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 429 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 430 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 427 THR OG1 : rot -13:sc= 0.847 USER MOD Set 2.2: A 432 SER OG : rot 180:sc= -1.57! USER MOD Set 3.1: A 412 LYS NZ :NH3+ 157:sc= -2.23! (180deg=-4.61!) USER MOD Set 3.2: A 413 LYS NZ :NH3+ -168:sc= -0.0304 (180deg=-0.259) USER MOD Set 4.1: A 396 HIS : no HD1:sc= 0.591 K(o=1.2,f=-4.3!) USER MOD Set 4.2: A 405 THR OG1 : rot -169:sc= 0.623 USER MOD Set 5.1: A 373 GLN : amide:sc= -0.322 K(o=-0.79,f=-2.5) USER MOD Set 5.2: A 391 SER OG : rot 180:sc= -0.464 USER MOD Set 6.1: A 377 THR OG1 : rot 180:sc= 0.213 USER MOD Set 6.2: A 380 SER OG : rot 84:sc= 0.219 USER MOD Single : A 355 SER OG : rot 180:sc= 0 USER MOD Single : A 356 HIS : no HD1:sc= -0.0952 K(o=-0.095,f=-2.4!) USER MOD Single : A 357 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 362 THR OG1 : rot 35:sc= 0.274 USER MOD Single : A 363 GLN :FLIP amide:sc= -0.394 F(o=-1.4,f=-0.39) USER MOD Single : A 364 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 365 HIS : no HD1:sc= -0.206 K(o=-0.21,f=-3) USER MOD Single : A 366 LYS NZ :NH3+ -133:sc= -3.25! (180deg=-6.29!) USER MOD Single : A 370 SER OG : rot 180:sc= 0 USER MOD Single : A 371 GLN :FLIP amide:sc= -0.98 F(o=-4.8!,f=-0.98) USER MOD Single : A 372 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 382 ASN :FLIP amide:sc= -0.626 F(o=-3.6!,f=-0.63) USER MOD Single : A 383 LYS NZ :NH3+ -166:sc= -0.0446 (180deg=-0.288) USER MOD Single : A 384 LYS NZ :NH3+ -119:sc= -0.263 (180deg=-2.96!) USER MOD Single : A 386 GLN : amide:sc= 0.0617 X(o=0.062,f=0) USER MOD Single : A 387 ASN : amide:sc= 0 X(o=0,f=0) 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= 0.414 K(o=0.41,f=-3.4!) USER MOD Single : A 401 ASN : amide:sc= -0.204 X(o=-0.2,f=-0.045) USER MOD Single : A 402 LYS NZ :NH3+ -140:sc= -0.739 (180deg=-1.72!) USER MOD Single : A 403 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 408 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 418 THR OG1 : rot 14:sc= 0.718 USER MOD Single : A 420 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 423 LYS NZ :NH3+ 164:sc= -0.0415 (180deg=-0.297) USER MOD Single : A 424 THR OG1 : rot 180:sc= 0 USER MOD Single : A 426 ASN : amide:sc= 0.181 K(o=0.18,f=-3.2!) USER MOD Single : A 428 ASN : amide:sc= -1.76 X(o=-1.8,f=-2) USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 354 21.590 -4.100 8.512 1.00 0.00 N ATOM 2 CA GLY A 354 22.206 -3.846 9.842 1.00 0.00 C ATOM 3 C GLY A 354 21.275 -3.099 10.778 1.00 0.00 C ATOM 4 O GLY A 354 20.090 -3.420 10.870 1.00 0.00 O ATOM 0 HA2 GLY A 354 22.488 -4.796 10.296 1.00 0.00 H new ATOM 0 HA3 GLY A 354 23.123 -3.271 9.711 1.00 0.00 H new ATOM 10 N SER A 355 21.812 -2.101 11.472 1.00 0.00 N ATOM 11 CA SER A 355 21.021 -1.307 12.404 1.00 0.00 C ATOM 12 C SER A 355 19.909 -0.560 11.675 1.00 0.00 C ATOM 13 O SER A 355 18.749 -0.597 12.085 1.00 0.00 O ATOM 14 CB SER A 355 21.915 -0.313 13.148 1.00 0.00 C ATOM 15 OG SER A 355 21.162 0.464 14.063 1.00 0.00 O ATOM 0 H SER A 355 22.791 -1.823 11.406 1.00 0.00 H new ATOM 0 HA SER A 355 20.566 -1.986 13.125 1.00 0.00 H new ATOM 0 HB2 SER A 355 22.698 -0.852 13.682 1.00 0.00 H new ATOM 0 HB3 SER A 355 22.411 0.342 12.432 1.00 0.00 H new ATOM 0 HG SER A 355 21.756 1.090 14.527 1.00 0.00 H new ATOM 21 N HIS A 356 20.270 0.115 10.587 1.00 0.00 N ATOM 22 CA HIS A 356 19.303 0.866 9.797 1.00 0.00 C ATOM 23 C HIS A 356 18.282 -0.075 9.164 1.00 0.00 C ATOM 24 O HIS A 356 18.643 -1.131 8.645 1.00 0.00 O ATOM 25 CB HIS A 356 20.013 1.673 8.708 1.00 0.00 C ATOM 26 CG HIS A 356 21.031 2.634 9.240 1.00 0.00 C ATOM 27 ND1 HIS A 356 22.130 2.238 9.973 1.00 0.00 N ATOM 28 CD2 HIS A 356 21.116 3.982 9.139 1.00 0.00 C ATOM 29 CE1 HIS A 356 22.846 3.299 10.300 1.00 0.00 C ATOM 30 NE2 HIS A 356 22.253 4.369 9.805 1.00 0.00 N ATOM 0 H HIS A 356 21.226 0.156 10.233 1.00 0.00 H new ATOM 0 HA HIS A 356 18.781 1.554 10.462 1.00 0.00 H new ATOM 0 HB2 HIS A 356 20.501 0.985 8.018 1.00 0.00 H new ATOM 0 HB3 HIS A 356 19.269 2.226 8.134 1.00 0.00 H new ATOM 0 HD2 HIS A 356 20.419 4.631 8.630 1.00 0.00 H new ATOM 0 HE1 HIS A 356 23.761 3.292 10.874 1.00 0.00 H new ATOM 0 HE2 HIS A 356 22.585 5.328 9.901 1.00 0.00 H new ATOM 39 N MET A 357 17.009 0.315 9.218 1.00 0.00 N ATOM 40 CA MET A 357 15.926 -0.491 8.656 1.00 0.00 C ATOM 41 C MET A 357 15.798 -1.818 9.402 1.00 0.00 C ATOM 42 O MET A 357 16.785 -2.521 9.616 1.00 0.00 O ATOM 43 CB MET A 357 16.160 -0.734 7.158 1.00 0.00 C ATOM 44 CG MET A 357 15.025 -1.471 6.456 1.00 0.00 C ATOM 45 SD MET A 357 14.947 -3.224 6.878 1.00 0.00 S ATOM 46 CE MET A 357 13.550 -3.753 5.890 1.00 0.00 C ATOM 0 H MET A 357 16.702 1.188 9.647 1.00 0.00 H new ATOM 0 HA MET A 357 14.992 0.058 8.775 1.00 0.00 H new ATOM 0 HB2 MET A 357 16.313 0.226 6.666 1.00 0.00 H new ATOM 0 HB3 MET A 357 17.080 -1.306 7.034 1.00 0.00 H new ATOM 0 HG2 MET A 357 14.078 -0.999 6.717 1.00 0.00 H new ATOM 0 HG3 MET A 357 15.146 -1.369 5.378 1.00 0.00 H new ATOM 0 HE1 MET A 357 13.377 -4.818 6.045 1.00 0.00 H new ATOM 0 HE2 MET A 357 12.662 -3.195 6.187 1.00 0.00 H new ATOM 0 HE3 MET A 357 13.759 -3.569 4.836 1.00 0.00 H new ATOM 56 N LEU A 358 14.572 -2.152 9.795 1.00 0.00 N ATOM 57 CA LEU A 358 14.313 -3.392 10.519 1.00 0.00 C ATOM 58 C LEU A 358 12.814 -3.648 10.668 1.00 0.00 C ATOM 59 O LEU A 358 12.355 -4.126 11.705 1.00 0.00 O ATOM 60 CB LEU A 358 14.990 -3.347 11.896 1.00 0.00 C ATOM 61 CG LEU A 358 14.886 -2.011 12.641 1.00 0.00 C ATOM 62 CD1 LEU A 358 13.447 -1.709 13.035 1.00 0.00 C ATOM 63 CD2 LEU A 358 15.784 -2.017 13.868 1.00 0.00 C ATOM 0 H LEU A 358 13.744 -1.582 9.624 1.00 0.00 H new ATOM 0 HA LEU A 358 14.733 -4.216 9.942 1.00 0.00 H new ATOM 0 HB2 LEU A 358 14.554 -4.126 12.521 1.00 0.00 H new ATOM 0 HB3 LEU A 358 16.045 -3.592 11.771 1.00 0.00 H new ATOM 0 HG LEU A 358 15.220 -1.223 11.966 1.00 0.00 H new ATOM 0 HD11 LEU A 358 13.406 -0.755 13.561 1.00 0.00 H new ATOM 0 HD12 LEU A 358 12.828 -1.656 12.139 1.00 0.00 H new ATOM 0 HD13 LEU A 358 13.075 -2.499 13.687 1.00 0.00 H new ATOM 0 HD21 LEU A 358 15.699 -1.062 14.386 1.00 0.00 H new ATOM 0 HD22 LEU A 358 15.480 -2.821 14.538 1.00 0.00 H new ATOM 0 HD23 LEU A 358 16.818 -2.172 13.561 1.00 0.00 H new ATOM 75 N GLU A 359 12.057 -3.334 9.619 1.00 0.00 N ATOM 76 CA GLU A 359 10.611 -3.536 9.631 1.00 0.00 C ATOM 77 C GLU A 359 10.266 -5.017 9.751 1.00 0.00 C ATOM 78 O GLU A 359 10.874 -5.862 9.094 1.00 0.00 O ATOM 79 CB GLU A 359 9.980 -2.956 8.362 1.00 0.00 C ATOM 80 CG GLU A 359 10.168 -1.454 8.214 1.00 0.00 C ATOM 81 CD GLU A 359 9.465 -0.657 9.299 1.00 0.00 C ATOM 82 OE1 GLU A 359 8.793 -1.274 10.153 1.00 0.00 O ATOM 83 OE2 GLU A 359 9.582 0.587 9.290 1.00 0.00 O ATOM 0 H GLU A 359 12.421 -2.939 8.752 1.00 0.00 H new ATOM 0 HA GLU A 359 10.208 -3.016 10.500 1.00 0.00 H new ATOM 0 HB2 GLU A 359 10.411 -3.454 7.493 1.00 0.00 H new ATOM 0 HB3 GLU A 359 8.913 -3.181 8.362 1.00 0.00 H new ATOM 0 HG2 GLU A 359 11.233 -1.223 8.234 1.00 0.00 H new ATOM 0 HG3 GLU A 359 9.792 -1.141 7.240 1.00 0.00 H new ATOM 90 N VAL A 360 9.286 -5.323 10.595 1.00 0.00 N ATOM 91 CA VAL A 360 8.853 -6.700 10.805 1.00 0.00 C ATOM 92 C VAL A 360 8.237 -7.286 9.536 1.00 0.00 C ATOM 93 O VAL A 360 7.566 -6.585 8.780 1.00 0.00 O ATOM 94 CB VAL A 360 7.832 -6.800 11.956 1.00 0.00 C ATOM 95 CG1 VAL A 360 7.431 -8.249 12.197 1.00 0.00 C ATOM 96 CG2 VAL A 360 8.394 -6.179 13.224 1.00 0.00 C ATOM 0 H VAL A 360 8.775 -4.633 11.146 1.00 0.00 H new ATOM 0 HA VAL A 360 9.742 -7.273 11.069 1.00 0.00 H new ATOM 0 HB VAL A 360 6.939 -6.244 11.670 1.00 0.00 H new ATOM 0 HG11 VAL A 360 6.710 -8.296 13.013 1.00 0.00 H new ATOM 0 HG12 VAL A 360 6.982 -8.657 11.292 1.00 0.00 H new ATOM 0 HG13 VAL A 360 8.314 -8.832 12.459 1.00 0.00 H new ATOM 0 HG21 VAL A 360 7.659 -6.259 14.025 1.00 0.00 H new ATOM 0 HG22 VAL A 360 9.305 -6.703 13.513 1.00 0.00 H new ATOM 0 HG23 VAL A 360 8.622 -5.128 13.044 1.00 0.00 H new ATOM 106 N LEU A 361 8.470 -8.577 9.313 1.00 0.00 N ATOM 107 CA LEU A 361 7.939 -9.262 8.139 1.00 0.00 C ATOM 108 C LEU A 361 7.863 -10.765 8.384 1.00 0.00 C ATOM 109 O LEU A 361 8.799 -11.367 8.912 1.00 0.00 O ATOM 110 CB LEU A 361 8.801 -8.973 6.903 1.00 0.00 C ATOM 111 CG LEU A 361 10.205 -9.594 6.908 1.00 0.00 C ATOM 112 CD1 LEU A 361 10.909 -9.327 5.587 1.00 0.00 C ATOM 113 CD2 LEU A 361 11.035 -9.055 8.065 1.00 0.00 C ATOM 0 H LEU A 361 9.024 -9.170 9.931 1.00 0.00 H new ATOM 0 HA LEU A 361 6.933 -8.885 7.956 1.00 0.00 H new ATOM 0 HB2 LEU A 361 8.269 -9.330 6.021 1.00 0.00 H new ATOM 0 HB3 LEU A 361 8.902 -7.893 6.798 1.00 0.00 H new ATOM 0 HG LEU A 361 10.097 -10.671 7.037 1.00 0.00 H new ATOM 0 HD11 LEU A 361 11.903 -9.774 5.608 1.00 0.00 H new ATOM 0 HD12 LEU A 361 10.331 -9.764 4.772 1.00 0.00 H new ATOM 0 HD13 LEU A 361 10.998 -8.252 5.433 1.00 0.00 H new ATOM 0 HD21 LEU A 361 12.025 -9.511 8.046 1.00 0.00 H new ATOM 0 HD22 LEU A 361 11.132 -7.973 7.971 1.00 0.00 H new ATOM 0 HD23 LEU A 361 10.544 -9.295 9.008 1.00 0.00 H new ATOM 125 N THR A 362 6.738 -11.364 8.006 1.00 0.00 N ATOM 126 CA THR A 362 6.536 -12.795 8.193 1.00 0.00 C ATOM 127 C THR A 362 7.312 -13.606 7.160 1.00 0.00 C ATOM 128 O THR A 362 7.184 -13.380 5.957 1.00 0.00 O ATOM 129 CB THR A 362 5.044 -13.168 8.105 1.00 0.00 C ATOM 130 OG1 THR A 362 4.527 -12.820 6.815 1.00 0.00 O ATOM 131 CG2 THR A 362 4.245 -12.455 9.185 1.00 0.00 C ATOM 0 H THR A 362 5.953 -10.880 7.569 1.00 0.00 H new ATOM 0 HA THR A 362 6.907 -13.035 9.189 1.00 0.00 H new ATOM 0 HB THR A 362 4.951 -14.244 8.255 1.00 0.00 H new ATOM 0 HG1 THR A 362 5.221 -12.957 6.137 1.00 0.00 H new ATOM 0 HG21 THR A 362 3.194 -12.733 9.104 1.00 0.00 H new ATOM 0 HG22 THR A 362 4.622 -12.743 10.166 1.00 0.00 H new ATOM 0 HG23 THR A 362 4.345 -11.377 9.060 1.00 0.00 H new ATOM 139 N GLN A 363 8.106 -14.559 7.640 1.00 0.00 N ATOM 140 CA GLN A 363 8.893 -15.415 6.759 1.00 0.00 C ATOM 141 C GLN A 363 8.052 -16.588 6.265 1.00 0.00 C ATOM 142 O GLN A 363 8.499 -17.735 6.276 1.00 0.00 O ATOM 143 CB GLN A 363 10.138 -15.928 7.486 1.00 0.00 C ATOM 144 CG GLN A 363 11.079 -14.823 7.940 1.00 0.00 C ATOM 145 CD GLN A 363 11.615 -14.002 6.784 1.00 0.00 C ATOM 146 OE1 GLN A 363 11.339 -12.703 6.800 1.00 0.00 O flip ATOM 147 NE2 GLN A 363 12.272 -14.529 5.886 1.00 0.00 N flip ATOM 0 H GLN A 363 8.221 -14.758 8.634 1.00 0.00 H new ATOM 0 HA GLN A 363 9.209 -14.825 5.898 1.00 0.00 H new ATOM 0 HB2 GLN A 363 9.827 -16.508 8.355 1.00 0.00 H new ATOM 0 HB3 GLN A 363 10.679 -16.606 6.827 1.00 0.00 H new ATOM 0 HG2 GLN A 363 10.554 -14.167 8.634 1.00 0.00 H new ATOM 0 HG3 GLN A 363 11.914 -15.263 8.486 1.00 0.00 H new ATOM 0 HE21 GLN A 363 12.461 -15.531 5.913 1.00 0.00 H new ATOM 0 HE22 GLN A 363 12.627 -13.964 5.115 1.00 0.00 H new ATOM 156 N LYS A 364 6.827 -16.291 5.840 1.00 0.00 N ATOM 157 CA LYS A 364 5.915 -17.316 5.351 1.00 0.00 C ATOM 158 C LYS A 364 4.851 -16.709 4.445 1.00 0.00 C ATOM 159 O LYS A 364 4.451 -15.559 4.634 1.00 0.00 O ATOM 160 CB LYS A 364 5.244 -18.035 6.522 1.00 0.00 C ATOM 161 CG LYS A 364 4.400 -17.121 7.395 1.00 0.00 C ATOM 162 CD LYS A 364 3.716 -17.895 8.509 1.00 0.00 C ATOM 163 CE LYS A 364 2.824 -16.994 9.346 1.00 0.00 C ATOM 164 NZ LYS A 364 2.120 -17.748 10.420 1.00 0.00 N ATOM 0 H LYS A 364 6.444 -15.346 5.825 1.00 0.00 H new ATOM 0 HA LYS A 364 6.497 -18.035 4.774 1.00 0.00 H new ATOM 0 HB2 LYS A 364 4.614 -18.835 6.133 1.00 0.00 H new ATOM 0 HB3 LYS A 364 6.012 -18.504 7.137 1.00 0.00 H new ATOM 0 HG2 LYS A 364 5.030 -16.342 7.825 1.00 0.00 H new ATOM 0 HG3 LYS A 364 3.649 -16.622 6.783 1.00 0.00 H new ATOM 0 HD2 LYS A 364 3.121 -18.702 8.081 1.00 0.00 H new ATOM 0 HD3 LYS A 364 4.469 -18.358 9.147 1.00 0.00 H new ATOM 0 HE2 LYS A 364 3.426 -16.203 9.793 1.00 0.00 H new ATOM 0 HE3 LYS A 364 2.090 -16.511 8.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 364 1.522 -17.096 10.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 364 1.526 -18.487 9.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 364 2.820 -18.188 11.051 1.00 0.00 H new ATOM 178 N HIS A 365 4.403 -17.491 3.460 1.00 0.00 N ATOM 179 CA HIS A 365 3.385 -17.051 2.505 1.00 0.00 C ATOM 180 C HIS A 365 3.958 -16.056 1.497 1.00 0.00 C ATOM 181 O HIS A 365 3.573 -16.057 0.328 1.00 0.00 O ATOM 182 CB HIS A 365 2.182 -16.436 3.229 1.00 0.00 C ATOM 183 CG HIS A 365 1.441 -17.407 4.097 1.00 0.00 C ATOM 184 ND1 HIS A 365 2.033 -18.090 5.140 1.00 0.00 N ATOM 185 CD2 HIS A 365 0.147 -17.811 4.073 1.00 0.00 C ATOM 186 CE1 HIS A 365 1.136 -18.870 5.718 1.00 0.00 C ATOM 187 NE2 HIS A 365 -0.014 -18.718 5.090 1.00 0.00 N ATOM 0 H HIS A 365 4.734 -18.443 3.303 1.00 0.00 H new ATOM 0 HA HIS A 365 3.050 -17.933 1.959 1.00 0.00 H new ATOM 0 HB2 HIS A 365 2.525 -15.603 3.842 1.00 0.00 H new ATOM 0 HB3 HIS A 365 1.495 -16.026 2.489 1.00 0.00 H new ATOM 0 HD2 HIS A 365 -0.615 -17.481 3.382 1.00 0.00 H new ATOM 0 HE1 HIS A 365 1.314 -19.521 6.561 1.00 0.00 H new ATOM 0 HE2 HIS A 365 -0.883 -19.198 5.323 1.00 0.00 H new ATOM 196 N LYS A 366 4.880 -15.211 1.952 1.00 0.00 N ATOM 197 CA LYS A 366 5.504 -14.217 1.088 1.00 0.00 C ATOM 198 C LYS A 366 6.735 -13.610 1.763 1.00 0.00 C ATOM 199 O LYS A 366 6.659 -13.135 2.897 1.00 0.00 O ATOM 200 CB LYS A 366 4.499 -13.118 0.733 1.00 0.00 C ATOM 201 CG LYS A 366 3.861 -12.459 1.946 1.00 0.00 C ATOM 202 CD LYS A 366 2.850 -11.398 1.541 1.00 0.00 C ATOM 203 CE LYS A 366 3.512 -10.238 0.814 1.00 0.00 C ATOM 204 NZ LYS A 366 4.533 -9.563 1.661 1.00 0.00 N ATOM 0 H LYS A 366 5.211 -15.196 2.917 1.00 0.00 H new ATOM 0 HA LYS A 366 5.824 -14.712 0.171 1.00 0.00 H new ATOM 0 HB2 LYS A 366 5.003 -12.355 0.139 1.00 0.00 H new ATOM 0 HB3 LYS A 366 3.715 -13.543 0.107 1.00 0.00 H new ATOM 0 HG2 LYS A 366 3.369 -13.217 2.556 1.00 0.00 H new ATOM 0 HG3 LYS A 366 4.636 -12.006 2.564 1.00 0.00 H new ATOM 0 HD2 LYS A 366 2.091 -11.845 0.898 1.00 0.00 H new ATOM 0 HD3 LYS A 366 2.337 -11.026 2.428 1.00 0.00 H new ATOM 0 HE2 LYS A 366 3.982 -10.603 -0.100 1.00 0.00 H new ATOM 0 HE3 LYS A 366 2.752 -9.515 0.516 1.00 0.00 H new ATOM 0 HZ1 LYS A 366 4.398 -8.533 1.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 366 4.431 -9.880 2.646 1.00 0.00 H new ATOM 0 HZ3 LYS A 366 5.484 -9.804 1.316 1.00 0.00 H new ATOM 218 N PRO A 367 7.893 -13.625 1.074 1.00 0.00 N ATOM 219 CA PRO A 367 9.145 -13.080 1.613 1.00 0.00 C ATOM 220 C PRO A 367 9.075 -11.573 1.846 1.00 0.00 C ATOM 221 O PRO A 367 8.012 -11.029 2.146 1.00 0.00 O ATOM 222 CB PRO A 367 10.184 -13.407 0.529 1.00 0.00 C ATOM 223 CG PRO A 367 9.551 -14.443 -0.329 1.00 0.00 C ATOM 224 CD PRO A 367 8.078 -14.182 -0.275 1.00 0.00 C ATOM 0 HA PRO A 367 9.381 -13.507 2.588 1.00 0.00 H new ATOM 0 HB2 PRO A 367 10.439 -12.520 -0.051 1.00 0.00 H new ATOM 0 HB3 PRO A 367 11.110 -13.776 0.971 1.00 0.00 H new ATOM 0 HG2 PRO A 367 9.921 -14.381 -1.352 1.00 0.00 H new ATOM 0 HG3 PRO A 367 9.783 -15.444 0.033 1.00 0.00 H new ATOM 0 HD2 PRO A 367 7.763 -13.481 -1.048 1.00 0.00 H new ATOM 0 HD3 PRO A 367 7.500 -15.095 -0.418 1.00 0.00 H new ATOM 232 N ALA A 368 10.216 -10.903 1.706 1.00 0.00 N ATOM 233 CA ALA A 368 10.287 -9.460 1.901 1.00 0.00 C ATOM 234 C ALA A 368 9.382 -8.724 0.921 1.00 0.00 C ATOM 235 O ALA A 368 9.362 -9.028 -0.272 1.00 0.00 O ATOM 236 CB ALA A 368 11.724 -8.981 1.758 1.00 0.00 C ATOM 0 H ALA A 368 11.104 -11.338 1.458 1.00 0.00 H new ATOM 0 HA ALA A 368 9.938 -9.238 2.909 1.00 0.00 H new ATOM 0 HB1 ALA A 368 11.764 -7.902 1.906 1.00 0.00 H new ATOM 0 HB2 ALA A 368 12.347 -9.473 2.505 1.00 0.00 H new ATOM 0 HB3 ALA A 368 12.091 -9.225 0.761 1.00 0.00 H new ATOM 242 N GLU A 369 8.634 -7.751 1.435 1.00 0.00 N ATOM 243 CA GLU A 369 7.723 -6.963 0.612 1.00 0.00 C ATOM 244 C GLU A 369 7.125 -5.818 1.418 1.00 0.00 C ATOM 245 O GLU A 369 6.985 -4.700 0.922 1.00 0.00 O ATOM 246 CB GLU A 369 6.606 -7.848 0.051 1.00 0.00 C ATOM 247 CG GLU A 369 5.634 -7.113 -0.863 1.00 0.00 C ATOM 248 CD GLU A 369 6.294 -6.577 -2.121 1.00 0.00 C ATOM 249 OE1 GLU A 369 7.195 -5.720 -2.003 1.00 0.00 O ATOM 250 OE2 GLU A 369 5.909 -7.016 -3.224 1.00 0.00 O ATOM 0 H GLU A 369 8.642 -7.489 2.421 1.00 0.00 H new ATOM 0 HA GLU A 369 8.291 -6.545 -0.219 1.00 0.00 H new ATOM 0 HB2 GLU A 369 7.054 -8.674 -0.501 1.00 0.00 H new ATOM 0 HB3 GLU A 369 6.050 -8.283 0.881 1.00 0.00 H new ATOM 0 HG2 GLU A 369 4.825 -7.788 -1.143 1.00 0.00 H new ATOM 0 HG3 GLU A 369 5.183 -6.286 -0.315 1.00 0.00 H new ATOM 257 N SER A 370 6.778 -6.109 2.663 1.00 0.00 N ATOM 258 CA SER A 370 6.193 -5.111 3.552 1.00 0.00 C ATOM 259 C SER A 370 7.175 -3.973 3.819 1.00 0.00 C ATOM 260 O SER A 370 8.344 -4.207 4.128 1.00 0.00 O ATOM 261 CB SER A 370 5.771 -5.757 4.872 1.00 0.00 C ATOM 262 OG SER A 370 5.211 -4.800 5.755 1.00 0.00 O ATOM 0 H SER A 370 6.891 -7.031 3.084 1.00 0.00 H new ATOM 0 HA SER A 370 5.313 -4.697 3.060 1.00 0.00 H new ATOM 0 HB2 SER A 370 5.044 -6.546 4.678 1.00 0.00 H new ATOM 0 HB3 SER A 370 6.634 -6.228 5.342 1.00 0.00 H new ATOM 0 HG SER A 370 4.948 -5.240 6.590 1.00 0.00 H new ATOM 268 N GLN A 371 6.687 -2.742 3.701 1.00 0.00 N ATOM 269 CA GLN A 371 7.510 -1.560 3.930 1.00 0.00 C ATOM 270 C GLN A 371 6.656 -0.297 3.897 1.00 0.00 C ATOM 271 O GLN A 371 6.565 0.429 4.887 1.00 0.00 O ATOM 272 CB GLN A 371 8.614 -1.465 2.872 1.00 0.00 C ATOM 273 CG GLN A 371 9.492 -0.229 3.008 1.00 0.00 C ATOM 274 CD GLN A 371 10.332 -0.224 4.276 1.00 0.00 C ATOM 275 OE1 GLN A 371 10.325 -1.334 5.010 1.00 0.00 O flip ATOM 276 NE2 GLN A 371 10.995 0.766 4.585 1.00 0.00 N flip ATOM 0 H GLN A 371 5.721 -2.537 3.447 1.00 0.00 H new ATOM 0 HA GLN A 371 7.968 -1.650 4.915 1.00 0.00 H new ATOM 0 HB2 GLN A 371 9.242 -2.354 2.935 1.00 0.00 H new ATOM 0 HB3 GLN A 371 8.157 -1.467 1.882 1.00 0.00 H new ATOM 0 HG2 GLN A 371 10.152 -0.164 2.143 1.00 0.00 H new ATOM 0 HG3 GLN A 371 8.861 0.660 2.995 1.00 0.00 H new ATOM 0 HE21 GLN A 371 10.974 1.598 3.996 1.00 0.00 H new ATOM 0 HE22 GLN A 371 11.566 0.754 5.430 1.00 0.00 H new ATOM 285 N GLN A 372 6.025 -0.050 2.755 1.00 0.00 N ATOM 286 CA GLN A 372 5.166 1.117 2.589 1.00 0.00 C ATOM 287 C GLN A 372 4.153 0.889 1.472 1.00 0.00 C ATOM 288 O GLN A 372 4.522 0.599 0.335 1.00 0.00 O ATOM 289 CB GLN A 372 6.008 2.360 2.295 1.00 0.00 C ATOM 290 CG GLN A 372 6.925 2.207 1.092 1.00 0.00 C ATOM 291 CD GLN A 372 7.745 3.453 0.823 1.00 0.00 C ATOM 292 OE1 GLN A 372 7.198 4.530 0.587 1.00 0.00 O ATOM 293 NE2 GLN A 372 9.064 3.311 0.855 1.00 0.00 N ATOM 0 H GLN A 372 6.092 -0.644 1.928 1.00 0.00 H new ATOM 0 HA GLN A 372 4.621 1.274 3.520 1.00 0.00 H new ATOM 0 HB2 GLN A 372 5.343 3.207 2.128 1.00 0.00 H new ATOM 0 HB3 GLN A 372 6.611 2.596 3.172 1.00 0.00 H new ATOM 0 HG2 GLN A 372 7.596 1.363 1.256 1.00 0.00 H new ATOM 0 HG3 GLN A 372 6.327 1.973 0.211 1.00 0.00 H new ATOM 0 HE21 GLN A 372 9.474 2.399 1.055 1.00 0.00 H new ATOM 0 HE22 GLN A 372 9.668 4.114 0.680 1.00 0.00 H new ATOM 302 N GLN A 373 2.873 1.019 1.806 1.00 0.00 N ATOM 303 CA GLN A 373 1.809 0.826 0.833 1.00 0.00 C ATOM 304 C GLN A 373 1.569 2.084 0.008 1.00 0.00 C ATOM 305 O GLN A 373 1.645 3.203 0.516 1.00 0.00 O ATOM 306 CB GLN A 373 0.520 0.389 1.524 1.00 0.00 C ATOM 307 CG GLN A 373 0.558 -1.056 1.985 1.00 0.00 C ATOM 308 CD GLN A 373 -0.718 -1.484 2.683 1.00 0.00 C ATOM 309 OE1 GLN A 373 -1.800 -1.453 2.098 1.00 0.00 O ATOM 310 NE2 GLN A 373 -0.597 -1.883 3.944 1.00 0.00 N ATOM 0 H GLN A 373 2.550 1.257 2.744 1.00 0.00 H new ATOM 0 HA GLN A 373 2.127 0.037 0.152 1.00 0.00 H new ATOM 0 HB2 GLN A 373 0.337 1.035 2.383 1.00 0.00 H new ATOM 0 HB3 GLN A 373 -0.317 0.525 0.840 1.00 0.00 H new ATOM 0 HG2 GLN A 373 0.730 -1.703 1.125 1.00 0.00 H new ATOM 0 HG3 GLN A 373 1.401 -1.195 2.662 1.00 0.00 H new ATOM 0 HE21 GLN A 373 0.320 -1.893 4.390 1.00 0.00 H new ATOM 0 HE22 GLN A 373 -1.421 -2.180 4.466 1.00 0.00 H new ATOM 319 N ALA A 374 1.282 1.881 -1.272 1.00 0.00 N ATOM 320 CA ALA A 374 1.030 2.986 -2.188 1.00 0.00 C ATOM 321 C ALA A 374 -0.290 3.679 -1.867 1.00 0.00 C ATOM 322 O ALA A 374 -1.299 3.022 -1.609 1.00 0.00 O ATOM 323 CB ALA A 374 1.032 2.487 -3.625 1.00 0.00 C ATOM 0 H ALA A 374 1.218 0.957 -1.700 1.00 0.00 H new ATOM 0 HA ALA A 374 1.829 3.717 -2.066 1.00 0.00 H new ATOM 0 HB1 ALA A 374 0.843 3.321 -4.300 1.00 0.00 H new ATOM 0 HB2 ALA A 374 2.002 2.046 -3.856 1.00 0.00 H new ATOM 0 HB3 ALA A 374 0.253 1.735 -3.750 1.00 0.00 H new ATOM 329 N ALA A 375 -0.272 5.008 -1.886 1.00 0.00 N ATOM 330 CA ALA A 375 -1.462 5.800 -1.602 1.00 0.00 C ATOM 331 C ALA A 375 -2.427 5.781 -2.780 1.00 0.00 C ATOM 332 O ALA A 375 -2.640 6.795 -3.446 1.00 0.00 O ATOM 333 CB ALA A 375 -1.077 7.227 -1.243 1.00 0.00 C ATOM 0 H ALA A 375 0.559 5.561 -2.096 1.00 0.00 H new ATOM 0 HA ALA A 375 -1.971 5.354 -0.747 1.00 0.00 H new ATOM 0 HB1 ALA A 375 -1.977 7.805 -1.034 1.00 0.00 H new ATOM 0 HB2 ALA A 375 -0.437 7.220 -0.361 1.00 0.00 H new ATOM 0 HB3 ALA A 375 -0.541 7.680 -2.077 1.00 0.00 H new ATOM 339 N GLU A 376 -3.000 4.611 -3.024 1.00 0.00 N ATOM 340 CA GLU A 376 -3.942 4.412 -4.111 1.00 0.00 C ATOM 341 C GLU A 376 -4.989 5.506 -4.132 1.00 0.00 C ATOM 342 O GLU A 376 -5.477 5.948 -3.093 1.00 0.00 O ATOM 343 CB GLU A 376 -4.613 3.049 -3.981 1.00 0.00 C ATOM 344 CG GLU A 376 -3.619 1.906 -3.972 1.00 0.00 C ATOM 345 CD GLU A 376 -2.936 1.704 -5.313 1.00 0.00 C ATOM 346 OE1 GLU A 376 -3.259 2.446 -6.265 1.00 0.00 O ATOM 347 OE2 GLU A 376 -2.079 0.801 -5.411 1.00 0.00 O ATOM 0 H GLU A 376 -2.823 3.772 -2.471 1.00 0.00 H new ATOM 0 HA GLU A 376 -3.389 4.451 -5.050 1.00 0.00 H new ATOM 0 HB2 GLU A 376 -5.198 3.023 -3.062 1.00 0.00 H new ATOM 0 HB3 GLU A 376 -5.311 2.912 -4.807 1.00 0.00 H new ATOM 0 HG2 GLU A 376 -2.863 2.095 -3.210 1.00 0.00 H new ATOM 0 HG3 GLU A 376 -4.133 0.987 -3.690 1.00 0.00 H new ATOM 354 N THR A 377 -5.310 5.939 -5.331 1.00 0.00 N ATOM 355 CA THR A 377 -6.283 6.993 -5.535 1.00 0.00 C ATOM 356 C THR A 377 -7.699 6.439 -5.572 1.00 0.00 C ATOM 357 O THR A 377 -7.903 5.256 -5.836 1.00 0.00 O ATOM 358 CB THR A 377 -5.969 7.756 -6.823 1.00 0.00 C ATOM 359 OG1 THR A 377 -6.215 6.924 -7.964 1.00 0.00 O ATOM 360 CG2 THR A 377 -4.511 8.183 -6.804 1.00 0.00 C ATOM 0 H THR A 377 -4.905 5.572 -6.192 1.00 0.00 H new ATOM 0 HA THR A 377 -6.220 7.682 -4.692 1.00 0.00 H new ATOM 0 HB THR A 377 -6.611 8.635 -6.887 1.00 0.00 H new ATOM 0 HG1 THR A 377 -6.012 7.423 -8.783 1.00 0.00 H new ATOM 0 HG21 THR A 377 -4.279 8.728 -7.719 1.00 0.00 H new ATOM 0 HG22 THR A 377 -4.332 8.827 -5.943 1.00 0.00 H new ATOM 0 HG23 THR A 377 -3.874 7.301 -6.736 1.00 0.00 H new ATOM 368 N GLU A 378 -8.669 7.301 -5.286 1.00 0.00 N ATOM 369 CA GLU A 378 -10.074 6.905 -5.266 1.00 0.00 C ATOM 370 C GLU A 378 -10.422 6.054 -6.479 1.00 0.00 C ATOM 371 O GLU A 378 -11.086 5.025 -6.359 1.00 0.00 O ATOM 372 CB GLU A 378 -10.972 8.141 -5.225 1.00 0.00 C ATOM 373 CG GLU A 378 -12.454 7.813 -5.146 1.00 0.00 C ATOM 374 CD GLU A 378 -13.332 9.051 -5.173 1.00 0.00 C ATOM 375 OE1 GLU A 378 -12.781 10.169 -5.252 1.00 0.00 O ATOM 376 OE2 GLU A 378 -14.570 8.901 -5.116 1.00 0.00 O ATOM 0 H GLU A 378 -8.507 8.283 -5.064 1.00 0.00 H new ATOM 0 HA GLU A 378 -10.241 6.309 -4.369 1.00 0.00 H new ATOM 0 HB2 GLU A 378 -10.697 8.751 -4.365 1.00 0.00 H new ATOM 0 HB3 GLU A 378 -10.788 8.743 -6.115 1.00 0.00 H new ATOM 0 HG2 GLU A 378 -12.723 7.164 -5.979 1.00 0.00 H new ATOM 0 HG3 GLU A 378 -12.650 7.254 -4.231 1.00 0.00 H new ATOM 383 N GLY A 379 -9.967 6.487 -7.647 1.00 0.00 N ATOM 384 CA GLY A 379 -10.239 5.749 -8.864 1.00 0.00 C ATOM 385 C GLY A 379 -9.644 4.358 -8.840 1.00 0.00 C ATOM 386 O GLY A 379 -10.259 3.403 -9.316 1.00 0.00 O ATOM 0 H GLY A 379 -9.415 7.335 -7.773 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -11.317 5.678 -9.009 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -9.838 6.298 -9.716 1.00 0.00 H new ATOM 390 N SER A 380 -8.443 4.243 -8.286 1.00 0.00 N ATOM 391 CA SER A 380 -7.762 2.958 -8.202 1.00 0.00 C ATOM 392 C SER A 380 -8.465 2.019 -7.226 1.00 0.00 C ATOM 393 O SER A 380 -8.744 0.869 -7.556 1.00 0.00 O ATOM 394 CB SER A 380 -6.312 3.157 -7.778 1.00 0.00 C ATOM 395 OG SER A 380 -5.610 3.956 -8.715 1.00 0.00 O ATOM 0 H SER A 380 -7.921 5.024 -7.889 1.00 0.00 H new ATOM 0 HA SER A 380 -7.789 2.501 -9.191 1.00 0.00 H new ATOM 0 HB2 SER A 380 -6.279 3.629 -6.796 1.00 0.00 H new ATOM 0 HB3 SER A 380 -5.822 2.188 -7.683 1.00 0.00 H new ATOM 0 HG SER A 380 -5.770 4.903 -8.522 1.00 0.00 H new ATOM 401 N CYS A 381 -8.743 2.516 -6.023 1.00 0.00 N ATOM 402 CA CYS A 381 -9.406 1.722 -4.990 1.00 0.00 C ATOM 403 C CYS A 381 -10.673 1.057 -5.514 1.00 0.00 C ATOM 404 O CYS A 381 -10.900 -0.130 -5.282 1.00 0.00 O ATOM 405 CB CYS A 381 -9.747 2.598 -3.786 1.00 0.00 C ATOM 406 SG CYS A 381 -8.300 3.110 -2.811 1.00 0.00 S ATOM 0 H CYS A 381 -8.518 3.469 -5.738 1.00 0.00 H new ATOM 0 HA CYS A 381 -8.713 0.937 -4.687 1.00 0.00 H new ATOM 0 HB2 CYS A 381 -10.271 3.488 -4.134 1.00 0.00 H new ATOM 0 HB3 CYS A 381 -10.435 2.055 -3.138 1.00 0.00 H new ATOM 411 N ASN A 382 -11.495 1.830 -6.212 1.00 0.00 N ATOM 412 CA ASN A 382 -12.747 1.317 -6.762 1.00 0.00 C ATOM 413 C ASN A 382 -12.511 0.052 -7.582 1.00 0.00 C ATOM 414 O ASN A 382 -13.401 -0.787 -7.719 1.00 0.00 O ATOM 415 CB ASN A 382 -13.417 2.374 -7.645 1.00 0.00 C ATOM 416 CG ASN A 382 -13.692 3.676 -6.916 1.00 0.00 C ATOM 417 OD1 ASN A 382 -13.331 3.741 -5.640 1.00 0.00 O flip ATOM 418 ND2 ASN A 382 -14.226 4.621 -7.499 1.00 0.00 N flip ATOM 0 H ASN A 382 -11.319 2.815 -6.412 1.00 0.00 H new ATOM 0 HA ASN A 382 -13.400 1.076 -5.924 1.00 0.00 H new ATOM 0 HB2 ASN A 382 -12.780 2.575 -8.506 1.00 0.00 H new ATOM 0 HB3 ASN A 382 -14.356 1.975 -8.029 1.00 0.00 H new ATOM 0 HD21 ASN A 382 -14.489 4.532 -8.481 1.00 0.00 H new ATOM 0 HD22 ASN A 382 -14.405 5.492 -7.000 1.00 0.00 H new ATOM 425 N LYS A 383 -11.312 -0.066 -8.141 1.00 0.00 N ATOM 426 CA LYS A 383 -10.958 -1.210 -8.967 1.00 0.00 C ATOM 427 C LYS A 383 -10.347 -2.340 -8.142 1.00 0.00 C ATOM 428 O LYS A 383 -10.528 -3.517 -8.458 1.00 0.00 O ATOM 429 CB LYS A 383 -9.984 -0.774 -10.061 1.00 0.00 C ATOM 430 CG LYS A 383 -10.438 0.469 -10.817 1.00 0.00 C ATOM 431 CD LYS A 383 -11.784 0.259 -11.498 1.00 0.00 C ATOM 432 CE LYS A 383 -11.708 -0.819 -12.569 1.00 0.00 C ATOM 433 NZ LYS A 383 -10.731 -0.470 -13.638 1.00 0.00 N ATOM 0 H LYS A 383 -10.566 0.622 -8.035 1.00 0.00 H new ATOM 0 HA LYS A 383 -11.873 -1.592 -9.419 1.00 0.00 H new ATOM 0 HB2 LYS A 383 -9.009 -0.582 -9.613 1.00 0.00 H new ATOM 0 HB3 LYS A 383 -9.854 -1.593 -10.768 1.00 0.00 H new ATOM 0 HG2 LYS A 383 -10.508 1.309 -10.126 1.00 0.00 H new ATOM 0 HG3 LYS A 383 -9.690 0.733 -11.565 1.00 0.00 H new ATOM 0 HD2 LYS A 383 -12.530 -0.019 -10.753 1.00 0.00 H new ATOM 0 HD3 LYS A 383 -12.115 1.196 -11.947 1.00 0.00 H new ATOM 0 HE2 LYS A 383 -11.423 -1.766 -12.111 1.00 0.00 H new ATOM 0 HE3 LYS A 383 -12.694 -0.962 -13.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 383 -10.874 -1.095 -14.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 383 -10.872 0.519 -13.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 383 -9.763 -0.589 -13.276 1.00 0.00 H new ATOM 447 N LYS A 384 -9.609 -1.981 -7.095 1.00 0.00 N ATOM 448 CA LYS A 384 -8.959 -2.966 -6.243 1.00 0.00 C ATOM 449 C LYS A 384 -9.971 -3.848 -5.522 1.00 0.00 C ATOM 450 O LYS A 384 -10.874 -3.353 -4.847 1.00 0.00 O ATOM 451 CB LYS A 384 -8.062 -2.253 -5.232 1.00 0.00 C ATOM 452 CG LYS A 384 -6.700 -1.828 -5.778 1.00 0.00 C ATOM 453 CD LYS A 384 -6.784 -1.202 -7.164 1.00 0.00 C ATOM 454 CE LYS A 384 -6.589 -2.237 -8.265 1.00 0.00 C ATOM 455 NZ LYS A 384 -6.680 -1.632 -9.622 1.00 0.00 N ATOM 0 H LYS A 384 -9.447 -1.013 -6.818 1.00 0.00 H new ATOM 0 HA LYS A 384 -8.356 -3.616 -6.876 1.00 0.00 H new ATOM 0 HB2 LYS A 384 -8.583 -1.369 -4.864 1.00 0.00 H new ATOM 0 HB3 LYS A 384 -7.907 -2.911 -4.377 1.00 0.00 H new ATOM 0 HG2 LYS A 384 -6.245 -1.115 -5.090 1.00 0.00 H new ATOM 0 HG3 LYS A 384 -6.043 -2.697 -5.817 1.00 0.00 H new ATOM 0 HD2 LYS A 384 -7.754 -0.719 -7.287 1.00 0.00 H new ATOM 0 HD3 LYS A 384 -6.026 -0.424 -7.258 1.00 0.00 H new ATOM 0 HE2 LYS A 384 -5.616 -2.714 -8.145 1.00 0.00 H new ATOM 0 HE3 LYS A 384 -7.342 -3.019 -8.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 384 -7.468 -2.066 -10.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 384 -6.844 -0.609 -9.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 384 -5.792 -1.798 -10.136 1.00 0.00 H new ATOM 469 N ASP A 385 -9.801 -5.161 -5.659 1.00 0.00 N ATOM 470 CA ASP A 385 -10.687 -6.120 -5.012 1.00 0.00 C ATOM 471 C ASP A 385 -10.396 -6.179 -3.516 1.00 0.00 C ATOM 472 O ASP A 385 -9.543 -5.447 -3.020 1.00 0.00 O ATOM 473 CB ASP A 385 -10.522 -7.505 -5.638 1.00 0.00 C ATOM 474 CG ASP A 385 -10.890 -7.518 -7.109 1.00 0.00 C ATOM 475 OD1 ASP A 385 -10.251 -6.780 -7.887 1.00 0.00 O ATOM 476 OD2 ASP A 385 -11.817 -8.268 -7.482 1.00 0.00 O ATOM 0 H ASP A 385 -9.056 -5.584 -6.213 1.00 0.00 H new ATOM 0 HA ASP A 385 -11.717 -5.795 -5.157 1.00 0.00 H new ATOM 0 HB2 ASP A 385 -9.489 -7.834 -5.521 1.00 0.00 H new ATOM 0 HB3 ASP A 385 -11.147 -8.220 -5.103 1.00 0.00 H new ATOM 481 N GLN A 386 -11.107 -7.049 -2.805 1.00 0.00 N ATOM 482 CA GLN A 386 -10.925 -7.194 -1.362 1.00 0.00 C ATOM 483 C GLN A 386 -9.445 -7.299 -0.999 1.00 0.00 C ATOM 484 O GLN A 386 -8.950 -6.560 -0.149 1.00 0.00 O ATOM 485 CB GLN A 386 -11.673 -8.430 -0.856 1.00 0.00 C ATOM 486 CG GLN A 386 -11.607 -8.612 0.651 1.00 0.00 C ATOM 487 CD GLN A 386 -12.335 -9.856 1.119 1.00 0.00 C ATOM 488 OE1 GLN A 386 -11.978 -10.974 0.749 1.00 0.00 O ATOM 489 NE2 GLN A 386 -13.366 -9.666 1.935 1.00 0.00 N ATOM 0 H GLN A 386 -11.815 -7.665 -3.204 1.00 0.00 H new ATOM 0 HA GLN A 386 -11.332 -6.304 -0.882 1.00 0.00 H new ATOM 0 HB2 GLN A 386 -12.718 -8.360 -1.159 1.00 0.00 H new ATOM 0 HB3 GLN A 386 -11.260 -9.316 -1.338 1.00 0.00 H new ATOM 0 HG2 GLN A 386 -10.564 -8.667 0.961 1.00 0.00 H new ATOM 0 HG3 GLN A 386 -12.039 -7.738 1.138 1.00 0.00 H new ATOM 0 HE21 GLN A 386 -13.627 -8.721 2.216 1.00 0.00 H new ATOM 0 HE22 GLN A 386 -13.897 -10.465 2.281 1.00 0.00 H new ATOM 498 N ASN A 387 -8.746 -8.220 -1.652 1.00 0.00 N ATOM 499 CA ASN A 387 -7.325 -8.422 -1.402 1.00 0.00 C ATOM 500 C ASN A 387 -6.507 -7.215 -1.855 1.00 0.00 C ATOM 501 O ASN A 387 -5.513 -6.855 -1.224 1.00 0.00 O ATOM 502 CB ASN A 387 -6.836 -9.681 -2.120 1.00 0.00 C ATOM 503 CG ASN A 387 -5.366 -9.946 -1.889 1.00 0.00 C ATOM 504 OD1 ASN A 387 -4.919 -10.086 -0.752 1.00 0.00 O ATOM 505 ND2 ASN A 387 -4.608 -10.022 -2.972 1.00 0.00 N ATOM 0 H ASN A 387 -9.141 -8.839 -2.360 1.00 0.00 H new ATOM 0 HA ASN A 387 -7.188 -8.544 -0.328 1.00 0.00 H new ATOM 0 HB2 ASN A 387 -7.415 -10.539 -1.777 1.00 0.00 H new ATOM 0 HB3 ASN A 387 -7.020 -9.580 -3.190 1.00 0.00 H new ATOM 0 HD21 ASN A 387 -3.608 -10.204 -2.883 1.00 0.00 H new ATOM 0 HD22 ASN A 387 -5.024 -9.899 -3.895 1.00 0.00 H new ATOM 512 N GLU A 388 -6.928 -6.600 -2.956 1.00 0.00 N ATOM 513 CA GLU A 388 -6.229 -5.439 -3.501 1.00 0.00 C ATOM 514 C GLU A 388 -6.611 -4.163 -2.763 1.00 0.00 C ATOM 515 O GLU A 388 -6.026 -3.107 -2.998 1.00 0.00 O ATOM 516 CB GLU A 388 -6.534 -5.291 -4.992 1.00 0.00 C ATOM 517 CG GLU A 388 -6.082 -6.478 -5.827 1.00 0.00 C ATOM 518 CD GLU A 388 -6.374 -6.297 -7.304 1.00 0.00 C ATOM 519 OE1 GLU A 388 -7.562 -6.157 -7.662 1.00 0.00 O ATOM 520 OE2 GLU A 388 -5.414 -6.293 -8.102 1.00 0.00 O ATOM 0 H GLU A 388 -7.750 -6.886 -3.489 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.159 -5.600 -3.366 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -7.607 -5.153 -5.123 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.049 -4.389 -5.366 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -5.011 -6.629 -5.688 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -6.580 -7.379 -5.470 1.00 0.00 H new ATOM 527 N CYS A 389 -7.596 -4.262 -1.876 1.00 0.00 N ATOM 528 CA CYS A 389 -8.043 -3.105 -1.121 1.00 0.00 C ATOM 529 C CYS A 389 -6.899 -2.573 -0.261 1.00 0.00 C ATOM 530 O CYS A 389 -6.640 -3.076 0.833 1.00 0.00 O ATOM 531 CB CYS A 389 -9.251 -3.475 -0.259 1.00 0.00 C ATOM 532 SG CYS A 389 -10.345 -2.068 0.114 1.00 0.00 S ATOM 0 H CYS A 389 -8.095 -5.127 -1.666 1.00 0.00 H new ATOM 0 HA CYS A 389 -8.347 -2.319 -1.812 1.00 0.00 H new ATOM 0 HB2 CYS A 389 -9.828 -4.246 -0.770 1.00 0.00 H new ATOM 0 HB3 CYS A 389 -8.899 -3.908 0.677 1.00 0.00 H new ATOM 537 N LYS A 390 -6.203 -1.568 -0.783 1.00 0.00 N ATOM 538 CA LYS A 390 -5.062 -0.973 -0.092 1.00 0.00 C ATOM 539 C LYS A 390 -5.483 -0.163 1.132 1.00 0.00 C ATOM 540 O LYS A 390 -6.662 0.131 1.324 1.00 0.00 O ATOM 541 CB LYS A 390 -4.262 -0.107 -1.059 1.00 0.00 C ATOM 542 CG LYS A 390 -3.481 -0.916 -2.088 1.00 0.00 C ATOM 543 CD LYS A 390 -2.325 -1.664 -1.442 1.00 0.00 C ATOM 544 CE LYS A 390 -1.516 -2.442 -2.469 1.00 0.00 C ATOM 545 NZ LYS A 390 -0.371 -3.161 -1.844 1.00 0.00 N ATOM 0 H LYS A 390 -6.410 -1.146 -1.688 1.00 0.00 H new ATOM 0 HA LYS A 390 -4.434 -1.788 0.268 1.00 0.00 H new ATOM 0 HB2 LYS A 390 -4.942 0.569 -1.578 1.00 0.00 H new ATOM 0 HB3 LYS A 390 -3.568 0.513 -0.492 1.00 0.00 H new ATOM 0 HG2 LYS A 390 -4.148 -1.626 -2.578 1.00 0.00 H new ATOM 0 HG3 LYS A 390 -3.099 -0.251 -2.863 1.00 0.00 H new ATOM 0 HD2 LYS A 390 -1.675 -0.956 -0.927 1.00 0.00 H new ATOM 0 HD3 LYS A 390 -2.711 -2.349 -0.687 1.00 0.00 H new ATOM 0 HE2 LYS A 390 -2.163 -3.159 -2.974 1.00 0.00 H new ATOM 0 HE3 LYS A 390 -1.143 -1.758 -3.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 390 0.155 -3.679 -2.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 390 0.261 -2.475 -1.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 390 -0.728 -3.832 -1.134 1.00 0.00 H new ATOM 559 N SER A 391 -4.497 0.173 1.963 1.00 0.00 N ATOM 560 CA SER A 391 -4.727 0.925 3.188 1.00 0.00 C ATOM 561 C SER A 391 -5.545 2.194 2.949 1.00 0.00 C ATOM 562 O SER A 391 -6.569 2.395 3.602 1.00 0.00 O ATOM 563 CB SER A 391 -3.389 1.268 3.840 1.00 0.00 C ATOM 564 OG SER A 391 -2.670 0.095 4.174 1.00 0.00 O ATOM 0 H SER A 391 -3.519 -0.070 1.803 1.00 0.00 H new ATOM 0 HA SER A 391 -5.312 0.294 3.857 1.00 0.00 H new ATOM 0 HB2 SER A 391 -2.796 1.881 3.161 1.00 0.00 H new ATOM 0 HB3 SER A 391 -3.560 1.862 4.738 1.00 0.00 H new ATOM 0 HG SER A 391 -1.817 0.341 4.588 1.00 0.00 H new ATOM 570 N PRO A 392 -5.130 3.075 2.012 1.00 0.00 N ATOM 571 CA PRO A 392 -5.862 4.305 1.723 1.00 0.00 C ATOM 572 C PRO A 392 -7.325 4.030 1.416 1.00 0.00 C ATOM 573 O PRO A 392 -8.205 4.819 1.760 1.00 0.00 O ATOM 574 CB PRO A 392 -5.142 4.835 0.484 1.00 0.00 C ATOM 575 CG PRO A 392 -3.767 4.351 0.639 1.00 0.00 C ATOM 576 CD PRO A 392 -3.934 2.962 1.152 1.00 0.00 C ATOM 0 HA PRO A 392 -5.872 5.001 2.562 1.00 0.00 H new ATOM 0 HB2 PRO A 392 -5.596 4.460 -0.433 1.00 0.00 H new ATOM 0 HB3 PRO A 392 -5.179 5.923 0.436 1.00 0.00 H new ATOM 0 HG2 PRO A 392 -3.229 4.365 -0.309 1.00 0.00 H new ATOM 0 HG3 PRO A 392 -3.202 4.969 1.336 1.00 0.00 H new ATOM 0 HD2 PRO A 392 -4.083 2.247 0.343 1.00 0.00 H new ATOM 0 HD3 PRO A 392 -3.061 2.630 1.714 1.00 0.00 H new ATOM 584 N CYS A 393 -7.571 2.902 0.761 1.00 0.00 N ATOM 585 CA CYS A 393 -8.921 2.505 0.391 1.00 0.00 C ATOM 586 C CYS A 393 -9.775 2.235 1.627 1.00 0.00 C ATOM 587 O CYS A 393 -9.393 2.577 2.746 1.00 0.00 O ATOM 588 CB CYS A 393 -8.861 1.254 -0.482 1.00 0.00 C ATOM 589 SG CYS A 393 -7.725 1.394 -1.901 1.00 0.00 S ATOM 0 H CYS A 393 -6.847 2.243 0.474 1.00 0.00 H new ATOM 0 HA CYS A 393 -9.381 3.322 -0.165 1.00 0.00 H new ATOM 0 HB2 CYS A 393 -8.555 0.408 0.134 1.00 0.00 H new ATOM 0 HB3 CYS A 393 -9.862 1.033 -0.852 1.00 0.00 H new ATOM 594 N LYS A 394 -10.928 1.610 1.415 1.00 0.00 N ATOM 595 CA LYS A 394 -11.837 1.280 2.506 1.00 0.00 C ATOM 596 C LYS A 394 -12.810 0.193 2.073 1.00 0.00 C ATOM 597 O LYS A 394 -13.572 0.363 1.116 1.00 0.00 O ATOM 598 CB LYS A 394 -12.604 2.523 2.967 1.00 0.00 C ATOM 599 CG LYS A 394 -13.429 2.300 4.225 1.00 0.00 C ATOM 600 CD LYS A 394 -12.550 1.996 5.432 1.00 0.00 C ATOM 601 CE LYS A 394 -11.621 3.157 5.756 1.00 0.00 C ATOM 602 NZ LYS A 394 -10.742 2.860 6.920 1.00 0.00 N ATOM 0 H LYS A 394 -11.256 1.321 0.493 1.00 0.00 H new ATOM 0 HA LYS A 394 -11.246 0.910 3.344 1.00 0.00 H new ATOM 0 HB2 LYS A 394 -11.895 3.331 3.147 1.00 0.00 H new ATOM 0 HB3 LYS A 394 -13.264 2.851 2.164 1.00 0.00 H new ATOM 0 HG2 LYS A 394 -14.030 3.186 4.427 1.00 0.00 H new ATOM 0 HG3 LYS A 394 -14.122 1.475 4.063 1.00 0.00 H new ATOM 0 HD2 LYS A 394 -13.179 1.781 6.296 1.00 0.00 H new ATOM 0 HD3 LYS A 394 -11.960 1.101 5.237 1.00 0.00 H new ATOM 0 HE2 LYS A 394 -11.005 3.383 4.885 1.00 0.00 H new ATOM 0 HE3 LYS A 394 -12.213 4.047 5.967 1.00 0.00 H new ATOM 0 HZ1 LYS A 394 -10.126 3.676 7.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 394 -11.328 2.670 7.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 394 -10.158 2.026 6.710 1.00 0.00 H new ATOM 616 N TRP A 395 -12.759 -0.929 2.782 1.00 0.00 N ATOM 617 CA TRP A 395 -13.610 -2.072 2.488 1.00 0.00 C ATOM 618 C TRP A 395 -15.027 -1.859 3.011 1.00 0.00 C ATOM 619 O TRP A 395 -15.236 -1.165 4.007 1.00 0.00 O ATOM 620 CB TRP A 395 -13.016 -3.341 3.104 1.00 0.00 C ATOM 621 CG TRP A 395 -13.665 -4.602 2.621 1.00 0.00 C ATOM 622 CD1 TRP A 395 -14.217 -5.587 3.388 1.00 0.00 C ATOM 623 CD2 TRP A 395 -13.815 -5.021 1.260 1.00 0.00 C ATOM 624 NE1 TRP A 395 -14.707 -6.589 2.588 1.00 0.00 N ATOM 625 CE2 TRP A 395 -14.474 -6.265 1.277 1.00 0.00 C ATOM 626 CE3 TRP A 395 -13.462 -4.461 0.029 1.00 0.00 C ATOM 627 CZ2 TRP A 395 -14.782 -6.959 0.110 1.00 0.00 C ATOM 628 CZ3 TRP A 395 -13.769 -5.150 -1.128 1.00 0.00 C ATOM 629 CH2 TRP A 395 -14.423 -6.387 -1.081 1.00 0.00 C ATOM 0 H TRP A 395 -12.130 -1.070 3.572 1.00 0.00 H new ATOM 0 HA TRP A 395 -13.660 -2.182 1.405 1.00 0.00 H new ATOM 0 HB2 TRP A 395 -11.951 -3.381 2.877 1.00 0.00 H new ATOM 0 HB3 TRP A 395 -13.109 -3.286 4.189 1.00 0.00 H new ATOM 0 HD1 TRP A 395 -14.262 -5.579 4.467 1.00 0.00 H new ATOM 0 HE1 TRP A 395 -15.169 -7.437 2.916 1.00 0.00 H new ATOM 0 HE3 TRP A 395 -12.958 -3.507 -0.017 1.00 0.00 H new ATOM 0 HZ2 TRP A 395 -15.286 -7.914 0.143 1.00 0.00 H new ATOM 0 HZ3 TRP A 395 -13.500 -4.728 -2.085 1.00 0.00 H new ATOM 0 HH2 TRP A 395 -14.649 -6.901 -2.004 1.00 0.00 H new ATOM 640 N HIS A 396 -15.995 -2.470 2.337 1.00 0.00 N ATOM 641 CA HIS A 396 -17.392 -2.361 2.733 1.00 0.00 C ATOM 642 C HIS A 396 -18.093 -3.707 2.589 1.00 0.00 C ATOM 643 O HIS A 396 -18.216 -4.240 1.484 1.00 0.00 O ATOM 644 CB HIS A 396 -18.106 -1.308 1.886 1.00 0.00 C ATOM 645 CG HIS A 396 -17.548 0.070 2.052 1.00 0.00 C ATOM 646 ND1 HIS A 396 -17.556 0.747 3.253 1.00 0.00 N ATOM 647 CD2 HIS A 396 -16.956 0.901 1.161 1.00 0.00 C ATOM 648 CE1 HIS A 396 -16.996 1.932 3.094 1.00 0.00 C ATOM 649 NE2 HIS A 396 -16.622 2.050 1.833 1.00 0.00 N ATOM 0 H HIS A 396 -15.836 -3.047 1.511 1.00 0.00 H new ATOM 0 HA HIS A 396 -17.429 -2.056 3.779 1.00 0.00 H new ATOM 0 HB2 HIS A 396 -18.042 -1.593 0.836 1.00 0.00 H new ATOM 0 HB3 HIS A 396 -19.164 -1.297 2.149 1.00 0.00 H new ATOM 0 HD2 HIS A 396 -16.780 0.697 0.115 1.00 0.00 H new ATOM 0 HE1 HIS A 396 -16.866 2.678 3.864 1.00 0.00 H new ATOM 0 HE2 HIS A 396 -16.160 2.863 1.425 1.00 0.00 H new ATOM 658 N ASN A 397 -18.543 -4.250 3.717 1.00 0.00 N ATOM 659 CA ASN A 397 -19.228 -5.538 3.737 1.00 0.00 C ATOM 660 C ASN A 397 -20.712 -5.384 3.423 1.00 0.00 C ATOM 661 O ASN A 397 -21.353 -4.425 3.854 1.00 0.00 O ATOM 662 CB ASN A 397 -19.053 -6.211 5.098 1.00 0.00 C ATOM 663 CG ASN A 397 -19.621 -5.379 6.232 1.00 0.00 C ATOM 664 OD1 ASN A 397 -19.197 -4.246 6.459 1.00 0.00 O ATOM 665 ND2 ASN A 397 -20.586 -5.939 6.951 1.00 0.00 N ATOM 0 H ASN A 397 -18.444 -3.814 4.634 1.00 0.00 H new ATOM 0 HA ASN A 397 -18.780 -6.163 2.965 1.00 0.00 H new ATOM 0 HB2 ASN A 397 -19.543 -7.185 5.085 1.00 0.00 H new ATOM 0 HB3 ASN A 397 -17.993 -6.390 5.278 1.00 0.00 H new ATOM 0 HD21 ASN A 397 -21.006 -5.427 7.727 1.00 0.00 H new ATOM 0 HD22 ASN A 397 -20.907 -6.881 6.728 1.00 0.00 H new ATOM 672 N ASP A 398 -21.248 -6.342 2.673 1.00 0.00 N ATOM 673 CA ASP A 398 -22.658 -6.334 2.296 1.00 0.00 C ATOM 674 C ASP A 398 -23.018 -5.058 1.543 1.00 0.00 C ATOM 675 O ASP A 398 -24.171 -4.623 1.553 1.00 0.00 O ATOM 676 CB ASP A 398 -23.544 -6.483 3.536 1.00 0.00 C ATOM 677 CG ASP A 398 -23.298 -7.787 4.272 1.00 0.00 C ATOM 678 OD1 ASP A 398 -22.154 -8.008 4.721 1.00 0.00 O ATOM 679 OD2 ASP A 398 -24.249 -8.585 4.400 1.00 0.00 O ATOM 0 H ASP A 398 -20.723 -7.139 2.312 1.00 0.00 H new ATOM 0 HA ASP A 398 -22.833 -7.181 1.633 1.00 0.00 H new ATOM 0 HB2 ASP A 398 -23.361 -5.648 4.212 1.00 0.00 H new ATOM 0 HB3 ASP A 398 -24.591 -6.429 3.239 1.00 0.00 H new ATOM 684 N ALA A 399 -22.029 -4.470 0.878 1.00 0.00 N ATOM 685 CA ALA A 399 -22.246 -3.254 0.106 1.00 0.00 C ATOM 686 C ALA A 399 -22.851 -3.598 -1.251 1.00 0.00 C ATOM 687 O ALA A 399 -23.552 -4.601 -1.386 1.00 0.00 O ATOM 688 CB ALA A 399 -20.932 -2.499 -0.064 1.00 0.00 C ATOM 0 H ALA A 399 -21.070 -4.817 0.859 1.00 0.00 H new ATOM 0 HA ALA A 399 -22.944 -2.611 0.642 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -21.106 -1.592 -0.643 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -20.535 -2.234 0.916 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -20.214 -3.131 -0.587 1.00 0.00 H new ATOM 694 N GLU A 400 -22.558 -2.781 -2.257 1.00 0.00 N ATOM 695 CA GLU A 400 -23.054 -3.028 -3.605 1.00 0.00 C ATOM 696 C GLU A 400 -22.200 -4.102 -4.267 1.00 0.00 C ATOM 697 O GLU A 400 -21.477 -3.827 -5.225 1.00 0.00 O ATOM 698 CB GLU A 400 -23.025 -1.740 -4.433 1.00 0.00 C ATOM 699 CG GLU A 400 -23.884 -0.627 -3.854 1.00 0.00 C ATOM 700 CD GLU A 400 -23.835 0.638 -4.689 1.00 0.00 C ATOM 701 OE1 GLU A 400 -24.219 0.581 -5.877 1.00 0.00 O ATOM 702 OE2 GLU A 400 -23.413 1.685 -4.156 1.00 0.00 O ATOM 0 H GLU A 400 -21.981 -1.945 -2.165 1.00 0.00 H new ATOM 0 HA GLU A 400 -24.087 -3.371 -3.549 1.00 0.00 H new ATOM 0 HB2 GLU A 400 -21.995 -1.391 -4.511 1.00 0.00 H new ATOM 0 HB3 GLU A 400 -23.364 -1.961 -5.445 1.00 0.00 H new ATOM 0 HG2 GLU A 400 -24.916 -0.970 -3.780 1.00 0.00 H new ATOM 0 HG3 GLU A 400 -23.549 -0.403 -2.841 1.00 0.00 H new ATOM 709 N ASN A 401 -22.254 -5.315 -3.708 1.00 0.00 N ATOM 710 CA ASN A 401 -21.456 -6.437 -4.193 1.00 0.00 C ATOM 711 C ASN A 401 -20.027 -6.242 -3.725 1.00 0.00 C ATOM 712 O ASN A 401 -19.069 -6.495 -4.457 1.00 0.00 O ATOM 713 CB ASN A 401 -21.515 -6.543 -5.717 1.00 0.00 C ATOM 714 CG ASN A 401 -22.936 -6.636 -6.229 1.00 0.00 C ATOM 715 OD1 ASN A 401 -23.580 -7.681 -6.134 1.00 0.00 O ATOM 716 ND2 ASN A 401 -23.443 -5.523 -6.741 1.00 0.00 N ATOM 0 H ASN A 401 -22.849 -5.542 -2.912 1.00 0.00 H new ATOM 0 HA ASN A 401 -21.858 -7.368 -3.793 1.00 0.00 H new ATOM 0 HB2 ASN A 401 -21.027 -5.674 -6.159 1.00 0.00 H new ATOM 0 HB3 ASN A 401 -20.956 -7.421 -6.040 1.00 0.00 H new ATOM 0 HD21 ASN A 401 -24.406 -5.509 -7.077 1.00 0.00 H new ATOM 0 HD22 ASN A 401 -22.870 -4.681 -6.799 1.00 0.00 H new ATOM 723 N LYS A 402 -19.917 -5.762 -2.488 1.00 0.00 N ATOM 724 CA LYS A 402 -18.629 -5.481 -1.858 1.00 0.00 C ATOM 725 C LYS A 402 -18.005 -4.234 -2.471 1.00 0.00 C ATOM 726 O LYS A 402 -17.946 -4.100 -3.695 1.00 0.00 O ATOM 727 CB LYS A 402 -17.683 -6.677 -1.997 1.00 0.00 C ATOM 728 CG LYS A 402 -18.192 -7.942 -1.323 1.00 0.00 C ATOM 729 CD LYS A 402 -18.331 -7.754 0.180 1.00 0.00 C ATOM 730 CE LYS A 402 -18.817 -9.024 0.861 1.00 0.00 C ATOM 731 NZ LYS A 402 -18.930 -8.854 2.336 1.00 0.00 N ATOM 0 H LYS A 402 -20.720 -5.557 -1.893 1.00 0.00 H new ATOM 0 HA LYS A 402 -18.797 -5.303 -0.796 1.00 0.00 H new ATOM 0 HB2 LYS A 402 -17.522 -6.880 -3.056 1.00 0.00 H new ATOM 0 HB3 LYS A 402 -16.714 -6.414 -1.572 1.00 0.00 H new ATOM 0 HG2 LYS A 402 -19.157 -8.219 -1.747 1.00 0.00 H new ATOM 0 HG3 LYS A 402 -17.507 -8.765 -1.526 1.00 0.00 H new ATOM 0 HD2 LYS A 402 -17.369 -7.460 0.601 1.00 0.00 H new ATOM 0 HD3 LYS A 402 -19.029 -6.942 0.383 1.00 0.00 H new ATOM 0 HE2 LYS A 402 -19.787 -9.307 0.453 1.00 0.00 H new ATOM 0 HE3 LYS A 402 -18.129 -9.840 0.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 402 -18.596 -9.716 2.811 1.00 0.00 H new ATOM 0 HZ2 LYS A 402 -18.350 -8.045 2.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 402 -19.924 -8.682 2.590 1.00 0.00 H new ATOM 745 N LYS A 403 -17.555 -3.309 -1.623 1.00 0.00 N ATOM 746 CA LYS A 403 -16.960 -2.069 -2.114 1.00 0.00 C ATOM 747 C LYS A 403 -15.644 -1.732 -1.416 1.00 0.00 C ATOM 748 O LYS A 403 -15.494 -1.926 -0.211 1.00 0.00 O ATOM 749 CB LYS A 403 -17.934 -0.900 -1.947 1.00 0.00 C ATOM 750 CG LYS A 403 -19.231 -1.062 -2.727 1.00 0.00 C ATOM 751 CD LYS A 403 -20.054 0.218 -2.717 1.00 0.00 C ATOM 752 CE LYS A 403 -20.433 0.636 -1.304 1.00 0.00 C ATOM 753 NZ LYS A 403 -21.216 1.903 -1.290 1.00 0.00 N ATOM 0 H LYS A 403 -17.591 -3.393 -0.607 1.00 0.00 H new ATOM 0 HA LYS A 403 -16.747 -2.227 -3.171 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -18.170 -0.784 -0.889 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -17.442 0.019 -2.266 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -19.005 -1.342 -3.756 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -19.816 -1.875 -2.297 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -19.487 1.018 -3.193 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -20.958 0.073 -3.308 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -21.017 -0.156 -0.835 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -19.529 0.761 -0.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -21.454 2.153 -0.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -20.650 2.666 -1.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -22.091 1.776 -1.837 1.00 0.00 H new ATOM 767 N CYS A 404 -14.704 -1.197 -2.194 1.00 0.00 N ATOM 768 CA CYS A 404 -13.397 -0.789 -1.682 1.00 0.00 C ATOM 769 C CYS A 404 -13.121 0.657 -2.087 1.00 0.00 C ATOM 770 O CYS A 404 -12.250 0.929 -2.914 1.00 0.00 O ATOM 771 CB CYS A 404 -12.287 -1.699 -2.218 1.00 0.00 C ATOM 772 SG CYS A 404 -10.612 -1.194 -1.704 1.00 0.00 S ATOM 0 H CYS A 404 -14.826 -1.035 -3.194 1.00 0.00 H new ATOM 0 HA CYS A 404 -13.410 -0.872 -0.595 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -12.470 -2.718 -1.878 1.00 0.00 H new ATOM 0 HB3 CYS A 404 -12.335 -1.712 -3.307 1.00 0.00 H new ATOM 777 N THR A 405 -13.889 1.578 -1.513 1.00 0.00 N ATOM 778 CA THR A 405 -13.749 2.999 -1.826 1.00 0.00 C ATOM 779 C THR A 405 -12.623 3.648 -1.030 1.00 0.00 C ATOM 780 O THR A 405 -12.403 3.316 0.133 1.00 0.00 O ATOM 781 CB THR A 405 -15.057 3.767 -1.556 1.00 0.00 C ATOM 782 OG1 THR A 405 -15.414 3.656 -0.174 1.00 0.00 O ATOM 783 CG2 THR A 405 -16.190 3.232 -2.422 1.00 0.00 C ATOM 0 H THR A 405 -14.615 1.367 -0.828 1.00 0.00 H new ATOM 0 HA THR A 405 -13.509 3.055 -2.888 1.00 0.00 H new ATOM 0 HB THR A 405 -14.894 4.815 -1.806 1.00 0.00 H new ATOM 0 HG1 THR A 405 -16.325 3.993 -0.043 1.00 0.00 H new ATOM 0 HG21 THR A 405 -17.103 3.790 -2.213 1.00 0.00 H new ATOM 0 HG22 THR A 405 -15.928 3.345 -3.474 1.00 0.00 H new ATOM 0 HG23 THR A 405 -16.351 2.177 -2.200 1.00 0.00 H new ATOM 791 N LEU A 406 -11.918 4.581 -1.664 1.00 0.00 N ATOM 792 CA LEU A 406 -10.822 5.282 -1.012 1.00 0.00 C ATOM 793 C LEU A 406 -11.342 6.220 0.069 1.00 0.00 C ATOM 794 O LEU A 406 -12.259 7.007 -0.166 1.00 0.00 O ATOM 795 CB LEU A 406 -10.011 6.085 -2.030 1.00 0.00 C ATOM 796 CG LEU A 406 -8.834 6.862 -1.440 1.00 0.00 C ATOM 797 CD1 LEU A 406 -7.700 5.920 -1.068 1.00 0.00 C ATOM 798 CD2 LEU A 406 -8.351 7.930 -2.404 1.00 0.00 C ATOM 0 H LEU A 406 -12.088 4.867 -2.628 1.00 0.00 H new ATOM 0 HA LEU A 406 -10.179 4.531 -0.552 1.00 0.00 H new ATOM 0 HB2 LEU A 406 -9.633 5.403 -2.792 1.00 0.00 H new ATOM 0 HB3 LEU A 406 -10.677 6.787 -2.532 1.00 0.00 H new ATOM 0 HG LEU A 406 -9.178 7.358 -0.532 1.00 0.00 H new ATOM 0 HD11 LEU A 406 -6.873 6.494 -0.650 1.00 0.00 H new ATOM 0 HD12 LEU A 406 -8.052 5.200 -0.329 1.00 0.00 H new ATOM 0 HD13 LEU A 406 -7.361 5.390 -1.958 1.00 0.00 H new ATOM 0 HD21 LEU A 406 -7.513 8.468 -1.961 1.00 0.00 H new ATOM 0 HD22 LEU A 406 -8.030 7.462 -3.334 1.00 0.00 H new ATOM 0 HD23 LEU A 406 -9.163 8.628 -2.610 1.00 0.00 H new ATOM 810 N ASP A 407 -10.741 6.137 1.248 1.00 0.00 N ATOM 811 CA ASP A 407 -11.131 6.989 2.364 1.00 0.00 C ATOM 812 C ASP A 407 -10.281 8.256 2.376 1.00 0.00 C ATOM 813 O ASP A 407 -9.056 8.189 2.299 1.00 0.00 O ATOM 814 CB ASP A 407 -10.984 6.234 3.688 1.00 0.00 C ATOM 815 CG ASP A 407 -11.457 7.050 4.876 1.00 0.00 C ATOM 816 OD1 ASP A 407 -12.630 7.476 4.874 1.00 0.00 O ATOM 817 OD2 ASP A 407 -10.656 7.256 5.812 1.00 0.00 O ATOM 0 H ASP A 407 -9.982 5.489 1.457 1.00 0.00 H new ATOM 0 HA ASP A 407 -12.177 7.270 2.243 1.00 0.00 H new ATOM 0 HB2 ASP A 407 -11.553 5.306 3.639 1.00 0.00 H new ATOM 0 HB3 ASP A 407 -9.939 5.960 3.832 1.00 0.00 H new ATOM 822 N LYS A 408 -10.936 9.408 2.462 1.00 0.00 N ATOM 823 CA LYS A 408 -10.232 10.686 2.472 1.00 0.00 C ATOM 824 C LYS A 408 -9.333 10.811 3.698 1.00 0.00 C ATOM 825 O LYS A 408 -8.191 11.259 3.600 1.00 0.00 O ATOM 826 CB LYS A 408 -11.231 11.842 2.446 1.00 0.00 C ATOM 827 CG LYS A 408 -12.171 11.808 1.251 1.00 0.00 C ATOM 828 CD LYS A 408 -13.169 12.956 1.288 1.00 0.00 C ATOM 829 CE LYS A 408 -14.093 12.855 2.493 1.00 0.00 C ATOM 830 NZ LYS A 408 -15.065 13.982 2.542 1.00 0.00 N ATOM 0 H LYS A 408 -11.951 9.484 2.526 1.00 0.00 H new ATOM 0 HA LYS A 408 -9.607 10.729 1.580 1.00 0.00 H new ATOM 0 HB2 LYS A 408 -11.821 11.822 3.362 1.00 0.00 H new ATOM 0 HB3 LYS A 408 -10.683 12.784 2.440 1.00 0.00 H new ATOM 0 HG2 LYS A 408 -11.591 11.860 0.330 1.00 0.00 H new ATOM 0 HG3 LYS A 408 -12.708 10.859 1.237 1.00 0.00 H new ATOM 0 HD2 LYS A 408 -12.633 13.904 1.318 1.00 0.00 H new ATOM 0 HD3 LYS A 408 -13.761 12.954 0.373 1.00 0.00 H new ATOM 0 HE2 LYS A 408 -14.634 11.910 2.457 1.00 0.00 H new ATOM 0 HE3 LYS A 408 -13.499 12.848 3.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 -15.676 13.877 3.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 -14.549 14.883 2.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 -15.649 13.974 1.682 1.00 0.00 H new ATOM 844 N GLU A 409 -9.862 10.425 4.851 1.00 0.00 N ATOM 845 CA GLU A 409 -9.120 10.503 6.104 1.00 0.00 C ATOM 846 C GLU A 409 -7.897 9.589 6.094 1.00 0.00 C ATOM 847 O GLU A 409 -6.810 9.987 6.512 1.00 0.00 O ATOM 848 CB GLU A 409 -10.029 10.136 7.277 1.00 0.00 C ATOM 849 CG GLU A 409 -11.259 11.021 7.395 1.00 0.00 C ATOM 850 CD GLU A 409 -12.154 10.630 8.555 1.00 0.00 C ATOM 851 OE1 GLU A 409 -11.815 9.661 9.268 1.00 0.00 O ATOM 852 OE2 GLU A 409 -13.196 11.291 8.750 1.00 0.00 O ATOM 0 H GLU A 409 -10.807 10.053 4.946 1.00 0.00 H new ATOM 0 HA GLU A 409 -8.772 11.530 6.217 1.00 0.00 H new ATOM 0 HB2 GLU A 409 -10.347 9.099 7.168 1.00 0.00 H new ATOM 0 HB3 GLU A 409 -9.457 10.199 8.203 1.00 0.00 H new ATOM 0 HG2 GLU A 409 -10.945 12.058 7.517 1.00 0.00 H new ATOM 0 HG3 GLU A 409 -11.830 10.968 6.468 1.00 0.00 H new ATOM 859 N GLU A 410 -8.081 8.361 5.631 1.00 0.00 N ATOM 860 CA GLU A 410 -6.991 7.391 5.589 1.00 0.00 C ATOM 861 C GLU A 410 -5.932 7.779 4.560 1.00 0.00 C ATOM 862 O GLU A 410 -4.738 7.790 4.861 1.00 0.00 O ATOM 863 CB GLU A 410 -7.534 5.995 5.275 1.00 0.00 C ATOM 864 CG GLU A 410 -6.471 4.907 5.292 1.00 0.00 C ATOM 865 CD GLU A 410 -5.822 4.735 6.654 1.00 0.00 C ATOM 866 OE1 GLU A 410 -5.181 5.693 7.135 1.00 0.00 O ATOM 867 OE2 GLU A 410 -5.958 3.641 7.241 1.00 0.00 O ATOM 0 H GLU A 410 -8.972 8.011 5.279 1.00 0.00 H new ATOM 0 HA GLU A 410 -6.520 7.383 6.572 1.00 0.00 H new ATOM 0 HB2 GLU A 410 -8.309 5.745 6.000 1.00 0.00 H new ATOM 0 HB3 GLU A 410 -8.009 6.012 4.294 1.00 0.00 H new ATOM 0 HG2 GLU A 410 -6.921 3.962 4.988 1.00 0.00 H new ATOM 0 HG3 GLU A 410 -5.703 5.146 4.557 1.00 0.00 H new ATOM 874 N ALA A 411 -6.373 8.083 3.345 1.00 0.00 N ATOM 875 CA ALA A 411 -5.461 8.457 2.269 1.00 0.00 C ATOM 876 C ALA A 411 -4.651 9.701 2.618 1.00 0.00 C ATOM 877 O ALA A 411 -3.458 9.775 2.320 1.00 0.00 O ATOM 878 CB ALA A 411 -6.233 8.679 0.980 1.00 0.00 C ATOM 0 H ALA A 411 -7.358 8.078 3.079 1.00 0.00 H new ATOM 0 HA ALA A 411 -4.759 7.634 2.132 1.00 0.00 H new ATOM 0 HB1 ALA A 411 -5.541 8.958 0.185 1.00 0.00 H new ATOM 0 HB2 ALA A 411 -6.752 7.761 0.704 1.00 0.00 H new ATOM 0 HB3 ALA A 411 -6.960 9.478 1.124 1.00 0.00 H new ATOM 884 N LYS A 412 -5.301 10.684 3.231 1.00 0.00 N ATOM 885 CA LYS A 412 -4.629 11.926 3.594 1.00 0.00 C ATOM 886 C LYS A 412 -3.535 11.678 4.632 1.00 0.00 C ATOM 887 O LYS A 412 -2.451 12.254 4.551 1.00 0.00 O ATOM 888 CB LYS A 412 -5.642 12.955 4.114 1.00 0.00 C ATOM 889 CG LYS A 412 -6.075 12.738 5.556 1.00 0.00 C ATOM 890 CD LYS A 412 -7.151 13.729 5.966 1.00 0.00 C ATOM 891 CE LYS A 412 -7.343 13.759 7.474 1.00 0.00 C ATOM 892 NZ LYS A 412 -7.731 12.428 8.015 1.00 0.00 N ATOM 0 H LYS A 412 -6.288 10.646 3.486 1.00 0.00 H new ATOM 0 HA LYS A 412 -4.157 12.327 2.697 1.00 0.00 H new ATOM 0 HB2 LYS A 412 -5.209 13.951 4.024 1.00 0.00 H new ATOM 0 HB3 LYS A 412 -6.525 12.932 3.475 1.00 0.00 H new ATOM 0 HG2 LYS A 412 -6.449 11.721 5.676 1.00 0.00 H new ATOM 0 HG3 LYS A 412 -5.213 12.840 6.216 1.00 0.00 H new ATOM 0 HD2 LYS A 412 -6.882 14.725 5.614 1.00 0.00 H new ATOM 0 HD3 LYS A 412 -8.092 13.464 5.485 1.00 0.00 H new ATOM 0 HE2 LYS A 412 -6.419 14.088 7.950 1.00 0.00 H new ATOM 0 HE3 LYS A 412 -8.110 14.491 7.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 412 -7.479 12.376 9.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 412 -8.757 12.295 7.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 412 -7.228 11.681 7.494 1.00 0.00 H new ATOM 906 N LYS A 413 -3.825 10.817 5.606 1.00 0.00 N ATOM 907 CA LYS A 413 -2.861 10.497 6.654 1.00 0.00 C ATOM 908 C LYS A 413 -1.618 9.827 6.076 1.00 0.00 C ATOM 909 O LYS A 413 -0.493 10.163 6.444 1.00 0.00 O ATOM 910 CB LYS A 413 -3.500 9.592 7.707 1.00 0.00 C ATOM 911 CG LYS A 413 -4.621 10.263 8.481 1.00 0.00 C ATOM 912 CD LYS A 413 -5.277 9.303 9.460 1.00 0.00 C ATOM 913 CE LYS A 413 -6.414 9.972 10.214 1.00 0.00 C ATOM 914 NZ LYS A 413 -5.947 11.153 10.990 1.00 0.00 N ATOM 0 H LYS A 413 -4.717 10.330 5.690 1.00 0.00 H new ATOM 0 HA LYS A 413 -2.557 11.432 7.124 1.00 0.00 H new ATOM 0 HB2 LYS A 413 -3.890 8.699 7.219 1.00 0.00 H new ATOM 0 HB3 LYS A 413 -2.732 9.263 8.407 1.00 0.00 H new ATOM 0 HG2 LYS A 413 -4.226 11.123 9.023 1.00 0.00 H new ATOM 0 HG3 LYS A 413 -5.369 10.641 7.785 1.00 0.00 H new ATOM 0 HD2 LYS A 413 -5.657 8.435 8.922 1.00 0.00 H new ATOM 0 HD3 LYS A 413 -4.533 8.939 10.169 1.00 0.00 H new ATOM 0 HE2 LYS A 413 -7.184 10.283 9.508 1.00 0.00 H new ATOM 0 HE3 LYS A 413 -6.874 9.252 10.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 413 -6.696 11.457 11.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 413 -5.097 10.898 11.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 413 -5.721 11.930 10.337 1.00 0.00 H new ATOM 928 N VAL A 414 -1.828 8.873 5.174 1.00 0.00 N ATOM 929 CA VAL A 414 -0.721 8.157 4.551 1.00 0.00 C ATOM 930 C VAL A 414 0.114 9.089 3.677 1.00 0.00 C ATOM 931 O VAL A 414 1.339 9.124 3.785 1.00 0.00 O ATOM 932 CB VAL A 414 -1.228 6.980 3.698 1.00 0.00 C ATOM 933 CG1 VAL A 414 -0.063 6.230 3.067 1.00 0.00 C ATOM 934 CG2 VAL A 414 -2.079 6.041 4.540 1.00 0.00 C ATOM 0 H VAL A 414 -2.752 8.579 4.859 1.00 0.00 H new ATOM 0 HA VAL A 414 -0.098 7.769 5.356 1.00 0.00 H new ATOM 0 HB VAL A 414 -1.848 7.380 2.895 1.00 0.00 H new ATOM 0 HG11 VAL A 414 -0.444 5.402 2.469 1.00 0.00 H new ATOM 0 HG12 VAL A 414 0.504 6.908 2.429 1.00 0.00 H new ATOM 0 HG13 VAL A 414 0.587 5.842 3.851 1.00 0.00 H new ATOM 0 HG21 VAL A 414 -2.429 5.215 3.922 1.00 0.00 H new ATOM 0 HG22 VAL A 414 -1.483 5.650 5.364 1.00 0.00 H new ATOM 0 HG23 VAL A 414 -2.936 6.585 4.938 1.00 0.00 H new ATOM 944 N ALA A 415 -0.561 9.842 2.817 1.00 0.00 N ATOM 945 CA ALA A 415 0.108 10.779 1.923 1.00 0.00 C ATOM 946 C ALA A 415 0.770 11.912 2.702 1.00 0.00 C ATOM 947 O ALA A 415 1.680 12.572 2.200 1.00 0.00 O ATOM 948 CB ALA A 415 -0.880 11.343 0.914 1.00 0.00 C ATOM 0 H ALA A 415 -1.576 9.822 2.720 1.00 0.00 H new ATOM 0 HA ALA A 415 0.888 10.235 1.391 1.00 0.00 H new ATOM 0 HB1 ALA A 415 -0.366 12.041 0.253 1.00 0.00 H new ATOM 0 HB2 ALA A 415 -1.303 10.529 0.325 1.00 0.00 H new ATOM 0 HB3 ALA A 415 -1.680 11.863 1.440 1.00 0.00 H new ATOM 954 N ASP A 416 0.293 12.140 3.924 1.00 0.00 N ATOM 955 CA ASP A 416 0.823 13.204 4.773 1.00 0.00 C ATOM 956 C ASP A 416 2.339 13.155 4.840 1.00 0.00 C ATOM 957 O ASP A 416 3.011 14.186 4.854 1.00 0.00 O ATOM 958 CB ASP A 416 0.228 13.108 6.181 1.00 0.00 C ATOM 959 CG ASP A 416 0.630 14.272 7.071 1.00 0.00 C ATOM 960 OD1 ASP A 416 1.322 15.189 6.582 1.00 0.00 O ATOM 961 OD2 ASP A 416 0.244 14.268 8.260 1.00 0.00 O ATOM 0 H ASP A 416 -0.461 11.601 4.349 1.00 0.00 H new ATOM 0 HA ASP A 416 0.537 14.158 4.330 1.00 0.00 H new ATOM 0 HB2 ASP A 416 -0.859 13.070 6.109 1.00 0.00 H new ATOM 0 HB3 ASP A 416 0.550 12.175 6.644 1.00 0.00 H new ATOM 966 N GLU A 417 2.860 11.949 4.871 1.00 0.00 N ATOM 967 CA GLU A 417 4.303 11.727 4.930 1.00 0.00 C ATOM 968 C GLU A 417 4.670 10.396 4.288 1.00 0.00 C ATOM 969 O GLU A 417 5.598 9.719 4.732 1.00 0.00 O ATOM 970 CB GLU A 417 4.793 11.745 6.383 1.00 0.00 C ATOM 971 CG GLU A 417 4.600 13.078 7.089 1.00 0.00 C ATOM 972 CD GLU A 417 5.091 13.051 8.523 1.00 0.00 C ATOM 973 OE1 GLU A 417 6.293 12.788 8.736 1.00 0.00 O ATOM 974 OE2 GLU A 417 4.271 13.292 9.434 1.00 0.00 O ATOM 0 H GLU A 417 2.306 11.093 4.856 1.00 0.00 H new ATOM 0 HA GLU A 417 4.788 12.533 4.379 1.00 0.00 H new ATOM 0 HB2 GLU A 417 4.267 10.971 6.942 1.00 0.00 H new ATOM 0 HB3 GLU A 417 5.852 11.487 6.401 1.00 0.00 H new ATOM 0 HG2 GLU A 417 5.131 13.856 6.541 1.00 0.00 H new ATOM 0 HG3 GLU A 417 3.543 13.343 7.075 1.00 0.00 H new ATOM 981 N THR A 418 3.929 10.025 3.246 1.00 0.00 N ATOM 982 CA THR A 418 4.161 8.773 2.539 1.00 0.00 C ATOM 983 C THR A 418 4.291 7.616 3.519 1.00 0.00 C ATOM 984 O THR A 418 5.030 6.661 3.275 1.00 0.00 O ATOM 985 CB THR A 418 5.425 8.841 1.657 1.00 0.00 C ATOM 986 OG1 THR A 418 6.576 9.132 2.456 1.00 0.00 O ATOM 987 CG2 THR A 418 5.271 9.901 0.576 1.00 0.00 C ATOM 0 H THR A 418 3.159 10.580 2.873 1.00 0.00 H new ATOM 0 HA THR A 418 3.298 8.607 1.894 1.00 0.00 H new ATOM 0 HB THR A 418 5.557 7.870 1.181 1.00 0.00 H new ATOM 0 HG1 THR A 418 6.355 9.013 3.403 1.00 0.00 H new ATOM 0 HG21 THR A 418 6.174 9.932 -0.034 1.00 0.00 H new ATOM 0 HG22 THR A 418 4.415 9.657 -0.054 1.00 0.00 H new ATOM 0 HG23 THR A 418 5.114 10.874 1.041 1.00 0.00 H new ATOM 995 N ALA A 419 3.560 7.711 4.628 1.00 0.00 N ATOM 996 CA ALA A 419 3.584 6.675 5.647 1.00 0.00 C ATOM 997 C ALA A 419 5.000 6.461 6.177 1.00 0.00 C ATOM 998 O ALA A 419 5.521 5.346 6.158 1.00 0.00 O ATOM 999 CB ALA A 419 3.013 5.389 5.080 1.00 0.00 C ATOM 0 H ALA A 419 2.945 8.497 4.840 1.00 0.00 H new ATOM 0 HA ALA A 419 2.967 6.993 6.487 1.00 0.00 H new ATOM 0 HB1 ALA A 419 3.032 4.614 5.846 1.00 0.00 H new ATOM 0 HB2 ALA A 419 1.985 5.558 4.760 1.00 0.00 H new ATOM 0 HB3 ALA A 419 3.611 5.071 4.226 1.00 0.00 H new ATOM 1005 N LYS A 420 5.618 7.548 6.633 1.00 0.00 N ATOM 1006 CA LYS A 420 6.972 7.512 7.159 1.00 0.00 C ATOM 1007 C LYS A 420 6.999 6.939 8.580 1.00 0.00 C ATOM 1008 O LYS A 420 7.660 7.479 9.467 1.00 0.00 O ATOM 1009 CB LYS A 420 7.556 8.925 7.142 1.00 0.00 C ATOM 1010 CG LYS A 420 9.039 8.977 7.443 1.00 0.00 C ATOM 1011 CD LYS A 420 9.562 10.404 7.411 1.00 0.00 C ATOM 1012 CE LYS A 420 11.054 10.460 7.692 1.00 0.00 C ATOM 1013 NZ LYS A 420 11.569 11.857 7.671 1.00 0.00 N ATOM 0 H LYS A 420 5.192 8.475 6.647 1.00 0.00 H new ATOM 0 HA LYS A 420 7.577 6.859 6.530 1.00 0.00 H new ATOM 0 HB2 LYS A 420 7.378 9.370 6.163 1.00 0.00 H new ATOM 0 HB3 LYS A 420 7.025 9.536 7.872 1.00 0.00 H new ATOM 0 HG2 LYS A 420 9.228 8.541 8.424 1.00 0.00 H new ATOM 0 HG3 LYS A 420 9.581 8.373 6.715 1.00 0.00 H new ATOM 0 HD2 LYS A 420 9.358 10.845 6.435 1.00 0.00 H new ATOM 0 HD3 LYS A 420 9.030 11.004 8.149 1.00 0.00 H new ATOM 0 HE2 LYS A 420 11.258 10.012 8.665 1.00 0.00 H new ATOM 0 HE3 LYS A 420 11.586 9.865 6.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 420 12.590 11.853 7.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 420 11.398 12.276 6.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 420 11.079 12.418 8.397 1.00 0.00 H new ATOM 1027 N ASP A 421 6.273 5.842 8.785 1.00 0.00 N ATOM 1028 CA ASP A 421 6.211 5.189 10.090 1.00 0.00 C ATOM 1029 C ASP A 421 5.725 6.167 11.158 1.00 0.00 C ATOM 1030 O ASP A 421 6.372 6.356 12.188 1.00 0.00 O ATOM 1031 CB ASP A 421 7.584 4.623 10.470 1.00 0.00 C ATOM 1032 CG ASP A 421 7.515 3.640 11.625 1.00 0.00 C ATOM 1033 OD1 ASP A 421 7.068 4.035 12.722 1.00 0.00 O ATOM 1034 OD2 ASP A 421 7.911 2.472 11.431 1.00 0.00 O ATOM 0 H ASP A 421 5.718 5.386 8.061 1.00 0.00 H new ATOM 0 HA ASP A 421 5.500 4.365 10.029 1.00 0.00 H new ATOM 0 HB2 ASP A 421 8.021 4.128 9.603 1.00 0.00 H new ATOM 0 HB3 ASP A 421 8.249 5.444 10.737 1.00 0.00 H new ATOM 1039 N GLY A 422 4.581 6.793 10.901 1.00 0.00 N ATOM 1040 CA GLY A 422 4.029 7.745 11.846 1.00 0.00 C ATOM 1041 C GLY A 422 2.671 8.265 11.419 1.00 0.00 C ATOM 1042 O GLY A 422 2.483 8.656 10.266 1.00 0.00 O ATOM 0 H GLY A 422 4.027 6.658 10.055 1.00 0.00 H new ATOM 0 HA2 GLY A 422 3.942 7.272 12.824 1.00 0.00 H new ATOM 0 HA3 GLY A 422 4.717 8.583 11.957 1.00 0.00 H new ATOM 1046 N LYS A 423 1.723 8.267 12.352 1.00 0.00 N ATOM 1047 CA LYS A 423 0.370 8.738 12.078 1.00 0.00 C ATOM 1048 C LYS A 423 -0.238 7.976 10.903 1.00 0.00 C ATOM 1049 O LYS A 423 -0.935 8.554 10.068 1.00 0.00 O ATOM 1050 CB LYS A 423 0.382 10.240 11.781 1.00 0.00 C ATOM 1051 CG LYS A 423 1.002 11.073 12.893 1.00 0.00 C ATOM 1052 CD LYS A 423 0.987 12.557 12.557 1.00 0.00 C ATOM 1053 CE LYS A 423 -0.430 13.102 12.489 1.00 0.00 C ATOM 1054 NZ LYS A 423 -1.142 12.963 13.789 1.00 0.00 N ATOM 0 H LYS A 423 1.869 7.946 13.309 1.00 0.00 H new ATOM 0 HA LYS A 423 -0.242 8.557 12.962 1.00 0.00 H new ATOM 0 HB2 LYS A 423 0.932 10.415 10.857 1.00 0.00 H new ATOM 0 HB3 LYS A 423 -0.641 10.577 11.612 1.00 0.00 H new ATOM 0 HG2 LYS A 423 0.457 10.904 13.822 1.00 0.00 H new ATOM 0 HG3 LYS A 423 2.029 10.748 13.062 1.00 0.00 H new ATOM 0 HD2 LYS A 423 1.553 13.106 13.309 1.00 0.00 H new ATOM 0 HD3 LYS A 423 1.486 12.719 11.602 1.00 0.00 H new ATOM 0 HE2 LYS A 423 -0.401 14.153 12.202 1.00 0.00 H new ATOM 0 HE3 LYS A 423 -0.985 12.575 11.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 -1.984 13.574 13.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 -1.432 11.973 13.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 -0.508 13.245 14.564 1.00 0.00 H new ATOM 1068 N THR A 424 0.037 6.678 10.846 1.00 0.00 N ATOM 1069 CA THR A 424 -0.475 5.829 9.777 1.00 0.00 C ATOM 1070 C THR A 424 -1.989 5.674 9.872 1.00 0.00 C ATOM 1071 O THR A 424 -2.704 5.850 8.884 1.00 0.00 O ATOM 1072 CB THR A 424 0.179 4.435 9.810 1.00 0.00 C ATOM 1073 OG1 THR A 424 1.602 4.561 9.706 1.00 0.00 O ATOM 1074 CG2 THR A 424 -0.337 3.561 8.675 1.00 0.00 C ATOM 0 H THR A 424 0.614 6.189 11.530 1.00 0.00 H new ATOM 0 HA THR A 424 -0.225 6.318 8.836 1.00 0.00 H new ATOM 0 HB THR A 424 -0.080 3.962 10.757 1.00 0.00 H new ATOM 0 HG1 THR A 424 2.012 3.671 9.729 1.00 0.00 H new ATOM 0 HG21 THR A 424 0.142 2.583 8.723 1.00 0.00 H new ATOM 0 HG22 THR A 424 -1.416 3.442 8.769 1.00 0.00 H new ATOM 0 HG23 THR A 424 -0.106 4.032 7.719 1.00 0.00 H new ATOM 1082 N GLY A 425 -2.471 5.343 11.065 1.00 0.00 N ATOM 1083 CA GLY A 425 -3.898 5.170 11.266 1.00 0.00 C ATOM 1084 C GLY A 425 -4.234 4.677 12.658 1.00 0.00 C ATOM 1085 O GLY A 425 -3.666 5.147 13.644 1.00 0.00 O ATOM 0 H GLY A 425 -1.899 5.191 11.896 1.00 0.00 H new ATOM 0 HA2 GLY A 425 -4.404 6.119 11.089 1.00 0.00 H new ATOM 0 HA3 GLY A 425 -4.282 4.462 10.531 1.00 0.00 H new ATOM 1089 N ASN A 426 -5.159 3.727 12.737 1.00 0.00 N ATOM 1090 CA ASN A 426 -5.576 3.165 14.017 1.00 0.00 C ATOM 1091 C ASN A 426 -4.433 2.404 14.680 1.00 0.00 C ATOM 1092 O ASN A 426 -3.712 1.651 14.025 1.00 0.00 O ATOM 1093 CB ASN A 426 -6.774 2.234 13.822 1.00 0.00 C ATOM 1094 CG ASN A 426 -6.463 1.080 12.889 1.00 0.00 C ATOM 1095 OD1 ASN A 426 -6.111 1.281 11.727 1.00 0.00 O ATOM 1096 ND2 ASN A 426 -6.590 -0.141 13.397 1.00 0.00 N ATOM 0 H ASN A 426 -5.636 3.329 11.928 1.00 0.00 H new ATOM 0 HA ASN A 426 -5.864 3.990 14.668 1.00 0.00 H new ATOM 0 HB2 ASN A 426 -7.087 1.841 14.789 1.00 0.00 H new ATOM 0 HB3 ASN A 426 -7.613 2.804 13.423 1.00 0.00 H new ATOM 0 HD21 ASN A 426 -6.393 -0.957 12.818 1.00 0.00 H new ATOM 0 HD22 ASN A 426 -6.885 -0.262 14.366 1.00 0.00 H new ATOM 1103 N THR A 427 -4.277 2.605 15.986 1.00 0.00 N ATOM 1104 CA THR A 427 -3.226 1.937 16.747 1.00 0.00 C ATOM 1105 C THR A 427 -3.512 2.006 18.245 1.00 0.00 C ATOM 1106 O THR A 427 -3.844 3.067 18.774 1.00 0.00 O ATOM 1107 CB THR A 427 -1.843 2.563 16.476 1.00 0.00 C ATOM 1108 OG1 THR A 427 -1.524 2.478 15.082 1.00 0.00 O ATOM 1109 CG2 THR A 427 -0.764 1.860 17.288 1.00 0.00 C ATOM 0 H THR A 427 -4.867 3.226 16.540 1.00 0.00 H new ATOM 0 HA THR A 427 -3.214 0.897 16.422 1.00 0.00 H new ATOM 0 HB THR A 427 -1.882 3.611 16.774 1.00 0.00 H new ATOM 0 HG1 THR A 427 -2.143 1.858 14.642 1.00 0.00 H new ATOM 0 HG21 THR A 427 0.203 2.318 17.081 1.00 0.00 H new ATOM 0 HG22 THR A 427 -0.990 1.953 18.350 1.00 0.00 H new ATOM 0 HG23 THR A 427 -0.732 0.805 17.015 1.00 0.00 H new ATOM 1117 N ASN A 428 -3.374 0.865 18.918 1.00 0.00 N ATOM 1118 CA ASN A 428 -3.612 0.777 20.351 1.00 0.00 C ATOM 1119 C ASN A 428 -2.919 -0.446 20.946 1.00 0.00 C ATOM 1120 O ASN A 428 -2.434 -0.407 22.078 1.00 0.00 O ATOM 1121 CB ASN A 428 -5.113 0.711 20.651 1.00 0.00 C ATOM 1122 CG ASN A 428 -5.834 2.008 20.336 1.00 0.00 C ATOM 1123 OD1 ASN A 428 -5.532 3.054 20.909 1.00 0.00 O ATOM 1124 ND2 ASN A 428 -6.796 1.944 19.423 1.00 0.00 N ATOM 0 H ASN A 428 -3.096 -0.016 18.486 1.00 0.00 H new ATOM 0 HA ASN A 428 -3.197 1.675 20.808 1.00 0.00 H new ATOM 0 HB2 ASN A 428 -5.559 -0.097 20.072 1.00 0.00 H new ATOM 0 HB3 ASN A 428 -5.258 0.467 21.703 1.00 0.00 H new ATOM 0 HD21 ASN A 428 -7.318 2.784 19.172 1.00 0.00 H new ATOM 0 HD22 ASN A 428 -7.013 1.055 18.973 1.00 0.00 H new ATOM 1131 N THR A 429 -2.881 -1.533 20.180 1.00 0.00 N ATOM 1132 CA THR A 429 -2.255 -2.769 20.636 1.00 0.00 C ATOM 1133 C THR A 429 -1.810 -3.630 19.459 1.00 0.00 C ATOM 1134 O THR A 429 -2.473 -3.668 18.422 1.00 0.00 O ATOM 1135 CB THR A 429 -3.211 -3.590 21.522 1.00 0.00 C ATOM 1136 OG1 THR A 429 -2.575 -4.804 21.938 1.00 0.00 O ATOM 1137 CG2 THR A 429 -4.497 -3.916 20.775 1.00 0.00 C ATOM 0 H THR A 429 -3.276 -1.582 19.241 1.00 0.00 H new ATOM 0 HA THR A 429 -1.383 -2.481 21.222 1.00 0.00 H new ATOM 0 HB THR A 429 -3.460 -2.992 22.399 1.00 0.00 H new ATOM 0 HG1 THR A 429 -3.189 -5.319 22.502 1.00 0.00 H new ATOM 0 HG21 THR A 429 -5.156 -4.496 21.421 1.00 0.00 H new ATOM 0 HG22 THR A 429 -4.995 -2.990 20.486 1.00 0.00 H new ATOM 0 HG23 THR A 429 -4.262 -4.495 19.882 1.00 0.00 H new ATOM 1145 N THR A 430 -0.679 -4.319 19.637 1.00 0.00 N ATOM 1146 CA THR A 430 -0.118 -5.192 18.604 1.00 0.00 C ATOM 1147 C THR A 430 0.542 -4.389 17.483 1.00 0.00 C ATOM 1148 O THR A 430 1.581 -4.790 16.957 1.00 0.00 O ATOM 1149 CB THR A 430 -1.184 -6.129 18.001 1.00 0.00 C ATOM 1150 OG1 THR A 430 -1.784 -6.915 19.037 1.00 0.00 O ATOM 1151 CG2 THR A 430 -0.572 -7.050 16.955 1.00 0.00 C ATOM 0 H THR A 430 -0.130 -4.287 20.496 1.00 0.00 H new ATOM 0 HA THR A 430 0.641 -5.799 19.098 1.00 0.00 H new ATOM 0 HB THR A 430 -1.944 -5.513 17.520 1.00 0.00 H new ATOM 0 HG1 THR A 430 -2.461 -7.507 18.648 1.00 0.00 H new ATOM 0 HG21 THR A 430 -1.345 -7.700 16.546 1.00 0.00 H new ATOM 0 HG22 THR A 430 -0.138 -6.452 16.153 1.00 0.00 H new ATOM 0 HG23 THR A 430 0.206 -7.658 17.416 1.00 0.00 H new ATOM 1159 N GLY A 431 -0.058 -3.258 17.124 1.00 0.00 N ATOM 1160 CA GLY A 431 0.498 -2.427 16.073 1.00 0.00 C ATOM 1161 C GLY A 431 1.793 -1.761 16.492 1.00 0.00 C ATOM 1162 O GLY A 431 2.642 -2.385 17.130 1.00 0.00 O ATOM 0 H GLY A 431 -0.918 -2.903 17.542 1.00 0.00 H new ATOM 0 HA2 GLY A 431 0.675 -3.036 15.187 1.00 0.00 H new ATOM 0 HA3 GLY A 431 -0.228 -1.663 15.795 1.00 0.00 H new ATOM 1166 N SER A 432 1.945 -0.489 16.139 1.00 0.00 N ATOM 1167 CA SER A 432 3.147 0.256 16.493 1.00 0.00 C ATOM 1168 C SER A 432 3.194 0.518 17.994 1.00 0.00 C ATOM 1169 O SER A 432 2.412 1.310 18.522 1.00 0.00 O ATOM 1170 CB SER A 432 3.199 1.579 15.727 1.00 0.00 C ATOM 1171 OG SER A 432 2.065 2.379 16.015 1.00 0.00 O ATOM 0 H SER A 432 1.255 0.045 15.611 1.00 0.00 H new ATOM 0 HA SER A 432 4.014 -0.344 16.218 1.00 0.00 H new ATOM 0 HB2 SER A 432 4.107 2.121 15.992 1.00 0.00 H new ATOM 0 HB3 SER A 432 3.246 1.381 14.656 1.00 0.00 H new ATOM 0 HG SER A 432 2.122 3.220 15.515 1.00 0.00 H new ATOM 1177 N SER A 433 4.116 -0.153 18.678 1.00 0.00 N ATOM 1178 CA SER A 433 4.269 0.005 20.119 1.00 0.00 C ATOM 1179 C SER A 433 4.662 1.435 20.475 1.00 0.00 C ATOM 1180 O SER A 433 4.505 1.813 21.655 1.00 0.00 O ATOM 1181 CB SER A 433 5.320 -0.972 20.649 1.00 0.00 C ATOM 1182 OG SER A 433 6.574 -0.763 20.020 1.00 0.00 O ATOM 1183 OXT SER A 433 5.123 2.163 19.572 1.00 0.00 O ATOM 0 H SER A 433 4.769 -0.813 18.256 1.00 0.00 H new ATOM 0 HA SER A 433 3.309 -0.213 20.586 1.00 0.00 H new ATOM 0 HB2 SER A 433 5.425 -0.849 21.727 1.00 0.00 H new ATOM 0 HB3 SER A 433 4.989 -1.996 20.476 1.00 0.00 H new ATOM 0 HG SER A 433 7.229 -1.398 20.377 1.00 0.00 H new TER 1189 SER A 433