USER MOD reduce.3.24.130724 H: found=0, std=0, add=835, rem=0, adj=23 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 532 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 533 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 467 GLN : amide:sc= -0.362 X(o=-0.36,f=-0.28) USER MOD Set 2.2: A 510 THR OG1 : rot 76:sc=-0.00121 USER MOD Set 3.1: A 455 SER OG : rot 92:sc= 0.155 USER MOD Set 3.2: A 471 ASN :FLIP amide:sc= -0.011 F(o=-1.8!,f=0.14) USER MOD Set 4.1: A 453 SER OG : rot 171:sc= 0.855 USER MOD Set 4.2: A 472 SER OG : rot -177:sc= -0.706 USER MOD Set 4.3: A 476 GLN : amide:sc= 0.233 K(o=0.38,f=-0.76) USER MOD Single : A 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 469 LYS NZ :NH3+ -161:sc= 0.96 (180deg=0.728) USER MOD Single : A 470 ASN : amide:sc= -0.656 K(o=-0.66,f=-1.4) USER MOD Single : A 474 LYS NZ :NH3+ 159:sc= 0.00593 (180deg=0) USER MOD Single : A 477 SER OG : rot 180:sc= 0 USER MOD Single : A 480 ASN : amide:sc= -0.142 X(o=-0.14,f=0) USER MOD Single : A 484 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0708) USER MOD Single : A 486 GLN : amide:sc= -0.561 K(o=-0.56,f=-4.8!) USER MOD Single : A 495 TYR OH : rot 180:sc= 0 USER MOD Single : A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 THR OG1 : rot 180:sc= -0.376 USER MOD Single : A 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 501 TYR OH : rot -154:sc= -0.435 USER MOD Single : A 507 GLN : amide:sc= -0.148 X(o=-0.15,f=-0.031) USER MOD Single : A 508 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 520 HIS : no HD1:sc= -0.111 X(o=-0.11,f=-0.59) USER MOD Single : A 521 SER OG : rot 71:sc= 0.28 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 531 GLN : amide:sc= -0.252 K(o=-0.25,f=-3.7!) USER MOD Single : A 536 THR OG1 : rot -85:sc= 0.346 USER MOD Single : A 539 SER OG : rot 180:sc= 0 USER MOD Single : A 542 THR OG1 : rot 180:sc= 0 USER MOD Single : A 546 ASN : amide:sc= -2.27! C(o=-2.3!,f=-3.8!) USER MOD Single : A 554 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 556 THR OG1 : rot 180:sc= 0 USER MOD Single : A 558 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0279) USER MOD Single : A 559 LYS NZ :NH3+ -166:sc= 0.78 (180deg=0.336) USER MOD ----------------------------------------------------------------- ATOM 40 N SER A 453 9.541 2.453 -5.429 1.00 0.00 N ATOM 41 CA SER A 453 10.811 2.474 -4.676 1.00 0.00 C ATOM 42 C SER A 453 11.931 1.973 -5.606 1.00 0.00 C ATOM 43 O SER A 453 12.869 2.709 -5.932 1.00 0.00 O ATOM 44 CB SER A 453 10.777 1.608 -3.379 1.00 0.00 C ATOM 45 OG SER A 453 10.037 2.229 -2.340 1.00 0.00 O ATOM 0 HA SER A 453 10.988 3.500 -4.352 1.00 0.00 H new ATOM 0 HB2 SER A 453 10.338 0.636 -3.604 1.00 0.00 H new ATOM 0 HB3 SER A 453 11.796 1.426 -3.038 1.00 0.00 H new ATOM 0 HG SER A 453 9.923 1.599 -1.598 1.00 0.00 H new ATOM 51 N VAL A 454 11.801 0.703 -6.035 1.00 0.00 N ATOM 52 CA VAL A 454 12.778 0.031 -6.899 1.00 0.00 C ATOM 53 C VAL A 454 12.379 0.229 -8.370 1.00 0.00 C ATOM 54 O VAL A 454 11.216 0.028 -8.745 1.00 0.00 O ATOM 55 CB VAL A 454 12.876 -1.511 -6.583 1.00 0.00 C ATOM 56 CG1 VAL A 454 14.089 -2.161 -7.297 1.00 0.00 C ATOM 57 CG2 VAL A 454 12.904 -1.781 -5.059 1.00 0.00 C ATOM 0 H VAL A 454 11.006 0.114 -5.787 1.00 0.00 H new ATOM 0 HA VAL A 454 13.756 0.474 -6.709 1.00 0.00 H new ATOM 0 HB VAL A 454 11.975 -1.980 -6.978 1.00 0.00 H new ATOM 0 HG11 VAL A 454 14.126 -3.224 -7.057 1.00 0.00 H new ATOM 0 HG12 VAL A 454 13.987 -2.036 -8.375 1.00 0.00 H new ATOM 0 HG13 VAL A 454 15.009 -1.681 -6.962 1.00 0.00 H new ATOM 0 HG21 VAL A 454 12.972 -2.854 -4.881 1.00 0.00 H new ATOM 0 HG22 VAL A 454 13.768 -1.284 -4.617 1.00 0.00 H new ATOM 0 HG23 VAL A 454 11.992 -1.395 -4.604 1.00 0.00 H new ATOM 67 N SER A 455 13.347 0.644 -9.179 1.00 0.00 N ATOM 68 CA SER A 455 13.208 0.782 -10.635 1.00 0.00 C ATOM 69 C SER A 455 14.039 -0.307 -11.333 1.00 0.00 C ATOM 70 O SER A 455 14.996 -0.826 -10.743 1.00 0.00 O ATOM 71 CB SER A 455 13.698 2.186 -11.061 1.00 0.00 C ATOM 72 OG SER A 455 13.057 3.210 -10.303 1.00 0.00 O ATOM 0 H SER A 455 14.274 0.901 -8.839 1.00 0.00 H new ATOM 0 HA SER A 455 12.163 0.666 -10.922 1.00 0.00 H new ATOM 0 HB2 SER A 455 14.778 2.253 -10.927 1.00 0.00 H new ATOM 0 HB3 SER A 455 13.499 2.337 -12.122 1.00 0.00 H new ATOM 0 HG SER A 455 13.598 3.420 -9.513 1.00 0.00 H new ATOM 78 N ILE A 456 13.669 -0.667 -12.576 1.00 0.00 N ATOM 79 CA ILE A 456 14.529 -1.514 -13.417 1.00 0.00 C ATOM 80 C ILE A 456 15.618 -0.624 -14.009 1.00 0.00 C ATOM 81 O ILE A 456 15.335 0.195 -14.895 1.00 0.00 O ATOM 82 CB ILE A 456 13.755 -2.238 -14.580 1.00 0.00 C ATOM 83 CG1 ILE A 456 12.497 -2.965 -14.038 1.00 0.00 C ATOM 84 CG2 ILE A 456 14.690 -3.242 -15.312 1.00 0.00 C ATOM 85 CD1 ILE A 456 11.630 -3.621 -15.101 1.00 0.00 C ATOM 0 H ILE A 456 12.791 -0.388 -13.014 1.00 0.00 H new ATOM 0 HA ILE A 456 14.939 -2.305 -12.789 1.00 0.00 H new ATOM 0 HB ILE A 456 13.429 -1.482 -15.294 1.00 0.00 H new ATOM 0 HG12 ILE A 456 12.814 -3.728 -13.327 1.00 0.00 H new ATOM 0 HG13 ILE A 456 11.890 -2.247 -13.486 1.00 0.00 H new ATOM 0 HG21 ILE A 456 14.139 -3.734 -16.113 1.00 0.00 H new ATOM 0 HG22 ILE A 456 15.541 -2.706 -15.732 1.00 0.00 H new ATOM 0 HG23 ILE A 456 15.046 -3.990 -14.604 1.00 0.00 H new ATOM 0 HD11 ILE A 456 10.775 -4.103 -14.627 1.00 0.00 H new ATOM 0 HD12 ILE A 456 11.277 -2.864 -15.801 1.00 0.00 H new ATOM 0 HD13 ILE A 456 12.215 -4.367 -15.639 1.00 0.00 H new ATOM 97 N GLU A 457 16.842 -0.767 -13.495 1.00 0.00 N ATOM 98 CA GLU A 457 17.961 0.086 -13.887 1.00 0.00 C ATOM 99 C GLU A 457 18.436 -0.299 -15.295 1.00 0.00 C ATOM 100 O GLU A 457 18.218 0.445 -16.261 1.00 0.00 O ATOM 101 CB GLU A 457 19.105 -0.016 -12.839 1.00 0.00 C ATOM 102 CG GLU A 457 20.254 0.991 -13.040 1.00 0.00 C ATOM 103 CD GLU A 457 19.783 2.460 -13.020 1.00 0.00 C ATOM 104 OE1 GLU A 457 19.507 2.993 -11.927 1.00 0.00 O ATOM 105 OE2 GLU A 457 19.692 3.095 -14.095 1.00 0.00 O ATOM 0 H GLU A 457 17.082 -1.474 -12.800 1.00 0.00 H new ATOM 0 HA GLU A 457 17.638 1.127 -13.916 1.00 0.00 H new ATOM 0 HB2 GLU A 457 18.683 0.129 -11.845 1.00 0.00 H new ATOM 0 HB3 GLU A 457 19.516 -1.025 -12.867 1.00 0.00 H new ATOM 0 HG2 GLU A 457 20.999 0.844 -12.258 1.00 0.00 H new ATOM 0 HG3 GLU A 457 20.746 0.787 -13.991 1.00 0.00 H new ATOM 112 N GLU A 458 19.045 -1.493 -15.403 1.00 0.00 N ATOM 113 CA GLU A 458 19.597 -2.016 -16.666 1.00 0.00 C ATOM 114 C GLU A 458 19.158 -3.474 -16.862 1.00 0.00 C ATOM 115 O GLU A 458 18.677 -4.118 -15.927 1.00 0.00 O ATOM 116 CB GLU A 458 21.155 -1.922 -16.675 1.00 0.00 C ATOM 117 CG GLU A 458 21.728 -0.539 -16.298 1.00 0.00 C ATOM 118 CD GLU A 458 23.206 -0.375 -16.672 1.00 0.00 C ATOM 119 OE1 GLU A 458 24.082 -0.720 -15.859 1.00 0.00 O ATOM 120 OE2 GLU A 458 23.503 0.090 -17.794 1.00 0.00 O ATOM 0 H GLU A 458 19.169 -2.126 -14.613 1.00 0.00 H new ATOM 0 HA GLU A 458 19.214 -1.409 -17.487 1.00 0.00 H new ATOM 0 HB2 GLU A 458 21.553 -2.664 -15.983 1.00 0.00 H new ATOM 0 HB3 GLU A 458 21.514 -2.189 -17.669 1.00 0.00 H new ATOM 0 HG2 GLU A 458 21.146 0.236 -16.796 1.00 0.00 H new ATOM 0 HG3 GLU A 458 21.612 -0.385 -15.225 1.00 0.00 H new ATOM 127 N ILE A 459 19.292 -3.972 -18.100 1.00 0.00 N ATOM 128 CA ILE A 459 19.100 -5.390 -18.446 1.00 0.00 C ATOM 129 C ILE A 459 20.145 -5.755 -19.509 1.00 0.00 C ATOM 130 O ILE A 459 20.490 -4.919 -20.354 1.00 0.00 O ATOM 131 CB ILE A 459 17.654 -5.706 -19.015 1.00 0.00 C ATOM 132 CG1 ILE A 459 16.536 -5.240 -18.036 1.00 0.00 C ATOM 133 CG2 ILE A 459 17.481 -7.219 -19.342 1.00 0.00 C ATOM 134 CD1 ILE A 459 15.126 -5.420 -18.546 1.00 0.00 C ATOM 0 H ILE A 459 19.541 -3.393 -18.902 1.00 0.00 H new ATOM 0 HA ILE A 459 19.212 -5.977 -17.535 1.00 0.00 H new ATOM 0 HB ILE A 459 17.555 -5.142 -19.942 1.00 0.00 H new ATOM 0 HG12 ILE A 459 16.641 -5.789 -17.100 1.00 0.00 H new ATOM 0 HG13 ILE A 459 16.691 -4.186 -17.806 1.00 0.00 H new ATOM 0 HG21 ILE A 459 16.477 -7.395 -19.729 1.00 0.00 H new ATOM 0 HG22 ILE A 459 18.216 -7.516 -20.090 1.00 0.00 H new ATOM 0 HG23 ILE A 459 17.628 -7.806 -18.436 1.00 0.00 H new ATOM 0 HD11 ILE A 459 14.420 -5.067 -17.795 1.00 0.00 H new ATOM 0 HD12 ILE A 459 14.995 -4.847 -19.464 1.00 0.00 H new ATOM 0 HD13 ILE A 459 14.944 -6.476 -18.748 1.00 0.00 H new ATOM 146 N ASP A 460 20.649 -6.987 -19.439 1.00 0.00 N ATOM 147 CA ASP A 460 21.578 -7.538 -20.436 1.00 0.00 C ATOM 148 C ASP A 460 20.875 -7.705 -21.807 1.00 0.00 C ATOM 149 O ASP A 460 19.665 -7.966 -21.847 1.00 0.00 O ATOM 150 CB ASP A 460 22.102 -8.892 -19.918 1.00 0.00 C ATOM 151 CG ASP A 460 23.224 -9.485 -20.777 1.00 0.00 C ATOM 152 OD1 ASP A 460 24.402 -9.183 -20.517 1.00 0.00 O ATOM 153 OD2 ASP A 460 22.927 -10.251 -21.714 1.00 0.00 O ATOM 0 H ASP A 460 20.425 -7.638 -18.686 1.00 0.00 H new ATOM 0 HA ASP A 460 22.413 -6.853 -20.581 1.00 0.00 H new ATOM 0 HB2 ASP A 460 22.465 -8.765 -18.898 1.00 0.00 H new ATOM 0 HB3 ASP A 460 21.275 -9.600 -19.876 1.00 0.00 H new ATOM 158 N LEU A 461 21.642 -7.560 -22.915 1.00 0.00 N ATOM 159 CA LEU A 461 21.096 -7.638 -24.295 1.00 0.00 C ATOM 160 C LEU A 461 20.497 -9.035 -24.584 1.00 0.00 C ATOM 161 O LEU A 461 19.426 -9.143 -25.184 1.00 0.00 O ATOM 162 CB LEU A 461 22.157 -7.244 -25.380 1.00 0.00 C ATOM 163 CG LEU A 461 23.365 -8.221 -25.641 1.00 0.00 C ATOM 164 CD1 LEU A 461 24.145 -7.830 -26.918 1.00 0.00 C ATOM 165 CD2 LEU A 461 24.326 -8.306 -24.436 1.00 0.00 C ATOM 0 H LEU A 461 22.647 -7.387 -22.880 1.00 0.00 H new ATOM 0 HA LEU A 461 20.292 -6.905 -24.356 1.00 0.00 H new ATOM 0 HB2 LEU A 461 21.630 -7.109 -26.325 1.00 0.00 H new ATOM 0 HB3 LEU A 461 22.569 -6.274 -25.103 1.00 0.00 H new ATOM 0 HG LEU A 461 22.930 -9.210 -25.787 1.00 0.00 H new ATOM 0 HD11 LEU A 461 24.971 -8.525 -27.067 1.00 0.00 H new ATOM 0 HD12 LEU A 461 23.477 -7.870 -27.779 1.00 0.00 H new ATOM 0 HD13 LEU A 461 24.537 -6.819 -26.810 1.00 0.00 H new ATOM 0 HD21 LEU A 461 25.141 -8.992 -24.668 1.00 0.00 H new ATOM 0 HD22 LEU A 461 24.733 -7.317 -24.225 1.00 0.00 H new ATOM 0 HD23 LEU A 461 23.784 -8.669 -23.563 1.00 0.00 H new ATOM 177 N GLU A 462 21.200 -10.091 -24.129 1.00 0.00 N ATOM 178 CA GLU A 462 20.722 -11.491 -24.214 1.00 0.00 C ATOM 179 C GLU A 462 19.731 -11.763 -23.066 1.00 0.00 C ATOM 180 O GLU A 462 18.809 -12.582 -23.188 1.00 0.00 O ATOM 181 CB GLU A 462 21.915 -12.484 -24.127 1.00 0.00 C ATOM 182 CG GLU A 462 23.111 -12.146 -25.031 1.00 0.00 C ATOM 183 CD GLU A 462 24.217 -13.214 -24.972 1.00 0.00 C ATOM 184 OE1 GLU A 462 24.867 -13.350 -23.918 1.00 0.00 O ATOM 185 OE2 GLU A 462 24.440 -13.918 -25.980 1.00 0.00 O ATOM 0 H GLU A 462 22.117 -10.000 -23.691 1.00 0.00 H new ATOM 0 HA GLU A 462 20.223 -11.636 -25.172 1.00 0.00 H new ATOM 0 HB2 GLU A 462 22.260 -12.524 -23.094 1.00 0.00 H new ATOM 0 HB3 GLU A 462 21.557 -13.481 -24.382 1.00 0.00 H new ATOM 0 HG2 GLU A 462 22.766 -12.042 -26.060 1.00 0.00 H new ATOM 0 HG3 GLU A 462 23.525 -11.182 -24.734 1.00 0.00 H new ATOM 192 N GLY A 463 19.950 -11.041 -21.957 1.00 0.00 N ATOM 193 CA GLY A 463 19.160 -11.167 -20.741 1.00 0.00 C ATOM 194 C GLY A 463 19.754 -12.168 -19.766 1.00 0.00 C ATOM 195 O GLY A 463 19.021 -12.925 -19.118 1.00 0.00 O ATOM 0 H GLY A 463 20.693 -10.346 -21.887 1.00 0.00 H new ATOM 0 HA2 GLY A 463 19.085 -10.193 -20.257 1.00 0.00 H new ATOM 0 HA3 GLY A 463 18.146 -11.473 -21.000 1.00 0.00 H new ATOM 199 N LYS A 464 21.095 -12.160 -19.658 1.00 0.00 N ATOM 200 CA LYS A 464 21.839 -13.025 -18.723 1.00 0.00 C ATOM 201 C LYS A 464 21.619 -12.544 -17.274 1.00 0.00 C ATOM 202 O LYS A 464 21.824 -13.300 -16.321 1.00 0.00 O ATOM 203 CB LYS A 464 23.356 -13.020 -19.070 1.00 0.00 C ATOM 204 CG LYS A 464 23.686 -13.299 -20.561 1.00 0.00 C ATOM 205 CD LYS A 464 23.162 -14.661 -21.082 1.00 0.00 C ATOM 206 CE LYS A 464 23.870 -15.870 -20.450 1.00 0.00 C ATOM 207 NZ LYS A 464 23.358 -17.149 -21.001 1.00 0.00 N ATOM 0 H LYS A 464 21.694 -11.553 -20.217 1.00 0.00 H new ATOM 0 HA LYS A 464 21.468 -14.046 -18.816 1.00 0.00 H new ATOM 0 HB2 LYS A 464 23.773 -12.051 -18.796 1.00 0.00 H new ATOM 0 HB3 LYS A 464 23.857 -13.768 -18.456 1.00 0.00 H new ATOM 0 HG2 LYS A 464 23.262 -12.502 -21.171 1.00 0.00 H new ATOM 0 HG3 LYS A 464 24.767 -13.263 -20.695 1.00 0.00 H new ATOM 0 HD2 LYS A 464 22.093 -14.731 -20.883 1.00 0.00 H new ATOM 0 HD3 LYS A 464 23.288 -14.700 -22.164 1.00 0.00 H new ATOM 0 HE2 LYS A 464 24.943 -15.799 -20.629 1.00 0.00 H new ATOM 0 HE3 LYS A 464 23.725 -15.854 -19.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 23.857 -17.944 -20.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 22.339 -17.227 -20.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 23.519 -17.174 -22.028 1.00 0.00 H new ATOM 221 N PHE A 465 21.199 -11.269 -17.148 1.00 0.00 N ATOM 222 CA PHE A 465 20.875 -10.643 -15.867 1.00 0.00 C ATOM 223 C PHE A 465 19.852 -9.509 -16.070 1.00 0.00 C ATOM 224 O PHE A 465 19.666 -9.012 -17.190 1.00 0.00 O ATOM 225 CB PHE A 465 22.171 -10.129 -15.173 1.00 0.00 C ATOM 226 CG PHE A 465 22.819 -8.872 -15.769 1.00 0.00 C ATOM 227 CD1 PHE A 465 22.431 -7.598 -15.349 1.00 0.00 C ATOM 228 CD2 PHE A 465 23.807 -8.961 -16.751 1.00 0.00 C ATOM 229 CE1 PHE A 465 23.001 -6.456 -15.890 1.00 0.00 C ATOM 230 CE2 PHE A 465 24.380 -7.820 -17.290 1.00 0.00 C ATOM 231 CZ PHE A 465 23.975 -6.568 -16.862 1.00 0.00 C ATOM 0 H PHE A 465 21.077 -10.645 -17.946 1.00 0.00 H new ATOM 0 HA PHE A 465 20.421 -11.386 -15.212 1.00 0.00 H new ATOM 0 HB2 PHE A 465 21.941 -9.930 -14.126 1.00 0.00 H new ATOM 0 HB3 PHE A 465 22.908 -10.932 -15.190 1.00 0.00 H new ATOM 0 HD1 PHE A 465 21.672 -7.500 -14.587 1.00 0.00 H new ATOM 0 HD2 PHE A 465 24.129 -9.932 -17.096 1.00 0.00 H new ATOM 0 HE1 PHE A 465 22.684 -5.481 -15.552 1.00 0.00 H new ATOM 0 HE2 PHE A 465 25.145 -7.908 -18.047 1.00 0.00 H new ATOM 0 HZ PHE A 465 24.420 -5.681 -17.287 1.00 0.00 H new ATOM 241 N VAL A 466 19.199 -9.120 -14.965 1.00 0.00 N ATOM 242 CA VAL A 466 18.306 -7.953 -14.879 1.00 0.00 C ATOM 243 C VAL A 466 18.731 -7.137 -13.641 1.00 0.00 C ATOM 244 O VAL A 466 18.602 -7.605 -12.500 1.00 0.00 O ATOM 245 CB VAL A 466 16.777 -8.358 -14.783 1.00 0.00 C ATOM 246 CG1 VAL A 466 15.866 -7.117 -14.558 1.00 0.00 C ATOM 247 CG2 VAL A 466 16.326 -9.154 -16.041 1.00 0.00 C ATOM 0 H VAL A 466 19.279 -9.622 -14.081 1.00 0.00 H new ATOM 0 HA VAL A 466 18.400 -7.364 -15.791 1.00 0.00 H new ATOM 0 HB VAL A 466 16.670 -9.007 -13.914 1.00 0.00 H new ATOM 0 HG11 VAL A 466 14.825 -7.436 -14.498 1.00 0.00 H new ATOM 0 HG12 VAL A 466 16.148 -6.622 -13.629 1.00 0.00 H new ATOM 0 HG13 VAL A 466 15.985 -6.423 -15.390 1.00 0.00 H new ATOM 0 HG21 VAL A 466 15.273 -9.418 -15.946 1.00 0.00 H new ATOM 0 HG22 VAL A 466 16.468 -8.540 -16.930 1.00 0.00 H new ATOM 0 HG23 VAL A 466 16.921 -10.063 -16.129 1.00 0.00 H new ATOM 257 N GLN A 467 19.278 -5.942 -13.892 1.00 0.00 N ATOM 258 CA GLN A 467 19.740 -5.012 -12.853 1.00 0.00 C ATOM 259 C GLN A 467 18.570 -4.122 -12.385 1.00 0.00 C ATOM 260 O GLN A 467 17.933 -3.439 -13.194 1.00 0.00 O ATOM 261 CB GLN A 467 20.898 -4.134 -13.420 1.00 0.00 C ATOM 262 CG GLN A 467 21.424 -3.031 -12.473 1.00 0.00 C ATOM 263 CD GLN A 467 22.097 -3.581 -11.211 1.00 0.00 C ATOM 264 OE1 GLN A 467 21.447 -3.809 -10.188 1.00 0.00 O ATOM 265 NE2 GLN A 467 23.399 -3.822 -11.271 1.00 0.00 N ATOM 0 H GLN A 467 19.415 -5.587 -14.839 1.00 0.00 H new ATOM 0 HA GLN A 467 20.109 -5.577 -11.997 1.00 0.00 H new ATOM 0 HB2 GLN A 467 21.729 -4.787 -13.685 1.00 0.00 H new ATOM 0 HB3 GLN A 467 20.556 -3.664 -14.342 1.00 0.00 H new ATOM 0 HG2 GLN A 467 22.137 -2.408 -13.014 1.00 0.00 H new ATOM 0 HG3 GLN A 467 20.594 -2.387 -12.182 1.00 0.00 H new ATOM 0 HE21 GLN A 467 23.915 -3.625 -12.128 1.00 0.00 H new ATOM 0 HE22 GLN A 467 23.885 -4.204 -10.460 1.00 0.00 H new ATOM 274 N LEU A 468 18.293 -4.156 -11.076 1.00 0.00 N ATOM 275 CA LEU A 468 17.308 -3.284 -10.412 1.00 0.00 C ATOM 276 C LEU A 468 18.067 -2.328 -9.479 1.00 0.00 C ATOM 277 O LEU A 468 19.178 -2.648 -9.055 1.00 0.00 O ATOM 278 CB LEU A 468 16.295 -4.125 -9.592 1.00 0.00 C ATOM 279 CG LEU A 468 15.551 -5.268 -10.344 1.00 0.00 C ATOM 280 CD1 LEU A 468 14.600 -6.013 -9.394 1.00 0.00 C ATOM 281 CD2 LEU A 468 14.800 -4.751 -11.585 1.00 0.00 C ATOM 0 H LEU A 468 18.754 -4.801 -10.434 1.00 0.00 H new ATOM 0 HA LEU A 468 16.750 -2.724 -11.162 1.00 0.00 H new ATOM 0 HB2 LEU A 468 16.825 -4.565 -8.747 1.00 0.00 H new ATOM 0 HB3 LEU A 468 15.547 -3.447 -9.181 1.00 0.00 H new ATOM 0 HG LEU A 468 16.306 -5.970 -10.698 1.00 0.00 H new ATOM 0 HD11 LEU A 468 14.090 -6.807 -9.939 1.00 0.00 H new ATOM 0 HD12 LEU A 468 15.171 -6.445 -8.573 1.00 0.00 H new ATOM 0 HD13 LEU A 468 13.863 -5.315 -8.996 1.00 0.00 H new ATOM 0 HD21 LEU A 468 14.296 -5.582 -12.078 1.00 0.00 H new ATOM 0 HD22 LEU A 468 14.062 -4.008 -11.281 1.00 0.00 H new ATOM 0 HD23 LEU A 468 15.509 -4.296 -12.276 1.00 0.00 H new ATOM 293 N LYS A 469 17.458 -1.186 -9.134 1.00 0.00 N ATOM 294 CA LYS A 469 18.094 -0.170 -8.268 1.00 0.00 C ATOM 295 C LYS A 469 16.995 0.528 -7.450 1.00 0.00 C ATOM 296 O LYS A 469 16.012 1.009 -8.020 1.00 0.00 O ATOM 297 CB LYS A 469 18.892 0.838 -9.172 1.00 0.00 C ATOM 298 CG LYS A 469 19.993 1.698 -8.489 1.00 0.00 C ATOM 299 CD LYS A 469 19.459 2.842 -7.592 1.00 0.00 C ATOM 300 CE LYS A 469 18.567 3.851 -8.343 1.00 0.00 C ATOM 301 NZ LYS A 469 19.271 4.499 -9.484 1.00 0.00 N ATOM 0 H LYS A 469 16.518 -0.936 -9.442 1.00 0.00 H new ATOM 0 HA LYS A 469 18.800 -0.622 -7.571 1.00 0.00 H new ATOM 0 HB2 LYS A 469 19.359 0.271 -9.977 1.00 0.00 H new ATOM 0 HB3 LYS A 469 18.174 1.516 -9.635 1.00 0.00 H new ATOM 0 HG2 LYS A 469 20.622 1.045 -7.885 1.00 0.00 H new ATOM 0 HG3 LYS A 469 20.630 2.128 -9.262 1.00 0.00 H new ATOM 0 HD2 LYS A 469 18.891 2.411 -6.768 1.00 0.00 H new ATOM 0 HD3 LYS A 469 20.304 3.373 -7.153 1.00 0.00 H new ATOM 0 HE2 LYS A 469 17.678 3.340 -8.712 1.00 0.00 H new ATOM 0 HE3 LYS A 469 18.227 4.618 -7.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 469 18.772 5.372 -9.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 469 20.246 4.729 -9.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 469 19.287 3.849 -10.296 1.00 0.00 H new ATOM 315 N ASN A 470 17.192 0.617 -6.125 1.00 0.00 N ATOM 316 CA ASN A 470 16.234 1.282 -5.201 1.00 0.00 C ATOM 317 C ASN A 470 16.606 2.761 -5.024 1.00 0.00 C ATOM 318 O ASN A 470 17.764 3.086 -4.743 1.00 0.00 O ATOM 319 CB ASN A 470 16.194 0.570 -3.814 1.00 0.00 C ATOM 320 CG ASN A 470 15.217 1.202 -2.809 1.00 0.00 C ATOM 321 OD1 ASN A 470 14.194 1.773 -3.184 1.00 0.00 O ATOM 322 ND2 ASN A 470 15.525 1.091 -1.525 1.00 0.00 N ATOM 0 H ASN A 470 18.014 0.235 -5.657 1.00 0.00 H new ATOM 0 HA ASN A 470 15.240 1.213 -5.644 1.00 0.00 H new ATOM 0 HB2 ASN A 470 15.920 -0.475 -3.962 1.00 0.00 H new ATOM 0 HB3 ASN A 470 17.196 0.579 -3.385 1.00 0.00 H new ATOM 0 HD21 ASN A 470 14.906 1.485 -0.816 1.00 0.00 H new ATOM 0 HD22 ASN A 470 16.381 0.612 -1.245 1.00 0.00 H new ATOM 329 N ASN A 471 15.603 3.640 -5.178 1.00 0.00 N ATOM 330 CA ASN A 471 15.750 5.096 -5.040 1.00 0.00 C ATOM 331 C ASN A 471 14.562 5.653 -4.226 1.00 0.00 C ATOM 332 O ASN A 471 13.528 6.060 -4.766 1.00 0.00 O ATOM 333 CB ASN A 471 15.907 5.805 -6.428 1.00 0.00 C ATOM 334 CG ASN A 471 14.796 5.536 -7.467 1.00 0.00 C ATOM 335 OD1 ASN A 471 14.431 4.278 -7.686 1.00 0.00 O flip ATOM 336 ND2 ASN A 471 14.322 6.461 -8.121 1.00 0.00 N flip ATOM 0 H ASN A 471 14.651 3.353 -5.406 1.00 0.00 H new ATOM 0 HA ASN A 471 16.671 5.308 -4.498 1.00 0.00 H new ATOM 0 HB2 ASN A 471 15.962 6.880 -6.258 1.00 0.00 H new ATOM 0 HB3 ASN A 471 16.860 5.501 -6.861 1.00 0.00 H new ATOM 0 HD21 ASN A 471 14.617 7.420 -7.936 1.00 0.00 H new ATOM 0 HD22 ASN A 471 13.634 6.270 -8.849 1.00 0.00 H new ATOM 343 N SER A 472 14.719 5.590 -2.894 1.00 0.00 N ATOM 344 CA SER A 472 13.738 6.094 -1.912 1.00 0.00 C ATOM 345 C SER A 472 14.472 6.642 -0.660 1.00 0.00 C ATOM 346 O SER A 472 15.678 6.918 -0.716 1.00 0.00 O ATOM 347 CB SER A 472 12.731 4.975 -1.550 1.00 0.00 C ATOM 348 OG SER A 472 11.903 4.637 -2.648 1.00 0.00 O ATOM 0 H SER A 472 15.545 5.180 -2.459 1.00 0.00 H new ATOM 0 HA SER A 472 13.173 6.918 -2.348 1.00 0.00 H new ATOM 0 HB2 SER A 472 13.275 4.090 -1.219 1.00 0.00 H new ATOM 0 HB3 SER A 472 12.111 5.300 -0.714 1.00 0.00 H new ATOM 0 HG SER A 472 11.251 3.960 -2.370 1.00 0.00 H new ATOM 354 N ASP A 473 13.735 6.818 0.462 1.00 0.00 N ATOM 355 CA ASP A 473 14.260 7.468 1.688 1.00 0.00 C ATOM 356 C ASP A 473 15.124 6.497 2.504 1.00 0.00 C ATOM 357 O ASP A 473 16.242 6.821 2.917 1.00 0.00 O ATOM 358 CB ASP A 473 13.092 7.979 2.585 1.00 0.00 C ATOM 359 CG ASP A 473 11.930 8.632 1.812 1.00 0.00 C ATOM 360 OD1 ASP A 473 11.965 9.857 1.563 1.00 0.00 O ATOM 361 OD2 ASP A 473 10.973 7.905 1.438 1.00 0.00 O ATOM 0 H ASP A 473 12.764 6.515 0.544 1.00 0.00 H new ATOM 0 HA ASP A 473 14.873 8.311 1.369 1.00 0.00 H new ATOM 0 HB2 ASP A 473 12.702 7.141 3.163 1.00 0.00 H new ATOM 0 HB3 ASP A 473 13.488 8.702 3.299 1.00 0.00 H new ATOM 366 N LYS A 474 14.576 5.300 2.721 1.00 0.00 N ATOM 367 CA LYS A 474 15.156 4.278 3.606 1.00 0.00 C ATOM 368 C LYS A 474 15.131 2.911 2.901 1.00 0.00 C ATOM 369 O LYS A 474 14.695 2.793 1.742 1.00 0.00 O ATOM 370 CB LYS A 474 14.418 4.206 4.988 1.00 0.00 C ATOM 371 CG LYS A 474 12.915 3.818 4.945 1.00 0.00 C ATOM 372 CD LYS A 474 12.007 4.977 4.467 1.00 0.00 C ATOM 373 CE LYS A 474 10.564 4.550 4.188 1.00 0.00 C ATOM 374 NZ LYS A 474 9.764 5.668 3.620 1.00 0.00 N ATOM 0 H LYS A 474 13.704 5.005 2.282 1.00 0.00 H new ATOM 0 HA LYS A 474 16.188 4.559 3.815 1.00 0.00 H new ATOM 0 HB2 LYS A 474 14.940 3.485 5.617 1.00 0.00 H new ATOM 0 HB3 LYS A 474 14.507 5.177 5.475 1.00 0.00 H new ATOM 0 HG2 LYS A 474 12.784 2.963 4.281 1.00 0.00 H new ATOM 0 HG3 LYS A 474 12.598 3.501 5.939 1.00 0.00 H new ATOM 0 HD2 LYS A 474 12.005 5.762 5.224 1.00 0.00 H new ATOM 0 HD3 LYS A 474 12.431 5.409 3.561 1.00 0.00 H new ATOM 0 HE2 LYS A 474 10.560 3.709 3.494 1.00 0.00 H new ATOM 0 HE3 LYS A 474 10.101 4.203 5.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 8.936 5.284 3.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 9.447 6.293 4.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 10.349 6.210 2.952 1.00 0.00 H new ATOM 388 N ASP A 475 15.664 1.908 3.599 1.00 0.00 N ATOM 389 CA ASP A 475 15.680 0.503 3.167 1.00 0.00 C ATOM 390 C ASP A 475 14.259 0.002 2.797 1.00 0.00 C ATOM 391 O ASP A 475 13.364 -0.061 3.641 1.00 0.00 O ATOM 392 CB ASP A 475 16.345 -0.366 4.283 1.00 0.00 C ATOM 393 CG ASP A 475 15.654 -0.258 5.662 1.00 0.00 C ATOM 394 OD1 ASP A 475 15.782 0.799 6.319 1.00 0.00 O ATOM 395 OD2 ASP A 475 14.977 -1.223 6.092 1.00 0.00 O ATOM 0 H ASP A 475 16.110 2.050 4.505 1.00 0.00 H new ATOM 0 HA ASP A 475 16.273 0.412 2.257 1.00 0.00 H new ATOM 0 HB2 ASP A 475 16.341 -1.409 3.967 1.00 0.00 H new ATOM 0 HB3 ASP A 475 17.388 -0.068 4.387 1.00 0.00 H new ATOM 400 N GLN A 476 14.063 -0.275 1.493 1.00 0.00 N ATOM 401 CA GLN A 476 12.805 -0.818 0.951 1.00 0.00 C ATOM 402 C GLN A 476 12.658 -2.305 1.314 1.00 0.00 C ATOM 403 O GLN A 476 13.449 -3.141 0.854 1.00 0.00 O ATOM 404 CB GLN A 476 12.743 -0.622 -0.596 1.00 0.00 C ATOM 405 CG GLN A 476 11.590 -1.372 -1.323 1.00 0.00 C ATOM 406 CD GLN A 476 10.188 -1.042 -0.791 1.00 0.00 C ATOM 407 OE1 GLN A 476 9.919 0.073 -0.350 1.00 0.00 O ATOM 408 NE2 GLN A 476 9.294 -2.019 -0.807 1.00 0.00 N ATOM 0 H GLN A 476 14.779 -0.127 0.782 1.00 0.00 H new ATOM 0 HA GLN A 476 11.975 -0.272 1.399 1.00 0.00 H new ATOM 0 HB2 GLN A 476 12.648 0.443 -0.806 1.00 0.00 H new ATOM 0 HB3 GLN A 476 13.691 -0.948 -1.024 1.00 0.00 H new ATOM 0 HG2 GLN A 476 11.629 -1.131 -2.385 1.00 0.00 H new ATOM 0 HG3 GLN A 476 11.757 -2.445 -1.233 1.00 0.00 H new ATOM 0 HE21 GLN A 476 9.546 -2.935 -1.179 1.00 0.00 H new ATOM 0 HE22 GLN A 476 8.354 -1.856 -0.447 1.00 0.00 H new ATOM 417 N SER A 477 11.656 -2.616 2.153 1.00 0.00 N ATOM 418 CA SER A 477 11.277 -3.995 2.470 1.00 0.00 C ATOM 419 C SER A 477 10.755 -4.693 1.194 1.00 0.00 C ATOM 420 O SER A 477 9.617 -4.463 0.759 1.00 0.00 O ATOM 421 CB SER A 477 10.224 -4.011 3.607 1.00 0.00 C ATOM 422 OG SER A 477 9.895 -5.335 4.012 1.00 0.00 O ATOM 0 H SER A 477 11.088 -1.915 2.629 1.00 0.00 H new ATOM 0 HA SER A 477 12.148 -4.546 2.824 1.00 0.00 H new ATOM 0 HB2 SER A 477 10.606 -3.455 4.463 1.00 0.00 H new ATOM 0 HB3 SER A 477 9.321 -3.500 3.272 1.00 0.00 H new ATOM 0 HG SER A 477 9.230 -5.301 4.731 1.00 0.00 H new ATOM 428 N LEU A 478 11.626 -5.507 0.580 1.00 0.00 N ATOM 429 CA LEU A 478 11.348 -6.170 -0.702 1.00 0.00 C ATOM 430 C LEU A 478 10.702 -7.548 -0.421 1.00 0.00 C ATOM 431 O LEU A 478 10.703 -8.016 0.724 1.00 0.00 O ATOM 432 CB LEU A 478 12.683 -6.287 -1.507 1.00 0.00 C ATOM 433 CG LEU A 478 12.554 -6.406 -3.059 1.00 0.00 C ATOM 434 CD1 LEU A 478 11.895 -5.150 -3.661 1.00 0.00 C ATOM 435 CD2 LEU A 478 13.923 -6.671 -3.723 1.00 0.00 C ATOM 0 H LEU A 478 12.547 -5.725 0.961 1.00 0.00 H new ATOM 0 HA LEU A 478 10.647 -5.594 -1.306 1.00 0.00 H new ATOM 0 HB2 LEU A 478 13.295 -5.413 -1.282 1.00 0.00 H new ATOM 0 HB3 LEU A 478 13.226 -7.159 -1.142 1.00 0.00 H new ATOM 0 HG LEU A 478 11.911 -7.261 -3.265 1.00 0.00 H new ATOM 0 HD11 LEU A 478 11.819 -5.262 -4.743 1.00 0.00 H new ATOM 0 HD12 LEU A 478 10.898 -5.024 -3.238 1.00 0.00 H new ATOM 0 HD13 LEU A 478 12.501 -4.274 -3.429 1.00 0.00 H new ATOM 0 HD21 LEU A 478 13.795 -6.748 -4.803 1.00 0.00 H new ATOM 0 HD22 LEU A 478 14.603 -5.850 -3.496 1.00 0.00 H new ATOM 0 HD23 LEU A 478 14.339 -7.603 -3.340 1.00 0.00 H new ATOM 447 N GLY A 479 10.112 -8.173 -1.446 1.00 0.00 N ATOM 448 CA GLY A 479 9.479 -9.485 -1.279 1.00 0.00 C ATOM 449 C GLY A 479 8.227 -9.621 -2.107 1.00 0.00 C ATOM 450 O GLY A 479 8.173 -10.393 -3.063 1.00 0.00 O ATOM 0 H GLY A 479 10.060 -7.795 -2.392 1.00 0.00 H new ATOM 0 HA2 GLY A 479 10.185 -10.266 -1.560 1.00 0.00 H new ATOM 0 HA3 GLY A 479 9.236 -9.638 -0.228 1.00 0.00 H new ATOM 454 N ASN A 480 7.231 -8.811 -1.750 1.00 0.00 N ATOM 455 CA ASN A 480 5.916 -8.762 -2.428 1.00 0.00 C ATOM 456 C ASN A 480 6.032 -8.246 -3.885 1.00 0.00 C ATOM 457 O ASN A 480 5.081 -8.346 -4.672 1.00 0.00 O ATOM 458 CB ASN A 480 4.956 -7.881 -1.603 1.00 0.00 C ATOM 459 CG ASN A 480 4.729 -8.415 -0.184 1.00 0.00 C ATOM 460 OD1 ASN A 480 3.801 -9.180 0.061 1.00 0.00 O ATOM 461 ND2 ASN A 480 5.593 -8.039 0.758 1.00 0.00 N ATOM 0 H ASN A 480 7.306 -8.157 -0.971 1.00 0.00 H new ATOM 0 HA ASN A 480 5.520 -9.775 -2.490 1.00 0.00 H new ATOM 0 HB2 ASN A 480 5.358 -6.869 -1.545 1.00 0.00 H new ATOM 0 HB3 ASN A 480 3.998 -7.814 -2.119 1.00 0.00 H new ATOM 0 HD21 ASN A 480 5.492 -8.388 1.711 1.00 0.00 H new ATOM 0 HD22 ASN A 480 6.355 -7.402 0.526 1.00 0.00 H new ATOM 468 N TRP A 481 7.209 -7.678 -4.210 1.00 0.00 N ATOM 469 CA TRP A 481 7.573 -7.240 -5.563 1.00 0.00 C ATOM 470 C TRP A 481 7.888 -8.468 -6.436 1.00 0.00 C ATOM 471 O TRP A 481 8.388 -9.485 -5.931 1.00 0.00 O ATOM 472 CB TRP A 481 8.797 -6.288 -5.499 1.00 0.00 C ATOM 473 CG TRP A 481 8.547 -4.984 -4.758 1.00 0.00 C ATOM 474 CD1 TRP A 481 8.146 -4.823 -3.455 1.00 0.00 C ATOM 475 CD2 TRP A 481 8.720 -3.661 -5.280 1.00 0.00 C ATOM 476 NE1 TRP A 481 8.050 -3.490 -3.154 1.00 0.00 N ATOM 477 CE2 TRP A 481 8.395 -2.758 -4.254 1.00 0.00 C ATOM 478 CE3 TRP A 481 9.110 -3.157 -6.525 1.00 0.00 C ATOM 479 CZ2 TRP A 481 8.448 -1.380 -4.429 1.00 0.00 C ATOM 480 CZ3 TRP A 481 9.161 -1.788 -6.698 1.00 0.00 C ATOM 481 CH2 TRP A 481 8.831 -0.913 -5.655 1.00 0.00 C ATOM 0 H TRP A 481 7.944 -7.509 -3.524 1.00 0.00 H new ATOM 0 HA TRP A 481 6.737 -6.699 -6.007 1.00 0.00 H new ATOM 0 HB2 TRP A 481 9.623 -6.812 -5.018 1.00 0.00 H new ATOM 0 HB3 TRP A 481 9.115 -6.058 -6.516 1.00 0.00 H new ATOM 0 HD1 TRP A 481 7.937 -5.629 -2.768 1.00 0.00 H new ATOM 0 HE1 TRP A 481 7.766 -3.106 -2.253 1.00 0.00 H new ATOM 0 HE3 TRP A 481 9.366 -3.825 -7.334 1.00 0.00 H new ATOM 0 HZ2 TRP A 481 8.196 -0.703 -3.626 1.00 0.00 H new ATOM 0 HZ3 TRP A 481 9.461 -1.385 -7.654 1.00 0.00 H new ATOM 0 HH2 TRP A 481 8.880 0.153 -5.823 1.00 0.00 H new ATOM 492 N ARG A 482 7.603 -8.361 -7.743 1.00 0.00 N ATOM 493 CA ARG A 482 7.747 -9.481 -8.692 1.00 0.00 C ATOM 494 C ARG A 482 8.119 -8.975 -10.097 1.00 0.00 C ATOM 495 O ARG A 482 7.531 -8.018 -10.606 1.00 0.00 O ATOM 496 CB ARG A 482 6.441 -10.336 -8.733 1.00 0.00 C ATOM 497 CG ARG A 482 5.148 -9.516 -8.926 1.00 0.00 C ATOM 498 CD ARG A 482 3.870 -10.373 -8.955 1.00 0.00 C ATOM 499 NE ARG A 482 2.652 -9.542 -8.843 1.00 0.00 N ATOM 500 CZ ARG A 482 1.972 -9.315 -7.701 1.00 0.00 C ATOM 501 NH1 ARG A 482 2.373 -9.847 -6.549 1.00 0.00 N ATOM 502 NH2 ARG A 482 0.892 -8.558 -7.720 1.00 0.00 N ATOM 0 H ARG A 482 7.267 -7.499 -8.173 1.00 0.00 H new ATOM 0 HA ARG A 482 8.561 -10.117 -8.344 1.00 0.00 H new ATOM 0 HB2 ARG A 482 6.521 -11.061 -9.543 1.00 0.00 H new ATOM 0 HB3 ARG A 482 6.363 -10.902 -7.805 1.00 0.00 H new ATOM 0 HG2 ARG A 482 5.067 -8.786 -8.120 1.00 0.00 H new ATOM 0 HG3 ARG A 482 5.220 -8.955 -9.858 1.00 0.00 H new ATOM 0 HD2 ARG A 482 3.836 -10.945 -9.882 1.00 0.00 H new ATOM 0 HD3 ARG A 482 3.896 -11.093 -8.137 1.00 0.00 H new ATOM 0 HE ARG A 482 2.299 -9.107 -9.695 1.00 0.00 H new ATOM 0 HH11 ARG A 482 3.205 -10.436 -6.522 1.00 0.00 H new ATOM 0 HH12 ARG A 482 1.848 -9.666 -5.693 1.00 0.00 H new ATOM 0 HH21 ARG A 482 0.573 -8.146 -8.597 1.00 0.00 H new ATOM 0 HH22 ARG A 482 0.376 -8.385 -6.858 1.00 0.00 H new ATOM 516 N ILE A 483 9.107 -9.639 -10.702 1.00 0.00 N ATOM 517 CA ILE A 483 9.587 -9.351 -12.048 1.00 0.00 C ATOM 518 C ILE A 483 8.822 -10.215 -13.069 1.00 0.00 C ATOM 519 O ILE A 483 8.923 -11.442 -13.036 1.00 0.00 O ATOM 520 CB ILE A 483 11.126 -9.653 -12.172 1.00 0.00 C ATOM 521 CG1 ILE A 483 11.939 -8.918 -11.064 1.00 0.00 C ATOM 522 CG2 ILE A 483 11.654 -9.291 -13.580 1.00 0.00 C ATOM 523 CD1 ILE A 483 13.437 -9.190 -11.100 1.00 0.00 C ATOM 0 H ILE A 483 9.605 -10.409 -10.255 1.00 0.00 H new ATOM 0 HA ILE A 483 9.417 -8.293 -12.250 1.00 0.00 H new ATOM 0 HB ILE A 483 11.264 -10.725 -12.028 1.00 0.00 H new ATOM 0 HG12 ILE A 483 11.774 -7.845 -11.161 1.00 0.00 H new ATOM 0 HG13 ILE A 483 11.551 -9.214 -10.089 1.00 0.00 H new ATOM 0 HG21 ILE A 483 12.720 -9.510 -13.636 1.00 0.00 H new ATOM 0 HG22 ILE A 483 11.123 -9.878 -14.330 1.00 0.00 H new ATOM 0 HG23 ILE A 483 11.492 -8.230 -13.768 1.00 0.00 H new ATOM 0 HD11 ILE A 483 13.926 -8.640 -10.296 1.00 0.00 H new ATOM 0 HD12 ILE A 483 13.616 -10.257 -10.971 1.00 0.00 H new ATOM 0 HD13 ILE A 483 13.842 -8.867 -12.059 1.00 0.00 H new ATOM 535 N LYS A 484 8.042 -9.569 -13.943 1.00 0.00 N ATOM 536 CA LYS A 484 7.511 -10.198 -15.161 1.00 0.00 C ATOM 537 C LYS A 484 8.628 -10.202 -16.219 1.00 0.00 C ATOM 538 O LYS A 484 9.423 -9.257 -16.274 1.00 0.00 O ATOM 539 CB LYS A 484 6.294 -9.406 -15.717 1.00 0.00 C ATOM 540 CG LYS A 484 5.087 -9.285 -14.765 1.00 0.00 C ATOM 541 CD LYS A 484 3.958 -8.410 -15.372 1.00 0.00 C ATOM 542 CE LYS A 484 2.692 -8.361 -14.500 1.00 0.00 C ATOM 543 NZ LYS A 484 2.051 -9.692 -14.366 1.00 0.00 N ATOM 0 H LYS A 484 7.760 -8.596 -13.827 1.00 0.00 H new ATOM 0 HA LYS A 484 7.181 -11.210 -14.926 1.00 0.00 H new ATOM 0 HB2 LYS A 484 6.627 -8.403 -15.982 1.00 0.00 H new ATOM 0 HB3 LYS A 484 5.961 -9.885 -16.638 1.00 0.00 H new ATOM 0 HG2 LYS A 484 4.697 -10.279 -14.544 1.00 0.00 H new ATOM 0 HG3 LYS A 484 5.413 -8.853 -13.819 1.00 0.00 H new ATOM 0 HD2 LYS A 484 4.331 -7.396 -15.516 1.00 0.00 H new ATOM 0 HD3 LYS A 484 3.698 -8.797 -16.357 1.00 0.00 H new ATOM 0 HE2 LYS A 484 2.949 -7.982 -13.511 1.00 0.00 H new ATOM 0 HE3 LYS A 484 1.980 -7.659 -14.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 1.126 -9.587 -13.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 1.920 -10.111 -15.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 2.657 -10.313 -13.793 1.00 0.00 H new ATOM 557 N ARG A 485 8.698 -11.255 -17.037 1.00 0.00 N ATOM 558 CA ARG A 485 9.604 -11.301 -18.191 1.00 0.00 C ATOM 559 C ARG A 485 8.915 -12.042 -19.348 1.00 0.00 C ATOM 560 O ARG A 485 8.860 -13.276 -19.385 1.00 0.00 O ATOM 561 CB ARG A 485 10.969 -11.931 -17.812 1.00 0.00 C ATOM 562 CG ARG A 485 12.011 -11.923 -18.961 1.00 0.00 C ATOM 563 CD ARG A 485 13.438 -12.202 -18.472 1.00 0.00 C ATOM 564 NE ARG A 485 14.378 -12.392 -19.591 1.00 0.00 N ATOM 565 CZ ARG A 485 15.708 -12.474 -19.474 1.00 0.00 C ATOM 566 NH1 ARG A 485 16.321 -12.194 -18.324 1.00 0.00 N ATOM 567 NH2 ARG A 485 16.421 -12.860 -20.515 1.00 0.00 N ATOM 0 H ARG A 485 8.133 -12.096 -16.921 1.00 0.00 H new ATOM 0 HA ARG A 485 9.823 -10.285 -18.520 1.00 0.00 H new ATOM 0 HB2 ARG A 485 11.381 -11.393 -16.959 1.00 0.00 H new ATOM 0 HB3 ARG A 485 10.806 -12.960 -17.491 1.00 0.00 H new ATOM 0 HG2 ARG A 485 11.733 -12.672 -19.702 1.00 0.00 H new ATOM 0 HG3 ARG A 485 11.986 -10.955 -19.461 1.00 0.00 H new ATOM 0 HD2 ARG A 485 13.777 -11.373 -17.851 1.00 0.00 H new ATOM 0 HD3 ARG A 485 13.438 -13.092 -17.843 1.00 0.00 H new ATOM 0 HE ARG A 485 13.983 -12.467 -20.529 1.00 0.00 H new ATOM 0 HH11 ARG A 485 15.775 -11.911 -17.511 1.00 0.00 H new ATOM 0 HH12 ARG A 485 17.336 -12.263 -18.257 1.00 0.00 H new ATOM 0 HH21 ARG A 485 15.957 -13.091 -21.394 1.00 0.00 H new ATOM 0 HH22 ARG A 485 17.436 -12.927 -20.441 1.00 0.00 H new ATOM 581 N GLN A 486 8.365 -11.240 -20.264 1.00 0.00 N ATOM 582 CA GLN A 486 7.568 -11.695 -21.409 1.00 0.00 C ATOM 583 C GLN A 486 8.456 -11.801 -22.659 1.00 0.00 C ATOM 584 O GLN A 486 8.790 -10.780 -23.265 1.00 0.00 O ATOM 585 CB GLN A 486 6.424 -10.666 -21.653 1.00 0.00 C ATOM 586 CG GLN A 486 5.511 -10.966 -22.862 1.00 0.00 C ATOM 587 CD GLN A 486 4.508 -9.842 -23.134 1.00 0.00 C ATOM 588 OE1 GLN A 486 4.789 -8.918 -23.897 1.00 0.00 O ATOM 589 NE2 GLN A 486 3.348 -9.901 -22.500 1.00 0.00 N ATOM 0 H GLN A 486 8.464 -10.225 -20.229 1.00 0.00 H new ATOM 0 HA GLN A 486 7.146 -12.679 -21.202 1.00 0.00 H new ATOM 0 HB2 GLN A 486 5.806 -10.615 -20.756 1.00 0.00 H new ATOM 0 HB3 GLN A 486 6.868 -9.680 -21.790 1.00 0.00 H new ATOM 0 HG2 GLN A 486 6.127 -11.121 -23.748 1.00 0.00 H new ATOM 0 HG3 GLN A 486 4.970 -11.895 -22.683 1.00 0.00 H new ATOM 0 HE21 GLN A 486 3.148 -10.681 -21.875 1.00 0.00 H new ATOM 0 HE22 GLN A 486 2.654 -9.166 -22.637 1.00 0.00 H new ATOM 598 N VAL A 487 8.837 -13.029 -23.045 1.00 0.00 N ATOM 599 CA VAL A 487 9.585 -13.265 -24.303 1.00 0.00 C ATOM 600 C VAL A 487 8.659 -12.950 -25.514 1.00 0.00 C ATOM 601 O VAL A 487 7.443 -13.109 -25.400 1.00 0.00 O ATOM 602 CB VAL A 487 10.175 -14.727 -24.370 1.00 0.00 C ATOM 603 CG1 VAL A 487 11.100 -14.916 -25.601 1.00 0.00 C ATOM 604 CG2 VAL A 487 10.939 -15.069 -23.063 1.00 0.00 C ATOM 0 H VAL A 487 8.643 -13.875 -22.510 1.00 0.00 H new ATOM 0 HA VAL A 487 10.445 -12.596 -24.336 1.00 0.00 H new ATOM 0 HB VAL A 487 9.335 -15.414 -24.477 1.00 0.00 H new ATOM 0 HG11 VAL A 487 11.487 -15.935 -25.612 1.00 0.00 H new ATOM 0 HG12 VAL A 487 10.533 -14.733 -26.514 1.00 0.00 H new ATOM 0 HG13 VAL A 487 11.931 -14.213 -25.543 1.00 0.00 H new ATOM 0 HG21 VAL A 487 11.338 -16.081 -23.129 1.00 0.00 H new ATOM 0 HG22 VAL A 487 11.759 -14.364 -22.926 1.00 0.00 H new ATOM 0 HG23 VAL A 487 10.257 -15.002 -22.215 1.00 0.00 H new ATOM 614 N LEU A 488 9.241 -12.488 -26.653 1.00 0.00 N ATOM 615 CA LEU A 488 8.476 -11.909 -27.801 1.00 0.00 C ATOM 616 C LEU A 488 7.334 -12.816 -28.310 1.00 0.00 C ATOM 617 O LEU A 488 6.296 -12.316 -28.766 1.00 0.00 O ATOM 618 CB LEU A 488 9.416 -11.548 -28.997 1.00 0.00 C ATOM 619 CG LEU A 488 10.015 -12.735 -29.857 1.00 0.00 C ATOM 620 CD1 LEU A 488 10.628 -12.222 -31.183 1.00 0.00 C ATOM 621 CD2 LEU A 488 11.058 -13.568 -29.077 1.00 0.00 C ATOM 0 H LEU A 488 10.249 -12.504 -26.805 1.00 0.00 H new ATOM 0 HA LEU A 488 8.021 -11.003 -27.402 1.00 0.00 H new ATOM 0 HB2 LEU A 488 8.863 -10.894 -29.671 1.00 0.00 H new ATOM 0 HB3 LEU A 488 10.250 -10.968 -28.603 1.00 0.00 H new ATOM 0 HG LEU A 488 9.176 -13.392 -30.089 1.00 0.00 H new ATOM 0 HD11 LEU A 488 11.030 -13.063 -31.748 1.00 0.00 H new ATOM 0 HD12 LEU A 488 9.857 -11.725 -31.772 1.00 0.00 H new ATOM 0 HD13 LEU A 488 11.429 -11.516 -30.964 1.00 0.00 H new ATOM 0 HD21 LEU A 488 11.435 -14.368 -29.714 1.00 0.00 H new ATOM 0 HD22 LEU A 488 11.884 -12.925 -28.774 1.00 0.00 H new ATOM 0 HD23 LEU A 488 10.591 -14.000 -28.192 1.00 0.00 H new ATOM 633 N GLU A 489 7.543 -14.138 -28.229 1.00 0.00 N ATOM 634 CA GLU A 489 6.560 -15.144 -28.683 1.00 0.00 C ATOM 635 C GLU A 489 5.297 -15.141 -27.784 1.00 0.00 C ATOM 636 O GLU A 489 4.174 -15.370 -28.264 1.00 0.00 O ATOM 637 CB GLU A 489 7.236 -16.536 -28.713 1.00 0.00 C ATOM 638 CG GLU A 489 6.352 -17.688 -29.217 1.00 0.00 C ATOM 639 CD GLU A 489 7.136 -18.996 -29.401 1.00 0.00 C ATOM 640 OE1 GLU A 489 7.371 -19.708 -28.399 1.00 0.00 O ATOM 641 OE2 GLU A 489 7.537 -19.315 -30.543 1.00 0.00 O ATOM 0 H GLU A 489 8.397 -14.544 -27.847 1.00 0.00 H new ATOM 0 HA GLU A 489 6.227 -14.892 -29.690 1.00 0.00 H new ATOM 0 HB2 GLU A 489 8.122 -16.477 -29.345 1.00 0.00 H new ATOM 0 HB3 GLU A 489 7.578 -16.777 -27.706 1.00 0.00 H new ATOM 0 HG2 GLU A 489 5.538 -17.853 -28.511 1.00 0.00 H new ATOM 0 HG3 GLU A 489 5.898 -17.404 -30.166 1.00 0.00 H new ATOM 648 N GLY A 490 5.502 -14.870 -26.483 1.00 0.00 N ATOM 649 CA GLY A 490 4.412 -14.708 -25.515 1.00 0.00 C ATOM 650 C GLY A 490 4.596 -15.526 -24.241 1.00 0.00 C ATOM 651 O GLY A 490 3.762 -15.445 -23.332 1.00 0.00 O ATOM 0 H GLY A 490 6.431 -14.758 -26.076 1.00 0.00 H new ATOM 0 HA2 GLY A 490 4.327 -13.654 -25.250 1.00 0.00 H new ATOM 0 HA3 GLY A 490 3.473 -14.995 -25.988 1.00 0.00 H new ATOM 655 N GLU A 491 5.683 -16.320 -24.171 1.00 0.00 N ATOM 656 CA GLU A 491 6.022 -17.108 -22.973 1.00 0.00 C ATOM 657 C GLU A 491 6.545 -16.188 -21.857 1.00 0.00 C ATOM 658 O GLU A 491 7.608 -15.573 -21.997 1.00 0.00 O ATOM 659 CB GLU A 491 7.067 -18.200 -23.311 1.00 0.00 C ATOM 660 CG GLU A 491 6.533 -19.334 -24.211 1.00 0.00 C ATOM 661 CD GLU A 491 7.546 -20.473 -24.410 1.00 0.00 C ATOM 662 OE1 GLU A 491 7.996 -21.058 -23.403 1.00 0.00 O ATOM 663 OE2 GLU A 491 7.893 -20.799 -25.555 1.00 0.00 O ATOM 0 H GLU A 491 6.345 -16.432 -24.939 1.00 0.00 H new ATOM 0 HA GLU A 491 5.117 -17.602 -22.620 1.00 0.00 H new ATOM 0 HB2 GLU A 491 7.918 -17.731 -23.804 1.00 0.00 H new ATOM 0 HB3 GLU A 491 7.436 -18.633 -22.381 1.00 0.00 H new ATOM 0 HG2 GLU A 491 5.621 -19.739 -23.772 1.00 0.00 H new ATOM 0 HG3 GLU A 491 6.263 -18.922 -25.183 1.00 0.00 H new ATOM 670 N GLU A 492 5.780 -16.098 -20.759 1.00 0.00 N ATOM 671 CA GLU A 492 6.104 -15.239 -19.610 1.00 0.00 C ATOM 672 C GLU A 492 6.525 -16.088 -18.405 1.00 0.00 C ATOM 673 O GLU A 492 5.987 -17.183 -18.186 1.00 0.00 O ATOM 674 CB GLU A 492 4.880 -14.374 -19.231 1.00 0.00 C ATOM 675 CG GLU A 492 4.263 -13.595 -20.399 1.00 0.00 C ATOM 676 CD GLU A 492 3.095 -12.695 -19.969 1.00 0.00 C ATOM 677 OE1 GLU A 492 1.997 -13.221 -19.687 1.00 0.00 O ATOM 678 OE2 GLU A 492 3.264 -11.458 -19.907 1.00 0.00 O ATOM 0 H GLU A 492 4.913 -16.623 -20.642 1.00 0.00 H new ATOM 0 HA GLU A 492 6.933 -14.589 -19.891 1.00 0.00 H new ATOM 0 HB2 GLU A 492 4.116 -15.019 -18.798 1.00 0.00 H new ATOM 0 HB3 GLU A 492 5.177 -13.667 -18.456 1.00 0.00 H new ATOM 0 HG2 GLU A 492 5.033 -12.982 -20.867 1.00 0.00 H new ATOM 0 HG3 GLU A 492 3.913 -14.299 -21.154 1.00 0.00 H new ATOM 685 N ILE A 493 7.498 -15.570 -17.641 1.00 0.00 N ATOM 686 CA ILE A 493 7.892 -16.106 -16.323 1.00 0.00 C ATOM 687 C ILE A 493 7.862 -14.958 -15.294 1.00 0.00 C ATOM 688 O ILE A 493 8.153 -13.800 -15.631 1.00 0.00 O ATOM 689 CB ILE A 493 9.314 -16.795 -16.340 1.00 0.00 C ATOM 690 CG1 ILE A 493 10.401 -15.839 -16.939 1.00 0.00 C ATOM 691 CG2 ILE A 493 9.274 -18.154 -17.088 1.00 0.00 C ATOM 692 CD1 ILE A 493 11.816 -16.402 -16.955 1.00 0.00 C ATOM 0 H ILE A 493 8.043 -14.755 -17.922 1.00 0.00 H new ATOM 0 HA ILE A 493 7.180 -16.885 -16.049 1.00 0.00 H new ATOM 0 HB ILE A 493 9.594 -17.001 -15.307 1.00 0.00 H new ATOM 0 HG12 ILE A 493 10.116 -15.584 -17.960 1.00 0.00 H new ATOM 0 HG13 ILE A 493 10.402 -14.911 -16.367 1.00 0.00 H new ATOM 0 HG21 ILE A 493 10.268 -18.602 -17.082 1.00 0.00 H new ATOM 0 HG22 ILE A 493 8.571 -18.823 -16.591 1.00 0.00 H new ATOM 0 HG23 ILE A 493 8.955 -17.993 -18.118 1.00 0.00 H new ATOM 0 HD11 ILE A 493 12.495 -15.667 -17.387 1.00 0.00 H new ATOM 0 HD12 ILE A 493 12.129 -16.630 -15.936 1.00 0.00 H new ATOM 0 HD13 ILE A 493 11.838 -17.313 -17.553 1.00 0.00 H new ATOM 704 N ALA A 494 7.497 -15.288 -14.045 1.00 0.00 N ATOM 705 CA ALA A 494 7.338 -14.309 -12.959 1.00 0.00 C ATOM 706 C ALA A 494 8.197 -14.724 -11.756 1.00 0.00 C ATOM 707 O ALA A 494 7.915 -15.736 -11.104 1.00 0.00 O ATOM 708 CB ALA A 494 5.852 -14.196 -12.571 1.00 0.00 C ATOM 0 H ALA A 494 7.303 -16.248 -13.759 1.00 0.00 H new ATOM 0 HA ALA A 494 7.676 -13.329 -13.296 1.00 0.00 H new ATOM 0 HB1 ALA A 494 5.740 -13.469 -11.766 1.00 0.00 H new ATOM 0 HB2 ALA A 494 5.274 -13.871 -13.436 1.00 0.00 H new ATOM 0 HB3 ALA A 494 5.489 -15.167 -12.236 1.00 0.00 H new ATOM 714 N TYR A 495 9.267 -13.958 -11.499 1.00 0.00 N ATOM 715 CA TYR A 495 10.140 -14.147 -10.333 1.00 0.00 C ATOM 716 C TYR A 495 9.729 -13.177 -9.218 1.00 0.00 C ATOM 717 O TYR A 495 10.005 -11.981 -9.305 1.00 0.00 O ATOM 718 CB TYR A 495 11.624 -13.902 -10.728 1.00 0.00 C ATOM 719 CG TYR A 495 12.611 -13.937 -9.545 1.00 0.00 C ATOM 720 CD1 TYR A 495 12.782 -15.095 -8.782 1.00 0.00 C ATOM 721 CD2 TYR A 495 13.367 -12.812 -9.191 1.00 0.00 C ATOM 722 CE1 TYR A 495 13.665 -15.131 -7.718 1.00 0.00 C ATOM 723 CE2 TYR A 495 14.249 -12.848 -8.129 1.00 0.00 C ATOM 724 CZ TYR A 495 14.395 -14.003 -7.398 1.00 0.00 C ATOM 725 OH TYR A 495 15.280 -14.030 -6.342 1.00 0.00 O ATOM 0 H TYR A 495 9.552 -13.184 -12.099 1.00 0.00 H new ATOM 0 HA TYR A 495 10.037 -15.171 -9.975 1.00 0.00 H new ATOM 0 HB2 TYR A 495 11.922 -14.655 -11.457 1.00 0.00 H new ATOM 0 HB3 TYR A 495 11.701 -12.933 -11.221 1.00 0.00 H new ATOM 0 HD1 TYR A 495 12.213 -15.980 -9.028 1.00 0.00 H new ATOM 0 HD2 TYR A 495 13.258 -11.900 -9.759 1.00 0.00 H new ATOM 0 HE1 TYR A 495 13.783 -16.036 -7.141 1.00 0.00 H new ATOM 0 HE2 TYR A 495 14.823 -11.970 -7.873 1.00 0.00 H new ATOM 0 HH TYR A 495 15.712 -13.155 -6.255 1.00 0.00 H new ATOM 735 N LYS A 496 9.080 -13.693 -8.166 1.00 0.00 N ATOM 736 CA LYS A 496 8.789 -12.899 -6.962 1.00 0.00 C ATOM 737 C LYS A 496 9.983 -12.978 -6.001 1.00 0.00 C ATOM 738 O LYS A 496 10.753 -13.948 -6.023 1.00 0.00 O ATOM 739 CB LYS A 496 7.479 -13.371 -6.274 1.00 0.00 C ATOM 740 CG LYS A 496 7.516 -14.807 -5.711 1.00 0.00 C ATOM 741 CD LYS A 496 6.192 -15.209 -5.022 1.00 0.00 C ATOM 742 CE LYS A 496 6.253 -16.615 -4.412 1.00 0.00 C ATOM 743 NZ LYS A 496 5.013 -16.944 -3.667 1.00 0.00 N ATOM 0 H LYS A 496 8.746 -14.656 -8.123 1.00 0.00 H new ATOM 0 HA LYS A 496 8.635 -11.860 -7.253 1.00 0.00 H new ATOM 0 HB2 LYS A 496 7.247 -12.684 -5.460 1.00 0.00 H new ATOM 0 HB3 LYS A 496 6.663 -13.300 -6.993 1.00 0.00 H new ATOM 0 HG2 LYS A 496 7.727 -15.506 -6.521 1.00 0.00 H new ATOM 0 HG3 LYS A 496 8.334 -14.892 -4.996 1.00 0.00 H new ATOM 0 HD2 LYS A 496 5.959 -14.487 -4.240 1.00 0.00 H new ATOM 0 HD3 LYS A 496 5.380 -15.166 -5.748 1.00 0.00 H new ATOM 0 HE2 LYS A 496 6.408 -17.349 -5.203 1.00 0.00 H new ATOM 0 HE3 LYS A 496 7.110 -16.684 -3.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 5.091 -17.902 -3.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 4.879 -16.259 -2.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 4.199 -16.903 -4.313 1.00 0.00 H new ATOM 757 N PHE A 497 10.137 -11.941 -5.178 1.00 0.00 N ATOM 758 CA PHE A 497 11.224 -11.849 -4.194 1.00 0.00 C ATOM 759 C PHE A 497 10.808 -12.484 -2.853 1.00 0.00 C ATOM 760 O PHE A 497 9.639 -12.849 -2.650 1.00 0.00 O ATOM 761 CB PHE A 497 11.630 -10.362 -4.018 1.00 0.00 C ATOM 762 CG PHE A 497 12.379 -9.792 -5.216 1.00 0.00 C ATOM 763 CD1 PHE A 497 13.740 -10.043 -5.376 1.00 0.00 C ATOM 764 CD2 PHE A 497 11.728 -9.030 -6.190 1.00 0.00 C ATOM 765 CE1 PHE A 497 14.429 -9.551 -6.465 1.00 0.00 C ATOM 766 CE2 PHE A 497 12.420 -8.541 -7.282 1.00 0.00 C ATOM 767 CZ PHE A 497 13.770 -8.803 -7.416 1.00 0.00 C ATOM 0 H PHE A 497 9.511 -11.136 -5.172 1.00 0.00 H new ATOM 0 HA PHE A 497 12.087 -12.407 -4.556 1.00 0.00 H new ATOM 0 HB2 PHE A 497 10.734 -9.767 -3.843 1.00 0.00 H new ATOM 0 HB3 PHE A 497 12.255 -10.267 -3.130 1.00 0.00 H new ATOM 0 HD1 PHE A 497 14.263 -10.631 -4.637 1.00 0.00 H new ATOM 0 HD2 PHE A 497 10.673 -8.821 -6.088 1.00 0.00 H new ATOM 0 HE1 PHE A 497 15.485 -9.752 -6.572 1.00 0.00 H new ATOM 0 HE2 PHE A 497 11.906 -7.955 -8.030 1.00 0.00 H new ATOM 0 HZ PHE A 497 14.310 -8.420 -8.269 1.00 0.00 H new ATOM 777 N THR A 498 11.787 -12.632 -1.957 1.00 0.00 N ATOM 778 CA THR A 498 11.592 -13.182 -0.610 1.00 0.00 C ATOM 779 C THR A 498 11.285 -12.030 0.385 1.00 0.00 C ATOM 780 O THR A 498 11.987 -11.018 0.363 1.00 0.00 O ATOM 781 CB THR A 498 12.871 -13.978 -0.185 1.00 0.00 C ATOM 782 OG1 THR A 498 14.022 -13.121 -0.242 1.00 0.00 O ATOM 783 CG2 THR A 498 13.113 -15.199 -1.097 1.00 0.00 C ATOM 0 H THR A 498 12.754 -12.369 -2.149 1.00 0.00 H new ATOM 0 HA THR A 498 10.744 -13.867 -0.604 1.00 0.00 H new ATOM 0 HB THR A 498 12.712 -14.332 0.833 1.00 0.00 H new ATOM 0 HG1 THR A 498 14.819 -13.625 0.027 1.00 0.00 H new ATOM 0 HG21 THR A 498 14.010 -15.725 -0.770 1.00 0.00 H new ATOM 0 HG22 THR A 498 12.257 -15.871 -1.040 1.00 0.00 H new ATOM 0 HG23 THR A 498 13.244 -14.864 -2.126 1.00 0.00 H new ATOM 791 N PRO A 499 10.220 -12.145 1.252 1.00 0.00 N ATOM 792 CA PRO A 499 9.808 -11.044 2.182 1.00 0.00 C ATOM 793 C PRO A 499 10.849 -10.754 3.295 1.00 0.00 C ATOM 794 O PRO A 499 10.808 -9.693 3.937 1.00 0.00 O ATOM 795 CB PRO A 499 8.463 -11.555 2.759 1.00 0.00 C ATOM 796 CG PRO A 499 8.550 -13.047 2.662 1.00 0.00 C ATOM 797 CD PRO A 499 9.325 -13.329 1.389 1.00 0.00 C ATOM 0 HA PRO A 499 9.723 -10.086 1.669 1.00 0.00 H new ATOM 0 HB2 PRO A 499 8.327 -11.233 3.791 1.00 0.00 H new ATOM 0 HB3 PRO A 499 7.616 -11.170 2.191 1.00 0.00 H new ATOM 0 HG2 PRO A 499 9.057 -13.467 3.531 1.00 0.00 H new ATOM 0 HG3 PRO A 499 7.557 -13.496 2.624 1.00 0.00 H new ATOM 0 HD2 PRO A 499 9.895 -14.255 1.464 1.00 0.00 H new ATOM 0 HD3 PRO A 499 8.661 -13.431 0.530 1.00 0.00 H new ATOM 805 N LYS A 500 11.770 -11.711 3.509 1.00 0.00 N ATOM 806 CA LYS A 500 12.914 -11.552 4.431 1.00 0.00 C ATOM 807 C LYS A 500 13.984 -10.600 3.853 1.00 0.00 C ATOM 808 O LYS A 500 14.817 -10.065 4.597 1.00 0.00 O ATOM 809 CB LYS A 500 13.554 -12.933 4.743 1.00 0.00 C ATOM 810 CG LYS A 500 14.043 -13.711 3.496 1.00 0.00 C ATOM 811 CD LYS A 500 14.751 -15.044 3.843 1.00 0.00 C ATOM 812 CE LYS A 500 16.058 -14.834 4.628 1.00 0.00 C ATOM 813 NZ LYS A 500 16.756 -16.114 4.907 1.00 0.00 N ATOM 0 H LYS A 500 11.743 -12.620 3.047 1.00 0.00 H new ATOM 0 HA LYS A 500 12.532 -11.113 5.353 1.00 0.00 H new ATOM 0 HB2 LYS A 500 14.398 -12.784 5.417 1.00 0.00 H new ATOM 0 HB3 LYS A 500 12.826 -13.545 5.275 1.00 0.00 H new ATOM 0 HG2 LYS A 500 13.191 -13.918 2.849 1.00 0.00 H new ATOM 0 HG3 LYS A 500 14.728 -13.081 2.929 1.00 0.00 H new ATOM 0 HD2 LYS A 500 14.076 -15.668 4.429 1.00 0.00 H new ATOM 0 HD3 LYS A 500 14.968 -15.586 2.923 1.00 0.00 H new ATOM 0 HE2 LYS A 500 16.719 -14.178 4.061 1.00 0.00 H new ATOM 0 HE3 LYS A 500 15.838 -14.330 5.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 500 17.630 -15.924 5.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 500 16.137 -16.731 5.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 500 16.990 -16.584 4.010 1.00 0.00 H new ATOM 827 N TYR A 501 13.959 -10.413 2.523 1.00 0.00 N ATOM 828 CA TYR A 501 14.942 -9.597 1.804 1.00 0.00 C ATOM 829 C TYR A 501 14.523 -8.120 1.856 1.00 0.00 C ATOM 830 O TYR A 501 13.385 -7.777 1.536 1.00 0.00 O ATOM 831 CB TYR A 501 15.056 -10.092 0.340 1.00 0.00 C ATOM 832 CG TYR A 501 16.163 -9.422 -0.479 1.00 0.00 C ATOM 833 CD1 TYR A 501 15.924 -8.247 -1.190 1.00 0.00 C ATOM 834 CD2 TYR A 501 17.450 -9.963 -0.534 1.00 0.00 C ATOM 835 CE1 TYR A 501 16.912 -7.644 -1.928 1.00 0.00 C ATOM 836 CE2 TYR A 501 18.441 -9.355 -1.274 1.00 0.00 C ATOM 837 CZ TYR A 501 18.162 -8.198 -1.964 1.00 0.00 C ATOM 838 OH TYR A 501 19.137 -7.598 -2.707 1.00 0.00 O ATOM 0 H TYR A 501 13.251 -10.827 1.917 1.00 0.00 H new ATOM 0 HA TYR A 501 15.920 -9.693 2.277 1.00 0.00 H new ATOM 0 HB2 TYR A 501 15.229 -11.168 0.347 1.00 0.00 H new ATOM 0 HB3 TYR A 501 14.102 -9.926 -0.160 1.00 0.00 H new ATOM 0 HD1 TYR A 501 14.941 -7.802 -1.160 1.00 0.00 H new ATOM 0 HD2 TYR A 501 17.671 -10.869 0.010 1.00 0.00 H new ATOM 0 HE1 TYR A 501 16.704 -6.738 -2.477 1.00 0.00 H new ATOM 0 HE2 TYR A 501 19.431 -9.784 -1.312 1.00 0.00 H new ATOM 0 HH TYR A 501 19.804 -8.266 -2.972 1.00 0.00 H new ATOM 848 N ILE A 502 15.449 -7.253 2.275 1.00 0.00 N ATOM 849 CA ILE A 502 15.266 -5.793 2.266 1.00 0.00 C ATOM 850 C ILE A 502 16.448 -5.167 1.508 1.00 0.00 C ATOM 851 O ILE A 502 17.602 -5.543 1.735 1.00 0.00 O ATOM 852 CB ILE A 502 15.173 -5.212 3.733 1.00 0.00 C ATOM 853 CG1 ILE A 502 13.973 -5.856 4.510 1.00 0.00 C ATOM 854 CG2 ILE A 502 15.065 -3.674 3.722 1.00 0.00 C ATOM 855 CD1 ILE A 502 13.736 -5.319 5.919 1.00 0.00 C ATOM 0 H ILE A 502 16.358 -7.545 2.635 1.00 0.00 H new ATOM 0 HA ILE A 502 14.327 -5.548 1.769 1.00 0.00 H new ATOM 0 HB ILE A 502 16.094 -5.472 4.255 1.00 0.00 H new ATOM 0 HG12 ILE A 502 13.064 -5.708 3.926 1.00 0.00 H new ATOM 0 HG13 ILE A 502 14.140 -6.931 4.573 1.00 0.00 H new ATOM 0 HG21 ILE A 502 15.003 -3.306 4.746 1.00 0.00 H new ATOM 0 HG22 ILE A 502 15.945 -3.251 3.237 1.00 0.00 H new ATOM 0 HG23 ILE A 502 14.171 -3.376 3.175 1.00 0.00 H new ATOM 0 HD11 ILE A 502 12.884 -5.832 6.365 1.00 0.00 H new ATOM 0 HD12 ILE A 502 14.623 -5.492 6.528 1.00 0.00 H new ATOM 0 HD13 ILE A 502 13.531 -4.249 5.871 1.00 0.00 H new ATOM 867 N LEU A 503 16.152 -4.232 0.593 1.00 0.00 N ATOM 868 CA LEU A 503 17.169 -3.572 -0.249 1.00 0.00 C ATOM 869 C LEU A 503 17.232 -2.076 0.125 1.00 0.00 C ATOM 870 O LEU A 503 16.226 -1.371 0.064 1.00 0.00 O ATOM 871 CB LEU A 503 16.835 -3.803 -1.765 1.00 0.00 C ATOM 872 CG LEU A 503 18.011 -3.642 -2.796 1.00 0.00 C ATOM 873 CD1 LEU A 503 18.346 -2.175 -3.090 1.00 0.00 C ATOM 874 CD2 LEU A 503 19.269 -4.406 -2.331 1.00 0.00 C ATOM 0 H LEU A 503 15.201 -3.910 0.413 1.00 0.00 H new ATOM 0 HA LEU A 503 18.155 -4.002 -0.074 1.00 0.00 H new ATOM 0 HB2 LEU A 503 16.429 -4.809 -1.871 1.00 0.00 H new ATOM 0 HB3 LEU A 503 16.043 -3.108 -2.045 1.00 0.00 H new ATOM 0 HG LEU A 503 17.662 -4.081 -3.731 1.00 0.00 H new ATOM 0 HD11 LEU A 503 19.165 -2.126 -3.808 1.00 0.00 H new ATOM 0 HD12 LEU A 503 17.469 -1.678 -3.505 1.00 0.00 H new ATOM 0 HD13 LEU A 503 18.642 -1.677 -2.167 1.00 0.00 H new ATOM 0 HD21 LEU A 503 20.065 -4.276 -3.064 1.00 0.00 H new ATOM 0 HD22 LEU A 503 19.596 -4.016 -1.367 1.00 0.00 H new ATOM 0 HD23 LEU A 503 19.035 -5.466 -2.233 1.00 0.00 H new ATOM 886 N ARG A 504 18.442 -1.610 0.481 1.00 0.00 N ATOM 887 CA ARG A 504 18.671 -0.267 1.057 1.00 0.00 C ATOM 888 C ARG A 504 18.479 0.859 0.009 1.00 0.00 C ATOM 889 O ARG A 504 18.591 0.623 -1.201 1.00 0.00 O ATOM 890 CB ARG A 504 20.093 -0.178 1.695 1.00 0.00 C ATOM 891 CG ARG A 504 20.322 -0.986 3.009 1.00 0.00 C ATOM 892 CD ARG A 504 20.220 -2.520 2.849 1.00 0.00 C ATOM 893 NE ARG A 504 20.663 -3.245 4.064 1.00 0.00 N ATOM 894 CZ ARG A 504 20.159 -4.409 4.518 1.00 0.00 C ATOM 895 NH1 ARG A 504 19.125 -4.994 3.922 1.00 0.00 N ATOM 896 NH2 ARG A 504 20.698 -4.973 5.587 1.00 0.00 N ATOM 0 H ARG A 504 19.297 -2.157 0.378 1.00 0.00 H new ATOM 0 HA ARG A 504 17.922 -0.119 1.835 1.00 0.00 H new ATOM 0 HB2 ARG A 504 20.819 -0.517 0.956 1.00 0.00 H new ATOM 0 HB3 ARG A 504 20.310 0.871 1.898 1.00 0.00 H new ATOM 0 HG2 ARG A 504 21.308 -0.740 3.404 1.00 0.00 H new ATOM 0 HG3 ARG A 504 19.592 -0.662 3.751 1.00 0.00 H new ATOM 0 HD2 ARG A 504 19.189 -2.791 2.623 1.00 0.00 H new ATOM 0 HD3 ARG A 504 20.826 -2.835 2.000 1.00 0.00 H new ATOM 0 HE ARG A 504 21.418 -2.824 4.605 1.00 0.00 H new ATOM 0 HH11 ARG A 504 18.697 -4.562 3.103 1.00 0.00 H new ATOM 0 HH12 ARG A 504 18.760 -5.875 4.283 1.00 0.00 H new ATOM 0 HH21 ARG A 504 21.485 -4.526 6.057 1.00 0.00 H new ATOM 0 HH22 ARG A 504 20.326 -5.854 5.941 1.00 0.00 H new ATOM 910 N ALA A 505 18.167 2.085 0.490 1.00 0.00 N ATOM 911 CA ALA A 505 18.007 3.283 -0.367 1.00 0.00 C ATOM 912 C ALA A 505 19.345 3.665 -1.026 1.00 0.00 C ATOM 913 O ALA A 505 20.375 3.756 -0.346 1.00 0.00 O ATOM 914 CB ALA A 505 17.454 4.461 0.455 1.00 0.00 C ATOM 0 H ALA A 505 18.019 2.271 1.482 1.00 0.00 H new ATOM 0 HA ALA A 505 17.294 3.047 -1.157 1.00 0.00 H new ATOM 0 HB1 ALA A 505 17.342 5.333 -0.189 1.00 0.00 H new ATOM 0 HB2 ALA A 505 16.484 4.190 0.871 1.00 0.00 H new ATOM 0 HB3 ALA A 505 18.144 4.695 1.266 1.00 0.00 H new ATOM 920 N GLY A 506 19.320 3.852 -2.358 1.00 0.00 N ATOM 921 CA GLY A 506 20.518 4.213 -3.128 1.00 0.00 C ATOM 922 C GLY A 506 21.351 3.005 -3.566 1.00 0.00 C ATOM 923 O GLY A 506 22.324 3.156 -4.316 1.00 0.00 O ATOM 0 H GLY A 506 18.476 3.758 -2.924 1.00 0.00 H new ATOM 0 HA2 GLY A 506 20.216 4.776 -4.012 1.00 0.00 H new ATOM 0 HA3 GLY A 506 21.141 4.875 -2.526 1.00 0.00 H new ATOM 927 N GLN A 507 20.966 1.810 -3.087 1.00 0.00 N ATOM 928 CA GLN A 507 21.607 0.536 -3.451 1.00 0.00 C ATOM 929 C GLN A 507 20.885 -0.112 -4.643 1.00 0.00 C ATOM 930 O GLN A 507 19.952 0.463 -5.212 1.00 0.00 O ATOM 931 CB GLN A 507 21.632 -0.417 -2.215 1.00 0.00 C ATOM 932 CG GLN A 507 22.610 0.006 -1.101 1.00 0.00 C ATOM 933 CD GLN A 507 24.074 -0.101 -1.525 1.00 0.00 C ATOM 934 OE1 GLN A 507 24.693 -1.153 -1.379 1.00 0.00 O ATOM 935 NE2 GLN A 507 24.622 0.969 -2.080 1.00 0.00 N ATOM 0 H GLN A 507 20.194 1.701 -2.430 1.00 0.00 H new ATOM 0 HA GLN A 507 22.636 0.729 -3.756 1.00 0.00 H new ATOM 0 HB2 GLN A 507 20.627 -0.475 -1.796 1.00 0.00 H new ATOM 0 HB3 GLN A 507 21.895 -1.420 -2.551 1.00 0.00 H new ATOM 0 HG2 GLN A 507 22.396 1.034 -0.807 1.00 0.00 H new ATOM 0 HG3 GLN A 507 22.445 -0.618 -0.223 1.00 0.00 H new ATOM 0 HE21 GLN A 507 24.077 1.825 -2.185 1.00 0.00 H new ATOM 0 HE22 GLN A 507 25.589 0.937 -2.403 1.00 0.00 H new ATOM 944 N MET A 508 21.328 -1.325 -5.003 1.00 0.00 N ATOM 945 CA MET A 508 20.822 -2.073 -6.167 1.00 0.00 C ATOM 946 C MET A 508 20.803 -3.587 -5.873 1.00 0.00 C ATOM 947 O MET A 508 21.482 -4.064 -4.951 1.00 0.00 O ATOM 948 CB MET A 508 21.707 -1.774 -7.408 1.00 0.00 C ATOM 949 CG MET A 508 23.177 -2.114 -7.205 1.00 0.00 C ATOM 950 SD MET A 508 24.155 -1.970 -8.719 1.00 0.00 S ATOM 951 CE MET A 508 25.765 -2.548 -8.181 1.00 0.00 C ATOM 0 H MET A 508 22.056 -1.822 -4.489 1.00 0.00 H new ATOM 0 HA MET A 508 19.800 -1.754 -6.373 1.00 0.00 H new ATOM 0 HB2 MET A 508 21.327 -2.338 -8.259 1.00 0.00 H new ATOM 0 HB3 MET A 508 21.619 -0.717 -7.661 1.00 0.00 H new ATOM 0 HG2 MET A 508 23.595 -1.453 -6.446 1.00 0.00 H new ATOM 0 HG3 MET A 508 23.259 -3.131 -6.822 1.00 0.00 H new ATOM 0 HE1 MET A 508 26.463 -2.511 -9.017 1.00 0.00 H new ATOM 0 HE2 MET A 508 26.130 -1.911 -7.375 1.00 0.00 H new ATOM 0 HE3 MET A 508 25.682 -3.574 -7.823 1.00 0.00 H new ATOM 961 N VAL A 509 20.013 -4.319 -6.672 1.00 0.00 N ATOM 962 CA VAL A 509 19.916 -5.786 -6.626 1.00 0.00 C ATOM 963 C VAL A 509 19.887 -6.315 -8.069 1.00 0.00 C ATOM 964 O VAL A 509 18.999 -5.963 -8.854 1.00 0.00 O ATOM 965 CB VAL A 509 18.654 -6.281 -5.807 1.00 0.00 C ATOM 966 CG1 VAL A 509 17.347 -5.557 -6.227 1.00 0.00 C ATOM 967 CG2 VAL A 509 18.503 -7.820 -5.894 1.00 0.00 C ATOM 0 H VAL A 509 19.412 -3.900 -7.382 1.00 0.00 H new ATOM 0 HA VAL A 509 20.786 -6.181 -6.101 1.00 0.00 H new ATOM 0 HB VAL A 509 18.830 -6.016 -4.765 1.00 0.00 H new ATOM 0 HG11 VAL A 509 16.515 -5.935 -5.634 1.00 0.00 H new ATOM 0 HG12 VAL A 509 17.455 -4.485 -6.059 1.00 0.00 H new ATOM 0 HG13 VAL A 509 17.153 -5.741 -7.284 1.00 0.00 H new ATOM 0 HG21 VAL A 509 17.629 -8.133 -5.323 1.00 0.00 H new ATOM 0 HG22 VAL A 509 18.380 -8.115 -6.936 1.00 0.00 H new ATOM 0 HG23 VAL A 509 19.394 -8.297 -5.484 1.00 0.00 H new ATOM 977 N THR A 510 20.889 -7.127 -8.425 1.00 0.00 N ATOM 978 CA THR A 510 21.027 -7.676 -9.776 1.00 0.00 C ATOM 979 C THR A 510 20.623 -9.158 -9.776 1.00 0.00 C ATOM 980 O THR A 510 21.309 -9.985 -9.167 1.00 0.00 O ATOM 981 CB THR A 510 22.498 -7.524 -10.291 1.00 0.00 C ATOM 982 OG1 THR A 510 23.064 -6.285 -9.828 1.00 0.00 O ATOM 983 CG2 THR A 510 22.567 -7.561 -11.826 1.00 0.00 C ATOM 0 H THR A 510 21.626 -7.421 -7.784 1.00 0.00 H new ATOM 0 HA THR A 510 20.370 -7.120 -10.445 1.00 0.00 H new ATOM 0 HB THR A 510 23.067 -8.365 -9.895 1.00 0.00 H new ATOM 0 HG1 THR A 510 23.307 -6.369 -8.882 1.00 0.00 H new ATOM 0 HG21 THR A 510 23.603 -7.453 -12.146 1.00 0.00 H new ATOM 0 HG22 THR A 510 22.174 -8.512 -12.185 1.00 0.00 H new ATOM 0 HG23 THR A 510 21.973 -6.745 -12.237 1.00 0.00 H new ATOM 991 N VAL A 511 19.488 -9.474 -10.419 1.00 0.00 N ATOM 992 CA VAL A 511 18.998 -10.856 -10.556 1.00 0.00 C ATOM 993 C VAL A 511 19.585 -11.485 -11.833 1.00 0.00 C ATOM 994 O VAL A 511 19.129 -11.210 -12.946 1.00 0.00 O ATOM 995 CB VAL A 511 17.427 -10.926 -10.581 1.00 0.00 C ATOM 996 CG1 VAL A 511 16.920 -12.398 -10.673 1.00 0.00 C ATOM 997 CG2 VAL A 511 16.826 -10.191 -9.353 1.00 0.00 C ATOM 0 H VAL A 511 18.884 -8.780 -10.859 1.00 0.00 H new ATOM 0 HA VAL A 511 19.329 -11.419 -9.683 1.00 0.00 H new ATOM 0 HB VAL A 511 17.083 -10.414 -11.480 1.00 0.00 H new ATOM 0 HG11 VAL A 511 15.830 -12.407 -10.688 1.00 0.00 H new ATOM 0 HG12 VAL A 511 17.299 -12.857 -11.586 1.00 0.00 H new ATOM 0 HG13 VAL A 511 17.276 -12.960 -9.809 1.00 0.00 H new ATOM 0 HG21 VAL A 511 15.738 -10.251 -9.389 1.00 0.00 H new ATOM 0 HG22 VAL A 511 17.185 -10.660 -8.437 1.00 0.00 H new ATOM 0 HG23 VAL A 511 17.132 -9.145 -9.369 1.00 0.00 H new ATOM 1007 N TRP A 512 20.637 -12.285 -11.648 1.00 0.00 N ATOM 1008 CA TRP A 512 21.301 -13.038 -12.719 1.00 0.00 C ATOM 1009 C TRP A 512 20.629 -14.405 -12.949 1.00 0.00 C ATOM 1010 O TRP A 512 19.777 -14.852 -12.164 1.00 0.00 O ATOM 1011 CB TRP A 512 22.790 -13.263 -12.361 1.00 0.00 C ATOM 1012 CG TRP A 512 23.682 -12.040 -12.431 1.00 0.00 C ATOM 1013 CD1 TRP A 512 23.663 -10.952 -11.611 1.00 0.00 C ATOM 1014 CD2 TRP A 512 24.746 -11.810 -13.366 1.00 0.00 C ATOM 1015 NE1 TRP A 512 24.646 -10.067 -11.977 1.00 0.00 N ATOM 1016 CE2 TRP A 512 25.316 -10.565 -13.055 1.00 0.00 C ATOM 1017 CE3 TRP A 512 25.264 -12.544 -14.439 1.00 0.00 C ATOM 1018 CZ2 TRP A 512 26.382 -10.032 -13.775 1.00 0.00 C ATOM 1019 CZ3 TRP A 512 26.318 -12.015 -15.159 1.00 0.00 C ATOM 1020 CH2 TRP A 512 26.870 -10.770 -14.824 1.00 0.00 C ATOM 0 H TRP A 512 21.061 -12.432 -10.732 1.00 0.00 H new ATOM 0 HA TRP A 512 21.218 -12.452 -13.634 1.00 0.00 H new ATOM 0 HB2 TRP A 512 22.843 -13.670 -11.351 1.00 0.00 H new ATOM 0 HB3 TRP A 512 23.194 -14.022 -13.032 1.00 0.00 H new ATOM 0 HD1 TRP A 512 22.974 -10.807 -10.792 1.00 0.00 H new ATOM 0 HE1 TRP A 512 24.844 -9.179 -11.516 1.00 0.00 H new ATOM 0 HE3 TRP A 512 24.848 -13.506 -14.699 1.00 0.00 H new ATOM 0 HZ2 TRP A 512 26.809 -9.074 -13.518 1.00 0.00 H new ATOM 0 HZ3 TRP A 512 26.723 -12.569 -15.993 1.00 0.00 H new ATOM 0 HH2 TRP A 512 27.696 -10.384 -15.403 1.00 0.00 H new ATOM 1031 N ALA A 513 21.050 -15.054 -14.048 1.00 0.00 N ATOM 1032 CA ALA A 513 20.675 -16.432 -14.389 1.00 0.00 C ATOM 1033 C ALA A 513 21.598 -17.424 -13.668 1.00 0.00 C ATOM 1034 O ALA A 513 22.780 -17.126 -13.433 1.00 0.00 O ATOM 1035 CB ALA A 513 20.777 -16.639 -15.909 1.00 0.00 C ATOM 0 H ALA A 513 21.671 -14.626 -14.735 1.00 0.00 H new ATOM 0 HA ALA A 513 19.648 -16.607 -14.070 1.00 0.00 H new ATOM 0 HB1 ALA A 513 20.498 -17.663 -16.156 1.00 0.00 H new ATOM 0 HB2 ALA A 513 20.105 -15.947 -16.416 1.00 0.00 H new ATOM 0 HB3 ALA A 513 21.801 -16.454 -16.234 1.00 0.00 H new ATOM 1041 N ALA A 514 21.055 -18.608 -13.338 1.00 0.00 N ATOM 1042 CA ALA A 514 21.827 -19.718 -12.750 1.00 0.00 C ATOM 1043 C ALA A 514 22.848 -20.283 -13.760 1.00 0.00 C ATOM 1044 O ALA A 514 23.944 -20.715 -13.381 1.00 0.00 O ATOM 1045 CB ALA A 514 20.867 -20.810 -12.253 1.00 0.00 C ATOM 0 H ALA A 514 20.067 -18.824 -13.471 1.00 0.00 H new ATOM 0 HA ALA A 514 22.394 -19.340 -11.899 1.00 0.00 H new ATOM 0 HB1 ALA A 514 21.441 -21.629 -11.819 1.00 0.00 H new ATOM 0 HB2 ALA A 514 20.201 -20.393 -11.497 1.00 0.00 H new ATOM 0 HB3 ALA A 514 20.277 -21.184 -13.090 1.00 0.00 H new ATOM 1051 N GLY A 515 22.480 -20.225 -15.057 1.00 0.00 N ATOM 1052 CA GLY A 515 23.327 -20.724 -16.150 1.00 0.00 C ATOM 1053 C GLY A 515 24.505 -19.812 -16.486 1.00 0.00 C ATOM 1054 O GLY A 515 25.428 -20.224 -17.197 1.00 0.00 O ATOM 0 H GLY A 515 21.592 -19.833 -15.370 1.00 0.00 H new ATOM 0 HA2 GLY A 515 23.708 -21.709 -15.880 1.00 0.00 H new ATOM 0 HA3 GLY A 515 22.714 -20.853 -17.042 1.00 0.00 H new ATOM 1058 N ALA A 516 24.480 -18.573 -15.951 1.00 0.00 N ATOM 1059 CA ALA A 516 25.548 -17.573 -16.164 1.00 0.00 C ATOM 1060 C ALA A 516 26.850 -17.952 -15.407 1.00 0.00 C ATOM 1061 O ALA A 516 27.917 -17.378 -15.675 1.00 0.00 O ATOM 1062 CB ALA A 516 25.056 -16.178 -15.732 1.00 0.00 C ATOM 0 H ALA A 516 23.719 -18.238 -15.360 1.00 0.00 H new ATOM 0 HA ALA A 516 25.785 -17.555 -17.228 1.00 0.00 H new ATOM 0 HB1 ALA A 516 25.849 -15.447 -15.892 1.00 0.00 H new ATOM 0 HB2 ALA A 516 24.183 -15.901 -16.322 1.00 0.00 H new ATOM 0 HB3 ALA A 516 24.788 -16.198 -14.676 1.00 0.00 H new ATOM 1068 N GLY A 517 26.745 -18.919 -14.462 1.00 0.00 N ATOM 1069 CA GLY A 517 27.896 -19.395 -13.671 1.00 0.00 C ATOM 1070 C GLY A 517 28.457 -18.334 -12.726 1.00 0.00 C ATOM 1071 O GLY A 517 29.635 -18.375 -12.344 1.00 0.00 O ATOM 0 H GLY A 517 25.867 -19.384 -14.232 1.00 0.00 H new ATOM 0 HA2 GLY A 517 27.594 -20.266 -13.090 1.00 0.00 H new ATOM 0 HA3 GLY A 517 28.684 -19.722 -14.349 1.00 0.00 H new ATOM 1075 N VAL A 518 27.584 -17.400 -12.344 1.00 0.00 N ATOM 1076 CA VAL A 518 27.924 -16.220 -11.534 1.00 0.00 C ATOM 1077 C VAL A 518 27.924 -16.562 -10.027 1.00 0.00 C ATOM 1078 O VAL A 518 27.129 -17.398 -9.566 1.00 0.00 O ATOM 1079 CB VAL A 518 26.913 -15.051 -11.848 1.00 0.00 C ATOM 1080 CG1 VAL A 518 25.456 -15.514 -11.648 1.00 0.00 C ATOM 1081 CG2 VAL A 518 27.215 -13.766 -11.027 1.00 0.00 C ATOM 0 H VAL A 518 26.596 -17.441 -12.593 1.00 0.00 H new ATOM 0 HA VAL A 518 28.931 -15.894 -11.794 1.00 0.00 H new ATOM 0 HB VAL A 518 27.047 -14.788 -12.897 1.00 0.00 H new ATOM 0 HG11 VAL A 518 24.778 -14.690 -11.871 1.00 0.00 H new ATOM 0 HG12 VAL A 518 25.244 -16.349 -12.317 1.00 0.00 H new ATOM 0 HG13 VAL A 518 25.314 -15.832 -10.615 1.00 0.00 H new ATOM 0 HG21 VAL A 518 26.490 -12.993 -11.281 1.00 0.00 H new ATOM 0 HG22 VAL A 518 27.148 -13.990 -9.962 1.00 0.00 H new ATOM 0 HG23 VAL A 518 28.219 -13.412 -11.261 1.00 0.00 H new ATOM 1091 N ALA A 519 28.851 -15.929 -9.286 1.00 0.00 N ATOM 1092 CA ALA A 519 28.949 -16.046 -7.832 1.00 0.00 C ATOM 1093 C ALA A 519 27.752 -15.351 -7.166 1.00 0.00 C ATOM 1094 O ALA A 519 27.643 -14.116 -7.201 1.00 0.00 O ATOM 1095 CB ALA A 519 30.284 -15.451 -7.340 1.00 0.00 C ATOM 0 H ALA A 519 29.559 -15.316 -9.691 1.00 0.00 H new ATOM 0 HA ALA A 519 28.927 -17.100 -7.554 1.00 0.00 H new ATOM 0 HB1 ALA A 519 30.346 -15.544 -6.256 1.00 0.00 H new ATOM 0 HB2 ALA A 519 31.113 -15.990 -7.798 1.00 0.00 H new ATOM 0 HB3 ALA A 519 30.338 -14.398 -7.618 1.00 0.00 H new ATOM 1101 N HIS A 520 26.831 -16.159 -6.620 1.00 0.00 N ATOM 1102 CA HIS A 520 25.674 -15.663 -5.860 1.00 0.00 C ATOM 1103 C HIS A 520 26.169 -14.919 -4.607 1.00 0.00 C ATOM 1104 O HIS A 520 26.703 -15.536 -3.674 1.00 0.00 O ATOM 1105 CB HIS A 520 24.749 -16.853 -5.485 1.00 0.00 C ATOM 1106 CG HIS A 520 23.479 -16.490 -4.737 1.00 0.00 C ATOM 1107 ND1 HIS A 520 22.923 -17.281 -3.752 1.00 0.00 N ATOM 1108 CD2 HIS A 520 22.635 -15.429 -4.872 1.00 0.00 C ATOM 1109 CE1 HIS A 520 21.797 -16.693 -3.330 1.00 0.00 C ATOM 1110 NE2 HIS A 520 21.577 -15.568 -3.976 1.00 0.00 N ATOM 0 H HIS A 520 26.868 -17.176 -6.693 1.00 0.00 H new ATOM 0 HA HIS A 520 25.097 -14.965 -6.466 1.00 0.00 H new ATOM 0 HB2 HIS A 520 24.473 -17.377 -6.400 1.00 0.00 H new ATOM 0 HB3 HIS A 520 25.319 -17.555 -4.876 1.00 0.00 H new ATOM 0 HD2 HIS A 520 22.765 -14.610 -5.564 1.00 0.00 H new ATOM 0 HE1 HIS A 520 21.153 -17.090 -2.560 1.00 0.00 H new ATOM 0 HE2 HIS A 520 20.793 -14.929 -3.847 1.00 0.00 H new ATOM 1118 N SER A 521 26.000 -13.586 -4.607 1.00 0.00 N ATOM 1119 CA SER A 521 26.542 -12.699 -3.565 1.00 0.00 C ATOM 1120 C SER A 521 25.447 -11.722 -3.063 1.00 0.00 C ATOM 1121 O SER A 521 25.424 -10.553 -3.469 1.00 0.00 O ATOM 1122 CB SER A 521 27.773 -11.941 -4.134 1.00 0.00 C ATOM 1123 OG SER A 521 28.756 -12.845 -4.615 1.00 0.00 O ATOM 0 H SER A 521 25.481 -13.092 -5.333 1.00 0.00 H new ATOM 0 HA SER A 521 26.864 -13.288 -2.707 1.00 0.00 H new ATOM 0 HB2 SER A 521 27.456 -11.281 -4.942 1.00 0.00 H new ATOM 0 HB3 SER A 521 28.205 -11.309 -3.358 1.00 0.00 H new ATOM 0 HG SER A 521 28.435 -13.270 -5.438 1.00 0.00 H new ATOM 1129 N PRO A 522 24.483 -12.208 -2.206 1.00 0.00 N ATOM 1130 CA PRO A 522 23.446 -11.341 -1.587 1.00 0.00 C ATOM 1131 C PRO A 522 24.068 -10.163 -0.768 1.00 0.00 C ATOM 1132 O PRO A 522 25.135 -10.339 -0.165 1.00 0.00 O ATOM 1133 CB PRO A 522 22.651 -12.315 -0.670 1.00 0.00 C ATOM 1134 CG PRO A 522 22.882 -13.669 -1.265 1.00 0.00 C ATOM 1135 CD PRO A 522 24.293 -13.634 -1.805 1.00 0.00 C ATOM 0 HA PRO A 522 22.820 -10.853 -2.334 1.00 0.00 H new ATOM 0 HB2 PRO A 522 23.006 -12.269 0.359 1.00 0.00 H new ATOM 0 HB3 PRO A 522 21.590 -12.066 -0.653 1.00 0.00 H new ATOM 0 HG2 PRO A 522 22.767 -14.452 -0.516 1.00 0.00 H new ATOM 0 HG3 PRO A 522 22.163 -13.878 -2.057 1.00 0.00 H new ATOM 0 HD2 PRO A 522 25.018 -13.938 -1.050 1.00 0.00 H new ATOM 0 HD3 PRO A 522 24.414 -14.308 -2.653 1.00 0.00 H new ATOM 1143 N PRO A 523 23.441 -8.942 -0.737 1.00 0.00 N ATOM 1144 CA PRO A 523 22.185 -8.618 -1.460 1.00 0.00 C ATOM 1145 C PRO A 523 22.400 -8.212 -2.951 1.00 0.00 C ATOM 1146 O PRO A 523 21.508 -8.399 -3.786 1.00 0.00 O ATOM 1147 CB PRO A 523 21.634 -7.443 -0.615 1.00 0.00 C ATOM 1148 CG PRO A 523 22.858 -6.709 -0.154 1.00 0.00 C ATOM 1149 CD PRO A 523 23.912 -7.777 0.081 1.00 0.00 C ATOM 0 HA PRO A 523 21.514 -9.473 -1.542 1.00 0.00 H new ATOM 0 HB2 PRO A 523 20.984 -6.799 -1.207 1.00 0.00 H new ATOM 0 HB3 PRO A 523 21.045 -7.802 0.229 1.00 0.00 H new ATOM 0 HG2 PRO A 523 23.189 -5.990 -0.903 1.00 0.00 H new ATOM 0 HG3 PRO A 523 22.658 -6.148 0.759 1.00 0.00 H new ATOM 0 HD2 PRO A 523 24.899 -7.440 -0.237 1.00 0.00 H new ATOM 0 HD3 PRO A 523 23.988 -8.036 1.137 1.00 0.00 H new ATOM 1157 N SER A 524 23.614 -7.728 -3.267 1.00 0.00 N ATOM 1158 CA SER A 524 23.930 -7.053 -4.550 1.00 0.00 C ATOM 1159 C SER A 524 23.761 -7.965 -5.789 1.00 0.00 C ATOM 1160 O SER A 524 23.437 -7.482 -6.883 1.00 0.00 O ATOM 1161 CB SER A 524 25.372 -6.504 -4.484 1.00 0.00 C ATOM 1162 OG SER A 524 25.549 -5.671 -3.343 1.00 0.00 O ATOM 0 H SER A 524 24.414 -7.792 -2.638 1.00 0.00 H new ATOM 0 HA SER A 524 23.211 -6.243 -4.676 1.00 0.00 H new ATOM 0 HB2 SER A 524 26.079 -7.333 -4.447 1.00 0.00 H new ATOM 0 HB3 SER A 524 25.591 -5.938 -5.389 1.00 0.00 H new ATOM 0 HG SER A 524 26.470 -5.337 -3.322 1.00 0.00 H new ATOM 1168 N THR A 525 23.973 -9.276 -5.601 1.00 0.00 N ATOM 1169 CA THR A 525 23.897 -10.268 -6.679 1.00 0.00 C ATOM 1170 C THR A 525 23.005 -11.441 -6.233 1.00 0.00 C ATOM 1171 O THR A 525 23.459 -12.331 -5.505 1.00 0.00 O ATOM 1172 CB THR A 525 25.332 -10.785 -7.060 1.00 0.00 C ATOM 1173 OG1 THR A 525 26.212 -9.670 -7.280 1.00 0.00 O ATOM 1174 CG2 THR A 525 25.316 -11.684 -8.313 1.00 0.00 C ATOM 0 H THR A 525 24.203 -9.678 -4.692 1.00 0.00 H new ATOM 0 HA THR A 525 23.462 -9.800 -7.562 1.00 0.00 H new ATOM 0 HB THR A 525 25.691 -11.387 -6.225 1.00 0.00 H new ATOM 0 HG1 THR A 525 27.105 -9.999 -7.515 1.00 0.00 H new ATOM 0 HG21 THR A 525 26.330 -12.016 -8.536 1.00 0.00 H new ATOM 0 HG22 THR A 525 24.682 -12.552 -8.130 1.00 0.00 H new ATOM 0 HG23 THR A 525 24.924 -11.121 -9.160 1.00 0.00 H new ATOM 1182 N LEU A 526 21.713 -11.392 -6.607 1.00 0.00 N ATOM 1183 CA LEU A 526 20.799 -12.539 -6.469 1.00 0.00 C ATOM 1184 C LEU A 526 20.834 -13.358 -7.760 1.00 0.00 C ATOM 1185 O LEU A 526 21.044 -12.817 -8.839 1.00 0.00 O ATOM 1186 CB LEU A 526 19.349 -12.090 -6.140 1.00 0.00 C ATOM 1187 CG LEU A 526 19.140 -11.393 -4.758 1.00 0.00 C ATOM 1188 CD1 LEU A 526 17.640 -11.141 -4.489 1.00 0.00 C ATOM 1189 CD2 LEU A 526 19.804 -12.187 -3.603 1.00 0.00 C ATOM 0 H LEU A 526 21.277 -10.563 -7.010 1.00 0.00 H new ATOM 0 HA LEU A 526 21.133 -13.152 -5.632 1.00 0.00 H new ATOM 0 HB2 LEU A 526 19.016 -11.407 -6.922 1.00 0.00 H new ATOM 0 HB3 LEU A 526 18.701 -12.965 -6.184 1.00 0.00 H new ATOM 0 HG LEU A 526 19.638 -10.425 -4.799 1.00 0.00 H new ATOM 0 HD11 LEU A 526 17.521 -10.655 -3.521 1.00 0.00 H new ATOM 0 HD12 LEU A 526 17.233 -10.499 -5.270 1.00 0.00 H new ATOM 0 HD13 LEU A 526 17.106 -12.091 -4.486 1.00 0.00 H new ATOM 0 HD21 LEU A 526 19.635 -11.667 -2.660 1.00 0.00 H new ATOM 0 HD22 LEU A 526 19.369 -13.185 -3.551 1.00 0.00 H new ATOM 0 HD23 LEU A 526 20.876 -12.267 -3.786 1.00 0.00 H new ATOM 1201 N VAL A 527 20.666 -14.675 -7.629 1.00 0.00 N ATOM 1202 CA VAL A 527 20.696 -15.620 -8.757 1.00 0.00 C ATOM 1203 C VAL A 527 19.460 -16.522 -8.665 1.00 0.00 C ATOM 1204 O VAL A 527 19.289 -17.225 -7.655 1.00 0.00 O ATOM 1205 CB VAL A 527 22.011 -16.492 -8.731 1.00 0.00 C ATOM 1206 CG1 VAL A 527 22.026 -17.552 -9.857 1.00 0.00 C ATOM 1207 CG2 VAL A 527 23.274 -15.598 -8.797 1.00 0.00 C ATOM 0 H VAL A 527 20.503 -15.125 -6.728 1.00 0.00 H new ATOM 0 HA VAL A 527 20.689 -15.065 -9.695 1.00 0.00 H new ATOM 0 HB VAL A 527 22.021 -17.028 -7.782 1.00 0.00 H new ATOM 0 HG11 VAL A 527 22.949 -18.129 -9.801 1.00 0.00 H new ATOM 0 HG12 VAL A 527 21.173 -18.220 -9.739 1.00 0.00 H new ATOM 0 HG13 VAL A 527 21.967 -17.055 -10.825 1.00 0.00 H new ATOM 0 HG21 VAL A 527 24.165 -16.225 -8.777 1.00 0.00 H new ATOM 0 HG22 VAL A 527 23.260 -15.016 -9.718 1.00 0.00 H new ATOM 0 HG23 VAL A 527 23.287 -14.923 -7.942 1.00 0.00 H new ATOM 1217 N TRP A 528 18.582 -16.487 -9.692 1.00 0.00 N ATOM 1218 CA TRP A 528 17.383 -17.342 -9.722 1.00 0.00 C ATOM 1219 C TRP A 528 17.813 -18.781 -10.063 1.00 0.00 C ATOM 1220 O TRP A 528 17.995 -19.134 -11.236 1.00 0.00 O ATOM 1221 CB TRP A 528 16.295 -16.810 -10.715 1.00 0.00 C ATOM 1222 CG TRP A 528 14.932 -17.505 -10.610 1.00 0.00 C ATOM 1223 CD1 TRP A 528 14.526 -18.427 -9.672 1.00 0.00 C ATOM 1224 CD2 TRP A 528 13.790 -17.299 -11.460 1.00 0.00 C ATOM 1225 NE1 TRP A 528 13.237 -18.817 -9.910 1.00 0.00 N ATOM 1226 CE2 TRP A 528 12.760 -18.140 -10.997 1.00 0.00 C ATOM 1227 CE3 TRP A 528 13.544 -16.495 -12.572 1.00 0.00 C ATOM 1228 CZ2 TRP A 528 11.504 -18.193 -11.605 1.00 0.00 C ATOM 1229 CZ3 TRP A 528 12.297 -16.548 -13.175 1.00 0.00 C ATOM 1230 CH2 TRP A 528 11.292 -17.392 -12.693 1.00 0.00 C ATOM 0 H TRP A 528 18.683 -15.879 -10.504 1.00 0.00 H new ATOM 0 HA TRP A 528 16.914 -17.325 -8.738 1.00 0.00 H new ATOM 0 HB2 TRP A 528 16.157 -15.743 -10.542 1.00 0.00 H new ATOM 0 HB3 TRP A 528 16.667 -16.923 -11.733 1.00 0.00 H new ATOM 0 HD1 TRP A 528 15.140 -18.791 -8.861 1.00 0.00 H new ATOM 0 HE1 TRP A 528 12.716 -19.503 -9.364 1.00 0.00 H new ATOM 0 HE3 TRP A 528 14.313 -15.841 -12.957 1.00 0.00 H new ATOM 0 HZ2 TRP A 528 10.728 -18.843 -11.229 1.00 0.00 H new ATOM 0 HZ3 TRP A 528 12.098 -15.925 -14.034 1.00 0.00 H new ATOM 0 HH2 TRP A 528 10.332 -17.412 -13.188 1.00 0.00 H new ATOM 1241 N LYS A 529 18.027 -19.577 -9.001 1.00 0.00 N ATOM 1242 CA LYS A 529 18.341 -21.003 -9.105 1.00 0.00 C ATOM 1243 C LYS A 529 17.116 -21.745 -9.669 1.00 0.00 C ATOM 1244 O LYS A 529 15.983 -21.489 -9.238 1.00 0.00 O ATOM 1245 CB LYS A 529 18.729 -21.562 -7.708 1.00 0.00 C ATOM 1246 CG LYS A 529 19.318 -22.993 -7.712 1.00 0.00 C ATOM 1247 CD LYS A 529 20.696 -23.081 -8.421 1.00 0.00 C ATOM 1248 CE LYS A 529 21.782 -22.226 -7.733 1.00 0.00 C ATOM 1249 NZ LYS A 529 23.113 -22.378 -8.375 1.00 0.00 N ATOM 0 H LYS A 529 17.985 -19.240 -8.039 1.00 0.00 H new ATOM 0 HA LYS A 529 19.187 -21.150 -9.776 1.00 0.00 H new ATOM 0 HB2 LYS A 529 19.456 -20.888 -7.254 1.00 0.00 H new ATOM 0 HB3 LYS A 529 17.844 -21.552 -7.072 1.00 0.00 H new ATOM 0 HG2 LYS A 529 19.422 -23.340 -6.684 1.00 0.00 H new ATOM 0 HG3 LYS A 529 18.618 -23.667 -8.206 1.00 0.00 H new ATOM 0 HD2 LYS A 529 21.021 -24.121 -8.445 1.00 0.00 H new ATOM 0 HD3 LYS A 529 20.588 -22.757 -9.456 1.00 0.00 H new ATOM 0 HE2 LYS A 529 21.486 -21.177 -7.760 1.00 0.00 H new ATOM 0 HE3 LYS A 529 21.853 -22.510 -6.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 529 23.808 -21.785 -7.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 529 23.410 -23.374 -8.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 529 23.054 -22.082 -9.370 1.00 0.00 H new ATOM 1263 N GLY A 530 17.346 -22.642 -10.636 1.00 0.00 N ATOM 1264 CA GLY A 530 16.264 -23.318 -11.359 1.00 0.00 C ATOM 1265 C GLY A 530 16.096 -22.749 -12.761 1.00 0.00 C ATOM 1266 O GLY A 530 15.776 -23.481 -13.708 1.00 0.00 O ATOM 0 H GLY A 530 18.281 -22.918 -10.937 1.00 0.00 H new ATOM 0 HA2 GLY A 530 16.476 -24.385 -11.420 1.00 0.00 H new ATOM 0 HA3 GLY A 530 15.331 -23.210 -10.806 1.00 0.00 H new ATOM 1270 N GLN A 531 16.302 -21.426 -12.893 1.00 0.00 N ATOM 1271 CA GLN A 531 16.334 -20.744 -14.199 1.00 0.00 C ATOM 1272 C GLN A 531 17.780 -20.550 -14.660 1.00 0.00 C ATOM 1273 O GLN A 531 18.413 -19.535 -14.361 1.00 0.00 O ATOM 1274 CB GLN A 531 15.555 -19.392 -14.173 1.00 0.00 C ATOM 1275 CG GLN A 531 14.043 -19.546 -14.422 1.00 0.00 C ATOM 1276 CD GLN A 531 13.702 -20.072 -15.821 1.00 0.00 C ATOM 1277 OE1 GLN A 531 14.405 -19.798 -16.799 1.00 0.00 O ATOM 1278 NE2 GLN A 531 12.629 -20.841 -15.922 1.00 0.00 N ATOM 0 H GLN A 531 16.450 -20.802 -12.100 1.00 0.00 H new ATOM 0 HA GLN A 531 15.824 -21.381 -14.922 1.00 0.00 H new ATOM 0 HB2 GLN A 531 15.708 -18.913 -13.206 1.00 0.00 H new ATOM 0 HB3 GLN A 531 15.973 -18.727 -14.929 1.00 0.00 H new ATOM 0 HG2 GLN A 531 13.628 -20.224 -13.677 1.00 0.00 H new ATOM 0 HG3 GLN A 531 13.559 -18.580 -14.278 1.00 0.00 H new ATOM 0 HE21 GLN A 531 12.070 -21.048 -15.094 1.00 0.00 H new ATOM 0 HE22 GLN A 531 12.361 -21.227 -16.828 1.00 0.00 H new ATOM 1287 N SER A 532 18.294 -21.565 -15.365 1.00 0.00 N ATOM 1288 CA SER A 532 19.571 -21.486 -16.076 1.00 0.00 C ATOM 1289 C SER A 532 19.439 -20.512 -17.259 1.00 0.00 C ATOM 1290 O SER A 532 20.368 -19.765 -17.589 1.00 0.00 O ATOM 1291 CB SER A 532 19.972 -22.898 -16.562 1.00 0.00 C ATOM 1292 OG SER A 532 18.953 -23.476 -17.371 1.00 0.00 O ATOM 0 H SER A 532 17.831 -22.469 -15.457 1.00 0.00 H new ATOM 0 HA SER A 532 20.350 -21.114 -15.410 1.00 0.00 H new ATOM 0 HB2 SER A 532 20.900 -22.839 -17.130 1.00 0.00 H new ATOM 0 HB3 SER A 532 20.164 -23.540 -15.702 1.00 0.00 H new ATOM 0 HG SER A 532 19.235 -24.367 -17.665 1.00 0.00 H new ATOM 1298 N SER A 533 18.242 -20.521 -17.873 1.00 0.00 N ATOM 1299 CA SER A 533 17.942 -19.732 -19.071 1.00 0.00 C ATOM 1300 C SER A 533 17.476 -18.300 -18.720 1.00 0.00 C ATOM 1301 O SER A 533 17.766 -17.365 -19.464 1.00 0.00 O ATOM 1302 CB SER A 533 16.842 -20.465 -19.878 1.00 0.00 C ATOM 1303 OG SER A 533 17.172 -21.838 -20.080 1.00 0.00 O ATOM 0 H SER A 533 17.454 -21.081 -17.546 1.00 0.00 H new ATOM 0 HA SER A 533 18.853 -19.635 -19.662 1.00 0.00 H new ATOM 0 HB2 SER A 533 15.891 -20.392 -19.350 1.00 0.00 H new ATOM 0 HB3 SER A 533 16.709 -19.975 -20.843 1.00 0.00 H new ATOM 0 HG SER A 533 16.458 -22.274 -20.591 1.00 0.00 H new ATOM 1309 N TRP A 534 16.773 -18.139 -17.570 1.00 0.00 N ATOM 1310 CA TRP A 534 16.197 -16.834 -17.116 1.00 0.00 C ATOM 1311 C TRP A 534 15.263 -16.224 -18.210 1.00 0.00 C ATOM 1312 O TRP A 534 14.988 -15.034 -18.203 1.00 0.00 O ATOM 1313 CB TRP A 534 17.369 -15.868 -16.710 1.00 0.00 C ATOM 1314 CG TRP A 534 17.086 -14.559 -15.928 1.00 0.00 C ATOM 1315 CD1 TRP A 534 18.046 -13.623 -15.630 1.00 0.00 C ATOM 1316 CD2 TRP A 534 15.851 -14.032 -15.353 1.00 0.00 C ATOM 1317 NE1 TRP A 534 17.507 -12.580 -14.930 1.00 0.00 N ATOM 1318 CE2 TRP A 534 16.175 -12.795 -14.747 1.00 0.00 C ATOM 1319 CE3 TRP A 534 14.521 -14.446 -15.291 1.00 0.00 C ATOM 1320 CZ2 TRP A 534 15.226 -11.998 -14.102 1.00 0.00 C ATOM 1321 CZ3 TRP A 534 13.586 -13.654 -14.646 1.00 0.00 C ATOM 1322 CH2 TRP A 534 13.940 -12.444 -14.055 1.00 0.00 C ATOM 0 H TRP A 534 16.586 -18.908 -16.926 1.00 0.00 H new ATOM 0 HA TRP A 534 15.570 -16.991 -16.238 1.00 0.00 H new ATOM 0 HB2 TRP A 534 18.072 -16.451 -16.115 1.00 0.00 H new ATOM 0 HB3 TRP A 534 17.885 -15.587 -17.628 1.00 0.00 H new ATOM 0 HD1 TRP A 534 19.086 -13.701 -15.911 1.00 0.00 H new ATOM 0 HE1 TRP A 534 18.023 -11.766 -14.596 1.00 0.00 H new ATOM 0 HE3 TRP A 534 14.222 -15.380 -15.744 1.00 0.00 H new ATOM 0 HZ2 TRP A 534 15.504 -11.056 -13.654 1.00 0.00 H new ATOM 0 HZ3 TRP A 534 12.558 -13.983 -14.600 1.00 0.00 H new ATOM 0 HH2 TRP A 534 13.187 -11.853 -13.554 1.00 0.00 H new ATOM 1333 N GLY A 535 14.734 -17.080 -19.106 1.00 0.00 N ATOM 1334 CA GLY A 535 13.935 -16.633 -20.258 1.00 0.00 C ATOM 1335 C GLY A 535 14.718 -15.743 -21.234 1.00 0.00 C ATOM 1336 O GLY A 535 14.268 -14.640 -21.589 1.00 0.00 O ATOM 0 H GLY A 535 14.849 -18.092 -19.051 1.00 0.00 H new ATOM 0 HA2 GLY A 535 13.562 -17.506 -20.793 1.00 0.00 H new ATOM 0 HA3 GLY A 535 13.065 -16.085 -19.897 1.00 0.00 H new ATOM 1340 N THR A 536 15.895 -16.238 -21.666 1.00 0.00 N ATOM 1341 CA THR A 536 16.753 -15.553 -22.652 1.00 0.00 C ATOM 1342 C THR A 536 16.182 -15.723 -24.073 1.00 0.00 C ATOM 1343 O THR A 536 16.178 -16.828 -24.627 1.00 0.00 O ATOM 1344 CB THR A 536 18.235 -16.080 -22.602 1.00 0.00 C ATOM 1345 OG1 THR A 536 18.240 -17.508 -22.439 1.00 0.00 O ATOM 1346 CG2 THR A 536 19.067 -15.416 -21.481 1.00 0.00 C ATOM 0 H THR A 536 16.278 -17.126 -21.340 1.00 0.00 H new ATOM 0 HA THR A 536 16.765 -14.494 -22.393 1.00 0.00 H new ATOM 0 HB THR A 536 18.704 -15.811 -23.548 1.00 0.00 H new ATOM 0 HG1 THR A 536 18.161 -17.729 -21.488 1.00 0.00 H new ATOM 0 HG21 THR A 536 20.080 -15.817 -21.494 1.00 0.00 H new ATOM 0 HG22 THR A 536 19.101 -14.339 -21.643 1.00 0.00 H new ATOM 0 HG23 THR A 536 18.607 -15.623 -20.515 1.00 0.00 H new ATOM 1354 N GLY A 537 15.685 -14.616 -24.634 1.00 0.00 N ATOM 1355 CA GLY A 537 15.225 -14.556 -26.020 1.00 0.00 C ATOM 1356 C GLY A 537 15.980 -13.492 -26.798 1.00 0.00 C ATOM 1357 O GLY A 537 16.721 -12.698 -26.206 1.00 0.00 O ATOM 0 H GLY A 537 15.591 -13.732 -24.134 1.00 0.00 H new ATOM 0 HA2 GLY A 537 15.364 -15.527 -26.496 1.00 0.00 H new ATOM 0 HA3 GLY A 537 14.157 -14.340 -26.044 1.00 0.00 H new ATOM 1361 N GLU A 538 15.807 -13.475 -28.129 1.00 0.00 N ATOM 1362 CA GLU A 538 16.427 -12.448 -28.992 1.00 0.00 C ATOM 1363 C GLU A 538 15.615 -11.137 -28.957 1.00 0.00 C ATOM 1364 O GLU A 538 16.073 -10.106 -29.451 1.00 0.00 O ATOM 1365 CB GLU A 538 16.598 -12.968 -30.438 1.00 0.00 C ATOM 1366 CG GLU A 538 15.286 -13.235 -31.203 1.00 0.00 C ATOM 1367 CD GLU A 538 15.526 -13.758 -32.631 1.00 0.00 C ATOM 1368 OE1 GLU A 538 15.884 -12.953 -33.523 1.00 0.00 O ATOM 1369 OE2 GLU A 538 15.368 -14.981 -32.874 1.00 0.00 O ATOM 0 H GLU A 538 15.244 -14.159 -28.634 1.00 0.00 H new ATOM 0 HA GLU A 538 17.421 -12.232 -28.601 1.00 0.00 H new ATOM 0 HB2 GLU A 538 17.186 -12.242 -31.000 1.00 0.00 H new ATOM 0 HB3 GLU A 538 17.176 -13.892 -30.408 1.00 0.00 H new ATOM 0 HG2 GLU A 538 14.689 -13.961 -30.650 1.00 0.00 H new ATOM 0 HG3 GLU A 538 14.704 -12.314 -31.251 1.00 0.00 H new ATOM 1376 N SER A 539 14.399 -11.210 -28.390 1.00 0.00 N ATOM 1377 CA SER A 539 13.541 -10.047 -28.108 1.00 0.00 C ATOM 1378 C SER A 539 12.628 -10.402 -26.914 1.00 0.00 C ATOM 1379 O SER A 539 12.113 -11.528 -26.846 1.00 0.00 O ATOM 1380 CB SER A 539 12.668 -9.671 -29.339 1.00 0.00 C ATOM 1381 OG SER A 539 13.434 -9.460 -30.523 1.00 0.00 O ATOM 0 H SER A 539 13.977 -12.095 -28.110 1.00 0.00 H new ATOM 0 HA SER A 539 14.170 -9.188 -27.876 1.00 0.00 H new ATOM 0 HB2 SER A 539 11.943 -10.465 -29.519 1.00 0.00 H new ATOM 0 HB3 SER A 539 12.102 -8.767 -29.113 1.00 0.00 H new ATOM 0 HG SER A 539 12.835 -9.229 -31.263 1.00 0.00 H new ATOM 1387 N PHE A 540 12.447 -9.456 -25.975 1.00 0.00 N ATOM 1388 CA PHE A 540 11.546 -9.627 -24.815 1.00 0.00 C ATOM 1389 C PHE A 540 11.277 -8.293 -24.109 1.00 0.00 C ATOM 1390 O PHE A 540 11.877 -7.267 -24.423 1.00 0.00 O ATOM 1391 CB PHE A 540 12.084 -10.681 -23.789 1.00 0.00 C ATOM 1392 CG PHE A 540 13.534 -10.507 -23.347 1.00 0.00 C ATOM 1393 CD1 PHE A 540 13.915 -9.506 -22.448 1.00 0.00 C ATOM 1394 CD2 PHE A 540 14.520 -11.356 -23.836 1.00 0.00 C ATOM 1395 CE1 PHE A 540 15.236 -9.365 -22.064 1.00 0.00 C ATOM 1396 CE2 PHE A 540 15.832 -11.216 -23.451 1.00 0.00 C ATOM 1397 CZ PHE A 540 16.195 -10.222 -22.567 1.00 0.00 C ATOM 0 H PHE A 540 12.919 -8.552 -25.996 1.00 0.00 H new ATOM 0 HA PHE A 540 10.606 -10.005 -25.216 1.00 0.00 H new ATOM 0 HB2 PHE A 540 11.449 -10.653 -22.903 1.00 0.00 H new ATOM 0 HB3 PHE A 540 11.975 -11.673 -24.227 1.00 0.00 H new ATOM 0 HD1 PHE A 540 13.169 -8.835 -22.049 1.00 0.00 H new ATOM 0 HD2 PHE A 540 14.251 -12.139 -24.530 1.00 0.00 H new ATOM 0 HE1 PHE A 540 15.517 -8.585 -21.371 1.00 0.00 H new ATOM 0 HE2 PHE A 540 16.582 -11.887 -23.843 1.00 0.00 H new ATOM 0 HZ PHE A 540 17.227 -10.114 -22.269 1.00 0.00 H new ATOM 1407 N ARG A 541 10.337 -8.355 -23.156 1.00 0.00 N ATOM 1408 CA ARG A 541 10.008 -7.275 -22.223 1.00 0.00 C ATOM 1409 C ARG A 541 10.288 -7.786 -20.810 1.00 0.00 C ATOM 1410 O ARG A 541 10.309 -9.001 -20.571 1.00 0.00 O ATOM 1411 CB ARG A 541 8.510 -6.831 -22.320 1.00 0.00 C ATOM 1412 CG ARG A 541 8.030 -6.397 -23.727 1.00 0.00 C ATOM 1413 CD ARG A 541 7.734 -7.584 -24.659 1.00 0.00 C ATOM 1414 NE ARG A 541 7.447 -7.148 -26.031 1.00 0.00 N ATOM 1415 CZ ARG A 541 6.846 -7.889 -26.972 1.00 0.00 C ATOM 1416 NH1 ARG A 541 6.357 -9.099 -26.691 1.00 0.00 N ATOM 1417 NH2 ARG A 541 6.696 -7.390 -28.189 1.00 0.00 N ATOM 0 H ARG A 541 9.767 -9.188 -23.011 1.00 0.00 H new ATOM 0 HA ARG A 541 10.615 -6.404 -22.472 1.00 0.00 H new ATOM 0 HB2 ARG A 541 7.883 -7.655 -21.980 1.00 0.00 H new ATOM 0 HB3 ARG A 541 8.350 -6.003 -21.630 1.00 0.00 H new ATOM 0 HG2 ARG A 541 7.130 -5.790 -23.626 1.00 0.00 H new ATOM 0 HG3 ARG A 541 8.791 -5.765 -24.185 1.00 0.00 H new ATOM 0 HD2 ARG A 541 8.588 -8.262 -24.665 1.00 0.00 H new ATOM 0 HD3 ARG A 541 6.884 -8.146 -24.272 1.00 0.00 H new ATOM 0 HE ARG A 541 7.728 -6.202 -26.290 1.00 0.00 H new ATOM 0 HH11 ARG A 541 6.437 -9.475 -25.746 1.00 0.00 H new ATOM 0 HH12 ARG A 541 5.903 -9.648 -27.421 1.00 0.00 H new ATOM 0 HH21 ARG A 541 7.036 -6.452 -28.401 1.00 0.00 H new ATOM 0 HH22 ARG A 541 6.240 -7.943 -28.915 1.00 0.00 H new ATOM 1431 N THR A 542 10.506 -6.863 -19.881 1.00 0.00 N ATOM 1432 CA THR A 542 10.695 -7.172 -18.463 1.00 0.00 C ATOM 1433 C THR A 542 10.051 -6.056 -17.639 1.00 0.00 C ATOM 1434 O THR A 542 10.414 -4.889 -17.786 1.00 0.00 O ATOM 1435 CB THR A 542 12.208 -7.323 -18.114 1.00 0.00 C ATOM 1436 OG1 THR A 542 12.788 -8.390 -18.885 1.00 0.00 O ATOM 1437 CG2 THR A 542 12.455 -7.588 -16.619 1.00 0.00 C ATOM 0 H THR A 542 10.558 -5.866 -20.090 1.00 0.00 H new ATOM 0 HA THR A 542 10.221 -8.125 -18.230 1.00 0.00 H new ATOM 0 HB THR A 542 12.680 -6.372 -18.361 1.00 0.00 H new ATOM 0 HG1 THR A 542 13.738 -8.477 -18.661 1.00 0.00 H new ATOM 0 HG21 THR A 542 13.526 -7.684 -16.438 1.00 0.00 H new ATOM 0 HG22 THR A 542 12.061 -6.758 -16.032 1.00 0.00 H new ATOM 0 HG23 THR A 542 11.954 -8.510 -16.325 1.00 0.00 H new ATOM 1445 N VAL A 543 9.067 -6.425 -16.813 1.00 0.00 N ATOM 1446 CA VAL A 543 8.294 -5.490 -15.984 1.00 0.00 C ATOM 1447 C VAL A 543 8.603 -5.750 -14.493 1.00 0.00 C ATOM 1448 O VAL A 543 8.865 -6.884 -14.106 1.00 0.00 O ATOM 1449 CB VAL A 543 6.749 -5.662 -16.241 1.00 0.00 C ATOM 1450 CG1 VAL A 543 5.930 -4.613 -15.466 1.00 0.00 C ATOM 1451 CG2 VAL A 543 6.408 -5.634 -17.755 1.00 0.00 C ATOM 0 H VAL A 543 8.779 -7.397 -16.699 1.00 0.00 H new ATOM 0 HA VAL A 543 8.578 -4.471 -16.249 1.00 0.00 H new ATOM 0 HB VAL A 543 6.470 -6.646 -15.865 1.00 0.00 H new ATOM 0 HG11 VAL A 543 4.869 -4.760 -15.666 1.00 0.00 H new ATOM 0 HG12 VAL A 543 6.117 -4.722 -14.398 1.00 0.00 H new ATOM 0 HG13 VAL A 543 6.224 -3.613 -15.785 1.00 0.00 H new ATOM 0 HG21 VAL A 543 5.333 -5.756 -17.888 1.00 0.00 H new ATOM 0 HG22 VAL A 543 6.721 -4.681 -18.181 1.00 0.00 H new ATOM 0 HG23 VAL A 543 6.930 -6.446 -18.261 1.00 0.00 H new ATOM 1461 N LEU A 544 8.592 -4.687 -13.675 1.00 0.00 N ATOM 1462 CA LEU A 544 8.696 -4.785 -12.210 1.00 0.00 C ATOM 1463 C LEU A 544 7.362 -4.326 -11.605 1.00 0.00 C ATOM 1464 O LEU A 544 6.860 -3.239 -11.921 1.00 0.00 O ATOM 1465 CB LEU A 544 9.885 -3.935 -11.684 1.00 0.00 C ATOM 1466 CG LEU A 544 10.222 -4.037 -10.156 1.00 0.00 C ATOM 1467 CD1 LEU A 544 10.417 -5.504 -9.705 1.00 0.00 C ATOM 1468 CD2 LEU A 544 11.458 -3.174 -9.821 1.00 0.00 C ATOM 0 H LEU A 544 8.510 -3.728 -14.013 1.00 0.00 H new ATOM 0 HA LEU A 544 8.893 -5.815 -11.914 1.00 0.00 H new ATOM 0 HB2 LEU A 544 10.776 -4.217 -12.245 1.00 0.00 H new ATOM 0 HB3 LEU A 544 9.681 -2.890 -11.915 1.00 0.00 H new ATOM 0 HG LEU A 544 9.370 -3.649 -9.598 1.00 0.00 H new ATOM 0 HD11 LEU A 544 10.649 -5.530 -8.640 1.00 0.00 H new ATOM 0 HD12 LEU A 544 9.502 -6.066 -9.891 1.00 0.00 H new ATOM 0 HD13 LEU A 544 11.238 -5.951 -10.266 1.00 0.00 H new ATOM 0 HD21 LEU A 544 11.680 -3.254 -8.757 1.00 0.00 H new ATOM 0 HD22 LEU A 544 12.314 -3.525 -10.398 1.00 0.00 H new ATOM 0 HD23 LEU A 544 11.254 -2.133 -10.071 1.00 0.00 H new ATOM 1480 N VAL A 545 6.776 -5.192 -10.782 1.00 0.00 N ATOM 1481 CA VAL A 545 5.508 -4.960 -10.071 1.00 0.00 C ATOM 1482 C VAL A 545 5.823 -4.848 -8.571 1.00 0.00 C ATOM 1483 O VAL A 545 6.835 -5.389 -8.117 1.00 0.00 O ATOM 1484 CB VAL A 545 4.516 -6.157 -10.341 1.00 0.00 C ATOM 1485 CG1 VAL A 545 3.143 -5.975 -9.653 1.00 0.00 C ATOM 1486 CG2 VAL A 545 4.343 -6.409 -11.857 1.00 0.00 C ATOM 0 H VAL A 545 7.179 -6.107 -10.581 1.00 0.00 H new ATOM 0 HA VAL A 545 5.032 -4.044 -10.421 1.00 0.00 H new ATOM 0 HB VAL A 545 4.974 -7.038 -9.891 1.00 0.00 H new ATOM 0 HG11 VAL A 545 2.507 -6.831 -9.878 1.00 0.00 H new ATOM 0 HG12 VAL A 545 3.283 -5.900 -8.575 1.00 0.00 H new ATOM 0 HG13 VAL A 545 2.669 -5.065 -10.021 1.00 0.00 H new ATOM 0 HG21 VAL A 545 3.654 -7.239 -12.012 1.00 0.00 H new ATOM 0 HG22 VAL A 545 3.943 -5.513 -12.332 1.00 0.00 H new ATOM 0 HG23 VAL A 545 5.310 -6.653 -12.298 1.00 0.00 H new ATOM 1496 N ASN A 546 4.971 -4.151 -7.806 1.00 0.00 N ATOM 1497 CA ASN A 546 5.185 -3.952 -6.356 1.00 0.00 C ATOM 1498 C ASN A 546 4.088 -4.656 -5.532 1.00 0.00 C ATOM 1499 O ASN A 546 3.232 -5.355 -6.090 1.00 0.00 O ATOM 1500 CB ASN A 546 5.268 -2.432 -6.042 1.00 0.00 C ATOM 1501 CG ASN A 546 3.919 -1.737 -5.895 1.00 0.00 C ATOM 1502 OD1 ASN A 546 3.495 -1.428 -4.787 1.00 0.00 O ATOM 1503 ND2 ASN A 546 3.208 -1.555 -6.990 1.00 0.00 N ATOM 0 H ASN A 546 4.123 -3.712 -8.164 1.00 0.00 H new ATOM 0 HA ASN A 546 6.132 -4.408 -6.068 1.00 0.00 H new ATOM 0 HB2 ASN A 546 5.834 -2.296 -5.120 1.00 0.00 H new ATOM 0 HB3 ASN A 546 5.830 -1.941 -6.837 1.00 0.00 H new ATOM 0 HD21 ASN A 546 2.275 -1.146 -6.930 1.00 0.00 H new ATOM 0 HD22 ASN A 546 3.590 -1.823 -7.897 1.00 0.00 H new ATOM 1510 N ALA A 547 4.129 -4.438 -4.201 1.00 0.00 N ATOM 1511 CA ALA A 547 3.183 -5.024 -3.223 1.00 0.00 C ATOM 1512 C ALA A 547 1.704 -4.692 -3.531 1.00 0.00 C ATOM 1513 O ALA A 547 0.808 -5.516 -3.300 1.00 0.00 O ATOM 1514 CB ALA A 547 3.560 -4.533 -1.815 1.00 0.00 C ATOM 0 H ALA A 547 4.832 -3.840 -3.766 1.00 0.00 H new ATOM 0 HA ALA A 547 3.268 -6.109 -3.289 1.00 0.00 H new ATOM 0 HB1 ALA A 547 2.871 -4.957 -1.085 1.00 0.00 H new ATOM 0 HB2 ALA A 547 4.577 -4.848 -1.580 1.00 0.00 H new ATOM 0 HB3 ALA A 547 3.500 -3.445 -1.781 1.00 0.00 H new ATOM 1520 N ASP A 548 1.475 -3.469 -4.036 1.00 0.00 N ATOM 1521 CA ASP A 548 0.137 -2.978 -4.434 1.00 0.00 C ATOM 1522 C ASP A 548 -0.489 -3.845 -5.546 1.00 0.00 C ATOM 1523 O ASP A 548 -1.700 -4.124 -5.530 1.00 0.00 O ATOM 1524 CB ASP A 548 0.260 -1.507 -4.904 1.00 0.00 C ATOM 1525 CG ASP A 548 -1.057 -0.901 -5.423 1.00 0.00 C ATOM 1526 OD1 ASP A 548 -1.874 -0.422 -4.602 1.00 0.00 O ATOM 1527 OD2 ASP A 548 -1.281 -0.899 -6.654 1.00 0.00 O ATOM 0 H ASP A 548 2.217 -2.784 -4.182 1.00 0.00 H new ATOM 0 HA ASP A 548 -0.524 -3.042 -3.570 1.00 0.00 H new ATOM 0 HB2 ASP A 548 0.624 -0.901 -4.074 1.00 0.00 H new ATOM 0 HB3 ASP A 548 1.010 -1.450 -5.693 1.00 0.00 H new ATOM 1532 N GLY A 549 0.351 -4.273 -6.500 1.00 0.00 N ATOM 1533 CA GLY A 549 -0.097 -5.052 -7.654 1.00 0.00 C ATOM 1534 C GLY A 549 -0.088 -4.255 -8.956 1.00 0.00 C ATOM 1535 O GLY A 549 -0.460 -4.791 -10.006 1.00 0.00 O ATOM 0 H GLY A 549 1.354 -4.088 -6.490 1.00 0.00 H new ATOM 0 HA2 GLY A 549 0.545 -5.926 -7.766 1.00 0.00 H new ATOM 0 HA3 GLY A 549 -1.106 -5.419 -7.467 1.00 0.00 H new ATOM 1539 N GLU A 550 0.327 -2.972 -8.897 1.00 0.00 N ATOM 1540 CA GLU A 550 0.536 -2.155 -10.113 1.00 0.00 C ATOM 1541 C GLU A 550 1.962 -2.354 -10.659 1.00 0.00 C ATOM 1542 O GLU A 550 2.903 -2.638 -9.894 1.00 0.00 O ATOM 1543 CB GLU A 550 0.272 -0.646 -9.847 1.00 0.00 C ATOM 1544 CG GLU A 550 1.243 0.028 -8.863 1.00 0.00 C ATOM 1545 CD GLU A 550 1.153 1.558 -8.863 1.00 0.00 C ATOM 1546 OE1 GLU A 550 0.267 2.115 -8.178 1.00 0.00 O ATOM 1547 OE2 GLU A 550 1.972 2.213 -9.553 1.00 0.00 O ATOM 0 H GLU A 550 0.523 -2.481 -8.025 1.00 0.00 H new ATOM 0 HA GLU A 550 -0.183 -2.493 -10.859 1.00 0.00 H new ATOM 0 HB2 GLU A 550 0.316 -0.113 -10.797 1.00 0.00 H new ATOM 0 HB3 GLU A 550 -0.743 -0.533 -9.465 1.00 0.00 H new ATOM 0 HG2 GLU A 550 1.041 -0.339 -7.857 1.00 0.00 H new ATOM 0 HG3 GLU A 550 2.262 -0.268 -9.111 1.00 0.00 H new ATOM 1554 N GLU A 551 2.103 -2.184 -11.984 1.00 0.00 N ATOM 1555 CA GLU A 551 3.384 -2.320 -12.698 1.00 0.00 C ATOM 1556 C GLU A 551 4.143 -0.983 -12.648 1.00 0.00 C ATOM 1557 O GLU A 551 3.840 -0.044 -13.404 1.00 0.00 O ATOM 1558 CB GLU A 551 3.105 -2.776 -14.152 1.00 0.00 C ATOM 1559 CG GLU A 551 2.364 -4.124 -14.240 1.00 0.00 C ATOM 1560 CD GLU A 551 1.940 -4.513 -15.666 1.00 0.00 C ATOM 1561 OE1 GLU A 551 0.827 -4.131 -16.093 1.00 0.00 O ATOM 1562 OE2 GLU A 551 2.712 -5.199 -16.366 1.00 0.00 O ATOM 0 H GLU A 551 1.323 -1.946 -12.596 1.00 0.00 H new ATOM 0 HA GLU A 551 4.012 -3.073 -12.222 1.00 0.00 H new ATOM 0 HB2 GLU A 551 2.515 -2.012 -14.657 1.00 0.00 H new ATOM 0 HB3 GLU A 551 4.051 -2.854 -14.688 1.00 0.00 H new ATOM 0 HG2 GLU A 551 3.006 -4.907 -13.837 1.00 0.00 H new ATOM 0 HG3 GLU A 551 1.477 -4.082 -13.607 1.00 0.00 H new ATOM 1569 N VAL A 552 5.106 -0.901 -11.713 1.00 0.00 N ATOM 1570 CA VAL A 552 5.807 0.349 -11.392 1.00 0.00 C ATOM 1571 C VAL A 552 6.837 0.727 -12.471 1.00 0.00 C ATOM 1572 O VAL A 552 6.961 1.902 -12.826 1.00 0.00 O ATOM 1573 CB VAL A 552 6.474 0.289 -9.968 1.00 0.00 C ATOM 1574 CG1 VAL A 552 5.399 0.163 -8.863 1.00 0.00 C ATOM 1575 CG2 VAL A 552 7.526 -0.848 -9.853 1.00 0.00 C ATOM 0 H VAL A 552 5.418 -1.700 -11.161 1.00 0.00 H new ATOM 0 HA VAL A 552 5.054 1.136 -11.374 1.00 0.00 H new ATOM 0 HB VAL A 552 7.009 1.228 -9.827 1.00 0.00 H new ATOM 0 HG11 VAL A 552 5.883 0.123 -7.887 1.00 0.00 H new ATOM 0 HG12 VAL A 552 4.733 1.025 -8.903 1.00 0.00 H new ATOM 0 HG13 VAL A 552 4.822 -0.748 -9.019 1.00 0.00 H new ATOM 0 HG21 VAL A 552 7.956 -0.846 -8.851 1.00 0.00 H new ATOM 0 HG22 VAL A 552 7.046 -1.808 -10.040 1.00 0.00 H new ATOM 0 HG23 VAL A 552 8.316 -0.689 -10.587 1.00 0.00 H new ATOM 1585 N ALA A 553 7.537 -0.277 -13.017 1.00 0.00 N ATOM 1586 CA ALA A 553 8.626 -0.066 -13.992 1.00 0.00 C ATOM 1587 C ALA A 553 8.508 -1.077 -15.139 1.00 0.00 C ATOM 1588 O ALA A 553 7.906 -2.134 -14.964 1.00 0.00 O ATOM 1589 CB ALA A 553 9.994 -0.184 -13.290 1.00 0.00 C ATOM 0 H ALA A 553 7.368 -1.259 -12.798 1.00 0.00 H new ATOM 0 HA ALA A 553 8.543 0.937 -14.411 1.00 0.00 H new ATOM 0 HB1 ALA A 553 10.791 -0.027 -14.017 1.00 0.00 H new ATOM 0 HB2 ALA A 553 10.066 0.568 -12.505 1.00 0.00 H new ATOM 0 HB3 ALA A 553 10.094 -1.177 -12.852 1.00 0.00 H new ATOM 1595 N MET A 554 9.090 -0.743 -16.307 1.00 0.00 N ATOM 1596 CA MET A 554 9.091 -1.636 -17.488 1.00 0.00 C ATOM 1597 C MET A 554 10.224 -1.260 -18.463 1.00 0.00 C ATOM 1598 O MET A 554 10.535 -0.081 -18.653 1.00 0.00 O ATOM 1599 CB MET A 554 7.714 -1.599 -18.223 1.00 0.00 C ATOM 1600 CG MET A 554 7.620 -2.498 -19.466 1.00 0.00 C ATOM 1601 SD MET A 554 6.002 -2.424 -20.270 1.00 0.00 S ATOM 1602 CE MET A 554 6.280 -3.469 -21.703 1.00 0.00 C ATOM 0 H MET A 554 9.569 0.144 -16.461 1.00 0.00 H new ATOM 0 HA MET A 554 9.263 -2.652 -17.131 1.00 0.00 H new ATOM 0 HB2 MET A 554 6.935 -1.894 -17.520 1.00 0.00 H new ATOM 0 HB3 MET A 554 7.504 -0.571 -18.519 1.00 0.00 H new ATOM 0 HG2 MET A 554 8.388 -2.203 -20.180 1.00 0.00 H new ATOM 0 HG3 MET A 554 7.830 -3.528 -19.179 1.00 0.00 H new ATOM 0 HE1 MET A 554 5.368 -3.521 -22.298 1.00 0.00 H new ATOM 0 HE2 MET A 554 7.085 -3.051 -22.308 1.00 0.00 H new ATOM 0 HE3 MET A 554 6.556 -4.471 -21.375 1.00 0.00 H new ATOM 1612 N ARG A 555 10.841 -2.296 -19.056 1.00 0.00 N ATOM 1613 CA ARG A 555 11.850 -2.184 -20.123 1.00 0.00 C ATOM 1614 C ARG A 555 11.490 -3.177 -21.250 1.00 0.00 C ATOM 1615 O ARG A 555 10.669 -4.084 -21.050 1.00 0.00 O ATOM 1616 CB ARG A 555 13.266 -2.519 -19.579 1.00 0.00 C ATOM 1617 CG ARG A 555 13.784 -1.629 -18.427 1.00 0.00 C ATOM 1618 CD ARG A 555 14.039 -0.170 -18.834 1.00 0.00 C ATOM 1619 NE ARG A 555 14.724 0.576 -17.758 1.00 0.00 N ATOM 1620 CZ ARG A 555 15.086 1.865 -17.810 1.00 0.00 C ATOM 1621 NH1 ARG A 555 14.765 2.628 -18.852 1.00 0.00 N ATOM 1622 NH2 ARG A 555 15.760 2.388 -16.797 1.00 0.00 N ATOM 0 H ARG A 555 10.646 -3.263 -18.798 1.00 0.00 H new ATOM 0 HA ARG A 555 11.857 -1.161 -20.500 1.00 0.00 H new ATOM 0 HB2 ARG A 555 13.266 -3.554 -19.238 1.00 0.00 H new ATOM 0 HB3 ARG A 555 13.974 -2.456 -20.405 1.00 0.00 H new ATOM 0 HG2 ARG A 555 13.060 -1.647 -17.613 1.00 0.00 H new ATOM 0 HG3 ARG A 555 14.710 -2.055 -18.040 1.00 0.00 H new ATOM 0 HD2 ARG A 555 14.644 -0.144 -19.740 1.00 0.00 H new ATOM 0 HD3 ARG A 555 13.092 0.315 -19.069 1.00 0.00 H new ATOM 0 HE ARG A 555 14.940 0.066 -16.902 1.00 0.00 H new ATOM 0 HH11 ARG A 555 14.235 2.234 -19.629 1.00 0.00 H new ATOM 0 HH12 ARG A 555 15.049 3.607 -18.874 1.00 0.00 H new ATOM 0 HH21 ARG A 555 15.997 1.811 -15.990 1.00 0.00 H new ATOM 0 HH22 ARG A 555 16.042 3.368 -16.824 1.00 0.00 H new ATOM 1636 N THR A 556 12.095 -2.988 -22.428 1.00 0.00 N ATOM 1637 CA THR A 556 12.001 -3.927 -23.558 1.00 0.00 C ATOM 1638 C THR A 556 13.390 -4.017 -24.218 1.00 0.00 C ATOM 1639 O THR A 556 13.953 -2.992 -24.617 1.00 0.00 O ATOM 1640 CB THR A 556 10.915 -3.474 -24.598 1.00 0.00 C ATOM 1641 OG1 THR A 556 9.635 -3.334 -23.952 1.00 0.00 O ATOM 1642 CG2 THR A 556 10.781 -4.462 -25.777 1.00 0.00 C ATOM 0 H THR A 556 12.671 -2.170 -22.629 1.00 0.00 H new ATOM 0 HA THR A 556 11.692 -4.907 -23.193 1.00 0.00 H new ATOM 0 HB THR A 556 11.243 -2.515 -24.999 1.00 0.00 H new ATOM 0 HG1 THR A 556 8.966 -3.050 -24.609 1.00 0.00 H new ATOM 0 HG21 THR A 556 10.018 -4.103 -26.467 1.00 0.00 H new ATOM 0 HG22 THR A 556 11.735 -4.538 -26.298 1.00 0.00 H new ATOM 0 HG23 THR A 556 10.495 -5.444 -25.399 1.00 0.00 H new ATOM 1650 N VAL A 557 13.958 -5.237 -24.285 1.00 0.00 N ATOM 1651 CA VAL A 557 15.327 -5.471 -24.786 1.00 0.00 C ATOM 1652 C VAL A 557 15.318 -6.497 -25.935 1.00 0.00 C ATOM 1653 O VAL A 557 14.656 -7.537 -25.843 1.00 0.00 O ATOM 1654 CB VAL A 557 16.271 -5.985 -23.632 1.00 0.00 C ATOM 1655 CG1 VAL A 557 17.724 -6.188 -24.125 1.00 0.00 C ATOM 1656 CG2 VAL A 557 16.230 -5.042 -22.407 1.00 0.00 C ATOM 0 H VAL A 557 13.480 -6.089 -23.993 1.00 0.00 H new ATOM 0 HA VAL A 557 15.709 -4.520 -25.157 1.00 0.00 H new ATOM 0 HB VAL A 557 15.892 -6.958 -23.320 1.00 0.00 H new ATOM 0 HG11 VAL A 557 18.342 -6.542 -23.300 1.00 0.00 H new ATOM 0 HG12 VAL A 557 17.736 -6.923 -24.929 1.00 0.00 H new ATOM 0 HG13 VAL A 557 18.119 -5.241 -24.493 1.00 0.00 H new ATOM 0 HG21 VAL A 557 16.892 -5.426 -21.630 1.00 0.00 H new ATOM 0 HG22 VAL A 557 16.558 -4.046 -22.704 1.00 0.00 H new ATOM 0 HG23 VAL A 557 15.211 -4.989 -22.022 1.00 0.00 H new ATOM 1666 N LYS A 558 16.047 -6.178 -27.020 1.00 0.00 N ATOM 1667 CA LYS A 558 16.308 -7.110 -28.134 1.00 0.00 C ATOM 1668 C LYS A 558 17.816 -7.437 -28.196 1.00 0.00 C ATOM 1669 O LYS A 558 18.647 -6.525 -28.253 1.00 0.00 O ATOM 1670 CB LYS A 558 15.851 -6.525 -29.511 1.00 0.00 C ATOM 1671 CG LYS A 558 14.320 -6.383 -29.721 1.00 0.00 C ATOM 1672 CD LYS A 558 13.707 -5.095 -29.126 1.00 0.00 C ATOM 1673 CE LYS A 558 12.196 -4.985 -29.423 1.00 0.00 C ATOM 1674 NZ LYS A 558 11.649 -3.645 -29.103 1.00 0.00 N ATOM 0 H LYS A 558 16.474 -5.261 -27.150 1.00 0.00 H new ATOM 0 HA LYS A 558 15.730 -8.014 -27.945 1.00 0.00 H new ATOM 0 HB2 LYS A 558 16.306 -5.542 -29.634 1.00 0.00 H new ATOM 0 HB3 LYS A 558 16.248 -7.161 -30.302 1.00 0.00 H new ATOM 0 HG2 LYS A 558 14.109 -6.410 -30.790 1.00 0.00 H new ATOM 0 HG3 LYS A 558 13.824 -7.245 -29.276 1.00 0.00 H new ATOM 0 HD2 LYS A 558 13.867 -5.082 -28.048 1.00 0.00 H new ATOM 0 HD3 LYS A 558 14.222 -4.226 -29.535 1.00 0.00 H new ATOM 0 HE2 LYS A 558 12.020 -5.204 -30.476 1.00 0.00 H new ATOM 0 HE3 LYS A 558 11.660 -5.739 -28.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 558 10.613 -3.663 -29.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 558 11.910 -3.387 -28.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 558 12.040 -2.944 -29.764 1.00 0.00 H new ATOM 1688 N LYS A 559 18.160 -8.736 -28.157 1.00 0.00 N ATOM 1689 CA LYS A 559 19.510 -9.211 -28.487 1.00 0.00 C ATOM 1690 C LYS A 559 19.743 -9.036 -29.999 1.00 0.00 C ATOM 1691 O LYS A 559 19.225 -9.804 -30.815 1.00 0.00 O ATOM 1692 CB LYS A 559 19.689 -10.707 -28.078 1.00 0.00 C ATOM 1693 CG LYS A 559 21.026 -11.345 -28.534 1.00 0.00 C ATOM 1694 CD LYS A 559 21.135 -12.845 -28.178 1.00 0.00 C ATOM 1695 CE LYS A 559 22.348 -13.529 -28.848 1.00 0.00 C ATOM 1696 NZ LYS A 559 23.645 -12.868 -28.528 1.00 0.00 N ATOM 0 H LYS A 559 17.513 -9.480 -27.897 1.00 0.00 H new ATOM 0 HA LYS A 559 20.243 -8.626 -27.931 1.00 0.00 H new ATOM 0 HB2 LYS A 559 19.616 -10.785 -26.993 1.00 0.00 H new ATOM 0 HB3 LYS A 559 18.865 -11.285 -28.495 1.00 0.00 H new ATOM 0 HG2 LYS A 559 21.130 -11.225 -29.612 1.00 0.00 H new ATOM 0 HG3 LYS A 559 21.854 -10.807 -28.073 1.00 0.00 H new ATOM 0 HD2 LYS A 559 21.214 -12.953 -27.096 1.00 0.00 H new ATOM 0 HD3 LYS A 559 20.221 -13.354 -28.484 1.00 0.00 H new ATOM 0 HE2 LYS A 559 22.391 -14.571 -28.531 1.00 0.00 H new ATOM 0 HE3 LYS A 559 22.205 -13.530 -29.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 559 24.380 -13.212 -29.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 559 23.545 -11.838 -28.632 1.00 0.00 H new ATOM 0 HZ3 LYS A 559 23.917 -13.092 -27.550 1.00 0.00 H new