USER MOD reduce.3.24.130724 H: found=0, std=0, add=578, rem=0, adj=28 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 394 LYS NZ :NH3+ -139:sc= -2.52! (180deg=-5.13!) USER MOD Set 1.2: A 405 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 397 ASN : amide:sc= -0.469 K(o=-0.47,f=-1.5) USER MOD Set 2.2: A 402 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 372 GLN : amide:sc= -0.583 K(o=0.64,f=0.07) USER MOD Set 3.2: A 391 SER OG : rot 93:sc= 1.22 USER MOD Single : A 355 SER OG : rot 180:sc= 0 USER MOD Single : A 356 HIS : no HD1:sc= -1.36 K(o=-1.4,f=-3.1!) 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 : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 364 LYS NZ :NH3+ -167:sc= -0.031 (180deg=-0.2) USER MOD Single : A 365 HIS : no HD1:sc= -0.385 K(o=-0.39,f=-3.7!) USER MOD Single : A 366 LYS NZ :NH3+ 135:sc= -0.0489 (180deg=-0.332) USER MOD Single : A 370 SER OG : rot 19:sc= 0.722 USER MOD Single : A 371 GLN :FLIP amide:sc= 0 F(o=-1.1!,f=0) USER MOD Single : A 373 GLN : amide:sc= -0.381 X(o=-0.38,f=-0.38) USER MOD Single : A 377 THR OG1 : rot 180:sc= 0 USER MOD Single : A 380 SER OG : rot 180:sc= 0 USER MOD Single : A 382 ASN :FLIP amide:sc= -4.12! C(o=-9.1!,f=-4.1!) USER MOD Single : A 383 LYS NZ :NH3+ -169:sc= -0.0214 (180deg=-0.185) USER MOD Single : A 384 LYS NZ :NH3+ -124:sc= -0.0963 (180deg=-2.44!) USER MOD Single : A 386 GLN : amide:sc= -2.17! C(o=-2.2!,f=-2.2!) USER MOD Single : A 387 ASN : amide:sc=-0.00581 X(o=-0.0058,f=-0.0032) USER MOD Single : A 390 LYS NZ :NH3+ -133:sc= 0.1 (180deg=-0.251) USER MOD Single : A 396 HIS : no HE2:sc= -3.01! C(o=-3!,f=-4.9!) USER MOD Single : A 401 ASN : amide:sc= -0.879 X(o=-0.88,f=-0.96) USER MOD Single : A 403 LYS NZ :NH3+ 165:sc= -0.0608 (180deg=-0.324) USER MOD Single : A 408 LYS NZ :NH3+ -166:sc= -0.03 (180deg=-0.255) USER MOD Single : A 412 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 413 LYS NZ :NH3+ -161:sc= -0.0371 (180deg=-0.294) USER MOD Single : A 418 THR OG1 : rot 15:sc= 0.643 USER MOD Single : A 420 LYS NZ :NH3+ 166:sc= -0.0171 (180deg=-0.287) USER MOD Single : A 423 LYS NZ :NH3+ -170:sc= -0.0296 (180deg=-0.187) USER MOD Single : A 424 THR OG1 : rot 180:sc= 0 USER MOD Single : A 426 ASN : amide:sc= -0.446 K(o=-0.45,f=-1.8!) USER MOD Single : A 427 THR OG1 : rot 64:sc= 0.177 USER MOD Single : A 428 ASN : amide:sc= 0.166 X(o=0.17,f=-0.13) USER MOD Single : A 429 THR OG1 : rot 180:sc= 0 USER MOD Single : A 430 THR OG1 : rot 11:sc= 0.539 USER MOD Single : A 432 SER OG : rot 180:sc= 0 USER MOD Single : A 433 SER OG : rot 16:sc= 0.711 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 354 -0.884 5.283 -24.787 1.00 0.00 N ATOM 2 CA GLY A 354 -2.119 4.454 -24.736 1.00 0.00 C ATOM 3 C GLY A 354 -2.646 4.285 -23.324 1.00 0.00 C ATOM 4 O GLY A 354 -2.680 5.241 -22.550 1.00 0.00 O ATOM 0 HA2 GLY A 354 -2.888 4.915 -25.355 1.00 0.00 H new ATOM 0 HA3 GLY A 354 -1.912 3.473 -25.163 1.00 0.00 H new ATOM 10 N SER A 355 -3.057 3.064 -22.991 1.00 0.00 N ATOM 11 CA SER A 355 -3.586 2.765 -21.665 1.00 0.00 C ATOM 12 C SER A 355 -3.862 1.273 -21.515 1.00 0.00 C ATOM 13 O SER A 355 -3.544 0.673 -20.488 1.00 0.00 O ATOM 14 CB SER A 355 -4.870 3.556 -21.408 1.00 0.00 C ATOM 15 OG SER A 355 -5.370 3.309 -20.104 1.00 0.00 O ATOM 0 H SER A 355 -3.033 2.264 -23.624 1.00 0.00 H new ATOM 0 HA SER A 355 -2.835 3.058 -20.931 1.00 0.00 H new ATOM 0 HB2 SER A 355 -4.675 4.621 -21.530 1.00 0.00 H new ATOM 0 HB3 SER A 355 -5.623 3.283 -22.147 1.00 0.00 H new ATOM 0 HG SER A 355 -6.190 3.827 -19.964 1.00 0.00 H new ATOM 21 N HIS A 356 -4.455 0.681 -22.548 1.00 0.00 N ATOM 22 CA HIS A 356 -4.774 -0.741 -22.534 1.00 0.00 C ATOM 23 C HIS A 356 -3.511 -1.578 -22.353 1.00 0.00 C ATOM 24 O HIS A 356 -2.446 -1.224 -22.862 1.00 0.00 O ATOM 25 CB HIS A 356 -5.492 -1.142 -23.827 1.00 0.00 C ATOM 26 CG HIS A 356 -4.671 -0.945 -25.065 1.00 0.00 C ATOM 27 ND1 HIS A 356 -3.496 -1.627 -25.308 1.00 0.00 N ATOM 28 CD2 HIS A 356 -4.865 -0.141 -26.139 1.00 0.00 C ATOM 29 CE1 HIS A 356 -3.003 -1.249 -26.475 1.00 0.00 C ATOM 30 NE2 HIS A 356 -3.816 -0.351 -26.998 1.00 0.00 N ATOM 0 H HIS A 356 -4.724 1.165 -23.405 1.00 0.00 H new ATOM 0 HA HIS A 356 -5.438 -0.931 -21.690 1.00 0.00 H new ATOM 0 HB2 HIS A 356 -5.783 -2.190 -23.759 1.00 0.00 H new ATOM 0 HB3 HIS A 356 -6.410 -0.561 -23.916 1.00 0.00 H new ATOM 0 HD2 HIS A 356 -5.691 0.538 -26.290 1.00 0.00 H new ATOM 0 HE1 HIS A 356 -2.091 -1.613 -26.924 1.00 0.00 H new ATOM 0 HE2 HIS A 356 -3.686 0.113 -27.897 1.00 0.00 H new ATOM 39 N MET A 357 -3.640 -2.683 -21.617 1.00 0.00 N ATOM 40 CA MET A 357 -2.513 -3.576 -21.356 1.00 0.00 C ATOM 41 C MET A 357 -1.472 -2.900 -20.469 1.00 0.00 C ATOM 42 O MET A 357 -1.126 -1.736 -20.673 1.00 0.00 O ATOM 43 CB MET A 357 -1.871 -4.033 -22.670 1.00 0.00 C ATOM 44 CG MET A 357 -0.666 -4.942 -22.481 1.00 0.00 C ATOM 45 SD MET A 357 0.065 -5.460 -24.046 1.00 0.00 S ATOM 46 CE MET A 357 1.429 -6.467 -23.467 1.00 0.00 C ATOM 0 H MET A 357 -4.517 -2.981 -21.190 1.00 0.00 H new ATOM 0 HA MET A 357 -2.895 -4.451 -20.830 1.00 0.00 H new ATOM 0 HB2 MET A 357 -2.619 -4.556 -23.266 1.00 0.00 H new ATOM 0 HB3 MET A 357 -1.566 -3.155 -23.239 1.00 0.00 H new ATOM 0 HG2 MET A 357 0.086 -4.423 -21.887 1.00 0.00 H new ATOM 0 HG3 MET A 357 -0.966 -5.824 -21.915 1.00 0.00 H new ATOM 0 HE1 MET A 357 1.979 -6.861 -24.322 1.00 0.00 H new ATOM 0 HE2 MET A 357 2.096 -5.859 -22.855 1.00 0.00 H new ATOM 0 HE3 MET A 357 1.043 -7.295 -22.872 1.00 0.00 H new ATOM 56 N LEU A 358 -0.979 -3.638 -19.477 1.00 0.00 N ATOM 57 CA LEU A 358 0.021 -3.114 -18.551 1.00 0.00 C ATOM 58 C LEU A 358 0.589 -4.232 -17.685 1.00 0.00 C ATOM 59 O LEU A 358 1.799 -4.319 -17.476 1.00 0.00 O ATOM 60 CB LEU A 358 -0.584 -2.013 -17.665 1.00 0.00 C ATOM 61 CG LEU A 358 -1.670 -2.466 -16.679 1.00 0.00 C ATOM 62 CD1 LEU A 358 -2.090 -1.308 -15.787 1.00 0.00 C ATOM 63 CD2 LEU A 358 -2.879 -3.026 -17.416 1.00 0.00 C ATOM 0 H LEU A 358 -1.257 -4.602 -19.294 1.00 0.00 H new ATOM 0 HA LEU A 358 0.832 -2.682 -19.137 1.00 0.00 H new ATOM 0 HB2 LEU A 358 0.222 -1.546 -17.099 1.00 0.00 H new ATOM 0 HB3 LEU A 358 -1.006 -1.244 -18.312 1.00 0.00 H new ATOM 0 HG LEU A 358 -1.253 -3.258 -16.058 1.00 0.00 H new ATOM 0 HD11 LEU A 358 -2.861 -1.644 -15.093 1.00 0.00 H new ATOM 0 HD12 LEU A 358 -1.227 -0.950 -15.225 1.00 0.00 H new ATOM 0 HD13 LEU A 358 -2.484 -0.499 -16.402 1.00 0.00 H new ATOM 0 HD21 LEU A 358 -3.633 -3.339 -16.693 1.00 0.00 H new ATOM 0 HD22 LEU A 358 -3.297 -2.257 -18.066 1.00 0.00 H new ATOM 0 HD23 LEU A 358 -2.574 -3.883 -18.017 1.00 0.00 H new ATOM 75 N GLU A 359 -0.300 -5.086 -17.197 1.00 0.00 N ATOM 76 CA GLU A 359 0.087 -6.216 -16.358 1.00 0.00 C ATOM 77 C GLU A 359 0.929 -5.761 -15.166 1.00 0.00 C ATOM 78 O GLU A 359 1.945 -6.377 -14.842 1.00 0.00 O ATOM 79 CB GLU A 359 0.861 -7.245 -17.186 1.00 0.00 C ATOM 80 CG GLU A 359 0.087 -7.772 -18.387 1.00 0.00 C ATOM 81 CD GLU A 359 -1.170 -8.528 -17.997 1.00 0.00 C ATOM 82 OE1 GLU A 359 -2.070 -7.915 -17.386 1.00 0.00 O ATOM 83 OE2 GLU A 359 -1.254 -9.736 -18.304 1.00 0.00 O ATOM 0 H GLU A 359 -1.303 -5.018 -17.369 1.00 0.00 H new ATOM 0 HA GLU A 359 -0.823 -6.675 -15.972 1.00 0.00 H new ATOM 0 HB2 GLU A 359 1.790 -6.794 -17.534 1.00 0.00 H new ATOM 0 HB3 GLU A 359 1.134 -8.083 -16.545 1.00 0.00 H new ATOM 0 HG2 GLU A 359 -0.184 -6.937 -19.033 1.00 0.00 H new ATOM 0 HG3 GLU A 359 0.733 -8.429 -18.969 1.00 0.00 H new ATOM 90 N VAL A 360 0.501 -4.682 -14.517 1.00 0.00 N ATOM 91 CA VAL A 360 1.217 -4.153 -13.361 1.00 0.00 C ATOM 92 C VAL A 360 1.237 -5.158 -12.213 1.00 0.00 C ATOM 93 O VAL A 360 0.232 -5.809 -11.926 1.00 0.00 O ATOM 94 CB VAL A 360 0.597 -2.830 -12.869 1.00 0.00 C ATOM 95 CG1 VAL A 360 0.760 -1.742 -13.920 1.00 0.00 C ATOM 96 CG2 VAL A 360 -0.870 -3.022 -12.516 1.00 0.00 C ATOM 0 H VAL A 360 -0.336 -4.158 -14.771 1.00 0.00 H new ATOM 0 HA VAL A 360 2.240 -3.963 -13.686 1.00 0.00 H new ATOM 0 HB VAL A 360 1.124 -2.518 -11.968 1.00 0.00 H new ATOM 0 HG11 VAL A 360 0.317 -0.815 -13.556 1.00 0.00 H new ATOM 0 HG12 VAL A 360 1.820 -1.584 -14.119 1.00 0.00 H new ATOM 0 HG13 VAL A 360 0.260 -2.047 -14.840 1.00 0.00 H new ATOM 0 HG21 VAL A 360 -1.288 -2.076 -12.171 1.00 0.00 H new ATOM 0 HG22 VAL A 360 -1.415 -3.360 -13.397 1.00 0.00 H new ATOM 0 HG23 VAL A 360 -0.960 -3.768 -11.726 1.00 0.00 H new ATOM 106 N LEU A 361 2.390 -5.279 -11.563 1.00 0.00 N ATOM 107 CA LEU A 361 2.551 -6.204 -10.446 1.00 0.00 C ATOM 108 C LEU A 361 1.596 -5.865 -9.304 1.00 0.00 C ATOM 109 O LEU A 361 1.279 -4.698 -9.071 1.00 0.00 O ATOM 110 CB LEU A 361 4.007 -6.208 -9.961 1.00 0.00 C ATOM 111 CG LEU A 361 4.629 -4.831 -9.698 1.00 0.00 C ATOM 112 CD1 LEU A 361 4.064 -4.209 -8.432 1.00 0.00 C ATOM 113 CD2 LEU A 361 6.144 -4.945 -9.606 1.00 0.00 C ATOM 0 H LEU A 361 3.229 -4.746 -11.791 1.00 0.00 H new ATOM 0 HA LEU A 361 2.301 -7.205 -10.796 1.00 0.00 H new ATOM 0 HB2 LEU A 361 4.062 -6.792 -9.042 1.00 0.00 H new ATOM 0 HB3 LEU A 361 4.616 -6.724 -10.703 1.00 0.00 H new ATOM 0 HG LEU A 361 4.377 -4.179 -10.534 1.00 0.00 H new ATOM 0 HD11 LEU A 361 4.523 -3.234 -8.270 1.00 0.00 H new ATOM 0 HD12 LEU A 361 2.985 -4.090 -8.535 1.00 0.00 H new ATOM 0 HD13 LEU A 361 4.278 -4.856 -7.582 1.00 0.00 H new ATOM 0 HD21 LEU A 361 6.572 -3.960 -9.419 1.00 0.00 H new ATOM 0 HD22 LEU A 361 6.409 -5.617 -8.790 1.00 0.00 H new ATOM 0 HD23 LEU A 361 6.537 -5.340 -10.543 1.00 0.00 H new ATOM 125 N THR A 362 1.137 -6.897 -8.601 1.00 0.00 N ATOM 126 CA THR A 362 0.215 -6.717 -7.484 1.00 0.00 C ATOM 127 C THR A 362 -0.053 -8.040 -6.771 1.00 0.00 C ATOM 128 O THR A 362 -0.116 -8.089 -5.541 1.00 0.00 O ATOM 129 CB THR A 362 -1.126 -6.114 -7.948 1.00 0.00 C ATOM 130 OG1 THR A 362 -2.022 -6.000 -6.836 1.00 0.00 O ATOM 131 CG2 THR A 362 -1.763 -6.968 -9.034 1.00 0.00 C ATOM 0 H THR A 362 1.389 -7.868 -8.786 1.00 0.00 H new ATOM 0 HA THR A 362 0.693 -6.025 -6.791 1.00 0.00 H new ATOM 0 HB THR A 362 -0.928 -5.124 -8.360 1.00 0.00 H new ATOM 0 HG1 THR A 362 -2.871 -5.615 -7.138 1.00 0.00 H new ATOM 0 HG21 THR A 362 -2.707 -6.519 -9.343 1.00 0.00 H new ATOM 0 HG22 THR A 362 -1.092 -7.027 -9.891 1.00 0.00 H new ATOM 0 HG23 THR A 362 -1.947 -7.971 -8.648 1.00 0.00 H new ATOM 139 N GLN A 363 -0.206 -9.111 -7.548 1.00 0.00 N ATOM 140 CA GLN A 363 -0.468 -10.436 -6.991 1.00 0.00 C ATOM 141 C GLN A 363 0.114 -11.527 -7.884 1.00 0.00 C ATOM 142 O GLN A 363 -0.069 -11.508 -9.101 1.00 0.00 O ATOM 143 CB GLN A 363 -1.975 -10.660 -6.827 1.00 0.00 C ATOM 144 CG GLN A 363 -2.640 -9.704 -5.850 1.00 0.00 C ATOM 145 CD GLN A 363 -4.136 -9.929 -5.747 1.00 0.00 C ATOM 146 OE1 GLN A 363 -4.863 -9.799 -6.731 1.00 0.00 O ATOM 147 NE2 GLN A 363 -4.604 -10.268 -4.551 1.00 0.00 N ATOM 0 H GLN A 363 -0.153 -9.086 -8.566 1.00 0.00 H new ATOM 0 HA GLN A 363 0.012 -10.488 -6.014 1.00 0.00 H new ATOM 0 HB2 GLN A 363 -2.455 -10.560 -7.801 1.00 0.00 H new ATOM 0 HB3 GLN A 363 -2.145 -11.683 -6.491 1.00 0.00 H new ATOM 0 HG2 GLN A 363 -2.189 -9.824 -4.865 1.00 0.00 H new ATOM 0 HG3 GLN A 363 -2.451 -8.678 -6.165 1.00 0.00 H new ATOM 0 HE21 GLN A 363 -3.965 -10.365 -3.762 1.00 0.00 H new ATOM 0 HE22 GLN A 363 -5.602 -10.432 -4.422 1.00 0.00 H new ATOM 156 N LYS A 364 0.810 -12.482 -7.267 1.00 0.00 N ATOM 157 CA LYS A 364 1.420 -13.591 -7.999 1.00 0.00 C ATOM 158 C LYS A 364 1.542 -14.828 -7.114 1.00 0.00 C ATOM 159 O LYS A 364 0.987 -14.876 -6.016 1.00 0.00 O ATOM 160 CB LYS A 364 2.804 -13.197 -8.528 1.00 0.00 C ATOM 161 CG LYS A 364 2.768 -12.189 -9.667 1.00 0.00 C ATOM 162 CD LYS A 364 2.053 -12.745 -10.892 1.00 0.00 C ATOM 163 CE LYS A 364 2.770 -13.961 -11.459 1.00 0.00 C ATOM 164 NZ LYS A 364 4.154 -13.634 -11.901 1.00 0.00 N ATOM 0 H LYS A 364 0.965 -12.509 -6.259 1.00 0.00 H new ATOM 0 HA LYS A 364 0.771 -13.826 -8.843 1.00 0.00 H new ATOM 0 HB2 LYS A 364 3.390 -12.782 -7.708 1.00 0.00 H new ATOM 0 HB3 LYS A 364 3.321 -14.095 -8.867 1.00 0.00 H new ATOM 0 HG2 LYS A 364 2.265 -11.281 -9.333 1.00 0.00 H new ATOM 0 HG3 LYS A 364 3.786 -11.909 -9.937 1.00 0.00 H new ATOM 0 HD2 LYS A 364 1.032 -13.017 -10.625 1.00 0.00 H new ATOM 0 HD3 LYS A 364 1.988 -11.972 -11.657 1.00 0.00 H new ATOM 0 HE2 LYS A 364 2.806 -14.746 -10.704 1.00 0.00 H new ATOM 0 HE3 LYS A 364 2.203 -14.356 -12.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 364 4.529 -14.416 -12.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 364 4.140 -12.763 -12.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 364 4.761 -13.494 -11.068 1.00 0.00 H new ATOM 178 N HIS A 365 2.266 -15.830 -7.607 1.00 0.00 N ATOM 179 CA HIS A 365 2.460 -17.076 -6.870 1.00 0.00 C ATOM 180 C HIS A 365 3.512 -16.916 -5.772 1.00 0.00 C ATOM 181 O HIS A 365 4.260 -17.850 -5.482 1.00 0.00 O ATOM 182 CB HIS A 365 2.888 -18.191 -7.828 1.00 0.00 C ATOM 183 CG HIS A 365 2.017 -18.314 -9.040 1.00 0.00 C ATOM 184 ND1 HIS A 365 1.854 -17.294 -9.955 1.00 0.00 N ATOM 185 CD2 HIS A 365 1.264 -19.345 -9.493 1.00 0.00 C ATOM 186 CE1 HIS A 365 1.040 -17.692 -10.915 1.00 0.00 C ATOM 187 NE2 HIS A 365 0.667 -18.932 -10.659 1.00 0.00 N ATOM 0 H HIS A 365 2.729 -15.803 -8.516 1.00 0.00 H new ATOM 0 HA HIS A 365 1.511 -17.337 -6.401 1.00 0.00 H new ATOM 0 HB2 HIS A 365 3.914 -18.009 -8.147 1.00 0.00 H new ATOM 0 HB3 HIS A 365 2.884 -19.140 -7.291 1.00 0.00 H new ATOM 0 HD2 HIS A 365 1.154 -20.312 -9.024 1.00 0.00 H new ATOM 0 HE1 HIS A 365 0.731 -17.103 -11.766 1.00 0.00 H new ATOM 0 HE2 HIS A 365 0.038 -19.492 -11.234 1.00 0.00 H new ATOM 196 N LYS A 366 3.566 -15.729 -5.165 1.00 0.00 N ATOM 197 CA LYS A 366 4.532 -15.454 -4.103 1.00 0.00 C ATOM 198 C LYS A 366 4.362 -14.032 -3.570 1.00 0.00 C ATOM 199 O LYS A 366 4.035 -13.116 -4.325 1.00 0.00 O ATOM 200 CB LYS A 366 5.959 -15.642 -4.618 1.00 0.00 C ATOM 201 CG LYS A 366 6.340 -14.663 -5.718 1.00 0.00 C ATOM 202 CD LYS A 366 7.707 -14.982 -6.302 1.00 0.00 C ATOM 203 CE LYS A 366 7.704 -16.316 -7.032 1.00 0.00 C ATOM 204 NZ LYS A 366 6.735 -16.326 -8.161 1.00 0.00 N ATOM 0 H LYS A 366 2.953 -14.945 -5.391 1.00 0.00 H new ATOM 0 HA LYS A 366 4.349 -16.158 -3.291 1.00 0.00 H new ATOM 0 HB2 LYS A 366 6.655 -15.531 -3.786 1.00 0.00 H new ATOM 0 HB3 LYS A 366 6.071 -16.659 -4.993 1.00 0.00 H new ATOM 0 HG2 LYS A 366 5.590 -14.693 -6.508 1.00 0.00 H new ATOM 0 HG3 LYS A 366 6.342 -13.649 -5.319 1.00 0.00 H new ATOM 0 HD2 LYS A 366 8.004 -14.190 -6.990 1.00 0.00 H new ATOM 0 HD3 LYS A 366 8.449 -15.005 -5.503 1.00 0.00 H new ATOM 0 HE2 LYS A 366 8.705 -16.526 -7.410 1.00 0.00 H new ATOM 0 HE3 LYS A 366 7.454 -17.113 -6.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 366 7.183 -16.749 -8.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 366 5.899 -16.885 -7.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 366 6.445 -15.351 -8.378 1.00 0.00 H new ATOM 218 N PRO A 367 4.586 -13.822 -2.258 1.00 0.00 N ATOM 219 CA PRO A 367 4.461 -12.501 -1.642 1.00 0.00 C ATOM 220 C PRO A 367 5.663 -11.610 -1.930 1.00 0.00 C ATOM 221 O PRO A 367 6.071 -10.805 -1.091 1.00 0.00 O ATOM 222 CB PRO A 367 4.379 -12.822 -0.158 1.00 0.00 C ATOM 223 CG PRO A 367 5.168 -14.070 -0.001 1.00 0.00 C ATOM 224 CD PRO A 367 4.988 -14.849 -1.277 1.00 0.00 C ATOM 0 HA PRO A 367 3.603 -11.948 -2.024 1.00 0.00 H new ATOM 0 HB2 PRO A 367 4.791 -12.014 0.446 1.00 0.00 H new ATOM 0 HB3 PRO A 367 3.346 -12.963 0.161 1.00 0.00 H new ATOM 0 HG2 PRO A 367 6.220 -13.845 0.172 1.00 0.00 H new ATOM 0 HG3 PRO A 367 4.820 -14.644 0.857 1.00 0.00 H new ATOM 0 HD2 PRO A 367 5.910 -15.349 -1.575 1.00 0.00 H new ATOM 0 HD3 PRO A 367 4.227 -15.622 -1.171 1.00 0.00 H new ATOM 232 N ALA A 368 6.222 -11.758 -3.125 1.00 0.00 N ATOM 233 CA ALA A 368 7.375 -10.968 -3.538 1.00 0.00 C ATOM 234 C ALA A 368 6.959 -9.553 -3.915 1.00 0.00 C ATOM 235 O ALA A 368 5.979 -9.359 -4.635 1.00 0.00 O ATOM 236 CB ALA A 368 8.080 -11.639 -4.708 1.00 0.00 C ATOM 0 H ALA A 368 5.894 -12.421 -3.827 1.00 0.00 H new ATOM 0 HA ALA A 368 8.065 -10.907 -2.697 1.00 0.00 H new ATOM 0 HB1 ALA A 368 8.940 -11.039 -5.007 1.00 0.00 H new ATOM 0 HB2 ALA A 368 8.417 -12.632 -4.409 1.00 0.00 H new ATOM 0 HB3 ALA A 368 7.389 -11.727 -5.547 1.00 0.00 H new ATOM 242 N GLU A 369 7.708 -8.566 -3.430 1.00 0.00 N ATOM 243 CA GLU A 369 7.413 -7.170 -3.725 1.00 0.00 C ATOM 244 C GLU A 369 5.979 -6.819 -3.317 1.00 0.00 C ATOM 245 O GLU A 369 5.633 -6.896 -2.139 1.00 0.00 O ATOM 246 CB GLU A 369 7.643 -6.884 -5.213 1.00 0.00 C ATOM 247 CG GLU A 369 9.076 -7.116 -5.662 1.00 0.00 C ATOM 248 CD GLU A 369 9.281 -6.810 -7.133 1.00 0.00 C ATOM 249 OE1 GLU A 369 9.040 -5.654 -7.538 1.00 0.00 O ATOM 250 OE2 GLU A 369 9.685 -7.727 -7.879 1.00 0.00 O ATOM 0 H GLU A 369 8.522 -8.708 -2.832 1.00 0.00 H new ATOM 0 HA GLU A 369 8.089 -6.542 -3.144 1.00 0.00 H new ATOM 0 HB2 GLU A 369 6.979 -7.516 -5.803 1.00 0.00 H new ATOM 0 HB3 GLU A 369 7.368 -5.850 -5.423 1.00 0.00 H new ATOM 0 HG2 GLU A 369 9.745 -6.493 -5.068 1.00 0.00 H new ATOM 0 HG3 GLU A 369 9.351 -8.153 -5.468 1.00 0.00 H new ATOM 257 N SER A 370 5.155 -6.432 -4.294 1.00 0.00 N ATOM 258 CA SER A 370 3.763 -6.070 -4.040 1.00 0.00 C ATOM 259 C SER A 370 3.653 -5.046 -2.915 1.00 0.00 C ATOM 260 O SER A 370 2.744 -5.112 -2.087 1.00 0.00 O ATOM 261 CB SER A 370 2.933 -7.314 -3.705 1.00 0.00 C ATOM 262 OG SER A 370 3.406 -7.952 -2.533 1.00 0.00 O ATOM 0 H SER A 370 5.432 -6.362 -5.273 1.00 0.00 H new ATOM 0 HA SER A 370 3.368 -5.618 -4.950 1.00 0.00 H new ATOM 0 HB2 SER A 370 1.889 -7.031 -3.571 1.00 0.00 H new ATOM 0 HB3 SER A 370 2.969 -8.013 -4.541 1.00 0.00 H new ATOM 0 HG SER A 370 3.959 -7.326 -2.021 1.00 0.00 H new ATOM 268 N GLN A 371 4.580 -4.094 -2.897 1.00 0.00 N ATOM 269 CA GLN A 371 4.581 -3.049 -1.880 1.00 0.00 C ATOM 270 C GLN A 371 3.369 -2.141 -2.044 1.00 0.00 C ATOM 271 O GLN A 371 3.024 -1.748 -3.160 1.00 0.00 O ATOM 272 CB GLN A 371 5.867 -2.226 -1.964 1.00 0.00 C ATOM 273 CG GLN A 371 7.129 -3.050 -1.761 1.00 0.00 C ATOM 274 CD GLN A 371 8.403 -2.226 -1.840 1.00 0.00 C ATOM 275 OE1 GLN A 371 8.266 -0.923 -2.073 1.00 0.00 O flip ATOM 276 NE2 GLN A 371 9.504 -2.757 -1.693 1.00 0.00 N flip ATOM 0 H GLN A 371 5.339 -4.025 -3.574 1.00 0.00 H new ATOM 0 HA GLN A 371 4.530 -3.525 -0.901 1.00 0.00 H new ATOM 0 HB2 GLN A 371 5.914 -1.738 -2.938 1.00 0.00 H new ATOM 0 HB3 GLN A 371 5.833 -1.437 -1.213 1.00 0.00 H new ATOM 0 HG2 GLN A 371 7.082 -3.541 -0.789 1.00 0.00 H new ATOM 0 HG3 GLN A 371 7.166 -3.837 -2.514 1.00 0.00 H new ATOM 0 HE21 GLN A 371 9.567 -3.760 -1.516 1.00 0.00 H new ATOM 0 HE22 GLN A 371 10.353 -2.194 -1.748 1.00 0.00 H new ATOM 285 N GLN A 372 2.720 -1.814 -0.931 1.00 0.00 N ATOM 286 CA GLN A 372 1.543 -0.954 -0.962 1.00 0.00 C ATOM 287 C GLN A 372 1.872 0.393 -1.598 1.00 0.00 C ATOM 288 O GLN A 372 2.897 1.002 -1.290 1.00 0.00 O ATOM 289 CB GLN A 372 1.000 -0.747 0.452 1.00 0.00 C ATOM 290 CG GLN A 372 -0.267 0.092 0.499 1.00 0.00 C ATOM 291 CD GLN A 372 -0.812 0.244 1.905 1.00 0.00 C ATOM 292 OE1 GLN A 372 -1.143 -0.742 2.563 1.00 0.00 O ATOM 293 NE2 GLN A 372 -0.910 1.483 2.371 1.00 0.00 N ATOM 0 H GLN A 372 2.988 -2.131 0.001 1.00 0.00 H new ATOM 0 HA GLN A 372 0.780 -1.444 -1.567 1.00 0.00 H new ATOM 0 HB2 GLN A 372 0.799 -1.720 0.901 1.00 0.00 H new ATOM 0 HB3 GLN A 372 1.767 -0.267 1.060 1.00 0.00 H new ATOM 0 HG2 GLN A 372 -0.061 1.079 0.084 1.00 0.00 H new ATOM 0 HG3 GLN A 372 -1.026 -0.367 -0.134 1.00 0.00 H new ATOM 0 HE21 GLN A 372 -0.623 2.271 1.790 1.00 0.00 H new ATOM 0 HE22 GLN A 372 -1.272 1.647 3.310 1.00 0.00 H new ATOM 302 N GLN A 373 0.999 0.849 -2.492 1.00 0.00 N ATOM 303 CA GLN A 373 1.197 2.120 -3.177 1.00 0.00 C ATOM 304 C GLN A 373 1.174 3.295 -2.215 1.00 0.00 C ATOM 305 O GLN A 373 1.051 3.128 -1.002 1.00 0.00 O ATOM 306 CB GLN A 373 0.136 2.334 -4.254 1.00 0.00 C ATOM 307 CG GLN A 373 0.319 1.459 -5.474 1.00 0.00 C ATOM 308 CD GLN A 373 1.716 1.547 -6.057 1.00 0.00 C ATOM 309 OE1 GLN A 373 2.169 2.620 -6.456 1.00 0.00 O ATOM 310 NE2 GLN A 373 2.407 0.415 -6.108 1.00 0.00 N ATOM 0 H GLN A 373 0.147 0.356 -2.758 1.00 0.00 H new ATOM 0 HA GLN A 373 2.182 2.071 -3.641 1.00 0.00 H new ATOM 0 HB2 GLN A 373 -0.848 2.142 -3.825 1.00 0.00 H new ATOM 0 HB3 GLN A 373 0.151 3.379 -4.563 1.00 0.00 H new ATOM 0 HG2 GLN A 373 0.106 0.424 -5.208 1.00 0.00 H new ATOM 0 HG3 GLN A 373 -0.406 1.748 -6.235 1.00 0.00 H new ATOM 0 HE21 GLN A 373 1.992 -0.452 -5.766 1.00 0.00 H new ATOM 0 HE22 GLN A 373 3.353 0.412 -6.489 1.00 0.00 H new ATOM 319 N ALA A 374 1.291 4.486 -2.782 1.00 0.00 N ATOM 320 CA ALA A 374 1.282 5.717 -2.000 1.00 0.00 C ATOM 321 C ALA A 374 0.221 6.683 -2.515 1.00 0.00 C ATOM 322 O ALA A 374 0.111 6.908 -3.720 1.00 0.00 O ATOM 323 CB ALA A 374 2.657 6.368 -2.031 1.00 0.00 C ATOM 0 H ALA A 374 1.394 4.628 -3.787 1.00 0.00 H new ATOM 0 HA ALA A 374 1.035 5.466 -0.968 1.00 0.00 H new ATOM 0 HB1 ALA A 374 2.638 7.286 -1.444 1.00 0.00 H new ATOM 0 HB2 ALA A 374 3.393 5.683 -1.610 1.00 0.00 H new ATOM 0 HB3 ALA A 374 2.926 6.602 -3.061 1.00 0.00 H new ATOM 329 N ALA A 375 -0.545 7.260 -1.587 1.00 0.00 N ATOM 330 CA ALA A 375 -1.591 8.215 -1.922 1.00 0.00 C ATOM 331 C ALA A 375 -2.322 7.835 -3.202 1.00 0.00 C ATOM 332 O ALA A 375 -2.231 8.525 -4.218 1.00 0.00 O ATOM 333 CB ALA A 375 -0.991 9.598 -2.013 1.00 0.00 C ATOM 0 H ALA A 375 -0.455 7.076 -0.588 1.00 0.00 H new ATOM 0 HA ALA A 375 -2.341 8.203 -1.131 1.00 0.00 H new ATOM 0 HB1 ALA A 375 -1.771 10.317 -2.264 1.00 0.00 H new ATOM 0 HB2 ALA A 375 -0.546 9.865 -1.055 1.00 0.00 H new ATOM 0 HB3 ALA A 375 -0.223 9.611 -2.786 1.00 0.00 H new ATOM 339 N GLU A 376 -3.039 6.723 -3.137 1.00 0.00 N ATOM 340 CA GLU A 376 -3.793 6.215 -4.274 1.00 0.00 C ATOM 341 C GLU A 376 -4.949 7.145 -4.626 1.00 0.00 C ATOM 342 O GLU A 376 -4.903 8.342 -4.342 1.00 0.00 O ATOM 343 CB GLU A 376 -4.305 4.814 -3.945 1.00 0.00 C ATOM 344 CG GLU A 376 -3.207 3.892 -3.443 1.00 0.00 C ATOM 345 CD GLU A 376 -3.713 2.510 -3.087 1.00 0.00 C ATOM 346 OE1 GLU A 376 -4.929 2.264 -3.231 1.00 0.00 O ATOM 347 OE2 GLU A 376 -2.890 1.671 -2.663 1.00 0.00 O ATOM 0 H GLU A 376 -3.115 6.149 -2.297 1.00 0.00 H new ATOM 0 HA GLU A 376 -3.139 6.168 -5.145 1.00 0.00 H new ATOM 0 HB2 GLU A 376 -5.087 4.886 -3.190 1.00 0.00 H new ATOM 0 HB3 GLU A 376 -4.760 4.380 -4.835 1.00 0.00 H new ATOM 0 HG2 GLU A 376 -2.435 3.805 -4.208 1.00 0.00 H new ATOM 0 HG3 GLU A 376 -2.738 4.338 -2.566 1.00 0.00 H new ATOM 354 N THR A 377 -5.982 6.590 -5.250 1.00 0.00 N ATOM 355 CA THR A 377 -7.145 7.370 -5.648 1.00 0.00 C ATOM 356 C THR A 377 -8.404 6.518 -5.619 1.00 0.00 C ATOM 357 O THR A 377 -8.349 5.309 -5.843 1.00 0.00 O ATOM 358 CB THR A 377 -6.973 7.963 -7.061 1.00 0.00 C ATOM 359 OG1 THR A 377 -6.773 6.912 -8.012 1.00 0.00 O ATOM 360 CG2 THR A 377 -5.795 8.925 -7.108 1.00 0.00 C ATOM 0 H THR A 377 -6.036 5.600 -5.491 1.00 0.00 H new ATOM 0 HA THR A 377 -7.240 8.187 -4.932 1.00 0.00 H new ATOM 0 HB THR A 377 -7.880 8.513 -7.311 1.00 0.00 H new ATOM 0 HG1 THR A 377 -6.666 7.297 -8.907 1.00 0.00 H new ATOM 0 HG21 THR A 377 -5.695 9.329 -8.115 1.00 0.00 H new ATOM 0 HG22 THR A 377 -5.963 9.741 -6.405 1.00 0.00 H new ATOM 0 HG23 THR A 377 -4.882 8.395 -6.838 1.00 0.00 H new ATOM 368 N GLU A 378 -9.534 7.157 -5.333 1.00 0.00 N ATOM 369 CA GLU A 378 -10.810 6.459 -5.268 1.00 0.00 C ATOM 370 C GLU A 378 -10.988 5.559 -6.479 1.00 0.00 C ATOM 371 O GLU A 378 -11.490 4.442 -6.370 1.00 0.00 O ATOM 372 CB GLU A 378 -11.960 7.464 -5.191 1.00 0.00 C ATOM 373 CG GLU A 378 -13.325 6.816 -5.023 1.00 0.00 C ATOM 374 CD GLU A 378 -14.452 7.830 -4.955 1.00 0.00 C ATOM 375 OE1 GLU A 378 -14.165 9.043 -5.025 1.00 0.00 O ATOM 376 OE2 GLU A 378 -15.621 7.410 -4.830 1.00 0.00 O ATOM 0 H GLU A 378 -9.590 8.158 -5.143 1.00 0.00 H new ATOM 0 HA GLU A 378 -10.818 5.841 -4.370 1.00 0.00 H new ATOM 0 HB2 GLU A 378 -11.784 8.142 -4.356 1.00 0.00 H new ATOM 0 HB3 GLU A 378 -11.964 8.069 -6.097 1.00 0.00 H new ATOM 0 HG2 GLU A 378 -13.504 6.135 -5.855 1.00 0.00 H new ATOM 0 HG3 GLU A 378 -13.328 6.215 -4.114 1.00 0.00 H new ATOM 383 N GLY A 379 -10.568 6.059 -7.632 1.00 0.00 N ATOM 384 CA GLY A 379 -10.683 5.297 -8.857 1.00 0.00 C ATOM 385 C GLY A 379 -9.929 3.988 -8.812 1.00 0.00 C ATOM 386 O GLY A 379 -10.433 2.962 -9.269 1.00 0.00 O ATOM 0 H GLY A 379 -10.148 6.982 -7.740 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -11.736 5.097 -9.056 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -10.310 5.896 -9.687 1.00 0.00 H new ATOM 390 N SER A 380 -8.720 4.012 -8.263 1.00 0.00 N ATOM 391 CA SER A 380 -7.914 2.803 -8.172 1.00 0.00 C ATOM 392 C SER A 380 -8.529 1.809 -7.192 1.00 0.00 C ATOM 393 O SER A 380 -8.708 0.636 -7.512 1.00 0.00 O ATOM 394 CB SER A 380 -6.492 3.145 -7.744 1.00 0.00 C ATOM 395 OG SER A 380 -5.687 1.982 -7.665 1.00 0.00 O ATOM 0 H SER A 380 -8.280 4.848 -7.878 1.00 0.00 H new ATOM 0 HA SER A 380 -7.887 2.341 -9.159 1.00 0.00 H new ATOM 0 HB2 SER A 380 -6.054 3.846 -8.455 1.00 0.00 H new ATOM 0 HB3 SER A 380 -6.511 3.644 -6.775 1.00 0.00 H new ATOM 0 HG SER A 380 -4.780 2.230 -7.390 1.00 0.00 H new ATOM 401 N CYS A 381 -8.843 2.294 -5.998 1.00 0.00 N ATOM 402 CA CYS A 381 -9.425 1.464 -4.947 1.00 0.00 C ATOM 403 C CYS A 381 -10.687 0.731 -5.403 1.00 0.00 C ATOM 404 O CYS A 381 -10.837 -0.466 -5.157 1.00 0.00 O ATOM 405 CB CYS A 381 -9.743 2.331 -3.732 1.00 0.00 C ATOM 406 SG CYS A 381 -8.275 3.056 -2.939 1.00 0.00 S ATOM 0 H CYS A 381 -8.703 3.268 -5.730 1.00 0.00 H new ATOM 0 HA CYS A 381 -8.689 0.702 -4.690 1.00 0.00 H new ATOM 0 HB2 CYS A 381 -10.413 3.135 -4.037 1.00 0.00 H new ATOM 0 HB3 CYS A 381 -10.280 1.729 -2.999 1.00 0.00 H new ATOM 411 N ASN A 382 -11.598 1.454 -6.046 1.00 0.00 N ATOM 412 CA ASN A 382 -12.856 0.870 -6.512 1.00 0.00 C ATOM 413 C ASN A 382 -12.619 -0.372 -7.365 1.00 0.00 C ATOM 414 O ASN A 382 -13.473 -1.256 -7.438 1.00 0.00 O ATOM 415 CB ASN A 382 -13.660 1.895 -7.317 1.00 0.00 C ATOM 416 CG ASN A 382 -13.991 3.146 -6.525 1.00 0.00 C ATOM 417 OD1 ASN A 382 -13.589 3.179 -5.260 1.00 0.00 O flip ATOM 418 ND2 ASN A 382 -14.606 4.076 -7.046 1.00 0.00 N flip ATOM 0 H ASN A 382 -11.491 2.446 -6.258 1.00 0.00 H new ATOM 0 HA ASN A 382 -13.422 0.577 -5.628 1.00 0.00 H new ATOM 0 HB2 ASN A 382 -13.095 2.174 -8.206 1.00 0.00 H new ATOM 0 HB3 ASN A 382 -14.586 1.433 -7.660 1.00 0.00 H new ATOM 0 HD21 ASN A 382 -14.897 4.012 -8.021 1.00 0.00 H new ATOM 0 HD22 ASN A 382 -14.824 4.911 -6.502 1.00 0.00 H new ATOM 425 N LYS A 383 -11.468 -0.426 -8.023 1.00 0.00 N ATOM 426 CA LYS A 383 -11.137 -1.550 -8.885 1.00 0.00 C ATOM 427 C LYS A 383 -10.500 -2.688 -8.096 1.00 0.00 C ATOM 428 O LYS A 383 -10.673 -3.860 -8.431 1.00 0.00 O ATOM 429 CB LYS A 383 -10.202 -1.089 -10.004 1.00 0.00 C ATOM 430 CG LYS A 383 -10.667 0.187 -10.698 1.00 0.00 C ATOM 431 CD LYS A 383 -12.088 0.063 -11.231 1.00 0.00 C ATOM 432 CE LYS A 383 -12.206 -1.032 -12.281 1.00 0.00 C ATOM 433 NZ LYS A 383 -11.337 -0.768 -13.461 1.00 0.00 N ATOM 0 H LYS A 383 -10.749 0.296 -7.975 1.00 0.00 H new ATOM 0 HA LYS A 383 -12.062 -1.928 -9.322 1.00 0.00 H new ATOM 0 HB2 LYS A 383 -9.206 -0.926 -9.591 1.00 0.00 H new ATOM 0 HB3 LYS A 383 -10.114 -1.884 -10.744 1.00 0.00 H new ATOM 0 HG2 LYS A 383 -10.614 1.020 -9.997 1.00 0.00 H new ATOM 0 HG3 LYS A 383 -9.991 0.419 -11.521 1.00 0.00 H new ATOM 0 HD2 LYS A 383 -12.768 -0.150 -10.406 1.00 0.00 H new ATOM 0 HD3 LYS A 383 -12.398 1.015 -11.662 1.00 0.00 H new ATOM 0 HE2 LYS A 383 -11.935 -1.990 -11.838 1.00 0.00 H new ATOM 0 HE3 LYS A 383 -13.243 -1.113 -12.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 383 -11.581 -1.428 -14.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 383 -11.482 0.209 -13.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 383 -10.340 -0.900 -13.195 1.00 0.00 H new ATOM 447 N LYS A 384 -9.752 -2.336 -7.057 1.00 0.00 N ATOM 448 CA LYS A 384 -9.075 -3.322 -6.228 1.00 0.00 C ATOM 449 C LYS A 384 -10.061 -4.241 -5.512 1.00 0.00 C ATOM 450 O LYS A 384 -10.986 -3.781 -4.843 1.00 0.00 O ATOM 451 CB LYS A 384 -8.187 -2.603 -5.214 1.00 0.00 C ATOM 452 CG LYS A 384 -6.828 -2.172 -5.759 1.00 0.00 C ATOM 453 CD LYS A 384 -6.914 -1.541 -7.142 1.00 0.00 C ATOM 454 CE LYS A 384 -6.708 -2.567 -8.248 1.00 0.00 C ATOM 455 NZ LYS A 384 -6.795 -1.950 -9.601 1.00 0.00 N ATOM 0 H LYS A 384 -9.599 -1.370 -6.769 1.00 0.00 H new ATOM 0 HA LYS A 384 -8.465 -3.951 -6.876 1.00 0.00 H new ATOM 0 HB2 LYS A 384 -8.714 -1.722 -4.848 1.00 0.00 H new ATOM 0 HB3 LYS A 384 -8.030 -3.259 -4.358 1.00 0.00 H new ATOM 0 HG2 LYS A 384 -6.375 -1.460 -5.069 1.00 0.00 H new ATOM 0 HG3 LYS A 384 -6.168 -3.039 -5.802 1.00 0.00 H new ATOM 0 HD2 LYS A 384 -7.887 -1.066 -7.264 1.00 0.00 H new ATOM 0 HD3 LYS A 384 -6.163 -0.756 -7.230 1.00 0.00 H new ATOM 0 HE2 LYS A 384 -5.734 -3.041 -8.127 1.00 0.00 H new ATOM 0 HE3 LYS A 384 -7.458 -3.353 -8.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 384 -7.522 -2.440 -10.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 384 -7.048 -0.945 -9.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 384 -5.876 -2.033 -10.080 1.00 0.00 H new ATOM 469 N ASP A 385 -9.841 -5.549 -5.648 1.00 0.00 N ATOM 470 CA ASP A 385 -10.694 -6.545 -5.006 1.00 0.00 C ATOM 471 C ASP A 385 -10.499 -6.509 -3.494 1.00 0.00 C ATOM 472 O ASP A 385 -9.718 -5.707 -2.990 1.00 0.00 O ATOM 473 CB ASP A 385 -10.382 -7.944 -5.543 1.00 0.00 C ATOM 474 CG ASP A 385 -10.601 -8.056 -7.039 1.00 0.00 C ATOM 475 OD1 ASP A 385 -11.002 -7.048 -7.660 1.00 0.00 O ATOM 476 OD2 ASP A 385 -10.374 -9.153 -7.592 1.00 0.00 O ATOM 0 H ASP A 385 -9.078 -5.942 -6.198 1.00 0.00 H new ATOM 0 HA ASP A 385 -11.733 -6.309 -5.234 1.00 0.00 H new ATOM 0 HB2 ASP A 385 -9.347 -8.196 -5.311 1.00 0.00 H new ATOM 0 HB3 ASP A 385 -11.010 -8.674 -5.032 1.00 0.00 H new ATOM 481 N GLN A 386 -11.210 -7.377 -2.777 1.00 0.00 N ATOM 482 CA GLN A 386 -11.110 -7.429 -1.319 1.00 0.00 C ATOM 483 C GLN A 386 -9.650 -7.431 -0.873 1.00 0.00 C ATOM 484 O GLN A 386 -9.234 -6.588 -0.078 1.00 0.00 O ATOM 485 CB GLN A 386 -11.828 -8.676 -0.786 1.00 0.00 C ATOM 486 CG GLN A 386 -12.001 -8.699 0.729 1.00 0.00 C ATOM 487 CD GLN A 386 -10.687 -8.792 1.480 1.00 0.00 C ATOM 488 OE1 GLN A 386 -9.933 -9.751 1.317 1.00 0.00 O ATOM 489 NE2 GLN A 386 -10.408 -7.793 2.310 1.00 0.00 N ATOM 0 H GLN A 386 -11.860 -8.052 -3.180 1.00 0.00 H new ATOM 0 HA GLN A 386 -11.590 -6.540 -0.911 1.00 0.00 H new ATOM 0 HB2 GLN A 386 -12.810 -8.743 -1.254 1.00 0.00 H new ATOM 0 HB3 GLN A 386 -11.269 -9.561 -1.090 1.00 0.00 H new ATOM 0 HG2 GLN A 386 -12.527 -7.797 1.042 1.00 0.00 H new ATOM 0 HG3 GLN A 386 -12.629 -9.546 1.003 1.00 0.00 H new ATOM 0 HE21 GLN A 386 -11.063 -7.018 2.413 1.00 0.00 H new ATOM 0 HE22 GLN A 386 -9.539 -7.801 2.844 1.00 0.00 H new ATOM 498 N ASN A 387 -8.876 -8.377 -1.391 1.00 0.00 N ATOM 499 CA ASN A 387 -7.473 -8.491 -1.056 1.00 0.00 C ATOM 500 C ASN A 387 -6.688 -7.286 -1.564 1.00 0.00 C ATOM 501 O ASN A 387 -5.739 -6.833 -0.924 1.00 0.00 O ATOM 502 CB ASN A 387 -6.917 -9.774 -1.663 1.00 0.00 C ATOM 503 CG ASN A 387 -7.634 -11.011 -1.163 1.00 0.00 C ATOM 504 OD1 ASN A 387 -7.649 -11.293 0.035 1.00 0.00 O ATOM 505 ND2 ASN A 387 -8.231 -11.757 -2.084 1.00 0.00 N ATOM 0 H ASN A 387 -9.207 -9.081 -2.051 1.00 0.00 H new ATOM 0 HA ASN A 387 -7.371 -8.522 0.029 1.00 0.00 H new ATOM 0 HB2 ASN A 387 -7.000 -9.724 -2.749 1.00 0.00 H new ATOM 0 HB3 ASN A 387 -5.856 -9.853 -1.428 1.00 0.00 H new ATOM 0 HD21 ASN A 387 -8.729 -12.604 -1.810 1.00 0.00 H new ATOM 0 HD22 ASN A 387 -8.192 -11.483 -3.066 1.00 0.00 H new ATOM 512 N GLU A 388 -7.090 -6.778 -2.725 1.00 0.00 N ATOM 513 CA GLU A 388 -6.428 -5.630 -3.335 1.00 0.00 C ATOM 514 C GLU A 388 -6.811 -4.335 -2.634 1.00 0.00 C ATOM 515 O GLU A 388 -6.146 -3.313 -2.809 1.00 0.00 O ATOM 516 CB GLU A 388 -6.775 -5.551 -4.821 1.00 0.00 C ATOM 517 CG GLU A 388 -6.360 -6.782 -5.609 1.00 0.00 C ATOM 518 CD GLU A 388 -6.732 -6.687 -7.075 1.00 0.00 C ATOM 519 OE1 GLU A 388 -6.255 -5.750 -7.749 1.00 0.00 O ATOM 520 OE2 GLU A 388 -7.501 -7.549 -7.550 1.00 0.00 O ATOM 0 H GLU A 388 -7.874 -7.145 -3.264 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.352 -5.764 -3.227 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -7.850 -5.407 -4.927 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.292 -4.674 -5.252 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -5.283 -6.920 -5.519 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -6.832 -7.663 -5.174 1.00 0.00 H new ATOM 527 N CYS A 389 -7.880 -4.373 -1.841 1.00 0.00 N ATOM 528 CA CYS A 389 -8.322 -3.186 -1.125 1.00 0.00 C ATOM 529 C CYS A 389 -7.197 -2.700 -0.222 1.00 0.00 C ATOM 530 O CYS A 389 -6.975 -3.238 0.863 1.00 0.00 O ATOM 531 CB CYS A 389 -9.585 -3.480 -0.313 1.00 0.00 C ATOM 532 SG CYS A 389 -10.531 -1.991 0.142 1.00 0.00 S ATOM 0 H CYS A 389 -8.448 -5.205 -1.681 1.00 0.00 H new ATOM 0 HA CYS A 389 -8.569 -2.404 -1.843 1.00 0.00 H new ATOM 0 HB2 CYS A 389 -10.228 -4.146 -0.888 1.00 0.00 H new ATOM 0 HB3 CYS A 389 -9.305 -4.013 0.596 1.00 0.00 H new ATOM 537 N LYS A 390 -6.470 -1.703 -0.704 1.00 0.00 N ATOM 538 CA LYS A 390 -5.330 -1.151 0.016 1.00 0.00 C ATOM 539 C LYS A 390 -5.748 -0.363 1.253 1.00 0.00 C ATOM 540 O LYS A 390 -6.909 0.014 1.407 1.00 0.00 O ATOM 541 CB LYS A 390 -4.502 -0.289 -0.925 1.00 0.00 C ATOM 542 CG LYS A 390 -3.843 -1.091 -2.040 1.00 0.00 C ATOM 543 CD LYS A 390 -2.768 -2.017 -1.495 1.00 0.00 C ATOM 544 CE LYS A 390 -2.098 -2.808 -2.607 1.00 0.00 C ATOM 545 NZ LYS A 390 -3.072 -3.653 -3.351 1.00 0.00 N ATOM 0 H LYS A 390 -6.652 -1.255 -1.602 1.00 0.00 H new ATOM 0 HA LYS A 390 -4.724 -1.984 0.373 1.00 0.00 H new ATOM 0 HB2 LYS A 390 -5.141 0.477 -1.364 1.00 0.00 H new ATOM 0 HB3 LYS A 390 -3.732 0.228 -0.353 1.00 0.00 H new ATOM 0 HG2 LYS A 390 -4.598 -1.676 -2.565 1.00 0.00 H new ATOM 0 HG3 LYS A 390 -3.404 -0.410 -2.769 1.00 0.00 H new ATOM 0 HD2 LYS A 390 -2.019 -1.432 -0.961 1.00 0.00 H new ATOM 0 HD3 LYS A 390 -3.210 -2.704 -0.773 1.00 0.00 H new ATOM 0 HE2 LYS A 390 -1.611 -2.121 -3.299 1.00 0.00 H new ATOM 0 HE3 LYS A 390 -1.318 -3.440 -2.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 390 -2.686 -4.612 -3.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 390 -3.967 -3.698 -2.823 1.00 0.00 H new ATOM 0 HZ3 LYS A 390 -3.244 -3.240 -4.290 1.00 0.00 H new ATOM 559 N SER A 391 -4.780 -0.141 2.142 1.00 0.00 N ATOM 560 CA SER A 391 -5.011 0.573 3.388 1.00 0.00 C ATOM 561 C SER A 391 -5.716 1.911 3.165 1.00 0.00 C ATOM 562 O SER A 391 -6.770 2.154 3.753 1.00 0.00 O ATOM 563 CB SER A 391 -3.684 0.781 4.117 1.00 0.00 C ATOM 564 OG SER A 391 -3.081 -0.459 4.445 1.00 0.00 O ATOM 0 H SER A 391 -3.817 -0.452 2.015 1.00 0.00 H new ATOM 0 HA SER A 391 -5.673 -0.036 4.003 1.00 0.00 H new ATOM 0 HB2 SER A 391 -3.008 1.363 3.490 1.00 0.00 H new ATOM 0 HB3 SER A 391 -3.852 1.359 5.026 1.00 0.00 H new ATOM 0 HG SER A 391 -2.461 -0.720 3.732 1.00 0.00 H new ATOM 570 N PRO A 392 -5.166 2.803 2.311 1.00 0.00 N ATOM 571 CA PRO A 392 -5.785 4.098 2.037 1.00 0.00 C ATOM 572 C PRO A 392 -7.246 3.937 1.646 1.00 0.00 C ATOM 573 O PRO A 392 -8.092 4.771 1.975 1.00 0.00 O ATOM 574 CB PRO A 392 -4.971 4.645 0.854 1.00 0.00 C ATOM 575 CG PRO A 392 -4.176 3.496 0.348 1.00 0.00 C ATOM 576 CD PRO A 392 -3.925 2.643 1.543 1.00 0.00 C ATOM 0 HA PRO A 392 -5.778 4.756 2.906 1.00 0.00 H new ATOM 0 HB2 PRO A 392 -5.626 5.040 0.077 1.00 0.00 H new ATOM 0 HB3 PRO A 392 -4.322 5.462 1.170 1.00 0.00 H new ATOM 0 HG2 PRO A 392 -4.721 2.948 -0.421 1.00 0.00 H new ATOM 0 HG3 PRO A 392 -3.241 3.831 -0.101 1.00 0.00 H new ATOM 0 HD2 PRO A 392 -3.748 1.603 1.270 1.00 0.00 H new ATOM 0 HD3 PRO A 392 -3.053 2.978 2.105 1.00 0.00 H new ATOM 584 N CYS A 393 -7.525 2.851 0.937 1.00 0.00 N ATOM 585 CA CYS A 393 -8.871 2.548 0.483 1.00 0.00 C ATOM 586 C CYS A 393 -9.778 2.196 1.652 1.00 0.00 C ATOM 587 O CYS A 393 -9.327 1.657 2.664 1.00 0.00 O ATOM 588 CB CYS A 393 -8.842 1.383 -0.497 1.00 0.00 C ATOM 589 SG CYS A 393 -7.579 1.538 -1.799 1.00 0.00 S ATOM 0 H CYS A 393 -6.827 2.160 0.663 1.00 0.00 H new ATOM 0 HA CYS A 393 -9.265 3.436 -0.010 1.00 0.00 H new ATOM 0 HB2 CYS A 393 -8.666 0.461 0.057 1.00 0.00 H new ATOM 0 HB3 CYS A 393 -9.822 1.292 -0.965 1.00 0.00 H new ATOM 594 N LYS A 394 -11.060 2.488 1.499 1.00 0.00 N ATOM 595 CA LYS A 394 -12.040 2.186 2.532 1.00 0.00 C ATOM 596 C LYS A 394 -12.900 1.001 2.113 1.00 0.00 C ATOM 597 O LYS A 394 -13.608 1.051 1.100 1.00 0.00 O ATOM 598 CB LYS A 394 -12.908 3.412 2.832 1.00 0.00 C ATOM 599 CG LYS A 394 -13.931 3.184 3.934 1.00 0.00 C ATOM 600 CD LYS A 394 -14.596 4.481 4.377 1.00 0.00 C ATOM 601 CE LYS A 394 -15.446 5.094 3.274 1.00 0.00 C ATOM 602 NZ LYS A 394 -14.623 5.640 2.160 1.00 0.00 N ATOM 0 H LYS A 394 -11.447 2.935 0.668 1.00 0.00 H new ATOM 0 HA LYS A 394 -11.509 1.920 3.446 1.00 0.00 H new ATOM 0 HB2 LYS A 394 -12.262 4.243 3.115 1.00 0.00 H new ATOM 0 HB3 LYS A 394 -13.428 3.709 1.921 1.00 0.00 H new ATOM 0 HG2 LYS A 394 -14.693 2.488 3.582 1.00 0.00 H new ATOM 0 HG3 LYS A 394 -13.443 2.717 4.790 1.00 0.00 H new ATOM 0 HD2 LYS A 394 -15.220 4.288 5.250 1.00 0.00 H new ATOM 0 HD3 LYS A 394 -13.831 5.194 4.683 1.00 0.00 H new ATOM 0 HE2 LYS A 394 -16.128 4.339 2.882 1.00 0.00 H new ATOM 0 HE3 LYS A 394 -16.060 5.891 3.693 1.00 0.00 H new ATOM 0 HZ1 LYS A 394 -15.022 6.548 1.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 394 -13.647 5.786 2.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 394 -14.624 4.968 1.366 1.00 0.00 H new ATOM 616 N TRP A 395 -12.811 -0.068 2.897 1.00 0.00 N ATOM 617 CA TRP A 395 -13.550 -1.295 2.628 1.00 0.00 C ATOM 618 C TRP A 395 -14.996 -1.197 3.108 1.00 0.00 C ATOM 619 O TRP A 395 -15.297 -0.485 4.067 1.00 0.00 O ATOM 620 CB TRP A 395 -12.856 -2.480 3.305 1.00 0.00 C ATOM 621 CG TRP A 395 -13.486 -3.803 2.993 1.00 0.00 C ATOM 622 CD1 TRP A 395 -14.016 -4.688 3.886 1.00 0.00 C ATOM 623 CD2 TRP A 395 -13.642 -4.396 1.699 1.00 0.00 C ATOM 624 NE1 TRP A 395 -14.502 -5.790 3.227 1.00 0.00 N ATOM 625 CE2 TRP A 395 -14.281 -5.636 1.883 1.00 0.00 C ATOM 626 CE3 TRP A 395 -13.304 -3.998 0.402 1.00 0.00 C ATOM 627 CZ2 TRP A 395 -14.592 -6.477 0.818 1.00 0.00 C ATOM 628 CZ3 TRP A 395 -13.613 -4.835 -0.653 1.00 0.00 C ATOM 629 CH2 TRP A 395 -14.250 -6.063 -0.440 1.00 0.00 C ATOM 0 H TRP A 395 -12.227 -0.108 3.733 1.00 0.00 H new ATOM 0 HA TRP A 395 -13.565 -1.447 1.549 1.00 0.00 H new ATOM 0 HB2 TRP A 395 -11.811 -2.503 2.996 1.00 0.00 H new ATOM 0 HB3 TRP A 395 -12.866 -2.328 4.384 1.00 0.00 H new ATOM 0 HD1 TRP A 395 -14.048 -4.543 4.956 1.00 0.00 H new ATOM 0 HE1 TRP A 395 -14.954 -6.592 3.666 1.00 0.00 H new ATOM 0 HE3 TRP A 395 -12.810 -3.053 0.228 1.00 0.00 H new ATOM 0 HZ2 TRP A 395 -15.086 -7.424 0.980 1.00 0.00 H new ATOM 0 HZ3 TRP A 395 -13.359 -4.537 -1.659 1.00 0.00 H new ATOM 0 HH2 TRP A 395 -14.476 -6.696 -1.285 1.00 0.00 H new ATOM 640 N HIS A 396 -15.883 -1.931 2.441 1.00 0.00 N ATOM 641 CA HIS A 396 -17.296 -1.948 2.801 1.00 0.00 C ATOM 642 C HIS A 396 -17.876 -3.346 2.631 1.00 0.00 C ATOM 643 O HIS A 396 -17.995 -3.853 1.509 1.00 0.00 O ATOM 644 CB HIS A 396 -18.086 -0.956 1.949 1.00 0.00 C ATOM 645 CG HIS A 396 -17.741 0.475 2.216 1.00 0.00 C ATOM 646 ND1 HIS A 396 -17.910 1.072 3.448 1.00 0.00 N ATOM 647 CD2 HIS A 396 -17.239 1.432 1.401 1.00 0.00 C ATOM 648 CE1 HIS A 396 -17.527 2.334 3.379 1.00 0.00 C ATOM 649 NE2 HIS A 396 -17.115 2.576 2.147 1.00 0.00 N ATOM 0 H HIS A 396 -15.646 -2.524 1.645 1.00 0.00 H new ATOM 0 HA HIS A 396 -17.377 -1.655 3.848 1.00 0.00 H new ATOM 0 HB2 HIS A 396 -17.908 -1.173 0.896 1.00 0.00 H new ATOM 0 HB3 HIS A 396 -19.151 -1.103 2.129 1.00 0.00 H new ATOM 0 HD1 HIS A 396 -18.274 0.611 4.282 1.00 0.00 H new ATOM 0 HD2 HIS A 396 -16.984 1.316 0.358 1.00 0.00 H new ATOM 0 HE1 HIS A 396 -17.547 3.046 4.191 1.00 0.00 H new ATOM 658 N ASN A 397 -18.232 -3.957 3.758 1.00 0.00 N ATOM 659 CA ASN A 397 -18.802 -5.299 3.772 1.00 0.00 C ATOM 660 C ASN A 397 -20.312 -5.256 3.555 1.00 0.00 C ATOM 661 O ASN A 397 -20.951 -4.229 3.784 1.00 0.00 O ATOM 662 CB ASN A 397 -18.486 -5.992 5.100 1.00 0.00 C ATOM 663 CG ASN A 397 -19.011 -7.413 5.153 1.00 0.00 C ATOM 664 OD1 ASN A 397 -18.637 -8.256 4.339 1.00 0.00 O ATOM 665 ND2 ASN A 397 -19.884 -7.685 6.116 1.00 0.00 N ATOM 0 H ASN A 397 -18.134 -3.537 4.682 1.00 0.00 H new ATOM 0 HA ASN A 397 -18.354 -5.865 2.955 1.00 0.00 H new ATOM 0 HB2 ASN A 397 -17.407 -6.001 5.254 1.00 0.00 H new ATOM 0 HB3 ASN A 397 -18.920 -5.417 5.918 1.00 0.00 H new ATOM 0 HD21 ASN A 397 -20.272 -8.624 6.202 1.00 0.00 H new ATOM 0 HD22 ASN A 397 -20.166 -6.955 6.770 1.00 0.00 H new ATOM 672 N ASP A 398 -20.869 -6.380 3.112 1.00 0.00 N ATOM 673 CA ASP A 398 -22.304 -6.485 2.860 1.00 0.00 C ATOM 674 C ASP A 398 -22.721 -5.513 1.759 1.00 0.00 C ATOM 675 O ASP A 398 -23.800 -4.924 1.800 1.00 0.00 O ATOM 676 CB ASP A 398 -23.091 -6.210 4.147 1.00 0.00 C ATOM 677 CG ASP A 398 -24.518 -6.728 4.089 1.00 0.00 C ATOM 678 OD1 ASP A 398 -25.284 -6.277 3.214 1.00 0.00 O ATOM 679 OD2 ASP A 398 -24.867 -7.588 4.924 1.00 0.00 O ATOM 0 H ASP A 398 -20.346 -7.234 2.919 1.00 0.00 H new ATOM 0 HA ASP A 398 -22.528 -7.499 2.528 1.00 0.00 H new ATOM 0 HB2 ASP A 398 -22.575 -6.673 4.988 1.00 0.00 H new ATOM 0 HB3 ASP A 398 -23.107 -5.136 4.335 1.00 0.00 H new ATOM 684 N ALA A 399 -21.850 -5.355 0.769 1.00 0.00 N ATOM 685 CA ALA A 399 -22.115 -4.466 -0.353 1.00 0.00 C ATOM 686 C ALA A 399 -22.700 -5.243 -1.528 1.00 0.00 C ATOM 687 O ALA A 399 -22.403 -6.426 -1.704 1.00 0.00 O ATOM 688 CB ALA A 399 -20.842 -3.742 -0.768 1.00 0.00 C ATOM 0 H ALA A 399 -20.951 -5.834 0.722 1.00 0.00 H new ATOM 0 HA ALA A 399 -22.847 -3.722 -0.039 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -21.057 -3.081 -1.608 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -20.468 -3.154 0.070 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -20.088 -4.472 -1.064 1.00 0.00 H new ATOM 694 N GLU A 400 -23.533 -4.577 -2.323 1.00 0.00 N ATOM 695 CA GLU A 400 -24.164 -5.205 -3.481 1.00 0.00 C ATOM 696 C GLU A 400 -23.144 -5.998 -4.297 1.00 0.00 C ATOM 697 O GLU A 400 -23.459 -7.054 -4.845 1.00 0.00 O ATOM 698 CB GLU A 400 -24.828 -4.147 -4.362 1.00 0.00 C ATOM 699 CG GLU A 400 -25.907 -3.351 -3.646 1.00 0.00 C ATOM 700 CD GLU A 400 -26.546 -2.300 -4.532 1.00 0.00 C ATOM 701 OE1 GLU A 400 -26.162 -2.207 -5.718 1.00 0.00 O ATOM 702 OE2 GLU A 400 -27.431 -1.568 -4.042 1.00 0.00 O ATOM 0 H GLU A 400 -23.788 -3.599 -2.186 1.00 0.00 H new ATOM 0 HA GLU A 400 -24.925 -5.895 -3.118 1.00 0.00 H new ATOM 0 HB2 GLU A 400 -24.065 -3.461 -4.729 1.00 0.00 H new ATOM 0 HB3 GLU A 400 -25.265 -4.634 -5.234 1.00 0.00 H new ATOM 0 HG2 GLU A 400 -26.677 -4.033 -3.286 1.00 0.00 H new ATOM 0 HG3 GLU A 400 -25.475 -2.867 -2.770 1.00 0.00 H new ATOM 709 N ASN A 401 -21.921 -5.480 -4.365 1.00 0.00 N ATOM 710 CA ASN A 401 -20.846 -6.134 -5.106 1.00 0.00 C ATOM 711 C ASN A 401 -19.499 -5.814 -4.471 1.00 0.00 C ATOM 712 O ASN A 401 -18.483 -5.702 -5.158 1.00 0.00 O ATOM 713 CB ASN A 401 -20.852 -5.673 -6.561 1.00 0.00 C ATOM 714 CG ASN A 401 -22.183 -5.919 -7.239 1.00 0.00 C ATOM 715 OD1 ASN A 401 -22.536 -7.056 -7.554 1.00 0.00 O ATOM 716 ND2 ASN A 401 -22.942 -4.851 -7.434 1.00 0.00 N ATOM 0 H ASN A 401 -21.649 -4.606 -3.914 1.00 0.00 H new ATOM 0 HA ASN A 401 -21.008 -7.211 -5.074 1.00 0.00 H new ATOM 0 HB2 ASN A 401 -20.617 -4.609 -6.603 1.00 0.00 H new ATOM 0 HB3 ASN A 401 -20.067 -6.195 -7.108 1.00 0.00 H new ATOM 0 HD21 ASN A 401 -23.862 -4.951 -7.862 1.00 0.00 H new ATOM 0 HD22 ASN A 401 -22.606 -3.929 -7.156 1.00 0.00 H new ATOM 723 N LYS A 402 -19.514 -5.666 -3.149 1.00 0.00 N ATOM 724 CA LYS A 402 -18.309 -5.350 -2.380 1.00 0.00 C ATOM 725 C LYS A 402 -17.795 -3.959 -2.741 1.00 0.00 C ATOM 726 O LYS A 402 -17.648 -3.631 -3.919 1.00 0.00 O ATOM 727 CB LYS A 402 -17.222 -6.402 -2.626 1.00 0.00 C ATOM 728 CG LYS A 402 -17.726 -7.838 -2.544 1.00 0.00 C ATOM 729 CD LYS A 402 -18.427 -8.125 -1.224 1.00 0.00 C ATOM 730 CE LYS A 402 -17.483 -7.972 -0.042 1.00 0.00 C ATOM 731 NZ LYS A 402 -18.169 -8.227 1.254 1.00 0.00 N ATOM 0 H LYS A 402 -20.356 -5.761 -2.581 1.00 0.00 H new ATOM 0 HA LYS A 402 -18.565 -5.360 -1.321 1.00 0.00 H new ATOM 0 HB2 LYS A 402 -16.785 -6.236 -3.611 1.00 0.00 H new ATOM 0 HB3 LYS A 402 -16.424 -6.264 -1.896 1.00 0.00 H new ATOM 0 HG2 LYS A 402 -18.414 -8.028 -3.368 1.00 0.00 H new ATOM 0 HG3 LYS A 402 -16.887 -8.523 -2.665 1.00 0.00 H new ATOM 0 HD2 LYS A 402 -19.272 -7.447 -1.105 1.00 0.00 H new ATOM 0 HD3 LYS A 402 -18.831 -9.137 -1.239 1.00 0.00 H new ATOM 0 HE2 LYS A 402 -16.648 -8.664 -0.153 1.00 0.00 H new ATOM 0 HE3 LYS A 402 -17.065 -6.965 -0.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 402 -17.491 -8.112 2.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 402 -18.950 -7.551 1.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 402 -18.546 -9.196 1.262 1.00 0.00 H new ATOM 745 N LYS A 403 -17.537 -3.133 -1.730 1.00 0.00 N ATOM 746 CA LYS A 403 -17.060 -1.773 -1.974 1.00 0.00 C ATOM 747 C LYS A 403 -15.685 -1.522 -1.360 1.00 0.00 C ATOM 748 O LYS A 403 -15.374 -2.005 -0.273 1.00 0.00 O ATOM 749 CB LYS A 403 -18.064 -0.752 -1.436 1.00 0.00 C ATOM 750 CG LYS A 403 -19.374 -0.711 -2.209 1.00 0.00 C ATOM 751 CD LYS A 403 -19.167 -0.226 -3.635 1.00 0.00 C ATOM 752 CE LYS A 403 -20.482 -0.167 -4.397 1.00 0.00 C ATOM 753 NZ LYS A 403 -21.478 0.704 -3.715 1.00 0.00 N ATOM 0 H LYS A 403 -17.648 -3.376 -0.746 1.00 0.00 H new ATOM 0 HA LYS A 403 -16.964 -1.657 -3.054 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -18.276 -0.981 -0.392 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -17.609 0.238 -1.459 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -19.820 -1.705 -2.223 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -20.078 -0.053 -1.699 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -18.708 0.762 -3.622 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -18.475 -0.892 -4.151 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -20.302 0.207 -5.405 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -20.889 -1.173 -4.499 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -22.254 0.925 -4.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -21.859 0.210 -2.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -21.018 1.587 -3.413 1.00 0.00 H new ATOM 767 N CYS A 404 -14.876 -0.746 -2.076 1.00 0.00 N ATOM 768 CA CYS A 404 -13.529 -0.389 -1.638 1.00 0.00 C ATOM 769 C CYS A 404 -13.166 0.987 -2.184 1.00 0.00 C ATOM 770 O CYS A 404 -12.317 1.112 -3.064 1.00 0.00 O ATOM 771 CB CYS A 404 -12.502 -1.419 -2.120 1.00 0.00 C ATOM 772 SG CYS A 404 -10.786 -1.033 -1.634 1.00 0.00 S ATOM 0 H CYS A 404 -15.136 -0.346 -2.978 1.00 0.00 H new ATOM 0 HA CYS A 404 -13.514 -0.373 -0.548 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -12.770 -2.398 -1.724 1.00 0.00 H new ATOM 0 HB3 CYS A 404 -12.555 -1.490 -3.206 1.00 0.00 H new ATOM 777 N THR A 405 -13.837 2.016 -1.677 1.00 0.00 N ATOM 778 CA THR A 405 -13.600 3.380 -2.139 1.00 0.00 C ATOM 779 C THR A 405 -12.545 4.092 -1.301 1.00 0.00 C ATOM 780 O THR A 405 -12.596 4.077 -0.074 1.00 0.00 O ATOM 781 CB THR A 405 -14.894 4.210 -2.134 1.00 0.00 C ATOM 782 OG1 THR A 405 -15.458 4.235 -0.818 1.00 0.00 O ATOM 783 CG2 THR A 405 -15.906 3.636 -3.116 1.00 0.00 C ATOM 0 H THR A 405 -14.547 1.933 -0.949 1.00 0.00 H new ATOM 0 HA THR A 405 -13.233 3.295 -3.162 1.00 0.00 H new ATOM 0 HB THR A 405 -14.649 5.227 -2.440 1.00 0.00 H new ATOM 0 HG1 THR A 405 -16.281 4.767 -0.825 1.00 0.00 H new ATOM 0 HG21 THR A 405 -16.814 4.238 -3.096 1.00 0.00 H new ATOM 0 HG22 THR A 405 -15.485 3.648 -4.121 1.00 0.00 H new ATOM 0 HG23 THR A 405 -16.145 2.610 -2.834 1.00 0.00 H new ATOM 791 N LEU A 406 -11.597 4.725 -1.985 1.00 0.00 N ATOM 792 CA LEU A 406 -10.523 5.457 -1.327 1.00 0.00 C ATOM 793 C LEU A 406 -11.086 6.529 -0.408 1.00 0.00 C ATOM 794 O LEU A 406 -12.068 7.195 -0.733 1.00 0.00 O ATOM 795 CB LEU A 406 -9.600 6.082 -2.377 1.00 0.00 C ATOM 796 CG LEU A 406 -8.325 6.747 -1.851 1.00 0.00 C ATOM 797 CD1 LEU A 406 -8.618 8.120 -1.269 1.00 0.00 C ATOM 798 CD2 LEU A 406 -7.643 5.858 -0.828 1.00 0.00 C ATOM 0 H LEU A 406 -11.552 4.745 -3.004 1.00 0.00 H new ATOM 0 HA LEU A 406 -9.947 4.760 -0.719 1.00 0.00 H new ATOM 0 HB2 LEU A 406 -9.313 5.305 -3.086 1.00 0.00 H new ATOM 0 HB3 LEU A 406 -10.170 6.827 -2.933 1.00 0.00 H new ATOM 0 HG LEU A 406 -7.646 6.885 -2.692 1.00 0.00 H new ATOM 0 HD11 LEU A 406 -7.693 8.566 -0.904 1.00 0.00 H new ATOM 0 HD12 LEU A 406 -9.048 8.758 -2.041 1.00 0.00 H new ATOM 0 HD13 LEU A 406 -9.324 8.022 -0.444 1.00 0.00 H new ATOM 0 HD21 LEU A 406 -6.739 6.347 -0.466 1.00 0.00 H new ATOM 0 HD22 LEU A 406 -8.319 5.680 0.008 1.00 0.00 H new ATOM 0 HD23 LEU A 406 -7.380 4.907 -1.290 1.00 0.00 H new ATOM 810 N ASP A 407 -10.451 6.686 0.742 1.00 0.00 N ATOM 811 CA ASP A 407 -10.874 7.678 1.724 1.00 0.00 C ATOM 812 C ASP A 407 -9.896 8.846 1.763 1.00 0.00 C ATOM 813 O ASP A 407 -8.684 8.648 1.781 1.00 0.00 O ATOM 814 CB ASP A 407 -10.990 7.040 3.110 1.00 0.00 C ATOM 815 CG ASP A 407 -11.544 7.999 4.144 1.00 0.00 C ATOM 816 OD1 ASP A 407 -12.667 8.509 3.941 1.00 0.00 O ATOM 817 OD2 ASP A 407 -10.860 8.237 5.161 1.00 0.00 O ATOM 0 H ASP A 407 -9.637 6.138 1.022 1.00 0.00 H new ATOM 0 HA ASP A 407 -11.853 8.056 1.429 1.00 0.00 H new ATOM 0 HB2 ASP A 407 -11.634 6.163 3.050 1.00 0.00 H new ATOM 0 HB3 ASP A 407 -10.008 6.693 3.430 1.00 0.00 H new ATOM 822 N LYS A 408 -10.429 10.063 1.769 1.00 0.00 N ATOM 823 CA LYS A 408 -9.596 11.261 1.798 1.00 0.00 C ATOM 824 C LYS A 408 -8.843 11.378 3.120 1.00 0.00 C ATOM 825 O LYS A 408 -7.646 11.665 3.140 1.00 0.00 O ATOM 826 CB LYS A 408 -10.446 12.516 1.567 1.00 0.00 C ATOM 827 CG LYS A 408 -11.006 12.635 0.155 1.00 0.00 C ATOM 828 CD LYS A 408 -12.043 11.563 -0.141 1.00 0.00 C ATOM 829 CE LYS A 408 -12.564 11.672 -1.565 1.00 0.00 C ATOM 830 NZ LYS A 408 -13.194 12.996 -1.824 1.00 0.00 N ATOM 0 H LYS A 408 -11.432 10.246 1.754 1.00 0.00 H new ATOM 0 HA LYS A 408 -8.866 11.175 0.993 1.00 0.00 H new ATOM 0 HB2 LYS A 408 -11.274 12.517 2.276 1.00 0.00 H new ATOM 0 HB3 LYS A 408 -9.841 13.397 1.782 1.00 0.00 H new ATOM 0 HG2 LYS A 408 -11.456 13.619 0.026 1.00 0.00 H new ATOM 0 HG3 LYS A 408 -10.191 12.560 -0.565 1.00 0.00 H new ATOM 0 HD2 LYS A 408 -11.603 10.577 0.013 1.00 0.00 H new ATOM 0 HD3 LYS A 408 -12.873 11.655 0.560 1.00 0.00 H new ATOM 0 HE2 LYS A 408 -11.743 11.517 -2.265 1.00 0.00 H new ATOM 0 HE3 LYS A 408 -13.292 10.881 -1.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 -13.741 12.953 -2.708 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 -13.828 13.239 -1.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 -12.454 13.722 -1.909 1.00 0.00 H new ATOM 844 N GLU A 409 -9.552 11.155 4.223 1.00 0.00 N ATOM 845 CA GLU A 409 -8.951 11.237 5.551 1.00 0.00 C ATOM 846 C GLU A 409 -7.862 10.183 5.724 1.00 0.00 C ATOM 847 O GLU A 409 -6.785 10.464 6.249 1.00 0.00 O ATOM 848 CB GLU A 409 -10.023 11.059 6.628 1.00 0.00 C ATOM 849 CG GLU A 409 -11.135 12.094 6.557 1.00 0.00 C ATOM 850 CD GLU A 409 -10.626 13.512 6.723 1.00 0.00 C ATOM 851 OE1 GLU A 409 -10.044 13.813 7.785 1.00 0.00 O ATOM 852 OE2 GLU A 409 -10.808 14.320 5.788 1.00 0.00 O ATOM 0 H GLU A 409 -10.544 10.916 4.224 1.00 0.00 H new ATOM 0 HA GLU A 409 -8.496 12.222 5.656 1.00 0.00 H new ATOM 0 HB2 GLU A 409 -10.458 10.064 6.535 1.00 0.00 H new ATOM 0 HB3 GLU A 409 -9.552 11.111 7.610 1.00 0.00 H new ATOM 0 HG2 GLU A 409 -11.647 12.006 5.599 1.00 0.00 H new ATOM 0 HG3 GLU A 409 -11.872 11.884 7.332 1.00 0.00 H new ATOM 859 N GLU A 410 -8.151 8.967 5.282 1.00 0.00 N ATOM 860 CA GLU A 410 -7.200 7.868 5.391 1.00 0.00 C ATOM 861 C GLU A 410 -6.004 8.080 4.466 1.00 0.00 C ATOM 862 O GLU A 410 -4.861 7.843 4.853 1.00 0.00 O ATOM 863 CB GLU A 410 -7.886 6.541 5.063 1.00 0.00 C ATOM 864 CG GLU A 410 -6.973 5.329 5.186 1.00 0.00 C ATOM 865 CD GLU A 410 -6.490 5.098 6.607 1.00 0.00 C ATOM 866 OE1 GLU A 410 -5.797 5.982 7.153 1.00 0.00 O ATOM 867 OE2 GLU A 410 -6.807 4.031 7.173 1.00 0.00 O ATOM 0 H GLU A 410 -9.037 8.716 4.844 1.00 0.00 H new ATOM 0 HA GLU A 410 -6.836 7.839 6.418 1.00 0.00 H new ATOM 0 HB2 GLU A 410 -8.739 6.410 5.728 1.00 0.00 H new ATOM 0 HB3 GLU A 410 -8.278 6.587 4.047 1.00 0.00 H new ATOM 0 HG2 GLU A 410 -7.504 4.443 4.839 1.00 0.00 H new ATOM 0 HG3 GLU A 410 -6.112 5.461 4.531 1.00 0.00 H new ATOM 874 N ALA A 411 -6.280 8.515 3.242 1.00 0.00 N ATOM 875 CA ALA A 411 -5.230 8.747 2.255 1.00 0.00 C ATOM 876 C ALA A 411 -4.248 9.818 2.706 1.00 0.00 C ATOM 877 O ALA A 411 -3.039 9.648 2.574 1.00 0.00 O ATOM 878 CB ALA A 411 -5.841 9.126 0.914 1.00 0.00 C ATOM 0 H ALA A 411 -7.223 8.715 2.908 1.00 0.00 H new ATOM 0 HA ALA A 411 -4.673 7.816 2.148 1.00 0.00 H new ATOM 0 HB1 ALA A 411 -5.047 9.296 0.187 1.00 0.00 H new ATOM 0 HB2 ALA A 411 -6.484 8.318 0.566 1.00 0.00 H new ATOM 0 HB3 ALA A 411 -6.430 10.036 1.027 1.00 0.00 H new ATOM 884 N LYS A 412 -4.763 10.923 3.234 1.00 0.00 N ATOM 885 CA LYS A 412 -3.903 12.006 3.691 1.00 0.00 C ATOM 886 C LYS A 412 -2.999 11.531 4.826 1.00 0.00 C ATOM 887 O LYS A 412 -1.810 11.847 4.852 1.00 0.00 O ATOM 888 CB LYS A 412 -4.735 13.213 4.134 1.00 0.00 C ATOM 889 CG LYS A 412 -5.666 12.930 5.301 1.00 0.00 C ATOM 890 CD LYS A 412 -6.457 14.166 5.702 1.00 0.00 C ATOM 891 CE LYS A 412 -5.544 15.283 6.184 1.00 0.00 C ATOM 892 NZ LYS A 412 -6.310 16.498 6.573 1.00 0.00 N ATOM 0 H LYS A 412 -5.762 11.091 3.355 1.00 0.00 H new ATOM 0 HA LYS A 412 -3.274 12.315 2.856 1.00 0.00 H new ATOM 0 HB2 LYS A 412 -4.061 14.024 4.409 1.00 0.00 H new ATOM 0 HB3 LYS A 412 -5.326 13.563 3.288 1.00 0.00 H new ATOM 0 HG2 LYS A 412 -6.354 12.129 5.031 1.00 0.00 H new ATOM 0 HG3 LYS A 412 -5.085 12.578 6.153 1.00 0.00 H new ATOM 0 HD2 LYS A 412 -7.043 14.515 4.852 1.00 0.00 H new ATOM 0 HD3 LYS A 412 -7.163 13.907 6.491 1.00 0.00 H new ATOM 0 HE2 LYS A 412 -4.961 14.933 7.036 1.00 0.00 H new ATOM 0 HE3 LYS A 412 -4.835 15.538 5.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 412 -5.651 17.235 6.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 412 -6.846 16.847 5.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 412 -6.969 16.262 7.342 1.00 0.00 H new ATOM 906 N LYS A 413 -3.566 10.761 5.754 1.00 0.00 N ATOM 907 CA LYS A 413 -2.800 10.237 6.882 1.00 0.00 C ATOM 908 C LYS A 413 -1.688 9.311 6.401 1.00 0.00 C ATOM 909 O LYS A 413 -0.527 9.468 6.782 1.00 0.00 O ATOM 910 CB LYS A 413 -3.718 9.484 7.847 1.00 0.00 C ATOM 911 CG LYS A 413 -4.785 10.356 8.484 1.00 0.00 C ATOM 912 CD LYS A 413 -4.175 11.455 9.340 1.00 0.00 C ATOM 913 CE LYS A 413 -5.247 12.280 10.033 1.00 0.00 C ATOM 914 NZ LYS A 413 -6.177 12.914 9.058 1.00 0.00 N ATOM 0 H LYS A 413 -4.549 10.488 5.747 1.00 0.00 H new ATOM 0 HA LYS A 413 -2.349 11.082 7.403 1.00 0.00 H new ATOM 0 HB2 LYS A 413 -4.202 8.667 7.311 1.00 0.00 H new ATOM 0 HB3 LYS A 413 -3.112 9.034 8.634 1.00 0.00 H new ATOM 0 HG2 LYS A 413 -5.403 10.802 7.705 1.00 0.00 H new ATOM 0 HG3 LYS A 413 -5.441 9.739 9.097 1.00 0.00 H new ATOM 0 HD2 LYS A 413 -3.515 11.013 10.087 1.00 0.00 H new ATOM 0 HD3 LYS A 413 -3.561 12.105 8.717 1.00 0.00 H new ATOM 0 HE2 LYS A 413 -5.813 11.643 10.713 1.00 0.00 H new ATOM 0 HE3 LYS A 413 -4.775 13.053 10.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 413 -6.677 13.702 9.517 1.00 0.00 H new ATOM 0 HZ2 LYS A 413 -5.636 13.273 8.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 413 -6.869 12.210 8.730 1.00 0.00 H new ATOM 928 N VAL A 414 -2.051 8.347 5.562 1.00 0.00 N ATOM 929 CA VAL A 414 -1.086 7.393 5.024 1.00 0.00 C ATOM 930 C VAL A 414 -0.022 8.107 4.196 1.00 0.00 C ATOM 931 O VAL A 414 1.162 7.775 4.265 1.00 0.00 O ATOM 932 CB VAL A 414 -1.776 6.333 4.143 1.00 0.00 C ATOM 933 CG1 VAL A 414 -0.762 5.326 3.620 1.00 0.00 C ATOM 934 CG2 VAL A 414 -2.883 5.630 4.914 1.00 0.00 C ATOM 0 H VAL A 414 -3.008 8.205 5.239 1.00 0.00 H new ATOM 0 HA VAL A 414 -0.617 6.898 5.874 1.00 0.00 H new ATOM 0 HB VAL A 414 -2.225 6.840 3.289 1.00 0.00 H new ATOM 0 HG11 VAL A 414 -1.270 4.587 3.001 1.00 0.00 H new ATOM 0 HG12 VAL A 414 -0.010 5.843 3.025 1.00 0.00 H new ATOM 0 HG13 VAL A 414 -0.279 4.826 4.460 1.00 0.00 H new ATOM 0 HG21 VAL A 414 -3.357 4.886 4.273 1.00 0.00 H new ATOM 0 HG22 VAL A 414 -2.460 5.138 5.790 1.00 0.00 H new ATOM 0 HG23 VAL A 414 -3.626 6.361 5.232 1.00 0.00 H new ATOM 944 N ALA A 415 -0.460 9.083 3.410 1.00 0.00 N ATOM 945 CA ALA A 415 0.434 9.853 2.556 1.00 0.00 C ATOM 946 C ALA A 415 1.462 10.624 3.373 1.00 0.00 C ATOM 947 O ALA A 415 2.582 10.850 2.915 1.00 0.00 O ATOM 948 CB ALA A 415 -0.363 10.807 1.682 1.00 0.00 C ATOM 0 H ALA A 415 -1.439 9.361 3.347 1.00 0.00 H new ATOM 0 HA ALA A 415 0.972 9.150 1.920 1.00 0.00 H new ATOM 0 HB1 ALA A 415 0.318 11.376 1.049 1.00 0.00 H new ATOM 0 HB2 ALA A 415 -1.051 10.238 1.056 1.00 0.00 H new ATOM 0 HB3 ALA A 415 -0.929 11.492 2.313 1.00 0.00 H new ATOM 954 N ASP A 416 1.075 11.038 4.577 1.00 0.00 N ATOM 955 CA ASP A 416 1.976 11.795 5.440 1.00 0.00 C ATOM 956 C ASP A 416 3.289 11.064 5.637 1.00 0.00 C ATOM 957 O ASP A 416 4.311 11.420 5.049 1.00 0.00 O ATOM 958 CB ASP A 416 1.327 12.074 6.799 1.00 0.00 C ATOM 959 CG ASP A 416 0.141 13.015 6.697 1.00 0.00 C ATOM 960 OD1 ASP A 416 0.311 14.126 6.153 1.00 0.00 O ATOM 961 OD2 ASP A 416 -0.952 12.645 7.173 1.00 0.00 O ATOM 0 H ASP A 416 0.152 10.864 4.974 1.00 0.00 H new ATOM 0 HA ASP A 416 2.179 12.745 4.946 1.00 0.00 H new ATOM 0 HB2 ASP A 416 1.002 11.133 7.242 1.00 0.00 H new ATOM 0 HB3 ASP A 416 2.070 12.503 7.471 1.00 0.00 H new ATOM 966 N GLU A 417 3.240 10.043 6.461 1.00 0.00 N ATOM 967 CA GLU A 417 4.416 9.227 6.762 1.00 0.00 C ATOM 968 C GLU A 417 4.019 7.816 7.193 1.00 0.00 C ATOM 969 O GLU A 417 4.736 7.171 7.956 1.00 0.00 O ATOM 970 CB GLU A 417 5.254 9.873 7.872 1.00 0.00 C ATOM 971 CG GLU A 417 5.846 11.223 7.502 1.00 0.00 C ATOM 972 CD GLU A 417 6.678 11.822 8.621 1.00 0.00 C ATOM 973 OE1 GLU A 417 6.789 11.181 9.688 1.00 0.00 O ATOM 974 OE2 GLU A 417 7.217 12.932 8.431 1.00 0.00 O ATOM 0 H GLU A 417 2.392 9.747 6.945 1.00 0.00 H new ATOM 0 HA GLU A 417 5.007 9.163 5.848 1.00 0.00 H new ATOM 0 HB2 GLU A 417 4.631 9.993 8.758 1.00 0.00 H new ATOM 0 HB3 GLU A 417 6.064 9.195 8.141 1.00 0.00 H new ATOM 0 HG2 GLU A 417 6.466 11.112 6.613 1.00 0.00 H new ATOM 0 HG3 GLU A 417 5.040 11.911 7.245 1.00 0.00 H new ATOM 981 N THR A 418 2.880 7.341 6.691 1.00 0.00 N ATOM 982 CA THR A 418 2.391 6.002 7.014 1.00 0.00 C ATOM 983 C THR A 418 2.499 5.711 8.510 1.00 0.00 C ATOM 984 O THR A 418 3.062 4.692 8.914 1.00 0.00 O ATOM 985 CB THR A 418 3.158 4.917 6.233 1.00 0.00 C ATOM 986 OG1 THR A 418 4.548 4.948 6.578 1.00 0.00 O ATOM 987 CG2 THR A 418 3.000 5.118 4.733 1.00 0.00 C ATOM 0 H THR A 418 2.277 7.866 6.057 1.00 0.00 H new ATOM 0 HA THR A 418 1.341 5.977 6.722 1.00 0.00 H new ATOM 0 HB THR A 418 2.741 3.947 6.502 1.00 0.00 H new ATOM 0 HG1 THR A 418 4.672 5.482 7.390 1.00 0.00 H new ATOM 0 HG21 THR A 418 3.550 4.341 4.202 1.00 0.00 H new ATOM 0 HG22 THR A 418 1.944 5.062 4.468 1.00 0.00 H new ATOM 0 HG23 THR A 418 3.393 6.096 4.454 1.00 0.00 H new ATOM 995 N ALA A 419 1.960 6.608 9.329 1.00 0.00 N ATOM 996 CA ALA A 419 2.004 6.441 10.777 1.00 0.00 C ATOM 997 C ALA A 419 0.644 6.715 11.409 1.00 0.00 C ATOM 998 O ALA A 419 0.202 5.979 12.292 1.00 0.00 O ATOM 999 CB ALA A 419 3.062 7.354 11.379 1.00 0.00 C ATOM 0 H ALA A 419 1.489 7.456 9.016 1.00 0.00 H new ATOM 0 HA ALA A 419 2.267 5.405 10.989 1.00 0.00 H new ATOM 0 HB1 ALA A 419 3.085 7.220 12.461 1.00 0.00 H new ATOM 0 HB2 ALA A 419 4.038 7.105 10.961 1.00 0.00 H new ATOM 0 HB3 ALA A 419 2.822 8.392 11.147 1.00 0.00 H new ATOM 1005 N LYS A 420 -0.016 7.776 10.953 1.00 0.00 N ATOM 1006 CA LYS A 420 -1.329 8.145 11.473 1.00 0.00 C ATOM 1007 C LYS A 420 -2.426 7.281 10.855 1.00 0.00 C ATOM 1008 O LYS A 420 -3.465 7.789 10.432 1.00 0.00 O ATOM 1009 CB LYS A 420 -1.614 9.623 11.206 1.00 0.00 C ATOM 1010 CG LYS A 420 -0.616 10.564 11.863 1.00 0.00 C ATOM 1011 CD LYS A 420 -0.997 12.022 11.652 1.00 0.00 C ATOM 1012 CE LYS A 420 -2.327 12.353 12.313 1.00 0.00 C ATOM 1013 NZ LYS A 420 -2.299 12.088 13.778 1.00 0.00 N ATOM 0 H LYS A 420 0.337 8.396 10.224 1.00 0.00 H new ATOM 0 HA LYS A 420 -1.323 7.974 12.550 1.00 0.00 H new ATOM 0 HB2 LYS A 420 -1.610 9.797 10.130 1.00 0.00 H new ATOM 0 HB3 LYS A 420 -2.616 9.862 11.564 1.00 0.00 H new ATOM 0 HG2 LYS A 420 -0.564 10.352 12.931 1.00 0.00 H new ATOM 0 HG3 LYS A 420 0.378 10.384 11.454 1.00 0.00 H new ATOM 0 HD2 LYS A 420 -0.217 12.665 12.059 1.00 0.00 H new ATOM 0 HD3 LYS A 420 -1.058 12.232 10.584 1.00 0.00 H new ATOM 0 HE2 LYS A 420 -2.569 13.401 12.138 1.00 0.00 H new ATOM 0 HE3 LYS A 420 -3.119 11.762 11.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 420 -3.121 12.539 14.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 420 -2.332 11.062 13.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 420 -1.425 12.478 14.185 1.00 0.00 H new ATOM 1027 N ASP A 421 -2.186 5.974 10.804 1.00 0.00 N ATOM 1028 CA ASP A 421 -3.151 5.040 10.236 1.00 0.00 C ATOM 1029 C ASP A 421 -2.771 3.601 10.565 1.00 0.00 C ATOM 1030 O ASP A 421 -3.625 2.788 10.922 1.00 0.00 O ATOM 1031 CB ASP A 421 -3.228 5.216 8.718 1.00 0.00 C ATOM 1032 CG ASP A 421 -1.896 4.954 8.041 1.00 0.00 C ATOM 1033 OD1 ASP A 421 -0.932 5.699 8.319 1.00 0.00 O ATOM 1034 OD2 ASP A 421 -1.815 4.001 7.239 1.00 0.00 O ATOM 0 H ASP A 421 -1.331 5.538 11.149 1.00 0.00 H new ATOM 0 HA ASP A 421 -4.126 5.254 10.674 1.00 0.00 H new ATOM 0 HB2 ASP A 421 -3.979 4.537 8.313 1.00 0.00 H new ATOM 0 HB3 ASP A 421 -3.557 6.229 8.488 1.00 0.00 H new ATOM 1039 N GLY A 422 -1.485 3.294 10.438 1.00 0.00 N ATOM 1040 CA GLY A 422 -1.006 1.954 10.720 1.00 0.00 C ATOM 1041 C GLY A 422 0.506 1.867 10.701 1.00 0.00 C ATOM 1042 O GLY A 422 1.157 2.459 9.840 1.00 0.00 O ATOM 0 H GLY A 422 -0.763 3.952 10.144 1.00 0.00 H new ATOM 0 HA2 GLY A 422 -1.373 1.637 11.696 1.00 0.00 H new ATOM 0 HA3 GLY A 422 -1.417 1.262 9.985 1.00 0.00 H new ATOM 1046 N LYS A 423 1.066 1.130 11.655 1.00 0.00 N ATOM 1047 CA LYS A 423 2.513 0.970 11.750 1.00 0.00 C ATOM 1048 C LYS A 423 2.861 -0.129 12.750 1.00 0.00 C ATOM 1049 O LYS A 423 3.750 -0.945 12.505 1.00 0.00 O ATOM 1050 CB LYS A 423 3.162 2.301 12.160 1.00 0.00 C ATOM 1051 CG LYS A 423 4.684 2.324 12.065 1.00 0.00 C ATOM 1052 CD LYS A 423 5.345 1.557 13.203 1.00 0.00 C ATOM 1053 CE LYS A 423 6.860 1.681 13.155 1.00 0.00 C ATOM 1054 NZ LYS A 423 7.421 1.197 11.864 1.00 0.00 N ATOM 0 H LYS A 423 0.539 0.634 12.374 1.00 0.00 H new ATOM 0 HA LYS A 423 2.902 0.679 10.774 1.00 0.00 H new ATOM 0 HB2 LYS A 423 2.760 3.095 11.530 1.00 0.00 H new ATOM 0 HB3 LYS A 423 2.872 2.530 13.185 1.00 0.00 H new ATOM 0 HG2 LYS A 423 4.993 1.894 11.112 1.00 0.00 H new ATOM 0 HG3 LYS A 423 5.031 3.357 12.076 1.00 0.00 H new ATOM 0 HD2 LYS A 423 4.978 1.934 14.158 1.00 0.00 H new ATOM 0 HD3 LYS A 423 5.063 0.506 13.146 1.00 0.00 H new ATOM 0 HE2 LYS A 423 7.143 2.723 13.305 1.00 0.00 H new ATOM 0 HE3 LYS A 423 7.296 1.111 13.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 8.457 1.140 11.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 7.036 0.255 11.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 7.162 1.858 11.104 1.00 0.00 H new ATOM 1068 N THR A 424 2.150 -0.148 13.874 1.00 0.00 N ATOM 1069 CA THR A 424 2.382 -1.147 14.911 1.00 0.00 C ATOM 1070 C THR A 424 1.260 -1.139 15.944 1.00 0.00 C ATOM 1071 O THR A 424 0.773 -0.080 16.340 1.00 0.00 O ATOM 1072 CB THR A 424 3.728 -0.918 15.625 1.00 0.00 C ATOM 1073 OG1 THR A 424 3.911 -1.901 16.651 1.00 0.00 O ATOM 1074 CG2 THR A 424 3.795 0.475 16.235 1.00 0.00 C ATOM 0 H THR A 424 1.408 0.518 14.089 1.00 0.00 H new ATOM 0 HA THR A 424 2.406 -2.117 14.414 1.00 0.00 H new ATOM 0 HB THR A 424 4.523 -1.009 14.885 1.00 0.00 H new ATOM 0 HG1 THR A 424 4.769 -1.750 17.099 1.00 0.00 H new ATOM 0 HG21 THR A 424 4.756 0.609 16.732 1.00 0.00 H new ATOM 0 HG22 THR A 424 3.686 1.222 15.449 1.00 0.00 H new ATOM 0 HG23 THR A 424 2.991 0.593 16.961 1.00 0.00 H new ATOM 1082 N GLY A 425 0.852 -2.330 16.373 1.00 0.00 N ATOM 1083 CA GLY A 425 -0.212 -2.444 17.355 1.00 0.00 C ATOM 1084 C GLY A 425 -0.384 -3.862 17.860 1.00 0.00 C ATOM 1085 O GLY A 425 -1.503 -4.368 17.944 1.00 0.00 O ATOM 0 H GLY A 425 1.240 -3.219 16.058 1.00 0.00 H new ATOM 0 HA2 GLY A 425 0.002 -1.785 18.197 1.00 0.00 H new ATOM 0 HA3 GLY A 425 -1.148 -2.103 16.913 1.00 0.00 H new ATOM 1089 N ASN A 426 0.732 -4.502 18.198 1.00 0.00 N ATOM 1090 CA ASN A 426 0.710 -5.871 18.700 1.00 0.00 C ATOM 1091 C ASN A 426 -0.146 -5.981 19.958 1.00 0.00 C ATOM 1092 O ASN A 426 -0.186 -5.063 20.777 1.00 0.00 O ATOM 1093 CB ASN A 426 2.134 -6.355 18.985 1.00 0.00 C ATOM 1094 CG ASN A 426 2.862 -5.471 19.980 1.00 0.00 C ATOM 1095 OD1 ASN A 426 2.446 -5.334 21.131 1.00 0.00 O ATOM 1096 ND2 ASN A 426 3.959 -4.865 19.540 1.00 0.00 N ATOM 0 H ASN A 426 1.664 -4.093 18.133 1.00 0.00 H new ATOM 0 HA ASN A 426 0.267 -6.505 17.932 1.00 0.00 H new ATOM 0 HB2 ASN A 426 2.097 -7.374 19.369 1.00 0.00 H new ATOM 0 HB3 ASN A 426 2.697 -6.386 18.052 1.00 0.00 H new ATOM 0 HD21 ASN A 426 4.492 -4.259 20.164 1.00 0.00 H new ATOM 0 HD22 ASN A 426 4.269 -5.006 18.578 1.00 0.00 H new ATOM 1103 N THR A 427 -0.835 -7.108 20.099 1.00 0.00 N ATOM 1104 CA THR A 427 -1.697 -7.342 21.251 1.00 0.00 C ATOM 1105 C THR A 427 -1.555 -8.773 21.756 1.00 0.00 C ATOM 1106 O THR A 427 -2.545 -9.484 21.933 1.00 0.00 O ATOM 1107 CB THR A 427 -3.175 -7.070 20.913 1.00 0.00 C ATOM 1108 OG1 THR A 427 -3.602 -7.933 19.852 1.00 0.00 O ATOM 1109 CG2 THR A 427 -3.381 -5.619 20.506 1.00 0.00 C ATOM 0 H THR A 427 -0.813 -7.876 19.428 1.00 0.00 H new ATOM 0 HA THR A 427 -1.381 -6.650 22.031 1.00 0.00 H new ATOM 0 HB THR A 427 -3.770 -7.268 21.805 1.00 0.00 H new ATOM 0 HG1 THR A 427 -3.559 -8.865 20.151 1.00 0.00 H new ATOM 0 HG21 THR A 427 -4.433 -5.452 20.272 1.00 0.00 H new ATOM 0 HG22 THR A 427 -3.083 -4.965 21.326 1.00 0.00 H new ATOM 0 HG23 THR A 427 -2.775 -5.398 19.628 1.00 0.00 H new ATOM 1117 N ASN A 428 -0.312 -9.187 21.984 1.00 0.00 N ATOM 1118 CA ASN A 428 -0.021 -10.529 22.466 1.00 0.00 C ATOM 1119 C ASN A 428 1.460 -10.669 22.802 1.00 0.00 C ATOM 1120 O ASN A 428 2.309 -10.035 22.176 1.00 0.00 O ATOM 1121 CB ASN A 428 -0.423 -11.576 21.425 1.00 0.00 C ATOM 1122 CG ASN A 428 -0.156 -12.992 21.899 1.00 0.00 C ATOM 1123 OD1 ASN A 428 -0.693 -13.431 22.915 1.00 0.00 O ATOM 1124 ND2 ASN A 428 0.680 -13.715 21.162 1.00 0.00 N ATOM 0 H ASN A 428 0.514 -8.606 21.841 1.00 0.00 H new ATOM 0 HA ASN A 428 -0.603 -10.696 23.372 1.00 0.00 H new ATOM 0 HB2 ASN A 428 -1.482 -11.467 21.193 1.00 0.00 H new ATOM 0 HB3 ASN A 428 0.126 -11.395 20.501 1.00 0.00 H new ATOM 0 HD21 ASN A 428 0.899 -14.674 21.432 1.00 0.00 H new ATOM 0 HD22 ASN A 428 1.103 -13.311 20.326 1.00 0.00 H new ATOM 1131 N THR A 429 1.760 -11.497 23.799 1.00 0.00 N ATOM 1132 CA THR A 429 3.139 -11.719 24.227 1.00 0.00 C ATOM 1133 C THR A 429 4.044 -12.038 23.040 1.00 0.00 C ATOM 1134 O THR A 429 3.678 -12.816 22.159 1.00 0.00 O ATOM 1135 CB THR A 429 3.231 -12.863 25.254 1.00 0.00 C ATOM 1136 OG1 THR A 429 4.597 -13.088 25.618 1.00 0.00 O ATOM 1137 CG2 THR A 429 2.632 -14.145 24.695 1.00 0.00 C ATOM 0 H THR A 429 1.066 -12.026 24.327 1.00 0.00 H new ATOM 0 HA THR A 429 3.476 -10.794 24.694 1.00 0.00 H new ATOM 0 HB THR A 429 2.663 -12.572 26.138 1.00 0.00 H new ATOM 0 HG1 THR A 429 4.646 -13.816 26.273 1.00 0.00 H new ATOM 0 HG21 THR A 429 2.709 -14.937 25.439 1.00 0.00 H new ATOM 0 HG22 THR A 429 1.583 -13.979 24.449 1.00 0.00 H new ATOM 0 HG23 THR A 429 3.174 -14.438 23.796 1.00 0.00 H new ATOM 1145 N THR A 430 5.226 -11.423 23.029 1.00 0.00 N ATOM 1146 CA THR A 430 6.201 -11.624 21.961 1.00 0.00 C ATOM 1147 C THR A 430 5.567 -11.456 20.582 1.00 0.00 C ATOM 1148 O THR A 430 5.893 -12.185 19.644 1.00 0.00 O ATOM 1149 CB THR A 430 6.866 -13.013 22.051 1.00 0.00 C ATOM 1150 OG1 THR A 430 5.880 -14.046 21.931 1.00 0.00 O ATOM 1151 CG2 THR A 430 7.612 -13.168 23.368 1.00 0.00 C ATOM 0 H THR A 430 5.532 -10.776 23.756 1.00 0.00 H new ATOM 0 HA THR A 430 6.966 -10.859 22.094 1.00 0.00 H new ATOM 0 HB THR A 430 7.579 -13.101 21.231 1.00 0.00 H new ATOM 0 HG1 THR A 430 5.029 -13.654 21.644 1.00 0.00 H new ATOM 0 HG21 THR A 430 8.073 -14.155 23.411 1.00 0.00 H new ATOM 0 HG22 THR A 430 8.385 -12.403 23.441 1.00 0.00 H new ATOM 0 HG23 THR A 430 6.913 -13.058 24.197 1.00 0.00 H new ATOM 1159 N GLY A 431 4.667 -10.483 20.466 1.00 0.00 N ATOM 1160 CA GLY A 431 4.004 -10.228 19.198 1.00 0.00 C ATOM 1161 C GLY A 431 3.273 -11.444 18.663 1.00 0.00 C ATOM 1162 O GLY A 431 2.585 -12.141 19.408 1.00 0.00 O ATOM 0 H GLY A 431 4.385 -9.866 21.228 1.00 0.00 H new ATOM 0 HA2 GLY A 431 3.295 -9.409 19.322 1.00 0.00 H new ATOM 0 HA3 GLY A 431 4.743 -9.902 18.466 1.00 0.00 H new ATOM 1166 N SER A 432 3.422 -11.694 17.364 1.00 0.00 N ATOM 1167 CA SER A 432 2.774 -12.830 16.714 1.00 0.00 C ATOM 1168 C SER A 432 3.482 -14.142 17.053 1.00 0.00 C ATOM 1169 O SER A 432 4.082 -14.774 16.183 1.00 0.00 O ATOM 1170 CB SER A 432 2.748 -12.629 15.197 1.00 0.00 C ATOM 1171 OG SER A 432 2.018 -11.466 14.849 1.00 0.00 O ATOM 0 H SER A 432 3.989 -11.122 16.738 1.00 0.00 H new ATOM 0 HA SER A 432 1.751 -12.889 17.087 1.00 0.00 H new ATOM 0 HB2 SER A 432 3.768 -12.548 14.820 1.00 0.00 H new ATOM 0 HB3 SER A 432 2.300 -13.500 14.719 1.00 0.00 H new ATOM 0 HG SER A 432 2.018 -11.359 13.875 1.00 0.00 H new ATOM 1177 N SER A 433 3.409 -14.541 18.323 1.00 0.00 N ATOM 1178 CA SER A 433 4.039 -15.776 18.789 1.00 0.00 C ATOM 1179 C SER A 433 5.507 -15.835 18.374 1.00 0.00 C ATOM 1180 O SER A 433 6.121 -14.759 18.219 1.00 0.00 O ATOM 1181 CB SER A 433 3.290 -17.002 18.255 1.00 0.00 C ATOM 1182 OG SER A 433 3.356 -17.073 16.842 1.00 0.00 O ATOM 1183 OXT SER A 433 6.031 -16.957 18.209 1.00 0.00 O ATOM 0 H SER A 433 2.917 -14.023 19.051 1.00 0.00 H new ATOM 0 HA SER A 433 3.990 -15.783 19.878 1.00 0.00 H new ATOM 0 HB2 SER A 433 3.717 -17.907 18.687 1.00 0.00 H new ATOM 0 HB3 SER A 433 2.247 -16.959 18.570 1.00 0.00 H new ATOM 0 HG SER A 433 4.064 -16.478 16.517 1.00 0.00 H new TER 1189 SER A 433