USER MOD reduce.3.24.130724 H: found=0, std=0, add=841, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 841 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 470 LYS NZ :NH3+ -165:sc= -0.789 (180deg=-1.37) USER MOD Set 1.2: A 472 TYR OH : rot 180:sc= 0 USER MOD Single : A 420 SER OG : rot 180:sc= 0 USER MOD Single : A 421 SER OG : rot 180:sc= 0 USER MOD Single : A 423 SER OG : rot -59:sc= 0.516 USER MOD Single : A 424 SER OG : rot 180:sc= -0.261 USER MOD Single : A 426 SER OG : rot 180:sc= 0 USER MOD Single : A 428 LYS NZ :NH3+ 159:sc=-0.00204 (180deg=-0.422) USER MOD Single : A 444 THR OG1 : rot 180:sc=-0.00228 USER MOD Single : A 446 SER OG : rot 180:sc= 0 USER MOD Single : A 459 HIS : no HD1:sc= -0.0617 X(o=-0.062,f=0) USER MOD Single : A 460 LYS NZ :NH3+ -108:sc= 0.124 (180deg=-1.67) USER MOD Single : A 463 SER OG : rot 180:sc= -0.0184 USER MOD Single : A 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 465 SER OG : rot 18:sc= 0.63 USER MOD Single : A 466 TYR OH : rot 180:sc= 0 USER MOD Single : A 478 GLN : amide:sc= -0.0564 X(o=-0.056,f=-0.07) USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 482 SER OG : rot 84:sc= 0.0721 USER MOD Single : A 484 GLN : amide:sc= -0.149 X(o=-0.15,f=-0.15) USER MOD Single : A 490 CYS SG : rot 60:sc= -0.484 USER MOD Single : A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 TYR OH : rot 180:sc= 0 USER MOD Single : A 500 CYS SG : rot 25:sc= 0.3 USER MOD Single : A 502 SER OG : rot 31:sc= 0.0894 USER MOD Single : A 503 SER OG : rot 180:sc= -1.02 USER MOD Single : A 505 THR OG1 : rot 150:sc= 0 USER MOD Single : A 507 LYS NZ :NH3+ 138:sc= 0.0623 (180deg=0) USER MOD Single : A 509 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 512 GLN : amide:sc= 0.811 K(o=0.81,f=-5.3!) USER MOD Single : A 517 ASN : amide:sc= -0.635 K(o=-0.63,f=-6.5!) USER MOD Single : A 519 SER OG : rot 180:sc= 0 USER MOD Single : A 521 SER OG : rot 180:sc= 0 USER MOD Single : A 525 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 527 SER OG : rot 33:sc= 0.785 USER MOD Single : A 530 SER OG : rot 180:sc= 0 USER MOD Single : A 531 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 419 -16.034 14.622 4.613 1.00 0.00 N ATOM 2 CA GLY A 419 -16.392 13.368 5.250 1.00 0.00 C ATOM 3 C GLY A 419 -15.365 12.281 5.007 1.00 0.00 C ATOM 4 O GLY A 419 -14.164 12.509 5.147 1.00 0.00 O ATOM 0 HA2 GLY A 419 -16.501 13.527 6.323 1.00 0.00 H new ATOM 0 HA3 GLY A 419 -17.361 13.038 4.876 1.00 0.00 H new ATOM 8 N SER A 420 -15.838 11.093 4.642 1.00 0.00 N ATOM 9 CA SER A 420 -14.952 9.964 4.384 1.00 0.00 C ATOM 10 C SER A 420 -14.995 9.565 2.912 1.00 0.00 C ATOM 11 O SER A 420 -15.974 8.983 2.443 1.00 0.00 O ATOM 12 CB SER A 420 -15.344 8.771 5.259 1.00 0.00 C ATOM 13 OG SER A 420 -14.875 8.937 6.586 1.00 0.00 O ATOM 0 H SER A 420 -16.829 10.888 4.518 1.00 0.00 H new ATOM 0 HA SER A 420 -13.935 10.268 4.631 1.00 0.00 H new ATOM 0 HB2 SER A 420 -16.428 8.660 5.264 1.00 0.00 H new ATOM 0 HB3 SER A 420 -14.932 7.855 4.836 1.00 0.00 H new ATOM 0 HG SER A 420 -15.139 8.163 7.126 1.00 0.00 H new ATOM 19 N SER A 421 -13.926 9.882 2.188 1.00 0.00 N ATOM 20 CA SER A 421 -13.842 9.560 0.768 1.00 0.00 C ATOM 21 C SER A 421 -12.412 9.715 0.260 1.00 0.00 C ATOM 22 O SER A 421 -11.550 10.256 0.953 1.00 0.00 O ATOM 23 CB SER A 421 -14.782 10.460 -0.036 1.00 0.00 C ATOM 24 OG SER A 421 -15.070 9.894 -1.303 1.00 0.00 O ATOM 0 H SER A 421 -13.107 10.361 2.561 1.00 0.00 H new ATOM 0 HA SER A 421 -14.145 8.521 0.637 1.00 0.00 H new ATOM 0 HB2 SER A 421 -15.709 10.610 0.518 1.00 0.00 H new ATOM 0 HB3 SER A 421 -14.327 11.442 -0.168 1.00 0.00 H new ATOM 0 HG SER A 421 -15.674 10.487 -1.797 1.00 0.00 H new ATOM 30 N GLY A 422 -12.167 9.236 -0.956 1.00 0.00 N ATOM 31 CA GLY A 422 -10.841 9.330 -1.537 1.00 0.00 C ATOM 32 C GLY A 422 -10.465 10.754 -1.895 1.00 0.00 C ATOM 33 O GLY A 422 -9.422 11.253 -1.472 1.00 0.00 O ATOM 0 H GLY A 422 -12.864 8.785 -1.549 1.00 0.00 H new ATOM 0 HA2 GLY A 422 -10.110 8.930 -0.834 1.00 0.00 H new ATOM 0 HA3 GLY A 422 -10.795 8.709 -2.432 1.00 0.00 H new ATOM 37 N SER A 423 -11.314 11.409 -2.680 1.00 0.00 N ATOM 38 CA SER A 423 -11.063 12.783 -3.100 1.00 0.00 C ATOM 39 C SER A 423 -9.694 12.906 -3.762 1.00 0.00 C ATOM 40 O SER A 423 -8.963 13.868 -3.527 1.00 0.00 O ATOM 41 CB SER A 423 -11.149 13.729 -1.901 1.00 0.00 C ATOM 42 OG SER A 423 -11.064 15.082 -2.312 1.00 0.00 O ATOM 0 H SER A 423 -12.182 11.011 -3.038 1.00 0.00 H new ATOM 0 HA SER A 423 -11.826 13.060 -3.827 1.00 0.00 H new ATOM 0 HB2 SER A 423 -12.087 13.565 -1.371 1.00 0.00 H new ATOM 0 HB3 SER A 423 -10.344 13.507 -1.200 1.00 0.00 H new ATOM 0 HG SER A 423 -10.217 15.229 -2.782 1.00 0.00 H new ATOM 48 N SER A 424 -9.354 11.924 -4.591 1.00 0.00 N ATOM 49 CA SER A 424 -8.071 11.919 -5.285 1.00 0.00 C ATOM 50 C SER A 424 -6.959 12.430 -4.374 1.00 0.00 C ATOM 51 O SER A 424 -6.120 13.230 -4.788 1.00 0.00 O ATOM 52 CB SER A 424 -8.147 12.780 -6.547 1.00 0.00 C ATOM 53 OG SER A 424 -8.662 14.068 -6.257 1.00 0.00 O ATOM 0 H SER A 424 -9.949 11.122 -4.798 1.00 0.00 H new ATOM 0 HA SER A 424 -7.843 10.891 -5.568 1.00 0.00 H new ATOM 0 HB2 SER A 424 -7.154 12.873 -6.988 1.00 0.00 H new ATOM 0 HB3 SER A 424 -8.780 12.290 -7.287 1.00 0.00 H new ATOM 0 HG SER A 424 -8.699 14.599 -7.080 1.00 0.00 H new ATOM 59 N GLY A 425 -6.959 11.962 -3.129 1.00 0.00 N ATOM 60 CA GLY A 425 -5.946 12.382 -2.179 1.00 0.00 C ATOM 61 C GLY A 425 -4.542 12.049 -2.642 1.00 0.00 C ATOM 62 O GLY A 425 -4.341 11.629 -3.782 1.00 0.00 O ATOM 0 H GLY A 425 -7.642 11.300 -2.762 1.00 0.00 H new ATOM 0 HA2 GLY A 425 -6.027 13.457 -2.018 1.00 0.00 H new ATOM 0 HA3 GLY A 425 -6.132 11.901 -1.218 1.00 0.00 H new ATOM 66 N SER A 426 -3.568 12.238 -1.758 1.00 0.00 N ATOM 67 CA SER A 426 -2.174 11.960 -2.085 1.00 0.00 C ATOM 68 C SER A 426 -2.034 10.593 -2.747 1.00 0.00 C ATOM 69 O SER A 426 -2.990 9.821 -2.810 1.00 0.00 O ATOM 70 CB SER A 426 -1.311 12.020 -0.823 1.00 0.00 C ATOM 71 OG SER A 426 0.019 12.397 -1.133 1.00 0.00 O ATOM 0 H SER A 426 -3.718 12.582 -0.810 1.00 0.00 H new ATOM 0 HA SER A 426 -1.832 12.721 -2.787 1.00 0.00 H new ATOM 0 HB2 SER A 426 -1.740 12.733 -0.119 1.00 0.00 H new ATOM 0 HB3 SER A 426 -1.312 11.047 -0.332 1.00 0.00 H new ATOM 0 HG SER A 426 0.550 12.430 -0.310 1.00 0.00 H new ATOM 77 N ARG A 427 -0.834 10.301 -3.239 1.00 0.00 N ATOM 78 CA ARG A 427 -0.567 9.029 -3.898 1.00 0.00 C ATOM 79 C ARG A 427 -0.480 7.897 -2.878 1.00 0.00 C ATOM 80 O ARG A 427 -0.972 6.793 -3.115 1.00 0.00 O ATOM 81 CB ARG A 427 0.732 9.108 -4.701 1.00 0.00 C ATOM 82 CG ARG A 427 0.732 10.205 -5.752 1.00 0.00 C ATOM 83 CD ARG A 427 1.632 9.852 -6.926 1.00 0.00 C ATOM 84 NE ARG A 427 2.198 11.040 -7.559 1.00 0.00 N ATOM 85 CZ ARG A 427 3.208 11.735 -7.047 1.00 0.00 C ATOM 86 NH1 ARG A 427 3.761 11.362 -5.901 1.00 0.00 N ATOM 87 NH2 ARG A 427 3.668 12.805 -7.682 1.00 0.00 N ATOM 0 H ARG A 427 -0.031 10.929 -3.193 1.00 0.00 H new ATOM 0 HA ARG A 427 -1.393 8.820 -4.578 1.00 0.00 H new ATOM 0 HB2 ARG A 427 1.563 9.273 -4.016 1.00 0.00 H new ATOM 0 HB3 ARG A 427 0.907 8.149 -5.189 1.00 0.00 H new ATOM 0 HG2 ARG A 427 -0.285 10.369 -6.108 1.00 0.00 H new ATOM 0 HG3 ARG A 427 1.067 11.140 -5.303 1.00 0.00 H new ATOM 0 HD2 ARG A 427 2.439 9.205 -6.582 1.00 0.00 H new ATOM 0 HD3 ARG A 427 1.062 9.286 -7.662 1.00 0.00 H new ATOM 0 HE ARG A 427 1.796 11.353 -8.443 1.00 0.00 H new ATOM 0 HH11 ARG A 427 3.411 10.539 -5.410 1.00 0.00 H new ATOM 0 HH12 ARG A 427 4.536 11.898 -5.511 1.00 0.00 H new ATOM 0 HH21 ARG A 427 3.246 13.095 -8.564 1.00 0.00 H new ATOM 0 HH22 ARG A 427 4.443 13.338 -7.288 1.00 0.00 H new ATOM 101 N LYS A 428 0.151 8.178 -1.743 1.00 0.00 N ATOM 102 CA LYS A 428 0.304 7.185 -0.686 1.00 0.00 C ATOM 103 C LYS A 428 -1.031 6.520 -0.367 1.00 0.00 C ATOM 104 O LYS A 428 -2.081 7.161 -0.410 1.00 0.00 O ATOM 105 CB LYS A 428 0.876 7.836 0.575 1.00 0.00 C ATOM 106 CG LYS A 428 1.276 6.838 1.648 1.00 0.00 C ATOM 107 CD LYS A 428 1.563 7.527 2.971 1.00 0.00 C ATOM 108 CE LYS A 428 2.588 6.757 3.789 1.00 0.00 C ATOM 109 NZ LYS A 428 3.958 6.877 3.217 1.00 0.00 N ATOM 0 H LYS A 428 0.565 9.086 -1.531 1.00 0.00 H new ATOM 0 HA LYS A 428 0.996 6.420 -1.038 1.00 0.00 H new ATOM 0 HB2 LYS A 428 1.747 8.432 0.303 1.00 0.00 H new ATOM 0 HB3 LYS A 428 0.136 8.522 0.987 1.00 0.00 H new ATOM 0 HG2 LYS A 428 0.478 6.108 1.783 1.00 0.00 H new ATOM 0 HG3 LYS A 428 2.160 6.288 1.324 1.00 0.00 H new ATOM 0 HD2 LYS A 428 1.929 8.537 2.785 1.00 0.00 H new ATOM 0 HD3 LYS A 428 0.639 7.623 3.541 1.00 0.00 H new ATOM 0 HE2 LYS A 428 2.588 7.129 4.814 1.00 0.00 H new ATOM 0 HE3 LYS A 428 2.303 5.706 3.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 4.661 6.661 3.952 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 4.065 6.207 2.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 4.106 7.846 2.870 1.00 0.00 H new ATOM 123 N VAL A 429 -0.984 5.231 -0.045 1.00 0.00 N ATOM 124 CA VAL A 429 -2.190 4.481 0.284 1.00 0.00 C ATOM 125 C VAL A 429 -1.951 3.549 1.468 1.00 0.00 C ATOM 126 O VAL A 429 -0.967 2.811 1.501 1.00 0.00 O ATOM 127 CB VAL A 429 -2.680 3.651 -0.917 1.00 0.00 C ATOM 128 CG1 VAL A 429 -3.935 2.873 -0.553 1.00 0.00 C ATOM 129 CG2 VAL A 429 -2.930 4.551 -2.118 1.00 0.00 C ATOM 0 H VAL A 429 -0.124 4.685 -0.005 1.00 0.00 H new ATOM 0 HA VAL A 429 -2.955 5.211 0.548 1.00 0.00 H new ATOM 0 HB VAL A 429 -1.903 2.935 -1.183 1.00 0.00 H new ATOM 0 HG11 VAL A 429 -4.266 2.293 -1.414 1.00 0.00 H new ATOM 0 HG12 VAL A 429 -3.718 2.200 0.276 1.00 0.00 H new ATOM 0 HG13 VAL A 429 -4.722 3.568 -0.260 1.00 0.00 H new ATOM 0 HG21 VAL A 429 -3.276 3.949 -2.958 1.00 0.00 H new ATOM 0 HG22 VAL A 429 -3.689 5.292 -1.866 1.00 0.00 H new ATOM 0 HG23 VAL A 429 -2.005 5.058 -2.392 1.00 0.00 H new ATOM 139 N PHE A 430 -2.859 3.589 2.437 1.00 0.00 N ATOM 140 CA PHE A 430 -2.748 2.748 3.623 1.00 0.00 C ATOM 141 C PHE A 430 -3.440 1.406 3.406 1.00 0.00 C ATOM 142 O PHE A 430 -4.594 1.351 2.981 1.00 0.00 O ATOM 143 CB PHE A 430 -3.355 3.457 4.836 1.00 0.00 C ATOM 144 CG PHE A 430 -3.578 2.550 6.011 1.00 0.00 C ATOM 145 CD1 PHE A 430 -2.508 1.942 6.647 1.00 0.00 C ATOM 146 CD2 PHE A 430 -4.858 2.305 6.481 1.00 0.00 C ATOM 147 CE1 PHE A 430 -2.711 1.106 7.729 1.00 0.00 C ATOM 148 CE2 PHE A 430 -5.068 1.470 7.563 1.00 0.00 C ATOM 149 CZ PHE A 430 -3.992 0.871 8.188 1.00 0.00 C ATOM 0 H PHE A 430 -3.680 4.195 2.424 1.00 0.00 H new ATOM 0 HA PHE A 430 -1.690 2.565 3.809 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -2.697 4.273 5.137 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -4.306 3.904 4.547 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -1.504 2.123 6.293 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -5.702 2.772 5.996 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -1.868 0.637 8.215 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -6.071 1.287 7.919 1.00 0.00 H new ATOM 0 HZ PHE A 430 -4.152 0.220 9.035 1.00 0.00 H new ATOM 159 N VAL A 431 -2.726 0.324 3.700 1.00 0.00 N ATOM 160 CA VAL A 431 -3.270 -1.019 3.538 1.00 0.00 C ATOM 161 C VAL A 431 -3.154 -1.819 4.830 1.00 0.00 C ATOM 162 O VAL A 431 -2.058 -2.020 5.352 1.00 0.00 O ATOM 163 CB VAL A 431 -2.554 -1.782 2.408 1.00 0.00 C ATOM 164 CG1 VAL A 431 -3.304 -3.061 2.068 1.00 0.00 C ATOM 165 CG2 VAL A 431 -2.405 -0.898 1.179 1.00 0.00 C ATOM 0 H VAL A 431 -1.769 0.351 4.052 1.00 0.00 H new ATOM 0 HA VAL A 431 -4.323 -0.905 3.279 1.00 0.00 H new ATOM 0 HB VAL A 431 -1.557 -2.055 2.753 1.00 0.00 H new ATOM 0 HG11 VAL A 431 -2.783 -3.586 1.268 1.00 0.00 H new ATOM 0 HG12 VAL A 431 -3.352 -3.700 2.950 1.00 0.00 H new ATOM 0 HG13 VAL A 431 -4.315 -2.815 1.743 1.00 0.00 H new ATOM 0 HG21 VAL A 431 -1.897 -1.453 0.391 1.00 0.00 H new ATOM 0 HG22 VAL A 431 -3.391 -0.592 0.829 1.00 0.00 H new ATOM 0 HG23 VAL A 431 -1.820 -0.015 1.435 1.00 0.00 H new ATOM 175 N GLY A 432 -4.293 -2.275 5.342 1.00 0.00 N ATOM 176 CA GLY A 432 -4.298 -3.049 6.570 1.00 0.00 C ATOM 177 C GLY A 432 -4.995 -4.385 6.410 1.00 0.00 C ATOM 178 O GLY A 432 -6.179 -4.440 6.081 1.00 0.00 O ATOM 0 H GLY A 432 -5.213 -2.122 4.928 1.00 0.00 H new ATOM 0 HA2 GLY A 432 -3.271 -3.215 6.895 1.00 0.00 H new ATOM 0 HA3 GLY A 432 -4.792 -2.476 7.355 1.00 0.00 H new ATOM 182 N GLY A 433 -4.257 -5.467 6.643 1.00 0.00 N ATOM 183 CA GLY A 433 -4.829 -6.795 6.516 1.00 0.00 C ATOM 184 C GLY A 433 -4.040 -7.677 5.569 1.00 0.00 C ATOM 185 O GLY A 433 -4.591 -8.595 4.959 1.00 0.00 O ATOM 0 H GLY A 433 -3.275 -5.447 6.917 1.00 0.00 H new ATOM 0 HA2 GLY A 433 -4.869 -7.266 7.498 1.00 0.00 H new ATOM 0 HA3 GLY A 433 -5.856 -6.713 6.160 1.00 0.00 H new ATOM 189 N LEU A 434 -2.747 -7.400 5.443 1.00 0.00 N ATOM 190 CA LEU A 434 -1.880 -8.175 4.562 1.00 0.00 C ATOM 191 C LEU A 434 -1.505 -9.508 5.201 1.00 0.00 C ATOM 192 O LEU A 434 -1.280 -9.604 6.408 1.00 0.00 O ATOM 193 CB LEU A 434 -0.615 -7.381 4.231 1.00 0.00 C ATOM 194 CG LEU A 434 -0.817 -6.112 3.401 1.00 0.00 C ATOM 195 CD1 LEU A 434 0.466 -5.297 3.353 1.00 0.00 C ATOM 196 CD2 LEU A 434 -1.282 -6.463 1.995 1.00 0.00 C ATOM 0 H LEU A 434 -2.276 -6.644 5.940 1.00 0.00 H new ATOM 0 HA LEU A 434 -2.427 -8.376 3.641 1.00 0.00 H new ATOM 0 HB2 LEU A 434 -0.128 -7.106 5.166 1.00 0.00 H new ATOM 0 HB3 LEU A 434 0.071 -8.036 3.695 1.00 0.00 H new ATOM 0 HG LEU A 434 -1.589 -5.508 3.877 1.00 0.00 H new ATOM 0 HD11 LEU A 434 0.304 -4.398 2.758 1.00 0.00 H new ATOM 0 HD12 LEU A 434 0.756 -5.015 4.365 1.00 0.00 H new ATOM 0 HD13 LEU A 434 1.259 -5.893 2.901 1.00 0.00 H new ATOM 0 HD21 LEU A 434 -1.421 -5.548 1.419 1.00 0.00 H new ATOM 0 HD22 LEU A 434 -0.533 -7.088 1.509 1.00 0.00 H new ATOM 0 HD23 LEU A 434 -2.226 -7.005 2.049 1.00 0.00 H new ATOM 208 N PRO A 435 -1.433 -10.562 4.374 1.00 0.00 N ATOM 209 CA PRO A 435 -1.082 -11.908 4.836 1.00 0.00 C ATOM 210 C PRO A 435 0.147 -11.909 5.739 1.00 0.00 C ATOM 211 O PRO A 435 1.030 -11.059 5.626 1.00 0.00 O ATOM 212 CB PRO A 435 -0.792 -12.664 3.537 1.00 0.00 C ATOM 213 CG PRO A 435 -1.608 -11.968 2.503 1.00 0.00 C ATOM 214 CD PRO A 435 -1.689 -10.520 2.925 1.00 0.00 C ATOM 0 HA PRO A 435 -1.876 -12.353 5.436 1.00 0.00 H new ATOM 0 HB2 PRO A 435 0.269 -12.634 3.290 1.00 0.00 H new ATOM 0 HB3 PRO A 435 -1.070 -13.715 3.620 1.00 0.00 H new ATOM 0 HG2 PRO A 435 -1.148 -12.060 1.519 1.00 0.00 H new ATOM 0 HG3 PRO A 435 -2.603 -12.408 2.433 1.00 0.00 H new ATOM 0 HD2 PRO A 435 -0.950 -9.910 2.406 1.00 0.00 H new ATOM 0 HD3 PRO A 435 -2.667 -10.093 2.704 1.00 0.00 H new ATOM 222 N PRO A 436 0.207 -12.885 6.657 1.00 0.00 N ATOM 223 CA PRO A 436 1.323 -13.021 7.596 1.00 0.00 C ATOM 224 C PRO A 436 2.544 -13.673 6.956 1.00 0.00 C ATOM 225 O PRO A 436 3.579 -13.843 7.600 1.00 0.00 O ATOM 226 CB PRO A 436 0.754 -13.919 8.697 1.00 0.00 C ATOM 227 CG PRO A 436 -0.288 -14.738 8.017 1.00 0.00 C ATOM 228 CD PRO A 436 -0.811 -13.932 6.847 1.00 0.00 C ATOM 0 HA PRO A 436 1.673 -12.053 7.955 1.00 0.00 H new ATOM 0 HB2 PRO A 436 1.529 -14.548 9.135 1.00 0.00 H new ATOM 0 HB3 PRO A 436 0.327 -13.329 9.508 1.00 0.00 H new ATOM 0 HG2 PRO A 436 0.132 -15.684 7.674 1.00 0.00 H new ATOM 0 HG3 PRO A 436 -1.096 -14.980 8.707 1.00 0.00 H new ATOM 0 HD2 PRO A 436 -0.922 -14.548 5.955 1.00 0.00 H new ATOM 0 HD3 PRO A 436 -1.790 -13.504 7.062 1.00 0.00 H new ATOM 236 N ASP A 437 2.416 -14.035 5.684 1.00 0.00 N ATOM 237 CA ASP A 437 3.510 -14.667 4.955 1.00 0.00 C ATOM 238 C ASP A 437 3.668 -14.049 3.569 1.00 0.00 C ATOM 239 O ASP A 437 3.917 -14.753 2.590 1.00 0.00 O ATOM 240 CB ASP A 437 3.267 -16.172 4.832 1.00 0.00 C ATOM 241 CG ASP A 437 4.505 -16.923 4.382 1.00 0.00 C ATOM 242 OD1 ASP A 437 4.700 -17.065 3.157 1.00 0.00 O ATOM 243 OD2 ASP A 437 5.278 -17.370 5.256 1.00 0.00 O ATOM 0 H ASP A 437 1.566 -13.902 5.136 1.00 0.00 H new ATOM 0 HA ASP A 437 4.431 -14.500 5.514 1.00 0.00 H new ATOM 0 HB2 ASP A 437 2.938 -16.564 5.794 1.00 0.00 H new ATOM 0 HB3 ASP A 437 2.459 -16.350 4.122 1.00 0.00 H new ATOM 248 N ILE A 438 3.521 -12.731 3.494 1.00 0.00 N ATOM 249 CA ILE A 438 3.647 -12.019 2.228 1.00 0.00 C ATOM 250 C ILE A 438 4.891 -11.137 2.216 1.00 0.00 C ATOM 251 O ILE A 438 5.196 -10.463 3.200 1.00 0.00 O ATOM 252 CB ILE A 438 2.410 -11.147 1.947 1.00 0.00 C ATOM 253 CG1 ILE A 438 2.492 -10.544 0.543 1.00 0.00 C ATOM 254 CG2 ILE A 438 2.285 -10.050 2.994 1.00 0.00 C ATOM 255 CD1 ILE A 438 1.182 -9.967 0.055 1.00 0.00 C ATOM 0 H ILE A 438 3.314 -12.134 4.295 1.00 0.00 H new ATOM 0 HA ILE A 438 3.733 -12.775 1.447 1.00 0.00 H new ATOM 0 HB ILE A 438 1.521 -11.776 2.001 1.00 0.00 H new ATOM 0 HG12 ILE A 438 3.249 -9.760 0.537 1.00 0.00 H new ATOM 0 HG13 ILE A 438 2.823 -11.313 -0.155 1.00 0.00 H new ATOM 0 HG21 ILE A 438 1.406 -9.442 2.781 1.00 0.00 H new ATOM 0 HG22 ILE A 438 2.185 -10.500 3.982 1.00 0.00 H new ATOM 0 HG23 ILE A 438 3.175 -9.421 2.970 1.00 0.00 H new ATOM 0 HD11 ILE A 438 1.315 -9.557 -0.946 1.00 0.00 H new ATOM 0 HD12 ILE A 438 0.426 -10.752 0.028 1.00 0.00 H new ATOM 0 HD13 ILE A 438 0.859 -9.175 0.731 1.00 0.00 H new ATOM 267 N ASP A 439 5.603 -11.145 1.095 1.00 0.00 N ATOM 268 CA ASP A 439 6.813 -10.342 0.952 1.00 0.00 C ATOM 269 C ASP A 439 6.538 -9.087 0.130 1.00 0.00 C ATOM 270 O ASP A 439 5.463 -8.936 -0.449 1.00 0.00 O ATOM 271 CB ASP A 439 7.921 -11.165 0.294 1.00 0.00 C ATOM 272 CG ASP A 439 7.614 -11.497 -1.153 1.00 0.00 C ATOM 273 OD1 ASP A 439 7.861 -10.638 -2.025 1.00 0.00 O ATOM 274 OD2 ASP A 439 7.128 -12.617 -1.414 1.00 0.00 O ATOM 0 H ASP A 439 5.364 -11.698 0.272 1.00 0.00 H new ATOM 0 HA ASP A 439 7.138 -10.039 1.947 1.00 0.00 H new ATOM 0 HB2 ASP A 439 8.859 -10.613 0.346 1.00 0.00 H new ATOM 0 HB3 ASP A 439 8.064 -12.090 0.853 1.00 0.00 H new ATOM 279 N GLU A 440 7.517 -8.188 0.086 1.00 0.00 N ATOM 280 CA GLU A 440 7.379 -6.945 -0.663 1.00 0.00 C ATOM 281 C GLU A 440 6.841 -7.212 -2.066 1.00 0.00 C ATOM 282 O GLU A 440 5.705 -6.858 -2.385 1.00 0.00 O ATOM 283 CB GLU A 440 8.725 -6.223 -0.750 1.00 0.00 C ATOM 284 CG GLU A 440 8.652 -4.882 -1.459 1.00 0.00 C ATOM 285 CD GLU A 440 10.018 -4.259 -1.672 1.00 0.00 C ATOM 286 OE1 GLU A 440 10.959 -4.627 -0.937 1.00 0.00 O ATOM 287 OE2 GLU A 440 10.146 -3.404 -2.573 1.00 0.00 O ATOM 0 H GLU A 440 8.413 -8.298 0.560 1.00 0.00 H new ATOM 0 HA GLU A 440 6.668 -6.310 -0.135 1.00 0.00 H new ATOM 0 HB2 GLU A 440 9.112 -6.071 0.258 1.00 0.00 H new ATOM 0 HB3 GLU A 440 9.437 -6.862 -1.272 1.00 0.00 H new ATOM 0 HG2 GLU A 440 8.162 -5.012 -2.424 1.00 0.00 H new ATOM 0 HG3 GLU A 440 8.033 -4.200 -0.876 1.00 0.00 H new ATOM 294 N ASP A 441 7.664 -7.837 -2.899 1.00 0.00 N ATOM 295 CA ASP A 441 7.273 -8.153 -4.268 1.00 0.00 C ATOM 296 C ASP A 441 5.792 -8.512 -4.341 1.00 0.00 C ATOM 297 O ASP A 441 5.019 -7.857 -5.039 1.00 0.00 O ATOM 298 CB ASP A 441 8.117 -9.307 -4.810 1.00 0.00 C ATOM 299 CG ASP A 441 8.163 -9.330 -6.325 1.00 0.00 C ATOM 300 OD1 ASP A 441 7.161 -8.932 -6.955 1.00 0.00 O ATOM 301 OD2 ASP A 441 9.201 -9.745 -6.880 1.00 0.00 O ATOM 0 H ASP A 441 8.607 -8.135 -2.651 1.00 0.00 H new ATOM 0 HA ASP A 441 7.445 -7.269 -4.881 1.00 0.00 H new ATOM 0 HB2 ASP A 441 9.132 -9.225 -4.420 1.00 0.00 H new ATOM 0 HB3 ASP A 441 7.711 -10.251 -4.448 1.00 0.00 H new ATOM 306 N GLU A 442 5.405 -9.557 -3.615 1.00 0.00 N ATOM 307 CA GLU A 442 4.017 -10.003 -3.600 1.00 0.00 C ATOM 308 C GLU A 442 3.064 -8.814 -3.511 1.00 0.00 C ATOM 309 O GLU A 442 2.215 -8.620 -4.381 1.00 0.00 O ATOM 310 CB GLU A 442 3.776 -10.952 -2.424 1.00 0.00 C ATOM 311 CG GLU A 442 4.570 -12.244 -2.513 1.00 0.00 C ATOM 312 CD GLU A 442 3.866 -13.306 -3.336 1.00 0.00 C ATOM 313 OE1 GLU A 442 3.055 -14.062 -2.761 1.00 0.00 O ATOM 314 OE2 GLU A 442 4.126 -13.380 -4.555 1.00 0.00 O ATOM 0 H GLU A 442 6.032 -10.109 -3.031 1.00 0.00 H new ATOM 0 HA GLU A 442 3.823 -10.534 -4.532 1.00 0.00 H new ATOM 0 HB2 GLU A 442 4.033 -10.440 -1.496 1.00 0.00 H new ATOM 0 HB3 GLU A 442 2.714 -11.191 -2.372 1.00 0.00 H new ATOM 0 HG2 GLU A 442 5.546 -12.037 -2.952 1.00 0.00 H new ATOM 0 HG3 GLU A 442 4.748 -12.627 -1.508 1.00 0.00 H new ATOM 321 N ILE A 443 3.212 -8.023 -2.454 1.00 0.00 N ATOM 322 CA ILE A 443 2.365 -6.853 -2.252 1.00 0.00 C ATOM 323 C ILE A 443 2.280 -6.011 -3.520 1.00 0.00 C ATOM 324 O ILE A 443 1.216 -5.496 -3.867 1.00 0.00 O ATOM 325 CB ILE A 443 2.886 -5.974 -1.099 1.00 0.00 C ATOM 326 CG1 ILE A 443 2.905 -6.769 0.208 1.00 0.00 C ATOM 327 CG2 ILE A 443 2.026 -4.727 -0.955 1.00 0.00 C ATOM 328 CD1 ILE A 443 3.803 -6.168 1.267 1.00 0.00 C ATOM 0 H ILE A 443 3.910 -8.170 -1.725 1.00 0.00 H new ATOM 0 HA ILE A 443 1.372 -7.222 -1.997 1.00 0.00 H new ATOM 0 HB ILE A 443 3.906 -5.664 -1.328 1.00 0.00 H new ATOM 0 HG12 ILE A 443 1.890 -6.835 0.599 1.00 0.00 H new ATOM 0 HG13 ILE A 443 3.233 -7.787 -0.000 1.00 0.00 H new ATOM 0 HG21 ILE A 443 2.406 -4.116 -0.137 1.00 0.00 H new ATOM 0 HG22 ILE A 443 2.058 -4.154 -1.882 1.00 0.00 H new ATOM 0 HG23 ILE A 443 0.997 -5.017 -0.744 1.00 0.00 H new ATOM 0 HD11 ILE A 443 3.768 -6.783 2.166 1.00 0.00 H new ATOM 0 HD12 ILE A 443 4.827 -6.127 0.895 1.00 0.00 H new ATOM 0 HD13 ILE A 443 3.462 -5.160 1.504 1.00 0.00 H new ATOM 340 N THR A 444 3.407 -5.875 -4.211 1.00 0.00 N ATOM 341 CA THR A 444 3.460 -5.096 -5.442 1.00 0.00 C ATOM 342 C THR A 444 2.526 -5.673 -6.499 1.00 0.00 C ATOM 343 O THR A 444 1.662 -4.973 -7.026 1.00 0.00 O ATOM 344 CB THR A 444 4.891 -5.042 -6.011 1.00 0.00 C ATOM 345 OG1 THR A 444 5.808 -4.626 -4.994 1.00 0.00 O ATOM 346 CG2 THR A 444 4.967 -4.087 -7.192 1.00 0.00 C ATOM 0 H THR A 444 4.296 -6.294 -3.939 1.00 0.00 H new ATOM 0 HA THR A 444 3.138 -4.085 -5.191 1.00 0.00 H new ATOM 0 HB THR A 444 5.160 -6.041 -6.354 1.00 0.00 H new ATOM 0 HG1 THR A 444 6.715 -4.596 -5.364 1.00 0.00 H new ATOM 0 HG21 THR A 444 5.986 -4.065 -7.577 1.00 0.00 H new ATOM 0 HG22 THR A 444 4.290 -4.424 -7.977 1.00 0.00 H new ATOM 0 HG23 THR A 444 4.679 -3.086 -6.870 1.00 0.00 H new ATOM 354 N ALA A 445 2.705 -6.954 -6.804 1.00 0.00 N ATOM 355 CA ALA A 445 1.876 -7.626 -7.797 1.00 0.00 C ATOM 356 C ALA A 445 0.394 -7.395 -7.521 1.00 0.00 C ATOM 357 O ALA A 445 -0.385 -7.139 -8.439 1.00 0.00 O ATOM 358 CB ALA A 445 2.184 -9.116 -7.821 1.00 0.00 C ATOM 0 H ALA A 445 3.417 -7.547 -6.378 1.00 0.00 H new ATOM 0 HA ALA A 445 2.108 -7.203 -8.774 1.00 0.00 H new ATOM 0 HB1 ALA A 445 1.558 -9.605 -8.567 1.00 0.00 H new ATOM 0 HB2 ALA A 445 3.234 -9.267 -8.073 1.00 0.00 H new ATOM 0 HB3 ALA A 445 1.982 -9.545 -6.840 1.00 0.00 H new ATOM 364 N SER A 446 0.011 -7.488 -6.252 1.00 0.00 N ATOM 365 CA SER A 446 -1.379 -7.294 -5.856 1.00 0.00 C ATOM 366 C SER A 446 -1.883 -5.924 -6.300 1.00 0.00 C ATOM 367 O SER A 446 -3.060 -5.757 -6.620 1.00 0.00 O ATOM 368 CB SER A 446 -1.524 -7.437 -4.340 1.00 0.00 C ATOM 369 OG SER A 446 -1.786 -8.781 -3.977 1.00 0.00 O ATOM 0 H SER A 446 0.644 -7.697 -5.480 1.00 0.00 H new ATOM 0 HA SER A 446 -1.981 -8.060 -6.345 1.00 0.00 H new ATOM 0 HB2 SER A 446 -0.612 -7.096 -3.851 1.00 0.00 H new ATOM 0 HB3 SER A 446 -2.333 -6.797 -3.987 1.00 0.00 H new ATOM 0 HG SER A 446 -1.873 -8.846 -3.003 1.00 0.00 H new ATOM 375 N PHE A 447 -0.983 -4.946 -6.316 1.00 0.00 N ATOM 376 CA PHE A 447 -1.336 -3.589 -6.719 1.00 0.00 C ATOM 377 C PHE A 447 -0.516 -3.151 -7.930 1.00 0.00 C ATOM 378 O PHE A 447 -0.208 -1.970 -8.089 1.00 0.00 O ATOM 379 CB PHE A 447 -1.114 -2.616 -5.560 1.00 0.00 C ATOM 380 CG PHE A 447 -1.976 -2.903 -4.364 1.00 0.00 C ATOM 381 CD1 PHE A 447 -1.583 -3.836 -3.418 1.00 0.00 C ATOM 382 CD2 PHE A 447 -3.179 -2.238 -4.184 1.00 0.00 C ATOM 383 CE1 PHE A 447 -2.375 -4.103 -2.317 1.00 0.00 C ATOM 384 CE2 PHE A 447 -3.974 -2.500 -3.085 1.00 0.00 C ATOM 385 CZ PHE A 447 -3.571 -3.433 -2.149 1.00 0.00 C ATOM 0 H PHE A 447 -0.005 -5.068 -6.055 1.00 0.00 H new ATOM 0 HA PHE A 447 -2.391 -3.581 -6.994 1.00 0.00 H new ATOM 0 HB2 PHE A 447 -0.067 -2.653 -5.260 1.00 0.00 H new ATOM 0 HB3 PHE A 447 -1.311 -1.601 -5.905 1.00 0.00 H new ATOM 0 HD1 PHE A 447 -0.647 -4.361 -3.542 1.00 0.00 H new ATOM 0 HD2 PHE A 447 -3.498 -1.506 -4.912 1.00 0.00 H new ATOM 0 HE1 PHE A 447 -2.059 -4.835 -1.589 1.00 0.00 H new ATOM 0 HE2 PHE A 447 -4.910 -1.976 -2.958 1.00 0.00 H new ATOM 0 HZ PHE A 447 -4.190 -3.638 -1.288 1.00 0.00 H new ATOM 395 N ARG A 448 -0.167 -4.112 -8.779 1.00 0.00 N ATOM 396 CA ARG A 448 0.619 -3.827 -9.974 1.00 0.00 C ATOM 397 C ARG A 448 -0.285 -3.664 -11.192 1.00 0.00 C ATOM 398 O ARG A 448 -0.059 -2.794 -12.034 1.00 0.00 O ATOM 399 CB ARG A 448 1.632 -4.945 -10.223 1.00 0.00 C ATOM 400 CG ARG A 448 2.503 -4.716 -11.447 1.00 0.00 C ATOM 401 CD ARG A 448 3.612 -3.714 -11.162 1.00 0.00 C ATOM 402 NE ARG A 448 4.681 -3.785 -12.154 1.00 0.00 N ATOM 403 CZ ARG A 448 5.881 -3.243 -11.981 1.00 0.00 C ATOM 404 NH1 ARG A 448 6.164 -2.595 -10.859 1.00 0.00 N ATOM 405 NH2 ARG A 448 6.803 -3.350 -12.930 1.00 0.00 N ATOM 0 H ARG A 448 -0.416 -5.094 -8.662 1.00 0.00 H new ATOM 0 HA ARG A 448 1.154 -2.891 -9.812 1.00 0.00 H new ATOM 0 HB2 ARG A 448 2.272 -5.046 -9.346 1.00 0.00 H new ATOM 0 HB3 ARG A 448 1.098 -5.888 -10.339 1.00 0.00 H new ATOM 0 HG2 ARG A 448 2.939 -5.662 -11.767 1.00 0.00 H new ATOM 0 HG3 ARG A 448 1.887 -4.355 -12.271 1.00 0.00 H new ATOM 0 HD2 ARG A 448 3.196 -2.707 -11.149 1.00 0.00 H new ATOM 0 HD3 ARG A 448 4.024 -3.902 -10.171 1.00 0.00 H new ATOM 0 HE ARG A 448 4.496 -4.278 -13.028 1.00 0.00 H new ATOM 0 HH11 ARG A 448 5.459 -2.512 -10.126 1.00 0.00 H new ATOM 0 HH12 ARG A 448 7.086 -2.180 -10.729 1.00 0.00 H new ATOM 0 HH21 ARG A 448 6.590 -3.849 -13.794 1.00 0.00 H new ATOM 0 HH22 ARG A 448 7.724 -2.933 -12.795 1.00 0.00 H new ATOM 419 N ARG A 449 -1.309 -4.506 -11.280 1.00 0.00 N ATOM 420 CA ARG A 449 -2.246 -4.457 -12.396 1.00 0.00 C ATOM 421 C ARG A 449 -2.664 -3.019 -12.692 1.00 0.00 C ATOM 422 O ARG A 449 -2.891 -2.653 -13.845 1.00 0.00 O ATOM 423 CB ARG A 449 -3.481 -5.306 -12.090 1.00 0.00 C ATOM 424 CG ARG A 449 -4.178 -4.923 -10.795 1.00 0.00 C ATOM 425 CD ARG A 449 -5.455 -5.724 -10.591 1.00 0.00 C ATOM 426 NE ARG A 449 -6.499 -5.339 -11.537 1.00 0.00 N ATOM 427 CZ ARG A 449 -6.632 -5.878 -12.744 1.00 0.00 C ATOM 428 NH1 ARG A 449 -5.792 -6.820 -13.149 1.00 0.00 N ATOM 429 NH2 ARG A 449 -7.608 -5.475 -13.548 1.00 0.00 N ATOM 0 H ARG A 449 -1.511 -5.231 -10.591 1.00 0.00 H new ATOM 0 HA ARG A 449 -1.746 -4.860 -13.276 1.00 0.00 H new ATOM 0 HB2 ARG A 449 -4.188 -5.214 -12.914 1.00 0.00 H new ATOM 0 HB3 ARG A 449 -3.187 -6.354 -12.038 1.00 0.00 H new ATOM 0 HG2 ARG A 449 -3.504 -5.090 -9.955 1.00 0.00 H new ATOM 0 HG3 ARG A 449 -4.413 -3.859 -10.808 1.00 0.00 H new ATOM 0 HD2 ARG A 449 -5.238 -6.786 -10.703 1.00 0.00 H new ATOM 0 HD3 ARG A 449 -5.816 -5.578 -9.573 1.00 0.00 H new ATOM 0 HE ARG A 449 -7.162 -4.617 -11.256 1.00 0.00 H new ATOM 0 HH11 ARG A 449 -5.041 -7.133 -12.533 1.00 0.00 H new ATOM 0 HH12 ARG A 449 -5.896 -7.232 -14.076 1.00 0.00 H new ATOM 0 HH21 ARG A 449 -8.257 -4.751 -13.239 1.00 0.00 H new ATOM 0 HH22 ARG A 449 -7.709 -5.889 -14.475 1.00 0.00 H new ATOM 443 N PHE A 450 -2.764 -2.210 -11.643 1.00 0.00 N ATOM 444 CA PHE A 450 -3.156 -0.813 -11.790 1.00 0.00 C ATOM 445 C PHE A 450 -2.044 -0.003 -12.449 1.00 0.00 C ATOM 446 O PHE A 450 -2.299 0.832 -13.316 1.00 0.00 O ATOM 447 CB PHE A 450 -3.501 -0.212 -10.425 1.00 0.00 C ATOM 448 CG PHE A 450 -4.601 -0.942 -9.710 1.00 0.00 C ATOM 449 CD1 PHE A 450 -5.928 -0.601 -9.920 1.00 0.00 C ATOM 450 CD2 PHE A 450 -4.309 -1.969 -8.826 1.00 0.00 C ATOM 451 CE1 PHE A 450 -6.942 -1.270 -9.262 1.00 0.00 C ATOM 452 CE2 PHE A 450 -5.320 -2.642 -8.166 1.00 0.00 C ATOM 453 CZ PHE A 450 -6.638 -2.293 -8.385 1.00 0.00 C ATOM 0 H PHE A 450 -2.579 -2.497 -10.682 1.00 0.00 H new ATOM 0 HA PHE A 450 -4.038 -0.774 -12.430 1.00 0.00 H new ATOM 0 HB2 PHE A 450 -2.608 -0.214 -9.800 1.00 0.00 H new ATOM 0 HB3 PHE A 450 -3.794 0.829 -10.559 1.00 0.00 H new ATOM 0 HD1 PHE A 450 -6.172 0.197 -10.606 1.00 0.00 H new ATOM 0 HD2 PHE A 450 -3.280 -2.246 -8.651 1.00 0.00 H new ATOM 0 HE1 PHE A 450 -7.972 -0.993 -9.433 1.00 0.00 H new ATOM 0 HE2 PHE A 450 -5.079 -3.440 -7.480 1.00 0.00 H new ATOM 0 HZ PHE A 450 -7.429 -2.819 -7.872 1.00 0.00 H new ATOM 463 N GLY A 451 -0.808 -0.255 -12.029 1.00 0.00 N ATOM 464 CA GLY A 451 0.325 0.460 -12.588 1.00 0.00 C ATOM 465 C GLY A 451 1.592 0.261 -11.780 1.00 0.00 C ATOM 466 O GLY A 451 1.647 -0.559 -10.863 1.00 0.00 O ATOM 0 H GLY A 451 -0.571 -0.941 -11.312 1.00 0.00 H new ATOM 0 HA2 GLY A 451 0.494 0.124 -13.611 1.00 0.00 H new ATOM 0 HA3 GLY A 451 0.092 1.524 -12.636 1.00 0.00 H new ATOM 470 N PRO A 452 2.642 1.023 -12.121 1.00 0.00 N ATOM 471 CA PRO A 452 3.934 0.944 -11.433 1.00 0.00 C ATOM 472 C PRO A 452 3.913 1.643 -10.078 1.00 0.00 C ATOM 473 O PRO A 452 3.837 2.870 -10.001 1.00 0.00 O ATOM 474 CB PRO A 452 4.890 1.661 -12.390 1.00 0.00 C ATOM 475 CG PRO A 452 4.031 2.630 -13.127 1.00 0.00 C ATOM 476 CD PRO A 452 2.648 2.021 -13.204 1.00 0.00 C ATOM 0 HA PRO A 452 4.218 -0.086 -11.217 1.00 0.00 H new ATOM 0 HB2 PRO A 452 5.686 2.171 -11.847 1.00 0.00 H new ATOM 0 HB3 PRO A 452 5.369 0.958 -13.072 1.00 0.00 H new ATOM 0 HG2 PRO A 452 4.002 3.590 -12.612 1.00 0.00 H new ATOM 0 HG3 PRO A 452 4.427 2.816 -14.125 1.00 0.00 H new ATOM 0 HD2 PRO A 452 1.872 2.772 -13.060 1.00 0.00 H new ATOM 0 HD3 PRO A 452 2.468 1.559 -14.175 1.00 0.00 H new ATOM 484 N LEU A 453 3.981 0.855 -9.010 1.00 0.00 N ATOM 485 CA LEU A 453 3.970 1.399 -7.656 1.00 0.00 C ATOM 486 C LEU A 453 5.143 0.859 -6.844 1.00 0.00 C ATOM 487 O LEU A 453 5.973 0.108 -7.355 1.00 0.00 O ATOM 488 CB LEU A 453 2.652 1.058 -6.959 1.00 0.00 C ATOM 489 CG LEU A 453 2.538 -0.359 -6.397 1.00 0.00 C ATOM 490 CD1 LEU A 453 1.366 -0.458 -5.432 1.00 0.00 C ATOM 491 CD2 LEU A 453 2.389 -1.370 -7.524 1.00 0.00 C ATOM 0 H LEU A 453 4.044 -0.162 -9.055 1.00 0.00 H new ATOM 0 HA LEU A 453 4.067 2.482 -7.725 1.00 0.00 H new ATOM 0 HB2 LEU A 453 2.502 1.764 -6.143 1.00 0.00 H new ATOM 0 HB3 LEU A 453 1.838 1.213 -7.668 1.00 0.00 H new ATOM 0 HG LEU A 453 3.453 -0.587 -5.850 1.00 0.00 H new ATOM 0 HD11 LEU A 453 1.301 -1.474 -5.042 1.00 0.00 H new ATOM 0 HD12 LEU A 453 1.514 0.239 -4.607 1.00 0.00 H new ATOM 0 HD13 LEU A 453 0.442 -0.210 -5.955 1.00 0.00 H new ATOM 0 HD21 LEU A 453 2.309 -2.373 -7.105 1.00 0.00 H new ATOM 0 HD22 LEU A 453 1.491 -1.144 -8.099 1.00 0.00 H new ATOM 0 HD23 LEU A 453 3.260 -1.318 -8.177 1.00 0.00 H new ATOM 503 N VAL A 454 5.204 1.247 -5.574 1.00 0.00 N ATOM 504 CA VAL A 454 6.273 0.800 -4.689 1.00 0.00 C ATOM 505 C VAL A 454 5.752 0.557 -3.277 1.00 0.00 C ATOM 506 O VAL A 454 4.983 1.355 -2.741 1.00 0.00 O ATOM 507 CB VAL A 454 7.420 1.826 -4.631 1.00 0.00 C ATOM 508 CG1 VAL A 454 6.909 3.171 -4.137 1.00 0.00 C ATOM 509 CG2 VAL A 454 8.547 1.316 -3.745 1.00 0.00 C ATOM 0 H VAL A 454 4.526 1.870 -5.135 1.00 0.00 H new ATOM 0 HA VAL A 454 6.653 -0.136 -5.099 1.00 0.00 H new ATOM 0 HB VAL A 454 7.814 1.962 -5.638 1.00 0.00 H new ATOM 0 HG11 VAL A 454 7.733 3.883 -4.103 1.00 0.00 H new ATOM 0 HG12 VAL A 454 6.139 3.539 -4.815 1.00 0.00 H new ATOM 0 HG13 VAL A 454 6.487 3.056 -3.138 1.00 0.00 H new ATOM 0 HG21 VAL A 454 9.349 2.054 -3.716 1.00 0.00 H new ATOM 0 HG22 VAL A 454 8.170 1.150 -2.736 1.00 0.00 H new ATOM 0 HG23 VAL A 454 8.931 0.379 -4.148 1.00 0.00 H new ATOM 519 N VAL A 455 6.177 -0.551 -2.678 1.00 0.00 N ATOM 520 CA VAL A 455 5.755 -0.900 -1.326 1.00 0.00 C ATOM 521 C VAL A 455 6.740 -0.372 -0.290 1.00 0.00 C ATOM 522 O VAL A 455 7.951 -0.548 -0.423 1.00 0.00 O ATOM 523 CB VAL A 455 5.616 -2.425 -1.157 1.00 0.00 C ATOM 524 CG1 VAL A 455 4.952 -2.757 0.170 1.00 0.00 C ATOM 525 CG2 VAL A 455 4.833 -3.020 -2.318 1.00 0.00 C ATOM 0 H VAL A 455 6.813 -1.223 -3.108 1.00 0.00 H new ATOM 0 HA VAL A 455 4.782 -0.435 -1.168 1.00 0.00 H new ATOM 0 HB VAL A 455 6.613 -2.866 -1.157 1.00 0.00 H new ATOM 0 HG11 VAL A 455 4.862 -3.839 0.271 1.00 0.00 H new ATOM 0 HG12 VAL A 455 5.557 -2.365 0.988 1.00 0.00 H new ATOM 0 HG13 VAL A 455 3.960 -2.306 0.203 1.00 0.00 H new ATOM 0 HG21 VAL A 455 4.744 -4.098 -2.183 1.00 0.00 H new ATOM 0 HG22 VAL A 455 3.838 -2.575 -2.352 1.00 0.00 H new ATOM 0 HG23 VAL A 455 5.355 -2.813 -3.253 1.00 0.00 H new ATOM 535 N ASP A 456 6.213 0.274 0.744 1.00 0.00 N ATOM 536 CA ASP A 456 7.045 0.827 1.806 1.00 0.00 C ATOM 537 C ASP A 456 6.327 0.761 3.150 1.00 0.00 C ATOM 538 O ASP A 456 5.323 1.441 3.362 1.00 0.00 O ATOM 539 CB ASP A 456 7.423 2.274 1.486 1.00 0.00 C ATOM 540 CG ASP A 456 7.925 3.024 2.704 1.00 0.00 C ATOM 541 OD1 ASP A 456 8.351 2.363 3.675 1.00 0.00 O ATOM 542 OD2 ASP A 456 7.893 4.272 2.687 1.00 0.00 O ATOM 0 H ASP A 456 5.212 0.428 0.869 1.00 0.00 H new ATOM 0 HA ASP A 456 7.953 0.228 1.871 1.00 0.00 H new ATOM 0 HB2 ASP A 456 8.193 2.283 0.714 1.00 0.00 H new ATOM 0 HB3 ASP A 456 6.555 2.791 1.077 1.00 0.00 H new ATOM 547 N TRP A 457 6.847 -0.063 4.053 1.00 0.00 N ATOM 548 CA TRP A 457 6.254 -0.219 5.376 1.00 0.00 C ATOM 549 C TRP A 457 7.025 0.587 6.416 1.00 0.00 C ATOM 550 O TRP A 457 8.189 0.939 6.226 1.00 0.00 O ATOM 551 CB TRP A 457 6.227 -1.695 5.775 1.00 0.00 C ATOM 552 CG TRP A 457 7.454 -2.446 5.355 1.00 0.00 C ATOM 553 CD1 TRP A 457 8.450 -2.907 6.168 1.00 0.00 C ATOM 554 CD2 TRP A 457 7.815 -2.822 4.022 1.00 0.00 C ATOM 555 NE1 TRP A 457 9.409 -3.547 5.419 1.00 0.00 N ATOM 556 CE2 TRP A 457 9.042 -3.508 4.100 1.00 0.00 C ATOM 557 CE3 TRP A 457 7.220 -2.646 2.769 1.00 0.00 C ATOM 558 CZ2 TRP A 457 9.684 -4.017 2.974 1.00 0.00 C ATOM 559 CZ3 TRP A 457 7.858 -3.151 1.653 1.00 0.00 C ATOM 560 CH2 TRP A 457 9.079 -3.831 1.760 1.00 0.00 C ATOM 0 H TRP A 457 7.678 -0.633 3.893 1.00 0.00 H new ATOM 0 HA TRP A 457 5.232 0.158 5.335 1.00 0.00 H new ATOM 0 HB2 TRP A 457 6.117 -1.770 6.857 1.00 0.00 H new ATOM 0 HB3 TRP A 457 5.351 -2.168 5.332 1.00 0.00 H new ATOM 0 HD1 TRP A 457 8.480 -2.787 7.241 1.00 0.00 H new ATOM 0 HE1 TRP A 457 10.256 -3.980 5.786 1.00 0.00 H new ATOM 0 HE3 TRP A 457 6.279 -2.125 2.676 1.00 0.00 H new ATOM 0 HZ2 TRP A 457 10.626 -4.540 3.055 1.00 0.00 H new ATOM 0 HZ3 TRP A 457 7.408 -3.020 0.680 1.00 0.00 H new ATOM 0 HH2 TRP A 457 9.551 -4.215 0.868 1.00 0.00 H new ATOM 571 N PRO A 458 6.363 0.887 7.544 1.00 0.00 N ATOM 572 CA PRO A 458 6.968 1.655 8.636 1.00 0.00 C ATOM 573 C PRO A 458 8.413 1.246 8.901 1.00 0.00 C ATOM 574 O PRO A 458 9.339 2.030 8.691 1.00 0.00 O ATOM 575 CB PRO A 458 6.086 1.313 9.840 1.00 0.00 C ATOM 576 CG PRO A 458 4.753 0.994 9.255 1.00 0.00 C ATOM 577 CD PRO A 458 4.973 0.500 7.838 1.00 0.00 C ATOM 0 HA PRO A 458 7.011 2.721 8.410 1.00 0.00 H new ATOM 0 HB2 PRO A 458 6.487 0.466 10.397 1.00 0.00 H new ATOM 0 HB3 PRO A 458 6.023 2.150 10.535 1.00 0.00 H new ATOM 0 HG2 PRO A 458 4.247 0.234 9.850 1.00 0.00 H new ATOM 0 HG3 PRO A 458 4.114 1.877 9.256 1.00 0.00 H new ATOM 0 HD2 PRO A 458 4.834 -0.579 7.764 1.00 0.00 H new ATOM 0 HD3 PRO A 458 4.273 0.960 7.140 1.00 0.00 H new ATOM 585 N HIS A 459 8.599 0.014 9.364 1.00 0.00 N ATOM 586 CA HIS A 459 9.932 -0.500 9.657 1.00 0.00 C ATOM 587 C HIS A 459 10.412 -1.430 8.547 1.00 0.00 C ATOM 588 O HIS A 459 10.174 -2.638 8.588 1.00 0.00 O ATOM 589 CB HIS A 459 9.935 -1.239 10.995 1.00 0.00 C ATOM 590 CG HIS A 459 9.861 -0.329 12.182 1.00 0.00 C ATOM 591 ND1 HIS A 459 10.591 -0.534 13.334 1.00 0.00 N ATOM 592 CD2 HIS A 459 9.139 0.797 12.391 1.00 0.00 C ATOM 593 CE1 HIS A 459 10.320 0.426 14.201 1.00 0.00 C ATOM 594 NE2 HIS A 459 9.442 1.246 13.653 1.00 0.00 N ATOM 0 H HIS A 459 7.843 -0.647 9.544 1.00 0.00 H new ATOM 0 HA HIS A 459 10.615 0.347 9.718 1.00 0.00 H new ATOM 0 HB2 HIS A 459 9.090 -1.928 11.022 1.00 0.00 H new ATOM 0 HB3 HIS A 459 10.840 -1.842 11.066 1.00 0.00 H new ATOM 0 HD2 HIS A 459 8.453 1.256 11.695 1.00 0.00 H new ATOM 0 HE1 HIS A 459 10.744 0.523 15.189 1.00 0.00 H new ATOM 0 HE2 HIS A 459 9.052 2.078 14.095 1.00 0.00 H new ATOM 602 N LYS A 460 11.088 -0.861 7.555 1.00 0.00 N ATOM 603 CA LYS A 460 11.602 -1.639 6.433 1.00 0.00 C ATOM 604 C LYS A 460 13.122 -1.540 6.355 1.00 0.00 C ATOM 605 O LYS A 460 13.805 -2.533 6.104 1.00 0.00 O ATOM 606 CB LYS A 460 10.980 -1.153 5.122 1.00 0.00 C ATOM 607 CG LYS A 460 11.656 0.080 4.549 1.00 0.00 C ATOM 608 CD LYS A 460 10.818 0.716 3.452 1.00 0.00 C ATOM 609 CE LYS A 460 11.093 0.077 2.099 1.00 0.00 C ATOM 610 NZ LYS A 460 10.502 0.865 0.983 1.00 0.00 N ATOM 0 H LYS A 460 11.293 0.137 7.505 1.00 0.00 H new ATOM 0 HA LYS A 460 11.331 -2.683 6.591 1.00 0.00 H new ATOM 0 HB2 LYS A 460 11.026 -1.957 4.387 1.00 0.00 H new ATOM 0 HB3 LYS A 460 9.925 -0.934 5.289 1.00 0.00 H new ATOM 0 HG2 LYS A 460 11.827 0.805 5.345 1.00 0.00 H new ATOM 0 HG3 LYS A 460 12.633 -0.192 4.150 1.00 0.00 H new ATOM 0 HD2 LYS A 460 9.760 0.614 3.695 1.00 0.00 H new ATOM 0 HD3 LYS A 460 11.032 1.784 3.402 1.00 0.00 H new ATOM 0 HE2 LYS A 460 12.169 -0.011 1.951 1.00 0.00 H new ATOM 0 HE3 LYS A 460 10.686 -0.934 2.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 460 9.682 0.356 0.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 460 10.197 1.794 1.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 460 11.213 0.996 0.236 1.00 0.00 H new ATOM 624 N ALA A 461 13.645 -0.338 6.572 1.00 0.00 N ATOM 625 CA ALA A 461 15.084 -0.112 6.529 1.00 0.00 C ATOM 626 C ALA A 461 15.739 -0.486 7.854 1.00 0.00 C ATOM 627 O ALA A 461 16.803 -1.104 7.878 1.00 0.00 O ATOM 628 CB ALA A 461 15.380 1.340 6.184 1.00 0.00 C ATOM 0 H ALA A 461 13.093 0.494 6.779 1.00 0.00 H new ATOM 0 HA ALA A 461 15.504 -0.752 5.753 1.00 0.00 H new ATOM 0 HB1 ALA A 461 16.459 1.495 6.155 1.00 0.00 H new ATOM 0 HB2 ALA A 461 14.953 1.577 5.209 1.00 0.00 H new ATOM 0 HB3 ALA A 461 14.940 1.991 6.940 1.00 0.00 H new ATOM 634 N GLU A 462 15.096 -0.107 8.954 1.00 0.00 N ATOM 635 CA GLU A 462 15.618 -0.402 10.284 1.00 0.00 C ATOM 636 C GLU A 462 15.660 -1.908 10.529 1.00 0.00 C ATOM 637 O GLU A 462 16.671 -2.447 10.980 1.00 0.00 O ATOM 638 CB GLU A 462 14.763 0.277 11.355 1.00 0.00 C ATOM 639 CG GLU A 462 14.632 1.779 11.167 1.00 0.00 C ATOM 640 CD GLU A 462 13.521 2.378 12.007 1.00 0.00 C ATOM 641 OE1 GLU A 462 13.545 2.193 13.242 1.00 0.00 O ATOM 642 OE2 GLU A 462 12.627 3.031 11.429 1.00 0.00 O ATOM 0 H GLU A 462 14.214 0.405 8.951 1.00 0.00 H new ATOM 0 HA GLU A 462 16.634 -0.013 10.342 1.00 0.00 H new ATOM 0 HB2 GLU A 462 13.769 -0.169 11.351 1.00 0.00 H new ATOM 0 HB3 GLU A 462 15.198 0.078 12.335 1.00 0.00 H new ATOM 0 HG2 GLU A 462 15.576 2.257 11.426 1.00 0.00 H new ATOM 0 HG3 GLU A 462 14.444 1.995 10.115 1.00 0.00 H new ATOM 649 N SER A 463 14.553 -2.581 10.231 1.00 0.00 N ATOM 650 CA SER A 463 14.460 -4.023 10.424 1.00 0.00 C ATOM 651 C SER A 463 15.448 -4.757 9.521 1.00 0.00 C ATOM 652 O SER A 463 15.614 -4.410 8.351 1.00 0.00 O ATOM 653 CB SER A 463 13.037 -4.507 10.139 1.00 0.00 C ATOM 654 OG SER A 463 12.128 -4.015 11.109 1.00 0.00 O ATOM 0 H SER A 463 13.708 -2.150 9.855 1.00 0.00 H new ATOM 0 HA SER A 463 14.710 -4.242 11.462 1.00 0.00 H new ATOM 0 HB2 SER A 463 12.729 -4.177 9.147 1.00 0.00 H new ATOM 0 HB3 SER A 463 13.014 -5.597 10.134 1.00 0.00 H new ATOM 0 HG SER A 463 11.225 -4.337 10.904 1.00 0.00 H new ATOM 660 N LYS A 464 16.102 -5.773 10.073 1.00 0.00 N ATOM 661 CA LYS A 464 17.074 -6.557 9.320 1.00 0.00 C ATOM 662 C LYS A 464 16.415 -7.783 8.695 1.00 0.00 C ATOM 663 O LYS A 464 16.974 -8.880 8.720 1.00 0.00 O ATOM 664 CB LYS A 464 18.225 -6.992 10.230 1.00 0.00 C ATOM 665 CG LYS A 464 19.198 -5.873 10.556 1.00 0.00 C ATOM 666 CD LYS A 464 18.779 -5.116 11.806 1.00 0.00 C ATOM 667 CE LYS A 464 19.300 -5.789 13.066 1.00 0.00 C ATOM 668 NZ LYS A 464 18.570 -5.332 14.281 1.00 0.00 N ATOM 0 H LYS A 464 15.977 -6.073 11.040 1.00 0.00 H new ATOM 0 HA LYS A 464 17.469 -5.930 8.521 1.00 0.00 H new ATOM 0 HB2 LYS A 464 17.813 -7.387 11.159 1.00 0.00 H new ATOM 0 HB3 LYS A 464 18.768 -7.806 9.751 1.00 0.00 H new ATOM 0 HG2 LYS A 464 20.196 -6.287 10.698 1.00 0.00 H new ATOM 0 HG3 LYS A 464 19.256 -5.183 9.714 1.00 0.00 H new ATOM 0 HD2 LYS A 464 19.154 -4.094 11.757 1.00 0.00 H new ATOM 0 HD3 LYS A 464 17.692 -5.055 11.848 1.00 0.00 H new ATOM 0 HE2 LYS A 464 19.201 -6.870 12.968 1.00 0.00 H new ATOM 0 HE3 LYS A 464 20.363 -5.575 13.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 18.955 -5.814 15.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 18.685 -4.304 14.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 17.560 -5.559 14.185 1.00 0.00 H new ATOM 682 N SER A 465 15.226 -7.589 8.134 1.00 0.00 N ATOM 683 CA SER A 465 14.491 -8.680 7.504 1.00 0.00 C ATOM 684 C SER A 465 13.521 -8.146 6.454 1.00 0.00 C ATOM 685 O SER A 465 12.993 -7.041 6.585 1.00 0.00 O ATOM 686 CB SER A 465 13.728 -9.484 8.558 1.00 0.00 C ATOM 687 OG SER A 465 14.585 -10.399 9.219 1.00 0.00 O ATOM 0 H SER A 465 14.751 -6.687 8.103 1.00 0.00 H new ATOM 0 HA SER A 465 15.211 -9.333 7.010 1.00 0.00 H new ATOM 0 HB2 SER A 465 13.284 -8.806 9.286 1.00 0.00 H new ATOM 0 HB3 SER A 465 12.909 -10.025 8.085 1.00 0.00 H new ATOM 0 HG SER A 465 15.518 -10.133 9.079 1.00 0.00 H new ATOM 693 N TYR A 466 13.290 -8.938 5.414 1.00 0.00 N ATOM 694 CA TYR A 466 12.385 -8.546 4.340 1.00 0.00 C ATOM 695 C TYR A 466 10.959 -9.000 4.635 1.00 0.00 C ATOM 696 O TYR A 466 10.221 -9.393 3.732 1.00 0.00 O ATOM 697 CB TYR A 466 12.855 -9.135 3.008 1.00 0.00 C ATOM 698 CG TYR A 466 13.172 -10.612 3.078 1.00 0.00 C ATOM 699 CD1 TYR A 466 14.407 -11.056 3.534 1.00 0.00 C ATOM 700 CD2 TYR A 466 12.237 -11.563 2.689 1.00 0.00 C ATOM 701 CE1 TYR A 466 14.701 -12.404 3.599 1.00 0.00 C ATOM 702 CE2 TYR A 466 12.522 -12.913 2.752 1.00 0.00 C ATOM 703 CZ TYR A 466 13.756 -13.329 3.207 1.00 0.00 C ATOM 704 OH TYR A 466 14.045 -14.673 3.272 1.00 0.00 O ATOM 0 H TYR A 466 13.717 -9.856 5.291 1.00 0.00 H new ATOM 0 HA TYR A 466 12.393 -7.458 4.272 1.00 0.00 H new ATOM 0 HB2 TYR A 466 12.083 -8.973 2.256 1.00 0.00 H new ATOM 0 HB3 TYR A 466 13.742 -8.597 2.675 1.00 0.00 H new ATOM 0 HD1 TYR A 466 15.150 -10.335 3.843 1.00 0.00 H new ATOM 0 HD2 TYR A 466 11.270 -11.241 2.331 1.00 0.00 H new ATOM 0 HE1 TYR A 466 15.666 -12.732 3.955 1.00 0.00 H new ATOM 0 HE2 TYR A 466 11.783 -13.639 2.447 1.00 0.00 H new ATOM 0 HH TYR A 466 13.272 -15.189 2.961 1.00 0.00 H new ATOM 714 N PHE A 467 10.579 -8.942 5.907 1.00 0.00 N ATOM 715 CA PHE A 467 9.241 -9.347 6.324 1.00 0.00 C ATOM 716 C PHE A 467 8.461 -8.159 6.877 1.00 0.00 C ATOM 717 O PHE A 467 8.559 -7.812 8.054 1.00 0.00 O ATOM 718 CB PHE A 467 9.326 -10.452 7.380 1.00 0.00 C ATOM 719 CG PHE A 467 9.639 -11.805 6.809 1.00 0.00 C ATOM 720 CD1 PHE A 467 8.722 -12.460 6.003 1.00 0.00 C ATOM 721 CD2 PHE A 467 10.851 -12.421 7.076 1.00 0.00 C ATOM 722 CE1 PHE A 467 9.007 -13.706 5.476 1.00 0.00 C ATOM 723 CE2 PHE A 467 11.142 -13.667 6.552 1.00 0.00 C ATOM 724 CZ PHE A 467 10.219 -14.309 5.750 1.00 0.00 C ATOM 0 H PHE A 467 11.178 -8.619 6.667 1.00 0.00 H new ATOM 0 HA PHE A 467 8.715 -9.729 5.449 1.00 0.00 H new ATOM 0 HB2 PHE A 467 10.092 -10.188 8.109 1.00 0.00 H new ATOM 0 HB3 PHE A 467 8.379 -10.504 7.917 1.00 0.00 H new ATOM 0 HD1 PHE A 467 7.774 -11.992 5.784 1.00 0.00 H new ATOM 0 HD2 PHE A 467 11.577 -11.922 7.701 1.00 0.00 H new ATOM 0 HE1 PHE A 467 8.283 -14.207 4.851 1.00 0.00 H new ATOM 0 HE2 PHE A 467 12.090 -14.137 6.770 1.00 0.00 H new ATOM 0 HZ PHE A 467 10.445 -15.281 5.338 1.00 0.00 H new ATOM 734 N PRO A 468 7.665 -7.518 6.007 1.00 0.00 N ATOM 735 CA PRO A 468 6.852 -6.358 6.385 1.00 0.00 C ATOM 736 C PRO A 468 6.157 -6.550 7.729 1.00 0.00 C ATOM 737 O PRO A 468 6.086 -7.656 8.266 1.00 0.00 O ATOM 738 CB PRO A 468 5.820 -6.267 5.258 1.00 0.00 C ATOM 739 CG PRO A 468 6.498 -6.865 4.074 1.00 0.00 C ATOM 740 CD PRO A 468 7.499 -7.877 4.589 1.00 0.00 C ATOM 0 HA PRO A 468 7.456 -5.458 6.503 1.00 0.00 H new ATOM 0 HB2 PRO A 468 4.910 -6.811 5.510 1.00 0.00 H new ATOM 0 HB3 PRO A 468 5.531 -5.233 5.068 1.00 0.00 H new ATOM 0 HG2 PRO A 468 5.772 -7.344 3.417 1.00 0.00 H new ATOM 0 HG3 PRO A 468 6.998 -6.094 3.488 1.00 0.00 H new ATOM 0 HD2 PRO A 468 7.131 -8.897 4.475 1.00 0.00 H new ATOM 0 HD3 PRO A 468 8.443 -7.816 4.048 1.00 0.00 H new ATOM 748 N PRO A 469 5.632 -5.449 8.287 1.00 0.00 N ATOM 749 CA PRO A 469 4.933 -5.471 9.575 1.00 0.00 C ATOM 750 C PRO A 469 3.952 -6.633 9.682 1.00 0.00 C ATOM 751 O PRO A 469 3.676 -7.319 8.698 1.00 0.00 O ATOM 752 CB PRO A 469 4.185 -4.136 9.595 1.00 0.00 C ATOM 753 CG PRO A 469 5.001 -3.231 8.739 1.00 0.00 C ATOM 754 CD PRO A 469 5.680 -4.098 7.703 1.00 0.00 C ATOM 0 HA PRO A 469 5.621 -5.602 10.410 1.00 0.00 H new ATOM 0 HB2 PRO A 469 3.173 -4.244 9.205 1.00 0.00 H new ATOM 0 HB3 PRO A 469 4.096 -3.747 10.609 1.00 0.00 H new ATOM 0 HG2 PRO A 469 4.371 -2.480 8.261 1.00 0.00 H new ATOM 0 HG3 PRO A 469 5.738 -2.695 9.337 1.00 0.00 H new ATOM 0 HD2 PRO A 469 5.161 -4.058 6.746 1.00 0.00 H new ATOM 0 HD3 PRO A 469 6.706 -3.777 7.523 1.00 0.00 H new ATOM 762 N LYS A 470 3.428 -6.850 10.884 1.00 0.00 N ATOM 763 CA LYS A 470 2.476 -7.928 11.121 1.00 0.00 C ATOM 764 C LYS A 470 1.497 -8.056 9.957 1.00 0.00 C ATOM 765 O LYS A 470 1.254 -9.152 9.455 1.00 0.00 O ATOM 766 CB LYS A 470 1.708 -7.682 12.421 1.00 0.00 C ATOM 767 CG LYS A 470 2.388 -8.265 13.648 1.00 0.00 C ATOM 768 CD LYS A 470 3.341 -7.267 14.285 1.00 0.00 C ATOM 769 CE LYS A 470 2.634 -6.401 15.316 1.00 0.00 C ATOM 770 NZ LYS A 470 1.756 -5.382 14.676 1.00 0.00 N ATOM 0 H LYS A 470 3.647 -6.293 11.710 1.00 0.00 H new ATOM 0 HA LYS A 470 3.035 -8.860 11.207 1.00 0.00 H new ATOM 0 HB2 LYS A 470 1.582 -6.608 12.561 1.00 0.00 H new ATOM 0 HB3 LYS A 470 0.710 -8.111 12.331 1.00 0.00 H new ATOM 0 HG2 LYS A 470 1.633 -8.564 14.376 1.00 0.00 H new ATOM 0 HG3 LYS A 470 2.936 -9.165 13.368 1.00 0.00 H new ATOM 0 HD2 LYS A 470 4.164 -7.801 14.760 1.00 0.00 H new ATOM 0 HD3 LYS A 470 3.775 -6.633 13.512 1.00 0.00 H new ATOM 0 HE2 LYS A 470 2.037 -7.033 15.973 1.00 0.00 H new ATOM 0 HE3 LYS A 470 3.375 -5.902 15.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 1.495 -4.659 15.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 2.264 -4.932 13.888 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 0.896 -5.842 14.316 1.00 0.00 H new ATOM 784 N GLY A 471 0.940 -6.926 9.532 1.00 0.00 N ATOM 785 CA GLY A 471 -0.004 -6.933 8.430 1.00 0.00 C ATOM 786 C GLY A 471 -0.494 -5.543 8.076 1.00 0.00 C ATOM 787 O GLY A 471 -1.678 -5.239 8.221 1.00 0.00 O ATOM 0 H GLY A 471 1.126 -6.006 9.931 1.00 0.00 H new ATOM 0 HA2 GLY A 471 0.467 -7.382 7.556 1.00 0.00 H new ATOM 0 HA3 GLY A 471 -0.857 -7.560 8.690 1.00 0.00 H new ATOM 791 N TYR A 472 0.419 -4.697 7.613 1.00 0.00 N ATOM 792 CA TYR A 472 0.074 -3.329 7.242 1.00 0.00 C ATOM 793 C TYR A 472 1.268 -2.619 6.611 1.00 0.00 C ATOM 794 O TYR A 472 2.383 -2.674 7.130 1.00 0.00 O ATOM 795 CB TYR A 472 -0.407 -2.551 8.468 1.00 0.00 C ATOM 796 CG TYR A 472 0.543 -2.625 9.643 1.00 0.00 C ATOM 797 CD1 TYR A 472 0.515 -3.704 10.517 1.00 0.00 C ATOM 798 CD2 TYR A 472 1.469 -1.616 9.877 1.00 0.00 C ATOM 799 CE1 TYR A 472 1.380 -3.775 11.592 1.00 0.00 C ATOM 800 CE2 TYR A 472 2.338 -1.679 10.948 1.00 0.00 C ATOM 801 CZ TYR A 472 2.290 -2.760 11.803 1.00 0.00 C ATOM 802 OH TYR A 472 3.154 -2.828 12.872 1.00 0.00 O ATOM 0 H TYR A 472 1.403 -4.934 7.485 1.00 0.00 H new ATOM 0 HA TYR A 472 -0.731 -3.370 6.508 1.00 0.00 H new ATOM 0 HB2 TYR A 472 -0.550 -1.506 8.192 1.00 0.00 H new ATOM 0 HB3 TYR A 472 -1.380 -2.936 8.773 1.00 0.00 H new ATOM 0 HD1 TYR A 472 -0.195 -4.501 10.354 1.00 0.00 H new ATOM 0 HD2 TYR A 472 1.510 -0.768 9.210 1.00 0.00 H new ATOM 0 HE1 TYR A 472 1.344 -4.620 12.263 1.00 0.00 H new ATOM 0 HE2 TYR A 472 3.052 -0.886 11.115 1.00 0.00 H new ATOM 0 HH TYR A 472 3.730 -2.035 12.878 1.00 0.00 H new ATOM 812 N ALA A 473 1.025 -1.951 5.488 1.00 0.00 N ATOM 813 CA ALA A 473 2.078 -1.227 4.787 1.00 0.00 C ATOM 814 C ALA A 473 1.512 -0.026 4.037 1.00 0.00 C ATOM 815 O ALA A 473 0.304 0.210 4.043 1.00 0.00 O ATOM 816 CB ALA A 473 2.808 -2.155 3.827 1.00 0.00 C ATOM 0 H ALA A 473 0.108 -1.896 5.044 1.00 0.00 H new ATOM 0 HA ALA A 473 2.787 -0.859 5.528 1.00 0.00 H new ATOM 0 HB1 ALA A 473 3.592 -1.601 3.310 1.00 0.00 H new ATOM 0 HB2 ALA A 473 3.254 -2.978 4.385 1.00 0.00 H new ATOM 0 HB3 ALA A 473 2.102 -2.551 3.097 1.00 0.00 H new ATOM 822 N PHE A 474 2.393 0.732 3.392 1.00 0.00 N ATOM 823 CA PHE A 474 1.982 1.910 2.638 1.00 0.00 C ATOM 824 C PHE A 474 2.409 1.798 1.177 1.00 0.00 C ATOM 825 O PHE A 474 3.579 1.555 0.877 1.00 0.00 O ATOM 826 CB PHE A 474 2.579 3.174 3.260 1.00 0.00 C ATOM 827 CG PHE A 474 2.132 3.415 4.673 1.00 0.00 C ATOM 828 CD1 PHE A 474 0.856 3.885 4.939 1.00 0.00 C ATOM 829 CD2 PHE A 474 2.987 3.171 5.736 1.00 0.00 C ATOM 830 CE1 PHE A 474 0.442 4.109 6.239 1.00 0.00 C ATOM 831 CE2 PHE A 474 2.579 3.393 7.037 1.00 0.00 C ATOM 832 CZ PHE A 474 1.304 3.861 7.289 1.00 0.00 C ATOM 0 H PHE A 474 3.397 0.551 3.377 1.00 0.00 H new ATOM 0 HA PHE A 474 0.895 1.973 2.676 1.00 0.00 H new ATOM 0 HB2 PHE A 474 3.666 3.101 3.239 1.00 0.00 H new ATOM 0 HB3 PHE A 474 2.305 4.034 2.649 1.00 0.00 H new ATOM 0 HD1 PHE A 474 0.177 4.079 4.122 1.00 0.00 H new ATOM 0 HD2 PHE A 474 3.984 2.803 5.545 1.00 0.00 H new ATOM 0 HE1 PHE A 474 -0.554 4.478 6.433 1.00 0.00 H new ATOM 0 HE2 PHE A 474 3.256 3.201 7.856 1.00 0.00 H new ATOM 0 HZ PHE A 474 0.982 4.033 8.305 1.00 0.00 H new ATOM 842 N LEU A 475 1.453 1.975 0.272 1.00 0.00 N ATOM 843 CA LEU A 475 1.728 1.894 -1.158 1.00 0.00 C ATOM 844 C LEU A 475 1.889 3.285 -1.762 1.00 0.00 C ATOM 845 O LEU A 475 1.209 4.231 -1.360 1.00 0.00 O ATOM 846 CB LEU A 475 0.603 1.143 -1.872 1.00 0.00 C ATOM 847 CG LEU A 475 0.347 -0.289 -1.400 1.00 0.00 C ATOM 848 CD1 LEU A 475 -0.787 -0.918 -2.194 1.00 0.00 C ATOM 849 CD2 LEU A 475 1.613 -1.125 -1.522 1.00 0.00 C ATOM 0 H LEU A 475 0.480 2.176 0.503 1.00 0.00 H new ATOM 0 HA LEU A 475 2.663 1.350 -1.292 1.00 0.00 H new ATOM 0 HB2 LEU A 475 -0.319 1.713 -1.755 1.00 0.00 H new ATOM 0 HB3 LEU A 475 0.829 1.118 -2.938 1.00 0.00 H new ATOM 0 HG LEU A 475 0.055 -0.258 -0.350 1.00 0.00 H new ATOM 0 HD11 LEU A 475 -0.955 -1.937 -1.844 1.00 0.00 H new ATOM 0 HD12 LEU A 475 -1.696 -0.333 -2.056 1.00 0.00 H new ATOM 0 HD13 LEU A 475 -0.524 -0.936 -3.252 1.00 0.00 H new ATOM 0 HD21 LEU A 475 1.412 -2.141 -1.182 1.00 0.00 H new ATOM 0 HD22 LEU A 475 1.935 -1.148 -2.563 1.00 0.00 H new ATOM 0 HD23 LEU A 475 2.400 -0.686 -0.909 1.00 0.00 H new ATOM 861 N LEU A 476 2.790 3.404 -2.731 1.00 0.00 N ATOM 862 CA LEU A 476 3.038 4.680 -3.392 1.00 0.00 C ATOM 863 C LEU A 476 3.009 4.521 -4.909 1.00 0.00 C ATOM 864 O LEU A 476 4.008 4.147 -5.524 1.00 0.00 O ATOM 865 CB LEU A 476 4.389 5.250 -2.954 1.00 0.00 C ATOM 866 CG LEU A 476 4.628 5.323 -1.445 1.00 0.00 C ATOM 867 CD1 LEU A 476 6.037 5.816 -1.152 1.00 0.00 C ATOM 868 CD2 LEU A 476 3.597 6.227 -0.785 1.00 0.00 C ATOM 0 H LEU A 476 3.361 2.632 -3.076 1.00 0.00 H new ATOM 0 HA LEU A 476 2.247 5.372 -3.101 1.00 0.00 H new ATOM 0 HB2 LEU A 476 5.178 4.643 -3.398 1.00 0.00 H new ATOM 0 HB3 LEU A 476 4.488 6.254 -3.367 1.00 0.00 H new ATOM 0 HG LEU A 476 4.522 4.321 -1.030 1.00 0.00 H new ATOM 0 HD11 LEU A 476 6.190 5.862 -0.074 1.00 0.00 H new ATOM 0 HD12 LEU A 476 6.761 5.131 -1.592 1.00 0.00 H new ATOM 0 HD13 LEU A 476 6.171 6.809 -1.580 1.00 0.00 H new ATOM 0 HD21 LEU A 476 3.782 6.267 0.288 1.00 0.00 H new ATOM 0 HD22 LEU A 476 3.672 7.231 -1.204 1.00 0.00 H new ATOM 0 HD23 LEU A 476 2.597 5.832 -0.966 1.00 0.00 H new ATOM 880 N PHE A 477 1.858 4.810 -5.507 1.00 0.00 N ATOM 881 CA PHE A 477 1.699 4.701 -6.952 1.00 0.00 C ATOM 882 C PHE A 477 2.417 5.842 -7.666 1.00 0.00 C ATOM 883 O PHE A 477 2.262 7.009 -7.306 1.00 0.00 O ATOM 884 CB PHE A 477 0.215 4.705 -7.325 1.00 0.00 C ATOM 885 CG PHE A 477 -0.516 3.466 -6.891 1.00 0.00 C ATOM 886 CD1 PHE A 477 -1.103 3.395 -5.638 1.00 0.00 C ATOM 887 CD2 PHE A 477 -0.615 2.373 -7.737 1.00 0.00 C ATOM 888 CE1 PHE A 477 -1.776 2.256 -5.236 1.00 0.00 C ATOM 889 CE2 PHE A 477 -1.287 1.232 -7.341 1.00 0.00 C ATOM 890 CZ PHE A 477 -1.867 1.173 -6.088 1.00 0.00 C ATOM 0 H PHE A 477 1.022 5.121 -5.013 1.00 0.00 H new ATOM 0 HA PHE A 477 2.144 3.759 -7.271 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -0.262 5.575 -6.875 1.00 0.00 H new ATOM 0 HB3 PHE A 477 0.120 4.813 -8.405 1.00 0.00 H new ATOM 0 HD1 PHE A 477 -1.034 4.239 -4.968 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -0.162 2.413 -8.717 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -2.230 2.213 -4.257 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -1.359 0.387 -8.010 1.00 0.00 H new ATOM 0 HZ PHE A 477 -2.391 0.281 -5.776 1.00 0.00 H new ATOM 900 N GLN A 478 3.203 5.496 -8.680 1.00 0.00 N ATOM 901 CA GLN A 478 3.947 6.491 -9.444 1.00 0.00 C ATOM 902 C GLN A 478 3.000 7.481 -10.115 1.00 0.00 C ATOM 903 O GLN A 478 3.110 8.690 -9.917 1.00 0.00 O ATOM 904 CB GLN A 478 4.820 5.808 -10.498 1.00 0.00 C ATOM 905 CG GLN A 478 6.100 5.213 -9.935 1.00 0.00 C ATOM 906 CD GLN A 478 7.121 6.271 -9.563 1.00 0.00 C ATOM 907 OE1 GLN A 478 7.529 7.077 -10.400 1.00 0.00 O ATOM 908 NE2 GLN A 478 7.540 6.274 -8.303 1.00 0.00 N ATOM 0 H GLN A 478 3.341 4.535 -8.992 1.00 0.00 H new ATOM 0 HA GLN A 478 4.587 7.039 -8.753 1.00 0.00 H new ATOM 0 HB2 GLN A 478 4.243 5.018 -10.979 1.00 0.00 H new ATOM 0 HB3 GLN A 478 5.075 6.533 -11.271 1.00 0.00 H new ATOM 0 HG2 GLN A 478 5.862 4.617 -9.054 1.00 0.00 H new ATOM 0 HG3 GLN A 478 6.535 4.536 -10.670 1.00 0.00 H new ATOM 0 HE21 GLN A 478 7.175 5.588 -7.643 1.00 0.00 H new ATOM 0 HE22 GLN A 478 8.227 6.963 -7.996 1.00 0.00 H new ATOM 917 N GLU A 479 2.072 6.958 -10.910 1.00 0.00 N ATOM 918 CA GLU A 479 1.107 7.797 -11.611 1.00 0.00 C ATOM 919 C GLU A 479 -0.149 8.003 -10.769 1.00 0.00 C ATOM 920 O GLU A 479 -0.896 7.060 -10.510 1.00 0.00 O ATOM 921 CB GLU A 479 0.734 7.170 -12.956 1.00 0.00 C ATOM 922 CG GLU A 479 1.770 7.401 -14.044 1.00 0.00 C ATOM 923 CD GLU A 479 1.298 6.937 -15.408 1.00 0.00 C ATOM 924 OE1 GLU A 479 0.647 7.734 -16.114 1.00 0.00 O ATOM 925 OE2 GLU A 479 1.581 5.775 -15.769 1.00 0.00 O ATOM 0 H GLU A 479 1.968 5.958 -11.085 1.00 0.00 H new ATOM 0 HA GLU A 479 1.570 8.768 -11.786 1.00 0.00 H new ATOM 0 HB2 GLU A 479 0.594 6.097 -12.821 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -0.222 7.577 -13.284 1.00 0.00 H new ATOM 0 HG2 GLU A 479 2.013 8.463 -14.090 1.00 0.00 H new ATOM 0 HG3 GLU A 479 2.688 6.875 -13.783 1.00 0.00 H new ATOM 932 N GLU A 480 -0.372 9.243 -10.344 1.00 0.00 N ATOM 933 CA GLU A 480 -1.536 9.572 -9.529 1.00 0.00 C ATOM 934 C GLU A 480 -2.760 8.782 -9.984 1.00 0.00 C ATOM 935 O GLU A 480 -3.470 8.193 -9.169 1.00 0.00 O ATOM 936 CB GLU A 480 -1.828 11.072 -9.601 1.00 0.00 C ATOM 937 CG GLU A 480 -0.993 11.902 -8.641 1.00 0.00 C ATOM 938 CD GLU A 480 -1.395 13.364 -8.630 1.00 0.00 C ATOM 939 OE1 GLU A 480 -1.544 13.947 -9.724 1.00 0.00 O ATOM 940 OE2 GLU A 480 -1.562 13.925 -7.527 1.00 0.00 O ATOM 0 H GLU A 480 0.237 10.035 -10.550 1.00 0.00 H new ATOM 0 HA GLU A 480 -1.314 9.301 -8.497 1.00 0.00 H new ATOM 0 HB2 GLU A 480 -1.649 11.420 -10.618 1.00 0.00 H new ATOM 0 HB3 GLU A 480 -2.884 11.239 -9.388 1.00 0.00 H new ATOM 0 HG2 GLU A 480 -1.091 11.495 -7.635 1.00 0.00 H new ATOM 0 HG3 GLU A 480 0.058 11.821 -8.916 1.00 0.00 H new ATOM 947 N SER A 481 -3.000 8.775 -11.291 1.00 0.00 N ATOM 948 CA SER A 481 -4.140 8.062 -11.855 1.00 0.00 C ATOM 949 C SER A 481 -4.401 6.766 -11.093 1.00 0.00 C ATOM 950 O SER A 481 -5.488 6.558 -10.555 1.00 0.00 O ATOM 951 CB SER A 481 -3.896 7.756 -13.335 1.00 0.00 C ATOM 952 OG SER A 481 -4.095 8.910 -14.133 1.00 0.00 O ATOM 0 H SER A 481 -2.420 9.255 -11.979 1.00 0.00 H new ATOM 0 HA SER A 481 -5.018 8.701 -11.763 1.00 0.00 H new ATOM 0 HB2 SER A 481 -2.879 7.387 -13.471 1.00 0.00 H new ATOM 0 HB3 SER A 481 -4.569 6.963 -13.662 1.00 0.00 H new ATOM 0 HG SER A 481 -3.932 8.689 -15.074 1.00 0.00 H new ATOM 958 N SER A 482 -3.395 5.898 -11.053 1.00 0.00 N ATOM 959 CA SER A 482 -3.516 4.620 -10.361 1.00 0.00 C ATOM 960 C SER A 482 -4.395 4.754 -9.122 1.00 0.00 C ATOM 961 O SER A 482 -5.330 3.978 -8.922 1.00 0.00 O ATOM 962 CB SER A 482 -2.133 4.098 -9.965 1.00 0.00 C ATOM 963 OG SER A 482 -1.269 4.041 -11.087 1.00 0.00 O ATOM 0 H SER A 482 -2.488 6.056 -11.491 1.00 0.00 H new ATOM 0 HA SER A 482 -3.984 3.909 -11.042 1.00 0.00 H new ATOM 0 HB2 SER A 482 -1.701 4.746 -9.202 1.00 0.00 H new ATOM 0 HB3 SER A 482 -2.228 3.106 -9.524 1.00 0.00 H new ATOM 0 HG SER A 482 -0.870 4.923 -11.238 1.00 0.00 H new ATOM 969 N VAL A 483 -4.089 5.746 -8.291 1.00 0.00 N ATOM 970 CA VAL A 483 -4.851 5.985 -7.071 1.00 0.00 C ATOM 971 C VAL A 483 -6.349 5.866 -7.327 1.00 0.00 C ATOM 972 O VAL A 483 -7.032 5.052 -6.707 1.00 0.00 O ATOM 973 CB VAL A 483 -4.550 7.377 -6.485 1.00 0.00 C ATOM 974 CG1 VAL A 483 -5.376 7.618 -5.230 1.00 0.00 C ATOM 975 CG2 VAL A 483 -3.064 7.520 -6.190 1.00 0.00 C ATOM 0 H VAL A 483 -3.318 6.397 -8.441 1.00 0.00 H new ATOM 0 HA VAL A 483 -4.547 5.224 -6.353 1.00 0.00 H new ATOM 0 HB VAL A 483 -4.825 8.130 -7.223 1.00 0.00 H new ATOM 0 HG11 VAL A 483 -5.150 8.606 -4.830 1.00 0.00 H new ATOM 0 HG12 VAL A 483 -6.436 7.560 -5.476 1.00 0.00 H new ATOM 0 HG13 VAL A 483 -5.134 6.861 -4.484 1.00 0.00 H new ATOM 0 HG21 VAL A 483 -2.869 8.509 -5.777 1.00 0.00 H new ATOM 0 HG22 VAL A 483 -2.761 6.760 -5.470 1.00 0.00 H new ATOM 0 HG23 VAL A 483 -2.496 7.394 -7.112 1.00 0.00 H new ATOM 985 N GLN A 484 -6.854 6.684 -8.245 1.00 0.00 N ATOM 986 CA GLN A 484 -8.272 6.671 -8.583 1.00 0.00 C ATOM 987 C GLN A 484 -8.725 5.268 -8.973 1.00 0.00 C ATOM 988 O GLN A 484 -9.601 4.688 -8.332 1.00 0.00 O ATOM 989 CB GLN A 484 -8.555 7.648 -9.725 1.00 0.00 C ATOM 990 CG GLN A 484 -10.036 7.906 -9.952 1.00 0.00 C ATOM 991 CD GLN A 484 -10.694 8.601 -8.776 1.00 0.00 C ATOM 992 OE1 GLN A 484 -10.396 9.758 -8.477 1.00 0.00 O ATOM 993 NE2 GLN A 484 -11.595 7.897 -8.101 1.00 0.00 N ATOM 0 H GLN A 484 -6.302 7.364 -8.768 1.00 0.00 H new ATOM 0 HA GLN A 484 -8.833 6.982 -7.702 1.00 0.00 H new ATOM 0 HB2 GLN A 484 -8.058 8.595 -9.514 1.00 0.00 H new ATOM 0 HB3 GLN A 484 -8.118 7.257 -10.644 1.00 0.00 H new ATOM 0 HG2 GLN A 484 -10.162 8.516 -10.847 1.00 0.00 H new ATOM 0 HG3 GLN A 484 -10.542 6.959 -10.139 1.00 0.00 H new ATOM 0 HE21 GLN A 484 -11.811 6.941 -8.384 1.00 0.00 H new ATOM 0 HE22 GLN A 484 -12.071 8.312 -7.300 1.00 0.00 H new ATOM 1002 N ALA A 485 -8.124 4.730 -10.029 1.00 0.00 N ATOM 1003 CA ALA A 485 -8.465 3.395 -10.504 1.00 0.00 C ATOM 1004 C ALA A 485 -8.535 2.403 -9.348 1.00 0.00 C ATOM 1005 O ALA A 485 -9.402 1.528 -9.319 1.00 0.00 O ATOM 1006 CB ALA A 485 -7.454 2.929 -11.541 1.00 0.00 C ATOM 0 H ALA A 485 -7.398 5.198 -10.572 1.00 0.00 H new ATOM 0 HA ALA A 485 -9.450 3.442 -10.969 1.00 0.00 H new ATOM 0 HB1 ALA A 485 -7.721 1.930 -11.887 1.00 0.00 H new ATOM 0 HB2 ALA A 485 -7.455 3.618 -12.386 1.00 0.00 H new ATOM 0 HB3 ALA A 485 -6.460 2.904 -11.095 1.00 0.00 H new ATOM 1012 N LEU A 486 -7.618 2.543 -8.398 1.00 0.00 N ATOM 1013 CA LEU A 486 -7.575 1.658 -7.239 1.00 0.00 C ATOM 1014 C LEU A 486 -8.824 1.824 -6.380 1.00 0.00 C ATOM 1015 O LEU A 486 -9.553 0.863 -6.133 1.00 0.00 O ATOM 1016 CB LEU A 486 -6.326 1.940 -6.403 1.00 0.00 C ATOM 1017 CG LEU A 486 -5.990 0.905 -5.328 1.00 0.00 C ATOM 1018 CD1 LEU A 486 -5.435 -0.361 -5.962 1.00 0.00 C ATOM 1019 CD2 LEU A 486 -4.999 1.480 -4.326 1.00 0.00 C ATOM 0 H LEU A 486 -6.894 3.261 -8.407 1.00 0.00 H new ATOM 0 HA LEU A 486 -7.539 0.630 -7.599 1.00 0.00 H new ATOM 0 HB2 LEU A 486 -5.473 2.024 -7.077 1.00 0.00 H new ATOM 0 HB3 LEU A 486 -6.448 2.910 -5.920 1.00 0.00 H new ATOM 0 HG LEU A 486 -6.907 0.649 -4.797 1.00 0.00 H new ATOM 0 HD11 LEU A 486 -5.202 -1.086 -5.182 1.00 0.00 H new ATOM 0 HD12 LEU A 486 -6.176 -0.783 -6.640 1.00 0.00 H new ATOM 0 HD13 LEU A 486 -4.529 -0.122 -6.518 1.00 0.00 H new ATOM 0 HD21 LEU A 486 -4.771 0.730 -3.568 1.00 0.00 H new ATOM 0 HD22 LEU A 486 -4.082 1.764 -4.843 1.00 0.00 H new ATOM 0 HD23 LEU A 486 -5.433 2.358 -3.848 1.00 0.00 H new ATOM 1031 N ILE A 487 -9.067 3.051 -5.930 1.00 0.00 N ATOM 1032 CA ILE A 487 -10.230 3.343 -5.101 1.00 0.00 C ATOM 1033 C ILE A 487 -11.499 2.753 -5.706 1.00 0.00 C ATOM 1034 O ILE A 487 -12.168 1.926 -5.086 1.00 0.00 O ATOM 1035 CB ILE A 487 -10.421 4.860 -4.915 1.00 0.00 C ATOM 1036 CG1 ILE A 487 -9.180 5.477 -4.268 1.00 0.00 C ATOM 1037 CG2 ILE A 487 -11.659 5.139 -4.075 1.00 0.00 C ATOM 1038 CD1 ILE A 487 -9.082 6.975 -4.455 1.00 0.00 C ATOM 0 H ILE A 487 -8.474 3.858 -6.125 1.00 0.00 H new ATOM 0 HA ILE A 487 -10.048 2.885 -4.129 1.00 0.00 H new ATOM 0 HB ILE A 487 -10.561 5.317 -5.895 1.00 0.00 H new ATOM 0 HG12 ILE A 487 -9.186 5.252 -3.202 1.00 0.00 H new ATOM 0 HG13 ILE A 487 -8.290 5.008 -4.688 1.00 0.00 H new ATOM 0 HG21 ILE A 487 -11.781 6.215 -3.952 1.00 0.00 H new ATOM 0 HG22 ILE A 487 -12.537 4.729 -4.574 1.00 0.00 H new ATOM 0 HG23 ILE A 487 -11.547 4.673 -3.096 1.00 0.00 H new ATOM 0 HD11 ILE A 487 -8.178 7.344 -3.970 1.00 0.00 H new ATOM 0 HD12 ILE A 487 -9.044 7.207 -5.519 1.00 0.00 H new ATOM 0 HD13 ILE A 487 -9.954 7.455 -4.010 1.00 0.00 H new ATOM 1050 N ASP A 488 -11.823 3.181 -6.921 1.00 0.00 N ATOM 1051 CA ASP A 488 -13.010 2.692 -7.613 1.00 0.00 C ATOM 1052 C ASP A 488 -13.105 1.172 -7.523 1.00 0.00 C ATOM 1053 O ASP A 488 -14.178 0.621 -7.280 1.00 0.00 O ATOM 1054 CB ASP A 488 -12.988 3.128 -9.079 1.00 0.00 C ATOM 1055 CG ASP A 488 -14.340 2.976 -9.748 1.00 0.00 C ATOM 1056 OD1 ASP A 488 -15.291 3.670 -9.330 1.00 0.00 O ATOM 1057 OD2 ASP A 488 -14.447 2.164 -10.691 1.00 0.00 O ATOM 0 H ASP A 488 -11.280 3.866 -7.447 1.00 0.00 H new ATOM 0 HA ASP A 488 -13.886 3.122 -7.127 1.00 0.00 H new ATOM 0 HB2 ASP A 488 -12.670 4.169 -9.141 1.00 0.00 H new ATOM 0 HB3 ASP A 488 -12.249 2.536 -9.620 1.00 0.00 H new ATOM 1062 N ALA A 489 -11.975 0.502 -7.721 1.00 0.00 N ATOM 1063 CA ALA A 489 -11.930 -0.954 -7.661 1.00 0.00 C ATOM 1064 C ALA A 489 -12.163 -1.452 -6.239 1.00 0.00 C ATOM 1065 O ALA A 489 -12.876 -2.434 -6.024 1.00 0.00 O ATOM 1066 CB ALA A 489 -10.597 -1.463 -8.188 1.00 0.00 C ATOM 0 H ALA A 489 -11.078 0.944 -7.924 1.00 0.00 H new ATOM 0 HA ALA A 489 -12.730 -1.344 -8.291 1.00 0.00 H new ATOM 0 HB1 ALA A 489 -10.577 -2.552 -8.137 1.00 0.00 H new ATOM 0 HB2 ALA A 489 -10.470 -1.146 -9.223 1.00 0.00 H new ATOM 0 HB3 ALA A 489 -9.787 -1.057 -7.582 1.00 0.00 H new ATOM 1072 N CYS A 490 -11.559 -0.772 -5.272 1.00 0.00 N ATOM 1073 CA CYS A 490 -11.700 -1.147 -3.869 1.00 0.00 C ATOM 1074 C CYS A 490 -13.139 -0.964 -3.400 1.00 0.00 C ATOM 1075 O CYS A 490 -13.657 0.154 -3.369 1.00 0.00 O ATOM 1076 CB CYS A 490 -10.757 -0.313 -3.000 1.00 0.00 C ATOM 1077 SG CYS A 490 -9.014 -0.450 -3.460 1.00 0.00 S ATOM 0 H CYS A 490 -10.966 0.042 -5.433 1.00 0.00 H new ATOM 0 HA CYS A 490 -11.436 -2.200 -3.771 1.00 0.00 H new ATOM 0 HB2 CYS A 490 -11.056 0.733 -3.059 1.00 0.00 H new ATOM 0 HB3 CYS A 490 -10.872 -0.619 -1.960 1.00 0.00 H new ATOM 0 HG CYS A 490 -8.856 -0.049 -4.687 1.00 0.00 H new ATOM 1083 N LEU A 491 -13.782 -2.068 -3.036 1.00 0.00 N ATOM 1084 CA LEU A 491 -15.164 -2.031 -2.570 1.00 0.00 C ATOM 1085 C LEU A 491 -15.310 -1.094 -1.375 1.00 0.00 C ATOM 1086 O LEU A 491 -14.343 -0.466 -0.945 1.00 0.00 O ATOM 1087 CB LEU A 491 -15.633 -3.436 -2.190 1.00 0.00 C ATOM 1088 CG LEU A 491 -15.374 -4.532 -3.224 1.00 0.00 C ATOM 1089 CD1 LEU A 491 -15.433 -5.906 -2.573 1.00 0.00 C ATOM 1090 CD2 LEU A 491 -16.377 -4.437 -4.364 1.00 0.00 C ATOM 0 H LEU A 491 -13.368 -3.000 -3.055 1.00 0.00 H new ATOM 0 HA LEU A 491 -15.785 -1.655 -3.383 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -15.145 -3.721 -1.258 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -16.704 -3.398 -1.990 1.00 0.00 H new ATOM 0 HG LEU A 491 -14.374 -4.389 -3.633 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -15.246 -6.673 -3.325 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -14.676 -5.971 -1.792 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -16.420 -6.059 -2.136 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -16.178 -5.225 -5.091 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -17.387 -4.553 -3.971 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -16.286 -3.465 -4.849 1.00 0.00 H new ATOM 1102 N GLU A 492 -16.525 -1.006 -0.843 1.00 0.00 N ATOM 1103 CA GLU A 492 -16.796 -0.146 0.303 1.00 0.00 C ATOM 1104 C GLU A 492 -17.820 -0.789 1.235 1.00 0.00 C ATOM 1105 O GLU A 492 -18.801 -1.378 0.783 1.00 0.00 O ATOM 1106 CB GLU A 492 -17.303 1.220 -0.164 1.00 0.00 C ATOM 1107 CG GLU A 492 -17.148 2.315 0.877 1.00 0.00 C ATOM 1108 CD GLU A 492 -18.147 3.441 0.692 1.00 0.00 C ATOM 1109 OE1 GLU A 492 -19.321 3.263 1.079 1.00 0.00 O ATOM 1110 OE2 GLU A 492 -17.754 4.501 0.160 1.00 0.00 O ATOM 0 H GLU A 492 -17.337 -1.519 -1.187 1.00 0.00 H new ATOM 0 HA GLU A 492 -15.864 -0.011 0.852 1.00 0.00 H new ATOM 0 HB2 GLU A 492 -16.764 1.509 -1.066 1.00 0.00 H new ATOM 0 HB3 GLU A 492 -18.355 1.134 -0.435 1.00 0.00 H new ATOM 0 HG2 GLU A 492 -17.270 1.886 1.871 1.00 0.00 H new ATOM 0 HG3 GLU A 492 -16.137 2.719 0.826 1.00 0.00 H new ATOM 1117 N GLU A 493 -17.581 -0.671 2.538 1.00 0.00 N ATOM 1118 CA GLU A 493 -18.481 -1.241 3.533 1.00 0.00 C ATOM 1119 C GLU A 493 -19.087 -0.149 4.409 1.00 0.00 C ATOM 1120 O GLU A 493 -20.264 0.187 4.276 1.00 0.00 O ATOM 1121 CB GLU A 493 -17.737 -2.255 4.405 1.00 0.00 C ATOM 1122 CG GLU A 493 -18.640 -3.013 5.363 1.00 0.00 C ATOM 1123 CD GLU A 493 -19.746 -3.766 4.650 1.00 0.00 C ATOM 1124 OE1 GLU A 493 -20.814 -3.163 4.409 1.00 0.00 O ATOM 1125 OE2 GLU A 493 -19.546 -4.956 4.332 1.00 0.00 O ATOM 0 H GLU A 493 -16.773 -0.186 2.928 1.00 0.00 H new ATOM 0 HA GLU A 493 -19.288 -1.749 3.005 1.00 0.00 H new ATOM 0 HB2 GLU A 493 -17.225 -2.969 3.760 1.00 0.00 H new ATOM 0 HB3 GLU A 493 -16.969 -1.735 4.978 1.00 0.00 H new ATOM 0 HG2 GLU A 493 -18.041 -3.716 5.941 1.00 0.00 H new ATOM 0 HG3 GLU A 493 -19.081 -2.312 6.072 1.00 0.00 H new ATOM 1132 N ASP A 494 -18.274 0.402 5.304 1.00 0.00 N ATOM 1133 CA ASP A 494 -18.729 1.458 6.202 1.00 0.00 C ATOM 1134 C ASP A 494 -17.809 2.672 6.122 1.00 0.00 C ATOM 1135 O ASP A 494 -17.074 2.970 7.062 1.00 0.00 O ATOM 1136 CB ASP A 494 -18.789 0.942 7.640 1.00 0.00 C ATOM 1137 CG ASP A 494 -19.776 -0.196 7.807 1.00 0.00 C ATOM 1138 OD1 ASP A 494 -20.796 -0.207 7.086 1.00 0.00 O ATOM 1139 OD2 ASP A 494 -19.530 -1.076 8.658 1.00 0.00 O ATOM 0 H ASP A 494 -17.297 0.135 5.427 1.00 0.00 H new ATOM 0 HA ASP A 494 -19.729 1.761 5.891 1.00 0.00 H new ATOM 0 HB2 ASP A 494 -17.797 0.606 7.944 1.00 0.00 H new ATOM 0 HB3 ASP A 494 -19.066 1.760 8.305 1.00 0.00 H new ATOM 1144 N GLY A 495 -17.856 3.370 4.991 1.00 0.00 N ATOM 1145 CA GLY A 495 -17.022 4.544 4.808 1.00 0.00 C ATOM 1146 C GLY A 495 -15.614 4.192 4.372 1.00 0.00 C ATOM 1147 O GLY A 495 -14.945 4.985 3.708 1.00 0.00 O ATOM 0 H GLY A 495 -18.457 3.143 4.198 1.00 0.00 H new ATOM 0 HA2 GLY A 495 -17.477 5.197 4.063 1.00 0.00 H new ATOM 0 HA3 GLY A 495 -16.980 5.106 5.741 1.00 0.00 H new ATOM 1151 N LYS A 496 -15.161 3.000 4.745 1.00 0.00 N ATOM 1152 CA LYS A 496 -13.823 2.544 4.389 1.00 0.00 C ATOM 1153 C LYS A 496 -13.872 1.590 3.200 1.00 0.00 C ATOM 1154 O LYS A 496 -14.892 0.946 2.949 1.00 0.00 O ATOM 1155 CB LYS A 496 -13.162 1.853 5.584 1.00 0.00 C ATOM 1156 CG LYS A 496 -12.941 2.773 6.773 1.00 0.00 C ATOM 1157 CD LYS A 496 -14.134 2.763 7.714 1.00 0.00 C ATOM 1158 CE LYS A 496 -13.724 3.117 9.136 1.00 0.00 C ATOM 1159 NZ LYS A 496 -13.309 4.542 9.255 1.00 0.00 N ATOM 0 H LYS A 496 -15.702 2.332 5.294 1.00 0.00 H new ATOM 0 HA LYS A 496 -13.232 3.416 4.109 1.00 0.00 H new ATOM 0 HB2 LYS A 496 -13.782 1.013 5.896 1.00 0.00 H new ATOM 0 HB3 LYS A 496 -12.203 1.442 5.270 1.00 0.00 H new ATOM 0 HG2 LYS A 496 -12.047 2.462 7.314 1.00 0.00 H new ATOM 0 HG3 LYS A 496 -12.763 3.789 6.420 1.00 0.00 H new ATOM 0 HD2 LYS A 496 -14.882 3.473 7.362 1.00 0.00 H new ATOM 0 HD3 LYS A 496 -14.600 1.778 7.703 1.00 0.00 H new ATOM 0 HE2 LYS A 496 -14.556 2.923 9.813 1.00 0.00 H new ATOM 0 HE3 LYS A 496 -12.903 2.472 9.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 -13.037 4.743 10.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 -12.499 4.721 8.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 -14.101 5.158 8.982 1.00 0.00 H new ATOM 1173 N LEU A 497 -12.764 1.502 2.472 1.00 0.00 N ATOM 1174 CA LEU A 497 -12.681 0.624 1.309 1.00 0.00 C ATOM 1175 C LEU A 497 -12.129 -0.743 1.698 1.00 0.00 C ATOM 1176 O LEU A 497 -11.634 -0.931 2.810 1.00 0.00 O ATOM 1177 CB LEU A 497 -11.797 1.256 0.232 1.00 0.00 C ATOM 1178 CG LEU A 497 -12.178 2.671 -0.203 1.00 0.00 C ATOM 1179 CD1 LEU A 497 -11.071 3.286 -1.046 1.00 0.00 C ATOM 1180 CD2 LEU A 497 -13.491 2.658 -0.972 1.00 0.00 C ATOM 0 H LEU A 497 -11.911 2.027 2.666 1.00 0.00 H new ATOM 0 HA LEU A 497 -13.687 0.489 0.912 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -10.770 1.274 0.597 1.00 0.00 H new ATOM 0 HB3 LEU A 497 -11.812 0.611 -0.647 1.00 0.00 H new ATOM 0 HG LEU A 497 -12.309 3.282 0.690 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -11.360 4.293 -1.347 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -10.152 3.331 -0.462 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -10.908 2.675 -1.934 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -13.746 3.674 -1.273 1.00 0.00 H new ATOM 0 HD22 LEU A 497 -13.388 2.032 -1.858 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -14.281 2.259 -0.336 1.00 0.00 H new ATOM 1192 N TYR A 498 -12.216 -1.695 0.775 1.00 0.00 N ATOM 1193 CA TYR A 498 -11.726 -3.046 1.022 1.00 0.00 C ATOM 1194 C TYR A 498 -11.414 -3.760 -0.290 1.00 0.00 C ATOM 1195 O TYR A 498 -12.306 -4.005 -1.104 1.00 0.00 O ATOM 1196 CB TYR A 498 -12.756 -3.847 1.819 1.00 0.00 C ATOM 1197 CG TYR A 498 -13.019 -3.290 3.200 1.00 0.00 C ATOM 1198 CD1 TYR A 498 -12.254 -3.689 4.289 1.00 0.00 C ATOM 1199 CD2 TYR A 498 -14.032 -2.364 3.416 1.00 0.00 C ATOM 1200 CE1 TYR A 498 -12.492 -3.184 5.553 1.00 0.00 C ATOM 1201 CE2 TYR A 498 -14.276 -1.852 4.675 1.00 0.00 C ATOM 1202 CZ TYR A 498 -13.503 -2.265 5.741 1.00 0.00 C ATOM 1203 OH TYR A 498 -13.742 -1.758 6.997 1.00 0.00 O ATOM 0 H TYR A 498 -12.621 -1.556 -0.151 1.00 0.00 H new ATOM 0 HA TYR A 498 -10.806 -2.971 1.602 1.00 0.00 H new ATOM 0 HB2 TYR A 498 -13.693 -3.874 1.263 1.00 0.00 H new ATOM 0 HB3 TYR A 498 -12.411 -4.877 1.911 1.00 0.00 H new ATOM 0 HD1 TYR A 498 -11.460 -4.406 4.145 1.00 0.00 H new ATOM 0 HD2 TYR A 498 -14.639 -2.039 2.584 1.00 0.00 H new ATOM 0 HE1 TYR A 498 -11.890 -3.507 6.389 1.00 0.00 H new ATOM 0 HE2 TYR A 498 -15.067 -1.132 4.825 1.00 0.00 H new ATOM 0 HH TYR A 498 -14.487 -1.122 6.957 1.00 0.00 H new ATOM 1213 N LEU A 499 -10.143 -4.091 -0.488 1.00 0.00 N ATOM 1214 CA LEU A 499 -9.712 -4.778 -1.701 1.00 0.00 C ATOM 1215 C LEU A 499 -9.277 -6.207 -1.391 1.00 0.00 C ATOM 1216 O LEU A 499 -8.584 -6.456 -0.404 1.00 0.00 O ATOM 1217 CB LEU A 499 -8.562 -4.015 -2.361 1.00 0.00 C ATOM 1218 CG LEU A 499 -8.220 -4.425 -3.794 1.00 0.00 C ATOM 1219 CD1 LEU A 499 -9.329 -4.007 -4.748 1.00 0.00 C ATOM 1220 CD2 LEU A 499 -6.891 -3.818 -4.219 1.00 0.00 C ATOM 0 H LEU A 499 -9.393 -3.895 0.175 1.00 0.00 H new ATOM 0 HA LEU A 499 -10.557 -4.815 -2.388 1.00 0.00 H new ATOM 0 HB2 LEU A 499 -8.807 -2.953 -2.357 1.00 0.00 H new ATOM 0 HB3 LEU A 499 -7.670 -4.139 -1.746 1.00 0.00 H new ATOM 0 HG LEU A 499 -8.129 -5.511 -3.829 1.00 0.00 H new ATOM 0 HD11 LEU A 499 -9.068 -4.307 -5.763 1.00 0.00 H new ATOM 0 HD12 LEU A 499 -10.262 -4.489 -4.455 1.00 0.00 H new ATOM 0 HD13 LEU A 499 -9.453 -2.925 -4.710 1.00 0.00 H new ATOM 0 HD21 LEU A 499 -6.663 -4.120 -5.241 1.00 0.00 H new ATOM 0 HD22 LEU A 499 -6.954 -2.731 -4.167 1.00 0.00 H new ATOM 0 HD23 LEU A 499 -6.102 -4.167 -3.553 1.00 0.00 H new ATOM 1232 N CYS A 500 -9.686 -7.141 -2.242 1.00 0.00 N ATOM 1233 CA CYS A 500 -9.338 -8.546 -2.060 1.00 0.00 C ATOM 1234 C CYS A 500 -7.966 -8.848 -2.655 1.00 0.00 C ATOM 1235 O CYS A 500 -7.670 -8.460 -3.786 1.00 0.00 O ATOM 1236 CB CYS A 500 -10.396 -9.443 -2.706 1.00 0.00 C ATOM 1237 SG CYS A 500 -10.479 -9.307 -4.507 1.00 0.00 S ATOM 0 H CYS A 500 -10.259 -6.951 -3.064 1.00 0.00 H new ATOM 0 HA CYS A 500 -9.303 -8.750 -0.990 1.00 0.00 H new ATOM 0 HB2 CYS A 500 -10.190 -10.480 -2.440 1.00 0.00 H new ATOM 0 HB3 CYS A 500 -11.372 -9.195 -2.288 1.00 0.00 H new ATOM 0 HG CYS A 500 -9.335 -8.892 -4.964 1.00 0.00 H new ATOM 1243 N VAL A 501 -7.132 -9.540 -1.886 1.00 0.00 N ATOM 1244 CA VAL A 501 -5.791 -9.893 -2.337 1.00 0.00 C ATOM 1245 C VAL A 501 -5.509 -11.374 -2.113 1.00 0.00 C ATOM 1246 O VAL A 501 -5.446 -11.840 -0.975 1.00 0.00 O ATOM 1247 CB VAL A 501 -4.718 -9.061 -1.609 1.00 0.00 C ATOM 1248 CG1 VAL A 501 -4.824 -7.595 -1.999 1.00 0.00 C ATOM 1249 CG2 VAL A 501 -4.842 -9.232 -0.103 1.00 0.00 C ATOM 0 H VAL A 501 -7.361 -9.867 -0.948 1.00 0.00 H new ATOM 0 HA VAL A 501 -5.747 -9.675 -3.404 1.00 0.00 H new ATOM 0 HB VAL A 501 -3.735 -9.422 -1.912 1.00 0.00 H new ATOM 0 HG11 VAL A 501 -4.058 -7.023 -1.475 1.00 0.00 H new ATOM 0 HG12 VAL A 501 -4.680 -7.493 -3.075 1.00 0.00 H new ATOM 0 HG13 VAL A 501 -5.809 -7.217 -1.727 1.00 0.00 H new ATOM 0 HG21 VAL A 501 -4.076 -8.637 0.395 1.00 0.00 H new ATOM 0 HG22 VAL A 501 -5.828 -8.899 0.221 1.00 0.00 H new ATOM 0 HG23 VAL A 501 -4.711 -10.283 0.156 1.00 0.00 H new ATOM 1259 N SER A 502 -5.339 -12.110 -3.207 1.00 0.00 N ATOM 1260 CA SER A 502 -5.066 -13.541 -3.131 1.00 0.00 C ATOM 1261 C SER A 502 -3.569 -13.802 -2.997 1.00 0.00 C ATOM 1262 O SER A 502 -2.764 -13.269 -3.760 1.00 0.00 O ATOM 1263 CB SER A 502 -5.610 -14.252 -4.371 1.00 0.00 C ATOM 1264 OG SER A 502 -5.001 -13.758 -5.551 1.00 0.00 O ATOM 0 H SER A 502 -5.385 -11.739 -4.156 1.00 0.00 H new ATOM 0 HA SER A 502 -5.566 -13.935 -2.246 1.00 0.00 H new ATOM 0 HB2 SER A 502 -5.431 -15.324 -4.287 1.00 0.00 H new ATOM 0 HB3 SER A 502 -6.689 -14.113 -4.430 1.00 0.00 H new ATOM 0 HG SER A 502 -4.084 -13.475 -5.352 1.00 0.00 H new ATOM 1270 N SER A 503 -3.203 -14.626 -2.020 1.00 0.00 N ATOM 1271 CA SER A 503 -1.803 -14.955 -1.782 1.00 0.00 C ATOM 1272 C SER A 503 -1.571 -16.459 -1.900 1.00 0.00 C ATOM 1273 O SER A 503 -2.436 -17.273 -1.578 1.00 0.00 O ATOM 1274 CB SER A 503 -1.370 -14.469 -0.397 1.00 0.00 C ATOM 1275 OG SER A 503 0.009 -14.147 -0.378 1.00 0.00 O ATOM 0 H SER A 503 -3.857 -15.078 -1.381 1.00 0.00 H new ATOM 0 HA SER A 503 -1.204 -14.451 -2.540 1.00 0.00 H new ATOM 0 HB2 SER A 503 -1.955 -13.593 -0.116 1.00 0.00 H new ATOM 0 HB3 SER A 503 -1.577 -15.241 0.344 1.00 0.00 H new ATOM 0 HG SER A 503 0.260 -13.838 0.517 1.00 0.00 H new ATOM 1281 N PRO A 504 -0.374 -16.837 -2.373 1.00 0.00 N ATOM 1282 CA PRO A 504 0.001 -18.243 -2.545 1.00 0.00 C ATOM 1283 C PRO A 504 -0.350 -19.090 -1.326 1.00 0.00 C ATOM 1284 O PRO A 504 -0.506 -20.307 -1.427 1.00 0.00 O ATOM 1285 CB PRO A 504 1.519 -18.185 -2.736 1.00 0.00 C ATOM 1286 CG PRO A 504 1.775 -16.839 -3.321 1.00 0.00 C ATOM 1287 CD PRO A 504 0.705 -15.920 -2.776 1.00 0.00 C ATOM 0 HA PRO A 504 -0.530 -18.707 -3.376 1.00 0.00 H new ATOM 0 HB2 PRO A 504 2.043 -18.311 -1.788 1.00 0.00 H new ATOM 0 HB3 PRO A 504 1.865 -18.978 -3.399 1.00 0.00 H new ATOM 0 HG2 PRO A 504 2.768 -16.481 -3.049 1.00 0.00 H new ATOM 0 HG3 PRO A 504 1.736 -16.876 -4.410 1.00 0.00 H new ATOM 0 HD2 PRO A 504 1.071 -15.337 -1.931 1.00 0.00 H new ATOM 0 HD3 PRO A 504 0.366 -15.210 -3.530 1.00 0.00 H new ATOM 1295 N THR A 505 -0.475 -18.438 -0.174 1.00 0.00 N ATOM 1296 CA THR A 505 -0.807 -19.131 1.064 1.00 0.00 C ATOM 1297 C THR A 505 -2.199 -18.747 1.552 1.00 0.00 C ATOM 1298 O THR A 505 -3.043 -19.612 1.792 1.00 0.00 O ATOM 1299 CB THR A 505 0.216 -18.822 2.173 1.00 0.00 C ATOM 1300 OG1 THR A 505 0.460 -17.413 2.236 1.00 0.00 O ATOM 1301 CG2 THR A 505 1.525 -19.557 1.922 1.00 0.00 C ATOM 0 H THR A 505 -0.351 -17.431 -0.073 1.00 0.00 H new ATOM 0 HA THR A 505 -0.783 -20.198 0.845 1.00 0.00 H new ATOM 0 HB THR A 505 -0.198 -19.162 3.123 1.00 0.00 H new ATOM 0 HG1 THR A 505 0.686 -17.161 3.156 1.00 0.00 H new ATOM 0 HG21 THR A 505 2.232 -19.323 2.718 1.00 0.00 H new ATOM 0 HG22 THR A 505 1.341 -20.631 1.904 1.00 0.00 H new ATOM 0 HG23 THR A 505 1.940 -19.243 0.964 1.00 0.00 H new ATOM 1309 N ILE A 506 -2.433 -17.447 1.696 1.00 0.00 N ATOM 1310 CA ILE A 506 -3.725 -16.950 2.154 1.00 0.00 C ATOM 1311 C ILE A 506 -4.644 -16.642 0.976 1.00 0.00 C ATOM 1312 O ILE A 506 -4.196 -16.169 -0.068 1.00 0.00 O ATOM 1313 CB ILE A 506 -3.567 -15.682 3.013 1.00 0.00 C ATOM 1314 CG1 ILE A 506 -2.641 -15.955 4.200 1.00 0.00 C ATOM 1315 CG2 ILE A 506 -4.926 -15.197 3.495 1.00 0.00 C ATOM 1316 CD1 ILE A 506 -3.297 -16.750 5.307 1.00 0.00 C ATOM 0 H ILE A 506 -1.745 -16.719 1.502 1.00 0.00 H new ATOM 0 HA ILE A 506 -4.170 -17.738 2.762 1.00 0.00 H new ATOM 0 HB ILE A 506 -3.119 -14.899 2.400 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -1.762 -16.495 3.848 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -2.291 -15.005 4.604 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -4.798 -14.300 4.101 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -5.556 -14.968 2.636 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -5.399 -15.975 4.094 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -2.583 -16.906 6.115 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -4.160 -16.202 5.686 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -3.622 -17.715 4.918 1.00 0.00 H new ATOM 1328 N LYS A 507 -5.933 -16.913 1.153 1.00 0.00 N ATOM 1329 CA LYS A 507 -6.918 -16.662 0.108 1.00 0.00 C ATOM 1330 C LYS A 507 -7.279 -15.182 0.043 1.00 0.00 C ATOM 1331 O LYS A 507 -6.864 -14.395 0.894 1.00 0.00 O ATOM 1332 CB LYS A 507 -8.178 -17.495 0.355 1.00 0.00 C ATOM 1333 CG LYS A 507 -8.125 -18.879 -0.269 1.00 0.00 C ATOM 1334 CD LYS A 507 -8.389 -18.826 -1.764 1.00 0.00 C ATOM 1335 CE LYS A 507 -9.872 -18.668 -2.063 1.00 0.00 C ATOM 1336 NZ LYS A 507 -10.120 -18.385 -3.504 1.00 0.00 N ATOM 0 H LYS A 507 -6.320 -17.307 2.011 1.00 0.00 H new ATOM 0 HA LYS A 507 -6.479 -16.952 -0.846 1.00 0.00 H new ATOM 0 HB2 LYS A 507 -8.332 -17.596 1.429 1.00 0.00 H new ATOM 0 HB3 LYS A 507 -9.041 -16.960 -0.042 1.00 0.00 H new ATOM 0 HG2 LYS A 507 -7.147 -19.324 -0.087 1.00 0.00 H new ATOM 0 HG3 LYS A 507 -8.863 -19.523 0.209 1.00 0.00 H new ATOM 0 HD2 LYS A 507 -7.838 -17.994 -2.203 1.00 0.00 H new ATOM 0 HD3 LYS A 507 -8.017 -19.737 -2.233 1.00 0.00 H new ATOM 0 HE2 LYS A 507 -10.399 -19.578 -1.775 1.00 0.00 H new ATOM 0 HE3 LYS A 507 -10.280 -17.858 -1.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 507 -10.939 -18.937 -3.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 507 -10.313 -17.371 -3.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 507 -9.281 -18.650 -4.059 1.00 0.00 H new ATOM 1350 N ASP A 508 -8.054 -14.810 -0.969 1.00 0.00 N ATOM 1351 CA ASP A 508 -8.473 -13.424 -1.143 1.00 0.00 C ATOM 1352 C ASP A 508 -8.795 -12.781 0.203 1.00 0.00 C ATOM 1353 O ASP A 508 -9.801 -13.107 0.834 1.00 0.00 O ATOM 1354 CB ASP A 508 -9.692 -13.348 -2.063 1.00 0.00 C ATOM 1355 CG ASP A 508 -10.695 -14.452 -1.788 1.00 0.00 C ATOM 1356 OD1 ASP A 508 -10.464 -15.590 -2.247 1.00 0.00 O ATOM 1357 OD2 ASP A 508 -11.710 -14.177 -1.114 1.00 0.00 O ATOM 0 H ASP A 508 -8.405 -15.449 -1.682 1.00 0.00 H new ATOM 0 HA ASP A 508 -7.649 -12.876 -1.600 1.00 0.00 H new ATOM 0 HB2 ASP A 508 -10.178 -12.380 -1.938 1.00 0.00 H new ATOM 0 HB3 ASP A 508 -9.365 -13.409 -3.101 1.00 0.00 H new ATOM 1362 N LYS A 509 -7.935 -11.867 0.637 1.00 0.00 N ATOM 1363 CA LYS A 509 -8.127 -11.177 1.908 1.00 0.00 C ATOM 1364 C LYS A 509 -8.583 -9.739 1.683 1.00 0.00 C ATOM 1365 O LYS A 509 -7.987 -8.987 0.912 1.00 0.00 O ATOM 1366 CB LYS A 509 -6.830 -11.191 2.720 1.00 0.00 C ATOM 1367 CG LYS A 509 -7.034 -10.900 4.197 1.00 0.00 C ATOM 1368 CD LYS A 509 -7.379 -12.161 4.971 1.00 0.00 C ATOM 1369 CE LYS A 509 -7.078 -12.004 6.454 1.00 0.00 C ATOM 1370 NZ LYS A 509 -6.714 -13.302 7.086 1.00 0.00 N ATOM 0 H LYS A 509 -7.097 -11.586 0.127 1.00 0.00 H new ATOM 0 HA LYS A 509 -8.903 -11.702 2.465 1.00 0.00 H new ATOM 0 HB2 LYS A 509 -6.354 -12.166 2.613 1.00 0.00 H new ATOM 0 HB3 LYS A 509 -6.143 -10.454 2.304 1.00 0.00 H new ATOM 0 HG2 LYS A 509 -6.129 -10.455 4.610 1.00 0.00 H new ATOM 0 HG3 LYS A 509 -7.833 -10.168 4.318 1.00 0.00 H new ATOM 0 HD2 LYS A 509 -8.435 -12.395 4.836 1.00 0.00 H new ATOM 0 HD3 LYS A 509 -6.812 -13.002 4.571 1.00 0.00 H new ATOM 0 HE2 LYS A 509 -6.261 -11.294 6.586 1.00 0.00 H new ATOM 0 HE3 LYS A 509 -7.949 -11.586 6.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 509 -6.516 -13.153 8.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 509 -7.503 -13.972 6.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 509 -5.868 -13.689 6.621 1.00 0.00 H new ATOM 1384 N PRO A 510 -9.664 -9.346 2.372 1.00 0.00 N ATOM 1385 CA PRO A 510 -10.223 -7.995 2.266 1.00 0.00 C ATOM 1386 C PRO A 510 -9.423 -6.972 3.065 1.00 0.00 C ATOM 1387 O PRO A 510 -9.761 -6.659 4.207 1.00 0.00 O ATOM 1388 CB PRO A 510 -11.630 -8.146 2.848 1.00 0.00 C ATOM 1389 CG PRO A 510 -11.523 -9.278 3.811 1.00 0.00 C ATOM 1390 CD PRO A 510 -10.425 -10.190 3.310 1.00 0.00 C ATOM 0 HA PRO A 510 -10.209 -7.628 1.240 1.00 0.00 H new ATOM 0 HB2 PRO A 510 -11.952 -7.232 3.346 1.00 0.00 H new ATOM 0 HB3 PRO A 510 -12.361 -8.358 2.067 1.00 0.00 H new ATOM 0 HG2 PRO A 510 -11.292 -8.912 4.811 1.00 0.00 H new ATOM 0 HG3 PRO A 510 -12.469 -9.816 3.879 1.00 0.00 H new ATOM 0 HD2 PRO A 510 -9.797 -10.546 4.127 1.00 0.00 H new ATOM 0 HD3 PRO A 510 -10.833 -11.071 2.814 1.00 0.00 H new ATOM 1398 N VAL A 511 -8.360 -6.454 2.458 1.00 0.00 N ATOM 1399 CA VAL A 511 -7.512 -5.465 3.113 1.00 0.00 C ATOM 1400 C VAL A 511 -8.151 -4.081 3.073 1.00 0.00 C ATOM 1401 O VAL A 511 -8.754 -3.694 2.073 1.00 0.00 O ATOM 1402 CB VAL A 511 -6.121 -5.395 2.456 1.00 0.00 C ATOM 1403 CG1 VAL A 511 -5.358 -6.692 2.681 1.00 0.00 C ATOM 1404 CG2 VAL A 511 -6.248 -5.092 0.971 1.00 0.00 C ATOM 0 H VAL A 511 -8.066 -6.703 1.514 1.00 0.00 H new ATOM 0 HA VAL A 511 -7.400 -5.781 4.150 1.00 0.00 H new ATOM 0 HB VAL A 511 -5.559 -4.586 2.922 1.00 0.00 H new ATOM 0 HG11 VAL A 511 -4.378 -6.624 2.210 1.00 0.00 H new ATOM 0 HG12 VAL A 511 -5.235 -6.861 3.751 1.00 0.00 H new ATOM 0 HG13 VAL A 511 -5.914 -7.522 2.244 1.00 0.00 H new ATOM 0 HG21 VAL A 511 -5.255 -5.046 0.523 1.00 0.00 H new ATOM 0 HG22 VAL A 511 -6.828 -5.878 0.488 1.00 0.00 H new ATOM 0 HG23 VAL A 511 -6.751 -4.134 0.837 1.00 0.00 H new ATOM 1414 N GLN A 512 -8.013 -3.341 4.168 1.00 0.00 N ATOM 1415 CA GLN A 512 -8.578 -1.999 4.258 1.00 0.00 C ATOM 1416 C GLN A 512 -7.689 -0.986 3.544 1.00 0.00 C ATOM 1417 O GLN A 512 -6.575 -0.703 3.986 1.00 0.00 O ATOM 1418 CB GLN A 512 -8.757 -1.596 5.723 1.00 0.00 C ATOM 1419 CG GLN A 512 -9.743 -0.456 5.924 1.00 0.00 C ATOM 1420 CD GLN A 512 -9.628 0.180 7.295 1.00 0.00 C ATOM 1421 OE1 GLN A 512 -8.943 1.188 7.469 1.00 0.00 O ATOM 1422 NE2 GLN A 512 -10.301 -0.407 8.278 1.00 0.00 N ATOM 0 H GLN A 512 -7.516 -3.647 5.004 1.00 0.00 H new ATOM 0 HA GLN A 512 -9.552 -2.008 3.769 1.00 0.00 H new ATOM 0 HB2 GLN A 512 -9.096 -2.463 6.291 1.00 0.00 H new ATOM 0 HB3 GLN A 512 -7.789 -1.305 6.132 1.00 0.00 H new ATOM 0 HG2 GLN A 512 -9.575 0.303 5.160 1.00 0.00 H new ATOM 0 HG3 GLN A 512 -10.758 -0.829 5.785 1.00 0.00 H new ATOM 0 HE21 GLN A 512 -10.856 -1.241 8.089 1.00 0.00 H new ATOM 0 HE22 GLN A 512 -10.262 -0.024 9.222 1.00 0.00 H new ATOM 1431 N ILE A 513 -8.189 -0.443 2.439 1.00 0.00 N ATOM 1432 CA ILE A 513 -7.440 0.539 1.665 1.00 0.00 C ATOM 1433 C ILE A 513 -7.919 1.956 1.965 1.00 0.00 C ATOM 1434 O ILE A 513 -9.058 2.314 1.665 1.00 0.00 O ATOM 1435 CB ILE A 513 -7.564 0.277 0.153 1.00 0.00 C ATOM 1436 CG1 ILE A 513 -7.122 -1.150 -0.177 1.00 0.00 C ATOM 1437 CG2 ILE A 513 -6.738 1.287 -0.629 1.00 0.00 C ATOM 1438 CD1 ILE A 513 -5.628 -1.360 -0.071 1.00 0.00 C ATOM 0 H ILE A 513 -9.109 -0.666 2.060 1.00 0.00 H new ATOM 0 HA ILE A 513 -6.395 0.441 1.958 1.00 0.00 H new ATOM 0 HB ILE A 513 -8.609 0.390 -0.136 1.00 0.00 H new ATOM 0 HG12 ILE A 513 -7.627 -1.843 0.496 1.00 0.00 H new ATOM 0 HG13 ILE A 513 -7.444 -1.397 -1.189 1.00 0.00 H new ATOM 0 HG21 ILE A 513 -6.836 1.089 -1.696 1.00 0.00 H new ATOM 0 HG22 ILE A 513 -7.095 2.294 -0.413 1.00 0.00 H new ATOM 0 HG23 ILE A 513 -5.691 1.203 -0.339 1.00 0.00 H new ATOM 0 HD11 ILE A 513 -5.387 -2.394 -0.319 1.00 0.00 H new ATOM 0 HD12 ILE A 513 -5.117 -0.692 -0.764 1.00 0.00 H new ATOM 0 HD13 ILE A 513 -5.302 -1.145 0.947 1.00 0.00 H new ATOM 1450 N ARG A 514 -7.041 2.759 2.557 1.00 0.00 N ATOM 1451 CA ARG A 514 -7.373 4.137 2.896 1.00 0.00 C ATOM 1452 C ARG A 514 -6.434 5.112 2.193 1.00 0.00 C ATOM 1453 O ARG A 514 -5.376 5.474 2.707 1.00 0.00 O ATOM 1454 CB ARG A 514 -7.299 4.344 4.410 1.00 0.00 C ATOM 1455 CG ARG A 514 -8.158 3.370 5.201 1.00 0.00 C ATOM 1456 CD ARG A 514 -9.566 3.907 5.403 1.00 0.00 C ATOM 1457 NE ARG A 514 -9.591 5.052 6.308 1.00 0.00 N ATOM 1458 CZ ARG A 514 -9.634 4.943 7.631 1.00 0.00 C ATOM 1459 NH1 ARG A 514 -9.656 3.745 8.200 1.00 0.00 N ATOM 1460 NH2 ARG A 514 -9.654 6.032 8.388 1.00 0.00 N ATOM 0 H ARG A 514 -6.094 2.479 2.812 1.00 0.00 H new ATOM 0 HA ARG A 514 -8.391 4.332 2.558 1.00 0.00 H new ATOM 0 HB2 ARG A 514 -6.262 4.245 4.731 1.00 0.00 H new ATOM 0 HB3 ARG A 514 -7.609 5.362 4.645 1.00 0.00 H new ATOM 0 HG2 ARG A 514 -8.203 2.415 4.678 1.00 0.00 H new ATOM 0 HG3 ARG A 514 -7.697 3.181 6.170 1.00 0.00 H new ATOM 0 HD2 ARG A 514 -9.985 4.198 4.439 1.00 0.00 H new ATOM 0 HD3 ARG A 514 -10.202 3.116 5.801 1.00 0.00 H new ATOM 0 HE ARG A 514 -9.575 5.988 5.902 1.00 0.00 H new ATOM 0 HH11 ARG A 514 -9.640 2.905 7.621 1.00 0.00 H new ATOM 0 HH12 ARG A 514 -9.689 3.664 9.216 1.00 0.00 H new ATOM 0 HH21 ARG A 514 -9.636 6.955 7.954 1.00 0.00 H new ATOM 0 HH22 ARG A 514 -9.687 5.946 9.404 1.00 0.00 H new ATOM 1474 N PRO A 515 -6.828 5.547 0.987 1.00 0.00 N ATOM 1475 CA PRO A 515 -6.036 6.486 0.186 1.00 0.00 C ATOM 1476 C PRO A 515 -5.557 7.682 1.002 1.00 0.00 C ATOM 1477 O PRO A 515 -6.347 8.553 1.366 1.00 0.00 O ATOM 1478 CB PRO A 515 -7.013 6.937 -0.902 1.00 0.00 C ATOM 1479 CG PRO A 515 -7.963 5.800 -1.053 1.00 0.00 C ATOM 1480 CD PRO A 515 -8.077 5.157 0.312 1.00 0.00 C ATOM 0 HA PRO A 515 -5.128 6.025 -0.203 1.00 0.00 H new ATOM 0 HB2 PRO A 515 -7.532 7.851 -0.614 1.00 0.00 H new ATOM 0 HB3 PRO A 515 -6.494 7.147 -1.838 1.00 0.00 H new ATOM 0 HG2 PRO A 515 -8.935 6.149 -1.401 1.00 0.00 H new ATOM 0 HG3 PRO A 515 -7.599 5.085 -1.791 1.00 0.00 H new ATOM 0 HD2 PRO A 515 -8.953 5.516 0.852 1.00 0.00 H new ATOM 0 HD3 PRO A 515 -8.171 4.074 0.238 1.00 0.00 H new ATOM 1488 N TRP A 516 -4.259 7.718 1.284 1.00 0.00 N ATOM 1489 CA TRP A 516 -3.676 8.809 2.056 1.00 0.00 C ATOM 1490 C TRP A 516 -4.122 10.162 1.511 1.00 0.00 C ATOM 1491 O TRP A 516 -3.842 10.501 0.362 1.00 0.00 O ATOM 1492 CB TRP A 516 -2.149 8.716 2.036 1.00 0.00 C ATOM 1493 CG TRP A 516 -1.492 9.496 3.134 1.00 0.00 C ATOM 1494 CD1 TRP A 516 -0.487 10.412 3.000 1.00 0.00 C ATOM 1495 CD2 TRP A 516 -1.792 9.429 4.532 1.00 0.00 C ATOM 1496 NE1 TRP A 516 -0.145 10.917 4.231 1.00 0.00 N ATOM 1497 CE2 TRP A 516 -0.931 10.330 5.187 1.00 0.00 C ATOM 1498 CE3 TRP A 516 -2.706 8.696 5.294 1.00 0.00 C ATOM 1499 CZ2 TRP A 516 -0.958 10.516 6.567 1.00 0.00 C ATOM 1500 CZ3 TRP A 516 -2.731 8.881 6.663 1.00 0.00 C ATOM 1501 CH2 TRP A 516 -1.863 9.785 7.288 1.00 0.00 C ATOM 0 H TRP A 516 -3.591 7.005 0.990 1.00 0.00 H new ATOM 0 HA TRP A 516 -4.026 8.720 3.085 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -1.855 7.670 2.117 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -1.783 9.076 1.075 1.00 0.00 H new ATOM 0 HD1 TRP A 516 -0.029 10.697 2.064 1.00 0.00 H new ATOM 0 HE1 TRP A 516 0.577 11.616 4.405 1.00 0.00 H new ATOM 0 HE3 TRP A 516 -3.381 7.998 4.821 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 -0.289 11.212 7.051 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 -3.432 8.319 7.262 1.00 0.00 H new ATOM 0 HH2 TRP A 516 -1.909 9.908 8.360 1.00 0.00 H new ATOM 1512 N ASN A 517 -4.817 10.930 2.343 1.00 0.00 N ATOM 1513 CA ASN A 517 -5.302 12.246 1.944 1.00 0.00 C ATOM 1514 C ASN A 517 -4.649 13.343 2.779 1.00 0.00 C ATOM 1515 O ASN A 517 -5.259 13.880 3.705 1.00 0.00 O ATOM 1516 CB ASN A 517 -6.824 12.317 2.087 1.00 0.00 C ATOM 1517 CG ASN A 517 -7.423 13.480 1.320 1.00 0.00 C ATOM 1518 OD1 ASN A 517 -7.303 13.559 0.097 1.00 0.00 O ATOM 1519 ND2 ASN A 517 -8.073 14.389 2.037 1.00 0.00 N ATOM 0 H ASN A 517 -5.057 10.664 3.298 1.00 0.00 H new ATOM 0 HA ASN A 517 -5.035 12.403 0.899 1.00 0.00 H new ATOM 0 HB2 ASN A 517 -7.264 11.385 1.731 1.00 0.00 H new ATOM 0 HB3 ASN A 517 -7.083 12.409 3.142 1.00 0.00 H new ATOM 0 HD21 ASN A 517 -8.498 15.194 1.576 1.00 0.00 H new ATOM 0 HD22 ASN A 517 -8.147 14.283 3.049 1.00 0.00 H new ATOM 1526 N LEU A 518 -3.406 13.673 2.446 1.00 0.00 N ATOM 1527 CA LEU A 518 -2.670 14.707 3.164 1.00 0.00 C ATOM 1528 C LEU A 518 -1.574 15.304 2.288 1.00 0.00 C ATOM 1529 O LEU A 518 -0.658 14.603 1.858 1.00 0.00 O ATOM 1530 CB LEU A 518 -2.059 14.130 4.443 1.00 0.00 C ATOM 1531 CG LEU A 518 -0.966 14.972 5.103 1.00 0.00 C ATOM 1532 CD1 LEU A 518 -1.580 16.056 5.975 1.00 0.00 C ATOM 1533 CD2 LEU A 518 -0.035 14.090 5.922 1.00 0.00 C ATOM 0 H LEU A 518 -2.887 13.239 1.683 1.00 0.00 H new ATOM 0 HA LEU A 518 -3.370 15.500 3.428 1.00 0.00 H new ATOM 0 HB2 LEU A 518 -2.859 13.977 5.167 1.00 0.00 H new ATOM 0 HB3 LEU A 518 -1.645 13.148 4.213 1.00 0.00 H new ATOM 0 HG LEU A 518 -0.382 15.453 4.319 1.00 0.00 H new ATOM 0 HD11 LEU A 518 -0.787 16.645 6.436 1.00 0.00 H new ATOM 0 HD12 LEU A 518 -2.205 16.706 5.362 1.00 0.00 H new ATOM 0 HD13 LEU A 518 -2.189 15.596 6.753 1.00 0.00 H new ATOM 0 HD21 LEU A 518 0.736 14.706 6.384 1.00 0.00 H new ATOM 0 HD22 LEU A 518 -0.606 13.580 6.698 1.00 0.00 H new ATOM 0 HD23 LEU A 518 0.432 13.351 5.271 1.00 0.00 H new ATOM 1545 N SER A 519 -1.674 16.604 2.027 1.00 0.00 N ATOM 1546 CA SER A 519 -0.692 17.295 1.200 1.00 0.00 C ATOM 1547 C SER A 519 -0.130 18.513 1.928 1.00 0.00 C ATOM 1548 O SER A 519 -0.797 19.106 2.775 1.00 0.00 O ATOM 1549 CB SER A 519 -1.323 17.725 -0.125 1.00 0.00 C ATOM 1550 OG SER A 519 -0.353 18.286 -0.993 1.00 0.00 O ATOM 0 H SER A 519 -2.425 17.199 2.376 1.00 0.00 H new ATOM 0 HA SER A 519 0.127 16.605 0.997 1.00 0.00 H new ATOM 0 HB2 SER A 519 -1.791 16.865 -0.605 1.00 0.00 H new ATOM 0 HB3 SER A 519 -2.112 18.453 0.064 1.00 0.00 H new ATOM 0 HG SER A 519 -0.781 18.551 -1.834 1.00 0.00 H new ATOM 1556 N ASP A 520 1.102 18.879 1.591 1.00 0.00 N ATOM 1557 CA ASP A 520 1.755 20.026 2.210 1.00 0.00 C ATOM 1558 C ASP A 520 1.685 21.248 1.300 1.00 0.00 C ATOM 1559 O ASP A 520 1.331 22.342 1.739 1.00 0.00 O ATOM 1560 CB ASP A 520 3.214 19.697 2.532 1.00 0.00 C ATOM 1561 CG ASP A 520 3.376 19.066 3.901 1.00 0.00 C ATOM 1562 OD1 ASP A 520 3.346 19.810 4.904 1.00 0.00 O ATOM 1563 OD2 ASP A 520 3.534 17.829 3.970 1.00 0.00 O ATOM 0 H ASP A 520 1.668 18.398 0.892 1.00 0.00 H new ATOM 0 HA ASP A 520 1.229 20.255 3.137 1.00 0.00 H new ATOM 0 HB2 ASP A 520 3.607 19.019 1.774 1.00 0.00 H new ATOM 0 HB3 ASP A 520 3.809 20.609 2.483 1.00 0.00 H new ATOM 1568 N SER A 521 2.027 21.054 0.030 1.00 0.00 N ATOM 1569 CA SER A 521 2.008 22.141 -0.941 1.00 0.00 C ATOM 1570 C SER A 521 0.711 22.939 -0.839 1.00 0.00 C ATOM 1571 O SER A 521 -0.346 22.389 -0.530 1.00 0.00 O ATOM 1572 CB SER A 521 2.170 21.590 -2.359 1.00 0.00 C ATOM 1573 OG SER A 521 2.103 22.628 -3.321 1.00 0.00 O ATOM 0 H SER A 521 2.320 20.154 -0.350 1.00 0.00 H new ATOM 0 HA SER A 521 2.842 22.807 -0.720 1.00 0.00 H new ATOM 0 HB2 SER A 521 3.125 21.072 -2.444 1.00 0.00 H new ATOM 0 HB3 SER A 521 1.390 20.855 -2.558 1.00 0.00 H new ATOM 0 HG SER A 521 2.211 22.250 -4.219 1.00 0.00 H new ATOM 1579 N ASP A 522 0.801 24.238 -1.101 1.00 0.00 N ATOM 1580 CA ASP A 522 -0.364 25.113 -1.039 1.00 0.00 C ATOM 1581 C ASP A 522 -0.697 25.672 -2.419 1.00 0.00 C ATOM 1582 O ASP A 522 -0.054 26.608 -2.893 1.00 0.00 O ATOM 1583 CB ASP A 522 -0.117 26.259 -0.057 1.00 0.00 C ATOM 1584 CG ASP A 522 1.227 26.927 -0.273 1.00 0.00 C ATOM 1585 OD1 ASP A 522 2.261 26.248 -0.101 1.00 0.00 O ATOM 1586 OD2 ASP A 522 1.245 28.128 -0.614 1.00 0.00 O ATOM 0 H ASP A 522 1.669 24.709 -1.358 1.00 0.00 H new ATOM 0 HA ASP A 522 -1.212 24.524 -0.691 1.00 0.00 H new ATOM 0 HB2 ASP A 522 -0.909 27.000 -0.162 1.00 0.00 H new ATOM 0 HB3 ASP A 522 -0.170 25.878 0.963 1.00 0.00 H new ATOM 1591 N PHE A 523 -1.706 25.090 -3.059 1.00 0.00 N ATOM 1592 CA PHE A 523 -2.124 25.529 -4.386 1.00 0.00 C ATOM 1593 C PHE A 523 -2.119 27.052 -4.482 1.00 0.00 C ATOM 1594 O PHE A 523 -2.754 27.738 -3.681 1.00 0.00 O ATOM 1595 CB PHE A 523 -3.519 24.991 -4.708 1.00 0.00 C ATOM 1596 CG PHE A 523 -3.685 23.530 -4.399 1.00 0.00 C ATOM 1597 CD1 PHE A 523 -2.932 22.577 -5.065 1.00 0.00 C ATOM 1598 CD2 PHE A 523 -4.594 23.111 -3.441 1.00 0.00 C ATOM 1599 CE1 PHE A 523 -3.081 21.233 -4.782 1.00 0.00 C ATOM 1600 CE2 PHE A 523 -4.748 21.767 -3.154 1.00 0.00 C ATOM 1601 CZ PHE A 523 -3.992 20.827 -3.826 1.00 0.00 C ATOM 0 H PHE A 523 -2.249 24.314 -2.681 1.00 0.00 H new ATOM 0 HA PHE A 523 -1.413 25.135 -5.112 1.00 0.00 H new ATOM 0 HB2 PHE A 523 -4.258 25.560 -4.144 1.00 0.00 H new ATOM 0 HB3 PHE A 523 -3.728 25.157 -5.765 1.00 0.00 H new ATOM 0 HD1 PHE A 523 -2.220 22.888 -5.815 1.00 0.00 H new ATOM 0 HD2 PHE A 523 -5.189 23.842 -2.913 1.00 0.00 H new ATOM 0 HE1 PHE A 523 -2.486 20.501 -5.307 1.00 0.00 H new ATOM 0 HE2 PHE A 523 -5.459 21.453 -2.405 1.00 0.00 H new ATOM 0 HZ PHE A 523 -4.113 19.777 -3.605 1.00 0.00 H new ATOM 1611 N VAL A 524 -1.397 27.574 -5.468 1.00 0.00 N ATOM 1612 CA VAL A 524 -1.309 29.015 -5.671 1.00 0.00 C ATOM 1613 C VAL A 524 -1.123 29.353 -7.146 1.00 0.00 C ATOM 1614 O VAL A 524 -0.352 28.701 -7.850 1.00 0.00 O ATOM 1615 CB VAL A 524 -0.146 29.625 -4.865 1.00 0.00 C ATOM 1616 CG1 VAL A 524 1.182 29.033 -5.313 1.00 0.00 C ATOM 1617 CG2 VAL A 524 -0.138 31.140 -5.005 1.00 0.00 C ATOM 0 H VAL A 524 -0.864 27.020 -6.139 1.00 0.00 H new ATOM 0 HA VAL A 524 -2.249 29.442 -5.320 1.00 0.00 H new ATOM 0 HB VAL A 524 -0.289 29.381 -3.812 1.00 0.00 H new ATOM 0 HG11 VAL A 524 1.992 29.476 -4.733 1.00 0.00 H new ATOM 0 HG12 VAL A 524 1.171 27.954 -5.156 1.00 0.00 H new ATOM 0 HG13 VAL A 524 1.336 29.244 -6.371 1.00 0.00 H new ATOM 0 HG21 VAL A 524 0.690 31.554 -4.429 1.00 0.00 H new ATOM 0 HG22 VAL A 524 -0.020 31.408 -6.055 1.00 0.00 H new ATOM 0 HG23 VAL A 524 -1.078 31.545 -4.631 1.00 0.00 H new ATOM 1627 N MET A 525 -1.834 30.376 -7.607 1.00 0.00 N ATOM 1628 CA MET A 525 -1.747 30.802 -8.999 1.00 0.00 C ATOM 1629 C MET A 525 -0.320 31.209 -9.354 1.00 0.00 C ATOM 1630 O MET A 525 0.331 31.939 -8.607 1.00 0.00 O ATOM 1631 CB MET A 525 -2.702 31.968 -9.259 1.00 0.00 C ATOM 1632 CG MET A 525 -2.754 32.397 -10.717 1.00 0.00 C ATOM 1633 SD MET A 525 -1.329 33.389 -11.201 1.00 0.00 S ATOM 1634 CE MET A 525 -1.879 34.024 -12.782 1.00 0.00 C ATOM 0 H MET A 525 -2.477 30.926 -7.037 1.00 0.00 H new ATOM 0 HA MET A 525 -2.034 29.960 -9.629 1.00 0.00 H new ATOM 0 HB2 MET A 525 -3.704 31.685 -8.936 1.00 0.00 H new ATOM 0 HB3 MET A 525 -2.398 32.819 -8.649 1.00 0.00 H new ATOM 0 HG2 MET A 525 -2.807 31.512 -11.350 1.00 0.00 H new ATOM 0 HG3 MET A 525 -3.666 32.969 -10.891 1.00 0.00 H new ATOM 0 HE1 MET A 525 -1.103 34.659 -13.209 1.00 0.00 H new ATOM 0 HE2 MET A 525 -2.081 33.193 -13.458 1.00 0.00 H new ATOM 0 HE3 MET A 525 -2.789 34.608 -12.643 1.00 0.00 H new ATOM 1644 N ASP A 526 0.159 30.732 -10.498 1.00 0.00 N ATOM 1645 CA ASP A 526 1.509 31.047 -10.952 1.00 0.00 C ATOM 1646 C ASP A 526 1.508 31.437 -12.427 1.00 0.00 C ATOM 1647 O ASP A 526 2.138 32.419 -12.819 1.00 0.00 O ATOM 1648 CB ASP A 526 2.437 29.853 -10.727 1.00 0.00 C ATOM 1649 CG ASP A 526 2.132 29.116 -9.438 1.00 0.00 C ATOM 1650 OD1 ASP A 526 1.854 29.788 -8.423 1.00 0.00 O ATOM 1651 OD2 ASP A 526 2.170 27.868 -9.444 1.00 0.00 O ATOM 0 H ASP A 526 -0.367 30.126 -11.128 1.00 0.00 H new ATOM 0 HA ASP A 526 1.874 31.894 -10.371 1.00 0.00 H new ATOM 0 HB2 ASP A 526 2.347 29.163 -11.566 1.00 0.00 H new ATOM 0 HB3 ASP A 526 3.471 30.199 -10.708 1.00 0.00 H new ATOM 1656 N SER A 527 0.799 30.660 -13.239 1.00 0.00 N ATOM 1657 CA SER A 527 0.720 30.921 -14.671 1.00 0.00 C ATOM 1658 C SER A 527 -0.313 30.015 -15.333 1.00 0.00 C ATOM 1659 O SER A 527 -0.099 28.812 -15.476 1.00 0.00 O ATOM 1660 CB SER A 527 2.089 30.716 -15.324 1.00 0.00 C ATOM 1661 OG SER A 527 2.540 29.383 -15.153 1.00 0.00 O ATOM 0 H SER A 527 0.271 29.844 -12.929 1.00 0.00 H new ATOM 0 HA SER A 527 0.410 31.957 -14.810 1.00 0.00 H new ATOM 0 HB2 SER A 527 2.027 30.949 -16.387 1.00 0.00 H new ATOM 0 HB3 SER A 527 2.811 31.406 -14.888 1.00 0.00 H new ATOM 0 HG SER A 527 1.771 28.776 -15.144 1.00 0.00 H new ATOM 1667 N GLY A 528 -1.435 30.603 -15.736 1.00 0.00 N ATOM 1668 CA GLY A 528 -2.486 29.835 -16.378 1.00 0.00 C ATOM 1669 C GLY A 528 -2.626 30.162 -17.851 1.00 0.00 C ATOM 1670 O GLY A 528 -3.300 31.119 -18.235 1.00 0.00 O ATOM 0 H GLY A 528 -1.635 31.597 -15.629 1.00 0.00 H new ATOM 0 HA2 GLY A 528 -2.276 28.772 -16.263 1.00 0.00 H new ATOM 0 HA3 GLY A 528 -3.433 30.029 -15.874 1.00 0.00 H new ATOM 1674 N PRO A 529 -1.978 29.356 -18.705 1.00 0.00 N ATOM 1675 CA PRO A 529 -2.017 29.546 -20.158 1.00 0.00 C ATOM 1676 C PRO A 529 -3.349 29.116 -20.763 1.00 0.00 C ATOM 1677 O PRO A 529 -4.165 28.476 -20.100 1.00 0.00 O ATOM 1678 CB PRO A 529 -0.885 28.649 -20.664 1.00 0.00 C ATOM 1679 CG PRO A 529 -0.767 27.574 -19.639 1.00 0.00 C ATOM 1680 CD PRO A 529 -1.156 28.197 -18.318 1.00 0.00 C ATOM 0 HA PRO A 529 -1.904 30.594 -20.435 1.00 0.00 H new ATOM 0 HB2 PRO A 529 -1.116 28.236 -21.646 1.00 0.00 H new ATOM 0 HB3 PRO A 529 0.047 29.206 -20.763 1.00 0.00 H new ATOM 0 HG2 PRO A 529 -1.420 26.735 -19.880 1.00 0.00 H new ATOM 0 HG3 PRO A 529 0.250 27.185 -19.600 1.00 0.00 H new ATOM 0 HD2 PRO A 529 -1.716 27.499 -17.696 1.00 0.00 H new ATOM 0 HD3 PRO A 529 -0.280 28.501 -17.746 1.00 0.00 H new ATOM 1688 N SER A 530 -3.562 29.470 -22.026 1.00 0.00 N ATOM 1689 CA SER A 530 -4.796 29.123 -22.720 1.00 0.00 C ATOM 1690 C SER A 530 -4.711 29.491 -24.198 1.00 0.00 C ATOM 1691 O SER A 530 -4.057 30.465 -24.570 1.00 0.00 O ATOM 1692 CB SER A 530 -5.987 29.835 -22.074 1.00 0.00 C ATOM 1693 OG SER A 530 -7.175 29.076 -22.218 1.00 0.00 O ATOM 0 H SER A 530 -2.895 29.997 -22.590 1.00 0.00 H new ATOM 0 HA SER A 530 -4.938 28.045 -22.639 1.00 0.00 H new ATOM 0 HB2 SER A 530 -5.785 30.002 -21.016 1.00 0.00 H new ATOM 0 HB3 SER A 530 -6.120 30.815 -22.532 1.00 0.00 H new ATOM 0 HG SER A 530 -7.920 29.552 -21.796 1.00 0.00 H new ATOM 1699 N SER A 531 -5.377 28.703 -25.037 1.00 0.00 N ATOM 1700 CA SER A 531 -5.374 28.942 -26.475 1.00 0.00 C ATOM 1701 C SER A 531 -6.662 29.632 -26.914 1.00 0.00 C ATOM 1702 O SER A 531 -7.726 29.411 -26.336 1.00 0.00 O ATOM 1703 CB SER A 531 -5.205 27.624 -27.232 1.00 0.00 C ATOM 1704 OG SER A 531 -6.322 26.774 -27.033 1.00 0.00 O ATOM 0 H SER A 531 -5.925 27.894 -24.745 1.00 0.00 H new ATOM 0 HA SER A 531 -4.534 29.597 -26.708 1.00 0.00 H new ATOM 0 HB2 SER A 531 -5.083 27.825 -28.296 1.00 0.00 H new ATOM 0 HB3 SER A 531 -4.298 27.122 -26.896 1.00 0.00 H new ATOM 0 HG SER A 531 -6.190 25.939 -27.529 1.00 0.00 H new ATOM 1710 N GLY A 532 -6.558 30.470 -27.941 1.00 0.00 N ATOM 1711 CA GLY A 532 -7.720 31.180 -28.441 1.00 0.00 C ATOM 1712 C GLY A 532 -7.537 32.685 -28.411 1.00 0.00 C ATOM 1713 O GLY A 532 -6.428 33.186 -28.597 1.00 0.00 O ATOM 0 H GLY A 532 -5.689 30.670 -28.436 1.00 0.00 H new ATOM 0 HA2 GLY A 532 -7.924 30.862 -29.463 1.00 0.00 H new ATOM 0 HA3 GLY A 532 -8.591 30.911 -27.844 1.00 0.00 H new TER 1717 GLY A 532