USER MOD reduce.3.24.130724 H: found=0, std=0, add=700, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 702 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 505 LYS NZ :NH3+ -154:sc= 2.38 (180deg=0.346) USER MOD Set 1.2: A 514 SER OG : rot -80:sc= 0.544 USER MOD Set 2.1: A 478 GLN : amide:sc= -4.99 K(o=-14,f=-16) USER MOD Set 2.2: A 486 SER OG : rot 168:sc= -4.3 USER MOD Set 2.3: B 949 MET CE :methyl 171:sc= -4.39! (180deg=-1.27) USER MOD Set 3.1: A 468 MET CE :methyl 165:sc= -0.0203 (180deg=-0.308) USER MOD Set 3.2: A 476 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 453 GLN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 455 THR OG1 : rot 180:sc= 0 USER MOD Single : A 462 TYR OH : rot 180:sc= 0 USER MOD Single : A 464 THR OG1 : rot -29:sc= -0.078 USER MOD Single : A 466 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 469 THR OG1 : rot 180:sc= 0 USER MOD Single : A 470 THR OG1 : rot 130:sc= -0.987 USER MOD Single : A 471 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 475 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 479 THR OG1 : rot -72:sc= 1.19 USER MOD Single : A 480 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 481 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0.00313 USER MOD Single : A 485 SER OG : rot 180:sc= 0 USER MOD Single : A 488 GLN : amide:sc= -0.0734 X(o=-0.073,f=-0.14) USER MOD Single : A 489 THR OG1 : rot 69:sc= 0.34 USER MOD Single : A 491 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 495 GLN : amide:sc= -0.0744 X(o=-0.074,f=-0.099) USER MOD Single : A 498 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 501 ASN : amide:sc= -6.71! C(o=-6.7!,f=-7.4!) USER MOD Single : A 506 MET CE :methyl 163:sc= -0.0113 (180deg=-0.272) USER MOD Single : A 508 ASN : amide:sc= -0.382 X(o=-0.38,f=0) USER MOD Single : A 510 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 511 MET CE :methyl -166:sc= -0.0523 (180deg=-0.372) USER MOD Single : A 512 HIS :FLIP no HE2:sc= -2! F(o=-2.6,f=-2!) USER MOD Single : A 516 LYS NZ :NH3+ 169:sc=-0.00254 (180deg=-0.103) USER MOD Single : B 951 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 958 ASN : amide:sc= 0.505 K(o=0.5,f=0) USER MOD Single : B 961 MET CE :methyl -164:sc= -0.0792 (180deg=-0.507) USER MOD ----------------------------------------------------------------- ATOM 29 N GLN A 453 -13.911 6.260 2.430 1.00 0.00 N ATOM 30 CA GLN A 453 -13.462 5.193 3.318 1.00 0.00 C ATOM 31 C GLN A 453 -12.519 4.240 2.591 1.00 0.00 C ATOM 32 O GLN A 453 -12.564 4.120 1.367 1.00 0.00 O ATOM 33 CB GLN A 453 -14.662 4.421 3.868 1.00 0.00 C ATOM 34 CG GLN A 453 -15.591 5.267 4.723 1.00 0.00 C ATOM 35 CD GLN A 453 -16.795 4.491 5.220 1.00 0.00 C ATOM 36 OE1 GLN A 453 -17.114 3.420 4.704 1.00 0.00 O ATOM 37 NE2 GLN A 453 -17.471 5.030 6.228 1.00 0.00 N ATOM 0 HA GLN A 453 -12.920 5.648 4.147 1.00 0.00 H new ATOM 0 HB2 GLN A 453 -15.228 4.004 3.035 1.00 0.00 H new ATOM 0 HB3 GLN A 453 -14.302 3.580 4.461 1.00 0.00 H new ATOM 0 HG2 GLN A 453 -15.038 5.658 5.577 1.00 0.00 H new ATOM 0 HG3 GLN A 453 -15.931 6.125 4.144 1.00 0.00 H new ATOM 0 HE21 GLN A 453 -17.171 5.920 6.625 1.00 0.00 H new ATOM 0 HE22 GLN A 453 -18.291 4.554 6.605 1.00 0.00 H new ATOM 46 N VAL A 454 -11.665 3.565 3.354 1.00 0.00 N ATOM 47 CA VAL A 454 -10.711 2.623 2.783 1.00 0.00 C ATOM 48 C VAL A 454 -11.097 1.185 3.111 1.00 0.00 C ATOM 49 O VAL A 454 -11.455 0.871 4.246 1.00 0.00 O ATOM 50 CB VAL A 454 -9.281 2.888 3.296 1.00 0.00 C ATOM 51 CG1 VAL A 454 -8.279 2.002 2.573 1.00 0.00 C ATOM 52 CG2 VAL A 454 -8.918 4.358 3.132 1.00 0.00 C ATOM 0 H VAL A 454 -11.615 3.653 4.369 1.00 0.00 H new ATOM 0 HA VAL A 454 -10.733 2.767 1.703 1.00 0.00 H new ATOM 0 HB VAL A 454 -9.246 2.644 4.358 1.00 0.00 H new ATOM 0 HG11 VAL A 454 -7.276 2.204 2.949 1.00 0.00 H new ATOM 0 HG12 VAL A 454 -8.527 0.955 2.747 1.00 0.00 H new ATOM 0 HG13 VAL A 454 -8.314 2.211 1.504 1.00 0.00 H new ATOM 0 HG21 VAL A 454 -7.906 4.526 3.499 1.00 0.00 H new ATOM 0 HG22 VAL A 454 -8.971 4.631 2.078 1.00 0.00 H new ATOM 0 HG23 VAL A 454 -9.617 4.971 3.701 1.00 0.00 H new ATOM 62 N THR A 455 -11.022 0.314 2.109 1.00 0.00 N ATOM 63 CA THR A 455 -11.363 -1.092 2.292 1.00 0.00 C ATOM 64 C THR A 455 -10.298 -1.996 1.679 1.00 0.00 C ATOM 65 O THR A 455 -9.589 -1.596 0.756 1.00 0.00 O ATOM 66 CB THR A 455 -12.727 -1.393 1.669 1.00 0.00 C ATOM 67 OG1 THR A 455 -13.132 -2.717 1.962 1.00 0.00 O ATOM 68 CG2 THR A 455 -12.750 -1.227 0.165 1.00 0.00 C ATOM 0 H THR A 455 -10.728 0.557 1.163 1.00 0.00 H new ATOM 0 HA THR A 455 -11.409 -1.292 3.362 1.00 0.00 H new ATOM 0 HB THR A 455 -13.410 -0.666 2.108 1.00 0.00 H new ATOM 0 HG1 THR A 455 -14.007 -2.889 1.556 1.00 0.00 H new ATOM 0 HG21 THR A 455 -13.747 -1.456 -0.211 1.00 0.00 H new ATOM 0 HG22 THR A 455 -12.493 -0.199 -0.092 1.00 0.00 H new ATOM 0 HG23 THR A 455 -12.027 -1.906 -0.287 1.00 0.00 H new ATOM 76 N GLU A 456 -10.193 -3.214 2.199 1.00 0.00 N ATOM 77 CA GLU A 456 -9.214 -4.175 1.702 1.00 0.00 C ATOM 78 C GLU A 456 -9.506 -4.551 0.254 1.00 0.00 C ATOM 79 O GLU A 456 -8.589 -4.743 -0.545 1.00 0.00 O ATOM 80 CB GLU A 456 -9.211 -5.430 2.577 1.00 0.00 C ATOM 81 CG GLU A 456 -8.681 -5.193 3.980 1.00 0.00 C ATOM 82 CD GLU A 456 -8.668 -6.455 4.822 1.00 0.00 C ATOM 83 OE1 GLU A 456 -9.284 -7.457 4.400 1.00 0.00 O ATOM 84 OE2 GLU A 456 -8.043 -6.441 5.903 1.00 0.00 O ATOM 0 H GLU A 456 -10.773 -3.559 2.964 1.00 0.00 H new ATOM 0 HA GLU A 456 -8.230 -3.708 1.745 1.00 0.00 H new ATOM 0 HB2 GLU A 456 -10.227 -5.819 2.643 1.00 0.00 H new ATOM 0 HB3 GLU A 456 -8.606 -6.198 2.094 1.00 0.00 H new ATOM 0 HG2 GLU A 456 -7.669 -4.792 3.919 1.00 0.00 H new ATOM 0 HG3 GLU A 456 -9.294 -4.439 4.473 1.00 0.00 H new ATOM 91 N ASP A 457 -10.788 -4.655 -0.079 1.00 0.00 N ATOM 92 CA ASP A 457 -11.201 -5.010 -1.432 1.00 0.00 C ATOM 93 C ASP A 457 -10.643 -4.022 -2.451 1.00 0.00 C ATOM 94 O ASP A 457 -10.180 -4.416 -3.523 1.00 0.00 O ATOM 95 CB ASP A 457 -12.727 -5.050 -1.527 1.00 0.00 C ATOM 96 CG ASP A 457 -13.210 -5.599 -2.856 1.00 0.00 C ATOM 97 OD1 ASP A 457 -13.285 -6.838 -2.995 1.00 0.00 O ATOM 98 OD2 ASP A 457 -13.512 -4.789 -3.758 1.00 0.00 O ATOM 0 H ASP A 457 -11.559 -4.498 0.570 1.00 0.00 H new ATOM 0 HA ASP A 457 -10.802 -5.999 -1.658 1.00 0.00 H new ATOM 0 HB2 ASP A 457 -13.123 -5.664 -0.718 1.00 0.00 H new ATOM 0 HB3 ASP A 457 -13.123 -4.044 -1.387 1.00 0.00 H new ATOM 103 N ALA A 458 -10.689 -2.739 -2.112 1.00 0.00 N ATOM 104 CA ALA A 458 -10.187 -1.696 -2.999 1.00 0.00 C ATOM 105 C ALA A 458 -8.680 -1.816 -3.193 1.00 0.00 C ATOM 106 O ALA A 458 -8.170 -1.643 -4.300 1.00 0.00 O ATOM 107 CB ALA A 458 -10.543 -0.322 -2.451 1.00 0.00 C ATOM 0 H ALA A 458 -11.069 -2.396 -1.230 1.00 0.00 H new ATOM 0 HA ALA A 458 -10.662 -1.822 -3.972 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -10.162 0.447 -3.123 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -11.626 -0.231 -2.372 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -10.096 -0.196 -1.465 1.00 0.00 H new ATOM 113 N VAL A 459 -7.970 -2.111 -2.110 1.00 0.00 N ATOM 114 CA VAL A 459 -6.520 -2.253 -2.160 1.00 0.00 C ATOM 115 C VAL A 459 -6.114 -3.517 -2.912 1.00 0.00 C ATOM 116 O VAL A 459 -5.203 -3.492 -3.741 1.00 0.00 O ATOM 117 CB VAL A 459 -5.910 -2.291 -0.746 1.00 0.00 C ATOM 118 CG1 VAL A 459 -4.390 -2.305 -0.817 1.00 0.00 C ATOM 119 CG2 VAL A 459 -6.400 -1.111 0.081 1.00 0.00 C ATOM 0 H VAL A 459 -8.376 -2.257 -1.186 1.00 0.00 H new ATOM 0 HA VAL A 459 -6.136 -1.381 -2.690 1.00 0.00 H new ATOM 0 HB VAL A 459 -6.236 -3.209 -0.257 1.00 0.00 H new ATOM 0 HG11 VAL A 459 -3.979 -2.332 0.192 1.00 0.00 H new ATOM 0 HG12 VAL A 459 -4.060 -3.186 -1.367 1.00 0.00 H new ATOM 0 HG13 VAL A 459 -4.041 -1.407 -1.327 1.00 0.00 H new ATOM 0 HG21 VAL A 459 -5.958 -1.156 1.076 1.00 0.00 H new ATOM 0 HG22 VAL A 459 -6.107 -0.180 -0.404 1.00 0.00 H new ATOM 0 HG23 VAL A 459 -7.486 -1.151 0.164 1.00 0.00 H new ATOM 129 N ARG A 460 -6.792 -4.620 -2.615 1.00 0.00 N ATOM 130 CA ARG A 460 -6.498 -5.895 -3.261 1.00 0.00 C ATOM 131 C ARG A 460 -6.697 -5.804 -4.771 1.00 0.00 C ATOM 132 O ARG A 460 -5.916 -6.360 -5.542 1.00 0.00 O ATOM 133 CB ARG A 460 -7.386 -6.998 -2.683 1.00 0.00 C ATOM 134 CG ARG A 460 -7.057 -7.354 -1.243 1.00 0.00 C ATOM 135 CD ARG A 460 -7.958 -8.461 -0.721 1.00 0.00 C ATOM 136 NE ARG A 460 -7.687 -9.740 -1.372 1.00 0.00 N ATOM 137 CZ ARG A 460 -6.670 -10.536 -1.050 1.00 0.00 C ATOM 138 NH1 ARG A 460 -5.825 -10.187 -0.088 1.00 0.00 N ATOM 139 NH2 ARG A 460 -6.496 -11.684 -1.692 1.00 0.00 N ATOM 0 H ARG A 460 -7.548 -4.658 -1.932 1.00 0.00 H new ATOM 0 HA ARG A 460 -5.453 -6.138 -3.067 1.00 0.00 H new ATOM 0 HB2 ARG A 460 -8.427 -6.682 -2.741 1.00 0.00 H new ATOM 0 HB3 ARG A 460 -7.289 -7.891 -3.300 1.00 0.00 H new ATOM 0 HG2 ARG A 460 -6.016 -7.669 -1.174 1.00 0.00 H new ATOM 0 HG3 ARG A 460 -7.165 -6.470 -0.615 1.00 0.00 H new ATOM 0 HD2 ARG A 460 -7.818 -8.565 0.355 1.00 0.00 H new ATOM 0 HD3 ARG A 460 -9.000 -8.186 -0.882 1.00 0.00 H new ATOM 0 HE ARG A 460 -8.314 -10.041 -2.118 1.00 0.00 H new ATOM 0 HH11 ARG A 460 -5.953 -9.305 0.408 1.00 0.00 H new ATOM 0 HH12 ARG A 460 -5.047 -10.801 0.155 1.00 0.00 H new ATOM 0 HH21 ARG A 460 -7.142 -11.957 -2.433 1.00 0.00 H new ATOM 0 HH22 ARG A 460 -5.716 -12.294 -1.445 1.00 0.00 H new ATOM 153 N ARG A 461 -7.746 -5.102 -5.187 1.00 0.00 N ATOM 154 CA ARG A 461 -8.044 -4.941 -6.605 1.00 0.00 C ATOM 155 C ARG A 461 -6.871 -4.303 -7.345 1.00 0.00 C ATOM 156 O ARG A 461 -6.576 -4.662 -8.484 1.00 0.00 O ATOM 157 CB ARG A 461 -9.303 -4.091 -6.792 1.00 0.00 C ATOM 158 CG ARG A 461 -10.594 -4.849 -6.529 1.00 0.00 C ATOM 159 CD ARG A 461 -11.804 -3.935 -6.621 1.00 0.00 C ATOM 160 NE ARG A 461 -12.058 -3.499 -7.993 1.00 0.00 N ATOM 161 CZ ARG A 461 -12.813 -2.449 -8.309 1.00 0.00 C ATOM 162 NH1 ARG A 461 -13.390 -1.727 -7.357 1.00 0.00 N ATOM 163 NH2 ARG A 461 -12.991 -2.121 -9.581 1.00 0.00 N ATOM 0 H ARG A 461 -8.404 -4.636 -4.562 1.00 0.00 H new ATOM 0 HA ARG A 461 -8.216 -5.932 -7.025 1.00 0.00 H new ATOM 0 HB2 ARG A 461 -9.254 -3.232 -6.123 1.00 0.00 H new ATOM 0 HB3 ARG A 461 -9.321 -3.702 -7.810 1.00 0.00 H new ATOM 0 HG2 ARG A 461 -10.694 -5.661 -7.250 1.00 0.00 H new ATOM 0 HG3 ARG A 461 -10.555 -5.304 -5.539 1.00 0.00 H new ATOM 0 HD2 ARG A 461 -12.682 -4.456 -6.238 1.00 0.00 H new ATOM 0 HD3 ARG A 461 -11.648 -3.063 -5.986 1.00 0.00 H new ATOM 0 HE ARG A 461 -11.632 -4.030 -8.752 1.00 0.00 H new ATOM 0 HH11 ARG A 461 -13.256 -1.975 -6.377 1.00 0.00 H new ATOM 0 HH12 ARG A 461 -13.967 -0.924 -7.605 1.00 0.00 H new ATOM 0 HH21 ARG A 461 -12.550 -2.673 -10.317 1.00 0.00 H new ATOM 0 HH22 ARG A 461 -13.569 -1.317 -9.824 1.00 0.00 H new ATOM 177 N TYR A 462 -6.207 -3.357 -6.690 1.00 0.00 N ATOM 178 CA TYR A 462 -5.068 -2.673 -7.290 1.00 0.00 C ATOM 179 C TYR A 462 -3.907 -3.638 -7.511 1.00 0.00 C ATOM 180 O TYR A 462 -3.218 -3.572 -8.528 1.00 0.00 O ATOM 181 CB TYR A 462 -4.618 -1.512 -6.400 1.00 0.00 C ATOM 182 CG TYR A 462 -5.672 -0.442 -6.222 1.00 0.00 C ATOM 183 CD1 TYR A 462 -6.410 0.020 -7.304 1.00 0.00 C ATOM 184 CD2 TYR A 462 -5.928 0.105 -4.971 1.00 0.00 C ATOM 185 CE1 TYR A 462 -7.373 0.998 -7.145 1.00 0.00 C ATOM 186 CE2 TYR A 462 -6.889 1.084 -4.804 1.00 0.00 C ATOM 187 CZ TYR A 462 -7.609 1.526 -5.893 1.00 0.00 C ATOM 188 OH TYR A 462 -8.567 2.499 -5.731 1.00 0.00 O ATOM 0 H TYR A 462 -6.437 -3.047 -5.746 1.00 0.00 H new ATOM 0 HA TYR A 462 -5.380 -2.281 -8.258 1.00 0.00 H new ATOM 0 HB2 TYR A 462 -4.339 -1.902 -5.421 1.00 0.00 H new ATOM 0 HB3 TYR A 462 -3.723 -1.061 -6.830 1.00 0.00 H new ATOM 0 HD1 TYR A 462 -6.228 -0.392 -8.286 1.00 0.00 H new ATOM 0 HD2 TYR A 462 -5.367 -0.240 -4.115 1.00 0.00 H new ATOM 0 HE1 TYR A 462 -7.938 1.347 -7.997 1.00 0.00 H new ATOM 0 HE2 TYR A 462 -7.075 1.501 -3.825 1.00 0.00 H new ATOM 0 HH TYR A 462 -8.609 2.763 -4.788 1.00 0.00 H new ATOM 198 N LEU A 463 -3.695 -4.532 -6.550 1.00 0.00 N ATOM 199 CA LEU A 463 -2.616 -5.510 -6.639 1.00 0.00 C ATOM 200 C LEU A 463 -2.981 -6.645 -7.590 1.00 0.00 C ATOM 201 O LEU A 463 -2.160 -7.078 -8.398 1.00 0.00 O ATOM 202 CB LEU A 463 -2.296 -6.071 -5.254 1.00 0.00 C ATOM 203 CG LEU A 463 -1.829 -5.036 -4.229 1.00 0.00 C ATOM 204 CD1 LEU A 463 -1.682 -5.673 -2.856 1.00 0.00 C ATOM 205 CD2 LEU A 463 -0.516 -4.406 -4.671 1.00 0.00 C ATOM 0 H LEU A 463 -4.256 -4.599 -5.701 1.00 0.00 H new ATOM 0 HA LEU A 463 -1.734 -5.005 -7.033 1.00 0.00 H new ATOM 0 HB2 LEU A 463 -3.185 -6.569 -4.866 1.00 0.00 H new ATOM 0 HB3 LEU A 463 -1.523 -6.833 -5.357 1.00 0.00 H new ATOM 0 HG LEU A 463 -2.582 -4.251 -4.163 1.00 0.00 H new ATOM 0 HD11 LEU A 463 -1.349 -4.922 -2.140 1.00 0.00 H new ATOM 0 HD12 LEU A 463 -2.643 -6.077 -2.538 1.00 0.00 H new ATOM 0 HD13 LEU A 463 -0.948 -6.478 -2.905 1.00 0.00 H new ATOM 0 HD21 LEU A 463 -0.197 -3.672 -3.931 1.00 0.00 H new ATOM 0 HD22 LEU A 463 0.245 -5.180 -4.765 1.00 0.00 H new ATOM 0 HD23 LEU A 463 -0.654 -3.914 -5.634 1.00 0.00 H new ATOM 217 N THR A 464 -4.216 -7.126 -7.487 1.00 0.00 N ATOM 218 CA THR A 464 -4.686 -8.211 -8.334 1.00 0.00 C ATOM 219 C THR A 464 -4.624 -7.820 -9.806 1.00 0.00 C ATOM 220 O THR A 464 -4.360 -8.657 -10.670 1.00 0.00 O ATOM 221 CB THR A 464 -6.115 -8.586 -7.950 1.00 0.00 C ATOM 222 OG1 THR A 464 -7.012 -7.535 -8.261 1.00 0.00 O ATOM 223 CG2 THR A 464 -6.276 -8.908 -6.480 1.00 0.00 C ATOM 0 H THR A 464 -4.909 -6.779 -6.823 1.00 0.00 H new ATOM 0 HA THR A 464 -4.035 -9.072 -8.184 1.00 0.00 H new ATOM 0 HB THR A 464 -6.342 -9.482 -8.528 1.00 0.00 H new ATOM 0 HG1 THR A 464 -6.543 -6.677 -8.203 1.00 0.00 H new ATOM 0 HG21 THR A 464 -7.315 -9.166 -6.276 1.00 0.00 H new ATOM 0 HG22 THR A 464 -5.635 -9.750 -6.220 1.00 0.00 H new ATOM 0 HG23 THR A 464 -5.994 -8.040 -5.884 1.00 0.00 H new ATOM 231 N ARG A 465 -4.867 -6.544 -10.085 1.00 0.00 N ATOM 232 CA ARG A 465 -4.837 -6.044 -11.455 1.00 0.00 C ATOM 233 C ARG A 465 -3.405 -5.798 -11.911 1.00 0.00 C ATOM 234 O ARG A 465 -2.990 -6.265 -12.972 1.00 0.00 O ATOM 235 CB ARG A 465 -5.651 -4.753 -11.567 1.00 0.00 C ATOM 236 CG ARG A 465 -7.149 -4.963 -11.425 1.00 0.00 C ATOM 237 CD ARG A 465 -7.913 -3.656 -11.559 1.00 0.00 C ATOM 238 NE ARG A 465 -7.802 -3.090 -12.902 1.00 0.00 N ATOM 239 CZ ARG A 465 -6.818 -2.279 -13.291 1.00 0.00 C ATOM 240 NH1 ARG A 465 -5.856 -1.934 -12.444 1.00 0.00 N ATOM 241 NH2 ARG A 465 -6.799 -1.812 -14.531 1.00 0.00 N ATOM 0 H ARG A 465 -5.087 -5.838 -9.382 1.00 0.00 H new ATOM 0 HA ARG A 465 -5.280 -6.801 -12.102 1.00 0.00 H new ATOM 0 HB2 ARG A 465 -5.316 -4.055 -10.800 1.00 0.00 H new ATOM 0 HB3 ARG A 465 -5.448 -4.288 -12.532 1.00 0.00 H new ATOM 0 HG2 ARG A 465 -7.492 -5.665 -12.185 1.00 0.00 H new ATOM 0 HG3 ARG A 465 -7.364 -5.413 -10.456 1.00 0.00 H new ATOM 0 HD2 ARG A 465 -8.964 -3.825 -11.323 1.00 0.00 H new ATOM 0 HD3 ARG A 465 -7.534 -2.939 -10.831 1.00 0.00 H new ATOM 0 HE ARG A 465 -8.522 -3.330 -13.584 1.00 0.00 H new ATOM 0 HH11 ARG A 465 -5.866 -2.290 -11.488 1.00 0.00 H new ATOM 0 HH12 ARG A 465 -5.106 -1.313 -12.749 1.00 0.00 H new ATOM 0 HH21 ARG A 465 -7.536 -2.073 -15.186 1.00 0.00 H new ATOM 0 HH22 ARG A 465 -6.047 -1.191 -14.831 1.00 0.00 H new ATOM 255 N LYS A 466 -2.657 -5.063 -11.102 1.00 0.00 N ATOM 256 CA LYS A 466 -1.267 -4.751 -11.414 1.00 0.00 C ATOM 257 C LYS A 466 -0.426 -4.677 -10.140 1.00 0.00 C ATOM 258 O LYS A 466 -0.860 -4.113 -9.135 1.00 0.00 O ATOM 259 CB LYS A 466 -1.178 -3.427 -12.175 1.00 0.00 C ATOM 260 CG LYS A 466 0.159 -3.208 -12.862 1.00 0.00 C ATOM 261 CD LYS A 466 0.115 -2.009 -13.796 1.00 0.00 C ATOM 262 CE LYS A 466 1.351 -1.944 -14.677 1.00 0.00 C ATOM 263 NZ LYS A 466 2.365 -0.992 -14.145 1.00 0.00 N ATOM 0 H LYS A 466 -2.989 -4.670 -10.221 1.00 0.00 H new ATOM 0 HA LYS A 466 -0.873 -5.550 -12.042 1.00 0.00 H new ATOM 0 HB2 LYS A 466 -1.971 -3.393 -12.922 1.00 0.00 H new ATOM 0 HB3 LYS A 466 -1.359 -2.606 -11.481 1.00 0.00 H new ATOM 0 HG2 LYS A 466 0.935 -3.058 -12.111 1.00 0.00 H new ATOM 0 HG3 LYS A 466 0.430 -4.100 -13.426 1.00 0.00 H new ATOM 0 HD2 LYS A 466 -0.776 -2.066 -14.421 1.00 0.00 H new ATOM 0 HD3 LYS A 466 0.036 -1.093 -13.210 1.00 0.00 H new ATOM 0 HE2 LYS A 466 1.793 -2.937 -14.756 1.00 0.00 H new ATOM 0 HE3 LYS A 466 1.063 -1.642 -15.684 1.00 0.00 H new ATOM 0 HZ1 LYS A 466 3.192 -0.978 -14.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 466 1.953 -0.039 -14.093 1.00 0.00 H new ATOM 0 HZ3 LYS A 466 2.659 -1.294 -13.194 1.00 0.00 H new ATOM 277 N PRO A 467 0.792 -5.245 -10.163 1.00 0.00 N ATOM 278 CA PRO A 467 1.687 -5.235 -9.002 1.00 0.00 C ATOM 279 C PRO A 467 2.301 -3.861 -8.757 1.00 0.00 C ATOM 280 O PRO A 467 2.930 -3.285 -9.645 1.00 0.00 O ATOM 281 CB PRO A 467 2.769 -6.245 -9.383 1.00 0.00 C ATOM 282 CG PRO A 467 2.806 -6.210 -10.871 1.00 0.00 C ATOM 283 CD PRO A 467 1.396 -5.939 -11.318 1.00 0.00 C ATOM 0 HA PRO A 467 1.162 -5.480 -8.078 1.00 0.00 H new ATOM 0 HB2 PRO A 467 3.734 -5.973 -8.956 1.00 0.00 H new ATOM 0 HB3 PRO A 467 2.528 -7.242 -9.016 1.00 0.00 H new ATOM 0 HG2 PRO A 467 3.483 -5.433 -11.226 1.00 0.00 H new ATOM 0 HG3 PRO A 467 3.167 -7.156 -11.274 1.00 0.00 H new ATOM 0 HD2 PRO A 467 1.372 -5.320 -12.215 1.00 0.00 H new ATOM 0 HD3 PRO A 467 0.866 -6.862 -11.553 1.00 0.00 H new ATOM 291 N MET A 468 2.115 -3.341 -7.548 1.00 0.00 N ATOM 292 CA MET A 468 2.654 -2.034 -7.189 1.00 0.00 C ATOM 293 C MET A 468 3.302 -2.073 -5.809 1.00 0.00 C ATOM 294 O MET A 468 2.977 -2.925 -4.982 1.00 0.00 O ATOM 295 CB MET A 468 1.548 -0.977 -7.217 1.00 0.00 C ATOM 296 CG MET A 468 0.238 -1.447 -6.605 1.00 0.00 C ATOM 297 SD MET A 468 -1.005 -0.142 -6.540 1.00 0.00 S ATOM 298 CE MET A 468 -1.326 0.108 -8.283 1.00 0.00 C ATOM 0 H MET A 468 1.596 -3.804 -6.802 1.00 0.00 H new ATOM 0 HA MET A 468 3.417 -1.770 -7.921 1.00 0.00 H new ATOM 0 HB2 MET A 468 1.891 -0.091 -6.683 1.00 0.00 H new ATOM 0 HB3 MET A 468 1.370 -0.678 -8.250 1.00 0.00 H new ATOM 0 HG2 MET A 468 -0.150 -2.284 -7.185 1.00 0.00 H new ATOM 0 HG3 MET A 468 0.424 -1.817 -5.597 1.00 0.00 H new ATOM 0 HE1 MET A 468 -2.246 0.680 -8.405 1.00 0.00 H new ATOM 0 HE2 MET A 468 -0.496 0.655 -8.731 1.00 0.00 H new ATOM 0 HE3 MET A 468 -1.432 -0.858 -8.776 1.00 0.00 H new ATOM 308 N THR A 469 4.220 -1.143 -5.567 1.00 0.00 N ATOM 309 CA THR A 469 4.917 -1.069 -4.287 1.00 0.00 C ATOM 310 C THR A 469 4.061 -0.358 -3.244 1.00 0.00 C ATOM 311 O THR A 469 3.024 0.221 -3.565 1.00 0.00 O ATOM 312 CB THR A 469 6.252 -0.342 -4.450 1.00 0.00 C ATOM 313 OG1 THR A 469 6.046 1.038 -4.687 1.00 0.00 O ATOM 314 CG2 THR A 469 7.093 -0.884 -5.586 1.00 0.00 C ATOM 0 H THR A 469 4.499 -0.430 -6.240 1.00 0.00 H new ATOM 0 HA THR A 469 5.106 -2.086 -3.945 1.00 0.00 H new ATOM 0 HB THR A 469 6.786 -0.505 -3.514 1.00 0.00 H new ATOM 0 HG1 THR A 469 6.912 1.486 -4.787 1.00 0.00 H new ATOM 0 HG21 THR A 469 8.026 -0.324 -5.647 1.00 0.00 H new ATOM 0 HG22 THR A 469 7.312 -1.937 -5.406 1.00 0.00 H new ATOM 0 HG23 THR A 469 6.547 -0.782 -6.524 1.00 0.00 H new ATOM 322 N THR A 470 4.504 -0.407 -1.992 1.00 0.00 N ATOM 323 CA THR A 470 3.781 0.233 -0.898 1.00 0.00 C ATOM 324 C THR A 470 3.619 1.729 -1.149 1.00 0.00 C ATOM 325 O THR A 470 2.580 2.311 -0.839 1.00 0.00 O ATOM 326 CB THR A 470 4.511 0.004 0.426 1.00 0.00 C ATOM 327 OG1 THR A 470 5.911 0.146 0.257 1.00 0.00 O ATOM 328 CG2 THR A 470 4.256 -1.363 1.023 1.00 0.00 C ATOM 0 H THR A 470 5.360 -0.883 -1.709 1.00 0.00 H new ATOM 0 HA THR A 470 2.789 -0.216 -0.843 1.00 0.00 H new ATOM 0 HB THR A 470 4.117 0.758 1.107 1.00 0.00 H new ATOM 0 HG1 THR A 470 6.263 0.753 0.941 1.00 0.00 H new ATOM 0 HG21 THR A 470 4.804 -1.459 1.961 1.00 0.00 H new ATOM 0 HG22 THR A 470 3.189 -1.484 1.212 1.00 0.00 H new ATOM 0 HG23 THR A 470 4.591 -2.132 0.327 1.00 0.00 H new ATOM 336 N LYS A 471 4.653 2.344 -1.713 1.00 0.00 N ATOM 337 CA LYS A 471 4.625 3.773 -2.006 1.00 0.00 C ATOM 338 C LYS A 471 3.454 4.120 -2.919 1.00 0.00 C ATOM 339 O LYS A 471 2.739 5.095 -2.685 1.00 0.00 O ATOM 340 CB LYS A 471 5.940 4.206 -2.658 1.00 0.00 C ATOM 341 CG LYS A 471 6.048 5.708 -2.870 1.00 0.00 C ATOM 342 CD LYS A 471 7.343 6.078 -3.574 1.00 0.00 C ATOM 343 CE LYS A 471 7.524 7.586 -3.650 1.00 0.00 C ATOM 344 NZ LYS A 471 8.272 8.116 -2.476 1.00 0.00 N ATOM 0 H LYS A 471 5.520 1.876 -1.976 1.00 0.00 H new ATOM 0 HA LYS A 471 4.499 4.308 -1.065 1.00 0.00 H new ATOM 0 HB2 LYS A 471 6.771 3.875 -2.035 1.00 0.00 H new ATOM 0 HB3 LYS A 471 6.042 3.703 -3.620 1.00 0.00 H new ATOM 0 HG2 LYS A 471 5.200 6.055 -3.460 1.00 0.00 H new ATOM 0 HG3 LYS A 471 5.997 6.217 -1.908 1.00 0.00 H new ATOM 0 HD2 LYS A 471 8.186 5.635 -3.044 1.00 0.00 H new ATOM 0 HD3 LYS A 471 7.344 5.659 -4.580 1.00 0.00 H new ATOM 0 HE2 LYS A 471 8.057 7.842 -4.566 1.00 0.00 H new ATOM 0 HE3 LYS A 471 6.547 8.066 -3.705 1.00 0.00 H new ATOM 0 HZ1 LYS A 471 8.374 9.147 -2.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 471 7.751 7.895 -1.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 471 9.214 7.677 -2.438 1.00 0.00 H new ATOM 358 N ASP A 472 3.261 3.315 -3.958 1.00 0.00 N ATOM 359 CA ASP A 472 2.174 3.536 -4.904 1.00 0.00 C ATOM 360 C ASP A 472 0.822 3.302 -4.242 1.00 0.00 C ATOM 361 O ASP A 472 -0.145 4.016 -4.509 1.00 0.00 O ATOM 362 CB ASP A 472 2.329 2.616 -6.116 1.00 0.00 C ATOM 363 CG ASP A 472 3.564 2.939 -6.935 1.00 0.00 C ATOM 364 OD1 ASP A 472 4.118 4.045 -6.764 1.00 0.00 O ATOM 365 OD2 ASP A 472 3.977 2.085 -7.749 1.00 0.00 O ATOM 0 H ASP A 472 3.843 2.504 -4.166 1.00 0.00 H new ATOM 0 HA ASP A 472 2.220 4.573 -5.237 1.00 0.00 H new ATOM 0 HB2 ASP A 472 2.381 1.581 -5.778 1.00 0.00 H new ATOM 0 HB3 ASP A 472 1.445 2.701 -6.748 1.00 0.00 H new ATOM 370 N LEU A 473 0.761 2.296 -3.377 1.00 0.00 N ATOM 371 CA LEU A 473 -0.472 1.965 -2.673 1.00 0.00 C ATOM 372 C LEU A 473 -0.868 3.082 -1.714 1.00 0.00 C ATOM 373 O LEU A 473 -2.038 3.459 -1.633 1.00 0.00 O ATOM 374 CB LEU A 473 -0.308 0.652 -1.903 1.00 0.00 C ATOM 375 CG LEU A 473 -0.105 -0.589 -2.772 1.00 0.00 C ATOM 376 CD1 LEU A 473 0.378 -1.758 -1.929 1.00 0.00 C ATOM 377 CD2 LEU A 473 -1.394 -0.948 -3.495 1.00 0.00 C ATOM 0 H LEU A 473 1.552 1.695 -3.146 1.00 0.00 H new ATOM 0 HA LEU A 473 -1.263 1.848 -3.414 1.00 0.00 H new ATOM 0 HB2 LEU A 473 0.544 0.748 -1.229 1.00 0.00 H new ATOM 0 HB3 LEU A 473 -1.191 0.501 -1.281 1.00 0.00 H new ATOM 0 HG LEU A 473 0.658 -0.366 -3.518 1.00 0.00 H new ATOM 0 HD11 LEU A 473 0.517 -2.632 -2.565 1.00 0.00 H new ATOM 0 HD12 LEU A 473 1.325 -1.499 -1.456 1.00 0.00 H new ATOM 0 HD13 LEU A 473 -0.361 -1.982 -1.160 1.00 0.00 H new ATOM 0 HD21 LEU A 473 -1.232 -1.834 -4.109 1.00 0.00 H new ATOM 0 HD22 LEU A 473 -2.177 -1.151 -2.764 1.00 0.00 H new ATOM 0 HD23 LEU A 473 -1.698 -0.116 -4.131 1.00 0.00 H new ATOM 389 N LEU A 474 0.114 3.609 -0.991 1.00 0.00 N ATOM 390 CA LEU A 474 -0.132 4.685 -0.037 1.00 0.00 C ATOM 391 C LEU A 474 -0.451 5.989 -0.760 1.00 0.00 C ATOM 392 O LEU A 474 -1.430 6.664 -0.440 1.00 0.00 O ATOM 393 CB LEU A 474 1.084 4.876 0.872 1.00 0.00 C ATOM 394 CG LEU A 474 0.783 5.487 2.241 1.00 0.00 C ATOM 395 CD1 LEU A 474 0.009 6.787 2.089 1.00 0.00 C ATOM 396 CD2 LEU A 474 0.010 4.502 3.106 1.00 0.00 C ATOM 0 H LEU A 474 1.087 3.309 -1.047 1.00 0.00 H new ATOM 0 HA LEU A 474 -0.992 4.408 0.572 1.00 0.00 H new ATOM 0 HB2 LEU A 474 1.562 3.908 1.021 1.00 0.00 H new ATOM 0 HB3 LEU A 474 1.805 5.512 0.359 1.00 0.00 H new ATOM 0 HG LEU A 474 1.730 5.709 2.734 1.00 0.00 H new ATOM 0 HD11 LEU A 474 -0.195 7.206 3.074 1.00 0.00 H new ATOM 0 HD12 LEU A 474 0.599 7.496 1.508 1.00 0.00 H new ATOM 0 HD13 LEU A 474 -0.932 6.592 1.575 1.00 0.00 H new ATOM 0 HD21 LEU A 474 -0.196 4.954 4.077 1.00 0.00 H new ATOM 0 HD22 LEU A 474 -0.931 4.249 2.617 1.00 0.00 H new ATOM 0 HD23 LEU A 474 0.602 3.597 3.245 1.00 0.00 H new ATOM 408 N LYS A 475 0.380 6.337 -1.736 1.00 0.00 N ATOM 409 CA LYS A 475 0.188 7.561 -2.505 1.00 0.00 C ATOM 410 C LYS A 475 -1.156 7.546 -3.227 1.00 0.00 C ATOM 411 O LYS A 475 -1.844 8.564 -3.302 1.00 0.00 O ATOM 412 CB LYS A 475 1.321 7.734 -3.518 1.00 0.00 C ATOM 413 CG LYS A 475 1.281 9.062 -4.255 1.00 0.00 C ATOM 414 CD LYS A 475 2.377 9.149 -5.305 1.00 0.00 C ATOM 415 CE LYS A 475 2.441 10.533 -5.930 1.00 0.00 C ATOM 416 NZ LYS A 475 3.775 10.810 -6.532 1.00 0.00 N ATOM 0 H LYS A 475 1.194 5.788 -2.014 1.00 0.00 H new ATOM 0 HA LYS A 475 0.198 8.401 -1.811 1.00 0.00 H new ATOM 0 HB2 LYS A 475 2.276 7.644 -3.001 1.00 0.00 H new ATOM 0 HB3 LYS A 475 1.274 6.923 -4.245 1.00 0.00 H new ATOM 0 HG2 LYS A 475 0.308 9.186 -4.731 1.00 0.00 H new ATOM 0 HG3 LYS A 475 1.393 9.879 -3.542 1.00 0.00 H new ATOM 0 HD2 LYS A 475 3.338 8.909 -4.850 1.00 0.00 H new ATOM 0 HD3 LYS A 475 2.198 8.406 -6.082 1.00 0.00 H new ATOM 0 HE2 LYS A 475 1.671 10.621 -6.697 1.00 0.00 H new ATOM 0 HE3 LYS A 475 2.222 11.284 -5.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 475 3.777 11.763 -6.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 475 4.507 10.752 -5.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 475 3.973 10.109 -7.274 1.00 0.00 H new ATOM 430 N LYS A 476 -1.523 6.384 -3.758 1.00 0.00 N ATOM 431 CA LYS A 476 -2.783 6.235 -4.475 1.00 0.00 C ATOM 432 C LYS A 476 -3.969 6.554 -3.569 1.00 0.00 C ATOM 433 O LYS A 476 -4.946 7.163 -4.002 1.00 0.00 O ATOM 434 CB LYS A 476 -2.916 4.814 -5.026 1.00 0.00 C ATOM 435 CG LYS A 476 -4.148 4.609 -5.892 1.00 0.00 C ATOM 436 CD LYS A 476 -3.993 5.278 -7.251 1.00 0.00 C ATOM 437 CE LYS A 476 -3.734 4.259 -8.348 1.00 0.00 C ATOM 438 NZ LYS A 476 -2.290 4.167 -8.693 1.00 0.00 N ATOM 0 H LYS A 476 -0.965 5.532 -3.705 1.00 0.00 H new ATOM 0 HA LYS A 476 -2.784 6.942 -5.305 1.00 0.00 H new ATOM 0 HB2 LYS A 476 -2.028 4.576 -5.611 1.00 0.00 H new ATOM 0 HB3 LYS A 476 -2.947 4.112 -4.193 1.00 0.00 H new ATOM 0 HG2 LYS A 476 -4.324 3.542 -6.029 1.00 0.00 H new ATOM 0 HG3 LYS A 476 -5.023 5.014 -5.384 1.00 0.00 H new ATOM 0 HD2 LYS A 476 -4.895 5.844 -7.484 1.00 0.00 H new ATOM 0 HD3 LYS A 476 -3.170 5.992 -7.214 1.00 0.00 H new ATOM 0 HE2 LYS A 476 -4.093 3.281 -8.027 1.00 0.00 H new ATOM 0 HE3 LYS A 476 -4.303 4.531 -9.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 476 -2.157 3.461 -9.445 1.00 0.00 H new ATOM 0 HZ2 LYS A 476 -1.952 5.093 -9.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 476 -1.749 3.882 -7.851 1.00 0.00 H new ATOM 452 N PHE A 477 -3.877 6.136 -2.311 1.00 0.00 N ATOM 453 CA PHE A 477 -4.944 6.376 -1.346 1.00 0.00 C ATOM 454 C PHE A 477 -4.557 7.476 -0.360 1.00 0.00 C ATOM 455 O PHE A 477 -5.071 7.527 0.757 1.00 0.00 O ATOM 456 CB PHE A 477 -5.275 5.086 -0.591 1.00 0.00 C ATOM 457 CG PHE A 477 -6.680 4.605 -0.812 1.00 0.00 C ATOM 458 CD1 PHE A 477 -7.732 5.142 -0.087 1.00 0.00 C ATOM 459 CD2 PHE A 477 -6.949 3.615 -1.744 1.00 0.00 C ATOM 460 CE1 PHE A 477 -9.027 4.701 -0.288 1.00 0.00 C ATOM 461 CE2 PHE A 477 -8.242 3.171 -1.949 1.00 0.00 C ATOM 462 CZ PHE A 477 -9.281 3.715 -1.220 1.00 0.00 C ATOM 0 H PHE A 477 -3.075 5.630 -1.936 1.00 0.00 H new ATOM 0 HA PHE A 477 -5.827 6.705 -1.894 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -4.580 4.305 -0.900 1.00 0.00 H new ATOM 0 HB3 PHE A 477 -5.119 5.249 0.475 1.00 0.00 H new ATOM 0 HD1 PHE A 477 -7.538 5.914 0.643 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -6.140 3.186 -2.316 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -9.838 5.127 0.283 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -8.439 2.399 -2.679 1.00 0.00 H new ATOM 0 HZ PHE A 477 -10.292 3.369 -1.379 1.00 0.00 H new ATOM 472 N GLN A 478 -3.651 8.354 -0.778 1.00 0.00 N ATOM 473 CA GLN A 478 -3.201 9.450 0.071 1.00 0.00 C ATOM 474 C GLN A 478 -3.312 10.785 -0.658 1.00 0.00 C ATOM 475 O GLN A 478 -4.048 11.676 -0.235 1.00 0.00 O ATOM 476 CB GLN A 478 -1.757 9.216 0.520 1.00 0.00 C ATOM 477 CG GLN A 478 -1.205 10.324 1.404 1.00 0.00 C ATOM 478 CD GLN A 478 -0.697 11.509 0.607 1.00 0.00 C ATOM 479 OE1 GLN A 478 0.088 11.351 -0.328 1.00 0.00 O ATOM 480 NE2 GLN A 478 -1.144 12.704 0.974 1.00 0.00 N ATOM 0 H GLN A 478 -3.214 8.327 -1.699 1.00 0.00 H new ATOM 0 HA GLN A 478 -3.845 9.484 0.950 1.00 0.00 H new ATOM 0 HB2 GLN A 478 -1.702 8.271 1.060 1.00 0.00 H new ATOM 0 HB3 GLN A 478 -1.123 9.117 -0.361 1.00 0.00 H new ATOM 0 HG2 GLN A 478 -1.984 10.659 2.089 1.00 0.00 H new ATOM 0 HG3 GLN A 478 -0.394 9.927 2.014 1.00 0.00 H new ATOM 0 HE21 GLN A 478 -1.794 12.787 1.755 1.00 0.00 H new ATOM 0 HE22 GLN A 478 -0.837 13.539 0.474 1.00 0.00 H new ATOM 489 N THR A 479 -2.576 10.916 -1.756 1.00 0.00 N ATOM 490 CA THR A 479 -2.592 12.143 -2.544 1.00 0.00 C ATOM 491 C THR A 479 -3.995 12.436 -3.064 1.00 0.00 C ATOM 492 O THR A 479 -4.378 13.594 -3.228 1.00 0.00 O ATOM 493 CB THR A 479 -1.613 12.036 -3.715 1.00 0.00 C ATOM 494 OG1 THR A 479 -2.003 11.000 -4.600 1.00 0.00 O ATOM 495 CG2 THR A 479 -0.190 11.760 -3.281 1.00 0.00 C ATOM 0 H THR A 479 -1.961 10.188 -2.121 1.00 0.00 H new ATOM 0 HA THR A 479 -2.284 12.965 -1.897 1.00 0.00 H new ATOM 0 HB THR A 479 -1.642 13.008 -4.208 1.00 0.00 H new ATOM 0 HG1 THR A 479 -1.839 10.131 -4.178 1.00 0.00 H new ATOM 0 HG21 THR A 479 0.452 11.696 -4.159 1.00 0.00 H new ATOM 0 HG22 THR A 479 0.157 12.567 -2.636 1.00 0.00 H new ATOM 0 HG23 THR A 479 -0.153 10.818 -2.735 1.00 0.00 H new ATOM 503 N LYS A 480 -4.758 11.379 -3.322 1.00 0.00 N ATOM 504 CA LYS A 480 -6.120 11.521 -3.822 1.00 0.00 C ATOM 505 C LYS A 480 -7.055 12.007 -2.720 1.00 0.00 C ATOM 506 O LYS A 480 -6.900 11.641 -1.555 1.00 0.00 O ATOM 507 CB LYS A 480 -6.621 10.190 -4.384 1.00 0.00 C ATOM 508 CG LYS A 480 -7.947 10.301 -5.121 1.00 0.00 C ATOM 509 CD LYS A 480 -8.431 8.943 -5.603 1.00 0.00 C ATOM 510 CE LYS A 480 -9.664 9.072 -6.482 1.00 0.00 C ATOM 511 NZ LYS A 480 -10.550 7.880 -6.376 1.00 0.00 N ATOM 0 H LYS A 480 -4.455 10.414 -3.193 1.00 0.00 H new ATOM 0 HA LYS A 480 -6.112 12.263 -4.620 1.00 0.00 H new ATOM 0 HB2 LYS A 480 -5.870 9.786 -5.063 1.00 0.00 H new ATOM 0 HB3 LYS A 480 -6.728 9.477 -3.566 1.00 0.00 H new ATOM 0 HG2 LYS A 480 -8.695 10.742 -4.462 1.00 0.00 H new ATOM 0 HG3 LYS A 480 -7.836 10.972 -5.973 1.00 0.00 H new ATOM 0 HD2 LYS A 480 -7.635 8.449 -6.160 1.00 0.00 H new ATOM 0 HD3 LYS A 480 -8.659 8.311 -4.745 1.00 0.00 H new ATOM 0 HE2 LYS A 480 -10.221 9.965 -6.197 1.00 0.00 H new ATOM 0 HE3 LYS A 480 -9.358 9.205 -7.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 480 -11.379 8.008 -6.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 480 -10.027 7.031 -6.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 480 -10.864 7.767 -5.391 1.00 0.00 H new ATOM 525 N LYS A 481 -8.027 12.832 -3.097 1.00 0.00 N ATOM 526 CA LYS A 481 -8.988 13.367 -2.138 1.00 0.00 C ATOM 527 C LYS A 481 -9.767 12.243 -1.462 1.00 0.00 C ATOM 528 O LYS A 481 -10.703 11.690 -2.039 1.00 0.00 O ATOM 529 CB LYS A 481 -9.955 14.325 -2.836 1.00 0.00 C ATOM 530 CG LYS A 481 -10.892 15.046 -1.882 1.00 0.00 C ATOM 531 CD LYS A 481 -11.884 15.920 -2.629 1.00 0.00 C ATOM 532 CE LYS A 481 -12.741 16.734 -1.673 1.00 0.00 C ATOM 533 NZ LYS A 481 -14.150 16.841 -2.143 1.00 0.00 N ATOM 0 H LYS A 481 -8.170 13.144 -4.057 1.00 0.00 H new ATOM 0 HA LYS A 481 -8.435 13.912 -1.373 1.00 0.00 H new ATOM 0 HB2 LYS A 481 -9.381 15.064 -3.396 1.00 0.00 H new ATOM 0 HB3 LYS A 481 -10.547 13.766 -3.561 1.00 0.00 H new ATOM 0 HG2 LYS A 481 -11.431 14.316 -1.279 1.00 0.00 H new ATOM 0 HG3 LYS A 481 -10.311 15.660 -1.194 1.00 0.00 H new ATOM 0 HD2 LYS A 481 -11.346 16.591 -3.299 1.00 0.00 H new ATOM 0 HD3 LYS A 481 -12.525 15.295 -3.251 1.00 0.00 H new ATOM 0 HE2 LYS A 481 -12.722 16.272 -0.686 1.00 0.00 H new ATOM 0 HE3 LYS A 481 -12.317 17.733 -1.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 481 -14.701 17.403 -1.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 481 -14.171 17.305 -3.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 481 -14.563 15.890 -2.220 1.00 0.00 H new ATOM 547 N THR A 482 -9.374 11.914 -0.236 1.00 0.00 N ATOM 548 CA THR A 482 -10.035 10.857 0.521 1.00 0.00 C ATOM 549 C THR A 482 -10.795 11.429 1.715 1.00 0.00 C ATOM 550 O THR A 482 -11.741 10.816 2.210 1.00 0.00 O ATOM 551 CB THR A 482 -9.010 9.827 1.001 1.00 0.00 C ATOM 552 OG1 THR A 482 -7.781 10.455 1.321 1.00 0.00 O ATOM 553 CG2 THR A 482 -8.723 8.748 -0.020 1.00 0.00 C ATOM 0 H THR A 482 -8.601 12.364 0.255 1.00 0.00 H new ATOM 0 HA THR A 482 -10.751 10.369 -0.140 1.00 0.00 H new ATOM 0 HB THR A 482 -9.457 9.362 1.880 1.00 0.00 H new ATOM 0 HG1 THR A 482 -7.139 9.781 1.627 1.00 0.00 H new ATOM 0 HG21 THR A 482 -7.989 8.051 0.384 1.00 0.00 H new ATOM 0 HG22 THR A 482 -9.643 8.212 -0.251 1.00 0.00 H new ATOM 0 HG23 THR A 482 -8.330 9.203 -0.929 1.00 0.00 H new ATOM 561 N GLY A 483 -10.374 12.604 2.176 1.00 0.00 N ATOM 562 CA GLY A 483 -11.028 13.233 3.308 1.00 0.00 C ATOM 563 C GLY A 483 -10.186 13.178 4.568 1.00 0.00 C ATOM 564 O GLY A 483 -10.318 14.027 5.449 1.00 0.00 O ATOM 0 H GLY A 483 -9.592 13.130 1.786 1.00 0.00 H new ATOM 0 HA2 GLY A 483 -11.246 14.273 3.066 1.00 0.00 H new ATOM 0 HA3 GLY A 483 -11.983 12.741 3.491 1.00 0.00 H new ATOM 568 N LEU A 484 -9.314 12.176 4.652 1.00 0.00 N ATOM 569 CA LEU A 484 -8.446 12.015 5.812 1.00 0.00 C ATOM 570 C LEU A 484 -7.045 12.540 5.517 1.00 0.00 C ATOM 571 O LEU A 484 -6.584 12.500 4.377 1.00 0.00 O ATOM 572 CB LEU A 484 -8.376 10.543 6.222 1.00 0.00 C ATOM 573 CG LEU A 484 -9.730 9.867 6.448 1.00 0.00 C ATOM 574 CD1 LEU A 484 -9.547 8.379 6.700 1.00 0.00 C ATOM 575 CD2 LEU A 484 -10.465 10.520 7.608 1.00 0.00 C ATOM 0 H LEU A 484 -9.191 11.465 3.931 1.00 0.00 H new ATOM 0 HA LEU A 484 -8.867 12.594 6.634 1.00 0.00 H new ATOM 0 HB2 LEU A 484 -7.837 9.992 5.451 1.00 0.00 H new ATOM 0 HB3 LEU A 484 -7.791 10.465 7.138 1.00 0.00 H new ATOM 0 HG LEU A 484 -10.332 9.991 5.548 1.00 0.00 H new ATOM 0 HD11 LEU A 484 -10.520 7.914 6.859 1.00 0.00 H new ATOM 0 HD12 LEU A 484 -9.062 7.921 5.838 1.00 0.00 H new ATOM 0 HD13 LEU A 484 -8.927 8.233 7.585 1.00 0.00 H new ATOM 0 HD21 LEU A 484 -11.426 10.026 7.754 1.00 0.00 H new ATOM 0 HD22 LEU A 484 -9.868 10.428 8.515 1.00 0.00 H new ATOM 0 HD23 LEU A 484 -10.629 11.575 7.387 1.00 0.00 H new ATOM 587 N SER A 485 -6.371 13.031 6.553 1.00 0.00 N ATOM 588 CA SER A 485 -5.021 13.564 6.405 1.00 0.00 C ATOM 589 C SER A 485 -4.075 12.502 5.852 1.00 0.00 C ATOM 590 O SER A 485 -4.338 11.305 5.961 1.00 0.00 O ATOM 591 CB SER A 485 -4.502 14.077 7.749 1.00 0.00 C ATOM 592 OG SER A 485 -5.397 15.018 8.315 1.00 0.00 O ATOM 0 H SER A 485 -6.738 13.071 7.504 1.00 0.00 H new ATOM 0 HA SER A 485 -5.060 14.393 5.699 1.00 0.00 H new ATOM 0 HB2 SER A 485 -4.368 13.240 8.434 1.00 0.00 H new ATOM 0 HB3 SER A 485 -3.523 14.537 7.613 1.00 0.00 H new ATOM 0 HG SER A 485 -5.044 15.330 9.174 1.00 0.00 H new ATOM 598 N SER A 486 -2.974 12.950 5.257 1.00 0.00 N ATOM 599 CA SER A 486 -1.988 12.039 4.686 1.00 0.00 C ATOM 600 C SER A 486 -1.451 11.081 5.744 1.00 0.00 C ATOM 601 O SER A 486 -1.227 9.902 5.473 1.00 0.00 O ATOM 602 CB SER A 486 -0.835 12.827 4.064 1.00 0.00 C ATOM 603 OG SER A 486 -0.020 11.992 3.261 1.00 0.00 O ATOM 0 H SER A 486 -2.742 13.938 5.158 1.00 0.00 H new ATOM 0 HA SER A 486 -2.481 11.453 3.910 1.00 0.00 H new ATOM 0 HB2 SER A 486 -1.232 13.642 3.459 1.00 0.00 H new ATOM 0 HB3 SER A 486 -0.233 13.279 4.852 1.00 0.00 H new ATOM 0 HG SER A 486 0.587 12.544 2.726 1.00 0.00 H new ATOM 609 N GLU A 487 -1.246 11.596 6.952 1.00 0.00 N ATOM 610 CA GLU A 487 -0.734 10.785 8.051 1.00 0.00 C ATOM 611 C GLU A 487 -1.796 9.811 8.551 1.00 0.00 C ATOM 612 O GLU A 487 -1.492 8.669 8.892 1.00 0.00 O ATOM 613 CB GLU A 487 -0.265 11.682 9.199 1.00 0.00 C ATOM 614 CG GLU A 487 -1.388 12.468 9.856 1.00 0.00 C ATOM 615 CD GLU A 487 -0.886 13.437 10.910 1.00 0.00 C ATOM 616 OE1 GLU A 487 0.304 13.347 11.281 1.00 0.00 O ATOM 617 OE2 GLU A 487 -1.683 14.284 11.366 1.00 0.00 O ATOM 0 H GLU A 487 -1.426 12.570 7.195 1.00 0.00 H new ATOM 0 HA GLU A 487 0.114 10.209 7.680 1.00 0.00 H new ATOM 0 HB2 GLU A 487 0.225 11.066 9.953 1.00 0.00 H new ATOM 0 HB3 GLU A 487 0.483 12.380 8.822 1.00 0.00 H new ATOM 0 HG2 GLU A 487 -1.935 13.020 9.092 1.00 0.00 H new ATOM 0 HG3 GLU A 487 -2.093 11.774 10.313 1.00 0.00 H new ATOM 624 N GLN A 488 -3.042 10.271 8.589 1.00 0.00 N ATOM 625 CA GLN A 488 -4.149 9.438 9.047 1.00 0.00 C ATOM 626 C GLN A 488 -4.340 8.233 8.132 1.00 0.00 C ATOM 627 O GLN A 488 -4.596 7.123 8.598 1.00 0.00 O ATOM 628 CB GLN A 488 -5.440 10.257 9.106 1.00 0.00 C ATOM 629 CG GLN A 488 -5.419 11.351 10.162 1.00 0.00 C ATOM 630 CD GLN A 488 -5.298 10.800 11.569 1.00 0.00 C ATOM 631 OE1 GLN A 488 -6.029 9.888 11.957 1.00 0.00 O ATOM 632 NE2 GLN A 488 -4.371 11.352 12.343 1.00 0.00 N ATOM 0 H GLN A 488 -3.311 11.214 8.309 1.00 0.00 H new ATOM 0 HA GLN A 488 -3.909 9.077 10.047 1.00 0.00 H new ATOM 0 HB2 GLN A 488 -5.619 10.709 8.130 1.00 0.00 H new ATOM 0 HB3 GLN A 488 -6.277 9.587 9.305 1.00 0.00 H new ATOM 0 HG2 GLN A 488 -4.584 12.024 9.966 1.00 0.00 H new ATOM 0 HG3 GLN A 488 -6.331 11.943 10.085 1.00 0.00 H new ATOM 0 HE21 GLN A 488 -3.787 12.106 11.981 1.00 0.00 H new ATOM 0 HE22 GLN A 488 -4.243 11.022 13.300 1.00 0.00 H new ATOM 641 N THR A 489 -4.212 8.459 6.829 1.00 0.00 N ATOM 642 CA THR A 489 -4.371 7.390 5.850 1.00 0.00 C ATOM 643 C THR A 489 -3.321 6.304 6.057 1.00 0.00 C ATOM 644 O THR A 489 -3.629 5.114 6.012 1.00 0.00 O ATOM 645 CB THR A 489 -4.267 7.949 4.430 1.00 0.00 C ATOM 646 OG1 THR A 489 -5.236 8.962 4.217 1.00 0.00 O ATOM 647 CG2 THR A 489 -4.458 6.898 3.357 1.00 0.00 C ATOM 0 H THR A 489 -3.999 9.372 6.427 1.00 0.00 H new ATOM 0 HA THR A 489 -5.358 6.949 5.988 1.00 0.00 H new ATOM 0 HB THR A 489 -3.255 8.347 4.350 1.00 0.00 H new ATOM 0 HG1 THR A 489 -5.008 9.750 4.753 1.00 0.00 H new ATOM 0 HG21 THR A 489 -4.372 7.362 2.374 1.00 0.00 H new ATOM 0 HG22 THR A 489 -3.695 6.127 3.463 1.00 0.00 H new ATOM 0 HG23 THR A 489 -5.445 6.448 3.461 1.00 0.00 H new ATOM 655 N VAL A 490 -2.080 6.722 6.280 1.00 0.00 N ATOM 656 CA VAL A 490 -0.985 5.783 6.491 1.00 0.00 C ATOM 657 C VAL A 490 -1.216 4.944 7.743 1.00 0.00 C ATOM 658 O VAL A 490 -0.963 3.740 7.750 1.00 0.00 O ATOM 659 CB VAL A 490 0.366 6.513 6.615 1.00 0.00 C ATOM 660 CG1 VAL A 490 1.512 5.514 6.692 1.00 0.00 C ATOM 661 CG2 VAL A 490 0.566 7.473 5.452 1.00 0.00 C ATOM 0 H VAL A 490 -1.807 7.704 6.319 1.00 0.00 H new ATOM 0 HA VAL A 490 -0.955 5.129 5.619 1.00 0.00 H new ATOM 0 HB VAL A 490 0.357 7.093 7.538 1.00 0.00 H new ATOM 0 HG11 VAL A 490 2.457 6.050 6.779 1.00 0.00 H new ATOM 0 HG12 VAL A 490 1.377 4.872 7.563 1.00 0.00 H new ATOM 0 HG13 VAL A 490 1.523 4.903 5.789 1.00 0.00 H new ATOM 0 HG21 VAL A 490 1.526 7.978 5.558 1.00 0.00 H new ATOM 0 HG22 VAL A 490 0.551 6.917 4.515 1.00 0.00 H new ATOM 0 HG23 VAL A 490 -0.235 8.212 5.449 1.00 0.00 H new ATOM 671 N ASN A 491 -1.693 5.588 8.803 1.00 0.00 N ATOM 672 CA ASN A 491 -1.954 4.899 10.063 1.00 0.00 C ATOM 673 C ASN A 491 -2.997 3.801 9.883 1.00 0.00 C ATOM 674 O ASN A 491 -2.789 2.661 10.298 1.00 0.00 O ATOM 675 CB ASN A 491 -2.424 5.895 11.124 1.00 0.00 C ATOM 676 CG ASN A 491 -1.353 6.907 11.481 1.00 0.00 C ATOM 677 OD1 ASN A 491 -0.184 6.740 11.135 1.00 0.00 O ATOM 678 ND2 ASN A 491 -1.749 7.967 12.178 1.00 0.00 N ATOM 0 H ASN A 491 -1.907 6.585 8.815 1.00 0.00 H new ATOM 0 HA ASN A 491 -1.023 4.437 10.392 1.00 0.00 H new ATOM 0 HB2 ASN A 491 -3.308 6.419 10.761 1.00 0.00 H new ATOM 0 HB3 ASN A 491 -2.721 5.353 12.021 1.00 0.00 H new ATOM 0 HD21 ASN A 491 -1.073 8.682 12.447 1.00 0.00 H new ATOM 0 HD22 ASN A 491 -2.729 8.065 12.444 1.00 0.00 H new ATOM 685 N VAL A 492 -4.120 4.150 9.264 1.00 0.00 N ATOM 686 CA VAL A 492 -5.195 3.192 9.033 1.00 0.00 C ATOM 687 C VAL A 492 -4.839 2.222 7.911 1.00 0.00 C ATOM 688 O VAL A 492 -4.993 1.009 8.053 1.00 0.00 O ATOM 689 CB VAL A 492 -6.517 3.904 8.682 1.00 0.00 C ATOM 690 CG1 VAL A 492 -7.656 2.900 8.576 1.00 0.00 C ATOM 691 CG2 VAL A 492 -6.836 4.977 9.711 1.00 0.00 C ATOM 0 H VAL A 492 -4.309 5.089 8.913 1.00 0.00 H new ATOM 0 HA VAL A 492 -5.326 2.635 9.961 1.00 0.00 H new ATOM 0 HB VAL A 492 -6.400 4.387 7.712 1.00 0.00 H new ATOM 0 HG11 VAL A 492 -8.580 3.423 8.328 1.00 0.00 H new ATOM 0 HG12 VAL A 492 -7.429 2.173 7.796 1.00 0.00 H new ATOM 0 HG13 VAL A 492 -7.776 2.384 9.529 1.00 0.00 H new ATOM 0 HG21 VAL A 492 -7.772 5.468 9.446 1.00 0.00 H new ATOM 0 HG22 VAL A 492 -6.932 4.520 10.696 1.00 0.00 H new ATOM 0 HG23 VAL A 492 -6.033 5.713 9.730 1.00 0.00 H new ATOM 701 N LEU A 493 -4.365 2.766 6.795 1.00 0.00 N ATOM 702 CA LEU A 493 -3.991 1.950 5.645 1.00 0.00 C ATOM 703 C LEU A 493 -2.894 0.956 6.015 1.00 0.00 C ATOM 704 O LEU A 493 -2.870 -0.168 5.514 1.00 0.00 O ATOM 705 CB LEU A 493 -3.524 2.841 4.492 1.00 0.00 C ATOM 706 CG LEU A 493 -3.363 2.132 3.148 1.00 0.00 C ATOM 707 CD1 LEU A 493 -4.717 1.699 2.606 1.00 0.00 C ATOM 708 CD2 LEU A 493 -2.654 3.037 2.152 1.00 0.00 C ATOM 0 H LEU A 493 -4.231 3.768 6.662 1.00 0.00 H new ATOM 0 HA LEU A 493 -4.870 1.389 5.328 1.00 0.00 H new ATOM 0 HB2 LEU A 493 -4.237 3.656 4.372 1.00 0.00 H new ATOM 0 HB3 LEU A 493 -2.569 3.290 4.765 1.00 0.00 H new ATOM 0 HG LEU A 493 -2.754 1.241 3.299 1.00 0.00 H new ATOM 0 HD11 LEU A 493 -4.582 1.196 1.648 1.00 0.00 H new ATOM 0 HD12 LEU A 493 -5.190 1.015 3.311 1.00 0.00 H new ATOM 0 HD13 LEU A 493 -5.351 2.575 2.469 1.00 0.00 H new ATOM 0 HD21 LEU A 493 -2.547 2.517 1.200 1.00 0.00 H new ATOM 0 HD22 LEU A 493 -3.238 3.945 2.006 1.00 0.00 H new ATOM 0 HD23 LEU A 493 -1.668 3.298 2.536 1.00 0.00 H new ATOM 720 N ALA A 494 -1.991 1.372 6.895 1.00 0.00 N ATOM 721 CA ALA A 494 -0.900 0.508 7.327 1.00 0.00 C ATOM 722 C ALA A 494 -1.437 -0.717 8.057 1.00 0.00 C ATOM 723 O ALA A 494 -0.923 -1.823 7.899 1.00 0.00 O ATOM 724 CB ALA A 494 0.066 1.275 8.216 1.00 0.00 C ATOM 0 H ALA A 494 -1.993 2.298 7.322 1.00 0.00 H new ATOM 0 HA ALA A 494 -0.362 0.169 6.441 1.00 0.00 H new ATOM 0 HB1 ALA A 494 0.875 0.615 8.530 1.00 0.00 H new ATOM 0 HB2 ALA A 494 0.480 2.117 7.662 1.00 0.00 H new ATOM 0 HB3 ALA A 494 -0.463 1.644 9.095 1.00 0.00 H new ATOM 730 N GLN A 495 -2.478 -0.508 8.855 1.00 0.00 N ATOM 731 CA GLN A 495 -3.094 -1.592 9.611 1.00 0.00 C ATOM 732 C GLN A 495 -3.888 -2.512 8.690 1.00 0.00 C ATOM 733 O GLN A 495 -3.848 -3.734 8.832 1.00 0.00 O ATOM 734 CB GLN A 495 -4.008 -1.027 10.699 1.00 0.00 C ATOM 735 CG GLN A 495 -3.275 -0.197 11.739 1.00 0.00 C ATOM 736 CD GLN A 495 -2.229 -0.997 12.492 1.00 0.00 C ATOM 737 OE1 GLN A 495 -2.509 -2.083 13.000 1.00 0.00 O ATOM 738 NE2 GLN A 495 -1.016 -0.461 12.567 1.00 0.00 N ATOM 0 H GLN A 495 -2.914 0.404 8.995 1.00 0.00 H new ATOM 0 HA GLN A 495 -2.300 -2.173 10.080 1.00 0.00 H new ATOM 0 HB2 GLN A 495 -4.777 -0.412 10.232 1.00 0.00 H new ATOM 0 HB3 GLN A 495 -4.518 -1.851 11.198 1.00 0.00 H new ATOM 0 HG2 GLN A 495 -2.796 0.651 11.250 1.00 0.00 H new ATOM 0 HG3 GLN A 495 -3.996 0.210 12.448 1.00 0.00 H new ATOM 0 HE21 GLN A 495 -0.830 0.442 12.131 1.00 0.00 H new ATOM 0 HE22 GLN A 495 -0.271 -0.952 13.061 1.00 0.00 H new ATOM 747 N ILE A 496 -4.609 -1.918 7.744 1.00 0.00 N ATOM 748 CA ILE A 496 -5.411 -2.685 6.801 1.00 0.00 C ATOM 749 C ILE A 496 -4.520 -3.508 5.874 1.00 0.00 C ATOM 750 O ILE A 496 -4.822 -4.661 5.565 1.00 0.00 O ATOM 751 CB ILE A 496 -6.335 -1.759 5.969 1.00 0.00 C ATOM 752 CG1 ILE A 496 -7.706 -2.410 5.779 1.00 0.00 C ATOM 753 CG2 ILE A 496 -5.716 -1.415 4.618 1.00 0.00 C ATOM 754 CD1 ILE A 496 -8.679 -1.556 4.997 1.00 0.00 C ATOM 0 H ILE A 496 -4.653 -0.908 7.611 1.00 0.00 H new ATOM 0 HA ILE A 496 -6.037 -3.365 7.378 1.00 0.00 H new ATOM 0 HB ILE A 496 -6.458 -0.828 6.522 1.00 0.00 H new ATOM 0 HG12 ILE A 496 -7.578 -3.363 5.266 1.00 0.00 H new ATOM 0 HG13 ILE A 496 -8.133 -2.630 6.757 1.00 0.00 H new ATOM 0 HG21 ILE A 496 -6.392 -0.765 4.063 1.00 0.00 H new ATOM 0 HG22 ILE A 496 -4.766 -0.904 4.773 1.00 0.00 H new ATOM 0 HG23 ILE A 496 -5.547 -2.331 4.051 1.00 0.00 H new ATOM 0 HD11 ILE A 496 -9.629 -2.081 4.902 1.00 0.00 H new ATOM 0 HD12 ILE A 496 -8.837 -0.613 5.520 1.00 0.00 H new ATOM 0 HD13 ILE A 496 -8.273 -1.358 4.005 1.00 0.00 H new ATOM 766 N LEU A 497 -3.419 -2.906 5.440 1.00 0.00 N ATOM 767 CA LEU A 497 -2.475 -3.576 4.555 1.00 0.00 C ATOM 768 C LEU A 497 -1.654 -4.606 5.317 1.00 0.00 C ATOM 769 O LEU A 497 -1.448 -5.719 4.838 1.00 0.00 O ATOM 770 CB LEU A 497 -1.547 -2.554 3.895 1.00 0.00 C ATOM 771 CG LEU A 497 -2.010 -2.044 2.529 1.00 0.00 C ATOM 772 CD1 LEU A 497 -1.471 -0.647 2.270 1.00 0.00 C ATOM 773 CD2 LEU A 497 -1.569 -3.000 1.428 1.00 0.00 C ATOM 0 H LEU A 497 -3.158 -1.952 5.688 1.00 0.00 H new ATOM 0 HA LEU A 497 -3.044 -4.091 3.781 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -1.436 -1.702 4.565 1.00 0.00 H new ATOM 0 HB3 LEU A 497 -0.560 -3.002 3.783 1.00 0.00 H new ATOM 0 HG LEU A 497 -3.099 -1.996 2.529 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -1.811 -0.301 1.294 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -1.834 0.032 3.042 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -0.381 -0.668 2.288 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -1.906 -2.623 0.462 1.00 0.00 H new ATOM 0 HD22 LEU A 497 -0.482 -3.078 1.428 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -2.003 -3.984 1.605 1.00 0.00 H new ATOM 785 N LYS A 498 -1.190 -4.233 6.508 1.00 0.00 N ATOM 786 CA LYS A 498 -0.383 -5.129 7.335 1.00 0.00 C ATOM 787 C LYS A 498 -1.011 -6.516 7.427 1.00 0.00 C ATOM 788 O LYS A 498 -0.320 -7.528 7.314 1.00 0.00 O ATOM 789 CB LYS A 498 -0.214 -4.547 8.739 1.00 0.00 C ATOM 790 CG LYS A 498 0.660 -5.397 9.649 1.00 0.00 C ATOM 791 CD LYS A 498 -0.157 -6.063 10.745 1.00 0.00 C ATOM 792 CE LYS A 498 -0.717 -7.400 10.288 1.00 0.00 C ATOM 793 NZ LYS A 498 -0.821 -8.371 11.411 1.00 0.00 N ATOM 0 H LYS A 498 -1.359 -3.316 6.922 1.00 0.00 H new ATOM 0 HA LYS A 498 0.594 -5.225 6.862 1.00 0.00 H new ATOM 0 HB2 LYS A 498 0.219 -3.550 8.660 1.00 0.00 H new ATOM 0 HB3 LYS A 498 -1.197 -4.432 9.196 1.00 0.00 H new ATOM 0 HG2 LYS A 498 1.168 -6.159 9.059 1.00 0.00 H new ATOM 0 HG3 LYS A 498 1.433 -4.774 10.098 1.00 0.00 H new ATOM 0 HD2 LYS A 498 0.467 -6.211 11.626 1.00 0.00 H new ATOM 0 HD3 LYS A 498 -0.975 -5.406 11.040 1.00 0.00 H new ATOM 0 HE2 LYS A 498 -1.702 -7.249 9.846 1.00 0.00 H new ATOM 0 HE3 LYS A 498 -0.078 -7.814 9.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 498 -1.207 -9.270 11.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 498 0.122 -8.535 11.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 498 -1.451 -7.988 12.144 1.00 0.00 H new ATOM 807 N ARG A 499 -2.322 -6.558 7.629 1.00 0.00 N ATOM 808 CA ARG A 499 -3.036 -7.826 7.730 1.00 0.00 C ATOM 809 C ARG A 499 -3.288 -8.430 6.349 1.00 0.00 C ATOM 810 O ARG A 499 -3.617 -9.610 6.229 1.00 0.00 O ATOM 811 CB ARG A 499 -4.365 -7.629 8.464 1.00 0.00 C ATOM 812 CG ARG A 499 -5.353 -6.753 7.710 1.00 0.00 C ATOM 813 CD ARG A 499 -6.601 -6.484 8.536 1.00 0.00 C ATOM 814 NE ARG A 499 -7.298 -7.718 8.894 1.00 0.00 N ATOM 815 CZ ARG A 499 -8.540 -7.756 9.369 1.00 0.00 C ATOM 816 NH1 ARG A 499 -9.226 -6.634 9.546 1.00 0.00 N ATOM 817 NH2 ARG A 499 -9.099 -8.921 9.669 1.00 0.00 N ATOM 0 H ARG A 499 -2.912 -5.731 7.726 1.00 0.00 H new ATOM 0 HA ARG A 499 -2.412 -8.518 8.296 1.00 0.00 H new ATOM 0 HB2 ARG A 499 -4.819 -8.603 8.643 1.00 0.00 H new ATOM 0 HB3 ARG A 499 -4.169 -7.184 9.440 1.00 0.00 H new ATOM 0 HG2 ARG A 499 -4.877 -5.808 7.449 1.00 0.00 H new ATOM 0 HG3 ARG A 499 -5.632 -7.239 6.775 1.00 0.00 H new ATOM 0 HD2 ARG A 499 -6.326 -5.947 9.444 1.00 0.00 H new ATOM 0 HD3 ARG A 499 -7.275 -5.837 7.974 1.00 0.00 H new ATOM 0 HE ARG A 499 -6.803 -8.602 8.772 1.00 0.00 H new ATOM 0 HH11 ARG A 499 -8.801 -5.735 9.317 1.00 0.00 H new ATOM 0 HH12 ARG A 499 -10.178 -6.670 9.911 1.00 0.00 H new ATOM 0 HH21 ARG A 499 -8.577 -9.787 9.535 1.00 0.00 H new ATOM 0 HH22 ARG A 499 -10.051 -8.951 10.033 1.00 0.00 H new ATOM 831 N LEU A 500 -3.143 -7.612 5.310 1.00 0.00 N ATOM 832 CA LEU A 500 -3.364 -8.063 3.941 1.00 0.00 C ATOM 833 C LEU A 500 -2.457 -9.235 3.583 1.00 0.00 C ATOM 834 O LEU A 500 -2.903 -10.216 2.986 1.00 0.00 O ATOM 835 CB LEU A 500 -3.154 -6.907 2.962 1.00 0.00 C ATOM 836 CG LEU A 500 -3.953 -7.007 1.662 1.00 0.00 C ATOM 837 CD1 LEU A 500 -4.176 -5.625 1.065 1.00 0.00 C ATOM 838 CD2 LEU A 500 -3.242 -7.911 0.667 1.00 0.00 C ATOM 0 H LEU A 500 -2.873 -6.632 5.391 1.00 0.00 H new ATOM 0 HA LEU A 500 -4.395 -8.409 3.867 1.00 0.00 H new ATOM 0 HB2 LEU A 500 -3.418 -5.975 3.462 1.00 0.00 H new ATOM 0 HB3 LEU A 500 -2.094 -6.848 2.716 1.00 0.00 H new ATOM 0 HG LEU A 500 -4.926 -7.444 1.888 1.00 0.00 H new ATOM 0 HD11 LEU A 500 -4.746 -5.716 0.140 1.00 0.00 H new ATOM 0 HD12 LEU A 500 -4.729 -5.008 1.773 1.00 0.00 H new ATOM 0 HD13 LEU A 500 -3.213 -5.160 0.853 1.00 0.00 H new ATOM 0 HD21 LEU A 500 -3.825 -7.970 -0.252 1.00 0.00 H new ATOM 0 HD22 LEU A 500 -2.256 -7.503 0.445 1.00 0.00 H new ATOM 0 HD23 LEU A 500 -3.135 -8.908 1.094 1.00 0.00 H new ATOM 850 N ASN A 501 -1.189 -9.133 3.953 1.00 0.00 N ATOM 851 CA ASN A 501 -0.223 -10.191 3.672 1.00 0.00 C ATOM 852 C ASN A 501 -0.158 -10.500 2.177 1.00 0.00 C ATOM 853 O ASN A 501 -0.351 -11.643 1.761 1.00 0.00 O ATOM 854 CB ASN A 501 -0.587 -11.456 4.453 1.00 0.00 C ATOM 855 CG ASN A 501 0.634 -12.183 4.985 1.00 0.00 C ATOM 856 OD1 ASN A 501 0.627 -12.690 6.107 1.00 0.00 O ATOM 857 ND2 ASN A 501 1.690 -12.239 4.182 1.00 0.00 N ATOM 0 H ASN A 501 -0.803 -8.330 4.449 1.00 0.00 H new ATOM 0 HA ASN A 501 0.760 -9.842 3.988 1.00 0.00 H new ATOM 0 HB2 ASN A 501 -1.239 -11.190 5.285 1.00 0.00 H new ATOM 0 HB3 ASN A 501 -1.153 -12.127 3.807 1.00 0.00 H new ATOM 0 HD21 ASN A 501 2.538 -12.716 4.488 1.00 0.00 H new ATOM 0 HD22 ASN A 501 1.653 -11.805 3.260 1.00 0.00 H new ATOM 864 N PRO A 502 0.124 -9.483 1.344 1.00 0.00 N ATOM 865 CA PRO A 502 0.221 -9.657 -0.107 1.00 0.00 C ATOM 866 C PRO A 502 1.529 -10.320 -0.521 1.00 0.00 C ATOM 867 O PRO A 502 2.544 -10.191 0.164 1.00 0.00 O ATOM 868 CB PRO A 502 0.162 -8.224 -0.632 1.00 0.00 C ATOM 869 CG PRO A 502 0.745 -7.400 0.464 1.00 0.00 C ATOM 870 CD PRO A 502 0.376 -8.087 1.752 1.00 0.00 C ATOM 0 HA PRO A 502 -0.564 -10.305 -0.498 1.00 0.00 H new ATOM 0 HB2 PRO A 502 0.731 -8.116 -1.555 1.00 0.00 H new ATOM 0 HB3 PRO A 502 -0.863 -7.924 -0.852 1.00 0.00 H new ATOM 0 HG2 PRO A 502 1.827 -7.325 0.360 1.00 0.00 H new ATOM 0 HG3 PRO A 502 0.351 -6.384 0.438 1.00 0.00 H new ATOM 0 HD2 PRO A 502 1.180 -8.023 2.485 1.00 0.00 H new ATOM 0 HD3 PRO A 502 -0.506 -7.637 2.207 1.00 0.00 H new ATOM 878 N GLU A 503 1.502 -11.030 -1.644 1.00 0.00 N ATOM 879 CA GLU A 503 2.692 -11.709 -2.144 1.00 0.00 C ATOM 880 C GLU A 503 3.810 -10.709 -2.419 1.00 0.00 C ATOM 881 O GLU A 503 3.577 -9.647 -2.994 1.00 0.00 O ATOM 882 CB GLU A 503 2.363 -12.490 -3.419 1.00 0.00 C ATOM 883 CG GLU A 503 1.328 -13.585 -3.213 1.00 0.00 C ATOM 884 CD GLU A 503 1.078 -14.395 -4.470 1.00 0.00 C ATOM 885 OE1 GLU A 503 1.529 -13.968 -5.553 1.00 0.00 O ATOM 886 OE2 GLU A 503 0.430 -15.459 -4.370 1.00 0.00 O ATOM 0 H GLU A 503 0.671 -11.150 -2.224 1.00 0.00 H new ATOM 0 HA GLU A 503 3.032 -12.407 -1.379 1.00 0.00 H new ATOM 0 HB2 GLU A 503 1.999 -11.796 -4.176 1.00 0.00 H new ATOM 0 HB3 GLU A 503 3.278 -12.936 -3.808 1.00 0.00 H new ATOM 0 HG2 GLU A 503 1.662 -14.250 -2.417 1.00 0.00 H new ATOM 0 HG3 GLU A 503 0.391 -13.137 -2.882 1.00 0.00 H new ATOM 893 N ARG A 504 5.024 -11.054 -2.003 1.00 0.00 N ATOM 894 CA ARG A 504 6.175 -10.183 -2.204 1.00 0.00 C ATOM 895 C ARG A 504 7.138 -10.776 -3.228 1.00 0.00 C ATOM 896 O ARG A 504 7.676 -11.866 -3.030 1.00 0.00 O ATOM 897 CB ARG A 504 6.902 -9.947 -0.878 1.00 0.00 C ATOM 898 CG ARG A 504 7.210 -11.227 -0.116 1.00 0.00 C ATOM 899 CD ARG A 504 8.488 -11.096 0.697 1.00 0.00 C ATOM 900 NE ARG A 504 9.246 -12.344 0.730 1.00 0.00 N ATOM 901 CZ ARG A 504 10.530 -12.423 1.070 1.00 0.00 C ATOM 902 NH1 ARG A 504 11.202 -11.329 1.407 1.00 0.00 N ATOM 903 NH2 ARG A 504 11.144 -13.599 1.074 1.00 0.00 N ATOM 0 H ARG A 504 5.236 -11.930 -1.525 1.00 0.00 H new ATOM 0 HA ARG A 504 5.812 -9.229 -2.586 1.00 0.00 H new ATOM 0 HB2 ARG A 504 7.834 -9.417 -1.074 1.00 0.00 H new ATOM 0 HB3 ARG A 504 6.292 -9.298 -0.250 1.00 0.00 H new ATOM 0 HG2 ARG A 504 6.378 -11.466 0.547 1.00 0.00 H new ATOM 0 HG3 ARG A 504 7.307 -12.055 -0.818 1.00 0.00 H new ATOM 0 HD2 ARG A 504 9.108 -10.306 0.273 1.00 0.00 H new ATOM 0 HD3 ARG A 504 8.241 -10.795 1.715 1.00 0.00 H new ATOM 0 HE ARG A 504 8.763 -13.206 0.477 1.00 0.00 H new ATOM 0 HH11 ARG A 504 10.734 -10.423 1.406 1.00 0.00 H new ATOM 0 HH12 ARG A 504 12.186 -11.395 1.667 1.00 0.00 H new ATOM 0 HH21 ARG A 504 10.632 -14.443 0.816 1.00 0.00 H new ATOM 0 HH22 ARG A 504 12.128 -13.660 1.335 1.00 0.00 H new ATOM 917 N LYS A 505 7.352 -10.050 -4.320 1.00 0.00 N ATOM 918 CA LYS A 505 8.251 -10.502 -5.376 1.00 0.00 C ATOM 919 C LYS A 505 9.198 -9.383 -5.796 1.00 0.00 C ATOM 920 O LYS A 505 8.824 -8.212 -5.810 1.00 0.00 O ATOM 921 CB LYS A 505 7.449 -10.987 -6.584 1.00 0.00 C ATOM 922 CG LYS A 505 6.544 -12.170 -6.278 1.00 0.00 C ATOM 923 CD LYS A 505 5.854 -12.683 -7.532 1.00 0.00 C ATOM 924 CE LYS A 505 4.836 -13.763 -7.206 1.00 0.00 C ATOM 925 NZ LYS A 505 3.447 -13.228 -7.182 1.00 0.00 N ATOM 0 H LYS A 505 6.915 -9.146 -4.497 1.00 0.00 H new ATOM 0 HA LYS A 505 8.843 -11.330 -4.987 1.00 0.00 H new ATOM 0 HB2 LYS A 505 6.842 -10.164 -6.961 1.00 0.00 H new ATOM 0 HB3 LYS A 505 8.139 -11.265 -7.380 1.00 0.00 H new ATOM 0 HG2 LYS A 505 7.131 -12.972 -5.830 1.00 0.00 H new ATOM 0 HG3 LYS A 505 5.794 -11.876 -5.544 1.00 0.00 H new ATOM 0 HD2 LYS A 505 5.358 -11.856 -8.040 1.00 0.00 H new ATOM 0 HD3 LYS A 505 6.599 -13.080 -8.222 1.00 0.00 H new ATOM 0 HE2 LYS A 505 4.905 -14.561 -7.945 1.00 0.00 H new ATOM 0 HE3 LYS A 505 5.072 -14.204 -6.237 1.00 0.00 H new ATOM 0 HZ1 LYS A 505 2.859 -13.818 -6.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 505 3.457 -12.251 -6.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 505 3.053 -13.241 -8.145 1.00 0.00 H new ATOM 939 N MET A 506 10.428 -9.753 -6.137 1.00 0.00 N ATOM 940 CA MET A 506 11.429 -8.778 -6.557 1.00 0.00 C ATOM 941 C MET A 506 11.391 -8.576 -8.068 1.00 0.00 C ATOM 942 O MET A 506 11.731 -9.477 -8.835 1.00 0.00 O ATOM 943 CB MET A 506 12.825 -9.233 -6.127 1.00 0.00 C ATOM 944 CG MET A 506 13.004 -9.303 -4.619 1.00 0.00 C ATOM 945 SD MET A 506 14.708 -9.648 -4.138 1.00 0.00 S ATOM 946 CE MET A 506 15.490 -8.082 -4.515 1.00 0.00 C ATOM 0 H MET A 506 10.756 -10.719 -6.131 1.00 0.00 H new ATOM 0 HA MET A 506 11.199 -7.827 -6.076 1.00 0.00 H new ATOM 0 HB2 MET A 506 13.026 -10.215 -6.554 1.00 0.00 H new ATOM 0 HB3 MET A 506 13.565 -8.548 -6.541 1.00 0.00 H new ATOM 0 HG2 MET A 506 12.689 -8.358 -4.175 1.00 0.00 H new ATOM 0 HG3 MET A 506 12.352 -10.078 -4.215 1.00 0.00 H new ATOM 0 HE1 MET A 506 16.452 -8.024 -4.007 1.00 0.00 H new ATOM 0 HE2 MET A 506 15.643 -8.001 -5.591 1.00 0.00 H new ATOM 0 HE3 MET A 506 14.852 -7.266 -4.177 1.00 0.00 H new ATOM 956 N ILE A 507 10.976 -7.386 -8.489 1.00 0.00 N ATOM 957 CA ILE A 507 10.894 -7.063 -9.909 1.00 0.00 C ATOM 958 C ILE A 507 11.800 -5.885 -10.255 1.00 0.00 C ATOM 959 O ILE A 507 11.649 -4.792 -9.708 1.00 0.00 O ATOM 960 CB ILE A 507 9.449 -6.727 -10.327 1.00 0.00 C ATOM 961 CG1 ILE A 507 8.492 -7.824 -9.858 1.00 0.00 C ATOM 962 CG2 ILE A 507 9.360 -6.549 -11.836 1.00 0.00 C ATOM 963 CD1 ILE A 507 7.036 -7.512 -10.131 1.00 0.00 C ATOM 0 H ILE A 507 10.691 -6.629 -7.867 1.00 0.00 H new ATOM 0 HA ILE A 507 11.224 -7.946 -10.456 1.00 0.00 H new ATOM 0 HB ILE A 507 9.159 -5.789 -9.853 1.00 0.00 H new ATOM 0 HG12 ILE A 507 8.754 -8.759 -10.352 1.00 0.00 H new ATOM 0 HG13 ILE A 507 8.627 -7.980 -8.788 1.00 0.00 H new ATOM 0 HG21 ILE A 507 8.333 -6.312 -12.114 1.00 0.00 H new ATOM 0 HG22 ILE A 507 10.017 -5.736 -12.146 1.00 0.00 H new ATOM 0 HG23 ILE A 507 9.666 -7.471 -12.330 1.00 0.00 H new ATOM 0 HD11 ILE A 507 6.415 -8.333 -9.773 1.00 0.00 H new ATOM 0 HD12 ILE A 507 6.758 -6.594 -9.614 1.00 0.00 H new ATOM 0 HD13 ILE A 507 6.886 -7.385 -11.203 1.00 0.00 H new ATOM 975 N ASN A 508 12.740 -6.115 -11.166 1.00 0.00 N ATOM 976 CA ASN A 508 13.670 -5.071 -11.585 1.00 0.00 C ATOM 977 C ASN A 508 14.446 -4.523 -10.391 1.00 0.00 C ATOM 978 O ASN A 508 14.634 -3.314 -10.260 1.00 0.00 O ATOM 979 CB ASN A 508 12.917 -3.938 -12.284 1.00 0.00 C ATOM 980 CG ASN A 508 12.719 -4.201 -13.764 1.00 0.00 C ATOM 981 OD1 ASN A 508 13.044 -3.362 -14.604 1.00 0.00 O ATOM 982 ND2 ASN A 508 12.182 -5.371 -14.091 1.00 0.00 N ATOM 0 H ASN A 508 12.878 -7.014 -11.628 1.00 0.00 H new ATOM 0 HA ASN A 508 14.380 -5.511 -12.285 1.00 0.00 H new ATOM 0 HB2 ASN A 508 11.945 -3.804 -11.809 1.00 0.00 H new ATOM 0 HB3 ASN A 508 13.467 -3.006 -12.154 1.00 0.00 H new ATOM 0 HD21 ASN A 508 12.024 -5.603 -15.072 1.00 0.00 H new ATOM 0 HD22 ASN A 508 11.928 -6.037 -13.362 1.00 0.00 H new ATOM 989 N ASP A 509 14.895 -5.423 -9.522 1.00 0.00 N ATOM 990 CA ASP A 509 15.650 -5.033 -8.337 1.00 0.00 C ATOM 991 C ASP A 509 14.825 -4.105 -7.450 1.00 0.00 C ATOM 992 O ASP A 509 15.356 -3.169 -6.849 1.00 0.00 O ATOM 993 CB ASP A 509 16.955 -4.344 -8.742 1.00 0.00 C ATOM 994 CG ASP A 509 17.896 -5.277 -9.479 1.00 0.00 C ATOM 995 OD1 ASP A 509 17.701 -6.508 -9.395 1.00 0.00 O ATOM 996 OD2 ASP A 509 18.829 -4.776 -10.141 1.00 0.00 O ATOM 0 H ASP A 509 14.749 -6.428 -9.617 1.00 0.00 H new ATOM 0 HA ASP A 509 15.884 -5.935 -7.771 1.00 0.00 H new ATOM 0 HB2 ASP A 509 16.729 -3.486 -9.375 1.00 0.00 H new ATOM 0 HB3 ASP A 509 17.452 -3.960 -7.851 1.00 0.00 H new ATOM 1001 N LYS A 510 13.526 -4.370 -7.372 1.00 0.00 N ATOM 1002 CA LYS A 510 12.626 -3.561 -6.558 1.00 0.00 C ATOM 1003 C LYS A 510 11.592 -4.436 -5.858 1.00 0.00 C ATOM 1004 O LYS A 510 11.236 -5.508 -6.348 1.00 0.00 O ATOM 1005 CB LYS A 510 11.923 -2.516 -7.425 1.00 0.00 C ATOM 1006 CG LYS A 510 12.871 -1.503 -8.048 1.00 0.00 C ATOM 1007 CD LYS A 510 12.117 -0.434 -8.821 1.00 0.00 C ATOM 1008 CE LYS A 510 13.068 0.508 -9.541 1.00 0.00 C ATOM 1009 NZ LYS A 510 12.338 1.511 -10.365 1.00 0.00 N ATOM 0 H LYS A 510 13.072 -5.140 -7.863 1.00 0.00 H new ATOM 0 HA LYS A 510 13.220 -3.053 -5.798 1.00 0.00 H new ATOM 0 HB2 LYS A 510 11.375 -3.024 -8.219 1.00 0.00 H new ATOM 0 HB3 LYS A 510 11.188 -1.988 -6.818 1.00 0.00 H new ATOM 0 HG2 LYS A 510 13.469 -1.034 -7.266 1.00 0.00 H new ATOM 0 HG3 LYS A 510 13.564 -2.015 -8.715 1.00 0.00 H new ATOM 0 HD2 LYS A 510 11.454 -0.907 -9.545 1.00 0.00 H new ATOM 0 HD3 LYS A 510 11.488 0.135 -8.137 1.00 0.00 H new ATOM 0 HE2 LYS A 510 13.691 1.023 -8.810 1.00 0.00 H new ATOM 0 HE3 LYS A 510 13.737 -0.069 -10.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 510 13.022 2.134 -10.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 510 11.763 1.021 -11.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 510 11.719 2.079 -9.752 1.00 0.00 H new ATOM 1023 N MET A 511 11.110 -3.970 -4.710 1.00 0.00 N ATOM 1024 CA MET A 511 10.116 -4.711 -3.943 1.00 0.00 C ATOM 1025 C MET A 511 8.704 -4.362 -4.404 1.00 0.00 C ATOM 1026 O MET A 511 8.274 -3.213 -4.303 1.00 0.00 O ATOM 1027 CB MET A 511 10.266 -4.413 -2.450 1.00 0.00 C ATOM 1028 CG MET A 511 9.386 -5.281 -1.565 1.00 0.00 C ATOM 1029 SD MET A 511 9.419 -4.767 0.164 1.00 0.00 S ATOM 1030 CE MET A 511 11.140 -5.053 0.569 1.00 0.00 C ATOM 0 H MET A 511 11.392 -3.084 -4.291 1.00 0.00 H new ATOM 0 HA MET A 511 10.282 -5.775 -4.112 1.00 0.00 H new ATOM 0 HB2 MET A 511 11.308 -4.554 -2.163 1.00 0.00 H new ATOM 0 HB3 MET A 511 10.026 -3.365 -2.271 1.00 0.00 H new ATOM 0 HG2 MET A 511 8.360 -5.244 -1.932 1.00 0.00 H new ATOM 0 HG3 MET A 511 9.714 -6.318 -1.638 1.00 0.00 H new ATOM 0 HE1 MET A 511 11.269 -5.023 1.651 1.00 0.00 H new ATOM 0 HE2 MET A 511 11.445 -6.030 0.194 1.00 0.00 H new ATOM 0 HE3 MET A 511 11.755 -4.280 0.109 1.00 0.00 H new ATOM 1040 N HIS A 512 7.988 -5.361 -4.909 1.00 0.00 N ATOM 1041 CA HIS A 512 6.624 -5.159 -5.385 1.00 0.00 C ATOM 1042 C HIS A 512 5.669 -6.158 -4.740 1.00 0.00 C ATOM 1043 O HIS A 512 6.043 -7.295 -4.455 1.00 0.00 O ATOM 1044 CB HIS A 512 6.569 -5.294 -6.908 1.00 0.00 C ATOM 1045 CG HIS A 512 7.191 -4.142 -7.634 1.00 0.00 C ATOM 1046 ND1 HIS A 512 6.696 -2.921 -7.947 1.00 0.00 N flip ATOM 1047 CD2 HIS A 512 8.477 -4.172 -8.133 1.00 0.00 C flip ATOM 1048 CE1 HIS A 512 7.683 -2.243 -8.621 1.00 0.00 C flip ATOM 1049 NE2 HIS A 512 8.746 -3.018 -8.719 1.00 0.00 N flip ATOM 0 H HIS A 512 8.329 -6.318 -4.999 1.00 0.00 H new ATOM 0 HA HIS A 512 6.313 -4.153 -5.104 1.00 0.00 H new ATOM 0 HB2 HIS A 512 7.075 -6.214 -7.201 1.00 0.00 H new ATOM 0 HB3 HIS A 512 5.529 -5.390 -7.219 1.00 0.00 H new ATOM 0 HD1 HIS A 512 5.765 -2.570 -7.724 1.00 0.00 H new ATOM 0 HD2 HIS A 512 9.157 -5.007 -8.057 1.00 0.00 H new ATOM 0 HE1 HIS A 512 7.602 -1.238 -9.008 1.00 0.00 H new ATOM 1058 N PHE A 513 4.433 -5.725 -4.513 1.00 0.00 N ATOM 1059 CA PHE A 513 3.423 -6.581 -3.902 1.00 0.00 C ATOM 1060 C PHE A 513 2.404 -7.044 -4.939 1.00 0.00 C ATOM 1061 O PHE A 513 1.891 -6.241 -5.718 1.00 0.00 O ATOM 1062 CB PHE A 513 2.713 -5.838 -2.769 1.00 0.00 C ATOM 1063 CG PHE A 513 3.636 -5.395 -1.670 1.00 0.00 C ATOM 1064 CD1 PHE A 513 3.952 -6.250 -0.625 1.00 0.00 C ATOM 1065 CD2 PHE A 513 4.185 -4.124 -1.680 1.00 0.00 C ATOM 1066 CE1 PHE A 513 4.799 -5.844 0.388 1.00 0.00 C ATOM 1067 CE2 PHE A 513 5.034 -3.712 -0.671 1.00 0.00 C ATOM 1068 CZ PHE A 513 5.341 -4.572 0.365 1.00 0.00 C ATOM 0 H PHE A 513 4.107 -4.786 -4.743 1.00 0.00 H new ATOM 0 HA PHE A 513 3.924 -7.459 -3.494 1.00 0.00 H new ATOM 0 HB2 PHE A 513 2.206 -4.965 -3.180 1.00 0.00 H new ATOM 0 HB3 PHE A 513 1.944 -6.485 -2.347 1.00 0.00 H new ATOM 0 HD1 PHE A 513 3.531 -7.244 -0.603 1.00 0.00 H new ATOM 0 HD2 PHE A 513 3.947 -3.446 -2.486 1.00 0.00 H new ATOM 0 HE1 PHE A 513 5.038 -6.519 1.197 1.00 0.00 H new ATOM 0 HE2 PHE A 513 5.457 -2.719 -0.692 1.00 0.00 H new ATOM 0 HZ PHE A 513 6.003 -4.252 1.156 1.00 0.00 H new ATOM 1078 N SER A 514 2.117 -8.341 -4.942 1.00 0.00 N ATOM 1079 CA SER A 514 1.159 -8.909 -5.884 1.00 0.00 C ATOM 1080 C SER A 514 0.103 -9.734 -5.155 1.00 0.00 C ATOM 1081 O SER A 514 0.354 -10.268 -4.074 1.00 0.00 O ATOM 1082 CB SER A 514 1.880 -9.779 -6.915 1.00 0.00 C ATOM 1083 OG SER A 514 2.479 -10.907 -6.302 1.00 0.00 O ATOM 0 H SER A 514 2.533 -9.019 -4.303 1.00 0.00 H new ATOM 0 HA SER A 514 0.661 -8.086 -6.398 1.00 0.00 H new ATOM 0 HB2 SER A 514 1.172 -10.108 -7.676 1.00 0.00 H new ATOM 0 HB3 SER A 514 2.643 -9.189 -7.423 1.00 0.00 H new ATOM 0 HG SER A 514 3.327 -10.642 -5.888 1.00 0.00 H new ATOM 1089 N LEU A 515 -1.080 -9.834 -5.752 1.00 0.00 N ATOM 1090 CA LEU A 515 -2.174 -10.594 -5.160 1.00 0.00 C ATOM 1091 C LEU A 515 -2.840 -11.491 -6.197 1.00 0.00 C ATOM 1092 O LEU A 515 -2.958 -11.126 -7.366 1.00 0.00 O ATOM 1093 CB LEU A 515 -3.210 -9.648 -4.550 1.00 0.00 C ATOM 1094 CG LEU A 515 -2.876 -9.139 -3.146 1.00 0.00 C ATOM 1095 CD1 LEU A 515 -4.011 -8.283 -2.606 1.00 0.00 C ATOM 1096 CD2 LEU A 515 -2.595 -10.305 -2.211 1.00 0.00 C ATOM 0 H LEU A 515 -1.305 -9.398 -6.646 1.00 0.00 H new ATOM 0 HA LEU A 515 -1.758 -11.224 -4.374 1.00 0.00 H new ATOM 0 HB2 LEU A 515 -3.330 -8.790 -5.212 1.00 0.00 H new ATOM 0 HB3 LEU A 515 -4.171 -10.161 -4.515 1.00 0.00 H new ATOM 0 HG LEU A 515 -1.979 -8.522 -3.206 1.00 0.00 H new ATOM 0 HD11 LEU A 515 -3.757 -7.930 -1.607 1.00 0.00 H new ATOM 0 HD12 LEU A 515 -4.167 -7.428 -3.264 1.00 0.00 H new ATOM 0 HD13 LEU A 515 -4.924 -8.877 -2.559 1.00 0.00 H new ATOM 0 HD21 LEU A 515 -2.359 -9.925 -1.217 1.00 0.00 H new ATOM 0 HD22 LEU A 515 -3.474 -10.947 -2.155 1.00 0.00 H new ATOM 0 HD23 LEU A 515 -1.750 -10.880 -2.590 1.00 0.00 H new ATOM 1108 N LYS A 516 -3.277 -12.668 -5.758 1.00 0.00 N ATOM 1109 CA LYS A 516 -3.935 -13.618 -6.646 1.00 0.00 C ATOM 1110 C LYS A 516 -5.221 -14.145 -6.017 1.00 0.00 C ATOM 1111 O LYS A 516 -5.198 -15.100 -5.241 1.00 0.00 O ATOM 1112 CB LYS A 516 -2.996 -14.782 -6.970 1.00 0.00 C ATOM 1113 CG LYS A 516 -3.564 -15.756 -7.989 1.00 0.00 C ATOM 1114 CD LYS A 516 -2.567 -16.852 -8.328 1.00 0.00 C ATOM 1115 CE LYS A 516 -2.355 -17.794 -7.154 1.00 0.00 C ATOM 1116 NZ LYS A 516 -3.549 -18.648 -6.903 1.00 0.00 N ATOM 0 H LYS A 516 -3.187 -12.985 -4.793 1.00 0.00 H new ATOM 0 HA LYS A 516 -4.189 -13.099 -7.571 1.00 0.00 H new ATOM 0 HB2 LYS A 516 -2.054 -14.384 -7.346 1.00 0.00 H new ATOM 0 HB3 LYS A 516 -2.769 -15.322 -6.051 1.00 0.00 H new ATOM 0 HG2 LYS A 516 -4.478 -16.203 -7.597 1.00 0.00 H new ATOM 0 HG3 LYS A 516 -3.836 -15.217 -8.896 1.00 0.00 H new ATOM 0 HD2 LYS A 516 -2.924 -17.417 -9.189 1.00 0.00 H new ATOM 0 HD3 LYS A 516 -1.615 -16.404 -8.613 1.00 0.00 H new ATOM 0 HE2 LYS A 516 -1.490 -18.428 -7.349 1.00 0.00 H new ATOM 0 HE3 LYS A 516 -2.129 -17.214 -6.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 -3.304 -19.397 -6.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 -4.317 -18.065 -6.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 -3.862 -19.079 -7.796 1.00 0.00 H new ATOM 1130 N GLU A 517 -6.341 -13.516 -6.358 1.00 0.00 N ATOM 1131 CA GLU A 517 -7.636 -13.921 -5.826 1.00 0.00 C ATOM 1132 C GLU A 517 -8.393 -14.782 -6.833 1.00 0.00 C ATOM 1133 O GLU A 517 -8.264 -14.520 -8.048 1.00 0.00 O ATOM 1134 CB GLU A 517 -8.469 -12.691 -5.462 1.00 0.00 C ATOM 1135 CG GLU A 517 -9.779 -13.027 -4.767 1.00 0.00 C ATOM 1136 CD GLU A 517 -10.631 -11.800 -4.497 1.00 0.00 C ATOM 1137 OE1 GLU A 517 -10.211 -10.688 -4.881 1.00 0.00 O ATOM 1138 OE2 GLU A 517 -11.718 -11.954 -3.901 1.00 0.00 O ATOM 1139 OXT GLU A 517 -9.107 -15.710 -6.398 1.00 0.00 O ATOM 0 H GLU A 517 -6.377 -12.724 -7.000 1.00 0.00 H new ATOM 0 HA GLU A 517 -7.462 -14.512 -4.927 1.00 0.00 H new ATOM 0 HB2 GLU A 517 -7.880 -12.042 -4.814 1.00 0.00 H new ATOM 0 HB3 GLU A 517 -8.683 -12.126 -6.369 1.00 0.00 H new ATOM 0 HG2 GLU A 517 -10.343 -13.727 -5.383 1.00 0.00 H new ATOM 0 HG3 GLU A 517 -9.566 -13.531 -3.824 1.00 0.00 H new ATOM 1187 N GLU B 945 8.776 13.413 3.911 1.00 0.00 N ATOM 1188 CA GLU B 945 7.660 12.619 4.412 1.00 0.00 C ATOM 1189 C GLU B 945 7.279 11.528 3.417 1.00 0.00 C ATOM 1190 O GLU B 945 6.799 10.461 3.802 1.00 0.00 O ATOM 1191 CB GLU B 945 6.453 13.517 4.689 1.00 0.00 C ATOM 1192 CG GLU B 945 5.290 12.788 5.344 1.00 0.00 C ATOM 1193 CD GLU B 945 4.068 13.670 5.516 1.00 0.00 C ATOM 1194 OE1 GLU B 945 4.114 14.841 5.082 1.00 0.00 O ATOM 1195 OE2 GLU B 945 3.066 13.190 6.085 1.00 0.00 O ATOM 0 HA GLU B 945 7.972 12.144 5.342 1.00 0.00 H new ATOM 0 HB2 GLU B 945 6.763 14.341 5.332 1.00 0.00 H new ATOM 0 HB3 GLU B 945 6.114 13.956 3.751 1.00 0.00 H new ATOM 0 HG2 GLU B 945 5.024 11.920 4.740 1.00 0.00 H new ATOM 0 HG3 GLU B 945 5.603 12.414 6.319 1.00 0.00 H new ATOM 1202 N ALA B 946 7.494 11.802 2.134 1.00 0.00 N ATOM 1203 CA ALA B 946 7.172 10.846 1.083 1.00 0.00 C ATOM 1204 C ALA B 946 7.996 9.571 1.227 1.00 0.00 C ATOM 1205 O ALA B 946 7.489 8.467 1.028 1.00 0.00 O ATOM 1206 CB ALA B 946 7.398 11.474 -0.285 1.00 0.00 C ATOM 0 H ALA B 946 7.890 12.680 1.798 1.00 0.00 H new ATOM 0 HA ALA B 946 6.120 10.577 1.179 1.00 0.00 H new ATOM 0 HB1 ALA B 946 7.154 10.750 -1.062 1.00 0.00 H new ATOM 0 HB2 ALA B 946 6.760 12.351 -0.393 1.00 0.00 H new ATOM 0 HB3 ALA B 946 8.442 11.771 -0.381 1.00 0.00 H new ATOM 1212 N ASP B 947 9.268 9.730 1.575 1.00 0.00 N ATOM 1213 CA ASP B 947 10.163 8.590 1.745 1.00 0.00 C ATOM 1214 C ASP B 947 9.693 7.689 2.882 1.00 0.00 C ATOM 1215 O ASP B 947 9.648 6.467 2.741 1.00 0.00 O ATOM 1216 CB ASP B 947 11.589 9.071 2.017 1.00 0.00 C ATOM 1217 CG ASP B 947 12.196 9.789 0.827 1.00 0.00 C ATOM 1218 OD1 ASP B 947 11.656 9.649 -0.290 1.00 0.00 O ATOM 1219 OD2 ASP B 947 13.213 10.491 1.013 1.00 0.00 O ATOM 0 H ASP B 947 9.703 10.637 1.745 1.00 0.00 H new ATOM 0 HA ASP B 947 10.150 8.012 0.821 1.00 0.00 H new ATOM 0 HB2 ASP B 947 11.586 9.740 2.878 1.00 0.00 H new ATOM 0 HB3 ASP B 947 12.213 8.217 2.279 1.00 0.00 H new ATOM 1224 N GLU B 948 9.343 8.299 4.009 1.00 0.00 N ATOM 1225 CA GLU B 948 8.877 7.551 5.172 1.00 0.00 C ATOM 1226 C GLU B 948 7.449 7.053 4.966 1.00 0.00 C ATOM 1227 O GLU B 948 7.047 6.042 5.541 1.00 0.00 O ATOM 1228 CB GLU B 948 8.951 8.421 6.428 1.00 0.00 C ATOM 1229 CG GLU B 948 8.017 9.619 6.395 1.00 0.00 C ATOM 1230 CD GLU B 948 8.184 10.521 7.602 1.00 0.00 C ATOM 1231 OE1 GLU B 948 7.789 10.107 8.712 1.00 0.00 O ATOM 1232 OE2 GLU B 948 8.710 11.642 7.437 1.00 0.00 O ATOM 0 H GLU B 948 9.373 9.310 4.142 1.00 0.00 H new ATOM 0 HA GLU B 948 9.528 6.686 5.299 1.00 0.00 H new ATOM 0 HB2 GLU B 948 8.713 7.809 7.298 1.00 0.00 H new ATOM 0 HB3 GLU B 948 9.975 8.773 6.556 1.00 0.00 H new ATOM 0 HG2 GLU B 948 8.202 10.194 5.488 1.00 0.00 H new ATOM 0 HG3 GLU B 948 6.986 9.270 6.347 1.00 0.00 H new ATOM 1239 N MET B 949 6.687 7.769 4.145 1.00 0.00 N ATOM 1240 CA MET B 949 5.303 7.397 3.867 1.00 0.00 C ATOM 1241 C MET B 949 5.218 5.978 3.314 1.00 0.00 C ATOM 1242 O MET B 949 4.306 5.223 3.653 1.00 0.00 O ATOM 1243 CB MET B 949 4.678 8.382 2.876 1.00 0.00 C ATOM 1244 CG MET B 949 3.228 8.072 2.542 1.00 0.00 C ATOM 1245 SD MET B 949 2.618 9.028 1.139 1.00 0.00 S ATOM 1246 CE MET B 949 2.143 10.554 1.948 1.00 0.00 C ATOM 0 H MET B 949 7.004 8.609 3.661 1.00 0.00 H new ATOM 0 HA MET B 949 4.749 7.434 4.805 1.00 0.00 H new ATOM 0 HB2 MET B 949 4.740 9.389 3.290 1.00 0.00 H new ATOM 0 HB3 MET B 949 5.263 8.379 1.956 1.00 0.00 H new ATOM 0 HG2 MET B 949 3.129 7.009 2.323 1.00 0.00 H new ATOM 0 HG3 MET B 949 2.607 8.277 3.414 1.00 0.00 H new ATOM 0 HE1 MET B 949 1.897 11.303 1.196 1.00 0.00 H new ATOM 0 HE2 MET B 949 1.273 10.375 2.580 1.00 0.00 H new ATOM 0 HE3 MET B 949 2.970 10.913 2.561 1.00 0.00 H new ATOM 1256 N ALA B 950 6.172 5.622 2.461 1.00 0.00 N ATOM 1257 CA ALA B 950 6.204 4.293 1.861 1.00 0.00 C ATOM 1258 C ALA B 950 6.923 3.297 2.763 1.00 0.00 C ATOM 1259 O ALA B 950 6.455 2.177 2.965 1.00 0.00 O ATOM 1260 CB ALA B 950 6.871 4.348 0.495 1.00 0.00 C ATOM 0 H ALA B 950 6.933 6.235 2.169 1.00 0.00 H new ATOM 0 HA ALA B 950 5.176 3.953 1.739 1.00 0.00 H new ATOM 0 HB1 ALA B 950 6.888 3.350 0.058 1.00 0.00 H new ATOM 0 HB2 ALA B 950 6.311 5.019 -0.156 1.00 0.00 H new ATOM 0 HB3 ALA B 950 7.892 4.715 0.603 1.00 0.00 H new ATOM 1266 N LYS B 951 8.067 3.711 3.302 1.00 0.00 N ATOM 1267 CA LYS B 951 8.852 2.853 4.182 1.00 0.00 C ATOM 1268 C LYS B 951 8.035 2.418 5.395 1.00 0.00 C ATOM 1269 O LYS B 951 8.195 1.306 5.898 1.00 0.00 O ATOM 1270 CB LYS B 951 10.119 3.580 4.639 1.00 0.00 C ATOM 1271 CG LYS B 951 11.101 3.857 3.513 1.00 0.00 C ATOM 1272 CD LYS B 951 12.312 4.630 4.009 1.00 0.00 C ATOM 1273 CE LYS B 951 13.170 3.785 4.937 1.00 0.00 C ATOM 1274 NZ LYS B 951 14.407 4.500 5.353 1.00 0.00 N ATOM 0 H LYS B 951 8.470 4.635 3.144 1.00 0.00 H new ATOM 0 HA LYS B 951 9.134 1.962 3.621 1.00 0.00 H new ATOM 0 HB2 LYS B 951 9.838 4.524 5.105 1.00 0.00 H new ATOM 0 HB3 LYS B 951 10.615 2.982 5.404 1.00 0.00 H new ATOM 0 HG2 LYS B 951 11.425 2.915 3.071 1.00 0.00 H new ATOM 0 HG3 LYS B 951 10.604 4.424 2.726 1.00 0.00 H new ATOM 0 HD2 LYS B 951 12.909 4.958 3.158 1.00 0.00 H new ATOM 0 HD3 LYS B 951 11.983 5.527 4.533 1.00 0.00 H new ATOM 0 HE2 LYS B 951 12.592 3.515 5.821 1.00 0.00 H new ATOM 0 HE3 LYS B 951 13.439 2.855 4.436 1.00 0.00 H new ATOM 0 HZ1 LYS B 951 14.964 3.890 5.985 1.00 0.00 H new ATOM 0 HZ2 LYS B 951 14.972 4.735 4.512 1.00 0.00 H new ATOM 0 HZ3 LYS B 951 14.151 5.375 5.853 1.00 0.00 H new ATOM 1288 N ALA B 952 7.161 3.304 5.862 1.00 0.00 N ATOM 1289 CA ALA B 952 6.320 3.011 7.015 1.00 0.00 C ATOM 1290 C ALA B 952 5.263 1.966 6.675 1.00 0.00 C ATOM 1291 O ALA B 952 4.917 1.125 7.505 1.00 0.00 O ATOM 1292 CB ALA B 952 5.662 4.284 7.524 1.00 0.00 C ATOM 0 H ALA B 952 7.017 4.230 5.459 1.00 0.00 H new ATOM 0 HA ALA B 952 6.955 2.603 7.801 1.00 0.00 H new ATOM 0 HB1 ALA B 952 5.036 4.051 8.386 1.00 0.00 H new ATOM 0 HB2 ALA B 952 6.431 4.999 7.817 1.00 0.00 H new ATOM 0 HB3 ALA B 952 5.046 4.716 6.735 1.00 0.00 H new ATOM 1298 N LEU B 953 4.751 2.028 5.450 1.00 0.00 N ATOM 1299 CA LEU B 953 3.730 1.089 5.000 1.00 0.00 C ATOM 1300 C LEU B 953 4.316 -0.305 4.795 1.00 0.00 C ATOM 1301 O LEU B 953 3.743 -1.300 5.236 1.00 0.00 O ATOM 1302 CB LEU B 953 3.093 1.582 3.699 1.00 0.00 C ATOM 1303 CG LEU B 953 1.884 0.775 3.222 1.00 0.00 C ATOM 1304 CD1 LEU B 953 0.613 1.261 3.904 1.00 0.00 C ATOM 1305 CD2 LEU B 953 1.751 0.859 1.709 1.00 0.00 C ATOM 0 H LEU B 953 5.026 2.718 4.752 1.00 0.00 H new ATOM 0 HA LEU B 953 2.965 1.029 5.774 1.00 0.00 H new ATOM 0 HB2 LEU B 953 2.788 2.620 3.833 1.00 0.00 H new ATOM 0 HB3 LEU B 953 3.850 1.571 2.915 1.00 0.00 H new ATOM 0 HG LEU B 953 2.037 -0.269 3.494 1.00 0.00 H new ATOM 0 HD11 LEU B 953 -0.236 0.675 3.552 1.00 0.00 H new ATOM 0 HD12 LEU B 953 0.712 1.144 4.983 1.00 0.00 H new ATOM 0 HD13 LEU B 953 0.452 2.312 3.666 1.00 0.00 H new ATOM 0 HD21 LEU B 953 0.886 0.279 1.387 1.00 0.00 H new ATOM 0 HD22 LEU B 953 1.621 1.900 1.412 1.00 0.00 H new ATOM 0 HD23 LEU B 953 2.651 0.458 1.242 1.00 0.00 H new ATOM 1317 N GLU B 954 5.460 -0.368 4.120 1.00 0.00 N ATOM 1318 CA GLU B 954 6.120 -1.642 3.856 1.00 0.00 C ATOM 1319 C GLU B 954 6.693 -2.238 5.137 1.00 0.00 C ATOM 1320 O GLU B 954 6.751 -3.459 5.294 1.00 0.00 O ATOM 1321 CB GLU B 954 7.235 -1.459 2.823 1.00 0.00 C ATOM 1322 CG GLU B 954 8.344 -0.527 3.284 1.00 0.00 C ATOM 1323 CD GLU B 954 9.490 -1.268 3.947 1.00 0.00 C ATOM 1324 OE1 GLU B 954 9.303 -2.446 4.314 1.00 0.00 O ATOM 1325 OE2 GLU B 954 10.575 -0.668 4.099 1.00 0.00 O ATOM 0 H GLU B 954 5.948 0.446 3.747 1.00 0.00 H new ATOM 0 HA GLU B 954 5.374 -2.331 3.460 1.00 0.00 H new ATOM 0 HB2 GLU B 954 7.664 -2.433 2.588 1.00 0.00 H new ATOM 0 HB3 GLU B 954 6.804 -1.069 1.901 1.00 0.00 H new ATOM 0 HG2 GLU B 954 8.724 0.031 2.428 1.00 0.00 H new ATOM 0 HG3 GLU B 954 7.934 0.202 3.983 1.00 0.00 H new ATOM 1332 N ALA B 955 7.115 -1.372 6.051 1.00 0.00 N ATOM 1333 CA ALA B 955 7.684 -1.815 7.318 1.00 0.00 C ATOM 1334 C ALA B 955 6.669 -2.616 8.126 1.00 0.00 C ATOM 1335 O ALA B 955 7.015 -3.609 8.766 1.00 0.00 O ATOM 1336 CB ALA B 955 8.176 -0.621 8.121 1.00 0.00 C ATOM 0 H ALA B 955 7.074 -0.359 5.938 1.00 0.00 H new ATOM 0 HA ALA B 955 8.530 -2.466 7.100 1.00 0.00 H new ATOM 0 HB1 ALA B 955 8.598 -0.966 9.065 1.00 0.00 H new ATOM 0 HB2 ALA B 955 8.941 -0.091 7.553 1.00 0.00 H new ATOM 0 HB3 ALA B 955 7.342 0.051 8.321 1.00 0.00 H new ATOM 1342 N GLU B 956 5.415 -2.176 8.096 1.00 0.00 N ATOM 1343 CA GLU B 956 4.349 -2.852 8.827 1.00 0.00 C ATOM 1344 C GLU B 956 4.001 -4.189 8.179 1.00 0.00 C ATOM 1345 O GLU B 956 3.810 -5.192 8.867 1.00 0.00 O ATOM 1346 CB GLU B 956 3.105 -1.964 8.891 1.00 0.00 C ATOM 1347 CG GLU B 956 3.302 -0.698 9.708 1.00 0.00 C ATOM 1348 CD GLU B 956 3.795 -0.982 11.113 1.00 0.00 C ATOM 1349 OE1 GLU B 956 3.179 -1.825 11.799 1.00 0.00 O ATOM 1350 OE2 GLU B 956 4.797 -0.362 11.528 1.00 0.00 O ATOM 0 H GLU B 956 5.112 -1.354 7.573 1.00 0.00 H new ATOM 0 HA GLU B 956 4.705 -3.044 9.839 1.00 0.00 H new ATOM 0 HB2 GLU B 956 2.812 -1.690 7.877 1.00 0.00 H new ATOM 0 HB3 GLU B 956 2.282 -2.537 9.317 1.00 0.00 H new ATOM 0 HG2 GLU B 956 4.016 -0.050 9.200 1.00 0.00 H new ATOM 0 HG3 GLU B 956 2.359 -0.154 9.761 1.00 0.00 H new ATOM 1357 N LEU B 957 3.919 -4.195 6.853 1.00 0.00 N ATOM 1358 CA LEU B 957 3.590 -5.410 6.114 1.00 0.00 C ATOM 1359 C LEU B 957 4.727 -6.426 6.198 1.00 0.00 C ATOM 1360 O LEU B 957 4.500 -7.634 6.126 1.00 0.00 O ATOM 1361 CB LEU B 957 3.293 -5.080 4.650 1.00 0.00 C ATOM 1362 CG LEU B 957 2.476 -6.135 3.900 1.00 0.00 C ATOM 1363 CD1 LEU B 957 1.028 -6.113 4.363 1.00 0.00 C ATOM 1364 CD2 LEU B 957 2.562 -5.906 2.397 1.00 0.00 C ATOM 0 H LEU B 957 4.075 -3.374 6.268 1.00 0.00 H new ATOM 0 HA LEU B 957 2.701 -5.849 6.567 1.00 0.00 H new ATOM 0 HB2 LEU B 957 2.758 -4.131 4.609 1.00 0.00 H new ATOM 0 HB3 LEU B 957 4.238 -4.936 4.127 1.00 0.00 H new ATOM 0 HG LEU B 957 2.893 -7.118 4.121 1.00 0.00 H new ATOM 0 HD11 LEU B 957 0.461 -6.869 3.820 1.00 0.00 H new ATOM 0 HD12 LEU B 957 0.984 -6.325 5.431 1.00 0.00 H new ATOM 0 HD13 LEU B 957 0.599 -5.130 4.170 1.00 0.00 H new ATOM 0 HD21 LEU B 957 1.976 -6.665 1.879 1.00 0.00 H new ATOM 0 HD22 LEU B 957 2.170 -4.918 2.157 1.00 0.00 H new ATOM 0 HD23 LEU B 957 3.602 -5.971 2.078 1.00 0.00 H new ATOM 1376 N ASN B 958 5.950 -5.927 6.347 1.00 0.00 N ATOM 1377 CA ASN B 958 7.125 -6.789 6.437 1.00 0.00 C ATOM 1378 C ASN B 958 7.037 -7.728 7.641 1.00 0.00 C ATOM 1379 O ASN B 958 7.751 -8.728 7.708 1.00 0.00 O ATOM 1380 CB ASN B 958 8.395 -5.942 6.530 1.00 0.00 C ATOM 1381 CG ASN B 958 9.543 -6.530 5.732 1.00 0.00 C ATOM 1382 OD1 ASN B 958 10.287 -5.806 5.069 1.00 0.00 O ATOM 1383 ND2 ASN B 958 9.693 -7.848 5.792 1.00 0.00 N ATOM 0 H ASN B 958 6.154 -4.929 6.408 1.00 0.00 H new ATOM 0 HA ASN B 958 7.162 -7.398 5.534 1.00 0.00 H new ATOM 0 HB2 ASN B 958 8.184 -4.935 6.170 1.00 0.00 H new ATOM 0 HB3 ASN B 958 8.692 -5.851 7.575 1.00 0.00 H new ATOM 0 HD21 ASN B 958 10.448 -8.299 5.276 1.00 0.00 H new ATOM 0 HD22 ASN B 958 9.053 -8.409 6.354 1.00 0.00 H new ATOM 1390 N ASP B 959 6.165 -7.400 8.591 1.00 0.00 N ATOM 1391 CA ASP B 959 5.998 -8.217 9.787 1.00 0.00 C ATOM 1392 C ASP B 959 5.384 -9.571 9.447 1.00 0.00 C ATOM 1393 O ASP B 959 5.659 -10.571 10.111 1.00 0.00 O ATOM 1394 CB ASP B 959 5.122 -7.489 10.808 1.00 0.00 C ATOM 1395 CG ASP B 959 5.771 -6.222 11.330 1.00 0.00 C ATOM 1396 OD1 ASP B 959 7.002 -6.077 11.172 1.00 0.00 O ATOM 1397 OD2 ASP B 959 5.049 -5.377 11.899 1.00 0.00 O ATOM 0 H ASP B 959 5.565 -6.576 8.555 1.00 0.00 H new ATOM 0 HA ASP B 959 6.985 -8.387 10.218 1.00 0.00 H new ATOM 0 HB2 ASP B 959 4.165 -7.241 10.350 1.00 0.00 H new ATOM 0 HB3 ASP B 959 4.912 -8.157 11.644 1.00 0.00 H new ATOM 1402 N LEU B 960 4.552 -9.599 8.412 1.00 0.00 N ATOM 1403 CA LEU B 960 3.901 -10.834 7.988 1.00 0.00 C ATOM 1404 C LEU B 960 4.933 -11.891 7.609 1.00 0.00 C ATOM 1405 O LEU B 960 4.767 -13.074 7.910 1.00 0.00 O ATOM 1406 CB LEU B 960 2.972 -10.568 6.803 1.00 0.00 C ATOM 1407 CG LEU B 960 1.918 -9.482 7.036 1.00 0.00 C ATOM 1408 CD1 LEU B 960 1.798 -8.585 5.813 1.00 0.00 C ATOM 1409 CD2 LEU B 960 0.573 -10.107 7.378 1.00 0.00 C ATOM 0 H LEU B 960 4.312 -8.782 7.851 1.00 0.00 H new ATOM 0 HA LEU B 960 3.312 -11.208 8.826 1.00 0.00 H new ATOM 0 HB2 LEU B 960 3.578 -10.286 5.942 1.00 0.00 H new ATOM 0 HB3 LEU B 960 2.463 -11.497 6.544 1.00 0.00 H new ATOM 0 HG LEU B 960 2.235 -8.870 7.880 1.00 0.00 H new ATOM 0 HD11 LEU B 960 1.045 -7.819 5.996 1.00 0.00 H new ATOM 0 HD12 LEU B 960 2.759 -8.109 5.615 1.00 0.00 H new ATOM 0 HD13 LEU B 960 1.505 -9.183 4.950 1.00 0.00 H new ATOM 0 HD21 LEU B 960 -0.163 -9.320 7.540 1.00 0.00 H new ATOM 0 HD22 LEU B 960 0.248 -10.744 6.555 1.00 0.00 H new ATOM 0 HD23 LEU B 960 0.670 -10.705 8.284 1.00 0.00 H new ATOM 1421 N MET B 961 5.998 -11.456 6.946 1.00 0.00 N ATOM 1422 CA MET B 961 7.060 -12.361 6.522 1.00 0.00 C ATOM 1423 C MET B 961 6.510 -13.466 5.626 1.00 0.00 C ATOM 1424 O MET B 961 6.099 -14.515 6.165 1.00 0.00 O ATOM 1425 CB MET B 961 7.753 -12.974 7.740 1.00 0.00 C ATOM 1426 CG MET B 961 8.485 -11.956 8.600 1.00 0.00 C ATOM 1427 SD MET B 961 9.446 -12.724 9.919 1.00 0.00 S ATOM 1428 CE MET B 961 8.157 -13.578 10.823 1.00 0.00 C ATOM 1429 OXT MET B 961 6.494 -13.274 4.392 1.00 0.00 O ATOM 0 H MET B 961 6.149 -10.480 6.690 1.00 0.00 H new ATOM 0 HA MET B 961 7.787 -11.784 5.951 1.00 0.00 H new ATOM 0 HB2 MET B 961 7.010 -13.486 8.351 1.00 0.00 H new ATOM 0 HB3 MET B 961 8.463 -13.729 7.402 1.00 0.00 H new ATOM 0 HG2 MET B 961 9.149 -11.364 7.970 1.00 0.00 H new ATOM 0 HG3 MET B 961 7.761 -11.267 9.036 1.00 0.00 H new ATOM 0 HE1 MET B 961 8.529 -13.860 11.808 1.00 0.00 H new ATOM 0 HE2 MET B 961 7.295 -12.921 10.935 1.00 0.00 H new ATOM 0 HE3 MET B 961 7.862 -14.474 10.277 1.00 0.00 H new