USER MOD reduce.3.24.130724 H: found=0, std=0, add=578, rem=0, adj=26 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 396 HIS : no HD1:sc= 0.71 K(o=1.4,f=-4.2!) USER MOD Set 1.2: A 405 THR OG1 : rot 26:sc= 0.728 USER MOD Set 2.1: A 373 GLN :FLIP amide:sc= -1.28 F(o=-3.7!,f=-1.3) USER MOD Set 2.2: A 391 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 377 THR OG1 : rot 180:sc= 0.435 USER MOD Set 3.2: A 380 SER OG : rot 88:sc= 0.477 USER MOD Single : A 355 SER OG : rot 180:sc= 0 USER MOD Single : A 356 HIS :FLIP no HD1:sc= -0.211 F(o=-1.3,f=-0.21) USER MOD Single : A 357 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 362 THR OG1 : rot 180:sc= 0 USER MOD Single : A 363 GLN :FLIP amide:sc= 0 F(o=-1.2!,f=0) USER MOD Single : A 364 LYS NZ :NH3+ -166:sc= -0.0278 (180deg=-0.269) USER MOD Single : A 365 HIS : no HD1:sc= -0.246 X(o=-0.25,f=-0.26) USER MOD Single : A 366 LYS NZ :NH3+ -152:sc= 1.21 (180deg=0.854) USER MOD Single : A 370 SER OG : rot 180:sc= 0 USER MOD Single : A 371 GLN :FLIP amide:sc= 0.192 F(o=-5.6!,f=0.19) USER MOD Single : A 372 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 382 ASN :FLIP amide:sc= -0.837 F(o=-3.4!,f=-0.84) USER MOD Single : A 383 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 384 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 386 GLN :FLIP amide:sc= 0 F(o=-1.2!,f=0) USER MOD Single : A 387 ASN : amide:sc= -0.258 X(o=-0.26,f=-0.26) USER MOD Single : A 390 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 394 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 397 ASN : amide:sc= 0.377 K(o=0.38,f=-3.5!) USER MOD Single : A 401 ASN :FLIP amide:sc= -0.536 F(o=-3!,f=-0.54) USER MOD Single : A 402 LYS NZ :NH3+ -167:sc= -0.0246 (180deg=-0.247) USER MOD Single : A 403 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 408 LYS NZ :NH3+ -169:sc= -0.0255 (180deg=-0.241) USER MOD Single : A 412 LYS NZ :NH3+ 179:sc= 0.695 (180deg=0.694) 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= 0.272 (180deg=0.272) USER MOD Single : A 423 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 424 THR OG1 : rot 180:sc= 0 USER MOD Single : A 426 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 427 THR OG1 : rot 180:sc= 0 USER MOD Single : A 428 ASN : amide:sc= -0.518 K(o=-0.52,f=-2.4!) USER MOD Single : A 429 THR OG1 : rot 180:sc= 0 USER MOD Single : A 430 THR OG1 : rot -55:sc= 1.02 USER MOD Single : A 432 SER OG : rot 180:sc= 0 USER MOD Single : A 433 SER OG : rot -13:sc= 0.878 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 354 26.432 1.525 19.193 1.00 0.00 N ATOM 2 CA GLY A 354 24.970 1.518 19.475 1.00 0.00 C ATOM 3 C GLY A 354 24.348 0.148 19.279 1.00 0.00 C ATOM 4 O GLY A 354 24.615 -0.523 18.283 1.00 0.00 O ATOM 0 HA2 GLY A 354 24.799 1.848 20.500 1.00 0.00 H new ATOM 0 HA3 GLY A 354 24.474 2.236 18.822 1.00 0.00 H new ATOM 10 N SER A 355 23.519 -0.264 20.234 1.00 0.00 N ATOM 11 CA SER A 355 22.856 -1.563 20.163 1.00 0.00 C ATOM 12 C SER A 355 21.955 -1.648 18.936 1.00 0.00 C ATOM 13 O SER A 355 21.973 -2.641 18.209 1.00 0.00 O ATOM 14 CB SER A 355 22.037 -1.811 21.431 1.00 0.00 C ATOM 15 OG SER A 355 21.385 -3.069 21.379 1.00 0.00 O ATOM 0 H SER A 355 23.290 0.282 21.065 1.00 0.00 H new ATOM 0 HA SER A 355 23.625 -2.331 20.080 1.00 0.00 H new ATOM 0 HB2 SER A 355 22.690 -1.772 22.303 1.00 0.00 H new ATOM 0 HB3 SER A 355 21.298 -1.019 21.551 1.00 0.00 H new ATOM 0 HG SER A 355 20.869 -3.205 22.201 1.00 0.00 H new ATOM 21 N HIS A 356 21.171 -0.599 18.713 1.00 0.00 N ATOM 22 CA HIS A 356 20.262 -0.550 17.572 1.00 0.00 C ATOM 23 C HIS A 356 21.023 -0.661 16.254 1.00 0.00 C ATOM 24 O HIS A 356 22.094 -0.076 16.087 1.00 0.00 O ATOM 25 CB HIS A 356 19.430 0.739 17.601 1.00 0.00 C ATOM 26 CG HIS A 356 20.239 2.001 17.696 1.00 0.00 C ATOM 27 ND1 HIS A 356 21.576 2.202 17.815 1.00 0.00 N flip ATOM 28 CD2 HIS A 356 19.669 3.256 17.681 1.00 0.00 C flip ATOM 29 CE1 HIS A 356 21.781 3.558 17.869 1.00 0.00 C flip ATOM 30 NE2 HIS A 356 20.616 4.172 17.785 1.00 0.00 N flip ATOM 0 H HIS A 356 21.146 0.230 19.307 1.00 0.00 H new ATOM 0 HA HIS A 356 19.588 -1.404 17.645 1.00 0.00 H new ATOM 0 HB2 HIS A 356 18.818 0.782 16.700 1.00 0.00 H new ATOM 0 HB3 HIS A 356 18.746 0.696 18.449 1.00 0.00 H new ATOM 0 HD2 HIS A 356 18.612 3.459 17.597 1.00 0.00 H new ATOM 0 HE1 HIS A 356 22.741 4.044 17.965 1.00 0.00 H new ATOM 0 HE2 HIS A 356 20.471 5.182 17.798 1.00 0.00 H new ATOM 39 N MET A 357 20.460 -1.422 15.320 1.00 0.00 N ATOM 40 CA MET A 357 21.076 -1.620 14.011 1.00 0.00 C ATOM 41 C MET A 357 20.144 -2.398 13.089 1.00 0.00 C ATOM 42 O MET A 357 19.539 -3.389 13.498 1.00 0.00 O ATOM 43 CB MET A 357 22.407 -2.362 14.154 1.00 0.00 C ATOM 44 CG MET A 357 22.278 -3.725 14.815 1.00 0.00 C ATOM 45 SD MET A 357 23.860 -4.579 14.962 1.00 0.00 S ATOM 46 CE MET A 357 23.348 -6.105 15.747 1.00 0.00 C ATOM 0 H MET A 357 19.575 -1.913 15.446 1.00 0.00 H new ATOM 0 HA MET A 357 21.263 -0.640 13.572 1.00 0.00 H new ATOM 0 HB2 MET A 357 22.851 -2.487 13.166 1.00 0.00 H new ATOM 0 HB3 MET A 357 23.094 -1.749 14.737 1.00 0.00 H new ATOM 0 HG2 MET A 357 21.842 -3.604 15.806 1.00 0.00 H new ATOM 0 HG3 MET A 357 21.589 -4.341 14.237 1.00 0.00 H new ATOM 0 HE1 MET A 357 24.218 -6.742 15.905 1.00 0.00 H new ATOM 0 HE2 MET A 357 22.882 -5.882 16.707 1.00 0.00 H new ATOM 0 HE3 MET A 357 22.632 -6.621 15.107 1.00 0.00 H new ATOM 56 N LEU A 358 20.032 -1.940 11.846 1.00 0.00 N ATOM 57 CA LEU A 358 19.170 -2.592 10.865 1.00 0.00 C ATOM 58 C LEU A 358 19.369 -1.983 9.477 1.00 0.00 C ATOM 59 O LEU A 358 20.484 -1.607 9.111 1.00 0.00 O ATOM 60 CB LEU A 358 17.696 -2.482 11.289 1.00 0.00 C ATOM 61 CG LEU A 358 17.113 -1.062 11.324 1.00 0.00 C ATOM 62 CD1 LEU A 358 15.609 -1.114 11.548 1.00 0.00 C ATOM 63 CD2 LEU A 358 17.777 -0.226 12.409 1.00 0.00 C ATOM 0 H LEU A 358 20.527 -1.120 11.494 1.00 0.00 H new ATOM 0 HA LEU A 358 19.444 -3.646 10.819 1.00 0.00 H new ATOM 0 HB2 LEU A 358 17.096 -3.084 10.607 1.00 0.00 H new ATOM 0 HB3 LEU A 358 17.589 -2.922 12.280 1.00 0.00 H new ATOM 0 HG LEU A 358 17.311 -0.591 10.361 1.00 0.00 H new ATOM 0 HD11 LEU A 358 15.209 -0.100 11.571 1.00 0.00 H new ATOM 0 HD12 LEU A 358 15.139 -1.671 10.737 1.00 0.00 H new ATOM 0 HD13 LEU A 358 15.399 -1.608 12.497 1.00 0.00 H new ATOM 0 HD21 LEU A 358 17.346 0.775 12.412 1.00 0.00 H new ATOM 0 HD22 LEU A 358 17.614 -0.694 13.380 1.00 0.00 H new ATOM 0 HD23 LEU A 358 18.847 -0.159 12.213 1.00 0.00 H new ATOM 75 N GLU A 359 18.286 -1.887 8.709 1.00 0.00 N ATOM 76 CA GLU A 359 18.343 -1.325 7.366 1.00 0.00 C ATOM 77 C GLU A 359 16.937 -1.103 6.819 1.00 0.00 C ATOM 78 O GLU A 359 16.092 -1.998 6.867 1.00 0.00 O ATOM 79 CB GLU A 359 19.128 -2.252 6.436 1.00 0.00 C ATOM 80 CG GLU A 359 19.249 -1.731 5.015 1.00 0.00 C ATOM 81 CD GLU A 359 20.041 -2.662 4.118 1.00 0.00 C ATOM 82 OE1 GLU A 359 19.626 -3.830 3.961 1.00 0.00 O ATOM 83 OE2 GLU A 359 21.076 -2.224 3.574 1.00 0.00 O ATOM 0 H GLU A 359 17.357 -2.193 8.997 1.00 0.00 H new ATOM 0 HA GLU A 359 18.853 -0.363 7.417 1.00 0.00 H new ATOM 0 HB2 GLU A 359 20.127 -2.401 6.845 1.00 0.00 H new ATOM 0 HB3 GLU A 359 18.643 -3.228 6.416 1.00 0.00 H new ATOM 0 HG2 GLU A 359 18.252 -1.591 4.597 1.00 0.00 H new ATOM 0 HG3 GLU A 359 19.729 -0.752 5.030 1.00 0.00 H new ATOM 90 N VAL A 360 16.691 0.098 6.304 1.00 0.00 N ATOM 91 CA VAL A 360 15.385 0.441 5.753 1.00 0.00 C ATOM 92 C VAL A 360 15.076 -0.378 4.506 1.00 0.00 C ATOM 93 O VAL A 360 15.907 -0.494 3.605 1.00 0.00 O ATOM 94 CB VAL A 360 15.300 1.940 5.404 1.00 0.00 C ATOM 95 CG1 VAL A 360 13.921 2.291 4.868 1.00 0.00 C ATOM 96 CG2 VAL A 360 15.639 2.791 6.619 1.00 0.00 C ATOM 0 H VAL A 360 17.379 0.850 6.257 1.00 0.00 H new ATOM 0 HA VAL A 360 14.649 0.210 6.523 1.00 0.00 H new ATOM 0 HB VAL A 360 16.030 2.152 4.623 1.00 0.00 H new ATOM 0 HG11 VAL A 360 13.883 3.354 4.628 1.00 0.00 H new ATOM 0 HG12 VAL A 360 13.721 1.709 3.968 1.00 0.00 H new ATOM 0 HG13 VAL A 360 13.168 2.063 5.623 1.00 0.00 H new ATOM 0 HG21 VAL A 360 15.574 3.846 6.354 1.00 0.00 H new ATOM 0 HG22 VAL A 360 14.935 2.575 7.423 1.00 0.00 H new ATOM 0 HG23 VAL A 360 16.651 2.563 6.952 1.00 0.00 H new ATOM 106 N LEU A 361 13.870 -0.938 4.458 1.00 0.00 N ATOM 107 CA LEU A 361 13.443 -1.741 3.318 1.00 0.00 C ATOM 108 C LEU A 361 13.372 -0.884 2.058 1.00 0.00 C ATOM 109 O LEU A 361 12.827 0.220 2.079 1.00 0.00 O ATOM 110 CB LEU A 361 12.079 -2.376 3.601 1.00 0.00 C ATOM 111 CG LEU A 361 11.522 -3.257 2.480 1.00 0.00 C ATOM 112 CD1 LEU A 361 12.445 -4.437 2.213 1.00 0.00 C ATOM 113 CD2 LEU A 361 10.124 -3.742 2.835 1.00 0.00 C ATOM 0 H LEU A 361 13.172 -0.850 5.196 1.00 0.00 H new ATOM 0 HA LEU A 361 14.175 -2.533 3.158 1.00 0.00 H new ATOM 0 HB2 LEU A 361 12.157 -2.976 4.507 1.00 0.00 H new ATOM 0 HB3 LEU A 361 11.362 -1.581 3.806 1.00 0.00 H new ATOM 0 HG LEU A 361 11.462 -2.660 1.570 1.00 0.00 H new ATOM 0 HD11 LEU A 361 12.030 -5.050 1.413 1.00 0.00 H new ATOM 0 HD12 LEU A 361 13.428 -4.070 1.917 1.00 0.00 H new ATOM 0 HD13 LEU A 361 12.539 -5.037 3.118 1.00 0.00 H new ATOM 0 HD21 LEU A 361 9.740 -4.367 2.029 1.00 0.00 H new ATOM 0 HD22 LEU A 361 10.163 -4.322 3.757 1.00 0.00 H new ATOM 0 HD23 LEU A 361 9.466 -2.884 2.974 1.00 0.00 H new ATOM 125 N THR A 362 13.929 -1.398 0.963 1.00 0.00 N ATOM 126 CA THR A 362 13.931 -0.676 -0.306 1.00 0.00 C ATOM 127 C THR A 362 14.536 -1.521 -1.424 1.00 0.00 C ATOM 128 O THR A 362 15.576 -2.155 -1.245 1.00 0.00 O ATOM 129 CB THR A 362 14.715 0.647 -0.199 1.00 0.00 C ATOM 130 OG1 THR A 362 14.740 1.307 -1.471 1.00 0.00 O ATOM 131 CG2 THR A 362 16.138 0.399 0.278 1.00 0.00 C ATOM 0 H THR A 362 14.384 -2.310 0.930 1.00 0.00 H new ATOM 0 HA THR A 362 12.890 -0.457 -0.544 1.00 0.00 H new ATOM 0 HB THR A 362 14.212 1.282 0.530 1.00 0.00 H new ATOM 0 HG1 THR A 362 15.238 2.147 -1.394 1.00 0.00 H new ATOM 0 HG21 THR A 362 16.670 1.348 0.345 1.00 0.00 H new ATOM 0 HG22 THR A 362 16.115 -0.074 1.260 1.00 0.00 H new ATOM 0 HG23 THR A 362 16.650 -0.255 -0.428 1.00 0.00 H new ATOM 139 N GLN A 363 13.874 -1.523 -2.576 1.00 0.00 N ATOM 140 CA GLN A 363 14.339 -2.287 -3.728 1.00 0.00 C ATOM 141 C GLN A 363 15.558 -1.630 -4.372 1.00 0.00 C ATOM 142 O GLN A 363 15.580 -0.420 -4.594 1.00 0.00 O ATOM 143 CB GLN A 363 13.214 -2.432 -4.756 1.00 0.00 C ATOM 144 CG GLN A 363 12.660 -1.103 -5.249 1.00 0.00 C ATOM 145 CD GLN A 363 11.535 -1.263 -6.259 1.00 0.00 C ATOM 146 OE1 GLN A 363 11.185 -2.505 -6.581 1.00 0.00 O flip ATOM 147 NE2 GLN A 363 10.985 -0.275 -6.746 1.00 0.00 N flip ATOM 0 H GLN A 363 13.012 -1.003 -2.737 1.00 0.00 H new ATOM 0 HA GLN A 363 14.633 -3.277 -3.379 1.00 0.00 H new ATOM 0 HB2 GLN A 363 13.585 -3.000 -5.609 1.00 0.00 H new ATOM 0 HB3 GLN A 363 12.403 -3.012 -4.315 1.00 0.00 H new ATOM 0 HG2 GLN A 363 12.296 -0.529 -4.397 1.00 0.00 H new ATOM 0 HG3 GLN A 363 13.466 -0.525 -5.701 1.00 0.00 H new ATOM 0 HE21 GLN A 363 11.283 0.661 -6.472 1.00 0.00 H new ATOM 0 HE22 GLN A 363 10.231 -0.393 -7.423 1.00 0.00 H new ATOM 156 N LYS A 364 16.566 -2.445 -4.675 1.00 0.00 N ATOM 157 CA LYS A 364 17.798 -1.966 -5.300 1.00 0.00 C ATOM 158 C LYS A 364 18.461 -3.087 -6.095 1.00 0.00 C ATOM 159 O LYS A 364 19.376 -3.751 -5.605 1.00 0.00 O ATOM 160 CB LYS A 364 18.775 -1.433 -4.245 1.00 0.00 C ATOM 161 CG LYS A 364 18.320 -0.148 -3.572 1.00 0.00 C ATOM 162 CD LYS A 364 19.341 0.340 -2.557 1.00 0.00 C ATOM 163 CE LYS A 364 18.899 1.639 -1.902 1.00 0.00 C ATOM 164 NZ LYS A 364 18.716 2.730 -2.899 1.00 0.00 N ATOM 0 H LYS A 364 16.553 -3.449 -4.496 1.00 0.00 H new ATOM 0 HA LYS A 364 17.537 -1.152 -5.977 1.00 0.00 H new ATOM 0 HB2 LYS A 364 18.922 -2.198 -3.482 1.00 0.00 H new ATOM 0 HB3 LYS A 364 19.743 -1.261 -4.715 1.00 0.00 H new ATOM 0 HG2 LYS A 364 18.159 0.622 -4.327 1.00 0.00 H new ATOM 0 HG3 LYS A 364 17.363 -0.314 -3.077 1.00 0.00 H new ATOM 0 HD2 LYS A 364 19.488 -0.423 -1.792 1.00 0.00 H new ATOM 0 HD3 LYS A 364 20.302 0.488 -3.049 1.00 0.00 H new ATOM 0 HE2 LYS A 364 17.964 1.476 -1.367 1.00 0.00 H new ATOM 0 HE3 LYS A 364 19.640 1.943 -1.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 364 18.649 3.643 -2.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 364 19.528 2.746 -3.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 364 17.843 2.564 -3.439 1.00 0.00 H new ATOM 178 N HIS A 365 17.983 -3.300 -7.320 1.00 0.00 N ATOM 179 CA HIS A 365 18.517 -4.348 -8.184 1.00 0.00 C ATOM 180 C HIS A 365 18.387 -5.709 -7.500 1.00 0.00 C ATOM 181 O HIS A 365 19.310 -6.524 -7.517 1.00 0.00 O ATOM 182 CB HIS A 365 19.980 -4.059 -8.538 1.00 0.00 C ATOM 183 CG HIS A 365 20.538 -4.968 -9.590 1.00 0.00 C ATOM 184 ND1 HIS A 365 19.995 -5.078 -10.853 1.00 0.00 N ATOM 185 CD2 HIS A 365 21.595 -5.814 -9.563 1.00 0.00 C ATOM 186 CE1 HIS A 365 20.694 -5.952 -11.556 1.00 0.00 C ATOM 187 NE2 HIS A 365 21.670 -6.411 -10.796 1.00 0.00 N ATOM 0 H HIS A 365 17.225 -2.759 -7.736 1.00 0.00 H new ATOM 0 HA HIS A 365 17.941 -4.367 -9.109 1.00 0.00 H new ATOM 0 HB2 HIS A 365 20.064 -3.028 -8.880 1.00 0.00 H new ATOM 0 HB3 HIS A 365 20.586 -4.146 -7.636 1.00 0.00 H new ATOM 0 HD2 HIS A 365 22.256 -5.987 -8.727 1.00 0.00 H new ATOM 0 HE1 HIS A 365 20.499 -6.241 -12.578 1.00 0.00 H new ATOM 0 HE2 HIS A 365 22.368 -7.099 -11.079 1.00 0.00 H new ATOM 196 N LYS A 366 17.226 -5.937 -6.893 1.00 0.00 N ATOM 197 CA LYS A 366 16.949 -7.185 -6.190 1.00 0.00 C ATOM 198 C LYS A 366 15.492 -7.203 -5.723 1.00 0.00 C ATOM 199 O LYS A 366 14.987 -6.197 -5.225 1.00 0.00 O ATOM 200 CB LYS A 366 17.905 -7.339 -4.998 1.00 0.00 C ATOM 201 CG LYS A 366 17.835 -8.693 -4.301 1.00 0.00 C ATOM 202 CD LYS A 366 16.658 -8.786 -3.341 1.00 0.00 C ATOM 203 CE LYS A 366 16.781 -7.779 -2.206 1.00 0.00 C ATOM 204 NZ LYS A 366 15.643 -7.875 -1.251 1.00 0.00 N ATOM 0 H LYS A 366 16.457 -5.268 -6.874 1.00 0.00 H new ATOM 0 HA LYS A 366 17.107 -8.025 -6.867 1.00 0.00 H new ATOM 0 HB2 LYS A 366 18.926 -7.175 -5.344 1.00 0.00 H new ATOM 0 HB3 LYS A 366 17.686 -6.558 -4.270 1.00 0.00 H new ATOM 0 HG2 LYS A 366 17.754 -9.481 -5.050 1.00 0.00 H new ATOM 0 HG3 LYS A 366 18.762 -8.867 -3.754 1.00 0.00 H new ATOM 0 HD2 LYS A 366 15.729 -8.611 -3.885 1.00 0.00 H new ATOM 0 HD3 LYS A 366 16.602 -9.794 -2.930 1.00 0.00 H new ATOM 0 HE2 LYS A 366 17.717 -7.946 -1.673 1.00 0.00 H new ATOM 0 HE3 LYS A 366 16.824 -6.771 -2.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 366 15.485 -6.949 -0.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 366 14.784 -8.164 -1.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 366 15.863 -8.579 -0.518 1.00 0.00 H new ATOM 218 N PRO A 367 14.789 -8.341 -5.891 1.00 0.00 N ATOM 219 CA PRO A 367 13.383 -8.463 -5.494 1.00 0.00 C ATOM 220 C PRO A 367 13.125 -7.934 -4.086 1.00 0.00 C ATOM 221 O PRO A 367 13.680 -8.436 -3.109 1.00 0.00 O ATOM 222 CB PRO A 367 13.130 -9.970 -5.553 1.00 0.00 C ATOM 223 CG PRO A 367 14.094 -10.479 -6.563 1.00 0.00 C ATOM 224 CD PRO A 367 15.303 -9.588 -6.492 1.00 0.00 C ATOM 0 HA PRO A 367 12.726 -7.879 -6.139 1.00 0.00 H new ATOM 0 HB2 PRO A 367 13.292 -10.436 -4.581 1.00 0.00 H new ATOM 0 HB3 PRO A 367 12.102 -10.187 -5.843 1.00 0.00 H new ATOM 0 HG2 PRO A 367 14.363 -11.514 -6.354 1.00 0.00 H new ATOM 0 HG3 PRO A 367 13.656 -10.459 -7.561 1.00 0.00 H new ATOM 0 HD2 PRO A 367 16.090 -10.031 -5.882 1.00 0.00 H new ATOM 0 HD3 PRO A 367 15.727 -9.410 -7.480 1.00 0.00 H new ATOM 232 N ALA A 368 12.274 -6.916 -3.994 1.00 0.00 N ATOM 233 CA ALA A 368 11.936 -6.312 -2.711 1.00 0.00 C ATOM 234 C ALA A 368 11.172 -7.287 -1.825 1.00 0.00 C ATOM 235 O ALA A 368 10.290 -8.008 -2.293 1.00 0.00 O ATOM 236 CB ALA A 368 11.122 -5.043 -2.924 1.00 0.00 C ATOM 0 H ALA A 368 11.806 -6.492 -4.795 1.00 0.00 H new ATOM 0 HA ALA A 368 12.866 -6.056 -2.204 1.00 0.00 H new ATOM 0 HB1 ALA A 368 10.876 -4.602 -1.958 1.00 0.00 H new ATOM 0 HB2 ALA A 368 11.704 -4.332 -3.510 1.00 0.00 H new ATOM 0 HB3 ALA A 368 10.202 -5.286 -3.457 1.00 0.00 H new ATOM 242 N GLU A 369 11.514 -7.302 -0.539 1.00 0.00 N ATOM 243 CA GLU A 369 10.858 -8.186 0.418 1.00 0.00 C ATOM 244 C GLU A 369 9.360 -7.918 0.456 1.00 0.00 C ATOM 245 O GLU A 369 8.556 -8.832 0.644 1.00 0.00 O ATOM 246 CB GLU A 369 11.460 -8.007 1.814 1.00 0.00 C ATOM 247 CG GLU A 369 12.952 -8.305 1.883 1.00 0.00 C ATOM 248 CD GLU A 369 13.283 -9.747 1.539 1.00 0.00 C ATOM 249 OE1 GLU A 369 13.018 -10.163 0.392 1.00 0.00 O ATOM 250 OE2 GLU A 369 13.810 -10.459 2.420 1.00 0.00 O ATOM 0 H GLU A 369 12.242 -6.712 -0.137 1.00 0.00 H new ATOM 0 HA GLU A 369 11.019 -9.215 0.097 1.00 0.00 H new ATOM 0 HB2 GLU A 369 11.288 -6.983 2.145 1.00 0.00 H new ATOM 0 HB3 GLU A 369 10.936 -8.660 2.512 1.00 0.00 H new ATOM 0 HG2 GLU A 369 13.482 -7.643 1.198 1.00 0.00 H new ATOM 0 HG3 GLU A 369 13.316 -8.083 2.886 1.00 0.00 H new ATOM 257 N SER A 370 8.996 -6.656 0.271 1.00 0.00 N ATOM 258 CA SER A 370 7.596 -6.248 0.277 1.00 0.00 C ATOM 259 C SER A 370 7.447 -4.816 -0.227 1.00 0.00 C ATOM 260 O SER A 370 8.172 -3.918 0.204 1.00 0.00 O ATOM 261 CB SER A 370 7.011 -6.370 1.685 1.00 0.00 C ATOM 262 OG SER A 370 5.656 -5.957 1.712 1.00 0.00 O ATOM 0 H SER A 370 9.654 -5.893 0.114 1.00 0.00 H new ATOM 0 HA SER A 370 7.047 -6.910 -0.393 1.00 0.00 H new ATOM 0 HB2 SER A 370 7.086 -7.403 2.025 1.00 0.00 H new ATOM 0 HB3 SER A 370 7.593 -5.763 2.378 1.00 0.00 H new ATOM 0 HG SER A 370 5.305 -6.046 2.623 1.00 0.00 H new ATOM 268 N GLN A 371 6.504 -4.612 -1.141 1.00 0.00 N ATOM 269 CA GLN A 371 6.259 -3.289 -1.706 1.00 0.00 C ATOM 270 C GLN A 371 5.744 -2.327 -0.640 1.00 0.00 C ATOM 271 O GLN A 371 4.800 -2.640 0.087 1.00 0.00 O ATOM 272 CB GLN A 371 5.255 -3.367 -2.863 1.00 0.00 C ATOM 273 CG GLN A 371 5.744 -4.184 -4.052 1.00 0.00 C ATOM 274 CD GLN A 371 5.629 -5.686 -3.845 1.00 0.00 C ATOM 275 OE1 GLN A 371 4.882 -6.099 -2.825 1.00 0.00 O flip ATOM 276 NE2 GLN A 371 6.184 -6.470 -4.614 1.00 0.00 N flip ATOM 0 H GLN A 371 5.897 -5.346 -1.507 1.00 0.00 H new ATOM 0 HA GLN A 371 7.208 -2.913 -2.088 1.00 0.00 H new ATOM 0 HB2 GLN A 371 4.325 -3.800 -2.495 1.00 0.00 H new ATOM 0 HB3 GLN A 371 5.025 -2.356 -3.200 1.00 0.00 H new ATOM 0 HG2 GLN A 371 5.172 -3.902 -4.936 1.00 0.00 H new ATOM 0 HG3 GLN A 371 6.785 -3.932 -4.252 1.00 0.00 H new ATOM 0 HE21 GLN A 371 6.749 -6.114 -5.385 1.00 0.00 H new ATOM 0 HE22 GLN A 371 6.079 -7.476 -4.480 1.00 0.00 H new ATOM 285 N GLN A 372 6.365 -1.155 -0.558 1.00 0.00 N ATOM 286 CA GLN A 372 5.965 -0.143 0.415 1.00 0.00 C ATOM 287 C GLN A 372 4.565 0.377 0.107 1.00 0.00 C ATOM 288 O GLN A 372 4.239 0.659 -1.046 1.00 0.00 O ATOM 289 CB GLN A 372 6.965 1.015 0.421 1.00 0.00 C ATOM 290 CG GLN A 372 8.382 0.592 0.776 1.00 0.00 C ATOM 291 CD GLN A 372 9.351 1.757 0.794 1.00 0.00 C ATOM 292 OE1 GLN A 372 9.536 2.440 -0.213 1.00 0.00 O ATOM 293 NE2 GLN A 372 9.974 1.990 1.943 1.00 0.00 N ATOM 0 H GLN A 372 7.147 -0.882 -1.153 1.00 0.00 H new ATOM 0 HA GLN A 372 5.954 -0.605 1.402 1.00 0.00 H new ATOM 0 HB2 GLN A 372 6.970 1.485 -0.563 1.00 0.00 H new ATOM 0 HB3 GLN A 372 6.631 1.770 1.133 1.00 0.00 H new ATOM 0 HG2 GLN A 372 8.379 0.111 1.754 1.00 0.00 H new ATOM 0 HG3 GLN A 372 8.726 -0.151 0.057 1.00 0.00 H new ATOM 0 HE21 GLN A 372 9.789 1.398 2.752 1.00 0.00 H new ATOM 0 HE22 GLN A 372 10.637 2.762 2.016 1.00 0.00 H new ATOM 302 N GLN A 373 3.742 0.501 1.144 1.00 0.00 N ATOM 303 CA GLN A 373 2.376 0.984 0.982 1.00 0.00 C ATOM 304 C GLN A 373 2.367 2.393 0.399 1.00 0.00 C ATOM 305 O GLN A 373 3.099 3.271 0.859 1.00 0.00 O ATOM 306 CB GLN A 373 1.647 0.972 2.325 1.00 0.00 C ATOM 307 CG GLN A 373 0.194 1.407 2.235 1.00 0.00 C ATOM 308 CD GLN A 373 -0.504 1.386 3.580 1.00 0.00 C ATOM 309 OE1 GLN A 373 -1.009 2.538 4.003 1.00 0.00 O flip ATOM 310 NE2 GLN A 373 -0.589 0.345 4.231 1.00 0.00 N flip ATOM 0 H GLN A 373 3.998 0.274 2.105 1.00 0.00 H new ATOM 0 HA GLN A 373 1.859 0.318 0.291 1.00 0.00 H new ATOM 0 HB2 GLN A 373 1.691 -0.034 2.743 1.00 0.00 H new ATOM 0 HB3 GLN A 373 2.171 1.629 3.019 1.00 0.00 H new ATOM 0 HG2 GLN A 373 0.145 2.414 1.820 1.00 0.00 H new ATOM 0 HG3 GLN A 373 -0.336 0.751 1.544 1.00 0.00 H new ATOM 0 HE21 GLN A 373 -0.186 -0.518 3.867 1.00 0.00 H new ATOM 0 HE22 GLN A 373 -1.063 0.346 5.134 1.00 0.00 H new ATOM 319 N ALA A 374 1.534 2.603 -0.615 1.00 0.00 N ATOM 320 CA ALA A 374 1.431 3.904 -1.259 1.00 0.00 C ATOM 321 C ALA A 374 -0.012 4.390 -1.282 1.00 0.00 C ATOM 322 O ALA A 374 -0.921 3.641 -1.638 1.00 0.00 O ATOM 323 CB ALA A 374 1.992 3.838 -2.671 1.00 0.00 C ATOM 0 H ALA A 374 0.921 1.888 -1.007 1.00 0.00 H new ATOM 0 HA ALA A 374 2.017 4.618 -0.680 1.00 0.00 H new ATOM 0 HB1 ALA A 374 1.909 4.818 -3.142 1.00 0.00 H new ATOM 0 HB2 ALA A 374 3.040 3.542 -2.633 1.00 0.00 H new ATOM 0 HB3 ALA A 374 1.429 3.107 -3.252 1.00 0.00 H new ATOM 329 N ALA A 375 -0.214 5.646 -0.901 1.00 0.00 N ATOM 330 CA ALA A 375 -1.546 6.232 -0.881 1.00 0.00 C ATOM 331 C ALA A 375 -2.176 6.186 -2.267 1.00 0.00 C ATOM 332 O ALA A 375 -1.879 7.018 -3.124 1.00 0.00 O ATOM 333 CB ALA A 375 -1.485 7.665 -0.373 1.00 0.00 C ATOM 0 H ALA A 375 0.529 6.277 -0.602 1.00 0.00 H new ATOM 0 HA ALA A 375 -2.168 5.647 -0.203 1.00 0.00 H new ATOM 0 HB1 ALA A 375 -2.488 8.091 -0.363 1.00 0.00 H new ATOM 0 HB2 ALA A 375 -1.077 7.676 0.638 1.00 0.00 H new ATOM 0 HB3 ALA A 375 -0.846 8.257 -1.029 1.00 0.00 H new ATOM 339 N GLU A 376 -3.042 5.201 -2.479 1.00 0.00 N ATOM 340 CA GLU A 376 -3.718 5.032 -3.760 1.00 0.00 C ATOM 341 C GLU A 376 -4.648 6.212 -4.045 1.00 0.00 C ATOM 342 O GLU A 376 -4.423 7.320 -3.562 1.00 0.00 O ATOM 343 CB GLU A 376 -4.507 3.718 -3.759 1.00 0.00 C ATOM 344 CG GLU A 376 -3.676 2.507 -3.359 1.00 0.00 C ATOM 345 CD GLU A 376 -2.561 2.201 -4.344 1.00 0.00 C ATOM 346 OE1 GLU A 376 -2.461 2.903 -5.373 1.00 0.00 O ATOM 347 OE2 GLU A 376 -1.789 1.252 -4.089 1.00 0.00 O ATOM 0 H GLU A 376 -3.293 4.505 -1.777 1.00 0.00 H new ATOM 0 HA GLU A 376 -2.967 4.998 -4.549 1.00 0.00 H new ATOM 0 HB2 GLU A 376 -5.350 3.811 -3.075 1.00 0.00 H new ATOM 0 HB3 GLU A 376 -4.920 3.552 -4.754 1.00 0.00 H new ATOM 0 HG2 GLU A 376 -3.245 2.679 -2.373 1.00 0.00 H new ATOM 0 HG3 GLU A 376 -4.328 1.638 -3.275 1.00 0.00 H new ATOM 354 N THR A 377 -5.691 5.967 -4.831 1.00 0.00 N ATOM 355 CA THR A 377 -6.650 7.008 -5.184 1.00 0.00 C ATOM 356 C THR A 377 -8.038 6.416 -5.380 1.00 0.00 C ATOM 357 O THR A 377 -8.176 5.232 -5.678 1.00 0.00 O ATOM 358 CB THR A 377 -6.232 7.751 -6.467 1.00 0.00 C ATOM 359 OG1 THR A 377 -6.175 6.834 -7.567 1.00 0.00 O ATOM 360 CG2 THR A 377 -4.876 8.420 -6.291 1.00 0.00 C ATOM 0 H THR A 377 -5.894 5.054 -5.237 1.00 0.00 H new ATOM 0 HA THR A 377 -6.669 7.720 -4.358 1.00 0.00 H new ATOM 0 HB THR A 377 -6.976 8.521 -6.671 1.00 0.00 H new ATOM 0 HG1 THR A 377 -5.910 7.314 -8.379 1.00 0.00 H new ATOM 0 HG21 THR A 377 -4.604 8.938 -7.211 1.00 0.00 H new ATOM 0 HG22 THR A 377 -4.928 9.138 -5.472 1.00 0.00 H new ATOM 0 HG23 THR A 377 -4.124 7.664 -6.064 1.00 0.00 H new ATOM 368 N GLU A 378 -9.061 7.245 -5.195 1.00 0.00 N ATOM 369 CA GLU A 378 -10.445 6.801 -5.337 1.00 0.00 C ATOM 370 C GLU A 378 -10.631 5.983 -6.606 1.00 0.00 C ATOM 371 O GLU A 378 -11.296 4.948 -6.597 1.00 0.00 O ATOM 372 CB GLU A 378 -11.387 8.005 -5.347 1.00 0.00 C ATOM 373 CG GLU A 378 -12.859 7.627 -5.378 1.00 0.00 C ATOM 374 CD GLU A 378 -13.772 8.837 -5.391 1.00 0.00 C ATOM 375 OE1 GLU A 378 -13.709 9.638 -4.433 1.00 0.00 O ATOM 376 OE2 GLU A 378 -14.548 8.986 -6.357 1.00 0.00 O ATOM 0 H GLU A 378 -8.958 8.229 -4.946 1.00 0.00 H new ATOM 0 HA GLU A 378 -10.685 6.166 -4.484 1.00 0.00 H new ATOM 0 HB2 GLU A 378 -11.195 8.613 -4.463 1.00 0.00 H new ATOM 0 HB3 GLU A 378 -11.161 8.625 -6.215 1.00 0.00 H new ATOM 0 HG2 GLU A 378 -13.055 7.019 -6.261 1.00 0.00 H new ATOM 0 HG3 GLU A 378 -13.090 7.011 -4.509 1.00 0.00 H new ATOM 383 N GLY A 379 -10.037 6.450 -7.694 1.00 0.00 N ATOM 384 CA GLY A 379 -10.147 5.748 -8.958 1.00 0.00 C ATOM 385 C GLY A 379 -9.502 4.376 -8.927 1.00 0.00 C ATOM 386 O GLY A 379 -10.037 3.421 -9.490 1.00 0.00 O ATOM 0 H GLY A 379 -9.480 7.304 -7.725 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -11.200 5.643 -9.220 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -9.682 6.346 -9.742 1.00 0.00 H new ATOM 390 N SER A 380 -8.348 4.278 -8.277 1.00 0.00 N ATOM 391 CA SER A 380 -7.628 3.013 -8.187 1.00 0.00 C ATOM 392 C SER A 380 -8.351 2.011 -7.288 1.00 0.00 C ATOM 393 O SER A 380 -8.516 0.845 -7.650 1.00 0.00 O ATOM 394 CB SER A 380 -6.216 3.247 -7.668 1.00 0.00 C ATOM 395 OG SER A 380 -5.482 4.089 -8.541 1.00 0.00 O ATOM 0 H SER A 380 -7.891 5.058 -7.805 1.00 0.00 H new ATOM 0 HA SER A 380 -7.582 2.590 -9.191 1.00 0.00 H new ATOM 0 HB2 SER A 380 -6.260 3.697 -6.676 1.00 0.00 H new ATOM 0 HB3 SER A 380 -5.702 2.292 -7.562 1.00 0.00 H new ATOM 0 HG SER A 380 -5.631 5.026 -8.294 1.00 0.00 H new ATOM 401 N CYS A 381 -8.769 2.472 -6.115 1.00 0.00 N ATOM 402 CA CYS A 381 -9.461 1.621 -5.152 1.00 0.00 C ATOM 403 C CYS A 381 -10.715 0.996 -5.756 1.00 0.00 C ATOM 404 O CYS A 381 -10.972 -0.195 -5.574 1.00 0.00 O ATOM 405 CB CYS A 381 -9.831 2.427 -3.909 1.00 0.00 C ATOM 406 SG CYS A 381 -8.417 3.249 -3.108 1.00 0.00 S ATOM 0 H CYS A 381 -8.640 3.435 -5.806 1.00 0.00 H new ATOM 0 HA CYS A 381 -8.782 0.815 -4.874 1.00 0.00 H new ATOM 0 HB2 CYS A 381 -10.568 3.182 -4.184 1.00 0.00 H new ATOM 0 HB3 CYS A 381 -10.308 1.764 -3.188 1.00 0.00 H new ATOM 411 N ASN A 382 -11.493 1.802 -6.473 1.00 0.00 N ATOM 412 CA ASN A 382 -12.720 1.317 -7.101 1.00 0.00 C ATOM 413 C ASN A 382 -12.434 0.097 -7.963 1.00 0.00 C ATOM 414 O ASN A 382 -13.244 -0.827 -8.041 1.00 0.00 O ATOM 415 CB ASN A 382 -13.358 2.415 -7.958 1.00 0.00 C ATOM 416 CG ASN A 382 -13.769 3.635 -7.154 1.00 0.00 C ATOM 417 OD1 ASN A 382 -13.530 3.602 -5.847 1.00 0.00 O flip ATOM 418 ND2 ASN A 382 -14.296 4.601 -7.704 1.00 0.00 N flip ATOM 0 H ASN A 382 -11.298 2.790 -6.634 1.00 0.00 H new ATOM 0 HA ASN A 382 -13.415 1.037 -6.309 1.00 0.00 H new ATOM 0 HB2 ASN A 382 -12.654 2.718 -8.733 1.00 0.00 H new ATOM 0 HB3 ASN A 382 -14.234 2.009 -8.465 1.00 0.00 H new ATOM 0 HD21 ASN A 382 -14.462 4.587 -8.710 1.00 0.00 H new ATOM 0 HD22 ASN A 382 -14.567 5.416 -7.154 1.00 0.00 H new ATOM 425 N LYS A 383 -11.276 0.105 -8.612 1.00 0.00 N ATOM 426 CA LYS A 383 -10.876 -0.995 -9.475 1.00 0.00 C ATOM 427 C LYS A 383 -10.526 -2.230 -8.654 1.00 0.00 C ATOM 428 O LYS A 383 -10.805 -3.358 -9.064 1.00 0.00 O ATOM 429 CB LYS A 383 -9.683 -0.579 -10.339 1.00 0.00 C ATOM 430 CG LYS A 383 -9.883 0.750 -11.054 1.00 0.00 C ATOM 431 CD LYS A 383 -11.139 0.753 -11.917 1.00 0.00 C ATOM 432 CE LYS A 383 -11.066 -0.287 -13.024 1.00 0.00 C ATOM 433 NZ LYS A 383 -12.295 -0.289 -13.864 1.00 0.00 N ATOM 0 H LYS A 383 -10.597 0.864 -8.555 1.00 0.00 H new ATOM 0 HA LYS A 383 -11.715 -1.244 -10.124 1.00 0.00 H new ATOM 0 HB2 LYS A 383 -8.795 -0.514 -9.710 1.00 0.00 H new ATOM 0 HB3 LYS A 383 -9.493 -1.356 -11.080 1.00 0.00 H new ATOM 0 HG2 LYS A 383 -9.948 1.551 -10.318 1.00 0.00 H new ATOM 0 HG3 LYS A 383 -9.014 0.960 -11.678 1.00 0.00 H new ATOM 0 HD2 LYS A 383 -12.010 0.558 -11.292 1.00 0.00 H new ATOM 0 HD3 LYS A 383 -11.276 1.741 -12.355 1.00 0.00 H new ATOM 0 HE2 LYS A 383 -10.197 -0.089 -13.652 1.00 0.00 H new ATOM 0 HE3 LYS A 383 -10.924 -1.275 -12.586 1.00 0.00 H new ATOM 0 HZ1 LYS A 383 -12.206 -1.011 -14.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 383 -13.121 -0.503 -13.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 383 -12.417 0.646 -14.303 1.00 0.00 H new ATOM 447 N LYS A 384 -9.895 -2.014 -7.501 1.00 0.00 N ATOM 448 CA LYS A 384 -9.489 -3.095 -6.632 1.00 0.00 C ATOM 449 C LYS A 384 -10.652 -3.986 -6.226 1.00 0.00 C ATOM 450 O LYS A 384 -11.783 -3.829 -6.687 1.00 0.00 O ATOM 451 CB LYS A 384 -8.835 -2.511 -5.386 1.00 0.00 C ATOM 452 CG LYS A 384 -7.747 -1.503 -5.700 1.00 0.00 C ATOM 453 CD LYS A 384 -6.641 -2.111 -6.543 1.00 0.00 C ATOM 454 CE LYS A 384 -6.908 -1.959 -8.033 1.00 0.00 C ATOM 455 NZ LYS A 384 -5.746 -2.395 -8.855 1.00 0.00 N ATOM 0 H LYS A 384 -9.656 -1.086 -7.152 1.00 0.00 H new ATOM 0 HA LYS A 384 -8.785 -3.718 -7.184 1.00 0.00 H new ATOM 0 HB2 LYS A 384 -9.599 -2.033 -4.773 1.00 0.00 H new ATOM 0 HB3 LYS A 384 -8.411 -3.321 -4.792 1.00 0.00 H new ATOM 0 HG2 LYS A 384 -8.180 -0.653 -6.227 1.00 0.00 H new ATOM 0 HG3 LYS A 384 -7.327 -1.121 -4.770 1.00 0.00 H new ATOM 0 HD2 LYS A 384 -5.693 -1.634 -6.295 1.00 0.00 H new ATOM 0 HD3 LYS A 384 -6.540 -3.169 -6.299 1.00 0.00 H new ATOM 0 HE2 LYS A 384 -7.785 -2.545 -8.306 1.00 0.00 H new ATOM 0 HE3 LYS A 384 -7.139 -0.917 -8.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 384 -5.970 -2.275 -9.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 384 -4.914 -1.819 -8.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 384 -5.541 -3.396 -8.663 1.00 0.00 H new ATOM 469 N ASP A 385 -10.343 -4.912 -5.338 1.00 0.00 N ATOM 470 CA ASP A 385 -11.311 -5.855 -4.806 1.00 0.00 C ATOM 471 C ASP A 385 -11.005 -6.106 -3.337 1.00 0.00 C ATOM 472 O ASP A 385 -10.326 -5.305 -2.706 1.00 0.00 O ATOM 473 CB ASP A 385 -11.266 -7.170 -5.586 1.00 0.00 C ATOM 474 CG ASP A 385 -11.673 -7.008 -7.039 1.00 0.00 C ATOM 475 OD1 ASP A 385 -10.968 -6.291 -7.777 1.00 0.00 O ATOM 476 OD2 ASP A 385 -12.699 -7.597 -7.436 1.00 0.00 O ATOM 0 H ASP A 385 -9.403 -5.033 -4.961 1.00 0.00 H new ATOM 0 HA ASP A 385 -12.312 -5.436 -4.906 1.00 0.00 H new ATOM 0 HB2 ASP A 385 -10.257 -7.580 -5.540 1.00 0.00 H new ATOM 0 HB3 ASP A 385 -11.926 -7.893 -5.107 1.00 0.00 H new ATOM 481 N GLN A 386 -11.487 -7.212 -2.791 1.00 0.00 N ATOM 482 CA GLN A 386 -11.230 -7.518 -1.389 1.00 0.00 C ATOM 483 C GLN A 386 -9.730 -7.565 -1.110 1.00 0.00 C ATOM 484 O GLN A 386 -9.210 -6.781 -0.316 1.00 0.00 O ATOM 485 CB GLN A 386 -11.875 -8.852 -1.005 1.00 0.00 C ATOM 486 CG GLN A 386 -11.664 -9.230 0.453 1.00 0.00 C ATOM 487 CD GLN A 386 -12.303 -10.559 0.824 1.00 0.00 C ATOM 488 OE1 GLN A 386 -12.955 -11.205 -0.138 1.00 0.00 O flip ATOM 489 NE2 GLN A 386 -12.210 -11.000 1.969 1.00 0.00 N flip ATOM 0 H GLN A 386 -12.050 -7.904 -3.286 1.00 0.00 H new ATOM 0 HA GLN A 386 -11.671 -6.725 -0.784 1.00 0.00 H new ATOM 0 HB2 GLN A 386 -12.945 -8.801 -1.208 1.00 0.00 H new ATOM 0 HB3 GLN A 386 -11.468 -9.639 -1.639 1.00 0.00 H new ATOM 0 HG2 GLN A 386 -10.595 -9.278 0.658 1.00 0.00 H new ATOM 0 HG3 GLN A 386 -12.076 -8.446 1.089 1.00 0.00 H new ATOM 0 HE21 GLN A 386 -11.701 -10.473 2.679 1.00 0.00 H new ATOM 0 HE22 GLN A 386 -12.642 -11.892 2.209 1.00 0.00 H new ATOM 498 N ASN A 387 -9.042 -8.488 -1.771 1.00 0.00 N ATOM 499 CA ASN A 387 -7.607 -8.652 -1.601 1.00 0.00 C ATOM 500 C ASN A 387 -6.824 -7.492 -2.217 1.00 0.00 C ATOM 501 O ASN A 387 -5.622 -7.359 -1.986 1.00 0.00 O ATOM 502 CB ASN A 387 -7.166 -9.973 -2.228 1.00 0.00 C ATOM 503 CG ASN A 387 -5.673 -10.184 -2.143 1.00 0.00 C ATOM 504 OD1 ASN A 387 -5.096 -10.218 -1.056 1.00 0.00 O ATOM 505 ND2 ASN A 387 -5.038 -10.328 -3.296 1.00 0.00 N ATOM 0 H ASN A 387 -9.461 -9.139 -2.435 1.00 0.00 H new ATOM 0 HA ASN A 387 -7.393 -8.659 -0.532 1.00 0.00 H new ATOM 0 HB2 ASN A 387 -7.675 -10.797 -1.728 1.00 0.00 H new ATOM 0 HB3 ASN A 387 -7.474 -9.996 -3.273 1.00 0.00 H new ATOM 0 HD21 ASN A 387 -4.029 -10.474 -3.308 1.00 0.00 H new ATOM 0 HD22 ASN A 387 -5.558 -10.293 -4.173 1.00 0.00 H new ATOM 512 N GLU A 388 -7.498 -6.660 -3.006 1.00 0.00 N ATOM 513 CA GLU A 388 -6.837 -5.528 -3.650 1.00 0.00 C ATOM 514 C GLU A 388 -7.188 -4.216 -2.965 1.00 0.00 C ATOM 515 O GLU A 388 -6.565 -3.188 -3.233 1.00 0.00 O ATOM 516 CB GLU A 388 -7.199 -5.469 -5.135 1.00 0.00 C ATOM 517 CG GLU A 388 -6.763 -6.698 -5.918 1.00 0.00 C ATOM 518 CD GLU A 388 -7.135 -6.619 -7.387 1.00 0.00 C ATOM 519 OE1 GLU A 388 -7.739 -5.605 -7.794 1.00 0.00 O ATOM 520 OE2 GLU A 388 -6.822 -7.573 -8.129 1.00 0.00 O ATOM 0 H GLU A 388 -8.493 -6.746 -3.214 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.761 -5.675 -3.557 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -8.278 -5.350 -5.233 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.740 -4.585 -5.577 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -5.683 -6.818 -5.827 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -7.220 -7.585 -5.479 1.00 0.00 H new ATOM 527 N CYS A 389 -8.172 -4.250 -2.072 1.00 0.00 N ATOM 528 CA CYS A 389 -8.562 -3.046 -1.356 1.00 0.00 C ATOM 529 C CYS A 389 -7.400 -2.615 -0.474 1.00 0.00 C ATOM 530 O CYS A 389 -7.174 -3.177 0.598 1.00 0.00 O ATOM 531 CB CYS A 389 -9.823 -3.292 -0.523 1.00 0.00 C ATOM 532 SG CYS A 389 -10.721 -1.773 -0.061 1.00 0.00 S ATOM 0 H CYS A 389 -8.705 -5.085 -1.831 1.00 0.00 H new ATOM 0 HA CYS A 389 -8.797 -2.253 -2.066 1.00 0.00 H new ATOM 0 HB2 CYS A 389 -10.495 -3.941 -1.084 1.00 0.00 H new ATOM 0 HB3 CYS A 389 -9.546 -3.828 0.385 1.00 0.00 H new ATOM 537 N LYS A 390 -6.639 -1.643 -0.959 1.00 0.00 N ATOM 538 CA LYS A 390 -5.462 -1.164 -0.247 1.00 0.00 C ATOM 539 C LYS A 390 -5.827 -0.410 1.025 1.00 0.00 C ATOM 540 O LYS A 390 -6.967 0.017 1.207 1.00 0.00 O ATOM 541 CB LYS A 390 -4.618 -0.299 -1.172 1.00 0.00 C ATOM 542 CG LYS A 390 -4.058 -1.069 -2.364 1.00 0.00 C ATOM 543 CD LYS A 390 -3.000 -2.076 -1.935 1.00 0.00 C ATOM 544 CE LYS A 390 -1.799 -1.394 -1.297 1.00 0.00 C ATOM 545 NZ LYS A 390 -0.766 -2.376 -0.867 1.00 0.00 N ATOM 0 H LYS A 390 -6.816 -1.170 -1.845 1.00 0.00 H new ATOM 0 HA LYS A 390 -4.879 -2.032 0.062 1.00 0.00 H new ATOM 0 HB2 LYS A 390 -5.223 0.532 -1.535 1.00 0.00 H new ATOM 0 HB3 LYS A 390 -3.793 0.132 -0.605 1.00 0.00 H new ATOM 0 HG2 LYS A 390 -4.869 -1.588 -2.876 1.00 0.00 H new ATOM 0 HG3 LYS A 390 -3.626 -0.369 -3.079 1.00 0.00 H new ATOM 0 HD2 LYS A 390 -3.435 -2.782 -1.228 1.00 0.00 H new ATOM 0 HD3 LYS A 390 -2.674 -2.652 -2.801 1.00 0.00 H new ATOM 0 HE2 LYS A 390 -1.360 -0.693 -2.007 1.00 0.00 H new ATOM 0 HE3 LYS A 390 -2.127 -0.812 -0.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 390 0.035 -1.871 -0.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 390 -1.177 -3.030 -0.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 390 -0.434 -2.914 -1.693 1.00 0.00 H new ATOM 559 N SER A 391 -4.844 -0.284 1.916 1.00 0.00 N ATOM 560 CA SER A 391 -5.038 0.381 3.201 1.00 0.00 C ATOM 561 C SER A 391 -5.720 1.742 3.047 1.00 0.00 C ATOM 562 O SER A 391 -6.760 1.977 3.662 1.00 0.00 O ATOM 563 CB SER A 391 -3.702 0.535 3.934 1.00 0.00 C ATOM 564 OG SER A 391 -3.876 1.184 5.181 1.00 0.00 O ATOM 0 H SER A 391 -3.899 -0.637 1.768 1.00 0.00 H new ATOM 0 HA SER A 391 -5.699 -0.251 3.795 1.00 0.00 H new ATOM 0 HB2 SER A 391 -3.254 -0.446 4.091 1.00 0.00 H new ATOM 0 HB3 SER A 391 -3.009 1.106 3.317 1.00 0.00 H new ATOM 0 HG SER A 391 -3.009 1.269 5.629 1.00 0.00 H new ATOM 570 N PRO A 392 -5.167 2.663 2.225 1.00 0.00 N ATOM 571 CA PRO A 392 -5.771 3.975 2.025 1.00 0.00 C ATOM 572 C PRO A 392 -7.245 3.854 1.654 1.00 0.00 C ATOM 573 O PRO A 392 -8.058 4.717 1.989 1.00 0.00 O ATOM 574 CB PRO A 392 -4.971 4.590 0.870 1.00 0.00 C ATOM 575 CG PRO A 392 -4.065 3.528 0.356 1.00 0.00 C ATOM 576 CD PRO A 392 -3.937 2.505 1.437 1.00 0.00 C ATOM 0 HA PRO A 392 -5.739 4.583 2.929 1.00 0.00 H new ATOM 0 HB2 PRO A 392 -5.638 4.942 0.083 1.00 0.00 H new ATOM 0 HB3 PRO A 392 -4.399 5.452 1.213 1.00 0.00 H new ATOM 0 HG2 PRO A 392 -4.470 3.081 -0.552 1.00 0.00 H new ATOM 0 HG3 PRO A 392 -3.090 3.943 0.100 1.00 0.00 H new ATOM 0 HD2 PRO A 392 -3.853 1.499 1.026 1.00 0.00 H new ATOM 0 HD3 PRO A 392 -3.049 2.676 2.045 1.00 0.00 H new ATOM 584 N CYS A 393 -7.576 2.770 0.959 1.00 0.00 N ATOM 585 CA CYS A 393 -8.947 2.513 0.541 1.00 0.00 C ATOM 586 C CYS A 393 -9.750 1.892 1.679 1.00 0.00 C ATOM 587 O CYS A 393 -9.236 1.070 2.438 1.00 0.00 O ATOM 588 CB CYS A 393 -8.978 1.563 -0.654 1.00 0.00 C ATOM 589 SG CYS A 393 -7.655 1.831 -1.879 1.00 0.00 S ATOM 0 H CYS A 393 -6.909 2.053 0.673 1.00 0.00 H new ATOM 0 HA CYS A 393 -9.389 3.469 0.260 1.00 0.00 H new ATOM 0 HB2 CYS A 393 -8.912 0.539 -0.287 1.00 0.00 H new ATOM 0 HB3 CYS A 393 -9.942 1.662 -1.154 1.00 0.00 H new ATOM 594 N LYS A 394 -11.017 2.268 1.774 1.00 0.00 N ATOM 595 CA LYS A 394 -11.902 1.728 2.802 1.00 0.00 C ATOM 596 C LYS A 394 -12.671 0.531 2.264 1.00 0.00 C ATOM 597 O LYS A 394 -13.345 0.627 1.239 1.00 0.00 O ATOM 598 CB LYS A 394 -12.887 2.792 3.290 1.00 0.00 C ATOM 599 CG LYS A 394 -12.241 3.909 4.090 1.00 0.00 C ATOM 600 CD LYS A 394 -13.276 4.911 4.583 1.00 0.00 C ATOM 601 CE LYS A 394 -14.297 4.258 5.503 1.00 0.00 C ATOM 602 NZ LYS A 394 -15.326 5.228 5.970 1.00 0.00 N ATOM 0 H LYS A 394 -11.458 2.946 1.152 1.00 0.00 H new ATOM 0 HA LYS A 394 -11.284 1.411 3.642 1.00 0.00 H new ATOM 0 HB2 LYS A 394 -13.397 3.223 2.428 1.00 0.00 H new ATOM 0 HB3 LYS A 394 -13.649 2.313 3.904 1.00 0.00 H new ATOM 0 HG2 LYS A 394 -11.707 3.487 4.941 1.00 0.00 H new ATOM 0 HG3 LYS A 394 -11.503 4.421 3.473 1.00 0.00 H new ATOM 0 HD2 LYS A 394 -12.775 5.721 5.112 1.00 0.00 H new ATOM 0 HD3 LYS A 394 -13.787 5.356 3.729 1.00 0.00 H new ATOM 0 HE2 LYS A 394 -14.785 3.436 4.979 1.00 0.00 H new ATOM 0 HE3 LYS A 394 -13.786 3.828 6.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 394 -16.002 4.743 6.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 394 -14.864 5.999 6.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 394 -15.831 5.620 5.150 1.00 0.00 H new ATOM 616 N TRP A 395 -12.573 -0.595 2.959 1.00 0.00 N ATOM 617 CA TRP A 395 -13.270 -1.799 2.537 1.00 0.00 C ATOM 618 C TRP A 395 -14.714 -1.783 3.022 1.00 0.00 C ATOM 619 O TRP A 395 -14.981 -1.546 4.200 1.00 0.00 O ATOM 620 CB TRP A 395 -12.555 -3.049 3.055 1.00 0.00 C ATOM 621 CG TRP A 395 -13.156 -4.328 2.552 1.00 0.00 C ATOM 622 CD1 TRP A 395 -13.517 -5.413 3.299 1.00 0.00 C ATOM 623 CD2 TRP A 395 -13.462 -4.658 1.190 1.00 0.00 C ATOM 624 NE1 TRP A 395 -14.030 -6.395 2.486 1.00 0.00 N ATOM 625 CE2 TRP A 395 -14.006 -5.957 1.189 1.00 0.00 C ATOM 626 CE3 TRP A 395 -13.329 -3.983 -0.029 1.00 0.00 C ATOM 627 CZ2 TRP A 395 -14.417 -6.590 0.019 1.00 0.00 C ATOM 628 CZ3 TRP A 395 -13.738 -4.613 -1.188 1.00 0.00 C ATOM 629 CH2 TRP A 395 -14.276 -5.905 -1.157 1.00 0.00 C ATOM 0 H TRP A 395 -12.022 -0.698 3.811 1.00 0.00 H new ATOM 0 HA TRP A 395 -13.269 -1.824 1.447 1.00 0.00 H new ATOM 0 HB2 TRP A 395 -11.506 -3.008 2.760 1.00 0.00 H new ATOM 0 HB3 TRP A 395 -12.580 -3.048 4.145 1.00 0.00 H new ATOM 0 HD1 TRP A 395 -13.414 -5.488 4.371 1.00 0.00 H new ATOM 0 HE1 TRP A 395 -14.373 -7.303 2.798 1.00 0.00 H new ATOM 0 HE3 TRP A 395 -12.914 -2.987 -0.063 1.00 0.00 H new ATOM 0 HZ2 TRP A 395 -14.833 -7.587 0.039 1.00 0.00 H new ATOM 0 HZ3 TRP A 395 -13.641 -4.100 -2.134 1.00 0.00 H new ATOM 0 HH2 TRP A 395 -14.586 -6.371 -2.081 1.00 0.00 H new ATOM 640 N HIS A 396 -15.642 -2.039 2.107 1.00 0.00 N ATOM 641 CA HIS A 396 -17.060 -2.056 2.441 1.00 0.00 C ATOM 642 C HIS A 396 -17.597 -3.482 2.448 1.00 0.00 C ATOM 643 O HIS A 396 -17.729 -4.113 1.396 1.00 0.00 O ATOM 644 CB HIS A 396 -17.852 -1.202 1.450 1.00 0.00 C ATOM 645 CG HIS A 396 -17.459 0.243 1.459 1.00 0.00 C ATOM 646 ND1 HIS A 396 -17.562 1.043 2.577 1.00 0.00 N ATOM 647 CD2 HIS A 396 -16.963 1.032 0.478 1.00 0.00 C ATOM 648 CE1 HIS A 396 -17.146 2.262 2.283 1.00 0.00 C ATOM 649 NE2 HIS A 396 -16.776 2.282 1.016 1.00 0.00 N ATOM 0 H HIS A 396 -15.437 -2.238 1.128 1.00 0.00 H new ATOM 0 HA HIS A 396 -17.178 -1.637 3.440 1.00 0.00 H new ATOM 0 HB2 HIS A 396 -17.713 -1.602 0.446 1.00 0.00 H new ATOM 0 HB3 HIS A 396 -18.914 -1.283 1.681 1.00 0.00 H new ATOM 0 HD2 HIS A 396 -16.753 0.734 -0.539 1.00 0.00 H new ATOM 0 HE1 HIS A 396 -17.114 3.100 2.964 1.00 0.00 H new ATOM 0 HE2 HIS A 396 -16.411 3.094 0.518 1.00 0.00 H new ATOM 658 N ASN A 397 -17.910 -3.975 3.643 1.00 0.00 N ATOM 659 CA ASN A 397 -18.441 -5.323 3.810 1.00 0.00 C ATOM 660 C ASN A 397 -19.958 -5.332 3.655 1.00 0.00 C ATOM 661 O ASN A 397 -20.638 -4.396 4.076 1.00 0.00 O ATOM 662 CB ASN A 397 -18.054 -5.881 5.182 1.00 0.00 C ATOM 663 CG ASN A 397 -18.616 -5.056 6.323 1.00 0.00 C ATOM 664 OD1 ASN A 397 -18.327 -3.865 6.445 1.00 0.00 O ATOM 665 ND2 ASN A 397 -19.423 -5.688 7.168 1.00 0.00 N ATOM 0 H ASN A 397 -17.804 -3.456 4.515 1.00 0.00 H new ATOM 0 HA ASN A 397 -18.010 -5.955 3.034 1.00 0.00 H new ATOM 0 HB2 ASN A 397 -18.413 -6.907 5.268 1.00 0.00 H new ATOM 0 HB3 ASN A 397 -16.968 -5.916 5.263 1.00 0.00 H new ATOM 0 HD21 ASN A 397 -19.831 -5.185 7.956 1.00 0.00 H new ATOM 0 HD22 ASN A 397 -19.635 -6.676 7.028 1.00 0.00 H new ATOM 672 N ASP A 398 -20.478 -6.394 3.049 1.00 0.00 N ATOM 673 CA ASP A 398 -21.915 -6.531 2.833 1.00 0.00 C ATOM 674 C ASP A 398 -22.445 -5.372 1.992 1.00 0.00 C ATOM 675 O ASP A 398 -23.624 -5.022 2.065 1.00 0.00 O ATOM 676 CB ASP A 398 -22.648 -6.593 4.178 1.00 0.00 C ATOM 677 CG ASP A 398 -24.132 -6.867 4.024 1.00 0.00 C ATOM 678 OD1 ASP A 398 -24.485 -7.925 3.461 1.00 0.00 O ATOM 679 OD2 ASP A 398 -24.940 -6.024 4.467 1.00 0.00 O ATOM 0 H ASP A 398 -19.924 -7.175 2.697 1.00 0.00 H new ATOM 0 HA ASP A 398 -22.097 -7.459 2.291 1.00 0.00 H new ATOM 0 HB2 ASP A 398 -22.201 -7.372 4.795 1.00 0.00 H new ATOM 0 HB3 ASP A 398 -22.510 -5.650 4.706 1.00 0.00 H new ATOM 684 N ALA A 399 -21.567 -4.788 1.183 1.00 0.00 N ATOM 685 CA ALA A 399 -21.948 -3.679 0.317 1.00 0.00 C ATOM 686 C ALA A 399 -22.729 -4.195 -0.888 1.00 0.00 C ATOM 687 O ALA A 399 -23.399 -5.224 -0.805 1.00 0.00 O ATOM 688 CB ALA A 399 -20.707 -2.913 -0.132 1.00 0.00 C ATOM 0 H ALA A 399 -20.588 -5.064 1.109 1.00 0.00 H new ATOM 0 HA ALA A 399 -22.590 -2.998 0.876 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -21.003 -2.087 -0.778 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -20.185 -2.521 0.741 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -20.044 -3.583 -0.680 1.00 0.00 H new ATOM 694 N GLU A 400 -22.625 -3.491 -2.010 1.00 0.00 N ATOM 695 CA GLU A 400 -23.307 -3.902 -3.231 1.00 0.00 C ATOM 696 C GLU A 400 -22.476 -4.965 -3.941 1.00 0.00 C ATOM 697 O GLU A 400 -22.004 -4.752 -5.060 1.00 0.00 O ATOM 698 CB GLU A 400 -23.546 -2.699 -4.148 1.00 0.00 C ATOM 699 CG GLU A 400 -24.363 -3.027 -5.389 1.00 0.00 C ATOM 700 CD GLU A 400 -24.598 -1.817 -6.273 1.00 0.00 C ATOM 701 OE1 GLU A 400 -24.118 -0.718 -5.921 1.00 0.00 O ATOM 702 OE2 GLU A 400 -25.265 -1.967 -7.319 1.00 0.00 O ATOM 0 H GLU A 400 -22.077 -2.636 -2.099 1.00 0.00 H new ATOM 0 HA GLU A 400 -24.279 -4.322 -2.974 1.00 0.00 H new ATOM 0 HB2 GLU A 400 -24.057 -1.919 -3.583 1.00 0.00 H new ATOM 0 HB3 GLU A 400 -22.583 -2.291 -4.455 1.00 0.00 H new ATOM 0 HG2 GLU A 400 -23.849 -3.797 -5.964 1.00 0.00 H new ATOM 0 HG3 GLU A 400 -25.324 -3.443 -5.087 1.00 0.00 H new ATOM 709 N ASN A 401 -22.271 -6.092 -3.253 1.00 0.00 N ATOM 710 CA ASN A 401 -21.467 -7.197 -3.766 1.00 0.00 C ATOM 711 C ASN A 401 -19.998 -6.878 -3.544 1.00 0.00 C ATOM 712 O ASN A 401 -19.168 -7.023 -4.443 1.00 0.00 O ATOM 713 CB ASN A 401 -21.745 -7.457 -5.253 1.00 0.00 C ATOM 714 CG ASN A 401 -23.219 -7.687 -5.550 1.00 0.00 C ATOM 715 OD1 ASN A 401 -24.058 -7.652 -4.518 1.00 0.00 O flip ATOM 716 ND2 ASN A 401 -23.601 -7.896 -6.703 1.00 0.00 N flip ATOM 0 H ASN A 401 -22.659 -6.261 -2.325 1.00 0.00 H new ATOM 0 HA ASN A 401 -21.735 -8.107 -3.229 1.00 0.00 H new ATOM 0 HB2 ASN A 401 -21.390 -6.608 -5.837 1.00 0.00 H new ATOM 0 HB3 ASN A 401 -21.174 -8.327 -5.577 1.00 0.00 H new ATOM 0 HD21 ASN A 401 -22.927 -7.915 -7.468 1.00 0.00 H new ATOM 0 HD22 ASN A 401 -24.591 -8.050 -6.892 1.00 0.00 H new ATOM 723 N LYS A 402 -19.706 -6.414 -2.329 1.00 0.00 N ATOM 724 CA LYS A 402 -18.352 -6.030 -1.935 1.00 0.00 C ATOM 725 C LYS A 402 -17.936 -4.759 -2.665 1.00 0.00 C ATOM 726 O LYS A 402 -18.025 -4.683 -3.890 1.00 0.00 O ATOM 727 CB LYS A 402 -17.357 -7.159 -2.231 1.00 0.00 C ATOM 728 CG LYS A 402 -17.685 -8.466 -1.523 1.00 0.00 C ATOM 729 CD LYS A 402 -17.658 -8.309 -0.011 1.00 0.00 C ATOM 730 CE LYS A 402 -17.973 -9.622 0.688 1.00 0.00 C ATOM 731 NZ LYS A 402 -19.326 -10.131 0.332 1.00 0.00 N ATOM 0 H LYS A 402 -20.401 -6.294 -1.592 1.00 0.00 H new ATOM 0 HA LYS A 402 -18.347 -5.842 -0.861 1.00 0.00 H new ATOM 0 HB2 LYS A 402 -17.331 -7.335 -3.306 1.00 0.00 H new ATOM 0 HB3 LYS A 402 -16.358 -6.837 -1.936 1.00 0.00 H new ATOM 0 HG2 LYS A 402 -18.670 -8.812 -1.835 1.00 0.00 H new ATOM 0 HG3 LYS A 402 -16.969 -9.232 -1.822 1.00 0.00 H new ATOM 0 HD2 LYS A 402 -16.676 -7.955 0.302 1.00 0.00 H new ATOM 0 HD3 LYS A 402 -18.381 -7.552 0.291 1.00 0.00 H new ATOM 0 HE2 LYS A 402 -17.223 -10.366 0.418 1.00 0.00 H new ATOM 0 HE3 LYS A 402 -17.910 -9.483 1.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 402 -19.592 -10.896 0.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 402 -20.018 -9.358 0.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 402 -19.315 -10.495 -0.642 1.00 0.00 H new ATOM 745 N LYS A 403 -17.497 -3.752 -1.912 1.00 0.00 N ATOM 746 CA LYS A 403 -17.095 -2.485 -2.514 1.00 0.00 C ATOM 747 C LYS A 403 -15.867 -1.889 -1.831 1.00 0.00 C ATOM 748 O LYS A 403 -15.718 -1.976 -0.615 1.00 0.00 O ATOM 749 CB LYS A 403 -18.249 -1.482 -2.459 1.00 0.00 C ATOM 750 CG LYS A 403 -19.502 -1.957 -3.175 1.00 0.00 C ATOM 751 CD LYS A 403 -20.564 -0.868 -3.229 1.00 0.00 C ATOM 752 CE LYS A 403 -20.086 0.341 -4.018 1.00 0.00 C ATOM 753 NZ LYS A 403 -21.120 1.412 -4.081 1.00 0.00 N ATOM 0 H LYS A 403 -17.412 -3.788 -0.896 1.00 0.00 H new ATOM 0 HA LYS A 403 -16.834 -2.691 -3.552 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -18.492 -1.277 -1.416 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -17.923 -0.541 -2.901 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -19.247 -2.268 -4.188 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -19.904 -2.832 -2.665 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -21.471 -1.265 -3.685 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -20.824 -0.562 -2.216 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -19.180 0.738 -3.559 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -19.822 0.032 -5.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -20.753 2.217 -4.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -21.976 1.042 -4.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -21.354 1.726 -3.117 1.00 0.00 H new ATOM 767 N CYS A 404 -15.000 -1.270 -2.629 1.00 0.00 N ATOM 768 CA CYS A 404 -13.789 -0.636 -2.113 1.00 0.00 C ATOM 769 C CYS A 404 -13.663 0.779 -2.674 1.00 0.00 C ATOM 770 O CYS A 404 -13.724 0.979 -3.888 1.00 0.00 O ATOM 771 CB CYS A 404 -12.549 -1.459 -2.490 1.00 0.00 C ATOM 772 SG CYS A 404 -10.980 -0.800 -1.832 1.00 0.00 S ATOM 0 H CYS A 404 -15.114 -1.194 -3.640 1.00 0.00 H new ATOM 0 HA CYS A 404 -13.858 -0.587 -1.026 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -12.681 -2.479 -2.129 1.00 0.00 H new ATOM 0 HB3 CYS A 404 -12.480 -1.512 -3.576 1.00 0.00 H new ATOM 777 N THR A 405 -13.498 1.759 -1.789 1.00 0.00 N ATOM 778 CA THR A 405 -13.377 3.153 -2.210 1.00 0.00 C ATOM 779 C THR A 405 -12.367 3.908 -1.354 1.00 0.00 C ATOM 780 O THR A 405 -12.381 3.814 -0.128 1.00 0.00 O ATOM 781 CB THR A 405 -14.731 3.884 -2.139 1.00 0.00 C ATOM 782 OG1 THR A 405 -15.224 3.873 -0.795 1.00 0.00 O ATOM 783 CG2 THR A 405 -15.749 3.230 -3.061 1.00 0.00 C ATOM 0 H THR A 405 -13.445 1.615 -0.781 1.00 0.00 H new ATOM 0 HA THR A 405 -13.032 3.135 -3.244 1.00 0.00 H new ATOM 0 HB THR A 405 -14.579 4.914 -2.463 1.00 0.00 H new ATOM 0 HG1 THR A 405 -14.472 3.801 -0.171 1.00 0.00 H new ATOM 0 HG21 THR A 405 -16.697 3.764 -2.993 1.00 0.00 H new ATOM 0 HG22 THR A 405 -15.385 3.265 -4.088 1.00 0.00 H new ATOM 0 HG23 THR A 405 -15.895 2.192 -2.763 1.00 0.00 H new ATOM 791 N LEU A 406 -11.492 4.657 -2.016 1.00 0.00 N ATOM 792 CA LEU A 406 -10.464 5.432 -1.339 1.00 0.00 C ATOM 793 C LEU A 406 -11.074 6.446 -0.383 1.00 0.00 C ATOM 794 O LEU A 406 -12.106 7.051 -0.674 1.00 0.00 O ATOM 795 CB LEU A 406 -9.590 6.144 -2.372 1.00 0.00 C ATOM 796 CG LEU A 406 -8.290 6.757 -1.846 1.00 0.00 C ATOM 797 CD1 LEU A 406 -8.555 8.054 -1.101 1.00 0.00 C ATOM 798 CD2 LEU A 406 -7.560 5.768 -0.955 1.00 0.00 C ATOM 0 H LEU A 406 -11.477 4.743 -3.032 1.00 0.00 H new ATOM 0 HA LEU A 406 -9.851 4.747 -0.753 1.00 0.00 H new ATOM 0 HB2 LEU A 406 -9.340 5.432 -3.159 1.00 0.00 H new ATOM 0 HB3 LEU A 406 -10.180 6.935 -2.834 1.00 0.00 H new ATOM 0 HG LEU A 406 -7.656 6.988 -2.702 1.00 0.00 H new ATOM 0 HD11 LEU A 406 -7.612 8.465 -0.740 1.00 0.00 H new ATOM 0 HD12 LEU A 406 -9.029 8.769 -1.773 1.00 0.00 H new ATOM 0 HD13 LEU A 406 -9.214 7.859 -0.255 1.00 0.00 H new ATOM 0 HD21 LEU A 406 -6.638 6.220 -0.589 1.00 0.00 H new ATOM 0 HD22 LEU A 406 -8.195 5.503 -0.109 1.00 0.00 H new ATOM 0 HD23 LEU A 406 -7.323 4.870 -1.526 1.00 0.00 H new ATOM 810 N ASP A 407 -10.418 6.628 0.753 1.00 0.00 N ATOM 811 CA ASP A 407 -10.875 7.578 1.760 1.00 0.00 C ATOM 812 C ASP A 407 -9.961 8.796 1.795 1.00 0.00 C ATOM 813 O ASP A 407 -8.741 8.661 1.840 1.00 0.00 O ATOM 814 CB ASP A 407 -10.917 6.915 3.134 1.00 0.00 C ATOM 815 CG ASP A 407 -11.537 7.808 4.191 1.00 0.00 C ATOM 816 OD1 ASP A 407 -12.702 8.222 4.010 1.00 0.00 O ATOM 817 OD2 ASP A 407 -10.861 8.090 5.203 1.00 0.00 O ATOM 0 H ASP A 407 -9.564 6.129 1.003 1.00 0.00 H new ATOM 0 HA ASP A 407 -11.881 7.903 1.496 1.00 0.00 H new ATOM 0 HB2 ASP A 407 -11.485 5.987 3.069 1.00 0.00 H new ATOM 0 HB3 ASP A 407 -9.904 6.649 3.436 1.00 0.00 H new ATOM 822 N LYS A 408 -10.552 9.984 1.765 1.00 0.00 N ATOM 823 CA LYS A 408 -9.780 11.223 1.783 1.00 0.00 C ATOM 824 C LYS A 408 -9.034 11.402 3.102 1.00 0.00 C ATOM 825 O LYS A 408 -7.840 11.699 3.111 1.00 0.00 O ATOM 826 CB LYS A 408 -10.696 12.421 1.531 1.00 0.00 C ATOM 827 CG LYS A 408 -11.359 12.404 0.162 1.00 0.00 C ATOM 828 CD LYS A 408 -10.328 12.476 -0.955 1.00 0.00 C ATOM 829 CE LYS A 408 -10.987 12.462 -2.324 1.00 0.00 C ATOM 830 NZ LYS A 408 -11.770 11.214 -2.551 1.00 0.00 N ATOM 0 H LYS A 408 -11.563 10.117 1.728 1.00 0.00 H new ATOM 0 HA LYS A 408 -9.039 11.162 0.986 1.00 0.00 H new ATOM 0 HB2 LYS A 408 -11.469 12.445 2.299 1.00 0.00 H new ATOM 0 HB3 LYS A 408 -10.117 13.339 1.633 1.00 0.00 H new ATOM 0 HG2 LYS A 408 -11.952 11.496 0.054 1.00 0.00 H new ATOM 0 HG3 LYS A 408 -12.047 13.245 0.079 1.00 0.00 H new ATOM 0 HD2 LYS A 408 -9.734 13.383 -0.845 1.00 0.00 H new ATOM 0 HD3 LYS A 408 -9.641 11.634 -0.872 1.00 0.00 H new ATOM 0 HE2 LYS A 408 -11.645 13.326 -2.419 1.00 0.00 H new ATOM 0 HE3 LYS A 408 -10.223 12.557 -3.096 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 -12.047 11.155 -3.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 -11.187 10.389 -2.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 -12.623 11.226 -1.956 1.00 0.00 H new ATOM 844 N GLU A 409 -9.744 11.229 4.212 1.00 0.00 N ATOM 845 CA GLU A 409 -9.148 11.381 5.538 1.00 0.00 C ATOM 846 C GLU A 409 -8.006 10.392 5.760 1.00 0.00 C ATOM 847 O GLU A 409 -6.957 10.748 6.297 1.00 0.00 O ATOM 848 CB GLU A 409 -10.213 11.189 6.620 1.00 0.00 C ATOM 849 CG GLU A 409 -11.308 12.246 6.601 1.00 0.00 C ATOM 850 CD GLU A 409 -10.798 13.627 6.969 1.00 0.00 C ATOM 851 OE1 GLU A 409 -9.943 14.163 6.235 1.00 0.00 O ATOM 852 OE2 GLU A 409 -11.255 14.171 7.997 1.00 0.00 O ATOM 0 H GLU A 409 -10.734 10.983 4.221 1.00 0.00 H new ATOM 0 HA GLU A 409 -8.739 12.389 5.601 1.00 0.00 H new ATOM 0 HB2 GLU A 409 -10.668 10.206 6.498 1.00 0.00 H new ATOM 0 HB3 GLU A 409 -9.730 11.198 7.597 1.00 0.00 H new ATOM 0 HG2 GLU A 409 -11.755 12.282 5.608 1.00 0.00 H new ATOM 0 HG3 GLU A 409 -12.097 11.958 7.296 1.00 0.00 H new ATOM 859 N GLU A 410 -8.217 9.146 5.357 1.00 0.00 N ATOM 860 CA GLU A 410 -7.207 8.110 5.524 1.00 0.00 C ATOM 861 C GLU A 410 -6.044 8.307 4.558 1.00 0.00 C ATOM 862 O GLU A 410 -4.885 8.143 4.930 1.00 0.00 O ATOM 863 CB GLU A 410 -7.835 6.727 5.334 1.00 0.00 C ATOM 864 CG GLU A 410 -6.855 5.580 5.522 1.00 0.00 C ATOM 865 CD GLU A 410 -7.540 4.229 5.520 1.00 0.00 C ATOM 866 OE1 GLU A 410 -8.241 3.920 4.534 1.00 0.00 O ATOM 867 OE2 GLU A 410 -7.375 3.480 6.505 1.00 0.00 O ATOM 0 H GLU A 410 -9.078 8.828 4.912 1.00 0.00 H new ATOM 0 HA GLU A 410 -6.811 8.183 6.537 1.00 0.00 H new ATOM 0 HB2 GLU A 410 -8.657 6.611 6.041 1.00 0.00 H new ATOM 0 HB3 GLU A 410 -8.264 6.667 4.334 1.00 0.00 H new ATOM 0 HG2 GLU A 410 -6.110 5.608 4.727 1.00 0.00 H new ATOM 0 HG3 GLU A 410 -6.321 5.712 6.463 1.00 0.00 H new ATOM 874 N ALA A 411 -6.359 8.655 3.314 1.00 0.00 N ATOM 875 CA ALA A 411 -5.333 8.867 2.297 1.00 0.00 C ATOM 876 C ALA A 411 -4.389 10.000 2.680 1.00 0.00 C ATOM 877 O ALA A 411 -3.173 9.866 2.559 1.00 0.00 O ATOM 878 CB ALA A 411 -5.975 9.157 0.949 1.00 0.00 C ATOM 0 H ALA A 411 -7.314 8.796 2.986 1.00 0.00 H new ATOM 0 HA ALA A 411 -4.747 7.951 2.225 1.00 0.00 H new ATOM 0 HB1 ALA A 411 -5.197 9.313 0.202 1.00 0.00 H new ATOM 0 HB2 ALA A 411 -6.598 8.313 0.654 1.00 0.00 H new ATOM 0 HB3 ALA A 411 -6.590 10.054 1.024 1.00 0.00 H new ATOM 884 N LYS A 412 -4.950 11.113 3.137 1.00 0.00 N ATOM 885 CA LYS A 412 -4.144 12.263 3.531 1.00 0.00 C ATOM 886 C LYS A 412 -3.228 11.908 4.698 1.00 0.00 C ATOM 887 O LYS A 412 -2.052 12.273 4.708 1.00 0.00 O ATOM 888 CB LYS A 412 -5.044 13.447 3.894 1.00 0.00 C ATOM 889 CG LYS A 412 -6.029 13.146 5.012 1.00 0.00 C ATOM 890 CD LYS A 412 -6.966 14.316 5.272 1.00 0.00 C ATOM 891 CE LYS A 412 -7.780 14.673 4.037 1.00 0.00 C ATOM 892 NZ LYS A 412 -8.694 15.823 4.286 1.00 0.00 N ATOM 0 H LYS A 412 -5.956 11.244 3.244 1.00 0.00 H new ATOM 0 HA LYS A 412 -3.520 12.549 2.685 1.00 0.00 H new ATOM 0 HB2 LYS A 412 -4.419 14.290 4.190 1.00 0.00 H new ATOM 0 HB3 LYS A 412 -5.598 13.756 3.007 1.00 0.00 H new ATOM 0 HG2 LYS A 412 -6.614 12.263 4.753 1.00 0.00 H new ATOM 0 HG3 LYS A 412 -5.482 12.909 5.924 1.00 0.00 H new ATOM 0 HD2 LYS A 412 -7.640 14.067 6.092 1.00 0.00 H new ATOM 0 HD3 LYS A 412 -6.386 15.183 5.588 1.00 0.00 H new ATOM 0 HE2 LYS A 412 -7.106 14.917 3.216 1.00 0.00 H new ATOM 0 HE3 LYS A 412 -8.363 13.807 3.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 412 -9.218 16.045 3.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 412 -9.366 15.576 5.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 412 -8.137 16.652 4.576 1.00 0.00 H new ATOM 906 N LYS A 413 -3.767 11.184 5.676 1.00 0.00 N ATOM 907 CA LYS A 413 -2.989 10.773 6.841 1.00 0.00 C ATOM 908 C LYS A 413 -1.842 9.853 6.437 1.00 0.00 C ATOM 909 O LYS A 413 -0.697 10.054 6.840 1.00 0.00 O ATOM 910 CB LYS A 413 -3.886 10.058 7.849 1.00 0.00 C ATOM 911 CG LYS A 413 -4.914 10.962 8.505 1.00 0.00 C ATOM 912 CD LYS A 413 -4.254 11.987 9.415 1.00 0.00 C ATOM 913 CE LYS A 413 -5.284 12.858 10.115 1.00 0.00 C ATOM 914 NZ LYS A 413 -4.645 13.833 11.043 1.00 0.00 N ATOM 0 H LYS A 413 -4.738 10.871 5.685 1.00 0.00 H new ATOM 0 HA LYS A 413 -2.571 11.670 7.298 1.00 0.00 H new ATOM 0 HB2 LYS A 413 -4.403 9.241 7.345 1.00 0.00 H new ATOM 0 HB3 LYS A 413 -3.262 9.611 8.623 1.00 0.00 H new ATOM 0 HG2 LYS A 413 -5.492 11.475 7.737 1.00 0.00 H new ATOM 0 HG3 LYS A 413 -5.615 10.359 9.082 1.00 0.00 H new ATOM 0 HD2 LYS A 413 -3.644 11.475 10.159 1.00 0.00 H new ATOM 0 HD3 LYS A 413 -3.583 12.615 8.830 1.00 0.00 H new ATOM 0 HE2 LYS A 413 -5.871 13.396 9.371 1.00 0.00 H new ATOM 0 HE3 LYS A 413 -5.976 12.226 10.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 413 -5.380 14.409 11.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 413 -4.105 13.319 11.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 413 -4.004 14.452 10.508 1.00 0.00 H new ATOM 928 N VAL A 414 -2.164 8.838 5.643 1.00 0.00 N ATOM 929 CA VAL A 414 -1.170 7.874 5.184 1.00 0.00 C ATOM 930 C VAL A 414 -0.116 8.540 4.307 1.00 0.00 C ATOM 931 O VAL A 414 1.075 8.260 4.427 1.00 0.00 O ATOM 932 CB VAL A 414 -1.824 6.720 4.402 1.00 0.00 C ATOM 933 CG1 VAL A 414 -0.770 5.746 3.898 1.00 0.00 C ATOM 934 CG2 VAL A 414 -2.846 6.006 5.270 1.00 0.00 C ATOM 0 H VAL A 414 -3.109 8.661 5.303 1.00 0.00 H new ATOM 0 HA VAL A 414 -0.689 7.470 6.075 1.00 0.00 H new ATOM 0 HB VAL A 414 -2.339 7.138 3.537 1.00 0.00 H new ATOM 0 HG11 VAL A 414 -1.254 4.939 3.348 1.00 0.00 H new ATOM 0 HG12 VAL A 414 -0.077 6.269 3.239 1.00 0.00 H new ATOM 0 HG13 VAL A 414 -0.223 5.331 4.745 1.00 0.00 H new ATOM 0 HG21 VAL A 414 -3.300 5.193 4.704 1.00 0.00 H new ATOM 0 HG22 VAL A 414 -2.353 5.602 6.154 1.00 0.00 H new ATOM 0 HG23 VAL A 414 -3.619 6.711 5.576 1.00 0.00 H new ATOM 944 N ALA A 415 -0.563 9.421 3.423 1.00 0.00 N ATOM 945 CA ALA A 415 0.340 10.128 2.526 1.00 0.00 C ATOM 946 C ALA A 415 1.284 11.035 3.306 1.00 0.00 C ATOM 947 O ALA A 415 2.469 11.139 2.986 1.00 0.00 O ATOM 948 CB ALA A 415 -0.449 10.937 1.507 1.00 0.00 C ATOM 0 H ALA A 415 -1.547 9.663 3.308 1.00 0.00 H new ATOM 0 HA ALA A 415 0.940 9.387 1.997 1.00 0.00 H new ATOM 0 HB1 ALA A 415 0.241 11.459 0.844 1.00 0.00 H new ATOM 0 HB2 ALA A 415 -1.079 10.268 0.921 1.00 0.00 H new ATOM 0 HB3 ALA A 415 -1.075 11.664 2.025 1.00 0.00 H new ATOM 954 N ASP A 416 0.751 11.692 4.332 1.00 0.00 N ATOM 955 CA ASP A 416 1.545 12.594 5.159 1.00 0.00 C ATOM 956 C ASP A 416 2.227 11.843 6.298 1.00 0.00 C ATOM 957 O ASP A 416 2.533 12.421 7.339 1.00 0.00 O ATOM 958 CB ASP A 416 0.670 13.715 5.722 1.00 0.00 C ATOM 959 CG ASP A 416 0.096 14.604 4.635 1.00 0.00 C ATOM 960 OD1 ASP A 416 0.889 15.195 3.872 1.00 0.00 O ATOM 961 OD2 ASP A 416 -1.145 14.715 4.551 1.00 0.00 O ATOM 0 H ASP A 416 -0.227 11.616 4.610 1.00 0.00 H new ATOM 0 HA ASP A 416 2.318 13.030 4.526 1.00 0.00 H new ATOM 0 HB2 ASP A 416 -0.146 13.280 6.300 1.00 0.00 H new ATOM 0 HB3 ASP A 416 1.260 14.321 6.410 1.00 0.00 H new ATOM 966 N GLU A 417 2.471 10.554 6.092 1.00 0.00 N ATOM 967 CA GLU A 417 3.121 9.728 7.081 1.00 0.00 C ATOM 968 C GLU A 417 4.626 9.948 7.033 1.00 0.00 C ATOM 969 O GLU A 417 5.296 10.004 8.064 1.00 0.00 O ATOM 970 CB GLU A 417 2.782 8.271 6.792 1.00 0.00 C ATOM 971 CG GLU A 417 3.217 7.306 7.866 1.00 0.00 C ATOM 972 CD GLU A 417 4.720 7.112 7.922 1.00 0.00 C ATOM 973 OE1 GLU A 417 5.300 6.674 6.906 1.00 0.00 O ATOM 974 OE2 GLU A 417 5.317 7.396 8.981 1.00 0.00 O ATOM 0 H GLU A 417 2.222 10.061 5.235 1.00 0.00 H new ATOM 0 HA GLU A 417 2.773 9.992 8.080 1.00 0.00 H new ATOM 0 HB2 GLU A 417 1.704 8.182 6.655 1.00 0.00 H new ATOM 0 HB3 GLU A 417 3.248 7.982 5.850 1.00 0.00 H new ATOM 0 HG2 GLU A 417 2.868 7.667 8.833 1.00 0.00 H new ATOM 0 HG3 GLU A 417 2.739 6.342 7.694 1.00 0.00 H new ATOM 981 N THR A 418 5.147 10.065 5.815 1.00 0.00 N ATOM 982 CA THR A 418 6.572 10.271 5.601 1.00 0.00 C ATOM 983 C THR A 418 6.975 11.723 5.851 1.00 0.00 C ATOM 984 O THR A 418 7.914 12.228 5.235 1.00 0.00 O ATOM 985 CB THR A 418 6.970 9.887 4.164 1.00 0.00 C ATOM 986 OG1 THR A 418 6.498 10.880 3.244 1.00 0.00 O ATOM 987 CG2 THR A 418 6.383 8.536 3.789 1.00 0.00 C ATOM 0 H THR A 418 4.597 10.020 4.957 1.00 0.00 H new ATOM 0 HA THR A 418 7.094 9.631 6.313 1.00 0.00 H new ATOM 0 HB THR A 418 8.057 9.828 4.114 1.00 0.00 H new ATOM 0 HG1 THR A 418 6.756 10.630 2.332 1.00 0.00 H new ATOM 0 HG21 THR A 418 6.675 8.282 2.770 1.00 0.00 H new ATOM 0 HG22 THR A 418 6.756 7.774 4.474 1.00 0.00 H new ATOM 0 HG23 THR A 418 5.296 8.581 3.854 1.00 0.00 H new ATOM 995 N ALA A 419 6.266 12.391 6.758 1.00 0.00 N ATOM 996 CA ALA A 419 6.565 13.785 7.081 1.00 0.00 C ATOM 997 C ALA A 419 5.771 14.260 8.293 1.00 0.00 C ATOM 998 O ALA A 419 6.334 14.825 9.232 1.00 0.00 O ATOM 999 CB ALA A 419 6.277 14.678 5.883 1.00 0.00 C ATOM 0 H ALA A 419 5.485 11.993 7.280 1.00 0.00 H new ATOM 0 HA ALA A 419 7.625 13.849 7.328 1.00 0.00 H new ATOM 0 HB1 ALA A 419 6.504 15.713 6.138 1.00 0.00 H new ATOM 0 HB2 ALA A 419 6.895 14.368 5.041 1.00 0.00 H new ATOM 0 HB3 ALA A 419 5.225 14.594 5.611 1.00 0.00 H new ATOM 1005 N LYS A 420 4.461 14.033 8.261 1.00 0.00 N ATOM 1006 CA LYS A 420 3.582 14.441 9.354 1.00 0.00 C ATOM 1007 C LYS A 420 3.680 15.943 9.604 1.00 0.00 C ATOM 1008 O LYS A 420 3.768 16.386 10.750 1.00 0.00 O ATOM 1009 CB LYS A 420 3.925 13.675 10.635 1.00 0.00 C ATOM 1010 CG LYS A 420 3.725 12.174 10.522 1.00 0.00 C ATOM 1011 CD LYS A 420 4.023 11.474 11.838 1.00 0.00 C ATOM 1012 CE LYS A 420 3.803 9.974 11.738 1.00 0.00 C ATOM 1013 NZ LYS A 420 4.678 9.354 10.707 1.00 0.00 N ATOM 0 H LYS A 420 3.983 13.568 7.489 1.00 0.00 H new ATOM 0 HA LYS A 420 2.558 14.205 9.064 1.00 0.00 H new ATOM 0 HB2 LYS A 420 4.963 13.875 10.900 1.00 0.00 H new ATOM 0 HB3 LYS A 420 3.309 14.054 11.450 1.00 0.00 H new ATOM 0 HG2 LYS A 420 2.699 11.964 10.221 1.00 0.00 H new ATOM 0 HG3 LYS A 420 4.374 11.777 9.742 1.00 0.00 H new ATOM 0 HD2 LYS A 420 5.054 11.672 12.130 1.00 0.00 H new ATOM 0 HD3 LYS A 420 3.385 11.884 12.621 1.00 0.00 H new ATOM 0 HE2 LYS A 420 3.999 9.513 12.706 1.00 0.00 H new ATOM 0 HE3 LYS A 420 2.759 9.775 11.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 420 4.498 8.330 10.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 420 4.473 9.776 9.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 420 5.675 9.522 10.951 1.00 0.00 H new ATOM 1027 N ASP A 421 3.661 16.723 8.524 1.00 0.00 N ATOM 1028 CA ASP A 421 3.747 18.177 8.627 1.00 0.00 C ATOM 1029 C ASP A 421 3.553 18.833 7.263 1.00 0.00 C ATOM 1030 O ASP A 421 2.793 19.792 7.129 1.00 0.00 O ATOM 1031 CB ASP A 421 5.100 18.586 9.216 1.00 0.00 C ATOM 1032 CG ASP A 421 5.220 20.085 9.420 1.00 0.00 C ATOM 1033 OD1 ASP A 421 5.165 20.829 8.418 1.00 0.00 O ATOM 1034 OD2 ASP A 421 5.366 20.515 10.584 1.00 0.00 O ATOM 0 H ASP A 421 3.587 16.372 7.569 1.00 0.00 H new ATOM 0 HA ASP A 421 2.951 18.518 9.289 1.00 0.00 H new ATOM 0 HB2 ASP A 421 5.244 18.081 10.171 1.00 0.00 H new ATOM 0 HB3 ASP A 421 5.897 18.248 8.554 1.00 0.00 H new ATOM 1039 N GLY A 422 4.247 18.312 6.255 1.00 0.00 N ATOM 1040 CA GLY A 422 4.139 18.864 4.917 1.00 0.00 C ATOM 1041 C GLY A 422 2.737 18.749 4.350 1.00 0.00 C ATOM 1042 O GLY A 422 2.140 17.672 4.365 1.00 0.00 O ATOM 0 H GLY A 422 4.882 17.518 6.341 1.00 0.00 H new ATOM 0 HA2 GLY A 422 4.434 19.913 4.936 1.00 0.00 H new ATOM 0 HA3 GLY A 422 4.837 18.348 4.258 1.00 0.00 H new ATOM 1046 N LYS A 423 2.213 19.863 3.846 1.00 0.00 N ATOM 1047 CA LYS A 423 0.874 19.886 3.266 1.00 0.00 C ATOM 1048 C LYS A 423 0.895 19.402 1.818 1.00 0.00 C ATOM 1049 O LYS A 423 0.237 19.983 0.953 1.00 0.00 O ATOM 1050 CB LYS A 423 0.292 21.301 3.336 1.00 0.00 C ATOM 1051 CG LYS A 423 0.144 21.831 4.753 1.00 0.00 C ATOM 1052 CD LYS A 423 -0.392 23.256 4.767 1.00 0.00 C ATOM 1053 CE LYS A 423 -1.789 23.338 4.169 1.00 0.00 C ATOM 1054 NZ LYS A 423 -2.311 24.732 4.169 1.00 0.00 N ATOM 0 H LYS A 423 2.695 20.761 3.828 1.00 0.00 H new ATOM 0 HA LYS A 423 0.244 19.210 3.844 1.00 0.00 H new ATOM 0 HB2 LYS A 423 0.933 21.977 2.770 1.00 0.00 H new ATOM 0 HB3 LYS A 423 -0.684 21.307 2.851 1.00 0.00 H new ATOM 0 HG2 LYS A 423 -0.529 21.183 5.316 1.00 0.00 H new ATOM 0 HG3 LYS A 423 1.111 21.801 5.256 1.00 0.00 H new ATOM 0 HD2 LYS A 423 -0.412 23.627 5.792 1.00 0.00 H new ATOM 0 HD3 LYS A 423 0.282 23.904 4.207 1.00 0.00 H new ATOM 0 HE2 LYS A 423 -1.770 22.957 3.148 1.00 0.00 H new ATOM 0 HE3 LYS A 423 -2.465 22.697 4.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 -3.264 24.746 3.754 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 -2.353 25.087 5.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 -1.680 25.339 3.607 1.00 0.00 H new ATOM 1068 N THR A 424 1.653 18.336 1.562 1.00 0.00 N ATOM 1069 CA THR A 424 1.766 17.769 0.220 1.00 0.00 C ATOM 1070 C THR A 424 2.435 18.751 -0.741 1.00 0.00 C ATOM 1071 O THR A 424 2.140 19.945 -0.730 1.00 0.00 O ATOM 1072 CB THR A 424 0.389 17.365 -0.343 1.00 0.00 C ATOM 1073 OG1 THR A 424 -0.253 16.446 0.548 1.00 0.00 O ATOM 1074 CG2 THR A 424 0.527 16.726 -1.718 1.00 0.00 C ATOM 0 H THR A 424 2.200 17.846 2.270 1.00 0.00 H new ATOM 0 HA THR A 424 2.385 16.876 0.308 1.00 0.00 H new ATOM 0 HB THR A 424 -0.215 18.267 -0.438 1.00 0.00 H new ATOM 0 HG1 THR A 424 -1.128 16.195 0.185 1.00 0.00 H new ATOM 0 HG21 THR A 424 -0.459 16.451 -2.092 1.00 0.00 H new ATOM 0 HG22 THR A 424 0.990 17.435 -2.404 1.00 0.00 H new ATOM 0 HG23 THR A 424 1.149 15.834 -1.644 1.00 0.00 H new ATOM 1082 N GLY A 425 3.341 18.237 -1.568 1.00 0.00 N ATOM 1083 CA GLY A 425 4.042 19.081 -2.520 1.00 0.00 C ATOM 1084 C GLY A 425 3.099 19.824 -3.447 1.00 0.00 C ATOM 1085 O GLY A 425 2.165 19.238 -3.994 1.00 0.00 O ATOM 0 H GLY A 425 3.602 17.251 -1.596 1.00 0.00 H new ATOM 0 HA2 GLY A 425 4.655 19.801 -1.978 1.00 0.00 H new ATOM 0 HA3 GLY A 425 4.720 18.467 -3.113 1.00 0.00 H new ATOM 1089 N ASN A 426 3.345 21.120 -3.623 1.00 0.00 N ATOM 1090 CA ASN A 426 2.514 21.949 -4.488 1.00 0.00 C ATOM 1091 C ASN A 426 2.606 21.486 -5.938 1.00 0.00 C ATOM 1092 O ASN A 426 3.699 21.254 -6.456 1.00 0.00 O ATOM 1093 CB ASN A 426 2.937 23.416 -4.385 1.00 0.00 C ATOM 1094 CG ASN A 426 2.840 23.948 -2.969 1.00 0.00 C ATOM 1095 OD1 ASN A 426 1.765 23.964 -2.371 1.00 0.00 O ATOM 1096 ND2 ASN A 426 3.969 24.388 -2.424 1.00 0.00 N ATOM 0 H ASN A 426 4.115 21.618 -3.177 1.00 0.00 H new ATOM 0 HA ASN A 426 1.480 21.850 -4.157 1.00 0.00 H new ATOM 0 HB2 ASN A 426 3.962 23.521 -4.740 1.00 0.00 H new ATOM 0 HB3 ASN A 426 2.309 24.019 -5.041 1.00 0.00 H new ATOM 0 HD21 ASN A 426 3.966 24.758 -1.473 1.00 0.00 H new ATOM 0 HD22 ASN A 426 4.839 24.356 -2.956 1.00 0.00 H new ATOM 1103 N THR A 427 1.452 21.357 -6.588 1.00 0.00 N ATOM 1104 CA THR A 427 1.399 20.923 -7.979 1.00 0.00 C ATOM 1105 C THR A 427 -0.031 20.945 -8.509 1.00 0.00 C ATOM 1106 O THR A 427 -0.960 20.501 -7.832 1.00 0.00 O ATOM 1107 CB THR A 427 1.977 19.504 -8.150 1.00 0.00 C ATOM 1108 OG1 THR A 427 1.866 19.090 -9.517 1.00 0.00 O ATOM 1109 CG2 THR A 427 1.254 18.509 -7.254 1.00 0.00 C ATOM 0 H THR A 427 0.540 21.547 -6.172 1.00 0.00 H new ATOM 0 HA THR A 427 2.006 21.625 -8.551 1.00 0.00 H new ATOM 0 HB THR A 427 3.028 19.529 -7.862 1.00 0.00 H new ATOM 0 HG1 THR A 427 2.237 18.188 -9.617 1.00 0.00 H new ATOM 0 HG21 THR A 427 1.681 17.516 -7.394 1.00 0.00 H new ATOM 0 HG22 THR A 427 1.367 18.809 -6.212 1.00 0.00 H new ATOM 0 HG23 THR A 427 0.195 18.488 -7.513 1.00 0.00 H new ATOM 1117 N ASN A 428 -0.199 21.458 -9.725 1.00 0.00 N ATOM 1118 CA ASN A 428 -1.510 21.535 -10.353 1.00 0.00 C ATOM 1119 C ASN A 428 -1.404 22.094 -11.768 1.00 0.00 C ATOM 1120 O ASN A 428 -1.885 21.484 -12.723 1.00 0.00 O ATOM 1121 CB ASN A 428 -2.457 22.402 -9.518 1.00 0.00 C ATOM 1122 CG ASN A 428 -3.851 22.482 -10.112 1.00 0.00 C ATOM 1123 OD1 ASN A 428 -4.037 22.965 -11.228 1.00 0.00 O ATOM 1124 ND2 ASN A 428 -4.840 22.004 -9.365 1.00 0.00 N ATOM 0 H ASN A 428 0.562 21.827 -10.295 1.00 0.00 H new ATOM 0 HA ASN A 428 -1.914 20.524 -10.409 1.00 0.00 H new ATOM 0 HB2 ASN A 428 -2.519 21.997 -8.508 1.00 0.00 H new ATOM 0 HB3 ASN A 428 -2.044 23.407 -9.433 1.00 0.00 H new ATOM 0 HD21 ASN A 428 -5.799 22.029 -9.712 1.00 0.00 H new ATOM 0 HD22 ASN A 428 -4.640 21.612 -8.445 1.00 0.00 H new ATOM 1131 N THR A 429 -0.770 23.257 -11.896 1.00 0.00 N ATOM 1132 CA THR A 429 -0.602 23.893 -13.197 1.00 0.00 C ATOM 1133 C THR A 429 0.455 23.173 -14.026 1.00 0.00 C ATOM 1134 O THR A 429 1.587 22.992 -13.576 1.00 0.00 O ATOM 1135 CB THR A 429 -0.205 25.374 -13.052 1.00 0.00 C ATOM 1136 OG1 THR A 429 -1.198 26.076 -12.296 1.00 0.00 O ATOM 1137 CG2 THR A 429 -0.046 26.029 -14.418 1.00 0.00 C ATOM 0 H THR A 429 -0.366 23.776 -11.116 1.00 0.00 H new ATOM 0 HA THR A 429 -1.564 23.832 -13.706 1.00 0.00 H new ATOM 0 HB THR A 429 0.751 25.421 -12.530 1.00 0.00 H new ATOM 0 HG1 THR A 429 -0.937 27.016 -12.207 1.00 0.00 H new ATOM 0 HG21 THR A 429 0.235 27.074 -14.290 1.00 0.00 H new ATOM 0 HG22 THR A 429 0.730 25.511 -14.982 1.00 0.00 H new ATOM 0 HG23 THR A 429 -0.989 25.970 -14.962 1.00 0.00 H new ATOM 1145 N THR A 430 0.072 22.772 -15.240 1.00 0.00 N ATOM 1146 CA THR A 430 0.971 22.072 -16.160 1.00 0.00 C ATOM 1147 C THR A 430 1.915 21.121 -15.423 1.00 0.00 C ATOM 1148 O THR A 430 3.113 21.068 -15.705 1.00 0.00 O ATOM 1149 CB THR A 430 1.788 23.059 -17.026 1.00 0.00 C ATOM 1150 OG1 THR A 430 2.645 22.335 -17.917 1.00 0.00 O ATOM 1151 CG2 THR A 430 2.622 23.998 -16.167 1.00 0.00 C ATOM 0 H THR A 430 -0.866 22.922 -15.612 1.00 0.00 H new ATOM 0 HA THR A 430 0.335 21.480 -16.818 1.00 0.00 H new ATOM 0 HB THR A 430 1.082 23.660 -17.600 1.00 0.00 H new ATOM 0 HG1 THR A 430 3.203 21.715 -17.403 1.00 0.00 H new ATOM 0 HG21 THR A 430 3.183 24.677 -16.809 1.00 0.00 H new ATOM 0 HG22 THR A 430 1.966 24.574 -15.515 1.00 0.00 H new ATOM 0 HG23 THR A 430 3.316 23.416 -15.561 1.00 0.00 H new ATOM 1159 N GLY A 431 1.361 20.364 -14.481 1.00 0.00 N ATOM 1160 CA GLY A 431 2.155 19.415 -13.719 1.00 0.00 C ATOM 1161 C GLY A 431 3.140 20.083 -12.775 1.00 0.00 C ATOM 1162 O GLY A 431 2.797 21.044 -12.087 1.00 0.00 O ATOM 0 H GLY A 431 0.373 20.391 -14.231 1.00 0.00 H new ATOM 0 HA2 GLY A 431 1.489 18.772 -13.144 1.00 0.00 H new ATOM 0 HA3 GLY A 431 2.701 18.772 -14.409 1.00 0.00 H new ATOM 1166 N SER A 432 4.363 19.557 -12.739 1.00 0.00 N ATOM 1167 CA SER A 432 5.414 20.085 -11.871 1.00 0.00 C ATOM 1168 C SER A 432 5.892 21.460 -12.338 1.00 0.00 C ATOM 1169 O SER A 432 6.984 21.590 -12.891 1.00 0.00 O ATOM 1170 CB SER A 432 6.594 19.112 -11.823 1.00 0.00 C ATOM 1171 OG SER A 432 6.199 17.853 -11.307 1.00 0.00 O ATOM 0 H SER A 432 4.652 18.760 -13.306 1.00 0.00 H new ATOM 0 HA SER A 432 4.994 20.197 -10.872 1.00 0.00 H new ATOM 0 HB2 SER A 432 7.005 18.985 -12.825 1.00 0.00 H new ATOM 0 HB3 SER A 432 7.388 19.529 -11.203 1.00 0.00 H new ATOM 0 HG SER A 432 6.971 17.250 -11.289 1.00 0.00 H new ATOM 1177 N SER A 433 5.070 22.480 -12.108 1.00 0.00 N ATOM 1178 CA SER A 433 5.410 23.844 -12.501 1.00 0.00 C ATOM 1179 C SER A 433 4.528 24.854 -11.771 1.00 0.00 C ATOM 1180 O SER A 433 3.319 24.911 -12.076 1.00 0.00 O ATOM 1181 CB SER A 433 5.253 24.023 -14.013 1.00 0.00 C ATOM 1182 OG SER A 433 6.128 23.167 -14.727 1.00 0.00 O ATOM 1183 OXT SER A 433 5.057 25.577 -10.902 1.00 0.00 O ATOM 0 H SER A 433 4.163 22.388 -11.651 1.00 0.00 H new ATOM 0 HA SER A 433 6.450 24.022 -12.227 1.00 0.00 H new ATOM 0 HB2 SER A 433 4.222 23.815 -14.301 1.00 0.00 H new ATOM 0 HB3 SER A 433 5.456 25.060 -14.282 1.00 0.00 H new ATOM 0 HG SER A 433 6.789 22.787 -14.111 1.00 0.00 H new TER 1189 SER A 433