USER MOD reduce.3.24.130724 H: found=0, std=0, add=950, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 956 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: B 547 SER OG : rot -39:sc= 1.22 USER MOD Set 1.2: B 548 GLN : amide:sc= -0.0958 X(o=1.1,f=1.1) USER MOD Single : A 589 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 592 HIS : no HD1:sc= 0 X(o=0,f=-0.0034) USER MOD Single : A 594 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 596 THR OG1 : rot -130:sc= -0.25 USER MOD Single : A 597 GLN : amide:sc= -1.5! K(o=-1.5!,f=0) USER MOD Single : A 601 SER OG : rot -42:sc= 1.24 USER MOD Single : A 602 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 605 HIS : no HD1:sc= -1.16 K(o=-1.2,f=0.3) USER MOD Single : A 606 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 609 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 614 THR OG1 : rot 41:sc= 0.443 USER MOD Single : A 621 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 625 MET CE :methyl -160:sc= -0.0511 (180deg=-0.528) USER MOD Single : A 627 ASN : amide:sc= -0.0115 K(o=-0.011,f=-1.2!) USER MOD Single : A 631 TYR OH : rot 180:sc= 0 USER MOD Single : A 633 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 634 LYS NZ :NH3+ 148:sc= 0.894 (180deg=0.244) USER MOD Single : A 639 MET CE :methyl 144:sc= -1.97 (180deg=-6.52!) USER MOD Single : A 640 TYR OH : rot 180:sc= 0 USER MOD Single : A 642 SER OG : rot 87:sc= 0.299 USER MOD Single : A 644 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 645 SER OG : rot 180:sc= -0.198 USER MOD Single : A 649 TYR OH : rot -124:sc= 0.933 USER MOD Single : A 650 TYR OH : rot 180:sc= 0 USER MOD Single : A 651 HIS : no HE2:sc= 1.22 K(o=1.2,f=-3.8!) USER MOD Single : A 656 LYS NZ :NH3+ -162:sc= 0.0201 (180deg=0.00309) USER MOD Single : A 658 TYR OH : rot 180:sc= 0 USER MOD Single : A 659 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 661 GLN : amide:sc= -0.061 K(o=-0.061,f=-1.4) USER MOD Single : A 662 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 667 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 670 SER OG : rot 170:sc= -0.302 USER MOD Single : B 520 SER OG : rot 180:sc= 0 USER MOD Single : B 523 TYR OH : rot 180:sc= 0 USER MOD Single : B 525 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 529 SER OG : rot 180:sc= -0.452 USER MOD Single : B 535 SER OG : rot -72:sc= 0.571 USER MOD Single : B 536 SER OG : rot -22:sc= 0.124 USER MOD Single : B 540 MET CE :methyl -174:sc= 0 (180deg=-0.0251) USER MOD Single : B 543 SER OG : rot 180:sc= 0 USER MOD Single : B 550 SER OG : rot -81:sc= 0.639 USER MOD Single : B 551 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 586 29.057 -3.742 -9.456 1.00 25.00 N ATOM 2 CA GLY A 586 28.056 -4.157 -8.435 1.00 25.00 C ATOM 3 C GLY A 586 28.410 -3.672 -7.043 1.00 25.00 C ATOM 4 O GLY A 586 29.528 -3.895 -6.568 1.00 25.00 O ATOM 0 HA2 GLY A 586 27.076 -3.769 -8.713 1.00 25.00 H new ATOM 0 HA3 GLY A 586 27.978 -5.244 -8.428 1.00 25.00 H new ATOM 10 N VAL A 587 27.448 -3.006 -6.390 1.00 25.00 N ATOM 11 CA VAL A 587 27.637 -2.478 -5.029 1.00 25.00 C ATOM 12 C VAL A 587 27.209 -3.533 -3.993 1.00 25.00 C ATOM 13 O VAL A 587 26.238 -4.265 -4.206 1.00 25.00 O ATOM 14 CB VAL A 587 26.843 -1.149 -4.805 1.00 25.00 C ATOM 15 CG1 VAL A 587 26.960 -0.657 -3.361 1.00 25.00 C ATOM 16 CG2 VAL A 587 27.312 -0.052 -5.759 1.00 25.00 C ATOM 0 H VAL A 587 26.526 -2.819 -6.784 1.00 25.00 H new ATOM 0 HA VAL A 587 28.696 -2.253 -4.903 1.00 25.00 H new ATOM 0 HB VAL A 587 25.796 -1.372 -5.012 1.00 25.00 H new ATOM 0 HG11 VAL A 587 26.395 0.268 -3.245 1.00 25.00 H new ATOM 0 HG12 VAL A 587 26.560 -1.413 -2.685 1.00 25.00 H new ATOM 0 HG13 VAL A 587 28.008 -0.475 -3.122 1.00 25.00 H new ATOM 0 HG21 VAL A 587 26.740 0.858 -5.577 1.00 25.00 H new ATOM 0 HG22 VAL A 587 28.371 0.146 -5.593 1.00 25.00 H new ATOM 0 HG23 VAL A 587 27.160 -0.376 -6.789 1.00 25.00 H new ATOM 26 N ARG A 588 27.945 -3.592 -2.876 1.00 25.00 N ATOM 27 CA ARG A 588 27.706 -4.588 -1.825 1.00 25.00 C ATOM 28 C ARG A 588 26.755 -4.037 -0.768 1.00 25.00 C ATOM 29 O ARG A 588 27.013 -2.979 -0.182 1.00 25.00 O ATOM 30 CB ARG A 588 29.031 -5.024 -1.169 1.00 25.00 C ATOM 31 CG ARG A 588 28.893 -6.070 -0.053 1.00 25.00 C ATOM 32 CD ARG A 588 30.228 -6.423 0.609 1.00 25.00 C ATOM 33 NE ARG A 588 30.085 -7.432 1.668 1.00 25.00 N ATOM 34 CZ ARG A 588 31.071 -7.827 2.491 1.00 25.00 C ATOM 35 NH1 ARG A 588 32.293 -7.309 2.401 1.00 25.00 N ATOM 36 NH2 ARG A 588 30.823 -8.750 3.409 1.00 25.00 N ATOM 0 H ARG A 588 28.717 -2.956 -2.676 1.00 25.00 H new ATOM 0 HA ARG A 588 27.246 -5.461 -2.289 1.00 25.00 H new ATOM 0 HB2 ARG A 588 29.686 -5.425 -1.942 1.00 25.00 H new ATOM 0 HB3 ARG A 588 29.523 -4.142 -0.760 1.00 25.00 H new ATOM 0 HG2 ARG A 588 28.206 -5.694 0.706 1.00 25.00 H new ATOM 0 HG3 ARG A 588 28.448 -6.976 -0.465 1.00 25.00 H new ATOM 0 HD2 ARG A 588 30.919 -6.793 -0.149 1.00 25.00 H new ATOM 0 HD3 ARG A 588 30.670 -5.520 1.030 1.00 25.00 H new ATOM 0 HE ARG A 588 29.169 -7.865 1.787 1.00 25.00 H new ATOM 0 HH11 ARG A 588 32.495 -6.598 1.698 1.00 25.00 H new ATOM 0 HH12 ARG A 588 33.028 -7.622 3.035 1.00 25.00 H new ATOM 0 HH21 ARG A 588 29.890 -9.154 3.486 1.00 25.00 H new ATOM 0 HH22 ARG A 588 31.565 -9.056 4.038 1.00 25.00 H new ATOM 50 N LYS A 589 25.655 -4.759 -0.532 1.00 25.00 N ATOM 51 CA LYS A 589 24.634 -4.315 0.419 1.00 25.00 C ATOM 52 C LYS A 589 24.322 -5.406 1.442 1.00 25.00 C ATOM 53 O LYS A 589 24.110 -6.569 1.078 1.00 25.00 O ATOM 54 CB LYS A 589 23.346 -3.894 -0.314 1.00 25.00 C ATOM 55 CG LYS A 589 23.543 -2.837 -1.407 1.00 25.00 C ATOM 56 CD LYS A 589 22.234 -2.392 -2.058 1.00 25.00 C ATOM 57 CE LYS A 589 22.275 -0.920 -2.438 1.00 25.00 C ATOM 58 NZ LYS A 589 21.200 -0.566 -3.406 1.00 25.00 N ATOM 0 H LYS A 589 25.450 -5.650 -0.985 1.00 25.00 H new ATOM 0 HA LYS A 589 25.033 -3.450 0.949 1.00 25.00 H new ATOM 0 HB2 LYS A 589 22.894 -4.779 -0.762 1.00 25.00 H new ATOM 0 HB3 LYS A 589 22.637 -3.510 0.419 1.00 25.00 H new ATOM 0 HG2 LYS A 589 24.041 -1.968 -0.977 1.00 25.00 H new ATOM 0 HG3 LYS A 589 24.205 -3.237 -2.175 1.00 25.00 H new ATOM 0 HD2 LYS A 589 22.045 -2.994 -2.947 1.00 25.00 H new ATOM 0 HD3 LYS A 589 21.406 -2.569 -1.372 1.00 25.00 H new ATOM 0 HE2 LYS A 589 22.170 -0.310 -1.540 1.00 25.00 H new ATOM 0 HE3 LYS A 589 23.247 -0.684 -2.872 1.00 25.00 H new ATOM 0 HZ1 LYS A 589 21.262 0.446 -3.639 1.00 25.00 H new ATOM 0 HZ2 LYS A 589 21.314 -1.129 -4.273 1.00 25.00 H new ATOM 0 HZ3 LYS A 589 20.272 -0.767 -2.983 1.00 25.00 H new ATOM 72 N GLY A 590 24.300 -5.015 2.724 1.00 25.00 N ATOM 73 CA GLY A 590 24.022 -5.952 3.813 1.00 25.00 C ATOM 74 C GLY A 590 22.537 -6.242 4.006 1.00 25.00 C ATOM 75 O GLY A 590 22.175 -7.272 4.580 1.00 25.00 O ATOM 0 H GLY A 590 24.472 -4.057 3.028 1.00 25.00 H new ATOM 0 HA2 GLY A 590 24.544 -6.889 3.617 1.00 25.00 H new ATOM 0 HA3 GLY A 590 24.428 -5.549 4.741 1.00 25.00 H new ATOM 79 N TRP A 591 21.682 -5.327 3.525 1.00 25.00 N ATOM 80 CA TRP A 591 20.222 -5.472 3.625 1.00 25.00 C ATOM 81 C TRP A 591 19.649 -6.324 2.485 1.00 25.00 C ATOM 82 O TRP A 591 18.588 -6.931 2.631 1.00 25.00 O ATOM 83 CB TRP A 591 19.538 -4.088 3.677 1.00 25.00 C ATOM 84 CG TRP A 591 19.640 -3.255 2.418 1.00 25.00 C ATOM 85 CD1 TRP A 591 20.550 -2.267 2.154 1.00 25.00 C ATOM 86 CD2 TRP A 591 18.777 -3.318 1.269 1.00 25.00 C ATOM 87 NE1 TRP A 591 20.319 -1.730 0.911 1.00 25.00 N ATOM 88 CE2 TRP A 591 19.235 -2.354 0.350 1.00 25.00 C ATOM 89 CE3 TRP A 591 17.665 -4.100 0.925 1.00 25.00 C ATOM 90 CZ2 TRP A 591 18.624 -2.151 -0.885 1.00 25.00 C ATOM 91 CZ3 TRP A 591 17.060 -3.893 -0.299 1.00 25.00 C ATOM 92 CH2 TRP A 591 17.542 -2.927 -1.191 1.00 25.00 C ATOM 0 H TRP A 591 21.981 -4.471 3.058 1.00 25.00 H new ATOM 0 HA TRP A 591 20.011 -5.998 4.556 1.00 25.00 H new ATOM 0 HB2 TRP A 591 18.483 -4.234 3.909 1.00 25.00 H new ATOM 0 HB3 TRP A 591 19.970 -3.521 4.501 1.00 25.00 H new ATOM 0 HD1 TRP A 591 21.336 -1.955 2.826 1.00 25.00 H new ATOM 0 HE1 TRP A 591 20.866 -0.987 0.476 1.00 25.00 H new ATOM 0 HE3 TRP A 591 17.289 -4.850 1.605 1.00 25.00 H new ATOM 0 HZ2 TRP A 591 18.992 -1.407 -1.576 1.00 25.00 H new ATOM 0 HZ3 TRP A 591 16.200 -4.486 -0.573 1.00 25.00 H new ATOM 0 HH2 TRP A 591 17.048 -2.792 -2.142 1.00 25.00 H new ATOM 103 N HIS A 592 20.369 -6.368 1.361 1.00 25.00 N ATOM 104 CA HIS A 592 20.002 -7.211 0.213 1.00 25.00 C ATOM 105 C HIS A 592 20.312 -8.700 0.489 1.00 25.00 C ATOM 106 O HIS A 592 19.842 -9.581 -0.237 1.00 25.00 O ATOM 107 CB HIS A 592 20.755 -6.717 -1.041 1.00 25.00 C ATOM 108 CG HIS A 592 20.371 -7.398 -2.330 1.00 25.00 C ATOM 109 ND1 HIS A 592 21.273 -8.071 -3.128 1.00 25.00 N ATOM 110 CD2 HIS A 592 19.169 -7.514 -2.947 1.00 25.00 C ATOM 111 CE1 HIS A 592 20.644 -8.570 -4.178 1.00 25.00 C ATOM 112 NE2 HIS A 592 19.367 -8.247 -4.090 1.00 25.00 N ATOM 0 H HIS A 592 21.220 -5.824 1.218 1.00 25.00 H new ATOM 0 HA HIS A 592 18.928 -7.131 0.045 1.00 25.00 H new ATOM 0 HB2 HIS A 592 20.584 -5.646 -1.150 1.00 25.00 H new ATOM 0 HB3 HIS A 592 21.824 -6.854 -0.881 1.00 25.00 H new ATOM 0 HD2 HIS A 592 18.230 -7.105 -2.603 1.00 25.00 H new ATOM 0 HE1 HIS A 592 21.097 -9.144 -4.972 1.00 25.00 H new ATOM 0 HE2 HIS A 592 18.644 -8.501 -4.763 1.00 25.00 H new ATOM 121 N GLU A 593 21.089 -8.961 1.552 1.00 25.00 N ATOM 122 CA GLU A 593 21.510 -10.323 1.908 1.00 25.00 C ATOM 123 C GLU A 593 20.449 -11.066 2.733 1.00 25.00 C ATOM 124 O GLU A 593 20.347 -12.294 2.644 1.00 25.00 O ATOM 125 CB GLU A 593 22.840 -10.289 2.677 1.00 25.00 C ATOM 126 CG GLU A 593 24.066 -10.033 1.806 1.00 25.00 C ATOM 127 CD GLU A 593 25.372 -10.035 2.585 1.00 25.00 C ATOM 128 OE1 GLU A 593 25.501 -9.227 3.528 1.00 25.00 O ATOM 129 OE2 GLU A 593 26.264 -10.843 2.248 1.00 25.00 O ATOM 0 H GLU A 593 21.440 -8.240 2.183 1.00 25.00 H new ATOM 0 HA GLU A 593 21.641 -10.869 0.974 1.00 25.00 H new ATOM 0 HB2 GLU A 593 22.784 -9.514 3.441 1.00 25.00 H new ATOM 0 HB3 GLU A 593 22.970 -11.239 3.196 1.00 25.00 H new ATOM 0 HG2 GLU A 593 24.115 -10.794 1.028 1.00 25.00 H new ATOM 0 HG3 GLU A 593 23.952 -9.072 1.305 1.00 25.00 H new ATOM 136 N HIS A 594 19.665 -10.323 3.529 1.00 25.00 N ATOM 137 CA HIS A 594 18.623 -10.927 4.373 1.00 25.00 C ATOM 138 C HIS A 594 17.210 -10.736 3.805 1.00 25.00 C ATOM 139 O HIS A 594 16.307 -11.510 4.141 1.00 25.00 O ATOM 140 CB HIS A 594 18.687 -10.411 5.827 1.00 25.00 C ATOM 141 CG HIS A 594 19.925 -10.772 6.598 1.00 25.00 C ATOM 142 ND1 HIS A 594 20.195 -12.056 7.019 1.00 25.00 N ATOM 143 CD2 HIS A 594 20.937 -10.006 7.060 1.00 25.00 C ATOM 144 CE1 HIS A 594 21.321 -12.064 7.710 1.00 25.00 C ATOM 145 NE2 HIS A 594 21.793 -10.831 7.748 1.00 25.00 N ATOM 0 H HIS A 594 19.732 -9.308 3.606 1.00 25.00 H new ATOM 0 HA HIS A 594 18.833 -11.997 4.376 1.00 25.00 H new ATOM 0 HB2 HIS A 594 18.596 -9.325 5.811 1.00 25.00 H new ATOM 0 HB3 HIS A 594 17.821 -10.795 6.367 1.00 25.00 H new ATOM 0 HD2 HIS A 594 21.052 -8.942 6.915 1.00 25.00 H new ATOM 0 HE1 HIS A 594 21.777 -12.930 8.166 1.00 25.00 H new ATOM 0 HE2 HIS A 594 22.653 -10.539 8.212 1.00 25.00 H new ATOM 154 N VAL A 595 17.012 -9.717 2.949 1.00 25.00 N ATOM 155 CA VAL A 595 15.698 -9.486 2.327 1.00 25.00 C ATOM 156 C VAL A 595 15.512 -10.421 1.124 1.00 25.00 C ATOM 157 O VAL A 595 16.371 -10.492 0.238 1.00 25.00 O ATOM 158 CB VAL A 595 15.474 -7.994 1.901 1.00 25.00 C ATOM 159 CG1 VAL A 595 14.163 -7.801 1.132 1.00 25.00 C ATOM 160 CG2 VAL A 595 15.480 -7.077 3.114 1.00 25.00 C ATOM 0 H VAL A 595 17.734 -9.050 2.676 1.00 25.00 H new ATOM 0 HA VAL A 595 14.946 -9.708 3.084 1.00 25.00 H new ATOM 0 HB VAL A 595 16.300 -7.734 1.239 1.00 25.00 H new ATOM 0 HG11 VAL A 595 14.053 -6.752 0.859 1.00 25.00 H new ATOM 0 HG12 VAL A 595 14.177 -8.412 0.229 1.00 25.00 H new ATOM 0 HG13 VAL A 595 13.325 -8.102 1.760 1.00 25.00 H new ATOM 0 HG21 VAL A 595 15.323 -6.047 2.793 1.00 25.00 H new ATOM 0 HG22 VAL A 595 14.682 -7.370 3.796 1.00 25.00 H new ATOM 0 HG23 VAL A 595 16.440 -7.155 3.624 1.00 25.00 H new ATOM 170 N THR A 596 14.382 -11.132 1.117 1.00 25.00 N ATOM 171 CA THR A 596 14.073 -12.106 0.068 1.00 25.00 C ATOM 172 C THR A 596 12.915 -11.635 -0.812 1.00 25.00 C ATOM 173 O THR A 596 12.419 -10.514 -0.664 1.00 25.00 O ATOM 174 CB THR A 596 13.699 -13.495 0.656 1.00 25.00 C ATOM 175 OG1 THR A 596 12.474 -13.410 1.399 1.00 25.00 O ATOM 176 CG2 THR A 596 14.790 -14.036 1.559 1.00 25.00 C ATOM 0 H THR A 596 13.660 -11.050 1.833 1.00 25.00 H new ATOM 0 HA THR A 596 14.980 -12.197 -0.530 1.00 25.00 H new ATOM 0 HB THR A 596 13.577 -14.177 -0.185 1.00 25.00 H new ATOM 0 HG1 THR A 596 12.596 -13.822 2.280 1.00 25.00 H new ATOM 0 HG21 THR A 596 14.490 -15.008 1.950 1.00 25.00 H new ATOM 0 HG22 THR A 596 15.714 -14.143 0.990 1.00 25.00 H new ATOM 0 HG23 THR A 596 14.952 -13.346 2.387 1.00 25.00 H new ATOM 184 N GLN A 597 12.501 -12.512 -1.733 1.00 25.00 N ATOM 185 CA GLN A 597 11.263 -12.339 -2.502 1.00 25.00 C ATOM 186 C GLN A 597 10.037 -12.519 -1.591 1.00 25.00 C ATOM 187 O GLN A 597 8.933 -12.075 -1.923 1.00 25.00 O ATOM 188 CB GLN A 597 11.214 -13.368 -3.639 1.00 25.00 C ATOM 189 CG GLN A 597 12.240 -13.134 -4.732 1.00 25.00 C ATOM 190 CD GLN A 597 12.178 -14.184 -5.822 1.00 25.00 C ATOM 191 OE1 GLN A 597 12.938 -14.146 -6.789 1.00 25.00 O ATOM 192 NE2 GLN A 597 11.249 -15.124 -5.670 1.00 25.00 N ATOM 0 H GLN A 597 13.014 -13.362 -1.967 1.00 25.00 H new ATOM 0 HA GLN A 597 11.247 -11.332 -2.919 1.00 25.00 H new ATOM 0 HB2 GLN A 597 11.365 -14.363 -3.221 1.00 25.00 H new ATOM 0 HB3 GLN A 597 10.218 -13.357 -4.082 1.00 25.00 H new ATOM 0 HG2 GLN A 597 12.080 -12.149 -5.171 1.00 25.00 H new ATOM 0 HG3 GLN A 597 13.238 -13.129 -4.294 1.00 25.00 H new ATOM 0 HE21 GLN A 597 10.642 -15.113 -4.850 1.00 25.00 H new ATOM 0 HE22 GLN A 597 11.144 -15.855 -6.373 1.00 25.00 H new ATOM 201 N ASP A 598 10.259 -13.166 -0.427 1.00 25.00 N ATOM 202 CA ASP A 598 9.194 -13.467 0.530 1.00 25.00 C ATOM 203 C ASP A 598 8.875 -12.275 1.439 1.00 25.00 C ATOM 204 O ASP A 598 7.705 -12.059 1.773 1.00 25.00 O ATOM 205 CB ASP A 598 9.569 -14.687 1.377 1.00 25.00 C ATOM 206 CG ASP A 598 9.656 -15.965 0.562 1.00 25.00 C ATOM 207 OD1 ASP A 598 8.761 -16.195 -0.280 1.00 25.00 O ATOM 208 OD2 ASP A 598 10.621 -16.733 0.763 1.00 25.00 O ATOM 0 H ASP A 598 11.181 -13.490 -0.133 1.00 25.00 H new ATOM 0 HA ASP A 598 8.296 -13.687 -0.048 1.00 25.00 H new ATOM 0 HB2 ASP A 598 10.528 -14.505 1.863 1.00 25.00 H new ATOM 0 HB3 ASP A 598 8.830 -14.815 2.168 1.00 25.00 H new ATOM 213 N LEU A 599 9.909 -11.503 1.852 1.00 25.00 N ATOM 214 CA LEU A 599 9.690 -10.277 2.642 1.00 25.00 C ATOM 215 C LEU A 599 8.836 -9.255 1.888 1.00 25.00 C ATOM 216 O LEU A 599 7.865 -8.740 2.433 1.00 25.00 O ATOM 217 CB LEU A 599 11.025 -9.614 3.056 1.00 25.00 C ATOM 218 CG LEU A 599 11.879 -10.350 4.112 1.00 25.00 C ATOM 219 CD1 LEU A 599 12.815 -9.369 4.790 1.00 25.00 C ATOM 220 CD2 LEU A 599 11.040 -11.019 5.192 1.00 25.00 C ATOM 0 H LEU A 599 10.888 -11.707 1.652 1.00 25.00 H new ATOM 0 HA LEU A 599 9.155 -10.590 3.539 1.00 25.00 H new ATOM 0 HB2 LEU A 599 11.632 -9.487 2.159 1.00 25.00 H new ATOM 0 HB3 LEU A 599 10.804 -8.616 3.435 1.00 25.00 H new ATOM 0 HG LEU A 599 12.429 -11.124 3.577 1.00 25.00 H new ATOM 0 HD11 LEU A 599 13.415 -9.893 5.534 1.00 25.00 H new ATOM 0 HD12 LEU A 599 13.472 -8.919 4.046 1.00 25.00 H new ATOM 0 HD13 LEU A 599 12.232 -8.588 5.279 1.00 25.00 H new ATOM 0 HD21 LEU A 599 11.696 -11.519 5.904 1.00 25.00 H new ATOM 0 HD22 LEU A 599 10.448 -10.266 5.711 1.00 25.00 H new ATOM 0 HD23 LEU A 599 10.375 -11.752 4.735 1.00 25.00 H new ATOM 232 N ARG A 600 9.183 -9.009 0.616 1.00 25.00 N ATOM 233 CA ARG A 600 8.519 -7.982 -0.215 1.00 25.00 C ATOM 234 C ARG A 600 7.023 -8.266 -0.382 1.00 25.00 C ATOM 235 O ARG A 600 6.219 -7.343 -0.531 1.00 25.00 O ATOM 236 CB ARG A 600 9.175 -7.908 -1.602 1.00 25.00 C ATOM 237 CG ARG A 600 10.580 -7.329 -1.587 1.00 25.00 C ATOM 238 CD ARG A 600 11.287 -7.525 -2.918 1.00 25.00 C ATOM 239 NE ARG A 600 10.625 -6.789 -4.002 1.00 25.00 N ATOM 240 CZ ARG A 600 10.948 -6.881 -5.302 1.00 25.00 C ATOM 241 NH1 ARG A 600 11.939 -7.668 -5.716 1.00 25.00 N ATOM 242 NH2 ARG A 600 10.268 -6.174 -6.195 1.00 25.00 N ATOM 0 H ARG A 600 9.927 -9.511 0.132 1.00 25.00 H new ATOM 0 HA ARG A 600 8.634 -7.029 0.301 1.00 25.00 H new ATOM 0 HB2 ARG A 600 9.210 -8.909 -2.031 1.00 25.00 H new ATOM 0 HB3 ARG A 600 8.550 -7.302 -2.257 1.00 25.00 H new ATOM 0 HG2 ARG A 600 10.532 -6.265 -1.354 1.00 25.00 H new ATOM 0 HG3 ARG A 600 11.160 -7.803 -0.795 1.00 25.00 H new ATOM 0 HD2 ARG A 600 12.322 -7.193 -2.832 1.00 25.00 H new ATOM 0 HD3 ARG A 600 11.313 -8.587 -3.163 1.00 25.00 H new ATOM 0 HE ARG A 600 9.863 -6.161 -3.749 1.00 25.00 H new ATOM 0 HH11 ARG A 600 12.471 -8.217 -5.040 1.00 25.00 H new ATOM 0 HH12 ARG A 600 12.167 -7.722 -6.709 1.00 25.00 H new ATOM 0 HH21 ARG A 600 9.507 -5.567 -5.892 1.00 25.00 H new ATOM 0 HH22 ARG A 600 10.507 -6.238 -7.185 1.00 25.00 H new ATOM 256 N SER A 601 6.675 -9.556 -0.353 1.00 25.00 N ATOM 257 CA SER A 601 5.279 -10.003 -0.447 1.00 25.00 C ATOM 258 C SER A 601 4.531 -9.806 0.885 1.00 25.00 C ATOM 259 O SER A 601 3.310 -9.634 0.894 1.00 25.00 O ATOM 260 CB SER A 601 5.231 -11.479 -0.863 1.00 25.00 C ATOM 261 OG SER A 601 5.760 -12.322 0.150 1.00 25.00 O ATOM 0 H SER A 601 7.348 -10.317 -0.264 1.00 25.00 H new ATOM 0 HA SER A 601 4.781 -9.395 -1.202 1.00 25.00 H new ATOM 0 HB2 SER A 601 4.201 -11.765 -1.075 1.00 25.00 H new ATOM 0 HB3 SER A 601 5.796 -11.617 -1.785 1.00 25.00 H new ATOM 0 HG SER A 601 6.572 -11.918 0.521 1.00 25.00 H new ATOM 267 N HIS A 602 5.281 -9.832 2.002 1.00 25.00 N ATOM 268 CA HIS A 602 4.720 -9.592 3.341 1.00 25.00 C ATOM 269 C HIS A 602 4.682 -8.086 3.649 1.00 25.00 C ATOM 270 O HIS A 602 3.917 -7.637 4.507 1.00 25.00 O ATOM 271 CB HIS A 602 5.546 -10.349 4.398 1.00 25.00 C ATOM 272 CG HIS A 602 5.512 -11.847 4.261 1.00 25.00 C ATOM 273 ND1 HIS A 602 6.444 -12.680 4.845 1.00 25.00 N ATOM 274 CD2 HIS A 602 4.648 -12.658 3.603 1.00 25.00 C ATOM 275 CE1 HIS A 602 6.155 -13.936 4.553 1.00 25.00 C ATOM 276 NE2 HIS A 602 5.070 -13.950 3.802 1.00 25.00 N ATOM 0 H HIS A 602 6.284 -10.018 2.001 1.00 25.00 H new ATOM 0 HA HIS A 602 3.696 -9.965 3.368 1.00 25.00 H new ATOM 0 HB2 HIS A 602 6.582 -10.015 4.339 1.00 25.00 H new ATOM 0 HB3 HIS A 602 5.180 -10.079 5.389 1.00 25.00 H new ATOM 0 HD2 HIS A 602 3.788 -12.346 3.029 1.00 25.00 H new ATOM 0 HE1 HIS A 602 6.712 -14.804 4.874 1.00 25.00 H new ATOM 0 HE2 HIS A 602 4.618 -14.785 3.430 1.00 25.00 H new ATOM 285 N LEU A 603 5.519 -7.325 2.931 1.00 25.00 N ATOM 286 CA LEU A 603 5.515 -5.857 2.980 1.00 25.00 C ATOM 287 C LEU A 603 4.327 -5.316 2.174 1.00 25.00 C ATOM 288 O LEU A 603 3.733 -4.294 2.526 1.00 25.00 O ATOM 289 CB LEU A 603 6.839 -5.306 2.400 1.00 25.00 C ATOM 290 CG LEU A 603 8.167 -5.480 3.206 1.00 25.00 C ATOM 291 CD1 LEU A 603 9.335 -4.878 2.463 1.00 25.00 C ATOM 292 CD2 LEU A 603 8.130 -4.879 4.599 1.00 25.00 C ATOM 0 H LEU A 603 6.220 -7.711 2.298 1.00 25.00 H new ATOM 0 HA LEU A 603 5.421 -5.534 4.017 1.00 25.00 H new ATOM 0 HB2 LEU A 603 6.986 -5.771 1.425 1.00 25.00 H new ATOM 0 HB3 LEU A 603 6.700 -4.239 2.227 1.00 25.00 H new ATOM 0 HG LEU A 603 8.286 -6.558 3.313 1.00 25.00 H new ATOM 0 HD11 LEU A 603 10.246 -5.013 3.046 1.00 25.00 H new ATOM 0 HD12 LEU A 603 9.446 -5.372 1.498 1.00 25.00 H new ATOM 0 HD13 LEU A 603 9.158 -3.814 2.308 1.00 25.00 H new ATOM 0 HD21 LEU A 603 9.089 -5.042 5.091 1.00 25.00 H new ATOM 0 HD22 LEU A 603 7.936 -3.809 4.528 1.00 25.00 H new ATOM 0 HD23 LEU A 603 7.339 -5.354 5.179 1.00 25.00 H new ATOM 304 N VAL A 604 4.002 -6.034 1.083 1.00 25.00 N ATOM 305 CA VAL A 604 2.807 -5.789 0.273 1.00 25.00 C ATOM 306 C VAL A 604 1.537 -6.272 1.008 1.00 25.00 C ATOM 307 O VAL A 604 0.479 -5.653 0.889 1.00 25.00 O ATOM 308 CB VAL A 604 2.962 -6.472 -1.129 1.00 25.00 C ATOM 309 CG1 VAL A 604 1.658 -6.556 -1.910 1.00 25.00 C ATOM 310 CG2 VAL A 604 3.979 -5.719 -1.965 1.00 25.00 C ATOM 0 H VAL A 604 4.572 -6.808 0.740 1.00 25.00 H new ATOM 0 HA VAL A 604 2.698 -4.716 0.116 1.00 25.00 H new ATOM 0 HB VAL A 604 3.293 -7.492 -0.932 1.00 25.00 H new ATOM 0 HG11 VAL A 604 1.839 -7.040 -2.870 1.00 25.00 H new ATOM 0 HG12 VAL A 604 0.931 -7.137 -1.343 1.00 25.00 H new ATOM 0 HG13 VAL A 604 1.269 -5.552 -2.078 1.00 25.00 H new ATOM 0 HG21 VAL A 604 4.080 -6.201 -2.937 1.00 25.00 H new ATOM 0 HG22 VAL A 604 3.646 -4.690 -2.103 1.00 25.00 H new ATOM 0 HG23 VAL A 604 4.943 -5.723 -1.456 1.00 25.00 H new ATOM 320 N HIS A 605 1.661 -7.374 1.765 1.00 25.00 N ATOM 321 CA HIS A 605 0.549 -7.908 2.570 1.00 25.00 C ATOM 322 C HIS A 605 0.308 -7.040 3.819 1.00 25.00 C ATOM 323 O HIS A 605 -0.750 -7.123 4.447 1.00 25.00 O ATOM 324 CB HIS A 605 0.824 -9.368 2.967 1.00 25.00 C ATOM 325 CG HIS A 605 0.241 -10.384 2.022 1.00 25.00 C ATOM 326 ND1 HIS A 605 -0.905 -11.100 2.297 1.00 25.00 N ATOM 327 CD2 HIS A 605 0.661 -10.809 0.802 1.00 25.00 C ATOM 328 CE1 HIS A 605 -1.165 -11.920 1.295 1.00 25.00 C ATOM 329 NE2 HIS A 605 -0.229 -11.763 0.374 1.00 25.00 N ATOM 0 H HIS A 605 2.523 -7.915 1.837 1.00 25.00 H new ATOM 0 HA HIS A 605 -0.355 -7.881 1.962 1.00 25.00 H new ATOM 0 HB2 HIS A 605 1.902 -9.520 3.026 1.00 25.00 H new ATOM 0 HB3 HIS A 605 0.422 -9.543 3.965 1.00 25.00 H new ATOM 0 HD2 HIS A 605 1.533 -10.461 0.268 1.00 25.00 H new ATOM 0 HE1 HIS A 605 -2.000 -12.603 1.237 1.00 25.00 H new ATOM 0 HE2 HIS A 605 -0.177 -12.268 -0.510 1.00 25.00 H new ATOM 338 N LYS A 606 1.311 -6.218 4.156 1.00 25.00 N ATOM 339 CA LYS A 606 1.223 -5.238 5.252 1.00 25.00 C ATOM 340 C LYS A 606 0.577 -3.948 4.720 1.00 25.00 C ATOM 341 O LYS A 606 -0.030 -3.168 5.459 1.00 25.00 O ATOM 342 CB LYS A 606 2.640 -4.942 5.763 1.00 25.00 C ATOM 343 CG LYS A 606 2.710 -4.022 6.974 1.00 25.00 C ATOM 344 CD LYS A 606 4.135 -3.848 7.432 1.00 25.00 C ATOM 345 CE LYS A 606 4.218 -2.892 8.596 1.00 25.00 C ATOM 346 NZ LYS A 606 5.609 -2.739 9.117 1.00 25.00 N ATOM 0 H LYS A 606 2.211 -6.212 3.675 1.00 25.00 H new ATOM 0 HA LYS A 606 0.617 -5.633 6.068 1.00 25.00 H new ATOM 0 HB2 LYS A 606 3.123 -5.886 6.015 1.00 25.00 H new ATOM 0 HB3 LYS A 606 3.216 -4.495 4.953 1.00 25.00 H new ATOM 0 HG2 LYS A 606 2.283 -3.051 6.724 1.00 25.00 H new ATOM 0 HG3 LYS A 606 2.110 -4.435 7.785 1.00 25.00 H new ATOM 0 HD2 LYS A 606 4.548 -4.814 7.721 1.00 25.00 H new ATOM 0 HD3 LYS A 606 4.742 -3.475 6.607 1.00 25.00 H new ATOM 0 HE2 LYS A 606 3.840 -1.917 8.288 1.00 25.00 H new ATOM 0 HE3 LYS A 606 3.571 -3.246 9.398 1.00 25.00 H new ATOM 0 HZ1 LYS A 606 5.609 -2.072 9.915 1.00 25.00 H new ATOM 0 HZ2 LYS A 606 5.963 -3.663 9.438 1.00 25.00 H new ATOM 0 HZ3 LYS A 606 6.225 -2.375 8.362 1.00 25.00 H new ATOM 360 N LEU A 607 0.741 -3.778 3.414 1.00 25.00 N ATOM 361 CA LEU A 607 0.321 -2.610 2.657 1.00 25.00 C ATOM 362 C LEU A 607 -1.145 -2.737 2.198 1.00 25.00 C ATOM 363 O LEU A 607 -1.920 -1.791 2.321 1.00 25.00 O ATOM 364 CB LEU A 607 1.323 -2.518 1.504 1.00 25.00 C ATOM 365 CG LEU A 607 2.496 -1.520 1.551 1.00 25.00 C ATOM 366 CD1 LEU A 607 3.543 -1.743 0.464 1.00 25.00 C ATOM 367 CD2 LEU A 607 1.921 -0.139 1.391 1.00 25.00 C ATOM 0 H LEU A 607 1.190 -4.483 2.830 1.00 25.00 H new ATOM 0 HA LEU A 607 0.329 -1.693 3.246 1.00 25.00 H new ATOM 0 HB2 LEU A 607 1.753 -3.511 1.375 1.00 25.00 H new ATOM 0 HB3 LEU A 607 0.752 -2.298 0.602 1.00 25.00 H new ATOM 0 HG LEU A 607 3.008 -1.659 2.503 1.00 25.00 H new ATOM 0 HD11 LEU A 607 4.335 -1.001 0.564 1.00 25.00 H new ATOM 0 HD12 LEU A 607 3.966 -2.742 0.566 1.00 25.00 H new ATOM 0 HD13 LEU A 607 3.076 -1.645 -0.516 1.00 25.00 H new ATOM 0 HD21 LEU A 607 2.726 0.596 1.420 1.00 25.00 H new ATOM 0 HD22 LEU A 607 1.400 -0.070 0.436 1.00 25.00 H new ATOM 0 HD23 LEU A 607 1.220 0.059 2.202 1.00 25.00 H new ATOM 379 N VAL A 608 -1.510 -3.933 1.704 1.00 25.00 N ATOM 380 CA VAL A 608 -2.888 -4.254 1.269 1.00 25.00 C ATOM 381 C VAL A 608 -3.850 -4.357 2.476 1.00 25.00 C ATOM 382 O VAL A 608 -5.052 -4.130 2.322 1.00 25.00 O ATOM 383 CB VAL A 608 -2.899 -5.579 0.427 1.00 25.00 C ATOM 384 CG1 VAL A 608 -4.313 -6.061 0.101 1.00 25.00 C ATOM 385 CG2 VAL A 608 -2.119 -5.398 -0.873 1.00 25.00 C ATOM 0 H VAL A 608 -0.858 -4.709 1.593 1.00 25.00 H new ATOM 0 HA VAL A 608 -3.243 -3.439 0.637 1.00 25.00 H new ATOM 0 HB VAL A 608 -2.422 -6.338 1.047 1.00 25.00 H new ATOM 0 HG11 VAL A 608 -4.259 -6.980 -0.482 1.00 25.00 H new ATOM 0 HG12 VAL A 608 -4.855 -6.251 1.027 1.00 25.00 H new ATOM 0 HG13 VAL A 608 -4.834 -5.296 -0.475 1.00 25.00 H new ATOM 0 HG21 VAL A 608 -2.139 -6.328 -1.442 1.00 25.00 H new ATOM 0 HG22 VAL A 608 -2.574 -4.602 -1.463 1.00 25.00 H new ATOM 0 HG23 VAL A 608 -1.086 -5.135 -0.644 1.00 25.00 H new ATOM 395 N GLN A 609 -3.315 -4.679 3.666 1.00 25.00 N ATOM 396 CA GLN A 609 -4.140 -4.819 4.879 1.00 25.00 C ATOM 397 C GLN A 609 -4.369 -3.459 5.560 1.00 25.00 C ATOM 398 O GLN A 609 -5.394 -3.251 6.216 1.00 25.00 O ATOM 399 CB GLN A 609 -3.537 -5.846 5.855 1.00 25.00 C ATOM 400 CG GLN A 609 -3.699 -7.282 5.415 1.00 25.00 C ATOM 401 CD GLN A 609 -3.139 -8.283 6.406 1.00 25.00 C ATOM 402 OE1 GLN A 609 -2.546 -7.908 7.418 1.00 25.00 O ATOM 403 NE2 GLN A 609 -3.324 -9.567 6.122 1.00 25.00 N ATOM 0 H GLN A 609 -2.320 -4.847 3.814 1.00 25.00 H new ATOM 0 HA GLN A 609 -5.115 -5.198 4.571 1.00 25.00 H new ATOM 0 HB2 GLN A 609 -2.475 -5.633 5.980 1.00 25.00 H new ATOM 0 HB3 GLN A 609 -4.004 -5.721 6.832 1.00 25.00 H new ATOM 0 HG2 GLN A 609 -4.758 -7.489 5.260 1.00 25.00 H new ATOM 0 HG3 GLN A 609 -3.203 -7.418 4.454 1.00 25.00 H new ATOM 0 HE21 GLN A 609 -3.821 -9.835 5.273 1.00 25.00 H new ATOM 0 HE22 GLN A 609 -2.969 -10.285 6.753 1.00 25.00 H new ATOM 412 N ALA A 610 -3.398 -2.544 5.393 1.00 25.00 N ATOM 413 CA ALA A 610 -3.525 -1.162 5.864 1.00 25.00 C ATOM 414 C ALA A 610 -4.530 -0.380 5.011 1.00 25.00 C ATOM 415 O ALA A 610 -5.246 0.486 5.517 1.00 25.00 O ATOM 416 CB ALA A 610 -2.167 -0.484 5.837 1.00 25.00 C ATOM 0 H ALA A 610 -2.511 -2.744 4.931 1.00 25.00 H new ATOM 0 HA ALA A 610 -3.897 -1.178 6.888 1.00 25.00 H new ATOM 0 HB1 ALA A 610 -2.266 0.543 6.188 1.00 25.00 H new ATOM 0 HB2 ALA A 610 -1.478 -1.024 6.486 1.00 25.00 H new ATOM 0 HB3 ALA A 610 -1.781 -0.483 4.818 1.00 25.00 H new ATOM 422 N ILE A 611 -4.579 -0.715 3.711 1.00 25.00 N ATOM 423 CA ILE A 611 -5.567 -0.152 2.783 1.00 25.00 C ATOM 424 C ILE A 611 -6.932 -0.829 3.018 1.00 25.00 C ATOM 425 O ILE A 611 -7.942 -0.147 3.209 1.00 25.00 O ATOM 426 CB ILE A 611 -5.103 -0.309 1.291 1.00 25.00 C ATOM 427 CG1 ILE A 611 -3.811 0.487 1.043 1.00 25.00 C ATOM 428 CG2 ILE A 611 -6.179 0.173 0.316 1.00 25.00 C ATOM 429 CD1 ILE A 611 -3.149 0.217 -0.294 1.00 25.00 C ATOM 0 H ILE A 611 -3.938 -1.380 3.278 1.00 25.00 H new ATOM 0 HA ILE A 611 -5.663 0.917 2.975 1.00 25.00 H new ATOM 0 HB ILE A 611 -4.923 -1.370 1.119 1.00 25.00 H new ATOM 0 HG12 ILE A 611 -4.036 1.551 1.113 1.00 25.00 H new ATOM 0 HG13 ILE A 611 -3.101 0.258 1.838 1.00 25.00 H new ATOM 0 HG21 ILE A 611 -5.824 0.050 -0.707 1.00 25.00 H new ATOM 0 HG22 ILE A 611 -7.087 -0.412 0.458 1.00 25.00 H new ATOM 0 HG23 ILE A 611 -6.393 1.226 0.502 1.00 25.00 H new ATOM 0 HD11 ILE A 611 -2.246 0.821 -0.382 1.00 25.00 H new ATOM 0 HD12 ILE A 611 -2.887 -0.839 -0.364 1.00 25.00 H new ATOM 0 HD13 ILE A 611 -3.837 0.474 -1.099 1.00 25.00 H new ATOM 441 N PHE A 612 -6.943 -2.174 2.999 1.00 25.00 N ATOM 442 CA PHE A 612 -8.125 -2.953 3.356 1.00 25.00 C ATOM 443 C PHE A 612 -7.721 -4.248 4.101 1.00 25.00 C ATOM 444 O PHE A 612 -7.057 -5.108 3.514 1.00 25.00 O ATOM 445 CB PHE A 612 -8.954 -3.280 2.094 1.00 25.00 C ATOM 446 CG PHE A 612 -10.204 -4.085 2.358 1.00 25.00 C ATOM 447 CD1 PHE A 612 -11.325 -3.472 2.888 1.00 25.00 C ATOM 448 CD2 PHE A 612 -10.251 -5.441 2.078 1.00 25.00 C ATOM 449 CE1 PHE A 612 -12.477 -4.196 3.135 1.00 25.00 C ATOM 450 CE2 PHE A 612 -11.398 -6.171 2.323 1.00 25.00 C ATOM 451 CZ PHE A 612 -12.513 -5.548 2.852 1.00 25.00 C ATOM 0 H PHE A 612 -6.136 -2.740 2.737 1.00 25.00 H new ATOM 0 HA PHE A 612 -8.743 -2.357 4.027 1.00 25.00 H new ATOM 0 HB2 PHE A 612 -9.234 -2.346 1.607 1.00 25.00 H new ATOM 0 HB3 PHE A 612 -8.325 -3.829 1.393 1.00 25.00 H new ATOM 0 HD1 PHE A 612 -11.300 -2.416 3.112 1.00 25.00 H new ATOM 0 HD2 PHE A 612 -9.383 -5.932 1.664 1.00 25.00 H new ATOM 0 HE1 PHE A 612 -13.346 -3.706 3.548 1.00 25.00 H new ATOM 0 HE2 PHE A 612 -11.424 -7.228 2.101 1.00 25.00 H new ATOM 0 HZ PHE A 612 -13.411 -6.117 3.044 1.00 25.00 H new ATOM 461 N PRO A 613 -8.114 -4.420 5.407 1.00 25.00 N ATOM 462 CA PRO A 613 -7.843 -5.667 6.154 1.00 25.00 C ATOM 463 C PRO A 613 -8.683 -6.850 5.643 1.00 25.00 C ATOM 464 O PRO A 613 -9.914 -6.760 5.572 1.00 25.00 O ATOM 465 CB PRO A 613 -8.219 -5.297 7.597 1.00 25.00 C ATOM 466 CG PRO A 613 -9.204 -4.190 7.464 1.00 25.00 C ATOM 467 CD PRO A 613 -8.812 -3.424 6.268 1.00 25.00 C ATOM 0 HA PRO A 613 -6.811 -6.001 6.046 1.00 25.00 H new ATOM 0 HB2 PRO A 613 -8.650 -6.148 8.124 1.00 25.00 H new ATOM 0 HB3 PRO A 613 -7.344 -4.981 8.165 1.00 25.00 H new ATOM 0 HG2 PRO A 613 -10.216 -4.581 7.360 1.00 25.00 H new ATOM 0 HG3 PRO A 613 -9.197 -3.556 8.351 1.00 25.00 H new ATOM 0 HD2 PRO A 613 -9.681 -3.001 5.764 1.00 25.00 H new ATOM 0 HD3 PRO A 613 -8.157 -2.592 6.525 1.00 25.00 H new ATOM 475 N THR A 614 -8.007 -7.946 5.284 1.00 25.00 N ATOM 476 CA THR A 614 -8.672 -9.106 4.696 1.00 25.00 C ATOM 477 C THR A 614 -8.909 -10.235 5.708 1.00 25.00 C ATOM 478 O THR A 614 -7.954 -10.837 6.210 1.00 25.00 O ATOM 479 CB THR A 614 -7.900 -9.687 3.499 1.00 25.00 C ATOM 480 OG1 THR A 614 -6.576 -10.078 3.886 1.00 25.00 O ATOM 481 CG2 THR A 614 -7.847 -8.696 2.347 1.00 25.00 C ATOM 0 H THR A 614 -6.998 -8.051 5.392 1.00 25.00 H new ATOM 0 HA THR A 614 -9.634 -8.723 4.356 1.00 25.00 H new ATOM 0 HB THR A 614 -8.435 -10.574 3.159 1.00 25.00 H new ATOM 0 HG1 THR A 614 -6.607 -10.516 4.762 1.00 25.00 H new ATOM 0 HG21 THR A 614 -7.295 -9.134 1.515 1.00 25.00 H new ATOM 0 HG22 THR A 614 -8.861 -8.458 2.025 1.00 25.00 H new ATOM 0 HG23 THR A 614 -7.347 -7.784 2.674 1.00 25.00 H new ATOM 489 N PRO A 615 -10.206 -10.526 6.032 1.00 25.00 N ATOM 490 CA PRO A 615 -10.609 -11.750 6.761 1.00 25.00 C ATOM 491 C PRO A 615 -10.275 -13.029 5.988 1.00 25.00 C ATOM 492 O PRO A 615 -9.648 -13.949 6.517 1.00 25.00 O ATOM 493 CB PRO A 615 -12.129 -11.614 6.868 1.00 25.00 C ATOM 494 CG PRO A 615 -12.377 -10.153 6.885 1.00 25.00 C ATOM 495 CD PRO A 615 -11.380 -9.662 5.767 1.00 25.00 C ATOM 0 HA PRO A 615 -10.091 -11.833 7.716 1.00 25.00 H new ATOM 0 HB2 PRO A 615 -12.629 -12.091 6.025 1.00 25.00 H new ATOM 0 HB3 PRO A 615 -12.506 -12.090 7.773 1.00 25.00 H new ATOM 0 HG2 PRO A 615 -13.413 -9.908 6.649 1.00 25.00 H new ATOM 0 HG3 PRO A 615 -12.158 -9.709 7.856 1.00 25.00 H new ATOM 0 HD2 PRO A 615 -11.781 -9.808 4.764 1.00 25.00 H new ATOM 0 HD3 PRO A 615 -11.142 -8.603 5.864 1.00 25.00 H new ATOM 503 N ASP A 616 -10.722 -13.054 4.729 1.00 25.00 N ATOM 504 CA ASP A 616 -10.507 -14.191 3.828 1.00 25.00 C ATOM 505 C ASP A 616 -9.448 -13.870 2.761 1.00 25.00 C ATOM 506 O ASP A 616 -9.593 -12.888 2.025 1.00 25.00 O ATOM 507 CB ASP A 616 -11.825 -14.590 3.145 1.00 25.00 C ATOM 508 CG ASP A 616 -11.741 -15.931 2.435 1.00 25.00 C ATOM 509 OD1 ASP A 616 -10.612 -16.391 2.168 1.00 25.00 O ATOM 510 OD2 ASP A 616 -12.806 -16.518 2.148 1.00 25.00 O ATOM 0 H ASP A 616 -11.243 -12.287 4.305 1.00 25.00 H new ATOM 0 HA ASP A 616 -10.145 -15.024 4.431 1.00 25.00 H new ATOM 0 HB2 ASP A 616 -12.618 -14.629 3.892 1.00 25.00 H new ATOM 0 HB3 ASP A 616 -12.103 -13.820 2.425 1.00 25.00 H new ATOM 515 N PRO A 617 -8.345 -14.688 2.664 1.00 25.00 N ATOM 516 CA PRO A 617 -7.326 -14.553 1.586 1.00 25.00 C ATOM 517 C PRO A 617 -7.886 -14.768 0.163 1.00 25.00 C ATOM 518 O PRO A 617 -7.195 -14.505 -0.826 1.00 25.00 O ATOM 519 CB PRO A 617 -6.305 -15.653 1.921 1.00 25.00 C ATOM 520 CG PRO A 617 -7.074 -16.674 2.687 1.00 25.00 C ATOM 521 CD PRO A 617 -7.963 -15.774 3.610 1.00 25.00 C ATOM 0 HA PRO A 617 -6.917 -13.543 1.565 1.00 25.00 H new ATOM 0 HB2 PRO A 617 -5.875 -16.081 1.016 1.00 25.00 H new ATOM 0 HB3 PRO A 617 -5.478 -15.257 2.511 1.00 25.00 H new ATOM 0 HG2 PRO A 617 -7.673 -17.310 2.035 1.00 25.00 H new ATOM 0 HG3 PRO A 617 -6.422 -17.332 3.262 1.00 25.00 H new ATOM 0 HD2 PRO A 617 -8.831 -16.309 3.996 1.00 25.00 H new ATOM 0 HD3 PRO A 617 -7.413 -15.396 4.472 1.00 25.00 H new ATOM 529 N ALA A 618 -9.138 -15.249 0.077 1.00 25.00 N ATOM 530 CA ALA A 618 -9.794 -15.541 -1.207 1.00 25.00 C ATOM 531 C ALA A 618 -10.292 -14.271 -1.920 1.00 25.00 C ATOM 532 O ALA A 618 -10.720 -14.333 -3.078 1.00 25.00 O ATOM 533 CB ALA A 618 -10.948 -16.512 -0.987 1.00 25.00 C ATOM 0 H ALA A 618 -9.720 -15.445 0.891 1.00 25.00 H new ATOM 0 HA ALA A 618 -9.048 -15.995 -1.858 1.00 25.00 H new ATOM 0 HB1 ALA A 618 -11.431 -16.725 -1.941 1.00 25.00 H new ATOM 0 HB2 ALA A 618 -10.567 -17.439 -0.558 1.00 25.00 H new ATOM 0 HB3 ALA A 618 -11.673 -16.067 -0.305 1.00 25.00 H new ATOM 539 N ALA A 619 -10.222 -13.125 -1.224 1.00 25.00 N ATOM 540 CA ALA A 619 -10.629 -11.828 -1.788 1.00 25.00 C ATOM 541 C ALA A 619 -9.540 -11.221 -2.680 1.00 25.00 C ATOM 542 O ALA A 619 -9.778 -10.226 -3.376 1.00 25.00 O ATOM 543 CB ALA A 619 -10.967 -10.858 -0.666 1.00 25.00 C ATOM 0 H ALA A 619 -9.885 -13.071 -0.263 1.00 25.00 H new ATOM 0 HA ALA A 619 -11.508 -12.003 -2.408 1.00 25.00 H new ATOM 0 HB1 ALA A 619 -11.267 -9.900 -1.091 1.00 25.00 H new ATOM 0 HB2 ALA A 619 -11.785 -11.263 -0.069 1.00 25.00 H new ATOM 0 HB3 ALA A 619 -10.092 -10.715 -0.032 1.00 25.00 H new ATOM 549 N LEU A 620 -8.350 -11.835 -2.659 1.00 25.00 N ATOM 550 CA LEU A 620 -7.188 -11.334 -3.391 1.00 25.00 C ATOM 551 C LEU A 620 -7.180 -11.810 -4.857 1.00 25.00 C ATOM 552 O LEU A 620 -6.267 -11.473 -5.619 1.00 25.00 O ATOM 553 CB LEU A 620 -5.889 -11.791 -2.681 1.00 25.00 C ATOM 554 CG LEU A 620 -5.547 -11.173 -1.293 1.00 25.00 C ATOM 555 CD1 LEU A 620 -4.422 -11.932 -0.596 1.00 25.00 C ATOM 556 CD2 LEU A 620 -5.200 -9.691 -1.396 1.00 25.00 C ATOM 0 H LEU A 620 -8.170 -12.691 -2.134 1.00 25.00 H new ATOM 0 HA LEU A 620 -7.244 -10.245 -3.400 1.00 25.00 H new ATOM 0 HB2 LEU A 620 -5.940 -12.873 -2.559 1.00 25.00 H new ATOM 0 HB3 LEU A 620 -5.054 -11.585 -3.351 1.00 25.00 H new ATOM 0 HG LEU A 620 -6.448 -11.266 -0.686 1.00 25.00 H new ATOM 0 HD11 LEU A 620 -4.214 -11.469 0.369 1.00 25.00 H new ATOM 0 HD12 LEU A 620 -4.722 -12.969 -0.444 1.00 25.00 H new ATOM 0 HD13 LEU A 620 -3.525 -11.901 -1.214 1.00 25.00 H new ATOM 0 HD21 LEU A 620 -4.968 -9.302 -0.405 1.00 25.00 H new ATOM 0 HD22 LEU A 620 -4.335 -9.564 -2.047 1.00 25.00 H new ATOM 0 HD23 LEU A 620 -6.049 -9.147 -1.810 1.00 25.00 H new ATOM 568 N LYS A 621 -8.209 -12.581 -5.238 1.00 25.00 N ATOM 569 CA LYS A 621 -8.325 -13.126 -6.596 1.00 25.00 C ATOM 570 C LYS A 621 -9.403 -12.365 -7.395 1.00 25.00 C ATOM 571 O LYS A 621 -9.837 -12.810 -8.464 1.00 25.00 O ATOM 572 CB LYS A 621 -8.648 -14.637 -6.516 1.00 25.00 C ATOM 573 CG LYS A 621 -7.575 -15.514 -5.854 1.00 25.00 C ATOM 574 CD LYS A 621 -7.958 -16.988 -5.820 1.00 25.00 C ATOM 575 CE LYS A 621 -6.896 -17.798 -5.118 1.00 25.00 C ATOM 576 NZ LYS A 621 -7.264 -19.237 -5.016 1.00 25.00 N ATOM 0 H LYS A 621 -8.977 -12.842 -4.619 1.00 25.00 H new ATOM 0 HA LYS A 621 -7.378 -12.998 -7.120 1.00 25.00 H new ATOM 0 HB2 LYS A 621 -9.582 -14.761 -5.968 1.00 25.00 H new ATOM 0 HB3 LYS A 621 -8.820 -15.007 -7.527 1.00 25.00 H new ATOM 0 HG2 LYS A 621 -6.635 -15.400 -6.393 1.00 25.00 H new ATOM 0 HG3 LYS A 621 -7.403 -15.164 -4.836 1.00 25.00 H new ATOM 0 HD2 LYS A 621 -8.913 -17.109 -5.308 1.00 25.00 H new ATOM 0 HD3 LYS A 621 -8.092 -17.358 -6.837 1.00 25.00 H new ATOM 0 HE2 LYS A 621 -5.953 -17.703 -5.657 1.00 25.00 H new ATOM 0 HE3 LYS A 621 -6.734 -17.394 -4.119 1.00 25.00 H new ATOM 0 HZ1 LYS A 621 -6.506 -19.755 -4.527 1.00 25.00 H new ATOM 0 HZ2 LYS A 621 -8.150 -19.332 -4.480 1.00 25.00 H new ATOM 0 HZ3 LYS A 621 -7.393 -19.631 -5.970 1.00 25.00 H new ATOM 590 N ASP A 622 -9.811 -11.202 -6.866 1.00 25.00 N ATOM 591 CA ASP A 622 -10.862 -10.382 -7.472 1.00 25.00 C ATOM 592 C ASP A 622 -10.266 -9.387 -8.481 1.00 25.00 C ATOM 593 O ASP A 622 -9.083 -9.040 -8.405 1.00 25.00 O ATOM 594 CB ASP A 622 -11.629 -9.643 -6.364 1.00 25.00 C ATOM 595 CG ASP A 622 -12.810 -8.841 -6.888 1.00 25.00 C ATOM 596 OD1 ASP A 622 -13.345 -9.202 -7.958 1.00 25.00 O ATOM 597 OD2 ASP A 622 -13.198 -7.854 -6.229 1.00 25.00 O ATOM 0 H ASP A 622 -9.422 -10.808 -6.010 1.00 25.00 H new ATOM 0 HA ASP A 622 -11.551 -11.028 -8.016 1.00 25.00 H new ATOM 0 HB2 ASP A 622 -11.986 -10.368 -5.632 1.00 25.00 H new ATOM 0 HB3 ASP A 622 -10.946 -8.973 -5.842 1.00 25.00 H new ATOM 602 N ARG A 623 -11.115 -8.937 -9.419 1.00 25.00 N ATOM 603 CA ARG A 623 -10.702 -8.045 -10.521 1.00 25.00 C ATOM 604 C ARG A 623 -10.592 -6.604 -10.040 1.00 25.00 C ATOM 605 O ARG A 623 -9.699 -5.863 -10.454 1.00 25.00 O ATOM 606 CB ARG A 623 -11.717 -8.099 -11.678 1.00 25.00 C ATOM 607 CG ARG A 623 -11.781 -9.439 -12.385 1.00 25.00 C ATOM 608 CD ARG A 623 -10.677 -9.594 -13.425 1.00 25.00 C ATOM 609 NE ARG A 623 -9.403 -10.002 -12.819 1.00 25.00 N ATOM 610 CZ ARG A 623 -9.137 -11.232 -12.349 1.00 25.00 C ATOM 611 NH1 ARG A 623 -10.040 -12.207 -12.414 1.00 25.00 N ATOM 612 NH2 ARG A 623 -7.949 -11.482 -11.815 1.00 25.00 N ATOM 0 H ARG A 623 -12.106 -9.179 -9.437 1.00 25.00 H new ATOM 0 HA ARG A 623 -9.729 -8.390 -10.870 1.00 25.00 H new ATOM 0 HB2 ARG A 623 -12.707 -7.858 -11.290 1.00 25.00 H new ATOM 0 HB3 ARG A 623 -11.463 -7.328 -12.406 1.00 25.00 H new ATOM 0 HG2 ARG A 623 -11.701 -10.240 -11.650 1.00 25.00 H new ATOM 0 HG3 ARG A 623 -12.752 -9.547 -12.869 1.00 25.00 H new ATOM 0 HD2 ARG A 623 -10.979 -10.334 -14.167 1.00 25.00 H new ATOM 0 HD3 ARG A 623 -10.541 -8.650 -13.953 1.00 25.00 H new ATOM 0 HE ARG A 623 -8.666 -9.300 -12.750 1.00 25.00 H new ATOM 0 HH11 ARG A 623 -10.955 -12.028 -12.827 1.00 25.00 H new ATOM 0 HH12 ARG A 623 -9.817 -13.134 -12.051 1.00 25.00 H new ATOM 0 HH21 ARG A 623 -7.247 -10.744 -11.764 1.00 25.00 H new ATOM 0 HH22 ARG A 623 -7.737 -12.413 -11.455 1.00 25.00 H new ATOM 626 N ARG A 624 -11.533 -6.227 -9.167 1.00 25.00 N ATOM 627 CA ARG A 624 -11.597 -4.872 -8.586 1.00 25.00 C ATOM 628 C ARG A 624 -10.446 -4.600 -7.605 1.00 25.00 C ATOM 629 O ARG A 624 -10.042 -3.448 -7.423 1.00 25.00 O ATOM 630 CB ARG A 624 -12.943 -4.657 -7.864 1.00 25.00 C ATOM 631 CG ARG A 624 -14.171 -4.590 -8.779 1.00 25.00 C ATOM 632 CD ARG A 624 -14.081 -3.455 -9.798 1.00 25.00 C ATOM 633 NE ARG A 624 -14.095 -2.137 -9.151 1.00 25.00 N ATOM 634 CZ ARG A 624 -15.171 -1.340 -9.062 1.00 25.00 C ATOM 635 NH1 ARG A 624 -16.347 -1.707 -9.571 1.00 25.00 N ATOM 636 NH2 ARG A 624 -15.065 -0.165 -8.457 1.00 25.00 N ATOM 0 H ARG A 624 -12.273 -6.849 -8.841 1.00 25.00 H new ATOM 0 HA ARG A 624 -11.504 -4.171 -9.416 1.00 25.00 H new ATOM 0 HB2 ARG A 624 -13.087 -5.467 -7.149 1.00 25.00 H new ATOM 0 HB3 ARG A 624 -12.886 -3.732 -7.291 1.00 25.00 H new ATOM 0 HG2 ARG A 624 -14.280 -5.538 -9.305 1.00 25.00 H new ATOM 0 HG3 ARG A 624 -15.066 -4.458 -8.171 1.00 25.00 H new ATOM 0 HD2 ARG A 624 -13.167 -3.563 -10.382 1.00 25.00 H new ATOM 0 HD3 ARG A 624 -14.916 -3.526 -10.496 1.00 25.00 H new ATOM 0 HE ARG A 624 -13.224 -1.803 -8.739 1.00 25.00 H new ATOM 0 HH11 ARG A 624 -16.441 -2.608 -10.039 1.00 25.00 H new ATOM 0 HH12 ARG A 624 -17.153 -1.086 -9.493 1.00 25.00 H new ATOM 0 HH21 ARG A 624 -14.170 0.127 -8.064 1.00 25.00 H new ATOM 0 HH22 ARG A 624 -15.878 0.447 -8.385 1.00 25.00 H new ATOM 650 N MET A 625 -9.927 -5.668 -6.984 1.00 25.00 N ATOM 651 CA MET A 625 -8.855 -5.555 -5.989 1.00 25.00 C ATOM 652 C MET A 625 -7.468 -5.641 -6.644 1.00 25.00 C ATOM 653 O MET A 625 -6.536 -4.949 -6.223 1.00 25.00 O ATOM 654 CB MET A 625 -9.006 -6.661 -4.935 1.00 25.00 C ATOM 655 CG MET A 625 -8.073 -6.515 -3.731 1.00 25.00 C ATOM 656 SD MET A 625 -8.283 -7.839 -2.524 1.00 25.00 S ATOM 657 CE MET A 625 -9.732 -7.275 -1.641 1.00 25.00 C ATOM 0 H MET A 625 -10.235 -6.625 -7.156 1.00 25.00 H new ATOM 0 HA MET A 625 -8.939 -4.579 -5.511 1.00 25.00 H new ATOM 0 HB2 MET A 625 -10.037 -6.672 -4.582 1.00 25.00 H new ATOM 0 HB3 MET A 625 -8.821 -7.625 -5.408 1.00 25.00 H new ATOM 0 HG2 MET A 625 -7.039 -6.504 -4.077 1.00 25.00 H new ATOM 0 HG3 MET A 625 -8.257 -5.556 -3.248 1.00 25.00 H new ATOM 0 HE1 MET A 625 -9.782 -7.769 -0.671 1.00 25.00 H new ATOM 0 HE2 MET A 625 -9.673 -6.196 -1.497 1.00 25.00 H new ATOM 0 HE3 MET A 625 -10.626 -7.516 -2.217 1.00 25.00 H new ATOM 667 N GLU A 626 -7.350 -6.503 -7.667 1.00 25.00 N ATOM 668 CA GLU A 626 -6.080 -6.749 -8.377 1.00 25.00 C ATOM 669 C GLU A 626 -5.457 -5.453 -8.953 1.00 25.00 C ATOM 670 O GLU A 626 -4.249 -5.400 -9.193 1.00 25.00 O ATOM 671 CB GLU A 626 -6.308 -7.785 -9.496 1.00 25.00 C ATOM 672 CG GLU A 626 -5.030 -8.284 -10.186 1.00 25.00 C ATOM 673 CD GLU A 626 -5.282 -9.339 -11.251 1.00 25.00 C ATOM 674 OE1 GLU A 626 -6.204 -9.147 -12.071 1.00 25.00 O ATOM 675 OE2 GLU A 626 -4.554 -10.354 -11.268 1.00 25.00 O ATOM 0 H GLU A 626 -8.132 -7.050 -8.027 1.00 25.00 H new ATOM 0 HA GLU A 626 -5.366 -7.139 -7.651 1.00 25.00 H new ATOM 0 HB2 GLU A 626 -6.835 -8.642 -9.076 1.00 25.00 H new ATOM 0 HB3 GLU A 626 -6.962 -7.346 -10.249 1.00 25.00 H new ATOM 0 HG2 GLU A 626 -4.519 -7.436 -10.641 1.00 25.00 H new ATOM 0 HG3 GLU A 626 -4.358 -8.694 -9.433 1.00 25.00 H new ATOM 682 N ASN A 627 -6.288 -4.414 -9.146 1.00 25.00 N ATOM 683 CA ASN A 627 -5.819 -3.113 -9.655 1.00 25.00 C ATOM 684 C ASN A 627 -5.025 -2.331 -8.597 1.00 25.00 C ATOM 685 O ASN A 627 -4.075 -1.619 -8.935 1.00 25.00 O ATOM 686 CB ASN A 627 -7.000 -2.265 -10.149 1.00 25.00 C ATOM 687 CG ASN A 627 -7.617 -2.799 -11.429 1.00 25.00 C ATOM 688 OD1 ASN A 627 -6.970 -3.517 -12.191 1.00 25.00 O ATOM 689 ND2 ASN A 627 -8.875 -2.448 -11.672 1.00 25.00 N ATOM 0 H ASN A 627 -7.290 -4.450 -8.957 1.00 25.00 H new ATOM 0 HA ASN A 627 -5.150 -3.322 -10.490 1.00 25.00 H new ATOM 0 HB2 ASN A 627 -7.764 -2.227 -9.372 1.00 25.00 H new ATOM 0 HB3 ASN A 627 -6.662 -1.242 -10.314 1.00 25.00 H new ATOM 0 HD21 ASN A 627 -9.342 -2.776 -12.518 1.00 25.00 H new ATOM 0 HD22 ASN A 627 -9.374 -1.851 -11.013 1.00 25.00 H new ATOM 696 N LEU A 628 -5.421 -2.470 -7.321 1.00 25.00 N ATOM 697 CA LEU A 628 -4.723 -1.809 -6.209 1.00 25.00 C ATOM 698 C LEU A 628 -3.546 -2.677 -5.720 1.00 25.00 C ATOM 699 O LEU A 628 -2.526 -2.151 -5.269 1.00 25.00 O ATOM 700 CB LEU A 628 -5.743 -1.410 -5.088 1.00 25.00 C ATOM 701 CG LEU A 628 -6.843 -0.360 -5.388 1.00 25.00 C ATOM 702 CD1 LEU A 628 -7.849 -0.241 -4.257 1.00 25.00 C ATOM 703 CD2 LEU A 628 -6.222 1.002 -5.617 1.00 25.00 C ATOM 0 H LEU A 628 -6.221 -3.035 -7.035 1.00 25.00 H new ATOM 0 HA LEU A 628 -4.276 -0.875 -6.549 1.00 25.00 H new ATOM 0 HB2 LEU A 628 -6.244 -2.322 -4.764 1.00 25.00 H new ATOM 0 HB3 LEU A 628 -5.166 -1.044 -4.239 1.00 25.00 H new ATOM 0 HG LEU A 628 -7.363 -0.702 -6.283 1.00 25.00 H new ATOM 0 HD11 LEU A 628 -8.599 0.507 -4.514 1.00 25.00 H new ATOM 0 HD12 LEU A 628 -8.335 -1.204 -4.100 1.00 25.00 H new ATOM 0 HD13 LEU A 628 -7.336 0.060 -3.344 1.00 25.00 H new ATOM 0 HD21 LEU A 628 -7.007 1.729 -5.827 1.00 25.00 H new ATOM 0 HD22 LEU A 628 -5.674 1.306 -4.725 1.00 25.00 H new ATOM 0 HD23 LEU A 628 -5.538 0.952 -6.464 1.00 25.00 H new ATOM 715 N VAL A 629 -3.700 -4.010 -5.827 1.00 25.00 N ATOM 716 CA VAL A 629 -2.606 -4.972 -5.570 1.00 25.00 C ATOM 717 C VAL A 629 -1.426 -4.707 -6.525 1.00 25.00 C ATOM 718 O VAL A 629 -0.260 -4.873 -6.155 1.00 25.00 O ATOM 719 CB VAL A 629 -3.120 -6.441 -5.736 1.00 25.00 C ATOM 720 CG1 VAL A 629 -1.992 -7.478 -5.774 1.00 25.00 C ATOM 721 CG2 VAL A 629 -4.107 -6.789 -4.627 1.00 25.00 C ATOM 0 H VAL A 629 -4.581 -4.451 -6.092 1.00 25.00 H new ATOM 0 HA VAL A 629 -2.261 -4.839 -4.544 1.00 25.00 H new ATOM 0 HB VAL A 629 -3.619 -6.481 -6.704 1.00 25.00 H new ATOM 0 HG11 VAL A 629 -2.418 -8.475 -5.891 1.00 25.00 H new ATOM 0 HG12 VAL A 629 -1.330 -7.265 -6.614 1.00 25.00 H new ATOM 0 HG13 VAL A 629 -1.424 -7.432 -4.845 1.00 25.00 H new ATOM 0 HG21 VAL A 629 -4.454 -7.814 -4.758 1.00 25.00 H new ATOM 0 HG22 VAL A 629 -3.615 -6.693 -3.659 1.00 25.00 H new ATOM 0 HG23 VAL A 629 -4.958 -6.109 -4.671 1.00 25.00 H new ATOM 731 N ALA A 630 -1.766 -4.287 -7.747 1.00 25.00 N ATOM 732 CA ALA A 630 -0.786 -3.977 -8.782 1.00 25.00 C ATOM 733 C ALA A 630 -0.151 -2.597 -8.570 1.00 25.00 C ATOM 734 O ALA A 630 0.918 -2.307 -9.117 1.00 25.00 O ATOM 735 CB ALA A 630 -1.457 -4.075 -10.139 1.00 25.00 C ATOM 0 H ALA A 630 -2.733 -4.153 -8.043 1.00 25.00 H new ATOM 0 HA ALA A 630 0.028 -4.700 -8.728 1.00 25.00 H new ATOM 0 HB1 ALA A 630 -0.733 -3.845 -10.920 1.00 25.00 H new ATOM 0 HB2 ALA A 630 -1.839 -5.086 -10.284 1.00 25.00 H new ATOM 0 HB3 ALA A 630 -2.282 -3.365 -10.189 1.00 25.00 H new ATOM 741 N TYR A 631 -0.824 -1.753 -7.770 1.00 25.00 N ATOM 742 CA TYR A 631 -0.272 -0.465 -7.340 1.00 25.00 C ATOM 743 C TYR A 631 0.736 -0.676 -6.192 1.00 25.00 C ATOM 744 O TYR A 631 1.764 0.001 -6.133 1.00 25.00 O ATOM 745 CB TYR A 631 -1.433 0.511 -6.952 1.00 25.00 C ATOM 746 CG TYR A 631 -1.086 2.000 -6.904 1.00 25.00 C ATOM 747 CD1 TYR A 631 -1.371 2.837 -7.982 1.00 25.00 C ATOM 748 CD2 TYR A 631 -0.496 2.567 -5.775 1.00 25.00 C ATOM 749 CE1 TYR A 631 -1.081 4.186 -7.930 1.00 25.00 C ATOM 750 CE2 TYR A 631 -0.204 3.914 -5.724 1.00 25.00 C ATOM 751 CZ TYR A 631 -0.409 4.698 -6.830 1.00 25.00 C ATOM 752 OH TYR A 631 -0.213 6.063 -6.752 1.00 25.00 O ATOM 0 H TYR A 631 -1.758 -1.945 -7.408 1.00 25.00 H new ATOM 0 HA TYR A 631 0.275 -0.004 -8.162 1.00 25.00 H new ATOM 0 HB2 TYR A 631 -2.247 0.373 -7.664 1.00 25.00 H new ATOM 0 HB3 TYR A 631 -1.813 0.218 -5.973 1.00 25.00 H new ATOM 0 HD1 TYR A 631 -1.825 2.424 -8.871 1.00 25.00 H new ATOM 0 HD2 TYR A 631 -0.264 1.941 -4.926 1.00 25.00 H new ATOM 0 HE1 TYR A 631 -1.375 4.837 -8.740 1.00 25.00 H new ATOM 0 HE2 TYR A 631 0.185 4.350 -4.816 1.00 25.00 H new ATOM 0 HH TYR A 631 0.271 6.277 -5.927 1.00 25.00 H new ATOM 762 N ALA A 632 0.424 -1.629 -5.300 1.00 25.00 N ATOM 763 CA ALA A 632 1.249 -1.906 -4.118 1.00 25.00 C ATOM 764 C ALA A 632 2.481 -2.753 -4.467 1.00 25.00 C ATOM 765 O ALA A 632 3.543 -2.590 -3.859 1.00 25.00 O ATOM 766 CB ALA A 632 0.429 -2.609 -3.058 1.00 25.00 C ATOM 0 H ALA A 632 -0.401 -2.224 -5.378 1.00 25.00 H new ATOM 0 HA ALA A 632 1.598 -0.948 -3.733 1.00 25.00 H new ATOM 0 HB1 ALA A 632 1.054 -2.808 -2.187 1.00 25.00 H new ATOM 0 HB2 ALA A 632 -0.409 -1.975 -2.766 1.00 25.00 H new ATOM 0 HB3 ALA A 632 0.050 -3.551 -3.456 1.00 25.00 H new ATOM 772 N LYS A 633 2.321 -3.658 -5.453 1.00 25.00 N ATOM 773 CA LYS A 633 3.399 -4.551 -5.911 1.00 25.00 C ATOM 774 C LYS A 633 4.556 -3.763 -6.556 1.00 25.00 C ATOM 775 O LYS A 633 5.716 -4.180 -6.497 1.00 25.00 O ATOM 776 CB LYS A 633 2.821 -5.564 -6.916 1.00 25.00 C ATOM 777 CG LYS A 633 2.188 -6.811 -6.294 1.00 25.00 C ATOM 778 CD LYS A 633 1.737 -7.817 -7.350 1.00 25.00 C ATOM 779 CE LYS A 633 1.208 -9.109 -6.734 1.00 25.00 C ATOM 780 NZ LYS A 633 0.235 -9.807 -7.623 1.00 25.00 N ATOM 0 H LYS A 633 1.441 -3.789 -5.952 1.00 25.00 H new ATOM 0 HA LYS A 633 3.805 -5.074 -5.045 1.00 25.00 H new ATOM 0 HB2 LYS A 633 2.070 -5.060 -7.524 1.00 25.00 H new ATOM 0 HB3 LYS A 633 3.618 -5.878 -7.590 1.00 25.00 H new ATOM 0 HG2 LYS A 633 2.906 -7.286 -5.626 1.00 25.00 H new ATOM 0 HG3 LYS A 633 1.332 -6.517 -5.686 1.00 25.00 H new ATOM 0 HD2 LYS A 633 0.960 -7.367 -7.968 1.00 25.00 H new ATOM 0 HD3 LYS A 633 2.574 -8.048 -8.009 1.00 25.00 H new ATOM 0 HE2 LYS A 633 2.044 -9.775 -6.521 1.00 25.00 H new ATOM 0 HE3 LYS A 633 0.729 -8.884 -5.781 1.00 25.00 H new ATOM 0 HZ1 LYS A 633 -0.095 -10.678 -7.160 1.00 25.00 H new ATOM 0 HZ2 LYS A 633 -0.577 -9.183 -7.806 1.00 25.00 H new ATOM 0 HZ3 LYS A 633 0.697 -10.047 -8.523 1.00 25.00 H new ATOM 794 N LYS A 634 4.205 -2.624 -7.168 1.00 25.00 N ATOM 795 CA LYS A 634 5.175 -1.677 -7.739 1.00 25.00 C ATOM 796 C LYS A 634 5.721 -0.747 -6.641 1.00 25.00 C ATOM 797 O LYS A 634 6.873 -0.311 -6.691 1.00 25.00 O ATOM 798 CB LYS A 634 4.481 -0.855 -8.851 1.00 25.00 C ATOM 799 CG LYS A 634 5.233 0.408 -9.298 1.00 25.00 C ATOM 800 CD LYS A 634 6.540 0.083 -10.025 1.00 25.00 C ATOM 801 CE LYS A 634 7.260 1.339 -10.530 1.00 25.00 C ATOM 802 NZ LYS A 634 8.654 1.050 -10.975 1.00 25.00 N ATOM 0 H LYS A 634 3.235 -2.331 -7.282 1.00 25.00 H new ATOM 0 HA LYS A 634 6.015 -2.225 -8.166 1.00 25.00 H new ATOM 0 HB2 LYS A 634 4.336 -1.498 -9.719 1.00 25.00 H new ATOM 0 HB3 LYS A 634 3.491 -0.564 -8.501 1.00 25.00 H new ATOM 0 HG2 LYS A 634 4.592 0.996 -9.955 1.00 25.00 H new ATOM 0 HG3 LYS A 634 5.449 1.026 -8.427 1.00 25.00 H new ATOM 0 HD2 LYS A 634 7.200 -0.464 -9.352 1.00 25.00 H new ATOM 0 HD3 LYS A 634 6.329 -0.575 -10.868 1.00 25.00 H new ATOM 0 HE2 LYS A 634 6.698 1.769 -11.359 1.00 25.00 H new ATOM 0 HE3 LYS A 634 7.281 2.087 -9.737 1.00 25.00 H new ATOM 0 HZ1 LYS A 634 8.910 1.690 -11.754 1.00 25.00 H new ATOM 0 HZ2 LYS A 634 9.309 1.193 -10.180 1.00 25.00 H new ATOM 0 HZ3 LYS A 634 8.717 0.065 -11.302 1.00 25.00 H new ATOM 816 N VAL A 635 4.866 -0.476 -5.655 1.00 25.00 N ATOM 817 CA VAL A 635 5.133 0.488 -4.589 1.00 25.00 C ATOM 818 C VAL A 635 6.170 -0.032 -3.567 1.00 25.00 C ATOM 819 O VAL A 635 6.782 0.758 -2.856 1.00 25.00 O ATOM 820 CB VAL A 635 3.758 0.895 -3.959 1.00 25.00 C ATOM 821 CG1 VAL A 635 3.665 0.800 -2.434 1.00 25.00 C ATOM 822 CG2 VAL A 635 3.382 2.290 -4.418 1.00 25.00 C ATOM 0 H VAL A 635 3.955 -0.927 -5.574 1.00 25.00 H new ATOM 0 HA VAL A 635 5.607 1.382 -4.995 1.00 25.00 H new ATOM 0 HB VAL A 635 3.050 0.150 -4.322 1.00 25.00 H new ATOM 0 HG11 VAL A 635 2.670 1.105 -2.110 1.00 25.00 H new ATOM 0 HG12 VAL A 635 3.848 -0.228 -2.122 1.00 25.00 H new ATOM 0 HG13 VAL A 635 4.410 1.455 -1.983 1.00 25.00 H new ATOM 0 HG21 VAL A 635 2.425 2.572 -3.979 1.00 25.00 H new ATOM 0 HG22 VAL A 635 4.149 2.997 -4.101 1.00 25.00 H new ATOM 0 HG23 VAL A 635 3.301 2.306 -5.505 1.00 25.00 H new ATOM 832 N GLU A 636 6.346 -1.355 -3.504 1.00 25.00 N ATOM 833 CA GLU A 636 7.359 -1.976 -2.636 1.00 25.00 C ATOM 834 C GLU A 636 8.747 -1.955 -3.314 1.00 25.00 C ATOM 835 O GLU A 636 9.773 -1.864 -2.634 1.00 25.00 O ATOM 836 CB GLU A 636 6.949 -3.433 -2.339 1.00 25.00 C ATOM 837 CG GLU A 636 7.803 -4.165 -1.296 1.00 25.00 C ATOM 838 CD GLU A 636 8.198 -3.308 -0.101 1.00 25.00 C ATOM 839 OE1 GLU A 636 7.292 -2.791 0.585 1.00 25.00 O ATOM 840 OE2 GLU A 636 9.411 -3.152 0.143 1.00 25.00 O ATOM 0 H GLU A 636 5.798 -2.023 -4.046 1.00 25.00 H new ATOM 0 HA GLU A 636 7.421 -1.410 -1.706 1.00 25.00 H new ATOM 0 HB2 GLU A 636 5.913 -3.438 -2.001 1.00 25.00 H new ATOM 0 HB3 GLU A 636 6.983 -3.998 -3.271 1.00 25.00 H new ATOM 0 HG2 GLU A 636 7.253 -5.036 -0.939 1.00 25.00 H new ATOM 0 HG3 GLU A 636 8.708 -4.535 -1.778 1.00 25.00 H new ATOM 847 N GLY A 637 8.754 -2.023 -4.658 1.00 25.00 N ATOM 848 CA GLY A 637 9.998 -2.159 -5.421 1.00 25.00 C ATOM 849 C GLY A 637 10.753 -0.851 -5.639 1.00 25.00 C ATOM 850 O GLY A 637 11.978 -0.865 -5.784 1.00 25.00 O ATOM 0 H GLY A 637 7.912 -1.986 -5.232 1.00 25.00 H new ATOM 0 HA2 GLY A 637 10.653 -2.860 -4.903 1.00 25.00 H new ATOM 0 HA3 GLY A 637 9.768 -2.597 -6.392 1.00 25.00 H new ATOM 854 N ASP A 638 10.025 0.276 -5.663 1.00 25.00 N ATOM 855 CA ASP A 638 10.633 1.608 -5.852 1.00 25.00 C ATOM 856 C ASP A 638 11.397 2.075 -4.603 1.00 25.00 C ATOM 857 O ASP A 638 12.246 2.968 -4.683 1.00 25.00 O ATOM 858 CB ASP A 638 9.562 2.642 -6.224 1.00 25.00 C ATOM 859 CG ASP A 638 9.044 2.466 -7.642 1.00 25.00 C ATOM 860 OD1 ASP A 638 9.654 1.686 -8.402 1.00 25.00 O ATOM 861 OD2 ASP A 638 8.034 3.109 -7.989 1.00 25.00 O ATOM 0 H ASP A 638 9.011 0.294 -5.554 1.00 25.00 H new ATOM 0 HA ASP A 638 11.349 1.520 -6.669 1.00 25.00 H new ATOM 0 HB2 ASP A 638 8.729 2.564 -5.525 1.00 25.00 H new ATOM 0 HB3 ASP A 638 9.977 3.644 -6.115 1.00 25.00 H new ATOM 866 N MET A 639 11.087 1.451 -3.459 1.00 25.00 N ATOM 867 CA MET A 639 11.738 1.760 -2.176 1.00 25.00 C ATOM 868 C MET A 639 13.152 1.176 -2.081 1.00 25.00 C ATOM 869 O MET A 639 13.968 1.638 -1.277 1.00 25.00 O ATOM 870 CB MET A 639 10.885 1.238 -1.023 1.00 25.00 C ATOM 871 CG MET A 639 9.578 1.978 -0.875 1.00 25.00 C ATOM 872 SD MET A 639 8.534 1.308 0.425 1.00 25.00 S ATOM 873 CE MET A 639 6.985 2.068 -0.019 1.00 25.00 C ATOM 0 H MET A 639 10.380 0.719 -3.395 1.00 25.00 H new ATOM 0 HA MET A 639 11.830 2.844 -2.113 1.00 25.00 H new ATOM 0 HB2 MET A 639 10.681 0.179 -1.180 1.00 25.00 H new ATOM 0 HB3 MET A 639 11.450 1.320 -0.094 1.00 25.00 H new ATOM 0 HG2 MET A 639 9.783 3.027 -0.664 1.00 25.00 H new ATOM 0 HG3 MET A 639 9.038 1.943 -1.821 1.00 25.00 H new ATOM 0 HE1 MET A 639 6.168 1.375 0.185 1.00 25.00 H new ATOM 0 HE2 MET A 639 6.845 2.977 0.566 1.00 25.00 H new ATOM 0 HE3 MET A 639 6.993 2.317 -1.080 1.00 25.00 H new ATOM 883 N TYR A 640 13.430 0.163 -2.913 1.00 25.00 N ATOM 884 CA TYR A 640 14.721 -0.537 -2.910 1.00 25.00 C ATOM 885 C TYR A 640 15.828 0.316 -3.554 1.00 25.00 C ATOM 886 O TYR A 640 17.004 0.186 -3.201 1.00 25.00 O ATOM 887 CB TYR A 640 14.583 -1.872 -3.657 1.00 25.00 C ATOM 888 CG TYR A 640 15.421 -1.969 -4.916 1.00 25.00 C ATOM 889 CD1 TYR A 640 16.786 -2.230 -4.839 1.00 25.00 C ATOM 890 CD2 TYR A 640 14.853 -1.808 -6.175 1.00 25.00 C ATOM 891 CE1 TYR A 640 17.558 -2.324 -5.979 1.00 25.00 C ATOM 892 CE2 TYR A 640 15.624 -1.900 -7.319 1.00 25.00 C ATOM 893 CZ TYR A 640 16.975 -2.159 -7.215 1.00 25.00 C ATOM 894 OH TYR A 640 17.747 -2.251 -8.350 1.00 25.00 O ATOM 0 H TYR A 640 12.769 -0.193 -3.604 1.00 25.00 H new ATOM 0 HA TYR A 640 15.006 -0.722 -1.874 1.00 25.00 H new ATOM 0 HB2 TYR A 640 14.863 -2.683 -2.984 1.00 25.00 H new ATOM 0 HB3 TYR A 640 13.536 -2.022 -3.919 1.00 25.00 H new ATOM 0 HD1 TYR A 640 17.248 -2.361 -3.872 1.00 25.00 H new ATOM 0 HD2 TYR A 640 13.795 -1.608 -6.260 1.00 25.00 H new ATOM 0 HE1 TYR A 640 18.616 -2.526 -5.902 1.00 25.00 H new ATOM 0 HE2 TYR A 640 15.170 -1.770 -8.290 1.00 25.00 H new ATOM 0 HH TYR A 640 17.185 -2.111 -9.140 1.00 25.00 H new ATOM 904 N GLU A 641 15.433 1.183 -4.497 1.00 25.00 N ATOM 905 CA GLU A 641 16.370 2.071 -5.202 1.00 25.00 C ATOM 906 C GLU A 641 16.564 3.407 -4.465 1.00 25.00 C ATOM 907 O GLU A 641 17.577 4.084 -4.664 1.00 25.00 O ATOM 908 CB GLU A 641 15.880 2.336 -6.633 1.00 25.00 C ATOM 909 CG GLU A 641 15.851 1.102 -7.517 1.00 25.00 C ATOM 910 CD GLU A 641 15.402 1.404 -8.935 1.00 25.00 C ATOM 911 OE1 GLU A 641 15.209 2.596 -9.255 1.00 25.00 O ATOM 912 OE2 GLU A 641 15.242 0.451 -9.723 1.00 25.00 O ATOM 0 H GLU A 641 14.462 1.289 -4.791 1.00 25.00 H new ATOM 0 HA GLU A 641 17.334 1.563 -5.233 1.00 25.00 H new ATOM 0 HB2 GLU A 641 14.878 2.762 -6.589 1.00 25.00 H new ATOM 0 HB3 GLU A 641 16.525 3.085 -7.094 1.00 25.00 H new ATOM 0 HG2 GLU A 641 16.845 0.656 -7.543 1.00 25.00 H new ATOM 0 HG3 GLU A 641 15.181 0.362 -7.079 1.00 25.00 H new ATOM 919 N SER A 642 15.592 3.772 -3.614 1.00 25.00 N ATOM 920 CA SER A 642 15.600 5.067 -2.919 1.00 25.00 C ATOM 921 C SER A 642 16.273 4.984 -1.542 1.00 25.00 C ATOM 922 O SER A 642 17.082 5.848 -1.194 1.00 25.00 O ATOM 923 CB SER A 642 14.169 5.595 -2.770 1.00 25.00 C ATOM 924 OG SER A 642 13.524 5.695 -4.027 1.00 25.00 O ATOM 0 H SER A 642 14.788 3.185 -3.391 1.00 25.00 H new ATOM 0 HA SER A 642 16.185 5.757 -3.528 1.00 25.00 H new ATOM 0 HB2 SER A 642 13.600 4.931 -2.119 1.00 25.00 H new ATOM 0 HB3 SER A 642 14.188 6.573 -2.290 1.00 25.00 H new ATOM 0 HG SER A 642 13.113 4.835 -4.253 1.00 25.00 H new ATOM 930 N ALA A 643 15.932 3.943 -0.765 1.00 25.00 N ATOM 931 CA ALA A 643 16.476 3.757 0.586 1.00 25.00 C ATOM 932 C ALA A 643 17.851 3.078 0.558 1.00 25.00 C ATOM 933 O ALA A 643 18.130 2.258 -0.322 1.00 25.00 O ATOM 934 CB ALA A 643 15.502 2.948 1.425 1.00 25.00 C ATOM 0 H ALA A 643 15.278 3.215 -1.053 1.00 25.00 H new ATOM 0 HA ALA A 643 16.610 4.742 1.034 1.00 25.00 H new ATOM 0 HB1 ALA A 643 15.910 2.813 2.427 1.00 25.00 H new ATOM 0 HB2 ALA A 643 14.551 3.476 1.489 1.00 25.00 H new ATOM 0 HB3 ALA A 643 15.345 1.974 0.962 1.00 25.00 H new ATOM 940 N ASN A 644 18.699 3.433 1.533 1.00 25.00 N ATOM 941 CA ASN A 644 20.068 2.909 1.620 1.00 25.00 C ATOM 942 C ASN A 644 20.203 1.870 2.748 1.00 25.00 C ATOM 943 O ASN A 644 21.159 1.087 2.761 1.00 25.00 O ATOM 944 CB ASN A 644 21.053 4.071 1.845 1.00 25.00 C ATOM 945 CG ASN A 644 21.213 4.974 0.627 1.00 25.00 C ATOM 946 OD1 ASN A 644 21.764 4.564 -0.395 1.00 25.00 O ATOM 947 ND2 ASN A 644 20.741 6.210 0.740 1.00 25.00 N ATOM 0 H ASN A 644 18.457 4.086 2.278 1.00 25.00 H new ATOM 0 HA ASN A 644 20.303 2.409 0.681 1.00 25.00 H new ATOM 0 HB2 ASN A 644 20.710 4.669 2.689 1.00 25.00 H new ATOM 0 HB3 ASN A 644 22.027 3.664 2.117 1.00 25.00 H new ATOM 0 HD21 ASN A 644 20.828 6.862 -0.039 1.00 25.00 H new ATOM 0 HD22 ASN A 644 20.291 6.507 1.606 1.00 25.00 H new ATOM 954 N SER A 645 19.240 1.865 3.679 1.00 25.00 N ATOM 955 CA SER A 645 19.282 0.974 4.842 1.00 25.00 C ATOM 956 C SER A 645 17.940 0.257 5.031 1.00 25.00 C ATOM 957 O SER A 645 16.920 0.673 4.474 1.00 25.00 O ATOM 958 CB SER A 645 19.647 1.770 6.108 1.00 25.00 C ATOM 959 OG SER A 645 18.702 2.794 6.371 1.00 25.00 O ATOM 0 H SER A 645 18.420 2.471 3.647 1.00 25.00 H new ATOM 0 HA SER A 645 20.048 0.219 4.667 1.00 25.00 H new ATOM 0 HB2 SER A 645 19.699 1.094 6.961 1.00 25.00 H new ATOM 0 HB3 SER A 645 20.637 2.210 5.989 1.00 25.00 H new ATOM 0 HG SER A 645 18.962 3.279 7.182 1.00 25.00 H new ATOM 965 N ARG A 646 17.961 -0.824 5.831 1.00 25.00 N ATOM 966 CA ARG A 646 16.788 -1.689 6.043 1.00 25.00 C ATOM 967 C ARG A 646 15.725 -1.011 6.924 1.00 25.00 C ATOM 968 O ARG A 646 14.531 -1.292 6.784 1.00 25.00 O ATOM 969 CB ARG A 646 17.238 -3.016 6.687 1.00 25.00 C ATOM 970 CG ARG A 646 16.125 -4.056 6.893 1.00 25.00 C ATOM 971 CD ARG A 646 16.621 -5.374 7.492 1.00 25.00 C ATOM 972 NE ARG A 646 17.128 -5.215 8.863 1.00 25.00 N ATOM 973 CZ ARG A 646 16.358 -5.108 9.959 1.00 25.00 C ATOM 974 NH1 ARG A 646 15.030 -5.142 9.873 1.00 25.00 N ATOM 975 NH2 ARG A 646 16.929 -4.966 11.147 1.00 25.00 N ATOM 0 H ARG A 646 18.789 -1.121 6.347 1.00 25.00 H new ATOM 0 HA ARG A 646 16.332 -1.881 5.072 1.00 25.00 H new ATOM 0 HB2 ARG A 646 18.015 -3.458 6.064 1.00 25.00 H new ATOM 0 HB3 ARG A 646 17.691 -2.797 7.654 1.00 25.00 H new ATOM 0 HG2 ARG A 646 15.362 -3.634 7.547 1.00 25.00 H new ATOM 0 HG3 ARG A 646 15.647 -4.259 5.935 1.00 25.00 H new ATOM 0 HD2 ARG A 646 15.807 -6.099 7.491 1.00 25.00 H new ATOM 0 HD3 ARG A 646 17.411 -5.781 6.861 1.00 25.00 H new ATOM 0 HE ARG A 646 18.139 -5.184 8.992 1.00 25.00 H new ATOM 0 HH11 ARG A 646 14.580 -5.251 8.964 1.00 25.00 H new ATOM 0 HH12 ARG A 646 14.462 -5.059 10.716 1.00 25.00 H new ATOM 0 HH21 ARG A 646 17.946 -4.939 11.224 1.00 25.00 H new ATOM 0 HH22 ARG A 646 16.352 -4.884 11.984 1.00 25.00 H new ATOM 989 N ASP A 647 16.171 -0.125 7.830 1.00 25.00 N ATOM 990 CA ASP A 647 15.265 0.617 8.725 1.00 25.00 C ATOM 991 C ASP A 647 14.644 1.835 8.028 1.00 25.00 C ATOM 992 O ASP A 647 13.571 2.300 8.426 1.00 25.00 O ATOM 993 CB ASP A 647 16.007 1.064 9.992 1.00 25.00 C ATOM 994 CG ASP A 647 16.365 -0.095 10.908 1.00 25.00 C ATOM 995 OD1 ASP A 647 15.821 -1.201 10.705 1.00 25.00 O ATOM 996 OD2 ASP A 647 17.187 0.106 11.826 1.00 25.00 O ATOM 0 H ASP A 647 17.158 0.096 7.963 1.00 25.00 H new ATOM 0 HA ASP A 647 14.457 -0.061 9.000 1.00 25.00 H new ATOM 0 HB2 ASP A 647 16.918 1.590 9.707 1.00 25.00 H new ATOM 0 HB3 ASP A 647 15.387 1.774 10.539 1.00 25.00 H new ATOM 1001 N GLU A 648 15.325 2.341 6.986 1.00 25.00 N ATOM 1002 CA GLU A 648 14.814 3.455 6.182 1.00 25.00 C ATOM 1003 C GLU A 648 13.890 2.921 5.082 1.00 25.00 C ATOM 1004 O GLU A 648 12.857 3.521 4.792 1.00 25.00 O ATOM 1005 CB GLU A 648 15.986 4.252 5.577 1.00 25.00 C ATOM 1006 CG GLU A 648 16.781 5.079 6.586 1.00 25.00 C ATOM 1007 CD GLU A 648 18.006 5.731 5.975 1.00 25.00 C ATOM 1008 OE1 GLU A 648 18.301 5.451 4.794 1.00 25.00 O ATOM 1009 OE2 GLU A 648 18.670 6.523 6.677 1.00 25.00 O ATOM 0 H GLU A 648 16.234 1.992 6.683 1.00 25.00 H new ATOM 0 HA GLU A 648 14.239 4.126 6.820 1.00 25.00 H new ATOM 0 HB2 GLU A 648 16.664 3.557 5.082 1.00 25.00 H new ATOM 0 HB3 GLU A 648 15.596 4.918 4.808 1.00 25.00 H new ATOM 0 HG2 GLU A 648 16.135 5.851 7.006 1.00 25.00 H new ATOM 0 HG3 GLU A 648 17.090 4.438 7.412 1.00 25.00 H new ATOM 1016 N TYR A 649 14.276 1.773 4.502 1.00 25.00 N ATOM 1017 CA TYR A 649 13.519 1.100 3.435 1.00 25.00 C ATOM 1018 C TYR A 649 12.063 0.818 3.857 1.00 25.00 C ATOM 1019 O TYR A 649 11.126 1.126 3.116 1.00 25.00 O ATOM 1020 CB TYR A 649 14.290 -0.192 3.033 1.00 25.00 C ATOM 1021 CG TYR A 649 13.570 -1.160 2.104 1.00 25.00 C ATOM 1022 CD1 TYR A 649 13.487 -0.888 0.746 1.00 25.00 C ATOM 1023 CD2 TYR A 649 12.987 -2.326 2.578 1.00 25.00 C ATOM 1024 CE1 TYR A 649 12.844 -1.745 -0.116 1.00 25.00 C ATOM 1025 CE2 TYR A 649 12.338 -3.195 1.720 1.00 25.00 C ATOM 1026 CZ TYR A 649 12.270 -2.900 0.373 1.00 25.00 C ATOM 1027 OH TYR A 649 11.626 -3.760 -0.487 1.00 25.00 O ATOM 0 H TYR A 649 15.131 1.282 4.763 1.00 25.00 H new ATOM 0 HA TYR A 649 13.442 1.752 2.565 1.00 25.00 H new ATOM 0 HB2 TYR A 649 15.225 0.104 2.557 1.00 25.00 H new ATOM 0 HB3 TYR A 649 14.553 -0.728 3.945 1.00 25.00 H new ATOM 0 HD1 TYR A 649 13.936 0.014 0.358 1.00 25.00 H new ATOM 0 HD2 TYR A 649 13.041 -2.558 3.631 1.00 25.00 H new ATOM 0 HE1 TYR A 649 12.789 -1.515 -1.170 1.00 25.00 H new ATOM 0 HE2 TYR A 649 11.887 -4.099 2.101 1.00 25.00 H new ATOM 0 HH TYR A 649 10.708 -3.905 -0.177 1.00 25.00 H new ATOM 1037 N TYR A 650 11.900 0.231 5.048 1.00 25.00 N ATOM 1038 CA TYR A 650 10.580 -0.078 5.604 1.00 25.00 C ATOM 1039 C TYR A 650 9.789 1.188 5.997 1.00 25.00 C ATOM 1040 O TYR A 650 8.570 1.124 6.189 1.00 25.00 O ATOM 1041 CB TYR A 650 10.735 -0.991 6.833 1.00 25.00 C ATOM 1042 CG TYR A 650 11.359 -2.353 6.539 1.00 25.00 C ATOM 1043 CD1 TYR A 650 11.889 -3.149 7.555 1.00 25.00 C ATOM 1044 CD2 TYR A 650 11.408 -2.843 5.240 1.00 25.00 C ATOM 1045 CE1 TYR A 650 12.441 -4.379 7.284 1.00 25.00 C ATOM 1046 CE2 TYR A 650 11.965 -4.077 4.961 1.00 25.00 C ATOM 1047 CZ TYR A 650 12.517 -4.832 6.022 1.00 25.00 C ATOM 1048 OH TYR A 650 13.030 -6.072 5.712 1.00 25.00 O ATOM 0 H TYR A 650 12.676 -0.042 5.651 1.00 25.00 H new ATOM 0 HA TYR A 650 10.013 -0.585 4.823 1.00 25.00 H new ATOM 0 HB2 TYR A 650 11.347 -0.478 7.575 1.00 25.00 H new ATOM 0 HB3 TYR A 650 9.753 -1.145 7.281 1.00 25.00 H new ATOM 0 HD1 TYR A 650 11.865 -2.792 8.574 1.00 25.00 H new ATOM 0 HD2 TYR A 650 11.004 -2.249 4.434 1.00 25.00 H new ATOM 0 HE1 TYR A 650 12.817 -4.987 8.094 1.00 25.00 H new ATOM 0 HE2 TYR A 650 11.978 -4.458 3.951 1.00 25.00 H new ATOM 0 HH TYR A 650 12.994 -6.208 4.742 1.00 25.00 H new ATOM 1058 N HIS A 651 10.485 2.331 6.102 1.00 25.00 N ATOM 1059 CA HIS A 651 9.878 3.576 6.591 1.00 25.00 C ATOM 1060 C HIS A 651 9.103 4.329 5.495 1.00 25.00 C ATOM 1061 O HIS A 651 8.192 5.098 5.814 1.00 25.00 O ATOM 1062 CB HIS A 651 10.963 4.478 7.210 1.00 25.00 C ATOM 1063 CG HIS A 651 10.874 4.627 8.706 1.00 25.00 C ATOM 1064 ND1 HIS A 651 11.762 4.027 9.576 1.00 25.00 N ATOM 1065 CD2 HIS A 651 9.986 5.297 9.483 1.00 25.00 C ATOM 1066 CE1 HIS A 651 11.425 4.320 10.819 1.00 25.00 C ATOM 1067 NE2 HIS A 651 10.351 5.090 10.790 1.00 25.00 N ATOM 0 H HIS A 651 11.471 2.417 5.854 1.00 25.00 H new ATOM 0 HA HIS A 651 9.149 3.306 7.355 1.00 25.00 H new ATOM 0 HB2 HIS A 651 11.943 4.073 6.956 1.00 25.00 H new ATOM 0 HB3 HIS A 651 10.899 5.466 6.755 1.00 25.00 H new ATOM 0 HD1 HIS A 651 12.555 3.447 9.302 1.00 25.00 H new ATOM 0 HD2 HIS A 651 9.148 5.884 9.137 1.00 25.00 H new ATOM 0 HE1 HIS A 651 11.940 3.987 11.708 1.00 25.00 H new ATOM 1076 N LEU A 652 9.457 4.114 4.214 1.00 25.00 N ATOM 1077 CA LEU A 652 8.737 4.733 3.100 1.00 25.00 C ATOM 1078 C LEU A 652 7.344 4.111 2.897 1.00 25.00 C ATOM 1079 O LEU A 652 6.414 4.800 2.467 1.00 25.00 O ATOM 1080 CB LEU A 652 9.539 4.609 1.790 1.00 25.00 C ATOM 1081 CG LEU A 652 10.891 5.356 1.652 1.00 25.00 C ATOM 1082 CD1 LEU A 652 11.655 4.976 0.387 1.00 25.00 C ATOM 1083 CD2 LEU A 652 10.710 6.864 1.753 1.00 25.00 C ATOM 0 H LEU A 652 10.235 3.518 3.932 1.00 25.00 H new ATOM 0 HA LEU A 652 8.613 5.785 3.356 1.00 25.00 H new ATOM 0 HB2 LEU A 652 9.732 3.549 1.624 1.00 25.00 H new ATOM 0 HB3 LEU A 652 8.894 4.947 0.978 1.00 25.00 H new ATOM 0 HG LEU A 652 11.503 5.031 2.493 1.00 25.00 H new ATOM 0 HD11 LEU A 652 12.592 5.531 0.347 1.00 25.00 H new ATOM 0 HD12 LEU A 652 11.867 3.907 0.397 1.00 25.00 H new ATOM 0 HD13 LEU A 652 11.052 5.218 -0.488 1.00 25.00 H new ATOM 0 HD21 LEU A 652 11.678 7.354 1.652 1.00 25.00 H new ATOM 0 HD22 LEU A 652 10.046 7.205 0.959 1.00 25.00 H new ATOM 0 HD23 LEU A 652 10.276 7.114 2.721 1.00 25.00 H new ATOM 1095 N LEU A 653 7.211 2.809 3.206 1.00 25.00 N ATOM 1096 CA LEU A 653 5.937 2.090 3.060 1.00 25.00 C ATOM 1097 C LEU A 653 5.053 2.247 4.304 1.00 25.00 C ATOM 1098 O LEU A 653 3.824 2.250 4.197 1.00 25.00 O ATOM 1099 CB LEU A 653 6.181 0.595 2.795 1.00 25.00 C ATOM 1100 CG LEU A 653 6.437 -0.302 4.021 1.00 25.00 C ATOM 1101 CD1 LEU A 653 5.333 -1.322 4.140 1.00 25.00 C ATOM 1102 CD2 LEU A 653 7.780 -1.017 3.941 1.00 25.00 C ATOM 0 H LEU A 653 7.975 2.233 3.560 1.00 25.00 H new ATOM 0 HA LEU A 653 5.418 2.530 2.208 1.00 25.00 H new ATOM 0 HB2 LEU A 653 5.316 0.200 2.262 1.00 25.00 H new ATOM 0 HB3 LEU A 653 7.036 0.505 2.126 1.00 25.00 H new ATOM 0 HG LEU A 653 6.456 0.342 4.900 1.00 25.00 H new ATOM 0 HD11 LEU A 653 5.515 -1.956 5.008 1.00 25.00 H new ATOM 0 HD12 LEU A 653 4.377 -0.812 4.258 1.00 25.00 H new ATOM 0 HD13 LEU A 653 5.307 -1.937 3.240 1.00 25.00 H new ATOM 0 HD21 LEU A 653 7.915 -1.637 4.827 1.00 25.00 H new ATOM 0 HD22 LEU A 653 7.805 -1.646 3.051 1.00 25.00 H new ATOM 0 HD23 LEU A 653 8.582 -0.280 3.888 1.00 25.00 H new ATOM 1114 N ALA A 654 5.691 2.381 5.480 1.00 25.00 N ATOM 1115 CA ALA A 654 4.978 2.538 6.759 1.00 25.00 C ATOM 1116 C ALA A 654 4.334 3.923 6.890 1.00 25.00 C ATOM 1117 O ALA A 654 3.314 4.073 7.570 1.00 25.00 O ATOM 1118 CB ALA A 654 5.924 2.289 7.923 1.00 25.00 C ATOM 0 H ALA A 654 6.707 2.384 5.570 1.00 25.00 H new ATOM 0 HA ALA A 654 4.177 1.799 6.779 1.00 25.00 H new ATOM 0 HB1 ALA A 654 5.384 2.408 8.862 1.00 25.00 H new ATOM 0 HB2 ALA A 654 6.321 1.276 7.859 1.00 25.00 H new ATOM 0 HB3 ALA A 654 6.746 3.004 7.883 1.00 25.00 H new ATOM 1124 N GLU A 655 4.937 4.929 6.233 1.00 25.00 N ATOM 1125 CA GLU A 655 4.401 6.301 6.244 1.00 25.00 C ATOM 1126 C GLU A 655 3.223 6.468 5.272 1.00 25.00 C ATOM 1127 O GLU A 655 2.381 7.338 5.477 1.00 25.00 O ATOM 1128 CB GLU A 655 5.510 7.342 5.967 1.00 25.00 C ATOM 1129 CG GLU A 655 6.499 7.564 7.113 1.00 25.00 C ATOM 1130 CD GLU A 655 7.572 8.579 6.769 1.00 25.00 C ATOM 1131 OE1 GLU A 655 7.555 9.101 5.633 1.00 25.00 O ATOM 1132 OE2 GLU A 655 8.432 8.851 7.633 1.00 25.00 O ATOM 0 H GLU A 655 5.793 4.818 5.689 1.00 25.00 H new ATOM 0 HA GLU A 655 4.016 6.484 7.247 1.00 25.00 H new ATOM 0 HB2 GLU A 655 6.067 7.029 5.084 1.00 25.00 H new ATOM 0 HB3 GLU A 655 5.039 8.295 5.726 1.00 25.00 H new ATOM 0 HG2 GLU A 655 5.956 7.900 7.996 1.00 25.00 H new ATOM 0 HG3 GLU A 655 6.970 6.615 7.370 1.00 25.00 H new ATOM 1139 N LYS A 656 3.176 5.633 4.217 1.00 25.00 N ATOM 1140 CA LYS A 656 1.986 5.532 3.347 1.00 25.00 C ATOM 1141 C LYS A 656 0.882 4.770 4.085 1.00 25.00 C ATOM 1142 O LYS A 656 -0.300 5.029 3.886 1.00 25.00 O ATOM 1143 CB LYS A 656 2.300 4.788 2.034 1.00 25.00 C ATOM 1144 CG LYS A 656 1.205 4.827 0.963 1.00 25.00 C ATOM 1145 CD LYS A 656 1.080 6.199 0.309 1.00 25.00 C ATOM 1146 CE LYS A 656 0.108 6.167 -0.862 1.00 25.00 C ATOM 1147 NZ LYS A 656 0.083 7.461 -1.599 1.00 25.00 N ATOM 0 H LYS A 656 3.945 5.020 3.946 1.00 25.00 H new ATOM 0 HA LYS A 656 1.666 6.545 3.104 1.00 25.00 H new ATOM 0 HB2 LYS A 656 3.211 5.209 1.610 1.00 25.00 H new ATOM 0 HB3 LYS A 656 2.512 3.745 2.272 1.00 25.00 H new ATOM 0 HG2 LYS A 656 1.422 4.081 0.198 1.00 25.00 H new ATOM 0 HG3 LYS A 656 0.251 4.554 1.413 1.00 25.00 H new ATOM 0 HD2 LYS A 656 0.740 6.926 1.047 1.00 25.00 H new ATOM 0 HD3 LYS A 656 2.059 6.530 -0.037 1.00 25.00 H new ATOM 0 HE2 LYS A 656 0.389 5.366 -1.545 1.00 25.00 H new ATOM 0 HE3 LYS A 656 -0.893 5.938 -0.497 1.00 25.00 H new ATOM 0 HZ1 LYS A 656 -0.780 7.515 -2.177 1.00 25.00 H new ATOM 0 HZ2 LYS A 656 0.094 8.248 -0.919 1.00 25.00 H new ATOM 0 HZ3 LYS A 656 0.918 7.525 -2.216 1.00 25.00 H new ATOM 1161 N ILE A 657 1.303 3.859 4.980 1.00 25.00 N ATOM 1162 CA ILE A 657 0.387 2.993 5.736 1.00 25.00 C ATOM 1163 C ILE A 657 -0.434 3.810 6.755 1.00 25.00 C ATOM 1164 O ILE A 657 -1.621 3.546 6.951 1.00 25.00 O ATOM 1165 CB ILE A 657 1.191 1.816 6.409 1.00 25.00 C ATOM 1166 CG1 ILE A 657 1.343 0.657 5.388 1.00 25.00 C ATOM 1167 CG2 ILE A 657 0.571 1.326 7.733 1.00 25.00 C ATOM 1168 CD1 ILE A 657 2.204 -0.523 5.837 1.00 25.00 C ATOM 0 H ILE A 657 2.287 3.704 5.198 1.00 25.00 H new ATOM 0 HA ILE A 657 -0.333 2.547 5.050 1.00 25.00 H new ATOM 0 HB ILE A 657 2.174 2.200 6.682 1.00 25.00 H new ATOM 0 HG12 ILE A 657 0.349 0.283 5.142 1.00 25.00 H new ATOM 0 HG13 ILE A 657 1.767 1.062 4.469 1.00 25.00 H new ATOM 0 HG21 ILE A 657 1.176 0.516 8.140 1.00 25.00 H new ATOM 0 HG22 ILE A 657 0.540 2.149 8.447 1.00 25.00 H new ATOM 0 HG23 ILE A 657 -0.441 0.966 7.549 1.00 25.00 H new ATOM 0 HD11 ILE A 657 2.238 -1.271 5.045 1.00 25.00 H new ATOM 0 HD12 ILE A 657 3.214 -0.175 6.052 1.00 25.00 H new ATOM 0 HD13 ILE A 657 1.774 -0.966 6.735 1.00 25.00 H new ATOM 1180 N TYR A 658 0.213 4.791 7.390 1.00 25.00 N ATOM 1181 CA TYR A 658 -0.455 5.672 8.352 1.00 25.00 C ATOM 1182 C TYR A 658 -1.157 6.829 7.623 1.00 25.00 C ATOM 1183 O TYR A 658 -2.139 7.389 8.119 1.00 25.00 O ATOM 1184 CB TYR A 658 0.575 6.216 9.354 1.00 25.00 C ATOM 1185 CG TYR A 658 1.087 5.187 10.353 1.00 25.00 C ATOM 1186 CD1 TYR A 658 2.387 4.700 10.272 1.00 25.00 C ATOM 1187 CD2 TYR A 658 0.270 4.702 11.370 1.00 25.00 C ATOM 1188 CE1 TYR A 658 2.857 3.763 11.173 1.00 25.00 C ATOM 1189 CE2 TYR A 658 0.733 3.765 12.273 1.00 25.00 C ATOM 1190 CZ TYR A 658 2.026 3.299 12.170 1.00 25.00 C ATOM 1191 OH TYR A 658 2.489 2.366 13.069 1.00 25.00 O ATOM 0 H TYR A 658 1.203 4.996 7.254 1.00 25.00 H new ATOM 0 HA TYR A 658 -1.211 5.101 8.892 1.00 25.00 H new ATOM 0 HB2 TYR A 658 1.423 6.620 8.801 1.00 25.00 H new ATOM 0 HB3 TYR A 658 0.127 7.045 9.902 1.00 25.00 H new ATOM 0 HD1 TYR A 658 3.041 5.060 9.491 1.00 25.00 H new ATOM 0 HD2 TYR A 658 -0.744 5.065 11.455 1.00 25.00 H new ATOM 0 HE1 TYR A 658 3.870 3.396 11.096 1.00 25.00 H new ATOM 0 HE2 TYR A 658 0.085 3.399 13.056 1.00 25.00 H new ATOM 0 HH TYR A 658 1.779 2.146 13.707 1.00 25.00 H new ATOM 1201 N LYS A 659 -0.631 7.160 6.439 1.00 25.00 N ATOM 1202 CA LYS A 659 -1.142 8.248 5.602 1.00 25.00 C ATOM 1203 C LYS A 659 -2.406 7.828 4.810 1.00 25.00 C ATOM 1204 O LYS A 659 -3.259 8.669 4.515 1.00 25.00 O ATOM 1205 CB LYS A 659 0.017 8.735 4.696 1.00 25.00 C ATOM 1206 CG LYS A 659 0.971 9.798 5.262 1.00 25.00 C ATOM 1207 CD LYS A 659 2.101 10.196 4.299 1.00 25.00 C ATOM 1208 CE LYS A 659 3.006 11.287 4.858 1.00 25.00 C ATOM 1209 NZ LYS A 659 4.067 11.718 3.900 1.00 25.00 N ATOM 0 H LYS A 659 0.169 6.675 6.032 1.00 25.00 H new ATOM 0 HA LYS A 659 -1.476 9.078 6.224 1.00 25.00 H new ATOM 0 HB2 LYS A 659 0.612 7.865 4.417 1.00 25.00 H new ATOM 0 HB3 LYS A 659 -0.419 9.131 3.779 1.00 25.00 H new ATOM 0 HG2 LYS A 659 0.396 10.688 5.520 1.00 25.00 H new ATOM 0 HG3 LYS A 659 1.410 9.423 6.187 1.00 25.00 H new ATOM 0 HD2 LYS A 659 2.702 9.316 4.070 1.00 25.00 H new ATOM 0 HD3 LYS A 659 1.666 10.539 3.360 1.00 25.00 H new ATOM 0 HE2 LYS A 659 2.399 12.150 5.130 1.00 25.00 H new ATOM 0 HE3 LYS A 659 3.476 10.927 5.773 1.00 25.00 H new ATOM 0 HZ1 LYS A 659 4.649 12.461 4.338 1.00 25.00 H new ATOM 0 HZ2 LYS A 659 4.668 10.904 3.659 1.00 25.00 H new ATOM 0 HZ3 LYS A 659 3.624 12.090 3.036 1.00 25.00 H new ATOM 1223 N ILE A 660 -2.515 6.531 4.480 1.00 25.00 N ATOM 1224 CA ILE A 660 -3.715 5.985 3.817 1.00 25.00 C ATOM 1225 C ILE A 660 -4.830 5.737 4.859 1.00 25.00 C ATOM 1226 O ILE A 660 -6.015 5.696 4.524 1.00 25.00 O ATOM 1227 CB ILE A 660 -3.378 4.673 3.029 1.00 25.00 C ATOM 1228 CG1 ILE A 660 -2.574 5.008 1.755 1.00 25.00 C ATOM 1229 CG2 ILE A 660 -4.649 3.899 2.661 1.00 25.00 C ATOM 1230 CD1 ILE A 660 -2.048 3.794 1.002 1.00 25.00 C ATOM 0 H ILE A 660 -1.788 5.839 4.661 1.00 25.00 H new ATOM 0 HA ILE A 660 -4.073 6.717 3.093 1.00 25.00 H new ATOM 0 HB ILE A 660 -2.774 4.039 3.678 1.00 25.00 H new ATOM 0 HG12 ILE A 660 -3.206 5.590 1.084 1.00 25.00 H new ATOM 0 HG13 ILE A 660 -1.731 5.643 2.029 1.00 25.00 H new ATOM 0 HG21 ILE A 660 -4.379 2.995 2.115 1.00 25.00 H new ATOM 0 HG22 ILE A 660 -5.186 3.628 3.570 1.00 25.00 H new ATOM 0 HG23 ILE A 660 -5.287 4.523 2.036 1.00 25.00 H new ATOM 0 HD11 ILE A 660 -1.496 4.123 0.122 1.00 25.00 H new ATOM 0 HD12 ILE A 660 -1.387 3.221 1.652 1.00 25.00 H new ATOM 0 HD13 ILE A 660 -2.884 3.167 0.692 1.00 25.00 H new ATOM 1242 N GLN A 661 -4.420 5.568 6.116 1.00 25.00 N ATOM 1243 CA GLN A 661 -5.348 5.448 7.248 1.00 25.00 C ATOM 1244 C GLN A 661 -6.049 6.783 7.562 1.00 25.00 C ATOM 1245 O GLN A 661 -7.095 6.801 8.218 1.00 25.00 O ATOM 1246 CB GLN A 661 -4.594 4.933 8.482 1.00 25.00 C ATOM 1247 CG GLN A 661 -4.328 3.423 8.471 1.00 25.00 C ATOM 1248 CD GLN A 661 -3.368 2.920 9.557 1.00 25.00 C ATOM 1249 OE1 GLN A 661 -2.761 3.723 10.267 1.00 25.00 O ATOM 1250 NE2 GLN A 661 -3.240 1.603 9.712 1.00 25.00 N ATOM 0 H GLN A 661 -3.437 5.510 6.381 1.00 25.00 H new ATOM 0 HA GLN A 661 -6.125 4.735 6.972 1.00 25.00 H new ATOM 0 HB2 GLN A 661 -3.642 5.458 8.557 1.00 25.00 H new ATOM 0 HB3 GLN A 661 -5.167 5.183 9.375 1.00 25.00 H new ATOM 0 HG2 GLN A 661 -5.279 2.902 8.580 1.00 25.00 H new ATOM 0 HG3 GLN A 661 -3.924 3.149 7.496 1.00 25.00 H new ATOM 0 HE21 GLN A 661 -3.757 0.966 9.107 1.00 25.00 H new ATOM 0 HE22 GLN A 661 -2.625 1.232 10.436 1.00 25.00 H new ATOM 1259 N LYS A 662 -5.459 7.891 7.080 1.00 25.00 N ATOM 1260 CA LYS A 662 -6.027 9.241 7.253 1.00 25.00 C ATOM 1261 C LYS A 662 -7.233 9.479 6.332 1.00 25.00 C ATOM 1262 O LYS A 662 -8.237 10.059 6.754 1.00 25.00 O ATOM 1263 CB LYS A 662 -4.969 10.320 6.962 1.00 25.00 C ATOM 1264 CG LYS A 662 -5.439 11.783 7.078 1.00 25.00 C ATOM 1265 CD LYS A 662 -4.460 12.811 6.498 1.00 25.00 C ATOM 1266 CE LYS A 662 -4.374 12.733 4.990 1.00 25.00 C ATOM 1267 NZ LYS A 662 -3.502 13.793 4.414 1.00 25.00 N ATOM 0 H LYS A 662 -4.580 7.877 6.562 1.00 25.00 H new ATOM 0 HA LYS A 662 -6.356 9.309 8.290 1.00 25.00 H new ATOM 0 HB2 LYS A 662 -4.133 10.173 7.646 1.00 25.00 H new ATOM 0 HB3 LYS A 662 -4.587 10.162 5.953 1.00 25.00 H new ATOM 0 HG2 LYS A 662 -6.398 11.885 6.569 1.00 25.00 H new ATOM 0 HG3 LYS A 662 -5.610 12.015 8.129 1.00 25.00 H new ATOM 0 HD2 LYS A 662 -4.773 13.813 6.791 1.00 25.00 H new ATOM 0 HD3 LYS A 662 -3.470 12.649 6.925 1.00 25.00 H new ATOM 0 HE2 LYS A 662 -3.990 11.755 4.701 1.00 25.00 H new ATOM 0 HE3 LYS A 662 -5.375 12.821 4.567 1.00 25.00 H new ATOM 0 HZ1 LYS A 662 -3.476 13.697 3.379 1.00 25.00 H new ATOM 0 HZ2 LYS A 662 -3.881 14.728 4.665 1.00 25.00 H new ATOM 0 HZ3 LYS A 662 -2.539 13.696 4.795 1.00 25.00 H new ATOM 1281 N GLU A 663 -7.114 9.021 5.076 1.00 25.00 N ATOM 1282 CA GLU A 663 -8.122 9.249 4.035 1.00 25.00 C ATOM 1283 C GLU A 663 -9.417 8.453 4.278 1.00 25.00 C ATOM 1284 O GLU A 663 -10.517 9.002 4.169 1.00 25.00 O ATOM 1285 CB GLU A 663 -7.508 8.930 2.658 1.00 25.00 C ATOM 1286 CG GLU A 663 -6.468 9.925 2.155 1.00 25.00 C ATOM 1287 CD GLU A 663 -5.791 9.478 0.877 1.00 25.00 C ATOM 1288 OE1 GLU A 663 -5.203 8.376 0.871 1.00 25.00 O ATOM 1289 OE2 GLU A 663 -5.858 10.225 -0.119 1.00 25.00 O ATOM 0 H GLU A 663 -6.311 8.480 4.755 1.00 25.00 H new ATOM 0 HA GLU A 663 -8.414 10.299 4.066 1.00 25.00 H new ATOM 0 HB2 GLU A 663 -7.048 7.943 2.705 1.00 25.00 H new ATOM 0 HB3 GLU A 663 -8.313 8.872 1.926 1.00 25.00 H new ATOM 0 HG2 GLU A 663 -6.947 10.890 1.988 1.00 25.00 H new ATOM 0 HG3 GLU A 663 -5.713 10.074 2.927 1.00 25.00 H new ATOM 1296 N LEU A 664 -9.266 7.157 4.599 1.00 25.00 N ATOM 1297 CA LEU A 664 -10.401 6.292 4.997 1.00 25.00 C ATOM 1298 C LEU A 664 -11.129 6.821 6.251 1.00 25.00 C ATOM 1299 O LEU A 664 -12.287 6.470 6.496 1.00 25.00 O ATOM 1300 CB LEU A 664 -9.932 4.843 5.282 1.00 25.00 C ATOM 1301 CG LEU A 664 -9.318 4.015 4.121 1.00 25.00 C ATOM 1302 CD1 LEU A 664 -8.744 2.687 4.606 1.00 25.00 C ATOM 1303 CD2 LEU A 664 -10.320 3.777 3.004 1.00 25.00 C ATOM 0 H LEU A 664 -8.365 6.679 4.592 1.00 25.00 H new ATOM 0 HA LEU A 664 -11.092 6.302 4.154 1.00 25.00 H new ATOM 0 HB2 LEU A 664 -9.194 4.886 6.083 1.00 25.00 H new ATOM 0 HB3 LEU A 664 -10.788 4.288 5.667 1.00 25.00 H new ATOM 0 HG LEU A 664 -8.498 4.612 3.722 1.00 25.00 H new ATOM 0 HD11 LEU A 664 -8.325 2.141 3.761 1.00 25.00 H new ATOM 0 HD12 LEU A 664 -7.961 2.876 5.340 1.00 25.00 H new ATOM 0 HD13 LEU A 664 -9.536 2.094 5.064 1.00 25.00 H new ATOM 0 HD21 LEU A 664 -9.850 3.194 2.212 1.00 25.00 H new ATOM 0 HD22 LEU A 664 -11.179 3.231 3.396 1.00 25.00 H new ATOM 0 HD23 LEU A 664 -10.651 4.735 2.602 1.00 25.00 H new ATOM 1315 N GLU A 665 -10.433 7.654 7.041 1.00 25.00 N ATOM 1316 CA GLU A 665 -10.996 8.237 8.264 1.00 25.00 C ATOM 1317 C GLU A 665 -11.769 9.536 7.953 1.00 25.00 C ATOM 1318 O GLU A 665 -12.593 9.978 8.759 1.00 25.00 O ATOM 1319 CB GLU A 665 -9.868 8.493 9.279 1.00 25.00 C ATOM 1320 CG GLU A 665 -9.644 7.363 10.284 1.00 25.00 C ATOM 1321 CD GLU A 665 -10.709 7.321 11.362 1.00 25.00 C ATOM 1322 OE1 GLU A 665 -11.159 8.403 11.795 1.00 25.00 O ATOM 1323 OE2 GLU A 665 -11.096 6.207 11.773 1.00 25.00 O ATOM 0 H GLU A 665 -9.472 7.939 6.850 1.00 25.00 H new ATOM 0 HA GLU A 665 -11.706 7.533 8.697 1.00 25.00 H new ATOM 0 HB2 GLU A 665 -8.940 8.666 8.734 1.00 25.00 H new ATOM 0 HB3 GLU A 665 -10.091 9.409 9.826 1.00 25.00 H new ATOM 0 HG2 GLU A 665 -9.629 6.410 9.756 1.00 25.00 H new ATOM 0 HG3 GLU A 665 -8.666 7.484 10.749 1.00 25.00 H new ATOM 1330 N GLU A 666 -11.496 10.129 6.779 1.00 25.00 N ATOM 1331 CA GLU A 666 -12.201 11.337 6.319 1.00 25.00 C ATOM 1332 C GLU A 666 -13.609 11.000 5.809 1.00 25.00 C ATOM 1333 O GLU A 666 -14.507 11.848 5.836 1.00 25.00 O ATOM 1334 CB GLU A 666 -11.402 12.043 5.214 1.00 25.00 C ATOM 1335 CG GLU A 666 -10.120 12.706 5.702 1.00 25.00 C ATOM 1336 CD GLU A 666 -10.377 13.782 6.738 1.00 25.00 C ATOM 1337 OE1 GLU A 666 -11.455 14.413 6.686 1.00 25.00 O ATOM 1338 OE2 GLU A 666 -9.502 13.994 7.604 1.00 25.00 O ATOM 0 H GLU A 666 -10.788 9.789 6.128 1.00 25.00 H new ATOM 0 HA GLU A 666 -12.296 12.007 7.173 1.00 25.00 H new ATOM 0 HB2 GLU A 666 -11.151 11.317 4.441 1.00 25.00 H new ATOM 0 HB3 GLU A 666 -12.035 12.799 4.749 1.00 25.00 H new ATOM 0 HG2 GLU A 666 -9.462 11.948 6.127 1.00 25.00 H new ATOM 0 HG3 GLU A 666 -9.595 13.143 4.852 1.00 25.00 H new ATOM 1345 N LYS A 667 -13.784 9.752 5.346 1.00 25.00 N ATOM 1346 CA LYS A 667 -15.088 9.245 4.900 1.00 25.00 C ATOM 1347 C LYS A 667 -15.904 8.682 6.082 1.00 25.00 C ATOM 1348 O LYS A 667 -17.125 8.525 5.988 1.00 25.00 O ATOM 1349 CB LYS A 667 -14.905 8.192 3.790 1.00 25.00 C ATOM 1350 CG LYS A 667 -14.166 8.707 2.560 1.00 25.00 C ATOM 1351 CD LYS A 667 -14.926 9.795 1.788 1.00 25.00 C ATOM 1352 CE LYS A 667 -14.196 10.295 0.541 1.00 25.00 C ATOM 1353 NZ LYS A 667 -13.079 11.235 0.850 1.00 25.00 N ATOM 0 H LYS A 667 -13.029 9.071 5.271 1.00 25.00 H new ATOM 0 HA LYS A 667 -15.655 10.079 4.485 1.00 25.00 H new ATOM 0 HB2 LYS A 667 -14.360 7.340 4.198 1.00 25.00 H new ATOM 0 HB3 LYS A 667 -15.886 7.827 3.485 1.00 25.00 H new ATOM 0 HG2 LYS A 667 -13.199 9.103 2.869 1.00 25.00 H new ATOM 0 HG3 LYS A 667 -13.969 7.870 1.890 1.00 25.00 H new ATOM 0 HD2 LYS A 667 -15.901 9.405 1.494 1.00 25.00 H new ATOM 0 HD3 LYS A 667 -15.108 10.639 2.453 1.00 25.00 H new ATOM 0 HE2 LYS A 667 -13.801 9.440 -0.008 1.00 25.00 H new ATOM 0 HE3 LYS A 667 -14.910 10.793 -0.115 1.00 25.00 H new ATOM 0 HZ1 LYS A 667 -12.625 11.537 -0.035 1.00 25.00 H new ATOM 0 HZ2 LYS A 667 -13.454 12.067 1.349 1.00 25.00 H new ATOM 0 HZ3 LYS A 667 -12.379 10.756 1.452 1.00 25.00 H new ATOM 1367 N ARG A 668 -15.201 8.390 7.191 1.00 25.00 N ATOM 1368 CA ARG A 668 -15.811 7.803 8.392 1.00 25.00 C ATOM 1369 C ARG A 668 -16.524 8.875 9.236 1.00 25.00 C ATOM 1370 O ARG A 668 -17.543 8.593 9.870 1.00 25.00 O ATOM 1371 CB ARG A 668 -14.727 7.099 9.227 1.00 25.00 C ATOM 1372 CG ARG A 668 -14.432 5.668 8.801 1.00 25.00 C ATOM 1373 CD ARG A 668 -13.313 5.086 9.642 1.00 25.00 C ATOM 1374 NE ARG A 668 -13.011 3.694 9.279 1.00 25.00 N ATOM 1375 CZ ARG A 668 -11.937 3.009 9.700 1.00 25.00 C ATOM 1376 NH1 ARG A 668 -11.027 3.570 10.496 1.00 25.00 N ATOM 1377 NH2 ARG A 668 -11.772 1.751 9.313 1.00 25.00 N ATOM 0 H ARG A 668 -14.198 8.554 7.277 1.00 25.00 H new ATOM 0 HA ARG A 668 -16.560 7.075 8.080 1.00 25.00 H new ATOM 0 HB2 ARG A 668 -13.806 7.679 9.167 1.00 25.00 H new ATOM 0 HB3 ARG A 668 -15.036 7.097 10.272 1.00 25.00 H new ATOM 0 HG2 ARG A 668 -15.329 5.058 8.906 1.00 25.00 H new ATOM 0 HG3 ARG A 668 -14.153 5.646 7.748 1.00 25.00 H new ATOM 0 HD2 ARG A 668 -12.416 5.694 9.521 1.00 25.00 H new ATOM 0 HD3 ARG A 668 -13.590 5.133 10.695 1.00 25.00 H new ATOM 0 HE ARG A 668 -13.666 3.214 8.662 1.00 25.00 H new ATOM 0 HH11 ARG A 668 -11.140 4.538 10.797 1.00 25.00 H new ATOM 0 HH12 ARG A 668 -10.218 3.031 10.805 1.00 25.00 H new ATOM 0 HH21 ARG A 668 -12.459 1.312 8.700 1.00 25.00 H new ATOM 0 HH22 ARG A 668 -10.958 1.223 9.628 1.00 25.00 H new ATOM 1391 N ARG A 669 -15.973 10.098 9.232 1.00 25.00 N ATOM 1392 CA ARG A 669 -16.535 11.220 9.993 1.00 25.00 C ATOM 1393 C ARG A 669 -17.532 12.032 9.141 1.00 25.00 C ATOM 1394 O ARG A 669 -18.232 12.907 9.660 1.00 25.00 O ATOM 1395 CB ARG A 669 -15.391 12.120 10.498 1.00 25.00 C ATOM 1396 CG ARG A 669 -14.461 11.458 11.507 1.00 25.00 C ATOM 1397 CD ARG A 669 -13.441 12.448 12.032 1.00 25.00 C ATOM 1398 NE ARG A 669 -12.476 12.846 11.002 1.00 25.00 N ATOM 1399 CZ ARG A 669 -11.248 12.325 10.859 1.00 25.00 C ATOM 1400 NH1 ARG A 669 -10.806 11.365 11.669 1.00 25.00 N ATOM 1401 NH2 ARG A 669 -10.456 12.771 9.892 1.00 25.00 N ATOM 0 H ARG A 669 -15.132 10.334 8.705 1.00 25.00 H new ATOM 0 HA ARG A 669 -17.085 10.823 10.846 1.00 25.00 H new ATOM 0 HB2 ARG A 669 -14.802 12.450 9.643 1.00 25.00 H new ATOM 0 HB3 ARG A 669 -15.822 13.012 10.952 1.00 25.00 H new ATOM 0 HG2 ARG A 669 -15.044 11.056 12.336 1.00 25.00 H new ATOM 0 HG3 ARG A 669 -13.950 10.617 11.039 1.00 25.00 H new ATOM 0 HD2 ARG A 669 -13.955 13.333 12.407 1.00 25.00 H new ATOM 0 HD3 ARG A 669 -12.909 12.007 12.875 1.00 25.00 H new ATOM 0 HE ARG A 669 -12.760 13.573 10.345 1.00 25.00 H new ATOM 0 HH11 ARG A 669 -11.405 11.012 12.416 1.00 25.00 H new ATOM 0 HH12 ARG A 669 -9.869 10.983 11.543 1.00 25.00 H new ATOM 0 HH21 ARG A 669 -10.782 13.505 9.264 1.00 25.00 H new ATOM 0 HH22 ARG A 669 -9.521 12.380 9.777 1.00 25.00 H new ATOM 1415 N SER A 670 -17.595 11.721 7.836 1.00 25.00 N ATOM 1416 CA SER A 670 -18.454 12.448 6.895 1.00 25.00 C ATOM 1417 C SER A 670 -19.853 11.822 6.792 1.00 25.00 C ATOM 1418 O SER A 670 -20.837 12.536 6.572 1.00 25.00 O ATOM 1419 CB SER A 670 -17.789 12.501 5.516 1.00 25.00 C ATOM 1420 OG SER A 670 -17.709 11.214 4.924 1.00 25.00 O ATOM 0 H SER A 670 -17.057 10.966 7.410 1.00 25.00 H new ATOM 0 HA SER A 670 -18.581 13.462 7.275 1.00 25.00 H new ATOM 0 HB2 SER A 670 -18.354 13.167 4.864 1.00 25.00 H new ATOM 0 HB3 SER A 670 -16.788 12.921 5.610 1.00 25.00 H new ATOM 0 HG SER A 670 -17.431 11.301 3.988 1.00 25.00 H new ATOM 1426 N ARG A 671 -19.933 10.493 6.954 1.00 25.00 N ATOM 1427 CA ARG A 671 -21.209 9.772 6.864 1.00 25.00 C ATOM 1428 C ARG A 671 -21.773 9.446 8.259 1.00 25.00 C ATOM 1429 O ARG A 671 -22.916 8.995 8.387 1.00 25.00 O ATOM 1430 CB ARG A 671 -21.031 8.504 6.026 1.00 25.00 C ATOM 1431 CG ARG A 671 -20.705 8.780 4.563 1.00 25.00 C ATOM 1432 CD ARG A 671 -20.459 7.496 3.805 1.00 25.00 C ATOM 1433 NE ARG A 671 -20.097 7.720 2.396 1.00 25.00 N ATOM 1434 CZ ARG A 671 -19.628 6.776 1.565 1.00 25.00 C ATOM 1435 NH1 ARG A 671 -19.451 5.520 1.977 1.00 25.00 N ATOM 1436 NH2 ARG A 671 -19.335 7.093 0.313 1.00 25.00 N ATOM 0 H ARG A 671 -19.129 9.897 7.148 1.00 25.00 H new ATOM 0 HA ARG A 671 -21.936 10.417 6.371 1.00 25.00 H new ATOM 0 HB2 ARG A 671 -20.233 7.901 6.460 1.00 25.00 H new ATOM 0 HB3 ARG A 671 -21.944 7.911 6.081 1.00 25.00 H new ATOM 0 HG2 ARG A 671 -21.528 9.326 4.101 1.00 25.00 H new ATOM 0 HG3 ARG A 671 -19.823 9.418 4.498 1.00 25.00 H new ATOM 0 HD2 ARG A 671 -19.661 6.938 4.295 1.00 25.00 H new ATOM 0 HD3 ARG A 671 -21.355 6.877 3.850 1.00 25.00 H new ATOM 0 HE ARG A 671 -20.211 8.663 2.023 1.00 25.00 H new ATOM 0 HH11 ARG A 671 -19.673 5.263 2.939 1.00 25.00 H new ATOM 0 HH12 ARG A 671 -19.094 4.817 1.330 1.00 25.00 H new ATOM 0 HH21 ARG A 671 -19.466 8.050 -0.015 1.00 25.00 H new ATOM 0 HH22 ARG A 671 -18.978 6.380 -0.323 1.00 25.00 H new ATOM 1450 N LEU A 672 -20.962 9.693 9.290 1.00 25.00 N ATOM 1451 CA LEU A 672 -21.363 9.463 10.682 1.00 25.00 C ATOM 1452 C LEU A 672 -21.396 10.781 11.462 1.00 25.00 C ATOM 1453 O LEU A 672 -22.510 11.297 11.693 1.00 25.00 O ATOM 1454 CB LEU A 672 -20.428 8.449 11.377 1.00 25.00 C ATOM 1455 CG LEU A 672 -20.403 7.024 10.788 1.00 25.00 C ATOM 1456 CD1 LEU A 672 -19.330 6.162 11.444 1.00 25.00 C ATOM 1457 CD2 LEU A 672 -21.768 6.370 10.933 1.00 25.00 C ATOM 1458 OXT LEU A 672 -20.313 11.295 11.819 1.00 25.00 O ATOM 0 H LEU A 672 -20.014 10.056 9.186 1.00 25.00 H new ATOM 0 HA LEU A 672 -22.368 9.040 10.670 1.00 25.00 H new ATOM 0 HB2 LEU A 672 -19.414 8.847 11.352 1.00 25.00 H new ATOM 0 HB3 LEU A 672 -20.718 8.380 12.426 1.00 25.00 H new ATOM 0 HG LEU A 672 -20.158 7.107 9.729 1.00 25.00 H new ATOM 0 HD11 LEU A 672 -19.344 5.166 11.002 1.00 25.00 H new ATOM 0 HD12 LEU A 672 -18.352 6.616 11.286 1.00 25.00 H new ATOM 0 HD13 LEU A 672 -19.527 6.088 12.514 1.00 25.00 H new ATOM 0 HD21 LEU A 672 -21.736 5.365 10.513 1.00 25.00 H new ATOM 0 HD22 LEU A 672 -22.034 6.314 11.988 1.00 25.00 H new ATOM 0 HD23 LEU A 672 -22.513 6.962 10.401 1.00 25.00 H new TER 1470 LEU A 672 ATOM 1471 N GLY B 519 21.769 18.616 7.932 1.00 25.00 N ATOM 1472 CA GLY B 519 21.448 18.115 6.567 1.00 25.00 C ATOM 1473 C GLY B 519 20.318 18.888 5.916 1.00 25.00 C ATOM 1474 O GLY B 519 20.498 20.044 5.525 1.00 25.00 O ATOM 0 HA2 GLY B 519 22.338 18.181 5.941 1.00 25.00 H new ATOM 0 HA3 GLY B 519 21.177 17.061 6.625 1.00 25.00 H new ATOM 1480 N SER B 520 19.153 18.239 5.801 1.00 25.00 N ATOM 1481 CA SER B 520 17.969 18.856 5.197 1.00 25.00 C ATOM 1482 C SER B 520 16.777 18.830 6.173 1.00 25.00 C ATOM 1483 O SER B 520 16.485 17.779 6.751 1.00 25.00 O ATOM 1484 CB SER B 520 17.596 18.134 3.897 1.00 25.00 C ATOM 1485 OG SER B 520 16.291 18.486 3.472 1.00 25.00 O ATOM 0 H SER B 520 19.006 17.282 6.121 1.00 25.00 H new ATOM 0 HA SER B 520 18.208 19.895 4.971 1.00 25.00 H new ATOM 0 HB2 SER B 520 18.316 18.387 3.118 1.00 25.00 H new ATOM 0 HB3 SER B 520 17.654 17.056 4.047 1.00 25.00 H new ATOM 0 HG SER B 520 16.079 18.013 2.640 1.00 25.00 H new ATOM 1491 N PRO B 521 16.065 19.990 6.378 1.00 25.00 N ATOM 1492 CA PRO B 521 14.925 20.066 7.323 1.00 25.00 C ATOM 1493 C PRO B 521 13.648 19.353 6.836 1.00 25.00 C ATOM 1494 O PRO B 521 12.772 19.027 7.643 1.00 25.00 O ATOM 1495 CB PRO B 521 14.687 21.577 7.456 1.00 25.00 C ATOM 1496 CG PRO B 521 15.219 22.157 6.200 1.00 25.00 C ATOM 1497 CD PRO B 521 16.319 21.315 5.739 1.00 25.00 C ATOM 0 HA PRO B 521 15.157 19.558 8.259 1.00 25.00 H new ATOM 0 HB2 PRO B 521 13.627 21.801 7.577 1.00 25.00 H new ATOM 0 HB3 PRO B 521 15.200 21.983 8.328 1.00 25.00 H new ATOM 0 HG2 PRO B 521 14.436 22.208 5.443 1.00 25.00 H new ATOM 0 HG3 PRO B 521 15.566 23.177 6.369 1.00 25.00 H new ATOM 0 HD2 PRO B 521 16.331 21.236 4.652 1.00 25.00 H new ATOM 0 HD3 PRO B 521 17.284 21.723 6.039 1.00 25.00 H new ATOM 1505 N GLY B 522 13.557 19.127 5.517 1.00 25.00 N ATOM 1506 CA GLY B 522 12.407 18.443 4.939 1.00 25.00 C ATOM 1507 C GLY B 522 11.567 19.348 4.057 1.00 25.00 C ATOM 1508 O GLY B 522 11.129 20.414 4.496 1.00 25.00 O ATOM 0 H GLY B 522 14.265 19.409 4.840 1.00 25.00 H new ATOM 0 HA2 GLY B 522 12.753 17.592 4.353 1.00 25.00 H new ATOM 0 HA3 GLY B 522 11.785 18.046 5.741 1.00 25.00 H new ATOM 1512 N TYR B 523 11.349 18.916 2.807 1.00 25.00 N ATOM 1513 CA TYR B 523 10.541 19.674 1.843 1.00 25.00 C ATOM 1514 C TYR B 523 9.465 18.770 1.200 1.00 25.00 C ATOM 1515 O TYR B 523 9.731 18.124 0.178 1.00 25.00 O ATOM 1516 CB TYR B 523 11.435 20.304 0.755 1.00 25.00 C ATOM 1517 CG TYR B 523 12.481 21.271 1.281 1.00 25.00 C ATOM 1518 CD1 TYR B 523 13.795 20.861 1.488 1.00 25.00 C ATOM 1519 CD2 TYR B 523 12.153 22.591 1.572 1.00 25.00 C ATOM 1520 CE1 TYR B 523 14.749 21.738 1.970 1.00 25.00 C ATOM 1521 CE2 TYR B 523 13.103 23.473 2.053 1.00 25.00 C ATOM 1522 CZ TYR B 523 14.397 23.042 2.250 1.00 25.00 C ATOM 1523 OH TYR B 523 15.344 23.918 2.728 1.00 25.00 O ATOM 0 H TYR B 523 11.723 18.041 2.439 1.00 25.00 H new ATOM 0 HA TYR B 523 10.038 20.477 2.382 1.00 25.00 H new ATOM 0 HB2 TYR B 523 11.938 19.506 0.209 1.00 25.00 H new ATOM 0 HB3 TYR B 523 10.801 20.828 0.040 1.00 25.00 H new ATOM 0 HD1 TYR B 523 14.074 19.841 1.268 1.00 25.00 H new ATOM 0 HD2 TYR B 523 11.140 22.933 1.420 1.00 25.00 H new ATOM 0 HE1 TYR B 523 15.764 21.404 2.126 1.00 25.00 H new ATOM 0 HE2 TYR B 523 12.832 24.495 2.273 1.00 25.00 H new ATOM 0 HH TYR B 523 14.934 24.796 2.873 1.00 25.00 H new ATOM 1533 N PRO B 524 8.225 18.684 1.793 1.00 25.00 N ATOM 1534 CA PRO B 524 7.125 17.875 1.224 1.00 25.00 C ATOM 1535 C PRO B 524 6.509 18.509 -0.034 1.00 25.00 C ATOM 1536 O PRO B 524 5.773 19.500 0.047 1.00 25.00 O ATOM 1537 CB PRO B 524 6.085 17.807 2.364 1.00 25.00 C ATOM 1538 CG PRO B 524 6.308 19.040 3.189 1.00 25.00 C ATOM 1539 CD PRO B 524 7.799 19.319 3.062 1.00 25.00 C ATOM 0 HA PRO B 524 7.478 16.897 0.898 1.00 25.00 H new ATOM 0 HB2 PRO B 524 5.070 17.779 1.967 1.00 25.00 H new ATOM 0 HB3 PRO B 524 6.218 16.906 2.962 1.00 25.00 H new ATOM 0 HG2 PRO B 524 5.715 19.877 2.820 1.00 25.00 H new ATOM 0 HG3 PRO B 524 6.021 18.879 4.228 1.00 25.00 H new ATOM 0 HD2 PRO B 524 7.996 20.391 3.048 1.00 25.00 H new ATOM 0 HD3 PRO B 524 8.347 18.906 3.909 1.00 25.00 H new ATOM 1547 N ASN B 525 6.836 17.929 -1.197 1.00 25.00 N ATOM 1548 CA ASN B 525 6.323 18.406 -2.489 1.00 25.00 C ATOM 1549 C ASN B 525 5.885 17.235 -3.367 1.00 25.00 C ATOM 1550 O ASN B 525 6.533 16.183 -3.380 1.00 25.00 O ATOM 1551 CB ASN B 525 7.383 19.240 -3.229 1.00 25.00 C ATOM 1552 CG ASN B 525 7.648 20.582 -2.566 1.00 25.00 C ATOM 1553 OD1 ASN B 525 6.813 21.485 -2.611 1.00 25.00 O ATOM 1554 ND2 ASN B 525 8.818 20.719 -1.953 1.00 25.00 N ATOM 0 H ASN B 525 7.458 17.124 -1.269 1.00 25.00 H new ATOM 0 HA ASN B 525 5.458 19.038 -2.286 1.00 25.00 H new ATOM 0 HB2 ASN B 525 8.314 18.675 -3.278 1.00 25.00 H new ATOM 0 HB3 ASN B 525 7.056 19.406 -4.256 1.00 25.00 H new ATOM 0 HD21 ASN B 525 9.054 21.599 -1.495 1.00 25.00 H new ATOM 0 HD22 ASN B 525 9.481 19.944 -1.940 1.00 25.00 H new ATOM 1561 N GLY B 526 4.780 17.431 -4.095 1.00 25.00 N ATOM 1562 CA GLY B 526 4.263 16.401 -4.986 1.00 25.00 C ATOM 1563 C GLY B 526 2.776 16.545 -5.243 1.00 25.00 C ATOM 1564 O GLY B 526 1.967 15.840 -4.633 1.00 25.00 O ATOM 0 H GLY B 526 4.233 18.292 -4.081 1.00 25.00 H new ATOM 0 HA2 GLY B 526 4.798 16.445 -5.935 1.00 25.00 H new ATOM 0 HA3 GLY B 526 4.460 15.420 -4.554 1.00 25.00 H new ATOM 1568 N LEU B 527 2.424 17.459 -6.152 1.00 25.00 N ATOM 1569 CA LEU B 527 1.026 17.701 -6.519 1.00 25.00 C ATOM 1570 C LEU B 527 0.734 17.176 -7.935 1.00 25.00 C ATOM 1571 O LEU B 527 1.422 16.271 -8.417 1.00 25.00 O ATOM 1572 CB LEU B 527 0.704 19.205 -6.419 1.00 25.00 C ATOM 1573 CG LEU B 527 0.863 19.836 -5.024 1.00 25.00 C ATOM 1574 CD1 LEU B 527 0.619 21.337 -5.094 1.00 25.00 C ATOM 1575 CD2 LEU B 527 -0.101 19.201 -4.021 1.00 25.00 C ATOM 0 H LEU B 527 3.093 18.047 -6.650 1.00 25.00 H new ATOM 0 HA LEU B 527 0.386 17.160 -5.822 1.00 25.00 H new ATOM 0 HB2 LEU B 527 1.349 19.742 -7.115 1.00 25.00 H new ATOM 0 HB3 LEU B 527 -0.322 19.360 -6.752 1.00 25.00 H new ATOM 0 HG LEU B 527 1.883 19.653 -4.686 1.00 25.00 H new ATOM 0 HD11 LEU B 527 0.734 21.771 -4.101 1.00 25.00 H new ATOM 0 HD12 LEU B 527 1.339 21.791 -5.775 1.00 25.00 H new ATOM 0 HD13 LEU B 527 -0.392 21.525 -5.457 1.00 25.00 H new ATOM 0 HD21 LEU B 527 0.033 19.665 -3.044 1.00 25.00 H new ATOM 0 HD22 LEU B 527 -1.127 19.351 -4.357 1.00 25.00 H new ATOM 0 HD23 LEU B 527 0.103 18.133 -3.946 1.00 25.00 H new ATOM 1587 N LEU B 528 -0.295 17.763 -8.601 1.00 25.00 N ATOM 1588 CA LEU B 528 -0.819 17.302 -9.893 1.00 25.00 C ATOM 1589 C LEU B 528 -1.137 15.795 -9.828 1.00 25.00 C ATOM 1590 O LEU B 528 -0.586 14.972 -10.564 1.00 25.00 O ATOM 1591 CB LEU B 528 0.166 17.701 -11.017 1.00 25.00 C ATOM 1592 CG LEU B 528 0.452 19.202 -11.220 1.00 25.00 C ATOM 1593 CD1 LEU B 528 1.482 19.378 -12.317 1.00 25.00 C ATOM 1594 CD2 LEU B 528 -0.813 19.969 -11.587 1.00 25.00 C ATOM 0 H LEU B 528 -0.784 18.582 -8.241 1.00 25.00 H new ATOM 0 HA LEU B 528 -1.765 17.790 -10.128 1.00 25.00 H new ATOM 0 HB2 LEU B 528 1.116 17.202 -10.824 1.00 25.00 H new ATOM 0 HB3 LEU B 528 -0.218 17.303 -11.956 1.00 25.00 H new ATOM 0 HG LEU B 528 0.831 19.602 -10.280 1.00 25.00 H new ATOM 0 HD11 LEU B 528 1.684 20.440 -12.460 1.00 25.00 H new ATOM 0 HD12 LEU B 528 2.404 18.868 -12.036 1.00 25.00 H new ATOM 0 HD13 LEU B 528 1.101 18.953 -13.246 1.00 25.00 H new ATOM 0 HD21 LEU B 528 -0.573 21.024 -11.722 1.00 25.00 H new ATOM 0 HD22 LEU B 528 -1.225 19.569 -12.513 1.00 25.00 H new ATOM 0 HD23 LEU B 528 -1.547 19.864 -10.788 1.00 25.00 H new ATOM 1606 N SER B 529 -2.023 15.463 -8.868 1.00 25.00 N ATOM 1607 CA SER B 529 -2.480 14.080 -8.580 1.00 25.00 C ATOM 1608 C SER B 529 -1.306 13.151 -8.226 1.00 25.00 C ATOM 1609 O SER B 529 -0.617 12.624 -9.108 1.00 25.00 O ATOM 1610 CB SER B 529 -3.329 13.494 -9.735 1.00 25.00 C ATOM 1611 OG SER B 529 -3.679 12.139 -9.505 1.00 25.00 O ATOM 0 H SER B 529 -2.452 16.158 -8.257 1.00 25.00 H new ATOM 0 HA SER B 529 -3.125 14.143 -7.704 1.00 25.00 H new ATOM 0 HB2 SER B 529 -4.236 14.087 -9.855 1.00 25.00 H new ATOM 0 HB3 SER B 529 -2.772 13.571 -10.669 1.00 25.00 H new ATOM 0 HG SER B 529 -4.215 11.808 -10.255 1.00 25.00 H new ATOM 1617 N GLY B 530 -1.090 12.979 -6.918 1.00 25.00 N ATOM 1618 CA GLY B 530 0.003 12.151 -6.424 1.00 25.00 C ATOM 1619 C GLY B 530 -0.307 11.523 -5.077 1.00 25.00 C ATOM 1620 O GLY B 530 -0.072 10.329 -4.876 1.00 25.00 O ATOM 0 H GLY B 530 -1.660 13.404 -6.187 1.00 25.00 H new ATOM 0 HA2 GLY B 530 0.215 11.364 -7.148 1.00 25.00 H new ATOM 0 HA3 GLY B 530 0.905 12.758 -6.340 1.00 25.00 H new ATOM 1624 N ASP B 531 -0.835 12.339 -4.155 1.00 25.00 N ATOM 1625 CA ASP B 531 -1.210 11.874 -2.811 1.00 25.00 C ATOM 1626 C ASP B 531 -2.693 12.136 -2.538 1.00 25.00 C ATOM 1627 O ASP B 531 -3.239 11.700 -1.519 1.00 25.00 O ATOM 1628 CB ASP B 531 -0.348 12.558 -1.739 1.00 25.00 C ATOM 1629 CG ASP B 531 1.041 11.957 -1.626 1.00 25.00 C ATOM 1630 OD1 ASP B 531 1.142 10.730 -1.419 1.00 25.00 O ATOM 1631 OD2 ASP B 531 2.027 12.715 -1.746 1.00 25.00 O ATOM 0 H ASP B 531 -1.013 13.330 -4.316 1.00 25.00 H new ATOM 0 HA ASP B 531 -1.034 10.799 -2.768 1.00 25.00 H new ATOM 0 HB2 ASP B 531 -0.261 13.619 -1.972 1.00 25.00 H new ATOM 0 HB3 ASP B 531 -0.850 12.484 -0.774 1.00 25.00 H new ATOM 1636 N GLU B 532 -3.329 12.846 -3.471 1.00 25.00 N ATOM 1637 CA GLU B 532 -4.739 13.204 -3.384 1.00 25.00 C ATOM 1638 C GLU B 532 -5.619 12.309 -4.259 1.00 25.00 C ATOM 1639 O GLU B 532 -6.851 12.412 -4.244 1.00 25.00 O ATOM 1640 CB GLU B 532 -4.909 14.664 -3.770 1.00 25.00 C ATOM 1641 CG GLU B 532 -4.233 15.629 -2.806 1.00 25.00 C ATOM 1642 CD GLU B 532 -4.403 17.091 -3.193 1.00 25.00 C ATOM 1643 OE1 GLU B 532 -5.129 17.365 -4.173 1.00 25.00 O ATOM 1644 OE2 GLU B 532 -3.812 17.958 -2.516 1.00 25.00 O ATOM 0 H GLU B 532 -2.872 13.190 -4.315 1.00 25.00 H new ATOM 0 HA GLU B 532 -5.065 13.053 -2.355 1.00 25.00 H new ATOM 0 HB2 GLU B 532 -4.503 14.817 -4.770 1.00 25.00 H new ATOM 0 HB3 GLU B 532 -5.973 14.897 -3.819 1.00 25.00 H new ATOM 0 HG2 GLU B 532 -4.640 15.476 -1.806 1.00 25.00 H new ATOM 0 HG3 GLU B 532 -3.169 15.396 -2.757 1.00 25.00 H new ATOM 1651 N ASP B 533 -4.960 11.429 -5.004 1.00 25.00 N ATOM 1652 CA ASP B 533 -5.619 10.535 -5.966 1.00 25.00 C ATOM 1653 C ASP B 533 -6.115 9.241 -5.290 1.00 25.00 C ATOM 1654 O ASP B 533 -6.856 8.463 -5.900 1.00 25.00 O ATOM 1655 CB ASP B 533 -4.642 10.213 -7.111 1.00 25.00 C ATOM 1656 CG ASP B 533 -5.308 9.538 -8.303 1.00 25.00 C ATOM 1657 OD1 ASP B 533 -6.342 10.056 -8.775 1.00 25.00 O ATOM 1658 OD2 ASP B 533 -4.794 8.495 -8.757 1.00 25.00 O ATOM 0 H ASP B 533 -3.948 11.310 -4.962 1.00 25.00 H new ATOM 0 HA ASP B 533 -6.496 11.042 -6.368 1.00 25.00 H new ATOM 0 HB2 ASP B 533 -4.167 11.136 -7.444 1.00 25.00 H new ATOM 0 HB3 ASP B 533 -3.851 9.566 -6.732 1.00 25.00 H new ATOM 1663 N PHE B 534 -5.710 9.027 -4.028 1.00 25.00 N ATOM 1664 CA PHE B 534 -6.102 7.830 -3.265 1.00 25.00 C ATOM 1665 C PHE B 534 -7.478 7.992 -2.613 1.00 25.00 C ATOM 1666 O PHE B 534 -8.093 7.011 -2.190 1.00 25.00 O ATOM 1667 CB PHE B 534 -5.051 7.507 -2.192 1.00 25.00 C ATOM 1668 CG PHE B 534 -4.236 6.275 -2.486 1.00 25.00 C ATOM 1669 CD1 PHE B 534 -3.008 6.378 -3.125 1.00 25.00 C ATOM 1670 CD2 PHE B 534 -4.697 5.016 -2.126 1.00 25.00 C ATOM 1671 CE1 PHE B 534 -2.259 5.253 -3.402 1.00 25.00 C ATOM 1672 CE2 PHE B 534 -3.950 3.893 -2.401 1.00 25.00 C ATOM 1673 CZ PHE B 534 -2.731 4.008 -3.039 1.00 25.00 C ATOM 0 H PHE B 534 -5.109 9.670 -3.512 1.00 25.00 H new ATOM 0 HA PHE B 534 -6.162 7.003 -3.973 1.00 25.00 H new ATOM 0 HB2 PHE B 534 -4.379 8.359 -2.088 1.00 25.00 H new ATOM 0 HB3 PHE B 534 -5.553 7.378 -1.233 1.00 25.00 H new ATOM 0 HD1 PHE B 534 -2.634 7.351 -3.409 1.00 25.00 H new ATOM 0 HD2 PHE B 534 -5.649 4.917 -1.626 1.00 25.00 H new ATOM 0 HE1 PHE B 534 -1.306 5.346 -3.901 1.00 25.00 H new ATOM 0 HE2 PHE B 534 -4.319 2.919 -2.117 1.00 25.00 H new ATOM 0 HZ PHE B 534 -2.148 3.125 -3.254 1.00 25.00 H new ATOM 1683 N SER B 535 -7.954 9.238 -2.557 1.00 25.00 N ATOM 1684 CA SER B 535 -9.271 9.554 -1.991 1.00 25.00 C ATOM 1685 C SER B 535 -10.385 9.280 -3.010 1.00 25.00 C ATOM 1686 O SER B 535 -11.541 9.064 -2.634 1.00 25.00 O ATOM 1687 CB SER B 535 -9.310 11.020 -1.541 1.00 25.00 C ATOM 1688 OG SER B 535 -9.217 11.907 -2.645 1.00 25.00 O ATOM 0 H SER B 535 -7.443 10.052 -2.899 1.00 25.00 H new ATOM 0 HA SER B 535 -9.438 8.912 -1.126 1.00 25.00 H new ATOM 0 HB2 SER B 535 -10.236 11.210 -0.998 1.00 25.00 H new ATOM 0 HB3 SER B 535 -8.489 11.211 -0.850 1.00 25.00 H new ATOM 0 HG SER B 535 -8.305 11.889 -3.003 1.00 25.00 H new ATOM 1694 N SER B 536 -10.018 9.295 -4.300 1.00 25.00 N ATOM 1695 CA SER B 536 -10.958 9.032 -5.391 1.00 25.00 C ATOM 1696 C SER B 536 -11.017 7.546 -5.759 1.00 25.00 C ATOM 1697 O SER B 536 -12.102 7.011 -5.986 1.00 25.00 O ATOM 1698 CB SER B 536 -10.590 9.860 -6.616 1.00 25.00 C ATOM 1699 OG SER B 536 -9.306 9.511 -7.107 1.00 25.00 O ATOM 0 H SER B 536 -9.066 9.489 -4.611 1.00 25.00 H new ATOM 0 HA SER B 536 -11.949 9.321 -5.041 1.00 25.00 H new ATOM 0 HB2 SER B 536 -11.334 9.708 -7.398 1.00 25.00 H new ATOM 0 HB3 SER B 536 -10.608 10.919 -6.360 1.00 25.00 H new ATOM 0 HG SER B 536 -8.786 9.088 -6.392 1.00 25.00 H new ATOM 1705 N ILE B 537 -9.848 6.884 -5.800 1.00 25.00 N ATOM 1706 CA ILE B 537 -9.752 5.492 -6.275 1.00 25.00 C ATOM 1707 C ILE B 537 -10.032 4.485 -5.150 1.00 25.00 C ATOM 1708 O ILE B 537 -10.751 3.506 -5.367 1.00 25.00 O ATOM 1709 CB ILE B 537 -8.356 5.195 -6.935 1.00 25.00 C ATOM 1710 CG1 ILE B 537 -8.137 6.029 -8.233 1.00 25.00 C ATOM 1711 CG2 ILE B 537 -8.167 3.694 -7.223 1.00 25.00 C ATOM 1712 CD1 ILE B 537 -6.713 6.045 -8.794 1.00 25.00 C ATOM 0 H ILE B 537 -8.958 7.289 -5.511 1.00 25.00 H new ATOM 0 HA ILE B 537 -10.521 5.372 -7.038 1.00 25.00 H new ATOM 0 HB ILE B 537 -7.601 5.498 -6.209 1.00 25.00 H new ATOM 0 HG12 ILE B 537 -8.805 5.644 -9.004 1.00 25.00 H new ATOM 0 HG13 ILE B 537 -8.439 7.057 -8.034 1.00 25.00 H new ATOM 0 HG21 ILE B 537 -7.190 3.531 -7.679 1.00 25.00 H new ATOM 0 HG22 ILE B 537 -8.230 3.134 -6.290 1.00 25.00 H new ATOM 0 HG23 ILE B 537 -8.947 3.353 -7.904 1.00 25.00 H new ATOM 0 HD11 ILE B 537 -6.684 6.656 -9.696 1.00 25.00 H new ATOM 0 HD12 ILE B 537 -6.034 6.462 -8.051 1.00 25.00 H new ATOM 0 HD13 ILE B 537 -6.406 5.027 -9.035 1.00 25.00 H new ATOM 1724 N ALA B 538 -9.473 4.727 -3.958 1.00 25.00 N ATOM 1725 CA ALA B 538 -9.616 3.788 -2.839 1.00 25.00 C ATOM 1726 C ALA B 538 -10.983 3.892 -2.160 1.00 25.00 C ATOM 1727 O ALA B 538 -11.345 3.050 -1.332 1.00 25.00 O ATOM 1728 CB ALA B 538 -8.488 3.968 -1.833 1.00 25.00 C ATOM 0 H ALA B 538 -8.922 5.558 -3.744 1.00 25.00 H new ATOM 0 HA ALA B 538 -9.549 2.783 -3.256 1.00 25.00 H new ATOM 0 HB1 ALA B 538 -8.616 3.261 -1.013 1.00 25.00 H new ATOM 0 HB2 ALA B 538 -7.531 3.787 -2.323 1.00 25.00 H new ATOM 0 HB3 ALA B 538 -8.508 4.985 -1.442 1.00 25.00 H new ATOM 1734 N ASP B 539 -11.722 4.930 -2.528 1.00 25.00 N ATOM 1735 CA ASP B 539 -13.095 5.129 -2.060 1.00 25.00 C ATOM 1736 C ASP B 539 -14.096 4.696 -3.151 1.00 25.00 C ATOM 1737 O ASP B 539 -15.306 4.647 -2.913 1.00 25.00 O ATOM 1738 CB ASP B 539 -13.297 6.598 -1.630 1.00 25.00 C ATOM 1739 CG ASP B 539 -14.612 6.848 -0.904 1.00 25.00 C ATOM 1740 OD1 ASP B 539 -14.886 6.143 0.089 1.00 25.00 O ATOM 1741 OD2 ASP B 539 -15.364 7.749 -1.330 1.00 25.00 O ATOM 0 H ASP B 539 -11.391 5.660 -3.159 1.00 25.00 H new ATOM 0 HA ASP B 539 -13.280 4.504 -1.186 1.00 25.00 H new ATOM 0 HB2 ASP B 539 -12.472 6.894 -0.982 1.00 25.00 H new ATOM 0 HB3 ASP B 539 -13.253 7.235 -2.513 1.00 25.00 H new ATOM 1746 N MET B 540 -13.565 4.373 -4.341 1.00 25.00 N ATOM 1747 CA MET B 540 -14.356 3.776 -5.422 1.00 25.00 C ATOM 1748 C MET B 540 -14.228 2.254 -5.423 1.00 25.00 C ATOM 1749 O MET B 540 -15.163 1.546 -5.812 1.00 25.00 O ATOM 1750 CB MET B 540 -13.933 4.320 -6.783 1.00 25.00 C ATOM 1751 CG MET B 540 -14.754 3.755 -7.940 1.00 25.00 C ATOM 1752 SD MET B 540 -14.359 4.505 -9.536 1.00 25.00 S ATOM 1753 CE MET B 540 -15.200 6.075 -9.396 1.00 25.00 C ATOM 0 H MET B 540 -12.583 4.518 -4.577 1.00 25.00 H new ATOM 0 HA MET B 540 -15.397 4.045 -5.242 1.00 25.00 H new ATOM 0 HB2 MET B 540 -14.025 5.406 -6.777 1.00 25.00 H new ATOM 0 HB3 MET B 540 -12.880 4.090 -6.947 1.00 25.00 H new ATOM 0 HG2 MET B 540 -14.588 2.679 -8.002 1.00 25.00 H new ATOM 0 HG3 MET B 540 -15.813 3.903 -7.730 1.00 25.00 H new ATOM 0 HE1 MET B 540 -15.138 6.607 -10.345 1.00 25.00 H new ATOM 0 HE2 MET B 540 -16.247 5.906 -9.143 1.00 25.00 H new ATOM 0 HE3 MET B 540 -14.729 6.671 -8.614 1.00 25.00 H new ATOM 1763 N ASP B 541 -13.064 1.763 -4.979 1.00 25.00 N ATOM 1764 CA ASP B 541 -12.771 0.340 -4.943 1.00 25.00 C ATOM 1765 C ASP B 541 -13.214 -0.314 -3.626 1.00 25.00 C ATOM 1766 O ASP B 541 -13.384 -1.534 -3.573 1.00 25.00 O ATOM 1767 CB ASP B 541 -11.276 0.127 -5.154 1.00 25.00 C ATOM 1768 CG ASP B 541 -10.874 0.187 -6.618 1.00 25.00 C ATOM 1769 OD1 ASP B 541 -11.635 -0.333 -7.462 1.00 25.00 O ATOM 1770 OD2 ASP B 541 -9.804 0.753 -6.919 1.00 25.00 O ATOM 0 H ASP B 541 -12.303 2.349 -4.636 1.00 25.00 H new ATOM 0 HA ASP B 541 -13.336 -0.137 -5.744 1.00 25.00 H new ATOM 0 HB2 ASP B 541 -10.724 0.885 -4.599 1.00 25.00 H new ATOM 0 HB3 ASP B 541 -10.990 -0.841 -4.743 1.00 25.00 H new ATOM 1775 N PHE B 542 -13.412 0.502 -2.573 1.00 25.00 N ATOM 1776 CA PHE B 542 -13.769 -0.009 -1.239 1.00 25.00 C ATOM 1777 C PHE B 542 -15.244 -0.451 -1.168 1.00 25.00 C ATOM 1778 O PHE B 542 -15.613 -1.247 -0.302 1.00 25.00 O ATOM 1779 CB PHE B 542 -13.491 1.076 -0.187 1.00 25.00 C ATOM 1780 CG PHE B 542 -13.786 0.685 1.241 1.00 25.00 C ATOM 1781 CD1 PHE B 542 -12.949 -0.175 1.936 1.00 25.00 C ATOM 1782 CD2 PHE B 542 -14.919 1.169 1.878 1.00 25.00 C ATOM 1783 CE1 PHE B 542 -13.235 -0.541 3.238 1.00 25.00 C ATOM 1784 CE2 PHE B 542 -15.210 0.807 3.178 1.00 25.00 C ATOM 1785 CZ PHE B 542 -14.367 -0.049 3.861 1.00 25.00 C ATOM 0 H PHE B 542 -13.330 1.518 -2.622 1.00 25.00 H new ATOM 0 HA PHE B 542 -13.157 -0.888 -1.038 1.00 25.00 H new ATOM 0 HB2 PHE B 542 -12.443 1.366 -0.257 1.00 25.00 H new ATOM 0 HB3 PHE B 542 -14.083 1.958 -0.434 1.00 25.00 H new ATOM 0 HD1 PHE B 542 -12.064 -0.563 1.455 1.00 25.00 H new ATOM 0 HD2 PHE B 542 -15.582 1.838 1.350 1.00 25.00 H new ATOM 0 HE1 PHE B 542 -12.574 -1.211 3.768 1.00 25.00 H new ATOM 0 HE2 PHE B 542 -16.096 1.192 3.661 1.00 25.00 H new ATOM 0 HZ PHE B 542 -14.592 -0.333 4.878 1.00 25.00 H new ATOM 1795 N SER B 543 -16.074 0.066 -2.089 1.00 25.00 N ATOM 1796 CA SER B 543 -17.517 -0.227 -2.109 1.00 25.00 C ATOM 1797 C SER B 543 -17.823 -1.571 -2.784 1.00 25.00 C ATOM 1798 O SER B 543 -18.723 -2.297 -2.351 1.00 25.00 O ATOM 1799 CB SER B 543 -18.271 0.909 -2.812 1.00 25.00 C ATOM 1800 OG SER B 543 -17.865 1.046 -4.165 1.00 25.00 O ATOM 0 H SER B 543 -15.768 0.692 -2.834 1.00 25.00 H new ATOM 0 HA SER B 543 -17.855 -0.302 -1.075 1.00 25.00 H new ATOM 0 HB2 SER B 543 -19.343 0.715 -2.771 1.00 25.00 H new ATOM 0 HB3 SER B 543 -18.096 1.845 -2.282 1.00 25.00 H new ATOM 0 HG SER B 543 -18.365 1.777 -4.584 1.00 25.00 H new ATOM 1806 N ALA B 544 -17.067 -1.889 -3.841 1.00 25.00 N ATOM 1807 CA ALA B 544 -17.197 -3.166 -4.558 1.00 25.00 C ATOM 1808 C ALA B 544 -16.434 -4.286 -3.839 1.00 25.00 C ATOM 1809 O ALA B 544 -16.724 -5.472 -4.025 1.00 25.00 O ATOM 1810 CB ALA B 544 -16.698 -3.017 -5.989 1.00 25.00 C ATOM 0 H ALA B 544 -16.350 -1.272 -4.223 1.00 25.00 H new ATOM 0 HA ALA B 544 -18.252 -3.439 -4.577 1.00 25.00 H new ATOM 0 HB1 ALA B 544 -16.799 -3.969 -6.511 1.00 25.00 H new ATOM 0 HB2 ALA B 544 -17.287 -2.257 -6.503 1.00 25.00 H new ATOM 0 HB3 ALA B 544 -15.650 -2.718 -5.980 1.00 25.00 H new ATOM 1816 N LEU B 545 -15.460 -3.879 -3.015 1.00 25.00 N ATOM 1817 CA LEU B 545 -14.601 -4.798 -2.258 1.00 25.00 C ATOM 1818 C LEU B 545 -15.325 -5.365 -1.017 1.00 25.00 C ATOM 1819 O LEU B 545 -14.903 -6.385 -0.464 1.00 25.00 O ATOM 1820 CB LEU B 545 -13.317 -4.038 -1.868 1.00 25.00 C ATOM 1821 CG LEU B 545 -11.981 -4.476 -2.501 1.00 25.00 C ATOM 1822 CD1 LEU B 545 -11.982 -4.341 -4.022 1.00 25.00 C ATOM 1823 CD2 LEU B 545 -10.847 -3.653 -1.921 1.00 25.00 C ATOM 0 H LEU B 545 -15.244 -2.895 -2.854 1.00 25.00 H new ATOM 0 HA LEU B 545 -14.348 -5.659 -2.877 1.00 25.00 H new ATOM 0 HB2 LEU B 545 -13.469 -2.986 -2.109 1.00 25.00 H new ATOM 0 HB3 LEU B 545 -13.208 -4.105 -0.785 1.00 25.00 H new ATOM 0 HG LEU B 545 -11.843 -5.532 -2.267 1.00 25.00 H new ATOM 0 HD11 LEU B 545 -11.018 -4.663 -4.416 1.00 25.00 H new ATOM 0 HD12 LEU B 545 -12.772 -4.964 -4.442 1.00 25.00 H new ATOM 0 HD13 LEU B 545 -12.157 -3.300 -4.295 1.00 25.00 H new ATOM 0 HD21 LEU B 545 -9.904 -3.965 -2.370 1.00 25.00 H new ATOM 0 HD22 LEU B 545 -11.018 -2.598 -2.133 1.00 25.00 H new ATOM 0 HD23 LEU B 545 -10.802 -3.804 -0.842 1.00 25.00 H new ATOM 1835 N LEU B 546 -16.410 -4.692 -0.589 1.00 25.00 N ATOM 1836 CA LEU B 546 -17.257 -5.178 0.518 1.00 25.00 C ATOM 1837 C LEU B 546 -18.352 -6.113 0.006 1.00 25.00 C ATOM 1838 O LEU B 546 -18.821 -6.998 0.728 1.00 25.00 O ATOM 1839 CB LEU B 546 -17.917 -4.003 1.262 1.00 25.00 C ATOM 1840 CG LEU B 546 -16.997 -3.160 2.144 1.00 25.00 C ATOM 1841 CD1 LEU B 546 -17.765 -1.986 2.735 1.00 25.00 C ATOM 1842 CD2 LEU B 546 -16.390 -3.999 3.256 1.00 25.00 C ATOM 0 H LEU B 546 -16.721 -3.809 -0.993 1.00 25.00 H new ATOM 0 HA LEU B 546 -16.607 -5.724 1.202 1.00 25.00 H new ATOM 0 HB2 LEU B 546 -18.380 -3.347 0.524 1.00 25.00 H new ATOM 0 HB3 LEU B 546 -18.719 -4.399 1.884 1.00 25.00 H new ATOM 0 HG LEU B 546 -16.187 -2.779 1.522 1.00 25.00 H new ATOM 0 HD11 LEU B 546 -17.098 -1.393 3.361 1.00 25.00 H new ATOM 0 HD12 LEU B 546 -18.155 -1.364 1.929 1.00 25.00 H new ATOM 0 HD13 LEU B 546 -18.593 -2.359 3.338 1.00 25.00 H new ATOM 0 HD21 LEU B 546 -15.740 -3.375 3.869 1.00 25.00 H new ATOM 0 HD22 LEU B 546 -17.186 -4.412 3.876 1.00 25.00 H new ATOM 0 HD23 LEU B 546 -15.809 -4.813 2.822 1.00 25.00 H new ATOM 1854 N SER B 547 -18.748 -5.895 -1.251 1.00 25.00 N ATOM 1855 CA SER B 547 -19.828 -6.660 -1.897 1.00 25.00 C ATOM 1856 C SER B 547 -19.387 -8.083 -2.287 1.00 25.00 C ATOM 1857 O SER B 547 -20.233 -8.945 -2.546 1.00 25.00 O ATOM 1858 CB SER B 547 -20.328 -5.903 -3.134 1.00 25.00 C ATOM 1859 OG SER B 547 -19.364 -5.916 -4.177 1.00 25.00 O ATOM 0 H SER B 547 -18.332 -5.184 -1.853 1.00 25.00 H new ATOM 0 HA SER B 547 -20.636 -6.764 -1.173 1.00 25.00 H new ATOM 0 HB2 SER B 547 -21.255 -6.354 -3.488 1.00 25.00 H new ATOM 0 HB3 SER B 547 -20.558 -4.873 -2.863 1.00 25.00 H new ATOM 0 HG SER B 547 -18.468 -5.810 -3.795 1.00 25.00 H new ATOM 1865 N GLN B 548 -18.067 -8.320 -2.321 1.00 25.00 N ATOM 1866 CA GLN B 548 -17.515 -9.629 -2.708 1.00 25.00 C ATOM 1867 C GLN B 548 -17.367 -10.587 -1.513 1.00 25.00 C ATOM 1868 O GLN B 548 -17.189 -11.795 -1.696 1.00 25.00 O ATOM 1869 CB GLN B 548 -16.174 -9.461 -3.449 1.00 25.00 C ATOM 1870 CG GLN B 548 -16.272 -8.672 -4.743 1.00 25.00 C ATOM 1871 CD GLN B 548 -17.192 -9.312 -5.765 1.00 25.00 C ATOM 1872 OE1 GLN B 548 -17.003 -10.466 -6.148 1.00 25.00 O ATOM 1873 NE2 GLN B 548 -18.201 -8.566 -6.205 1.00 25.00 N ATOM 0 H GLN B 548 -17.361 -7.623 -2.085 1.00 25.00 H new ATOM 0 HA GLN B 548 -18.234 -10.086 -3.388 1.00 25.00 H new ATOM 0 HB2 GLN B 548 -15.465 -8.964 -2.786 1.00 25.00 H new ATOM 0 HB3 GLN B 548 -15.767 -10.448 -3.668 1.00 25.00 H new ATOM 0 HG2 GLN B 548 -16.629 -7.666 -4.522 1.00 25.00 H new ATOM 0 HG3 GLN B 548 -15.276 -8.569 -5.174 1.00 25.00 H new ATOM 0 HE21 GLN B 548 -18.319 -7.614 -5.860 1.00 25.00 H new ATOM 0 HE22 GLN B 548 -18.857 -8.946 -6.888 1.00 25.00 H new ATOM 1882 N ILE B 549 -17.451 -10.031 -0.303 1.00 25.00 N ATOM 1883 CA ILE B 549 -17.325 -10.817 0.937 1.00 25.00 C ATOM 1884 C ILE B 549 -18.682 -11.029 1.626 1.00 25.00 C ATOM 1885 O ILE B 549 -18.860 -12.004 2.363 1.00 25.00 O ATOM 1886 CB ILE B 549 -16.315 -10.190 1.948 1.00 25.00 C ATOM 1887 CG1 ILE B 549 -14.903 -10.024 1.328 1.00 25.00 C ATOM 1888 CG2 ILE B 549 -16.262 -11.041 3.221 1.00 25.00 C ATOM 1889 CD1 ILE B 549 -13.932 -9.211 2.171 1.00 25.00 C ATOM 0 H ILE B 549 -17.606 -9.035 -0.150 1.00 25.00 H new ATOM 0 HA ILE B 549 -16.934 -11.786 0.627 1.00 25.00 H new ATOM 0 HB ILE B 549 -16.665 -9.190 2.203 1.00 25.00 H new ATOM 0 HG12 ILE B 549 -14.477 -11.013 1.159 1.00 25.00 H new ATOM 0 HG13 ILE B 549 -15.003 -9.548 0.352 1.00 25.00 H new ATOM 0 HG21 ILE B 549 -15.556 -10.600 3.924 1.00 25.00 H new ATOM 0 HG22 ILE B 549 -17.252 -11.078 3.676 1.00 25.00 H new ATOM 0 HG23 ILE B 549 -15.941 -12.052 2.970 1.00 25.00 H new ATOM 0 HD11 ILE B 549 -12.971 -9.147 1.660 1.00 25.00 H new ATOM 0 HD12 ILE B 549 -14.331 -8.208 2.320 1.00 25.00 H new ATOM 0 HD13 ILE B 549 -13.797 -9.695 3.138 1.00 25.00 H new ATOM 1901 N SER B 550 -19.630 -10.113 1.378 1.00 25.00 N ATOM 1902 CA SER B 550 -20.962 -10.176 1.989 1.00 25.00 C ATOM 1903 C SER B 550 -21.984 -10.811 1.037 1.00 25.00 C ATOM 1904 O SER B 550 -22.843 -11.584 1.471 1.00 25.00 O ATOM 1905 CB SER B 550 -21.418 -8.769 2.403 1.00 25.00 C ATOM 1906 OG SER B 550 -21.554 -7.916 1.277 1.00 25.00 O ATOM 0 H SER B 550 -19.496 -9.317 0.755 1.00 25.00 H new ATOM 0 HA SER B 550 -20.899 -10.806 2.876 1.00 25.00 H new ATOM 0 HB2 SER B 550 -22.370 -8.834 2.929 1.00 25.00 H new ATOM 0 HB3 SER B 550 -20.697 -8.342 3.100 1.00 25.00 H new ATOM 0 HG SER B 550 -20.673 -7.574 1.017 1.00 25.00 H new ATOM 1912 N SER B 551 -21.882 -10.476 -0.258 1.00 25.00 N ATOM 1913 CA SER B 551 -22.792 -11.006 -1.276 1.00 25.00 C ATOM 1914 C SER B 551 -22.052 -11.944 -2.237 1.00 25.00 C ATOM 1915 O SER B 551 -22.195 -13.174 -2.079 1.00 25.00 O ATOM 1916 CB SER B 551 -23.460 -9.860 -2.047 1.00 25.00 C ATOM 1917 OG SER B 551 -24.294 -10.355 -3.081 1.00 25.00 O ATOM 1918 OXT SER B 551 -21.325 -11.445 -3.126 1.00 25.00 O ATOM 0 H SER B 551 -21.175 -9.838 -0.623 1.00 25.00 H new ATOM 0 HA SER B 551 -23.568 -11.583 -0.772 1.00 25.00 H new ATOM 0 HB2 SER B 551 -24.049 -9.252 -1.361 1.00 25.00 H new ATOM 0 HB3 SER B 551 -22.695 -9.210 -2.473 1.00 25.00 H new ATOM 0 HG SER B 551 -24.708 -9.604 -3.555 1.00 25.00 H new TER 1924 SER B 551