USER MOD reduce.3.24.130724 H: found=0, std=0, add=700, rem=0, adj=22 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 491 ASN : amide:sc= 0 K(o=0,f=-1.6) USER MOD Set 1.2: A 495 GLN : amide:sc= 0 K(o=0,f=-0.92) USER MOD Set 2.1: A 468 MET CE :methyl 148:sc= -3.5! (180deg=-6.72!) USER MOD Set 2.2: A 476 LYS NZ :NH3+ -149:sc=-0.00163 (180deg=-0.0365) USER MOD Single : A 453 GLN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 455 THR OG1 : rot 180:sc= 0.21 USER MOD Single : A 462 TYR OH : rot 180:sc= 0 USER MOD Single : A 464 THR OG1 : rot -37:sc= 1.21 USER MOD Single : A 466 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 469 THR OG1 : rot 180:sc= -0.204 USER MOD Single : A 470 THR OG1 : rot 90:sc= -2.09 USER MOD Single : A 471 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 475 LYS NZ :NH3+ -172:sc= -1.52 (180deg=-1.52) USER MOD Single : A 478 GLN :FLIP amide:sc= 0.856 F(o=0,f=0.86) USER MOD Single : A 479 THR OG1 : rot -22:sc= 0.597 USER MOD Single : A 480 LYS NZ :NH3+ 165:sc= -0.178 (180deg=-0.681) USER MOD Single : A 481 LYS NZ :NH3+ 171:sc= -0.159 (180deg=-0.372) USER MOD Single : A 482 THR OG1 : rot -75:sc= 0.463 USER MOD Single : A 485 SER OG : rot 180:sc= -0.904 USER MOD Single : A 486 SER OG : rot 180:sc= -0.0971 USER MOD Single : A 488 GLN : amide:sc= -0.898 K(o=-0.9,f=-5.2!) USER MOD Single : A 489 THR OG1 : rot 74:sc= 1.17 USER MOD Single : A 498 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.24) USER MOD Single : A 501 ASN : amide:sc= -0.15 X(o=-0.15,f=0) USER MOD Single : A 505 LYS NZ :NH3+ -168:sc=-0.00486 (180deg=-0.114) USER MOD Single : A 506 MET CE :methyl -168:sc= -0.114 (180deg=-0.559) USER MOD Single : A 508 ASN : amide:sc= -0.206 X(o=-0.21,f=-0.34) USER MOD Single : A 510 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 511 MET CE :methyl 180:sc= -1.9 (180deg=-1.9) USER MOD Single : A 512 HIS : no HD1:sc= -2.44 X(o=-2.4,f=-2.7) USER MOD Single : A 514 SER OG : rot 180:sc= -1 USER MOD Single : A 516 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 949 MET CE :methyl -120:sc= -3.58! (180deg=-5.68!) USER MOD Single : B 951 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 958 ASN : amide:sc= -0.0454 X(o=-0.045,f=-0.045) USER MOD Single : B 961 MET CE :methyl 164:sc= -0.0164 (180deg=-0.275) USER MOD ----------------------------------------------------------------- ATOM 29 N GLN A 453 -13.492 6.672 0.563 1.00 0.00 N ATOM 30 CA GLN A 453 -12.664 6.069 1.603 1.00 0.00 C ATOM 31 C GLN A 453 -11.879 4.883 1.054 1.00 0.00 C ATOM 32 O GLN A 453 -12.179 4.374 -0.026 1.00 0.00 O ATOM 33 CB GLN A 453 -13.533 5.621 2.779 1.00 0.00 C ATOM 34 CG GLN A 453 -14.231 6.768 3.492 1.00 0.00 C ATOM 35 CD GLN A 453 -15.118 6.295 4.627 1.00 0.00 C ATOM 36 OE1 GLN A 453 -15.513 5.130 4.678 1.00 0.00 O ATOM 37 NE2 GLN A 453 -15.439 7.200 5.543 1.00 0.00 N ATOM 0 HA GLN A 453 -11.955 6.821 1.950 1.00 0.00 H new ATOM 0 HB2 GLN A 453 -14.284 4.918 2.418 1.00 0.00 H new ATOM 0 HB3 GLN A 453 -12.911 5.084 3.495 1.00 0.00 H new ATOM 0 HG2 GLN A 453 -13.482 7.457 3.884 1.00 0.00 H new ATOM 0 HG3 GLN A 453 -14.832 7.325 2.774 1.00 0.00 H new ATOM 0 HE21 GLN A 453 -15.089 8.155 5.461 1.00 0.00 H new ATOM 0 HE22 GLN A 453 -16.036 6.941 6.329 1.00 0.00 H new ATOM 46 N VAL A 454 -10.871 4.449 1.804 1.00 0.00 N ATOM 47 CA VAL A 454 -10.041 3.323 1.392 1.00 0.00 C ATOM 48 C VAL A 454 -10.513 2.027 2.044 1.00 0.00 C ATOM 49 O VAL A 454 -10.745 1.978 3.252 1.00 0.00 O ATOM 50 CB VAL A 454 -8.561 3.557 1.751 1.00 0.00 C ATOM 51 CG1 VAL A 454 -7.689 2.449 1.180 1.00 0.00 C ATOM 52 CG2 VAL A 454 -8.098 4.919 1.254 1.00 0.00 C ATOM 0 H VAL A 454 -10.609 4.860 2.700 1.00 0.00 H new ATOM 0 HA VAL A 454 -10.135 3.237 0.309 1.00 0.00 H new ATOM 0 HB VAL A 454 -8.464 3.540 2.837 1.00 0.00 H new ATOM 0 HG11 VAL A 454 -6.648 2.633 1.445 1.00 0.00 H new ATOM 0 HG12 VAL A 454 -8.004 1.490 1.591 1.00 0.00 H new ATOM 0 HG13 VAL A 454 -7.790 2.429 0.095 1.00 0.00 H new ATOM 0 HG21 VAL A 454 -7.050 5.066 1.517 1.00 0.00 H new ATOM 0 HG22 VAL A 454 -8.210 4.969 0.171 1.00 0.00 H new ATOM 0 HG23 VAL A 454 -8.701 5.700 1.717 1.00 0.00 H new ATOM 62 N THR A 455 -10.650 0.981 1.238 1.00 0.00 N ATOM 63 CA THR A 455 -11.093 -0.316 1.736 1.00 0.00 C ATOM 64 C THR A 455 -10.086 -1.408 1.384 1.00 0.00 C ATOM 65 O THR A 455 -9.333 -1.282 0.419 1.00 0.00 O ATOM 66 CB THR A 455 -12.465 -0.667 1.160 1.00 0.00 C ATOM 67 OG1 THR A 455 -12.355 -1.055 -0.197 1.00 0.00 O ATOM 68 CG2 THR A 455 -13.454 0.477 1.232 1.00 0.00 C ATOM 0 H THR A 455 -10.461 1.005 0.236 1.00 0.00 H new ATOM 0 HA THR A 455 -11.169 -0.253 2.822 1.00 0.00 H new ATOM 0 HB THR A 455 -12.836 -1.486 1.776 1.00 0.00 H new ATOM 0 HG1 THR A 455 -13.243 -1.277 -0.547 1.00 0.00 H new ATOM 0 HG21 THR A 455 -14.407 0.162 0.807 1.00 0.00 H new ATOM 0 HG22 THR A 455 -13.599 0.767 2.272 1.00 0.00 H new ATOM 0 HG23 THR A 455 -13.069 1.327 0.668 1.00 0.00 H new ATOM 76 N GLU A 456 -10.082 -2.478 2.172 1.00 0.00 N ATOM 77 CA GLU A 456 -9.169 -3.592 1.942 1.00 0.00 C ATOM 78 C GLU A 456 -9.490 -4.299 0.630 1.00 0.00 C ATOM 79 O GLU A 456 -8.590 -4.675 -0.121 1.00 0.00 O ATOM 80 CB GLU A 456 -9.245 -4.588 3.102 1.00 0.00 C ATOM 81 CG GLU A 456 -8.226 -5.712 3.007 1.00 0.00 C ATOM 82 CD GLU A 456 -8.382 -6.738 4.113 1.00 0.00 C ATOM 83 OE1 GLU A 456 -9.314 -6.592 4.934 1.00 0.00 O ATOM 84 OE2 GLU A 456 -7.572 -7.687 4.160 1.00 0.00 O ATOM 0 H GLU A 456 -10.700 -2.597 2.975 1.00 0.00 H new ATOM 0 HA GLU A 456 -8.157 -3.192 1.879 1.00 0.00 H new ATOM 0 HB2 GLU A 456 -9.097 -4.053 4.040 1.00 0.00 H new ATOM 0 HB3 GLU A 456 -10.246 -5.018 3.136 1.00 0.00 H new ATOM 0 HG2 GLU A 456 -8.326 -6.207 2.041 1.00 0.00 H new ATOM 0 HG3 GLU A 456 -7.222 -5.291 3.047 1.00 0.00 H new ATOM 91 N ASP A 457 -10.780 -4.476 0.360 1.00 0.00 N ATOM 92 CA ASP A 457 -11.221 -5.139 -0.862 1.00 0.00 C ATOM 93 C ASP A 457 -10.773 -4.362 -2.096 1.00 0.00 C ATOM 94 O ASP A 457 -10.357 -4.949 -3.095 1.00 0.00 O ATOM 95 CB ASP A 457 -12.743 -5.289 -0.865 1.00 0.00 C ATOM 96 CG ASP A 457 -13.234 -6.230 0.218 1.00 0.00 C ATOM 97 OD1 ASP A 457 -12.408 -6.993 0.761 1.00 0.00 O ATOM 98 OD2 ASP A 457 -14.446 -6.204 0.522 1.00 0.00 O ATOM 0 H ASP A 457 -11.537 -4.170 0.971 1.00 0.00 H new ATOM 0 HA ASP A 457 -10.765 -6.128 -0.893 1.00 0.00 H new ATOM 0 HB2 ASP A 457 -13.202 -4.310 -0.727 1.00 0.00 H new ATOM 0 HB3 ASP A 457 -13.067 -5.659 -1.838 1.00 0.00 H new ATOM 103 N ALA A 458 -10.861 -3.038 -2.020 1.00 0.00 N ATOM 104 CA ALA A 458 -10.465 -2.181 -3.132 1.00 0.00 C ATOM 105 C ALA A 458 -8.984 -2.350 -3.455 1.00 0.00 C ATOM 106 O ALA A 458 -8.604 -2.476 -4.618 1.00 0.00 O ATOM 107 CB ALA A 458 -10.776 -0.727 -2.813 1.00 0.00 C ATOM 0 H ALA A 458 -11.203 -2.535 -1.201 1.00 0.00 H new ATOM 0 HA ALA A 458 -11.037 -2.479 -4.011 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -10.475 -0.098 -3.651 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -11.846 -0.613 -2.640 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -10.230 -0.426 -1.919 1.00 0.00 H new ATOM 113 N VAL A 459 -8.154 -2.349 -2.418 1.00 0.00 N ATOM 114 CA VAL A 459 -6.714 -2.502 -2.592 1.00 0.00 C ATOM 115 C VAL A 459 -6.366 -3.900 -3.091 1.00 0.00 C ATOM 116 O VAL A 459 -5.463 -4.071 -3.910 1.00 0.00 O ATOM 117 CB VAL A 459 -5.958 -2.233 -1.276 1.00 0.00 C ATOM 118 CG1 VAL A 459 -4.454 -2.273 -1.502 1.00 0.00 C ATOM 119 CG2 VAL A 459 -6.379 -0.898 -0.681 1.00 0.00 C ATOM 0 H VAL A 459 -8.453 -2.244 -1.449 1.00 0.00 H new ATOM 0 HA VAL A 459 -6.405 -1.768 -3.336 1.00 0.00 H new ATOM 0 HB VAL A 459 -6.215 -3.019 -0.566 1.00 0.00 H new ATOM 0 HG11 VAL A 459 -3.939 -2.081 -0.561 1.00 0.00 H new ATOM 0 HG12 VAL A 459 -4.168 -3.256 -1.877 1.00 0.00 H new ATOM 0 HG13 VAL A 459 -4.175 -1.511 -2.230 1.00 0.00 H new ATOM 0 HG21 VAL A 459 -5.835 -0.726 0.248 1.00 0.00 H new ATOM 0 HG22 VAL A 459 -6.155 -0.098 -1.387 1.00 0.00 H new ATOM 0 HG23 VAL A 459 -7.450 -0.912 -0.477 1.00 0.00 H new ATOM 129 N ARG A 460 -7.089 -4.898 -2.592 1.00 0.00 N ATOM 130 CA ARG A 460 -6.857 -6.284 -2.985 1.00 0.00 C ATOM 131 C ARG A 460 -7.011 -6.458 -4.493 1.00 0.00 C ATOM 132 O ARG A 460 -6.252 -7.195 -5.123 1.00 0.00 O ATOM 133 CB ARG A 460 -7.826 -7.211 -2.252 1.00 0.00 C ATOM 134 CG ARG A 460 -7.586 -8.686 -2.529 1.00 0.00 C ATOM 135 CD ARG A 460 -8.553 -9.564 -1.751 1.00 0.00 C ATOM 136 NE ARG A 460 -9.926 -9.423 -2.231 1.00 0.00 N ATOM 137 CZ ARG A 460 -10.980 -9.975 -1.633 1.00 0.00 C ATOM 138 NH1 ARG A 460 -10.823 -10.703 -0.534 1.00 0.00 N ATOM 139 NH2 ARG A 460 -12.194 -9.797 -2.135 1.00 0.00 N ATOM 0 H ARG A 460 -7.841 -4.773 -1.914 1.00 0.00 H new ATOM 0 HA ARG A 460 -5.835 -6.546 -2.711 1.00 0.00 H new ATOM 0 HB2 ARG A 460 -7.744 -7.034 -1.180 1.00 0.00 H new ATOM 0 HB3 ARG A 460 -8.846 -6.957 -2.540 1.00 0.00 H new ATOM 0 HG2 ARG A 460 -7.696 -8.879 -3.596 1.00 0.00 H new ATOM 0 HG3 ARG A 460 -6.562 -8.945 -2.262 1.00 0.00 H new ATOM 0 HD2 ARG A 460 -8.245 -10.606 -1.835 1.00 0.00 H new ATOM 0 HD3 ARG A 460 -8.510 -9.303 -0.694 1.00 0.00 H new ATOM 0 HE ARG A 460 -10.086 -8.870 -3.073 1.00 0.00 H new ATOM 0 HH11 ARG A 460 -9.891 -10.842 -0.143 1.00 0.00 H new ATOM 0 HH12 ARG A 460 -11.634 -11.123 -0.080 1.00 0.00 H new ATOM 0 HH21 ARG A 460 -12.320 -9.238 -2.979 1.00 0.00 H new ATOM 0 HH22 ARG A 460 -13.002 -10.219 -1.678 1.00 0.00 H new ATOM 153 N ARG A 461 -7.999 -5.777 -5.066 1.00 0.00 N ATOM 154 CA ARG A 461 -8.253 -5.858 -6.500 1.00 0.00 C ATOM 155 C ARG A 461 -7.025 -5.434 -7.300 1.00 0.00 C ATOM 156 O ARG A 461 -6.754 -5.976 -8.372 1.00 0.00 O ATOM 157 CB ARG A 461 -9.448 -4.982 -6.878 1.00 0.00 C ATOM 158 CG ARG A 461 -10.770 -5.483 -6.321 1.00 0.00 C ATOM 159 CD ARG A 461 -11.935 -4.630 -6.797 1.00 0.00 C ATOM 160 NE ARG A 461 -13.183 -4.983 -6.123 1.00 0.00 N ATOM 161 CZ ARG A 461 -14.390 -4.667 -6.586 1.00 0.00 C ATOM 162 NH1 ARG A 461 -14.518 -3.992 -7.721 1.00 0.00 N ATOM 163 NH2 ARG A 461 -15.473 -5.027 -5.911 1.00 0.00 N ATOM 0 H ARG A 461 -8.637 -5.163 -4.559 1.00 0.00 H new ATOM 0 HA ARG A 461 -8.479 -6.896 -6.742 1.00 0.00 H new ATOM 0 HB2 ARG A 461 -9.273 -3.968 -6.518 1.00 0.00 H new ATOM 0 HB3 ARG A 461 -9.518 -4.927 -7.964 1.00 0.00 H new ATOM 0 HG2 ARG A 461 -10.926 -6.517 -6.627 1.00 0.00 H new ATOM 0 HG3 ARG A 461 -10.733 -5.475 -5.232 1.00 0.00 H new ATOM 0 HD2 ARG A 461 -11.711 -3.578 -6.618 1.00 0.00 H new ATOM 0 HD3 ARG A 461 -12.057 -4.751 -7.873 1.00 0.00 H new ATOM 0 HE ARG A 461 -13.125 -5.502 -5.247 1.00 0.00 H new ATOM 0 HH11 ARG A 461 -13.688 -3.712 -8.244 1.00 0.00 H new ATOM 0 HH12 ARG A 461 -15.446 -3.753 -8.070 1.00 0.00 H new ATOM 0 HH21 ARG A 461 -15.381 -5.546 -5.038 1.00 0.00 H new ATOM 0 HH22 ARG A 461 -16.398 -4.785 -6.265 1.00 0.00 H new ATOM 177 N TYR A 462 -6.286 -4.463 -6.774 1.00 0.00 N ATOM 178 CA TYR A 462 -5.088 -3.968 -7.441 1.00 0.00 C ATOM 179 C TYR A 462 -4.023 -5.057 -7.528 1.00 0.00 C ATOM 180 O TYR A 462 -3.373 -5.221 -8.560 1.00 0.00 O ATOM 181 CB TYR A 462 -4.532 -2.752 -6.699 1.00 0.00 C ATOM 182 CG TYR A 462 -5.285 -1.471 -6.981 1.00 0.00 C ATOM 183 CD1 TYR A 462 -6.647 -1.373 -6.723 1.00 0.00 C ATOM 184 CD2 TYR A 462 -4.635 -0.362 -7.506 1.00 0.00 C ATOM 185 CE1 TYR A 462 -7.339 -0.204 -6.979 1.00 0.00 C ATOM 186 CE2 TYR A 462 -5.320 0.810 -7.764 1.00 0.00 C ATOM 187 CZ TYR A 462 -6.671 0.884 -7.499 1.00 0.00 C ATOM 188 OH TYR A 462 -7.357 2.048 -7.756 1.00 0.00 O ATOM 0 H TYR A 462 -6.496 -4.003 -5.888 1.00 0.00 H new ATOM 0 HA TYR A 462 -5.362 -3.673 -8.454 1.00 0.00 H new ATOM 0 HB2 TYR A 462 -4.557 -2.949 -5.627 1.00 0.00 H new ATOM 0 HB3 TYR A 462 -3.486 -2.616 -6.974 1.00 0.00 H new ATOM 0 HD1 TYR A 462 -7.173 -2.224 -6.316 1.00 0.00 H new ATOM 0 HD2 TYR A 462 -3.577 -0.416 -7.716 1.00 0.00 H new ATOM 0 HE1 TYR A 462 -8.397 -0.143 -6.773 1.00 0.00 H new ATOM 0 HE2 TYR A 462 -4.800 1.664 -8.171 1.00 0.00 H new ATOM 0 HH TYR A 462 -6.740 2.718 -8.119 1.00 0.00 H new ATOM 198 N LEU A 463 -3.849 -5.797 -6.438 1.00 0.00 N ATOM 199 CA LEU A 463 -2.862 -6.870 -6.393 1.00 0.00 C ATOM 200 C LEU A 463 -3.281 -8.036 -7.282 1.00 0.00 C ATOM 201 O LEU A 463 -2.447 -8.663 -7.934 1.00 0.00 O ATOM 202 CB LEU A 463 -2.671 -7.354 -4.954 1.00 0.00 C ATOM 203 CG LEU A 463 -2.188 -6.286 -3.972 1.00 0.00 C ATOM 204 CD1 LEU A 463 -2.228 -6.814 -2.547 1.00 0.00 C ATOM 205 CD2 LEU A 463 -0.782 -5.828 -4.333 1.00 0.00 C ATOM 0 H LEU A 463 -4.378 -5.674 -5.575 1.00 0.00 H new ATOM 0 HA LEU A 463 -1.917 -6.475 -6.766 1.00 0.00 H new ATOM 0 HB2 LEU A 463 -3.618 -7.756 -4.593 1.00 0.00 H new ATOM 0 HB3 LEU A 463 -1.955 -8.176 -4.955 1.00 0.00 H new ATOM 0 HG LEU A 463 -2.857 -5.428 -4.039 1.00 0.00 H new ATOM 0 HD11 LEU A 463 -1.881 -6.040 -1.862 1.00 0.00 H new ATOM 0 HD12 LEU A 463 -3.250 -7.093 -2.291 1.00 0.00 H new ATOM 0 HD13 LEU A 463 -1.582 -7.688 -2.465 1.00 0.00 H new ATOM 0 HD21 LEU A 463 -0.454 -5.068 -3.624 1.00 0.00 H new ATOM 0 HD22 LEU A 463 -0.101 -6.678 -4.294 1.00 0.00 H new ATOM 0 HD23 LEU A 463 -0.783 -5.409 -5.339 1.00 0.00 H new ATOM 217 N THR A 464 -4.578 -8.322 -7.303 1.00 0.00 N ATOM 218 CA THR A 464 -5.110 -9.410 -8.108 1.00 0.00 C ATOM 219 C THR A 464 -4.834 -9.178 -9.589 1.00 0.00 C ATOM 220 O THR A 464 -4.625 -10.125 -10.348 1.00 0.00 O ATOM 221 CB THR A 464 -6.614 -9.548 -7.873 1.00 0.00 C ATOM 222 OG1 THR A 464 -7.322 -8.520 -8.539 1.00 0.00 O ATOM 223 CG2 THR A 464 -6.998 -9.497 -6.409 1.00 0.00 C ATOM 0 H THR A 464 -5.281 -7.812 -6.769 1.00 0.00 H new ATOM 0 HA THR A 464 -4.613 -10.332 -7.807 1.00 0.00 H new ATOM 0 HB THR A 464 -6.879 -10.529 -8.268 1.00 0.00 H new ATOM 0 HG1 THR A 464 -6.809 -7.686 -8.492 1.00 0.00 H new ATOM 0 HG21 THR A 464 -8.079 -9.601 -6.313 1.00 0.00 H new ATOM 0 HG22 THR A 464 -6.506 -10.310 -5.875 1.00 0.00 H new ATOM 0 HG23 THR A 464 -6.686 -8.543 -5.984 1.00 0.00 H new ATOM 231 N ARG A 465 -4.835 -7.912 -9.995 1.00 0.00 N ATOM 232 CA ARG A 465 -4.584 -7.556 -11.387 1.00 0.00 C ATOM 233 C ARG A 465 -3.094 -7.590 -11.698 1.00 0.00 C ATOM 234 O ARG A 465 -2.641 -8.363 -12.544 1.00 0.00 O ATOM 235 CB ARG A 465 -5.149 -6.167 -11.689 1.00 0.00 C ATOM 236 CG ARG A 465 -6.665 -6.094 -11.601 1.00 0.00 C ATOM 237 CD ARG A 465 -7.181 -4.723 -12.007 1.00 0.00 C ATOM 238 NE ARG A 465 -8.608 -4.573 -11.737 1.00 0.00 N ATOM 239 CZ ARG A 465 -9.369 -3.622 -12.273 1.00 0.00 C ATOM 240 NH1 ARG A 465 -8.843 -2.735 -13.108 1.00 0.00 N ATOM 241 NH2 ARG A 465 -10.659 -3.557 -11.973 1.00 0.00 N ATOM 0 H ARG A 465 -5.007 -7.116 -9.380 1.00 0.00 H new ATOM 0 HA ARG A 465 -5.084 -8.290 -12.019 1.00 0.00 H new ATOM 0 HB2 ARG A 465 -4.718 -5.449 -10.991 1.00 0.00 H new ATOM 0 HB3 ARG A 465 -4.837 -5.866 -12.689 1.00 0.00 H new ATOM 0 HG2 ARG A 465 -7.105 -6.855 -12.245 1.00 0.00 H new ATOM 0 HG3 ARG A 465 -6.983 -6.316 -10.582 1.00 0.00 H new ATOM 0 HD2 ARG A 465 -6.627 -3.953 -11.469 1.00 0.00 H new ATOM 0 HD3 ARG A 465 -6.995 -4.566 -13.069 1.00 0.00 H new ATOM 0 HE ARG A 465 -9.048 -5.237 -11.100 1.00 0.00 H new ATOM 0 HH11 ARG A 465 -7.851 -2.780 -13.342 1.00 0.00 H new ATOM 0 HH12 ARG A 465 -9.431 -2.008 -13.516 1.00 0.00 H new ATOM 0 HH21 ARG A 465 -11.068 -4.236 -11.331 1.00 0.00 H new ATOM 0 HH22 ARG A 465 -11.242 -2.828 -12.384 1.00 0.00 H new ATOM 255 N LYS A 466 -2.339 -6.748 -11.009 1.00 0.00 N ATOM 256 CA LYS A 466 -0.896 -6.674 -11.205 1.00 0.00 C ATOM 257 C LYS A 466 -0.185 -6.354 -9.892 1.00 0.00 C ATOM 258 O LYS A 466 -0.741 -5.684 -9.022 1.00 0.00 O ATOM 259 CB LYS A 466 -0.558 -5.615 -12.258 1.00 0.00 C ATOM 260 CG LYS A 466 0.262 -6.153 -13.419 1.00 0.00 C ATOM 261 CD LYS A 466 -0.113 -5.474 -14.727 1.00 0.00 C ATOM 262 CE LYS A 466 1.108 -5.238 -15.601 1.00 0.00 C ATOM 263 NZ LYS A 466 1.493 -6.461 -16.360 1.00 0.00 N ATOM 0 H LYS A 466 -2.702 -6.104 -10.306 1.00 0.00 H new ATOM 0 HA LYS A 466 -0.549 -7.646 -11.555 1.00 0.00 H new ATOM 0 HB2 LYS A 466 -1.484 -5.190 -12.644 1.00 0.00 H new ATOM 0 HB3 LYS A 466 -0.009 -4.803 -11.782 1.00 0.00 H new ATOM 0 HG2 LYS A 466 1.322 -6.000 -13.219 1.00 0.00 H new ATOM 0 HG3 LYS A 466 0.107 -7.228 -13.508 1.00 0.00 H new ATOM 0 HD2 LYS A 466 -0.833 -6.090 -15.265 1.00 0.00 H new ATOM 0 HD3 LYS A 466 -0.601 -4.522 -14.517 1.00 0.00 H new ATOM 0 HE2 LYS A 466 0.903 -4.427 -16.300 1.00 0.00 H new ATOM 0 HE3 LYS A 466 1.944 -4.919 -14.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 466 2.330 -6.258 -16.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 466 1.713 -7.228 -15.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 466 0.705 -6.751 -16.974 1.00 0.00 H new ATOM 277 N PRO A 467 1.063 -6.830 -9.731 1.00 0.00 N ATOM 278 CA PRO A 467 1.849 -6.589 -8.517 1.00 0.00 C ATOM 279 C PRO A 467 2.202 -5.115 -8.342 1.00 0.00 C ATOM 280 O PRO A 467 2.714 -4.477 -9.261 1.00 0.00 O ATOM 281 CB PRO A 467 3.116 -7.421 -8.733 1.00 0.00 C ATOM 282 CG PRO A 467 3.217 -7.588 -10.210 1.00 0.00 C ATOM 283 CD PRO A 467 1.804 -7.636 -10.717 1.00 0.00 C ATOM 0 HA PRO A 467 1.298 -6.861 -7.617 1.00 0.00 H new ATOM 0 HB2 PRO A 467 3.994 -6.915 -8.332 1.00 0.00 H new ATOM 0 HB3 PRO A 467 3.046 -8.386 -8.230 1.00 0.00 H new ATOM 0 HG2 PRO A 467 3.765 -6.760 -10.660 1.00 0.00 H new ATOM 0 HG3 PRO A 467 3.754 -8.502 -10.464 1.00 0.00 H new ATOM 0 HD2 PRO A 467 1.722 -7.219 -11.721 1.00 0.00 H new ATOM 0 HD3 PRO A 467 1.428 -8.658 -10.765 1.00 0.00 H new ATOM 291 N MET A 468 1.923 -4.581 -7.157 1.00 0.00 N ATOM 292 CA MET A 468 2.211 -3.182 -6.864 1.00 0.00 C ATOM 293 C MET A 468 2.812 -3.029 -5.471 1.00 0.00 C ATOM 294 O MET A 468 2.650 -3.899 -4.616 1.00 0.00 O ATOM 295 CB MET A 468 0.936 -2.345 -6.975 1.00 0.00 C ATOM 296 CG MET A 468 0.243 -2.471 -8.322 1.00 0.00 C ATOM 297 SD MET A 468 -1.146 -1.335 -8.498 1.00 0.00 S ATOM 298 CE MET A 468 -0.285 0.215 -8.750 1.00 0.00 C ATOM 0 H MET A 468 1.498 -5.095 -6.385 1.00 0.00 H new ATOM 0 HA MET A 468 2.938 -2.826 -7.594 1.00 0.00 H new ATOM 0 HB2 MET A 468 0.243 -2.647 -6.189 1.00 0.00 H new ATOM 0 HB3 MET A 468 1.182 -1.298 -6.798 1.00 0.00 H new ATOM 0 HG2 MET A 468 0.965 -2.282 -9.117 1.00 0.00 H new ATOM 0 HG3 MET A 468 -0.111 -3.494 -8.450 1.00 0.00 H new ATOM 0 HE1 MET A 468 -0.876 0.858 -9.402 1.00 0.00 H new ATOM 0 HE2 MET A 468 -0.137 0.709 -7.790 1.00 0.00 H new ATOM 0 HE3 MET A 468 0.683 0.022 -9.212 1.00 0.00 H new ATOM 308 N THR A 469 3.505 -1.917 -5.251 1.00 0.00 N ATOM 309 CA THR A 469 4.129 -1.648 -3.962 1.00 0.00 C ATOM 310 C THR A 469 3.298 -0.655 -3.155 1.00 0.00 C ATOM 311 O THR A 469 2.487 0.086 -3.710 1.00 0.00 O ATOM 312 CB THR A 469 5.546 -1.105 -4.158 1.00 0.00 C ATOM 313 OG1 THR A 469 6.044 -0.556 -2.952 1.00 0.00 O ATOM 314 CG2 THR A 469 5.636 -0.034 -5.223 1.00 0.00 C ATOM 0 H THR A 469 3.648 -1.188 -5.949 1.00 0.00 H new ATOM 0 HA THR A 469 4.182 -2.586 -3.409 1.00 0.00 H new ATOM 0 HB THR A 469 6.141 -1.961 -4.477 1.00 0.00 H new ATOM 0 HG1 THR A 469 6.951 -0.216 -3.098 1.00 0.00 H new ATOM 0 HG21 THR A 469 6.668 0.307 -5.310 1.00 0.00 H new ATOM 0 HG22 THR A 469 5.307 -0.442 -6.178 1.00 0.00 H new ATOM 0 HG23 THR A 469 4.998 0.806 -4.949 1.00 0.00 H new ATOM 322 N THR A 470 3.506 -0.646 -1.842 1.00 0.00 N ATOM 323 CA THR A 470 2.776 0.255 -0.956 1.00 0.00 C ATOM 324 C THR A 470 2.942 1.707 -1.391 1.00 0.00 C ATOM 325 O THR A 470 1.977 2.472 -1.420 1.00 0.00 O ATOM 326 CB THR A 470 3.260 0.086 0.484 1.00 0.00 C ATOM 327 OG1 THR A 470 4.669 0.211 0.556 1.00 0.00 O ATOM 328 CG2 THR A 470 2.885 -1.249 1.090 1.00 0.00 C ATOM 0 H THR A 470 4.175 -1.253 -1.368 1.00 0.00 H new ATOM 0 HA THR A 470 1.718 -0.001 -1.013 1.00 0.00 H new ATOM 0 HB THR A 470 2.764 0.874 1.050 1.00 0.00 H new ATOM 0 HG1 THR A 470 4.907 1.150 0.707 1.00 0.00 H new ATOM 0 HG21 THR A 470 3.259 -1.302 2.112 1.00 0.00 H new ATOM 0 HG22 THR A 470 1.800 -1.355 1.095 1.00 0.00 H new ATOM 0 HG23 THR A 470 3.325 -2.053 0.500 1.00 0.00 H new ATOM 336 N LYS A 471 4.172 2.081 -1.726 1.00 0.00 N ATOM 337 CA LYS A 471 4.468 3.442 -2.158 1.00 0.00 C ATOM 338 C LYS A 471 3.612 3.835 -3.359 1.00 0.00 C ATOM 339 O LYS A 471 3.159 4.974 -3.464 1.00 0.00 O ATOM 340 CB LYS A 471 5.951 3.575 -2.511 1.00 0.00 C ATOM 341 CG LYS A 471 6.367 4.994 -2.864 1.00 0.00 C ATOM 342 CD LYS A 471 7.838 5.065 -3.241 1.00 0.00 C ATOM 343 CE LYS A 471 8.293 6.501 -3.439 1.00 0.00 C ATOM 344 NZ LYS A 471 9.733 6.582 -3.812 1.00 0.00 N ATOM 0 H LYS A 471 4.981 1.460 -1.707 1.00 0.00 H new ATOM 0 HA LYS A 471 4.233 4.115 -1.333 1.00 0.00 H new ATOM 0 HB2 LYS A 471 6.549 3.229 -1.668 1.00 0.00 H new ATOM 0 HB3 LYS A 471 6.176 2.919 -3.352 1.00 0.00 H new ATOM 0 HG2 LYS A 471 5.760 5.357 -3.693 1.00 0.00 H new ATOM 0 HG3 LYS A 471 6.175 5.652 -2.017 1.00 0.00 H new ATOM 0 HD2 LYS A 471 8.438 4.596 -2.461 1.00 0.00 H new ATOM 0 HD3 LYS A 471 8.008 4.499 -4.157 1.00 0.00 H new ATOM 0 HE2 LYS A 471 7.690 6.969 -4.217 1.00 0.00 H new ATOM 0 HE3 LYS A 471 8.123 7.065 -2.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 471 10.004 7.578 -3.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 471 10.311 6.159 -3.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 471 9.891 6.066 -4.701 1.00 0.00 H new ATOM 358 N ASP A 472 3.395 2.884 -4.262 1.00 0.00 N ATOM 359 CA ASP A 472 2.593 3.133 -5.454 1.00 0.00 C ATOM 360 C ASP A 472 1.168 3.525 -5.080 1.00 0.00 C ATOM 361 O ASP A 472 0.555 4.373 -5.729 1.00 0.00 O ATOM 362 CB ASP A 472 2.575 1.892 -6.351 1.00 0.00 C ATOM 363 CG ASP A 472 1.994 2.178 -7.722 1.00 0.00 C ATOM 364 OD1 ASP A 472 1.321 3.218 -7.878 1.00 0.00 O ATOM 365 OD2 ASP A 472 2.215 1.361 -8.641 1.00 0.00 O ATOM 0 H ASP A 472 3.763 1.935 -4.191 1.00 0.00 H new ATOM 0 HA ASP A 472 3.046 3.961 -5.999 1.00 0.00 H new ATOM 0 HB2 ASP A 472 3.591 1.512 -6.462 1.00 0.00 H new ATOM 0 HB3 ASP A 472 1.992 1.107 -5.869 1.00 0.00 H new ATOM 370 N LEU A 473 0.647 2.901 -4.030 1.00 0.00 N ATOM 371 CA LEU A 473 -0.708 3.184 -3.566 1.00 0.00 C ATOM 372 C LEU A 473 -0.811 4.601 -3.013 1.00 0.00 C ATOM 373 O LEU A 473 -1.798 5.298 -3.249 1.00 0.00 O ATOM 374 CB LEU A 473 -1.124 2.173 -2.497 1.00 0.00 C ATOM 375 CG LEU A 473 -1.480 0.781 -3.022 1.00 0.00 C ATOM 376 CD1 LEU A 473 -0.221 -0.027 -3.291 1.00 0.00 C ATOM 377 CD2 LEU A 473 -2.382 0.055 -2.036 1.00 0.00 C ATOM 0 H LEU A 473 1.141 2.196 -3.483 1.00 0.00 H new ATOM 0 HA LEU A 473 -1.382 3.099 -4.418 1.00 0.00 H new ATOM 0 HB2 LEU A 473 -0.312 2.076 -1.776 1.00 0.00 H new ATOM 0 HB3 LEU A 473 -1.983 2.571 -1.957 1.00 0.00 H new ATOM 0 HG LEU A 473 -2.020 0.895 -3.962 1.00 0.00 H new ATOM 0 HD11 LEU A 473 -0.495 -1.014 -3.664 1.00 0.00 H new ATOM 0 HD12 LEU A 473 0.388 0.486 -4.035 1.00 0.00 H new ATOM 0 HD13 LEU A 473 0.348 -0.133 -2.367 1.00 0.00 H new ATOM 0 HD21 LEU A 473 -2.625 -0.934 -2.425 1.00 0.00 H new ATOM 0 HD22 LEU A 473 -1.868 -0.048 -1.080 1.00 0.00 H new ATOM 0 HD23 LEU A 473 -3.300 0.625 -1.895 1.00 0.00 H new ATOM 389 N LEU A 474 0.212 5.020 -2.276 1.00 0.00 N ATOM 390 CA LEU A 474 0.232 6.356 -1.689 1.00 0.00 C ATOM 391 C LEU A 474 0.138 7.429 -2.769 1.00 0.00 C ATOM 392 O LEU A 474 -0.549 8.435 -2.600 1.00 0.00 O ATOM 393 CB LEU A 474 1.506 6.555 -0.866 1.00 0.00 C ATOM 394 CG LEU A 474 1.547 5.792 0.460 1.00 0.00 C ATOM 395 CD1 LEU A 474 2.977 5.670 0.963 1.00 0.00 C ATOM 396 CD2 LEU A 474 0.672 6.480 1.497 1.00 0.00 C ATOM 0 H LEU A 474 1.037 4.456 -2.071 1.00 0.00 H new ATOM 0 HA LEU A 474 -0.635 6.450 -1.034 1.00 0.00 H new ATOM 0 HB2 LEU A 474 2.361 6.251 -1.469 1.00 0.00 H new ATOM 0 HB3 LEU A 474 1.624 7.619 -0.659 1.00 0.00 H new ATOM 0 HG LEU A 474 1.157 4.788 0.292 1.00 0.00 H new ATOM 0 HD11 LEU A 474 2.985 5.125 1.907 1.00 0.00 H new ATOM 0 HD12 LEU A 474 3.577 5.133 0.228 1.00 0.00 H new ATOM 0 HD13 LEU A 474 3.395 6.665 1.115 1.00 0.00 H new ATOM 0 HD21 LEU A 474 0.713 5.924 2.434 1.00 0.00 H new ATOM 0 HD22 LEU A 474 1.033 7.495 1.661 1.00 0.00 H new ATOM 0 HD23 LEU A 474 -0.357 6.514 1.140 1.00 0.00 H new ATOM 408 N LYS A 475 0.833 7.204 -3.880 1.00 0.00 N ATOM 409 CA LYS A 475 0.825 8.152 -4.988 1.00 0.00 C ATOM 410 C LYS A 475 -0.581 8.314 -5.555 1.00 0.00 C ATOM 411 O LYS A 475 -0.981 9.411 -5.946 1.00 0.00 O ATOM 412 CB LYS A 475 1.781 7.690 -6.089 1.00 0.00 C ATOM 413 CG LYS A 475 3.212 8.162 -5.890 1.00 0.00 C ATOM 414 CD LYS A 475 3.902 7.393 -4.776 1.00 0.00 C ATOM 415 CE LYS A 475 5.302 7.927 -4.516 1.00 0.00 C ATOM 416 NZ LYS A 475 6.152 7.877 -5.738 1.00 0.00 N ATOM 0 H LYS A 475 1.407 6.376 -4.036 1.00 0.00 H new ATOM 0 HA LYS A 475 1.158 9.118 -4.609 1.00 0.00 H new ATOM 0 HB2 LYS A 475 1.770 6.601 -6.135 1.00 0.00 H new ATOM 0 HB3 LYS A 475 1.418 8.054 -7.050 1.00 0.00 H new ATOM 0 HG2 LYS A 475 3.770 8.038 -6.818 1.00 0.00 H new ATOM 0 HG3 LYS A 475 3.216 9.226 -5.655 1.00 0.00 H new ATOM 0 HD2 LYS A 475 3.310 7.462 -3.864 1.00 0.00 H new ATOM 0 HD3 LYS A 475 3.957 6.337 -5.041 1.00 0.00 H new ATOM 0 HE2 LYS A 475 5.238 8.955 -4.160 1.00 0.00 H new ATOM 0 HE3 LYS A 475 5.771 7.344 -3.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 475 7.132 8.120 -5.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 475 6.125 6.919 -6.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 475 5.793 8.557 -6.438 1.00 0.00 H new ATOM 430 N LYS A 476 -1.328 7.216 -5.595 1.00 0.00 N ATOM 431 CA LYS A 476 -2.690 7.236 -6.114 1.00 0.00 C ATOM 432 C LYS A 476 -3.578 8.151 -5.276 1.00 0.00 C ATOM 433 O LYS A 476 -4.421 8.873 -5.809 1.00 0.00 O ATOM 434 CB LYS A 476 -3.272 5.822 -6.134 1.00 0.00 C ATOM 435 CG LYS A 476 -2.559 4.884 -7.096 1.00 0.00 C ATOM 436 CD LYS A 476 -3.231 3.522 -7.147 1.00 0.00 C ATOM 437 CE LYS A 476 -2.468 2.557 -8.042 1.00 0.00 C ATOM 438 NZ LYS A 476 -2.830 2.725 -9.476 1.00 0.00 N ATOM 0 H LYS A 476 -1.013 6.301 -5.274 1.00 0.00 H new ATOM 0 HA LYS A 476 -2.658 7.623 -7.133 1.00 0.00 H new ATOM 0 HB2 LYS A 476 -3.223 5.404 -5.129 1.00 0.00 H new ATOM 0 HB3 LYS A 476 -4.326 5.876 -6.406 1.00 0.00 H new ATOM 0 HG2 LYS A 476 -2.549 5.323 -8.094 1.00 0.00 H new ATOM 0 HG3 LYS A 476 -1.520 4.767 -6.788 1.00 0.00 H new ATOM 0 HD2 LYS A 476 -3.298 3.110 -6.140 1.00 0.00 H new ATOM 0 HD3 LYS A 476 -4.251 3.632 -7.515 1.00 0.00 H new ATOM 0 HE2 LYS A 476 -1.397 2.716 -7.917 1.00 0.00 H new ATOM 0 HE3 LYS A 476 -2.677 1.533 -7.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 476 -2.747 1.811 -9.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 476 -3.809 3.069 -9.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 476 -2.188 3.413 -9.918 1.00 0.00 H new ATOM 452 N PHE A 477 -3.382 8.117 -3.962 1.00 0.00 N ATOM 453 CA PHE A 477 -4.165 8.943 -3.051 1.00 0.00 C ATOM 454 C PHE A 477 -3.522 10.313 -2.871 1.00 0.00 C ATOM 455 O PHE A 477 -4.026 11.319 -3.369 1.00 0.00 O ATOM 456 CB PHE A 477 -4.309 8.251 -1.695 1.00 0.00 C ATOM 457 CG PHE A 477 -5.049 6.945 -1.762 1.00 0.00 C ATOM 458 CD1 PHE A 477 -6.431 6.922 -1.867 1.00 0.00 C ATOM 459 CD2 PHE A 477 -4.363 5.742 -1.720 1.00 0.00 C ATOM 460 CE1 PHE A 477 -7.114 5.722 -1.928 1.00 0.00 C ATOM 461 CE2 PHE A 477 -5.041 4.540 -1.782 1.00 0.00 C ATOM 462 CZ PHE A 477 -6.419 4.529 -1.886 1.00 0.00 C ATOM 0 H PHE A 477 -2.688 7.526 -3.505 1.00 0.00 H new ATOM 0 HA PHE A 477 -5.155 9.081 -3.486 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -3.317 8.076 -1.279 1.00 0.00 H new ATOM 0 HB3 PHE A 477 -4.829 8.919 -1.009 1.00 0.00 H new ATOM 0 HD1 PHE A 477 -6.980 7.852 -1.902 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -3.286 5.744 -1.638 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -8.191 5.717 -2.008 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -4.494 3.609 -1.749 1.00 0.00 H new ATOM 0 HZ PHE A 477 -6.951 3.590 -1.934 1.00 0.00 H new ATOM 472 N GLN A 478 -2.407 10.341 -2.154 1.00 0.00 N ATOM 473 CA GLN A 478 -1.688 11.583 -1.904 1.00 0.00 C ATOM 474 C GLN A 478 -2.581 12.600 -1.195 1.00 0.00 C ATOM 475 O GLN A 478 -2.718 13.740 -1.639 1.00 0.00 O ATOM 476 CB GLN A 478 -1.169 12.165 -3.220 1.00 0.00 C ATOM 477 CG GLN A 478 0.228 11.689 -3.584 1.00 0.00 C ATOM 478 CD GLN A 478 0.756 12.345 -4.846 1.00 0.00 C ATOM 479 OE1 GLN A 478 1.576 13.377 -4.678 1.00 0.00 O flip ATOM 480 NE2 GLN A 478 0.432 11.929 -5.958 1.00 0.00 N flip ATOM 0 H GLN A 478 -1.980 9.515 -1.734 1.00 0.00 H new ATOM 0 HA GLN A 478 -0.842 11.361 -1.254 1.00 0.00 H new ATOM 0 HB2 GLN A 478 -1.856 11.897 -4.023 1.00 0.00 H new ATOM 0 HB3 GLN A 478 -1.167 13.253 -3.151 1.00 0.00 H new ATOM 0 HG2 GLN A 478 0.907 11.900 -2.758 1.00 0.00 H new ATOM 0 HG3 GLN A 478 0.216 10.607 -3.719 1.00 0.00 H new ATOM 0 HE21 GLN A 478 -0.201 11.133 -6.040 1.00 0.00 H new ATOM 0 HE22 GLN A 478 0.796 12.380 -6.797 1.00 0.00 H new ATOM 489 N THR A 479 -3.184 12.177 -0.088 1.00 0.00 N ATOM 490 CA THR A 479 -4.062 13.047 0.689 1.00 0.00 C ATOM 491 C THR A 479 -5.178 13.622 -0.179 1.00 0.00 C ATOM 492 O THR A 479 -5.474 14.816 -0.118 1.00 0.00 O ATOM 493 CB THR A 479 -3.259 14.181 1.327 1.00 0.00 C ATOM 494 OG1 THR A 479 -2.944 15.175 0.369 1.00 0.00 O ATOM 495 CG2 THR A 479 -1.960 13.718 1.953 1.00 0.00 C ATOM 0 H THR A 479 -3.081 11.236 0.292 1.00 0.00 H new ATOM 0 HA THR A 479 -4.517 12.446 1.476 1.00 0.00 H new ATOM 0 HB THR A 479 -3.900 14.580 2.113 1.00 0.00 H new ATOM 0 HG1 THR A 479 -2.991 14.789 -0.531 1.00 0.00 H new ATOM 0 HG21 THR A 479 -1.440 14.572 2.387 1.00 0.00 H new ATOM 0 HG22 THR A 479 -2.172 12.988 2.734 1.00 0.00 H new ATOM 0 HG23 THR A 479 -1.331 13.260 1.189 1.00 0.00 H new ATOM 503 N LYS A 480 -5.796 12.766 -0.986 1.00 0.00 N ATOM 504 CA LYS A 480 -6.881 13.191 -1.864 1.00 0.00 C ATOM 505 C LYS A 480 -8.237 12.879 -1.244 1.00 0.00 C ATOM 506 O LYS A 480 -8.563 11.719 -0.991 1.00 0.00 O ATOM 507 CB LYS A 480 -6.766 12.501 -3.224 1.00 0.00 C ATOM 508 CG LYS A 480 -7.766 13.008 -4.250 1.00 0.00 C ATOM 509 CD LYS A 480 -7.663 12.237 -5.557 1.00 0.00 C ATOM 510 CE LYS A 480 -8.568 12.829 -6.624 1.00 0.00 C ATOM 511 NZ LYS A 480 -8.457 14.313 -6.688 1.00 0.00 N ATOM 0 H LYS A 480 -5.565 11.775 -1.050 1.00 0.00 H new ATOM 0 HA LYS A 480 -6.800 14.269 -2.000 1.00 0.00 H new ATOM 0 HB2 LYS A 480 -5.757 12.644 -3.611 1.00 0.00 H new ATOM 0 HB3 LYS A 480 -6.907 11.428 -3.091 1.00 0.00 H new ATOM 0 HG2 LYS A 480 -8.776 12.917 -3.851 1.00 0.00 H new ATOM 0 HG3 LYS A 480 -7.592 14.068 -4.437 1.00 0.00 H new ATOM 0 HD2 LYS A 480 -6.631 12.248 -5.907 1.00 0.00 H new ATOM 0 HD3 LYS A 480 -7.932 11.194 -5.388 1.00 0.00 H new ATOM 0 HE2 LYS A 480 -8.311 12.404 -7.594 1.00 0.00 H new ATOM 0 HE3 LYS A 480 -9.602 12.551 -6.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 480 -8.881 14.655 -7.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 480 -8.958 14.734 -5.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 480 -7.455 14.588 -6.655 1.00 0.00 H new ATOM 525 N LYS A 481 -9.028 13.921 -1.001 1.00 0.00 N ATOM 526 CA LYS A 481 -10.352 13.752 -0.411 1.00 0.00 C ATOM 527 C LYS A 481 -10.269 12.947 0.886 1.00 0.00 C ATOM 528 O LYS A 481 -9.204 12.845 1.492 1.00 0.00 O ATOM 529 CB LYS A 481 -11.285 13.058 -1.408 1.00 0.00 C ATOM 530 CG LYS A 481 -12.648 13.719 -1.526 1.00 0.00 C ATOM 531 CD LYS A 481 -13.412 13.209 -2.738 1.00 0.00 C ATOM 532 CE LYS A 481 -13.374 14.208 -3.882 1.00 0.00 C ATOM 533 NZ LYS A 481 -11.989 14.676 -4.167 1.00 0.00 N ATOM 0 H LYS A 481 -8.776 14.888 -1.203 1.00 0.00 H new ATOM 0 HA LYS A 481 -10.754 14.737 -0.175 1.00 0.00 H new ATOM 0 HB2 LYS A 481 -10.810 13.045 -2.389 1.00 0.00 H new ATOM 0 HB3 LYS A 481 -11.419 12.019 -1.105 1.00 0.00 H new ATOM 0 HG2 LYS A 481 -13.226 13.526 -0.622 1.00 0.00 H new ATOM 0 HG3 LYS A 481 -12.524 14.799 -1.601 1.00 0.00 H new ATOM 0 HD2 LYS A 481 -12.984 12.262 -3.067 1.00 0.00 H new ATOM 0 HD3 LYS A 481 -14.447 13.012 -2.460 1.00 0.00 H new ATOM 0 HE2 LYS A 481 -13.794 13.750 -4.778 1.00 0.00 H new ATOM 0 HE3 LYS A 481 -14.003 15.064 -3.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 481 -11.985 15.234 -5.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 481 -11.653 15.267 -3.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 481 -11.361 13.855 -4.276 1.00 0.00 H new ATOM 547 N THR A 482 -11.398 12.376 1.305 1.00 0.00 N ATOM 548 CA THR A 482 -11.453 11.577 2.529 1.00 0.00 C ATOM 549 C THR A 482 -11.350 12.462 3.770 1.00 0.00 C ATOM 550 O THR A 482 -12.255 12.480 4.605 1.00 0.00 O ATOM 551 CB THR A 482 -10.346 10.512 2.537 1.00 0.00 C ATOM 552 OG1 THR A 482 -9.151 11.021 3.106 1.00 0.00 O ATOM 553 CG2 THR A 482 -10.010 9.978 1.158 1.00 0.00 C ATOM 0 H THR A 482 -12.289 12.452 0.814 1.00 0.00 H new ATOM 0 HA THR A 482 -12.418 11.072 2.552 1.00 0.00 H new ATOM 0 HB THR A 482 -10.747 9.695 3.136 1.00 0.00 H new ATOM 0 HG1 THR A 482 -8.712 11.619 2.465 1.00 0.00 H new ATOM 0 HG21 THR A 482 -9.221 9.230 1.240 1.00 0.00 H new ATOM 0 HG22 THR A 482 -10.897 9.523 0.718 1.00 0.00 H new ATOM 0 HG23 THR A 482 -9.670 10.797 0.524 1.00 0.00 H new ATOM 561 N GLY A 483 -10.246 13.193 3.890 1.00 0.00 N ATOM 562 CA GLY A 483 -10.055 14.065 5.035 1.00 0.00 C ATOM 563 C GLY A 483 -9.040 13.520 6.021 1.00 0.00 C ATOM 564 O GLY A 483 -9.031 13.909 7.189 1.00 0.00 O ATOM 0 H GLY A 483 -9.481 13.197 3.215 1.00 0.00 H new ATOM 0 HA2 GLY A 483 -9.729 15.046 4.689 1.00 0.00 H new ATOM 0 HA3 GLY A 483 -11.009 14.206 5.542 1.00 0.00 H new ATOM 568 N LEU A 484 -8.182 12.620 5.551 1.00 0.00 N ATOM 569 CA LEU A 484 -7.158 12.024 6.403 1.00 0.00 C ATOM 570 C LEU A 484 -5.770 12.519 6.009 1.00 0.00 C ATOM 571 O LEU A 484 -5.428 12.563 4.828 1.00 0.00 O ATOM 572 CB LEU A 484 -7.213 10.497 6.312 1.00 0.00 C ATOM 573 CG LEU A 484 -8.440 9.853 6.961 1.00 0.00 C ATOM 574 CD1 LEU A 484 -8.462 10.135 8.456 1.00 0.00 C ATOM 575 CD2 LEU A 484 -9.716 10.352 6.303 1.00 0.00 C ATOM 0 H LEU A 484 -8.175 12.288 4.587 1.00 0.00 H new ATOM 0 HA LEU A 484 -7.355 12.326 7.432 1.00 0.00 H new ATOM 0 HB2 LEU A 484 -7.184 10.210 5.261 1.00 0.00 H new ATOM 0 HB3 LEU A 484 -6.317 10.088 6.779 1.00 0.00 H new ATOM 0 HG LEU A 484 -8.380 8.774 6.816 1.00 0.00 H new ATOM 0 HD11 LEU A 484 -9.341 9.670 8.901 1.00 0.00 H new ATOM 0 HD12 LEU A 484 -7.563 9.726 8.917 1.00 0.00 H new ATOM 0 HD13 LEU A 484 -8.498 11.212 8.623 1.00 0.00 H new ATOM 0 HD21 LEU A 484 -10.578 9.883 6.778 1.00 0.00 H new ATOM 0 HD22 LEU A 484 -9.784 11.434 6.415 1.00 0.00 H new ATOM 0 HD23 LEU A 484 -9.703 10.097 5.243 1.00 0.00 H new ATOM 587 N SER A 485 -4.974 12.889 7.006 1.00 0.00 N ATOM 588 CA SER A 485 -3.622 13.381 6.764 1.00 0.00 C ATOM 589 C SER A 485 -2.727 12.266 6.236 1.00 0.00 C ATOM 590 O SER A 485 -3.093 11.091 6.273 1.00 0.00 O ATOM 591 CB SER A 485 -3.031 13.962 8.049 1.00 0.00 C ATOM 592 OG SER A 485 -2.732 12.938 8.982 1.00 0.00 O ATOM 0 H SER A 485 -5.241 12.858 7.990 1.00 0.00 H new ATOM 0 HA SER A 485 -3.676 14.167 6.011 1.00 0.00 H new ATOM 0 HB2 SER A 485 -2.125 14.521 7.816 1.00 0.00 H new ATOM 0 HB3 SER A 485 -3.736 14.666 8.491 1.00 0.00 H new ATOM 0 HG SER A 485 -2.354 13.336 9.794 1.00 0.00 H new ATOM 598 N SER A 486 -1.549 12.642 5.745 1.00 0.00 N ATOM 599 CA SER A 486 -0.598 11.672 5.211 1.00 0.00 C ATOM 600 C SER A 486 -0.255 10.613 6.254 1.00 0.00 C ATOM 601 O SER A 486 -0.162 9.427 5.941 1.00 0.00 O ATOM 602 CB SER A 486 0.676 12.380 4.748 1.00 0.00 C ATOM 603 OG SER A 486 0.382 13.402 3.812 1.00 0.00 O ATOM 0 H SER A 486 -1.231 13.610 5.706 1.00 0.00 H new ATOM 0 HA SER A 486 -1.062 11.177 4.358 1.00 0.00 H new ATOM 0 HB2 SER A 486 1.191 12.808 5.608 1.00 0.00 H new ATOM 0 HB3 SER A 486 1.355 11.656 4.298 1.00 0.00 H new ATOM 0 HG SER A 486 1.213 13.840 3.534 1.00 0.00 H new ATOM 609 N GLU A 487 -0.072 11.052 7.495 1.00 0.00 N ATOM 610 CA GLU A 487 0.259 10.141 8.585 1.00 0.00 C ATOM 611 C GLU A 487 -0.925 9.236 8.913 1.00 0.00 C ATOM 612 O GLU A 487 -0.756 8.041 9.153 1.00 0.00 O ATOM 613 CB GLU A 487 0.672 10.930 9.829 1.00 0.00 C ATOM 614 CG GLU A 487 1.143 10.053 10.977 1.00 0.00 C ATOM 615 CD GLU A 487 2.469 9.375 10.687 1.00 0.00 C ATOM 616 OE1 GLU A 487 3.238 9.905 9.858 1.00 0.00 O ATOM 617 OE2 GLU A 487 2.737 8.314 11.289 1.00 0.00 O ATOM 0 H GLU A 487 -0.147 12.031 7.771 1.00 0.00 H new ATOM 0 HA GLU A 487 1.094 9.518 8.265 1.00 0.00 H new ATOM 0 HB2 GLU A 487 1.470 11.623 9.561 1.00 0.00 H new ATOM 0 HB3 GLU A 487 -0.173 11.531 10.165 1.00 0.00 H new ATOM 0 HG2 GLU A 487 1.239 10.660 11.877 1.00 0.00 H new ATOM 0 HG3 GLU A 487 0.388 9.294 11.183 1.00 0.00 H new ATOM 624 N GLN A 488 -2.121 9.815 8.921 1.00 0.00 N ATOM 625 CA GLN A 488 -3.333 9.061 9.218 1.00 0.00 C ATOM 626 C GLN A 488 -3.589 8.000 8.153 1.00 0.00 C ATOM 627 O GLN A 488 -4.031 6.892 8.459 1.00 0.00 O ATOM 628 CB GLN A 488 -4.534 10.003 9.315 1.00 0.00 C ATOM 629 CG GLN A 488 -4.448 10.984 10.473 1.00 0.00 C ATOM 630 CD GLN A 488 -4.680 10.322 11.817 1.00 0.00 C ATOM 631 OE1 GLN A 488 -4.363 9.148 12.007 1.00 0.00 O ATOM 632 NE2 GLN A 488 -5.240 11.074 12.757 1.00 0.00 N ATOM 0 H GLN A 488 -2.277 10.804 8.725 1.00 0.00 H new ATOM 0 HA GLN A 488 -3.194 8.561 10.177 1.00 0.00 H new ATOM 0 HB2 GLN A 488 -4.623 10.561 8.383 1.00 0.00 H new ATOM 0 HB3 GLN A 488 -5.443 9.410 9.419 1.00 0.00 H new ATOM 0 HG2 GLN A 488 -3.467 11.458 10.470 1.00 0.00 H new ATOM 0 HG3 GLN A 488 -5.184 11.775 10.330 1.00 0.00 H new ATOM 0 HE21 GLN A 488 -5.487 12.043 12.555 1.00 0.00 H new ATOM 0 HE22 GLN A 488 -5.424 10.683 13.681 1.00 0.00 H new ATOM 641 N THR A 489 -3.310 8.347 6.901 1.00 0.00 N ATOM 642 CA THR A 489 -3.510 7.424 5.789 1.00 0.00 C ATOM 643 C THR A 489 -2.676 6.161 5.973 1.00 0.00 C ATOM 644 O THR A 489 -3.142 5.053 5.705 1.00 0.00 O ATOM 645 CB THR A 489 -3.148 8.101 4.466 1.00 0.00 C ATOM 646 OG1 THR A 489 -3.859 9.317 4.313 1.00 0.00 O ATOM 647 CG2 THR A 489 -3.440 7.242 3.255 1.00 0.00 C ATOM 0 H THR A 489 -2.945 9.260 6.631 1.00 0.00 H new ATOM 0 HA THR A 489 -4.563 7.142 5.768 1.00 0.00 H new ATOM 0 HB THR A 489 -2.073 8.276 4.516 1.00 0.00 H new ATOM 0 HG1 THR A 489 -3.476 9.997 4.906 1.00 0.00 H new ATOM 0 HG21 THR A 489 -3.160 7.782 2.350 1.00 0.00 H new ATOM 0 HG22 THR A 489 -2.866 6.317 3.318 1.00 0.00 H new ATOM 0 HG23 THR A 489 -4.504 7.008 3.223 1.00 0.00 H new ATOM 655 N VAL A 490 -1.440 6.336 6.431 1.00 0.00 N ATOM 656 CA VAL A 490 -0.542 5.209 6.652 1.00 0.00 C ATOM 657 C VAL A 490 -1.067 4.297 7.755 1.00 0.00 C ATOM 658 O VAL A 490 -0.917 3.078 7.689 1.00 0.00 O ATOM 659 CB VAL A 490 0.875 5.685 7.025 1.00 0.00 C ATOM 660 CG1 VAL A 490 1.834 4.506 7.106 1.00 0.00 C ATOM 661 CG2 VAL A 490 1.372 6.718 6.024 1.00 0.00 C ATOM 0 H VAL A 490 -1.039 7.246 6.656 1.00 0.00 H new ATOM 0 HA VAL A 490 -0.495 4.653 5.716 1.00 0.00 H new ATOM 0 HB VAL A 490 0.832 6.155 8.008 1.00 0.00 H new ATOM 0 HG11 VAL A 490 2.829 4.864 7.371 1.00 0.00 H new ATOM 0 HG12 VAL A 490 1.486 3.806 7.866 1.00 0.00 H new ATOM 0 HG13 VAL A 490 1.874 4.003 6.140 1.00 0.00 H new ATOM 0 HG21 VAL A 490 2.374 7.043 6.304 1.00 0.00 H new ATOM 0 HG22 VAL A 490 1.398 6.276 5.028 1.00 0.00 H new ATOM 0 HG23 VAL A 490 0.700 7.576 6.023 1.00 0.00 H new ATOM 671 N ASN A 491 -1.684 4.897 8.768 1.00 0.00 N ATOM 672 CA ASN A 491 -2.231 4.139 9.887 1.00 0.00 C ATOM 673 C ASN A 491 -3.271 3.131 9.409 1.00 0.00 C ATOM 674 O ASN A 491 -3.258 1.970 9.819 1.00 0.00 O ATOM 675 CB ASN A 491 -2.857 5.086 10.914 1.00 0.00 C ATOM 676 CG ASN A 491 -3.178 4.389 12.221 1.00 0.00 C ATOM 677 OD1 ASN A 491 -2.682 3.297 12.494 1.00 0.00 O ATOM 678 ND2 ASN A 491 -4.013 5.022 13.039 1.00 0.00 N ATOM 0 H ASN A 491 -1.818 5.906 8.837 1.00 0.00 H new ATOM 0 HA ASN A 491 -1.413 3.593 10.356 1.00 0.00 H new ATOM 0 HB2 ASN A 491 -2.174 5.914 11.105 1.00 0.00 H new ATOM 0 HB3 ASN A 491 -3.770 5.515 10.500 1.00 0.00 H new ATOM 0 HD21 ASN A 491 -4.266 4.603 13.934 1.00 0.00 H new ATOM 0 HD22 ASN A 491 -4.401 5.927 12.772 1.00 0.00 H new ATOM 685 N VAL A 492 -4.172 3.581 8.542 1.00 0.00 N ATOM 686 CA VAL A 492 -5.219 2.715 8.011 1.00 0.00 C ATOM 687 C VAL A 492 -4.642 1.678 7.054 1.00 0.00 C ATOM 688 O VAL A 492 -4.916 0.485 7.176 1.00 0.00 O ATOM 689 CB VAL A 492 -6.303 3.529 7.277 1.00 0.00 C ATOM 690 CG1 VAL A 492 -7.445 2.627 6.832 1.00 0.00 C ATOM 691 CG2 VAL A 492 -6.816 4.654 8.162 1.00 0.00 C ATOM 0 H VAL A 492 -4.199 4.539 8.192 1.00 0.00 H new ATOM 0 HA VAL A 492 -5.671 2.207 8.863 1.00 0.00 H new ATOM 0 HB VAL A 492 -5.856 3.972 6.387 1.00 0.00 H new ATOM 0 HG11 VAL A 492 -8.199 3.222 6.316 1.00 0.00 H new ATOM 0 HG12 VAL A 492 -7.062 1.862 6.157 1.00 0.00 H new ATOM 0 HG13 VAL A 492 -7.893 2.150 7.704 1.00 0.00 H new ATOM 0 HG21 VAL A 492 -7.580 5.218 7.627 1.00 0.00 H new ATOM 0 HG22 VAL A 492 -7.245 4.234 9.072 1.00 0.00 H new ATOM 0 HG23 VAL A 492 -5.991 5.317 8.422 1.00 0.00 H new ATOM 701 N LEU A 493 -3.840 2.142 6.101 1.00 0.00 N ATOM 702 CA LEU A 493 -3.225 1.254 5.121 1.00 0.00 C ATOM 703 C LEU A 493 -2.289 0.259 5.800 1.00 0.00 C ATOM 704 O LEU A 493 -2.235 -0.911 5.425 1.00 0.00 O ATOM 705 CB LEU A 493 -2.454 2.065 4.078 1.00 0.00 C ATOM 706 CG LEU A 493 -3.320 2.746 3.018 1.00 0.00 C ATOM 707 CD1 LEU A 493 -2.586 3.931 2.412 1.00 0.00 C ATOM 708 CD2 LEU A 493 -3.715 1.751 1.936 1.00 0.00 C ATOM 0 H LEU A 493 -3.601 3.127 5.987 1.00 0.00 H new ATOM 0 HA LEU A 493 -4.020 0.698 4.624 1.00 0.00 H new ATOM 0 HB2 LEU A 493 -1.870 2.828 4.593 1.00 0.00 H new ATOM 0 HB3 LEU A 493 -1.746 1.405 3.577 1.00 0.00 H new ATOM 0 HG LEU A 493 -4.228 3.113 3.496 1.00 0.00 H new ATOM 0 HD11 LEU A 493 -3.217 4.404 1.660 1.00 0.00 H new ATOM 0 HD12 LEU A 493 -2.352 4.653 3.195 1.00 0.00 H new ATOM 0 HD13 LEU A 493 -1.662 3.587 1.947 1.00 0.00 H new ATOM 0 HD21 LEU A 493 -4.331 2.251 1.189 1.00 0.00 H new ATOM 0 HD22 LEU A 493 -2.818 1.355 1.460 1.00 0.00 H new ATOM 0 HD23 LEU A 493 -4.279 0.933 2.383 1.00 0.00 H new ATOM 720 N ALA A 494 -1.553 0.733 6.799 1.00 0.00 N ATOM 721 CA ALA A 494 -0.619 -0.117 7.527 1.00 0.00 C ATOM 722 C ALA A 494 -1.348 -1.245 8.246 1.00 0.00 C ATOM 723 O ALA A 494 -0.934 -2.403 8.190 1.00 0.00 O ATOM 724 CB ALA A 494 0.186 0.709 8.517 1.00 0.00 C ATOM 0 H ALA A 494 -1.585 1.700 7.123 1.00 0.00 H new ATOM 0 HA ALA A 494 0.064 -0.564 6.805 1.00 0.00 H new ATOM 0 HB1 ALA A 494 0.879 0.061 9.053 1.00 0.00 H new ATOM 0 HB2 ALA A 494 0.746 1.475 7.981 1.00 0.00 H new ATOM 0 HB3 ALA A 494 -0.489 1.185 9.228 1.00 0.00 H new ATOM 730 N GLN A 495 -2.435 -0.897 8.921 1.00 0.00 N ATOM 731 CA GLN A 495 -3.227 -1.875 9.656 1.00 0.00 C ATOM 732 C GLN A 495 -3.980 -2.799 8.701 1.00 0.00 C ATOM 733 O GLN A 495 -4.077 -4.003 8.936 1.00 0.00 O ATOM 734 CB GLN A 495 -4.217 -1.169 10.584 1.00 0.00 C ATOM 735 CG GLN A 495 -3.549 -0.397 11.711 1.00 0.00 C ATOM 736 CD GLN A 495 -4.546 0.343 12.581 1.00 0.00 C ATOM 737 OE1 GLN A 495 -5.698 0.541 12.195 1.00 0.00 O ATOM 738 NE2 GLN A 495 -4.107 0.758 13.763 1.00 0.00 N ATOM 0 H GLN A 495 -2.790 0.058 8.975 1.00 0.00 H new ATOM 0 HA GLN A 495 -2.544 -2.479 10.254 1.00 0.00 H new ATOM 0 HB2 GLN A 495 -4.827 -0.483 9.997 1.00 0.00 H new ATOM 0 HB3 GLN A 495 -4.892 -1.910 11.012 1.00 0.00 H new ATOM 0 HG2 GLN A 495 -2.975 -1.087 12.329 1.00 0.00 H new ATOM 0 HG3 GLN A 495 -2.841 0.316 11.288 1.00 0.00 H new ATOM 0 HE21 GLN A 495 -3.144 0.572 14.043 1.00 0.00 H new ATOM 0 HE22 GLN A 495 -4.733 1.262 14.391 1.00 0.00 H new ATOM 747 N ILE A 496 -4.512 -2.225 7.628 1.00 0.00 N ATOM 748 CA ILE A 496 -5.258 -2.997 6.641 1.00 0.00 C ATOM 749 C ILE A 496 -4.326 -3.887 5.822 1.00 0.00 C ATOM 750 O ILE A 496 -4.621 -5.056 5.576 1.00 0.00 O ATOM 751 CB ILE A 496 -6.068 -2.067 5.703 1.00 0.00 C ATOM 752 CG1 ILE A 496 -7.372 -2.744 5.283 1.00 0.00 C ATOM 753 CG2 ILE A 496 -5.259 -1.662 4.474 1.00 0.00 C ATOM 754 CD1 ILE A 496 -8.429 -1.773 4.803 1.00 0.00 C ATOM 0 H ILE A 496 -4.441 -1.229 7.419 1.00 0.00 H new ATOM 0 HA ILE A 496 -5.957 -3.634 7.183 1.00 0.00 H new ATOM 0 HB ILE A 496 -6.301 -1.158 6.258 1.00 0.00 H new ATOM 0 HG12 ILE A 496 -7.161 -3.460 4.489 1.00 0.00 H new ATOM 0 HG13 ILE A 496 -7.766 -3.310 6.127 1.00 0.00 H new ATOM 0 HG21 ILE A 496 -5.861 -1.010 3.841 1.00 0.00 H new ATOM 0 HG22 ILE A 496 -4.360 -1.133 4.789 1.00 0.00 H new ATOM 0 HG23 ILE A 496 -4.978 -2.554 3.914 1.00 0.00 H new ATOM 0 HD11 ILE A 496 -9.327 -2.323 4.521 1.00 0.00 H new ATOM 0 HD12 ILE A 496 -8.669 -1.072 5.602 1.00 0.00 H new ATOM 0 HD13 ILE A 496 -8.054 -1.224 3.939 1.00 0.00 H new ATOM 766 N LEU A 497 -3.200 -3.319 5.406 1.00 0.00 N ATOM 767 CA LEU A 497 -2.217 -4.053 4.616 1.00 0.00 C ATOM 768 C LEU A 497 -1.557 -5.147 5.446 1.00 0.00 C ATOM 769 O LEU A 497 -1.155 -6.181 4.917 1.00 0.00 O ATOM 770 CB LEU A 497 -1.155 -3.100 4.068 1.00 0.00 C ATOM 771 CG LEU A 497 -1.635 -2.176 2.946 1.00 0.00 C ATOM 772 CD1 LEU A 497 -0.791 -0.912 2.896 1.00 0.00 C ATOM 773 CD2 LEU A 497 -1.595 -2.901 1.609 1.00 0.00 C ATOM 0 H LEU A 497 -2.944 -2.351 5.603 1.00 0.00 H new ATOM 0 HA LEU A 497 -2.738 -4.522 3.781 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -0.780 -2.487 4.888 1.00 0.00 H new ATOM 0 HB3 LEU A 497 -0.315 -3.689 3.700 1.00 0.00 H new ATOM 0 HG LEU A 497 -2.666 -1.889 3.152 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -1.148 -0.268 2.092 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -0.870 -0.384 3.846 1.00 0.00 H new ATOM 0 HD13 LEU A 497 0.250 -1.177 2.714 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -1.939 -2.231 0.821 1.00 0.00 H new ATOM 0 HD22 LEU A 497 -0.573 -3.216 1.397 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -2.244 -3.776 1.650 1.00 0.00 H new ATOM 785 N LYS A 498 -1.447 -4.915 6.750 1.00 0.00 N ATOM 786 CA LYS A 498 -0.832 -5.888 7.646 1.00 0.00 C ATOM 787 C LYS A 498 -1.479 -7.260 7.491 1.00 0.00 C ATOM 788 O LYS A 498 -0.792 -8.261 7.313 1.00 0.00 O ATOM 789 CB LYS A 498 -0.951 -5.424 9.098 1.00 0.00 C ATOM 790 CG LYS A 498 -0.090 -6.220 10.063 1.00 0.00 C ATOM 791 CD LYS A 498 1.350 -5.737 10.052 1.00 0.00 C ATOM 792 CE LYS A 498 2.290 -6.768 10.655 1.00 0.00 C ATOM 793 NZ LYS A 498 1.739 -7.361 11.904 1.00 0.00 N ATOM 0 H LYS A 498 -1.774 -4.065 7.209 1.00 0.00 H new ATOM 0 HA LYS A 498 0.222 -5.969 7.379 1.00 0.00 H new ATOM 0 HB2 LYS A 498 -0.672 -4.372 9.158 1.00 0.00 H new ATOM 0 HB3 LYS A 498 -1.993 -5.496 9.410 1.00 0.00 H new ATOM 0 HG2 LYS A 498 -0.496 -6.134 11.071 1.00 0.00 H new ATOM 0 HG3 LYS A 498 -0.123 -7.276 9.795 1.00 0.00 H new ATOM 0 HD2 LYS A 498 1.654 -5.521 9.028 1.00 0.00 H new ATOM 0 HD3 LYS A 498 1.426 -4.804 10.610 1.00 0.00 H new ATOM 0 HE2 LYS A 498 2.474 -7.559 9.928 1.00 0.00 H new ATOM 0 HE3 LYS A 498 3.251 -6.301 10.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 498 2.496 -7.857 12.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 498 1.352 -6.606 12.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 498 0.984 -8.035 11.665 1.00 0.00 H new ATOM 807 N ARG A 499 -2.802 -7.298 7.568 1.00 0.00 N ATOM 808 CA ARG A 499 -3.544 -8.548 7.438 1.00 0.00 C ATOM 809 C ARG A 499 -3.713 -8.959 5.973 1.00 0.00 C ATOM 810 O ARG A 499 -4.084 -10.096 5.680 1.00 0.00 O ATOM 811 CB ARG A 499 -4.919 -8.427 8.102 1.00 0.00 C ATOM 812 CG ARG A 499 -4.920 -7.590 9.372 1.00 0.00 C ATOM 813 CD ARG A 499 -3.912 -8.107 10.386 1.00 0.00 C ATOM 814 NE ARG A 499 -4.476 -9.153 11.236 1.00 0.00 N ATOM 815 CZ ARG A 499 -3.962 -9.513 12.410 1.00 0.00 C ATOM 816 NH1 ARG A 499 -2.872 -8.917 12.875 1.00 0.00 N ATOM 817 NH2 ARG A 499 -4.540 -10.472 13.120 1.00 0.00 N ATOM 0 H ARG A 499 -3.386 -6.476 7.720 1.00 0.00 H new ATOM 0 HA ARG A 499 -2.964 -9.322 7.942 1.00 0.00 H new ATOM 0 HB2 ARG A 499 -5.618 -7.989 7.390 1.00 0.00 H new ATOM 0 HB3 ARG A 499 -5.287 -9.426 8.337 1.00 0.00 H new ATOM 0 HG2 ARG A 499 -4.689 -6.554 9.125 1.00 0.00 H new ATOM 0 HG3 ARG A 499 -5.917 -7.598 9.813 1.00 0.00 H new ATOM 0 HD2 ARG A 499 -3.039 -8.497 9.863 1.00 0.00 H new ATOM 0 HD3 ARG A 499 -3.568 -7.281 11.008 1.00 0.00 H new ATOM 0 HE ARG A 499 -5.313 -9.636 10.911 1.00 0.00 H new ATOM 0 HH11 ARG A 499 -2.423 -8.179 12.332 1.00 0.00 H new ATOM 0 HH12 ARG A 499 -2.482 -9.197 13.775 1.00 0.00 H new ATOM 0 HH21 ARG A 499 -5.378 -10.934 12.767 1.00 0.00 H new ATOM 0 HH22 ARG A 499 -4.147 -10.748 14.020 1.00 0.00 H new ATOM 831 N LEU A 500 -3.475 -8.021 5.058 1.00 0.00 N ATOM 832 CA LEU A 500 -3.639 -8.278 3.626 1.00 0.00 C ATOM 833 C LEU A 500 -3.021 -9.605 3.188 1.00 0.00 C ATOM 834 O LEU A 500 -3.471 -10.211 2.217 1.00 0.00 O ATOM 835 CB LEU A 500 -3.055 -7.127 2.805 1.00 0.00 C ATOM 836 CG LEU A 500 -4.014 -6.511 1.783 1.00 0.00 C ATOM 837 CD1 LEU A 500 -4.762 -5.337 2.395 1.00 0.00 C ATOM 838 CD2 LEU A 500 -3.256 -6.074 0.538 1.00 0.00 C ATOM 0 H LEU A 500 -3.168 -7.075 5.282 1.00 0.00 H new ATOM 0 HA LEU A 500 -4.711 -8.349 3.441 1.00 0.00 H new ATOM 0 HB2 LEU A 500 -2.724 -6.345 3.488 1.00 0.00 H new ATOM 0 HB3 LEU A 500 -2.170 -7.487 2.280 1.00 0.00 H new ATOM 0 HG LEU A 500 -4.743 -7.268 1.493 1.00 0.00 H new ATOM 0 HD11 LEU A 500 -5.439 -4.911 1.655 1.00 0.00 H new ATOM 0 HD12 LEU A 500 -5.335 -5.680 3.256 1.00 0.00 H new ATOM 0 HD13 LEU A 500 -4.048 -4.577 2.713 1.00 0.00 H new ATOM 0 HD21 LEU A 500 -3.953 -5.638 -0.178 1.00 0.00 H new ATOM 0 HD22 LEU A 500 -2.505 -5.332 0.811 1.00 0.00 H new ATOM 0 HD23 LEU A 500 -2.766 -6.938 0.088 1.00 0.00 H new ATOM 850 N ASN A 501 -1.993 -10.054 3.896 1.00 0.00 N ATOM 851 CA ASN A 501 -1.331 -11.311 3.555 1.00 0.00 C ATOM 852 C ASN A 501 -0.969 -11.365 2.069 1.00 0.00 C ATOM 853 O ASN A 501 -1.249 -12.356 1.393 1.00 0.00 O ATOM 854 CB ASN A 501 -2.234 -12.493 3.914 1.00 0.00 C ATOM 855 CG ASN A 501 -1.452 -13.678 4.445 1.00 0.00 C ATOM 856 OD1 ASN A 501 -1.761 -14.215 5.509 1.00 0.00 O ATOM 857 ND2 ASN A 501 -0.431 -14.094 3.704 1.00 0.00 N ATOM 0 H ASN A 501 -1.600 -9.572 4.705 1.00 0.00 H new ATOM 0 HA ASN A 501 -0.407 -11.371 4.131 1.00 0.00 H new ATOM 0 HB2 ASN A 501 -2.961 -12.177 4.662 1.00 0.00 H new ATOM 0 HB3 ASN A 501 -2.796 -12.798 3.031 1.00 0.00 H new ATOM 0 HD21 ASN A 501 0.132 -14.888 4.011 1.00 0.00 H new ATOM 0 HD22 ASN A 501 -0.210 -13.620 2.828 1.00 0.00 H new ATOM 864 N PRO A 502 -0.336 -10.302 1.535 1.00 0.00 N ATOM 865 CA PRO A 502 0.057 -10.253 0.128 1.00 0.00 C ATOM 866 C PRO A 502 1.389 -10.951 -0.127 1.00 0.00 C ATOM 867 O PRO A 502 2.333 -10.810 0.649 1.00 0.00 O ATOM 868 CB PRO A 502 0.182 -8.755 -0.131 1.00 0.00 C ATOM 869 CG PRO A 502 0.631 -8.187 1.172 1.00 0.00 C ATOM 870 CD PRO A 502 0.051 -9.068 2.252 1.00 0.00 C ATOM 0 HA PRO A 502 -0.655 -10.762 -0.521 1.00 0.00 H new ATOM 0 HB2 PRO A 502 0.901 -8.548 -0.923 1.00 0.00 H new ATOM 0 HB3 PRO A 502 -0.770 -8.326 -0.444 1.00 0.00 H new ATOM 0 HG2 PRO A 502 1.719 -8.168 1.231 1.00 0.00 H new ATOM 0 HG3 PRO A 502 0.287 -7.159 1.285 1.00 0.00 H new ATOM 0 HD2 PRO A 502 0.781 -9.273 3.035 1.00 0.00 H new ATOM 0 HD3 PRO A 502 -0.808 -8.599 2.732 1.00 0.00 H new ATOM 878 N GLU A 503 1.458 -11.704 -1.220 1.00 0.00 N ATOM 879 CA GLU A 503 2.677 -12.421 -1.576 1.00 0.00 C ATOM 880 C GLU A 503 3.783 -11.449 -1.971 1.00 0.00 C ATOM 881 O GLU A 503 3.540 -10.474 -2.683 1.00 0.00 O ATOM 882 CB GLU A 503 2.404 -13.396 -2.723 1.00 0.00 C ATOM 883 CG GLU A 503 1.405 -14.486 -2.371 1.00 0.00 C ATOM 884 CD GLU A 503 1.875 -15.359 -1.224 1.00 0.00 C ATOM 885 OE1 GLU A 503 3.089 -15.352 -0.931 1.00 0.00 O ATOM 886 OE2 GLU A 503 1.028 -16.049 -0.618 1.00 0.00 O ATOM 0 H GLU A 503 0.686 -11.833 -1.873 1.00 0.00 H new ATOM 0 HA GLU A 503 3.007 -12.983 -0.702 1.00 0.00 H new ATOM 0 HB2 GLU A 503 2.032 -12.838 -3.582 1.00 0.00 H new ATOM 0 HB3 GLU A 503 3.343 -13.859 -3.026 1.00 0.00 H new ATOM 0 HG2 GLU A 503 0.451 -14.028 -2.107 1.00 0.00 H new ATOM 0 HG3 GLU A 503 1.228 -15.109 -3.248 1.00 0.00 H new ATOM 893 N ARG A 504 4.997 -11.718 -1.504 1.00 0.00 N ATOM 894 CA ARG A 504 6.139 -10.865 -1.809 1.00 0.00 C ATOM 895 C ARG A 504 6.755 -11.241 -3.153 1.00 0.00 C ATOM 896 O ARG A 504 7.062 -12.407 -3.402 1.00 0.00 O ATOM 897 CB ARG A 504 7.193 -10.970 -0.706 1.00 0.00 C ATOM 898 CG ARG A 504 6.700 -10.506 0.655 1.00 0.00 C ATOM 899 CD ARG A 504 7.840 -10.398 1.653 1.00 0.00 C ATOM 900 NE ARG A 504 8.559 -11.661 1.804 1.00 0.00 N ATOM 901 CZ ARG A 504 9.778 -11.762 2.328 1.00 0.00 C ATOM 902 NH1 ARG A 504 10.419 -10.679 2.751 1.00 0.00 N ATOM 903 NH2 ARG A 504 10.359 -12.949 2.429 1.00 0.00 N ATOM 0 H ARG A 504 5.215 -12.520 -0.913 1.00 0.00 H new ATOM 0 HA ARG A 504 5.785 -9.836 -1.866 1.00 0.00 H new ATOM 0 HB2 ARG A 504 7.524 -12.006 -0.629 1.00 0.00 H new ATOM 0 HB3 ARG A 504 8.063 -10.377 -0.989 1.00 0.00 H new ATOM 0 HG2 ARG A 504 6.210 -9.538 0.555 1.00 0.00 H new ATOM 0 HG3 ARG A 504 5.952 -11.205 1.030 1.00 0.00 H new ATOM 0 HD2 ARG A 504 8.534 -9.623 1.328 1.00 0.00 H new ATOM 0 HD3 ARG A 504 7.446 -10.088 2.621 1.00 0.00 H new ATOM 0 HE ARG A 504 8.100 -12.516 1.489 1.00 0.00 H new ATOM 0 HH11 ARG A 504 9.977 -9.763 2.675 1.00 0.00 H new ATOM 0 HH12 ARG A 504 11.353 -10.763 3.152 1.00 0.00 H new ATOM 0 HH21 ARG A 504 9.872 -13.785 2.105 1.00 0.00 H new ATOM 0 HH22 ARG A 504 11.293 -13.027 2.831 1.00 0.00 H new ATOM 917 N LYS A 505 6.933 -10.246 -4.017 1.00 0.00 N ATOM 918 CA LYS A 505 7.513 -10.472 -5.335 1.00 0.00 C ATOM 919 C LYS A 505 8.438 -9.325 -5.728 1.00 0.00 C ATOM 920 O LYS A 505 8.073 -8.154 -5.611 1.00 0.00 O ATOM 921 CB LYS A 505 6.407 -10.632 -6.380 1.00 0.00 C ATOM 922 CG LYS A 505 6.920 -11.050 -7.749 1.00 0.00 C ATOM 923 CD LYS A 505 5.841 -10.923 -8.810 1.00 0.00 C ATOM 924 CE LYS A 505 4.737 -11.950 -8.609 1.00 0.00 C ATOM 925 NZ LYS A 505 5.202 -13.331 -8.916 1.00 0.00 N ATOM 0 H LYS A 505 6.684 -9.275 -3.827 1.00 0.00 H new ATOM 0 HA LYS A 505 8.101 -11.389 -5.293 1.00 0.00 H new ATOM 0 HB2 LYS A 505 5.690 -11.374 -6.028 1.00 0.00 H new ATOM 0 HB3 LYS A 505 5.869 -9.689 -6.475 1.00 0.00 H new ATOM 0 HG2 LYS A 505 7.775 -10.432 -8.023 1.00 0.00 H new ATOM 0 HG3 LYS A 505 7.272 -12.081 -7.708 1.00 0.00 H new ATOM 0 HD2 LYS A 505 5.416 -9.920 -8.780 1.00 0.00 H new ATOM 0 HD3 LYS A 505 6.284 -11.052 -9.798 1.00 0.00 H new ATOM 0 HE2 LYS A 505 4.384 -11.906 -7.579 1.00 0.00 H new ATOM 0 HE3 LYS A 505 3.889 -11.702 -9.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 505 4.383 -13.970 -8.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 505 5.700 -13.335 -9.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 505 5.848 -13.654 -8.168 1.00 0.00 H new ATOM 939 N MET A 506 9.634 -9.666 -6.192 1.00 0.00 N ATOM 940 CA MET A 506 10.609 -8.664 -6.603 1.00 0.00 C ATOM 941 C MET A 506 10.523 -8.399 -8.101 1.00 0.00 C ATOM 942 O MET A 506 10.640 -9.317 -8.913 1.00 0.00 O ATOM 943 CB MET A 506 12.025 -9.116 -6.237 1.00 0.00 C ATOM 944 CG MET A 506 12.309 -9.080 -4.744 1.00 0.00 C ATOM 945 SD MET A 506 12.088 -7.438 -4.033 1.00 0.00 S ATOM 946 CE MET A 506 13.325 -6.508 -4.934 1.00 0.00 C ATOM 0 H MET A 506 9.952 -10.630 -6.293 1.00 0.00 H new ATOM 0 HA MET A 506 10.381 -7.738 -6.074 1.00 0.00 H new ATOM 0 HB2 MET A 506 12.179 -10.131 -6.603 1.00 0.00 H new ATOM 0 HB3 MET A 506 12.745 -8.479 -6.751 1.00 0.00 H new ATOM 0 HG2 MET A 506 11.649 -9.783 -4.236 1.00 0.00 H new ATOM 0 HG3 MET A 506 13.331 -9.415 -4.564 1.00 0.00 H new ATOM 0 HE1 MET A 506 13.461 -5.534 -4.465 1.00 0.00 H new ATOM 0 HE2 MET A 506 14.270 -7.052 -4.921 1.00 0.00 H new ATOM 0 HE3 MET A 506 12.998 -6.372 -5.965 1.00 0.00 H new ATOM 956 N ILE A 507 10.319 -7.136 -8.463 1.00 0.00 N ATOM 957 CA ILE A 507 10.220 -6.748 -9.865 1.00 0.00 C ATOM 958 C ILE A 507 11.372 -5.829 -10.257 1.00 0.00 C ATOM 959 O ILE A 507 11.532 -4.747 -9.694 1.00 0.00 O ATOM 960 CB ILE A 507 8.886 -6.035 -10.158 1.00 0.00 C ATOM 961 CG1 ILE A 507 7.712 -6.866 -9.636 1.00 0.00 C ATOM 962 CG2 ILE A 507 8.736 -5.779 -11.650 1.00 0.00 C ATOM 963 CD1 ILE A 507 6.372 -6.181 -9.785 1.00 0.00 C ATOM 0 H ILE A 507 10.219 -6.364 -7.804 1.00 0.00 H new ATOM 0 HA ILE A 507 10.269 -7.664 -10.454 1.00 0.00 H new ATOM 0 HB ILE A 507 8.886 -5.075 -9.643 1.00 0.00 H new ATOM 0 HG12 ILE A 507 7.686 -7.817 -10.168 1.00 0.00 H new ATOM 0 HG13 ILE A 507 7.879 -7.094 -8.583 1.00 0.00 H new ATOM 0 HG21 ILE A 507 7.788 -5.275 -11.839 1.00 0.00 H new ATOM 0 HG22 ILE A 507 9.557 -5.151 -11.996 1.00 0.00 H new ATOM 0 HG23 ILE A 507 8.755 -6.728 -12.186 1.00 0.00 H new ATOM 0 HD11 ILE A 507 5.587 -6.828 -9.394 1.00 0.00 H new ATOM 0 HD12 ILE A 507 6.379 -5.243 -9.230 1.00 0.00 H new ATOM 0 HD13 ILE A 507 6.183 -5.977 -10.839 1.00 0.00 H new ATOM 975 N ASN A 508 12.172 -6.271 -11.223 1.00 0.00 N ATOM 976 CA ASN A 508 13.315 -5.492 -11.691 1.00 0.00 C ATOM 977 C ASN A 508 14.337 -5.302 -10.574 1.00 0.00 C ATOM 978 O ASN A 508 15.357 -5.988 -10.529 1.00 0.00 O ATOM 979 CB ASN A 508 12.853 -4.133 -12.223 1.00 0.00 C ATOM 980 CG ASN A 508 12.031 -4.257 -13.490 1.00 0.00 C ATOM 981 OD1 ASN A 508 10.922 -3.730 -13.578 1.00 0.00 O ATOM 982 ND2 ASN A 508 12.571 -4.958 -14.481 1.00 0.00 N ATOM 0 H ASN A 508 12.050 -7.166 -11.698 1.00 0.00 H new ATOM 0 HA ASN A 508 13.792 -6.043 -12.502 1.00 0.00 H new ATOM 0 HB2 ASN A 508 12.263 -3.628 -11.458 1.00 0.00 H new ATOM 0 HB3 ASN A 508 13.724 -3.507 -12.418 1.00 0.00 H new ATOM 0 HD21 ASN A 508 12.063 -5.076 -15.358 1.00 0.00 H new ATOM 0 HD22 ASN A 508 13.493 -5.378 -14.365 1.00 0.00 H new ATOM 989 N ASP A 509 14.053 -4.368 -9.676 1.00 0.00 N ATOM 990 CA ASP A 509 14.943 -4.085 -8.555 1.00 0.00 C ATOM 991 C ASP A 509 14.199 -3.360 -7.439 1.00 0.00 C ATOM 992 O ASP A 509 14.789 -2.582 -6.689 1.00 0.00 O ATOM 993 CB ASP A 509 16.134 -3.245 -9.022 1.00 0.00 C ATOM 994 CG ASP A 509 17.184 -3.081 -7.940 1.00 0.00 C ATOM 995 OD1 ASP A 509 18.032 -3.987 -7.793 1.00 0.00 O ATOM 996 OD2 ASP A 509 17.159 -2.046 -7.240 1.00 0.00 O ATOM 0 H ASP A 509 13.212 -3.792 -9.701 1.00 0.00 H new ATOM 0 HA ASP A 509 15.309 -5.035 -8.164 1.00 0.00 H new ATOM 0 HB2 ASP A 509 16.586 -3.715 -9.896 1.00 0.00 H new ATOM 0 HB3 ASP A 509 15.782 -2.262 -9.335 1.00 0.00 H new ATOM 1001 N LYS A 510 12.899 -3.620 -7.334 1.00 0.00 N ATOM 1002 CA LYS A 510 12.074 -2.992 -6.308 1.00 0.00 C ATOM 1003 C LYS A 510 11.160 -4.016 -5.644 1.00 0.00 C ATOM 1004 O LYS A 510 10.833 -5.046 -6.233 1.00 0.00 O ATOM 1005 CB LYS A 510 11.237 -1.864 -6.915 1.00 0.00 C ATOM 1006 CG LYS A 510 12.069 -0.772 -7.567 1.00 0.00 C ATOM 1007 CD LYS A 510 12.348 -1.083 -9.029 1.00 0.00 C ATOM 1008 CE LYS A 510 13.147 0.028 -9.691 1.00 0.00 C ATOM 1009 NZ LYS A 510 13.436 -0.271 -11.121 1.00 0.00 N ATOM 0 H LYS A 510 12.395 -4.261 -7.947 1.00 0.00 H new ATOM 0 HA LYS A 510 12.737 -2.576 -5.550 1.00 0.00 H new ATOM 0 HB2 LYS A 510 10.559 -2.285 -7.658 1.00 0.00 H new ATOM 0 HB3 LYS A 510 10.619 -1.421 -6.134 1.00 0.00 H new ATOM 0 HG2 LYS A 510 11.545 0.181 -7.490 1.00 0.00 H new ATOM 0 HG3 LYS A 510 13.012 -0.662 -7.031 1.00 0.00 H new ATOM 0 HD2 LYS A 510 12.896 -2.022 -9.104 1.00 0.00 H new ATOM 0 HD3 LYS A 510 11.406 -1.221 -9.559 1.00 0.00 H new ATOM 0 HE2 LYS A 510 12.594 0.964 -9.621 1.00 0.00 H new ATOM 0 HE3 LYS A 510 14.084 0.171 -9.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 510 13.982 0.511 -11.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 510 13.986 -1.151 -11.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 510 12.542 -0.382 -11.640 1.00 0.00 H new ATOM 1023 N MET A 511 10.751 -3.727 -4.412 1.00 0.00 N ATOM 1024 CA MET A 511 9.874 -4.623 -3.669 1.00 0.00 C ATOM 1025 C MET A 511 8.411 -4.343 -3.995 1.00 0.00 C ATOM 1026 O MET A 511 7.946 -3.208 -3.884 1.00 0.00 O ATOM 1027 CB MET A 511 10.112 -4.472 -2.165 1.00 0.00 C ATOM 1028 CG MET A 511 9.333 -5.468 -1.322 1.00 0.00 C ATOM 1029 SD MET A 511 9.524 -5.181 0.448 1.00 0.00 S ATOM 1030 CE MET A 511 8.558 -3.688 0.654 1.00 0.00 C ATOM 0 H MET A 511 11.013 -2.880 -3.908 1.00 0.00 H new ATOM 0 HA MET A 511 10.105 -5.646 -3.965 1.00 0.00 H new ATOM 0 HB2 MET A 511 11.176 -4.590 -1.961 1.00 0.00 H new ATOM 0 HB3 MET A 511 9.839 -3.461 -1.862 1.00 0.00 H new ATOM 0 HG2 MET A 511 8.276 -5.411 -1.583 1.00 0.00 H new ATOM 0 HG3 MET A 511 9.666 -6.478 -1.560 1.00 0.00 H new ATOM 0 HE1 MET A 511 8.579 -3.383 1.700 1.00 0.00 H new ATOM 0 HE2 MET A 511 8.978 -2.895 0.036 1.00 0.00 H new ATOM 0 HE3 MET A 511 7.528 -3.877 0.352 1.00 0.00 H new ATOM 1040 N HIS A 512 7.690 -5.384 -4.396 1.00 0.00 N ATOM 1041 CA HIS A 512 6.279 -5.250 -4.739 1.00 0.00 C ATOM 1042 C HIS A 512 5.446 -6.329 -4.054 1.00 0.00 C ATOM 1043 O HIS A 512 5.984 -7.305 -3.534 1.00 0.00 O ATOM 1044 CB HIS A 512 6.090 -5.329 -6.255 1.00 0.00 C ATOM 1045 CG HIS A 512 6.573 -4.113 -6.983 1.00 0.00 C ATOM 1046 ND1 HIS A 512 7.829 -4.022 -7.545 1.00 0.00 N ATOM 1047 CD2 HIS A 512 5.961 -2.933 -7.241 1.00 0.00 C ATOM 1048 CE1 HIS A 512 7.969 -2.838 -8.116 1.00 0.00 C ATOM 1049 NE2 HIS A 512 6.848 -2.160 -7.946 1.00 0.00 N ATOM 0 H HIS A 512 8.059 -6.330 -4.492 1.00 0.00 H new ATOM 0 HA HIS A 512 5.938 -4.276 -4.388 1.00 0.00 H new ATOM 0 HB2 HIS A 512 6.619 -6.203 -6.634 1.00 0.00 H new ATOM 0 HB3 HIS A 512 5.033 -5.477 -6.474 1.00 0.00 H new ATOM 0 HD2 HIS A 512 4.960 -2.653 -6.946 1.00 0.00 H new ATOM 0 HE1 HIS A 512 8.849 -2.485 -8.633 1.00 0.00 H new ATOM 0 HE2 HIS A 512 6.671 -1.214 -8.284 1.00 0.00 H new ATOM 1058 N PHE A 513 4.129 -6.145 -4.060 1.00 0.00 N ATOM 1059 CA PHE A 513 3.221 -7.102 -3.441 1.00 0.00 C ATOM 1060 C PHE A 513 2.250 -7.675 -4.468 1.00 0.00 C ATOM 1061 O PHE A 513 1.983 -7.056 -5.497 1.00 0.00 O ATOM 1062 CB PHE A 513 2.442 -6.435 -2.305 1.00 0.00 C ATOM 1063 CG PHE A 513 3.278 -6.150 -1.090 1.00 0.00 C ATOM 1064 CD1 PHE A 513 3.480 -7.126 -0.128 1.00 0.00 C ATOM 1065 CD2 PHE A 513 3.861 -4.905 -0.909 1.00 0.00 C ATOM 1066 CE1 PHE A 513 4.247 -6.867 0.992 1.00 0.00 C ATOM 1067 CE2 PHE A 513 4.629 -4.641 0.210 1.00 0.00 C ATOM 1068 CZ PHE A 513 4.821 -5.623 1.162 1.00 0.00 C ATOM 0 H PHE A 513 3.668 -5.342 -4.487 1.00 0.00 H new ATOM 0 HA PHE A 513 3.817 -7.919 -3.035 1.00 0.00 H new ATOM 0 HB2 PHE A 513 2.014 -5.501 -2.669 1.00 0.00 H new ATOM 0 HB3 PHE A 513 1.609 -7.078 -2.020 1.00 0.00 H new ATOM 0 HD1 PHE A 513 3.033 -8.101 -0.255 1.00 0.00 H new ATOM 0 HD2 PHE A 513 3.714 -4.133 -1.650 1.00 0.00 H new ATOM 0 HE1 PHE A 513 4.397 -7.637 1.734 1.00 0.00 H new ATOM 0 HE2 PHE A 513 5.078 -3.668 0.340 1.00 0.00 H new ATOM 0 HZ PHE A 513 5.419 -5.418 2.038 1.00 0.00 H new ATOM 1078 N SER A 514 1.726 -8.862 -4.181 1.00 0.00 N ATOM 1079 CA SER A 514 0.783 -9.519 -5.081 1.00 0.00 C ATOM 1080 C SER A 514 -0.240 -10.331 -4.295 1.00 0.00 C ATOM 1081 O SER A 514 0.030 -10.776 -3.179 1.00 0.00 O ATOM 1082 CB SER A 514 1.530 -10.427 -6.060 1.00 0.00 C ATOM 1083 OG SER A 514 2.107 -11.535 -5.390 1.00 0.00 O ATOM 0 H SER A 514 1.938 -9.389 -3.334 1.00 0.00 H new ATOM 0 HA SER A 514 0.255 -8.748 -5.642 1.00 0.00 H new ATOM 0 HB2 SER A 514 0.843 -10.781 -6.829 1.00 0.00 H new ATOM 0 HB3 SER A 514 2.310 -9.858 -6.566 1.00 0.00 H new ATOM 0 HG SER A 514 2.577 -12.100 -6.038 1.00 0.00 H new ATOM 1089 N LEU A 515 -1.416 -10.521 -4.884 1.00 0.00 N ATOM 1090 CA LEU A 515 -2.480 -11.278 -4.236 1.00 0.00 C ATOM 1091 C LEU A 515 -3.207 -12.165 -5.243 1.00 0.00 C ATOM 1092 O LEU A 515 -3.668 -11.693 -6.282 1.00 0.00 O ATOM 1093 CB LEU A 515 -3.472 -10.328 -3.562 1.00 0.00 C ATOM 1094 CG LEU A 515 -3.961 -10.778 -2.181 1.00 0.00 C ATOM 1095 CD1 LEU A 515 -3.809 -9.653 -1.167 1.00 0.00 C ATOM 1096 CD2 LEU A 515 -5.409 -11.241 -2.251 1.00 0.00 C ATOM 0 H LEU A 515 -1.656 -10.162 -5.808 1.00 0.00 H new ATOM 0 HA LEU A 515 -2.029 -11.917 -3.477 1.00 0.00 H new ATOM 0 HB2 LEU A 515 -3.005 -9.348 -3.464 1.00 0.00 H new ATOM 0 HB3 LEU A 515 -4.336 -10.205 -4.215 1.00 0.00 H new ATOM 0 HG LEU A 515 -3.347 -11.618 -1.857 1.00 0.00 H new ATOM 0 HD11 LEU A 515 -4.161 -9.991 -0.193 1.00 0.00 H new ATOM 0 HD12 LEU A 515 -2.759 -9.368 -1.094 1.00 0.00 H new ATOM 0 HD13 LEU A 515 -4.397 -8.793 -1.487 1.00 0.00 H new ATOM 0 HD21 LEU A 515 -5.738 -11.557 -1.261 1.00 0.00 H new ATOM 0 HD22 LEU A 515 -6.037 -10.420 -2.598 1.00 0.00 H new ATOM 0 HD23 LEU A 515 -5.490 -12.078 -2.944 1.00 0.00 H new ATOM 1108 N LYS A 516 -3.307 -13.452 -4.927 1.00 0.00 N ATOM 1109 CA LYS A 516 -3.978 -14.404 -5.802 1.00 0.00 C ATOM 1110 C LYS A 516 -5.416 -14.638 -5.349 1.00 0.00 C ATOM 1111 O LYS A 516 -5.671 -14.913 -4.177 1.00 0.00 O ATOM 1112 CB LYS A 516 -3.218 -15.731 -5.828 1.00 0.00 C ATOM 1113 CG LYS A 516 -1.822 -15.621 -6.417 1.00 0.00 C ATOM 1114 CD LYS A 516 -1.153 -16.982 -6.524 1.00 0.00 C ATOM 1115 CE LYS A 516 0.284 -16.861 -7.005 1.00 0.00 C ATOM 1116 NZ LYS A 516 1.176 -17.854 -6.346 1.00 0.00 N ATOM 0 H LYS A 516 -2.931 -13.859 -4.071 1.00 0.00 H new ATOM 0 HA LYS A 516 -3.995 -13.984 -6.808 1.00 0.00 H new ATOM 0 HB2 LYS A 516 -3.145 -16.118 -4.812 1.00 0.00 H new ATOM 0 HB3 LYS A 516 -3.791 -16.457 -6.405 1.00 0.00 H new ATOM 0 HG2 LYS A 516 -1.878 -15.163 -7.405 1.00 0.00 H new ATOM 0 HG3 LYS A 516 -1.214 -14.964 -5.795 1.00 0.00 H new ATOM 0 HD2 LYS A 516 -1.172 -17.475 -5.552 1.00 0.00 H new ATOM 0 HD3 LYS A 516 -1.716 -17.612 -7.212 1.00 0.00 H new ATOM 0 HE2 LYS A 516 0.318 -17.003 -8.085 1.00 0.00 H new ATOM 0 HE3 LYS A 516 0.650 -15.854 -6.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 2.147 -17.738 -6.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 1.164 -17.703 -5.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 0.842 -18.816 -6.559 1.00 0.00 H new ATOM 1130 N GLU A 517 -6.352 -14.527 -6.286 1.00 0.00 N ATOM 1131 CA GLU A 517 -7.764 -14.726 -5.982 1.00 0.00 C ATOM 1132 C GLU A 517 -8.099 -16.211 -5.899 1.00 0.00 C ATOM 1133 O GLU A 517 -8.176 -16.861 -6.963 1.00 0.00 O ATOM 1134 CB GLU A 517 -8.636 -14.054 -7.045 1.00 0.00 C ATOM 1135 CG GLU A 517 -8.438 -12.550 -7.132 1.00 0.00 C ATOM 1136 CD GLU A 517 -9.371 -11.896 -8.132 1.00 0.00 C ATOM 1137 OE1 GLU A 517 -9.114 -12.015 -9.349 1.00 0.00 O ATOM 1138 OE2 GLU A 517 -10.357 -11.264 -7.699 1.00 0.00 O ATOM 1139 OXT GLU A 517 -8.280 -16.714 -4.769 1.00 0.00 O ATOM 0 H GLU A 517 -6.158 -14.300 -7.261 1.00 0.00 H new ATOM 0 HA GLU A 517 -7.968 -14.271 -5.013 1.00 0.00 H new ATOM 0 HB2 GLU A 517 -8.417 -14.498 -8.016 1.00 0.00 H new ATOM 0 HB3 GLU A 517 -9.684 -14.262 -6.828 1.00 0.00 H new ATOM 0 HG2 GLU A 517 -8.599 -12.109 -6.148 1.00 0.00 H new ATOM 0 HG3 GLU A 517 -7.406 -12.339 -7.412 1.00 0.00 H new ATOM 1187 N GLU B 945 9.537 13.446 3.473 1.00 0.00 N ATOM 1188 CA GLU B 945 8.573 12.760 4.325 1.00 0.00 C ATOM 1189 C GLU B 945 7.833 11.675 3.549 1.00 0.00 C ATOM 1190 O GLU B 945 7.410 10.670 4.118 1.00 0.00 O ATOM 1191 CB GLU B 945 7.572 13.762 4.906 1.00 0.00 C ATOM 1192 CG GLU B 945 6.685 14.415 3.859 1.00 0.00 C ATOM 1193 CD GLU B 945 5.783 15.487 4.442 1.00 0.00 C ATOM 1194 OE1 GLU B 945 5.698 15.581 5.685 1.00 0.00 O ATOM 1195 OE2 GLU B 945 5.160 16.231 3.655 1.00 0.00 O ATOM 0 HA GLU B 945 9.119 12.287 5.141 1.00 0.00 H new ATOM 0 HB2 GLU B 945 6.943 13.252 5.636 1.00 0.00 H new ATOM 0 HB3 GLU B 945 8.118 14.538 5.442 1.00 0.00 H new ATOM 0 HG2 GLU B 945 7.310 14.855 3.082 1.00 0.00 H new ATOM 0 HG3 GLU B 945 6.072 13.651 3.380 1.00 0.00 H new ATOM 1202 N ALA B 946 7.680 11.887 2.245 1.00 0.00 N ATOM 1203 CA ALA B 946 6.991 10.926 1.391 1.00 0.00 C ATOM 1204 C ALA B 946 7.685 9.568 1.420 1.00 0.00 C ATOM 1205 O ALA B 946 7.032 8.526 1.406 1.00 0.00 O ATOM 1206 CB ALA B 946 6.912 11.449 -0.034 1.00 0.00 C ATOM 0 H ALA B 946 8.023 12.715 1.758 1.00 0.00 H new ATOM 0 HA ALA B 946 5.980 10.796 1.776 1.00 0.00 H new ATOM 0 HB1 ALA B 946 6.395 10.722 -0.660 1.00 0.00 H new ATOM 0 HB2 ALA B 946 6.365 12.392 -0.046 1.00 0.00 H new ATOM 0 HB3 ALA B 946 7.919 11.609 -0.419 1.00 0.00 H new ATOM 1212 N ASP B 947 9.013 9.589 1.462 1.00 0.00 N ATOM 1213 CA ASP B 947 9.796 8.359 1.493 1.00 0.00 C ATOM 1214 C ASP B 947 9.447 7.525 2.722 1.00 0.00 C ATOM 1215 O ASP B 947 9.291 6.307 2.634 1.00 0.00 O ATOM 1216 CB ASP B 947 11.292 8.680 1.488 1.00 0.00 C ATOM 1217 CG ASP B 947 11.743 9.320 0.190 1.00 0.00 C ATOM 1218 OD1 ASP B 947 10.991 9.237 -0.805 1.00 0.00 O ATOM 1219 OD2 ASP B 947 12.847 9.902 0.166 1.00 0.00 O ATOM 0 H ASP B 947 9.569 10.444 1.475 1.00 0.00 H new ATOM 0 HA ASP B 947 9.554 7.781 0.601 1.00 0.00 H new ATOM 0 HB2 ASP B 947 11.520 9.349 2.318 1.00 0.00 H new ATOM 0 HB3 ASP B 947 11.858 7.763 1.653 1.00 0.00 H new ATOM 1224 N GLU B 948 9.326 8.190 3.867 1.00 0.00 N ATOM 1225 CA GLU B 948 8.994 7.511 5.113 1.00 0.00 C ATOM 1226 C GLU B 948 7.569 6.970 5.074 1.00 0.00 C ATOM 1227 O GLU B 948 7.265 5.947 5.689 1.00 0.00 O ATOM 1228 CB GLU B 948 9.158 8.466 6.297 1.00 0.00 C ATOM 1229 CG GLU B 948 10.595 8.899 6.535 1.00 0.00 C ATOM 1230 CD GLU B 948 11.541 7.724 6.682 1.00 0.00 C ATOM 1231 OE1 GLU B 948 11.246 6.822 7.494 1.00 0.00 O ATOM 1232 OE2 GLU B 948 12.578 7.705 5.985 1.00 0.00 O ATOM 0 H GLU B 948 9.453 9.198 3.957 1.00 0.00 H new ATOM 0 HA GLU B 948 9.679 6.672 5.235 1.00 0.00 H new ATOM 0 HB2 GLU B 948 8.544 9.351 6.127 1.00 0.00 H new ATOM 0 HB3 GLU B 948 8.779 7.983 7.198 1.00 0.00 H new ATOM 0 HG2 GLU B 948 10.924 9.524 5.705 1.00 0.00 H new ATOM 0 HG3 GLU B 948 10.641 9.513 7.435 1.00 0.00 H new ATOM 1239 N MET B 949 6.699 7.664 4.348 1.00 0.00 N ATOM 1240 CA MET B 949 5.304 7.255 4.227 1.00 0.00 C ATOM 1241 C MET B 949 5.195 5.840 3.665 1.00 0.00 C ATOM 1242 O MET B 949 4.332 5.063 4.073 1.00 0.00 O ATOM 1243 CB MET B 949 4.542 8.232 3.329 1.00 0.00 C ATOM 1244 CG MET B 949 3.068 7.891 3.171 1.00 0.00 C ATOM 1245 SD MET B 949 1.985 9.081 3.986 1.00 0.00 S ATOM 1246 CE MET B 949 1.192 9.843 2.571 1.00 0.00 C ATOM 0 H MET B 949 6.935 8.513 3.834 1.00 0.00 H new ATOM 0 HA MET B 949 4.862 7.264 5.223 1.00 0.00 H new ATOM 0 HB2 MET B 949 4.632 9.237 3.741 1.00 0.00 H new ATOM 0 HB3 MET B 949 5.010 8.248 2.345 1.00 0.00 H new ATOM 0 HG2 MET B 949 2.821 7.849 2.110 1.00 0.00 H new ATOM 0 HG3 MET B 949 2.883 6.898 3.581 1.00 0.00 H new ATOM 0 HE1 MET B 949 1.407 10.912 2.565 1.00 0.00 H new ATOM 0 HE2 MET B 949 1.571 9.391 1.654 1.00 0.00 H new ATOM 0 HE3 MET B 949 0.114 9.690 2.632 1.00 0.00 H new ATOM 1256 N ALA B 950 6.077 5.514 2.726 1.00 0.00 N ATOM 1257 CA ALA B 950 6.080 4.194 2.106 1.00 0.00 C ATOM 1258 C ALA B 950 6.897 3.202 2.928 1.00 0.00 C ATOM 1259 O ALA B 950 6.425 2.111 3.249 1.00 0.00 O ATOM 1260 CB ALA B 950 6.623 4.280 0.688 1.00 0.00 C ATOM 0 H ALA B 950 6.799 6.145 2.378 1.00 0.00 H new ATOM 0 HA ALA B 950 5.052 3.834 2.070 1.00 0.00 H new ATOM 0 HB1 ALA B 950 6.620 3.288 0.236 1.00 0.00 H new ATOM 0 HB2 ALA B 950 5.996 4.949 0.098 1.00 0.00 H new ATOM 0 HB3 ALA B 950 7.643 4.665 0.712 1.00 0.00 H new ATOM 1266 N LYS B 951 8.124 3.585 3.262 1.00 0.00 N ATOM 1267 CA LYS B 951 9.008 2.727 4.044 1.00 0.00 C ATOM 1268 C LYS B 951 8.375 2.364 5.385 1.00 0.00 C ATOM 1269 O LYS B 951 8.467 1.223 5.836 1.00 0.00 O ATOM 1270 CB LYS B 951 10.352 3.420 4.274 1.00 0.00 C ATOM 1271 CG LYS B 951 11.080 3.775 2.988 1.00 0.00 C ATOM 1272 CD LYS B 951 11.455 2.532 2.199 1.00 0.00 C ATOM 1273 CE LYS B 951 12.313 2.875 0.991 1.00 0.00 C ATOM 1274 NZ LYS B 951 13.262 1.779 0.654 1.00 0.00 N ATOM 0 H LYS B 951 8.530 4.484 3.004 1.00 0.00 H new ATOM 0 HA LYS B 951 9.170 1.808 3.480 1.00 0.00 H new ATOM 0 HB2 LYS B 951 10.188 4.329 4.852 1.00 0.00 H new ATOM 0 HB3 LYS B 951 10.988 2.770 4.875 1.00 0.00 H new ATOM 0 HG2 LYS B 951 10.447 4.418 2.376 1.00 0.00 H new ATOM 0 HG3 LYS B 951 11.980 4.343 3.223 1.00 0.00 H new ATOM 0 HD2 LYS B 951 11.995 1.839 2.845 1.00 0.00 H new ATOM 0 HD3 LYS B 951 10.550 2.022 1.870 1.00 0.00 H new ATOM 0 HE2 LYS B 951 11.670 3.074 0.134 1.00 0.00 H new ATOM 0 HE3 LYS B 951 12.871 3.790 1.190 1.00 0.00 H new ATOM 0 HZ1 LYS B 951 13.828 2.052 -0.175 1.00 0.00 H new ATOM 0 HZ2 LYS B 951 13.893 1.605 1.462 1.00 0.00 H new ATOM 0 HZ3 LYS B 951 12.729 0.912 0.439 1.00 0.00 H new ATOM 1288 N ALA B 952 7.734 3.341 6.016 1.00 0.00 N ATOM 1289 CA ALA B 952 7.089 3.122 7.305 1.00 0.00 C ATOM 1290 C ALA B 952 5.931 2.137 7.179 1.00 0.00 C ATOM 1291 O ALA B 952 5.747 1.268 8.031 1.00 0.00 O ATOM 1292 CB ALA B 952 6.600 4.442 7.881 1.00 0.00 C ATOM 0 H ALA B 952 7.647 4.292 5.656 1.00 0.00 H new ATOM 0 HA ALA B 952 7.826 2.692 7.984 1.00 0.00 H new ATOM 0 HB1 ALA B 952 6.120 4.264 8.843 1.00 0.00 H new ATOM 0 HB2 ALA B 952 7.446 5.116 8.016 1.00 0.00 H new ATOM 0 HB3 ALA B 952 5.882 4.894 7.196 1.00 0.00 H new ATOM 1298 N LEU B 953 5.154 2.279 6.111 1.00 0.00 N ATOM 1299 CA LEU B 953 4.013 1.403 5.873 1.00 0.00 C ATOM 1300 C LEU B 953 4.472 -0.019 5.561 1.00 0.00 C ATOM 1301 O LEU B 953 3.867 -0.990 6.017 1.00 0.00 O ATOM 1302 CB LEU B 953 3.164 1.941 4.719 1.00 0.00 C ATOM 1303 CG LEU B 953 1.813 1.248 4.533 1.00 0.00 C ATOM 1304 CD1 LEU B 953 0.793 2.217 3.951 1.00 0.00 C ATOM 1305 CD2 LEU B 953 1.959 0.024 3.640 1.00 0.00 C ATOM 0 H LEU B 953 5.294 2.993 5.396 1.00 0.00 H new ATOM 0 HA LEU B 953 3.410 1.379 6.781 1.00 0.00 H new ATOM 0 HB2 LEU B 953 2.991 3.005 4.881 1.00 0.00 H new ATOM 0 HB3 LEU B 953 3.734 1.848 3.794 1.00 0.00 H new ATOM 0 HG LEU B 953 1.457 0.919 5.509 1.00 0.00 H new ATOM 0 HD11 LEU B 953 -0.162 1.707 3.825 1.00 0.00 H new ATOM 0 HD12 LEU B 953 0.667 3.062 4.627 1.00 0.00 H new ATOM 0 HD13 LEU B 953 1.143 2.576 2.983 1.00 0.00 H new ATOM 0 HD21 LEU B 953 0.988 -0.456 3.519 1.00 0.00 H new ATOM 0 HD22 LEU B 953 2.337 0.329 2.664 1.00 0.00 H new ATOM 0 HD23 LEU B 953 2.657 -0.678 4.096 1.00 0.00 H new ATOM 1317 N GLU B 954 5.541 -0.134 4.781 1.00 0.00 N ATOM 1318 CA GLU B 954 6.078 -1.439 4.407 1.00 0.00 C ATOM 1319 C GLU B 954 6.587 -2.193 5.631 1.00 0.00 C ATOM 1320 O GLU B 954 6.420 -3.408 5.735 1.00 0.00 O ATOM 1321 CB GLU B 954 7.209 -1.275 3.390 1.00 0.00 C ATOM 1322 CG GLU B 954 6.737 -0.798 2.026 1.00 0.00 C ATOM 1323 CD GLU B 954 7.869 -0.684 1.023 1.00 0.00 C ATOM 1324 OE1 GLU B 954 9.045 -0.744 1.443 1.00 0.00 O ATOM 1325 OE2 GLU B 954 7.581 -0.536 -0.183 1.00 0.00 O ATOM 0 H GLU B 954 6.053 0.659 4.395 1.00 0.00 H new ATOM 0 HA GLU B 954 5.272 -2.018 3.957 1.00 0.00 H new ATOM 0 HB2 GLU B 954 7.938 -0.566 3.781 1.00 0.00 H new ATOM 0 HB3 GLU B 954 7.723 -2.229 3.274 1.00 0.00 H new ATOM 0 HG2 GLU B 954 5.986 -1.489 1.643 1.00 0.00 H new ATOM 0 HG3 GLU B 954 6.252 0.172 2.133 1.00 0.00 H new ATOM 1332 N ALA B 955 7.210 -1.468 6.552 1.00 0.00 N ATOM 1333 CA ALA B 955 7.749 -2.071 7.767 1.00 0.00 C ATOM 1334 C ALA B 955 6.675 -2.840 8.530 1.00 0.00 C ATOM 1335 O ALA B 955 6.977 -3.786 9.261 1.00 0.00 O ATOM 1336 CB ALA B 955 8.365 -1.001 8.656 1.00 0.00 C ATOM 0 H ALA B 955 7.355 -0.461 6.482 1.00 0.00 H new ATOM 0 HA ALA B 955 8.523 -2.780 7.475 1.00 0.00 H new ATOM 0 HB1 ALA B 955 8.764 -1.463 9.559 1.00 0.00 H new ATOM 0 HB2 ALA B 955 9.171 -0.501 8.119 1.00 0.00 H new ATOM 0 HB3 ALA B 955 7.603 -0.271 8.928 1.00 0.00 H new ATOM 1342 N GLU B 956 5.422 -2.430 8.363 1.00 0.00 N ATOM 1343 CA GLU B 956 4.308 -3.083 9.043 1.00 0.00 C ATOM 1344 C GLU B 956 3.898 -4.365 8.324 1.00 0.00 C ATOM 1345 O GLU B 956 3.938 -5.450 8.902 1.00 0.00 O ATOM 1346 CB GLU B 956 3.113 -2.131 9.134 1.00 0.00 C ATOM 1347 CG GLU B 956 3.369 -0.917 10.011 1.00 0.00 C ATOM 1348 CD GLU B 956 3.689 -1.289 11.446 1.00 0.00 C ATOM 1349 OE1 GLU B 956 3.388 -2.435 11.843 1.00 0.00 O ATOM 1350 OE2 GLU B 956 4.240 -0.436 12.172 1.00 0.00 O ATOM 0 H GLU B 956 5.152 -1.650 7.764 1.00 0.00 H new ATOM 0 HA GLU B 956 4.636 -3.346 10.049 1.00 0.00 H new ATOM 0 HB2 GLU B 956 2.849 -1.795 8.131 1.00 0.00 H new ATOM 0 HB3 GLU B 956 2.254 -2.676 9.524 1.00 0.00 H new ATOM 0 HG2 GLU B 956 4.197 -0.342 9.596 1.00 0.00 H new ATOM 0 HG3 GLU B 956 2.492 -0.270 9.995 1.00 0.00 H new ATOM 1357 N LEU B 957 3.501 -4.232 7.062 1.00 0.00 N ATOM 1358 CA LEU B 957 3.078 -5.382 6.270 1.00 0.00 C ATOM 1359 C LEU B 957 4.240 -6.341 6.025 1.00 0.00 C ATOM 1360 O LEU B 957 4.044 -7.552 5.919 1.00 0.00 O ATOM 1361 CB LEU B 957 2.489 -4.921 4.934 1.00 0.00 C ATOM 1362 CG LEU B 957 2.074 -6.047 3.979 1.00 0.00 C ATOM 1363 CD1 LEU B 957 1.321 -7.139 4.726 1.00 0.00 C ATOM 1364 CD2 LEU B 957 1.226 -5.494 2.842 1.00 0.00 C ATOM 0 H LEU B 957 3.463 -3.341 6.567 1.00 0.00 H new ATOM 0 HA LEU B 957 2.311 -5.913 6.834 1.00 0.00 H new ATOM 0 HB2 LEU B 957 1.618 -4.298 5.135 1.00 0.00 H new ATOM 0 HB3 LEU B 957 3.222 -4.291 4.430 1.00 0.00 H new ATOM 0 HG LEU B 957 2.977 -6.486 3.555 1.00 0.00 H new ATOM 0 HD11 LEU B 957 1.037 -7.927 4.029 1.00 0.00 H new ATOM 0 HD12 LEU B 957 1.961 -7.556 5.503 1.00 0.00 H new ATOM 0 HD13 LEU B 957 0.425 -6.717 5.182 1.00 0.00 H new ATOM 0 HD21 LEU B 957 0.940 -6.306 2.173 1.00 0.00 H new ATOM 0 HD22 LEU B 957 0.330 -5.027 3.250 1.00 0.00 H new ATOM 0 HD23 LEU B 957 1.801 -4.752 2.287 1.00 0.00 H new ATOM 1376 N ASN B 958 5.448 -5.795 5.938 1.00 0.00 N ATOM 1377 CA ASN B 958 6.640 -6.606 5.707 1.00 0.00 C ATOM 1378 C ASN B 958 6.804 -7.668 6.793 1.00 0.00 C ATOM 1379 O ASN B 958 7.504 -8.662 6.597 1.00 0.00 O ATOM 1380 CB ASN B 958 7.886 -5.720 5.654 1.00 0.00 C ATOM 1381 CG ASN B 958 9.144 -6.507 5.342 1.00 0.00 C ATOM 1382 OD1 ASN B 958 9.974 -6.745 6.219 1.00 0.00 O ATOM 1383 ND2 ASN B 958 9.290 -6.915 4.087 1.00 0.00 N ATOM 0 H ASN B 958 5.629 -4.795 6.024 1.00 0.00 H new ATOM 0 HA ASN B 958 6.519 -7.111 4.749 1.00 0.00 H new ATOM 0 HB2 ASN B 958 7.747 -4.948 4.897 1.00 0.00 H new ATOM 0 HB3 ASN B 958 8.007 -5.211 6.610 1.00 0.00 H new ATOM 0 HD21 ASN B 958 10.116 -7.449 3.817 1.00 0.00 H new ATOM 0 HD22 ASN B 958 8.576 -6.695 3.393 1.00 0.00 H new ATOM 1390 N ASP B 959 6.160 -7.454 7.936 1.00 0.00 N ATOM 1391 CA ASP B 959 6.242 -8.394 9.047 1.00 0.00 C ATOM 1392 C ASP B 959 5.552 -9.712 8.707 1.00 0.00 C ATOM 1393 O ASP B 959 5.894 -10.759 9.258 1.00 0.00 O ATOM 1394 CB ASP B 959 5.615 -7.788 10.303 1.00 0.00 C ATOM 1395 CG ASP B 959 6.383 -6.583 10.811 1.00 0.00 C ATOM 1396 OD1 ASP B 959 7.549 -6.406 10.401 1.00 0.00 O ATOM 1397 OD2 ASP B 959 5.818 -5.816 11.619 1.00 0.00 O ATOM 0 H ASP B 959 5.576 -6.638 8.117 1.00 0.00 H new ATOM 0 HA ASP B 959 7.296 -8.598 9.235 1.00 0.00 H new ATOM 0 HB2 ASP B 959 4.587 -7.496 10.087 1.00 0.00 H new ATOM 0 HB3 ASP B 959 5.573 -8.545 11.086 1.00 0.00 H new ATOM 1402 N LEU B 960 4.583 -9.660 7.796 1.00 0.00 N ATOM 1403 CA LEU B 960 3.854 -10.859 7.391 1.00 0.00 C ATOM 1404 C LEU B 960 4.816 -11.942 6.910 1.00 0.00 C ATOM 1405 O LEU B 960 4.628 -13.125 7.191 1.00 0.00 O ATOM 1406 CB LEU B 960 2.851 -10.535 6.278 1.00 0.00 C ATOM 1407 CG LEU B 960 1.601 -9.754 6.705 1.00 0.00 C ATOM 1408 CD1 LEU B 960 0.521 -9.875 5.641 1.00 0.00 C ATOM 1409 CD2 LEU B 960 1.078 -10.247 8.048 1.00 0.00 C ATOM 0 H LEU B 960 4.286 -8.805 7.326 1.00 0.00 H new ATOM 0 HA LEU B 960 3.312 -11.227 8.262 1.00 0.00 H new ATOM 0 HB2 LEU B 960 3.367 -9.963 5.507 1.00 0.00 H new ATOM 0 HB3 LEU B 960 2.531 -11.471 5.820 1.00 0.00 H new ATOM 0 HG LEU B 960 1.876 -8.705 6.816 1.00 0.00 H new ATOM 0 HD11 LEU B 960 -0.362 -9.317 5.954 1.00 0.00 H new ATOM 0 HD12 LEU B 960 0.891 -9.470 4.699 1.00 0.00 H new ATOM 0 HD13 LEU B 960 0.258 -10.924 5.507 1.00 0.00 H new ATOM 0 HD21 LEU B 960 0.192 -9.676 8.325 1.00 0.00 H new ATOM 0 HD22 LEU B 960 0.820 -11.303 7.972 1.00 0.00 H new ATOM 0 HD23 LEU B 960 1.848 -10.115 8.809 1.00 0.00 H new ATOM 1421 N MET B 961 5.845 -11.525 6.180 1.00 0.00 N ATOM 1422 CA MET B 961 6.838 -12.455 5.656 1.00 0.00 C ATOM 1423 C MET B 961 8.251 -11.982 5.980 1.00 0.00 C ATOM 1424 O MET B 961 8.674 -10.953 5.413 1.00 0.00 O ATOM 1425 CB MET B 961 6.674 -12.610 4.142 1.00 0.00 C ATOM 1426 CG MET B 961 5.364 -13.265 3.736 1.00 0.00 C ATOM 1427 SD MET B 961 5.286 -13.628 1.972 1.00 0.00 S ATOM 1428 CE MET B 961 6.424 -15.007 1.860 1.00 0.00 C ATOM 1429 OXT MET B 961 8.923 -12.643 6.799 1.00 0.00 O ATOM 0 H MET B 961 6.013 -10.549 5.938 1.00 0.00 H new ATOM 0 HA MET B 961 6.680 -13.422 6.133 1.00 0.00 H new ATOM 0 HB2 MET B 961 6.739 -11.627 3.675 1.00 0.00 H new ATOM 0 HB3 MET B 961 7.502 -13.203 3.754 1.00 0.00 H new ATOM 0 HG2 MET B 961 5.235 -14.189 4.299 1.00 0.00 H new ATOM 0 HG3 MET B 961 4.536 -12.609 4.005 1.00 0.00 H new ATOM 0 HE1 MET B 961 6.277 -15.524 0.911 1.00 0.00 H new ATOM 0 HE2 MET B 961 7.448 -14.639 1.918 1.00 0.00 H new ATOM 0 HE3 MET B 961 6.240 -15.699 2.682 1.00 0.00 H new