -28.678 1.00 0.00 H new ATOM 0 HD13 LEU A 124 47.225 97.917 -29.774 1.00 0.00 H new ATOM 0 HD21 LEU A 124 44.418 96.804 -28.975 1.00 0.00 H new ATOM 0 HD22 LEU A 124 45.852 95.756 -29.096 1.00 0.00 H new ATOM 0 HD23 LEU A 124 44.921 95.820 -27.580 1.00 0.00 H new ATOM 1985 N GLU A 125 47.402 99.386 -25.815 1.00 0.00 N ATOM 1986 CA GLU A 125 47.570 100.743 -25.325 1.00 0.00 C ATOM 1987 C GLU A 125 47.502 101.739 -26.484 1.00 0.00 C ATOM 1988 O GLU A 125 48.088 101.508 -27.541 1.00 0.00 O ATOM 1989 CB GLU A 125 48.883 100.889 -24.553 1.00 0.00 C ATOM 1990 CG GLU A 125 48.737 101.891 -23.406 1.00 0.00 C ATOM 1991 CD GLU A 125 49.931 101.812 -22.453 1.00 0.00 C ATOM 1992 OE1 GLU A 125 51.033 102.210 -22.889 1.00 0.00 O ATOM 1993 OE2 GLU A 125 49.716 101.354 -21.310 1.00 0.00 O ATOM 0 H GLU A 125 47.269 99.310 -26.824 1.00 0.00 H new ATOM 0 HA GLU A 125 46.755 100.962 -24.635 1.00 0.00 H new ATOM 0 HB2 GLU A 125 49.186 99.920 -24.157 1.00 0.00 H new ATOM 0 HB3 GLU A 125 49.672 101.218 -25.229 1.00 0.00 H new ATOM 0 HG2 GLU A 125 48.655 102.901 -23.809 1.00 0.00 H new ATOM 0 HG3 GLU A 125 47.816 101.690 -22.858 1.00 0.00 H new ATOM 2000 N LYS A 126 46.781 102.825 -26.248 1.00 0.00 N ATOM 2001 CA LYS A 126 46.629 103.857 -27.260 1.00 0.00 C ATOM 2002 C LYS A 126 47.850 104.779 -27.230 1.00 0.00 C ATOM 2003 O LYS A 126 48.494 104.928 -26.193 1.00 0.00 O ATOM 2004 CB LYS A 126 45.299 104.592 -27.080 1.00 0.00 C ATOM 2005 CG LYS A 126 45.271 105.884 -27.898 1.00 0.00 C ATOM 2006 CD LYS A 126 44.068 106.749 -27.518 1.00 0.00 C ATOM 2007 CE LYS A 126 44.341 108.226 -27.805 1.00 0.00 C ATOM 2008 NZ LYS A 126 43.258 108.803 -28.632 1.00 0.00 N ATOM 0 H LYS A 126 46.296 103.013 -25.371 1.00 0.00 H new ATOM 0 HA LYS A 126 46.589 103.412 -28.254 1.00 0.00 H new ATOM 0 HB2 LYS A 126 44.477 103.945 -27.387 1.00 0.00 H new ATOM 0 HB3 LYS A 126 45.146 104.822 -26.025 1.00 0.00 H new ATOM 0 HG2 LYS A 126 46.192 106.443 -27.732 1.00 0.00 H new ATOM 0 HG3 LYS A 126 45.230 105.645 -28.961 1.00 0.00 H new ATOM 0 HD2 LYS A 126 43.190 106.423 -28.076 1.00 0.00 H new ATOM 0 HD3 LYS A 126 43.840 106.617 -26.460 1.00 0.00 H new ATOM 0 HE2 LYS A 126 44.422 108.776 -26.867 1.00 0.00 H new ATOM 0 HE3 LYS A 126 45.296 108.332 -28.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 43.460 109.806 -28.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 43.199 108.289 -29.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 42.353 108.719 -28.126 1.00 0.00 H new ATOM 2022 N GLU A 127 48.131 105.373 -28.380 1.00 0.00 N ATOM 2023 CA GLU A 127 49.263 106.276 -28.499 1.00 0.00 C ATOM 2024 C GLU A 127 48.896 107.476 -29.374 1.00 0.00 C ATOM 2025 O GLU A 127 47.957 107.406 -30.167 1.00 0.00 O ATOM 2026 CB GLU A 127 50.489 105.548 -29.053 1.00 0.00 C ATOM 2027 CG GLU A 127 51.780 106.121 -28.465 1.00 0.00 C ATOM 2028 CD GLU A 127 52.533 105.061 -27.657 1.00 0.00 C ATOM 2029 OE1 GLU A 127 51.842 104.231 -27.028 1.00 0.00 O ATOM 2030 OE2 GLU A 127 53.781 105.105 -27.688 1.00 0.00 O ATOM 0 H GLU A 127 47.594 105.247 -29.238 1.00 0.00 H new ATOM 0 HA GLU A 127 49.517 106.641 -27.504 1.00 0.00 H new ATOM 0 HB2 GLU A 127 50.420 104.485 -28.822 1.00 0.00 H new ATOM 0 HB3 GLU A 127 50.509 105.637 -30.139 1.00 0.00 H new ATOM 0 HG2 GLU A 127 52.417 106.491 -29.269 1.00 0.00 H new ATOM 0 HG3 GLU A 127 51.546 106.972 -27.826 1.00 0.00 H new ATOM 2037 N SER A 128 49.654 108.548 -29.202 1.00 0.00 N ATOM 2038 CA SER A 128 49.420 109.761 -29.966 1.00 0.00 C ATOM 2039 C SER A 128 50.490 110.803 -29.635 1.00 0.00 C ATOM 2040 O SER A 128 51.213 110.664 -28.649 1.00 0.00 O ATOM 2041 CB SER A 128 48.026 110.326 -29.689 1.00 0.00 C ATOM 2042 OG SER A 128 47.204 110.313 -30.854 1.00 0.00 O ATOM 0 H SER A 128 50.432 108.602 -28.544 1.00 0.00 H new ATOM 0 HA SER A 128 49.478 109.514 -31.026 1.00 0.00 H new ATOM 0 HB2 SER A 128 47.548 109.743 -28.902 1.00 0.00 H new ATOM 0 HB3 SER A 128 48.116 111.348 -29.320 1.00 0.00 H new ATOM 0 HG SER A 128 47.104 109.392 -31.174 1.00 0.00 H new ATOM 2048 N GLY A 129 50.557 111.824 -30.476 1.00 0.00 N ATOM 2049 CA GLY A 129 51.527 112.889 -30.285 1.00 0.00 C ATOM 2050 C GLY A 129 51.314 114.014 -31.300 1.00 0.00 C ATOM 2051 O GLY A 129 51.412 113.794 -32.506 1.00 0.00 O ATOM 0 H GLY A 129 49.955 111.937 -31.292 1.00 0.00 H new ATOM 0 HA2 GLY A 129 51.442 113.286 -29.274 1.00 0.00 H new ATOM 0 HA3 GLY A 129 52.536 112.489 -30.386 1.00 0.00 H new ATOM 2055 N PRO A 130 51.018 115.227 -30.760 1.00 0.00 N ATOM 2056 CA PRO A 130 50.790 116.387 -31.605 1.00 0.00 C ATOM 2057 C PRO A 130 52.107 116.921 -32.171 1.00 0.00 C ATOM 2058 O PRO A 130 53.163 116.325 -31.963 1.00 0.00 O ATOM 2059 CB PRO A 130 50.076 117.389 -30.713 1.00 0.00 C ATOM 2060 CG PRO A 130 50.344 116.942 -29.286 1.00 0.00 C ATOM 2061 CD PRO A 130 50.893 115.525 -29.337 1.00 0.00 C ATOM 0 HA PRO A 130 50.187 116.156 -32.483 1.00 0.00 H new ATOM 0 HB2 PRO A 130 50.450 118.399 -30.883 1.00 0.00 H new ATOM 0 HB3 PRO A 130 49.006 117.406 -30.923 1.00 0.00 H new ATOM 0 HG2 PRO A 130 51.057 117.611 -28.804 1.00 0.00 H new ATOM 0 HG3 PRO A 130 49.427 116.975 -28.697 1.00 0.00 H new ATOM 0 HD2 PRO A 130 51.856 115.455 -28.832 1.00 0.00 H new ATOM 0 HD3 PRO A 130 50.222 114.822 -28.843 1.00 0.00 H new ATOM 2069 N SER A 131 52.002 118.039 -32.874 1.00 0.00 N ATOM 2070 CA SER A 131 53.172 118.660 -33.471 1.00 0.00 C ATOM 2071 C SER A 131 52.831 120.075 -33.942 1.00 0.00 C ATOM 2072 O SER A 131 51.677 120.495 -33.871 1.00 0.00 O ATOM 2073 CB SER A 131 53.704 117.826 -34.639 1.00 0.00 C ATOM 2074 OG SER A 131 52.846 117.891 -35.775 1.00 0.00 O ATOM 0 H SER A 131 51.125 118.531 -33.044 1.00 0.00 H new ATOM 0 HA SER A 131 53.953 118.714 -32.713 1.00 0.00 H new ATOM 0 HB2 SER A 131 54.698 118.180 -34.914 1.00 0.00 H new ATOM 0 HB3 SER A 131 53.811 116.788 -34.324 1.00 0.00 H new ATOM 0 HG SER A 131 53.221 117.348 -36.499 1.00 0.00 H new ATOM 2080 N SER A 132 53.855 120.771 -34.412 1.00 0.00 N ATOM 2081 CA SER A 132 53.678 122.131 -34.894 1.00 0.00 C ATOM 2082 C SER A 132 53.418 123.073 -33.718 1.00 0.00 C ATOM 2083 O SER A 132 54.184 124.007 -33.484 1.00 0.00 O ATOM 2084 CB SER A 132 52.531 122.212 -35.904 1.00 0.00 C ATOM 2085 OG SER A 132 52.980 122.635 -37.188 1.00 0.00 O ATOM 0 H SER A 132 54.811 120.419 -34.470 1.00 0.00 H new ATOM 0 HA SER A 132 54.594 122.437 -35.400 1.00 0.00 H new ATOM 0 HB2 SER A 132 52.054 121.236 -35.990 1.00 0.00 H new ATOM 0 HB3 SER A 132 51.774 122.905 -35.538 1.00 0.00 H new ATOM 0 HG SER A 132 52.219 122.672 -37.805 1.00 0.00 H new ATOM 2091 N GLY A 133 52.333 122.797 -33.008 1.00 0.00 N ATOM 2092 CA GLY A 133 51.962 123.609 -31.862 1.00 0.00 C ATOM 2093 C GLY A 133 52.146 122.832 -30.557 1.00 0.00 C ATOM 2094 O GLY A 133 52.385 121.625 -30.577 1.00 0.00 O ATOM 0 H GLY A 133 51.699 122.022 -33.205 1.00 0.00 H new ATOM 0 HA2 GLY A 133 52.571 124.513 -31.840 1.00 0.00 H new ATOM 0 HA3 GLY A 133 50.923 123.926 -31.957 1.00 0.00 H new