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 178:sc= 0.921! USER MOD Set 1.2: A 51 TYR OH : rot -11:sc= 1.95 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot 180:sc= 1.02 USER MOD Single : A 29 HIS : no HD1:sc= -0.0324 X(o=-0.032,f=-0.22) USER MOD Single : A 30 SER OG : rot 180:sc=0.000118 USER MOD Single : A 35 GLN : amide:sc= 0.205 K(o=0.21,f=-4.4!) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -0.796 K(o=-0.8,f=-1.4) USER MOD Single : A 41 GLN : amide:sc= -0.311 X(o=-0.31,f=-0.31) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 HIS :FLIP no HD1:sc= -0.909 F(o=-2.7!,f=-0.91) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=-0.093) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 30:sc= 0.273 USER MOD Single : A 99 ASN : amide:sc= -0.0229 X(o=-0.023,f=-0.17) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=-0.26) 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 :FLIP no HD1:sc= -0.0485 F(o=-0.91,f=-0.049) USER MOD Single : A 108 ASN : amide:sc= -0.0117 X(o=-0.012,f=0.32) USER MOD Single : A 109 HIS :FLIP no HD1:sc= -1.02 F(o=-3.4!,f=-1) USER MOD Single : A 111 GLN : amide:sc= -4.91! C(o=-4.9!,f=-5.4!) USER MOD Single : A 112 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00871) USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 MET CE :methyl 156:sc= -0.35 (180deg=-0.638) USER MOD Single : A 120 THR OG1 : rot 180:sc=-0.00734 USER MOD Single : A 121 THR OG1 : rot 180:sc= -0.0332 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 180:sc= 0 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 140 N VAL A 13 -59.364 -3.339 6.957 1.00 0.00 N ATOM 141 CA VAL A 13 -59.465 -1.891 7.019 1.00 0.00 C ATOM 142 C VAL A 13 -60.193 -1.489 8.303 1.00 0.00 C ATOM 143 O VAL A 13 -61.383 -1.761 8.457 1.00 0.00 O ATOM 144 CB VAL A 13 -60.143 -1.359 5.755 1.00 0.00 C ATOM 145 CG1 VAL A 13 -60.523 0.115 5.916 1.00 0.00 C ATOM 146 CG2 VAL A 13 -59.254 -1.565 4.527 1.00 0.00 C ATOM 0 HA VAL A 13 -58.473 -1.440 7.054 1.00 0.00 H new ATOM 0 HB VAL A 13 -61.061 -1.927 5.603 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -61.003 0.469 5.004 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -61.211 0.224 6.754 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -59.625 0.704 6.105 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -59.760 -1.178 3.642 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -58.312 -1.035 4.667 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -59.056 -2.629 4.395 1.00 0.00 H new ATOM 156 N GLU A 14 -59.448 -0.848 9.192 1.00 0.00 N ATOM 157 CA GLU A 14 -60.008 -0.405 10.457 1.00 0.00 C ATOM 158 C GLU A 14 -60.294 1.097 10.416 1.00 0.00 C ATOM 159 O GLU A 14 -59.525 1.863 9.836 1.00 0.00 O ATOM 160 CB GLU A 14 -59.077 -0.754 11.620 1.00 0.00 C ATOM 161 CG GLU A 14 -58.963 -2.270 11.795 1.00 0.00 C ATOM 162 CD GLU A 14 -58.482 -2.625 13.204 1.00 0.00 C ATOM 163 OE1 GLU A 14 -57.328 -2.263 13.517 1.00 0.00 O ATOM 164 OE2 GLU A 14 -59.280 -3.249 13.936 1.00 0.00 O ATOM 0 H GLU A 14 -58.461 -0.625 9.061 1.00 0.00 H new ATOM 0 HA GLU A 14 -60.950 -0.929 10.618 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -58.089 -0.330 11.440 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -59.454 -0.305 12.539 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -59.931 -2.735 11.610 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -58.269 -2.674 11.058 1.00 0.00 H new ATOM 171 N ILE A 15 -61.401 1.474 11.038 1.00 0.00 N ATOM 172 CA ILE A 15 -61.797 2.872 11.079 1.00 0.00 C ATOM 173 C ILE A 15 -61.008 3.589 12.175 1.00 0.00 C ATOM 174 O ILE A 15 -60.627 2.978 13.172 1.00 0.00 O ATOM 175 CB ILE A 15 -63.315 2.994 11.233 1.00 0.00 C ATOM 176 CG1 ILE A 15 -64.040 1.983 10.342 1.00 0.00 C ATOM 177 CG2 ILE A 15 -63.779 4.427 10.970 1.00 0.00 C ATOM 178 CD1 ILE A 15 -63.618 2.140 8.880 1.00 0.00 C ATOM 0 H ILE A 15 -62.036 0.836 11.518 1.00 0.00 H new ATOM 0 HA ILE A 15 -61.555 3.365 10.138 1.00 0.00 H new ATOM 0 HB ILE A 15 -63.574 2.756 12.265 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -63.820 0.971 10.681 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -65.118 2.122 10.430 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -64.861 4.486 11.086 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -63.301 5.101 11.681 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -63.506 4.717 9.955 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -64.148 1.410 8.268 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -63.861 3.146 8.537 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -62.544 1.976 8.792 1.00 0.00 H new ATOM 190 N GLY A 16 -60.785 4.876 11.954 1.00 0.00 N ATOM 191 CA GLY A 16 -60.048 5.684 12.911 1.00 0.00 C ATOM 192 C GLY A 16 -58.559 5.727 12.559 1.00 0.00 C ATOM 193 O GLY A 16 -57.872 6.698 12.874 1.00 0.00 O ATOM 0 H GLY A 16 -61.102 5.380 11.126 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -60.452 6.696 12.925 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -60.177 5.275 13.913 1.00 0.00 H new ATOM 197 N GLU A 17 -58.105 4.664 11.912 1.00 0.00 N ATOM 198 CA GLU A 17 -56.711 4.568 11.515 1.00 0.00 C ATOM 199 C GLU A 17 -56.478 5.328 10.208 1.00 0.00 C ATOM 200 O GLU A 17 -57.428 5.657 9.499 1.00 0.00 O ATOM 201 CB GLU A 17 -56.277 3.107 11.385 1.00 0.00 C ATOM 202 CG GLU A 17 -55.791 2.557 12.728 1.00 0.00 C ATOM 203 CD GLU A 17 -56.743 1.482 13.256 1.00 0.00 C ATOM 204 OE1 GLU A 17 -57.968 1.717 13.171 1.00 0.00 O ATOM 205 OE2 GLU A 17 -56.224 0.450 13.734 1.00 0.00 O ATOM 0 H GLU A 17 -58.678 3.861 11.653 1.00 0.00 H new ATOM 0 HA GLU A 17 -56.100 5.026 12.293 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -57.112 2.507 11.023 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -55.481 3.025 10.645 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -54.791 2.138 12.613 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -55.716 3.369 13.452 1.00 0.00 H new ATOM 212 N THR A 18 -55.209 5.585 9.928 1.00 0.00 N ATOM 213 CA THR A 18 -54.839 6.300 8.718 1.00 0.00 C ATOM 214 C THR A 18 -54.158 5.354 7.726 1.00 0.00 C ATOM 215 O THR A 18 -53.340 4.524 8.117 1.00 0.00 O ATOM 216 CB THR A 18 -53.966 7.490 9.120 1.00 0.00 C ATOM 217 OG1 THR A 18 -54.598 8.005 10.289 1.00 0.00 O ATOM 218 CG2 THR A 18 -54.047 8.641 8.116 1.00 0.00 C ATOM 0 H THR A 18 -54.424 5.311 10.518 1.00 0.00 H new ATOM 0 HA THR A 18 -55.719 6.684 8.201 1.00 0.00 H new ATOM 0 HB THR A 18 -52.930 7.164 9.216 1.00 0.00 H new ATOM 0 HG1 THR A 18 -54.096 8.779 10.618 1.00 0.00 H new ATOM 0 HG21 THR A 18 -53.409 9.460 8.449 1.00 0.00 H new ATOM 0 HG22 THR A 18 -53.713 8.295 7.138 1.00 0.00 H new ATOM 0 HG23 THR A 18 -55.077 8.990 8.045 1.00 0.00 H new ATOM 226 N TYR A 19 -54.522 5.512 6.462 1.00 0.00 N ATOM 227 CA TYR A 19 -53.956 4.683 5.412 1.00 0.00 C ATOM 228 C TYR A 19 -53.467 5.538 4.241 1.00 0.00 C ATOM 229 O TYR A 19 -53.859 6.697 4.108 1.00 0.00 O ATOM 230 CB TYR A 19 -55.094 3.781 4.928 1.00 0.00 C ATOM 231 CG TYR A 19 -55.582 2.779 5.977 1.00 0.00 C ATOM 232 CD1 TYR A 19 -56.168 3.230 7.141 1.00 0.00 C ATOM 233 CD2 TYR A 19 -55.435 1.424 5.757 1.00 0.00 C ATOM 234 CE1 TYR A 19 -56.628 2.287 8.128 1.00 0.00 C ATOM 235 CE2 TYR A 19 -55.894 0.481 6.744 1.00 0.00 C ATOM 236 CZ TYR A 19 -56.468 0.959 7.881 1.00 0.00 C ATOM 237 OH TYR A 19 -56.902 0.068 8.812 1.00 0.00 O ATOM 0 H TYR A 19 -55.202 6.202 6.142 1.00 0.00 H new ATOM 0 HA TYR A 19 -53.104 4.117 5.788 1.00 0.00 H new ATOM 0 HB2 TYR A 19 -55.932 4.405 4.619 1.00 0.00 H new ATOM 0 HB3 TYR A 19 -54.761 3.235 4.046 1.00 0.00 H new ATOM 0 HD1 TYR A 19 -56.282 4.290 7.313 1.00 0.00 H new ATOM 0 HD2 TYR A 19 -54.976 1.071 4.845 1.00 0.00 H new ATOM 0 HE1 TYR A 19 -57.089 2.627 9.043 1.00 0.00 H new ATOM 0 HE2 TYR A 19 -55.785 -0.582 6.585 1.00 0.00 H new ATOM 0 HH TYR A 19 -56.723 -0.844 8.500 1.00 0.00 H new ATOM 247 N LEU A 20 -52.618 4.934 3.422 1.00 0.00 N ATOM 248 CA LEU A 20 -52.072 5.626 2.268 1.00 0.00 C ATOM 249 C LEU A 20 -53.011 5.438 1.074 1.00 0.00 C ATOM 250 O LEU A 20 -53.303 4.310 0.681 1.00 0.00 O ATOM 251 CB LEU A 20 -50.637 5.169 1.999 1.00 0.00 C ATOM 252 CG LEU A 20 -49.637 5.394 3.135 1.00 0.00 C ATOM 253 CD1 LEU A 20 -49.380 6.887 3.351 1.00 0.00 C ATOM 254 CD2 LEU A 20 -50.100 4.701 4.418 1.00 0.00 C ATOM 0 H LEU A 20 -52.295 3.973 3.535 1.00 0.00 H new ATOM 0 HA LEU A 20 -52.011 6.697 2.460 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -50.654 4.105 1.762 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -50.272 5.687 1.112 1.00 0.00 H new ATOM 0 HG LEU A 20 -48.687 4.942 2.849 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -48.666 7.019 4.164 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -48.975 7.322 2.438 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -50.316 7.384 3.606 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -49.372 4.877 5.210 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -51.067 5.102 4.720 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -50.191 3.629 4.240 1.00 0.00 H new ATOM 266 N CYS A 21 -53.458 6.561 0.532 1.00 0.00 N ATOM 267 CA CYS A 21 -54.358 6.535 -0.609 1.00 0.00 C ATOM 268 C CYS A 21 -53.582 6.995 -1.844 1.00 0.00 C ATOM 269 O CYS A 21 -52.595 7.720 -1.727 1.00 0.00 O ATOM 270 CB CYS A 21 -55.604 7.389 -0.366 1.00 0.00 C ATOM 271 SG CYS A 21 -56.582 7.522 -1.907 1.00 0.00 S ATOM 0 H CYS A 21 -53.214 7.495 0.862 1.00 0.00 H new ATOM 0 HA CYS A 21 -54.720 5.519 -0.767 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -56.211 6.945 0.423 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -55.313 8.382 -0.023 1.00 0.00 H new ATOM 0 HG CYS A 21 -57.657 8.217 -1.680 1.00 0.00 H new ATOM 277 N ARG A 22 -54.058 6.556 -3.000 1.00 0.00 N ATOM 278 CA ARG A 22 -53.420 6.914 -4.256 1.00 0.00 C ATOM 279 C ARG A 22 -53.831 8.327 -4.676 1.00 0.00 C ATOM 280 O ARG A 22 -55.019 8.640 -4.735 1.00 0.00 O ATOM 281 CB ARG A 22 -53.798 5.930 -5.365 1.00 0.00 C ATOM 282 CG ARG A 22 -52.650 5.762 -6.363 1.00 0.00 C ATOM 283 CD ARG A 22 -52.337 4.283 -6.594 1.00 0.00 C ATOM 284 NE ARG A 22 -51.746 4.095 -7.939 1.00 0.00 N ATOM 285 CZ ARG A 22 -51.232 2.938 -8.378 1.00 0.00 C ATOM 286 NH1 ARG A 22 -51.233 1.859 -7.583 1.00 0.00 N ATOM 287 NH2 ARG A 22 -50.717 2.860 -9.613 1.00 0.00 N ATOM 0 H ARG A 22 -54.878 5.956 -3.093 1.00 0.00 H new ATOM 0 HA ARG A 22 -52.341 6.876 -4.103 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -54.050 4.963 -4.928 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -54.687 6.286 -5.885 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -52.914 6.234 -7.309 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -51.762 6.272 -5.990 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -51.646 3.925 -5.831 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -53.248 3.691 -6.502 1.00 0.00 H new ATOM 0 HE ARG A 22 -51.729 4.896 -8.570 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -51.625 1.918 -6.643 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -50.842 0.979 -7.918 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -50.716 3.681 -10.218 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -50.326 1.980 -9.948 1.00 0.00 H new ATOM 376 N TRP A 28 -48.133 8.617 -2.882 1.00 0.00 N ATOM 377 CA TRP A 28 -49.261 8.224 -2.055 1.00 0.00 C ATOM 378 C TRP A 28 -49.423 9.268 -0.949 1.00 0.00 C ATOM 379 O TRP A 28 -48.442 9.863 -0.503 1.00 0.00 O ATOM 380 CB TRP A 28 -49.077 6.804 -1.515 1.00 0.00 C ATOM 381 CG TRP A 28 -49.347 5.706 -2.546 1.00 0.00 C ATOM 382 CD1 TRP A 28 -48.778 5.546 -3.748 1.00 0.00 C ATOM 383 CD2 TRP A 28 -50.283 4.615 -2.415 1.00 0.00 C ATOM 384 NE1 TRP A 28 -49.276 4.436 -4.400 1.00 0.00 N ATOM 385 CE2 TRP A 28 -50.220 3.852 -3.563 1.00 0.00 C ATOM 386 CE3 TRP A 28 -51.153 4.284 -1.361 1.00 0.00 C ATOM 387 CZ2 TRP A 28 -51.003 2.710 -3.767 1.00 0.00 C ATOM 388 CZ3 TRP A 28 -51.929 3.140 -1.581 1.00 0.00 C ATOM 389 CH2 TRP A 28 -51.878 2.361 -2.731 1.00 0.00 C ATOM 0 HA TRP A 28 -50.178 8.195 -2.643 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -48.058 6.697 -1.144 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -49.743 6.661 -0.664 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -48.024 6.203 -4.156 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -49.002 4.105 -5.325 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -51.217 4.866 -0.454 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -50.936 2.129 -4.675 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -52.616 2.842 -0.803 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -52.510 1.491 -2.825 1.00 0.00 H new ATOM 400 N HIS A 29 -50.667 9.460 -0.537 1.00 0.00 N ATOM 401 CA HIS A 29 -50.970 10.422 0.509 1.00 0.00 C ATOM 402 C HIS A 29 -51.757 9.735 1.626 1.00 0.00 C ATOM 403 O HIS A 29 -52.451 8.748 1.385 1.00 0.00 O ATOM 404 CB HIS A 29 -51.697 11.639 -0.066 1.00 0.00 C ATOM 405 CG HIS A 29 -50.774 12.711 -0.597 1.00 0.00 C ATOM 406 ND1 HIS A 29 -49.811 13.325 0.184 1.00 0.00 N ATOM 407 CD2 HIS A 29 -50.678 13.270 -1.838 1.00 0.00 C ATOM 408 CE1 HIS A 29 -49.170 14.212 -0.563 1.00 0.00 C ATOM 409 NE2 HIS A 29 -49.710 14.177 -1.815 1.00 0.00 N ATOM 0 H HIS A 29 -51.478 8.965 -0.909 1.00 0.00 H new ATOM 0 HA HIS A 29 -50.043 10.797 0.943 1.00 0.00 H new ATOM 0 HB2 HIS A 29 -52.355 11.310 -0.870 1.00 0.00 H new ATOM 0 HB3 HIS A 29 -52.331 12.071 0.709 1.00 0.00 H new ATOM 0 HD2 HIS A 29 -51.287 13.017 -2.694 1.00 0.00 H new ATOM 0 HE1 HIS A 29 -48.362 14.850 -0.238 1.00 0.00 H new ATOM 0 HE2 HIS A 29 -49.418 14.753 -2.604 1.00 0.00 H new ATOM 417 N SER A 30 -51.624 10.284 2.825 1.00 0.00 N ATOM 418 CA SER A 30 -52.314 9.736 3.980 1.00 0.00 C ATOM 419 C SER A 30 -53.816 10.010 3.870 1.00 0.00 C ATOM 420 O SER A 30 -54.240 10.858 3.088 1.00 0.00 O ATOM 421 CB SER A 30 -51.762 10.322 5.281 1.00 0.00 C ATOM 422 OG SER A 30 -51.642 11.740 5.219 1.00 0.00 O ATOM 0 H SER A 30 -51.048 11.103 3.021 1.00 0.00 H new ATOM 0 HA SER A 30 -52.147 8.659 3.999 1.00 0.00 H new ATOM 0 HB2 SER A 30 -52.417 10.049 6.108 1.00 0.00 H new ATOM 0 HB3 SER A 30 -50.786 9.884 5.490 1.00 0.00 H new ATOM 0 HG SER A 30 -51.288 12.076 6.069 1.00 0.00 H new ATOM 428 N ALA A 31 -54.578 9.275 4.667 1.00 0.00 N ATOM 429 CA ALA A 31 -56.023 9.428 4.669 1.00 0.00 C ATOM 430 C ALA A 31 -56.614 8.630 5.833 1.00 0.00 C ATOM 431 O ALA A 31 -56.405 7.422 5.932 1.00 0.00 O ATOM 432 CB ALA A 31 -56.586 8.988 3.316 1.00 0.00 C ATOM 0 H ALA A 31 -54.222 8.572 5.315 1.00 0.00 H new ATOM 0 HA ALA A 31 -56.298 10.473 4.812 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -57.670 9.103 3.318 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -56.157 9.604 2.526 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -56.332 7.943 3.139 1.00 0.00 H new ATOM 438 N GLU A 32 -57.340 9.338 6.686 1.00 0.00 N ATOM 439 CA GLU A 32 -57.963 8.711 7.839 1.00 0.00 C ATOM 440 C GLU A 32 -59.249 7.994 7.424 1.00 0.00 C ATOM 441 O GLU A 32 -60.059 8.545 6.681 1.00 0.00 O ATOM 442 CB GLU A 32 -58.239 9.739 8.939 1.00 0.00 C ATOM 443 CG GLU A 32 -59.342 10.711 8.516 1.00 0.00 C ATOM 444 CD GLU A 32 -59.842 11.526 9.711 1.00 0.00 C ATOM 445 OE1 GLU A 32 -60.239 10.886 10.708 1.00 0.00 O ATOM 446 OE2 GLU A 32 -59.815 12.771 9.600 1.00 0.00 O ATOM 0 H GLU A 32 -57.511 10.340 6.601 1.00 0.00 H new ATOM 0 HA GLU A 32 -57.272 7.971 8.243 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -58.532 9.227 9.855 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -57.327 10.293 9.162 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -58.964 11.383 7.746 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -60.171 10.157 8.077 1.00 0.00 H new ATOM 453 N VAL A 33 -59.396 6.775 7.922 1.00 0.00 N ATOM 454 CA VAL A 33 -60.569 5.976 7.612 1.00 0.00 C ATOM 455 C VAL A 33 -61.752 6.470 8.446 1.00 0.00 C ATOM 456 O VAL A 33 -61.844 6.172 9.636 1.00 0.00 O ATOM 457 CB VAL A 33 -60.264 4.492 7.826 1.00 0.00 C ATOM 458 CG1 VAL A 33 -61.378 3.615 7.253 1.00 0.00 C ATOM 459 CG2 VAL A 33 -58.908 4.119 7.225 1.00 0.00 C ATOM 0 H VAL A 33 -58.722 6.321 8.538 1.00 0.00 H new ATOM 0 HA VAL A 33 -60.841 6.089 6.563 1.00 0.00 H new ATOM 0 HB VAL A 33 -60.215 4.312 8.900 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -61.136 2.565 7.418 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -62.319 3.853 7.748 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -61.474 3.801 6.183 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -58.716 3.059 7.391 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -58.916 4.323 6.154 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -58.125 4.709 7.701 1.00 0.00 H new ATOM 469 N ILE A 34 -62.628 7.216 7.790 1.00 0.00 N ATOM 470 CA ILE A 34 -63.801 7.755 8.457 1.00 0.00 C ATOM 471 C ILE A 34 -64.752 6.609 8.810 1.00 0.00 C ATOM 472 O ILE A 34 -65.104 6.426 9.974 1.00 0.00 O ATOM 473 CB ILE A 34 -64.447 8.849 7.605 1.00 0.00 C ATOM 474 CG1 ILE A 34 -63.443 9.959 7.285 1.00 0.00 C ATOM 475 CG2 ILE A 34 -65.709 9.394 8.277 1.00 0.00 C ATOM 476 CD1 ILE A 34 -63.524 11.085 8.318 1.00 0.00 C ATOM 0 H ILE A 34 -62.549 7.460 6.803 1.00 0.00 H new ATOM 0 HA ILE A 34 -63.519 8.237 9.393 1.00 0.00 H new ATOM 0 HB ILE A 34 -64.753 8.408 6.656 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -62.434 9.548 7.268 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -63.641 10.358 6.290 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -66.149 10.170 7.651 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -66.428 8.586 8.411 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -65.451 9.815 9.249 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -62.801 11.861 8.068 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -64.528 11.510 8.315 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -63.301 10.687 9.308 1.00 0.00 H new ATOM 488 N GLN A 35 -65.141 5.867 7.783 1.00 0.00 N ATOM 489 CA GLN A 35 -66.044 4.744 7.971 1.00 0.00 C ATOM 490 C GLN A 35 -65.909 3.755 6.811 1.00 0.00 C ATOM 491 O GLN A 35 -65.097 3.958 5.909 1.00 0.00 O ATOM 492 CB GLN A 35 -67.490 5.222 8.118 1.00 0.00 C ATOM 493 CG GLN A 35 -67.929 5.199 9.583 1.00 0.00 C ATOM 494 CD GLN A 35 -68.318 3.784 10.016 1.00 0.00 C ATOM 495 OE1 GLN A 35 -67.662 2.807 9.697 1.00 0.00 O ATOM 496 NE2 GLN A 35 -69.420 3.730 10.759 1.00 0.00 N ATOM 0 H GLN A 35 -64.847 6.022 6.818 1.00 0.00 H new ATOM 0 HA GLN A 35 -65.769 4.232 8.893 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -67.584 6.233 7.722 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -68.149 4.586 7.527 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -67.121 5.567 10.215 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -68.775 5.872 9.724 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -69.922 4.587 10.990 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -69.763 2.831 11.098 1.00 0.00 H new ATOM 505 N SER A 36 -66.716 2.706 6.873 1.00 0.00 N ATOM 506 CA SER A 36 -66.697 1.685 5.840 1.00 0.00 C ATOM 507 C SER A 36 -68.121 1.397 5.362 1.00 0.00 C ATOM 508 O SER A 36 -69.084 1.632 6.091 1.00 0.00 O ATOM 509 CB SER A 36 -66.036 0.402 6.346 1.00 0.00 C ATOM 510 OG SER A 36 -66.803 -0.225 7.370 1.00 0.00 O ATOM 0 H SER A 36 -67.387 2.541 7.623 1.00 0.00 H new ATOM 0 HA SER A 36 -66.109 2.058 5.002 1.00 0.00 H new ATOM 0 HB2 SER A 36 -65.906 -0.291 5.515 1.00 0.00 H new ATOM 0 HB3 SER A 36 -65.041 0.633 6.728 1.00 0.00 H new ATOM 0 HG SER A 36 -66.349 -1.042 7.666 1.00 0.00 H new ATOM 516 N ARG A 37 -68.211 0.890 4.141 1.00 0.00 N ATOM 517 CA ARG A 37 -69.502 0.567 3.558 1.00 0.00 C ATOM 518 C ARG A 37 -69.333 -0.443 2.421 1.00 0.00 C ATOM 519 O ARG A 37 -68.219 -0.680 1.958 1.00 0.00 O ATOM 520 CB ARG A 37 -70.192 1.821 3.018 1.00 0.00 C ATOM 521 CG ARG A 37 -69.348 2.485 1.928 1.00 0.00 C ATOM 522 CD ARG A 37 -70.178 3.492 1.129 1.00 0.00 C ATOM 523 NE ARG A 37 -70.073 3.198 -0.318 1.00 0.00 N ATOM 524 CZ ARG A 37 -70.625 3.950 -1.280 1.00 0.00 C ATOM 525 NH1 ARG A 37 -71.324 5.046 -0.954 1.00 0.00 N ATOM 526 NH2 ARG A 37 -70.478 3.607 -2.567 1.00 0.00 N ATOM 0 H ARG A 37 -67.411 0.695 3.539 1.00 0.00 H new ATOM 0 HA ARG A 37 -70.122 0.135 4.344 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -71.170 1.557 2.616 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -70.362 2.526 3.832 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -68.495 2.990 2.381 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -68.949 1.724 1.258 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -71.221 3.447 1.443 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -69.828 4.505 1.329 1.00 0.00 H new ATOM 0 HE ARG A 37 -69.547 2.371 -0.601 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -71.435 5.307 0.026 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -71.745 5.619 -1.686 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -69.946 2.773 -2.815 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -70.898 4.180 -3.299 1.00 0.00 H new ATOM 540 N VAL A 38 -70.455 -1.011 2.006 1.00 0.00 N ATOM 541 CA VAL A 38 -70.446 -1.990 0.932 1.00 0.00 C ATOM 542 C VAL A 38 -71.507 -1.615 -0.104 1.00 0.00 C ATOM 543 O VAL A 38 -72.573 -1.113 0.247 1.00 0.00 O ATOM 544 CB VAL A 38 -70.640 -3.396 1.504 1.00 0.00 C ATOM 545 CG1 VAL A 38 -71.226 -4.340 0.452 1.00 0.00 C ATOM 546 CG2 VAL A 38 -69.326 -3.946 2.064 1.00 0.00 C ATOM 0 H VAL A 38 -71.377 -0.812 2.394 1.00 0.00 H new ATOM 0 HA VAL A 38 -69.482 -1.990 0.424 1.00 0.00 H new ATOM 0 HB VAL A 38 -71.352 -3.328 2.326 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -71.354 -5.332 0.884 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -72.193 -3.961 0.121 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -70.549 -4.400 -0.400 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -69.491 -4.946 2.464 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -68.582 -3.992 1.268 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -68.967 -3.292 2.859 1.00 0.00 H new ATOM 556 N ASN A 39 -71.177 -1.873 -1.362 1.00 0.00 N ATOM 557 CA ASN A 39 -72.089 -1.569 -2.452 1.00 0.00 C ATOM 558 C ASN A 39 -72.707 -2.868 -2.972 1.00 0.00 C ATOM 559 O ASN A 39 -71.990 -3.787 -3.364 1.00 0.00 O ATOM 560 CB ASN A 39 -71.354 -0.897 -3.613 1.00 0.00 C ATOM 561 CG ASN A 39 -71.862 0.529 -3.832 1.00 0.00 C ATOM 562 OD1 ASN A 39 -71.985 1.320 -2.912 1.00 0.00 O ATOM 563 ND2 ASN A 39 -72.149 0.812 -5.100 1.00 0.00 N ATOM 0 H ASN A 39 -70.291 -2.289 -1.650 1.00 0.00 H new ATOM 0 HA ASN A 39 -72.856 -0.894 -2.072 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -70.284 -0.878 -3.408 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -71.494 -1.480 -4.523 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -72.495 1.738 -5.350 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -72.023 0.103 -5.822 1.00 0.00 H new ATOM 570 N ASP A 40 -74.032 -2.902 -2.958 1.00 0.00 N ATOM 571 CA ASP A 40 -74.755 -4.074 -3.423 1.00 0.00 C ATOM 572 C ASP A 40 -74.826 -4.050 -4.951 1.00 0.00 C ATOM 573 O ASP A 40 -74.575 -5.061 -5.604 1.00 0.00 O ATOM 574 CB ASP A 40 -76.186 -4.088 -2.883 1.00 0.00 C ATOM 575 CG ASP A 40 -76.306 -4.335 -1.378 1.00 0.00 C ATOM 576 OD1 ASP A 40 -75.349 -3.965 -0.664 1.00 0.00 O ATOM 577 OD2 ASP A 40 -77.353 -4.887 -0.975 1.00 0.00 O ATOM 0 H ASP A 40 -74.623 -2.137 -2.632 1.00 0.00 H new ATOM 0 HA ASP A 40 -74.227 -4.959 -3.068 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -76.657 -3.133 -3.118 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -76.749 -4.859 -3.409 1.00 0.00 H new ATOM 582 N GLN A 41 -75.171 -2.883 -5.477 1.00 0.00 N ATOM 583 CA GLN A 41 -75.279 -2.714 -6.916 1.00 0.00 C ATOM 584 C GLN A 41 -73.996 -3.185 -7.604 1.00 0.00 C ATOM 585 O GLN A 41 -74.043 -4.015 -8.511 1.00 0.00 O ATOM 586 CB GLN A 41 -75.592 -1.260 -7.276 1.00 0.00 C ATOM 587 CG GLN A 41 -77.029 -0.899 -6.896 1.00 0.00 C ATOM 588 CD GLN A 41 -78.031 -1.801 -7.620 1.00 0.00 C ATOM 589 OE1 GLN A 41 -78.053 -1.896 -8.836 1.00 0.00 O ATOM 590 NE2 GLN A 41 -78.855 -2.455 -6.807 1.00 0.00 N ATOM 0 H GLN A 41 -75.379 -2.046 -4.932 1.00 0.00 H new ATOM 0 HA GLN A 41 -76.106 -3.328 -7.273 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -74.898 -0.596 -6.760 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -75.445 -1.106 -8.345 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -77.159 -0.996 -5.818 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -77.225 0.143 -7.148 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -78.782 -2.329 -5.797 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -79.560 -3.083 -7.193 1.00 0.00 H new ATOM 599 N GLU A 42 -72.881 -2.635 -7.147 1.00 0.00 N ATOM 600 CA GLU A 42 -71.588 -2.989 -7.706 1.00 0.00 C ATOM 601 C GLU A 42 -71.094 -4.308 -7.110 1.00 0.00 C ATOM 602 O GLU A 42 -70.573 -5.162 -7.827 1.00 0.00 O ATOM 603 CB GLU A 42 -70.569 -1.870 -7.482 1.00 0.00 C ATOM 604 CG GLU A 42 -70.399 -1.022 -8.744 1.00 0.00 C ATOM 605 CD GLU A 42 -69.278 -1.573 -9.628 1.00 0.00 C ATOM 606 OE1 GLU A 42 -69.429 -2.728 -10.082 1.00 0.00 O ATOM 607 OE2 GLU A 42 -68.296 -0.827 -9.830 1.00 0.00 O ATOM 0 H GLU A 42 -72.846 -1.946 -6.395 1.00 0.00 H new ATOM 0 HA GLU A 42 -71.703 -3.121 -8.782 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -70.894 -1.238 -6.656 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -69.609 -2.300 -7.196 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -71.334 -1.006 -9.304 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -70.175 0.008 -8.467 1.00 0.00 H new ATOM 614 N GLY A 43 -71.274 -4.434 -5.803 1.00 0.00 N ATOM 615 CA GLY A 43 -70.854 -5.635 -5.102 1.00 0.00 C ATOM 616 C GLY A 43 -69.376 -5.554 -4.714 1.00 0.00 C ATOM 617 O GLY A 43 -68.624 -6.506 -4.917 1.00 0.00 O ATOM 0 H GLY A 43 -71.705 -3.724 -5.211 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -71.462 -5.770 -4.207 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -71.020 -6.507 -5.735 1.00 0.00 H new ATOM 621 N ARG A 44 -69.004 -4.408 -4.162 1.00 0.00 N ATOM 622 CA ARG A 44 -67.630 -4.191 -3.744 1.00 0.00 C ATOM 623 C ARG A 44 -67.594 -3.486 -2.386 1.00 0.00 C ATOM 624 O ARG A 44 -68.633 -3.092 -1.860 1.00 0.00 O ATOM 625 CB ARG A 44 -66.869 -3.347 -4.769 1.00 0.00 C ATOM 626 CG ARG A 44 -66.554 -4.163 -6.024 1.00 0.00 C ATOM 627 CD ARG A 44 -65.070 -4.534 -6.079 1.00 0.00 C ATOM 628 NE ARG A 44 -64.507 -4.173 -7.399 1.00 0.00 N ATOM 629 CZ ARG A 44 -63.307 -4.576 -7.839 1.00 0.00 C ATOM 630 NH1 ARG A 44 -62.537 -5.354 -7.067 1.00 0.00 N ATOM 631 NH2 ARG A 44 -62.877 -4.200 -9.052 1.00 0.00 N ATOM 0 H ARG A 44 -69.630 -3.621 -3.995 1.00 0.00 H new ATOM 0 HA ARG A 44 -67.149 -5.166 -3.665 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -67.462 -2.473 -5.038 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -65.943 -2.980 -4.327 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -67.160 -5.069 -6.034 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -66.822 -3.590 -6.912 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -64.527 -4.015 -5.289 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -64.947 -5.602 -5.902 1.00 0.00 H new ATOM 0 HE ARG A 44 -65.067 -3.581 -8.012 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -62.864 -5.640 -6.144 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -61.624 -5.661 -7.402 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -63.463 -3.607 -9.640 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -61.964 -4.507 -9.387 1.00 0.00 H new ATOM 645 N GLU A 45 -66.386 -3.348 -1.858 1.00 0.00 N ATOM 646 CA GLU A 45 -66.201 -2.698 -0.572 1.00 0.00 C ATOM 647 C GLU A 45 -65.541 -1.330 -0.759 1.00 0.00 C ATOM 648 O GLU A 45 -64.725 -1.149 -1.661 1.00 0.00 O ATOM 649 CB GLU A 45 -65.382 -3.577 0.374 1.00 0.00 C ATOM 650 CG GLU A 45 -66.031 -4.952 0.545 1.00 0.00 C ATOM 651 CD GLU A 45 -64.985 -6.066 0.469 1.00 0.00 C ATOM 652 OE1 GLU A 45 -64.631 -6.434 -0.672 1.00 0.00 O ATOM 653 OE2 GLU A 45 -64.563 -6.524 1.553 1.00 0.00 O ATOM 0 H GLU A 45 -65.526 -3.675 -2.298 1.00 0.00 H new ATOM 0 HA GLU A 45 -67.181 -2.548 -0.118 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -64.371 -3.694 -0.017 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -65.294 -3.089 1.345 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -66.547 -4.998 1.504 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -66.784 -5.102 -0.229 1.00 0.00 H new ATOM 660 N GLU A 46 -65.919 -0.403 0.108 1.00 0.00 N ATOM 661 CA GLU A 46 -65.374 0.943 0.050 1.00 0.00 C ATOM 662 C GLU A 46 -65.121 1.475 1.462 1.00 0.00 C ATOM 663 O GLU A 46 -65.676 0.960 2.431 1.00 0.00 O ATOM 664 CB GLU A 46 -66.302 1.877 -0.729 1.00 0.00 C ATOM 665 CG GLU A 46 -65.853 2.006 -2.186 1.00 0.00 C ATOM 666 CD GLU A 46 -66.993 1.655 -3.145 1.00 0.00 C ATOM 667 OE1 GLU A 46 -67.717 0.684 -2.834 1.00 0.00 O ATOM 668 OE2 GLU A 46 -67.115 2.365 -4.166 1.00 0.00 O ATOM 0 H GLU A 46 -66.596 -0.557 0.855 1.00 0.00 H new ATOM 0 HA GLU A 46 -64.422 0.906 -0.479 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -67.322 1.496 -0.692 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -66.312 2.861 -0.259 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -65.513 3.024 -2.377 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -65.004 1.347 -2.368 1.00 0.00 H new ATOM 675 N PHE A 47 -64.282 2.498 1.533 1.00 0.00 N ATOM 676 CA PHE A 47 -63.948 3.104 2.810 1.00 0.00 C ATOM 677 C PHE A 47 -63.786 4.620 2.671 1.00 0.00 C ATOM 678 O PHE A 47 -62.977 5.091 1.874 1.00 0.00 O ATOM 679 CB PHE A 47 -62.615 2.500 3.258 1.00 0.00 C ATOM 680 CG PHE A 47 -62.675 0.995 3.530 1.00 0.00 C ATOM 681 CD1 PHE A 47 -63.014 0.541 4.766 1.00 0.00 C ATOM 682 CD2 PHE A 47 -62.389 0.113 2.535 1.00 0.00 C ATOM 683 CE1 PHE A 47 -63.070 -0.856 5.018 1.00 0.00 C ATOM 684 CE2 PHE A 47 -62.444 -1.284 2.788 1.00 0.00 C ATOM 685 CZ PHE A 47 -62.783 -1.738 4.024 1.00 0.00 C ATOM 0 H PHE A 47 -63.824 2.922 0.727 1.00 0.00 H new ATOM 0 HA PHE A 47 -64.743 2.914 3.531 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -61.865 2.691 2.490 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -62.282 3.010 4.162 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -63.241 1.242 5.556 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -62.120 0.474 1.553 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -63.341 -1.217 5.999 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -62.217 -1.985 1.999 1.00 0.00 H new ATOM 0 HZ PHE A 47 -62.824 -2.800 4.216 1.00 0.00 H new ATOM 695 N TYR A 48 -64.568 5.341 3.461 1.00 0.00 N ATOM 696 CA TYR A 48 -64.522 6.793 3.436 1.00 0.00 C ATOM 697 C TYR A 48 -63.251 7.312 4.112 1.00 0.00 C ATOM 698 O TYR A 48 -63.217 7.486 5.329 1.00 0.00 O ATOM 699 CB TYR A 48 -65.739 7.267 4.233 1.00 0.00 C ATOM 700 CG TYR A 48 -66.165 8.703 3.922 1.00 0.00 C ATOM 701 CD1 TYR A 48 -66.225 9.137 2.613 1.00 0.00 C ATOM 702 CD2 TYR A 48 -66.489 9.565 4.950 1.00 0.00 C ATOM 703 CE1 TYR A 48 -66.627 10.489 2.320 1.00 0.00 C ATOM 704 CE2 TYR A 48 -66.891 10.916 4.657 1.00 0.00 C ATOM 705 CZ TYR A 48 -66.939 11.311 3.357 1.00 0.00 C ATOM 706 OH TYR A 48 -67.319 12.588 3.080 1.00 0.00 O ATOM 0 H TYR A 48 -65.237 4.947 4.122 1.00 0.00 H new ATOM 0 HA TYR A 48 -64.526 7.160 2.410 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -66.576 6.599 4.031 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -65.517 7.187 5.297 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -65.971 8.463 1.808 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -66.441 9.226 5.974 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -66.679 10.841 1.300 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -67.149 11.600 5.452 1.00 0.00 H new ATOM 0 HH TYR A 48 -67.513 13.060 3.916 1.00 0.00 H new ATOM 716 N VAL A 49 -62.237 7.545 3.292 1.00 0.00 N ATOM 717 CA VAL A 49 -60.967 8.041 3.795 1.00 0.00 C ATOM 718 C VAL A 49 -60.922 9.563 3.642 1.00 0.00 C ATOM 719 O VAL A 49 -61.321 10.098 2.609 1.00 0.00 O ATOM 720 CB VAL A 49 -59.811 7.335 3.084 1.00 0.00 C ATOM 721 CG1 VAL A 49 -60.025 5.820 3.061 1.00 0.00 C ATOM 722 CG2 VAL A 49 -59.620 7.883 1.669 1.00 0.00 C ATOM 0 H VAL A 49 -62.269 7.400 2.283 1.00 0.00 H new ATOM 0 HA VAL A 49 -60.863 7.817 4.857 1.00 0.00 H new ATOM 0 HB VAL A 49 -58.899 7.536 3.647 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -59.189 5.342 2.550 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -60.087 5.446 4.083 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -60.951 5.591 2.534 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -58.792 7.364 1.186 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -60.532 7.727 1.092 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -59.400 8.949 1.718 1.00 0.00 H new ATOM 732 N HIS A 50 -60.433 10.216 4.685 1.00 0.00 N ATOM 733 CA HIS A 50 -60.331 11.666 4.680 1.00 0.00 C ATOM 734 C HIS A 50 -58.870 12.077 4.485 1.00 0.00 C ATOM 735 O HIS A 50 -58.004 11.696 5.270 1.00 0.00 O ATOM 736 CB HIS A 50 -60.949 12.259 5.948 1.00 0.00 C ATOM 737 CG HIS A 50 -60.613 13.714 6.173 1.00 0.00 C ATOM 738 ND1 HIS A 50 -59.409 14.354 6.213 1.00 0.00 N flip ATOM 739 CD2 HIS A 50 -61.578 14.681 6.389 1.00 0.00 C flip ATOM 740 CE1 HIS A 50 -59.628 15.644 6.440 1.00 0.00 C flip ATOM 741 NE2 HIS A 50 -60.972 15.848 6.550 1.00 0.00 N flip ATOM 0 H HIS A 50 -60.103 9.768 5.540 1.00 0.00 H new ATOM 0 HA HIS A 50 -60.901 12.071 3.844 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -62.032 12.151 5.897 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -60.611 11.682 6.809 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -62.644 14.513 6.421 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -58.867 16.406 6.524 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -61.430 16.742 6.725 1.00 0.00 H new ATOM 749 N TYR A 51 -58.642 12.848 3.432 1.00 0.00 N ATOM 750 CA TYR A 51 -57.301 13.315 3.123 1.00 0.00 C ATOM 751 C TYR A 51 -56.884 14.447 4.065 1.00 0.00 C ATOM 752 O TYR A 51 -57.126 15.618 3.778 1.00 0.00 O ATOM 753 CB TYR A 51 -57.361 13.854 1.693 1.00 0.00 C ATOM 754 CG TYR A 51 -57.560 12.773 0.628 1.00 0.00 C ATOM 755 CD1 TYR A 51 -56.499 11.977 0.247 1.00 0.00 C ATOM 756 CD2 TYR A 51 -58.800 12.594 0.050 1.00 0.00 C ATOM 757 CE1 TYR A 51 -56.686 10.960 -0.755 1.00 0.00 C ATOM 758 CE2 TYR A 51 -58.987 11.577 -0.952 1.00 0.00 C ATOM 759 CZ TYR A 51 -57.921 10.810 -1.305 1.00 0.00 C ATOM 760 OH TYR A 51 -58.097 9.849 -2.251 1.00 0.00 O ATOM 0 H TYR A 51 -59.363 13.161 2.782 1.00 0.00 H new ATOM 0 HA TYR A 51 -56.578 12.507 3.235 1.00 0.00 H new ATOM 0 HB2 TYR A 51 -58.176 14.575 1.621 1.00 0.00 H new ATOM 0 HB3 TYR A 51 -56.438 14.394 1.480 1.00 0.00 H new ATOM 0 HD1 TYR A 51 -55.529 12.117 0.700 1.00 0.00 H new ATOM 0 HD2 TYR A 51 -59.630 13.217 0.349 1.00 0.00 H new ATOM 0 HE1 TYR A 51 -55.864 10.330 -1.063 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -59.952 11.427 -1.413 1.00 0.00 H new ATOM 0 HH TYR A 51 -57.224 9.501 -2.530 1.00 0.00 H new ATOM 770 N VAL A 52 -56.264 14.057 5.169 1.00 0.00 N ATOM 771 CA VAL A 52 -55.811 15.024 6.154 1.00 0.00 C ATOM 772 C VAL A 52 -54.706 15.888 5.544 1.00 0.00 C ATOM 773 O VAL A 52 -53.550 15.472 5.485 1.00 0.00 O ATOM 774 CB VAL A 52 -55.371 14.303 7.431 1.00 0.00 C ATOM 775 CG1 VAL A 52 -56.459 13.348 7.924 1.00 0.00 C ATOM 776 CG2 VAL A 52 -54.049 13.565 7.215 1.00 0.00 C ATOM 0 H VAL A 52 -56.065 13.084 5.403 1.00 0.00 H new ATOM 0 HA VAL A 52 -56.625 15.691 6.437 1.00 0.00 H new ATOM 0 HB VAL A 52 -55.212 15.055 8.203 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -56.121 12.849 8.832 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -57.368 13.911 8.136 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -56.665 12.603 7.156 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -53.759 13.061 8.137 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -54.169 12.828 6.421 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -53.276 14.279 6.933 1.00 0.00 H new ATOM 906 N GLU A 60 -63.496 10.988 0.254 1.00 0.00 N ATOM 907 CA GLU A 60 -64.427 10.206 -0.542 1.00 0.00 C ATOM 908 C GLU A 60 -64.256 8.715 -0.247 1.00 0.00 C ATOM 909 O GLU A 60 -63.252 8.305 0.333 1.00 0.00 O ATOM 910 CB GLU A 60 -64.248 10.494 -2.034 1.00 0.00 C ATOM 911 CG GLU A 60 -62.896 9.981 -2.533 1.00 0.00 C ATOM 912 CD GLU A 60 -62.421 10.781 -3.748 1.00 0.00 C ATOM 913 OE1 GLU A 60 -62.851 10.424 -4.866 1.00 0.00 O ATOM 914 OE2 GLU A 60 -61.638 11.731 -3.531 1.00 0.00 O ATOM 0 HA GLU A 60 -65.441 10.496 -0.268 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -65.051 10.021 -2.598 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -64.322 11.567 -2.212 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -62.158 10.054 -1.734 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -62.978 8.927 -2.797 1.00 0.00 H new ATOM 921 N TRP A 61 -65.252 7.945 -0.659 1.00 0.00 N ATOM 922 CA TRP A 61 -65.225 6.508 -0.446 1.00 0.00 C ATOM 923 C TRP A 61 -64.208 5.905 -1.417 1.00 0.00 C ATOM 924 O TRP A 61 -64.372 6.002 -2.633 1.00 0.00 O ATOM 925 CB TRP A 61 -66.623 5.905 -0.593 1.00 0.00 C ATOM 926 CG TRP A 61 -67.702 6.632 0.211 1.00 0.00 C ATOM 927 CD1 TRP A 61 -68.410 7.712 -0.146 1.00 0.00 C ATOM 928 CD2 TRP A 61 -68.171 6.285 1.532 1.00 0.00 C ATOM 929 NE1 TRP A 61 -69.297 8.086 0.843 1.00 0.00 N ATOM 930 CE2 TRP A 61 -69.147 7.191 1.896 1.00 0.00 C ATOM 931 CE3 TRP A 61 -67.783 5.241 2.390 1.00 0.00 C ATOM 932 CZ2 TRP A 61 -69.816 7.144 3.124 1.00 0.00 C ATOM 933 CZ3 TRP A 61 -68.462 5.208 3.614 1.00 0.00 C ATOM 934 CH2 TRP A 61 -69.446 6.112 3.996 1.00 0.00 C ATOM 0 H TRP A 61 -66.083 8.289 -1.139 1.00 0.00 H new ATOM 0 HA TRP A 61 -64.914 6.275 0.572 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -66.902 5.913 -1.647 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -66.592 4.861 -0.280 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -68.300 8.226 -1.090 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -69.944 8.874 0.808 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -67.022 4.522 2.126 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -70.577 7.865 3.386 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -68.203 4.425 4.311 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -69.923 6.019 4.960 1.00 0.00 H new ATOM 945 N VAL A 62 -63.180 5.295 -0.846 1.00 0.00 N ATOM 946 CA VAL A 62 -62.137 4.677 -1.646 1.00 0.00 C ATOM 947 C VAL A 62 -62.186 3.159 -1.456 1.00 0.00 C ATOM 948 O VAL A 62 -62.709 2.672 -0.454 1.00 0.00 O ATOM 949 CB VAL A 62 -60.777 5.280 -1.291 1.00 0.00 C ATOM 950 CG1 VAL A 62 -60.749 6.781 -1.586 1.00 0.00 C ATOM 951 CG2 VAL A 62 -60.419 5.002 0.170 1.00 0.00 C ATOM 0 H VAL A 62 -63.047 5.216 0.162 1.00 0.00 H new ATOM 0 HA VAL A 62 -62.299 4.878 -2.705 1.00 0.00 H new ATOM 0 HB VAL A 62 -60.024 4.801 -1.918 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -59.771 7.185 -1.325 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -60.939 6.947 -2.646 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -61.518 7.282 -0.997 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -59.448 5.441 0.397 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -61.176 5.441 0.820 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -60.378 3.926 0.336 1.00 0.00 H new ATOM 961 N ASP A 63 -61.635 2.454 -2.433 1.00 0.00 N ATOM 962 CA ASP A 63 -61.609 1.002 -2.385 1.00 0.00 C ATOM 963 C ASP A 63 -60.301 0.540 -1.740 1.00 0.00 C ATOM 964 O ASP A 63 -59.387 1.339 -1.541 1.00 0.00 O ATOM 965 CB ASP A 63 -61.680 0.404 -3.791 1.00 0.00 C ATOM 966 CG ASP A 63 -62.608 -0.804 -3.934 1.00 0.00 C ATOM 967 OD1 ASP A 63 -63.830 -0.569 -4.060 1.00 0.00 O ATOM 968 OD2 ASP A 63 -62.076 -1.935 -3.913 1.00 0.00 O ATOM 0 H ASP A 63 -61.203 2.861 -3.262 1.00 0.00 H new ATOM 0 HA ASP A 63 -62.471 0.668 -1.807 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -62.008 1.179 -4.483 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -60.676 0.110 -4.095 1.00 0.00 H new ATOM 973 N LYS A 64 -60.253 -0.747 -1.431 1.00 0.00 N ATOM 974 CA LYS A 64 -59.071 -1.324 -0.812 1.00 0.00 C ATOM 975 C LYS A 64 -57.866 -1.115 -1.731 1.00 0.00 C ATOM 976 O LYS A 64 -56.733 -1.015 -1.261 1.00 0.00 O ATOM 977 CB LYS A 64 -59.319 -2.790 -0.448 1.00 0.00 C ATOM 978 CG LYS A 64 -60.422 -2.914 0.606 1.00 0.00 C ATOM 979 CD LYS A 64 -60.326 -4.250 1.345 1.00 0.00 C ATOM 980 CE LYS A 64 -60.061 -4.034 2.836 1.00 0.00 C ATOM 981 NZ LYS A 64 -60.652 -5.133 3.632 1.00 0.00 N ATOM 0 H LYS A 64 -61.013 -1.407 -1.597 1.00 0.00 H new ATOM 0 HA LYS A 64 -58.848 -0.819 0.128 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -59.600 -3.348 -1.341 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -58.399 -3.236 -0.071 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -60.343 -2.093 1.319 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -61.398 -2.828 0.128 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -61.252 -4.809 1.214 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -59.526 -4.852 0.913 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -58.987 -3.983 3.017 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -60.483 -3.080 3.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -60.463 -4.971 4.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -61.679 -5.164 3.473 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -60.230 -6.038 3.342 1.00 0.00 H new ATOM 995 N ASN A 65 -58.151 -1.054 -3.023 1.00 0.00 N ATOM 996 CA ASN A 65 -57.104 -0.858 -4.012 1.00 0.00 C ATOM 997 C ASN A 65 -56.554 0.565 -3.891 1.00 0.00 C ATOM 998 O ASN A 65 -55.341 0.767 -3.876 1.00 0.00 O ATOM 999 CB ASN A 65 -57.646 -1.036 -5.431 1.00 0.00 C ATOM 1000 CG ASN A 65 -56.607 -0.616 -6.472 1.00 0.00 C ATOM 1001 OD1 ASN A 65 -55.428 -0.914 -6.366 1.00 0.00 O ATOM 1002 ND2 ASN A 65 -57.107 0.092 -7.481 1.00 0.00 N ATOM 0 H ASN A 65 -59.092 -1.137 -3.408 1.00 0.00 H new ATOM 0 HA ASN A 65 -56.325 -1.597 -3.829 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -57.924 -2.078 -5.590 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -58.551 -0.442 -5.555 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -56.494 0.420 -8.227 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -58.104 0.307 -7.509 1.00 0.00 H new ATOM 1009 N ARG A 66 -57.474 1.516 -3.808 1.00 0.00 N ATOM 1010 CA ARG A 66 -57.097 2.914 -3.689 1.00 0.00 C ATOM 1011 C ARG A 66 -56.271 3.135 -2.421 1.00 0.00 C ATOM 1012 O ARG A 66 -55.571 4.139 -2.298 1.00 0.00 O ATOM 1013 CB ARG A 66 -58.332 3.816 -3.649 1.00 0.00 C ATOM 1014 CG ARG A 66 -58.915 4.012 -5.050 1.00 0.00 C ATOM 1015 CD ARG A 66 -60.144 4.922 -5.010 1.00 0.00 C ATOM 1016 NE ARG A 66 -60.227 5.714 -6.258 1.00 0.00 N ATOM 1017 CZ ARG A 66 -59.306 6.607 -6.644 1.00 0.00 C ATOM 1018 NH1 ARG A 66 -58.226 6.827 -5.882 1.00 0.00 N ATOM 1019 NH2 ARG A 66 -59.464 7.280 -7.791 1.00 0.00 N ATOM 0 H ARG A 66 -58.480 1.345 -3.821 1.00 0.00 H new ATOM 0 HA ARG A 66 -56.501 3.172 -4.564 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -59.086 3.377 -2.996 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -58.066 4.784 -3.223 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -58.159 4.445 -5.705 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -59.188 3.045 -5.473 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -61.047 4.323 -4.889 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -60.086 5.589 -4.150 1.00 0.00 H new ATOM 0 HE ARG A 66 -61.036 5.571 -6.862 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -58.105 6.315 -5.008 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -57.525 7.507 -6.176 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -60.286 7.113 -8.371 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -58.762 7.960 -8.084 1.00 0.00 H new ATOM 1033 N LEU A 67 -56.378 2.179 -1.509 1.00 0.00 N ATOM 1034 CA LEU A 67 -55.650 2.257 -0.254 1.00 0.00 C ATOM 1035 C LEU A 67 -54.419 1.351 -0.327 1.00 0.00 C ATOM 1036 O LEU A 67 -54.230 0.632 -1.308 1.00 0.00 O ATOM 1037 CB LEU A 67 -56.575 1.943 0.923 1.00 0.00 C ATOM 1038 CG LEU A 67 -57.772 2.879 1.104 1.00 0.00 C ATOM 1039 CD1 LEU A 67 -58.948 2.146 1.752 1.00 0.00 C ATOM 1040 CD2 LEU A 67 -57.375 4.131 1.887 1.00 0.00 C ATOM 0 H LEU A 67 -56.958 1.347 -1.615 1.00 0.00 H new ATOM 0 HA LEU A 67 -55.291 3.272 -0.085 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -56.949 0.926 0.804 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -55.984 1.960 1.839 1.00 0.00 H new ATOM 0 HG LEU A 67 -58.101 3.207 0.118 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -59.785 2.834 1.869 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -59.250 1.311 1.119 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -58.648 1.770 2.730 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -58.244 4.779 2.002 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -57.005 3.843 2.871 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -56.593 4.665 1.347 1.00 0.00 H new ATOM 1052 N ALA A 68 -53.613 1.415 0.722 1.00 0.00 N ATOM 1053 CA ALA A 68 -52.405 0.610 0.789 1.00 0.00 C ATOM 1054 C ALA A 68 -52.519 -0.375 1.954 1.00 0.00 C ATOM 1055 O ALA A 68 -52.576 0.033 3.113 1.00 0.00 O ATOM 1056 CB ALA A 68 -51.187 1.526 0.917 1.00 0.00 C ATOM 0 H ALA A 68 -53.773 2.012 1.533 1.00 0.00 H new ATOM 0 HA ALA A 68 -52.280 0.028 -0.124 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -50.281 0.922 0.967 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -51.135 2.186 0.051 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -51.275 2.124 1.824 1.00 0.00 H new ATOM 1062 N LEU A 69 -52.548 -1.653 1.606 1.00 0.00 N ATOM 1063 CA LEU A 69 -52.653 -2.700 2.609 1.00 0.00 C ATOM 1064 C LEU A 69 -51.362 -3.520 2.622 1.00 0.00 C ATOM 1065 O LEU A 69 -51.105 -4.296 1.702 1.00 0.00 O ATOM 1066 CB LEU A 69 -53.912 -3.539 2.377 1.00 0.00 C ATOM 1067 CG LEU A 69 -55.230 -2.765 2.309 1.00 0.00 C ATOM 1068 CD1 LEU A 69 -56.359 -3.652 1.778 1.00 0.00 C ATOM 1069 CD2 LEU A 69 -55.575 -2.150 3.666 1.00 0.00 C ATOM 0 H LEU A 69 -52.501 -1.988 0.644 1.00 0.00 H new ATOM 0 HA LEU A 69 -52.765 -2.266 3.603 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -53.790 -4.092 1.446 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -53.987 -4.275 3.177 1.00 0.00 H new ATOM 0 HG LEU A 69 -55.108 -1.942 1.605 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -57.285 -3.078 1.739 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -56.107 -4.002 0.777 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -56.490 -4.509 2.439 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -56.516 -1.605 3.590 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -55.672 -2.941 4.410 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -54.783 -1.465 3.967 1.00 0.00 H new ATOM 1464 N ARG A 94 -37.026 -11.529 36.446 1.00 0.00 N ATOM 1465 CA ARG A 94 -36.626 -12.542 37.407 1.00 0.00 C ATOM 1466 C ARG A 94 -35.118 -12.469 37.659 1.00 0.00 C ATOM 1467 O ARG A 94 -34.343 -12.218 36.738 1.00 0.00 O ATOM 1468 CB ARG A 94 -36.986 -13.944 36.912 1.00 0.00 C ATOM 1469 CG ARG A 94 -36.928 -14.018 35.385 1.00 0.00 C ATOM 1470 CD ARG A 94 -37.037 -15.465 34.901 1.00 0.00 C ATOM 1471 NE ARG A 94 -37.750 -15.514 33.605 1.00 0.00 N ATOM 1472 CZ ARG A 94 -39.063 -15.287 33.461 1.00 0.00 C ATOM 1473 NH1 ARG A 94 -39.814 -14.996 34.532 1.00 0.00 N ATOM 1474 NH2 ARG A 94 -39.625 -15.353 32.247 1.00 0.00 N ATOM 0 HA ARG A 94 -37.163 -12.348 38.336 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -36.299 -14.673 37.341 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -37.986 -14.209 37.255 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -37.737 -13.426 34.958 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -35.994 -13.582 35.032 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -36.042 -15.897 34.794 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -37.568 -16.065 35.640 1.00 0.00 H new ATOM 0 HE ARG A 94 -37.208 -15.734 32.769 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -39.386 -14.947 35.457 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -40.813 -14.823 34.422 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -39.054 -15.576 31.432 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -40.624 -15.180 32.138 1.00 0.00 H new ATOM 1488 N LYS A 95 -34.748 -12.693 38.911 1.00 0.00 N ATOM 1489 CA LYS A 95 -33.348 -12.656 39.296 1.00 0.00 C ATOM 1490 C LYS A 95 -33.229 -12.909 40.800 1.00 0.00 C ATOM 1491 O LYS A 95 -33.554 -12.039 41.607 1.00 0.00 O ATOM 1492 CB LYS A 95 -32.702 -11.346 38.840 1.00 0.00 C ATOM 1493 CG LYS A 95 -31.500 -11.614 37.932 1.00 0.00 C ATOM 1494 CD LYS A 95 -30.243 -11.901 38.756 1.00 0.00 C ATOM 1495 CE LYS A 95 -29.589 -13.213 38.320 1.00 0.00 C ATOM 1496 NZ LYS A 95 -28.466 -13.557 39.220 1.00 0.00 N ATOM 0 H LYS A 95 -35.394 -12.901 39.672 1.00 0.00 H new ATOM 0 HA LYS A 95 -32.794 -13.450 38.795 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -33.436 -10.740 38.308 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -32.384 -10.771 39.710 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -31.714 -12.462 37.281 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -31.328 -10.752 37.287 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -29.534 -11.081 38.641 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -30.501 -11.953 39.814 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -30.328 -14.015 38.328 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -29.227 -13.123 37.296 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -28.033 -14.450 38.910 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -27.754 -12.799 39.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -28.820 -13.663 40.192 1.00 0.00 H new ATOM 1510 N ILE A 96 -32.763 -14.104 41.132 1.00 0.00 N ATOM 1511 CA ILE A 96 -32.598 -14.483 42.525 1.00 0.00 C ATOM 1512 C ILE A 96 -31.109 -14.480 42.876 1.00 0.00 C ATOM 1513 O ILE A 96 -30.257 -14.492 41.988 1.00 0.00 O ATOM 1514 CB ILE A 96 -33.293 -15.817 42.804 1.00 0.00 C ATOM 1515 CG1 ILE A 96 -34.814 -15.656 42.788 1.00 0.00 C ATOM 1516 CG2 ILE A 96 -32.795 -16.431 44.113 1.00 0.00 C ATOM 1517 CD1 ILE A 96 -35.446 -16.527 41.700 1.00 0.00 C ATOM 0 H ILE A 96 -32.494 -14.823 40.460 1.00 0.00 H new ATOM 0 HA ILE A 96 -33.082 -13.756 43.177 1.00 0.00 H new ATOM 0 HB ILE A 96 -33.034 -16.511 42.004 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -35.223 -15.930 43.761 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -35.071 -14.611 42.617 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -33.305 -17.378 44.288 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -31.721 -16.604 44.048 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -33.004 -15.749 44.937 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -36.528 -16.394 41.710 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -35.053 -16.235 40.726 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -35.208 -17.574 41.888 1.00 0.00 H new ATOM 1529 N THR A 97 -30.839 -14.464 44.173 1.00 0.00 N ATOM 1530 CA THR A 97 -29.468 -14.460 44.653 1.00 0.00 C ATOM 1531 C THR A 97 -29.350 -15.281 45.939 1.00 0.00 C ATOM 1532 O THR A 97 -30.314 -15.402 46.693 1.00 0.00 O ATOM 1533 CB THR A 97 -29.030 -13.003 44.820 1.00 0.00 C ATOM 1534 OG1 THR A 97 -28.478 -12.660 43.552 1.00 0.00 O ATOM 1535 CG2 THR A 97 -27.857 -12.852 45.791 1.00 0.00 C ATOM 0 H THR A 97 -31.547 -14.454 44.907 1.00 0.00 H new ATOM 0 HA THR A 97 -28.797 -14.937 43.938 1.00 0.00 H new ATOM 0 HB THR A 97 -29.872 -12.408 45.174 1.00 0.00 H new ATOM 0 HG1 THR A 97 -28.921 -13.181 42.850 1.00 0.00 H new ATOM 0 HG21 THR A 97 -27.586 -11.799 45.873 1.00 0.00 H new ATOM 0 HG22 THR A 97 -28.146 -13.230 46.772 1.00 0.00 H new ATOM 0 HG23 THR A 97 -27.003 -13.419 45.421 1.00 0.00 H new ATOM 1543 N ARG A 98 -28.160 -15.823 46.150 1.00 0.00 N ATOM 1544 CA ARG A 98 -27.903 -16.629 47.331 1.00 0.00 C ATOM 1545 C ARG A 98 -26.413 -16.602 47.679 1.00 0.00 C ATOM 1546 O ARG A 98 -25.582 -16.264 46.838 1.00 0.00 O ATOM 1547 CB ARG A 98 -28.344 -18.078 47.116 1.00 0.00 C ATOM 1548 CG ARG A 98 -29.207 -18.568 48.280 1.00 0.00 C ATOM 1549 CD ARG A 98 -28.867 -20.014 48.645 1.00 0.00 C ATOM 1550 NE ARG A 98 -30.094 -20.737 49.048 1.00 0.00 N ATOM 1551 CZ ARG A 98 -30.150 -22.057 49.269 1.00 0.00 C ATOM 1552 NH1 ARG A 98 -29.049 -22.808 49.127 1.00 0.00 N ATOM 1553 NH2 ARG A 98 -31.307 -22.628 49.631 1.00 0.00 N ATOM 0 H ARG A 98 -27.362 -15.720 45.523 1.00 0.00 H new ATOM 0 HA ARG A 98 -28.479 -16.205 48.153 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -28.905 -18.157 46.185 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -27.467 -18.717 47.015 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -29.054 -17.925 49.147 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -30.261 -18.495 48.012 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -28.404 -20.513 47.794 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -28.141 -20.031 49.458 1.00 0.00 H new ATOM 0 HE ARG A 98 -30.951 -20.196 49.165 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -28.168 -22.374 48.851 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -29.092 -23.813 49.295 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -32.146 -22.057 49.738 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -31.349 -23.633 49.799 1.00 0.00 H new ATOM 1567 N ASN A 99 -26.121 -16.963 48.920 1.00 0.00 N ATOM 1568 CA ASN A 99 -24.746 -16.985 49.389 1.00 0.00 C ATOM 1569 C ASN A 99 -24.594 -18.067 50.460 1.00 0.00 C ATOM 1570 O ASN A 99 -25.586 -18.550 51.004 1.00 0.00 O ATOM 1571 CB ASN A 99 -24.356 -15.644 50.014 1.00 0.00 C ATOM 1572 CG ASN A 99 -23.737 -14.712 48.970 1.00 0.00 C ATOM 1573 OD1 ASN A 99 -22.777 -15.045 48.295 1.00 0.00 O ATOM 1574 ND2 ASN A 99 -24.337 -13.529 48.877 1.00 0.00 N ATOM 0 H ASN A 99 -26.813 -17.243 49.615 1.00 0.00 H new ATOM 0 HA ASN A 99 -24.101 -17.186 48.533 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -25.236 -15.173 50.451 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -23.647 -15.809 50.825 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -23.997 -12.836 48.210 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -25.137 -13.315 49.473 1.00 0.00 H new ATOM 1581 N GLN A 100 -23.345 -18.417 50.729 1.00 0.00 N ATOM 1582 CA GLN A 100 -23.050 -19.433 51.725 1.00 0.00 C ATOM 1583 C GLN A 100 -21.783 -19.066 52.499 1.00 0.00 C ATOM 1584 O GLN A 100 -20.990 -18.243 52.044 1.00 0.00 O ATOM 1585 CB GLN A 100 -22.917 -20.813 51.077 1.00 0.00 C ATOM 1586 CG GLN A 100 -23.176 -21.924 52.096 1.00 0.00 C ATOM 1587 CD GLN A 100 -23.957 -23.078 51.464 1.00 0.00 C ATOM 1588 OE1 GLN A 100 -23.811 -23.393 50.294 1.00 0.00 O ATOM 1589 NE2 GLN A 100 -24.793 -23.687 52.300 1.00 0.00 N ATOM 0 H GLN A 100 -22.525 -18.015 50.274 1.00 0.00 H new ATOM 0 HA GLN A 100 -23.881 -19.477 52.429 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -23.623 -20.900 50.251 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -21.918 -20.926 50.656 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -22.227 -22.293 52.486 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -23.734 -21.523 52.942 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -24.866 -23.372 53.267 1.00 0.00 H new ATOM 0 HE22 GLN A 100 -25.361 -24.469 51.974 1.00 0.00 H new ATOM 1598 N LYS A 101 -21.631 -19.695 53.655 1.00 0.00 N ATOM 1599 CA LYS A 101 -20.473 -19.445 54.497 1.00 0.00 C ATOM 1600 C LYS A 101 -19.803 -20.776 54.843 1.00 0.00 C ATOM 1601 O LYS A 101 -20.355 -21.841 54.574 1.00 0.00 O ATOM 1602 CB LYS A 101 -20.870 -18.618 55.722 1.00 0.00 C ATOM 1603 CG LYS A 101 -21.713 -19.447 56.693 1.00 0.00 C ATOM 1604 CD LYS A 101 -23.205 -19.295 56.392 1.00 0.00 C ATOM 1605 CE LYS A 101 -24.026 -20.345 57.142 1.00 0.00 C ATOM 1606 NZ LYS A 101 -25.385 -19.833 57.430 1.00 0.00 N ATOM 0 H LYS A 101 -22.291 -20.377 54.029 1.00 0.00 H new ATOM 0 HA LYS A 101 -19.735 -18.846 53.963 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -19.974 -18.258 56.228 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -21.432 -17.739 55.406 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -21.429 -20.497 56.621 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -21.511 -19.131 57.716 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -23.537 -18.297 56.677 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -23.375 -19.393 55.320 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -24.093 -21.256 56.547 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -23.526 -20.609 58.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -25.929 -20.559 57.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -25.316 -18.977 58.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -25.866 -19.604 56.537 1.00 0.00 H new ATOM 1620 N ARG A 102 -18.623 -20.671 55.436 1.00 0.00 N ATOM 1621 CA ARG A 102 -17.871 -21.853 55.822 1.00 0.00 C ATOM 1622 C ARG A 102 -16.740 -21.474 56.779 1.00 0.00 C ATOM 1623 O ARG A 102 -16.370 -20.304 56.877 1.00 0.00 O ATOM 1624 CB ARG A 102 -17.280 -22.554 54.597 1.00 0.00 C ATOM 1625 CG ARG A 102 -17.398 -24.074 54.726 1.00 0.00 C ATOM 1626 CD ARG A 102 -16.016 -24.727 54.800 1.00 0.00 C ATOM 1627 NE ARG A 102 -15.656 -25.302 53.485 1.00 0.00 N ATOM 1628 CZ ARG A 102 -14.414 -25.667 53.139 1.00 0.00 C ATOM 1629 NH1 ARG A 102 -13.406 -25.520 54.009 1.00 0.00 N ATOM 1630 NH2 ARG A 102 -14.181 -26.180 51.924 1.00 0.00 N ATOM 0 H ARG A 102 -18.169 -19.785 55.659 1.00 0.00 H new ATOM 0 HA ARG A 102 -18.559 -22.536 56.320 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -17.798 -22.220 53.698 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -16.232 -22.275 54.484 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -17.970 -24.323 55.620 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -17.948 -24.473 53.874 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -15.272 -23.989 55.099 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -16.014 -25.508 55.560 1.00 0.00 H new ATOM 0 HE ARG A 102 -16.400 -25.428 52.799 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -13.584 -25.130 54.935 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -12.461 -25.798 53.746 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -14.949 -26.293 51.262 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -13.236 -26.458 51.660 1.00 0.00 H new ATOM 1644 N LYS A 103 -16.222 -22.484 57.462 1.00 0.00 N ATOM 1645 CA LYS A 103 -15.140 -22.271 58.409 1.00 0.00 C ATOM 1646 C LYS A 103 -14.157 -23.440 58.325 1.00 0.00 C ATOM 1647 O LYS A 103 -14.412 -24.421 57.627 1.00 0.00 O ATOM 1648 CB LYS A 103 -15.697 -22.035 59.814 1.00 0.00 C ATOM 1649 CG LYS A 103 -16.303 -23.319 60.386 1.00 0.00 C ATOM 1650 CD LYS A 103 -17.796 -23.411 60.063 1.00 0.00 C ATOM 1651 CE LYS A 103 -18.334 -24.813 60.359 1.00 0.00 C ATOM 1652 NZ LYS A 103 -19.333 -24.764 61.451 1.00 0.00 N ATOM 0 H LYS A 103 -16.531 -23.452 57.379 1.00 0.00 H new ATOM 0 HA LYS A 103 -14.584 -21.368 58.156 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -14.902 -21.680 60.470 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -16.456 -21.253 59.782 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -15.784 -24.185 59.975 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -16.159 -23.344 61.466 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -18.345 -22.675 60.650 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -17.961 -23.168 59.013 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -18.788 -25.232 59.461 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -17.513 -25.473 60.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -19.688 -25.723 61.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -18.889 -24.384 62.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -20.125 -24.151 61.170 1.00 0.00 H new ATOM 1666 N HIS A 104 -13.055 -23.298 59.046 1.00 0.00 N ATOM 1667 CA HIS A 104 -12.033 -24.330 59.062 1.00 0.00 C ATOM 1668 C HIS A 104 -11.022 -24.035 60.171 1.00 0.00 C ATOM 1669 O HIS A 104 -11.044 -22.957 60.765 1.00 0.00 O ATOM 1670 CB HIS A 104 -11.379 -24.468 57.685 1.00 0.00 C ATOM 1671 CG HIS A 104 -11.074 -25.893 57.290 1.00 0.00 C ATOM 1672 ND1 HIS A 104 -11.109 -27.047 58.017 1.00 0.00 N flip ATOM 1673 CD2 HIS A 104 -10.679 -26.249 56.012 1.00 0.00 C flip ATOM 1674 CE1 HIS A 104 -10.757 -28.053 57.226 1.00 0.00 C flip ATOM 1675 NE2 HIS A 104 -10.489 -27.560 55.983 1.00 0.00 N flip ATOM 0 H HIS A 104 -12.847 -22.483 59.624 1.00 0.00 H new ATOM 0 HA HIS A 104 -12.490 -25.295 59.282 1.00 0.00 H new ATOM 0 HB2 HIS A 104 -12.037 -24.027 56.936 1.00 0.00 H new ATOM 0 HB3 HIS A 104 -10.453 -23.893 57.675 1.00 0.00 H new ATOM 0 HD2 HIS A 104 -10.548 -25.573 55.180 1.00 0.00 H new ATOM 0 HE1 HIS A 104 -10.693 -29.091 57.518 1.00 0.00 H new ATOM 0 HE2 HIS A 104 -10.194 -28.105 55.173 1.00 0.00 H new ATOM 1683 N ASP A 105 -10.160 -25.010 60.418 1.00 0.00 N ATOM 1684 CA ASP A 105 -9.143 -24.868 61.446 1.00 0.00 C ATOM 1685 C ASP A 105 -8.095 -25.970 61.276 1.00 0.00 C ATOM 1686 O ASP A 105 -8.316 -26.935 60.546 1.00 0.00 O ATOM 1687 CB ASP A 105 -9.750 -25.004 62.844 1.00 0.00 C ATOM 1688 CG ASP A 105 -9.756 -23.719 63.674 1.00 0.00 C ATOM 1689 OD1 ASP A 105 -8.715 -23.028 63.657 1.00 0.00 O ATOM 1690 OD2 ASP A 105 -10.802 -23.458 64.307 1.00 0.00 O ATOM 0 H ASP A 105 -10.145 -25.902 59.924 1.00 0.00 H new ATOM 0 HA ASP A 105 -8.694 -23.880 61.342 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -10.776 -25.360 62.745 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -9.198 -25.769 63.390 1.00 0.00 H new ATOM 1695 N GLU A 106 -6.976 -25.789 61.963 1.00 0.00 N ATOM 1696 CA GLU A 106 -5.893 -26.756 61.897 1.00 0.00 C ATOM 1697 C GLU A 106 -5.106 -26.761 63.209 1.00 0.00 C ATOM 1698 O GLU A 106 -4.856 -25.706 63.791 1.00 0.00 O ATOM 1699 CB GLU A 106 -4.975 -26.470 60.707 1.00 0.00 C ATOM 1700 CG GLU A 106 -4.022 -27.641 60.457 1.00 0.00 C ATOM 1701 CD GLU A 106 -3.473 -27.605 59.029 1.00 0.00 C ATOM 1702 OE1 GLU A 106 -3.068 -26.501 58.604 1.00 0.00 O ATOM 1703 OE2 GLU A 106 -3.472 -28.682 58.394 1.00 0.00 O ATOM 0 H GLU A 106 -6.796 -24.988 62.568 1.00 0.00 H new ATOM 0 HA GLU A 106 -6.324 -27.747 61.751 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -5.575 -26.288 59.815 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -4.401 -25.563 60.896 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -3.197 -27.602 61.169 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -4.545 -28.583 60.626 1.00 0.00 H new ATOM 1710 N ILE A 107 -4.737 -27.959 63.636 1.00 0.00 N ATOM 1711 CA ILE A 107 -3.983 -28.116 64.868 1.00 0.00 C ATOM 1712 C ILE A 107 -2.507 -27.819 64.599 1.00 0.00 C ATOM 1713 O ILE A 107 -2.077 -27.783 63.447 1.00 0.00 O ATOM 1714 CB ILE A 107 -4.231 -29.497 65.477 1.00 0.00 C ATOM 1715 CG1 ILE A 107 -3.375 -30.562 64.788 1.00 0.00 C ATOM 1716 CG2 ILE A 107 -5.720 -29.851 65.445 1.00 0.00 C ATOM 1717 CD1 ILE A 107 -3.935 -30.908 63.408 1.00 0.00 C ATOM 0 H ILE A 107 -4.946 -28.831 63.150 1.00 0.00 H new ATOM 0 HA ILE A 107 -4.322 -27.399 65.615 1.00 0.00 H new ATOM 0 HB ILE A 107 -3.929 -29.468 66.524 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -2.351 -30.202 64.689 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -3.339 -31.460 65.405 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -5.869 -30.838 65.884 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -6.282 -29.112 66.015 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -6.071 -29.856 64.413 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -3.308 -31.667 62.941 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -4.950 -31.291 63.513 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -3.947 -30.013 62.785 1.00 0.00 H new ATOM 1729 N ASN A 108 -1.770 -27.613 65.681 1.00 0.00 N ATOM 1730 CA ASN A 108 -0.351 -27.321 65.576 1.00 0.00 C ATOM 1731 C ASN A 108 0.261 -27.275 66.978 1.00 0.00 C ATOM 1732 O ASN A 108 -0.393 -26.857 67.931 1.00 0.00 O ATOM 1733 CB ASN A 108 -0.116 -25.962 64.914 1.00 0.00 C ATOM 1734 CG ASN A 108 0.654 -26.117 63.601 1.00 0.00 C ATOM 1735 OD1 ASN A 108 0.088 -26.319 62.539 1.00 0.00 O ATOM 1736 ND2 ASN A 108 1.973 -26.013 63.732 1.00 0.00 N ATOM 0 H ASN A 108 -2.130 -27.643 66.635 1.00 0.00 H new ATOM 0 HA ASN A 108 0.110 -28.102 64.971 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -1.073 -25.476 64.723 1.00 0.00 H new ATOM 0 HB3 ASN A 108 0.441 -25.315 65.592 1.00 0.00 H new ATOM 0 HD21 ASN A 108 2.575 -26.103 62.914 1.00 0.00 H new ATOM 0 HD22 ASN A 108 2.382 -25.843 64.651 1.00 0.00 H new ATOM 1743 N HIS A 109 1.510 -27.712 67.058 1.00 0.00 N ATOM 1744 CA HIS A 109 2.217 -27.726 68.327 1.00 0.00 C ATOM 1745 C HIS A 109 3.664 -27.277 68.112 1.00 0.00 C ATOM 1746 O HIS A 109 4.137 -27.214 66.979 1.00 0.00 O ATOM 1747 CB HIS A 109 2.115 -29.101 68.990 1.00 0.00 C ATOM 1748 CG HIS A 109 3.066 -30.129 68.423 1.00 0.00 C ATOM 1749 ND1 HIS A 109 4.412 -30.075 68.211 1.00 0.00 N flip ATOM 1750 CD2 HIS A 109 2.654 -31.381 68.004 1.00 0.00 C flip ATOM 1751 CE1 HIS A 109 4.801 -31.233 67.691 1.00 0.00 C flip ATOM 1752 NE2 HIS A 109 3.712 -32.044 67.562 1.00 0.00 N flip ATOM 0 H HIS A 109 2.050 -28.059 66.265 1.00 0.00 H new ATOM 0 HA HIS A 109 1.752 -27.020 69.015 1.00 0.00 H new ATOM 0 HB2 HIS A 109 2.307 -28.993 70.058 1.00 0.00 H new ATOM 0 HB3 HIS A 109 1.094 -29.469 68.885 1.00 0.00 H new ATOM 0 HD2 HIS A 109 1.641 -31.755 68.032 1.00 0.00 H new ATOM 0 HE1 HIS A 109 5.813 -31.490 67.416 1.00 0.00 H new ATOM 0 HE2 HIS A 109 3.712 -32.994 67.191 1.00 0.00 H new ATOM 1760 N VAL A 110 4.327 -26.976 69.220 1.00 0.00 N ATOM 1761 CA VAL A 110 5.710 -26.535 69.168 1.00 0.00 C ATOM 1762 C VAL A 110 6.627 -27.701 69.541 1.00 0.00 C ATOM 1763 O VAL A 110 6.211 -28.623 70.242 1.00 0.00 O ATOM 1764 CB VAL A 110 5.903 -25.311 70.065 1.00 0.00 C ATOM 1765 CG1 VAL A 110 5.215 -25.509 71.418 1.00 0.00 C ATOM 1766 CG2 VAL A 110 7.388 -24.993 70.247 1.00 0.00 C ATOM 0 H VAL A 110 3.931 -27.029 70.159 1.00 0.00 H new ATOM 0 HA VAL A 110 5.974 -26.225 68.157 1.00 0.00 H new ATOM 0 HB VAL A 110 5.436 -24.458 69.573 1.00 0.00 H new ATOM 0 HG11 VAL A 110 5.367 -24.625 72.037 1.00 0.00 H new ATOM 0 HG12 VAL A 110 4.147 -25.664 71.264 1.00 0.00 H new ATOM 0 HG13 VAL A 110 5.640 -26.379 71.918 1.00 0.00 H new ATOM 0 HG21 VAL A 110 7.497 -24.119 70.889 1.00 0.00 H new ATOM 0 HG22 VAL A 110 7.889 -25.845 70.707 1.00 0.00 H new ATOM 0 HG23 VAL A 110 7.838 -24.788 69.276 1.00 0.00 H new ATOM 1776 N GLN A 111 7.858 -27.622 69.058 1.00 0.00 N ATOM 1777 CA GLN A 111 8.838 -28.660 69.332 1.00 0.00 C ATOM 1778 C GLN A 111 9.747 -28.238 70.489 1.00 0.00 C ATOM 1779 O GLN A 111 9.823 -27.057 70.824 1.00 0.00 O ATOM 1780 CB GLN A 111 9.657 -28.985 68.081 1.00 0.00 C ATOM 1781 CG GLN A 111 10.067 -27.707 67.347 1.00 0.00 C ATOM 1782 CD GLN A 111 10.614 -26.665 68.324 1.00 0.00 C ATOM 1783 OE1 GLN A 111 10.063 -25.590 68.497 1.00 0.00 O ATOM 1784 NE2 GLN A 111 11.725 -27.040 68.950 1.00 0.00 N ATOM 0 H GLN A 111 8.200 -26.855 68.478 1.00 0.00 H new ATOM 0 HA GLN A 111 8.308 -29.566 69.624 1.00 0.00 H new ATOM 0 HB2 GLN A 111 10.547 -29.549 68.361 1.00 0.00 H new ATOM 0 HB3 GLN A 111 9.073 -29.620 67.415 1.00 0.00 H new ATOM 0 HG2 GLN A 111 10.823 -27.941 66.598 1.00 0.00 H new ATOM 0 HG3 GLN A 111 9.208 -27.297 66.816 1.00 0.00 H new ATOM 0 HE21 GLN A 111 12.134 -27.954 68.759 1.00 0.00 H new ATOM 0 HE22 GLN A 111 12.168 -26.413 69.622 1.00 0.00 H new ATOM 1793 N LYS A 112 10.414 -29.227 71.065 1.00 0.00 N ATOM 1794 CA LYS A 112 11.315 -28.974 72.177 1.00 0.00 C ATOM 1795 C LYS A 112 12.607 -29.766 71.971 1.00 0.00 C ATOM 1796 O LYS A 112 12.569 -30.943 71.617 1.00 0.00 O ATOM 1797 CB LYS A 112 10.619 -29.268 73.508 1.00 0.00 C ATOM 1798 CG LYS A 112 11.332 -28.566 74.665 1.00 0.00 C ATOM 1799 CD LYS A 112 12.107 -29.569 75.522 1.00 0.00 C ATOM 1800 CE LYS A 112 12.140 -29.129 76.987 1.00 0.00 C ATOM 1801 NZ LYS A 112 12.956 -27.904 77.142 1.00 0.00 N ATOM 0 H LYS A 112 10.349 -30.205 70.783 1.00 0.00 H new ATOM 0 HA LYS A 112 11.589 -27.920 72.213 1.00 0.00 H new ATOM 0 HB2 LYS A 112 9.581 -28.937 73.461 1.00 0.00 H new ATOM 0 HB3 LYS A 112 10.603 -30.343 73.685 1.00 0.00 H new ATOM 0 HG2 LYS A 112 12.016 -27.813 74.272 1.00 0.00 H new ATOM 0 HG3 LYS A 112 10.602 -28.042 75.282 1.00 0.00 H new ATOM 0 HD2 LYS A 112 11.644 -30.553 75.445 1.00 0.00 H new ATOM 0 HD3 LYS A 112 13.125 -29.665 75.144 1.00 0.00 H new ATOM 0 HE2 LYS A 112 11.126 -28.944 77.340 1.00 0.00 H new ATOM 0 HE3 LYS A 112 12.552 -29.928 77.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 13.024 -27.657 78.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 13.909 -28.071 76.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 12.509 -27.121 76.624 1.00 0.00 H new ATOM 1829 N TYR A 114 16.830 -30.366 73.500 1.00 0.00 N ATOM 1830 CA TYR A 114 17.726 -30.253 74.638 1.00 0.00 C ATOM 1831 C TYR A 114 18.852 -31.285 74.555 1.00 0.00 C ATOM 1832 O TYR A 114 18.685 -32.344 73.951 1.00 0.00 O ATOM 1833 CB TYR A 114 16.875 -30.543 75.876 1.00 0.00 C ATOM 1834 CG TYR A 114 17.616 -30.348 77.201 1.00 0.00 C ATOM 1835 CD1 TYR A 114 18.628 -31.216 77.560 1.00 0.00 C ATOM 1836 CD2 TYR A 114 17.273 -29.305 78.036 1.00 0.00 C ATOM 1837 CE1 TYR A 114 19.325 -31.032 78.806 1.00 0.00 C ATOM 1838 CE2 TYR A 114 17.970 -29.121 79.282 1.00 0.00 C ATOM 1839 CZ TYR A 114 18.962 -29.994 79.606 1.00 0.00 C ATOM 1840 OH TYR A 114 19.620 -29.820 80.783 1.00 0.00 O ATOM 0 HA TYR A 114 18.184 -29.265 74.668 1.00 0.00 H new ATOM 0 HB2 TYR A 114 15.999 -29.894 75.862 1.00 0.00 H new ATOM 0 HB3 TYR A 114 16.512 -31.569 75.822 1.00 0.00 H new ATOM 0 HD1 TYR A 114 18.897 -32.033 76.906 1.00 0.00 H new ATOM 0 HD2 TYR A 114 16.481 -28.626 77.755 1.00 0.00 H new ATOM 0 HE1 TYR A 114 20.119 -31.703 79.099 1.00 0.00 H new ATOM 0 HE2 TYR A 114 17.711 -28.308 79.945 1.00 0.00 H new ATOM 0 HH TYR A 114 19.255 -29.039 81.249 1.00 0.00 H new ATOM 1850 N ALA A 115 19.975 -30.941 75.169 1.00 0.00 N ATOM 1851 CA ALA A 115 21.128 -31.825 75.171 1.00 0.00 C ATOM 1852 C ALA A 115 21.906 -31.638 76.475 1.00 0.00 C ATOM 1853 O ALA A 115 21.816 -30.589 77.111 1.00 0.00 O ATOM 1854 CB ALA A 115 21.986 -31.548 73.935 1.00 0.00 C ATOM 0 H ALA A 115 20.111 -30.062 75.668 1.00 0.00 H new ATOM 0 HA ALA A 115 20.813 -32.867 75.122 1.00 0.00 H new ATOM 0 HB1 ALA A 115 22.851 -32.211 73.937 1.00 0.00 H new ATOM 0 HB2 ALA A 115 21.396 -31.723 73.036 1.00 0.00 H new ATOM 0 HB3 ALA A 115 22.323 -30.512 73.951 1.00 0.00 H new ATOM 1860 N GLU A 116 22.651 -32.672 76.836 1.00 0.00 N ATOM 1861 CA GLU A 116 23.444 -32.635 78.053 1.00 0.00 C ATOM 1862 C GLU A 116 24.872 -32.181 77.742 1.00 0.00 C ATOM 1863 O GLU A 116 25.691 -32.972 77.277 1.00 0.00 O ATOM 1864 CB GLU A 116 23.441 -33.997 78.751 1.00 0.00 C ATOM 1865 CG GLU A 116 22.433 -34.021 79.901 1.00 0.00 C ATOM 1866 CD GLU A 116 22.383 -35.402 80.558 1.00 0.00 C ATOM 1867 OE1 GLU A 116 22.609 -36.388 79.824 1.00 0.00 O ATOM 1868 OE2 GLU A 116 22.121 -35.440 81.780 1.00 0.00 O ATOM 0 H GLU A 116 22.722 -33.541 76.307 1.00 0.00 H new ATOM 0 HA GLU A 116 22.994 -31.913 78.735 1.00 0.00 H new ATOM 0 HB2 GLU A 116 23.196 -34.778 78.031 1.00 0.00 H new ATOM 0 HB3 GLU A 116 24.438 -34.217 79.132 1.00 0.00 H new ATOM 0 HG2 GLU A 116 22.705 -33.271 80.643 1.00 0.00 H new ATOM 0 HG3 GLU A 116 21.444 -33.756 79.528 1.00 0.00 H new ATOM 1875 N MET A 117 25.126 -30.909 78.013 1.00 0.00 N ATOM 1876 CA MET A 117 26.441 -30.340 77.768 1.00 0.00 C ATOM 1877 C MET A 117 27.315 -30.421 79.021 1.00 0.00 C ATOM 1878 O MET A 117 26.804 -30.579 80.129 1.00 0.00 O ATOM 1879 CB MET A 117 26.293 -28.879 77.341 1.00 0.00 C ATOM 1880 CG MET A 117 25.742 -28.026 78.485 1.00 0.00 C ATOM 1881 SD MET A 117 24.512 -26.892 77.864 1.00 0.00 S ATOM 1882 CE MET A 117 23.089 -27.969 77.824 1.00 0.00 C ATOM 0 H MET A 117 24.444 -30.256 78.400 1.00 0.00 H new ATOM 0 HA MET A 117 26.923 -30.912 76.975 1.00 0.00 H new ATOM 0 HB2 MET A 117 27.261 -28.489 77.025 1.00 0.00 H new ATOM 0 HB3 MET A 117 25.627 -28.814 76.481 1.00 0.00 H new ATOM 0 HG2 MET A 117 25.304 -28.668 79.249 1.00 0.00 H new ATOM 0 HG3 MET A 117 26.552 -27.472 78.960 1.00 0.00 H new ATOM 0 HE1 MET A 117 22.179 -27.372 77.879 1.00 0.00 H new ATOM 0 HE2 MET A 117 23.092 -28.541 76.896 1.00 0.00 H new ATOM 0 HE3 MET A 117 23.126 -28.653 78.672 1.00 0.00 H new ATOM 1892 N ASP A 118 28.617 -30.308 78.804 1.00 0.00 N ATOM 1893 CA ASP A 118 29.567 -30.365 79.902 1.00 0.00 C ATOM 1894 C ASP A 118 29.749 -28.964 80.487 1.00 0.00 C ATOM 1895 O ASP A 118 29.755 -27.977 79.753 1.00 0.00 O ATOM 1896 CB ASP A 118 30.933 -30.859 79.423 1.00 0.00 C ATOM 1897 CG ASP A 118 31.435 -30.218 78.127 1.00 0.00 C ATOM 1898 OD1 ASP A 118 30.717 -30.353 77.113 1.00 0.00 O ATOM 1899 OD2 ASP A 118 32.524 -29.607 78.181 1.00 0.00 O ATOM 0 H ASP A 118 29.037 -30.177 77.884 1.00 0.00 H new ATOM 0 HA ASP A 118 29.176 -31.055 80.650 1.00 0.00 H new ATOM 0 HB2 ASP A 118 31.665 -30.675 80.209 1.00 0.00 H new ATOM 0 HB3 ASP A 118 30.883 -31.939 79.281 1.00 0.00 H new ATOM 1904 N PRO A 119 29.896 -28.920 81.838 1.00 0.00 N ATOM 1905 CA PRO A 119 30.078 -27.655 82.531 1.00 0.00 C ATOM 1906 C PRO A 119 31.495 -27.116 82.324 1.00 0.00 C ATOM 1907 O PRO A 119 31.675 -26.028 81.779 1.00 0.00 O ATOM 1908 CB PRO A 119 29.764 -27.955 83.987 1.00 0.00 C ATOM 1909 CG PRO A 119 29.871 -29.464 84.134 1.00 0.00 C ATOM 1910 CD PRO A 119 29.894 -30.068 82.740 1.00 0.00 C ATOM 0 HA PRO A 119 29.425 -26.869 82.151 1.00 0.00 H new ATOM 0 HB2 PRO A 119 30.464 -27.447 84.650 1.00 0.00 H new ATOM 0 HB3 PRO A 119 28.765 -27.607 84.251 1.00 0.00 H new ATOM 0 HG2 PRO A 119 30.775 -29.731 84.681 1.00 0.00 H new ATOM 0 HG3 PRO A 119 29.027 -29.853 84.704 1.00 0.00 H new ATOM 0 HD2 PRO A 119 30.777 -30.689 82.592 1.00 0.00 H new ATOM 0 HD3 PRO A 119 29.025 -30.704 82.570 1.00 0.00 H new ATOM 1918 N THR A 120 32.464 -27.901 82.770 1.00 0.00 N ATOM 1919 CA THR A 120 33.859 -27.516 82.640 1.00 0.00 C ATOM 1920 C THR A 120 34.772 -28.700 82.966 1.00 0.00 C ATOM 1921 O THR A 120 34.379 -29.609 83.696 1.00 0.00 O ATOM 1922 CB THR A 120 34.099 -26.300 83.537 1.00 0.00 C ATOM 1923 OG1 THR A 120 35.433 -25.902 83.233 1.00 0.00 O ATOM 1924 CG2 THR A 120 34.149 -26.668 85.022 1.00 0.00 C ATOM 0 H THR A 120 32.311 -28.802 83.222 1.00 0.00 H new ATOM 0 HA THR A 120 34.097 -27.235 81.614 1.00 0.00 H new ATOM 0 HB THR A 120 33.310 -25.566 83.371 1.00 0.00 H new ATOM 0 HG1 THR A 120 35.671 -25.117 83.770 1.00 0.00 H new ATOM 0 HG21 THR A 120 34.321 -25.769 85.614 1.00 0.00 H new ATOM 0 HG22 THR A 120 33.202 -27.121 85.317 1.00 0.00 H new ATOM 0 HG23 THR A 120 34.959 -27.377 85.194 1.00 0.00 H new ATOM 1932 N THR A 121 35.972 -28.652 82.407 1.00 0.00 N ATOM 1933 CA THR A 121 36.944 -29.709 82.628 1.00 0.00 C ATOM 1934 C THR A 121 38.331 -29.115 82.880 1.00 0.00 C ATOM 1935 O THR A 121 38.695 -28.103 82.282 1.00 0.00 O ATOM 1936 CB THR A 121 36.896 -30.654 81.426 1.00 0.00 C ATOM 1937 OG1 THR A 121 35.595 -31.232 81.489 1.00 0.00 O ATOM 1938 CG2 THR A 121 37.842 -31.847 81.581 1.00 0.00 C ATOM 0 H THR A 121 36.293 -27.897 81.801 1.00 0.00 H new ATOM 0 HA THR A 121 36.705 -30.285 83.522 1.00 0.00 H new ATOM 0 HB THR A 121 37.152 -30.103 80.521 1.00 0.00 H new ATOM 0 HG1 THR A 121 35.479 -31.858 80.744 1.00 0.00 H new ATOM 0 HG21 THR A 121 37.769 -32.486 80.701 1.00 0.00 H new ATOM 0 HG22 THR A 121 38.866 -31.488 81.685 1.00 0.00 H new ATOM 0 HG23 THR A 121 37.566 -32.418 82.468 1.00 0.00 H new ATOM 1946 N ALA A 122 39.068 -29.768 83.766 1.00 0.00 N ATOM 1947 CA ALA A 122 40.407 -29.317 84.104 1.00 0.00 C ATOM 1948 C ALA A 122 41.046 -30.313 85.074 1.00 0.00 C ATOM 1949 O ALA A 122 40.376 -31.216 85.573 1.00 0.00 O ATOM 1950 CB ALA A 122 40.339 -27.902 84.681 1.00 0.00 C ATOM 0 H ALA A 122 38.763 -30.606 84.260 1.00 0.00 H new ATOM 0 HA ALA A 122 41.034 -29.275 83.214 1.00 0.00 H new ATOM 0 HB1 ALA A 122 41.344 -27.564 84.935 1.00 0.00 H new ATOM 0 HB2 ALA A 122 39.905 -27.228 83.942 1.00 0.00 H new ATOM 0 HB3 ALA A 122 39.720 -27.904 85.578 1.00 0.00 H new ATOM 1956 N ALA A 123 42.334 -30.114 85.312 1.00 0.00 N ATOM 1957 CA ALA A 123 43.071 -30.983 86.214 1.00 0.00 C ATOM 1958 C ALA A 123 44.122 -30.160 86.963 1.00 0.00 C ATOM 1959 O ALA A 123 44.086 -28.931 86.939 1.00 0.00 O ATOM 1960 CB ALA A 123 43.690 -32.136 85.421 1.00 0.00 C ATOM 0 H ALA A 123 42.886 -29.364 84.896 1.00 0.00 H new ATOM 0 HA ALA A 123 42.403 -31.420 86.957 1.00 0.00 H new ATOM 0 HB1 ALA A 123 44.243 -32.788 86.098 1.00 0.00 H new ATOM 0 HB2 ALA A 123 42.900 -32.707 84.932 1.00 0.00 H new ATOM 0 HB3 ALA A 123 44.369 -31.736 84.667 1.00 0.00 H new ATOM 1966 N LEU A 124 45.033 -30.872 87.610 1.00 0.00 N ATOM 1967 CA LEU A 124 46.092 -30.223 88.364 1.00 0.00 C ATOM 1968 C LEU A 124 47.120 -31.271 88.796 1.00 0.00 C ATOM 1969 O LEU A 124 46.757 -32.327 89.311 1.00 0.00 O ATOM 1970 CB LEU A 124 45.507 -29.420 89.528 1.00 0.00 C ATOM 1971 CG LEU A 124 45.060 -30.232 90.745 1.00 0.00 C ATOM 1972 CD1 LEU A 124 45.501 -29.558 92.046 1.00 0.00 C ATOM 1973 CD2 LEU A 124 43.551 -30.484 90.713 1.00 0.00 C ATOM 0 H LEU A 124 45.060 -31.891 87.628 1.00 0.00 H new ATOM 0 HA LEU A 124 46.616 -29.500 87.739 1.00 0.00 H new ATOM 0 HB2 LEU A 124 46.252 -28.695 89.854 1.00 0.00 H new ATOM 0 HB3 LEU A 124 44.651 -28.854 89.159 1.00 0.00 H new ATOM 0 HG LEU A 124 45.549 -31.205 90.704 1.00 0.00 H new ATOM 0 HD11 LEU A 124 45.171 -30.156 92.896 1.00 0.00 H new ATOM 0 HD12 LEU A 124 46.588 -29.474 92.062 1.00 0.00 H new ATOM 0 HD13 LEU A 124 45.059 -28.563 92.108 1.00 0.00 H new ATOM 0 HD21 LEU A 124 43.260 -31.063 91.589 1.00 0.00 H new ATOM 0 HD22 LEU A 124 43.023 -29.531 90.716 1.00 0.00 H new ATOM 0 HD23 LEU A 124 43.294 -31.038 89.810 1.00 0.00 H new ATOM 1985 N GLU A 125 48.384 -30.942 88.569 1.00 0.00 N ATOM 1986 CA GLU A 125 49.467 -31.841 88.928 1.00 0.00 C ATOM 1987 C GLU A 125 50.523 -31.099 89.749 1.00 0.00 C ATOM 1988 O GLU A 125 50.548 -29.869 89.768 1.00 0.00 O ATOM 1989 CB GLU A 125 50.088 -32.476 87.682 1.00 0.00 C ATOM 1990 CG GLU A 125 50.753 -33.812 88.021 1.00 0.00 C ATOM 1991 CD GLU A 125 50.397 -34.880 86.986 1.00 0.00 C ATOM 1992 OE1 GLU A 125 49.207 -35.262 86.951 1.00 0.00 O ATOM 1993 OE2 GLU A 125 51.322 -35.291 86.253 1.00 0.00 O ATOM 0 H GLU A 125 48.682 -30.065 88.141 1.00 0.00 H new ATOM 0 HA GLU A 125 49.058 -32.645 89.540 1.00 0.00 H new ATOM 0 HB2 GLU A 125 49.318 -32.630 86.926 1.00 0.00 H new ATOM 0 HB3 GLU A 125 50.825 -31.797 87.252 1.00 0.00 H new ATOM 0 HG2 GLU A 125 51.835 -33.684 88.060 1.00 0.00 H new ATOM 0 HG3 GLU A 125 50.435 -34.140 89.011 1.00 0.00 H new ATOM 2000 N LYS A 126 51.370 -31.877 90.407 1.00 0.00 N ATOM 2001 CA LYS A 126 52.426 -31.308 91.228 1.00 0.00 C ATOM 2002 C LYS A 126 53.620 -32.264 91.248 1.00 0.00 C ATOM 2003 O LYS A 126 53.516 -33.404 90.798 1.00 0.00 O ATOM 2004 CB LYS A 126 51.894 -30.959 92.619 1.00 0.00 C ATOM 2005 CG LYS A 126 51.710 -29.447 92.772 1.00 0.00 C ATOM 2006 CD LYS A 126 53.060 -28.744 92.932 1.00 0.00 C ATOM 2007 CE LYS A 126 53.604 -28.920 94.351 1.00 0.00 C ATOM 2008 NZ LYS A 126 54.392 -27.734 94.754 1.00 0.00 N ATOM 0 H LYS A 126 51.347 -32.897 90.388 1.00 0.00 H new ATOM 0 HA LYS A 126 52.776 -30.368 90.802 1.00 0.00 H new ATOM 0 HB2 LYS A 126 50.942 -31.464 92.785 1.00 0.00 H new ATOM 0 HB3 LYS A 126 52.585 -31.324 93.379 1.00 0.00 H new ATOM 0 HG2 LYS A 126 51.190 -29.050 91.900 1.00 0.00 H new ATOM 0 HG3 LYS A 126 51.083 -29.239 93.639 1.00 0.00 H new ATOM 0 HD2 LYS A 126 53.772 -29.148 92.213 1.00 0.00 H new ATOM 0 HD3 LYS A 126 52.950 -27.683 92.710 1.00 0.00 H new ATOM 0 HE2 LYS A 126 52.779 -29.070 95.047 1.00 0.00 H new ATOM 0 HE3 LYS A 126 54.228 -29.812 94.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 54.754 -27.869 95.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 55.190 -27.609 94.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 53.786 -26.889 94.727 1.00 0.00 H new ATOM 2022 N GLU A 127 54.728 -31.764 91.776 1.00 0.00 N ATOM 2023 CA GLU A 127 55.941 -32.560 91.861 1.00 0.00 C ATOM 2024 C GLU A 127 56.929 -31.919 92.839 1.00 0.00 C ATOM 2025 O GLU A 127 56.958 -30.698 92.986 1.00 0.00 O ATOM 2026 CB GLU A 127 56.576 -32.742 90.481 1.00 0.00 C ATOM 2027 CG GLU A 127 56.462 -34.194 90.012 1.00 0.00 C ATOM 2028 CD GLU A 127 57.699 -34.999 90.414 1.00 0.00 C ATOM 2029 OE1 GLU A 127 58.784 -34.672 89.888 1.00 0.00 O ATOM 2030 OE2 GLU A 127 57.531 -35.923 91.239 1.00 0.00 O ATOM 0 H GLU A 127 54.811 -30.818 92.149 1.00 0.00 H new ATOM 0 HA GLU A 127 55.678 -33.549 92.236 1.00 0.00 H new ATOM 0 HB2 GLU A 127 56.087 -32.084 89.762 1.00 0.00 H new ATOM 0 HB3 GLU A 127 57.625 -32.449 90.518 1.00 0.00 H new ATOM 0 HG2 GLU A 127 55.571 -34.650 90.443 1.00 0.00 H new ATOM 0 HG3 GLU A 127 56.342 -34.222 88.929 1.00 0.00 H new ATOM 2037 N SER A 128 57.714 -32.771 93.481 1.00 0.00 N ATOM 2038 CA SER A 128 58.700 -32.303 94.441 1.00 0.00 C ATOM 2039 C SER A 128 60.045 -32.984 94.182 1.00 0.00 C ATOM 2040 O SER A 128 60.132 -33.908 93.375 1.00 0.00 O ATOM 2041 CB SER A 128 58.239 -32.564 95.876 1.00 0.00 C ATOM 2042 OG SER A 128 58.090 -31.356 96.617 1.00 0.00 O ATOM 0 H SER A 128 57.688 -33.783 93.356 1.00 0.00 H new ATOM 0 HA SER A 128 58.815 -31.226 94.317 1.00 0.00 H new ATOM 0 HB2 SER A 128 57.289 -33.099 95.860 1.00 0.00 H new ATOM 0 HB3 SER A 128 58.960 -33.210 96.377 1.00 0.00 H new ATOM 0 HG SER A 128 57.793 -31.565 97.527 1.00 0.00 H new ATOM 2048 N GLY A 129 61.061 -32.502 94.883 1.00 0.00 N ATOM 2049 CA GLY A 129 62.398 -33.053 94.740 1.00 0.00 C ATOM 2050 C GLY A 129 63.261 -32.720 95.958 1.00 0.00 C ATOM 2051 O GLY A 129 63.029 -31.719 96.634 1.00 0.00 O ATOM 0 H GLY A 129 60.985 -31.736 95.552 1.00 0.00 H new ATOM 0 HA2 GLY A 129 62.338 -34.134 94.617 1.00 0.00 H new ATOM 0 HA3 GLY A 129 62.865 -32.655 93.839 1.00 0.00 H new ATOM 2055 N PRO A 130 64.266 -33.602 96.209 1.00 0.00 N ATOM 2056 CA PRO A 130 65.165 -33.412 97.334 1.00 0.00 C ATOM 2057 C PRO A 130 66.171 -32.294 97.049 1.00 0.00 C ATOM 2058 O PRO A 130 66.055 -31.590 96.047 1.00 0.00 O ATOM 2059 CB PRO A 130 65.825 -34.765 97.543 1.00 0.00 C ATOM 2060 CG PRO A 130 65.623 -35.532 96.246 1.00 0.00 C ATOM 2061 CD PRO A 130 64.571 -34.798 95.430 1.00 0.00 C ATOM 0 HA PRO A 130 64.646 -33.093 98.238 1.00 0.00 H new ATOM 0 HB2 PRO A 130 66.885 -34.652 97.769 1.00 0.00 H new ATOM 0 HB3 PRO A 130 65.375 -35.293 98.383 1.00 0.00 H new ATOM 0 HG2 PRO A 130 66.559 -35.598 95.691 1.00 0.00 H new ATOM 0 HG3 PRO A 130 65.302 -36.553 96.452 1.00 0.00 H new ATOM 0 HD2 PRO A 130 64.947 -34.540 94.440 1.00 0.00 H new ATOM 0 HD3 PRO A 130 63.683 -35.413 95.284 1.00 0.00 H new ATOM 2069 N SER A 131 67.134 -32.165 97.950 1.00 0.00 N ATOM 2070 CA SER A 131 68.159 -31.145 97.808 1.00 0.00 C ATOM 2071 C SER A 131 69.359 -31.481 98.696 1.00 0.00 C ATOM 2072 O SER A 131 69.247 -32.292 99.615 1.00 0.00 O ATOM 2073 CB SER A 131 67.610 -29.760 98.159 1.00 0.00 C ATOM 2074 OG SER A 131 67.020 -29.733 99.456 1.00 0.00 O ATOM 0 H SER A 131 67.226 -32.750 98.781 1.00 0.00 H new ATOM 0 HA SER A 131 68.480 -31.126 96.767 1.00 0.00 H new ATOM 0 HB2 SER A 131 68.416 -29.028 98.112 1.00 0.00 H new ATOM 0 HB3 SER A 131 66.868 -29.465 97.417 1.00 0.00 H new ATOM 0 HG SER A 131 66.683 -28.832 99.643 1.00 0.00 H new ATOM 2080 N SER A 132 70.478 -30.841 98.391 1.00 0.00 N ATOM 2081 CA SER A 132 71.697 -31.062 99.150 1.00 0.00 C ATOM 2082 C SER A 132 72.333 -29.721 99.521 1.00 0.00 C ATOM 2083 O SER A 132 71.930 -28.677 99.011 1.00 0.00 O ATOM 2084 CB SER A 132 72.689 -31.920 98.362 1.00 0.00 C ATOM 2085 OG SER A 132 72.354 -33.304 98.411 1.00 0.00 O ATOM 0 H SER A 132 70.566 -30.169 97.629 1.00 0.00 H new ATOM 0 HA SER A 132 71.439 -31.599 100.063 1.00 0.00 H new ATOM 0 HB2 SER A 132 72.710 -31.589 97.324 1.00 0.00 H new ATOM 0 HB3 SER A 132 73.692 -31.775 98.763 1.00 0.00 H new ATOM 0 HG SER A 132 73.010 -33.818 97.895 1.00 0.00 H new ATOM 2091 N GLY A 133 73.316 -29.793 100.407 1.00 0.00 N ATOM 2092 CA GLY A 133 74.012 -28.598 100.852 1.00 0.00 C ATOM 2093 C GLY A 133 74.878 -28.018 99.732 1.00 0.00 C ATOM 2094 O GLY A 133 74.751 -28.417 98.575 1.00 0.00 O ATOM 0 H GLY A 133 73.647 -30.661 100.829 1.00 0.00 H new ATOM 0 HA2 GLY A 133 73.288 -27.852 101.180 1.00 0.00 H new ATOM 0 HA3 GLY A 133 74.636 -28.836 101.713 1.00 0.00 H new