USER MOD reduce.3.24.130724 H: found=0, std=0, add=815, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 815 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 354 SER OG : rot 180:sc= 0.0385 USER MOD Set 1.2: A 413 LYS NZ :NH3+ 144:sc= 0.0125 (180deg=-0.477) USER MOD Set 2.1: A 372 ASN : amide:sc= -1.08 K(o=-1.1,f=-3.4!) USER MOD Set 2.2: A 390 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 348 TYR OH : rot 165:sc= -0.296 USER MOD Set 3.2: A 396 LYS NZ :NH3+ -104:sc= -2.51! (180deg=-5.11!) USER MOD Set 4.1: A 334 SER OG : rot -81:sc= 0.987 USER MOD Set 4.2: A 336 ASN : amide:sc= 0.517 K(o=1.5,f=-1.6!) USER MOD Single : A 323 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 326 SER OG : rot 180:sc= 0.296 USER MOD Single : A 327 HIS : no HD1:sc= -0.222 K(o=-0.22,f=-0.77) USER MOD Single : A 328 HIS : no HD1:sc= -0.108 X(o=-0.11,f=-0.38) USER MOD Single : A 329 HIS :FLIP no HD1:sc= -3.09! C(o=-3.6!,f=-3.1!) USER MOD Single : A 330 HIS : no HD1:sc= -0.748 X(o=-0.75,f=-0.55) USER MOD Single : A 331 HIS : no HD1:sc= -1.41! C(o=-1.4!,f=-1.3!) USER MOD Single : A 332 HIS : no HD1:sc= -0.546 X(o=-0.55,f=-0.31) USER MOD Single : A 335 ASN :FLIP amide:sc= 0.0651 F(o=-2.7!,f=0.065) USER MOD Single : A 337 ASN : amide:sc= -1.48 K(o=-1.5,f=-4!) USER MOD Single : A 339 SER OG : rot 180:sc= 0 USER MOD Single : A 341 LYS NZ :NH3+ -140:sc= -4.95! (180deg=-8.56!) USER MOD Single : A 342 SER OG : rot -1:sc= 0.735 USER MOD Single : A 345 SER OG : rot 180:sc= 0 USER MOD Single : A 346 SER OG : rot 180:sc= 0 USER MOD Single : A 347 HIS : no HD1:sc= -0.767 X(o=-0.77,f=-1.2) USER MOD Single : A 349 THR OG1 : rot -25:sc= -0.222 USER MOD Single : A 351 GLN :FLIP amide:sc= -8.73! C(o=-11!,f=-8.7!) USER MOD Single : A 353 SER OG : rot 160:sc= -0.0552 USER MOD Single : A 355 SER OG : rot 68:sc= 1.21 USER MOD Single : A 356 SER OG : rot -63:sc= 0.0675 USER MOD Single : A 357 ASN : amide:sc= -1.53 K(o=-1.5,f=-8.3!) USER MOD Single : A 358 TYR OH : rot 180:sc= 0 USER MOD Single : A 360 ASN :FLIP amide:sc= -0.546 F(o=-2.1!,f=-0.55) USER MOD Single : A 362 ASN : amide:sc= 0 X(o=0,f=-0.027) USER MOD Single : A 366 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 367 LYS NZ :NH3+ 163:sc= -0.0102 (180deg=-0.386) USER MOD Single : A 369 ASN : amide:sc= -1.55 K(o=-1.6,f=-2.6!) USER MOD Single : A 371 LYS NZ :NH3+ -133:sc= -0.117 (180deg=-0.986) USER MOD Single : A 373 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 TYR OH : rot 180:sc= 0 USER MOD Single : A 378 THR OG1 : rot 180:sc= 0.15 USER MOD Single : A 379 THR OG1 : rot 180:sc= 0 USER MOD Single : A 381 ASN : amide:sc= -1.72! C(o=-1.7!,f=-7.5!) USER MOD Single : A 383 GLN : amide:sc= -0.221 X(o=-0.22,f=-0.19) USER MOD Single : A 386 TYR OH : rot -81:sc= 0.0153 USER MOD Single : A 393 TYR OH : rot 180:sc= -0.315 USER MOD Single : A 395 SER OG : rot -160:sc= -0.906 USER MOD Single : A 400 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 401 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 404 SER OG : rot 180:sc= 0 USER MOD Single : A 405 THR OG1 : rot -86:sc= 0.23 USER MOD Single : A 411 GLN :FLIP amide:sc= -4.99! C(o=-5.6!,f=-5!) USER MOD Single : A 414 ASN : amide:sc= -0.441 K(o=-0.44,f=-3.9!) USER MOD Single : A 418 LYS NZ :NH3+ 177:sc= -0.0528 (180deg=-0.0696) USER MOD Single : A 422 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 424 GLN : amide:sc= 0.881 K(o=0.88,f=-0.33) USER MOD Single : A 428 LYS NZ :NH3+ -158:sc= -0.0416 (180deg=-0.403) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 323 62.499 6.583 -5.245 1.00 0.00 N ATOM 2 CA MET A 323 61.400 7.425 -4.695 1.00 0.00 C ATOM 3 C MET A 323 60.611 6.618 -3.669 1.00 0.00 C ATOM 4 O MET A 323 60.467 5.403 -3.798 1.00 0.00 O ATOM 5 CB MET A 323 60.478 7.867 -5.835 1.00 0.00 C ATOM 6 CG MET A 323 60.086 6.654 -6.684 1.00 0.00 C ATOM 7 SD MET A 323 61.463 6.208 -7.772 1.00 0.00 S ATOM 8 CE MET A 323 61.016 7.286 -9.155 1.00 0.00 C ATOM 0 HA MET A 323 61.818 8.308 -4.212 1.00 0.00 H new ATOM 0 HB2 MET A 323 59.585 8.343 -5.429 1.00 0.00 H new ATOM 0 HB3 MET A 323 60.981 8.609 -6.455 1.00 0.00 H new ATOM 0 HG2 MET A 323 59.831 5.813 -6.039 1.00 0.00 H new ATOM 0 HG3 MET A 323 59.200 6.882 -7.276 1.00 0.00 H new ATOM 0 HE1 MET A 323 61.746 7.171 -9.957 1.00 0.00 H new ATOM 0 HE2 MET A 323 60.027 7.014 -9.523 1.00 0.00 H new ATOM 0 HE3 MET A 323 61.006 8.323 -8.820 1.00 0.00 H new ATOM 17 N ARG A 324 60.101 7.305 -2.651 1.00 0.00 N ATOM 18 CA ARG A 324 59.328 6.641 -1.607 1.00 0.00 C ATOM 19 C ARG A 324 60.140 5.520 -0.968 1.00 0.00 C ATOM 20 O ARG A 324 61.132 5.058 -1.535 1.00 0.00 O ATOM 21 CB ARG A 324 58.039 6.065 -2.198 1.00 0.00 C ATOM 22 CG ARG A 324 57.389 7.103 -3.115 1.00 0.00 C ATOM 23 CD ARG A 324 56.076 6.545 -3.666 1.00 0.00 C ATOM 24 NE ARG A 324 55.519 7.454 -4.662 1.00 0.00 N ATOM 25 CZ ARG A 324 56.023 7.519 -5.890 1.00 0.00 C ATOM 26 NH1 ARG A 324 57.033 6.762 -6.222 1.00 0.00 N ATOM 27 NH2 ARG A 324 55.509 8.340 -6.764 1.00 0.00 N ATOM 0 H ARG A 324 60.208 8.312 -2.527 1.00 0.00 H new ATOM 0 HA ARG A 324 59.081 7.377 -0.842 1.00 0.00 H new ATOM 0 HB2 ARG A 324 58.258 5.156 -2.758 1.00 0.00 H new ATOM 0 HB3 ARG A 324 57.351 5.789 -1.398 1.00 0.00 H new ATOM 0 HG2 ARG A 324 57.202 8.025 -2.564 1.00 0.00 H new ATOM 0 HG3 ARG A 324 58.063 7.353 -3.935 1.00 0.00 H new ATOM 0 HD2 ARG A 324 56.248 5.566 -4.113 1.00 0.00 H new ATOM 0 HD3 ARG A 324 55.363 6.404 -2.853 1.00 0.00 H new ATOM 0 HE ARG A 324 54.730 8.050 -4.412 1.00 0.00 H new ATOM 0 HH11 ARG A 324 57.436 6.120 -5.539 1.00 0.00 H new ATOM 0 HH12 ARG A 324 57.420 6.812 -7.165 1.00 0.00 H new ATOM 0 HH21 ARG A 324 54.720 8.932 -6.505 1.00 0.00 H new ATOM 0 HH22 ARG A 324 55.896 8.390 -7.706 1.00 0.00 H new ATOM 41 N GLY A 325 59.716 5.087 0.215 1.00 0.00 N ATOM 42 CA GLY A 325 60.412 4.019 0.922 1.00 0.00 C ATOM 43 C GLY A 325 60.027 2.654 0.363 1.00 0.00 C ATOM 44 O GLY A 325 58.864 2.254 0.422 1.00 0.00 O ATOM 0 H GLY A 325 58.899 5.457 0.701 1.00 0.00 H new ATOM 0 HA2 GLY A 325 61.489 4.161 0.834 1.00 0.00 H new ATOM 0 HA3 GLY A 325 60.170 4.063 1.984 1.00 0.00 H new ATOM 48 N SER A 326 61.009 1.942 -0.179 1.00 0.00 N ATOM 49 CA SER A 326 60.762 0.622 -0.745 1.00 0.00 C ATOM 50 C SER A 326 62.064 -0.163 -0.868 1.00 0.00 C ATOM 51 O SER A 326 62.576 -0.692 0.119 1.00 0.00 O ATOM 52 CB SER A 326 60.113 0.759 -2.123 1.00 0.00 C ATOM 53 OG SER A 326 60.932 1.578 -2.948 1.00 0.00 O ATOM 0 H SER A 326 61.978 2.255 -0.238 1.00 0.00 H new ATOM 0 HA SER A 326 60.089 0.082 -0.079 1.00 0.00 H new ATOM 0 HB2 SER A 326 59.986 -0.224 -2.577 1.00 0.00 H new ATOM 0 HB3 SER A 326 59.119 1.197 -2.028 1.00 0.00 H new ATOM 0 HG SER A 326 60.520 1.667 -3.833 1.00 0.00 H new ATOM 59 N HIS A 327 62.597 -0.235 -2.083 1.00 0.00 N ATOM 60 CA HIS A 327 63.840 -0.958 -2.321 1.00 0.00 C ATOM 61 C HIS A 327 65.036 -0.139 -1.845 1.00 0.00 C ATOM 62 O HIS A 327 65.372 0.887 -2.435 1.00 0.00 O ATOM 63 CB HIS A 327 63.990 -1.263 -3.812 1.00 0.00 C ATOM 64 CG HIS A 327 62.834 -2.109 -4.271 1.00 0.00 C ATOM 65 ND1 HIS A 327 61.979 -2.737 -3.378 1.00 0.00 N ATOM 66 CD2 HIS A 327 62.380 -2.441 -5.523 1.00 0.00 C ATOM 67 CE1 HIS A 327 61.062 -3.408 -4.100 1.00 0.00 C ATOM 68 NE2 HIS A 327 61.261 -3.260 -5.412 1.00 0.00 N ATOM 0 H HIS A 327 62.190 0.196 -2.913 1.00 0.00 H new ATOM 0 HA HIS A 327 63.807 -1.892 -1.761 1.00 0.00 H new ATOM 0 HB2 HIS A 327 64.024 -0.335 -4.382 1.00 0.00 H new ATOM 0 HB3 HIS A 327 64.930 -1.783 -3.995 1.00 0.00 H new ATOM 0 HD2 HIS A 327 62.824 -2.116 -6.452 1.00 0.00 H new ATOM 0 HE1 HIS A 327 60.263 -3.994 -3.671 1.00 0.00 H new ATOM 0 HE2 HIS A 327 60.710 -3.662 -6.171 1.00 0.00 H new ATOM 77 N HIS A 328 65.672 -0.599 -0.773 1.00 0.00 N ATOM 78 CA HIS A 328 66.830 0.100 -0.226 1.00 0.00 C ATOM 79 C HIS A 328 67.540 -0.768 0.808 1.00 0.00 C ATOM 80 O HIS A 328 67.011 -1.019 1.891 1.00 0.00 O ATOM 81 CB HIS A 328 66.387 1.413 0.425 1.00 0.00 C ATOM 82 CG HIS A 328 67.596 2.252 0.733 1.00 0.00 C ATOM 83 ND1 HIS A 328 68.689 2.315 -0.118 1.00 0.00 N ATOM 84 CD2 HIS A 328 67.899 3.070 1.793 1.00 0.00 C ATOM 85 CE1 HIS A 328 69.590 3.144 0.441 1.00 0.00 C ATOM 86 NE2 HIS A 328 69.158 3.632 1.607 1.00 0.00 N ATOM 0 H HIS A 328 65.408 -1.446 -0.269 1.00 0.00 H new ATOM 0 HA HIS A 328 67.521 0.313 -1.041 1.00 0.00 H new ATOM 0 HB2 HIS A 328 65.716 1.954 -0.242 1.00 0.00 H new ATOM 0 HB3 HIS A 328 65.830 1.208 1.340 1.00 0.00 H new ATOM 0 HD2 HIS A 328 67.257 3.250 2.643 1.00 0.00 H new ATOM 0 HE1 HIS A 328 70.546 3.385 0.000 1.00 0.00 H new ATOM 0 HE2 HIS A 328 69.646 4.278 2.228 1.00 0.00 H new ATOM 95 N HIS A 329 68.742 -1.222 0.466 1.00 0.00 N ATOM 96 CA HIS A 329 69.519 -2.063 1.371 1.00 0.00 C ATOM 97 C HIS A 329 70.999 -2.017 1.007 1.00 0.00 C ATOM 98 O HIS A 329 71.420 -2.596 0.005 1.00 0.00 O ATOM 99 CB HIS A 329 69.020 -3.507 1.301 1.00 0.00 C ATOM 100 CG HIS A 329 67.603 -3.575 1.802 1.00 0.00 C ATOM 101 ND1 HIS A 329 66.401 -3.655 1.144 1.00 0.00 N flip ATOM 102 CD2 HIS A 329 67.295 -3.562 3.153 1.00 0.00 C flip ATOM 103 CE1 HIS A 329 65.362 -3.692 2.069 1.00 0.00 C flip ATOM 104 NE2 HIS A 329 65.956 -3.634 3.264 1.00 0.00 N flip ATOM 0 H HIS A 329 69.197 -1.024 -0.425 1.00 0.00 H new ATOM 0 HA HIS A 329 69.393 -1.684 2.385 1.00 0.00 H new ATOM 0 HB2 HIS A 329 69.072 -3.871 0.275 1.00 0.00 H new ATOM 0 HB3 HIS A 329 69.660 -4.153 1.901 1.00 0.00 H new ATOM 0 HD2 HIS A 329 68.001 -3.505 3.968 1.00 0.00 H new ATOM 0 HE1 HIS A 329 64.303 -3.754 1.865 1.00 0.00 H new ATOM 0 HE2 HIS A 329 65.455 -3.643 4.153 1.00 0.00 H new ATOM 113 N HIS A 330 71.784 -1.326 1.827 1.00 0.00 N ATOM 114 CA HIS A 330 73.218 -1.212 1.582 1.00 0.00 C ATOM 115 C HIS A 330 73.926 -2.517 1.931 1.00 0.00 C ATOM 116 O HIS A 330 73.456 -3.284 2.770 1.00 0.00 O ATOM 117 CB HIS A 330 73.801 -0.072 2.418 1.00 0.00 C ATOM 118 CG HIS A 330 73.453 -0.282 3.866 1.00 0.00 C ATOM 119 ND1 HIS A 330 74.254 -1.027 4.718 1.00 0.00 N ATOM 120 CD2 HIS A 330 72.394 0.148 4.626 1.00 0.00 C ATOM 121 CE1 HIS A 330 73.668 -1.023 5.929 1.00 0.00 C ATOM 122 NE2 HIS A 330 72.532 -0.321 5.929 1.00 0.00 N ATOM 0 H HIS A 330 71.455 -0.840 2.661 1.00 0.00 H new ATOM 0 HA HIS A 330 73.372 -1.001 0.524 1.00 0.00 H new ATOM 0 HB2 HIS A 330 74.883 -0.034 2.295 1.00 0.00 H new ATOM 0 HB3 HIS A 330 73.407 0.884 2.073 1.00 0.00 H new ATOM 0 HD2 HIS A 330 71.578 0.758 4.267 1.00 0.00 H new ATOM 0 HE1 HIS A 330 74.068 -1.527 6.797 1.00 0.00 H new ATOM 0 HE2 HIS A 330 71.901 -0.163 6.715 1.00 0.00 H new ATOM 131 N HIS A 331 75.060 -2.761 1.282 1.00 0.00 N ATOM 132 CA HIS A 331 75.825 -3.978 1.533 1.00 0.00 C ATOM 133 C HIS A 331 77.176 -3.917 0.826 1.00 0.00 C ATOM 134 O HIS A 331 78.083 -3.204 1.260 1.00 0.00 O ATOM 135 CB HIS A 331 75.040 -5.197 1.044 1.00 0.00 C ATOM 136 CG HIS A 331 75.860 -6.440 1.256 1.00 0.00 C ATOM 137 ND1 HIS A 331 76.501 -6.706 2.455 1.00 0.00 N ATOM 138 CD2 HIS A 331 76.152 -7.498 0.431 1.00 0.00 C ATOM 139 CE1 HIS A 331 77.142 -7.883 2.319 1.00 0.00 C ATOM 140 NE2 HIS A 331 76.961 -8.408 1.105 1.00 0.00 N ATOM 0 H HIS A 331 75.467 -2.138 0.584 1.00 0.00 H new ATOM 0 HA HIS A 331 75.996 -4.065 2.606 1.00 0.00 H new ATOM 0 HB2 HIS A 331 74.096 -5.275 1.583 1.00 0.00 H new ATOM 0 HB3 HIS A 331 74.796 -5.086 -0.012 1.00 0.00 H new ATOM 0 HD2 HIS A 331 75.806 -7.607 -0.586 1.00 0.00 H new ATOM 0 HE1 HIS A 331 77.731 -8.346 3.097 1.00 0.00 H new ATOM 0 HE2 HIS A 331 77.335 -9.287 0.748 1.00 0.00 H new ATOM 149 N HIS A 332 77.306 -4.668 -0.263 1.00 0.00 N ATOM 150 CA HIS A 332 78.553 -4.692 -1.020 1.00 0.00 C ATOM 151 C HIS A 332 79.732 -4.993 -0.100 1.00 0.00 C ATOM 152 O HIS A 332 80.228 -4.111 0.600 1.00 0.00 O ATOM 153 CB HIS A 332 78.772 -3.343 -1.707 1.00 0.00 C ATOM 154 CG HIS A 332 79.971 -3.430 -2.610 1.00 0.00 C ATOM 155 ND1 HIS A 332 80.273 -4.576 -3.330 1.00 0.00 N ATOM 156 CD2 HIS A 332 80.954 -2.523 -2.921 1.00 0.00 C ATOM 157 CE1 HIS A 332 81.394 -4.330 -4.032 1.00 0.00 C ATOM 158 NE2 HIS A 332 81.852 -3.094 -3.818 1.00 0.00 N ATOM 0 H HIS A 332 76.569 -5.264 -0.639 1.00 0.00 H new ATOM 0 HA HIS A 332 78.484 -5.477 -1.773 1.00 0.00 H new ATOM 0 HB2 HIS A 332 77.888 -3.068 -2.283 1.00 0.00 H new ATOM 0 HB3 HIS A 332 78.921 -2.563 -0.961 1.00 0.00 H new ATOM 0 HD2 HIS A 332 81.020 -1.519 -2.529 1.00 0.00 H new ATOM 0 HE1 HIS A 332 81.866 -5.045 -4.689 1.00 0.00 H new ATOM 0 HE2 HIS A 332 82.681 -2.661 -4.224 1.00 0.00 H new ATOM 167 N GLY A 333 80.177 -6.246 -0.108 1.00 0.00 N ATOM 168 CA GLY A 333 81.299 -6.653 0.729 1.00 0.00 C ATOM 169 C GLY A 333 82.562 -5.882 0.361 1.00 0.00 C ATOM 170 O GLY A 333 83.407 -5.610 1.213 1.00 0.00 O ATOM 0 H GLY A 333 79.781 -6.992 -0.680 1.00 0.00 H new ATOM 0 HA2 GLY A 333 81.056 -6.481 1.778 1.00 0.00 H new ATOM 0 HA3 GLY A 333 81.475 -7.723 0.613 1.00 0.00 H new ATOM 174 N SER A 334 82.684 -5.532 -0.916 1.00 0.00 N ATOM 175 CA SER A 334 83.848 -4.792 -1.387 1.00 0.00 C ATOM 176 C SER A 334 85.134 -5.436 -0.880 1.00 0.00 C ATOM 177 O SER A 334 85.552 -5.201 0.254 1.00 0.00 O ATOM 178 CB SER A 334 83.776 -3.343 -0.903 1.00 0.00 C ATOM 179 OG SER A 334 84.718 -2.560 -1.624 1.00 0.00 O ATOM 0 H SER A 334 81.996 -5.747 -1.638 1.00 0.00 H new ATOM 0 HA SER A 334 83.851 -4.812 -2.477 1.00 0.00 H new ATOM 0 HB2 SER A 334 82.770 -2.948 -1.049 1.00 0.00 H new ATOM 0 HB3 SER A 334 83.986 -3.293 0.165 1.00 0.00 H new ATOM 0 HG SER A 334 85.609 -2.677 -1.232 1.00 0.00 H new ATOM 185 N ASN A 335 85.757 -6.248 -1.728 1.00 0.00 N ATOM 186 CA ASN A 335 86.996 -6.921 -1.355 1.00 0.00 C ATOM 187 C ASN A 335 88.178 -5.961 -1.450 1.00 0.00 C ATOM 188 O ASN A 335 88.898 -5.749 -0.475 1.00 0.00 O ATOM 189 CB ASN A 335 87.236 -8.121 -2.274 1.00 0.00 C ATOM 190 CG ASN A 335 85.947 -8.918 -2.435 1.00 0.00 C ATOM 191 OD1 ASN A 335 84.976 -8.432 -3.160 1.00 0.00 O flip ATOM 192 ND2 ASN A 335 85.821 -10.014 -1.888 1.00 0.00 N flip ATOM 0 H ASN A 335 85.428 -6.455 -2.671 1.00 0.00 H new ATOM 0 HA ASN A 335 86.904 -7.265 -0.325 1.00 0.00 H new ATOM 0 HB2 ASN A 335 87.587 -7.780 -3.248 1.00 0.00 H new ATOM 0 HB3 ASN A 335 88.018 -8.757 -1.859 1.00 0.00 H new ATOM 0 HD21 ASN A 335 86.581 -10.392 -1.322 1.00 0.00 H new ATOM 0 HD22 ASN A 335 84.957 -10.544 -2.001 1.00 0.00 H new ATOM 199 N ASN A 336 88.369 -5.382 -2.632 1.00 0.00 N ATOM 200 CA ASN A 336 89.466 -4.445 -2.843 1.00 0.00 C ATOM 201 C ASN A 336 90.787 -5.053 -2.379 1.00 0.00 C ATOM 202 O ASN A 336 91.332 -4.665 -1.346 1.00 0.00 O ATOM 203 CB ASN A 336 89.203 -3.149 -2.074 1.00 0.00 C ATOM 204 CG ASN A 336 87.767 -2.689 -2.307 1.00 0.00 C ATOM 205 OD1 ASN A 336 87.102 -2.234 -1.377 1.00 0.00 O ATOM 206 ND2 ASN A 336 87.247 -2.782 -3.500 1.00 0.00 N ATOM 0 H ASN A 336 87.784 -5.544 -3.451 1.00 0.00 H new ATOM 0 HA ASN A 336 89.532 -4.228 -3.909 1.00 0.00 H new ATOM 0 HB2 ASN A 336 89.375 -3.306 -1.009 1.00 0.00 H new ATOM 0 HB3 ASN A 336 89.899 -2.376 -2.399 1.00 0.00 H new ATOM 0 HD21 ASN A 336 86.287 -2.477 -3.663 1.00 0.00 H new ATOM 0 HD22 ASN A 336 87.800 -3.159 -4.269 1.00 0.00 H new ATOM 213 N ASN A 337 91.296 -6.008 -3.152 1.00 0.00 N ATOM 214 CA ASN A 337 92.554 -6.662 -2.810 1.00 0.00 C ATOM 215 C ASN A 337 93.017 -7.561 -3.952 1.00 0.00 C ATOM 216 O ASN A 337 92.210 -8.019 -4.761 1.00 0.00 O ATOM 217 CB ASN A 337 92.381 -7.497 -1.541 1.00 0.00 C ATOM 218 CG ASN A 337 91.136 -8.369 -1.655 1.00 0.00 C ATOM 219 OD1 ASN A 337 90.125 -8.099 -1.007 1.00 0.00 O ATOM 220 ND2 ASN A 337 91.148 -9.406 -2.448 1.00 0.00 N ATOM 0 H ASN A 337 90.861 -6.344 -4.012 1.00 0.00 H new ATOM 0 HA ASN A 337 93.307 -5.893 -2.638 1.00 0.00 H new ATOM 0 HB2 ASN A 337 93.260 -8.123 -1.385 1.00 0.00 H new ATOM 0 HB3 ASN A 337 92.298 -6.842 -0.674 1.00 0.00 H new ATOM 0 HD21 ASN A 337 90.319 -9.994 -2.531 1.00 0.00 H new ATOM 0 HD22 ASN A 337 91.987 -9.628 -2.984 1.00 0.00 H new ATOM 227 N GLY A 338 94.323 -7.807 -4.013 1.00 0.00 N ATOM 228 CA GLY A 338 94.882 -8.652 -5.060 1.00 0.00 C ATOM 229 C GLY A 338 96.399 -8.513 -5.121 1.00 0.00 C ATOM 230 O GLY A 338 96.977 -7.635 -4.481 1.00 0.00 O ATOM 0 H GLY A 338 95.008 -7.436 -3.355 1.00 0.00 H new ATOM 0 HA2 GLY A 338 94.616 -9.692 -4.874 1.00 0.00 H new ATOM 0 HA3 GLY A 338 94.449 -8.379 -6.022 1.00 0.00 H new ATOM 234 N SER A 339 97.038 -9.383 -5.896 1.00 0.00 N ATOM 235 CA SER A 339 98.490 -9.347 -6.033 1.00 0.00 C ATOM 236 C SER A 339 98.922 -8.112 -6.818 1.00 0.00 C ATOM 237 O SER A 339 100.115 -7.867 -7.001 1.00 0.00 O ATOM 238 CB SER A 339 98.978 -10.606 -6.749 1.00 0.00 C ATOM 239 OG SER A 339 98.510 -10.594 -8.091 1.00 0.00 O ATOM 0 H SER A 339 96.578 -10.116 -6.435 1.00 0.00 H new ATOM 0 HA SER A 339 98.930 -9.303 -5.037 1.00 0.00 H new ATOM 0 HB2 SER A 339 100.067 -10.649 -6.732 1.00 0.00 H new ATOM 0 HB3 SER A 339 98.616 -11.495 -6.233 1.00 0.00 H new ATOM 0 HG SER A 339 98.823 -11.399 -8.554 1.00 0.00 H new ATOM 245 N LEU A 340 97.946 -7.338 -7.280 1.00 0.00 N ATOM 246 CA LEU A 340 98.238 -6.131 -8.044 1.00 0.00 C ATOM 247 C LEU A 340 99.054 -5.155 -7.201 1.00 0.00 C ATOM 248 O LEU A 340 99.458 -4.094 -7.677 1.00 0.00 O ATOM 249 CB LEU A 340 96.930 -5.463 -8.489 1.00 0.00 C ATOM 250 CG LEU A 340 96.337 -6.220 -9.684 1.00 0.00 C ATOM 251 CD1 LEU A 340 95.995 -7.655 -9.272 1.00 0.00 C ATOM 252 CD2 LEU A 340 95.066 -5.505 -10.152 1.00 0.00 C ATOM 0 H LEU A 340 96.953 -7.523 -7.140 1.00 0.00 H new ATOM 0 HA LEU A 340 98.818 -6.408 -8.925 1.00 0.00 H new ATOM 0 HB2 LEU A 340 96.218 -5.453 -7.664 1.00 0.00 H new ATOM 0 HB3 LEU A 340 97.116 -4.424 -8.762 1.00 0.00 H new ATOM 0 HG LEU A 340 97.065 -6.246 -10.495 1.00 0.00 H new ATOM 0 HD11 LEU A 340 95.574 -8.188 -10.125 1.00 0.00 H new ATOM 0 HD12 LEU A 340 96.900 -8.163 -8.937 1.00 0.00 H new ATOM 0 HD13 LEU A 340 95.268 -7.637 -8.460 1.00 0.00 H new ATOM 0 HD21 LEU A 340 94.640 -6.039 -11.002 1.00 0.00 H new ATOM 0 HD22 LEU A 340 94.341 -5.481 -9.338 1.00 0.00 H new ATOM 0 HD23 LEU A 340 95.311 -4.485 -10.450 1.00 0.00 H new ATOM 264 N LYS A 341 99.294 -5.522 -5.946 1.00 0.00 N ATOM 265 CA LYS A 341 100.063 -4.672 -5.044 1.00 0.00 C ATOM 266 C LYS A 341 101.527 -4.624 -5.471 1.00 0.00 C ATOM 267 O LYS A 341 102.367 -4.054 -4.776 1.00 0.00 O ATOM 268 CB LYS A 341 99.964 -5.204 -3.613 1.00 0.00 C ATOM 269 CG LYS A 341 100.241 -6.710 -3.605 1.00 0.00 C ATOM 270 CD LYS A 341 100.534 -7.174 -2.175 1.00 0.00 C ATOM 271 CE LYS A 341 99.314 -6.919 -1.284 1.00 0.00 C ATOM 272 NZ LYS A 341 99.277 -5.483 -0.887 1.00 0.00 N ATOM 0 H LYS A 341 98.970 -6.396 -5.533 1.00 0.00 H new ATOM 0 HA LYS A 341 99.651 -3.664 -5.086 1.00 0.00 H new ATOM 0 HB2 LYS A 341 100.680 -4.689 -2.972 1.00 0.00 H new ATOM 0 HB3 LYS A 341 98.972 -5.004 -3.208 1.00 0.00 H new ATOM 0 HG2 LYS A 341 99.382 -7.250 -4.004 1.00 0.00 H new ATOM 0 HG3 LYS A 341 101.088 -6.937 -4.252 1.00 0.00 H new ATOM 0 HD2 LYS A 341 100.782 -8.235 -2.171 1.00 0.00 H new ATOM 0 HD3 LYS A 341 101.400 -6.643 -1.781 1.00 0.00 H new ATOM 0 HE2 LYS A 341 98.400 -7.183 -1.817 1.00 0.00 H new ATOM 0 HE3 LYS A 341 99.360 -7.551 -0.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 341 98.986 -5.405 0.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 341 100.222 -5.066 -1.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 341 98.597 -4.974 -1.487 1.00 0.00 H new ATOM 286 N SER A 342 101.823 -5.228 -6.617 1.00 0.00 N ATOM 287 CA SER A 342 103.189 -5.248 -7.127 1.00 0.00 C ATOM 288 C SER A 342 103.665 -3.836 -7.442 1.00 0.00 C ATOM 289 O SER A 342 104.836 -3.622 -7.756 1.00 0.00 O ATOM 290 CB SER A 342 103.264 -6.108 -8.389 1.00 0.00 C ATOM 291 OG SER A 342 104.548 -5.963 -8.980 1.00 0.00 O ATOM 0 H SER A 342 101.142 -5.707 -7.206 1.00 0.00 H new ATOM 0 HA SER A 342 103.836 -5.673 -6.360 1.00 0.00 H new ATOM 0 HB2 SER A 342 103.081 -7.154 -8.142 1.00 0.00 H new ATOM 0 HB3 SER A 342 102.490 -5.807 -9.095 1.00 0.00 H new ATOM 0 HG SER A 342 105.082 -5.333 -8.452 1.00 0.00 H new ATOM 297 N ALA A 343 102.752 -2.873 -7.354 1.00 0.00 N ATOM 298 CA ALA A 343 103.099 -1.483 -7.629 1.00 0.00 C ATOM 299 C ALA A 343 103.740 -0.845 -6.391 1.00 0.00 C ATOM 300 O ALA A 343 103.354 -1.157 -5.265 1.00 0.00 O ATOM 301 CB ALA A 343 101.841 -0.700 -8.013 1.00 0.00 C ATOM 0 H ALA A 343 101.777 -3.027 -7.097 1.00 0.00 H new ATOM 0 HA ALA A 343 103.810 -1.455 -8.455 1.00 0.00 H new ATOM 0 HB1 ALA A 343 102.106 0.337 -8.217 1.00 0.00 H new ATOM 0 HB2 ALA A 343 101.395 -1.142 -8.904 1.00 0.00 H new ATOM 0 HB3 ALA A 343 101.125 -0.736 -7.192 1.00 0.00 H new ATOM 307 N PRO A 344 104.700 0.035 -6.564 1.00 0.00 N ATOM 308 CA PRO A 344 105.381 0.710 -5.417 1.00 0.00 C ATOM 309 C PRO A 344 104.461 1.709 -4.715 1.00 0.00 C ATOM 310 O PRO A 344 103.868 2.578 -5.355 1.00 0.00 O ATOM 311 CB PRO A 344 106.579 1.414 -6.074 1.00 0.00 C ATOM 312 CG PRO A 344 106.148 1.663 -7.482 1.00 0.00 C ATOM 313 CD PRO A 344 105.245 0.487 -7.858 1.00 0.00 C ATOM 0 HA PRO A 344 105.676 0.009 -4.636 1.00 0.00 H new ATOM 0 HB2 PRO A 344 106.819 2.346 -5.563 1.00 0.00 H new ATOM 0 HB3 PRO A 344 107.473 0.791 -6.038 1.00 0.00 H new ATOM 0 HG2 PRO A 344 105.613 2.609 -7.565 1.00 0.00 H new ATOM 0 HG3 PRO A 344 107.008 1.724 -8.149 1.00 0.00 H new ATOM 0 HD2 PRO A 344 104.453 0.793 -8.541 1.00 0.00 H new ATOM 0 HD3 PRO A 344 105.805 -0.305 -8.355 1.00 0.00 H new ATOM 321 N SER A 345 104.349 1.577 -3.396 1.00 0.00 N ATOM 322 CA SER A 345 103.499 2.471 -2.613 1.00 0.00 C ATOM 323 C SER A 345 104.238 3.766 -2.290 1.00 0.00 C ATOM 324 O SER A 345 103.656 4.702 -1.741 1.00 0.00 O ATOM 325 CB SER A 345 103.082 1.783 -1.313 1.00 0.00 C ATOM 326 OG SER A 345 104.146 1.865 -0.376 1.00 0.00 O ATOM 0 H SER A 345 104.833 0.865 -2.849 1.00 0.00 H new ATOM 0 HA SER A 345 102.613 2.709 -3.201 1.00 0.00 H new ATOM 0 HB2 SER A 345 102.188 2.257 -0.908 1.00 0.00 H new ATOM 0 HB3 SER A 345 102.831 0.740 -1.505 1.00 0.00 H new ATOM 0 HG SER A 345 103.881 1.426 0.459 1.00 0.00 H new ATOM 332 N SER A 346 105.522 3.812 -2.631 1.00 0.00 N ATOM 333 CA SER A 346 106.329 4.999 -2.370 1.00 0.00 C ATOM 334 C SER A 346 105.702 6.229 -3.019 1.00 0.00 C ATOM 335 O SER A 346 105.991 7.361 -2.633 1.00 0.00 O ATOM 336 CB SER A 346 107.743 4.798 -2.915 1.00 0.00 C ATOM 337 OG SER A 346 108.315 3.639 -2.322 1.00 0.00 O ATOM 0 H SER A 346 106.023 3.048 -3.085 1.00 0.00 H new ATOM 0 HA SER A 346 106.373 5.155 -1.292 1.00 0.00 H new ATOM 0 HB2 SER A 346 107.715 4.690 -3.999 1.00 0.00 H new ATOM 0 HB3 SER A 346 108.357 5.672 -2.698 1.00 0.00 H new ATOM 0 HG SER A 346 109.221 3.506 -2.671 1.00 0.00 H new ATOM 343 N HIS A 347 104.843 5.999 -4.007 1.00 0.00 N ATOM 344 CA HIS A 347 104.183 7.096 -4.704 1.00 0.00 C ATOM 345 C HIS A 347 103.361 7.933 -3.727 1.00 0.00 C ATOM 346 O HIS A 347 103.488 7.790 -2.511 1.00 0.00 O ATOM 347 CB HIS A 347 103.272 6.545 -5.803 1.00 0.00 C ATOM 348 CG HIS A 347 104.113 5.994 -6.922 1.00 0.00 C ATOM 349 ND1 HIS A 347 103.720 6.072 -8.249 1.00 0.00 N ATOM 350 CD2 HIS A 347 105.328 5.357 -6.927 1.00 0.00 C ATOM 351 CE1 HIS A 347 104.684 5.495 -8.990 1.00 0.00 C ATOM 352 NE2 HIS A 347 105.687 5.042 -8.234 1.00 0.00 N ATOM 0 H HIS A 347 104.589 5.069 -4.341 1.00 0.00 H new ATOM 0 HA HIS A 347 104.948 7.730 -5.153 1.00 0.00 H new ATOM 0 HB2 HIS A 347 102.628 5.764 -5.399 1.00 0.00 H new ATOM 0 HB3 HIS A 347 102.619 7.333 -6.178 1.00 0.00 H new ATOM 0 HD2 HIS A 347 105.917 5.134 -6.049 1.00 0.00 H new ATOM 0 HE1 HIS A 347 104.650 5.409 -10.066 1.00 0.00 H new ATOM 0 HE2 HIS A 347 106.534 4.567 -8.547 1.00 0.00 H new ATOM 361 N TYR A 348 102.513 8.802 -4.268 1.00 0.00 N ATOM 362 CA TYR A 348 101.668 9.655 -3.440 1.00 0.00 C ATOM 363 C TYR A 348 100.637 10.370 -4.312 1.00 0.00 C ATOM 364 O TYR A 348 100.949 10.829 -5.411 1.00 0.00 O ATOM 365 CB TYR A 348 102.540 10.686 -2.684 1.00 0.00 C ATOM 366 CG TYR A 348 102.887 10.168 -1.302 1.00 0.00 C ATOM 367 CD1 TYR A 348 101.884 10.056 -0.331 1.00 0.00 C ATOM 368 CD2 TYR A 348 104.204 9.803 -0.993 1.00 0.00 C ATOM 369 CE1 TYR A 348 102.196 9.581 0.948 1.00 0.00 C ATOM 370 CE2 TYR A 348 104.515 9.327 0.287 1.00 0.00 C ATOM 371 CZ TYR A 348 103.512 9.216 1.257 1.00 0.00 C ATOM 372 OH TYR A 348 103.820 8.746 2.518 1.00 0.00 O ATOM 0 H TYR A 348 102.393 8.934 -5.272 1.00 0.00 H new ATOM 0 HA TYR A 348 101.143 9.038 -2.711 1.00 0.00 H new ATOM 0 HB2 TYR A 348 103.453 10.882 -3.246 1.00 0.00 H new ATOM 0 HB3 TYR A 348 102.007 11.633 -2.602 1.00 0.00 H new ATOM 0 HD1 TYR A 348 100.869 10.336 -0.569 1.00 0.00 H new ATOM 0 HD2 TYR A 348 104.978 9.889 -1.741 1.00 0.00 H new ATOM 0 HE1 TYR A 348 101.422 9.496 1.696 1.00 0.00 H new ATOM 0 HE2 TYR A 348 105.530 9.045 0.526 1.00 0.00 H new ATOM 0 HH TYR A 348 104.701 8.317 2.501 1.00 0.00 H new ATOM 382 N THR A 349 99.409 10.460 -3.810 1.00 0.00 N ATOM 383 CA THR A 349 98.335 11.120 -4.544 1.00 0.00 C ATOM 384 C THR A 349 97.255 11.598 -3.581 1.00 0.00 C ATOM 385 O THR A 349 96.356 10.840 -3.217 1.00 0.00 O ATOM 386 CB THR A 349 97.724 10.153 -5.560 1.00 0.00 C ATOM 387 OG1 THR A 349 98.754 9.607 -6.371 1.00 0.00 O ATOM 388 CG2 THR A 349 96.719 10.899 -6.439 1.00 0.00 C ATOM 0 H THR A 349 99.134 10.086 -2.902 1.00 0.00 H new ATOM 0 HA THR A 349 98.750 11.980 -5.070 1.00 0.00 H new ATOM 0 HB THR A 349 97.212 9.348 -5.033 1.00 0.00 H new ATOM 0 HG1 THR A 349 99.515 10.224 -6.393 1.00 0.00 H new ATOM 0 HG21 THR A 349 96.285 10.208 -7.162 1.00 0.00 H new ATOM 0 HG22 THR A 349 95.928 11.315 -5.815 1.00 0.00 H new ATOM 0 HG23 THR A 349 97.227 11.706 -6.968 1.00 0.00 H new ATOM 396 N LEU A 350 97.354 12.858 -3.167 1.00 0.00 N ATOM 397 CA LEU A 350 96.380 13.425 -2.242 1.00 0.00 C ATOM 398 C LEU A 350 94.978 13.354 -2.844 1.00 0.00 C ATOM 399 O LEU A 350 94.668 12.440 -3.609 1.00 0.00 O ATOM 400 CB LEU A 350 96.753 14.887 -1.925 1.00 0.00 C ATOM 401 CG LEU A 350 96.238 15.286 -0.523 1.00 0.00 C ATOM 402 CD1 LEU A 350 97.248 14.865 0.552 1.00 0.00 C ATOM 403 CD2 LEU A 350 96.046 16.806 -0.456 1.00 0.00 C ATOM 0 H LEU A 350 98.092 13.500 -3.455 1.00 0.00 H new ATOM 0 HA LEU A 350 96.389 12.848 -1.317 1.00 0.00 H new ATOM 0 HB2 LEU A 350 97.835 15.010 -1.970 1.00 0.00 H new ATOM 0 HB3 LEU A 350 96.325 15.549 -2.678 1.00 0.00 H new ATOM 0 HG LEU A 350 95.288 14.783 -0.345 1.00 0.00 H new ATOM 0 HD11 LEU A 350 96.874 15.152 1.535 1.00 0.00 H new ATOM 0 HD12 LEU A 350 97.387 13.784 0.517 1.00 0.00 H new ATOM 0 HD13 LEU A 350 98.202 15.359 0.369 1.00 0.00 H new ATOM 0 HD21 LEU A 350 95.683 17.084 0.534 1.00 0.00 H new ATOM 0 HD22 LEU A 350 96.998 17.302 -0.645 1.00 0.00 H new ATOM 0 HD23 LEU A 350 95.320 17.115 -1.208 1.00 0.00 H new ATOM 415 N GLN A 351 94.132 14.321 -2.498 1.00 0.00 N ATOM 416 CA GLN A 351 92.764 14.358 -3.011 1.00 0.00 C ATOM 417 C GLN A 351 92.333 15.798 -3.240 1.00 0.00 C ATOM 418 O GLN A 351 93.162 16.706 -3.264 1.00 0.00 O ATOM 419 CB GLN A 351 91.814 13.683 -2.016 1.00 0.00 C ATOM 420 CG GLN A 351 91.825 14.443 -0.681 1.00 0.00 C ATOM 421 CD GLN A 351 90.903 15.656 -0.753 1.00 0.00 C ATOM 422 OE1 GLN A 351 91.412 16.841 -0.952 1.00 0.00 O flip ATOM 423 NE2 GLN A 351 89.686 15.521 -0.627 1.00 0.00 N flip ATOM 0 H GLN A 351 94.368 15.087 -1.867 1.00 0.00 H new ATOM 0 HA GLN A 351 92.728 13.821 -3.959 1.00 0.00 H new ATOM 0 HB2 GLN A 351 90.803 13.661 -2.423 1.00 0.00 H new ATOM 0 HB3 GLN A 351 92.116 12.648 -1.857 1.00 0.00 H new ATOM 0 HG2 GLN A 351 91.504 13.782 0.124 1.00 0.00 H new ATOM 0 HG3 GLN A 351 92.840 14.763 -0.446 1.00 0.00 H new ATOM 0 HE21 GLN A 351 89.289 14.594 -0.472 1.00 0.00 H new ATOM 0 HE22 GLN A 351 89.074 16.336 -0.678 1.00 0.00 H new ATOM 432 N LEU A 352 91.030 16.001 -3.412 1.00 0.00 N ATOM 433 CA LEU A 352 90.493 17.342 -3.646 1.00 0.00 C ATOM 434 C LEU A 352 89.192 17.533 -2.861 1.00 0.00 C ATOM 435 O LEU A 352 88.985 18.572 -2.233 1.00 0.00 O ATOM 436 CB LEU A 352 90.254 17.538 -5.167 1.00 0.00 C ATOM 437 CG LEU A 352 90.953 18.813 -5.677 1.00 0.00 C ATOM 438 CD1 LEU A 352 92.453 18.556 -5.846 1.00 0.00 C ATOM 439 CD2 LEU A 352 90.355 19.221 -7.028 1.00 0.00 C ATOM 0 H LEU A 352 90.329 15.261 -3.394 1.00 0.00 H new ATOM 0 HA LEU A 352 91.208 18.089 -3.301 1.00 0.00 H new ATOM 0 HB2 LEU A 352 90.628 16.671 -5.712 1.00 0.00 H new ATOM 0 HB3 LEU A 352 89.184 17.602 -5.365 1.00 0.00 H new ATOM 0 HG LEU A 352 90.804 19.613 -4.952 1.00 0.00 H new ATOM 0 HD11 LEU A 352 92.939 19.462 -6.207 1.00 0.00 H new ATOM 0 HD12 LEU A 352 92.884 18.271 -4.886 1.00 0.00 H new ATOM 0 HD13 LEU A 352 92.606 17.752 -6.566 1.00 0.00 H new ATOM 0 HD21 LEU A 352 90.850 20.123 -7.388 1.00 0.00 H new ATOM 0 HD22 LEU A 352 90.500 18.416 -7.748 1.00 0.00 H new ATOM 0 HD23 LEU A 352 89.289 19.415 -6.910 1.00 0.00 H new ATOM 451 N SER A 353 88.321 16.527 -2.900 1.00 0.00 N ATOM 452 CA SER A 353 87.049 16.603 -2.187 1.00 0.00 C ATOM 453 C SER A 353 86.499 15.209 -1.915 1.00 0.00 C ATOM 454 O SER A 353 87.081 14.207 -2.330 1.00 0.00 O ATOM 455 CB SER A 353 86.037 17.394 -3.012 1.00 0.00 C ATOM 456 OG SER A 353 86.030 16.900 -4.344 1.00 0.00 O ATOM 0 H SER A 353 88.471 15.658 -3.413 1.00 0.00 H new ATOM 0 HA SER A 353 87.220 17.106 -1.235 1.00 0.00 H new ATOM 0 HB2 SER A 353 85.043 17.304 -2.573 1.00 0.00 H new ATOM 0 HB3 SER A 353 86.294 18.453 -3.006 1.00 0.00 H new ATOM 0 HG SER A 353 85.194 17.160 -4.785 1.00 0.00 H new ATOM 462 N SER A 354 85.369 15.153 -1.211 1.00 0.00 N ATOM 463 CA SER A 354 84.735 13.879 -0.881 1.00 0.00 C ATOM 464 C SER A 354 83.217 14.025 -0.878 1.00 0.00 C ATOM 465 O SER A 354 82.686 15.099 -0.592 1.00 0.00 O ATOM 466 CB SER A 354 85.205 13.406 0.496 1.00 0.00 C ATOM 467 OG SER A 354 84.606 14.216 1.499 1.00 0.00 O ATOM 0 H SER A 354 84.875 15.973 -0.859 1.00 0.00 H new ATOM 0 HA SER A 354 85.018 13.145 -1.635 1.00 0.00 H new ATOM 0 HB2 SER A 354 84.934 12.361 0.646 1.00 0.00 H new ATOM 0 HB3 SER A 354 86.291 13.467 0.563 1.00 0.00 H new ATOM 0 HG SER A 354 84.903 13.915 2.383 1.00 0.00 H new ATOM 473 N SER A 355 82.526 12.938 -1.200 1.00 0.00 N ATOM 474 CA SER A 355 81.069 12.948 -1.234 1.00 0.00 C ATOM 475 C SER A 355 80.555 11.657 -1.875 1.00 0.00 C ATOM 476 O SER A 355 81.323 10.725 -2.104 1.00 0.00 O ATOM 477 CB SER A 355 80.570 14.183 -2.006 1.00 0.00 C ATOM 478 OG SER A 355 80.205 15.193 -1.076 1.00 0.00 O ATOM 0 H SER A 355 82.949 12.042 -1.440 1.00 0.00 H new ATOM 0 HA SER A 355 80.683 13.003 -0.216 1.00 0.00 H new ATOM 0 HB2 SER A 355 81.349 14.550 -2.674 1.00 0.00 H new ATOM 0 HB3 SER A 355 79.716 13.918 -2.629 1.00 0.00 H new ATOM 0 HG SER A 355 81.008 15.525 -0.622 1.00 0.00 H new ATOM 484 N SER A 356 79.253 11.607 -2.155 1.00 0.00 N ATOM 485 CA SER A 356 78.647 10.418 -2.763 1.00 0.00 C ATOM 486 C SER A 356 77.662 10.811 -3.859 1.00 0.00 C ATOM 487 O SER A 356 76.511 10.375 -3.856 1.00 0.00 O ATOM 488 CB SER A 356 77.919 9.606 -1.693 1.00 0.00 C ATOM 489 OG SER A 356 77.648 8.303 -2.194 1.00 0.00 O ATOM 0 H SER A 356 78.600 12.369 -1.973 1.00 0.00 H new ATOM 0 HA SER A 356 79.441 9.817 -3.207 1.00 0.00 H new ATOM 0 HB2 SER A 356 78.529 9.542 -0.792 1.00 0.00 H new ATOM 0 HB3 SER A 356 76.989 10.102 -1.414 1.00 0.00 H new ATOM 0 HG SER A 356 77.041 8.367 -2.960 1.00 0.00 H new ATOM 495 N ASN A 357 78.120 11.637 -4.796 1.00 0.00 N ATOM 496 CA ASN A 357 77.264 12.081 -5.894 1.00 0.00 C ATOM 497 C ASN A 357 78.097 12.464 -7.113 1.00 0.00 C ATOM 498 O ASN A 357 79.193 13.004 -6.984 1.00 0.00 O ATOM 499 CB ASN A 357 76.428 13.282 -5.450 1.00 0.00 C ATOM 500 CG ASN A 357 75.284 13.515 -6.432 1.00 0.00 C ATOM 501 OD1 ASN A 357 75.515 13.648 -7.634 1.00 0.00 O ATOM 502 ND2 ASN A 357 74.058 13.573 -5.990 1.00 0.00 N ATOM 0 H ASN A 357 79.069 12.010 -4.818 1.00 0.00 H new ATOM 0 HA ASN A 357 76.605 11.256 -6.167 1.00 0.00 H new ATOM 0 HB2 ASN A 357 76.030 13.108 -4.450 1.00 0.00 H new ATOM 0 HB3 ASN A 357 77.056 14.171 -5.393 1.00 0.00 H new ATOM 0 HD21 ASN A 357 73.288 13.729 -6.641 1.00 0.00 H new ATOM 0 HD22 ASN A 357 73.869 13.462 -4.994 1.00 0.00 H new ATOM 509 N TYR A 358 77.559 12.174 -8.298 1.00 0.00 N ATOM 510 CA TYR A 358 78.244 12.489 -9.554 1.00 0.00 C ATOM 511 C TYR A 358 77.743 13.814 -10.119 1.00 0.00 C ATOM 512 O TYR A 358 78.467 14.810 -10.127 1.00 0.00 O ATOM 513 CB TYR A 358 78.001 11.374 -10.575 1.00 0.00 C ATOM 514 CG TYR A 358 78.651 11.741 -11.889 1.00 0.00 C ATOM 515 CD1 TYR A 358 79.990 11.405 -12.127 1.00 0.00 C ATOM 516 CD2 TYR A 358 77.915 12.421 -12.867 1.00 0.00 C ATOM 517 CE1 TYR A 358 80.591 11.747 -13.344 1.00 0.00 C ATOM 518 CE2 TYR A 358 78.517 12.763 -14.083 1.00 0.00 C ATOM 519 CZ TYR A 358 79.855 12.426 -14.322 1.00 0.00 C ATOM 520 OH TYR A 358 80.448 12.765 -15.522 1.00 0.00 O ATOM 0 H TYR A 358 76.652 11.722 -8.415 1.00 0.00 H new ATOM 0 HA TYR A 358 79.312 12.572 -9.353 1.00 0.00 H new ATOM 0 HB2 TYR A 358 78.409 10.433 -10.206 1.00 0.00 H new ATOM 0 HB3 TYR A 358 76.931 11.223 -10.716 1.00 0.00 H new ATOM 0 HD1 TYR A 358 80.558 10.882 -11.372 1.00 0.00 H new ATOM 0 HD2 TYR A 358 76.883 12.681 -12.683 1.00 0.00 H new ATOM 0 HE1 TYR A 358 81.623 11.487 -13.528 1.00 0.00 H new ATOM 0 HE2 TYR A 358 77.949 13.287 -14.838 1.00 0.00 H new ATOM 0 HH TYR A 358 79.798 13.231 -16.088 1.00 0.00 H new ATOM 530 N ASP A 359 76.501 13.818 -10.589 1.00 0.00 N ATOM 531 CA ASP A 359 75.913 15.027 -11.154 1.00 0.00 C ATOM 532 C ASP A 359 76.173 16.224 -10.245 1.00 0.00 C ATOM 533 O ASP A 359 76.858 17.171 -10.630 1.00 0.00 O ATOM 534 CB ASP A 359 74.404 14.839 -11.335 1.00 0.00 C ATOM 535 CG ASP A 359 73.838 15.968 -12.190 1.00 0.00 C ATOM 536 OD1 ASP A 359 73.960 17.111 -11.782 1.00 0.00 O ATOM 537 OD2 ASP A 359 73.290 15.672 -13.239 1.00 0.00 O ATOM 0 H ASP A 359 75.886 13.005 -10.591 1.00 0.00 H new ATOM 0 HA ASP A 359 76.374 15.214 -12.124 1.00 0.00 H new ATOM 0 HB2 ASP A 359 74.203 13.878 -11.808 1.00 0.00 H new ATOM 0 HB3 ASP A 359 73.911 14.826 -10.363 1.00 0.00 H new ATOM 542 N ASN A 360 75.619 16.173 -9.039 1.00 0.00 N ATOM 543 CA ASN A 360 75.794 17.259 -8.082 1.00 0.00 C ATOM 544 C ASN A 360 77.257 17.692 -8.016 1.00 0.00 C ATOM 545 O ASN A 360 77.559 18.832 -7.665 1.00 0.00 O ATOM 546 CB ASN A 360 75.330 16.813 -6.695 1.00 0.00 C ATOM 547 CG ASN A 360 75.186 18.024 -5.779 1.00 0.00 C ATOM 548 OD1 ASN A 360 75.445 19.216 -6.243 1.00 0.00 O flip ATOM 549 ND2 ASN A 360 74.827 17.881 -4.610 1.00 0.00 N flip ATOM 0 H ASN A 360 75.049 15.397 -8.702 1.00 0.00 H new ATOM 0 HA ASN A 360 75.193 18.106 -8.413 1.00 0.00 H new ATOM 0 HB2 ASN A 360 74.377 16.290 -6.772 1.00 0.00 H new ATOM 0 HB3 ASN A 360 76.047 16.109 -6.271 1.00 0.00 H new ATOM 0 HD21 ASN A 360 74.625 16.949 -4.249 1.00 0.00 H new ATOM 0 HD22 ASN A 360 74.732 18.695 -4.003 1.00 0.00 H new ATOM 556 N LEU A 361 78.160 16.777 -8.355 1.00 0.00 N ATOM 557 CA LEU A 361 79.586 17.085 -8.328 1.00 0.00 C ATOM 558 C LEU A 361 79.940 18.041 -9.464 1.00 0.00 C ATOM 559 O LEU A 361 80.618 19.047 -9.253 1.00 0.00 O ATOM 560 CB LEU A 361 80.409 15.788 -8.451 1.00 0.00 C ATOM 561 CG LEU A 361 81.723 15.911 -7.665 1.00 0.00 C ATOM 562 CD1 LEU A 361 82.495 14.592 -7.750 1.00 0.00 C ATOM 563 CD2 LEU A 361 82.576 17.043 -8.249 1.00 0.00 C ATOM 0 H LEU A 361 77.934 15.827 -8.648 1.00 0.00 H new ATOM 0 HA LEU A 361 79.824 17.565 -7.379 1.00 0.00 H new ATOM 0 HB2 LEU A 361 79.830 14.945 -8.074 1.00 0.00 H new ATOM 0 HB3 LEU A 361 80.623 15.584 -9.500 1.00 0.00 H new ATOM 0 HG LEU A 361 81.497 16.135 -6.622 1.00 0.00 H new ATOM 0 HD11 LEU A 361 83.427 14.680 -7.192 1.00 0.00 H new ATOM 0 HD12 LEU A 361 81.892 13.789 -7.325 1.00 0.00 H new ATOM 0 HD13 LEU A 361 82.716 14.366 -8.793 1.00 0.00 H new ATOM 0 HD21 LEU A 361 83.506 17.125 -7.687 1.00 0.00 H new ATOM 0 HD22 LEU A 361 82.801 16.827 -9.294 1.00 0.00 H new ATOM 0 HD23 LEU A 361 82.028 17.983 -8.182 1.00 0.00 H new ATOM 575 N ASN A 362 79.466 17.732 -10.667 1.00 0.00 N ATOM 576 CA ASN A 362 79.735 18.580 -11.820 1.00 0.00 C ATOM 577 C ASN A 362 79.529 20.045 -11.453 1.00 0.00 C ATOM 578 O ASN A 362 80.328 20.908 -11.817 1.00 0.00 O ATOM 579 CB ASN A 362 78.805 18.197 -12.973 1.00 0.00 C ATOM 580 CG ASN A 362 79.321 18.787 -14.281 1.00 0.00 C ATOM 581 OD1 ASN A 362 78.789 19.786 -14.766 1.00 0.00 O ATOM 582 ND2 ASN A 362 80.332 18.225 -14.884 1.00 0.00 N ATOM 0 H ASN A 362 78.899 16.908 -10.867 1.00 0.00 H new ATOM 0 HA ASN A 362 80.770 18.437 -12.131 1.00 0.00 H new ATOM 0 HB2 ASN A 362 78.742 17.112 -13.054 1.00 0.00 H new ATOM 0 HB3 ASN A 362 77.797 18.561 -12.774 1.00 0.00 H new ATOM 0 HD21 ASN A 362 80.684 18.613 -15.759 1.00 0.00 H new ATOM 0 HD22 ASN A 362 80.771 17.398 -14.480 1.00 0.00 H new ATOM 589 N GLY A 363 78.454 20.314 -10.720 1.00 0.00 N ATOM 590 CA GLY A 363 78.153 21.672 -10.294 1.00 0.00 C ATOM 591 C GLY A 363 79.302 22.247 -9.473 1.00 0.00 C ATOM 592 O GLY A 363 79.807 23.329 -9.770 1.00 0.00 O ATOM 0 H GLY A 363 77.781 19.613 -10.411 1.00 0.00 H new ATOM 0 HA2 GLY A 363 77.973 22.300 -11.166 1.00 0.00 H new ATOM 0 HA3 GLY A 363 77.238 21.678 -9.702 1.00 0.00 H new ATOM 596 N TRP A 364 79.713 21.515 -8.439 1.00 0.00 N ATOM 597 CA TRP A 364 80.804 21.970 -7.585 1.00 0.00 C ATOM 598 C TRP A 364 82.108 22.057 -8.372 1.00 0.00 C ATOM 599 O TRP A 364 82.660 23.141 -8.559 1.00 0.00 O ATOM 600 CB TRP A 364 80.991 21.015 -6.403 1.00 0.00 C ATOM 601 CG TRP A 364 82.010 21.592 -5.476 1.00 0.00 C ATOM 602 CD1 TRP A 364 81.836 22.715 -4.742 1.00 0.00 C ATOM 603 CD2 TRP A 364 83.356 21.111 -5.178 1.00 0.00 C ATOM 604 NE1 TRP A 364 82.988 22.958 -4.014 1.00 0.00 N ATOM 605 CE2 TRP A 364 83.952 22.000 -4.249 1.00 0.00 C ATOM 606 CE3 TRP A 364 84.112 20.006 -5.617 1.00 0.00 C ATOM 607 CZ2 TRP A 364 85.248 21.801 -3.776 1.00 0.00 C ATOM 608 CZ3 TRP A 364 85.417 19.806 -5.140 1.00 0.00 C ATOM 609 CH2 TRP A 364 85.983 20.703 -4.223 1.00 0.00 C ATOM 0 H TRP A 364 79.311 20.615 -8.176 1.00 0.00 H new ATOM 0 HA TRP A 364 80.546 22.962 -7.213 1.00 0.00 H new ATOM 0 HB2 TRP A 364 80.045 20.870 -5.881 1.00 0.00 H new ATOM 0 HB3 TRP A 364 81.313 20.036 -6.756 1.00 0.00 H new ATOM 0 HD1 TRP A 364 80.944 23.323 -4.727 1.00 0.00 H new ATOM 0 HE1 TRP A 364 83.109 23.749 -3.381 1.00 0.00 H new ATOM 0 HE3 TRP A 364 83.685 19.310 -6.324 1.00 0.00 H new ATOM 0 HZ2 TRP A 364 85.680 22.493 -3.068 1.00 0.00 H new ATOM 0 HZ3 TRP A 364 85.989 18.956 -5.482 1.00 0.00 H new ATOM 0 HH2 TRP A 364 86.989 20.544 -3.863 1.00 0.00 H new ATOM 620 N ALA A 365 82.598 20.906 -8.828 1.00 0.00 N ATOM 621 CA ALA A 365 83.845 20.861 -9.590 1.00 0.00 C ATOM 622 C ALA A 365 83.928 22.030 -10.569 1.00 0.00 C ATOM 623 O ALA A 365 84.968 22.678 -10.690 1.00 0.00 O ATOM 624 CB ALA A 365 83.934 19.543 -10.363 1.00 0.00 C ATOM 0 H ALA A 365 82.155 19.998 -8.685 1.00 0.00 H new ATOM 0 HA ALA A 365 84.676 20.934 -8.888 1.00 0.00 H new ATOM 0 HB1 ALA A 365 84.865 19.515 -10.929 1.00 0.00 H new ATOM 0 HB2 ALA A 365 83.910 18.708 -9.663 1.00 0.00 H new ATOM 0 HB3 ALA A 365 83.090 19.466 -11.049 1.00 0.00 H new ATOM 630 N LYS A 366 82.825 22.298 -11.260 1.00 0.00 N ATOM 631 CA LYS A 366 82.786 23.395 -12.221 1.00 0.00 C ATOM 632 C LYS A 366 82.780 24.736 -11.495 1.00 0.00 C ATOM 633 O LYS A 366 83.414 25.695 -11.936 1.00 0.00 O ATOM 634 CB LYS A 366 81.533 23.281 -13.097 1.00 0.00 C ATOM 635 CG LYS A 366 81.597 22.002 -13.954 1.00 0.00 C ATOM 636 CD LYS A 366 82.408 22.256 -15.232 1.00 0.00 C ATOM 637 CE LYS A 366 82.326 21.025 -16.138 1.00 0.00 C ATOM 638 NZ LYS A 366 83.121 21.265 -17.376 1.00 0.00 N ATOM 0 H LYS A 366 81.953 21.776 -11.174 1.00 0.00 H new ATOM 0 HA LYS A 366 83.674 23.336 -12.851 1.00 0.00 H new ATOM 0 HB2 LYS A 366 80.642 23.263 -12.469 1.00 0.00 H new ATOM 0 HB3 LYS A 366 81.451 24.156 -13.742 1.00 0.00 H new ATOM 0 HG2 LYS A 366 82.053 21.195 -13.381 1.00 0.00 H new ATOM 0 HG3 LYS A 366 80.589 21.679 -14.213 1.00 0.00 H new ATOM 0 HD2 LYS A 366 82.021 23.132 -15.753 1.00 0.00 H new ATOM 0 HD3 LYS A 366 83.447 22.468 -14.981 1.00 0.00 H new ATOM 0 HE2 LYS A 366 82.706 20.148 -15.613 1.00 0.00 H new ATOM 0 HE3 LYS A 366 81.287 20.818 -16.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 366 83.065 20.429 -17.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 366 82.739 22.091 -17.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 366 84.114 21.443 -17.122 1.00 0.00 H new ATOM 652 N LYS A 367 82.060 24.798 -10.379 1.00 0.00 N ATOM 653 CA LYS A 367 81.980 26.029 -9.600 1.00 0.00 C ATOM 654 C LYS A 367 83.370 26.622 -9.395 1.00 0.00 C ATOM 655 O LYS A 367 83.676 27.701 -9.904 1.00 0.00 O ATOM 656 CB LYS A 367 81.338 25.746 -8.236 1.00 0.00 C ATOM 657 CG LYS A 367 80.958 27.068 -7.541 1.00 0.00 C ATOM 658 CD LYS A 367 79.567 27.530 -7.997 1.00 0.00 C ATOM 659 CE LYS A 367 79.163 28.778 -7.210 1.00 0.00 C ATOM 660 NZ LYS A 367 80.098 29.893 -7.534 1.00 0.00 N ATOM 0 H LYS A 367 81.527 24.017 -9.996 1.00 0.00 H new ATOM 0 HA LYS A 367 81.367 26.745 -10.148 1.00 0.00 H new ATOM 0 HB2 LYS A 367 80.450 25.127 -8.365 1.00 0.00 H new ATOM 0 HB3 LYS A 367 82.031 25.184 -7.610 1.00 0.00 H new ATOM 0 HG2 LYS A 367 80.967 26.934 -6.459 1.00 0.00 H new ATOM 0 HG3 LYS A 367 81.697 27.834 -7.773 1.00 0.00 H new ATOM 0 HD2 LYS A 367 79.576 27.747 -9.065 1.00 0.00 H new ATOM 0 HD3 LYS A 367 78.838 26.735 -7.839 1.00 0.00 H new ATOM 0 HE2 LYS A 367 78.141 29.063 -7.458 1.00 0.00 H new ATOM 0 HE3 LYS A 367 79.185 28.570 -6.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 367 79.675 30.797 -7.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 367 80.996 29.751 -7.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 367 80.277 29.910 -8.558 1.00 0.00 H new ATOM 674 N GLU A 368 84.208 25.911 -8.648 1.00 0.00 N ATOM 675 CA GLU A 368 85.565 26.377 -8.385 1.00 0.00 C ATOM 676 C GLU A 368 86.411 26.295 -9.652 1.00 0.00 C ATOM 677 O GLU A 368 87.535 26.795 -9.693 1.00 0.00 O ATOM 678 CB GLU A 368 86.205 25.530 -7.284 1.00 0.00 C ATOM 679 CG GLU A 368 85.403 25.682 -5.990 1.00 0.00 C ATOM 680 CD GLU A 368 86.120 24.973 -4.847 1.00 0.00 C ATOM 681 OE1 GLU A 368 86.504 23.830 -5.032 1.00 0.00 O ATOM 682 OE2 GLU A 368 86.277 25.584 -3.802 1.00 0.00 O ATOM 0 H GLU A 368 83.974 25.017 -8.217 1.00 0.00 H new ATOM 0 HA GLU A 368 85.517 27.416 -8.059 1.00 0.00 H new ATOM 0 HB2 GLU A 368 86.233 24.483 -7.586 1.00 0.00 H new ATOM 0 HB3 GLU A 368 87.237 25.843 -7.124 1.00 0.00 H new ATOM 0 HG2 GLU A 368 85.277 26.738 -5.752 1.00 0.00 H new ATOM 0 HG3 GLU A 368 84.405 25.264 -6.120 1.00 0.00 H new ATOM 689 N ASN A 369 85.859 25.662 -10.682 1.00 0.00 N ATOM 690 CA ASN A 369 86.569 25.519 -11.947 1.00 0.00 C ATOM 691 C ASN A 369 87.935 24.876 -11.729 1.00 0.00 C ATOM 692 O ASN A 369 88.970 25.500 -11.964 1.00 0.00 O ATOM 693 CB ASN A 369 86.747 26.889 -12.605 1.00 0.00 C ATOM 694 CG ASN A 369 85.383 27.499 -12.914 1.00 0.00 C ATOM 695 OD1 ASN A 369 84.610 26.934 -13.688 1.00 0.00 O ATOM 696 ND2 ASN A 369 85.040 28.624 -12.352 1.00 0.00 N ATOM 0 H ASN A 369 84.929 25.243 -10.666 1.00 0.00 H new ATOM 0 HA ASN A 369 85.979 24.876 -12.600 1.00 0.00 H new ATOM 0 HB2 ASN A 369 87.309 27.549 -11.944 1.00 0.00 H new ATOM 0 HB3 ASN A 369 87.326 26.789 -13.523 1.00 0.00 H new ATOM 0 HD21 ASN A 369 84.130 29.038 -12.553 1.00 0.00 H new ATOM 0 HD22 ASN A 369 85.682 29.090 -11.711 1.00 0.00 H new ATOM 703 N LEU A 370 87.931 23.623 -11.284 1.00 0.00 N ATOM 704 CA LEU A 370 89.178 22.906 -11.045 1.00 0.00 C ATOM 705 C LEU A 370 89.992 22.831 -12.333 1.00 0.00 C ATOM 706 O LEU A 370 89.475 22.445 -13.382 1.00 0.00 O ATOM 707 CB LEU A 370 88.883 21.489 -10.539 1.00 0.00 C ATOM 708 CG LEU A 370 87.887 21.541 -9.372 1.00 0.00 C ATOM 709 CD1 LEU A 370 87.467 20.114 -8.997 1.00 0.00 C ATOM 710 CD2 LEU A 370 88.541 22.215 -8.158 1.00 0.00 C ATOM 0 H LEU A 370 87.086 23.088 -11.083 1.00 0.00 H new ATOM 0 HA LEU A 370 89.751 23.443 -10.289 1.00 0.00 H new ATOM 0 HB2 LEU A 370 88.475 20.883 -11.348 1.00 0.00 H new ATOM 0 HB3 LEU A 370 89.808 21.010 -10.217 1.00 0.00 H new ATOM 0 HG LEU A 370 87.011 22.115 -9.673 1.00 0.00 H new ATOM 0 HD11 LEU A 370 86.760 20.149 -8.168 1.00 0.00 H new ATOM 0 HD12 LEU A 370 86.996 19.636 -9.856 1.00 0.00 H new ATOM 0 HD13 LEU A 370 88.346 19.542 -8.700 1.00 0.00 H new ATOM 0 HD21 LEU A 370 87.829 22.249 -7.333 1.00 0.00 H new ATOM 0 HD22 LEU A 370 89.420 21.646 -7.856 1.00 0.00 H new ATOM 0 HD23 LEU A 370 88.839 23.230 -8.422 1.00 0.00 H new ATOM 722 N LYS A 371 91.266 23.205 -12.253 1.00 0.00 N ATOM 723 CA LYS A 371 92.136 23.178 -13.424 1.00 0.00 C ATOM 724 C LYS A 371 92.568 21.751 -13.741 1.00 0.00 C ATOM 725 O LYS A 371 91.790 20.810 -13.584 1.00 0.00 O ATOM 726 CB LYS A 371 93.375 24.043 -13.174 1.00 0.00 C ATOM 727 CG LYS A 371 92.950 25.398 -12.609 1.00 0.00 C ATOM 728 CD LYS A 371 94.192 26.248 -12.333 1.00 0.00 C ATOM 729 CE LYS A 371 93.776 27.700 -12.094 1.00 0.00 C ATOM 730 NZ LYS A 371 93.155 28.249 -13.332 1.00 0.00 N ATOM 0 H LYS A 371 91.716 23.528 -11.396 1.00 0.00 H new ATOM 0 HA LYS A 371 91.580 23.574 -14.274 1.00 0.00 H new ATOM 0 HB2 LYS A 371 94.046 23.541 -12.477 1.00 0.00 H new ATOM 0 HB3 LYS A 371 93.927 24.182 -14.103 1.00 0.00 H new ATOM 0 HG2 LYS A 371 92.296 25.909 -13.315 1.00 0.00 H new ATOM 0 HG3 LYS A 371 92.380 25.258 -11.690 1.00 0.00 H new ATOM 0 HD2 LYS A 371 94.723 25.863 -11.462 1.00 0.00 H new ATOM 0 HD3 LYS A 371 94.880 26.190 -13.177 1.00 0.00 H new ATOM 0 HE2 LYS A 371 93.070 27.756 -11.265 1.00 0.00 H new ATOM 0 HE3 LYS A 371 94.644 28.297 -11.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 93.560 29.185 -13.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 93.343 27.607 -14.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 92.128 28.339 -13.195 1.00 0.00 H new ATOM 744 N ASN A 372 93.814 21.600 -14.192 1.00 0.00 N ATOM 745 CA ASN A 372 94.353 20.282 -14.539 1.00 0.00 C ATOM 746 C ASN A 372 93.845 19.209 -13.579 1.00 0.00 C ATOM 747 O ASN A 372 94.287 19.124 -12.433 1.00 0.00 O ATOM 748 CB ASN A 372 95.881 20.322 -14.500 1.00 0.00 C ATOM 749 CG ASN A 372 96.357 20.768 -13.122 1.00 0.00 C ATOM 750 OD1 ASN A 372 96.097 21.899 -12.712 1.00 0.00 O ATOM 751 ND2 ASN A 372 97.044 19.943 -12.380 1.00 0.00 N ATOM 0 H ASN A 372 94.468 22.371 -14.326 1.00 0.00 H new ATOM 0 HA ASN A 372 94.016 20.031 -15.545 1.00 0.00 H new ATOM 0 HB2 ASN A 372 96.285 19.336 -14.732 1.00 0.00 H new ATOM 0 HB3 ASN A 372 96.254 21.006 -15.262 1.00 0.00 H new ATOM 0 HD21 ASN A 372 97.367 20.235 -11.458 1.00 0.00 H new ATOM 0 HD22 ASN A 372 97.258 19.006 -12.722 1.00 0.00 H new ATOM 758 N TYR A 373 92.907 18.399 -14.056 1.00 0.00 N ATOM 759 CA TYR A 373 92.333 17.337 -13.238 1.00 0.00 C ATOM 760 C TYR A 373 91.518 16.373 -14.101 1.00 0.00 C ATOM 761 O TYR A 373 91.276 16.633 -15.278 1.00 0.00 O ATOM 762 CB TYR A 373 91.460 17.947 -12.124 1.00 0.00 C ATOM 763 CG TYR A 373 90.059 18.266 -12.624 1.00 0.00 C ATOM 764 CD1 TYR A 373 89.857 18.793 -13.910 1.00 0.00 C ATOM 765 CD2 TYR A 373 88.960 18.036 -11.788 1.00 0.00 C ATOM 766 CE1 TYR A 373 88.561 19.085 -14.350 1.00 0.00 C ATOM 767 CE2 TYR A 373 87.665 18.329 -12.231 1.00 0.00 C ATOM 768 CZ TYR A 373 87.465 18.853 -13.512 1.00 0.00 C ATOM 769 OH TYR A 373 86.189 19.143 -13.949 1.00 0.00 O ATOM 0 H TYR A 373 92.529 18.457 -15.002 1.00 0.00 H new ATOM 0 HA TYR A 373 93.142 16.771 -12.777 1.00 0.00 H new ATOM 0 HB2 TYR A 373 91.399 17.252 -11.287 1.00 0.00 H new ATOM 0 HB3 TYR A 373 91.930 18.857 -11.750 1.00 0.00 H new ATOM 0 HD1 TYR A 373 90.701 18.973 -14.559 1.00 0.00 H new ATOM 0 HD2 TYR A 373 89.112 17.631 -10.798 1.00 0.00 H new ATOM 0 HE1 TYR A 373 88.407 19.490 -15.339 1.00 0.00 H new ATOM 0 HE2 TYR A 373 86.820 18.150 -11.583 1.00 0.00 H new ATOM 0 HH TYR A 373 85.544 18.922 -13.245 1.00 0.00 H new ATOM 779 N VAL A 374 91.104 15.254 -13.505 1.00 0.00 N ATOM 780 CA VAL A 374 90.321 14.248 -14.226 1.00 0.00 C ATOM 781 C VAL A 374 89.237 13.659 -13.329 1.00 0.00 C ATOM 782 O VAL A 374 89.477 13.370 -12.156 1.00 0.00 O ATOM 783 CB VAL A 374 91.245 13.131 -14.713 1.00 0.00 C ATOM 784 CG1 VAL A 374 91.780 12.343 -13.515 1.00 0.00 C ATOM 785 CG2 VAL A 374 90.468 12.190 -15.636 1.00 0.00 C ATOM 0 H VAL A 374 91.296 15.022 -12.531 1.00 0.00 H new ATOM 0 HA VAL A 374 89.842 14.729 -15.079 1.00 0.00 H new ATOM 0 HB VAL A 374 92.081 13.569 -15.259 1.00 0.00 H new ATOM 0 HG11 VAL A 374 92.438 11.548 -13.867 1.00 0.00 H new ATOM 0 HG12 VAL A 374 92.337 13.012 -12.859 1.00 0.00 H new ATOM 0 HG13 VAL A 374 90.946 11.907 -12.965 1.00 0.00 H new ATOM 0 HG21 VAL A 374 91.127 11.394 -15.983 1.00 0.00 H new ATOM 0 HG22 VAL A 374 89.630 11.755 -15.091 1.00 0.00 H new ATOM 0 HG23 VAL A 374 90.092 12.749 -16.493 1.00 0.00 H new ATOM 795 N VAL A 375 88.044 13.479 -13.893 1.00 0.00 N ATOM 796 CA VAL A 375 86.917 12.918 -13.146 1.00 0.00 C ATOM 797 C VAL A 375 86.779 11.426 -13.437 1.00 0.00 C ATOM 798 O VAL A 375 86.686 11.018 -14.594 1.00 0.00 O ATOM 799 CB VAL A 375 85.624 13.636 -13.545 1.00 0.00 C ATOM 800 CG1 VAL A 375 84.533 13.344 -12.512 1.00 0.00 C ATOM 801 CG2 VAL A 375 85.877 15.146 -13.608 1.00 0.00 C ATOM 0 H VAL A 375 87.832 13.713 -14.863 1.00 0.00 H new ATOM 0 HA VAL A 375 87.099 13.057 -12.080 1.00 0.00 H new ATOM 0 HB VAL A 375 85.300 13.280 -14.523 1.00 0.00 H new ATOM 0 HG11 VAL A 375 83.614 13.856 -12.798 1.00 0.00 H new ATOM 0 HG12 VAL A 375 84.351 12.270 -12.468 1.00 0.00 H new ATOM 0 HG13 VAL A 375 84.855 13.698 -11.533 1.00 0.00 H new ATOM 0 HG21 VAL A 375 84.957 15.657 -13.892 1.00 0.00 H new ATOM 0 HG22 VAL A 375 86.203 15.501 -12.630 1.00 0.00 H new ATOM 0 HG23 VAL A 375 86.651 15.355 -14.347 1.00 0.00 H new ATOM 811 N TYR A 376 86.765 10.615 -12.380 1.00 0.00 N ATOM 812 CA TYR A 376 86.635 9.167 -12.539 1.00 0.00 C ATOM 813 C TYR A 376 85.977 8.552 -11.305 1.00 0.00 C ATOM 814 O TYR A 376 85.682 9.250 -10.339 1.00 0.00 O ATOM 815 CB TYR A 376 88.019 8.541 -12.773 1.00 0.00 C ATOM 816 CG TYR A 376 88.777 8.436 -11.464 1.00 0.00 C ATOM 817 CD1 TYR A 376 89.136 9.597 -10.768 1.00 0.00 C ATOM 818 CD2 TYR A 376 89.115 7.178 -10.946 1.00 0.00 C ATOM 819 CE1 TYR A 376 89.834 9.500 -9.557 1.00 0.00 C ATOM 820 CE2 TYR A 376 89.810 7.081 -9.736 1.00 0.00 C ATOM 821 CZ TYR A 376 90.171 8.242 -9.042 1.00 0.00 C ATOM 822 OH TYR A 376 90.857 8.147 -7.848 1.00 0.00 O ATOM 0 H TYR A 376 86.841 10.932 -11.413 1.00 0.00 H new ATOM 0 HA TYR A 376 86.003 8.963 -13.403 1.00 0.00 H new ATOM 0 HB2 TYR A 376 87.908 7.552 -13.217 1.00 0.00 H new ATOM 0 HB3 TYR A 376 88.585 9.147 -13.481 1.00 0.00 H new ATOM 0 HD1 TYR A 376 88.875 10.567 -11.165 1.00 0.00 H new ATOM 0 HD2 TYR A 376 88.838 6.282 -11.482 1.00 0.00 H new ATOM 0 HE1 TYR A 376 90.112 10.395 -9.021 1.00 0.00 H new ATOM 0 HE2 TYR A 376 90.068 6.111 -9.337 1.00 0.00 H new ATOM 0 HH TYR A 376 91.010 7.203 -7.633 1.00 0.00 H new ATOM 832 N GLU A 377 85.753 7.239 -11.348 1.00 0.00 N ATOM 833 CA GLU A 377 85.126 6.531 -10.228 1.00 0.00 C ATOM 834 C GLU A 377 86.175 5.820 -9.376 1.00 0.00 C ATOM 835 O GLU A 377 87.285 5.546 -9.833 1.00 0.00 O ATOM 836 CB GLU A 377 84.125 5.503 -10.763 1.00 0.00 C ATOM 837 CG GLU A 377 83.551 4.693 -9.598 1.00 0.00 C ATOM 838 CD GLU A 377 82.313 3.927 -10.055 1.00 0.00 C ATOM 839 OE1 GLU A 377 81.425 4.551 -10.611 1.00 0.00 O ATOM 840 OE2 GLU A 377 82.273 2.726 -9.842 1.00 0.00 O ATOM 0 H GLU A 377 85.994 6.645 -12.141 1.00 0.00 H new ATOM 0 HA GLU A 377 84.610 7.263 -9.606 1.00 0.00 H new ATOM 0 HB2 GLU A 377 83.321 6.008 -11.299 1.00 0.00 H new ATOM 0 HB3 GLU A 377 84.615 4.839 -11.475 1.00 0.00 H new ATOM 0 HG2 GLU A 377 84.302 3.997 -9.223 1.00 0.00 H new ATOM 0 HG3 GLU A 377 83.294 5.358 -8.774 1.00 0.00 H new ATOM 847 N THR A 378 85.805 5.520 -8.134 1.00 0.00 N ATOM 848 CA THR A 378 86.703 4.833 -7.212 1.00 0.00 C ATOM 849 C THR A 378 85.903 4.235 -6.055 1.00 0.00 C ATOM 850 O THR A 378 84.676 4.148 -6.122 1.00 0.00 O ATOM 851 CB THR A 378 87.773 5.809 -6.685 1.00 0.00 C ATOM 852 OG1 THR A 378 88.903 5.068 -6.245 1.00 0.00 O ATOM 853 CG2 THR A 378 87.227 6.642 -5.515 1.00 0.00 C ATOM 0 H THR A 378 84.889 5.742 -7.743 1.00 0.00 H new ATOM 0 HA THR A 378 87.207 4.025 -7.741 1.00 0.00 H new ATOM 0 HB THR A 378 88.054 6.486 -7.491 1.00 0.00 H new ATOM 0 HG1 THR A 378 89.588 5.684 -5.910 1.00 0.00 H new ATOM 0 HG21 THR A 378 88.001 7.323 -5.161 1.00 0.00 H new ATOM 0 HG22 THR A 378 86.363 7.217 -5.849 1.00 0.00 H new ATOM 0 HG23 THR A 378 86.929 5.978 -4.704 1.00 0.00 H new ATOM 861 N THR A 379 86.599 3.834 -4.992 1.00 0.00 N ATOM 862 CA THR A 379 85.941 3.253 -3.818 1.00 0.00 C ATOM 863 C THR A 379 86.087 4.177 -2.613 1.00 0.00 C ATOM 864 O THR A 379 87.071 4.906 -2.492 1.00 0.00 O ATOM 865 CB THR A 379 86.562 1.894 -3.491 1.00 0.00 C ATOM 866 OG1 THR A 379 87.915 2.075 -3.099 1.00 0.00 O ATOM 867 CG2 THR A 379 86.501 0.991 -4.724 1.00 0.00 C ATOM 0 H THR A 379 87.614 3.899 -4.917 1.00 0.00 H new ATOM 0 HA THR A 379 84.882 3.127 -4.044 1.00 0.00 H new ATOM 0 HB THR A 379 86.007 1.428 -2.677 1.00 0.00 H new ATOM 0 HG1 THR A 379 88.313 1.205 -2.888 1.00 0.00 H new ATOM 0 HG21 THR A 379 86.944 0.023 -4.489 1.00 0.00 H new ATOM 0 HG22 THR A 379 85.462 0.852 -5.022 1.00 0.00 H new ATOM 0 HG23 THR A 379 87.054 1.454 -5.542 1.00 0.00 H new ATOM 875 N ARG A 380 85.100 4.135 -1.725 1.00 0.00 N ATOM 876 CA ARG A 380 85.124 4.970 -0.530 1.00 0.00 C ATOM 877 C ARG A 380 84.117 4.456 0.495 1.00 0.00 C ATOM 878 O ARG A 380 82.947 4.839 0.475 1.00 0.00 O ATOM 879 CB ARG A 380 84.790 6.417 -0.894 1.00 0.00 C ATOM 880 CG ARG A 380 85.108 7.325 0.295 1.00 0.00 C ATOM 881 CD ARG A 380 84.850 8.782 -0.088 1.00 0.00 C ATOM 882 NE ARG A 380 85.381 9.674 0.935 1.00 0.00 N ATOM 883 CZ ARG A 380 84.725 9.886 2.071 1.00 0.00 C ATOM 884 NH1 ARG A 380 83.582 9.294 2.284 1.00 0.00 N ATOM 885 NH2 ARG A 380 85.223 10.686 2.973 1.00 0.00 N ATOM 0 H ARG A 380 84.279 3.536 -1.809 1.00 0.00 H new ATOM 0 HA ARG A 380 86.124 4.929 -0.099 1.00 0.00 H new ATOM 0 HB2 ARG A 380 85.365 6.726 -1.766 1.00 0.00 H new ATOM 0 HB3 ARG A 380 83.736 6.503 -1.160 1.00 0.00 H new ATOM 0 HG2 ARG A 380 84.492 7.049 1.151 1.00 0.00 H new ATOM 0 HG3 ARG A 380 86.148 7.196 0.596 1.00 0.00 H new ATOM 0 HD2 ARG A 380 85.316 9.001 -1.049 1.00 0.00 H new ATOM 0 HD3 ARG A 380 83.780 8.950 -0.207 1.00 0.00 H new ATOM 0 HE ARG A 380 86.272 10.144 0.776 1.00 0.00 H new ATOM 0 HH11 ARG A 380 83.192 8.669 1.579 1.00 0.00 H new ATOM 0 HH12 ARG A 380 83.078 9.456 3.156 1.00 0.00 H new ATOM 0 HH21 ARG A 380 86.116 11.149 2.806 1.00 0.00 H new ATOM 0 HH22 ARG A 380 84.719 10.848 3.845 1.00 0.00 H new ATOM 899 N ASN A 381 84.577 3.584 1.388 1.00 0.00 N ATOM 900 CA ASN A 381 83.703 3.024 2.412 1.00 0.00 C ATOM 901 C ASN A 381 82.511 2.322 1.769 1.00 0.00 C ATOM 902 O ASN A 381 81.381 2.803 1.846 1.00 0.00 O ATOM 903 CB ASN A 381 83.203 4.133 3.339 1.00 0.00 C ATOM 904 CG ASN A 381 84.375 4.984 3.813 1.00 0.00 C ATOM 905 OD1 ASN A 381 85.415 5.032 3.155 1.00 0.00 O ATOM 906 ND2 ASN A 381 84.271 5.663 4.923 1.00 0.00 N ATOM 0 H ASN A 381 85.541 3.253 1.423 1.00 0.00 H new ATOM 0 HA ASN A 381 84.273 2.298 2.992 1.00 0.00 H new ATOM 0 HB2 ASN A 381 82.478 4.757 2.816 1.00 0.00 H new ATOM 0 HB3 ASN A 381 82.689 3.698 4.196 1.00 0.00 H new ATOM 0 HD21 ASN A 381 85.052 6.234 5.246 1.00 0.00 H new ATOM 0 HD22 ASN A 381 83.409 5.622 5.467 1.00 0.00 H new ATOM 913 N GLY A 382 82.776 1.177 1.139 1.00 0.00 N ATOM 914 CA GLY A 382 81.725 0.399 0.479 1.00 0.00 C ATOM 915 C GLY A 382 80.680 1.309 -0.165 1.00 0.00 C ATOM 916 O GLY A 382 79.490 0.995 -0.177 1.00 0.00 O ATOM 0 H GLY A 382 83.708 0.768 1.071 1.00 0.00 H new ATOM 0 HA2 GLY A 382 82.169 -0.243 -0.282 1.00 0.00 H new ATOM 0 HA3 GLY A 382 81.243 -0.254 1.206 1.00 0.00 H new ATOM 920 N GLN A 383 81.139 2.442 -0.693 1.00 0.00 N ATOM 921 CA GLN A 383 80.245 3.405 -1.332 1.00 0.00 C ATOM 922 C GLN A 383 80.986 4.169 -2.434 1.00 0.00 C ATOM 923 O GLN A 383 81.587 5.209 -2.167 1.00 0.00 O ATOM 924 CB GLN A 383 79.736 4.400 -0.287 1.00 0.00 C ATOM 925 CG GLN A 383 78.582 5.215 -0.874 1.00 0.00 C ATOM 926 CD GLN A 383 77.345 4.335 -1.023 1.00 0.00 C ATOM 927 OE1 GLN A 383 76.673 4.036 -0.036 1.00 0.00 O ATOM 928 NE2 GLN A 383 77.004 3.900 -2.205 1.00 0.00 N ATOM 0 H GLN A 383 82.122 2.715 -0.691 1.00 0.00 H new ATOM 0 HA GLN A 383 79.406 2.866 -1.773 1.00 0.00 H new ATOM 0 HB2 GLN A 383 79.403 3.868 0.604 1.00 0.00 H new ATOM 0 HB3 GLN A 383 80.544 5.064 0.021 1.00 0.00 H new ATOM 0 HG2 GLN A 383 78.359 6.063 -0.227 1.00 0.00 H new ATOM 0 HG3 GLN A 383 78.869 5.621 -1.844 1.00 0.00 H new ATOM 0 HE21 GLN A 383 77.563 4.149 -3.021 1.00 0.00 H new ATOM 0 HE22 GLN A 383 76.179 3.311 -2.313 1.00 0.00 H new ATOM 937 N PRO A 384 80.969 3.683 -3.656 1.00 0.00 N ATOM 938 CA PRO A 384 81.673 4.357 -4.787 1.00 0.00 C ATOM 939 C PRO A 384 81.470 5.870 -4.782 1.00 0.00 C ATOM 940 O PRO A 384 80.422 6.367 -4.369 1.00 0.00 O ATOM 941 CB PRO A 384 81.049 3.706 -6.024 1.00 0.00 C ATOM 942 CG PRO A 384 80.695 2.325 -5.578 1.00 0.00 C ATOM 943 CD PRO A 384 80.286 2.452 -4.105 1.00 0.00 C ATOM 0 HA PRO A 384 82.755 4.235 -4.736 1.00 0.00 H new ATOM 0 HB2 PRO A 384 80.168 4.253 -6.359 1.00 0.00 H new ATOM 0 HB3 PRO A 384 81.749 3.687 -6.859 1.00 0.00 H new ATOM 0 HG2 PRO A 384 79.880 1.918 -6.176 1.00 0.00 H new ATOM 0 HG3 PRO A 384 81.542 1.649 -5.691 1.00 0.00 H new ATOM 0 HD2 PRO A 384 79.204 2.532 -3.995 1.00 0.00 H new ATOM 0 HD3 PRO A 384 80.602 1.585 -3.526 1.00 0.00 H new ATOM 951 N TRP A 385 82.487 6.594 -5.238 1.00 0.00 N ATOM 952 CA TRP A 385 82.431 8.051 -5.280 1.00 0.00 C ATOM 953 C TRP A 385 83.415 8.570 -6.332 1.00 0.00 C ATOM 954 O TRP A 385 84.355 7.875 -6.709 1.00 0.00 O ATOM 955 CB TRP A 385 82.755 8.612 -3.871 1.00 0.00 C ATOM 956 CG TRP A 385 83.542 9.891 -3.947 1.00 0.00 C ATOM 957 CD1 TRP A 385 84.874 9.989 -3.736 1.00 0.00 C ATOM 958 CD2 TRP A 385 83.075 11.241 -4.248 1.00 0.00 C ATOM 959 NE1 TRP A 385 85.256 11.311 -3.887 1.00 0.00 N ATOM 960 CE2 TRP A 385 84.184 12.122 -4.203 1.00 0.00 C ATOM 961 CE3 TRP A 385 81.813 11.780 -4.553 1.00 0.00 C ATOM 962 CZ2 TRP A 385 84.041 13.491 -4.450 1.00 0.00 C ATOM 963 CZ3 TRP A 385 81.669 13.156 -4.803 1.00 0.00 C ATOM 964 CH2 TRP A 385 82.783 14.007 -4.751 1.00 0.00 C ATOM 0 H TRP A 385 83.360 6.196 -5.584 1.00 0.00 H new ATOM 0 HA TRP A 385 81.432 8.386 -5.561 1.00 0.00 H new ATOM 0 HB2 TRP A 385 81.827 8.788 -3.328 1.00 0.00 H new ATOM 0 HB3 TRP A 385 83.320 7.871 -3.306 1.00 0.00 H new ATOM 0 HD1 TRP A 385 85.533 9.169 -3.490 1.00 0.00 H new ATOM 0 HE1 TRP A 385 86.213 11.646 -3.778 1.00 0.00 H new ATOM 0 HE3 TRP A 385 80.949 11.133 -4.596 1.00 0.00 H new ATOM 0 HZ2 TRP A 385 84.900 14.144 -4.408 1.00 0.00 H new ATOM 0 HZ3 TRP A 385 80.695 13.560 -5.036 1.00 0.00 H new ATOM 0 HH2 TRP A 385 82.665 15.063 -4.945 1.00 0.00 H new ATOM 975 N TYR A 386 83.185 9.794 -6.802 1.00 0.00 N ATOM 976 CA TYR A 386 84.056 10.399 -7.811 1.00 0.00 C ATOM 977 C TYR A 386 85.034 11.373 -7.161 1.00 0.00 C ATOM 978 O TYR A 386 84.750 12.566 -7.042 1.00 0.00 O ATOM 979 CB TYR A 386 83.211 11.134 -8.851 1.00 0.00 C ATOM 980 CG TYR A 386 82.427 10.130 -9.664 1.00 0.00 C ATOM 981 CD1 TYR A 386 81.256 9.569 -9.140 1.00 0.00 C ATOM 982 CD2 TYR A 386 82.872 9.757 -10.938 1.00 0.00 C ATOM 983 CE1 TYR A 386 80.530 8.637 -9.889 1.00 0.00 C ATOM 984 CE2 TYR A 386 82.145 8.825 -11.689 1.00 0.00 C ATOM 985 CZ TYR A 386 80.974 8.264 -11.164 1.00 0.00 C ATOM 986 OH TYR A 386 80.258 7.345 -11.903 1.00 0.00 O ATOM 0 H TYR A 386 82.409 10.384 -6.504 1.00 0.00 H new ATOM 0 HA TYR A 386 84.624 9.607 -8.299 1.00 0.00 H new ATOM 0 HB2 TYR A 386 82.531 11.829 -8.358 1.00 0.00 H new ATOM 0 HB3 TYR A 386 83.852 11.725 -9.504 1.00 0.00 H new ATOM 0 HD1 TYR A 386 80.913 9.856 -8.157 1.00 0.00 H new ATOM 0 HD2 TYR A 386 83.776 10.188 -11.342 1.00 0.00 H new ATOM 0 HE1 TYR A 386 79.627 8.205 -9.484 1.00 0.00 H new ATOM 0 HE2 TYR A 386 82.487 8.539 -12.673 1.00 0.00 H new ATOM 0 HH TYR A 386 80.481 6.439 -11.603 1.00 0.00 H new ATOM 996 N VAL A 387 86.190 10.856 -6.747 1.00 0.00 N ATOM 997 CA VAL A 387 87.212 11.685 -6.115 1.00 0.00 C ATOM 998 C VAL A 387 88.108 12.311 -7.177 1.00 0.00 C ATOM 999 O VAL A 387 88.336 11.721 -8.233 1.00 0.00 O ATOM 1000 CB VAL A 387 88.050 10.840 -5.143 1.00 0.00 C ATOM 1001 CG1 VAL A 387 89.003 9.923 -5.918 1.00 0.00 C ATOM 1002 CG2 VAL A 387 88.866 11.763 -4.235 1.00 0.00 C ATOM 0 H VAL A 387 86.440 9.871 -6.838 1.00 0.00 H new ATOM 0 HA VAL A 387 86.724 12.482 -5.554 1.00 0.00 H new ATOM 0 HB VAL A 387 87.378 10.228 -4.542 1.00 0.00 H new ATOM 0 HG11 VAL A 387 89.590 9.331 -5.216 1.00 0.00 H new ATOM 0 HG12 VAL A 387 88.426 9.258 -6.560 1.00 0.00 H new ATOM 0 HG13 VAL A 387 89.672 10.528 -6.530 1.00 0.00 H new ATOM 0 HG21 VAL A 387 89.460 11.163 -3.546 1.00 0.00 H new ATOM 0 HG22 VAL A 387 89.528 12.379 -4.843 1.00 0.00 H new ATOM 0 HG23 VAL A 387 88.192 12.405 -3.668 1.00 0.00 H new ATOM 1012 N LEU A 388 88.602 13.512 -6.896 1.00 0.00 N ATOM 1013 CA LEU A 388 89.468 14.226 -7.838 1.00 0.00 C ATOM 1014 C LEU A 388 90.878 14.368 -7.275 1.00 0.00 C ATOM 1015 O LEU A 388 91.079 14.358 -6.061 1.00 0.00 O ATOM 1016 CB LEU A 388 88.880 15.609 -8.115 1.00 0.00 C ATOM 1017 CG LEU A 388 87.425 15.474 -8.584 1.00 0.00 C ATOM 1018 CD1 LEU A 388 86.778 16.860 -8.633 1.00 0.00 C ATOM 1019 CD2 LEU A 388 87.377 14.834 -9.981 1.00 0.00 C ATOM 0 H LEU A 388 88.420 14.014 -6.027 1.00 0.00 H new ATOM 0 HA LEU A 388 89.525 13.656 -8.765 1.00 0.00 H new ATOM 0 HB2 LEU A 388 88.925 16.220 -7.214 1.00 0.00 H new ATOM 0 HB3 LEU A 388 89.471 16.119 -8.876 1.00 0.00 H new ATOM 0 HG LEU A 388 86.881 14.839 -7.885 1.00 0.00 H new ATOM 0 HD11 LEU A 388 85.744 16.767 -8.966 1.00 0.00 H new ATOM 0 HD12 LEU A 388 86.801 17.307 -7.639 1.00 0.00 H new ATOM 0 HD13 LEU A 388 87.328 17.494 -9.329 1.00 0.00 H new ATOM 0 HD21 LEU A 388 86.340 14.743 -10.304 1.00 0.00 H new ATOM 0 HD22 LEU A 388 87.923 15.460 -10.687 1.00 0.00 H new ATOM 0 HD23 LEU A 388 87.834 13.845 -9.944 1.00 0.00 H new ATOM 1031 N VAL A 389 91.852 14.492 -8.175 1.00 0.00 N ATOM 1032 CA VAL A 389 93.253 14.626 -7.774 1.00 0.00 C ATOM 1033 C VAL A 389 94.003 15.566 -8.715 1.00 0.00 C ATOM 1034 O VAL A 389 93.396 16.351 -9.444 1.00 0.00 O ATOM 1035 CB VAL A 389 93.928 13.253 -7.784 1.00 0.00 C ATOM 1036 CG1 VAL A 389 93.103 12.271 -6.950 1.00 0.00 C ATOM 1037 CG2 VAL A 389 94.025 12.741 -9.224 1.00 0.00 C ATOM 0 H VAL A 389 91.699 14.503 -9.183 1.00 0.00 H new ATOM 0 HA VAL A 389 93.281 15.045 -6.768 1.00 0.00 H new ATOM 0 HB VAL A 389 94.928 13.339 -7.360 1.00 0.00 H new ATOM 0 HG11 VAL A 389 93.585 11.293 -6.958 1.00 0.00 H new ATOM 0 HG12 VAL A 389 93.034 12.633 -5.924 1.00 0.00 H new ATOM 0 HG13 VAL A 389 92.102 12.186 -7.373 1.00 0.00 H new ATOM 0 HG21 VAL A 389 94.506 11.763 -9.231 1.00 0.00 H new ATOM 0 HG22 VAL A 389 93.025 12.656 -9.648 1.00 0.00 H new ATOM 0 HG23 VAL A 389 94.614 13.439 -9.819 1.00 0.00 H new ATOM 1047 N SER A 390 95.329 15.473 -8.688 1.00 0.00 N ATOM 1048 CA SER A 390 96.176 16.311 -9.535 1.00 0.00 C ATOM 1049 C SER A 390 97.451 15.566 -9.920 1.00 0.00 C ATOM 1050 O SER A 390 98.360 15.408 -9.105 1.00 0.00 O ATOM 1051 CB SER A 390 96.542 17.598 -8.798 1.00 0.00 C ATOM 1052 OG SER A 390 97.195 18.485 -9.696 1.00 0.00 O ATOM 0 H SER A 390 95.842 14.826 -8.089 1.00 0.00 H new ATOM 0 HA SER A 390 95.621 16.556 -10.441 1.00 0.00 H new ATOM 0 HB2 SER A 390 95.645 18.067 -8.394 1.00 0.00 H new ATOM 0 HB3 SER A 390 97.193 17.374 -7.953 1.00 0.00 H new ATOM 0 HG SER A 390 97.430 19.312 -9.226 1.00 0.00 H new ATOM 1058 N GLY A 391 97.509 15.110 -11.167 1.00 0.00 N ATOM 1059 CA GLY A 391 98.676 14.384 -11.650 1.00 0.00 C ATOM 1060 C GLY A 391 99.059 13.264 -10.690 1.00 0.00 C ATOM 1061 O GLY A 391 98.202 12.524 -10.208 1.00 0.00 O ATOM 0 H GLY A 391 96.767 15.230 -11.856 1.00 0.00 H new ATOM 0 HA2 GLY A 391 98.467 13.968 -12.635 1.00 0.00 H new ATOM 0 HA3 GLY A 391 99.514 15.071 -11.765 1.00 0.00 H new ATOM 1065 N VAL A 392 100.357 13.146 -10.415 1.00 0.00 N ATOM 1066 CA VAL A 392 100.855 12.112 -9.509 1.00 0.00 C ATOM 1067 C VAL A 392 102.149 12.566 -8.842 1.00 0.00 C ATOM 1068 O VAL A 392 103.177 12.722 -9.499 1.00 0.00 O ATOM 1069 CB VAL A 392 101.109 10.814 -10.282 1.00 0.00 C ATOM 1070 CG1 VAL A 392 101.720 9.771 -9.343 1.00 0.00 C ATOM 1071 CG2 VAL A 392 99.787 10.283 -10.841 1.00 0.00 C ATOM 0 H VAL A 392 101.080 13.751 -10.805 1.00 0.00 H new ATOM 0 HA VAL A 392 100.102 11.936 -8.741 1.00 0.00 H new ATOM 0 HB VAL A 392 101.797 11.012 -11.104 1.00 0.00 H new ATOM 0 HG11 VAL A 392 101.901 8.848 -9.893 1.00 0.00 H new ATOM 0 HG12 VAL A 392 102.663 10.147 -8.946 1.00 0.00 H new ATOM 0 HG13 VAL A 392 101.032 9.575 -8.520 1.00 0.00 H new ATOM 0 HG21 VAL A 392 99.969 9.360 -11.391 1.00 0.00 H new ATOM 0 HG22 VAL A 392 99.098 10.087 -10.020 1.00 0.00 H new ATOM 0 HG23 VAL A 392 99.351 11.024 -11.511 1.00 0.00 H new ATOM 1081 N TYR A 393 102.089 12.775 -7.531 1.00 0.00 N ATOM 1082 CA TYR A 393 103.263 13.210 -6.782 1.00 0.00 C ATOM 1083 C TYR A 393 104.243 12.054 -6.606 1.00 0.00 C ATOM 1084 O TYR A 393 103.846 10.934 -6.285 1.00 0.00 O ATOM 1085 CB TYR A 393 102.844 13.740 -5.410 1.00 0.00 C ATOM 1086 CG TYR A 393 101.718 14.738 -5.576 1.00 0.00 C ATOM 1087 CD1 TYR A 393 101.925 15.909 -6.314 1.00 0.00 C ATOM 1088 CD2 TYR A 393 100.466 14.493 -4.993 1.00 0.00 C ATOM 1089 CE1 TYR A 393 100.886 16.833 -6.471 1.00 0.00 C ATOM 1090 CE2 TYR A 393 99.427 15.417 -5.150 1.00 0.00 C ATOM 1091 CZ TYR A 393 99.637 16.587 -5.889 1.00 0.00 C ATOM 1092 OH TYR A 393 98.612 17.499 -6.043 1.00 0.00 O ATOM 0 H TYR A 393 101.247 12.652 -6.968 1.00 0.00 H new ATOM 0 HA TYR A 393 103.753 14.006 -7.342 1.00 0.00 H new ATOM 0 HB2 TYR A 393 102.523 12.916 -4.773 1.00 0.00 H new ATOM 0 HB3 TYR A 393 103.693 14.213 -4.916 1.00 0.00 H new ATOM 0 HD1 TYR A 393 102.888 16.100 -6.763 1.00 0.00 H new ATOM 0 HD2 TYR A 393 100.304 13.590 -4.422 1.00 0.00 H new ATOM 0 HE1 TYR A 393 101.048 17.736 -7.041 1.00 0.00 H new ATOM 0 HE2 TYR A 393 98.463 15.227 -4.701 1.00 0.00 H new ATOM 0 HH TYR A 393 97.813 17.175 -5.577 1.00 0.00 H new ATOM 1102 N ALA A 394 105.525 12.335 -6.820 1.00 0.00 N ATOM 1103 CA ALA A 394 106.559 11.312 -6.683 1.00 0.00 C ATOM 1104 C ALA A 394 106.970 11.157 -5.222 1.00 0.00 C ATOM 1105 O ALA A 394 107.537 10.137 -4.832 1.00 0.00 O ATOM 1106 CB ALA A 394 107.782 11.693 -7.519 1.00 0.00 C ATOM 0 H ALA A 394 105.872 13.256 -7.087 1.00 0.00 H new ATOM 0 HA ALA A 394 106.155 10.364 -7.038 1.00 0.00 H new ATOM 0 HB1 ALA A 394 108.549 10.926 -7.412 1.00 0.00 H new ATOM 0 HB2 ALA A 394 107.495 11.776 -8.567 1.00 0.00 H new ATOM 0 HB3 ALA A 394 108.175 12.649 -7.174 1.00 0.00 H new ATOM 1112 N SER A 395 106.678 12.178 -4.419 1.00 0.00 N ATOM 1113 CA SER A 395 107.018 12.150 -2.999 1.00 0.00 C ATOM 1114 C SER A 395 106.036 13.006 -2.203 1.00 0.00 C ATOM 1115 O SER A 395 105.445 13.946 -2.733 1.00 0.00 O ATOM 1116 CB SER A 395 108.444 12.670 -2.795 1.00 0.00 C ATOM 1117 OG SER A 395 108.638 13.832 -3.590 1.00 0.00 O ATOM 0 H SER A 395 106.209 13.030 -4.726 1.00 0.00 H new ATOM 0 HA SER A 395 106.956 11.121 -2.644 1.00 0.00 H new ATOM 0 HB2 SER A 395 108.612 12.903 -1.743 1.00 0.00 H new ATOM 0 HB3 SER A 395 109.167 11.902 -3.071 1.00 0.00 H new ATOM 0 HG SER A 395 109.598 13.984 -3.718 1.00 0.00 H new ATOM 1123 N LYS A 396 105.864 12.669 -0.929 1.00 0.00 N ATOM 1124 CA LYS A 396 104.948 13.411 -0.070 1.00 0.00 C ATOM 1125 C LYS A 396 105.344 14.882 -0.004 1.00 0.00 C ATOM 1126 O LYS A 396 104.526 15.742 0.325 1.00 0.00 O ATOM 1127 CB LYS A 396 104.957 12.810 1.340 1.00 0.00 C ATOM 1128 CG LYS A 396 103.719 13.279 2.112 1.00 0.00 C ATOM 1129 CD LYS A 396 103.911 13.010 3.608 1.00 0.00 C ATOM 1130 CE LYS A 396 104.074 11.506 3.852 1.00 0.00 C ATOM 1131 NZ LYS A 396 105.472 11.100 3.536 1.00 0.00 N ATOM 0 H LYS A 396 106.343 11.893 -0.471 1.00 0.00 H new ATOM 0 HA LYS A 396 103.945 13.339 -0.490 1.00 0.00 H new ATOM 0 HB2 LYS A 396 104.970 11.722 1.281 1.00 0.00 H new ATOM 0 HB3 LYS A 396 105.862 13.111 1.868 1.00 0.00 H new ATOM 0 HG2 LYS A 396 103.554 14.343 1.942 1.00 0.00 H new ATOM 0 HG3 LYS A 396 102.833 12.757 1.750 1.00 0.00 H new ATOM 0 HD2 LYS A 396 104.789 13.543 3.972 1.00 0.00 H new ATOM 0 HD3 LYS A 396 103.054 13.387 4.167 1.00 0.00 H new ATOM 0 HE2 LYS A 396 103.841 11.268 4.890 1.00 0.00 H new ATOM 0 HE3 LYS A 396 103.373 10.948 3.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 396 105.492 10.608 2.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 396 106.077 11.945 3.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 396 105.825 10.463 4.279 1.00 0.00 H new ATOM 1145 N GLU A 397 106.603 15.167 -0.319 1.00 0.00 N ATOM 1146 CA GLU A 397 107.097 16.538 -0.289 1.00 0.00 C ATOM 1147 C GLU A 397 106.155 17.470 -1.050 1.00 0.00 C ATOM 1148 O GLU A 397 105.903 18.597 -0.622 1.00 0.00 O ATOM 1149 CB GLU A 397 108.508 16.598 -0.893 1.00 0.00 C ATOM 1150 CG GLU A 397 108.445 16.462 -2.425 1.00 0.00 C ATOM 1151 CD GLU A 397 108.180 17.819 -3.078 1.00 0.00 C ATOM 1152 OE1 GLU A 397 108.000 18.783 -2.352 1.00 0.00 O ATOM 1153 OE2 GLU A 397 108.164 17.872 -4.296 1.00 0.00 O ATOM 0 H GLU A 397 107.296 14.472 -0.596 1.00 0.00 H new ATOM 0 HA GLU A 397 107.139 16.870 0.748 1.00 0.00 H new ATOM 0 HB2 GLU A 397 108.985 17.541 -0.625 1.00 0.00 H new ATOM 0 HB3 GLU A 397 109.123 15.800 -0.476 1.00 0.00 H new ATOM 0 HG2 GLU A 397 109.383 16.051 -2.797 1.00 0.00 H new ATOM 0 HG3 GLU A 397 107.658 15.760 -2.701 1.00 0.00 H new ATOM 1160 N GLU A 398 105.638 16.993 -2.181 1.00 0.00 N ATOM 1161 CA GLU A 398 104.726 17.793 -2.998 1.00 0.00 C ATOM 1162 C GLU A 398 103.280 17.584 -2.555 1.00 0.00 C ATOM 1163 O GLU A 398 102.475 18.515 -2.577 1.00 0.00 O ATOM 1164 CB GLU A 398 104.866 17.398 -4.470 1.00 0.00 C ATOM 1165 CG GLU A 398 104.197 18.455 -5.351 1.00 0.00 C ATOM 1166 CD GLU A 398 105.045 19.723 -5.378 1.00 0.00 C ATOM 1167 OE1 GLU A 398 106.157 19.657 -5.876 1.00 0.00 O ATOM 1168 OE2 GLU A 398 104.568 20.740 -4.903 1.00 0.00 O ATOM 0 H GLU A 398 105.833 16.063 -2.551 1.00 0.00 H new ATOM 0 HA GLU A 398 104.985 18.844 -2.872 1.00 0.00 H new ATOM 0 HB2 GLU A 398 105.920 17.305 -4.733 1.00 0.00 H new ATOM 0 HB3 GLU A 398 104.407 16.424 -4.641 1.00 0.00 H new ATOM 0 HG2 GLU A 398 104.071 18.070 -6.363 1.00 0.00 H new ATOM 0 HG3 GLU A 398 103.201 18.681 -4.970 1.00 0.00 H new ATOM 1175 N ALA A 399 102.958 16.358 -2.156 1.00 0.00 N ATOM 1176 CA ALA A 399 101.605 16.041 -1.713 1.00 0.00 C ATOM 1177 C ALA A 399 101.126 17.050 -0.675 1.00 0.00 C ATOM 1178 O ALA A 399 100.255 17.875 -0.952 1.00 0.00 O ATOM 1179 CB ALA A 399 101.566 14.633 -1.116 1.00 0.00 C ATOM 0 H ALA A 399 103.609 15.573 -2.130 1.00 0.00 H new ATOM 0 HA ALA A 399 100.943 16.088 -2.577 1.00 0.00 H new ATOM 0 HB1 ALA A 399 100.552 14.405 -0.788 1.00 0.00 H new ATOM 0 HB2 ALA A 399 101.875 13.909 -1.870 1.00 0.00 H new ATOM 0 HB3 ALA A 399 102.244 14.580 -0.264 1.00 0.00 H new ATOM 1185 N LYS A 400 101.698 16.978 0.522 1.00 0.00 N ATOM 1186 CA LYS A 400 101.319 17.891 1.595 1.00 0.00 C ATOM 1187 C LYS A 400 101.358 19.336 1.108 1.00 0.00 C ATOM 1188 O LYS A 400 100.465 20.128 1.411 1.00 0.00 O ATOM 1189 CB LYS A 400 102.270 17.723 2.782 1.00 0.00 C ATOM 1190 CG LYS A 400 103.670 18.201 2.389 1.00 0.00 C ATOM 1191 CD LYS A 400 104.687 17.712 3.423 1.00 0.00 C ATOM 1192 CE LYS A 400 106.005 18.470 3.243 1.00 0.00 C ATOM 1193 NZ LYS A 400 107.089 17.763 3.980 1.00 0.00 N ATOM 0 H LYS A 400 102.420 16.303 0.773 1.00 0.00 H new ATOM 0 HA LYS A 400 100.302 17.654 1.908 1.00 0.00 H new ATOM 0 HB2 LYS A 400 101.906 18.294 3.636 1.00 0.00 H new ATOM 0 HB3 LYS A 400 102.304 16.678 3.089 1.00 0.00 H new ATOM 0 HG2 LYS A 400 103.930 17.823 1.400 1.00 0.00 H new ATOM 0 HG3 LYS A 400 103.691 19.289 2.330 1.00 0.00 H new ATOM 0 HD2 LYS A 400 104.301 17.868 4.430 1.00 0.00 H new ATOM 0 HD3 LYS A 400 104.853 16.641 3.307 1.00 0.00 H new ATOM 0 HE2 LYS A 400 106.256 18.539 2.184 1.00 0.00 H new ATOM 0 HE3 LYS A 400 105.904 19.490 3.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 400 107.985 18.278 3.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 400 106.850 17.719 4.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 400 107.191 16.798 3.606 1.00 0.00 H new ATOM 1207 N LYS A 401 102.400 19.672 0.354 1.00 0.00 N ATOM 1208 CA LYS A 401 102.547 21.026 -0.169 1.00 0.00 C ATOM 1209 C LYS A 401 101.367 21.385 -1.068 1.00 0.00 C ATOM 1210 O LYS A 401 101.001 22.553 -1.193 1.00 0.00 O ATOM 1211 CB LYS A 401 103.855 21.137 -0.966 1.00 0.00 C ATOM 1212 CG LYS A 401 104.242 22.619 -1.151 1.00 0.00 C ATOM 1213 CD LYS A 401 105.084 23.101 0.037 1.00 0.00 C ATOM 1214 CE LYS A 401 105.208 24.624 -0.011 1.00 0.00 C ATOM 1215 NZ LYS A 401 106.054 25.089 1.124 1.00 0.00 N ATOM 0 H LYS A 401 103.150 19.031 0.093 1.00 0.00 H new ATOM 0 HA LYS A 401 102.572 21.721 0.670 1.00 0.00 H new ATOM 0 HB2 LYS A 401 104.653 20.608 -0.445 1.00 0.00 H new ATOM 0 HB3 LYS A 401 103.738 20.660 -1.939 1.00 0.00 H new ATOM 0 HG2 LYS A 401 104.803 22.743 -2.077 1.00 0.00 H new ATOM 0 HG3 LYS A 401 103.343 23.229 -1.239 1.00 0.00 H new ATOM 0 HD2 LYS A 401 104.620 22.793 0.974 1.00 0.00 H new ATOM 0 HD3 LYS A 401 106.073 22.644 0.005 1.00 0.00 H new ATOM 0 HE2 LYS A 401 105.649 24.934 -0.958 1.00 0.00 H new ATOM 0 HE3 LYS A 401 104.221 25.082 0.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 401 106.139 26.125 1.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 401 105.615 24.805 2.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 401 106.999 24.662 1.050 1.00 0.00 H new ATOM 1229 N ALA A 402 100.776 20.371 -1.691 1.00 0.00 N ATOM 1230 CA ALA A 402 99.638 20.590 -2.576 1.00 0.00 C ATOM 1231 C ALA A 402 98.570 21.430 -1.884 1.00 0.00 C ATOM 1232 O ALA A 402 97.940 22.285 -2.505 1.00 0.00 O ATOM 1233 CB ALA A 402 99.038 19.247 -2.998 1.00 0.00 C ATOM 0 H ALA A 402 101.063 19.396 -1.601 1.00 0.00 H new ATOM 0 HA ALA A 402 99.989 21.126 -3.458 1.00 0.00 H new ATOM 0 HB1 ALA A 402 98.189 19.420 -3.659 1.00 0.00 H new ATOM 0 HB2 ALA A 402 99.792 18.660 -3.522 1.00 0.00 H new ATOM 0 HB3 ALA A 402 98.705 18.703 -2.114 1.00 0.00 H new ATOM 1239 N VAL A 403 98.373 21.181 -0.594 1.00 0.00 N ATOM 1240 CA VAL A 403 97.376 21.920 0.172 1.00 0.00 C ATOM 1241 C VAL A 403 97.556 23.424 -0.015 1.00 0.00 C ATOM 1242 O VAL A 403 96.652 24.113 -0.486 1.00 0.00 O ATOM 1243 CB VAL A 403 97.496 21.573 1.657 1.00 0.00 C ATOM 1244 CG1 VAL A 403 96.390 22.283 2.438 1.00 0.00 C ATOM 1245 CG2 VAL A 403 97.358 20.060 1.839 1.00 0.00 C ATOM 0 H VAL A 403 98.886 20.479 -0.060 1.00 0.00 H new ATOM 0 HA VAL A 403 96.388 21.637 -0.191 1.00 0.00 H new ATOM 0 HB VAL A 403 98.468 21.897 2.029 1.00 0.00 H new ATOM 0 HG11 VAL A 403 96.476 22.036 3.496 1.00 0.00 H new ATOM 0 HG12 VAL A 403 96.487 23.361 2.308 1.00 0.00 H new ATOM 0 HG13 VAL A 403 95.417 21.959 2.067 1.00 0.00 H new ATOM 0 HG21 VAL A 403 97.443 19.811 2.897 1.00 0.00 H new ATOM 0 HG22 VAL A 403 96.386 19.736 1.467 1.00 0.00 H new ATOM 0 HG23 VAL A 403 98.146 19.553 1.282 1.00 0.00 H new ATOM 1255 N SER A 404 98.728 23.926 0.362 1.00 0.00 N ATOM 1256 CA SER A 404 99.018 25.351 0.236 1.00 0.00 C ATOM 1257 C SER A 404 98.539 25.892 -1.109 1.00 0.00 C ATOM 1258 O SER A 404 97.959 26.975 -1.181 1.00 0.00 O ATOM 1259 CB SER A 404 100.521 25.590 0.376 1.00 0.00 C ATOM 1260 OG SER A 404 100.967 25.060 1.618 1.00 0.00 O ATOM 0 H SER A 404 99.488 23.371 0.755 1.00 0.00 H new ATOM 0 HA SER A 404 98.486 25.876 1.029 1.00 0.00 H new ATOM 0 HB2 SER A 404 101.055 25.116 -0.448 1.00 0.00 H new ATOM 0 HB3 SER A 404 100.738 26.657 0.324 1.00 0.00 H new ATOM 0 HG SER A 404 101.931 25.210 1.710 1.00 0.00 H new ATOM 1266 N THR A 405 98.791 25.136 -2.172 1.00 0.00 N ATOM 1267 CA THR A 405 98.384 25.558 -3.507 1.00 0.00 C ATOM 1268 C THR A 405 96.866 25.683 -3.602 1.00 0.00 C ATOM 1269 O THR A 405 96.346 26.715 -4.025 1.00 0.00 O ATOM 1270 CB THR A 405 98.879 24.552 -4.549 1.00 0.00 C ATOM 1271 OG1 THR A 405 98.009 23.430 -4.573 1.00 0.00 O ATOM 1272 CG2 THR A 405 100.295 24.097 -4.191 1.00 0.00 C ATOM 0 H THR A 405 99.270 24.236 -2.137 1.00 0.00 H new ATOM 0 HA THR A 405 98.827 26.535 -3.702 1.00 0.00 H new ATOM 0 HB THR A 405 98.890 25.023 -5.532 1.00 0.00 H new ATOM 0 HG1 THR A 405 98.283 22.789 -3.885 1.00 0.00 H new ATOM 0 HG21 THR A 405 100.646 23.381 -4.934 1.00 0.00 H new ATOM 0 HG22 THR A 405 100.961 24.959 -4.176 1.00 0.00 H new ATOM 0 HG23 THR A 405 100.288 23.626 -3.208 1.00 0.00 H new ATOM 1280 N LEU A 406 96.160 24.627 -3.209 1.00 0.00 N ATOM 1281 CA LEU A 406 94.702 24.637 -3.262 1.00 0.00 C ATOM 1282 C LEU A 406 94.145 25.773 -2.397 1.00 0.00 C ATOM 1283 O LEU A 406 94.738 26.118 -1.374 1.00 0.00 O ATOM 1284 CB LEU A 406 94.155 23.296 -2.757 1.00 0.00 C ATOM 1285 CG LEU A 406 94.782 22.137 -3.544 1.00 0.00 C ATOM 1286 CD1 LEU A 406 94.477 20.819 -2.829 1.00 0.00 C ATOM 1287 CD2 LEU A 406 94.206 22.087 -4.968 1.00 0.00 C ATOM 0 H LEU A 406 96.568 23.762 -2.854 1.00 0.00 H new ATOM 0 HA LEU A 406 94.392 24.792 -4.295 1.00 0.00 H new ATOM 0 HB2 LEU A 406 94.372 23.183 -1.695 1.00 0.00 H new ATOM 0 HB3 LEU A 406 93.071 23.274 -2.865 1.00 0.00 H new ATOM 0 HG LEU A 406 95.860 22.289 -3.603 1.00 0.00 H new ATOM 0 HD11 LEU A 406 94.920 19.993 -3.384 1.00 0.00 H new ATOM 0 HD12 LEU A 406 94.895 20.846 -1.823 1.00 0.00 H new ATOM 0 HD13 LEU A 406 93.398 20.679 -2.770 1.00 0.00 H new ATOM 0 HD21 LEU A 406 94.659 21.260 -5.515 1.00 0.00 H new ATOM 0 HD22 LEU A 406 93.127 21.941 -4.919 1.00 0.00 H new ATOM 0 HD23 LEU A 406 94.423 23.024 -5.481 1.00 0.00 H new ATOM 1299 N PRO A 407 93.027 26.359 -2.769 1.00 0.00 N ATOM 1300 CA PRO A 407 92.411 27.470 -1.984 1.00 0.00 C ATOM 1301 C PRO A 407 91.763 26.963 -0.695 1.00 0.00 C ATOM 1302 O PRO A 407 91.634 25.757 -0.487 1.00 0.00 O ATOM 1303 CB PRO A 407 91.363 28.047 -2.946 1.00 0.00 C ATOM 1304 CG PRO A 407 90.964 26.890 -3.803 1.00 0.00 C ATOM 1305 CD PRO A 407 92.227 26.040 -3.971 1.00 0.00 C ATOM 0 HA PRO A 407 93.143 28.208 -1.657 1.00 0.00 H new ATOM 0 HB2 PRO A 407 90.509 28.453 -2.405 1.00 0.00 H new ATOM 0 HB3 PRO A 407 91.777 28.859 -3.543 1.00 0.00 H new ATOM 0 HG2 PRO A 407 90.165 26.315 -3.336 1.00 0.00 H new ATOM 0 HG3 PRO A 407 90.590 27.229 -4.769 1.00 0.00 H new ATOM 0 HD2 PRO A 407 91.990 24.977 -4.024 1.00 0.00 H new ATOM 0 HD3 PRO A 407 92.761 26.294 -4.887 1.00 0.00 H new ATOM 1313 N ALA A 408 91.357 27.893 0.165 1.00 0.00 N ATOM 1314 CA ALA A 408 90.727 27.527 1.428 1.00 0.00 C ATOM 1315 C ALA A 408 89.459 26.715 1.182 1.00 0.00 C ATOM 1316 O ALA A 408 89.321 25.598 1.681 1.00 0.00 O ATOM 1317 CB ALA A 408 90.379 28.789 2.222 1.00 0.00 C ATOM 0 H ALA A 408 91.452 28.897 0.012 1.00 0.00 H new ATOM 0 HA ALA A 408 91.429 26.918 1.998 1.00 0.00 H new ATOM 0 HB1 ALA A 408 89.909 28.508 3.164 1.00 0.00 H new ATOM 0 HB2 ALA A 408 91.289 29.354 2.425 1.00 0.00 H new ATOM 0 HB3 ALA A 408 89.691 29.405 1.643 1.00 0.00 H new ATOM 1323 N ASP A 409 88.535 27.287 0.414 1.00 0.00 N ATOM 1324 CA ASP A 409 87.272 26.615 0.107 1.00 0.00 C ATOM 1325 C ASP A 409 87.482 25.120 -0.125 1.00 0.00 C ATOM 1326 O ASP A 409 86.684 24.296 0.323 1.00 0.00 O ATOM 1327 CB ASP A 409 86.642 27.240 -1.138 1.00 0.00 C ATOM 1328 CG ASP A 409 85.228 26.703 -1.332 1.00 0.00 C ATOM 1329 OD1 ASP A 409 84.874 25.758 -0.646 1.00 0.00 O ATOM 1330 OD2 ASP A 409 84.518 27.245 -2.164 1.00 0.00 O ATOM 0 H ASP A 409 88.635 28.211 -0.007 1.00 0.00 H new ATOM 0 HA ASP A 409 86.607 26.740 0.962 1.00 0.00 H new ATOM 0 HB2 ASP A 409 86.617 28.325 -1.038 1.00 0.00 H new ATOM 0 HB3 ASP A 409 87.249 27.015 -2.015 1.00 0.00 H new ATOM 1335 N VAL A 410 88.559 24.776 -0.825 1.00 0.00 N ATOM 1336 CA VAL A 410 88.860 23.376 -1.106 1.00 0.00 C ATOM 1337 C VAL A 410 89.492 22.710 0.113 1.00 0.00 C ATOM 1338 O VAL A 410 89.149 21.580 0.462 1.00 0.00 O ATOM 1339 CB VAL A 410 89.809 23.279 -2.305 1.00 0.00 C ATOM 1340 CG1 VAL A 410 90.257 21.828 -2.496 1.00 0.00 C ATOM 1341 CG2 VAL A 410 89.083 23.756 -3.567 1.00 0.00 C ATOM 0 H VAL A 410 89.233 25.441 -1.205 1.00 0.00 H new ATOM 0 HA VAL A 410 87.930 22.859 -1.341 1.00 0.00 H new ATOM 0 HB VAL A 410 90.683 23.905 -2.124 1.00 0.00 H new ATOM 0 HG11 VAL A 410 90.932 21.765 -3.350 1.00 0.00 H new ATOM 0 HG12 VAL A 410 90.774 21.486 -1.599 1.00 0.00 H new ATOM 0 HG13 VAL A 410 89.385 21.199 -2.675 1.00 0.00 H new ATOM 0 HG21 VAL A 410 89.756 23.688 -4.422 1.00 0.00 H new ATOM 0 HG22 VAL A 410 88.209 23.129 -3.743 1.00 0.00 H new ATOM 0 HG23 VAL A 410 88.767 24.791 -3.436 1.00 0.00 H new ATOM 1351 N GLN A 411 90.416 23.415 0.757 1.00 0.00 N ATOM 1352 CA GLN A 411 91.086 22.879 1.936 1.00 0.00 C ATOM 1353 C GLN A 411 90.114 22.788 3.108 1.00 0.00 C ATOM 1354 O GLN A 411 90.358 22.068 4.077 1.00 0.00 O ATOM 1355 CB GLN A 411 92.270 23.772 2.318 1.00 0.00 C ATOM 1356 CG GLN A 411 93.066 23.110 3.443 1.00 0.00 C ATOM 1357 CD GLN A 411 94.348 23.893 3.703 1.00 0.00 C ATOM 1358 OE1 GLN A 411 94.635 24.925 2.957 1.00 0.00 O flip ATOM 1359 NE2 GLN A 411 95.110 23.555 4.610 1.00 0.00 N flip ATOM 0 H GLN A 411 90.716 24.351 0.485 1.00 0.00 H new ATOM 0 HA GLN A 411 91.449 21.879 1.701 1.00 0.00 H new ATOM 0 HB2 GLN A 411 92.911 23.935 1.452 1.00 0.00 H new ATOM 0 HB3 GLN A 411 91.913 24.751 2.638 1.00 0.00 H new ATOM 0 HG2 GLN A 411 92.464 23.069 4.351 1.00 0.00 H new ATOM 0 HG3 GLN A 411 93.306 22.081 3.174 1.00 0.00 H new ATOM 0 HE21 GLN A 411 94.884 22.748 5.192 1.00 0.00 H new ATOM 0 HE22 GLN A 411 95.967 24.082 4.779 1.00 0.00 H new ATOM 1368 N ALA A 412 89.010 23.521 3.011 1.00 0.00 N ATOM 1369 CA ALA A 412 88.005 23.515 4.069 1.00 0.00 C ATOM 1370 C ALA A 412 87.254 22.187 4.082 1.00 0.00 C ATOM 1371 O ALA A 412 86.436 21.934 4.965 1.00 0.00 O ATOM 1372 CB ALA A 412 87.015 24.662 3.854 1.00 0.00 C ATOM 0 H ALA A 412 88.789 24.122 2.217 1.00 0.00 H new ATOM 0 HA ALA A 412 88.508 23.646 5.027 1.00 0.00 H new ATOM 0 HB1 ALA A 412 86.268 24.651 4.647 1.00 0.00 H new ATOM 0 HB2 ALA A 412 87.549 25.612 3.872 1.00 0.00 H new ATOM 0 HB3 ALA A 412 86.522 24.541 2.890 1.00 0.00 H new ATOM 1378 N LYS A 413 87.544 21.342 3.094 1.00 0.00 N ATOM 1379 CA LYS A 413 86.897 20.035 2.993 1.00 0.00 C ATOM 1380 C LYS A 413 87.714 18.982 3.741 1.00 0.00 C ATOM 1381 O LYS A 413 87.440 17.786 3.652 1.00 0.00 O ATOM 1382 CB LYS A 413 86.765 19.639 1.513 1.00 0.00 C ATOM 1383 CG LYS A 413 85.655 18.582 1.337 1.00 0.00 C ATOM 1384 CD LYS A 413 84.288 19.265 1.183 1.00 0.00 C ATOM 1385 CE LYS A 413 83.231 18.212 0.845 1.00 0.00 C ATOM 1386 NZ LYS A 413 83.216 17.165 1.904 1.00 0.00 N ATOM 0 H LYS A 413 88.220 21.538 2.355 1.00 0.00 H new ATOM 0 HA LYS A 413 85.906 20.093 3.442 1.00 0.00 H new ATOM 0 HB2 LYS A 413 86.536 20.520 0.913 1.00 0.00 H new ATOM 0 HB3 LYS A 413 87.714 19.244 1.150 1.00 0.00 H new ATOM 0 HG2 LYS A 413 85.863 17.968 0.460 1.00 0.00 H new ATOM 0 HG3 LYS A 413 85.640 17.914 2.198 1.00 0.00 H new ATOM 0 HD2 LYS A 413 84.021 19.782 2.105 1.00 0.00 H new ATOM 0 HD3 LYS A 413 84.332 20.018 0.396 1.00 0.00 H new ATOM 0 HE2 LYS A 413 82.249 18.679 0.767 1.00 0.00 H new ATOM 0 HE3 LYS A 413 83.448 17.762 -0.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 413 82.240 16.841 2.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 413 83.805 16.361 1.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 413 83.593 17.561 2.789 1.00 0.00 H new ATOM 1400 N ASN A 414 88.718 19.439 4.476 1.00 0.00 N ATOM 1401 CA ASN A 414 89.571 18.533 5.234 1.00 0.00 C ATOM 1402 C ASN A 414 90.197 17.480 4.322 1.00 0.00 C ATOM 1403 O ASN A 414 89.894 16.292 4.433 1.00 0.00 O ATOM 1404 CB ASN A 414 88.755 17.841 6.328 1.00 0.00 C ATOM 1405 CG ASN A 414 89.689 17.179 7.335 1.00 0.00 C ATOM 1406 OD1 ASN A 414 90.839 16.878 7.012 1.00 0.00 O ATOM 1407 ND2 ASN A 414 89.262 16.932 8.543 1.00 0.00 N ATOM 0 H ASN A 414 88.961 20.426 4.564 1.00 0.00 H new ATOM 0 HA ASN A 414 90.370 19.119 5.688 1.00 0.00 H new ATOM 0 HB2 ASN A 414 88.118 18.568 6.833 1.00 0.00 H new ATOM 0 HB3 ASN A 414 88.097 17.094 5.885 1.00 0.00 H new ATOM 0 HD21 ASN A 414 89.881 16.489 9.222 1.00 0.00 H new ATOM 0 HD22 ASN A 414 88.309 17.182 8.808 1.00 0.00 H new ATOM 1414 N PRO A 415 91.065 17.892 3.433 1.00 0.00 N ATOM 1415 CA PRO A 415 91.752 16.961 2.487 1.00 0.00 C ATOM 1416 C PRO A 415 92.396 15.781 3.214 1.00 0.00 C ATOM 1417 O PRO A 415 92.996 15.948 4.276 1.00 0.00 O ATOM 1418 CB PRO A 415 92.812 17.847 1.810 1.00 0.00 C ATOM 1419 CG PRO A 415 92.278 19.239 1.918 1.00 0.00 C ATOM 1420 CD PRO A 415 91.486 19.288 3.228 1.00 0.00 C ATOM 0 HA PRO A 415 91.061 16.508 1.777 1.00 0.00 H new ATOM 0 HB2 PRO A 415 93.778 17.755 2.306 1.00 0.00 H new ATOM 0 HB3 PRO A 415 92.960 17.560 0.769 1.00 0.00 H new ATOM 0 HG2 PRO A 415 93.088 19.968 1.925 1.00 0.00 H new ATOM 0 HG3 PRO A 415 91.640 19.479 1.067 1.00 0.00 H new ATOM 0 HD2 PRO A 415 92.100 19.647 4.054 1.00 0.00 H new ATOM 0 HD3 PRO A 415 90.629 19.958 3.153 1.00 0.00 H new ATOM 1428 N TRP A 416 92.270 14.586 2.633 1.00 0.00 N ATOM 1429 CA TRP A 416 92.845 13.377 3.229 1.00 0.00 C ATOM 1430 C TRP A 416 93.639 12.595 2.188 1.00 0.00 C ATOM 1431 O TRP A 416 93.208 12.449 1.044 1.00 0.00 O ATOM 1432 CB TRP A 416 91.729 12.494 3.795 1.00 0.00 C ATOM 1433 CG TRP A 416 90.830 12.049 2.686 1.00 0.00 C ATOM 1434 CD1 TRP A 416 89.974 12.849 2.011 1.00 0.00 C ATOM 1435 CD2 TRP A 416 90.680 10.717 2.116 1.00 0.00 C ATOM 1436 NE1 TRP A 416 89.311 12.094 1.061 1.00 0.00 N ATOM 1437 CE2 TRP A 416 89.711 10.772 1.087 1.00 0.00 C ATOM 1438 CE3 TRP A 416 91.287 9.477 2.389 1.00 0.00 C ATOM 1439 CZ2 TRP A 416 89.356 9.640 0.355 1.00 0.00 C ATOM 1440 CZ3 TRP A 416 90.932 8.334 1.654 1.00 0.00 C ATOM 1441 CH2 TRP A 416 89.968 8.416 0.638 1.00 0.00 C ATOM 0 H TRP A 416 91.777 14.429 1.754 1.00 0.00 H new ATOM 0 HA TRP A 416 93.517 13.673 4.035 1.00 0.00 H new ATOM 0 HB2 TRP A 416 92.157 11.628 4.299 1.00 0.00 H new ATOM 0 HB3 TRP A 416 91.157 13.046 4.541 1.00 0.00 H new ATOM 0 HD1 TRP A 416 89.831 13.905 2.185 1.00 0.00 H new ATOM 0 HE1 TRP A 416 88.612 12.468 0.419 1.00 0.00 H new ATOM 0 HE3 TRP A 416 92.031 9.404 3.169 1.00 0.00 H new ATOM 0 HZ2 TRP A 416 88.613 9.709 -0.426 1.00 0.00 H new ATOM 0 HZ3 TRP A 416 91.404 7.387 1.872 1.00 0.00 H new ATOM 0 HH2 TRP A 416 89.699 7.534 0.075 1.00 0.00 H new ATOM 1452 N ALA A 417 94.802 12.095 2.594 1.00 0.00 N ATOM 1453 CA ALA A 417 95.652 11.328 1.690 1.00 0.00 C ATOM 1454 C ALA A 417 94.929 10.074 1.211 1.00 0.00 C ATOM 1455 O ALA A 417 93.942 9.649 1.812 1.00 0.00 O ATOM 1456 CB ALA A 417 96.948 10.934 2.403 1.00 0.00 C ATOM 0 H ALA A 417 95.176 12.206 3.537 1.00 0.00 H new ATOM 0 HA ALA A 417 95.888 11.949 0.826 1.00 0.00 H new ATOM 0 HB1 ALA A 417 97.578 10.361 1.722 1.00 0.00 H new ATOM 0 HB2 ALA A 417 97.478 11.833 2.718 1.00 0.00 H new ATOM 0 HB3 ALA A 417 96.712 10.327 3.277 1.00 0.00 H new ATOM 1462 N LYS A 418 95.425 9.485 0.125 1.00 0.00 N ATOM 1463 CA LYS A 418 94.815 8.279 -0.426 1.00 0.00 C ATOM 1464 C LYS A 418 95.827 7.504 -1.270 1.00 0.00 C ATOM 1465 O LYS A 418 95.859 7.645 -2.493 1.00 0.00 O ATOM 1466 CB LYS A 418 93.616 8.660 -1.297 1.00 0.00 C ATOM 1467 CG LYS A 418 92.788 7.411 -1.603 1.00 0.00 C ATOM 1468 CD LYS A 418 91.723 7.748 -2.649 1.00 0.00 C ATOM 1469 CE LYS A 418 90.987 6.471 -3.060 1.00 0.00 C ATOM 1470 NZ LYS A 418 90.092 6.035 -1.952 1.00 0.00 N ATOM 0 H LYS A 418 96.241 9.820 -0.387 1.00 0.00 H new ATOM 0 HA LYS A 418 94.486 7.648 0.400 1.00 0.00 H new ATOM 0 HB2 LYS A 418 93.001 9.400 -0.784 1.00 0.00 H new ATOM 0 HB3 LYS A 418 93.958 9.118 -2.225 1.00 0.00 H new ATOM 0 HG2 LYS A 418 93.435 6.614 -1.971 1.00 0.00 H new ATOM 0 HG3 LYS A 418 92.315 7.043 -0.692 1.00 0.00 H new ATOM 0 HD2 LYS A 418 91.017 8.473 -2.244 1.00 0.00 H new ATOM 0 HD3 LYS A 418 92.188 8.209 -3.521 1.00 0.00 H new ATOM 0 HE2 LYS A 418 90.404 6.649 -3.964 1.00 0.00 H new ATOM 0 HE3 LYS A 418 91.704 5.684 -3.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 89.554 5.196 -2.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 90.664 5.800 -1.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 89.432 6.804 -1.716 1.00 0.00 H new ATOM 1484 N PRO A 419 96.645 6.688 -0.651 1.00 0.00 N ATOM 1485 CA PRO A 419 97.671 5.876 -1.374 1.00 0.00 C ATOM 1486 C PRO A 419 97.072 5.116 -2.558 1.00 0.00 C ATOM 1487 O PRO A 419 95.915 4.697 -2.519 1.00 0.00 O ATOM 1488 CB PRO A 419 98.194 4.913 -0.297 1.00 0.00 C ATOM 1489 CG PRO A 419 97.966 5.627 0.996 1.00 0.00 C ATOM 1490 CD PRO A 419 96.691 6.452 0.803 1.00 0.00 C ATOM 0 HA PRO A 419 98.456 6.494 -1.811 1.00 0.00 H new ATOM 0 HB2 PRO A 419 97.661 3.963 -0.323 1.00 0.00 H new ATOM 0 HB3 PRO A 419 99.251 4.690 -0.445 1.00 0.00 H new ATOM 0 HG2 PRO A 419 97.852 4.920 1.818 1.00 0.00 H new ATOM 0 HG3 PRO A 419 98.812 6.268 1.242 1.00 0.00 H new ATOM 0 HD2 PRO A 419 95.809 5.913 1.149 1.00 0.00 H new ATOM 0 HD3 PRO A 419 96.732 7.388 1.360 1.00 0.00 H new ATOM 1498 N LEU A 420 97.870 4.940 -3.606 1.00 0.00 N ATOM 1499 CA LEU A 420 97.410 4.227 -4.794 1.00 0.00 C ATOM 1500 C LEU A 420 97.437 2.721 -4.557 1.00 0.00 C ATOM 1501 O LEU A 420 96.702 1.970 -5.197 1.00 0.00 O ATOM 1502 CB LEU A 420 98.301 4.569 -5.992 1.00 0.00 C ATOM 1503 CG LEU A 420 98.487 6.087 -6.089 1.00 0.00 C ATOM 1504 CD1 LEU A 420 99.457 6.405 -7.229 1.00 0.00 C ATOM 1505 CD2 LEU A 420 97.134 6.758 -6.365 1.00 0.00 C ATOM 0 H LEU A 420 98.831 5.278 -3.658 1.00 0.00 H new ATOM 0 HA LEU A 420 96.386 4.536 -5.003 1.00 0.00 H new ATOM 0 HB2 LEU A 420 99.270 4.081 -5.886 1.00 0.00 H new ATOM 0 HB3 LEU A 420 97.852 4.190 -6.910 1.00 0.00 H new ATOM 0 HG LEU A 420 98.889 6.464 -5.149 1.00 0.00 H new ATOM 0 HD11 LEU A 420 99.592 7.484 -7.301 1.00 0.00 H new ATOM 0 HD12 LEU A 420 100.419 5.931 -7.031 1.00 0.00 H new ATOM 0 HD13 LEU A 420 99.052 6.026 -8.167 1.00 0.00 H new ATOM 0 HD21 LEU A 420 97.270 7.837 -6.433 1.00 0.00 H new ATOM 0 HD22 LEU A 420 96.727 6.384 -7.304 1.00 0.00 H new ATOM 0 HD23 LEU A 420 96.443 6.530 -5.554 1.00 0.00 H new ATOM 1517 N ARG A 421 98.289 2.287 -3.632 1.00 0.00 N ATOM 1518 CA ARG A 421 98.408 0.865 -3.316 1.00 0.00 C ATOM 1519 C ARG A 421 97.036 0.197 -3.275 1.00 0.00 C ATOM 1520 O ARG A 421 96.897 -0.978 -3.616 1.00 0.00 O ATOM 1521 CB ARG A 421 99.101 0.691 -1.963 1.00 0.00 C ATOM 1522 CG ARG A 421 99.438 -0.787 -1.747 1.00 0.00 C ATOM 1523 CD ARG A 421 100.053 -0.975 -0.360 1.00 0.00 C ATOM 1524 NE ARG A 421 100.080 -2.389 -0.005 1.00 0.00 N ATOM 1525 CZ ARG A 421 100.437 -2.786 1.212 1.00 0.00 C ATOM 1526 NH1 ARG A 421 100.772 -1.904 2.113 1.00 0.00 N ATOM 1527 NH2 ARG A 421 100.452 -4.057 1.505 1.00 0.00 N ATOM 0 H ARG A 421 98.904 2.895 -3.091 1.00 0.00 H new ATOM 0 HA ARG A 421 99.001 0.391 -4.098 1.00 0.00 H new ATOM 0 HB2 ARG A 421 100.010 1.291 -1.929 1.00 0.00 H new ATOM 0 HB3 ARG A 421 98.453 1.048 -1.162 1.00 0.00 H new ATOM 0 HG2 ARG A 421 98.537 -1.393 -1.842 1.00 0.00 H new ATOM 0 HG3 ARG A 421 100.134 -1.128 -2.514 1.00 0.00 H new ATOM 0 HD2 ARG A 421 101.065 -0.570 -0.346 1.00 0.00 H new ATOM 0 HD3 ARG A 421 99.477 -0.419 0.379 1.00 0.00 H new ATOM 0 HE ARG A 421 99.820 -3.086 -0.703 1.00 0.00 H new ATOM 0 HH11 ARG A 421 100.760 -0.910 1.883 1.00 0.00 H new ATOM 0 HH12 ARG A 421 101.046 -2.208 3.047 1.00 0.00 H new ATOM 0 HH21 ARG A 421 100.190 -4.746 0.800 1.00 0.00 H new ATOM 0 HH22 ARG A 421 100.726 -4.362 2.439 1.00 0.00 H new ATOM 1541 N GLN A 422 96.025 0.954 -2.858 1.00 0.00 N ATOM 1542 CA GLN A 422 94.667 0.425 -2.776 1.00 0.00 C ATOM 1543 C GLN A 422 93.978 0.504 -4.134 1.00 0.00 C ATOM 1544 O GLN A 422 93.553 -0.512 -4.684 1.00 0.00 O ATOM 1545 CB GLN A 422 93.858 1.214 -1.745 1.00 0.00 C ATOM 1546 CG GLN A 422 94.538 1.116 -0.379 1.00 0.00 C ATOM 1547 CD GLN A 422 93.683 1.803 0.680 1.00 0.00 C ATOM 1548 OE1 GLN A 422 93.901 2.974 0.992 1.00 0.00 O ATOM 1549 NE2 GLN A 422 92.715 1.141 1.255 1.00 0.00 N ATOM 0 H GLN A 422 96.119 1.929 -2.573 1.00 0.00 H new ATOM 0 HA GLN A 422 94.724 -0.620 -2.470 1.00 0.00 H new ATOM 0 HB2 GLN A 422 93.780 2.258 -2.050 1.00 0.00 H new ATOM 0 HB3 GLN A 422 92.843 0.822 -1.687 1.00 0.00 H new ATOM 0 HG2 GLN A 422 94.689 0.070 -0.113 1.00 0.00 H new ATOM 0 HG3 GLN A 422 95.523 1.580 -0.420 1.00 0.00 H new ATOM 0 HE21 GLN A 422 92.536 0.171 0.995 1.00 0.00 H new ATOM 0 HE22 GLN A 422 92.138 1.594 1.964 1.00 0.00 H new ATOM 1558 N VAL A 423 93.870 1.716 -4.671 1.00 0.00 N ATOM 1559 CA VAL A 423 93.228 1.915 -5.969 1.00 0.00 C ATOM 1560 C VAL A 423 93.630 0.815 -6.946 1.00 0.00 C ATOM 1561 O VAL A 423 92.928 0.554 -7.923 1.00 0.00 O ATOM 1562 CB VAL A 423 93.624 3.272 -6.545 1.00 0.00 C ATOM 1563 CG1 VAL A 423 92.782 3.565 -7.788 1.00 0.00 C ATOM 1564 CG2 VAL A 423 93.385 4.363 -5.498 1.00 0.00 C ATOM 0 H VAL A 423 94.215 2.570 -4.233 1.00 0.00 H new ATOM 0 HA VAL A 423 92.148 1.880 -5.823 1.00 0.00 H new ATOM 0 HB VAL A 423 94.679 3.255 -6.817 1.00 0.00 H new ATOM 0 HG11 VAL A 423 93.065 4.534 -8.199 1.00 0.00 H new ATOM 0 HG12 VAL A 423 92.954 2.790 -8.535 1.00 0.00 H new ATOM 0 HG13 VAL A 423 91.726 3.580 -7.517 1.00 0.00 H new ATOM 0 HG21 VAL A 423 93.668 5.331 -5.910 1.00 0.00 H new ATOM 0 HG22 VAL A 423 92.330 4.380 -5.224 1.00 0.00 H new ATOM 0 HG23 VAL A 423 93.986 4.156 -4.613 1.00 0.00 H new ATOM 1574 N GLN A 424 94.759 0.168 -6.671 1.00 0.00 N ATOM 1575 CA GLN A 424 95.234 -0.909 -7.531 1.00 0.00 C ATOM 1576 C GLN A 424 94.106 -1.901 -7.791 1.00 0.00 C ATOM 1577 O GLN A 424 94.202 -2.753 -8.675 1.00 0.00 O ATOM 1578 CB GLN A 424 96.415 -1.628 -6.872 1.00 0.00 C ATOM 1579 CG GLN A 424 97.665 -0.750 -6.960 1.00 0.00 C ATOM 1580 CD GLN A 424 98.169 -0.701 -8.400 1.00 0.00 C ATOM 1581 OE1 GLN A 424 97.974 0.297 -9.092 1.00 0.00 O ATOM 1582 NE2 GLN A 424 98.808 -1.726 -8.892 1.00 0.00 N ATOM 0 H GLN A 424 95.356 0.368 -5.868 1.00 0.00 H new ATOM 0 HA GLN A 424 95.563 -0.483 -8.479 1.00 0.00 H new ATOM 0 HB2 GLN A 424 96.185 -1.847 -5.829 1.00 0.00 H new ATOM 0 HB3 GLN A 424 96.594 -2.583 -7.366 1.00 0.00 H new ATOM 0 HG2 GLN A 424 97.437 0.257 -6.611 1.00 0.00 H new ATOM 0 HG3 GLN A 424 98.443 -1.145 -6.307 1.00 0.00 H new ATOM 0 HE21 GLN A 424 98.968 -2.552 -8.315 1.00 0.00 H new ATOM 0 HE22 GLN A 424 99.148 -1.702 -9.853 1.00 0.00 H new ATOM 1591 N ALA A 425 93.039 -1.775 -7.012 1.00 0.00 N ATOM 1592 CA ALA A 425 91.885 -2.652 -7.150 1.00 0.00 C ATOM 1593 C ALA A 425 91.085 -2.294 -8.399 1.00 0.00 C ATOM 1594 O ALA A 425 90.991 -3.086 -9.336 1.00 0.00 O ATOM 1595 CB ALA A 425 90.995 -2.514 -5.914 1.00 0.00 C ATOM 0 H ALA A 425 92.950 -1.073 -6.278 1.00 0.00 H new ATOM 0 HA ALA A 425 92.233 -3.681 -7.244 1.00 0.00 H new ATOM 0 HB1 ALA A 425 90.130 -3.169 -6.014 1.00 0.00 H new ATOM 0 HB2 ALA A 425 91.561 -2.793 -5.025 1.00 0.00 H new ATOM 0 HB3 ALA A 425 90.659 -1.481 -5.821 1.00 0.00 H new ATOM 1601 N ASP A 426 90.509 -1.096 -8.402 1.00 0.00 N ATOM 1602 CA ASP A 426 89.715 -0.641 -9.538 1.00 0.00 C ATOM 1603 C ASP A 426 90.586 -0.493 -10.781 1.00 0.00 C ATOM 1604 O ASP A 426 90.122 -0.701 -11.902 1.00 0.00 O ATOM 1605 CB ASP A 426 89.059 0.702 -9.210 1.00 0.00 C ATOM 1606 CG ASP A 426 90.103 1.677 -8.677 1.00 0.00 C ATOM 1607 OD1 ASP A 426 90.627 1.424 -7.604 1.00 0.00 O ATOM 1608 OD2 ASP A 426 90.363 2.661 -9.349 1.00 0.00 O ATOM 0 H ASP A 426 90.576 -0.426 -7.636 1.00 0.00 H new ATOM 0 HA ASP A 426 88.944 -1.385 -9.738 1.00 0.00 H new ATOM 0 HB2 ASP A 426 88.588 1.113 -10.103 1.00 0.00 H new ATOM 0 HB3 ASP A 426 88.271 0.560 -8.470 1.00 0.00 H new ATOM 1613 N LEU A 427 91.849 -0.132 -10.578 1.00 0.00 N ATOM 1614 CA LEU A 427 92.772 0.040 -11.694 1.00 0.00 C ATOM 1615 C LEU A 427 93.213 -1.315 -12.239 1.00 0.00 C ATOM 1616 O LEU A 427 94.386 -1.518 -12.551 1.00 0.00 O ATOM 1617 CB LEU A 427 94.003 0.836 -11.236 1.00 0.00 C ATOM 1618 CG LEU A 427 94.763 1.397 -12.459 1.00 0.00 C ATOM 1619 CD1 LEU A 427 94.182 2.758 -12.867 1.00 0.00 C ATOM 1620 CD2 LEU A 427 96.247 1.578 -12.109 1.00 0.00 C ATOM 0 H LEU A 427 92.254 0.046 -9.659 1.00 0.00 H new ATOM 0 HA LEU A 427 92.259 0.587 -12.485 1.00 0.00 H new ATOM 0 HB2 LEU A 427 93.694 1.654 -10.584 1.00 0.00 H new ATOM 0 HB3 LEU A 427 94.663 0.195 -10.652 1.00 0.00 H new ATOM 0 HG LEU A 427 94.658 0.694 -13.285 1.00 0.00 H new ATOM 0 HD11 LEU A 427 94.726 3.142 -13.730 1.00 0.00 H new ATOM 0 HD12 LEU A 427 93.129 2.642 -13.125 1.00 0.00 H new ATOM 0 HD13 LEU A 427 94.277 3.458 -12.037 1.00 0.00 H new ATOM 0 HD21 LEU A 427 96.779 1.974 -12.974 1.00 0.00 H new ATOM 0 HD22 LEU A 427 96.342 2.274 -11.275 1.00 0.00 H new ATOM 0 HD23 LEU A 427 96.675 0.615 -11.829 1.00 0.00 H new ATOM 1632 N LYS A 428 92.264 -2.239 -12.351 1.00 0.00 N ATOM 1633 CA LYS A 428 92.566 -3.572 -12.859 1.00 0.00 C ATOM 1634 C LYS A 428 93.208 -3.485 -14.239 1.00 0.00 C ATOM 1635 CB LYS A 428 91.283 -4.402 -12.942 1.00 0.00 C ATOM 1636 CG LYS A 428 91.619 -5.811 -13.434 1.00 0.00 C ATOM 1637 CD LYS A 428 90.387 -6.708 -13.295 1.00 0.00 C ATOM 1638 CE LYS A 428 90.614 -8.009 -14.065 1.00 0.00 C ATOM 1639 NZ LYS A 428 90.562 -7.736 -15.530 1.00 0.00 N ATOM 0 H LYS A 428 91.287 -2.091 -12.099 1.00 0.00 H new ATOM 0 HA LYS A 428 93.265 -4.052 -12.175 1.00 0.00 H new ATOM 0 HB2 LYS A 428 90.805 -4.451 -11.964 1.00 0.00 H new ATOM 0 HB3 LYS A 428 90.573 -3.928 -13.620 1.00 0.00 H new ATOM 0 HG2 LYS A 428 91.942 -5.777 -14.475 1.00 0.00 H new ATOM 0 HG3 LYS A 428 92.448 -6.221 -12.857 1.00 0.00 H new ATOM 0 HD2 LYS A 428 90.198 -6.924 -12.243 1.00 0.00 H new ATOM 0 HD3 LYS A 428 89.505 -6.195 -13.679 1.00 0.00 H new ATOM 0 HE2 LYS A 428 91.580 -8.438 -13.798 1.00 0.00 H new ATOM 0 HE3 LYS A 428 89.854 -8.742 -13.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 90.343 -8.616 -16.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 89.824 -7.029 -15.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 91.483 -7.372 -15.848 1.00 0.00 H new TER 1653 LYS A 428