USER MOD reduce.3.24.130724 H: found=0, std=0, add=835, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 835 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 467 GLN : amide:sc= -0.846 X(o=-0.85,f=-0.38) USER MOD Set 1.2: A 510 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 455 SER OG : rot -102:sc= 0.817 USER MOD Set 2.2: A 471 ASN :FLIP amide:sc= 0.63 F(o=-1.6!,f=1.4) USER MOD Set 3.1: A 453 SER OG : rot 24:sc= 0.0529 USER MOD Set 3.2: A 472 SER OG : rot -170:sc= 0 USER MOD Single : A 464 LYS NZ :NH3+ -167:sc= 0.0858 (180deg=0.0525) USER MOD Single : A 469 LYS NZ :NH3+ -163:sc= 0.318 (180deg=-0.104) USER MOD Single : A 470 ASN : amide:sc= -0.441 K(o=-0.44,f=-3.2!) USER MOD Single : A 474 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0775) USER MOD Single : A 476 GLN :FLIP amide:sc= -0.746 F(o=-2,f=-0.75) USER MOD Single : A 477 SER OG : rot 180:sc= 0 USER MOD Single : A 480 ASN :FLIP amide:sc= -0.0664 F(o=-2!,f=-0.066) USER MOD Single : A 484 LYS NZ :NH3+ -155:sc= -0.492 (180deg=-1.56!) USER MOD Single : A 486 GLN : amide:sc= -0.463 K(o=-0.46,f=-3.5!) USER MOD Single : A 495 TYR OH : rot 30:sc= -0.0131 USER MOD Single : A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 THR OG1 : rot 180:sc= -0.185 USER MOD Single : A 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 501 TYR OH : rot 23:sc= 1.15 USER MOD Single : A 507 GLN : amide:sc= -0.0956 X(o=-0.096,f=-0.032) USER MOD Single : A 508 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 520 HIS : no HD1:sc= -0.27 X(o=-0.27,f=-0.73) USER MOD Single : A 521 SER OG : rot 70:sc= 0.243 USER MOD Single : A 524 SER OG : rot 180:sc= 0 USER MOD Single : A 525 THR OG1 : rot 180:sc= 0 USER MOD Single : A 529 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0343) USER MOD Single : A 531 GLN : amide:sc= -1.79! X(o=-1.8!,f=-1.3) USER MOD Single : A 532 SER OG : rot 180:sc= 0.00978 USER MOD Single : A 533 SER OG : rot 180:sc= 0 USER MOD Single : A 536 THR OG1 : rot 37:sc= -1.56! USER MOD Single : A 539 SER OG : rot 180:sc= -0.394 USER MOD Single : A 542 THR OG1 : rot 70:sc= 0.18 USER MOD Single : A 546 ASN :FLIP amide:sc= -3.13! C(o=-3.8!,f=-3.1!) USER MOD Single : A 554 MET CE :methyl -160:sc= -0.212 (180deg=-0.74) USER MOD Single : A 556 THR OG1 : rot 150:sc= 0.484 USER MOD Single : A 558 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000245) USER MOD Single : A 559 LYS NZ :NH3+ 161:sc= 0.523 (180deg=0.333) USER MOD ----------------------------------------------------------------- ATOM 40 N SER A 453 9.768 3.091 -6.879 1.00 0.00 N ATOM 41 CA SER A 453 10.836 3.295 -5.876 1.00 0.00 C ATOM 42 C SER A 453 12.074 2.458 -6.228 1.00 0.00 C ATOM 43 O SER A 453 13.195 2.973 -6.254 1.00 0.00 O ATOM 44 CB SER A 453 10.310 2.960 -4.464 1.00 0.00 C ATOM 45 OG SER A 453 9.212 3.799 -4.135 1.00 0.00 O ATOM 0 HA SER A 453 11.135 4.343 -5.885 1.00 0.00 H new ATOM 0 HB2 SER A 453 10.003 1.915 -4.421 1.00 0.00 H new ATOM 0 HB3 SER A 453 11.107 3.089 -3.732 1.00 0.00 H new ATOM 0 HG SER A 453 8.788 4.121 -4.958 1.00 0.00 H new ATOM 51 N VAL A 454 11.848 1.169 -6.521 1.00 0.00 N ATOM 52 CA VAL A 454 12.848 0.325 -7.177 1.00 0.00 C ATOM 53 C VAL A 454 12.575 0.390 -8.692 1.00 0.00 C ATOM 54 O VAL A 454 11.546 -0.108 -9.164 1.00 0.00 O ATOM 55 CB VAL A 454 12.815 -1.170 -6.676 1.00 0.00 C ATOM 56 CG1 VAL A 454 14.029 -1.969 -7.213 1.00 0.00 C ATOM 57 CG2 VAL A 454 12.727 -1.253 -5.135 1.00 0.00 C ATOM 0 H VAL A 454 10.973 0.689 -6.311 1.00 0.00 H new ATOM 0 HA VAL A 454 13.843 0.697 -6.932 1.00 0.00 H new ATOM 0 HB VAL A 454 11.911 -1.628 -7.078 1.00 0.00 H new ATOM 0 HG11 VAL A 454 13.978 -2.996 -6.850 1.00 0.00 H new ATOM 0 HG12 VAL A 454 14.012 -1.968 -8.303 1.00 0.00 H new ATOM 0 HG13 VAL A 454 14.952 -1.506 -6.864 1.00 0.00 H new ATOM 0 HG21 VAL A 454 12.706 -2.299 -4.828 1.00 0.00 H new ATOM 0 HG22 VAL A 454 13.595 -0.762 -4.694 1.00 0.00 H new ATOM 0 HG23 VAL A 454 11.818 -0.757 -4.795 1.00 0.00 H new ATOM 67 N SER A 455 13.449 1.085 -9.422 1.00 0.00 N ATOM 68 CA SER A 455 13.384 1.178 -10.887 1.00 0.00 C ATOM 69 C SER A 455 14.170 0.017 -11.524 1.00 0.00 C ATOM 70 O SER A 455 15.009 -0.610 -10.864 1.00 0.00 O ATOM 71 CB SER A 455 13.970 2.536 -11.341 1.00 0.00 C ATOM 72 OG SER A 455 15.329 2.678 -10.945 1.00 0.00 O ATOM 0 H SER A 455 14.227 1.603 -9.014 1.00 0.00 H new ATOM 0 HA SER A 455 12.345 1.111 -11.210 1.00 0.00 H new ATOM 0 HB2 SER A 455 13.895 2.621 -12.425 1.00 0.00 H new ATOM 0 HB3 SER A 455 13.380 3.348 -10.916 1.00 0.00 H new ATOM 0 HG SER A 455 15.381 3.260 -10.158 1.00 0.00 H new ATOM 78 N ILE A 456 13.882 -0.272 -12.803 1.00 0.00 N ATOM 79 CA ILE A 456 14.681 -1.211 -13.600 1.00 0.00 C ATOM 80 C ILE A 456 15.920 -0.461 -14.130 1.00 0.00 C ATOM 81 O ILE A 456 15.852 0.248 -15.147 1.00 0.00 O ATOM 82 CB ILE A 456 13.853 -1.843 -14.775 1.00 0.00 C ATOM 83 CG1 ILE A 456 12.518 -2.449 -14.241 1.00 0.00 C ATOM 84 CG2 ILE A 456 14.681 -2.917 -15.511 1.00 0.00 C ATOM 85 CD1 ILE A 456 11.594 -3.024 -15.302 1.00 0.00 C ATOM 0 H ILE A 456 13.095 0.136 -13.308 1.00 0.00 H new ATOM 0 HA ILE A 456 14.990 -2.044 -12.968 1.00 0.00 H new ATOM 0 HB ILE A 456 13.612 -1.053 -15.486 1.00 0.00 H new ATOM 0 HG12 ILE A 456 12.756 -3.236 -13.525 1.00 0.00 H new ATOM 0 HG13 ILE A 456 11.979 -1.674 -13.695 1.00 0.00 H new ATOM 0 HG21 ILE A 456 14.088 -3.342 -16.321 1.00 0.00 H new ATOM 0 HG22 ILE A 456 15.583 -2.463 -15.921 1.00 0.00 H new ATOM 0 HG23 ILE A 456 14.957 -3.706 -14.812 1.00 0.00 H new ATOM 0 HD11 ILE A 456 10.696 -3.419 -14.827 1.00 0.00 H new ATOM 0 HD12 ILE A 456 11.317 -2.240 -16.007 1.00 0.00 H new ATOM 0 HD13 ILE A 456 12.106 -3.826 -15.834 1.00 0.00 H new ATOM 97 N GLU A 457 17.029 -0.616 -13.393 1.00 0.00 N ATOM 98 CA GLU A 457 18.270 0.148 -13.594 1.00 0.00 C ATOM 99 C GLU A 457 18.955 -0.228 -14.919 1.00 0.00 C ATOM 100 O GLU A 457 19.231 0.642 -15.755 1.00 0.00 O ATOM 101 CB GLU A 457 19.211 -0.083 -12.375 1.00 0.00 C ATOM 102 CG GLU A 457 20.616 0.548 -12.486 1.00 0.00 C ATOM 103 CD GLU A 457 20.605 2.051 -12.817 1.00 0.00 C ATOM 104 OE1 GLU A 457 20.082 2.852 -12.012 1.00 0.00 O ATOM 105 OE2 GLU A 457 21.104 2.441 -13.896 1.00 0.00 O ATOM 0 H GLU A 457 17.091 -1.287 -12.627 1.00 0.00 H new ATOM 0 HA GLU A 457 18.030 1.209 -13.662 1.00 0.00 H new ATOM 0 HB2 GLU A 457 18.724 0.313 -11.483 1.00 0.00 H new ATOM 0 HB3 GLU A 457 19.326 -1.157 -12.226 1.00 0.00 H new ATOM 0 HG2 GLU A 457 21.145 0.398 -11.545 1.00 0.00 H new ATOM 0 HG3 GLU A 457 21.179 0.021 -13.256 1.00 0.00 H new ATOM 112 N GLU A 458 19.240 -1.529 -15.089 1.00 0.00 N ATOM 113 CA GLU A 458 19.871 -2.082 -16.304 1.00 0.00 C ATOM 114 C GLU A 458 19.240 -3.445 -16.615 1.00 0.00 C ATOM 115 O GLU A 458 18.710 -4.112 -15.720 1.00 0.00 O ATOM 116 CB GLU A 458 21.415 -2.254 -16.117 1.00 0.00 C ATOM 117 CG GLU A 458 22.159 -0.996 -15.635 1.00 0.00 C ATOM 118 CD GLU A 458 23.653 -1.228 -15.404 1.00 0.00 C ATOM 119 OE1 GLU A 458 24.443 -1.141 -16.375 1.00 0.00 O ATOM 120 OE2 GLU A 458 24.055 -1.490 -14.251 1.00 0.00 O ATOM 0 H GLU A 458 19.038 -2.235 -14.382 1.00 0.00 H new ATOM 0 HA GLU A 458 19.706 -1.387 -17.128 1.00 0.00 H new ATOM 0 HB2 GLU A 458 21.591 -3.058 -15.402 1.00 0.00 H new ATOM 0 HB3 GLU A 458 21.847 -2.571 -17.066 1.00 0.00 H new ATOM 0 HG2 GLU A 458 22.031 -0.202 -16.371 1.00 0.00 H new ATOM 0 HG3 GLU A 458 21.705 -0.647 -14.708 1.00 0.00 H new ATOM 127 N ILE A 459 19.271 -3.834 -17.891 1.00 0.00 N ATOM 128 CA ILE A 459 18.926 -5.197 -18.334 1.00 0.00 C ATOM 129 C ILE A 459 19.978 -5.626 -19.357 1.00 0.00 C ATOM 130 O ILE A 459 20.346 -4.837 -20.234 1.00 0.00 O ATOM 131 CB ILE A 459 17.496 -5.294 -18.999 1.00 0.00 C ATOM 132 CG1 ILE A 459 16.387 -4.703 -18.083 1.00 0.00 C ATOM 133 CG2 ILE A 459 17.150 -6.761 -19.382 1.00 0.00 C ATOM 134 CD1 ILE A 459 15.005 -4.640 -18.712 1.00 0.00 C ATOM 0 H ILE A 459 19.537 -3.213 -18.655 1.00 0.00 H new ATOM 0 HA ILE A 459 18.907 -5.844 -17.457 1.00 0.00 H new ATOM 0 HB ILE A 459 17.532 -4.696 -19.909 1.00 0.00 H new ATOM 0 HG12 ILE A 459 16.330 -5.302 -17.174 1.00 0.00 H new ATOM 0 HG13 ILE A 459 16.681 -3.697 -17.784 1.00 0.00 H new ATOM 0 HG21 ILE A 459 16.160 -6.794 -19.837 1.00 0.00 H new ATOM 0 HG22 ILE A 459 17.888 -7.136 -20.091 1.00 0.00 H new ATOM 0 HG23 ILE A 459 17.159 -7.383 -18.487 1.00 0.00 H new ATOM 0 HD11 ILE A 459 14.300 -4.214 -17.998 1.00 0.00 H new ATOM 0 HD12 ILE A 459 15.040 -4.015 -19.605 1.00 0.00 H new ATOM 0 HD13 ILE A 459 14.683 -5.645 -18.985 1.00 0.00 H new ATOM 146 N ASP A 460 20.468 -6.860 -19.228 1.00 0.00 N ATOM 147 CA ASP A 460 21.399 -7.443 -20.200 1.00 0.00 C ATOM 148 C ASP A 460 20.693 -7.649 -21.552 1.00 0.00 C ATOM 149 O ASP A 460 19.512 -8.025 -21.580 1.00 0.00 O ATOM 150 CB ASP A 460 21.954 -8.773 -19.662 1.00 0.00 C ATOM 151 CG ASP A 460 22.988 -9.407 -20.607 1.00 0.00 C ATOM 152 OD1 ASP A 460 24.123 -8.897 -20.699 1.00 0.00 O ATOM 153 OD2 ASP A 460 22.668 -10.413 -21.245 1.00 0.00 O ATOM 0 H ASP A 460 20.234 -7.481 -18.453 1.00 0.00 H new ATOM 0 HA ASP A 460 22.233 -6.759 -20.353 1.00 0.00 H new ATOM 0 HB2 ASP A 460 22.413 -8.604 -18.688 1.00 0.00 H new ATOM 0 HB3 ASP A 460 21.131 -9.471 -19.509 1.00 0.00 H new ATOM 158 N LEU A 461 21.424 -7.391 -22.660 1.00 0.00 N ATOM 159 CA LEU A 461 20.878 -7.496 -24.031 1.00 0.00 C ATOM 160 C LEU A 461 20.451 -8.946 -24.344 1.00 0.00 C ATOM 161 O LEU A 461 19.408 -9.164 -24.962 1.00 0.00 O ATOM 162 CB LEU A 461 21.877 -6.968 -25.114 1.00 0.00 C ATOM 163 CG LEU A 461 23.170 -7.816 -25.407 1.00 0.00 C ATOM 164 CD1 LEU A 461 23.843 -7.361 -26.720 1.00 0.00 C ATOM 165 CD2 LEU A 461 24.182 -7.775 -24.241 1.00 0.00 C ATOM 0 H LEU A 461 22.403 -7.106 -22.629 1.00 0.00 H new ATOM 0 HA LEU A 461 19.997 -6.856 -24.070 1.00 0.00 H new ATOM 0 HB2 LEU A 461 21.329 -6.862 -26.050 1.00 0.00 H new ATOM 0 HB3 LEU A 461 22.194 -5.969 -24.816 1.00 0.00 H new ATOM 0 HG LEU A 461 22.846 -8.851 -25.516 1.00 0.00 H new ATOM 0 HD11 LEU A 461 24.734 -7.963 -26.900 1.00 0.00 H new ATOM 0 HD12 LEU A 461 23.146 -7.488 -27.549 1.00 0.00 H new ATOM 0 HD13 LEU A 461 24.124 -6.311 -26.640 1.00 0.00 H new ATOM 0 HD21 LEU A 461 25.055 -8.376 -24.496 1.00 0.00 H new ATOM 0 HD22 LEU A 461 24.490 -6.745 -24.063 1.00 0.00 H new ATOM 0 HD23 LEU A 461 23.716 -8.175 -23.341 1.00 0.00 H new ATOM 177 N GLU A 462 21.253 -9.932 -23.884 1.00 0.00 N ATOM 178 CA GLU A 462 20.938 -11.363 -24.057 1.00 0.00 C ATOM 179 C GLU A 462 19.814 -11.757 -23.082 1.00 0.00 C ATOM 180 O GLU A 462 18.935 -12.557 -23.418 1.00 0.00 O ATOM 181 CB GLU A 462 22.192 -12.250 -23.800 1.00 0.00 C ATOM 182 CG GLU A 462 23.467 -11.815 -24.546 1.00 0.00 C ATOM 183 CD GLU A 462 24.689 -12.687 -24.177 1.00 0.00 C ATOM 184 OE1 GLU A 462 25.356 -12.417 -23.145 1.00 0.00 O ATOM 185 OE2 GLU A 462 24.972 -13.670 -24.898 1.00 0.00 O ATOM 0 H GLU A 462 22.127 -9.759 -23.388 1.00 0.00 H new ATOM 0 HA GLU A 462 20.614 -11.525 -25.085 1.00 0.00 H new ATOM 0 HB2 GLU A 462 22.400 -12.255 -22.730 1.00 0.00 H new ATOM 0 HB3 GLU A 462 21.956 -13.276 -24.084 1.00 0.00 H new ATOM 0 HG2 GLU A 462 23.294 -11.872 -25.621 1.00 0.00 H new ATOM 0 HG3 GLU A 462 23.684 -10.772 -24.313 1.00 0.00 H new ATOM 192 N GLY A 463 19.827 -11.108 -21.907 1.00 0.00 N ATOM 193 CA GLY A 463 18.863 -11.359 -20.839 1.00 0.00 C ATOM 194 C GLY A 463 19.357 -12.363 -19.815 1.00 0.00 C ATOM 195 O GLY A 463 18.558 -13.115 -19.242 1.00 0.00 O ATOM 0 H GLY A 463 20.514 -10.390 -21.676 1.00 0.00 H new ATOM 0 HA2 GLY A 463 18.634 -10.419 -20.336 1.00 0.00 H new ATOM 0 HA3 GLY A 463 17.933 -11.722 -21.276 1.00 0.00 H new ATOM 199 N LYS A 464 20.683 -12.358 -19.570 1.00 0.00 N ATOM 200 CA LYS A 464 21.334 -13.290 -18.628 1.00 0.00 C ATOM 201 C LYS A 464 21.241 -12.751 -17.185 1.00 0.00 C ATOM 202 O LYS A 464 21.477 -13.495 -16.226 1.00 0.00 O ATOM 203 CB LYS A 464 22.813 -13.518 -19.047 1.00 0.00 C ATOM 204 CG LYS A 464 23.792 -12.359 -18.709 1.00 0.00 C ATOM 205 CD LYS A 464 25.055 -12.335 -19.606 1.00 0.00 C ATOM 206 CE LYS A 464 25.839 -13.652 -19.606 1.00 0.00 C ATOM 207 NZ LYS A 464 26.957 -13.620 -20.579 1.00 0.00 N ATOM 0 H LYS A 464 21.331 -11.710 -20.018 1.00 0.00 H new ATOM 0 HA LYS A 464 20.816 -14.249 -18.660 1.00 0.00 H new ATOM 0 HB2 LYS A 464 23.173 -14.426 -18.564 1.00 0.00 H new ATOM 0 HB3 LYS A 464 22.844 -13.695 -20.122 1.00 0.00 H new ATOM 0 HG2 LYS A 464 23.267 -11.409 -18.810 1.00 0.00 H new ATOM 0 HG3 LYS A 464 24.098 -12.445 -17.666 1.00 0.00 H new ATOM 0 HD2 LYS A 464 24.759 -12.099 -20.628 1.00 0.00 H new ATOM 0 HD3 LYS A 464 25.712 -11.532 -19.271 1.00 0.00 H new ATOM 0 HE2 LYS A 464 26.230 -13.843 -18.607 1.00 0.00 H new ATOM 0 HE3 LYS A 464 25.168 -14.476 -19.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 27.326 -14.583 -20.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 26.615 -13.248 -21.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 27.715 -13.007 -20.217 1.00 0.00 H new ATOM 221 N PHE A 465 20.910 -11.445 -17.057 1.00 0.00 N ATOM 222 CA PHE A 465 20.675 -10.796 -15.757 1.00 0.00 C ATOM 223 C PHE A 465 19.811 -9.530 -15.926 1.00 0.00 C ATOM 224 O PHE A 465 19.694 -8.976 -17.027 1.00 0.00 O ATOM 225 CB PHE A 465 22.011 -10.475 -15.024 1.00 0.00 C ATOM 226 CG PHE A 465 22.796 -9.258 -15.521 1.00 0.00 C ATOM 227 CD1 PHE A 465 23.721 -9.367 -16.554 1.00 0.00 C ATOM 228 CD2 PHE A 465 22.616 -8.000 -14.936 1.00 0.00 C ATOM 229 CE1 PHE A 465 24.427 -8.263 -16.998 1.00 0.00 C ATOM 230 CE2 PHE A 465 23.324 -6.899 -15.381 1.00 0.00 C ATOM 231 CZ PHE A 465 24.232 -7.033 -16.409 1.00 0.00 C ATOM 0 H PHE A 465 20.800 -10.817 -17.853 1.00 0.00 H new ATOM 0 HA PHE A 465 20.126 -11.499 -15.131 1.00 0.00 H new ATOM 0 HB2 PHE A 465 21.792 -10.329 -13.966 1.00 0.00 H new ATOM 0 HB3 PHE A 465 22.657 -11.349 -15.098 1.00 0.00 H new ATOM 0 HD1 PHE A 465 23.891 -10.328 -17.017 1.00 0.00 H new ATOM 0 HD2 PHE A 465 21.913 -7.887 -14.124 1.00 0.00 H new ATOM 0 HE1 PHE A 465 25.133 -8.366 -17.809 1.00 0.00 H new ATOM 0 HE2 PHE A 465 23.165 -5.934 -14.923 1.00 0.00 H new ATOM 0 HZ PHE A 465 24.790 -6.175 -16.753 1.00 0.00 H new ATOM 241 N VAL A 466 19.209 -9.089 -14.804 1.00 0.00 N ATOM 242 CA VAL A 466 18.440 -7.835 -14.702 1.00 0.00 C ATOM 243 C VAL A 466 18.885 -7.096 -13.428 1.00 0.00 C ATOM 244 O VAL A 466 18.810 -7.646 -12.321 1.00 0.00 O ATOM 245 CB VAL A 466 16.876 -8.068 -14.660 1.00 0.00 C ATOM 246 CG1 VAL A 466 16.102 -6.730 -14.481 1.00 0.00 C ATOM 247 CG2 VAL A 466 16.393 -8.814 -15.925 1.00 0.00 C ATOM 0 H VAL A 466 19.245 -9.606 -13.926 1.00 0.00 H new ATOM 0 HA VAL A 466 18.643 -7.246 -15.596 1.00 0.00 H new ATOM 0 HB VAL A 466 16.663 -8.692 -13.792 1.00 0.00 H new ATOM 0 HG11 VAL A 466 15.031 -6.930 -14.457 1.00 0.00 H new ATOM 0 HG12 VAL A 466 16.404 -6.257 -13.547 1.00 0.00 H new ATOM 0 HG13 VAL A 466 16.328 -6.065 -15.314 1.00 0.00 H new ATOM 0 HG21 VAL A 466 15.314 -8.961 -15.871 1.00 0.00 H new ATOM 0 HG22 VAL A 466 16.635 -8.225 -16.810 1.00 0.00 H new ATOM 0 HG23 VAL A 466 16.889 -9.783 -15.988 1.00 0.00 H new ATOM 257 N GLN A 467 19.376 -5.870 -13.608 1.00 0.00 N ATOM 258 CA GLN A 467 19.747 -4.966 -12.517 1.00 0.00 C ATOM 259 C GLN A 467 18.547 -4.061 -12.159 1.00 0.00 C ATOM 260 O GLN A 467 18.028 -3.336 -13.010 1.00 0.00 O ATOM 261 CB GLN A 467 20.972 -4.104 -12.941 1.00 0.00 C ATOM 262 CG GLN A 467 21.468 -3.090 -11.888 1.00 0.00 C ATOM 263 CD GLN A 467 22.084 -3.745 -10.650 1.00 0.00 C ATOM 264 OE1 GLN A 467 23.282 -3.975 -10.593 1.00 0.00 O ATOM 265 NE2 GLN A 467 21.271 -4.077 -9.661 1.00 0.00 N ATOM 0 H GLN A 467 19.530 -5.469 -14.533 1.00 0.00 H new ATOM 0 HA GLN A 467 20.019 -5.550 -11.638 1.00 0.00 H new ATOM 0 HB2 GLN A 467 21.795 -4.773 -13.192 1.00 0.00 H new ATOM 0 HB3 GLN A 467 20.714 -3.561 -13.850 1.00 0.00 H new ATOM 0 HG2 GLN A 467 22.207 -2.434 -12.348 1.00 0.00 H new ATOM 0 HG3 GLN A 467 20.633 -2.462 -11.579 1.00 0.00 H new ATOM 0 HE21 GLN A 467 20.274 -3.875 -9.731 1.00 0.00 H new ATOM 0 HE22 GLN A 467 21.641 -4.535 -8.828 1.00 0.00 H new ATOM 274 N LEU A 468 18.086 -4.151 -10.907 1.00 0.00 N ATOM 275 CA LEU A 468 17.110 -3.217 -10.315 1.00 0.00 C ATOM 276 C LEU A 468 17.829 -2.346 -9.278 1.00 0.00 C ATOM 277 O LEU A 468 18.801 -2.804 -8.684 1.00 0.00 O ATOM 278 CB LEU A 468 15.970 -3.992 -9.615 1.00 0.00 C ATOM 279 CG LEU A 468 15.196 -5.040 -10.463 1.00 0.00 C ATOM 280 CD1 LEU A 468 14.116 -5.719 -9.606 1.00 0.00 C ATOM 281 CD2 LEU A 468 14.591 -4.414 -11.733 1.00 0.00 C ATOM 0 H LEU A 468 18.382 -4.884 -10.263 1.00 0.00 H new ATOM 0 HA LEU A 468 16.682 -2.601 -11.106 1.00 0.00 H new ATOM 0 HB2 LEU A 468 16.391 -4.503 -8.749 1.00 0.00 H new ATOM 0 HB3 LEU A 468 15.250 -3.266 -9.237 1.00 0.00 H new ATOM 0 HG LEU A 468 15.906 -5.799 -10.793 1.00 0.00 H new ATOM 0 HD11 LEU A 468 13.580 -6.451 -10.210 1.00 0.00 H new ATOM 0 HD12 LEU A 468 14.585 -6.220 -8.759 1.00 0.00 H new ATOM 0 HD13 LEU A 468 13.416 -4.968 -9.240 1.00 0.00 H new ATOM 0 HD21 LEU A 468 14.059 -5.179 -12.298 1.00 0.00 H new ATOM 0 HD22 LEU A 468 13.897 -3.621 -11.453 1.00 0.00 H new ATOM 0 HD23 LEU A 468 15.388 -3.998 -12.349 1.00 0.00 H new ATOM 293 N LYS A 469 17.329 -1.127 -9.028 1.00 0.00 N ATOM 294 CA LYS A 469 17.945 -0.189 -8.062 1.00 0.00 C ATOM 295 C LYS A 469 16.884 0.677 -7.382 1.00 0.00 C ATOM 296 O LYS A 469 15.917 1.087 -8.020 1.00 0.00 O ATOM 297 CB LYS A 469 18.984 0.718 -8.773 1.00 0.00 C ATOM 298 CG LYS A 469 19.623 1.782 -7.855 1.00 0.00 C ATOM 299 CD LYS A 469 20.632 2.683 -8.578 1.00 0.00 C ATOM 300 CE LYS A 469 21.077 3.861 -7.705 1.00 0.00 C ATOM 301 NZ LYS A 469 19.920 4.717 -7.323 1.00 0.00 N ATOM 0 H LYS A 469 16.493 -0.760 -9.483 1.00 0.00 H new ATOM 0 HA LYS A 469 18.449 -0.782 -7.299 1.00 0.00 H new ATOM 0 HB2 LYS A 469 19.773 0.092 -9.189 1.00 0.00 H new ATOM 0 HB3 LYS A 469 18.500 1.220 -9.611 1.00 0.00 H new ATOM 0 HG2 LYS A 469 18.835 2.402 -7.426 1.00 0.00 H new ATOM 0 HG3 LYS A 469 20.123 1.282 -7.025 1.00 0.00 H new ATOM 0 HD2 LYS A 469 21.504 2.094 -8.865 1.00 0.00 H new ATOM 0 HD3 LYS A 469 20.186 3.061 -9.498 1.00 0.00 H new ATOM 0 HE2 LYS A 469 21.567 3.486 -6.807 1.00 0.00 H new ATOM 0 HE3 LYS A 469 21.812 4.459 -8.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 469 20.266 5.639 -6.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 469 19.304 4.856 -8.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 469 19.381 4.254 -6.563 1.00 0.00 H new ATOM 315 N ASN A 470 17.105 0.990 -6.088 1.00 0.00 N ATOM 316 CA ASN A 470 16.224 1.909 -5.329 1.00 0.00 C ATOM 317 C ASN A 470 16.743 3.343 -5.498 1.00 0.00 C ATOM 318 O ASN A 470 17.934 3.609 -5.297 1.00 0.00 O ATOM 319 CB ASN A 470 16.143 1.531 -3.824 1.00 0.00 C ATOM 320 CG ASN A 470 15.176 2.392 -2.999 1.00 0.00 C ATOM 321 OD1 ASN A 470 14.194 2.923 -3.520 1.00 0.00 O ATOM 322 ND2 ASN A 470 15.433 2.507 -1.703 1.00 0.00 N ATOM 0 H ASN A 470 17.886 0.621 -5.545 1.00 0.00 H new ATOM 0 HA ASN A 470 15.213 1.827 -5.727 1.00 0.00 H new ATOM 0 HB2 ASN A 470 15.840 0.487 -3.741 1.00 0.00 H new ATOM 0 HB3 ASN A 470 17.139 1.609 -3.389 1.00 0.00 H new ATOM 0 HD21 ASN A 470 14.808 3.048 -1.105 1.00 0.00 H new ATOM 0 HD22 ASN A 470 16.255 2.054 -1.304 1.00 0.00 H new ATOM 329 N ASN A 471 15.849 4.242 -5.922 1.00 0.00 N ATOM 330 CA ASN A 471 16.157 5.664 -6.146 1.00 0.00 C ATOM 331 C ASN A 471 15.701 6.503 -4.933 1.00 0.00 C ATOM 332 O ASN A 471 16.168 7.630 -4.734 1.00 0.00 O ATOM 333 CB ASN A 471 15.457 6.167 -7.450 1.00 0.00 C ATOM 334 CG ASN A 471 15.932 5.508 -8.763 1.00 0.00 C ATOM 335 OD1 ASN A 471 16.230 4.211 -8.753 1.00 0.00 O flip ATOM 336 ND2 ASN A 471 15.990 6.165 -9.807 1.00 0.00 N flip ATOM 0 H ASN A 471 14.878 4.003 -6.123 1.00 0.00 H new ATOM 0 HA ASN A 471 17.235 5.778 -6.263 1.00 0.00 H new ATOM 0 HB2 ASN A 471 14.384 6.003 -7.351 1.00 0.00 H new ATOM 0 HB3 ASN A 471 15.609 7.243 -7.530 1.00 0.00 H new ATOM 0 HD21 ASN A 471 15.758 7.158 -9.798 1.00 0.00 H new ATOM 0 HD22 ASN A 471 16.269 5.714 -10.678 1.00 0.00 H new ATOM 343 N SER A 472 14.816 5.918 -4.106 1.00 0.00 N ATOM 344 CA SER A 472 14.159 6.609 -2.978 1.00 0.00 C ATOM 345 C SER A 472 15.076 6.721 -1.738 1.00 0.00 C ATOM 346 O SER A 472 15.981 5.902 -1.553 1.00 0.00 O ATOM 347 CB SER A 472 12.882 5.835 -2.615 1.00 0.00 C ATOM 348 OG SER A 472 12.021 5.690 -3.732 1.00 0.00 O ATOM 0 H SER A 472 14.533 4.943 -4.202 1.00 0.00 H new ATOM 0 HA SER A 472 13.925 7.627 -3.289 1.00 0.00 H new ATOM 0 HB2 SER A 472 13.150 4.850 -2.232 1.00 0.00 H new ATOM 0 HB3 SER A 472 12.356 6.356 -1.815 1.00 0.00 H new ATOM 0 HG SER A 472 11.157 5.337 -3.435 1.00 0.00 H new ATOM 354 N ASP A 473 14.792 7.728 -0.878 1.00 0.00 N ATOM 355 CA ASP A 473 15.560 7.993 0.364 1.00 0.00 C ATOM 356 C ASP A 473 15.253 6.937 1.432 1.00 0.00 C ATOM 357 O ASP A 473 16.137 6.551 2.209 1.00 0.00 O ATOM 358 CB ASP A 473 15.231 9.399 0.930 1.00 0.00 C ATOM 359 CG ASP A 473 15.660 10.548 0.007 1.00 0.00 C ATOM 360 OD1 ASP A 473 14.871 10.940 -0.886 1.00 0.00 O ATOM 361 OD2 ASP A 473 16.784 11.068 0.170 1.00 0.00 O ATOM 0 H ASP A 473 14.023 8.381 -1.026 1.00 0.00 H new ATOM 0 HA ASP A 473 16.619 7.948 0.108 1.00 0.00 H new ATOM 0 HB2 ASP A 473 14.158 9.468 1.108 1.00 0.00 H new ATOM 0 HB3 ASP A 473 15.722 9.517 1.896 1.00 0.00 H new ATOM 366 N LYS A 474 13.982 6.506 1.496 1.00 0.00 N ATOM 367 CA LYS A 474 13.561 5.420 2.398 1.00 0.00 C ATOM 368 C LYS A 474 13.950 4.060 1.792 1.00 0.00 C ATOM 369 O LYS A 474 14.006 3.914 0.558 1.00 0.00 O ATOM 370 CB LYS A 474 12.025 5.471 2.722 1.00 0.00 C ATOM 371 CG LYS A 474 11.036 5.086 1.585 1.00 0.00 C ATOM 372 CD LYS A 474 10.975 6.112 0.429 1.00 0.00 C ATOM 373 CE LYS A 474 9.762 5.894 -0.505 1.00 0.00 C ATOM 374 NZ LYS A 474 8.473 6.234 0.169 1.00 0.00 N ATOM 0 H LYS A 474 13.226 6.894 0.932 1.00 0.00 H new ATOM 0 HA LYS A 474 14.082 5.555 3.346 1.00 0.00 H new ATOM 0 HB2 LYS A 474 11.838 4.810 3.568 1.00 0.00 H new ATOM 0 HB3 LYS A 474 11.784 6.483 3.049 1.00 0.00 H new ATOM 0 HG2 LYS A 474 11.324 4.115 1.181 1.00 0.00 H new ATOM 0 HG3 LYS A 474 10.038 4.972 2.009 1.00 0.00 H new ATOM 0 HD2 LYS A 474 10.931 7.118 0.845 1.00 0.00 H new ATOM 0 HD3 LYS A 474 11.893 6.049 -0.155 1.00 0.00 H new ATOM 0 HE2 LYS A 474 9.877 6.507 -1.399 1.00 0.00 H new ATOM 0 HE3 LYS A 474 9.738 4.855 -0.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 7.708 6.255 -0.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 8.259 5.517 0.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 8.553 7.167 0.621 1.00 0.00 H new ATOM 388 N ASP A 475 14.252 3.092 2.673 1.00 0.00 N ATOM 389 CA ASP A 475 14.532 1.699 2.282 1.00 0.00 C ATOM 390 C ASP A 475 13.262 1.060 1.749 1.00 0.00 C ATOM 391 O ASP A 475 12.165 1.305 2.281 1.00 0.00 O ATOM 392 CB ASP A 475 15.068 0.860 3.480 1.00 0.00 C ATOM 393 CG ASP A 475 16.325 1.457 4.131 1.00 0.00 C ATOM 394 OD1 ASP A 475 17.217 1.938 3.398 1.00 0.00 O ATOM 395 OD2 ASP A 475 16.421 1.483 5.374 1.00 0.00 O ATOM 0 H ASP A 475 14.309 3.253 3.679 1.00 0.00 H new ATOM 0 HA ASP A 475 15.302 1.715 1.511 1.00 0.00 H new ATOM 0 HB2 ASP A 475 14.284 0.774 4.233 1.00 0.00 H new ATOM 0 HB3 ASP A 475 15.291 -0.150 3.135 1.00 0.00 H new ATOM 400 N GLN A 476 13.408 0.255 0.699 1.00 0.00 N ATOM 401 CA GLN A 476 12.280 -0.404 0.046 1.00 0.00 C ATOM 402 C GLN A 476 12.386 -1.922 0.300 1.00 0.00 C ATOM 403 O GLN A 476 13.289 -2.577 -0.223 1.00 0.00 O ATOM 404 CB GLN A 476 12.265 -0.077 -1.482 1.00 0.00 C ATOM 405 CG GLN A 476 10.866 -0.091 -2.144 1.00 0.00 C ATOM 406 CD GLN A 476 10.027 -1.315 -1.788 1.00 0.00 C ATOM 407 OE1 GLN A 476 10.296 -2.429 -2.445 1.00 0.00 O flip ATOM 408 NE2 GLN A 476 9.221 -1.287 -0.862 1.00 0.00 N flip ATOM 0 H GLN A 476 14.312 0.041 0.277 1.00 0.00 H new ATOM 0 HA GLN A 476 11.340 -0.038 0.460 1.00 0.00 H new ATOM 0 HB2 GLN A 476 12.710 0.907 -1.631 1.00 0.00 H new ATOM 0 HB3 GLN A 476 12.901 -0.797 -1.998 1.00 0.00 H new ATOM 0 HG2 GLN A 476 10.325 0.807 -1.847 1.00 0.00 H new ATOM 0 HG3 GLN A 476 10.986 -0.047 -3.226 1.00 0.00 H new ATOM 0 HE21 GLN A 476 9.035 -0.411 -0.374 1.00 0.00 H new ATOM 0 HE22 GLN A 476 8.738 -2.140 -0.581 1.00 0.00 H new ATOM 417 N SER A 477 11.450 -2.451 1.100 1.00 0.00 N ATOM 418 CA SER A 477 11.365 -3.887 1.417 1.00 0.00 C ATOM 419 C SER A 477 10.778 -4.672 0.227 1.00 0.00 C ATOM 420 O SER A 477 9.679 -4.366 -0.254 1.00 0.00 O ATOM 421 CB SER A 477 10.510 -4.093 2.691 1.00 0.00 C ATOM 422 OG SER A 477 11.048 -3.358 3.783 1.00 0.00 O ATOM 0 H SER A 477 10.725 -1.892 1.549 1.00 0.00 H new ATOM 0 HA SER A 477 12.369 -4.268 1.605 1.00 0.00 H new ATOM 0 HB2 SER A 477 9.485 -3.775 2.502 1.00 0.00 H new ATOM 0 HB3 SER A 477 10.473 -5.153 2.943 1.00 0.00 H new ATOM 0 HG SER A 477 10.493 -3.500 4.578 1.00 0.00 H new ATOM 428 N LEU A 478 11.533 -5.665 -0.258 1.00 0.00 N ATOM 429 CA LEU A 478 11.113 -6.538 -1.367 1.00 0.00 C ATOM 430 C LEU A 478 10.545 -7.862 -0.809 1.00 0.00 C ATOM 431 O LEU A 478 10.689 -8.165 0.383 1.00 0.00 O ATOM 432 CB LEU A 478 12.310 -6.796 -2.326 1.00 0.00 C ATOM 433 CG LEU A 478 12.873 -5.549 -3.089 1.00 0.00 C ATOM 434 CD1 LEU A 478 14.091 -5.912 -3.960 1.00 0.00 C ATOM 435 CD2 LEU A 478 11.785 -4.878 -3.942 1.00 0.00 C ATOM 0 H LEU A 478 12.458 -5.889 0.108 1.00 0.00 H new ATOM 0 HA LEU A 478 10.326 -6.045 -1.937 1.00 0.00 H new ATOM 0 HB2 LEU A 478 13.122 -7.238 -1.748 1.00 0.00 H new ATOM 0 HB3 LEU A 478 12.003 -7.538 -3.063 1.00 0.00 H new ATOM 0 HG LEU A 478 13.204 -4.838 -2.332 1.00 0.00 H new ATOM 0 HD11 LEU A 478 14.451 -5.020 -4.472 1.00 0.00 H new ATOM 0 HD12 LEU A 478 14.884 -6.312 -3.328 1.00 0.00 H new ATOM 0 HD13 LEU A 478 13.801 -6.661 -4.697 1.00 0.00 H new ATOM 0 HD21 LEU A 478 12.208 -4.016 -4.459 1.00 0.00 H new ATOM 0 HD22 LEU A 478 11.406 -5.590 -4.675 1.00 0.00 H new ATOM 0 HD23 LEU A 478 10.968 -4.551 -3.298 1.00 0.00 H new ATOM 447 N GLY A 479 9.883 -8.632 -1.680 1.00 0.00 N ATOM 448 CA GLY A 479 9.255 -9.899 -1.292 1.00 0.00 C ATOM 449 C GLY A 479 7.960 -10.110 -2.031 1.00 0.00 C ATOM 450 O GLY A 479 7.739 -11.142 -2.676 1.00 0.00 O ATOM 0 H GLY A 479 9.768 -8.397 -2.666 1.00 0.00 H new ATOM 0 HA2 GLY A 479 9.935 -10.725 -1.501 1.00 0.00 H new ATOM 0 HA3 GLY A 479 9.069 -9.903 -0.218 1.00 0.00 H new ATOM 454 N ASN A 480 7.103 -9.096 -1.929 1.00 0.00 N ATOM 455 CA ASN A 480 5.808 -9.028 -2.631 1.00 0.00 C ATOM 456 C ASN A 480 6.013 -8.550 -4.085 1.00 0.00 C ATOM 457 O ASN A 480 5.091 -8.601 -4.906 1.00 0.00 O ATOM 458 CB ASN A 480 4.852 -8.081 -1.863 1.00 0.00 C ATOM 459 CG ASN A 480 4.420 -8.560 -0.460 1.00 0.00 C ATOM 460 OD1 ASN A 480 5.242 -9.350 0.226 1.00 0.00 O flip ATOM 461 ND2 ASN A 480 3.341 -8.213 0.013 1.00 0.00 N flip ATOM 0 H ASN A 480 7.286 -8.279 -1.346 1.00 0.00 H new ATOM 0 HA ASN A 480 5.361 -10.021 -2.665 1.00 0.00 H new ATOM 0 HB2 ASN A 480 5.336 -7.110 -1.762 1.00 0.00 H new ATOM 0 HB3 ASN A 480 3.957 -7.930 -2.467 1.00 0.00 H new ATOM 0 HD21 ASN A 480 2.720 -7.607 -0.524 1.00 0.00 H new ATOM 0 HD22 ASN A 480 3.066 -8.531 0.942 1.00 0.00 H new ATOM 468 N TRP A 481 7.229 -8.049 -4.371 1.00 0.00 N ATOM 469 CA TRP A 481 7.611 -7.546 -5.697 1.00 0.00 C ATOM 470 C TRP A 481 8.060 -8.717 -6.588 1.00 0.00 C ATOM 471 O TRP A 481 8.748 -9.632 -6.116 1.00 0.00 O ATOM 472 CB TRP A 481 8.740 -6.483 -5.558 1.00 0.00 C ATOM 473 CG TRP A 481 8.310 -5.197 -4.866 1.00 0.00 C ATOM 474 CD1 TRP A 481 7.650 -5.076 -3.671 1.00 0.00 C ATOM 475 CD2 TRP A 481 8.537 -3.856 -5.323 1.00 0.00 C ATOM 476 NE1 TRP A 481 7.441 -3.756 -3.377 1.00 0.00 N ATOM 477 CE2 TRP A 481 7.981 -2.987 -4.374 1.00 0.00 C ATOM 478 CE3 TRP A 481 9.164 -3.308 -6.442 1.00 0.00 C ATOM 479 CZ2 TRP A 481 8.012 -1.603 -4.521 1.00 0.00 C ATOM 480 CZ3 TRP A 481 9.199 -1.934 -6.585 1.00 0.00 C ATOM 481 CH2 TRP A 481 8.633 -1.093 -5.625 1.00 0.00 C ATOM 0 H TRP A 481 7.977 -7.983 -3.681 1.00 0.00 H new ATOM 0 HA TRP A 481 6.751 -7.068 -6.166 1.00 0.00 H new ATOM 0 HB2 TRP A 481 9.569 -6.921 -5.002 1.00 0.00 H new ATOM 0 HB3 TRP A 481 9.117 -6.239 -6.551 1.00 0.00 H new ATOM 0 HD1 TRP A 481 7.339 -5.904 -3.050 1.00 0.00 H new ATOM 0 HE1 TRP A 481 6.961 -3.402 -2.550 1.00 0.00 H new ATOM 0 HE3 TRP A 481 9.615 -3.948 -7.186 1.00 0.00 H new ATOM 0 HZ2 TRP A 481 7.560 -0.954 -3.786 1.00 0.00 H new ATOM 0 HZ3 TRP A 481 9.673 -1.503 -7.455 1.00 0.00 H new ATOM 0 HH2 TRP A 481 8.687 -0.023 -5.758 1.00 0.00 H new ATOM 492 N ARG A 482 7.662 -8.680 -7.872 1.00 0.00 N ATOM 493 CA ARG A 482 7.973 -9.739 -8.856 1.00 0.00 C ATOM 494 C ARG A 482 8.548 -9.126 -10.148 1.00 0.00 C ATOM 495 O ARG A 482 8.146 -8.031 -10.556 1.00 0.00 O ATOM 496 CB ARG A 482 6.708 -10.584 -9.175 1.00 0.00 C ATOM 497 CG ARG A 482 5.540 -9.792 -9.808 1.00 0.00 C ATOM 498 CD ARG A 482 4.367 -10.686 -10.240 1.00 0.00 C ATOM 499 NE ARG A 482 3.764 -11.418 -9.110 1.00 0.00 N ATOM 500 CZ ARG A 482 2.693 -12.224 -9.190 1.00 0.00 C ATOM 501 NH1 ARG A 482 2.076 -12.429 -10.346 1.00 0.00 N ATOM 502 NH2 ARG A 482 2.236 -12.812 -8.099 1.00 0.00 N ATOM 0 H ARG A 482 7.113 -7.913 -8.261 1.00 0.00 H new ATOM 0 HA ARG A 482 8.724 -10.397 -8.420 1.00 0.00 H new ATOM 0 HB2 ARG A 482 6.989 -11.392 -9.851 1.00 0.00 H new ATOM 0 HB3 ARG A 482 6.356 -11.048 -8.253 1.00 0.00 H new ATOM 0 HG2 ARG A 482 5.181 -9.053 -9.092 1.00 0.00 H new ATOM 0 HG3 ARG A 482 5.909 -9.243 -10.675 1.00 0.00 H new ATOM 0 HD2 ARG A 482 3.604 -10.072 -10.718 1.00 0.00 H new ATOM 0 HD3 ARG A 482 4.715 -11.400 -10.986 1.00 0.00 H new ATOM 0 HE ARG A 482 4.196 -11.302 -8.193 1.00 0.00 H new ATOM 0 HH11 ARG A 482 2.414 -11.971 -11.193 1.00 0.00 H new ATOM 0 HH12 ARG A 482 1.264 -13.045 -10.388 1.00 0.00 H new ATOM 0 HH21 ARG A 482 2.696 -12.653 -7.203 1.00 0.00 H new ATOM 0 HH22 ARG A 482 1.423 -13.425 -8.153 1.00 0.00 H new ATOM 516 N ILE A 483 9.486 -9.848 -10.789 1.00 0.00 N ATOM 517 CA ILE A 483 10.132 -9.420 -12.037 1.00 0.00 C ATOM 518 C ILE A 483 9.583 -10.265 -13.191 1.00 0.00 C ATOM 519 O ILE A 483 10.054 -11.384 -13.441 1.00 0.00 O ATOM 520 CB ILE A 483 11.692 -9.581 -11.981 1.00 0.00 C ATOM 521 CG1 ILE A 483 12.280 -8.944 -10.698 1.00 0.00 C ATOM 522 CG2 ILE A 483 12.362 -8.992 -13.250 1.00 0.00 C ATOM 523 CD1 ILE A 483 13.784 -9.101 -10.569 1.00 0.00 C ATOM 0 H ILE A 483 9.817 -10.751 -10.450 1.00 0.00 H new ATOM 0 HA ILE A 483 9.913 -8.363 -12.185 1.00 0.00 H new ATOM 0 HB ILE A 483 11.910 -10.649 -11.951 1.00 0.00 H new ATOM 0 HG12 ILE A 483 12.033 -7.883 -10.685 1.00 0.00 H new ATOM 0 HG13 ILE A 483 11.801 -9.394 -9.828 1.00 0.00 H new ATOM 0 HG21 ILE A 483 13.443 -9.118 -13.183 1.00 0.00 H new ATOM 0 HG22 ILE A 483 11.990 -9.512 -14.133 1.00 0.00 H new ATOM 0 HG23 ILE A 483 12.125 -7.931 -13.328 1.00 0.00 H new ATOM 0 HD11 ILE A 483 14.121 -8.630 -9.646 1.00 0.00 H new ATOM 0 HD12 ILE A 483 14.039 -10.161 -10.549 1.00 0.00 H new ATOM 0 HD13 ILE A 483 14.274 -8.626 -11.419 1.00 0.00 H new ATOM 535 N LYS A 484 8.572 -9.724 -13.867 1.00 0.00 N ATOM 536 CA LYS A 484 7.918 -10.360 -15.012 1.00 0.00 C ATOM 537 C LYS A 484 8.790 -10.173 -16.257 1.00 0.00 C ATOM 538 O LYS A 484 9.227 -9.071 -16.531 1.00 0.00 O ATOM 539 CB LYS A 484 6.529 -9.708 -15.218 1.00 0.00 C ATOM 540 CG LYS A 484 5.639 -9.730 -13.953 1.00 0.00 C ATOM 541 CD LYS A 484 4.405 -8.798 -14.049 1.00 0.00 C ATOM 542 CE LYS A 484 3.215 -9.367 -14.841 1.00 0.00 C ATOM 543 NZ LYS A 484 3.562 -9.747 -16.238 1.00 0.00 N ATOM 0 H LYS A 484 8.176 -8.814 -13.631 1.00 0.00 H new ATOM 0 HA LYS A 484 7.788 -11.427 -14.833 1.00 0.00 H new ATOM 0 HB2 LYS A 484 6.666 -8.675 -15.537 1.00 0.00 H new ATOM 0 HB3 LYS A 484 6.011 -10.225 -16.025 1.00 0.00 H new ATOM 0 HG2 LYS A 484 5.300 -10.751 -13.774 1.00 0.00 H new ATOM 0 HG3 LYS A 484 6.239 -9.438 -13.091 1.00 0.00 H new ATOM 0 HD2 LYS A 484 4.069 -8.561 -13.039 1.00 0.00 H new ATOM 0 HD3 LYS A 484 4.713 -7.860 -14.511 1.00 0.00 H new ATOM 0 HE2 LYS A 484 2.827 -10.242 -14.320 1.00 0.00 H new ATOM 0 HE3 LYS A 484 2.415 -8.627 -14.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 2.707 -9.714 -16.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 4.269 -9.083 -16.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 3.953 -10.711 -16.249 1.00 0.00 H new ATOM 557 N ARG A 485 9.063 -11.258 -16.978 1.00 0.00 N ATOM 558 CA ARG A 485 9.875 -11.241 -18.198 1.00 0.00 C ATOM 559 C ARG A 485 9.176 -12.086 -19.254 1.00 0.00 C ATOM 560 O ARG A 485 9.304 -13.319 -19.281 1.00 0.00 O ATOM 561 CB ARG A 485 11.324 -11.733 -17.922 1.00 0.00 C ATOM 562 CG ARG A 485 12.186 -10.708 -17.163 1.00 0.00 C ATOM 563 CD ARG A 485 13.607 -11.208 -16.886 1.00 0.00 C ATOM 564 NE ARG A 485 14.319 -11.646 -18.102 1.00 0.00 N ATOM 565 CZ ARG A 485 15.032 -10.861 -18.930 1.00 0.00 C ATOM 566 NH1 ARG A 485 15.026 -9.535 -18.811 1.00 0.00 N ATOM 567 NH2 ARG A 485 15.727 -11.414 -19.908 1.00 0.00 N ATOM 0 H ARG A 485 8.723 -12.187 -16.730 1.00 0.00 H new ATOM 0 HA ARG A 485 9.969 -10.219 -18.564 1.00 0.00 H new ATOM 0 HB2 ARG A 485 11.282 -12.658 -17.346 1.00 0.00 H new ATOM 0 HB3 ARG A 485 11.806 -11.970 -18.871 1.00 0.00 H new ATOM 0 HG2 ARG A 485 12.238 -9.786 -17.742 1.00 0.00 H new ATOM 0 HG3 ARG A 485 11.702 -10.464 -16.217 1.00 0.00 H new ATOM 0 HD2 ARG A 485 14.177 -10.413 -16.406 1.00 0.00 H new ATOM 0 HD3 ARG A 485 13.562 -12.038 -16.181 1.00 0.00 H new ATOM 0 HE ARG A 485 14.266 -12.637 -18.337 1.00 0.00 H new ATOM 0 HH11 ARG A 485 14.472 -9.091 -18.079 1.00 0.00 H new ATOM 0 HH12 ARG A 485 15.576 -8.963 -19.452 1.00 0.00 H new ATOM 0 HH21 ARG A 485 15.720 -12.427 -20.030 1.00 0.00 H new ATOM 0 HH22 ARG A 485 16.271 -10.828 -20.542 1.00 0.00 H new ATOM 581 N GLN A 486 8.373 -11.398 -20.070 1.00 0.00 N ATOM 582 CA GLN A 486 7.646 -11.984 -21.191 1.00 0.00 C ATOM 583 C GLN A 486 8.483 -11.815 -22.473 1.00 0.00 C ATOM 584 O GLN A 486 8.594 -10.719 -23.041 1.00 0.00 O ATOM 585 CB GLN A 486 6.210 -11.362 -21.324 1.00 0.00 C ATOM 586 CG GLN A 486 6.121 -9.807 -21.254 1.00 0.00 C ATOM 587 CD GLN A 486 5.996 -9.220 -19.833 1.00 0.00 C ATOM 588 OE1 GLN A 486 6.434 -9.810 -18.842 1.00 0.00 O ATOM 589 NE2 GLN A 486 5.441 -8.026 -19.737 1.00 0.00 N ATOM 0 H GLN A 486 8.209 -10.397 -19.964 1.00 0.00 H new ATOM 0 HA GLN A 486 7.496 -13.049 -21.016 1.00 0.00 H new ATOM 0 HB2 GLN A 486 5.783 -11.687 -22.273 1.00 0.00 H new ATOM 0 HB3 GLN A 486 5.583 -11.776 -20.534 1.00 0.00 H new ATOM 0 HG2 GLN A 486 7.009 -9.387 -21.727 1.00 0.00 H new ATOM 0 HG3 GLN A 486 5.262 -9.481 -21.841 1.00 0.00 H new ATOM 0 HE21 GLN A 486 5.087 -7.560 -20.572 1.00 0.00 H new ATOM 0 HE22 GLN A 486 5.367 -7.570 -18.828 1.00 0.00 H new ATOM 598 N VAL A 487 9.120 -12.920 -22.874 1.00 0.00 N ATOM 599 CA VAL A 487 9.892 -13.031 -24.119 1.00 0.00 C ATOM 600 C VAL A 487 8.915 -13.165 -25.307 1.00 0.00 C ATOM 601 O VAL A 487 7.803 -13.680 -25.134 1.00 0.00 O ATOM 602 CB VAL A 487 10.868 -14.271 -24.049 1.00 0.00 C ATOM 603 CG1 VAL A 487 11.797 -14.359 -25.283 1.00 0.00 C ATOM 604 CG2 VAL A 487 11.701 -14.244 -22.744 1.00 0.00 C ATOM 0 H VAL A 487 9.114 -13.783 -22.330 1.00 0.00 H new ATOM 0 HA VAL A 487 10.499 -12.136 -24.256 1.00 0.00 H new ATOM 0 HB VAL A 487 10.244 -15.165 -24.050 1.00 0.00 H new ATOM 0 HG11 VAL A 487 12.448 -15.228 -25.187 1.00 0.00 H new ATOM 0 HG12 VAL A 487 11.194 -14.455 -26.186 1.00 0.00 H new ATOM 0 HG13 VAL A 487 12.404 -13.456 -25.347 1.00 0.00 H new ATOM 0 HG21 VAL A 487 12.365 -15.108 -22.719 1.00 0.00 H new ATOM 0 HG22 VAL A 487 12.293 -13.329 -22.709 1.00 0.00 H new ATOM 0 HG23 VAL A 487 11.032 -14.276 -21.884 1.00 0.00 H new ATOM 614 N LEU A 488 9.330 -12.704 -26.504 1.00 0.00 N ATOM 615 CA LEU A 488 8.490 -12.739 -27.732 1.00 0.00 C ATOM 616 C LEU A 488 8.060 -14.180 -28.125 1.00 0.00 C ATOM 617 O LEU A 488 7.081 -14.372 -28.855 1.00 0.00 O ATOM 618 CB LEU A 488 9.217 -12.044 -28.926 1.00 0.00 C ATOM 619 CG LEU A 488 10.400 -12.821 -29.623 1.00 0.00 C ATOM 620 CD1 LEU A 488 10.865 -12.103 -30.913 1.00 0.00 C ATOM 621 CD2 LEU A 488 11.600 -13.051 -28.683 1.00 0.00 C ATOM 0 H LEU A 488 10.253 -12.297 -26.653 1.00 0.00 H new ATOM 0 HA LEU A 488 7.580 -12.185 -27.500 1.00 0.00 H new ATOM 0 HB2 LEU A 488 8.470 -11.819 -29.687 1.00 0.00 H new ATOM 0 HB3 LEU A 488 9.607 -11.090 -28.571 1.00 0.00 H new ATOM 0 HG LEU A 488 10.001 -13.800 -29.888 1.00 0.00 H new ATOM 0 HD11 LEU A 488 11.681 -12.665 -31.368 1.00 0.00 H new ATOM 0 HD12 LEU A 488 10.033 -12.039 -31.614 1.00 0.00 H new ATOM 0 HD13 LEU A 488 11.209 -11.099 -30.666 1.00 0.00 H new ATOM 0 HD21 LEU A 488 12.383 -13.590 -29.217 1.00 0.00 H new ATOM 0 HD22 LEU A 488 11.987 -12.090 -28.345 1.00 0.00 H new ATOM 0 HD23 LEU A 488 11.280 -13.636 -27.821 1.00 0.00 H new ATOM 633 N GLU A 489 8.808 -15.172 -27.615 1.00 0.00 N ATOM 634 CA GLU A 489 8.552 -16.614 -27.830 1.00 0.00 C ATOM 635 C GLU A 489 7.329 -17.127 -27.037 1.00 0.00 C ATOM 636 O GLU A 489 6.848 -18.246 -27.271 1.00 0.00 O ATOM 637 CB GLU A 489 9.824 -17.409 -27.441 1.00 0.00 C ATOM 638 CG GLU A 489 11.084 -17.003 -28.232 1.00 0.00 C ATOM 639 CD GLU A 489 12.353 -17.720 -27.748 1.00 0.00 C ATOM 640 OE1 GLU A 489 12.570 -18.892 -28.133 1.00 0.00 O ATOM 641 OE2 GLU A 489 13.144 -17.111 -26.994 1.00 0.00 O ATOM 0 H GLU A 489 9.624 -14.995 -27.030 1.00 0.00 H new ATOM 0 HA GLU A 489 8.318 -16.764 -28.884 1.00 0.00 H new ATOM 0 HB2 GLU A 489 10.015 -17.270 -26.377 1.00 0.00 H new ATOM 0 HB3 GLU A 489 9.637 -18.472 -27.596 1.00 0.00 H new ATOM 0 HG2 GLU A 489 10.930 -17.223 -29.288 1.00 0.00 H new ATOM 0 HG3 GLU A 489 11.228 -15.926 -28.148 1.00 0.00 H new ATOM 648 N GLY A 490 6.832 -16.299 -26.110 1.00 0.00 N ATOM 649 CA GLY A 490 5.680 -16.640 -25.271 1.00 0.00 C ATOM 650 C GLY A 490 6.059 -16.890 -23.815 1.00 0.00 C ATOM 651 O GLY A 490 5.191 -16.862 -22.940 1.00 0.00 O ATOM 0 H GLY A 490 7.218 -15.374 -25.922 1.00 0.00 H new ATOM 0 HA2 GLY A 490 4.951 -15.831 -25.318 1.00 0.00 H new ATOM 0 HA3 GLY A 490 5.195 -17.530 -25.673 1.00 0.00 H new ATOM 655 N GLU A 491 7.369 -17.116 -23.564 1.00 0.00 N ATOM 656 CA GLU A 491 7.901 -17.454 -22.232 1.00 0.00 C ATOM 657 C GLU A 491 7.727 -16.286 -21.243 1.00 0.00 C ATOM 658 O GLU A 491 8.464 -15.303 -21.305 1.00 0.00 O ATOM 659 CB GLU A 491 9.402 -17.819 -22.345 1.00 0.00 C ATOM 660 CG GLU A 491 9.711 -19.028 -23.246 1.00 0.00 C ATOM 661 CD GLU A 491 11.218 -19.283 -23.388 1.00 0.00 C ATOM 662 OE1 GLU A 491 11.818 -19.900 -22.482 1.00 0.00 O ATOM 663 OE2 GLU A 491 11.817 -18.843 -24.388 1.00 0.00 O ATOM 0 H GLU A 491 8.087 -17.068 -24.287 1.00 0.00 H new ATOM 0 HA GLU A 491 7.339 -18.307 -21.852 1.00 0.00 H new ATOM 0 HB2 GLU A 491 9.943 -16.953 -22.726 1.00 0.00 H new ATOM 0 HB3 GLU A 491 9.788 -18.022 -21.346 1.00 0.00 H new ATOM 0 HG2 GLU A 491 9.232 -19.916 -22.834 1.00 0.00 H new ATOM 0 HG3 GLU A 491 9.279 -18.862 -24.233 1.00 0.00 H new ATOM 670 N GLU A 492 6.734 -16.403 -20.358 1.00 0.00 N ATOM 671 CA GLU A 492 6.498 -15.437 -19.280 1.00 0.00 C ATOM 672 C GLU A 492 6.914 -16.068 -17.933 1.00 0.00 C ATOM 673 O GLU A 492 6.401 -17.130 -17.543 1.00 0.00 O ATOM 674 CB GLU A 492 5.011 -14.968 -19.263 1.00 0.00 C ATOM 675 CG GLU A 492 3.966 -16.096 -19.150 1.00 0.00 C ATOM 676 CD GLU A 492 2.553 -15.577 -18.844 1.00 0.00 C ATOM 677 OE1 GLU A 492 2.310 -15.164 -17.681 1.00 0.00 O ATOM 678 OE2 GLU A 492 1.687 -15.574 -19.748 1.00 0.00 O ATOM 0 H GLU A 492 6.067 -17.175 -20.368 1.00 0.00 H new ATOM 0 HA GLU A 492 7.105 -14.548 -19.452 1.00 0.00 H new ATOM 0 HB2 GLU A 492 4.873 -14.282 -18.427 1.00 0.00 H new ATOM 0 HB3 GLU A 492 4.815 -14.403 -20.174 1.00 0.00 H new ATOM 0 HG2 GLU A 492 3.946 -16.660 -20.083 1.00 0.00 H new ATOM 0 HG3 GLU A 492 4.271 -16.789 -18.365 1.00 0.00 H new ATOM 685 N ILE A 493 7.881 -15.435 -17.251 1.00 0.00 N ATOM 686 CA ILE A 493 8.361 -15.862 -15.912 1.00 0.00 C ATOM 687 C ILE A 493 8.393 -14.652 -14.966 1.00 0.00 C ATOM 688 O ILE A 493 8.659 -13.539 -15.399 1.00 0.00 O ATOM 689 CB ILE A 493 9.788 -16.537 -15.980 1.00 0.00 C ATOM 690 CG1 ILE A 493 10.826 -15.588 -16.666 1.00 0.00 C ATOM 691 CG2 ILE A 493 9.723 -17.916 -16.686 1.00 0.00 C ATOM 692 CD1 ILE A 493 12.247 -16.115 -16.695 1.00 0.00 C ATOM 0 H ILE A 493 8.359 -14.608 -17.608 1.00 0.00 H new ATOM 0 HA ILE A 493 7.666 -16.611 -15.532 1.00 0.00 H new ATOM 0 HB ILE A 493 10.126 -16.710 -14.958 1.00 0.00 H new ATOM 0 HG12 ILE A 493 10.503 -15.398 -17.690 1.00 0.00 H new ATOM 0 HG13 ILE A 493 10.819 -14.630 -16.147 1.00 0.00 H new ATOM 0 HG21 ILE A 493 10.720 -18.356 -16.718 1.00 0.00 H new ATOM 0 HG22 ILE A 493 9.053 -18.576 -16.135 1.00 0.00 H new ATOM 0 HG23 ILE A 493 9.351 -17.787 -17.702 1.00 0.00 H new ATOM 0 HD11 ILE A 493 12.894 -15.390 -17.189 1.00 0.00 H new ATOM 0 HD12 ILE A 493 12.596 -16.277 -15.675 1.00 0.00 H new ATOM 0 HD13 ILE A 493 12.274 -17.058 -17.242 1.00 0.00 H new ATOM 704 N ALA A 494 8.118 -14.874 -13.672 1.00 0.00 N ATOM 705 CA ALA A 494 8.086 -13.799 -12.665 1.00 0.00 C ATOM 706 C ALA A 494 8.948 -14.184 -11.457 1.00 0.00 C ATOM 707 O ALA A 494 8.591 -15.095 -10.701 1.00 0.00 O ATOM 708 CB ALA A 494 6.634 -13.503 -12.249 1.00 0.00 C ATOM 0 H ALA A 494 7.912 -15.799 -13.294 1.00 0.00 H new ATOM 0 HA ALA A 494 8.501 -12.889 -13.098 1.00 0.00 H new ATOM 0 HB1 ALA A 494 6.624 -12.707 -11.505 1.00 0.00 H new ATOM 0 HB2 ALA A 494 6.062 -13.190 -13.122 1.00 0.00 H new ATOM 0 HB3 ALA A 494 6.187 -14.402 -11.825 1.00 0.00 H new ATOM 714 N TYR A 495 10.106 -13.508 -11.297 1.00 0.00 N ATOM 715 CA TYR A 495 10.962 -13.696 -10.116 1.00 0.00 C ATOM 716 C TYR A 495 10.385 -12.890 -8.951 1.00 0.00 C ATOM 717 O TYR A 495 10.551 -11.672 -8.892 1.00 0.00 O ATOM 718 CB TYR A 495 12.421 -13.239 -10.400 1.00 0.00 C ATOM 719 CG TYR A 495 13.389 -13.398 -9.206 1.00 0.00 C ATOM 720 CD1 TYR A 495 13.980 -14.628 -8.921 1.00 0.00 C ATOM 721 CD2 TYR A 495 13.712 -12.322 -8.364 1.00 0.00 C ATOM 722 CE1 TYR A 495 14.854 -14.782 -7.859 1.00 0.00 C ATOM 723 CE2 TYR A 495 14.584 -12.478 -7.300 1.00 0.00 C ATOM 724 CZ TYR A 495 15.150 -13.706 -7.052 1.00 0.00 C ATOM 725 OH TYR A 495 16.025 -13.858 -5.996 1.00 0.00 O ATOM 0 H TYR A 495 10.465 -12.831 -11.970 1.00 0.00 H new ATOM 0 HA TYR A 495 10.986 -14.757 -9.866 1.00 0.00 H new ATOM 0 HB2 TYR A 495 12.809 -13.810 -11.244 1.00 0.00 H new ATOM 0 HB3 TYR A 495 12.407 -12.192 -10.703 1.00 0.00 H new ATOM 0 HD1 TYR A 495 13.751 -15.480 -9.543 1.00 0.00 H new ATOM 0 HD2 TYR A 495 13.272 -11.354 -8.550 1.00 0.00 H new ATOM 0 HE1 TYR A 495 15.303 -15.744 -7.663 1.00 0.00 H new ATOM 0 HE2 TYR A 495 14.819 -11.636 -6.666 1.00 0.00 H new ATOM 0 HH TYR A 495 16.678 -14.556 -6.210 1.00 0.00 H new ATOM 735 N LYS A 496 9.724 -13.576 -8.020 1.00 0.00 N ATOM 736 CA LYS A 496 9.271 -12.954 -6.776 1.00 0.00 C ATOM 737 C LYS A 496 10.426 -12.993 -5.777 1.00 0.00 C ATOM 738 O LYS A 496 11.124 -14.007 -5.658 1.00 0.00 O ATOM 739 CB LYS A 496 7.985 -13.626 -6.189 1.00 0.00 C ATOM 740 CG LYS A 496 8.112 -15.104 -5.721 1.00 0.00 C ATOM 741 CD LYS A 496 7.973 -16.139 -6.856 1.00 0.00 C ATOM 742 CE LYS A 496 8.192 -17.582 -6.368 1.00 0.00 C ATOM 743 NZ LYS A 496 8.109 -18.559 -7.483 1.00 0.00 N ATOM 0 H LYS A 496 9.490 -14.565 -8.104 1.00 0.00 H new ATOM 0 HA LYS A 496 8.985 -11.923 -6.985 1.00 0.00 H new ATOM 0 HB2 LYS A 496 7.648 -13.030 -5.341 1.00 0.00 H new ATOM 0 HB3 LYS A 496 7.201 -13.576 -6.945 1.00 0.00 H new ATOM 0 HG2 LYS A 496 9.080 -15.239 -5.238 1.00 0.00 H new ATOM 0 HG3 LYS A 496 7.349 -15.302 -4.968 1.00 0.00 H new ATOM 0 HD2 LYS A 496 6.981 -16.056 -7.300 1.00 0.00 H new ATOM 0 HD3 LYS A 496 8.694 -15.911 -7.641 1.00 0.00 H new ATOM 0 HE2 LYS A 496 9.168 -17.660 -5.889 1.00 0.00 H new ATOM 0 HE3 LYS A 496 7.445 -17.828 -5.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 8.262 -19.520 -7.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 7.169 -18.503 -7.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 8.838 -18.340 -8.192 1.00 0.00 H new ATOM 757 N PHE A 497 10.660 -11.863 -5.112 1.00 0.00 N ATOM 758 CA PHE A 497 11.703 -11.743 -4.086 1.00 0.00 C ATOM 759 C PHE A 497 11.305 -12.482 -2.801 1.00 0.00 C ATOM 760 O PHE A 497 10.141 -12.855 -2.610 1.00 0.00 O ATOM 761 CB PHE A 497 11.973 -10.247 -3.805 1.00 0.00 C ATOM 762 CG PHE A 497 12.689 -9.528 -4.938 1.00 0.00 C ATOM 763 CD1 PHE A 497 14.071 -9.629 -5.072 1.00 0.00 C ATOM 764 CD2 PHE A 497 11.989 -8.769 -5.877 1.00 0.00 C ATOM 765 CE1 PHE A 497 14.731 -8.991 -6.100 1.00 0.00 C ATOM 766 CE2 PHE A 497 12.651 -8.131 -6.907 1.00 0.00 C ATOM 767 CZ PHE A 497 14.022 -8.247 -7.018 1.00 0.00 C ATOM 0 H PHE A 497 10.134 -11.003 -5.267 1.00 0.00 H new ATOM 0 HA PHE A 497 12.617 -12.208 -4.454 1.00 0.00 H new ATOM 0 HB2 PHE A 497 11.024 -9.746 -3.612 1.00 0.00 H new ATOM 0 HB3 PHE A 497 12.570 -10.160 -2.897 1.00 0.00 H new ATOM 0 HD1 PHE A 497 14.634 -10.215 -4.361 1.00 0.00 H new ATOM 0 HD2 PHE A 497 10.916 -8.680 -5.797 1.00 0.00 H new ATOM 0 HE1 PHE A 497 15.804 -9.074 -6.186 1.00 0.00 H new ATOM 0 HE2 PHE A 497 12.098 -7.543 -7.624 1.00 0.00 H new ATOM 0 HZ PHE A 497 14.540 -7.753 -7.827 1.00 0.00 H new ATOM 777 N THR A 498 12.291 -12.711 -1.937 1.00 0.00 N ATOM 778 CA THR A 498 12.074 -13.296 -0.616 1.00 0.00 C ATOM 779 C THR A 498 11.576 -12.190 0.341 1.00 0.00 C ATOM 780 O THR A 498 12.107 -11.076 0.310 1.00 0.00 O ATOM 781 CB THR A 498 13.391 -13.961 -0.099 1.00 0.00 C ATOM 782 OG1 THR A 498 14.435 -12.975 -0.013 1.00 0.00 O ATOM 783 CG2 THR A 498 13.839 -15.108 -1.039 1.00 0.00 C ATOM 0 H THR A 498 13.268 -12.495 -2.135 1.00 0.00 H new ATOM 0 HA THR A 498 11.317 -14.078 -0.668 1.00 0.00 H new ATOM 0 HB THR A 498 13.197 -14.378 0.889 1.00 0.00 H new ATOM 0 HG1 THR A 498 15.257 -13.397 0.313 1.00 0.00 H new ATOM 0 HG21 THR A 498 14.757 -15.554 -0.657 1.00 0.00 H new ATOM 0 HG22 THR A 498 13.058 -15.867 -1.084 1.00 0.00 H new ATOM 0 HG23 THR A 498 14.017 -14.711 -2.038 1.00 0.00 H new ATOM 791 N PRO A 499 10.527 -12.460 1.186 1.00 0.00 N ATOM 792 CA PRO A 499 9.908 -11.421 2.058 1.00 0.00 C ATOM 793 C PRO A 499 10.845 -10.903 3.172 1.00 0.00 C ATOM 794 O PRO A 499 10.518 -9.924 3.855 1.00 0.00 O ATOM 795 CB PRO A 499 8.664 -12.142 2.637 1.00 0.00 C ATOM 796 CG PRO A 499 9.010 -13.599 2.588 1.00 0.00 C ATOM 797 CD PRO A 499 9.851 -13.777 1.345 1.00 0.00 C ATOM 0 HA PRO A 499 9.668 -10.516 1.500 1.00 0.00 H new ATOM 0 HB2 PRO A 499 8.458 -11.818 3.657 1.00 0.00 H new ATOM 0 HB3 PRO A 499 7.772 -11.927 2.048 1.00 0.00 H new ATOM 0 HG2 PRO A 499 9.560 -13.901 3.479 1.00 0.00 H new ATOM 0 HG3 PRO A 499 8.111 -14.214 2.544 1.00 0.00 H new ATOM 0 HD2 PRO A 499 10.572 -14.586 1.462 1.00 0.00 H new ATOM 0 HD3 PRO A 499 9.237 -14.020 0.477 1.00 0.00 H new ATOM 805 N LYS A 500 11.999 -11.571 3.353 1.00 0.00 N ATOM 806 CA LYS A 500 13.028 -11.166 4.332 1.00 0.00 C ATOM 807 C LYS A 500 14.090 -10.240 3.693 1.00 0.00 C ATOM 808 O LYS A 500 14.930 -9.684 4.406 1.00 0.00 O ATOM 809 CB LYS A 500 13.705 -12.421 4.945 1.00 0.00 C ATOM 810 CG LYS A 500 14.424 -13.340 3.930 1.00 0.00 C ATOM 811 CD LYS A 500 15.170 -14.507 4.618 1.00 0.00 C ATOM 812 CE LYS A 500 15.873 -15.439 3.621 1.00 0.00 C ATOM 813 NZ LYS A 500 16.655 -16.489 4.323 1.00 0.00 N ATOM 0 H LYS A 500 12.246 -12.408 2.825 1.00 0.00 H new ATOM 0 HA LYS A 500 12.533 -10.603 5.123 1.00 0.00 H new ATOM 0 HB2 LYS A 500 14.428 -12.096 5.693 1.00 0.00 H new ATOM 0 HB3 LYS A 500 12.947 -13.005 5.467 1.00 0.00 H new ATOM 0 HG2 LYS A 500 13.694 -13.743 3.228 1.00 0.00 H new ATOM 0 HG3 LYS A 500 15.134 -12.751 3.349 1.00 0.00 H new ATOM 0 HD2 LYS A 500 15.908 -14.102 5.310 1.00 0.00 H new ATOM 0 HD3 LYS A 500 14.461 -15.086 5.210 1.00 0.00 H new ATOM 0 HE2 LYS A 500 15.132 -15.907 2.973 1.00 0.00 H new ATOM 0 HE3 LYS A 500 16.535 -14.857 2.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 17.118 -17.103 3.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 17.377 -16.041 4.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 16.018 -17.059 4.915 1.00 0.00 H new ATOM 827 N TYR A 501 14.065 -10.096 2.357 1.00 0.00 N ATOM 828 CA TYR A 501 15.032 -9.262 1.628 1.00 0.00 C ATOM 829 C TYR A 501 14.521 -7.811 1.553 1.00 0.00 C ATOM 830 O TYR A 501 13.451 -7.552 1.004 1.00 0.00 O ATOM 831 CB TYR A 501 15.285 -9.829 0.202 1.00 0.00 C ATOM 832 CG TYR A 501 16.337 -9.038 -0.589 1.00 0.00 C ATOM 833 CD1 TYR A 501 17.704 -9.230 -0.365 1.00 0.00 C ATOM 834 CD2 TYR A 501 15.966 -8.072 -1.528 1.00 0.00 C ATOM 835 CE1 TYR A 501 18.649 -8.489 -1.051 1.00 0.00 C ATOM 836 CE2 TYR A 501 16.908 -7.333 -2.201 1.00 0.00 C ATOM 837 CZ TYR A 501 18.241 -7.543 -1.966 1.00 0.00 C ATOM 838 OH TYR A 501 19.170 -6.793 -2.643 1.00 0.00 O ATOM 0 H TYR A 501 13.378 -10.552 1.757 1.00 0.00 H new ATOM 0 HA TYR A 501 15.980 -9.274 2.166 1.00 0.00 H new ATOM 0 HB2 TYR A 501 15.607 -10.867 0.283 1.00 0.00 H new ATOM 0 HB3 TYR A 501 14.347 -9.828 -0.353 1.00 0.00 H new ATOM 0 HD1 TYR A 501 18.027 -9.968 0.354 1.00 0.00 H new ATOM 0 HD2 TYR A 501 14.918 -7.903 -1.728 1.00 0.00 H new ATOM 0 HE1 TYR A 501 19.701 -8.651 -0.870 1.00 0.00 H new ATOM 0 HE2 TYR A 501 16.597 -6.586 -2.916 1.00 0.00 H new ATOM 0 HH TYR A 501 20.027 -7.268 -2.657 1.00 0.00 H new ATOM 848 N ILE A 502 15.291 -6.875 2.127 1.00 0.00 N ATOM 849 CA ILE A 502 15.049 -5.429 1.986 1.00 0.00 C ATOM 850 C ILE A 502 16.128 -4.832 1.077 1.00 0.00 C ATOM 851 O ILE A 502 17.325 -5.077 1.279 1.00 0.00 O ATOM 852 CB ILE A 502 15.047 -4.677 3.374 1.00 0.00 C ATOM 853 CG1 ILE A 502 13.951 -5.279 4.307 1.00 0.00 C ATOM 854 CG2 ILE A 502 14.854 -3.141 3.196 1.00 0.00 C ATOM 855 CD1 ILE A 502 13.766 -4.574 5.643 1.00 0.00 C ATOM 0 H ILE A 502 16.102 -7.099 2.704 1.00 0.00 H new ATOM 0 HA ILE A 502 14.059 -5.297 1.550 1.00 0.00 H new ATOM 0 HB ILE A 502 16.021 -4.823 3.841 1.00 0.00 H new ATOM 0 HG12 ILE A 502 13.000 -5.267 3.775 1.00 0.00 H new ATOM 0 HG13 ILE A 502 14.196 -6.324 4.498 1.00 0.00 H new ATOM 0 HG21 ILE A 502 14.858 -2.658 4.173 1.00 0.00 H new ATOM 0 HG22 ILE A 502 15.666 -2.740 2.590 1.00 0.00 H new ATOM 0 HG23 ILE A 502 13.902 -2.949 2.700 1.00 0.00 H new ATOM 0 HD11 ILE A 502 12.981 -5.073 6.212 1.00 0.00 H new ATOM 0 HD12 ILE A 502 14.699 -4.608 6.205 1.00 0.00 H new ATOM 0 HD13 ILE A 502 13.485 -3.535 5.470 1.00 0.00 H new ATOM 867 N LEU A 503 15.687 -4.072 0.071 1.00 0.00 N ATOM 868 CA LEU A 503 16.575 -3.307 -0.806 1.00 0.00 C ATOM 869 C LEU A 503 16.865 -1.966 -0.108 1.00 0.00 C ATOM 870 O LEU A 503 15.952 -1.169 0.139 1.00 0.00 O ATOM 871 CB LEU A 503 15.924 -3.111 -2.215 1.00 0.00 C ATOM 872 CG LEU A 503 16.896 -2.857 -3.416 1.00 0.00 C ATOM 873 CD1 LEU A 503 17.655 -1.537 -3.307 1.00 0.00 C ATOM 874 CD2 LEU A 503 17.878 -4.015 -3.564 1.00 0.00 C ATOM 0 H LEU A 503 14.698 -3.970 -0.158 1.00 0.00 H new ATOM 0 HA LEU A 503 17.511 -3.839 -0.976 1.00 0.00 H new ATOM 0 HB2 LEU A 503 15.331 -3.997 -2.441 1.00 0.00 H new ATOM 0 HB3 LEU A 503 15.232 -2.271 -2.155 1.00 0.00 H new ATOM 0 HG LEU A 503 16.271 -2.789 -4.307 1.00 0.00 H new ATOM 0 HD11 LEU A 503 18.311 -1.422 -4.170 1.00 0.00 H new ATOM 0 HD12 LEU A 503 16.945 -0.710 -3.278 1.00 0.00 H new ATOM 0 HD13 LEU A 503 18.252 -1.535 -2.395 1.00 0.00 H new ATOM 0 HD21 LEU A 503 18.546 -3.821 -4.404 1.00 0.00 H new ATOM 0 HD22 LEU A 503 18.464 -4.114 -2.650 1.00 0.00 H new ATOM 0 HD23 LEU A 503 17.327 -4.938 -3.744 1.00 0.00 H new ATOM 886 N ARG A 504 18.143 -1.747 0.216 1.00 0.00 N ATOM 887 CA ARG A 504 18.596 -0.561 0.957 1.00 0.00 C ATOM 888 C ARG A 504 18.622 0.680 0.024 1.00 0.00 C ATOM 889 O ARG A 504 18.863 0.547 -1.183 1.00 0.00 O ATOM 890 CB ARG A 504 20.008 -0.832 1.559 1.00 0.00 C ATOM 891 CG ARG A 504 20.363 0.022 2.793 1.00 0.00 C ATOM 892 CD ARG A 504 19.530 -0.365 4.023 1.00 0.00 C ATOM 893 NE ARG A 504 19.843 0.465 5.204 1.00 0.00 N ATOM 894 CZ ARG A 504 19.811 0.031 6.476 1.00 0.00 C ATOM 895 NH1 ARG A 504 19.473 -1.226 6.762 1.00 0.00 N ATOM 896 NH2 ARG A 504 20.107 0.861 7.463 1.00 0.00 N ATOM 0 H ARG A 504 18.897 -2.389 -0.028 1.00 0.00 H new ATOM 0 HA ARG A 504 17.900 -0.356 1.771 1.00 0.00 H new ATOM 0 HB2 ARG A 504 20.074 -1.885 1.833 1.00 0.00 H new ATOM 0 HB3 ARG A 504 20.756 -0.656 0.786 1.00 0.00 H new ATOM 0 HG2 ARG A 504 21.422 -0.095 3.022 1.00 0.00 H new ATOM 0 HG3 ARG A 504 20.201 1.075 2.563 1.00 0.00 H new ATOM 0 HD2 ARG A 504 18.471 -0.268 3.785 1.00 0.00 H new ATOM 0 HD3 ARG A 504 19.708 -1.413 4.263 1.00 0.00 H new ATOM 0 HE ARG A 504 20.102 1.438 5.043 1.00 0.00 H new ATOM 0 HH11 ARG A 504 19.234 -1.873 6.011 1.00 0.00 H new ATOM 0 HH12 ARG A 504 19.453 -1.541 7.732 1.00 0.00 H new ATOM 0 HH21 ARG A 504 20.359 1.828 7.258 1.00 0.00 H new ATOM 0 HH22 ARG A 504 20.083 0.534 8.429 1.00 0.00 H new ATOM 910 N ALA A 505 18.375 1.873 0.591 1.00 0.00 N ATOM 911 CA ALA A 505 18.398 3.148 -0.155 1.00 0.00 C ATOM 912 C ALA A 505 19.823 3.461 -0.655 1.00 0.00 C ATOM 913 O ALA A 505 20.748 3.606 0.150 1.00 0.00 O ATOM 914 CB ALA A 505 17.861 4.277 0.735 1.00 0.00 C ATOM 0 H ALA A 505 18.153 1.983 1.580 1.00 0.00 H new ATOM 0 HA ALA A 505 17.755 3.061 -1.031 1.00 0.00 H new ATOM 0 HB1 ALA A 505 17.879 5.216 0.182 1.00 0.00 H new ATOM 0 HB2 ALA A 505 16.837 4.050 1.032 1.00 0.00 H new ATOM 0 HB3 ALA A 505 18.485 4.367 1.624 1.00 0.00 H new ATOM 920 N GLY A 506 19.985 3.541 -1.988 1.00 0.00 N ATOM 921 CA GLY A 506 21.294 3.754 -2.621 1.00 0.00 C ATOM 922 C GLY A 506 21.866 2.478 -3.223 1.00 0.00 C ATOM 923 O GLY A 506 22.700 2.530 -4.136 1.00 0.00 O ATOM 0 H GLY A 506 19.215 3.460 -2.652 1.00 0.00 H new ATOM 0 HA2 GLY A 506 21.198 4.509 -3.402 1.00 0.00 H new ATOM 0 HA3 GLY A 506 21.992 4.147 -1.882 1.00 0.00 H new ATOM 927 N GLN A 507 21.406 1.326 -2.704 1.00 0.00 N ATOM 928 CA GLN A 507 21.825 -0.002 -3.172 1.00 0.00 C ATOM 929 C GLN A 507 20.946 -0.489 -4.335 1.00 0.00 C ATOM 930 O GLN A 507 20.025 0.213 -4.790 1.00 0.00 O ATOM 931 CB GLN A 507 21.803 -1.007 -1.985 1.00 0.00 C ATOM 932 CG GLN A 507 22.825 -0.701 -0.869 1.00 0.00 C ATOM 933 CD GLN A 507 24.277 -0.793 -1.341 1.00 0.00 C ATOM 934 OE1 GLN A 507 24.895 -1.858 -1.279 1.00 0.00 O ATOM 935 NE2 GLN A 507 24.820 0.310 -1.829 1.00 0.00 N ATOM 0 H GLN A 507 20.728 1.293 -1.943 1.00 0.00 H new ATOM 0 HA GLN A 507 22.844 0.067 -3.552 1.00 0.00 H new ATOM 0 HB2 GLN A 507 20.803 -1.017 -1.552 1.00 0.00 H new ATOM 0 HB3 GLN A 507 21.993 -2.009 -2.370 1.00 0.00 H new ATOM 0 HG2 GLN A 507 22.639 0.300 -0.479 1.00 0.00 H new ATOM 0 HG3 GLN A 507 22.673 -1.398 -0.045 1.00 0.00 H new ATOM 0 HE21 GLN A 507 24.277 1.173 -1.864 1.00 0.00 H new ATOM 0 HE22 GLN A 507 25.781 0.298 -2.170 1.00 0.00 H new ATOM 944 N MET A 508 21.252 -1.710 -4.801 1.00 0.00 N ATOM 945 CA MET A 508 20.641 -2.316 -5.988 1.00 0.00 C ATOM 946 C MET A 508 20.763 -3.852 -5.943 1.00 0.00 C ATOM 947 O MET A 508 21.747 -4.390 -5.420 1.00 0.00 O ATOM 948 CB MET A 508 21.311 -1.739 -7.266 1.00 0.00 C ATOM 949 CG MET A 508 22.834 -1.762 -7.260 1.00 0.00 C ATOM 950 SD MET A 508 23.540 -1.178 -8.817 1.00 0.00 S ATOM 951 CE MET A 508 25.292 -1.182 -8.446 1.00 0.00 C ATOM 0 H MET A 508 21.943 -2.312 -4.354 1.00 0.00 H new ATOM 0 HA MET A 508 19.579 -2.073 -6.007 1.00 0.00 H new ATOM 0 HB2 MET A 508 20.957 -2.302 -8.129 1.00 0.00 H new ATOM 0 HB3 MET A 508 20.979 -0.710 -7.399 1.00 0.00 H new ATOM 0 HG2 MET A 508 23.200 -1.141 -6.443 1.00 0.00 H new ATOM 0 HG3 MET A 508 23.178 -2.778 -7.067 1.00 0.00 H new ATOM 0 HE1 MET A 508 25.850 -0.843 -9.319 1.00 0.00 H new ATOM 0 HE2 MET A 508 25.488 -0.513 -7.608 1.00 0.00 H new ATOM 0 HE3 MET A 508 25.606 -2.192 -8.185 1.00 0.00 H new ATOM 961 N VAL A 509 19.742 -4.543 -6.487 1.00 0.00 N ATOM 962 CA VAL A 509 19.689 -6.015 -6.552 1.00 0.00 C ATOM 963 C VAL A 509 19.864 -6.466 -8.008 1.00 0.00 C ATOM 964 O VAL A 509 19.183 -5.970 -8.910 1.00 0.00 O ATOM 965 CB VAL A 509 18.345 -6.585 -5.950 1.00 0.00 C ATOM 966 CG1 VAL A 509 17.083 -5.992 -6.633 1.00 0.00 C ATOM 967 CG2 VAL A 509 18.330 -8.130 -5.969 1.00 0.00 C ATOM 0 H VAL A 509 18.925 -4.091 -6.897 1.00 0.00 H new ATOM 0 HA VAL A 509 20.502 -6.413 -5.945 1.00 0.00 H new ATOM 0 HB VAL A 509 18.309 -6.264 -4.909 1.00 0.00 H new ATOM 0 HG11 VAL A 509 16.189 -6.419 -6.179 1.00 0.00 H new ATOM 0 HG12 VAL A 509 17.074 -4.910 -6.503 1.00 0.00 H new ATOM 0 HG13 VAL A 509 17.099 -6.230 -7.697 1.00 0.00 H new ATOM 0 HG21 VAL A 509 17.391 -8.490 -5.548 1.00 0.00 H new ATOM 0 HG22 VAL A 509 18.426 -8.482 -6.996 1.00 0.00 H new ATOM 0 HG23 VAL A 509 19.163 -8.509 -5.376 1.00 0.00 H new ATOM 977 N THR A 510 20.807 -7.378 -8.231 1.00 0.00 N ATOM 978 CA THR A 510 21.105 -7.920 -9.554 1.00 0.00 C ATOM 979 C THR A 510 20.680 -9.394 -9.589 1.00 0.00 C ATOM 980 O THR A 510 21.328 -10.234 -8.958 1.00 0.00 O ATOM 981 CB THR A 510 22.634 -7.789 -9.878 1.00 0.00 C ATOM 982 OG1 THR A 510 23.131 -6.529 -9.391 1.00 0.00 O ATOM 983 CG2 THR A 510 22.897 -7.892 -11.390 1.00 0.00 C ATOM 0 H THR A 510 21.392 -7.765 -7.491 1.00 0.00 H new ATOM 0 HA THR A 510 20.555 -7.356 -10.308 1.00 0.00 H new ATOM 0 HB THR A 510 23.153 -8.609 -9.382 1.00 0.00 H new ATOM 0 HG1 THR A 510 24.087 -6.453 -9.595 1.00 0.00 H new ATOM 0 HG21 THR A 510 23.966 -7.797 -11.581 1.00 0.00 H new ATOM 0 HG22 THR A 510 22.547 -8.858 -11.755 1.00 0.00 H new ATOM 0 HG23 THR A 510 22.364 -7.094 -11.907 1.00 0.00 H new ATOM 991 N VAL A 511 19.564 -9.687 -10.278 1.00 0.00 N ATOM 992 CA VAL A 511 19.052 -11.057 -10.421 1.00 0.00 C ATOM 993 C VAL A 511 19.596 -11.675 -11.713 1.00 0.00 C ATOM 994 O VAL A 511 19.266 -11.225 -12.808 1.00 0.00 O ATOM 995 CB VAL A 511 17.487 -11.110 -10.408 1.00 0.00 C ATOM 996 CG1 VAL A 511 16.966 -12.576 -10.486 1.00 0.00 C ATOM 997 CG2 VAL A 511 16.930 -10.369 -9.167 1.00 0.00 C ATOM 0 H VAL A 511 18.995 -8.983 -10.749 1.00 0.00 H new ATOM 0 HA VAL A 511 19.396 -11.633 -9.562 1.00 0.00 H new ATOM 0 HB VAL A 511 17.121 -10.597 -11.297 1.00 0.00 H new ATOM 0 HG11 VAL A 511 15.876 -12.576 -10.475 1.00 0.00 H new ATOM 0 HG12 VAL A 511 17.319 -13.039 -11.407 1.00 0.00 H new ATOM 0 HG13 VAL A 511 17.338 -13.140 -9.631 1.00 0.00 H new ATOM 0 HG21 VAL A 511 15.841 -10.416 -9.174 1.00 0.00 H new ATOM 0 HG22 VAL A 511 17.308 -10.842 -8.261 1.00 0.00 H new ATOM 0 HG23 VAL A 511 17.249 -9.327 -9.192 1.00 0.00 H new ATOM 1007 N TRP A 512 20.458 -12.682 -11.557 1.00 0.00 N ATOM 1008 CA TRP A 512 21.073 -13.417 -12.669 1.00 0.00 C ATOM 1009 C TRP A 512 20.338 -14.737 -12.947 1.00 0.00 C ATOM 1010 O TRP A 512 19.437 -15.152 -12.201 1.00 0.00 O ATOM 1011 CB TRP A 512 22.552 -13.728 -12.347 1.00 0.00 C ATOM 1012 CG TRP A 512 23.493 -12.545 -12.359 1.00 0.00 C ATOM 1013 CD1 TRP A 512 23.564 -11.529 -11.453 1.00 0.00 C ATOM 1014 CD2 TRP A 512 24.529 -12.290 -13.322 1.00 0.00 C ATOM 1015 NE1 TRP A 512 24.578 -10.669 -11.788 1.00 0.00 N ATOM 1016 CE2 TRP A 512 25.177 -11.108 -12.936 1.00 0.00 C ATOM 1017 CE3 TRP A 512 24.959 -12.949 -14.475 1.00 0.00 C ATOM 1018 CZ2 TRP A 512 26.241 -10.574 -13.656 1.00 0.00 C ATOM 1019 CZ3 TRP A 512 26.010 -12.419 -15.195 1.00 0.00 C ATOM 1020 CH2 TRP A 512 26.645 -11.241 -14.781 1.00 0.00 C ATOM 0 H TRP A 512 20.754 -13.017 -10.640 1.00 0.00 H new ATOM 0 HA TRP A 512 21.006 -12.785 -13.555 1.00 0.00 H new ATOM 0 HB2 TRP A 512 22.599 -14.195 -11.363 1.00 0.00 H new ATOM 0 HB3 TRP A 512 22.914 -14.463 -13.066 1.00 0.00 H new ATOM 0 HD1 TRP A 512 22.916 -11.418 -10.596 1.00 0.00 H new ATOM 0 HE1 TRP A 512 24.843 -9.835 -11.264 1.00 0.00 H new ATOM 0 HE3 TRP A 512 24.477 -13.860 -14.798 1.00 0.00 H new ATOM 0 HZ2 TRP A 512 26.731 -9.665 -13.339 1.00 0.00 H new ATOM 0 HZ3 TRP A 512 26.348 -12.919 -16.090 1.00 0.00 H new ATOM 0 HH2 TRP A 512 27.469 -10.852 -15.360 1.00 0.00 H new ATOM 1031 N ALA A 513 20.769 -15.385 -14.040 1.00 0.00 N ATOM 1032 CA ALA A 513 20.345 -16.734 -14.423 1.00 0.00 C ATOM 1033 C ALA A 513 21.184 -17.789 -13.688 1.00 0.00 C ATOM 1034 O ALA A 513 22.365 -17.553 -13.385 1.00 0.00 O ATOM 1035 CB ALA A 513 20.500 -16.911 -15.944 1.00 0.00 C ATOM 0 H ALA A 513 21.436 -14.974 -14.694 1.00 0.00 H new ATOM 0 HA ALA A 513 19.299 -16.866 -14.146 1.00 0.00 H new ATOM 0 HB1 ALA A 513 20.184 -17.915 -16.228 1.00 0.00 H new ATOM 0 HB2 ALA A 513 19.882 -16.177 -16.461 1.00 0.00 H new ATOM 0 HB3 ALA A 513 21.544 -16.767 -16.223 1.00 0.00 H new ATOM 1041 N ALA A 514 20.564 -18.947 -13.402 1.00 0.00 N ATOM 1042 CA ALA A 514 21.274 -20.141 -12.901 1.00 0.00 C ATOM 1043 C ALA A 514 22.297 -20.633 -13.945 1.00 0.00 C ATOM 1044 O ALA A 514 23.416 -21.045 -13.610 1.00 0.00 O ATOM 1045 CB ALA A 514 20.261 -21.248 -12.562 1.00 0.00 C ATOM 0 H ALA A 514 19.559 -19.083 -13.511 1.00 0.00 H new ATOM 0 HA ALA A 514 21.817 -19.879 -11.993 1.00 0.00 H new ATOM 0 HB1 ALA A 514 20.791 -22.126 -12.193 1.00 0.00 H new ATOM 0 HB2 ALA A 514 19.574 -20.890 -11.795 1.00 0.00 H new ATOM 0 HB3 ALA A 514 19.699 -21.513 -13.457 1.00 0.00 H new ATOM 1051 N GLY A 515 21.899 -20.536 -15.228 1.00 0.00 N ATOM 1052 CA GLY A 515 22.742 -20.954 -16.350 1.00 0.00 C ATOM 1053 C GLY A 515 23.665 -19.856 -16.872 1.00 0.00 C ATOM 1054 O GLY A 515 24.219 -19.989 -17.965 1.00 0.00 O ATOM 0 H GLY A 515 20.990 -20.168 -15.508 1.00 0.00 H new ATOM 0 HA2 GLY A 515 23.346 -21.806 -16.040 1.00 0.00 H new ATOM 0 HA3 GLY A 515 22.103 -21.296 -17.164 1.00 0.00 H new ATOM 1058 N ALA A 516 23.828 -18.764 -16.094 1.00 0.00 N ATOM 1059 CA ALA A 516 24.749 -17.649 -16.431 1.00 0.00 C ATOM 1060 C ALA A 516 26.195 -17.947 -15.963 1.00 0.00 C ATOM 1061 O ALA A 516 27.131 -17.229 -16.342 1.00 0.00 O ATOM 1062 CB ALA A 516 24.245 -16.326 -15.818 1.00 0.00 C ATOM 0 H ALA A 516 23.327 -18.628 -15.216 1.00 0.00 H new ATOM 0 HA ALA A 516 24.765 -17.549 -17.516 1.00 0.00 H new ATOM 0 HB1 ALA A 516 24.933 -15.520 -16.076 1.00 0.00 H new ATOM 0 HB2 ALA A 516 23.254 -16.097 -16.211 1.00 0.00 H new ATOM 0 HB3 ALA A 516 24.191 -16.425 -14.734 1.00 0.00 H new ATOM 1068 N GLY A 517 26.358 -19.007 -15.138 1.00 0.00 N ATOM 1069 CA GLY A 517 27.677 -19.444 -14.641 1.00 0.00 C ATOM 1070 C GLY A 517 28.307 -18.493 -13.620 1.00 0.00 C ATOM 1071 O GLY A 517 29.532 -18.494 -13.426 1.00 0.00 O ATOM 0 H GLY A 517 25.583 -19.578 -14.802 1.00 0.00 H new ATOM 0 HA2 GLY A 517 27.574 -20.430 -14.188 1.00 0.00 H new ATOM 0 HA3 GLY A 517 28.355 -19.552 -15.488 1.00 0.00 H new ATOM 1075 N VAL A 518 27.453 -17.702 -12.957 1.00 0.00 N ATOM 1076 CA VAL A 518 27.858 -16.690 -11.963 1.00 0.00 C ATOM 1077 C VAL A 518 27.697 -17.258 -10.536 1.00 0.00 C ATOM 1078 O VAL A 518 26.840 -18.120 -10.299 1.00 0.00 O ATOM 1079 CB VAL A 518 26.994 -15.385 -12.141 1.00 0.00 C ATOM 1080 CG1 VAL A 518 25.494 -15.676 -11.906 1.00 0.00 C ATOM 1081 CG2 VAL A 518 27.493 -14.219 -11.243 1.00 0.00 C ATOM 0 H VAL A 518 26.443 -17.745 -13.096 1.00 0.00 H new ATOM 0 HA VAL A 518 28.906 -16.435 -12.118 1.00 0.00 H new ATOM 0 HB VAL A 518 27.117 -15.059 -13.174 1.00 0.00 H new ATOM 0 HG11 VAL A 518 24.921 -14.758 -12.035 1.00 0.00 H new ATOM 0 HG12 VAL A 518 25.151 -16.422 -12.623 1.00 0.00 H new ATOM 0 HG13 VAL A 518 25.351 -16.054 -10.894 1.00 0.00 H new ATOM 0 HG21 VAL A 518 26.865 -13.343 -11.402 1.00 0.00 H new ATOM 0 HG22 VAL A 518 27.440 -14.518 -10.196 1.00 0.00 H new ATOM 0 HG23 VAL A 518 28.524 -13.978 -11.500 1.00 0.00 H new ATOM 1091 N ALA A 519 28.544 -16.790 -9.604 1.00 0.00 N ATOM 1092 CA ALA A 519 28.478 -17.183 -8.192 1.00 0.00 C ATOM 1093 C ALA A 519 27.376 -16.387 -7.463 1.00 0.00 C ATOM 1094 O ALA A 519 27.386 -15.147 -7.475 1.00 0.00 O ATOM 1095 CB ALA A 519 29.848 -16.975 -7.523 1.00 0.00 C ATOM 0 H ALA A 519 29.293 -16.129 -9.811 1.00 0.00 H new ATOM 0 HA ALA A 519 28.224 -18.241 -8.129 1.00 0.00 H new ATOM 0 HB1 ALA A 519 29.790 -17.269 -6.475 1.00 0.00 H new ATOM 0 HB2 ALA A 519 30.597 -17.584 -8.030 1.00 0.00 H new ATOM 0 HB3 ALA A 519 30.130 -15.924 -7.590 1.00 0.00 H new ATOM 1101 N HIS A 520 26.409 -17.107 -6.866 1.00 0.00 N ATOM 1102 CA HIS A 520 25.335 -16.499 -6.060 1.00 0.00 C ATOM 1103 C HIS A 520 25.936 -15.843 -4.799 1.00 0.00 C ATOM 1104 O HIS A 520 26.421 -16.537 -3.895 1.00 0.00 O ATOM 1105 CB HIS A 520 24.291 -17.590 -5.695 1.00 0.00 C ATOM 1106 CG HIS A 520 23.119 -17.116 -4.865 1.00 0.00 C ATOM 1107 ND1 HIS A 520 22.545 -17.863 -3.858 1.00 0.00 N ATOM 1108 CD2 HIS A 520 22.393 -15.967 -4.928 1.00 0.00 C ATOM 1109 CE1 HIS A 520 21.517 -17.168 -3.361 1.00 0.00 C ATOM 1110 NE2 HIS A 520 21.382 -16.009 -3.975 1.00 0.00 N ATOM 0 H HIS A 520 26.350 -18.123 -6.928 1.00 0.00 H new ATOM 0 HA HIS A 520 24.831 -15.719 -6.631 1.00 0.00 H new ATOM 0 HB2 HIS A 520 23.908 -18.025 -6.618 1.00 0.00 H new ATOM 0 HB3 HIS A 520 24.799 -18.388 -5.153 1.00 0.00 H new ATOM 0 HD2 HIS A 520 22.574 -15.150 -5.611 1.00 0.00 H new ATOM 0 HE1 HIS A 520 20.879 -17.511 -2.560 1.00 0.00 H new ATOM 0 HE2 HIS A 520 20.681 -15.292 -3.789 1.00 0.00 H new ATOM 1118 N SER A 521 25.914 -14.498 -4.760 1.00 0.00 N ATOM 1119 CA SER A 521 26.580 -13.706 -3.709 1.00 0.00 C ATOM 1120 C SER A 521 25.626 -12.608 -3.164 1.00 0.00 C ATOM 1121 O SER A 521 25.719 -11.446 -3.577 1.00 0.00 O ATOM 1122 CB SER A 521 27.884 -13.082 -4.281 1.00 0.00 C ATOM 1123 OG SER A 521 28.720 -14.066 -4.883 1.00 0.00 O ATOM 0 H SER A 521 25.433 -13.929 -5.457 1.00 0.00 H new ATOM 0 HA SER A 521 26.839 -14.359 -2.875 1.00 0.00 H new ATOM 0 HB2 SER A 521 27.630 -12.320 -5.018 1.00 0.00 H new ATOM 0 HB3 SER A 521 28.429 -12.582 -3.481 1.00 0.00 H new ATOM 0 HG SER A 521 28.301 -14.392 -5.707 1.00 0.00 H new ATOM 1129 N PRO A 522 24.645 -12.968 -2.273 1.00 0.00 N ATOM 1130 CA PRO A 522 23.754 -11.973 -1.608 1.00 0.00 C ATOM 1131 C PRO A 522 24.540 -10.941 -0.740 1.00 0.00 C ATOM 1132 O PRO A 522 25.641 -11.250 -0.273 1.00 0.00 O ATOM 1133 CB PRO A 522 22.811 -12.854 -0.739 1.00 0.00 C ATOM 1134 CG PRO A 522 22.869 -14.211 -1.369 1.00 0.00 C ATOM 1135 CD PRO A 522 24.284 -14.359 -1.877 1.00 0.00 C ATOM 0 HA PRO A 522 23.220 -11.355 -2.330 1.00 0.00 H new ATOM 0 HB2 PRO A 522 23.143 -12.885 0.299 1.00 0.00 H new ATOM 0 HB3 PRO A 522 21.794 -12.462 -0.737 1.00 0.00 H new ATOM 0 HG2 PRO A 522 22.628 -14.990 -0.646 1.00 0.00 H new ATOM 0 HG3 PRO A 522 22.149 -14.297 -2.183 1.00 0.00 H new ATOM 0 HD2 PRO A 522 24.951 -14.745 -1.106 1.00 0.00 H new ATOM 0 HD3 PRO A 522 24.340 -15.046 -2.721 1.00 0.00 H new ATOM 1143 N PRO A 523 23.997 -9.701 -0.491 1.00 0.00 N ATOM 1144 CA PRO A 523 22.650 -9.260 -0.919 1.00 0.00 C ATOM 1145 C PRO A 523 22.641 -8.547 -2.294 1.00 0.00 C ATOM 1146 O PRO A 523 21.605 -8.061 -2.729 1.00 0.00 O ATOM 1147 CB PRO A 523 22.274 -8.293 0.222 1.00 0.00 C ATOM 1148 CG PRO A 523 23.569 -7.600 0.554 1.00 0.00 C ATOM 1149 CD PRO A 523 24.681 -8.612 0.268 1.00 0.00 C ATOM 0 HA PRO A 523 21.957 -10.088 -1.067 1.00 0.00 H new ATOM 0 HB2 PRO A 523 21.510 -7.582 -0.093 1.00 0.00 H new ATOM 0 HB3 PRO A 523 21.875 -8.828 1.084 1.00 0.00 H new ATOM 0 HG2 PRO A 523 23.696 -6.702 -0.050 1.00 0.00 H new ATOM 0 HG3 PRO A 523 23.587 -7.287 1.598 1.00 0.00 H new ATOM 0 HD2 PRO A 523 25.486 -8.165 -0.315 1.00 0.00 H new ATOM 0 HD3 PRO A 523 25.125 -8.987 1.190 1.00 0.00 H new ATOM 1157 N SER A 524 23.803 -8.490 -2.962 1.00 0.00 N ATOM 1158 CA SER A 524 23.945 -7.805 -4.256 1.00 0.00 C ATOM 1159 C SER A 524 23.542 -8.742 -5.409 1.00 0.00 C ATOM 1160 O SER A 524 22.617 -8.445 -6.167 1.00 0.00 O ATOM 1161 CB SER A 524 25.399 -7.314 -4.420 1.00 0.00 C ATOM 1162 OG SER A 524 25.784 -6.486 -3.328 1.00 0.00 O ATOM 0 H SER A 524 24.666 -8.915 -2.623 1.00 0.00 H new ATOM 0 HA SER A 524 23.279 -6.942 -4.284 1.00 0.00 H new ATOM 0 HB2 SER A 524 26.070 -8.170 -4.486 1.00 0.00 H new ATOM 0 HB3 SER A 524 25.496 -6.760 -5.353 1.00 0.00 H new ATOM 0 HG SER A 524 26.709 -6.189 -3.453 1.00 0.00 H new ATOM 1168 N THR A 525 24.225 -9.893 -5.503 1.00 0.00 N ATOM 1169 CA THR A 525 24.044 -10.844 -6.607 1.00 0.00 C ATOM 1170 C THR A 525 23.086 -11.964 -6.179 1.00 0.00 C ATOM 1171 O THR A 525 23.500 -12.968 -5.589 1.00 0.00 O ATOM 1172 CB THR A 525 25.427 -11.426 -7.075 1.00 0.00 C ATOM 1173 OG1 THR A 525 26.326 -10.351 -7.394 1.00 0.00 O ATOM 1174 CG2 THR A 525 25.305 -12.351 -8.299 1.00 0.00 C ATOM 0 H THR A 525 24.918 -10.189 -4.815 1.00 0.00 H new ATOM 0 HA THR A 525 23.605 -10.320 -7.456 1.00 0.00 H new ATOM 0 HB THR A 525 25.811 -12.021 -6.247 1.00 0.00 H new ATOM 0 HG1 THR A 525 27.187 -10.719 -7.683 1.00 0.00 H new ATOM 0 HG21 THR A 525 26.292 -12.722 -8.575 1.00 0.00 H new ATOM 0 HG22 THR A 525 24.656 -13.193 -8.056 1.00 0.00 H new ATOM 0 HG23 THR A 525 24.880 -11.795 -9.134 1.00 0.00 H new ATOM 1182 N LEU A 526 21.785 -11.736 -6.413 1.00 0.00 N ATOM 1183 CA LEU A 526 20.757 -12.776 -6.267 1.00 0.00 C ATOM 1184 C LEU A 526 20.682 -13.550 -7.588 1.00 0.00 C ATOM 1185 O LEU A 526 20.802 -12.969 -8.659 1.00 0.00 O ATOM 1186 CB LEU A 526 19.366 -12.175 -5.875 1.00 0.00 C ATOM 1187 CG LEU A 526 19.161 -11.840 -4.354 1.00 0.00 C ATOM 1188 CD1 LEU A 526 20.168 -10.792 -3.838 1.00 0.00 C ATOM 1189 CD2 LEU A 526 17.699 -11.415 -4.063 1.00 0.00 C ATOM 0 H LEU A 526 21.418 -10.831 -6.707 1.00 0.00 H new ATOM 0 HA LEU A 526 21.030 -13.448 -5.453 1.00 0.00 H new ATOM 0 HB2 LEU A 526 19.212 -11.262 -6.451 1.00 0.00 H new ATOM 0 HB3 LEU A 526 18.591 -12.878 -6.179 1.00 0.00 H new ATOM 0 HG LEU A 526 19.359 -12.758 -3.801 1.00 0.00 H new ATOM 0 HD11 LEU A 526 19.982 -10.598 -2.782 1.00 0.00 H new ATOM 0 HD12 LEU A 526 21.183 -11.170 -3.964 1.00 0.00 H new ATOM 0 HD13 LEU A 526 20.052 -9.867 -4.403 1.00 0.00 H new ATOM 0 HD21 LEU A 526 17.590 -11.190 -3.002 1.00 0.00 H new ATOM 0 HD22 LEU A 526 17.454 -10.529 -4.649 1.00 0.00 H new ATOM 0 HD23 LEU A 526 17.024 -12.227 -4.333 1.00 0.00 H new ATOM 1201 N VAL A 527 20.556 -14.870 -7.506 1.00 0.00 N ATOM 1202 CA VAL A 527 20.447 -15.743 -8.682 1.00 0.00 C ATOM 1203 C VAL A 527 19.179 -16.582 -8.525 1.00 0.00 C ATOM 1204 O VAL A 527 18.958 -17.174 -7.457 1.00 0.00 O ATOM 1205 CB VAL A 527 21.717 -16.673 -8.832 1.00 0.00 C ATOM 1206 CG1 VAL A 527 21.564 -17.686 -9.997 1.00 0.00 C ATOM 1207 CG2 VAL A 527 23.009 -15.830 -9.000 1.00 0.00 C ATOM 0 H VAL A 527 20.526 -15.373 -6.619 1.00 0.00 H new ATOM 0 HA VAL A 527 20.394 -15.136 -9.586 1.00 0.00 H new ATOM 0 HB VAL A 527 21.800 -17.250 -7.911 1.00 0.00 H new ATOM 0 HG11 VAL A 527 22.460 -18.303 -10.062 1.00 0.00 H new ATOM 0 HG12 VAL A 527 20.698 -18.322 -9.815 1.00 0.00 H new ATOM 0 HG13 VAL A 527 21.427 -17.145 -10.934 1.00 0.00 H new ATOM 0 HG21 VAL A 527 23.867 -16.495 -9.101 1.00 0.00 H new ATOM 0 HG22 VAL A 527 22.925 -15.209 -9.892 1.00 0.00 H new ATOM 0 HG23 VAL A 527 23.144 -15.193 -8.126 1.00 0.00 H new ATOM 1217 N TRP A 528 18.316 -16.593 -9.561 1.00 0.00 N ATOM 1218 CA TRP A 528 17.168 -17.507 -9.606 1.00 0.00 C ATOM 1219 C TRP A 528 17.721 -18.912 -9.887 1.00 0.00 C ATOM 1220 O TRP A 528 17.907 -19.314 -11.044 1.00 0.00 O ATOM 1221 CB TRP A 528 16.106 -17.065 -10.660 1.00 0.00 C ATOM 1222 CG TRP A 528 14.774 -17.841 -10.640 1.00 0.00 C ATOM 1223 CD1 TRP A 528 14.473 -19.014 -9.980 1.00 0.00 C ATOM 1224 CD2 TRP A 528 13.573 -17.486 -11.349 1.00 0.00 C ATOM 1225 NE1 TRP A 528 13.194 -19.407 -10.268 1.00 0.00 N ATOM 1226 CE2 TRP A 528 12.621 -18.490 -11.104 1.00 0.00 C ATOM 1227 CE3 TRP A 528 13.224 -16.431 -12.186 1.00 0.00 C ATOM 1228 CZ2 TRP A 528 11.340 -18.454 -11.656 1.00 0.00 C ATOM 1229 CZ3 TRP A 528 11.957 -16.393 -12.732 1.00 0.00 C ATOM 1230 CH2 TRP A 528 11.031 -17.404 -12.474 1.00 0.00 C ATOM 0 H TRP A 528 18.396 -15.980 -10.372 1.00 0.00 H new ATOM 0 HA TRP A 528 16.637 -17.497 -8.654 1.00 0.00 H new ATOM 0 HB2 TRP A 528 15.890 -16.007 -10.508 1.00 0.00 H new ATOM 0 HB3 TRP A 528 16.546 -17.162 -11.653 1.00 0.00 H new ATOM 0 HD1 TRP A 528 15.150 -19.547 -9.329 1.00 0.00 H new ATOM 0 HE1 TRP A 528 12.741 -20.250 -9.915 1.00 0.00 H new ATOM 0 HE3 TRP A 528 13.937 -15.650 -12.406 1.00 0.00 H new ATOM 0 HZ2 TRP A 528 10.618 -19.229 -11.444 1.00 0.00 H new ATOM 0 HZ3 TRP A 528 11.678 -15.567 -13.369 1.00 0.00 H new ATOM 0 HH2 TRP A 528 10.053 -17.356 -12.929 1.00 0.00 H new ATOM 1241 N LYS A 529 18.051 -19.609 -8.791 1.00 0.00 N ATOM 1242 CA LYS A 529 18.508 -20.996 -8.817 1.00 0.00 C ATOM 1243 C LYS A 529 17.368 -21.881 -9.349 1.00 0.00 C ATOM 1244 O LYS A 529 16.324 -22.010 -8.699 1.00 0.00 O ATOM 1245 CB LYS A 529 18.934 -21.422 -7.383 1.00 0.00 C ATOM 1246 CG LYS A 529 19.564 -22.825 -7.265 1.00 0.00 C ATOM 1247 CD LYS A 529 20.884 -22.954 -8.054 1.00 0.00 C ATOM 1248 CE LYS A 529 21.542 -24.334 -7.883 1.00 0.00 C ATOM 1249 NZ LYS A 529 20.666 -25.448 -8.347 1.00 0.00 N ATOM 0 H LYS A 529 18.006 -19.215 -7.851 1.00 0.00 H new ATOM 0 HA LYS A 529 19.371 -21.107 -9.474 1.00 0.00 H new ATOM 0 HB2 LYS A 529 19.646 -20.690 -7.002 1.00 0.00 H new ATOM 0 HB3 LYS A 529 18.058 -21.381 -6.736 1.00 0.00 H new ATOM 0 HG2 LYS A 529 19.750 -23.048 -6.214 1.00 0.00 H new ATOM 0 HG3 LYS A 529 18.855 -23.569 -7.628 1.00 0.00 H new ATOM 0 HD2 LYS A 529 20.690 -22.777 -9.112 1.00 0.00 H new ATOM 0 HD3 LYS A 529 21.578 -22.181 -7.723 1.00 0.00 H new ATOM 0 HE2 LYS A 529 22.479 -24.357 -8.440 1.00 0.00 H new ATOM 0 HE3 LYS A 529 21.791 -24.486 -6.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 529 21.192 -26.344 -8.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 529 19.828 -25.510 -7.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 529 20.365 -25.268 -9.326 1.00 0.00 H new ATOM 1263 N GLY A 530 17.568 -22.449 -10.544 1.00 0.00 N ATOM 1264 CA GLY A 530 16.537 -23.205 -11.246 1.00 0.00 C ATOM 1265 C GLY A 530 16.248 -22.643 -12.637 1.00 0.00 C ATOM 1266 O GLY A 530 16.041 -23.412 -13.585 1.00 0.00 O ATOM 0 H GLY A 530 18.453 -22.394 -11.048 1.00 0.00 H new ATOM 0 HA2 GLY A 530 16.850 -24.245 -11.335 1.00 0.00 H new ATOM 0 HA3 GLY A 530 15.620 -23.198 -10.657 1.00 0.00 H new ATOM 1270 N GLN A 531 16.257 -21.299 -12.770 1.00 0.00 N ATOM 1271 CA GLN A 531 15.963 -20.622 -14.054 1.00 0.00 C ATOM 1272 C GLN A 531 17.253 -20.508 -14.886 1.00 0.00 C ATOM 1273 O GLN A 531 18.059 -19.600 -14.674 1.00 0.00 O ATOM 1274 CB GLN A 531 15.340 -19.225 -13.814 1.00 0.00 C ATOM 1275 CG GLN A 531 14.425 -18.709 -14.943 1.00 0.00 C ATOM 1276 CD GLN A 531 13.145 -19.538 -15.127 1.00 0.00 C ATOM 1277 OE1 GLN A 531 12.628 -20.130 -14.182 1.00 0.00 O ATOM 1278 NE2 GLN A 531 12.615 -19.572 -16.339 1.00 0.00 N ATOM 0 H GLN A 531 16.465 -20.660 -12.003 1.00 0.00 H new ATOM 0 HA GLN A 531 15.236 -21.217 -14.606 1.00 0.00 H new ATOM 0 HB2 GLN A 531 14.765 -19.256 -12.888 1.00 0.00 H new ATOM 0 HB3 GLN A 531 16.146 -18.507 -13.665 1.00 0.00 H new ATOM 0 HG2 GLN A 531 14.151 -17.675 -14.733 1.00 0.00 H new ATOM 0 HG3 GLN A 531 14.984 -18.707 -15.879 1.00 0.00 H new ATOM 0 HE21 GLN A 531 13.064 -19.072 -17.106 1.00 0.00 H new ATOM 0 HE22 GLN A 531 11.757 -20.098 -16.506 1.00 0.00 H new ATOM 1287 N SER A 532 17.433 -21.460 -15.803 1.00 0.00 N ATOM 1288 CA SER A 532 18.646 -21.602 -16.618 1.00 0.00 C ATOM 1289 C SER A 532 18.872 -20.386 -17.546 1.00 0.00 C ATOM 1290 O SER A 532 19.952 -19.786 -17.541 1.00 0.00 O ATOM 1291 CB SER A 532 18.528 -22.908 -17.428 1.00 0.00 C ATOM 1292 OG SER A 532 17.263 -22.986 -18.068 1.00 0.00 O ATOM 0 H SER A 532 16.728 -22.169 -16.006 1.00 0.00 H new ATOM 0 HA SER A 532 19.516 -21.643 -15.962 1.00 0.00 H new ATOM 0 HB2 SER A 532 19.322 -22.953 -18.173 1.00 0.00 H new ATOM 0 HB3 SER A 532 18.661 -23.765 -16.768 1.00 0.00 H new ATOM 0 HG SER A 532 17.206 -23.820 -18.579 1.00 0.00 H new ATOM 1298 N SER A 533 17.843 -20.028 -18.332 1.00 0.00 N ATOM 1299 CA SER A 533 17.936 -18.947 -19.324 1.00 0.00 C ATOM 1300 C SER A 533 17.574 -17.571 -18.715 1.00 0.00 C ATOM 1301 O SER A 533 18.126 -16.561 -19.143 1.00 0.00 O ATOM 1302 CB SER A 533 17.014 -19.260 -20.525 1.00 0.00 C ATOM 1303 OG SER A 533 15.646 -19.298 -20.145 1.00 0.00 O ATOM 0 H SER A 533 16.928 -20.478 -18.297 1.00 0.00 H new ATOM 0 HA SER A 533 18.971 -18.891 -19.662 1.00 0.00 H new ATOM 0 HB2 SER A 533 17.155 -18.505 -21.298 1.00 0.00 H new ATOM 0 HB3 SER A 533 17.297 -20.218 -20.960 1.00 0.00 H new ATOM 0 HG SER A 533 15.094 -19.497 -20.930 1.00 0.00 H new ATOM 1309 N TRP A 534 16.667 -17.540 -17.696 1.00 0.00 N ATOM 1310 CA TRP A 534 16.165 -16.266 -17.082 1.00 0.00 C ATOM 1311 C TRP A 534 15.540 -15.354 -18.170 1.00 0.00 C ATOM 1312 O TRP A 534 15.598 -14.124 -18.114 1.00 0.00 O ATOM 1313 CB TRP A 534 17.323 -15.605 -16.266 1.00 0.00 C ATOM 1314 CG TRP A 534 17.105 -14.254 -15.592 1.00 0.00 C ATOM 1315 CD1 TRP A 534 18.020 -13.243 -15.549 1.00 0.00 C ATOM 1316 CD2 TRP A 534 15.951 -13.760 -14.876 1.00 0.00 C ATOM 1317 NE1 TRP A 534 17.533 -12.182 -14.846 1.00 0.00 N ATOM 1318 CE2 TRP A 534 16.271 -12.466 -14.427 1.00 0.00 C ATOM 1319 CE3 TRP A 534 14.695 -14.277 -14.564 1.00 0.00 C ATOM 1320 CZ2 TRP A 534 15.384 -11.683 -13.695 1.00 0.00 C ATOM 1321 CZ3 TRP A 534 13.813 -13.494 -13.838 1.00 0.00 C ATOM 1322 CH2 TRP A 534 14.161 -12.214 -13.410 1.00 0.00 C ATOM 0 H TRP A 534 16.266 -18.381 -17.280 1.00 0.00 H new ATOM 0 HA TRP A 534 15.358 -16.460 -16.376 1.00 0.00 H new ATOM 0 HB2 TRP A 534 17.617 -16.311 -15.490 1.00 0.00 H new ATOM 0 HB3 TRP A 534 18.174 -15.498 -16.939 1.00 0.00 H new ATOM 0 HD1 TRP A 534 18.996 -13.279 -16.009 1.00 0.00 H new ATOM 0 HE1 TRP A 534 18.035 -11.313 -14.663 1.00 0.00 H new ATOM 0 HE3 TRP A 534 14.415 -15.270 -14.883 1.00 0.00 H new ATOM 0 HZ2 TRP A 534 15.654 -10.691 -13.365 1.00 0.00 H new ATOM 0 HZ3 TRP A 534 12.835 -13.884 -13.598 1.00 0.00 H new ATOM 0 HH2 TRP A 534 13.449 -11.633 -12.843 1.00 0.00 H new ATOM 1333 N GLY A 535 14.898 -16.013 -19.152 1.00 0.00 N ATOM 1334 CA GLY A 535 14.238 -15.341 -20.260 1.00 0.00 C ATOM 1335 C GLY A 535 15.218 -14.681 -21.226 1.00 0.00 C ATOM 1336 O GLY A 535 15.080 -13.490 -21.543 1.00 0.00 O ATOM 0 H GLY A 535 14.829 -17.030 -19.189 1.00 0.00 H new ATOM 0 HA2 GLY A 535 13.630 -16.063 -20.805 1.00 0.00 H new ATOM 0 HA3 GLY A 535 13.559 -14.584 -19.866 1.00 0.00 H new ATOM 1340 N THR A 536 16.215 -15.461 -21.692 1.00 0.00 N ATOM 1341 CA THR A 536 17.117 -15.035 -22.773 1.00 0.00 C ATOM 1342 C THR A 536 16.368 -15.104 -24.114 1.00 0.00 C ATOM 1343 O THR A 536 15.845 -16.163 -24.490 1.00 0.00 O ATOM 1344 CB THR A 536 18.432 -15.894 -22.851 1.00 0.00 C ATOM 1345 OG1 THR A 536 18.118 -17.284 -22.764 1.00 0.00 O ATOM 1346 CG2 THR A 536 19.468 -15.519 -21.773 1.00 0.00 C ATOM 0 H THR A 536 16.413 -16.394 -21.331 1.00 0.00 H new ATOM 0 HA THR A 536 17.424 -14.012 -22.556 1.00 0.00 H new ATOM 0 HB THR A 536 18.889 -15.675 -23.816 1.00 0.00 H new ATOM 0 HG1 THR A 536 17.278 -17.460 -23.237 1.00 0.00 H new ATOM 0 HG21 THR A 536 20.351 -16.149 -21.882 1.00 0.00 H new ATOM 0 HG22 THR A 536 19.751 -14.473 -21.889 1.00 0.00 H new ATOM 0 HG23 THR A 536 19.035 -15.670 -20.784 1.00 0.00 H new ATOM 1354 N GLY A 537 16.322 -13.969 -24.818 1.00 0.00 N ATOM 1355 CA GLY A 537 15.597 -13.868 -26.075 1.00 0.00 C ATOM 1356 C GLY A 537 16.118 -12.755 -26.955 1.00 0.00 C ATOM 1357 O GLY A 537 17.076 -12.056 -26.592 1.00 0.00 O ATOM 0 H GLY A 537 16.783 -13.106 -24.531 1.00 0.00 H new ATOM 0 HA2 GLY A 537 15.670 -14.815 -26.610 1.00 0.00 H new ATOM 0 HA3 GLY A 537 14.540 -13.699 -25.869 1.00 0.00 H new ATOM 1361 N GLU A 538 15.492 -12.612 -28.127 1.00 0.00 N ATOM 1362 CA GLU A 538 15.799 -11.537 -29.077 1.00 0.00 C ATOM 1363 C GLU A 538 15.165 -10.229 -28.592 1.00 0.00 C ATOM 1364 O GLU A 538 15.744 -9.154 -28.714 1.00 0.00 O ATOM 1365 CB GLU A 538 15.256 -11.902 -30.482 1.00 0.00 C ATOM 1366 CG GLU A 538 15.783 -11.022 -31.631 1.00 0.00 C ATOM 1367 CD GLU A 538 17.318 -11.085 -31.775 1.00 0.00 C ATOM 1368 OE1 GLU A 538 17.846 -12.163 -32.143 1.00 0.00 O ATOM 1369 OE2 GLU A 538 18.005 -10.070 -31.509 1.00 0.00 O ATOM 0 H GLU A 538 14.755 -13.241 -28.445 1.00 0.00 H new ATOM 0 HA GLU A 538 16.880 -11.410 -29.141 1.00 0.00 H new ATOM 0 HB2 GLU A 538 15.509 -12.941 -30.694 1.00 0.00 H new ATOM 0 HB3 GLU A 538 14.168 -11.836 -30.463 1.00 0.00 H new ATOM 0 HG2 GLU A 538 15.321 -11.338 -32.566 1.00 0.00 H new ATOM 0 HG3 GLU A 538 15.481 -9.989 -31.460 1.00 0.00 H new ATOM 1376 N SER A 539 13.946 -10.356 -28.042 1.00 0.00 N ATOM 1377 CA SER A 539 13.153 -9.231 -27.542 1.00 0.00 C ATOM 1378 C SER A 539 12.309 -9.718 -26.348 1.00 0.00 C ATOM 1379 O SER A 539 11.587 -10.715 -26.459 1.00 0.00 O ATOM 1380 CB SER A 539 12.246 -8.680 -28.672 1.00 0.00 C ATOM 1381 OG SER A 539 12.993 -8.360 -29.842 1.00 0.00 O ATOM 0 H SER A 539 13.481 -11.257 -27.933 1.00 0.00 H new ATOM 0 HA SER A 539 13.808 -8.424 -27.214 1.00 0.00 H new ATOM 0 HB2 SER A 539 11.483 -9.419 -28.919 1.00 0.00 H new ATOM 0 HB3 SER A 539 11.725 -7.790 -28.319 1.00 0.00 H new ATOM 0 HG SER A 539 12.388 -8.017 -30.533 1.00 0.00 H new ATOM 1387 N PHE A 540 12.428 -9.028 -25.208 1.00 0.00 N ATOM 1388 CA PHE A 540 11.712 -9.370 -23.963 1.00 0.00 C ATOM 1389 C PHE A 540 11.369 -8.094 -23.194 1.00 0.00 C ATOM 1390 O PHE A 540 12.135 -7.121 -23.209 1.00 0.00 O ATOM 1391 CB PHE A 540 12.544 -10.355 -23.084 1.00 0.00 C ATOM 1392 CG PHE A 540 14.039 -10.037 -23.023 1.00 0.00 C ATOM 1393 CD1 PHE A 540 14.538 -9.029 -22.197 1.00 0.00 C ATOM 1394 CD2 PHE A 540 14.945 -10.739 -23.819 1.00 0.00 C ATOM 1395 CE1 PHE A 540 15.888 -8.738 -22.173 1.00 0.00 C ATOM 1396 CE2 PHE A 540 16.292 -10.447 -23.788 1.00 0.00 C ATOM 1397 CZ PHE A 540 16.763 -9.448 -22.967 1.00 0.00 C ATOM 0 H PHE A 540 13.028 -8.208 -25.118 1.00 0.00 H new ATOM 0 HA PHE A 540 10.784 -9.879 -24.224 1.00 0.00 H new ATOM 0 HB2 PHE A 540 12.142 -10.348 -22.071 1.00 0.00 H new ATOM 0 HB3 PHE A 540 12.415 -11.366 -23.471 1.00 0.00 H new ATOM 0 HD1 PHE A 540 13.860 -8.470 -21.569 1.00 0.00 H new ATOM 0 HD2 PHE A 540 14.586 -11.523 -24.469 1.00 0.00 H new ATOM 0 HE1 PHE A 540 16.259 -7.953 -21.531 1.00 0.00 H new ATOM 0 HE2 PHE A 540 16.979 -11.003 -24.409 1.00 0.00 H new ATOM 0 HZ PHE A 540 17.818 -9.220 -22.945 1.00 0.00 H new ATOM 1407 N ARG A 541 10.206 -8.105 -22.535 1.00 0.00 N ATOM 1408 CA ARG A 541 9.752 -6.994 -21.697 1.00 0.00 C ATOM 1409 C ARG A 541 9.853 -7.383 -20.223 1.00 0.00 C ATOM 1410 O ARG A 541 9.200 -8.332 -19.776 1.00 0.00 O ATOM 1411 CB ARG A 541 8.306 -6.605 -22.067 1.00 0.00 C ATOM 1412 CG ARG A 541 7.730 -5.412 -21.274 1.00 0.00 C ATOM 1413 CD ARG A 541 6.326 -5.021 -21.757 1.00 0.00 C ATOM 1414 NE ARG A 541 6.327 -4.636 -23.183 1.00 0.00 N ATOM 1415 CZ ARG A 541 5.279 -4.711 -24.015 1.00 0.00 C ATOM 1416 NH1 ARG A 541 4.110 -5.184 -23.606 1.00 0.00 N ATOM 1417 NH2 ARG A 541 5.420 -4.324 -25.270 1.00 0.00 N ATOM 0 H ARG A 541 9.552 -8.887 -22.569 1.00 0.00 H new ATOM 0 HA ARG A 541 10.390 -6.128 -21.870 1.00 0.00 H new ATOM 0 HB2 ARG A 541 8.270 -6.367 -23.130 1.00 0.00 H new ATOM 0 HB3 ARG A 541 7.662 -7.470 -21.912 1.00 0.00 H new ATOM 0 HG2 ARG A 541 7.691 -5.666 -20.215 1.00 0.00 H new ATOM 0 HG3 ARG A 541 8.398 -4.556 -21.372 1.00 0.00 H new ATOM 0 HD2 ARG A 541 5.643 -5.857 -21.606 1.00 0.00 H new ATOM 0 HD3 ARG A 541 5.952 -4.192 -21.156 1.00 0.00 H new ATOM 0 HE ARG A 541 7.202 -4.282 -23.568 1.00 0.00 H new ATOM 0 HH11 ARG A 541 3.996 -5.499 -22.643 1.00 0.00 H new ATOM 0 HH12 ARG A 541 3.324 -5.233 -24.255 1.00 0.00 H new ATOM 0 HH21 ARG A 541 6.320 -3.972 -25.597 1.00 0.00 H new ATOM 0 HH22 ARG A 541 4.629 -4.377 -25.912 1.00 0.00 H new ATOM 1431 N THR A 542 10.700 -6.661 -19.490 1.00 0.00 N ATOM 1432 CA THR A 542 10.830 -6.798 -18.044 1.00 0.00 C ATOM 1433 C THR A 542 9.923 -5.762 -17.360 1.00 0.00 C ATOM 1434 O THR A 542 10.036 -4.567 -17.632 1.00 0.00 O ATOM 1435 CB THR A 542 12.315 -6.607 -17.611 1.00 0.00 C ATOM 1436 OG1 THR A 542 13.146 -7.541 -18.325 1.00 0.00 O ATOM 1437 CG2 THR A 542 12.528 -6.790 -16.101 1.00 0.00 C ATOM 0 H THR A 542 11.321 -5.958 -19.890 1.00 0.00 H new ATOM 0 HA THR A 542 10.522 -7.799 -17.742 1.00 0.00 H new ATOM 0 HB THR A 542 12.588 -5.580 -17.853 1.00 0.00 H new ATOM 0 HG1 THR A 542 13.189 -7.285 -19.270 1.00 0.00 H new ATOM 0 HG21 THR A 542 13.581 -6.645 -15.862 1.00 0.00 H new ATOM 0 HG22 THR A 542 11.928 -6.060 -15.558 1.00 0.00 H new ATOM 0 HG23 THR A 542 12.225 -7.796 -15.810 1.00 0.00 H new ATOM 1445 N VAL A 543 8.996 -6.242 -16.522 1.00 0.00 N ATOM 1446 CA VAL A 543 8.074 -5.409 -15.744 1.00 0.00 C ATOM 1447 C VAL A 543 8.217 -5.767 -14.256 1.00 0.00 C ATOM 1448 O VAL A 543 7.956 -6.905 -13.861 1.00 0.00 O ATOM 1449 CB VAL A 543 6.574 -5.622 -16.187 1.00 0.00 C ATOM 1450 CG1 VAL A 543 5.617 -4.706 -15.386 1.00 0.00 C ATOM 1451 CG2 VAL A 543 6.402 -5.414 -17.710 1.00 0.00 C ATOM 0 H VAL A 543 8.864 -7.241 -16.363 1.00 0.00 H new ATOM 0 HA VAL A 543 8.329 -4.364 -15.919 1.00 0.00 H new ATOM 0 HB VAL A 543 6.309 -6.655 -15.963 1.00 0.00 H new ATOM 0 HG11 VAL A 543 4.591 -4.876 -15.714 1.00 0.00 H new ATOM 0 HG12 VAL A 543 5.701 -4.933 -14.323 1.00 0.00 H new ATOM 0 HG13 VAL A 543 5.884 -3.663 -15.556 1.00 0.00 H new ATOM 0 HG21 VAL A 543 5.358 -5.568 -17.983 1.00 0.00 H new ATOM 0 HG22 VAL A 543 6.700 -4.400 -17.975 1.00 0.00 H new ATOM 0 HG23 VAL A 543 7.026 -6.128 -18.247 1.00 0.00 H new ATOM 1461 N LEU A 544 8.634 -4.794 -13.442 1.00 0.00 N ATOM 1462 CA LEU A 544 8.685 -4.940 -11.985 1.00 0.00 C ATOM 1463 C LEU A 544 7.324 -4.494 -11.403 1.00 0.00 C ATOM 1464 O LEU A 544 6.942 -3.323 -11.521 1.00 0.00 O ATOM 1465 CB LEU A 544 9.861 -4.104 -11.417 1.00 0.00 C ATOM 1466 CG LEU A 544 10.102 -4.177 -9.878 1.00 0.00 C ATOM 1467 CD1 LEU A 544 10.288 -5.630 -9.381 1.00 0.00 C ATOM 1468 CD2 LEU A 544 11.293 -3.285 -9.483 1.00 0.00 C ATOM 0 H LEU A 544 8.946 -3.882 -13.775 1.00 0.00 H new ATOM 0 HA LEU A 544 8.861 -5.978 -11.703 1.00 0.00 H new ATOM 0 HB2 LEU A 544 10.775 -4.421 -11.919 1.00 0.00 H new ATOM 0 HB3 LEU A 544 9.696 -3.061 -11.685 1.00 0.00 H new ATOM 0 HG LEU A 544 9.208 -3.798 -9.383 1.00 0.00 H new ATOM 0 HD11 LEU A 544 10.453 -5.628 -8.304 1.00 0.00 H new ATOM 0 HD12 LEU A 544 9.394 -6.210 -9.610 1.00 0.00 H new ATOM 0 HD13 LEU A 544 11.148 -6.077 -9.879 1.00 0.00 H new ATOM 0 HD21 LEU A 544 11.451 -3.345 -8.406 1.00 0.00 H new ATOM 0 HD22 LEU A 544 12.190 -3.625 -10.001 1.00 0.00 H new ATOM 0 HD23 LEU A 544 11.083 -2.253 -9.762 1.00 0.00 H new ATOM 1480 N VAL A 545 6.563 -5.458 -10.862 1.00 0.00 N ATOM 1481 CA VAL A 545 5.276 -5.215 -10.180 1.00 0.00 C ATOM 1482 C VAL A 545 5.493 -5.275 -8.659 1.00 0.00 C ATOM 1483 O VAL A 545 6.372 -5.997 -8.193 1.00 0.00 O ATOM 1484 CB VAL A 545 4.202 -6.258 -10.659 1.00 0.00 C ATOM 1485 CG1 VAL A 545 2.914 -6.250 -9.800 1.00 0.00 C ATOM 1486 CG2 VAL A 545 3.859 -6.013 -12.142 1.00 0.00 C ATOM 0 H VAL A 545 6.826 -6.443 -10.885 1.00 0.00 H new ATOM 0 HA VAL A 545 4.900 -4.224 -10.434 1.00 0.00 H new ATOM 0 HB VAL A 545 4.645 -7.246 -10.537 1.00 0.00 H new ATOM 0 HG11 VAL A 545 2.215 -6.993 -10.185 1.00 0.00 H new ATOM 0 HG12 VAL A 545 3.165 -6.489 -8.766 1.00 0.00 H new ATOM 0 HG13 VAL A 545 2.454 -5.263 -9.843 1.00 0.00 H new ATOM 0 HG21 VAL A 545 3.114 -6.739 -12.468 1.00 0.00 H new ATOM 0 HG22 VAL A 545 3.460 -5.006 -12.262 1.00 0.00 H new ATOM 0 HG23 VAL A 545 4.760 -6.121 -12.746 1.00 0.00 H new ATOM 1496 N ASN A 546 4.691 -4.514 -7.893 1.00 0.00 N ATOM 1497 CA ASN A 546 4.886 -4.353 -6.432 1.00 0.00 C ATOM 1498 C ASN A 546 3.749 -5.023 -5.625 1.00 0.00 C ATOM 1499 O ASN A 546 2.882 -5.693 -6.197 1.00 0.00 O ATOM 1500 CB ASN A 546 5.014 -2.834 -6.102 1.00 0.00 C ATOM 1501 CG ASN A 546 3.689 -2.119 -5.889 1.00 0.00 C ATOM 1502 OD1 ASN A 546 2.950 -1.916 -6.951 1.00 0.00 O flip ATOM 1503 ND2 ASN A 546 3.308 -1.812 -4.760 1.00 0.00 N flip ATOM 0 H ASN A 546 3.894 -3.995 -8.261 1.00 0.00 H new ATOM 0 HA ASN A 546 5.805 -4.859 -6.137 1.00 0.00 H new ATOM 0 HB2 ASN A 546 5.622 -2.721 -5.204 1.00 0.00 H new ATOM 0 HB3 ASN A 546 5.550 -2.343 -6.914 1.00 0.00 H new ATOM 0 HD21 ASN A 546 3.909 -1.984 -3.954 1.00 0.00 H new ATOM 0 HD22 ASN A 546 2.391 -1.385 -4.630 1.00 0.00 H new ATOM 1510 N ALA A 547 3.761 -4.793 -4.292 1.00 0.00 N ATOM 1511 CA ALA A 547 2.779 -5.345 -3.327 1.00 0.00 C ATOM 1512 C ALA A 547 1.316 -4.967 -3.664 1.00 0.00 C ATOM 1513 O ALA A 547 0.390 -5.775 -3.474 1.00 0.00 O ATOM 1514 CB ALA A 547 3.141 -4.856 -1.916 1.00 0.00 C ATOM 0 H ALA A 547 4.467 -4.207 -3.847 1.00 0.00 H new ATOM 0 HA ALA A 547 2.834 -6.432 -3.385 1.00 0.00 H new ATOM 0 HB1 ALA A 547 2.425 -5.256 -1.198 1.00 0.00 H new ATOM 0 HB2 ALA A 547 4.143 -5.198 -1.658 1.00 0.00 H new ATOM 0 HB3 ALA A 547 3.111 -3.767 -1.890 1.00 0.00 H new ATOM 1520 N ASP A 548 1.130 -3.728 -4.146 1.00 0.00 N ATOM 1521 CA ASP A 548 -0.190 -3.205 -4.579 1.00 0.00 C ATOM 1522 C ASP A 548 -0.777 -4.056 -5.719 1.00 0.00 C ATOM 1523 O ASP A 548 -1.982 -4.356 -5.742 1.00 0.00 O ATOM 1524 CB ASP A 548 -0.032 -1.739 -5.057 1.00 0.00 C ATOM 1525 CG ASP A 548 -1.343 -1.074 -5.546 1.00 0.00 C ATOM 1526 OD1 ASP A 548 -1.705 -1.240 -6.737 1.00 0.00 O ATOM 1527 OD2 ASP A 548 -2.007 -0.372 -4.750 1.00 0.00 O ATOM 0 H ASP A 548 1.888 -3.054 -4.249 1.00 0.00 H new ATOM 0 HA ASP A 548 -0.873 -3.250 -3.731 1.00 0.00 H new ATOM 0 HB2 ASP A 548 0.377 -1.146 -4.239 1.00 0.00 H new ATOM 0 HB3 ASP A 548 0.698 -1.711 -5.866 1.00 0.00 H new ATOM 1532 N GLY A 549 0.106 -4.453 -6.648 1.00 0.00 N ATOM 1533 CA GLY A 549 -0.279 -5.178 -7.858 1.00 0.00 C ATOM 1534 C GLY A 549 -0.098 -4.343 -9.118 1.00 0.00 C ATOM 1535 O GLY A 549 -0.057 -4.898 -10.222 1.00 0.00 O ATOM 0 H GLY A 549 1.108 -4.278 -6.577 1.00 0.00 H new ATOM 0 HA2 GLY A 549 0.318 -6.087 -7.939 1.00 0.00 H new ATOM 0 HA3 GLY A 549 -1.321 -5.487 -7.777 1.00 0.00 H new ATOM 1539 N GLU A 550 0.014 -3.010 -8.957 1.00 0.00 N ATOM 1540 CA GLU A 550 0.292 -2.091 -10.085 1.00 0.00 C ATOM 1541 C GLU A 550 1.731 -2.290 -10.608 1.00 0.00 C ATOM 1542 O GLU A 550 2.653 -2.635 -9.842 1.00 0.00 O ATOM 1543 CB GLU A 550 0.055 -0.604 -9.674 1.00 0.00 C ATOM 1544 CG GLU A 550 0.996 -0.088 -8.575 1.00 0.00 C ATOM 1545 CD GLU A 550 0.740 1.359 -8.136 1.00 0.00 C ATOM 1546 OE1 GLU A 550 1.133 2.284 -8.869 1.00 0.00 O ATOM 1547 OE2 GLU A 550 0.156 1.580 -7.050 1.00 0.00 O ATOM 0 H GLU A 550 -0.084 -2.542 -8.056 1.00 0.00 H new ATOM 0 HA GLU A 550 -0.403 -2.330 -10.890 1.00 0.00 H new ATOM 0 HB2 GLU A 550 0.168 0.026 -10.556 1.00 0.00 H new ATOM 0 HB3 GLU A 550 -0.975 -0.494 -9.334 1.00 0.00 H new ATOM 0 HG2 GLU A 550 0.906 -0.738 -7.705 1.00 0.00 H new ATOM 0 HG3 GLU A 550 2.024 -0.169 -8.929 1.00 0.00 H new ATOM 1554 N GLU A 551 1.903 -2.073 -11.917 1.00 0.00 N ATOM 1555 CA GLU A 551 3.195 -2.181 -12.606 1.00 0.00 C ATOM 1556 C GLU A 551 3.978 -0.873 -12.398 1.00 0.00 C ATOM 1557 O GLU A 551 3.694 0.144 -13.042 1.00 0.00 O ATOM 1558 CB GLU A 551 2.931 -2.469 -14.106 1.00 0.00 C ATOM 1559 CG GLU A 551 1.982 -3.662 -14.363 1.00 0.00 C ATOM 1560 CD GLU A 551 1.748 -3.947 -15.855 1.00 0.00 C ATOM 1561 OE1 GLU A 551 1.003 -3.186 -16.507 1.00 0.00 O ATOM 1562 OE2 GLU A 551 2.300 -4.936 -16.383 1.00 0.00 O ATOM 0 H GLU A 551 1.136 -1.813 -12.538 1.00 0.00 H new ATOM 0 HA GLU A 551 3.794 -2.998 -12.204 1.00 0.00 H new ATOM 0 HB2 GLU A 551 2.508 -1.576 -14.567 1.00 0.00 H new ATOM 0 HB3 GLU A 551 3.883 -2.663 -14.601 1.00 0.00 H new ATOM 0 HG2 GLU A 551 2.395 -4.553 -13.891 1.00 0.00 H new ATOM 0 HG3 GLU A 551 1.023 -3.463 -13.884 1.00 0.00 H new ATOM 1569 N VAL A 552 4.923 -0.897 -11.447 1.00 0.00 N ATOM 1570 CA VAL A 552 5.648 0.309 -11.002 1.00 0.00 C ATOM 1571 C VAL A 552 6.858 0.622 -11.892 1.00 0.00 C ATOM 1572 O VAL A 552 7.350 1.756 -11.900 1.00 0.00 O ATOM 1573 CB VAL A 552 6.099 0.183 -9.504 1.00 0.00 C ATOM 1574 CG1 VAL A 552 4.872 0.151 -8.571 1.00 0.00 C ATOM 1575 CG2 VAL A 552 7.012 -1.048 -9.276 1.00 0.00 C ATOM 0 H VAL A 552 5.208 -1.749 -10.964 1.00 0.00 H new ATOM 0 HA VAL A 552 4.948 1.140 -11.089 1.00 0.00 H new ATOM 0 HB VAL A 552 6.692 1.065 -9.261 1.00 0.00 H new ATOM 0 HG11 VAL A 552 5.204 0.063 -7.536 1.00 0.00 H new ATOM 0 HG12 VAL A 552 4.299 1.070 -8.692 1.00 0.00 H new ATOM 0 HG13 VAL A 552 4.244 -0.703 -8.824 1.00 0.00 H new ATOM 0 HG21 VAL A 552 7.301 -1.097 -8.226 1.00 0.00 H new ATOM 0 HG22 VAL A 552 6.473 -1.956 -9.547 1.00 0.00 H new ATOM 0 HG23 VAL A 552 7.905 -0.958 -9.894 1.00 0.00 H new ATOM 1585 N ALA A 553 7.330 -0.385 -12.633 1.00 0.00 N ATOM 1586 CA ALA A 553 8.454 -0.237 -13.558 1.00 0.00 C ATOM 1587 C ALA A 553 8.256 -1.177 -14.751 1.00 0.00 C ATOM 1588 O ALA A 553 7.810 -2.310 -14.574 1.00 0.00 O ATOM 1589 CB ALA A 553 9.779 -0.505 -12.828 1.00 0.00 C ATOM 0 H ALA A 553 6.941 -1.328 -12.607 1.00 0.00 H new ATOM 0 HA ALA A 553 8.494 0.785 -13.935 1.00 0.00 H new ATOM 0 HB1 ALA A 553 10.608 -0.392 -13.526 1.00 0.00 H new ATOM 0 HB2 ALA A 553 9.894 0.206 -12.010 1.00 0.00 H new ATOM 0 HB3 ALA A 553 9.776 -1.519 -12.429 1.00 0.00 H new ATOM 1595 N MET A 554 8.582 -0.691 -15.956 1.00 0.00 N ATOM 1596 CA MET A 554 8.389 -1.433 -17.215 1.00 0.00 C ATOM 1597 C MET A 554 9.447 -0.983 -18.236 1.00 0.00 C ATOM 1598 O MET A 554 9.653 0.224 -18.433 1.00 0.00 O ATOM 1599 CB MET A 554 6.951 -1.199 -17.760 1.00 0.00 C ATOM 1600 CG MET A 554 6.634 -1.880 -19.101 1.00 0.00 C ATOM 1601 SD MET A 554 4.925 -1.621 -19.635 1.00 0.00 S ATOM 1602 CE MET A 554 4.000 -2.320 -18.262 1.00 0.00 C ATOM 0 H MET A 554 8.990 0.234 -16.089 1.00 0.00 H new ATOM 0 HA MET A 554 8.508 -2.501 -17.034 1.00 0.00 H new ATOM 0 HB2 MET A 554 6.237 -1.551 -17.016 1.00 0.00 H new ATOM 0 HB3 MET A 554 6.793 -0.126 -17.871 1.00 0.00 H new ATOM 0 HG2 MET A 554 7.310 -1.498 -19.866 1.00 0.00 H new ATOM 0 HG3 MET A 554 6.824 -2.950 -19.013 1.00 0.00 H new ATOM 0 HE1 MET A 554 2.987 -2.555 -18.588 1.00 0.00 H new ATOM 0 HE2 MET A 554 4.491 -3.230 -17.918 1.00 0.00 H new ATOM 0 HE3 MET A 554 3.960 -1.599 -17.446 1.00 0.00 H new ATOM 1612 N ARG A 555 10.101 -1.959 -18.888 1.00 0.00 N ATOM 1613 CA ARG A 555 11.232 -1.707 -19.792 1.00 0.00 C ATOM 1614 C ARG A 555 11.386 -2.886 -20.768 1.00 0.00 C ATOM 1615 O ARG A 555 11.646 -4.018 -20.345 1.00 0.00 O ATOM 1616 CB ARG A 555 12.523 -1.496 -18.957 1.00 0.00 C ATOM 1617 CG ARG A 555 13.789 -1.140 -19.768 1.00 0.00 C ATOM 1618 CD ARG A 555 14.984 -0.843 -18.853 1.00 0.00 C ATOM 1619 NE ARG A 555 16.212 -0.516 -19.598 1.00 0.00 N ATOM 1620 CZ ARG A 555 17.336 -0.051 -19.036 1.00 0.00 C ATOM 1621 NH1 ARG A 555 17.383 0.223 -17.742 1.00 0.00 N ATOM 1622 NH2 ARG A 555 18.400 0.170 -19.780 1.00 0.00 N ATOM 0 H ARG A 555 9.859 -2.946 -18.802 1.00 0.00 H new ATOM 0 HA ARG A 555 11.049 -0.805 -20.376 1.00 0.00 H new ATOM 0 HB2 ARG A 555 12.341 -0.701 -18.233 1.00 0.00 H new ATOM 0 HB3 ARG A 555 12.720 -2.405 -18.389 1.00 0.00 H new ATOM 0 HG2 ARG A 555 14.038 -1.965 -20.435 1.00 0.00 H new ATOM 0 HG3 ARG A 555 13.587 -0.272 -20.396 1.00 0.00 H new ATOM 0 HD2 ARG A 555 14.733 -0.011 -18.195 1.00 0.00 H new ATOM 0 HD3 ARG A 555 15.171 -1.708 -18.217 1.00 0.00 H new ATOM 0 HE ARG A 555 16.206 -0.653 -20.609 1.00 0.00 H new ATOM 0 HH11 ARG A 555 16.557 0.081 -17.160 1.00 0.00 H new ATOM 0 HH12 ARG A 555 18.245 0.576 -17.327 1.00 0.00 H new ATOM 0 HH21 ARG A 555 18.368 -0.013 -20.783 1.00 0.00 H new ATOM 0 HH22 ARG A 555 19.256 0.524 -19.353 1.00 0.00 H new ATOM 1636 N THR A 556 11.225 -2.607 -22.071 1.00 0.00 N ATOM 1637 CA THR A 556 11.278 -3.622 -23.138 1.00 0.00 C ATOM 1638 C THR A 556 12.631 -3.528 -23.868 1.00 0.00 C ATOM 1639 O THR A 556 12.905 -2.524 -24.539 1.00 0.00 O ATOM 1640 CB THR A 556 10.102 -3.414 -24.159 1.00 0.00 C ATOM 1641 OG1 THR A 556 8.874 -3.203 -23.447 1.00 0.00 O ATOM 1642 CG2 THR A 556 9.935 -4.611 -25.120 1.00 0.00 C ATOM 0 H THR A 556 11.053 -1.663 -22.418 1.00 0.00 H new ATOM 0 HA THR A 556 11.173 -4.610 -22.690 1.00 0.00 H new ATOM 0 HB THR A 556 10.350 -2.540 -24.761 1.00 0.00 H new ATOM 0 HG1 THR A 556 8.283 -2.628 -23.977 1.00 0.00 H new ATOM 0 HG21 THR A 556 9.109 -4.416 -25.804 1.00 0.00 H new ATOM 0 HG22 THR A 556 10.853 -4.751 -25.690 1.00 0.00 H new ATOM 0 HG23 THR A 556 9.724 -5.513 -24.545 1.00 0.00 H new ATOM 1650 N VAL A 557 13.481 -4.563 -23.717 1.00 0.00 N ATOM 1651 CA VAL A 557 14.836 -4.598 -24.305 1.00 0.00 C ATOM 1652 C VAL A 557 14.879 -5.550 -25.512 1.00 0.00 C ATOM 1653 O VAL A 557 14.541 -6.736 -25.410 1.00 0.00 O ATOM 1654 CB VAL A 557 15.910 -4.994 -23.224 1.00 0.00 C ATOM 1655 CG1 VAL A 557 17.313 -5.264 -23.842 1.00 0.00 C ATOM 1656 CG2 VAL A 557 15.992 -3.894 -22.135 1.00 0.00 C ATOM 0 H VAL A 557 13.247 -5.400 -23.183 1.00 0.00 H new ATOM 0 HA VAL A 557 15.081 -3.597 -24.659 1.00 0.00 H new ATOM 0 HB VAL A 557 15.586 -5.931 -22.771 1.00 0.00 H new ATOM 0 HG11 VAL A 557 18.013 -5.533 -23.051 1.00 0.00 H new ATOM 0 HG12 VAL A 557 17.244 -6.082 -24.559 1.00 0.00 H new ATOM 0 HG13 VAL A 557 17.666 -4.366 -24.350 1.00 0.00 H new ATOM 0 HG21 VAL A 557 16.737 -4.174 -21.390 1.00 0.00 H new ATOM 0 HG22 VAL A 557 16.277 -2.948 -22.595 1.00 0.00 H new ATOM 0 HG23 VAL A 557 15.020 -3.786 -21.653 1.00 0.00 H new ATOM 1666 N LYS A 558 15.272 -4.977 -26.659 1.00 0.00 N ATOM 1667 CA LYS A 558 15.529 -5.697 -27.906 1.00 0.00 C ATOM 1668 C LYS A 558 17.057 -5.811 -28.061 1.00 0.00 C ATOM 1669 O LYS A 558 17.753 -4.788 -28.116 1.00 0.00 O ATOM 1670 CB LYS A 558 14.903 -4.938 -29.127 1.00 0.00 C ATOM 1671 CG LYS A 558 13.355 -5.006 -29.268 1.00 0.00 C ATOM 1672 CD LYS A 558 12.556 -4.348 -28.110 1.00 0.00 C ATOM 1673 CE LYS A 558 12.895 -2.862 -27.894 1.00 0.00 C ATOM 1674 NZ LYS A 558 12.646 -2.035 -29.105 1.00 0.00 N ATOM 0 H LYS A 558 15.423 -3.972 -26.743 1.00 0.00 H new ATOM 0 HA LYS A 558 15.072 -6.686 -27.877 1.00 0.00 H new ATOM 0 HB2 LYS A 558 15.194 -3.890 -29.062 1.00 0.00 H new ATOM 0 HB3 LYS A 558 15.346 -5.336 -30.040 1.00 0.00 H new ATOM 0 HG2 LYS A 558 13.070 -4.525 -30.204 1.00 0.00 H new ATOM 0 HG3 LYS A 558 13.059 -6.052 -29.344 1.00 0.00 H new ATOM 0 HD2 LYS A 558 11.490 -4.443 -28.316 1.00 0.00 H new ATOM 0 HD3 LYS A 558 12.752 -4.895 -27.188 1.00 0.00 H new ATOM 0 HE2 LYS A 558 12.301 -2.475 -27.066 1.00 0.00 H new ATOM 0 HE3 LYS A 558 13.942 -2.771 -27.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 558 12.874 -1.041 -28.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 558 13.244 -2.374 -29.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 558 11.645 -2.111 -29.378 1.00 0.00 H new ATOM 1688 N LYS A 559 17.568 -7.054 -28.074 1.00 0.00 N ATOM 1689 CA LYS A 559 19.002 -7.358 -28.244 1.00 0.00 C ATOM 1690 C LYS A 559 19.510 -6.831 -29.600 1.00 0.00 C ATOM 1691 O LYS A 559 19.353 -7.481 -30.636 1.00 0.00 O ATOM 1692 CB LYS A 559 19.208 -8.893 -28.112 1.00 0.00 C ATOM 1693 CG LYS A 559 20.657 -9.388 -28.308 1.00 0.00 C ATOM 1694 CD LYS A 559 20.842 -10.880 -27.935 1.00 0.00 C ATOM 1695 CE LYS A 559 19.865 -11.823 -28.667 1.00 0.00 C ATOM 1696 NZ LYS A 559 19.977 -11.718 -30.147 1.00 0.00 N ATOM 0 H LYS A 559 16.990 -7.888 -27.965 1.00 0.00 H new ATOM 0 HA LYS A 559 19.583 -6.857 -27.469 1.00 0.00 H new ATOM 0 HB2 LYS A 559 18.867 -9.204 -27.125 1.00 0.00 H new ATOM 0 HB3 LYS A 559 18.570 -9.392 -28.842 1.00 0.00 H new ATOM 0 HG2 LYS A 559 20.948 -9.240 -29.348 1.00 0.00 H new ATOM 0 HG3 LYS A 559 21.328 -8.781 -27.700 1.00 0.00 H new ATOM 0 HD2 LYS A 559 21.865 -11.180 -28.165 1.00 0.00 H new ATOM 0 HD3 LYS A 559 20.710 -10.997 -26.859 1.00 0.00 H new ATOM 0 HE2 LYS A 559 20.060 -12.851 -28.363 1.00 0.00 H new ATOM 0 HE3 LYS A 559 18.844 -11.589 -28.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 559 19.561 -12.563 -30.587 1.00 0.00 H new ATOM 0 HZ2 LYS A 559 19.469 -10.871 -30.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 559 20.979 -11.646 -30.415 1.00 0.00 H new