USER MOD reduce.3.24.130724 H: found=0, std=0, add=578, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 581 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 423 LYS NZ :NH3+ -150:sc= 0.064 (180deg=0) USER MOD Set 1.2: A 426 ASN : amide:sc= 0.0489 X(o=0.11,f=-0.23) USER MOD Set 2.1: A 396 HIS : no HD1:sc= -1.47! C(o=-0.83!,f=-4.7!) USER MOD Set 2.2: A 405 THR OG1 : rot 154:sc= 0.636 USER MOD Set 3.1: A 377 THR OG1 : rot -14:sc= -0.0103 USER MOD Set 3.2: A 380 SER OG : rot -26:sc= -0.321! USER MOD Single : A 355 SER OG : rot 180:sc= 0 USER MOD Single : A 356 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 357 MET CE :methyl -165:sc= -0.105 (180deg=-0.415) USER MOD Single : A 362 THR OG1 : rot 180:sc= 0 USER MOD Single : A 363 GLN : amide:sc= -0.922 K(o=-0.92,f=-3.5!) USER MOD Single : A 364 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 365 HIS :FLIP no HD1:sc= -0.988 F(o=-1.7!,f=-0.99) USER MOD Single : A 366 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 370 SER OG : rot 180:sc= 0 USER MOD Single : A 371 GLN : amide:sc= -1.28 K(o=-1.3,f=-3.4!) USER MOD Single : A 372 GLN : amide:sc= -0.322 X(o=-0.32,f=-0.05) USER MOD Single : A 373 GLN : amide:sc= 0.0758 K(o=0.076,f=-5.9!) USER MOD Single : A 382 ASN :FLIP amide:sc= -2.82 F(o=-7.4!,f=-2.8) USER MOD Single : A 383 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 384 LYS NZ :NH3+ -146:sc= 0 (180deg=-0.9) USER MOD Single : A 386 GLN : amide:sc= 0.171 X(o=0.17,f=0) USER MOD Single : A 387 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 390 LYS NZ :NH3+ -108:sc= -1.44 (180deg=-4.12!) USER MOD Single : A 391 SER OG : rot 180:sc= 0 USER MOD Single : A 394 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 397 ASN : amide:sc= 0.459 K(o=0.46,f=-3.4!) USER MOD Single : A 401 ASN :FLIP amide:sc= 0.185 F(o=-0.56,f=0.18) USER MOD Single : A 402 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 403 LYS NZ :NH3+ 143:sc= -3.16! (180deg=-5.74!) USER MOD Single : A 408 LYS NZ :NH3+ 168:sc= -0.0246 (180deg=-0.197) USER MOD Single : A 412 LYS NZ :NH3+ 146:sc= -3.4! (180deg=-6.21!) USER MOD Single : A 413 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 418 THR OG1 : rot 180:sc= 0 USER MOD Single : A 420 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 424 THR OG1 : rot 180:sc= -0.0184 USER MOD Single : A 427 THR OG1 : rot 180:sc= 0 USER MOD Single : A 428 ASN : amide:sc= -0.811 K(o=-0.81,f=-2.1) USER MOD Single : A 429 THR OG1 : rot 180:sc= 0 USER MOD Single : A 430 THR OG1 : rot 180:sc= 0 USER MOD Single : A 432 SER OG : rot 180:sc= 0 USER MOD Single : A 433 SER OG : rot -61:sc= 0.344 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 354 13.258 -23.705 -3.706 1.00 0.00 N ATOM 2 CA GLY A 354 12.078 -23.750 -4.612 1.00 0.00 C ATOM 3 C GLY A 354 12.317 -23.010 -5.913 1.00 0.00 C ATOM 4 O GLY A 354 13.359 -23.177 -6.547 1.00 0.00 O ATOM 0 HA2 GLY A 354 11.830 -24.789 -4.829 1.00 0.00 H new ATOM 0 HA3 GLY A 354 11.217 -23.316 -4.104 1.00 0.00 H new ATOM 10 N SER A 355 11.349 -22.189 -6.310 1.00 0.00 N ATOM 11 CA SER A 355 11.455 -21.416 -7.543 1.00 0.00 C ATOM 12 C SER A 355 12.538 -20.343 -7.423 1.00 0.00 C ATOM 13 O SER A 355 13.598 -20.584 -6.843 1.00 0.00 O ATOM 14 CB SER A 355 10.105 -20.778 -7.878 1.00 0.00 C ATOM 15 OG SER A 355 9.679 -19.910 -6.842 1.00 0.00 O ATOM 0 H SER A 355 10.481 -22.042 -5.795 1.00 0.00 H new ATOM 0 HA SER A 355 11.738 -22.091 -8.351 1.00 0.00 H new ATOM 0 HB2 SER A 355 10.184 -20.222 -8.812 1.00 0.00 H new ATOM 0 HB3 SER A 355 9.359 -21.558 -8.033 1.00 0.00 H new ATOM 0 HG SER A 355 8.815 -19.514 -7.081 1.00 0.00 H new ATOM 21 N HIS A 356 12.271 -19.160 -7.972 1.00 0.00 N ATOM 22 CA HIS A 356 13.229 -18.061 -7.920 1.00 0.00 C ATOM 23 C HIS A 356 13.496 -17.642 -6.478 1.00 0.00 C ATOM 24 O HIS A 356 12.564 -17.433 -5.701 1.00 0.00 O ATOM 25 CB HIS A 356 12.707 -16.868 -8.721 1.00 0.00 C ATOM 26 CG HIS A 356 12.427 -17.188 -10.156 1.00 0.00 C ATOM 27 ND1 HIS A 356 13.388 -17.663 -11.023 1.00 0.00 N ATOM 28 CD2 HIS A 356 11.284 -17.100 -10.877 1.00 0.00 C ATOM 29 CE1 HIS A 356 12.849 -17.852 -12.214 1.00 0.00 C ATOM 30 NE2 HIS A 356 11.573 -17.520 -12.151 1.00 0.00 N ATOM 0 H HIS A 356 11.401 -18.939 -8.457 1.00 0.00 H new ATOM 0 HA HIS A 356 14.166 -18.404 -8.359 1.00 0.00 H new ATOM 0 HB2 HIS A 356 11.794 -16.499 -8.254 1.00 0.00 H new ATOM 0 HB3 HIS A 356 13.438 -16.061 -8.673 1.00 0.00 H new ATOM 0 HD2 HIS A 356 10.324 -16.762 -10.516 1.00 0.00 H new ATOM 0 HE1 HIS A 356 13.365 -18.216 -13.090 1.00 0.00 H new ATOM 0 HE2 HIS A 356 10.909 -17.568 -12.924 1.00 0.00 H new ATOM 39 N MET A 357 14.773 -17.520 -6.128 1.00 0.00 N ATOM 40 CA MET A 357 15.162 -17.124 -4.778 1.00 0.00 C ATOM 41 C MET A 357 14.711 -15.697 -4.479 1.00 0.00 C ATOM 42 O MET A 357 14.871 -14.799 -5.305 1.00 0.00 O ATOM 43 CB MET A 357 16.677 -17.240 -4.607 1.00 0.00 C ATOM 44 CG MET A 357 17.213 -18.634 -4.891 1.00 0.00 C ATOM 45 SD MET A 357 16.427 -19.902 -3.876 1.00 0.00 S ATOM 46 CE MET A 357 16.857 -19.342 -2.230 1.00 0.00 C ATOM 0 H MET A 357 15.556 -17.689 -6.760 1.00 0.00 H new ATOM 0 HA MET A 357 14.672 -17.796 -4.073 1.00 0.00 H new ATOM 0 HB2 MET A 357 17.166 -16.529 -5.273 1.00 0.00 H new ATOM 0 HB3 MET A 357 16.943 -16.957 -3.588 1.00 0.00 H new ATOM 0 HG2 MET A 357 17.059 -18.870 -5.944 1.00 0.00 H new ATOM 0 HG3 MET A 357 18.289 -18.648 -4.715 1.00 0.00 H new ATOM 0 HE1 MET A 357 16.680 -20.145 -1.515 1.00 0.00 H new ATOM 0 HE2 MET A 357 17.909 -19.060 -2.205 1.00 0.00 H new ATOM 0 HE3 MET A 357 16.244 -18.480 -1.967 1.00 0.00 H new ATOM 56 N LEU A 358 14.144 -15.498 -3.293 1.00 0.00 N ATOM 57 CA LEU A 358 13.665 -14.183 -2.880 1.00 0.00 C ATOM 58 C LEU A 358 14.801 -13.163 -2.860 1.00 0.00 C ATOM 59 O LEU A 358 15.893 -13.444 -2.365 1.00 0.00 O ATOM 60 CB LEU A 358 13.014 -14.267 -1.497 1.00 0.00 C ATOM 61 CG LEU A 358 11.789 -15.181 -1.410 1.00 0.00 C ATOM 62 CD1 LEU A 358 11.282 -15.259 0.022 1.00 0.00 C ATOM 63 CD2 LEU A 358 10.688 -14.690 -2.337 1.00 0.00 C ATOM 0 H LEU A 358 14.005 -16.233 -2.599 1.00 0.00 H new ATOM 0 HA LEU A 358 12.923 -13.853 -3.607 1.00 0.00 H new ATOM 0 HB2 LEU A 358 13.759 -14.616 -0.782 1.00 0.00 H new ATOM 0 HB3 LEU A 358 12.722 -13.263 -1.189 1.00 0.00 H new ATOM 0 HG LEU A 358 12.085 -16.181 -1.727 1.00 0.00 H new ATOM 0 HD11 LEU A 358 10.411 -15.913 0.064 1.00 0.00 H new ATOM 0 HD12 LEU A 358 12.067 -15.658 0.665 1.00 0.00 H new ATOM 0 HD13 LEU A 358 11.004 -14.262 0.364 1.00 0.00 H new ATOM 0 HD21 LEU A 358 9.826 -15.353 -2.261 1.00 0.00 H new ATOM 0 HD22 LEU A 358 10.395 -13.680 -2.051 1.00 0.00 H new ATOM 0 HD23 LEU A 358 11.052 -14.685 -3.364 1.00 0.00 H new ATOM 75 N GLU A 359 14.533 -11.978 -3.401 1.00 0.00 N ATOM 76 CA GLU A 359 15.526 -10.910 -3.448 1.00 0.00 C ATOM 77 C GLU A 359 15.909 -10.461 -2.041 1.00 0.00 C ATOM 78 O GLU A 359 15.050 -10.312 -1.171 1.00 0.00 O ATOM 79 CB GLU A 359 14.994 -9.717 -4.248 1.00 0.00 C ATOM 80 CG GLU A 359 14.736 -10.024 -5.717 1.00 0.00 C ATOM 81 CD GLU A 359 13.632 -11.044 -5.923 1.00 0.00 C ATOM 82 OE1 GLU A 359 12.487 -10.772 -5.507 1.00 0.00 O ATOM 83 OE2 GLU A 359 13.915 -12.115 -6.500 1.00 0.00 O ATOM 0 H GLU A 359 13.633 -11.733 -3.814 1.00 0.00 H new ATOM 0 HA GLU A 359 16.415 -11.301 -3.943 1.00 0.00 H new ATOM 0 HB2 GLU A 359 14.067 -9.370 -3.791 1.00 0.00 H new ATOM 0 HB3 GLU A 359 15.709 -8.898 -4.179 1.00 0.00 H new ATOM 0 HG2 GLU A 359 14.473 -9.102 -6.235 1.00 0.00 H new ATOM 0 HG3 GLU A 359 15.655 -10.394 -6.172 1.00 0.00 H new ATOM 90 N VAL A 360 17.204 -10.249 -1.823 1.00 0.00 N ATOM 91 CA VAL A 360 17.703 -9.818 -0.522 1.00 0.00 C ATOM 92 C VAL A 360 17.103 -8.472 -0.117 1.00 0.00 C ATOM 93 O VAL A 360 17.023 -7.547 -0.926 1.00 0.00 O ATOM 94 CB VAL A 360 19.243 -9.717 -0.513 1.00 0.00 C ATOM 95 CG1 VAL A 360 19.725 -8.715 -1.551 1.00 0.00 C ATOM 96 CG2 VAL A 360 19.751 -9.345 0.872 1.00 0.00 C ATOM 0 H VAL A 360 17.927 -10.369 -2.532 1.00 0.00 H new ATOM 0 HA VAL A 360 17.397 -10.575 0.200 1.00 0.00 H new ATOM 0 HB VAL A 360 19.648 -10.695 -0.772 1.00 0.00 H new ATOM 0 HG11 VAL A 360 20.813 -8.661 -1.526 1.00 0.00 H new ATOM 0 HG12 VAL A 360 19.400 -9.033 -2.542 1.00 0.00 H new ATOM 0 HG13 VAL A 360 19.308 -7.733 -1.330 1.00 0.00 H new ATOM 0 HG21 VAL A 360 20.839 -9.279 0.855 1.00 0.00 H new ATOM 0 HG22 VAL A 360 19.334 -8.382 1.166 1.00 0.00 H new ATOM 0 HG23 VAL A 360 19.445 -10.107 1.589 1.00 0.00 H new ATOM 106 N LEU A 361 16.677 -8.377 1.140 1.00 0.00 N ATOM 107 CA LEU A 361 16.077 -7.151 1.659 1.00 0.00 C ATOM 108 C LEU A 361 17.122 -6.049 1.816 1.00 0.00 C ATOM 109 O LEU A 361 18.236 -6.298 2.276 1.00 0.00 O ATOM 110 CB LEU A 361 15.395 -7.409 3.008 1.00 0.00 C ATOM 111 CG LEU A 361 14.177 -8.340 2.968 1.00 0.00 C ATOM 112 CD1 LEU A 361 14.591 -9.761 2.615 1.00 0.00 C ATOM 113 CD2 LEU A 361 13.445 -8.313 4.301 1.00 0.00 C ATOM 0 H LEU A 361 16.736 -9.136 1.819 1.00 0.00 H new ATOM 0 HA LEU A 361 15.329 -6.822 0.938 1.00 0.00 H new ATOM 0 HB2 LEU A 361 16.131 -7.832 3.692 1.00 0.00 H new ATOM 0 HB3 LEU A 361 15.084 -6.452 3.427 1.00 0.00 H new ATOM 0 HG LEU A 361 13.500 -7.982 2.192 1.00 0.00 H new ATOM 0 HD11 LEU A 361 13.710 -10.402 2.593 1.00 0.00 H new ATOM 0 HD12 LEU A 361 15.069 -9.768 1.636 1.00 0.00 H new ATOM 0 HD13 LEU A 361 15.291 -10.133 3.363 1.00 0.00 H new ATOM 0 HD21 LEU A 361 12.583 -8.979 4.256 1.00 0.00 H new ATOM 0 HD22 LEU A 361 14.118 -8.643 5.092 1.00 0.00 H new ATOM 0 HD23 LEU A 361 13.109 -7.298 4.511 1.00 0.00 H new ATOM 125 N THR A 362 16.751 -4.828 1.437 1.00 0.00 N ATOM 126 CA THR A 362 17.651 -3.686 1.543 1.00 0.00 C ATOM 127 C THR A 362 17.994 -3.402 3.002 1.00 0.00 C ATOM 128 O THR A 362 19.138 -3.087 3.331 1.00 0.00 O ATOM 129 CB THR A 362 17.037 -2.423 0.911 1.00 0.00 C ATOM 130 OG1 THR A 362 16.685 -2.680 -0.453 1.00 0.00 O ATOM 131 CG2 THR A 362 18.014 -1.259 0.974 1.00 0.00 C ATOM 0 H THR A 362 15.832 -4.606 1.054 1.00 0.00 H new ATOM 0 HA THR A 362 18.560 -3.942 0.999 1.00 0.00 H new ATOM 0 HB THR A 362 16.142 -2.159 1.475 1.00 0.00 H new ATOM 0 HG1 THR A 362 16.294 -1.873 -0.848 1.00 0.00 H new ATOM 0 HG21 THR A 362 17.559 -0.377 0.522 1.00 0.00 H new ATOM 0 HG22 THR A 362 18.261 -1.047 2.014 1.00 0.00 H new ATOM 0 HG23 THR A 362 18.923 -1.517 0.431 1.00 0.00 H new ATOM 139 N GLN A 363 16.991 -3.525 3.870 1.00 0.00 N ATOM 140 CA GLN A 363 17.168 -3.297 5.302 1.00 0.00 C ATOM 141 C GLN A 363 17.496 -1.835 5.607 1.00 0.00 C ATOM 142 O GLN A 363 18.619 -1.507 5.996 1.00 0.00 O ATOM 143 CB GLN A 363 18.264 -4.214 5.858 1.00 0.00 C ATOM 144 CG GLN A 363 18.435 -4.122 7.367 1.00 0.00 C ATOM 145 CD GLN A 363 17.197 -4.561 8.128 1.00 0.00 C ATOM 146 OE1 GLN A 363 16.126 -3.969 7.992 1.00 0.00 O ATOM 147 NE2 GLN A 363 17.341 -5.606 8.934 1.00 0.00 N ATOM 0 H GLN A 363 16.041 -3.783 3.603 1.00 0.00 H new ATOM 0 HA GLN A 363 16.223 -3.533 5.791 1.00 0.00 H new ATOM 0 HB2 GLN A 363 18.033 -5.245 5.590 1.00 0.00 H new ATOM 0 HB3 GLN A 363 19.211 -3.965 5.379 1.00 0.00 H new ATOM 0 HG2 GLN A 363 19.280 -4.740 7.670 1.00 0.00 H new ATOM 0 HG3 GLN A 363 18.677 -3.095 7.638 1.00 0.00 H new ATOM 0 HE21 GLN A 363 18.248 -6.066 9.016 1.00 0.00 H new ATOM 0 HE22 GLN A 363 16.545 -5.949 9.472 1.00 0.00 H new ATOM 156 N LYS A 364 16.506 -0.961 5.443 1.00 0.00 N ATOM 157 CA LYS A 364 16.687 0.461 5.719 1.00 0.00 C ATOM 158 C LYS A 364 15.345 1.137 5.992 1.00 0.00 C ATOM 159 O LYS A 364 14.408 1.016 5.203 1.00 0.00 O ATOM 160 CB LYS A 364 17.393 1.156 4.551 1.00 0.00 C ATOM 161 CG LYS A 364 16.623 1.099 3.242 1.00 0.00 C ATOM 162 CD LYS A 364 17.314 1.912 2.158 1.00 0.00 C ATOM 163 CE LYS A 364 16.527 1.895 0.858 1.00 0.00 C ATOM 164 NZ LYS A 364 17.207 2.681 -0.209 1.00 0.00 N ATOM 0 H LYS A 364 15.571 -1.212 5.121 1.00 0.00 H new ATOM 0 HA LYS A 364 17.310 0.550 6.609 1.00 0.00 H new ATOM 0 HB2 LYS A 364 17.566 2.200 4.814 1.00 0.00 H new ATOM 0 HB3 LYS A 364 18.371 0.697 4.406 1.00 0.00 H new ATOM 0 HG2 LYS A 364 16.529 0.063 2.918 1.00 0.00 H new ATOM 0 HG3 LYS A 364 15.613 1.478 3.395 1.00 0.00 H new ATOM 0 HD2 LYS A 364 17.436 2.941 2.496 1.00 0.00 H new ATOM 0 HD3 LYS A 364 18.313 1.513 1.984 1.00 0.00 H new ATOM 0 HE2 LYS A 364 16.397 0.865 0.525 1.00 0.00 H new ATOM 0 HE3 LYS A 364 15.531 2.302 1.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 364 16.640 2.646 -1.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 364 17.308 3.669 0.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 364 18.148 2.277 -0.391 1.00 0.00 H new ATOM 178 N HIS A 365 15.269 1.847 7.122 1.00 0.00 N ATOM 179 CA HIS A 365 14.053 2.554 7.533 1.00 0.00 C ATOM 180 C HIS A 365 12.968 1.582 8.003 1.00 0.00 C ATOM 181 O HIS A 365 12.248 1.863 8.961 1.00 0.00 O ATOM 182 CB HIS A 365 13.519 3.434 6.396 1.00 0.00 C ATOM 183 CG HIS A 365 12.286 4.202 6.760 1.00 0.00 C ATOM 184 ND1 HIS A 365 11.058 4.232 6.188 1.00 0.00 N flip ATOM 185 CD2 HIS A 365 12.228 5.071 7.830 1.00 0.00 C flip ATOM 186 CE1 HIS A 365 10.292 5.109 6.916 1.00 0.00 C flip ATOM 187 NE2 HIS A 365 11.019 5.601 7.901 1.00 0.00 N flip ATOM 0 H HIS A 365 16.046 1.947 7.775 1.00 0.00 H new ATOM 0 HA HIS A 365 14.320 3.194 8.374 1.00 0.00 H new ATOM 0 HB2 HIS A 365 14.297 4.135 6.094 1.00 0.00 H new ATOM 0 HB3 HIS A 365 13.303 2.805 5.532 1.00 0.00 H new ATOM 0 HD2 HIS A 365 13.044 5.285 8.505 1.00 0.00 H new ATOM 0 HE1 HIS A 365 9.260 5.356 6.715 1.00 0.00 H new ATOM 0 HE2 HIS A 365 10.702 6.275 8.598 1.00 0.00 H new ATOM 196 N LYS A 366 12.854 0.442 7.328 1.00 0.00 N ATOM 197 CA LYS A 366 11.859 -0.565 7.678 1.00 0.00 C ATOM 198 C LYS A 366 12.097 -1.855 6.898 1.00 0.00 C ATOM 199 O LYS A 366 12.461 -1.816 5.721 1.00 0.00 O ATOM 200 CB LYS A 366 10.446 -0.043 7.402 1.00 0.00 C ATOM 201 CG LYS A 366 10.212 0.350 5.952 1.00 0.00 C ATOM 202 CD LYS A 366 8.773 0.786 5.712 1.00 0.00 C ATOM 203 CE LYS A 366 8.397 1.985 6.569 1.00 0.00 C ATOM 204 NZ LYS A 366 6.993 2.419 6.331 1.00 0.00 N ATOM 0 H LYS A 366 13.441 0.192 6.532 1.00 0.00 H new ATOM 0 HA LYS A 366 11.956 -0.778 8.743 1.00 0.00 H new ATOM 0 HB2 LYS A 366 9.724 -0.810 7.682 1.00 0.00 H new ATOM 0 HB3 LYS A 366 10.257 0.821 8.039 1.00 0.00 H new ATOM 0 HG2 LYS A 366 10.888 1.161 5.681 1.00 0.00 H new ATOM 0 HG3 LYS A 366 10.450 -0.493 5.303 1.00 0.00 H new ATOM 0 HD2 LYS A 366 8.639 1.035 4.659 1.00 0.00 H new ATOM 0 HD3 LYS A 366 8.100 -0.043 5.931 1.00 0.00 H new ATOM 0 HE2 LYS A 366 8.526 1.733 7.622 1.00 0.00 H new ATOM 0 HE3 LYS A 366 9.074 2.812 6.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 366 6.776 3.238 6.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 366 6.876 2.684 5.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 366 6.345 1.639 6.561 1.00 0.00 H new ATOM 218 N PRO A 367 11.903 -3.020 7.545 1.00 0.00 N ATOM 219 CA PRO A 367 12.101 -4.324 6.907 1.00 0.00 C ATOM 220 C PRO A 367 10.975 -4.683 5.940 1.00 0.00 C ATOM 221 O PRO A 367 10.512 -5.824 5.905 1.00 0.00 O ATOM 222 CB PRO A 367 12.117 -5.293 8.090 1.00 0.00 C ATOM 223 CG PRO A 367 11.279 -4.637 9.125 1.00 0.00 C ATOM 224 CD PRO A 367 11.478 -3.156 8.952 1.00 0.00 C ATOM 0 HA PRO A 367 13.007 -4.346 6.302 1.00 0.00 H new ATOM 0 HB2 PRO A 367 11.712 -6.266 7.811 1.00 0.00 H new ATOM 0 HB3 PRO A 367 13.132 -5.462 8.450 1.00 0.00 H new ATOM 0 HG2 PRO A 367 10.230 -4.905 9.003 1.00 0.00 H new ATOM 0 HG3 PRO A 367 11.575 -4.955 10.125 1.00 0.00 H new ATOM 0 HD2 PRO A 367 10.559 -2.603 9.148 1.00 0.00 H new ATOM 0 HD3 PRO A 367 12.233 -2.771 9.637 1.00 0.00 H new ATOM 232 N ALA A 368 10.539 -3.703 5.153 1.00 0.00 N ATOM 233 CA ALA A 368 9.471 -3.913 4.184 1.00 0.00 C ATOM 234 C ALA A 368 9.888 -4.924 3.121 1.00 0.00 C ATOM 235 O ALA A 368 11.031 -4.921 2.662 1.00 0.00 O ATOM 236 CB ALA A 368 9.080 -2.593 3.536 1.00 0.00 C ATOM 0 H ALA A 368 10.911 -2.753 5.169 1.00 0.00 H new ATOM 0 HA ALA A 368 8.607 -4.315 4.712 1.00 0.00 H new ATOM 0 HB1 ALA A 368 8.281 -2.764 2.814 1.00 0.00 H new ATOM 0 HB2 ALA A 368 8.734 -1.900 4.303 1.00 0.00 H new ATOM 0 HB3 ALA A 368 9.945 -2.168 3.026 1.00 0.00 H new ATOM 242 N GLU A 369 8.954 -5.790 2.737 1.00 0.00 N ATOM 243 CA GLU A 369 9.222 -6.812 1.730 1.00 0.00 C ATOM 244 C GLU A 369 9.189 -6.224 0.317 1.00 0.00 C ATOM 245 O GLU A 369 8.654 -6.837 -0.607 1.00 0.00 O ATOM 246 CB GLU A 369 8.203 -7.947 1.852 1.00 0.00 C ATOM 247 CG GLU A 369 6.760 -7.493 1.696 1.00 0.00 C ATOM 248 CD GLU A 369 5.773 -8.637 1.816 1.00 0.00 C ATOM 249 OE1 GLU A 369 5.862 -9.585 1.007 1.00 0.00 O ATOM 250 OE2 GLU A 369 4.913 -8.587 2.719 1.00 0.00 O ATOM 0 H GLU A 369 8.004 -5.804 3.108 1.00 0.00 H new ATOM 0 HA GLU A 369 10.223 -7.206 1.906 1.00 0.00 H new ATOM 0 HB2 GLU A 369 8.421 -8.702 1.096 1.00 0.00 H new ATOM 0 HB3 GLU A 369 8.321 -8.426 2.824 1.00 0.00 H new ATOM 0 HG2 GLU A 369 6.535 -6.743 2.454 1.00 0.00 H new ATOM 0 HG3 GLU A 369 6.637 -7.012 0.726 1.00 0.00 H new ATOM 257 N SER A 370 9.771 -5.036 0.158 1.00 0.00 N ATOM 258 CA SER A 370 9.814 -4.367 -1.139 1.00 0.00 C ATOM 259 C SER A 370 8.416 -4.240 -1.740 1.00 0.00 C ATOM 260 O SER A 370 8.216 -4.492 -2.927 1.00 0.00 O ATOM 261 CB SER A 370 10.728 -5.132 -2.100 1.00 0.00 C ATOM 262 OG SER A 370 12.059 -5.174 -1.613 1.00 0.00 O ATOM 0 H SER A 370 10.220 -4.517 0.913 1.00 0.00 H new ATOM 0 HA SER A 370 10.213 -3.364 -0.987 1.00 0.00 H new ATOM 0 HB2 SER A 370 10.354 -6.147 -2.232 1.00 0.00 H new ATOM 0 HB3 SER A 370 10.711 -4.655 -3.080 1.00 0.00 H new ATOM 0 HG SER A 370 12.623 -5.669 -2.243 1.00 0.00 H new ATOM 268 N GLN A 371 7.454 -3.848 -0.908 1.00 0.00 N ATOM 269 CA GLN A 371 6.071 -3.687 -1.351 1.00 0.00 C ATOM 270 C GLN A 371 5.345 -2.648 -0.504 1.00 0.00 C ATOM 271 O GLN A 371 4.218 -2.872 -0.058 1.00 0.00 O ATOM 272 CB GLN A 371 5.326 -5.025 -1.278 1.00 0.00 C ATOM 273 CG GLN A 371 5.788 -6.050 -2.302 1.00 0.00 C ATOM 274 CD GLN A 371 5.463 -5.642 -3.727 1.00 0.00 C ATOM 275 OE1 GLN A 371 5.903 -4.598 -4.205 1.00 0.00 O ATOM 276 NE2 GLN A 371 4.686 -6.472 -4.414 1.00 0.00 N ATOM 0 H GLN A 371 7.607 -3.636 0.078 1.00 0.00 H new ATOM 0 HA GLN A 371 6.089 -3.343 -2.385 1.00 0.00 H new ATOM 0 HB2 GLN A 371 5.450 -5.444 -0.279 1.00 0.00 H new ATOM 0 HB3 GLN A 371 4.260 -4.843 -1.417 1.00 0.00 H new ATOM 0 HG2 GLN A 371 6.864 -6.194 -2.206 1.00 0.00 H new ATOM 0 HG3 GLN A 371 5.318 -7.010 -2.087 1.00 0.00 H new ATOM 0 HE21 GLN A 371 4.343 -7.328 -3.978 1.00 0.00 H new ATOM 0 HE22 GLN A 371 4.432 -6.253 -5.378 1.00 0.00 H new ATOM 285 N GLN A 372 5.993 -1.509 -0.286 1.00 0.00 N ATOM 286 CA GLN A 372 5.402 -0.437 0.506 1.00 0.00 C ATOM 287 C GLN A 372 4.143 0.096 -0.172 1.00 0.00 C ATOM 288 O GLN A 372 4.141 0.367 -1.372 1.00 0.00 O ATOM 289 CB GLN A 372 6.414 0.692 0.715 1.00 0.00 C ATOM 290 CG GLN A 372 5.912 1.800 1.627 1.00 0.00 C ATOM 291 CD GLN A 372 6.968 2.855 1.897 1.00 0.00 C ATOM 292 OE1 GLN A 372 8.039 2.555 2.423 1.00 0.00 O ATOM 293 NE2 GLN A 372 6.667 4.099 1.543 1.00 0.00 N ATOM 0 H GLN A 372 6.925 -1.305 -0.646 1.00 0.00 H new ATOM 0 HA GLN A 372 5.125 -0.840 1.480 1.00 0.00 H new ATOM 0 HB2 GLN A 372 7.329 0.275 1.135 1.00 0.00 H new ATOM 0 HB3 GLN A 372 6.673 1.120 -0.253 1.00 0.00 H new ATOM 0 HG2 GLN A 372 5.040 2.271 1.174 1.00 0.00 H new ATOM 0 HG3 GLN A 372 5.585 1.367 2.573 1.00 0.00 H new ATOM 0 HE21 GLN A 372 5.766 4.302 1.109 1.00 0.00 H new ATOM 0 HE22 GLN A 372 7.336 4.851 1.705 1.00 0.00 H new ATOM 302 N GLN A 373 3.073 0.232 0.606 1.00 0.00 N ATOM 303 CA GLN A 373 1.800 0.720 0.085 1.00 0.00 C ATOM 304 C GLN A 373 1.912 2.132 -0.467 1.00 0.00 C ATOM 305 O GLN A 373 2.698 2.946 0.018 1.00 0.00 O ATOM 306 CB GLN A 373 0.724 0.670 1.166 1.00 0.00 C ATOM 307 CG GLN A 373 0.291 -0.740 1.506 1.00 0.00 C ATOM 308 CD GLN A 373 -0.772 -0.778 2.584 1.00 0.00 C ATOM 309 OE1 GLN A 373 -1.872 -0.256 2.404 1.00 0.00 O ATOM 310 NE2 GLN A 373 -0.447 -1.393 3.715 1.00 0.00 N ATOM 0 H GLN A 373 3.062 0.011 1.602 1.00 0.00 H new ATOM 0 HA GLN A 373 1.518 0.062 -0.737 1.00 0.00 H new ATOM 0 HB2 GLN A 373 1.099 1.156 2.067 1.00 0.00 H new ATOM 0 HB3 GLN A 373 -0.143 1.240 0.834 1.00 0.00 H new ATOM 0 HG2 GLN A 373 -0.090 -1.226 0.608 1.00 0.00 H new ATOM 0 HG3 GLN A 373 1.158 -1.313 1.835 1.00 0.00 H new ATOM 0 HE21 GLN A 373 0.477 -1.812 3.820 1.00 0.00 H new ATOM 0 HE22 GLN A 373 -1.121 -1.447 4.478 1.00 0.00 H new ATOM 319 N ALA A 374 1.107 2.410 -1.486 1.00 0.00 N ATOM 320 CA ALA A 374 1.092 3.722 -2.121 1.00 0.00 C ATOM 321 C ALA A 374 -0.319 4.301 -2.142 1.00 0.00 C ATOM 322 O ALA A 374 -1.274 3.619 -2.512 1.00 0.00 O ATOM 323 CB ALA A 374 1.649 3.628 -3.534 1.00 0.00 C ATOM 0 H ALA A 374 0.453 1.740 -1.892 1.00 0.00 H new ATOM 0 HA ALA A 374 1.724 4.392 -1.538 1.00 0.00 H new ATOM 0 HB1 ALA A 374 1.633 4.614 -3.998 1.00 0.00 H new ATOM 0 HB2 ALA A 374 2.675 3.261 -3.497 1.00 0.00 H new ATOM 0 HB3 ALA A 374 1.039 2.941 -4.121 1.00 0.00 H new ATOM 329 N ALA A 375 -0.441 5.561 -1.736 1.00 0.00 N ATOM 330 CA ALA A 375 -1.734 6.232 -1.702 1.00 0.00 C ATOM 331 C ALA A 375 -2.371 6.289 -3.088 1.00 0.00 C ATOM 332 O ALA A 375 -2.066 7.172 -3.889 1.00 0.00 O ATOM 333 CB ALA A 375 -1.581 7.635 -1.131 1.00 0.00 C ATOM 0 H ALA A 375 0.341 6.138 -1.426 1.00 0.00 H new ATOM 0 HA ALA A 375 -2.396 5.654 -1.057 1.00 0.00 H new ATOM 0 HB1 ALA A 375 -2.553 8.127 -1.110 1.00 0.00 H new ATOM 0 HB2 ALA A 375 -1.183 7.574 -0.118 1.00 0.00 H new ATOM 0 HB3 ALA A 375 -0.897 8.209 -1.756 1.00 0.00 H new ATOM 339 N GLU A 376 -3.267 5.344 -3.357 1.00 0.00 N ATOM 340 CA GLU A 376 -3.963 5.280 -4.635 1.00 0.00 C ATOM 341 C GLU A 376 -4.995 6.400 -4.732 1.00 0.00 C ATOM 342 O GLU A 376 -4.808 7.476 -4.165 1.00 0.00 O ATOM 343 CB GLU A 376 -4.623 3.907 -4.796 1.00 0.00 C ATOM 344 CG GLU A 376 -3.638 2.753 -4.715 1.00 0.00 C ATOM 345 CD GLU A 376 -4.290 1.409 -4.980 1.00 0.00 C ATOM 346 OE1 GLU A 376 -5.521 1.374 -5.184 1.00 0.00 O ATOM 347 OE2 GLU A 376 -3.566 0.390 -4.983 1.00 0.00 O ATOM 0 H GLU A 376 -3.528 4.608 -2.701 1.00 0.00 H new ATOM 0 HA GLU A 376 -3.245 5.415 -5.444 1.00 0.00 H new ATOM 0 HB2 GLU A 376 -5.381 3.783 -4.023 1.00 0.00 H new ATOM 0 HB3 GLU A 376 -5.138 3.869 -5.756 1.00 0.00 H new ATOM 0 HG2 GLU A 376 -2.837 2.913 -5.437 1.00 0.00 H new ATOM 0 HG3 GLU A 376 -3.179 2.741 -3.727 1.00 0.00 H new ATOM 354 N THR A 377 -6.079 6.144 -5.451 1.00 0.00 N ATOM 355 CA THR A 377 -7.133 7.129 -5.624 1.00 0.00 C ATOM 356 C THR A 377 -8.490 6.449 -5.654 1.00 0.00 C ATOM 357 O THR A 377 -8.599 5.287 -6.040 1.00 0.00 O ATOM 358 CB THR A 377 -6.934 7.942 -6.915 1.00 0.00 C ATOM 359 OG1 THR A 377 -6.973 7.074 -8.055 1.00 0.00 O ATOM 360 CG2 THR A 377 -5.606 8.681 -6.877 1.00 0.00 C ATOM 0 H THR A 377 -6.250 5.257 -5.925 1.00 0.00 H new ATOM 0 HA THR A 377 -7.088 7.813 -4.777 1.00 0.00 H new ATOM 0 HB THR A 377 -7.741 8.671 -6.992 1.00 0.00 H new ATOM 0 HG1 THR A 377 -6.888 6.143 -7.760 1.00 0.00 H new ATOM 0 HG21 THR A 377 -5.480 9.251 -7.797 1.00 0.00 H new ATOM 0 HG22 THR A 377 -5.592 9.360 -6.025 1.00 0.00 H new ATOM 0 HG23 THR A 377 -4.792 7.962 -6.782 1.00 0.00 H new ATOM 368 N GLU A 378 -9.516 7.171 -5.221 1.00 0.00 N ATOM 369 CA GLU A 378 -10.866 6.628 -5.176 1.00 0.00 C ATOM 370 C GLU A 378 -11.198 5.891 -6.464 1.00 0.00 C ATOM 371 O GLU A 378 -11.810 4.826 -6.443 1.00 0.00 O ATOM 372 CB GLU A 378 -11.882 7.746 -4.938 1.00 0.00 C ATOM 373 CG GLU A 378 -13.306 7.245 -4.760 1.00 0.00 C ATOM 374 CD GLU A 378 -14.302 8.372 -4.577 1.00 0.00 C ATOM 375 OE1 GLU A 378 -14.402 9.230 -5.478 1.00 0.00 O ATOM 376 OE2 GLU A 378 -14.986 8.395 -3.531 1.00 0.00 O ATOM 0 H GLU A 378 -9.438 8.135 -4.896 1.00 0.00 H new ATOM 0 HA GLU A 378 -10.917 5.919 -4.349 1.00 0.00 H new ATOM 0 HB2 GLU A 378 -11.590 8.309 -4.051 1.00 0.00 H new ATOM 0 HB3 GLU A 378 -11.852 8.439 -5.779 1.00 0.00 H new ATOM 0 HG2 GLU A 378 -13.590 6.652 -5.629 1.00 0.00 H new ATOM 0 HG3 GLU A 378 -13.349 6.583 -3.895 1.00 0.00 H new ATOM 383 N GLY A 379 -10.790 6.468 -7.582 1.00 0.00 N ATOM 384 CA GLY A 379 -11.057 5.857 -8.866 1.00 0.00 C ATOM 385 C GLY A 379 -10.374 4.519 -9.055 1.00 0.00 C ATOM 386 O GLY A 379 -10.957 3.601 -9.632 1.00 0.00 O ATOM 0 H GLY A 379 -10.278 7.349 -7.624 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -12.133 5.725 -8.979 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -10.734 6.535 -9.656 1.00 0.00 H new ATOM 390 N SER A 380 -9.136 4.403 -8.592 1.00 0.00 N ATOM 391 CA SER A 380 -8.394 3.159 -8.746 1.00 0.00 C ATOM 392 C SER A 380 -8.848 2.092 -7.751 1.00 0.00 C ATOM 393 O SER A 380 -9.033 0.929 -8.117 1.00 0.00 O ATOM 394 CB SER A 380 -6.896 3.414 -8.579 1.00 0.00 C ATOM 395 OG SER A 380 -6.602 3.907 -7.284 1.00 0.00 O ATOM 0 H SER A 380 -8.629 5.147 -8.112 1.00 0.00 H new ATOM 0 HA SER A 380 -8.595 2.785 -9.750 1.00 0.00 H new ATOM 0 HB2 SER A 380 -6.345 2.489 -8.753 1.00 0.00 H new ATOM 0 HB3 SER A 380 -6.561 4.131 -9.329 1.00 0.00 H new ATOM 0 HG SER A 380 -7.387 4.371 -6.925 1.00 0.00 H new ATOM 401 N CYS A 381 -8.996 2.479 -6.489 1.00 0.00 N ATOM 402 CA CYS A 381 -9.382 1.534 -5.449 1.00 0.00 C ATOM 403 C CYS A 381 -10.732 0.878 -5.720 1.00 0.00 C ATOM 404 O CYS A 381 -10.914 -0.300 -5.416 1.00 0.00 O ATOM 405 CB CYS A 381 -9.385 2.193 -4.076 1.00 0.00 C ATOM 406 SG CYS A 381 -8.871 1.048 -2.759 1.00 0.00 S ATOM 0 H CYS A 381 -8.855 3.435 -6.163 1.00 0.00 H new ATOM 0 HA CYS A 381 -8.629 0.746 -5.461 1.00 0.00 H new ATOM 0 HB2 CYS A 381 -8.716 3.054 -4.087 1.00 0.00 H new ATOM 0 HB3 CYS A 381 -10.385 2.569 -3.858 1.00 0.00 H new ATOM 411 N ASN A 382 -11.675 1.624 -6.291 1.00 0.00 N ATOM 412 CA ASN A 382 -12.987 1.059 -6.593 1.00 0.00 C ATOM 413 C ASN A 382 -12.812 -0.213 -7.406 1.00 0.00 C ATOM 414 O ASN A 382 -13.645 -1.120 -7.367 1.00 0.00 O ATOM 415 CB ASN A 382 -13.859 2.057 -7.361 1.00 0.00 C ATOM 416 CG ASN A 382 -14.150 3.318 -6.573 1.00 0.00 C ATOM 417 OD1 ASN A 382 -13.656 3.381 -5.343 1.00 0.00 O flip ATOM 418 ND2 ASN A 382 -14.819 4.227 -7.064 1.00 0.00 N flip ATOM 0 H ASN A 382 -11.559 2.604 -6.550 1.00 0.00 H new ATOM 0 HA ASN A 382 -13.490 0.831 -5.654 1.00 0.00 H new ATOM 0 HB2 ASN A 382 -13.361 2.324 -8.293 1.00 0.00 H new ATOM 0 HB3 ASN A 382 -14.800 1.577 -7.629 1.00 0.00 H new ATOM 0 HD21 ASN A 382 -15.180 4.139 -8.014 1.00 0.00 H new ATOM 0 HD22 ASN A 382 -15.012 5.069 -6.521 1.00 0.00 H new ATOM 425 N LYS A 383 -11.707 -0.263 -8.138 1.00 0.00 N ATOM 426 CA LYS A 383 -11.377 -1.407 -8.964 1.00 0.00 C ATOM 427 C LYS A 383 -10.635 -2.461 -8.148 1.00 0.00 C ATOM 428 O LYS A 383 -10.746 -3.657 -8.416 1.00 0.00 O ATOM 429 CB LYS A 383 -10.528 -0.959 -10.152 1.00 0.00 C ATOM 430 CG LYS A 383 -11.105 0.244 -10.887 1.00 0.00 C ATOM 431 CD LYS A 383 -12.517 -0.024 -11.392 1.00 0.00 C ATOM 432 CE LYS A 383 -12.547 -1.176 -12.385 1.00 0.00 C ATOM 433 NZ LYS A 383 -13.928 -1.466 -12.860 1.00 0.00 N ATOM 0 H LYS A 383 -11.018 0.489 -8.173 1.00 0.00 H new ATOM 0 HA LYS A 383 -12.301 -1.851 -9.335 1.00 0.00 H new ATOM 0 HB2 LYS A 383 -9.525 -0.715 -9.801 1.00 0.00 H new ATOM 0 HB3 LYS A 383 -10.428 -1.789 -10.851 1.00 0.00 H new ATOM 0 HG2 LYS A 383 -11.115 1.106 -10.220 1.00 0.00 H new ATOM 0 HG3 LYS A 383 -10.461 0.499 -11.728 1.00 0.00 H new ATOM 0 HD2 LYS A 383 -13.168 -0.253 -10.549 1.00 0.00 H new ATOM 0 HD3 LYS A 383 -12.912 0.875 -11.865 1.00 0.00 H new ATOM 0 HE2 LYS A 383 -11.913 -0.936 -13.238 1.00 0.00 H new ATOM 0 HE3 LYS A 383 -12.129 -2.068 -11.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 383 -13.904 -2.257 -13.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 383 -14.528 -1.720 -12.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 383 -14.318 -0.623 -13.328 1.00 0.00 H new ATOM 447 N LYS A 384 -9.875 -2.007 -7.148 1.00 0.00 N ATOM 448 CA LYS A 384 -9.116 -2.905 -6.296 1.00 0.00 C ATOM 449 C LYS A 384 -10.014 -3.946 -5.634 1.00 0.00 C ATOM 450 O LYS A 384 -10.976 -3.602 -4.947 1.00 0.00 O ATOM 451 CB LYS A 384 -8.384 -2.092 -5.230 1.00 0.00 C ATOM 452 CG LYS A 384 -7.042 -1.520 -5.676 1.00 0.00 C ATOM 453 CD LYS A 384 -7.102 -0.875 -7.054 1.00 0.00 C ATOM 454 CE LYS A 384 -6.725 -1.855 -8.156 1.00 0.00 C ATOM 455 NZ LYS A 384 -6.750 -1.214 -9.500 1.00 0.00 N ATOM 0 H LYS A 384 -9.774 -1.019 -6.914 1.00 0.00 H new ATOM 0 HA LYS A 384 -8.396 -3.439 -6.917 1.00 0.00 H new ATOM 0 HB2 LYS A 384 -9.027 -1.271 -4.914 1.00 0.00 H new ATOM 0 HB3 LYS A 384 -8.222 -2.725 -4.357 1.00 0.00 H new ATOM 0 HG2 LYS A 384 -6.708 -0.780 -4.948 1.00 0.00 H new ATOM 0 HG3 LYS A 384 -6.298 -2.317 -5.685 1.00 0.00 H new ATOM 0 HD2 LYS A 384 -8.108 -0.496 -7.234 1.00 0.00 H new ATOM 0 HD3 LYS A 384 -6.428 -0.019 -7.084 1.00 0.00 H new ATOM 0 HE2 LYS A 384 -5.729 -2.254 -7.962 1.00 0.00 H new ATOM 0 HE3 LYS A 384 -7.415 -2.699 -8.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 384 -7.061 -1.908 -10.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 384 -7.410 -0.410 -9.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 384 -5.797 -0.876 -9.741 1.00 0.00 H new ATOM 469 N ASP A 385 -9.678 -5.221 -5.828 1.00 0.00 N ATOM 470 CA ASP A 385 -10.438 -6.311 -5.231 1.00 0.00 C ATOM 471 C ASP A 385 -10.340 -6.231 -3.713 1.00 0.00 C ATOM 472 O ASP A 385 -9.662 -5.355 -3.186 1.00 0.00 O ATOM 473 CB ASP A 385 -9.913 -7.664 -5.720 1.00 0.00 C ATOM 474 CG ASP A 385 -10.012 -7.818 -7.226 1.00 0.00 C ATOM 475 OD1 ASP A 385 -10.510 -6.885 -7.890 1.00 0.00 O ATOM 476 OD2 ASP A 385 -9.595 -8.877 -7.741 1.00 0.00 O ATOM 0 H ASP A 385 -8.884 -5.521 -6.394 1.00 0.00 H new ATOM 0 HA ASP A 385 -11.482 -6.218 -5.531 1.00 0.00 H new ATOM 0 HB2 ASP A 385 -8.873 -7.778 -5.414 1.00 0.00 H new ATOM 0 HB3 ASP A 385 -10.476 -8.464 -5.239 1.00 0.00 H new ATOM 481 N GLN A 386 -11.014 -7.137 -3.012 1.00 0.00 N ATOM 482 CA GLN A 386 -10.985 -7.136 -1.551 1.00 0.00 C ATOM 483 C GLN A 386 -9.550 -7.068 -1.033 1.00 0.00 C ATOM 484 O GLN A 386 -9.203 -6.177 -0.260 1.00 0.00 O ATOM 485 CB GLN A 386 -11.686 -8.379 -1.002 1.00 0.00 C ATOM 486 CG GLN A 386 -11.768 -8.412 0.515 1.00 0.00 C ATOM 487 CD GLN A 386 -12.533 -9.614 1.033 1.00 0.00 C ATOM 488 OE1 GLN A 386 -12.158 -10.758 0.782 1.00 0.00 O ATOM 489 NE2 GLN A 386 -13.614 -9.357 1.760 1.00 0.00 N ATOM 0 H GLN A 386 -11.583 -7.876 -3.426 1.00 0.00 H new ATOM 0 HA GLN A 386 -11.516 -6.250 -1.204 1.00 0.00 H new ATOM 0 HB2 GLN A 386 -12.694 -8.428 -1.413 1.00 0.00 H new ATOM 0 HB3 GLN A 386 -11.157 -9.267 -1.348 1.00 0.00 H new ATOM 0 HG2 GLN A 386 -10.760 -8.422 0.929 1.00 0.00 H new ATOM 0 HG3 GLN A 386 -12.249 -7.500 0.869 1.00 0.00 H new ATOM 0 HE21 GLN A 386 -13.888 -8.392 1.943 1.00 0.00 H new ATOM 0 HE22 GLN A 386 -14.171 -10.125 2.135 1.00 0.00 H new ATOM 498 N ASN A 387 -8.715 -8.002 -1.478 1.00 0.00 N ATOM 499 CA ASN A 387 -7.318 -8.035 -1.069 1.00 0.00 C ATOM 500 C ASN A 387 -6.596 -6.768 -1.518 1.00 0.00 C ATOM 501 O ASN A 387 -5.703 -6.269 -0.833 1.00 0.00 O ATOM 502 CB ASN A 387 -6.635 -9.269 -1.659 1.00 0.00 C ATOM 503 CG ASN A 387 -5.148 -9.292 -1.393 1.00 0.00 C ATOM 504 OD1 ASN A 387 -4.708 -9.294 -0.244 1.00 0.00 O ATOM 505 ND2 ASN A 387 -4.363 -9.309 -2.461 1.00 0.00 N ATOM 0 H ASN A 387 -8.983 -8.746 -2.122 1.00 0.00 H new ATOM 0 HA ASN A 387 -7.273 -8.087 0.019 1.00 0.00 H new ATOM 0 HB2 ASN A 387 -7.089 -10.167 -1.240 1.00 0.00 H new ATOM 0 HB3 ASN A 387 -6.809 -9.296 -2.735 1.00 0.00 H new ATOM 0 HD21 ASN A 387 -3.349 -9.325 -2.349 1.00 0.00 H new ATOM 0 HD22 ASN A 387 -4.773 -9.307 -3.395 1.00 0.00 H new ATOM 512 N GLU A 388 -6.999 -6.256 -2.673 1.00 0.00 N ATOM 513 CA GLU A 388 -6.412 -5.046 -3.236 1.00 0.00 C ATOM 514 C GLU A 388 -6.788 -3.826 -2.422 1.00 0.00 C ATOM 515 O GLU A 388 -6.015 -2.873 -2.334 1.00 0.00 O ATOM 516 CB GLU A 388 -6.880 -4.871 -4.663 1.00 0.00 C ATOM 517 CG GLU A 388 -6.558 -6.058 -5.535 1.00 0.00 C ATOM 518 CD GLU A 388 -5.074 -6.202 -5.806 1.00 0.00 C ATOM 519 OE1 GLU A 388 -4.481 -5.265 -6.381 1.00 0.00 O ATOM 520 OE2 GLU A 388 -4.504 -7.252 -5.441 1.00 0.00 O ATOM 0 H GLU A 388 -7.738 -6.665 -3.244 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.327 -5.149 -3.213 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -7.957 -4.704 -4.669 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.416 -3.980 -5.086 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -6.925 -6.966 -5.055 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -7.088 -5.961 -6.483 1.00 0.00 H new ATOM 527 N CYS A 389 -7.981 -3.869 -1.835 1.00 0.00 N ATOM 528 CA CYS A 389 -8.480 -2.767 -1.017 1.00 0.00 C ATOM 529 C CYS A 389 -7.348 -2.234 -0.154 1.00 0.00 C ATOM 530 O CYS A 389 -7.019 -2.801 0.888 1.00 0.00 O ATOM 531 CB CYS A 389 -9.642 -3.247 -0.149 1.00 0.00 C ATOM 532 SG CYS A 389 -10.644 -1.903 0.557 1.00 0.00 S ATOM 0 H CYS A 389 -8.622 -4.658 -1.911 1.00 0.00 H new ATOM 0 HA CYS A 389 -8.844 -1.965 -1.660 1.00 0.00 H new ATOM 0 HB2 CYS A 389 -10.287 -3.891 -0.747 1.00 0.00 H new ATOM 0 HB3 CYS A 389 -9.247 -3.857 0.663 1.00 0.00 H new ATOM 537 N LYS A 390 -6.727 -1.166 -0.632 1.00 0.00 N ATOM 538 CA LYS A 390 -5.587 -0.569 0.050 1.00 0.00 C ATOM 539 C LYS A 390 -5.978 0.120 1.353 1.00 0.00 C ATOM 540 O LYS A 390 -7.145 0.432 1.585 1.00 0.00 O ATOM 541 CB LYS A 390 -4.881 0.398 -0.890 1.00 0.00 C ATOM 542 CG LYS A 390 -4.263 -0.296 -2.097 1.00 0.00 C ATOM 543 CD LYS A 390 -3.025 -1.094 -1.714 1.00 0.00 C ATOM 544 CE LYS A 390 -1.921 -0.195 -1.181 1.00 0.00 C ATOM 545 NZ LYS A 390 -1.484 0.808 -2.191 1.00 0.00 N ATOM 0 H LYS A 390 -6.995 -0.692 -1.495 1.00 0.00 H new ATOM 0 HA LYS A 390 -4.904 -1.373 0.325 1.00 0.00 H new ATOM 0 HB2 LYS A 390 -5.593 1.148 -1.233 1.00 0.00 H new ATOM 0 HB3 LYS A 390 -4.101 0.926 -0.342 1.00 0.00 H new ATOM 0 HG2 LYS A 390 -4.998 -0.960 -2.551 1.00 0.00 H new ATOM 0 HG3 LYS A 390 -3.999 0.448 -2.849 1.00 0.00 H new ATOM 0 HD2 LYS A 390 -3.288 -1.834 -0.959 1.00 0.00 H new ATOM 0 HD3 LYS A 390 -2.661 -1.641 -2.584 1.00 0.00 H new ATOM 0 HE2 LYS A 390 -2.272 0.320 -0.287 1.00 0.00 H new ATOM 0 HE3 LYS A 390 -1.068 -0.805 -0.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 390 -0.540 0.554 -2.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 390 -2.160 0.822 -2.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 390 -1.447 1.750 -1.751 1.00 0.00 H new ATOM 559 N SER A 391 -4.980 0.325 2.209 1.00 0.00 N ATOM 560 CA SER A 391 -5.188 0.950 3.515 1.00 0.00 C ATOM 561 C SER A 391 -5.818 2.339 3.392 1.00 0.00 C ATOM 562 O SER A 391 -6.832 2.613 4.035 1.00 0.00 O ATOM 563 CB SER A 391 -3.867 1.036 4.282 1.00 0.00 C ATOM 564 OG SER A 391 -4.056 1.629 5.556 1.00 0.00 O ATOM 0 H SER A 391 -4.012 0.066 2.021 1.00 0.00 H new ATOM 0 HA SER A 391 -5.885 0.320 4.069 1.00 0.00 H new ATOM 0 HB2 SER A 391 -3.446 0.038 4.401 1.00 0.00 H new ATOM 0 HB3 SER A 391 -3.147 1.620 3.709 1.00 0.00 H new ATOM 0 HG SER A 391 -3.198 1.671 6.028 1.00 0.00 H new ATOM 570 N PRO A 392 -5.245 3.241 2.564 1.00 0.00 N ATOM 571 CA PRO A 392 -5.791 4.584 2.384 1.00 0.00 C ATOM 572 C PRO A 392 -7.271 4.530 2.027 1.00 0.00 C ATOM 573 O PRO A 392 -8.020 5.479 2.256 1.00 0.00 O ATOM 574 CB PRO A 392 -4.966 5.164 1.224 1.00 0.00 C ATOM 575 CG PRO A 392 -4.226 4.021 0.633 1.00 0.00 C ATOM 576 CD PRO A 392 -4.046 3.038 1.741 1.00 0.00 C ATOM 0 HA PRO A 392 -5.727 5.188 3.289 1.00 0.00 H new ATOM 0 HB2 PRO A 392 -5.612 5.635 0.483 1.00 0.00 H new ATOM 0 HB3 PRO A 392 -4.278 5.931 1.580 1.00 0.00 H new ATOM 0 HG2 PRO A 392 -4.782 3.580 -0.194 1.00 0.00 H new ATOM 0 HG3 PRO A 392 -3.264 4.342 0.235 1.00 0.00 H new ATOM 0 HD2 PRO A 392 -3.982 2.016 1.367 1.00 0.00 H new ATOM 0 HD3 PRO A 392 -3.133 3.229 2.305 1.00 0.00 H new ATOM 584 N CYS A 393 -7.675 3.397 1.466 1.00 0.00 N ATOM 585 CA CYS A 393 -9.057 3.172 1.069 1.00 0.00 C ATOM 586 C CYS A 393 -9.927 2.843 2.278 1.00 0.00 C ATOM 587 O CYS A 393 -9.628 3.240 3.405 1.00 0.00 O ATOM 588 CB CYS A 393 -9.108 2.016 0.071 1.00 0.00 C ATOM 589 SG CYS A 393 -8.024 2.239 -1.370 1.00 0.00 S ATOM 0 H CYS A 393 -7.054 2.611 1.274 1.00 0.00 H new ATOM 0 HA CYS A 393 -9.442 4.082 0.610 1.00 0.00 H new ATOM 0 HB2 CYS A 393 -8.831 1.095 0.583 1.00 0.00 H new ATOM 0 HB3 CYS A 393 -10.134 1.892 -0.274 1.00 0.00 H new ATOM 594 N LYS A 394 -10.994 2.099 2.026 1.00 0.00 N ATOM 595 CA LYS A 394 -11.917 1.680 3.072 1.00 0.00 C ATOM 596 C LYS A 394 -12.843 0.595 2.541 1.00 0.00 C ATOM 597 O LYS A 394 -13.564 0.798 1.562 1.00 0.00 O ATOM 598 CB LYS A 394 -12.720 2.875 3.595 1.00 0.00 C ATOM 599 CG LYS A 394 -13.667 2.523 4.734 1.00 0.00 C ATOM 600 CD LYS A 394 -14.265 3.769 5.376 1.00 0.00 C ATOM 601 CE LYS A 394 -15.083 4.580 4.382 1.00 0.00 C ATOM 602 NZ LYS A 394 -15.659 5.803 5.006 1.00 0.00 N ATOM 0 H LYS A 394 -11.244 1.769 1.094 1.00 0.00 H new ATOM 0 HA LYS A 394 -11.344 1.272 3.905 1.00 0.00 H new ATOM 0 HB2 LYS A 394 -12.028 3.646 3.934 1.00 0.00 H new ATOM 0 HB3 LYS A 394 -13.296 3.302 2.774 1.00 0.00 H new ATOM 0 HG2 LYS A 394 -14.468 1.887 4.357 1.00 0.00 H new ATOM 0 HG3 LYS A 394 -13.131 1.947 5.488 1.00 0.00 H new ATOM 0 HD2 LYS A 394 -14.897 3.478 6.215 1.00 0.00 H new ATOM 0 HD3 LYS A 394 -13.465 4.389 5.780 1.00 0.00 H new ATOM 0 HE2 LYS A 394 -14.453 4.864 3.539 1.00 0.00 H new ATOM 0 HE3 LYS A 394 -15.888 3.962 3.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 394 -16.209 6.328 4.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 394 -16.280 5.531 5.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 394 -14.890 6.405 5.363 1.00 0.00 H new ATOM 616 N TRP A 395 -12.795 -0.567 3.182 1.00 0.00 N ATOM 617 CA TRP A 395 -13.602 -1.708 2.773 1.00 0.00 C ATOM 618 C TRP A 395 -15.078 -1.502 3.096 1.00 0.00 C ATOM 619 O TRP A 395 -15.423 -0.910 4.120 1.00 0.00 O ATOM 620 CB TRP A 395 -13.094 -2.981 3.452 1.00 0.00 C ATOM 621 CG TRP A 395 -13.728 -4.232 2.924 1.00 0.00 C ATOM 622 CD1 TRP A 395 -14.339 -5.213 3.653 1.00 0.00 C ATOM 623 CD2 TRP A 395 -13.806 -4.643 1.553 1.00 0.00 C ATOM 624 NE1 TRP A 395 -14.795 -6.205 2.818 1.00 0.00 N ATOM 625 CE2 TRP A 395 -14.480 -5.878 1.525 1.00 0.00 C ATOM 626 CE3 TRP A 395 -13.375 -4.084 0.345 1.00 0.00 C ATOM 627 CZ2 TRP A 395 -14.731 -6.562 0.339 1.00 0.00 C ATOM 628 CZ3 TRP A 395 -13.624 -4.766 -0.831 1.00 0.00 C ATOM 629 CH2 TRP A 395 -14.297 -5.993 -0.826 1.00 0.00 C ATOM 0 H TRP A 395 -12.201 -0.743 3.992 1.00 0.00 H new ATOM 0 HA TRP A 395 -13.508 -1.808 1.692 1.00 0.00 H new ATOM 0 HB2 TRP A 395 -12.014 -3.047 3.321 1.00 0.00 H new ATOM 0 HB3 TRP A 395 -13.282 -2.912 4.523 1.00 0.00 H new ATOM 0 HD1 TRP A 395 -14.448 -5.209 4.728 1.00 0.00 H new ATOM 0 HE1 TRP A 395 -15.288 -7.048 3.113 1.00 0.00 H new ATOM 0 HE3 TRP A 395 -12.857 -3.136 0.332 1.00 0.00 H new ATOM 0 HZ2 TRP A 395 -15.250 -7.509 0.339 1.00 0.00 H new ATOM 0 HZ3 TRP A 395 -13.294 -4.345 -1.769 1.00 0.00 H new ATOM 0 HH2 TRP A 395 -14.477 -6.501 -1.762 1.00 0.00 H new ATOM 640 N HIS A 396 -15.944 -2.007 2.222 1.00 0.00 N ATOM 641 CA HIS A 396 -17.384 -1.895 2.419 1.00 0.00 C ATOM 642 C HIS A 396 -18.045 -3.267 2.325 1.00 0.00 C ATOM 643 O HIS A 396 -18.061 -3.892 1.261 1.00 0.00 O ATOM 644 CB HIS A 396 -17.996 -0.948 1.386 1.00 0.00 C ATOM 645 CG HIS A 396 -17.507 0.462 1.505 1.00 0.00 C ATOM 646 ND1 HIS A 396 -17.663 1.220 2.646 1.00 0.00 N ATOM 647 CD2 HIS A 396 -16.864 1.254 0.615 1.00 0.00 C ATOM 648 CE1 HIS A 396 -17.138 2.416 2.454 1.00 0.00 C ATOM 649 NE2 HIS A 396 -16.647 2.464 1.229 1.00 0.00 N ATOM 0 H HIS A 396 -15.672 -2.498 1.370 1.00 0.00 H new ATOM 0 HA HIS A 396 -17.560 -1.488 3.415 1.00 0.00 H new ATOM 0 HB2 HIS A 396 -17.771 -1.319 0.386 1.00 0.00 H new ATOM 0 HB3 HIS A 396 -19.081 -0.958 1.493 1.00 0.00 H new ATOM 0 HD2 HIS A 396 -16.575 0.985 -0.390 1.00 0.00 H new ATOM 0 HE1 HIS A 396 -17.114 3.219 3.176 1.00 0.00 H new ATOM 0 HE2 HIS A 396 -16.182 3.268 0.807 1.00 0.00 H new ATOM 658 N ASN A 397 -18.586 -3.724 3.453 1.00 0.00 N ATOM 659 CA ASN A 397 -19.252 -5.019 3.530 1.00 0.00 C ATOM 660 C ASN A 397 -20.704 -4.924 3.072 1.00 0.00 C ATOM 661 O ASN A 397 -21.360 -3.899 3.264 1.00 0.00 O ATOM 662 CB ASN A 397 -19.191 -5.561 4.959 1.00 0.00 C ATOM 663 CG ASN A 397 -19.843 -4.627 5.959 1.00 0.00 C ATOM 664 OD1 ASN A 397 -19.418 -3.485 6.127 1.00 0.00 O ATOM 665 ND2 ASN A 397 -20.883 -5.109 6.630 1.00 0.00 N ATOM 0 H ASN A 397 -18.574 -3.209 4.333 1.00 0.00 H new ATOM 0 HA ASN A 397 -18.729 -5.704 2.862 1.00 0.00 H new ATOM 0 HB2 ASN A 397 -19.684 -6.532 4.998 1.00 0.00 H new ATOM 0 HB3 ASN A 397 -18.150 -5.721 5.240 1.00 0.00 H new ATOM 0 HD21 ASN A 397 -21.362 -4.526 7.316 1.00 0.00 H new ATOM 0 HD22 ASN A 397 -21.203 -6.062 6.459 1.00 0.00 H new ATOM 672 N ASP A 398 -21.196 -6.003 2.470 1.00 0.00 N ATOM 673 CA ASP A 398 -22.571 -6.056 1.982 1.00 0.00 C ATOM 674 C ASP A 398 -22.841 -4.935 0.985 1.00 0.00 C ATOM 675 O ASP A 398 -23.949 -4.404 0.913 1.00 0.00 O ATOM 676 CB ASP A 398 -23.558 -5.967 3.150 1.00 0.00 C ATOM 677 CG ASP A 398 -23.410 -7.120 4.127 1.00 0.00 C ATOM 678 OD1 ASP A 398 -22.546 -7.991 3.893 1.00 0.00 O ATOM 679 OD2 ASP A 398 -24.160 -7.150 5.125 1.00 0.00 O ATOM 0 H ASP A 398 -20.661 -6.856 2.308 1.00 0.00 H new ATOM 0 HA ASP A 398 -22.709 -7.010 1.473 1.00 0.00 H new ATOM 0 HB2 ASP A 398 -23.406 -5.026 3.678 1.00 0.00 H new ATOM 0 HB3 ASP A 398 -24.576 -5.954 2.761 1.00 0.00 H new ATOM 684 N ALA A 399 -21.818 -4.585 0.214 1.00 0.00 N ATOM 685 CA ALA A 399 -21.936 -3.534 -0.788 1.00 0.00 C ATOM 686 C ALA A 399 -22.546 -4.074 -2.073 1.00 0.00 C ATOM 687 O ALA A 399 -22.093 -3.748 -3.171 1.00 0.00 O ATOM 688 CB ALA A 399 -20.575 -2.928 -1.067 1.00 0.00 C ATOM 0 H ALA A 399 -20.895 -5.016 0.265 1.00 0.00 H new ATOM 0 HA ALA A 399 -22.597 -2.760 -0.398 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -20.673 -2.143 -1.817 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -20.171 -2.503 -0.148 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -19.901 -3.701 -1.437 1.00 0.00 H new ATOM 694 N GLU A 400 -23.565 -4.914 -1.919 1.00 0.00 N ATOM 695 CA GLU A 400 -24.253 -5.535 -3.044 1.00 0.00 C ATOM 696 C GLU A 400 -23.395 -6.639 -3.653 1.00 0.00 C ATOM 697 O GLU A 400 -23.911 -7.578 -4.261 1.00 0.00 O ATOM 698 CB GLU A 400 -24.617 -4.495 -4.105 1.00 0.00 C ATOM 699 CG GLU A 400 -25.457 -5.059 -5.234 1.00 0.00 C ATOM 700 CD GLU A 400 -25.812 -4.017 -6.276 1.00 0.00 C ATOM 701 OE1 GLU A 400 -24.883 -3.446 -6.886 1.00 0.00 O ATOM 702 OE2 GLU A 400 -27.019 -3.771 -6.481 1.00 0.00 O ATOM 0 H GLU A 400 -23.937 -5.183 -1.008 1.00 0.00 H new ATOM 0 HA GLU A 400 -25.177 -5.978 -2.672 1.00 0.00 H new ATOM 0 HB2 GLU A 400 -25.160 -3.677 -3.631 1.00 0.00 H new ATOM 0 HB3 GLU A 400 -23.701 -4.072 -4.519 1.00 0.00 H new ATOM 0 HG2 GLU A 400 -24.915 -5.875 -5.712 1.00 0.00 H new ATOM 0 HG3 GLU A 400 -26.373 -5.483 -4.823 1.00 0.00 H new ATOM 709 N ASN A 401 -22.081 -6.517 -3.477 1.00 0.00 N ATOM 710 CA ASN A 401 -21.138 -7.495 -3.999 1.00 0.00 C ATOM 711 C ASN A 401 -19.722 -7.150 -3.549 1.00 0.00 C ATOM 712 O ASN A 401 -18.752 -7.402 -4.265 1.00 0.00 O ATOM 713 CB ASN A 401 -21.219 -7.524 -5.523 1.00 0.00 C ATOM 714 CG ASN A 401 -20.795 -6.208 -6.149 1.00 0.00 C ATOM 715 OD1 ASN A 401 -21.767 -5.453 -6.642 1.00 0.00 O flip ATOM 716 ND2 ASN A 401 -19.613 -5.865 -6.169 1.00 0.00 N flip ATOM 0 H ASN A 401 -21.646 -5.744 -2.973 1.00 0.00 H new ATOM 0 HA ASN A 401 -21.393 -8.482 -3.612 1.00 0.00 H new ATOM 0 HB2 ASN A 401 -20.585 -8.325 -5.903 1.00 0.00 H new ATOM 0 HB3 ASN A 401 -22.240 -7.755 -5.826 1.00 0.00 H new ATOM 0 HD21 ASN A 401 -18.897 -6.478 -5.778 1.00 0.00 H new ATOM 0 HD22 ASN A 401 -19.349 -4.968 -6.576 1.00 0.00 H new ATOM 723 N LYS A 402 -19.625 -6.567 -2.355 1.00 0.00 N ATOM 724 CA LYS A 402 -18.342 -6.163 -1.782 1.00 0.00 C ATOM 725 C LYS A 402 -17.708 -5.060 -2.627 1.00 0.00 C ATOM 726 O LYS A 402 -17.562 -5.206 -3.841 1.00 0.00 O ATOM 727 CB LYS A 402 -17.387 -7.362 -1.677 1.00 0.00 C ATOM 728 CG LYS A 402 -17.822 -8.427 -0.674 1.00 0.00 C ATOM 729 CD LYS A 402 -19.074 -9.162 -1.129 1.00 0.00 C ATOM 730 CE LYS A 402 -19.491 -10.228 -0.128 1.00 0.00 C ATOM 731 NZ LYS A 402 -20.706 -10.963 -0.575 1.00 0.00 N ATOM 0 H LYS A 402 -20.428 -6.362 -1.761 1.00 0.00 H new ATOM 0 HA LYS A 402 -18.524 -5.780 -0.778 1.00 0.00 H new ATOM 0 HB2 LYS A 402 -17.292 -7.823 -2.660 1.00 0.00 H new ATOM 0 HB3 LYS A 402 -16.397 -7.000 -1.398 1.00 0.00 H new ATOM 0 HG2 LYS A 402 -17.013 -9.143 -0.532 1.00 0.00 H new ATOM 0 HG3 LYS A 402 -18.007 -7.960 0.293 1.00 0.00 H new ATOM 0 HD2 LYS A 402 -19.887 -8.449 -1.262 1.00 0.00 H new ATOM 0 HD3 LYS A 402 -18.893 -9.624 -2.100 1.00 0.00 H new ATOM 0 HE2 LYS A 402 -18.672 -10.933 0.014 1.00 0.00 H new ATOM 0 HE3 LYS A 402 -19.683 -9.763 0.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 402 -20.958 -11.681 0.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 402 -21.495 -10.294 -0.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 402 -20.515 -11.428 -1.485 1.00 0.00 H new ATOM 745 N LYS A 403 -17.342 -3.947 -1.990 1.00 0.00 N ATOM 746 CA LYS A 403 -16.743 -2.827 -2.717 1.00 0.00 C ATOM 747 C LYS A 403 -15.729 -2.067 -1.866 1.00 0.00 C ATOM 748 O LYS A 403 -15.897 -1.925 -0.654 1.00 0.00 O ATOM 749 CB LYS A 403 -17.827 -1.856 -3.195 1.00 0.00 C ATOM 750 CG LYS A 403 -18.881 -2.495 -4.085 1.00 0.00 C ATOM 751 CD LYS A 403 -19.781 -1.455 -4.744 1.00 0.00 C ATOM 752 CE LYS A 403 -20.668 -0.734 -3.738 1.00 0.00 C ATOM 753 NZ LYS A 403 -19.885 0.123 -2.804 1.00 0.00 N ATOM 0 H LYS A 403 -17.448 -3.797 -0.987 1.00 0.00 H new ATOM 0 HA LYS A 403 -16.220 -3.250 -3.575 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -18.317 -1.418 -2.325 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -17.354 -1.039 -3.739 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -18.392 -3.091 -4.855 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -19.490 -3.178 -3.492 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -19.165 -0.725 -5.269 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -20.406 -1.942 -5.493 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -21.392 -0.118 -4.272 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -21.235 -1.468 -3.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -20.418 0.993 -2.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -19.716 -0.394 -1.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -18.974 0.369 -3.240 1.00 0.00 H new ATOM 767 N CYS A 404 -14.683 -1.566 -2.522 1.00 0.00 N ATOM 768 CA CYS A 404 -13.640 -0.799 -1.849 1.00 0.00 C ATOM 769 C CYS A 404 -13.541 0.600 -2.448 1.00 0.00 C ATOM 770 O CYS A 404 -13.686 0.773 -3.657 1.00 0.00 O ATOM 771 CB CYS A 404 -12.283 -1.494 -1.973 1.00 0.00 C ATOM 772 SG CYS A 404 -10.954 -0.678 -1.031 1.00 0.00 S ATOM 0 H CYS A 404 -14.537 -1.680 -3.525 1.00 0.00 H new ATOM 0 HA CYS A 404 -13.907 -0.728 -0.795 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -12.380 -2.524 -1.630 1.00 0.00 H new ATOM 0 HB3 CYS A 404 -12.000 -1.533 -3.025 1.00 0.00 H new ATOM 777 N THR A 405 -13.294 1.596 -1.602 1.00 0.00 N ATOM 778 CA THR A 405 -13.177 2.974 -2.068 1.00 0.00 C ATOM 779 C THR A 405 -12.123 3.741 -1.277 1.00 0.00 C ATOM 780 O THR A 405 -12.035 3.619 -0.055 1.00 0.00 O ATOM 781 CB THR A 405 -14.520 3.722 -1.969 1.00 0.00 C ATOM 782 OG1 THR A 405 -14.957 3.768 -0.605 1.00 0.00 O ATOM 783 CG2 THR A 405 -15.580 3.045 -2.825 1.00 0.00 C ATOM 0 H THR A 405 -13.172 1.476 -0.596 1.00 0.00 H new ATOM 0 HA THR A 405 -12.875 2.923 -3.114 1.00 0.00 H new ATOM 0 HB THR A 405 -14.373 4.738 -2.336 1.00 0.00 H new ATOM 0 HG1 THR A 405 -15.536 4.548 -0.473 1.00 0.00 H new ATOM 0 HG21 THR A 405 -16.520 3.591 -2.739 1.00 0.00 H new ATOM 0 HG22 THR A 405 -15.258 3.039 -3.866 1.00 0.00 H new ATOM 0 HG23 THR A 405 -15.723 2.020 -2.484 1.00 0.00 H new ATOM 791 N LEU A 406 -11.325 4.530 -1.992 1.00 0.00 N ATOM 792 CA LEU A 406 -10.269 5.324 -1.382 1.00 0.00 C ATOM 793 C LEU A 406 -10.859 6.354 -0.428 1.00 0.00 C ATOM 794 O LEU A 406 -11.931 6.908 -0.678 1.00 0.00 O ATOM 795 CB LEU A 406 -9.442 6.008 -2.472 1.00 0.00 C ATOM 796 CG LEU A 406 -8.089 6.579 -2.040 1.00 0.00 C ATOM 797 CD1 LEU A 406 -8.264 7.848 -1.227 1.00 0.00 C ATOM 798 CD2 LEU A 406 -7.297 5.541 -1.266 1.00 0.00 C ATOM 0 H LEU A 406 -11.394 4.635 -3.004 1.00 0.00 H new ATOM 0 HA LEU A 406 -9.617 4.666 -0.807 1.00 0.00 H new ATOM 0 HB2 LEU A 406 -9.270 5.289 -3.273 1.00 0.00 H new ATOM 0 HB3 LEU A 406 -10.036 6.818 -2.894 1.00 0.00 H new ATOM 0 HG LEU A 406 -7.528 6.838 -2.938 1.00 0.00 H new ATOM 0 HD11 LEU A 406 -7.286 8.230 -0.934 1.00 0.00 H new ATOM 0 HD12 LEU A 406 -8.781 8.596 -1.827 1.00 0.00 H new ATOM 0 HD13 LEU A 406 -8.850 7.630 -0.334 1.00 0.00 H new ATOM 0 HD21 LEU A 406 -6.338 5.964 -0.967 1.00 0.00 H new ATOM 0 HD22 LEU A 406 -7.856 5.245 -0.378 1.00 0.00 H new ATOM 0 HD23 LEU A 406 -7.128 4.668 -1.896 1.00 0.00 H new ATOM 810 N ASP A 407 -10.152 6.602 0.664 1.00 0.00 N ATOM 811 CA ASP A 407 -10.599 7.565 1.665 1.00 0.00 C ATOM 812 C ASP A 407 -9.640 8.748 1.739 1.00 0.00 C ATOM 813 O ASP A 407 -8.425 8.567 1.805 1.00 0.00 O ATOM 814 CB ASP A 407 -10.709 6.891 3.035 1.00 0.00 C ATOM 815 CG ASP A 407 -11.295 7.805 4.095 1.00 0.00 C ATOM 816 OD1 ASP A 407 -11.660 8.952 3.760 1.00 0.00 O ATOM 817 OD2 ASP A 407 -11.394 7.371 5.261 1.00 0.00 O ATOM 0 H ASP A 407 -9.264 6.150 0.882 1.00 0.00 H new ATOM 0 HA ASP A 407 -11.582 7.934 1.372 1.00 0.00 H new ATOM 0 HB2 ASP A 407 -11.330 5.999 2.947 1.00 0.00 H new ATOM 0 HB3 ASP A 407 -9.720 6.561 3.353 1.00 0.00 H new ATOM 822 N LYS A 408 -10.193 9.957 1.723 1.00 0.00 N ATOM 823 CA LYS A 408 -9.384 11.170 1.786 1.00 0.00 C ATOM 824 C LYS A 408 -8.660 11.284 3.125 1.00 0.00 C ATOM 825 O LYS A 408 -7.485 11.644 3.174 1.00 0.00 O ATOM 826 CB LYS A 408 -10.261 12.403 1.561 1.00 0.00 C ATOM 827 CG LYS A 408 -10.937 12.429 0.200 1.00 0.00 C ATOM 828 CD LYS A 408 -11.815 13.658 0.038 1.00 0.00 C ATOM 829 CE LYS A 408 -12.454 13.707 -1.341 1.00 0.00 C ATOM 830 NZ LYS A 408 -13.320 12.522 -1.595 1.00 0.00 N ATOM 0 H LYS A 408 -11.198 10.123 1.667 1.00 0.00 H new ATOM 0 HA LYS A 408 -8.634 11.113 0.997 1.00 0.00 H new ATOM 0 HB2 LYS A 408 -11.025 12.442 2.338 1.00 0.00 H new ATOM 0 HB3 LYS A 408 -9.649 13.298 1.671 1.00 0.00 H new ATOM 0 HG2 LYS A 408 -10.180 12.416 -0.584 1.00 0.00 H new ATOM 0 HG3 LYS A 408 -11.541 11.530 0.075 1.00 0.00 H new ATOM 0 HD2 LYS A 408 -12.593 13.654 0.801 1.00 0.00 H new ATOM 0 HD3 LYS A 408 -11.218 14.556 0.196 1.00 0.00 H new ATOM 0 HE2 LYS A 408 -13.047 14.617 -1.434 1.00 0.00 H new ATOM 0 HE3 LYS A 408 -11.674 13.756 -2.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 -13.892 12.686 -2.448 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 -12.725 11.680 -1.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 -13.949 12.371 -0.781 1.00 0.00 H new ATOM 844 N GLU A 409 -9.370 10.980 4.207 1.00 0.00 N ATOM 845 CA GLU A 409 -8.795 11.054 5.547 1.00 0.00 C ATOM 846 C GLU A 409 -7.647 10.063 5.712 1.00 0.00 C ATOM 847 O GLU A 409 -6.597 10.399 6.258 1.00 0.00 O ATOM 848 CB GLU A 409 -9.871 10.782 6.600 1.00 0.00 C ATOM 849 CG GLU A 409 -11.043 11.751 6.545 1.00 0.00 C ATOM 850 CD GLU A 409 -10.647 13.178 6.876 1.00 0.00 C ATOM 851 OE1 GLU A 409 -9.820 13.754 6.138 1.00 0.00 O ATOM 852 OE2 GLU A 409 -11.165 13.719 7.875 1.00 0.00 O ATOM 0 H GLU A 409 -10.345 10.680 4.183 1.00 0.00 H new ATOM 0 HA GLU A 409 -8.400 12.060 5.686 1.00 0.00 H new ATOM 0 HB2 GLU A 409 -10.245 9.766 6.470 1.00 0.00 H new ATOM 0 HB3 GLU A 409 -9.418 10.830 7.590 1.00 0.00 H new ATOM 0 HG2 GLU A 409 -11.484 11.724 5.548 1.00 0.00 H new ATOM 0 HG3 GLU A 409 -11.813 11.422 7.243 1.00 0.00 H new ATOM 859 N GLU A 410 -7.855 8.840 5.241 1.00 0.00 N ATOM 860 CA GLU A 410 -6.836 7.800 5.341 1.00 0.00 C ATOM 861 C GLU A 410 -5.664 8.084 4.407 1.00 0.00 C ATOM 862 O GLU A 410 -4.511 7.857 4.766 1.00 0.00 O ATOM 863 CB GLU A 410 -7.439 6.431 5.023 1.00 0.00 C ATOM 864 CG GLU A 410 -8.574 6.034 5.955 1.00 0.00 C ATOM 865 CD GLU A 410 -8.136 5.942 7.404 1.00 0.00 C ATOM 866 OE1 GLU A 410 -7.237 5.129 7.702 1.00 0.00 O ATOM 867 OE2 GLU A 410 -8.694 6.683 8.242 1.00 0.00 O ATOM 0 H GLU A 410 -8.718 8.543 4.786 1.00 0.00 H new ATOM 0 HA GLU A 410 -6.463 7.796 6.365 1.00 0.00 H new ATOM 0 HB2 GLU A 410 -7.807 6.435 3.997 1.00 0.00 H new ATOM 0 HB3 GLU A 410 -6.654 5.676 5.077 1.00 0.00 H new ATOM 0 HG2 GLU A 410 -9.381 6.762 5.869 1.00 0.00 H new ATOM 0 HG3 GLU A 410 -8.978 5.072 5.640 1.00 0.00 H new ATOM 874 N ALA A 411 -5.966 8.571 3.206 1.00 0.00 N ATOM 875 CA ALA A 411 -4.931 8.877 2.220 1.00 0.00 C ATOM 876 C ALA A 411 -4.028 10.015 2.681 1.00 0.00 C ATOM 877 O ALA A 411 -2.808 9.927 2.572 1.00 0.00 O ATOM 878 CB ALA A 411 -5.565 9.220 0.880 1.00 0.00 C ATOM 0 H ALA A 411 -6.917 8.762 2.892 1.00 0.00 H new ATOM 0 HA ALA A 411 -4.311 7.988 2.108 1.00 0.00 H new ATOM 0 HB1 ALA A 411 -4.783 9.446 0.155 1.00 0.00 H new ATOM 0 HB2 ALA A 411 -6.153 8.372 0.528 1.00 0.00 H new ATOM 0 HB3 ALA A 411 -6.214 10.088 0.996 1.00 0.00 H new ATOM 884 N LYS A 412 -4.624 11.085 3.193 1.00 0.00 N ATOM 885 CA LYS A 412 -3.841 12.220 3.661 1.00 0.00 C ATOM 886 C LYS A 412 -2.918 11.785 4.794 1.00 0.00 C ATOM 887 O LYS A 412 -1.743 12.148 4.825 1.00 0.00 O ATOM 888 CB LYS A 412 -4.754 13.364 4.114 1.00 0.00 C ATOM 889 CG LYS A 412 -5.657 13.010 5.284 1.00 0.00 C ATOM 890 CD LYS A 412 -6.541 14.180 5.697 1.00 0.00 C ATOM 891 CE LYS A 412 -5.735 15.318 6.315 1.00 0.00 C ATOM 892 NZ LYS A 412 -4.846 15.985 5.323 1.00 0.00 N ATOM 0 H LYS A 412 -5.634 11.190 3.294 1.00 0.00 H new ATOM 0 HA LYS A 412 -3.232 12.587 2.834 1.00 0.00 H new ATOM 0 HB2 LYS A 412 -4.137 14.219 4.390 1.00 0.00 H new ATOM 0 HB3 LYS A 412 -5.373 13.676 3.273 1.00 0.00 H new ATOM 0 HG2 LYS A 412 -6.284 12.160 5.014 1.00 0.00 H new ATOM 0 HG3 LYS A 412 -5.047 12.700 6.132 1.00 0.00 H new ATOM 0 HD2 LYS A 412 -7.081 14.551 4.826 1.00 0.00 H new ATOM 0 HD3 LYS A 412 -7.288 13.835 6.412 1.00 0.00 H new ATOM 0 HE2 LYS A 412 -6.417 16.054 6.741 1.00 0.00 H new ATOM 0 HE3 LYS A 412 -5.132 14.929 7.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 412 -4.775 16.998 5.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 412 -3.900 15.555 5.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 412 -5.241 15.868 4.368 1.00 0.00 H new ATOM 906 N LYS A 413 -3.459 10.995 5.718 1.00 0.00 N ATOM 907 CA LYS A 413 -2.697 10.497 6.845 1.00 0.00 C ATOM 908 C LYS A 413 -1.610 9.528 6.385 1.00 0.00 C ATOM 909 O LYS A 413 -0.476 9.582 6.862 1.00 0.00 O ATOM 910 CB LYS A 413 -3.633 9.800 7.827 1.00 0.00 C ATOM 911 CG LYS A 413 -3.007 9.568 9.181 1.00 0.00 C ATOM 912 CD LYS A 413 -3.979 8.911 10.145 1.00 0.00 C ATOM 913 CE LYS A 413 -3.339 8.673 11.503 1.00 0.00 C ATOM 914 NZ LYS A 413 -4.295 8.064 12.469 1.00 0.00 N ATOM 0 H LYS A 413 -4.431 10.687 5.702 1.00 0.00 H new ATOM 0 HA LYS A 413 -2.214 11.341 7.337 1.00 0.00 H new ATOM 0 HB2 LYS A 413 -4.535 10.401 7.949 1.00 0.00 H new ATOM 0 HB3 LYS A 413 -3.942 8.843 7.408 1.00 0.00 H new ATOM 0 HG2 LYS A 413 -2.124 8.939 9.070 1.00 0.00 H new ATOM 0 HG3 LYS A 413 -2.672 10.519 9.594 1.00 0.00 H new ATOM 0 HD2 LYS A 413 -4.860 9.542 10.262 1.00 0.00 H new ATOM 0 HD3 LYS A 413 -4.319 7.962 9.730 1.00 0.00 H new ATOM 0 HE2 LYS A 413 -2.474 8.019 11.387 1.00 0.00 H new ATOM 0 HE3 LYS A 413 -2.973 9.619 11.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 413 -3.820 7.918 13.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 413 -5.108 8.699 12.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 413 -4.625 7.149 12.101 1.00 0.00 H new ATOM 928 N VAL A 414 -1.966 8.639 5.460 1.00 0.00 N ATOM 929 CA VAL A 414 -1.023 7.654 4.942 1.00 0.00 C ATOM 930 C VAL A 414 0.148 8.342 4.245 1.00 0.00 C ATOM 931 O VAL A 414 1.297 7.918 4.373 1.00 0.00 O ATOM 932 CB VAL A 414 -1.704 6.658 3.980 1.00 0.00 C ATOM 933 CG1 VAL A 414 -1.788 7.229 2.585 1.00 0.00 C ATOM 934 CG2 VAL A 414 -0.968 5.327 3.979 1.00 0.00 C ATOM 0 H VAL A 414 -2.900 8.582 5.055 1.00 0.00 H new ATOM 0 HA VAL A 414 -0.646 7.089 5.794 1.00 0.00 H new ATOM 0 HB VAL A 414 -2.721 6.484 4.332 1.00 0.00 H new ATOM 0 HG11 VAL A 414 -2.272 6.509 1.925 1.00 0.00 H new ATOM 0 HG12 VAL A 414 -2.369 8.151 2.604 1.00 0.00 H new ATOM 0 HG13 VAL A 414 -0.784 7.440 2.217 1.00 0.00 H new ATOM 0 HG21 VAL A 414 -1.463 4.638 3.295 1.00 0.00 H new ATOM 0 HG22 VAL A 414 0.062 5.481 3.657 1.00 0.00 H new ATOM 0 HG23 VAL A 414 -0.975 4.907 4.985 1.00 0.00 H new ATOM 944 N ALA A 415 -0.152 9.416 3.518 1.00 0.00 N ATOM 945 CA ALA A 415 0.871 10.175 2.813 1.00 0.00 C ATOM 946 C ALA A 415 1.845 10.793 3.805 1.00 0.00 C ATOM 947 O ALA A 415 3.052 10.836 3.566 1.00 0.00 O ATOM 948 CB ALA A 415 0.234 11.257 1.955 1.00 0.00 C ATOM 0 H ALA A 415 -1.098 9.779 3.403 1.00 0.00 H new ATOM 0 HA ALA A 415 1.420 9.495 2.161 1.00 0.00 H new ATOM 0 HB1 ALA A 415 1.013 11.815 1.435 1.00 0.00 H new ATOM 0 HB2 ALA A 415 -0.432 10.797 1.225 1.00 0.00 H new ATOM 0 HB3 ALA A 415 -0.336 11.936 2.589 1.00 0.00 H new ATOM 954 N ASP A 416 1.304 11.265 4.925 1.00 0.00 N ATOM 955 CA ASP A 416 2.115 11.878 5.971 1.00 0.00 C ATOM 956 C ASP A 416 2.766 10.810 6.842 1.00 0.00 C ATOM 957 O ASP A 416 2.859 10.955 8.061 1.00 0.00 O ATOM 958 CB ASP A 416 1.261 12.806 6.835 1.00 0.00 C ATOM 959 CG ASP A 416 0.702 13.977 6.052 1.00 0.00 C ATOM 960 OD1 ASP A 416 1.503 14.742 5.476 1.00 0.00 O ATOM 961 OD2 ASP A 416 -0.537 14.133 6.020 1.00 0.00 O ATOM 0 H ASP A 416 0.305 11.234 5.131 1.00 0.00 H new ATOM 0 HA ASP A 416 2.899 12.464 5.492 1.00 0.00 H new ATOM 0 HB2 ASP A 416 0.438 12.238 7.269 1.00 0.00 H new ATOM 0 HB3 ASP A 416 1.862 13.181 7.664 1.00 0.00 H new ATOM 966 N GLU A 417 3.216 9.739 6.201 1.00 0.00 N ATOM 967 CA GLU A 417 3.864 8.631 6.896 1.00 0.00 C ATOM 968 C GLU A 417 4.881 7.958 5.982 1.00 0.00 C ATOM 969 O GLU A 417 5.991 7.635 6.402 1.00 0.00 O ATOM 970 CB GLU A 417 2.829 7.600 7.362 1.00 0.00 C ATOM 971 CG GLU A 417 1.840 8.137 8.384 1.00 0.00 C ATOM 972 CD GLU A 417 0.829 7.094 8.820 1.00 0.00 C ATOM 973 OE1 GLU A 417 0.085 6.588 7.954 1.00 0.00 O ATOM 974 OE2 GLU A 417 0.782 6.782 10.029 1.00 0.00 O ATOM 0 H GLU A 417 3.144 9.613 5.191 1.00 0.00 H new ATOM 0 HA GLU A 417 4.376 9.033 7.771 1.00 0.00 H new ATOM 0 HB2 GLU A 417 2.278 7.236 6.495 1.00 0.00 H new ATOM 0 HB3 GLU A 417 3.351 6.744 7.791 1.00 0.00 H new ATOM 0 HG2 GLU A 417 2.385 8.497 9.257 1.00 0.00 H new ATOM 0 HG3 GLU A 417 1.314 8.993 7.961 1.00 0.00 H new ATOM 981 N THR A 418 4.492 7.758 4.725 1.00 0.00 N ATOM 982 CA THR A 418 5.369 7.134 3.744 1.00 0.00 C ATOM 983 C THR A 418 6.460 8.100 3.310 1.00 0.00 C ATOM 984 O THR A 418 7.292 7.779 2.460 1.00 0.00 O ATOM 985 CB THR A 418 4.587 6.655 2.507 1.00 0.00 C ATOM 986 OG1 THR A 418 3.921 7.762 1.887 1.00 0.00 O ATOM 987 CG2 THR A 418 3.568 5.593 2.892 1.00 0.00 C ATOM 0 H THR A 418 3.575 8.020 4.364 1.00 0.00 H new ATOM 0 HA THR A 418 5.822 6.266 4.223 1.00 0.00 H new ATOM 0 HB THR A 418 5.295 6.219 1.802 1.00 0.00 H new ATOM 0 HG1 THR A 418 3.428 7.448 1.100 1.00 0.00 H new ATOM 0 HG21 THR A 418 3.027 5.269 2.003 1.00 0.00 H new ATOM 0 HG22 THR A 418 4.081 4.740 3.336 1.00 0.00 H new ATOM 0 HG23 THR A 418 2.865 6.008 3.614 1.00 0.00 H new ATOM 995 N ALA A 419 6.451 9.279 3.917 1.00 0.00 N ATOM 996 CA ALA A 419 7.441 10.307 3.624 1.00 0.00 C ATOM 997 C ALA A 419 7.452 10.673 2.142 1.00 0.00 C ATOM 998 O ALA A 419 8.492 10.613 1.484 1.00 0.00 O ATOM 999 CB ALA A 419 8.812 9.842 4.076 1.00 0.00 C ATOM 0 H ALA A 419 5.764 9.549 4.621 1.00 0.00 H new ATOM 0 HA ALA A 419 7.171 11.208 4.174 1.00 0.00 H new ATOM 0 HB1 ALA A 419 9.549 10.614 3.855 1.00 0.00 H new ATOM 0 HB2 ALA A 419 8.796 9.652 5.149 1.00 0.00 H new ATOM 0 HB3 ALA A 419 9.077 8.925 3.549 1.00 0.00 H new ATOM 1005 N LYS A 420 6.288 11.055 1.626 1.00 0.00 N ATOM 1006 CA LYS A 420 6.157 11.437 0.225 1.00 0.00 C ATOM 1007 C LYS A 420 5.169 12.590 0.074 1.00 0.00 C ATOM 1008 O LYS A 420 4.324 12.589 -0.822 1.00 0.00 O ATOM 1009 CB LYS A 420 5.697 10.240 -0.613 1.00 0.00 C ATOM 1010 CG LYS A 420 6.676 9.077 -0.607 1.00 0.00 C ATOM 1011 CD LYS A 420 6.170 7.918 -1.451 1.00 0.00 C ATOM 1012 CE LYS A 420 7.143 6.750 -1.438 1.00 0.00 C ATOM 1013 NZ LYS A 420 6.653 5.609 -2.259 1.00 0.00 N ATOM 0 H LYS A 420 5.420 11.108 2.159 1.00 0.00 H new ATOM 0 HA LYS A 420 7.133 11.764 -0.133 1.00 0.00 H new ATOM 0 HB2 LYS A 420 4.734 9.894 -0.238 1.00 0.00 H new ATOM 0 HB3 LYS A 420 5.541 10.566 -1.641 1.00 0.00 H new ATOM 0 HG2 LYS A 420 7.641 9.411 -0.987 1.00 0.00 H new ATOM 0 HG3 LYS A 420 6.836 8.740 0.417 1.00 0.00 H new ATOM 0 HD2 LYS A 420 5.201 7.589 -1.075 1.00 0.00 H new ATOM 0 HD3 LYS A 420 6.017 8.254 -2.477 1.00 0.00 H new ATOM 0 HE2 LYS A 420 8.111 7.080 -1.816 1.00 0.00 H new ATOM 0 HE3 LYS A 420 7.298 6.418 -0.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 420 7.345 4.833 -2.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 420 5.742 5.277 -1.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 420 6.529 5.918 -3.244 1.00 0.00 H new ATOM 1027 N ASP A 421 5.284 13.573 0.963 1.00 0.00 N ATOM 1028 CA ASP A 421 4.407 14.737 0.941 1.00 0.00 C ATOM 1029 C ASP A 421 4.647 15.585 -0.304 1.00 0.00 C ATOM 1030 O ASP A 421 5.781 15.726 -0.765 1.00 0.00 O ATOM 1031 CB ASP A 421 4.611 15.582 2.202 1.00 0.00 C ATOM 1032 CG ASP A 421 6.050 16.028 2.386 1.00 0.00 C ATOM 1033 OD1 ASP A 421 6.905 15.648 1.557 1.00 0.00 O ATOM 1034 OD2 ASP A 421 6.325 16.755 3.365 1.00 0.00 O ATOM 0 H ASP A 421 5.979 13.585 1.710 1.00 0.00 H new ATOM 0 HA ASP A 421 3.377 14.380 0.915 1.00 0.00 H new ATOM 0 HB2 ASP A 421 3.967 16.460 2.153 1.00 0.00 H new ATOM 0 HB3 ASP A 421 4.300 15.006 3.074 1.00 0.00 H new ATOM 1039 N GLY A 422 3.572 16.149 -0.843 1.00 0.00 N ATOM 1040 CA GLY A 422 3.682 16.977 -2.028 1.00 0.00 C ATOM 1041 C GLY A 422 2.363 17.618 -2.410 1.00 0.00 C ATOM 1042 O GLY A 422 1.621 18.087 -1.547 1.00 0.00 O ATOM 0 H GLY A 422 2.625 16.047 -0.479 1.00 0.00 H new ATOM 0 HA2 GLY A 422 4.425 17.756 -1.856 1.00 0.00 H new ATOM 0 HA3 GLY A 422 4.042 16.371 -2.859 1.00 0.00 H new ATOM 1046 N LYS A 423 2.071 17.634 -3.708 1.00 0.00 N ATOM 1047 CA LYS A 423 0.832 18.221 -4.206 1.00 0.00 C ATOM 1048 C LYS A 423 0.666 17.947 -5.696 1.00 0.00 C ATOM 1049 O LYS A 423 1.609 18.095 -6.473 1.00 0.00 O ATOM 1050 CB LYS A 423 0.817 19.731 -3.951 1.00 0.00 C ATOM 1051 CG LYS A 423 -0.469 20.412 -4.398 1.00 0.00 C ATOM 1052 CD LYS A 423 -0.406 21.920 -4.193 1.00 0.00 C ATOM 1053 CE LYS A 423 -0.249 22.282 -2.723 1.00 0.00 C ATOM 1054 NZ LYS A 423 -0.204 23.756 -2.517 1.00 0.00 N ATOM 0 H LYS A 423 2.676 17.247 -4.433 1.00 0.00 H new ATOM 0 HA LYS A 423 0.001 17.762 -3.671 1.00 0.00 H new ATOM 0 HB2 LYS A 423 0.963 19.913 -2.886 1.00 0.00 H new ATOM 0 HB3 LYS A 423 1.659 20.187 -4.471 1.00 0.00 H new ATOM 0 HG2 LYS A 423 -0.649 20.195 -5.451 1.00 0.00 H new ATOM 0 HG3 LYS A 423 -1.311 20.003 -3.839 1.00 0.00 H new ATOM 0 HD2 LYS A 423 0.430 22.330 -4.760 1.00 0.00 H new ATOM 0 HD3 LYS A 423 -1.313 22.379 -4.586 1.00 0.00 H new ATOM 0 HE2 LYS A 423 -1.078 21.861 -2.155 1.00 0.00 H new ATOM 0 HE3 LYS A 423 0.665 21.833 -2.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 0.378 23.972 -1.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 0.210 24.211 -3.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 -1.169 24.115 -2.369 1.00 0.00 H new ATOM 1068 N THR A 424 -0.541 17.552 -6.088 1.00 0.00 N ATOM 1069 CA THR A 424 -0.833 17.263 -7.485 1.00 0.00 C ATOM 1070 C THR A 424 -0.605 18.496 -8.352 1.00 0.00 C ATOM 1071 O THR A 424 -0.040 18.407 -9.443 1.00 0.00 O ATOM 1072 CB THR A 424 -2.284 16.782 -7.667 1.00 0.00 C ATOM 1073 OG1 THR A 424 -3.195 17.797 -7.228 1.00 0.00 O ATOM 1074 CG2 THR A 424 -2.531 15.501 -6.884 1.00 0.00 C ATOM 0 H THR A 424 -1.332 17.425 -5.457 1.00 0.00 H new ATOM 0 HA THR A 424 -0.155 16.468 -7.797 1.00 0.00 H new ATOM 0 HB THR A 424 -2.447 16.580 -8.726 1.00 0.00 H new ATOM 0 HG1 THR A 424 -4.116 17.484 -7.349 1.00 0.00 H new ATOM 0 HG21 THR A 424 -3.563 15.180 -7.028 1.00 0.00 H new ATOM 0 HG22 THR A 424 -1.856 14.722 -7.238 1.00 0.00 H new ATOM 0 HG23 THR A 424 -2.352 15.682 -5.824 1.00 0.00 H new ATOM 1082 N GLY A 425 -1.049 19.645 -7.855 1.00 0.00 N ATOM 1083 CA GLY A 425 -0.887 20.888 -8.586 1.00 0.00 C ATOM 1084 C GLY A 425 -1.480 22.068 -7.845 1.00 0.00 C ATOM 1085 O GLY A 425 -2.600 21.992 -7.341 1.00 0.00 O ATOM 0 H GLY A 425 -1.520 19.738 -6.955 1.00 0.00 H new ATOM 0 HA2 GLY A 425 0.173 21.068 -8.763 1.00 0.00 H new ATOM 0 HA3 GLY A 425 -1.363 20.798 -9.563 1.00 0.00 H new ATOM 1089 N ASN A 426 -0.727 23.163 -7.777 1.00 0.00 N ATOM 1090 CA ASN A 426 -1.188 24.363 -7.089 1.00 0.00 C ATOM 1091 C ASN A 426 -2.492 24.869 -7.695 1.00 0.00 C ATOM 1092 O ASN A 426 -2.591 25.060 -8.907 1.00 0.00 O ATOM 1093 CB ASN A 426 -0.123 25.459 -7.155 1.00 0.00 C ATOM 1094 CG ASN A 426 1.181 25.041 -6.504 1.00 0.00 C ATOM 1095 OD1 ASN A 426 1.223 24.736 -5.312 1.00 0.00 O ATOM 1096 ND2 ASN A 426 2.255 25.025 -7.286 1.00 0.00 N ATOM 0 H ASN A 426 0.203 23.243 -8.189 1.00 0.00 H new ATOM 0 HA ASN A 426 -1.368 24.105 -6.045 1.00 0.00 H new ATOM 0 HB2 ASN A 426 0.062 25.719 -8.197 1.00 0.00 H new ATOM 0 HB3 ASN A 426 -0.499 26.357 -6.664 1.00 0.00 H new ATOM 0 HD21 ASN A 426 3.160 24.752 -6.904 1.00 0.00 H new ATOM 0 HD22 ASN A 426 2.174 25.286 -8.269 1.00 0.00 H new ATOM 1103 N THR A 427 -3.490 25.082 -6.844 1.00 0.00 N ATOM 1104 CA THR A 427 -4.790 25.565 -7.293 1.00 0.00 C ATOM 1105 C THR A 427 -4.715 27.028 -7.721 1.00 0.00 C ATOM 1106 O THR A 427 -4.108 27.855 -7.040 1.00 0.00 O ATOM 1107 CB THR A 427 -5.857 25.413 -6.192 1.00 0.00 C ATOM 1108 OG1 THR A 427 -5.945 24.044 -5.780 1.00 0.00 O ATOM 1109 CG2 THR A 427 -7.218 25.884 -6.684 1.00 0.00 C ATOM 0 H THR A 427 -3.423 24.927 -5.838 1.00 0.00 H new ATOM 0 HA THR A 427 -5.077 24.955 -8.150 1.00 0.00 H new ATOM 0 HB THR A 427 -5.560 26.031 -5.345 1.00 0.00 H new ATOM 0 HG1 THR A 427 -6.624 23.956 -5.079 1.00 0.00 H new ATOM 0 HG21 THR A 427 -7.953 25.766 -5.888 1.00 0.00 H new ATOM 0 HG22 THR A 427 -7.158 26.934 -6.970 1.00 0.00 H new ATOM 0 HG23 THR A 427 -7.519 25.290 -7.547 1.00 0.00 H new ATOM 1117 N ASN A 428 -5.345 27.336 -8.853 1.00 0.00 N ATOM 1118 CA ASN A 428 -5.364 28.693 -9.382 1.00 0.00 C ATOM 1119 C ASN A 428 -6.209 28.760 -10.649 1.00 0.00 C ATOM 1120 O ASN A 428 -7.024 29.667 -10.817 1.00 0.00 O ATOM 1121 CB ASN A 428 -3.943 29.183 -9.675 1.00 0.00 C ATOM 1122 CG ASN A 428 -3.248 28.353 -10.737 1.00 0.00 C ATOM 1123 OD1 ASN A 428 -3.082 27.144 -10.587 1.00 0.00 O ATOM 1124 ND2 ASN A 428 -2.835 29.005 -11.817 1.00 0.00 N ATOM 0 H ASN A 428 -5.851 26.658 -9.422 1.00 0.00 H new ATOM 0 HA ASN A 428 -5.807 29.343 -8.627 1.00 0.00 H new ATOM 0 HB2 ASN A 428 -3.981 30.223 -9.999 1.00 0.00 H new ATOM 0 HB3 ASN A 428 -3.357 29.156 -8.757 1.00 0.00 H new ATOM 0 HD21 ASN A 428 -2.358 28.502 -12.565 1.00 0.00 H new ATOM 0 HD22 ASN A 428 -2.995 30.009 -11.899 1.00 0.00 H new ATOM 1131 N THR A 429 -6.011 27.789 -11.537 1.00 0.00 N ATOM 1132 CA THR A 429 -6.756 27.728 -12.788 1.00 0.00 C ATOM 1133 C THR A 429 -8.227 27.420 -12.533 1.00 0.00 C ATOM 1134 O THR A 429 -8.682 27.416 -11.388 1.00 0.00 O ATOM 1135 CB THR A 429 -6.177 26.659 -13.733 1.00 0.00 C ATOM 1136 OG1 THR A 429 -6.252 25.368 -13.116 1.00 0.00 O ATOM 1137 CG2 THR A 429 -4.730 26.973 -14.085 1.00 0.00 C ATOM 0 H THR A 429 -5.339 27.032 -11.411 1.00 0.00 H new ATOM 0 HA THR A 429 -6.667 28.707 -13.260 1.00 0.00 H new ATOM 0 HB THR A 429 -6.766 26.660 -14.650 1.00 0.00 H new ATOM 0 HG1 THR A 429 -5.884 24.693 -13.724 1.00 0.00 H new ATOM 0 HG21 THR A 429 -4.343 26.204 -14.753 1.00 0.00 H new ATOM 0 HG22 THR A 429 -4.678 27.943 -14.579 1.00 0.00 H new ATOM 0 HG23 THR A 429 -4.131 26.997 -13.175 1.00 0.00 H new ATOM 1145 N THR A 430 -8.969 27.161 -13.606 1.00 0.00 N ATOM 1146 CA THR A 430 -10.390 26.848 -13.496 1.00 0.00 C ATOM 1147 C THR A 430 -10.606 25.392 -13.088 1.00 0.00 C ATOM 1148 O THR A 430 -11.463 24.702 -13.643 1.00 0.00 O ATOM 1149 CB THR A 430 -11.127 27.119 -14.821 1.00 0.00 C ATOM 1150 OG1 THR A 430 -10.560 26.326 -15.870 1.00 0.00 O ATOM 1151 CG2 THR A 430 -11.045 28.593 -15.192 1.00 0.00 C ATOM 0 H THR A 430 -8.610 27.162 -14.561 1.00 0.00 H new ATOM 0 HA THR A 430 -10.799 27.499 -12.723 1.00 0.00 H new ATOM 0 HB THR A 430 -12.175 26.850 -14.690 1.00 0.00 H new ATOM 0 HG1 THR A 430 -11.036 26.504 -16.708 1.00 0.00 H new ATOM 0 HG21 THR A 430 -11.572 28.762 -16.131 1.00 0.00 H new ATOM 0 HG22 THR A 430 -11.504 29.192 -14.406 1.00 0.00 H new ATOM 0 HG23 THR A 430 -10.000 28.882 -15.305 1.00 0.00 H new ATOM 1159 N GLY A 431 -9.824 24.929 -12.116 1.00 0.00 N ATOM 1160 CA GLY A 431 -9.945 23.559 -11.651 1.00 0.00 C ATOM 1161 C GLY A 431 -9.354 22.567 -12.630 1.00 0.00 C ATOM 1162 O GLY A 431 -9.561 22.679 -13.838 1.00 0.00 O ATOM 0 H GLY A 431 -9.108 25.480 -11.642 1.00 0.00 H new ATOM 0 HA2 GLY A 431 -9.444 23.459 -10.688 1.00 0.00 H new ATOM 0 HA3 GLY A 431 -10.997 23.324 -11.489 1.00 0.00 H new ATOM 1166 N SER A 432 -8.611 21.595 -12.108 1.00 0.00 N ATOM 1167 CA SER A 432 -7.983 20.583 -12.949 1.00 0.00 C ATOM 1168 C SER A 432 -9.023 19.858 -13.793 1.00 0.00 C ATOM 1169 O SER A 432 -9.805 19.056 -13.281 1.00 0.00 O ATOM 1170 CB SER A 432 -7.216 19.578 -12.087 1.00 0.00 C ATOM 1171 OG SER A 432 -6.589 18.592 -12.889 1.00 0.00 O ATOM 0 H SER A 432 -8.430 21.488 -11.110 1.00 0.00 H new ATOM 0 HA SER A 432 -7.284 21.084 -13.618 1.00 0.00 H new ATOM 0 HB2 SER A 432 -6.465 20.101 -11.495 1.00 0.00 H new ATOM 0 HB3 SER A 432 -7.899 19.100 -11.385 1.00 0.00 H new ATOM 0 HG SER A 432 -6.104 17.963 -12.315 1.00 0.00 H new ATOM 1177 N SER A 433 -9.021 20.146 -15.090 1.00 0.00 N ATOM 1178 CA SER A 433 -9.962 19.525 -16.018 1.00 0.00 C ATOM 1179 C SER A 433 -9.608 19.867 -17.461 1.00 0.00 C ATOM 1180 O SER A 433 -8.842 20.832 -17.670 1.00 0.00 O ATOM 1181 CB SER A 433 -11.393 19.978 -15.712 1.00 0.00 C ATOM 1182 OG SER A 433 -11.513 21.388 -15.801 1.00 0.00 O ATOM 1183 OXT SER A 433 -10.096 19.165 -18.372 1.00 0.00 O ATOM 0 H SER A 433 -8.377 20.807 -15.524 1.00 0.00 H new ATOM 0 HA SER A 433 -9.896 18.444 -15.891 1.00 0.00 H new ATOM 0 HB2 SER A 433 -12.084 19.506 -16.411 1.00 0.00 H new ATOM 0 HB3 SER A 433 -11.676 19.648 -14.712 1.00 0.00 H new ATOM 0 HG SER A 433 -10.925 21.809 -15.139 1.00 0.00 H new TER 1189 SER A 433