USER MOD reduce.3.24.130724 H: found=0, std=0, add=950, rem=0, adj=28 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: A 589 LYS NZ :NH3+ -143:sc= 0.973 (180deg=0) USER MOD Set 1.2: A 644 ASN : amide:sc= 0.856 K(o=1.8,f=-2.1) USER MOD Set 2.1: A 601 SER OG : rot -27:sc= 1.19 USER MOD Set 2.2: A 602 HIS : no HD1:sc=-0.00271 X(o=1.2,f=1.2) USER MOD Single : A 592 HIS : no HD1:sc= -0.0068 X(o=-0.0068,f=-0.034) USER MOD Single : A 594 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 596 THR OG1 : rot -140:sc= 0.112 USER MOD Single : A 597 GLN : amide:sc= -1.35! K(o=-1.3!,f=0) USER MOD Single : A 605 HIS : no HD1:sc=-0.000786 X(o=-0.00079,f=-0.00079) 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=-0.76) USER MOD Single : A 614 THR OG1 : rot 180:sc= 0 USER MOD Single : A 621 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 625 MET CE :methyl -116:sc= -1.03 (180deg=-1.43) USER MOD Single : A 627 ASN : amide:sc= -0.0211 K(o=-0.021,f=-1.4!) USER MOD Single : A 631 TYR OH : rot -166:sc= -0.0952 USER MOD Single : A 633 LYS NZ :NH3+ -114:sc= 0 (180deg=-0.256) USER MOD Single : A 634 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 639 MET CE :methyl -117:sc= -3.6! (180deg=-7.33!) USER MOD Single : A 640 TYR OH : rot 180:sc= 0 USER MOD Single : A 642 SER OG : rot -90:sc= 0.228 USER MOD Single : A 645 SER OG : rot 180:sc= 0 USER MOD Single : A 649 TYR OH : rot 180:sc= 0 USER MOD Single : A 650 TYR OH : rot 30:sc= -0.794 USER MOD Single : A 651 HIS : no HD1:sc= -0.386 X(o=-0.39,f=0.034) USER MOD Single : A 656 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00243) USER MOD Single : A 658 TYR OH : rot 180:sc= 0 USER MOD Single : A 659 LYS NZ :NH3+ 149:sc= 1.24 (180deg=-0.204) USER MOD Single : A 661 GLN : amide:sc= 0.375 X(o=0.37,f=0) USER MOD Single : A 662 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 667 LYS NZ :NH3+ -125:sc= 0.579 (180deg=0.00303) USER MOD Single : A 670 SER OG : rot -88:sc= 1.66 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 USER MOD Single : B 535 SER OG : rot -60:sc= 0.16 USER MOD Single : B 536 SER OG : rot 180:sc=-0.00692 USER MOD Single : B 540 MET CE :methyl 171:sc= 0 (180deg=-0.127) USER MOD Single : B 543 SER OG : rot 180:sc= 0 USER MOD Single : B 547 SER OG : rot -37:sc= 0.546 USER MOD Single : B 548 GLN : amide:sc= -0.795 K(o=-0.79,f=-1.8!) USER MOD Single : B 550 SER OG : rot 180:sc= 0 USER MOD Single : B 551 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 586 29.984 0.137 -7.610 1.00 25.00 N ATOM 2 CA GLY A 586 28.767 -0.535 -7.075 1.00 25.00 C ATOM 3 C GLY A 586 29.041 -1.298 -5.794 1.00 25.00 C ATOM 4 O GLY A 586 29.479 -2.451 -5.836 1.00 25.00 O ATOM 0 HA2 GLY A 586 27.995 0.212 -6.891 1.00 25.00 H new ATOM 0 HA3 GLY A 586 28.375 -1.221 -7.826 1.00 25.00 H new ATOM 10 N VAL A 587 28.780 -0.646 -4.654 1.00 25.00 N ATOM 11 CA VAL A 587 28.998 -1.249 -3.335 1.00 25.00 C ATOM 12 C VAL A 587 27.731 -1.987 -2.842 1.00 25.00 C ATOM 13 O VAL A 587 26.612 -1.481 -2.970 1.00 25.00 O ATOM 14 CB VAL A 587 29.500 -0.183 -2.305 1.00 25.00 C ATOM 15 CG1 VAL A 587 29.728 -0.793 -0.934 1.00 25.00 C ATOM 16 CG2 VAL A 587 30.757 0.542 -2.796 1.00 25.00 C ATOM 0 H VAL A 587 28.415 0.306 -4.620 1.00 25.00 H new ATOM 0 HA VAL A 587 29.785 -1.997 -3.429 1.00 25.00 H new ATOM 0 HB VAL A 587 28.708 0.560 -2.213 1.00 25.00 H new ATOM 0 HG11 VAL A 587 30.076 -0.022 -0.246 1.00 25.00 H new ATOM 0 HG12 VAL A 587 28.794 -1.215 -0.564 1.00 25.00 H new ATOM 0 HG13 VAL A 587 30.478 -1.580 -1.006 1.00 25.00 H new ATOM 0 HG21 VAL A 587 31.070 1.273 -2.050 1.00 25.00 H new ATOM 0 HG22 VAL A 587 31.557 -0.182 -2.953 1.00 25.00 H new ATOM 0 HG23 VAL A 587 30.540 1.052 -3.735 1.00 25.00 H new ATOM 26 N ARG A 588 27.941 -3.188 -2.291 1.00 25.00 N ATOM 27 CA ARG A 588 26.856 -4.045 -1.801 1.00 25.00 C ATOM 28 C ARG A 588 26.588 -3.807 -0.315 1.00 25.00 C ATOM 29 O ARG A 588 27.513 -3.533 0.456 1.00 25.00 O ATOM 30 CB ARG A 588 27.191 -5.530 -2.040 1.00 25.00 C ATOM 31 CG ARG A 588 26.044 -6.511 -1.755 1.00 25.00 C ATOM 32 CD ARG A 588 26.375 -7.954 -2.150 1.00 25.00 C ATOM 33 NE ARG A 588 27.279 -8.615 -1.198 1.00 25.00 N ATOM 34 CZ ARG A 588 27.933 -9.764 -1.435 1.00 25.00 C ATOM 35 NH1 ARG A 588 27.796 -10.409 -2.594 1.00 25.00 N ATOM 36 NH2 ARG A 588 28.729 -10.268 -0.504 1.00 25.00 N ATOM 0 H ARG A 588 28.869 -3.593 -2.172 1.00 25.00 H new ATOM 0 HA ARG A 588 25.955 -3.787 -2.358 1.00 25.00 H new ATOM 0 HB2 ARG A 588 27.505 -5.653 -3.077 1.00 25.00 H new ATOM 0 HB3 ARG A 588 28.042 -5.799 -1.415 1.00 25.00 H new ATOM 0 HG2 ARG A 588 25.801 -6.478 -0.693 1.00 25.00 H new ATOM 0 HG3 ARG A 588 25.154 -6.188 -2.296 1.00 25.00 H new ATOM 0 HD2 ARG A 588 25.450 -8.527 -2.223 1.00 25.00 H new ATOM 0 HD3 ARG A 588 26.831 -7.959 -3.140 1.00 25.00 H new ATOM 0 HE ARG A 588 27.420 -8.169 -0.292 1.00 25.00 H new ATOM 0 HH11 ARG A 588 27.186 -10.031 -3.319 1.00 25.00 H new ATOM 0 HH12 ARG A 588 28.301 -11.280 -2.756 1.00 25.00 H new ATOM 0 HH21 ARG A 588 28.842 -9.784 0.387 1.00 25.00 H new ATOM 0 HH22 ARG A 588 29.228 -11.140 -0.678 1.00 25.00 H new ATOM 50 N LYS A 589 25.313 -3.918 0.072 1.00 25.00 N ATOM 51 CA LYS A 589 24.893 -3.725 1.464 1.00 25.00 C ATOM 52 C LYS A 589 24.292 -5.021 2.030 1.00 25.00 C ATOM 53 O LYS A 589 24.058 -5.984 1.292 1.00 25.00 O ATOM 54 CB LYS A 589 23.873 -2.571 1.572 1.00 25.00 C ATOM 55 CG LYS A 589 24.412 -1.179 1.230 1.00 25.00 C ATOM 56 CD LYS A 589 23.378 -0.078 1.439 1.00 25.00 C ATOM 57 CE LYS A 589 24.009 1.295 1.291 1.00 25.00 C ATOM 58 NZ LYS A 589 24.319 1.618 -0.129 1.00 25.00 N ATOM 0 H LYS A 589 24.549 -4.142 -0.565 1.00 25.00 H new ATOM 0 HA LYS A 589 25.773 -3.463 2.051 1.00 25.00 H new ATOM 0 HB2 LYS A 589 23.034 -2.789 0.912 1.00 25.00 H new ATOM 0 HB3 LYS A 589 23.481 -2.550 2.589 1.00 25.00 H new ATOM 0 HG2 LYS A 589 25.287 -0.971 1.846 1.00 25.00 H new ATOM 0 HG3 LYS A 589 24.744 -1.168 0.192 1.00 25.00 H new ATOM 0 HD2 LYS A 589 22.570 -0.191 0.716 1.00 25.00 H new ATOM 0 HD3 LYS A 589 22.935 -0.174 2.430 1.00 25.00 H new ATOM 0 HE2 LYS A 589 23.334 2.049 1.695 1.00 25.00 H new ATOM 0 HE3 LYS A 589 24.925 1.338 1.881 1.00 25.00 H new ATOM 0 HZ1 LYS A 589 25.212 2.149 -0.177 1.00 25.00 H new ATOM 0 HZ2 LYS A 589 24.410 0.737 -0.674 1.00 25.00 H new ATOM 0 HZ3 LYS A 589 23.551 2.194 -0.529 1.00 25.00 H new ATOM 72 N GLY A 590 24.042 -5.021 3.350 1.00 25.00 N ATOM 73 CA GLY A 590 23.584 -6.216 4.061 1.00 25.00 C ATOM 74 C GLY A 590 22.104 -6.542 3.873 1.00 25.00 C ATOM 75 O GLY A 590 21.684 -7.668 4.158 1.00 25.00 O ATOM 0 H GLY A 590 24.152 -4.200 3.945 1.00 25.00 H new ATOM 0 HA2 GLY A 590 24.175 -7.069 3.728 1.00 25.00 H new ATOM 0 HA3 GLY A 590 23.781 -6.087 5.125 1.00 25.00 H new ATOM 79 N TRP A 591 21.316 -5.558 3.409 1.00 25.00 N ATOM 80 CA TRP A 591 19.855 -5.714 3.237 1.00 25.00 C ATOM 81 C TRP A 591 19.479 -6.783 2.198 1.00 25.00 C ATOM 82 O TRP A 591 18.491 -7.494 2.376 1.00 25.00 O ATOM 83 CB TRP A 591 19.197 -4.356 2.885 1.00 25.00 C ATOM 84 CG TRP A 591 19.440 -3.820 1.481 1.00 25.00 C ATOM 85 CD1 TRP A 591 20.440 -2.981 1.064 1.00 25.00 C ATOM 86 CD2 TRP A 591 18.639 -4.083 0.317 1.00 25.00 C ATOM 87 NE1 TRP A 591 20.307 -2.707 -0.276 1.00 25.00 N ATOM 88 CE2 TRP A 591 19.213 -3.374 -0.758 1.00 25.00 C ATOM 89 CE3 TRP A 591 17.492 -4.851 0.077 1.00 25.00 C ATOM 90 CZ2 TRP A 591 18.679 -3.410 -2.043 1.00 25.00 C ATOM 91 CZ3 TRP A 591 16.967 -4.886 -1.200 1.00 25.00 C ATOM 92 CH2 TRP A 591 17.560 -4.170 -2.245 1.00 25.00 C ATOM 0 H TRP A 591 21.666 -4.638 3.143 1.00 25.00 H new ATOM 0 HA TRP A 591 19.468 -6.063 4.194 1.00 25.00 H new ATOM 0 HB2 TRP A 591 18.121 -4.452 3.031 1.00 25.00 H new ATOM 0 HB3 TRP A 591 19.550 -3.612 3.599 1.00 25.00 H new ATOM 0 HD1 TRP A 591 21.222 -2.590 1.699 1.00 25.00 H new ATOM 0 HE1 TRP A 591 20.923 -2.105 -0.822 1.00 25.00 H new ATOM 0 HE3 TRP A 591 17.026 -5.407 0.877 1.00 25.00 H new ATOM 0 HZ2 TRP A 591 19.133 -2.857 -2.852 1.00 25.00 H new ATOM 0 HZ3 TRP A 591 16.084 -5.476 -1.395 1.00 25.00 H new ATOM 0 HH2 TRP A 591 17.125 -4.218 -3.232 1.00 25.00 H new ATOM 103 N HIS A 592 20.284 -6.904 1.136 1.00 25.00 N ATOM 104 CA HIS A 592 20.027 -7.878 0.061 1.00 25.00 C ATOM 105 C HIS A 592 20.303 -9.325 0.528 1.00 25.00 C ATOM 106 O HIS A 592 19.909 -10.284 -0.145 1.00 25.00 O ATOM 107 CB HIS A 592 20.883 -7.530 -1.171 1.00 25.00 C ATOM 108 CG HIS A 592 20.098 -7.273 -2.428 1.00 25.00 C ATOM 109 ND1 HIS A 592 20.297 -6.165 -3.226 1.00 25.00 N ATOM 110 CD2 HIS A 592 19.105 -7.984 -3.019 1.00 25.00 C ATOM 111 CE1 HIS A 592 19.461 -6.205 -4.249 1.00 25.00 C ATOM 112 NE2 HIS A 592 18.730 -7.298 -4.146 1.00 25.00 N ATOM 0 H HIS A 592 21.122 -6.339 0.995 1.00 25.00 H new ATOM 0 HA HIS A 592 18.972 -7.821 -0.208 1.00 25.00 H new ATOM 0 HB2 HIS A 592 21.480 -6.647 -0.944 1.00 25.00 H new ATOM 0 HB3 HIS A 592 21.580 -8.347 -1.355 1.00 25.00 H new ATOM 0 HD2 HIS A 592 18.688 -8.916 -2.668 1.00 25.00 H new ATOM 0 HE1 HIS A 592 19.389 -5.468 -5.035 1.00 25.00 H new ATOM 0 HE2 HIS A 592 18.002 -7.587 -4.800 1.00 25.00 H new ATOM 121 N GLU A 593 20.971 -9.463 1.684 1.00 25.00 N ATOM 122 CA GLU A 593 21.291 -10.775 2.259 1.00 25.00 C ATOM 123 C GLU A 593 20.120 -11.354 3.066 1.00 25.00 C ATOM 124 O GLU A 593 20.021 -12.576 3.222 1.00 25.00 O ATOM 125 CB GLU A 593 22.542 -10.685 3.146 1.00 25.00 C ATOM 126 CG GLU A 593 23.829 -10.360 2.394 1.00 25.00 C ATOM 127 CD GLU A 593 25.048 -10.256 3.299 1.00 25.00 C ATOM 128 OE1 GLU A 593 24.896 -10.449 4.524 1.00 25.00 O ATOM 129 OE2 GLU A 593 26.152 -9.982 2.782 1.00 25.00 O ATOM 0 H GLU A 593 21.301 -8.675 2.241 1.00 25.00 H new ATOM 0 HA GLU A 593 21.486 -11.450 1.425 1.00 25.00 H new ATOM 0 HB2 GLU A 593 22.378 -9.922 3.907 1.00 25.00 H new ATOM 0 HB3 GLU A 593 22.671 -11.633 3.668 1.00 25.00 H new ATOM 0 HG2 GLU A 593 24.007 -11.131 1.644 1.00 25.00 H new ATOM 0 HG3 GLU A 593 23.701 -9.419 1.860 1.00 25.00 H new ATOM 136 N HIS A 594 19.236 -10.477 3.571 1.00 25.00 N ATOM 137 CA HIS A 594 18.071 -10.918 4.351 1.00 25.00 C ATOM 138 C HIS A 594 16.741 -10.666 3.632 1.00 25.00 C ATOM 139 O HIS A 594 15.755 -11.355 3.915 1.00 25.00 O ATOM 140 CB HIS A 594 18.041 -10.286 5.759 1.00 25.00 C ATOM 141 CG HIS A 594 19.235 -10.555 6.628 1.00 25.00 C ATOM 142 ND1 HIS A 594 19.512 -11.800 7.153 1.00 25.00 N ATOM 143 CD2 HIS A 594 20.190 -9.726 7.105 1.00 25.00 C ATOM 144 CE1 HIS A 594 20.585 -11.724 7.919 1.00 25.00 C ATOM 145 NE2 HIS A 594 21.016 -10.476 7.907 1.00 25.00 N ATOM 0 H HIS A 594 19.306 -9.466 3.453 1.00 25.00 H new ATOM 0 HA HIS A 594 18.188 -11.996 4.459 1.00 25.00 H new ATOM 0 HB2 HIS A 594 17.933 -9.207 5.649 1.00 25.00 H new ATOM 0 HB3 HIS A 594 17.152 -10.644 6.277 1.00 25.00 H new ATOM 0 HD2 HIS A 594 20.286 -8.671 6.895 1.00 25.00 H new ATOM 0 HE1 HIS A 594 21.033 -12.543 8.462 1.00 25.00 H new ATOM 0 HE2 HIS A 594 21.830 -10.125 8.411 1.00 25.00 H new ATOM 154 N VAL A 595 16.702 -9.689 2.704 1.00 25.00 N ATOM 155 CA VAL A 595 15.468 -9.407 1.952 1.00 25.00 C ATOM 156 C VAL A 595 15.300 -10.438 0.828 1.00 25.00 C ATOM 157 O VAL A 595 16.187 -10.610 -0.015 1.00 25.00 O ATOM 158 CB VAL A 595 15.431 -7.949 1.379 1.00 25.00 C ATOM 159 CG1 VAL A 595 14.177 -7.684 0.538 1.00 25.00 C ATOM 160 CG2 VAL A 595 15.495 -6.938 2.510 1.00 25.00 C ATOM 0 H VAL A 595 17.494 -9.094 2.462 1.00 25.00 H new ATOM 0 HA VAL A 595 14.633 -9.486 2.648 1.00 25.00 H new ATOM 0 HB VAL A 595 16.300 -7.843 0.730 1.00 25.00 H new ATOM 0 HG11 VAL A 595 14.199 -6.660 0.164 1.00 25.00 H new ATOM 0 HG12 VAL A 595 14.150 -8.377 -0.303 1.00 25.00 H new ATOM 0 HG13 VAL A 595 13.289 -7.826 1.154 1.00 25.00 H new ATOM 0 HG21 VAL A 595 15.469 -5.929 2.098 1.00 25.00 H new ATOM 0 HG22 VAL A 595 14.643 -7.081 3.175 1.00 25.00 H new ATOM 0 HG23 VAL A 595 16.420 -7.077 3.070 1.00 25.00 H new ATOM 170 N THR A 596 14.151 -11.112 0.843 1.00 25.00 N ATOM 171 CA THR A 596 13.844 -12.168 -0.121 1.00 25.00 C ATOM 172 C THR A 596 12.695 -11.775 -1.042 1.00 25.00 C ATOM 173 O THR A 596 12.214 -10.637 -1.009 1.00 25.00 O ATOM 174 CB THR A 596 13.475 -13.501 0.570 1.00 25.00 C ATOM 175 OG1 THR A 596 12.268 -13.354 1.331 1.00 25.00 O ATOM 176 CG2 THR A 596 14.590 -13.996 1.475 1.00 25.00 C ATOM 0 H THR A 596 13.409 -10.942 1.522 1.00 25.00 H new ATOM 0 HA THR A 596 14.754 -12.305 -0.705 1.00 25.00 H new ATOM 0 HB THR A 596 13.323 -14.240 -0.216 1.00 25.00 H new ATOM 0 HG1 THR A 596 12.353 -13.842 2.177 1.00 25.00 H new ATOM 0 HG21 THR A 596 14.291 -14.935 1.941 1.00 25.00 H new ATOM 0 HG22 THR A 596 15.493 -14.155 0.886 1.00 25.00 H new ATOM 0 HG23 THR A 596 14.788 -13.254 2.248 1.00 25.00 H new ATOM 184 N GLN A 597 12.270 -12.735 -1.872 1.00 25.00 N ATOM 185 CA GLN A 597 11.047 -12.605 -2.664 1.00 25.00 C ATOM 186 C GLN A 597 9.815 -12.791 -1.765 1.00 25.00 C ATOM 187 O GLN A 597 8.699 -12.408 -2.131 1.00 25.00 O ATOM 188 CB GLN A 597 11.024 -13.629 -3.812 1.00 25.00 C ATOM 189 CG GLN A 597 12.090 -13.389 -4.875 1.00 25.00 C ATOM 190 CD GLN A 597 12.090 -14.411 -5.997 1.00 25.00 C ATOM 191 OE1 GLN A 597 12.938 -14.383 -6.888 1.00 25.00 O ATOM 192 NE2 GLN A 597 11.124 -15.323 -5.941 1.00 25.00 N ATOM 0 H GLN A 597 12.762 -13.617 -2.011 1.00 25.00 H new ATOM 0 HA GLN A 597 11.025 -11.605 -3.098 1.00 25.00 H new ATOM 0 HB2 GLN A 597 11.157 -14.628 -3.397 1.00 25.00 H new ATOM 0 HB3 GLN A 597 10.042 -13.608 -4.285 1.00 25.00 H new ATOM 0 HG2 GLN A 597 11.944 -12.397 -5.302 1.00 25.00 H new ATOM 0 HG3 GLN A 597 13.070 -13.390 -4.398 1.00 25.00 H new ATOM 0 HE21 GLN A 597 10.445 -15.301 -5.180 1.00 25.00 H new ATOM 0 HE22 GLN A 597 11.062 -16.045 -6.659 1.00 25.00 H new ATOM 201 N ASP A 598 10.046 -13.388 -0.578 1.00 25.00 N ATOM 202 CA ASP A 598 8.984 -13.654 0.394 1.00 25.00 C ATOM 203 C ASP A 598 8.702 -12.421 1.272 1.00 25.00 C ATOM 204 O ASP A 598 7.544 -12.175 1.622 1.00 25.00 O ATOM 205 CB ASP A 598 9.359 -14.866 1.264 1.00 25.00 C ATOM 206 CG ASP A 598 9.238 -16.194 0.529 1.00 25.00 C ATOM 207 OD1 ASP A 598 8.580 -16.227 -0.532 1.00 25.00 O ATOM 208 OD2 ASP A 598 9.805 -17.194 1.016 1.00 25.00 O ATOM 0 H ASP A 598 10.970 -13.695 -0.274 1.00 25.00 H new ATOM 0 HA ASP A 598 8.070 -13.880 -0.155 1.00 25.00 H new ATOM 0 HB2 ASP A 598 10.383 -14.747 1.619 1.00 25.00 H new ATOM 0 HB3 ASP A 598 8.716 -14.886 2.144 1.00 25.00 H new ATOM 213 N LEU A 599 9.756 -11.651 1.631 1.00 25.00 N ATOM 214 CA LEU A 599 9.573 -10.399 2.388 1.00 25.00 C ATOM 215 C LEU A 599 8.786 -9.357 1.589 1.00 25.00 C ATOM 216 O LEU A 599 7.897 -8.706 2.136 1.00 25.00 O ATOM 217 CB LEU A 599 10.923 -9.790 2.845 1.00 25.00 C ATOM 218 CG LEU A 599 10.855 -8.504 3.706 1.00 25.00 C ATOM 219 CD1 LEU A 599 10.070 -8.762 4.981 1.00 25.00 C ATOM 220 CD2 LEU A 599 12.231 -7.978 4.092 1.00 25.00 C ATOM 0 H LEU A 599 10.727 -11.874 1.411 1.00 25.00 H new ATOM 0 HA LEU A 599 8.998 -10.668 3.274 1.00 25.00 H new ATOM 0 HB2 LEU A 599 11.464 -10.549 3.411 1.00 25.00 H new ATOM 0 HB3 LEU A 599 11.515 -9.573 1.956 1.00 25.00 H new ATOM 0 HG LEU A 599 10.361 -7.753 3.090 1.00 25.00 H new ATOM 0 HD11 LEU A 599 10.031 -7.849 5.575 1.00 25.00 H new ATOM 0 HD12 LEU A 599 9.057 -9.074 4.728 1.00 25.00 H new ATOM 0 HD13 LEU A 599 10.558 -9.549 5.556 1.00 25.00 H new ATOM 0 HD21 LEU A 599 12.120 -7.076 4.694 1.00 25.00 H new ATOM 0 HD22 LEU A 599 12.762 -8.736 4.668 1.00 25.00 H new ATOM 0 HD23 LEU A 599 12.797 -7.745 3.190 1.00 25.00 H new ATOM 232 N ARG A 600 9.083 -9.237 0.287 1.00 25.00 N ATOM 233 CA ARG A 600 8.434 -8.232 -0.571 1.00 25.00 C ATOM 234 C ARG A 600 6.916 -8.481 -0.715 1.00 25.00 C ATOM 235 O ARG A 600 6.156 -7.553 -0.997 1.00 25.00 O ATOM 236 CB ARG A 600 9.123 -8.170 -1.957 1.00 25.00 C ATOM 237 CG ARG A 600 10.570 -7.676 -1.955 1.00 25.00 C ATOM 238 CD ARG A 600 11.227 -7.888 -3.309 1.00 25.00 C ATOM 239 NE ARG A 600 10.542 -7.153 -4.379 1.00 25.00 N ATOM 240 CZ ARG A 600 10.887 -7.194 -5.676 1.00 25.00 C ATOM 241 NH1 ARG A 600 11.914 -7.933 -6.096 1.00 25.00 N ATOM 242 NH2 ARG A 600 10.197 -6.486 -6.559 1.00 25.00 N ATOM 0 H ARG A 600 9.766 -9.821 -0.195 1.00 25.00 H new ATOM 0 HA ARG A 600 8.551 -7.264 -0.083 1.00 25.00 H new ATOM 0 HB2 ARG A 600 9.099 -9.166 -2.400 1.00 25.00 H new ATOM 0 HB3 ARG A 600 8.537 -7.519 -2.605 1.00 25.00 H new ATOM 0 HG2 ARG A 600 10.595 -6.617 -1.698 1.00 25.00 H new ATOM 0 HG3 ARG A 600 11.136 -8.204 -1.187 1.00 25.00 H new ATOM 0 HD2 ARG A 600 12.268 -7.568 -3.260 1.00 25.00 H new ATOM 0 HD3 ARG A 600 11.231 -8.952 -3.546 1.00 25.00 H new ATOM 0 HE ARG A 600 9.747 -6.569 -4.119 1.00 25.00 H new ATOM 0 HH11 ARG A 600 12.455 -8.482 -5.427 1.00 25.00 H new ATOM 0 HH12 ARG A 600 12.159 -7.950 -7.086 1.00 25.00 H new ATOM 0 HH21 ARG A 600 9.410 -5.915 -6.252 1.00 25.00 H new ATOM 0 HH22 ARG A 600 10.453 -6.512 -7.546 1.00 25.00 H new ATOM 256 N SER A 601 6.499 -9.741 -0.509 1.00 25.00 N ATOM 257 CA SER A 601 5.089 -10.136 -0.604 1.00 25.00 C ATOM 258 C SER A 601 4.334 -9.876 0.712 1.00 25.00 C ATOM 259 O SER A 601 3.152 -9.523 0.691 1.00 25.00 O ATOM 260 CB SER A 601 4.990 -11.620 -0.981 1.00 25.00 C ATOM 261 OG SER A 601 5.457 -12.453 0.069 1.00 25.00 O ATOM 0 H SER A 601 7.128 -10.509 -0.273 1.00 25.00 H new ATOM 0 HA SER A 601 4.622 -9.528 -1.379 1.00 25.00 H new ATOM 0 HB2 SER A 601 3.955 -11.870 -1.213 1.00 25.00 H new ATOM 0 HB3 SER A 601 5.573 -11.808 -1.883 1.00 25.00 H new ATOM 0 HG SER A 601 6.114 -11.964 0.607 1.00 25.00 H new ATOM 267 N HIS A 602 5.029 -10.057 1.851 1.00 25.00 N ATOM 268 CA HIS A 602 4.443 -9.841 3.187 1.00 25.00 C ATOM 269 C HIS A 602 4.318 -8.344 3.496 1.00 25.00 C ATOM 270 O HIS A 602 3.384 -7.923 4.179 1.00 25.00 O ATOM 271 CB HIS A 602 5.297 -10.552 4.254 1.00 25.00 C ATOM 272 CG HIS A 602 5.429 -12.039 4.065 1.00 25.00 C ATOM 273 ND1 HIS A 602 6.422 -12.790 4.659 1.00 25.00 N ATOM 274 CD2 HIS A 602 4.683 -12.910 3.344 1.00 25.00 C ATOM 275 CE1 HIS A 602 6.281 -14.057 4.311 1.00 25.00 C ATOM 276 NE2 HIS A 602 5.235 -14.157 3.514 1.00 25.00 N ATOM 0 H HIS A 602 6.004 -10.355 1.871 1.00 25.00 H new ATOM 0 HA HIS A 602 3.439 -10.266 3.201 1.00 25.00 H new ATOM 0 HB2 HIS A 602 6.293 -10.110 4.256 1.00 25.00 H new ATOM 0 HB3 HIS A 602 4.861 -10.361 5.235 1.00 25.00 H new ATOM 0 HD2 HIS A 602 3.816 -12.669 2.747 1.00 25.00 H new ATOM 0 HE1 HIS A 602 6.915 -14.873 4.626 1.00 25.00 H new ATOM 0 HE2 HIS A 602 4.891 -15.020 3.092 1.00 25.00 H new ATOM 285 N LEU A 603 5.281 -7.562 2.998 1.00 25.00 N ATOM 286 CA LEU A 603 5.232 -6.105 3.041 1.00 25.00 C ATOM 287 C LEU A 603 4.126 -5.527 2.159 1.00 25.00 C ATOM 288 O LEU A 603 3.636 -4.422 2.408 1.00 25.00 O ATOM 289 CB LEU A 603 6.591 -5.567 2.637 1.00 25.00 C ATOM 290 CG LEU A 603 7.693 -5.917 3.639 1.00 25.00 C ATOM 291 CD1 LEU A 603 9.058 -5.423 3.200 1.00 25.00 C ATOM 292 CD2 LEU A 603 7.372 -5.398 5.008 1.00 25.00 C ATOM 0 H LEU A 603 6.121 -7.929 2.551 1.00 25.00 H new ATOM 0 HA LEU A 603 4.992 -5.795 4.058 1.00 25.00 H new ATOM 0 HB2 LEU A 603 6.857 -5.966 1.658 1.00 25.00 H new ATOM 0 HB3 LEU A 603 6.531 -4.483 2.534 1.00 25.00 H new ATOM 0 HG LEU A 603 7.735 -7.006 3.676 1.00 25.00 H new ATOM 0 HD11 LEU A 603 9.802 -5.698 3.947 1.00 25.00 H new ATOM 0 HD12 LEU A 603 9.319 -5.877 2.244 1.00 25.00 H new ATOM 0 HD13 LEU A 603 9.035 -4.339 3.093 1.00 25.00 H new ATOM 0 HD21 LEU A 603 8.175 -5.664 5.695 1.00 25.00 H new ATOM 0 HD22 LEU A 603 7.270 -4.313 4.971 1.00 25.00 H new ATOM 0 HD23 LEU A 603 6.437 -5.839 5.354 1.00 25.00 H new ATOM 304 N VAL A 604 3.748 -6.288 1.129 1.00 25.00 N ATOM 305 CA VAL A 604 2.609 -5.968 0.286 1.00 25.00 C ATOM 306 C VAL A 604 1.303 -6.463 0.945 1.00 25.00 C ATOM 307 O VAL A 604 0.238 -5.888 0.729 1.00 25.00 O ATOM 308 CB VAL A 604 2.839 -6.548 -1.139 1.00 25.00 C ATOM 309 CG1 VAL A 604 1.557 -6.685 -1.950 1.00 25.00 C ATOM 310 CG2 VAL A 604 3.814 -5.651 -1.882 1.00 25.00 C ATOM 0 H VAL A 604 4.230 -7.146 0.861 1.00 25.00 H new ATOM 0 HA VAL A 604 2.507 -4.888 0.178 1.00 25.00 H new ATOM 0 HB VAL A 604 3.240 -7.554 -1.017 1.00 25.00 H new ATOM 0 HG11 VAL A 604 1.790 -7.095 -2.933 1.00 25.00 H new ATOM 0 HG12 VAL A 604 0.868 -7.353 -1.432 1.00 25.00 H new ATOM 0 HG13 VAL A 604 1.094 -5.705 -2.066 1.00 25.00 H new ATOM 0 HG21 VAL A 604 3.983 -6.048 -2.883 1.00 25.00 H new ATOM 0 HG22 VAL A 604 3.400 -4.645 -1.956 1.00 25.00 H new ATOM 0 HG23 VAL A 604 4.760 -5.615 -1.341 1.00 25.00 H new ATOM 320 N HIS A 605 1.417 -7.523 1.761 1.00 25.00 N ATOM 321 CA HIS A 605 0.312 -7.996 2.611 1.00 25.00 C ATOM 322 C HIS A 605 0.181 -7.096 3.856 1.00 25.00 C ATOM 323 O HIS A 605 -0.842 -7.107 4.544 1.00 25.00 O ATOM 324 CB HIS A 605 0.542 -9.463 3.016 1.00 25.00 C ATOM 325 CG HIS A 605 -0.600 -10.086 3.774 1.00 25.00 C ATOM 326 ND1 HIS A 605 -1.843 -10.299 3.218 1.00 25.00 N ATOM 327 CD2 HIS A 605 -0.683 -10.526 5.055 1.00 25.00 C ATOM 328 CE1 HIS A 605 -2.642 -10.841 4.122 1.00 25.00 C ATOM 329 NE2 HIS A 605 -1.962 -10.990 5.243 1.00 25.00 N ATOM 0 H HIS A 605 2.271 -8.073 1.850 1.00 25.00 H new ATOM 0 HA HIS A 605 -0.619 -7.941 2.047 1.00 25.00 H new ATOM 0 HB2 HIS A 605 0.728 -10.050 2.117 1.00 25.00 H new ATOM 0 HB3 HIS A 605 1.443 -9.521 3.627 1.00 25.00 H new ATOM 0 HD2 HIS A 605 0.109 -10.514 5.789 1.00 25.00 H new ATOM 0 HE1 HIS A 605 -3.675 -11.115 3.969 1.00 25.00 H new ATOM 0 HE2 HIS A 605 -2.327 -11.386 6.109 1.00 25.00 H new ATOM 338 N LYS A 606 1.248 -6.325 4.114 1.00 25.00 N ATOM 339 CA LYS A 606 1.304 -5.333 5.200 1.00 25.00 C ATOM 340 C LYS A 606 0.638 -4.032 4.717 1.00 25.00 C ATOM 341 O LYS A 606 0.073 -3.259 5.494 1.00 25.00 O ATOM 342 CB LYS A 606 2.786 -5.075 5.541 1.00 25.00 C ATOM 343 CG LYS A 606 3.045 -4.134 6.715 1.00 25.00 C ATOM 344 CD LYS A 606 4.533 -4.061 7.035 1.00 25.00 C ATOM 345 CE LYS A 606 4.805 -3.116 8.181 1.00 25.00 C ATOM 346 NZ LYS A 606 6.247 -3.085 8.550 1.00 25.00 N ATOM 0 H LYS A 606 2.108 -6.373 3.567 1.00 25.00 H new ATOM 0 HA LYS A 606 0.781 -5.694 6.086 1.00 25.00 H new ATOM 0 HB2 LYS A 606 3.262 -6.032 5.756 1.00 25.00 H new ATOM 0 HB3 LYS A 606 3.276 -4.666 4.658 1.00 25.00 H new ATOM 0 HG2 LYS A 606 2.671 -3.138 6.478 1.00 25.00 H new ATOM 0 HG3 LYS A 606 2.497 -4.480 7.591 1.00 25.00 H new ATOM 0 HD2 LYS A 606 4.902 -5.055 7.286 1.00 25.00 H new ATOM 0 HD3 LYS A 606 5.081 -3.732 6.152 1.00 25.00 H new ATOM 0 HE2 LYS A 606 4.479 -2.112 7.908 1.00 25.00 H new ATOM 0 HE3 LYS A 606 4.216 -3.418 9.047 1.00 25.00 H new ATOM 0 HZ1 LYS A 606 6.389 -2.424 9.340 1.00 25.00 H new ATOM 0 HZ2 LYS A 606 6.553 -4.037 8.836 1.00 25.00 H new ATOM 0 HZ3 LYS A 606 6.808 -2.772 7.732 1.00 25.00 H new ATOM 360 N LEU A 607 0.747 -3.846 3.408 1.00 25.00 N ATOM 361 CA LEU A 607 0.292 -2.672 2.681 1.00 25.00 C ATOM 362 C LEU A 607 -1.181 -2.803 2.240 1.00 25.00 C ATOM 363 O LEU A 607 -1.936 -1.830 2.293 1.00 25.00 O ATOM 364 CB LEU A 607 1.268 -2.545 1.514 1.00 25.00 C ATOM 365 CG LEU A 607 1.145 -1.386 0.504 1.00 25.00 C ATOM 366 CD1 LEU A 607 1.037 -0.007 1.142 1.00 25.00 C ATOM 367 CD2 LEU A 607 2.371 -1.411 -0.373 1.00 25.00 C ATOM 0 H LEU A 607 1.175 -4.542 2.798 1.00 25.00 H new ATOM 0 HA LEU A 607 0.295 -1.771 3.294 1.00 25.00 H new ATOM 0 HB2 LEU A 607 2.270 -2.494 1.939 1.00 25.00 H new ATOM 0 HB3 LEU A 607 1.210 -3.473 0.945 1.00 25.00 H new ATOM 0 HG LEU A 607 0.219 -1.541 -0.050 1.00 25.00 H new ATOM 0 HD11 LEU A 607 0.954 0.749 0.362 1.00 25.00 H new ATOM 0 HD12 LEU A 607 0.154 0.031 1.779 1.00 25.00 H new ATOM 0 HD13 LEU A 607 1.926 0.187 1.742 1.00 25.00 H new ATOM 0 HD21 LEU A 607 2.315 -0.601 -1.100 1.00 25.00 H new ATOM 0 HD22 LEU A 607 3.261 -1.284 0.243 1.00 25.00 H new ATOM 0 HD23 LEU A 607 2.425 -2.366 -0.896 1.00 25.00 H new ATOM 379 N VAL A 608 -1.572 -4.019 1.820 1.00 25.00 N ATOM 380 CA VAL A 608 -2.962 -4.329 1.409 1.00 25.00 C ATOM 381 C VAL A 608 -3.900 -4.445 2.637 1.00 25.00 C ATOM 382 O VAL A 608 -5.117 -4.277 2.504 1.00 25.00 O ATOM 383 CB VAL A 608 -3.003 -5.641 0.544 1.00 25.00 C ATOM 384 CG1 VAL A 608 -4.416 -6.208 0.393 1.00 25.00 C ATOM 385 CG2 VAL A 608 -2.422 -5.388 -0.844 1.00 25.00 C ATOM 0 H VAL A 608 -0.939 -4.816 1.754 1.00 25.00 H new ATOM 0 HA VAL A 608 -3.323 -3.503 0.796 1.00 25.00 H new ATOM 0 HB VAL A 608 -2.400 -6.376 1.078 1.00 25.00 H new ATOM 0 HG11 VAL A 608 -4.382 -7.113 -0.214 1.00 25.00 H new ATOM 0 HG12 VAL A 608 -4.820 -6.446 1.377 1.00 25.00 H new ATOM 0 HG13 VAL A 608 -5.054 -5.470 -0.092 1.00 25.00 H new ATOM 0 HG21 VAL A 608 -2.459 -6.308 -1.427 1.00 25.00 H new ATOM 0 HG22 VAL A 608 -3.004 -4.616 -1.347 1.00 25.00 H new ATOM 0 HG23 VAL A 608 -1.387 -5.059 -0.751 1.00 25.00 H new ATOM 395 N GLN A 609 -3.328 -4.714 3.822 1.00 25.00 N ATOM 396 CA GLN A 609 -4.122 -4.858 5.054 1.00 25.00 C ATOM 397 C GLN A 609 -4.446 -3.488 5.670 1.00 25.00 C ATOM 398 O GLN A 609 -5.445 -3.337 6.379 1.00 25.00 O ATOM 399 CB GLN A 609 -3.419 -5.782 6.067 1.00 25.00 C ATOM 400 CG GLN A 609 -4.224 -6.046 7.320 1.00 25.00 C ATOM 401 CD GLN A 609 -3.539 -6.995 8.285 1.00 25.00 C ATOM 402 OE1 GLN A 609 -2.489 -7.562 7.976 1.00 25.00 O ATOM 403 NE2 GLN A 609 -4.128 -7.173 9.462 1.00 25.00 N ATOM 0 H GLN A 609 -2.324 -4.836 3.953 1.00 25.00 H new ATOM 0 HA GLN A 609 -5.068 -5.328 4.786 1.00 25.00 H new ATOM 0 HB2 GLN A 609 -3.197 -6.733 5.583 1.00 25.00 H new ATOM 0 HB3 GLN A 609 -2.464 -5.337 6.348 1.00 25.00 H new ATOM 0 HG2 GLN A 609 -4.416 -5.100 7.826 1.00 25.00 H new ATOM 0 HG3 GLN A 609 -5.193 -6.460 7.040 1.00 25.00 H new ATOM 0 HE21 GLN A 609 -4.997 -6.684 9.677 1.00 25.00 H new ATOM 0 HE22 GLN A 609 -3.712 -7.799 10.151 1.00 25.00 H new ATOM 412 N ALA A 610 -3.585 -2.501 5.381 1.00 25.00 N ATOM 413 CA ALA A 610 -3.807 -1.115 5.792 1.00 25.00 C ATOM 414 C ALA A 610 -4.800 -0.405 4.861 1.00 25.00 C ATOM 415 O ALA A 610 -5.424 0.586 5.252 1.00 25.00 O ATOM 416 CB ALA A 610 -2.481 -0.376 5.821 1.00 25.00 C ATOM 0 H ALA A 610 -2.721 -2.644 4.858 1.00 25.00 H new ATOM 0 HA ALA A 610 -4.242 -1.117 6.791 1.00 25.00 H new ATOM 0 HB1 ALA A 610 -2.647 0.657 6.127 1.00 25.00 H new ATOM 0 HB2 ALA A 610 -1.809 -0.861 6.529 1.00 25.00 H new ATOM 0 HB3 ALA A 610 -2.034 -0.392 4.827 1.00 25.00 H new ATOM 422 N ILE A 611 -4.938 -0.927 3.630 1.00 25.00 N ATOM 423 CA ILE A 611 -5.895 -0.395 2.652 1.00 25.00 C ATOM 424 C ILE A 611 -7.264 -1.080 2.837 1.00 25.00 C ATOM 425 O ILE A 611 -8.265 -0.405 3.099 1.00 25.00 O ATOM 426 CB ILE A 611 -5.378 -0.559 1.177 1.00 25.00 C ATOM 427 CG1 ILE A 611 -4.150 0.337 0.932 1.00 25.00 C ATOM 428 CG2 ILE A 611 -6.475 -0.199 0.174 1.00 25.00 C ATOM 429 CD1 ILE A 611 -3.473 0.159 -0.423 1.00 25.00 C ATOM 0 H ILE A 611 -4.395 -1.721 3.290 1.00 25.00 H new ATOM 0 HA ILE A 611 -6.004 0.675 2.831 1.00 25.00 H new ATOM 0 HB ILE A 611 -5.096 -1.603 1.037 1.00 25.00 H new ATOM 0 HG12 ILE A 611 -4.455 1.379 1.033 1.00 25.00 H new ATOM 0 HG13 ILE A 611 -3.417 0.142 1.714 1.00 25.00 H new ATOM 0 HG21 ILE A 611 -6.095 -0.320 -0.840 1.00 25.00 H new ATOM 0 HG22 ILE A 611 -7.332 -0.856 0.321 1.00 25.00 H new ATOM 0 HG23 ILE A 611 -6.781 0.836 0.326 1.00 25.00 H new ATOM 0 HD11 ILE A 611 -2.621 0.835 -0.495 1.00 25.00 H new ATOM 0 HD12 ILE A 611 -3.130 -0.870 -0.526 1.00 25.00 H new ATOM 0 HD13 ILE A 611 -4.184 0.385 -1.218 1.00 25.00 H new ATOM 441 N PHE A 612 -7.292 -2.414 2.696 1.00 25.00 N ATOM 442 CA PHE A 612 -8.504 -3.196 2.914 1.00 25.00 C ATOM 443 C PHE A 612 -8.172 -4.511 3.658 1.00 25.00 C ATOM 444 O PHE A 612 -7.657 -5.453 3.045 1.00 25.00 O ATOM 445 CB PHE A 612 -9.201 -3.472 1.560 1.00 25.00 C ATOM 446 CG PHE A 612 -10.515 -4.205 1.664 1.00 25.00 C ATOM 447 CD1 PHE A 612 -11.669 -3.516 1.987 1.00 25.00 C ATOM 448 CD2 PHE A 612 -10.590 -5.569 1.438 1.00 25.00 C ATOM 449 CE1 PHE A 612 -12.882 -4.174 2.083 1.00 25.00 C ATOM 450 CE2 PHE A 612 -11.798 -6.234 1.533 1.00 25.00 C ATOM 451 CZ PHE A 612 -12.946 -5.535 1.855 1.00 25.00 C ATOM 0 H PHE A 612 -6.480 -2.971 2.430 1.00 25.00 H new ATOM 0 HA PHE A 612 -9.191 -2.628 3.541 1.00 25.00 H new ATOM 0 HB2 PHE A 612 -9.370 -2.522 1.054 1.00 25.00 H new ATOM 0 HB3 PHE A 612 -8.526 -4.052 0.931 1.00 25.00 H new ATOM 0 HD1 PHE A 612 -11.623 -2.452 2.166 1.00 25.00 H new ATOM 0 HD2 PHE A 612 -9.696 -6.119 1.185 1.00 25.00 H new ATOM 0 HE1 PHE A 612 -13.777 -3.625 2.336 1.00 25.00 H new ATOM 0 HE2 PHE A 612 -11.845 -7.298 1.356 1.00 25.00 H new ATOM 0 HZ PHE A 612 -13.891 -6.052 1.928 1.00 25.00 H new ATOM 461 N PRO A 613 -8.445 -4.594 5.001 1.00 25.00 N ATOM 462 CA PRO A 613 -8.290 -5.845 5.755 1.00 25.00 C ATOM 463 C PRO A 613 -9.502 -6.775 5.615 1.00 25.00 C ATOM 464 O PRO A 613 -10.649 -6.312 5.602 1.00 25.00 O ATOM 465 CB PRO A 613 -8.126 -5.380 7.205 1.00 25.00 C ATOM 466 CG PRO A 613 -8.854 -4.074 7.317 1.00 25.00 C ATOM 467 CD PRO A 613 -8.883 -3.480 5.881 1.00 25.00 C ATOM 0 HA PRO A 613 -7.447 -6.432 5.389 1.00 25.00 H new ATOM 0 HB2 PRO A 613 -8.538 -6.115 7.897 1.00 25.00 H new ATOM 0 HB3 PRO A 613 -7.072 -5.260 7.457 1.00 25.00 H new ATOM 0 HG2 PRO A 613 -9.864 -4.221 7.700 1.00 25.00 H new ATOM 0 HG3 PRO A 613 -8.346 -3.401 8.008 1.00 25.00 H new ATOM 0 HD2 PRO A 613 -9.882 -3.136 5.615 1.00 25.00 H new ATOM 0 HD3 PRO A 613 -8.217 -2.622 5.794 1.00 25.00 H new ATOM 475 N THR A 614 -9.235 -8.081 5.509 1.00 25.00 N ATOM 476 CA THR A 614 -10.292 -9.081 5.318 1.00 25.00 C ATOM 477 C THR A 614 -9.872 -10.478 5.825 1.00 25.00 C ATOM 478 O THR A 614 -8.798 -10.973 5.468 1.00 25.00 O ATOM 479 CB THR A 614 -10.776 -9.169 3.841 1.00 25.00 C ATOM 480 OG1 THR A 614 -11.677 -10.275 3.669 1.00 25.00 O ATOM 481 CG2 THR A 614 -9.617 -9.297 2.861 1.00 25.00 C ATOM 0 H THR A 614 -8.294 -8.471 5.552 1.00 25.00 H new ATOM 0 HA THR A 614 -11.131 -8.736 5.922 1.00 25.00 H new ATOM 0 HB THR A 614 -11.296 -8.236 3.624 1.00 25.00 H new ATOM 0 HG1 THR A 614 -11.972 -10.314 2.735 1.00 25.00 H new ATOM 0 HG21 THR A 614 -10.005 -9.355 1.844 1.00 25.00 H new ATOM 0 HG22 THR A 614 -8.966 -8.428 2.952 1.00 25.00 H new ATOM 0 HG23 THR A 614 -9.049 -10.200 3.085 1.00 25.00 H new ATOM 489 N PRO A 615 -10.726 -11.122 6.684 1.00 25.00 N ATOM 490 CA PRO A 615 -10.553 -12.528 7.131 1.00 25.00 C ATOM 491 C PRO A 615 -10.328 -13.532 5.989 1.00 25.00 C ATOM 492 O PRO A 615 -9.346 -14.279 5.992 1.00 25.00 O ATOM 493 CB PRO A 615 -11.886 -12.832 7.808 1.00 25.00 C ATOM 494 CG PRO A 615 -12.341 -11.527 8.346 1.00 25.00 C ATOM 495 CD PRO A 615 -11.910 -10.502 7.339 1.00 25.00 C ATOM 0 HA PRO A 615 -9.668 -12.627 7.760 1.00 25.00 H new ATOM 0 HB2 PRO A 615 -12.606 -13.241 7.099 1.00 25.00 H new ATOM 0 HB3 PRO A 615 -11.768 -13.568 8.603 1.00 25.00 H new ATOM 0 HG2 PRO A 615 -13.423 -11.514 8.480 1.00 25.00 H new ATOM 0 HG3 PRO A 615 -11.897 -11.329 9.321 1.00 25.00 H new ATOM 0 HD2 PRO A 615 -12.701 -10.292 6.619 1.00 25.00 H new ATOM 0 HD3 PRO A 615 -11.653 -9.556 7.816 1.00 25.00 H new ATOM 503 N ASP A 616 -11.261 -13.535 5.030 1.00 25.00 N ATOM 504 CA ASP A 616 -11.249 -14.471 3.893 1.00 25.00 C ATOM 505 C ASP A 616 -10.141 -14.144 2.872 1.00 25.00 C ATOM 506 O ASP A 616 -10.150 -13.063 2.274 1.00 25.00 O ATOM 507 CB ASP A 616 -12.615 -14.475 3.190 1.00 25.00 C ATOM 508 CG ASP A 616 -12.766 -15.617 2.201 1.00 25.00 C ATOM 509 OD1 ASP A 616 -11.813 -16.410 2.058 1.00 25.00 O ATOM 510 OD2 ASP A 616 -13.838 -15.714 1.566 1.00 25.00 O ATOM 0 H ASP A 616 -12.049 -12.888 5.018 1.00 25.00 H new ATOM 0 HA ASP A 616 -11.040 -15.460 4.300 1.00 25.00 H new ATOM 0 HB2 ASP A 616 -13.404 -14.543 3.939 1.00 25.00 H new ATOM 0 HB3 ASP A 616 -12.752 -13.528 2.668 1.00 25.00 H new ATOM 515 N PRO A 617 -9.150 -15.076 2.667 1.00 25.00 N ATOM 516 CA PRO A 617 -8.119 -14.934 1.605 1.00 25.00 C ATOM 517 C PRO A 617 -8.685 -14.992 0.168 1.00 25.00 C ATOM 518 O PRO A 617 -7.973 -14.691 -0.795 1.00 25.00 O ATOM 519 CB PRO A 617 -7.191 -16.137 1.849 1.00 25.00 C ATOM 520 CG PRO A 617 -8.054 -17.158 2.505 1.00 25.00 C ATOM 521 CD PRO A 617 -8.911 -16.306 3.475 1.00 25.00 C ATOM 0 HA PRO A 617 -7.633 -13.960 1.666 1.00 25.00 H new ATOM 0 HB2 PRO A 617 -6.776 -16.512 0.914 1.00 25.00 H new ATOM 0 HB3 PRO A 617 -6.349 -15.864 2.485 1.00 25.00 H new ATOM 0 HG2 PRO A 617 -8.671 -17.692 1.782 1.00 25.00 H new ATOM 0 HG3 PRO A 617 -7.465 -17.906 3.035 1.00 25.00 H new ATOM 0 HD2 PRO A 617 -9.841 -16.805 3.745 1.00 25.00 H new ATOM 0 HD3 PRO A 617 -8.384 -16.089 4.404 1.00 25.00 H new ATOM 529 N ALA A 618 -9.969 -15.372 0.045 1.00 25.00 N ATOM 530 CA ALA A 618 -10.629 -15.544 -1.260 1.00 25.00 C ATOM 531 C ALA A 618 -10.984 -14.207 -1.932 1.00 25.00 C ATOM 532 O ALA A 618 -11.332 -14.179 -3.117 1.00 25.00 O ATOM 533 CB ALA A 618 -11.880 -16.398 -1.092 1.00 25.00 C ATOM 0 H ALA A 618 -10.575 -15.567 0.842 1.00 25.00 H new ATOM 0 HA ALA A 618 -9.919 -16.045 -1.918 1.00 25.00 H new ATOM 0 HB1 ALA A 618 -12.367 -16.524 -2.059 1.00 25.00 H new ATOM 0 HB2 ALA A 618 -11.603 -17.375 -0.695 1.00 25.00 H new ATOM 0 HB3 ALA A 618 -12.566 -15.907 -0.402 1.00 25.00 H new ATOM 539 N ALA A 619 -10.887 -13.106 -1.170 1.00 25.00 N ATOM 540 CA ALA A 619 -11.170 -11.760 -1.688 1.00 25.00 C ATOM 541 C ALA A 619 -9.960 -11.156 -2.409 1.00 25.00 C ATOM 542 O ALA A 619 -10.098 -10.183 -3.159 1.00 25.00 O ATOM 543 CB ALA A 619 -11.595 -10.843 -0.553 1.00 25.00 C ATOM 0 H ALA A 619 -10.613 -13.123 -0.188 1.00 25.00 H new ATOM 0 HA ALA A 619 -11.979 -11.854 -2.412 1.00 25.00 H new ATOM 0 HB1 ALA A 619 -11.802 -9.848 -0.947 1.00 25.00 H new ATOM 0 HB2 ALA A 619 -12.493 -11.241 -0.081 1.00 25.00 H new ATOM 0 HB3 ALA A 619 -10.795 -10.782 0.184 1.00 25.00 H new ATOM 549 N LEU A 620 -8.782 -11.748 -2.180 1.00 25.00 N ATOM 550 CA LEU A 620 -7.527 -11.250 -2.739 1.00 25.00 C ATOM 551 C LEU A 620 -7.269 -11.795 -4.156 1.00 25.00 C ATOM 552 O LEU A 620 -6.273 -11.437 -4.795 1.00 25.00 O ATOM 553 CB LEU A 620 -6.351 -11.629 -1.806 1.00 25.00 C ATOM 554 CG LEU A 620 -6.342 -11.054 -0.359 1.00 25.00 C ATOM 555 CD1 LEU A 620 -5.177 -11.597 0.464 1.00 25.00 C ATOM 556 CD2 LEU A 620 -6.331 -9.528 -0.347 1.00 25.00 C ATOM 0 H LEU A 620 -8.676 -12.583 -1.604 1.00 25.00 H new ATOM 0 HA LEU A 620 -7.606 -10.165 -2.814 1.00 25.00 H new ATOM 0 HB2 LEU A 620 -6.322 -12.716 -1.732 1.00 25.00 H new ATOM 0 HB3 LEU A 620 -5.427 -11.318 -2.293 1.00 25.00 H new ATOM 0 HG LEU A 620 -7.270 -11.388 0.105 1.00 25.00 H new ATOM 0 HD11 LEU A 620 -5.209 -11.170 1.466 1.00 25.00 H new ATOM 0 HD12 LEU A 620 -5.253 -12.682 0.530 1.00 25.00 H new ATOM 0 HD13 LEU A 620 -4.236 -11.327 -0.015 1.00 25.00 H new ATOM 0 HD21 LEU A 620 -6.325 -9.172 0.683 1.00 25.00 H new ATOM 0 HD22 LEU A 620 -5.440 -9.167 -0.861 1.00 25.00 H new ATOM 0 HD23 LEU A 620 -7.220 -9.154 -0.855 1.00 25.00 H new ATOM 568 N LYS A 621 -8.181 -12.651 -4.640 1.00 25.00 N ATOM 569 CA LYS A 621 -8.060 -13.267 -5.965 1.00 25.00 C ATOM 570 C LYS A 621 -9.088 -12.657 -6.940 1.00 25.00 C ATOM 571 O LYS A 621 -9.332 -13.192 -8.029 1.00 25.00 O ATOM 572 CB LYS A 621 -8.247 -14.796 -5.841 1.00 25.00 C ATOM 573 CG LYS A 621 -7.265 -15.510 -4.903 1.00 25.00 C ATOM 574 CD LYS A 621 -5.813 -15.333 -5.329 1.00 25.00 C ATOM 575 CE LYS A 621 -4.888 -16.094 -4.412 1.00 25.00 C ATOM 576 NZ LYS A 621 -3.458 -15.757 -4.652 1.00 25.00 N ATOM 0 H LYS A 621 -9.016 -12.933 -4.127 1.00 25.00 H new ATOM 0 HA LYS A 621 -7.066 -13.068 -6.367 1.00 25.00 H new ATOM 0 HB2 LYS A 621 -9.261 -14.993 -5.494 1.00 25.00 H new ATOM 0 HB3 LYS A 621 -8.159 -15.237 -6.834 1.00 25.00 H new ATOM 0 HG2 LYS A 621 -7.392 -15.127 -3.890 1.00 25.00 H new ATOM 0 HG3 LYS A 621 -7.504 -16.573 -4.874 1.00 25.00 H new ATOM 0 HD2 LYS A 621 -5.685 -15.682 -6.353 1.00 25.00 H new ATOM 0 HD3 LYS A 621 -5.553 -14.275 -5.318 1.00 25.00 H new ATOM 0 HE2 LYS A 621 -5.143 -15.873 -3.376 1.00 25.00 H new ATOM 0 HE3 LYS A 621 -5.037 -17.164 -4.555 1.00 25.00 H new ATOM 0 HZ1 LYS A 621 -2.859 -16.303 -4.000 1.00 25.00 H new ATOM 0 HZ2 LYS A 621 -3.206 -15.992 -5.633 1.00 25.00 H new ATOM 0 HZ3 LYS A 621 -3.309 -14.740 -4.490 1.00 25.00 H new ATOM 590 N ASP A 622 -9.671 -11.517 -6.538 1.00 25.00 N ATOM 591 CA ASP A 622 -10.700 -10.829 -7.321 1.00 25.00 C ATOM 592 C ASP A 622 -10.062 -9.947 -8.411 1.00 25.00 C ATOM 593 O ASP A 622 -8.871 -9.629 -8.345 1.00 25.00 O ATOM 594 CB ASP A 622 -11.575 -9.991 -6.374 1.00 25.00 C ATOM 595 CG ASP A 622 -12.773 -9.355 -7.063 1.00 25.00 C ATOM 596 OD1 ASP A 622 -13.778 -10.064 -7.279 1.00 25.00 O ATOM 597 OD2 ASP A 622 -12.701 -8.152 -7.387 1.00 25.00 O ATOM 0 H ASP A 622 -9.440 -11.049 -5.661 1.00 25.00 H new ATOM 0 HA ASP A 622 -11.324 -11.567 -7.825 1.00 25.00 H new ATOM 0 HB2 ASP A 622 -11.927 -10.625 -5.560 1.00 25.00 H new ATOM 0 HB3 ASP A 622 -10.965 -9.207 -5.926 1.00 25.00 H new ATOM 602 N ARG A 623 -10.878 -9.560 -9.403 1.00 25.00 N ATOM 603 CA ARG A 623 -10.412 -8.779 -10.566 1.00 25.00 C ATOM 604 C ARG A 623 -10.247 -7.308 -10.201 1.00 25.00 C ATOM 605 O ARG A 623 -9.271 -6.663 -10.589 1.00 25.00 O ATOM 606 CB ARG A 623 -11.410 -8.887 -11.735 1.00 25.00 C ATOM 607 CG ARG A 623 -11.446 -10.252 -12.403 1.00 25.00 C ATOM 608 CD ARG A 623 -10.231 -10.508 -13.296 1.00 25.00 C ATOM 609 NE ARG A 623 -9.053 -10.949 -12.532 1.00 25.00 N ATOM 610 CZ ARG A 623 -7.801 -10.994 -13.013 1.00 25.00 C ATOM 611 NH1 ARG A 623 -7.529 -10.633 -14.267 1.00 25.00 N ATOM 612 NH2 ARG A 623 -6.814 -11.405 -12.229 1.00 25.00 N ATOM 0 H ARG A 623 -11.875 -9.777 -9.425 1.00 25.00 H new ATOM 0 HA ARG A 623 -9.449 -9.191 -10.868 1.00 25.00 H new ATOM 0 HB2 ARG A 623 -12.408 -8.649 -11.368 1.00 25.00 H new ATOM 0 HB3 ARG A 623 -11.158 -8.136 -12.483 1.00 25.00 H new ATOM 0 HG2 ARG A 623 -11.497 -11.025 -11.636 1.00 25.00 H new ATOM 0 HG3 ARG A 623 -12.354 -10.335 -13.000 1.00 25.00 H new ATOM 0 HD2 ARG A 623 -10.483 -11.265 -14.038 1.00 25.00 H new ATOM 0 HD3 ARG A 623 -9.986 -9.596 -13.841 1.00 25.00 H new ATOM 0 HE ARG A 623 -9.199 -11.242 -11.566 1.00 25.00 H new ATOM 0 HH11 ARG A 623 -8.279 -10.315 -14.880 1.00 25.00 H new ATOM 0 HH12 ARG A 623 -6.570 -10.675 -14.613 1.00 25.00 H new ATOM 0 HH21 ARG A 623 -7.009 -11.684 -11.268 1.00 25.00 H new ATOM 0 HH22 ARG A 623 -5.860 -11.442 -12.587 1.00 25.00 H new ATOM 626 N ARG A 624 -11.229 -6.800 -9.446 1.00 25.00 N ATOM 627 CA ARG A 624 -11.250 -5.396 -9.002 1.00 25.00 C ATOM 628 C ARG A 624 -10.227 -5.140 -7.878 1.00 25.00 C ATOM 629 O ARG A 624 -9.819 -3.996 -7.653 1.00 25.00 O ATOM 630 CB ARG A 624 -12.672 -5.024 -8.526 1.00 25.00 C ATOM 631 CG ARG A 624 -13.735 -4.951 -9.631 1.00 25.00 C ATOM 632 CD ARG A 624 -15.108 -4.549 -9.097 1.00 25.00 C ATOM 633 NE ARG A 624 -16.041 -5.681 -9.079 1.00 25.00 N ATOM 634 CZ ARG A 624 -17.359 -5.590 -9.320 1.00 25.00 C ATOM 635 NH1 ARG A 624 -17.932 -4.423 -9.605 1.00 25.00 N ATOM 636 NH2 ARG A 624 -18.107 -6.685 -9.272 1.00 25.00 N ATOM 0 H ARG A 624 -12.029 -7.346 -9.126 1.00 25.00 H new ATOM 0 HA ARG A 624 -10.971 -4.768 -9.848 1.00 25.00 H new ATOM 0 HB2 ARG A 624 -12.992 -5.756 -7.784 1.00 25.00 H new ATOM 0 HB3 ARG A 624 -12.628 -4.058 -8.023 1.00 25.00 H new ATOM 0 HG2 ARG A 624 -13.419 -4.233 -10.388 1.00 25.00 H new ATOM 0 HG3 ARG A 624 -13.810 -5.921 -10.123 1.00 25.00 H new ATOM 0 HD2 ARG A 624 -15.002 -4.150 -8.088 1.00 25.00 H new ATOM 0 HD3 ARG A 624 -15.518 -3.750 -9.715 1.00 25.00 H new ATOM 0 HE ARG A 624 -15.661 -6.604 -8.868 1.00 25.00 H new ATOM 0 HH11 ARG A 624 -17.368 -3.574 -9.644 1.00 25.00 H new ATOM 0 HH12 ARG A 624 -18.935 -4.378 -9.785 1.00 25.00 H new ATOM 0 HH21 ARG A 624 -17.680 -7.585 -9.054 1.00 25.00 H new ATOM 0 HH22 ARG A 624 -19.109 -6.626 -9.453 1.00 25.00 H new ATOM 650 N MET A 625 -9.818 -6.215 -7.188 1.00 25.00 N ATOM 651 CA MET A 625 -8.851 -6.126 -6.090 1.00 25.00 C ATOM 652 C MET A 625 -7.411 -6.234 -6.613 1.00 25.00 C ATOM 653 O MET A 625 -6.509 -5.566 -6.100 1.00 25.00 O ATOM 654 CB MET A 625 -9.129 -7.234 -5.062 1.00 25.00 C ATOM 655 CG MET A 625 -8.116 -7.301 -3.919 1.00 25.00 C ATOM 656 SD MET A 625 -8.158 -5.836 -2.869 1.00 25.00 S ATOM 657 CE MET A 625 -8.625 -6.562 -1.305 1.00 25.00 C ATOM 0 H MET A 625 -10.147 -7.162 -7.375 1.00 25.00 H new ATOM 0 HA MET A 625 -8.962 -5.154 -5.610 1.00 25.00 H new ATOM 0 HB2 MET A 625 -10.123 -7.082 -4.642 1.00 25.00 H new ATOM 0 HB3 MET A 625 -9.143 -8.195 -5.576 1.00 25.00 H new ATOM 0 HG2 MET A 625 -8.316 -8.184 -3.312 1.00 25.00 H new ATOM 0 HG3 MET A 625 -7.114 -7.419 -4.333 1.00 25.00 H new ATOM 0 HE1 MET A 625 -9.600 -6.179 -1.003 1.00 25.00 H new ATOM 0 HE2 MET A 625 -8.677 -7.646 -1.408 1.00 25.00 H new ATOM 0 HE3 MET A 625 -7.884 -6.305 -0.549 1.00 25.00 H new ATOM 667 N GLU A 626 -7.216 -7.089 -7.629 1.00 25.00 N ATOM 668 CA GLU A 626 -5.903 -7.308 -8.261 1.00 25.00 C ATOM 669 C GLU A 626 -5.287 -5.998 -8.808 1.00 25.00 C ATOM 670 O GLU A 626 -4.071 -5.922 -9.014 1.00 25.00 O ATOM 671 CB GLU A 626 -6.037 -8.356 -9.381 1.00 25.00 C ATOM 672 CG GLU A 626 -4.706 -8.819 -9.972 1.00 25.00 C ATOM 673 CD GLU A 626 -3.873 -9.612 -8.982 1.00 25.00 C ATOM 674 OE1 GLU A 626 -4.417 -10.004 -7.928 1.00 25.00 O ATOM 675 OE2 GLU A 626 -2.677 -9.843 -9.262 1.00 25.00 O ATOM 0 H GLU A 626 -7.964 -7.649 -8.037 1.00 25.00 H new ATOM 0 HA GLU A 626 -5.221 -7.678 -7.495 1.00 25.00 H new ATOM 0 HB2 GLU A 626 -6.568 -9.223 -8.989 1.00 25.00 H new ATOM 0 HB3 GLU A 626 -6.651 -7.940 -10.180 1.00 25.00 H new ATOM 0 HG2 GLU A 626 -4.897 -9.431 -10.853 1.00 25.00 H new ATOM 0 HG3 GLU A 626 -4.138 -7.950 -10.305 1.00 25.00 H new ATOM 682 N ASN A 627 -6.137 -4.978 -9.032 1.00 25.00 N ATOM 683 CA ASN A 627 -5.690 -3.669 -9.534 1.00 25.00 C ATOM 684 C ASN A 627 -4.870 -2.894 -8.492 1.00 25.00 C ATOM 685 O ASN A 627 -3.903 -2.215 -8.852 1.00 25.00 O ATOM 686 CB ASN A 627 -6.886 -2.816 -9.983 1.00 25.00 C ATOM 687 CG ASN A 627 -7.505 -3.302 -11.282 1.00 25.00 C ATOM 688 OD1 ASN A 627 -6.867 -4.007 -12.062 1.00 25.00 O ATOM 689 ND2 ASN A 627 -8.756 -2.925 -11.517 1.00 25.00 N ATOM 0 H ASN A 627 -7.142 -5.038 -8.871 1.00 25.00 H new ATOM 0 HA ASN A 627 -5.045 -3.869 -10.389 1.00 25.00 H new ATOM 0 HB2 ASN A 627 -7.645 -2.823 -9.200 1.00 25.00 H new ATOM 0 HB3 ASN A 627 -6.563 -1.782 -10.105 1.00 25.00 H new ATOM 0 HD21 ASN A 627 -9.226 -3.221 -12.373 1.00 25.00 H new ATOM 0 HD22 ASN A 627 -9.248 -2.340 -10.842 1.00 25.00 H new ATOM 696 N LEU A 628 -5.254 -2.997 -7.205 1.00 25.00 N ATOM 697 CA LEU A 628 -4.523 -2.308 -6.134 1.00 25.00 C ATOM 698 C LEU A 628 -3.355 -3.168 -5.632 1.00 25.00 C ATOM 699 O LEU A 628 -2.352 -2.637 -5.151 1.00 25.00 O ATOM 700 CB LEU A 628 -5.473 -1.813 -4.995 1.00 25.00 C ATOM 701 CG LEU A 628 -6.413 -0.605 -5.245 1.00 25.00 C ATOM 702 CD1 LEU A 628 -7.106 -0.157 -3.968 1.00 25.00 C ATOM 703 CD2 LEU A 628 -5.613 0.555 -5.792 1.00 25.00 C ATOM 0 H LEU A 628 -6.055 -3.543 -6.889 1.00 25.00 H new ATOM 0 HA LEU A 628 -4.085 -1.400 -6.549 1.00 25.00 H new ATOM 0 HB2 LEU A 628 -6.099 -2.657 -4.704 1.00 25.00 H new ATOM 0 HB3 LEU A 628 -4.849 -1.567 -4.136 1.00 25.00 H new ATOM 0 HG LEU A 628 -7.173 -0.922 -5.960 1.00 25.00 H new ATOM 0 HD11 LEU A 628 -7.756 0.691 -4.185 1.00 25.00 H new ATOM 0 HD12 LEU A 628 -7.702 -0.978 -3.570 1.00 25.00 H new ATOM 0 HD13 LEU A 628 -6.358 0.138 -3.232 1.00 25.00 H new ATOM 0 HD21 LEU A 628 -6.275 1.403 -5.967 1.00 25.00 H new ATOM 0 HD22 LEU A 628 -4.844 0.838 -5.073 1.00 25.00 H new ATOM 0 HD23 LEU A 628 -5.143 0.262 -6.731 1.00 25.00 H new ATOM 715 N VAL A 629 -3.503 -4.502 -5.742 1.00 25.00 N ATOM 716 CA VAL A 629 -2.405 -5.456 -5.482 1.00 25.00 C ATOM 717 C VAL A 629 -1.204 -5.131 -6.389 1.00 25.00 C ATOM 718 O VAL A 629 -0.048 -5.290 -5.991 1.00 25.00 O ATOM 719 CB VAL A 629 -2.887 -6.926 -5.720 1.00 25.00 C ATOM 720 CG1 VAL A 629 -1.737 -7.943 -5.705 1.00 25.00 C ATOM 721 CG2 VAL A 629 -3.943 -7.316 -4.689 1.00 25.00 C ATOM 0 H VAL A 629 -4.380 -4.948 -6.012 1.00 25.00 H new ATOM 0 HA VAL A 629 -2.097 -5.362 -4.441 1.00 25.00 H new ATOM 0 HB VAL A 629 -3.323 -6.951 -6.719 1.00 25.00 H new ATOM 0 HG11 VAL A 629 -2.134 -8.944 -5.875 1.00 25.00 H new ATOM 0 HG12 VAL A 629 -1.023 -7.697 -6.491 1.00 25.00 H new ATOM 0 HG13 VAL A 629 -1.236 -7.911 -4.738 1.00 25.00 H new ATOM 0 HG21 VAL A 629 -4.267 -8.341 -4.870 1.00 25.00 H new ATOM 0 HG22 VAL A 629 -3.519 -7.240 -3.688 1.00 25.00 H new ATOM 0 HG23 VAL A 629 -4.798 -6.645 -4.773 1.00 25.00 H new ATOM 731 N ALA A 630 -1.522 -4.669 -7.599 1.00 25.00 N ATOM 732 CA ALA A 630 -0.529 -4.257 -8.582 1.00 25.00 C ATOM 733 C ALA A 630 -0.068 -2.812 -8.338 1.00 25.00 C ATOM 734 O ALA A 630 0.990 -2.395 -8.821 1.00 25.00 O ATOM 735 CB ALA A 630 -1.127 -4.414 -9.967 1.00 25.00 C ATOM 0 H ALA A 630 -2.484 -4.571 -7.923 1.00 25.00 H new ATOM 0 HA ALA A 630 0.355 -4.888 -8.491 1.00 25.00 H new ATOM 0 HB1 ALA A 630 -0.396 -4.109 -10.716 1.00 25.00 H new ATOM 0 HB2 ALA A 630 -1.400 -5.457 -10.129 1.00 25.00 H new ATOM 0 HB3 ALA A 630 -2.016 -3.789 -10.053 1.00 25.00 H new ATOM 741 N TYR A 631 -0.883 -2.066 -7.579 1.00 25.00 N ATOM 742 CA TYR A 631 -0.559 -0.703 -7.138 1.00 25.00 C ATOM 743 C TYR A 631 0.422 -0.742 -5.954 1.00 25.00 C ATOM 744 O TYR A 631 1.303 0.114 -5.835 1.00 25.00 O ATOM 745 CB TYR A 631 -1.871 0.016 -6.748 1.00 25.00 C ATOM 746 CG TYR A 631 -1.774 1.478 -6.311 1.00 25.00 C ATOM 747 CD1 TYR A 631 -1.192 2.459 -7.113 1.00 25.00 C ATOM 748 CD2 TYR A 631 -2.284 1.862 -5.075 1.00 25.00 C ATOM 749 CE1 TYR A 631 -1.120 3.773 -6.697 1.00 25.00 C ATOM 750 CE2 TYR A 631 -2.217 3.176 -4.655 1.00 25.00 C ATOM 751 CZ TYR A 631 -1.634 4.127 -5.468 1.00 25.00 C ATOM 752 OH TYR A 631 -1.567 5.435 -5.051 1.00 25.00 O ATOM 0 H TYR A 631 -1.792 -2.394 -7.252 1.00 25.00 H new ATOM 0 HA TYR A 631 -0.075 -0.156 -7.947 1.00 25.00 H new ATOM 0 HB2 TYR A 631 -2.549 -0.036 -7.600 1.00 25.00 H new ATOM 0 HB3 TYR A 631 -2.335 -0.547 -5.938 1.00 25.00 H new ATOM 0 HD1 TYR A 631 -0.790 2.186 -8.077 1.00 25.00 H new ATOM 0 HD2 TYR A 631 -2.739 1.121 -4.434 1.00 25.00 H new ATOM 0 HE1 TYR A 631 -0.664 4.519 -7.331 1.00 25.00 H new ATOM 0 HE2 TYR A 631 -2.620 3.459 -3.693 1.00 25.00 H new ATOM 0 HH TYR A 631 -1.765 5.483 -4.092 1.00 25.00 H new ATOM 762 N ALA A 632 0.249 -1.752 -5.096 1.00 25.00 N ATOM 763 CA ALA A 632 1.111 -1.962 -3.933 1.00 25.00 C ATOM 764 C ALA A 632 2.385 -2.717 -4.320 1.00 25.00 C ATOM 765 O ALA A 632 3.447 -2.509 -3.725 1.00 25.00 O ATOM 766 CB ALA A 632 0.368 -2.736 -2.870 1.00 25.00 C ATOM 0 H ALA A 632 -0.493 -2.446 -5.190 1.00 25.00 H new ATOM 0 HA ALA A 632 1.393 -0.984 -3.543 1.00 25.00 H new ATOM 0 HB1 ALA A 632 1.018 -2.887 -2.008 1.00 25.00 H new ATOM 0 HB2 ALA A 632 -0.516 -2.177 -2.564 1.00 25.00 H new ATOM 0 HB3 ALA A 632 0.065 -3.704 -3.270 1.00 25.00 H new ATOM 772 N LYS A 633 2.257 -3.601 -5.326 1.00 25.00 N ATOM 773 CA LYS A 633 3.390 -4.365 -5.869 1.00 25.00 C ATOM 774 C LYS A 633 4.352 -3.439 -6.632 1.00 25.00 C ATOM 775 O LYS A 633 5.518 -3.779 -6.856 1.00 25.00 O ATOM 776 CB LYS A 633 2.868 -5.458 -6.818 1.00 25.00 C ATOM 777 CG LYS A 633 2.788 -6.863 -6.215 1.00 25.00 C ATOM 778 CD LYS A 633 2.149 -7.871 -7.171 1.00 25.00 C ATOM 779 CE LYS A 633 2.208 -9.295 -6.632 1.00 25.00 C ATOM 780 NZ LYS A 633 1.452 -9.453 -5.355 1.00 25.00 N ATOM 0 H LYS A 633 1.368 -3.804 -5.783 1.00 25.00 H new ATOM 0 HA LYS A 633 3.930 -4.823 -5.040 1.00 25.00 H new ATOM 0 HB2 LYS A 633 1.875 -5.172 -7.164 1.00 25.00 H new ATOM 0 HB3 LYS A 633 3.514 -5.493 -7.696 1.00 25.00 H new ATOM 0 HG2 LYS A 633 3.791 -7.200 -5.952 1.00 25.00 H new ATOM 0 HG3 LYS A 633 2.211 -6.827 -5.291 1.00 25.00 H new ATOM 0 HD2 LYS A 633 1.110 -7.594 -7.346 1.00 25.00 H new ATOM 0 HD3 LYS A 633 2.657 -7.828 -8.134 1.00 25.00 H new ATOM 0 HE2 LYS A 633 1.803 -9.980 -7.377 1.00 25.00 H new ATOM 0 HE3 LYS A 633 3.249 -9.577 -6.472 1.00 25.00 H new ATOM 0 HZ1 LYS A 633 2.115 -9.670 -4.584 1.00 25.00 H new ATOM 0 HZ2 LYS A 633 0.946 -8.570 -5.139 1.00 25.00 H new ATOM 0 HZ3 LYS A 633 0.767 -10.230 -5.451 1.00 25.00 H new ATOM 794 N LYS A 634 3.831 -2.262 -7.017 1.00 25.00 N ATOM 795 CA LYS A 634 4.589 -1.245 -7.745 1.00 25.00 C ATOM 796 C LYS A 634 5.444 -0.398 -6.789 1.00 25.00 C ATOM 797 O LYS A 634 6.600 -0.098 -7.101 1.00 25.00 O ATOM 798 CB LYS A 634 3.611 -0.351 -8.540 1.00 25.00 C ATOM 799 CG LYS A 634 3.894 1.155 -8.450 1.00 25.00 C ATOM 800 CD LYS A 634 3.858 1.853 -9.813 1.00 25.00 C ATOM 801 CE LYS A 634 4.449 3.264 -9.770 1.00 25.00 C ATOM 802 NZ LYS A 634 3.638 4.178 -8.920 1.00 25.00 N ATOM 0 H LYS A 634 2.865 -1.993 -6.828 1.00 25.00 H new ATOM 0 HA LYS A 634 5.269 -1.741 -8.437 1.00 25.00 H new ATOM 0 HB2 LYS A 634 3.639 -0.649 -9.588 1.00 25.00 H new ATOM 0 HB3 LYS A 634 2.598 -0.538 -8.182 1.00 25.00 H new ATOM 0 HG2 LYS A 634 3.160 1.618 -7.791 1.00 25.00 H new ATOM 0 HG3 LYS A 634 4.872 1.309 -7.995 1.00 25.00 H new ATOM 0 HD2 LYS A 634 4.410 1.254 -10.538 1.00 25.00 H new ATOM 0 HD3 LYS A 634 2.827 1.906 -10.162 1.00 25.00 H new ATOM 0 HE2 LYS A 634 5.468 3.220 -9.386 1.00 25.00 H new ATOM 0 HE3 LYS A 634 4.507 3.665 -10.782 1.00 25.00 H new ATOM 0 HZ1 LYS A 634 4.071 5.124 -8.916 1.00 25.00 H new ATOM 0 HZ2 LYS A 634 2.672 4.241 -9.301 1.00 25.00 H new ATOM 0 HZ3 LYS A 634 3.604 3.809 -7.948 1.00 25.00 H new ATOM 816 N VAL A 635 4.876 -0.026 -5.626 1.00 25.00 N ATOM 817 CA VAL A 635 5.559 0.879 -4.688 1.00 25.00 C ATOM 818 C VAL A 635 6.747 0.194 -3.986 1.00 25.00 C ATOM 819 O VAL A 635 7.828 0.775 -3.901 1.00 25.00 O ATOM 820 CB VAL A 635 4.590 1.528 -3.634 1.00 25.00 C ATOM 821 CG1 VAL A 635 5.365 2.303 -2.574 1.00 25.00 C ATOM 822 CG2 VAL A 635 3.521 2.430 -4.258 1.00 25.00 C ATOM 0 H VAL A 635 3.955 -0.336 -5.317 1.00 25.00 H new ATOM 0 HA VAL A 635 5.948 1.691 -5.302 1.00 25.00 H new ATOM 0 HB VAL A 635 4.069 0.692 -3.167 1.00 25.00 H new ATOM 0 HG11 VAL A 635 4.667 2.740 -1.860 1.00 25.00 H new ATOM 0 HG12 VAL A 635 6.043 1.627 -2.052 1.00 25.00 H new ATOM 0 HG13 VAL A 635 5.940 3.097 -3.051 1.00 25.00 H new ATOM 0 HG21 VAL A 635 2.889 2.843 -3.472 1.00 25.00 H new ATOM 0 HG22 VAL A 635 4.003 3.243 -4.801 1.00 25.00 H new ATOM 0 HG23 VAL A 635 2.909 1.847 -4.946 1.00 25.00 H new ATOM 832 N GLU A 636 6.539 -1.060 -3.536 1.00 25.00 N ATOM 833 CA GLU A 636 7.554 -1.847 -2.796 1.00 25.00 C ATOM 834 C GLU A 636 8.893 -1.940 -3.562 1.00 25.00 C ATOM 835 O GLU A 636 9.960 -2.030 -2.947 1.00 25.00 O ATOM 836 CB GLU A 636 7.011 -3.271 -2.550 1.00 25.00 C ATOM 837 CG GLU A 636 6.695 -4.088 -3.808 1.00 25.00 C ATOM 838 CD GLU A 636 7.796 -5.062 -4.206 1.00 25.00 C ATOM 839 OE1 GLU A 636 8.774 -5.200 -3.442 1.00 25.00 O ATOM 840 OE2 GLU A 636 7.676 -5.686 -5.282 1.00 25.00 O ATOM 0 H GLU A 636 5.661 -1.559 -3.675 1.00 25.00 H new ATOM 0 HA GLU A 636 7.746 -1.337 -1.852 1.00 25.00 H new ATOM 0 HB2 GLU A 636 7.741 -3.821 -1.956 1.00 25.00 H new ATOM 0 HB3 GLU A 636 6.104 -3.196 -1.951 1.00 25.00 H new ATOM 0 HG2 GLU A 636 5.772 -4.645 -3.645 1.00 25.00 H new ATOM 0 HG3 GLU A 636 6.512 -3.404 -4.637 1.00 25.00 H new ATOM 847 N GLY A 637 8.815 -1.912 -4.904 1.00 25.00 N ATOM 848 CA GLY A 637 10.007 -1.984 -5.749 1.00 25.00 C ATOM 849 C GLY A 637 10.731 -0.649 -5.891 1.00 25.00 C ATOM 850 O GLY A 637 11.910 -0.618 -6.254 1.00 25.00 O ATOM 0 H GLY A 637 7.938 -1.840 -5.420 1.00 25.00 H new ATOM 0 HA2 GLY A 637 10.695 -2.719 -5.332 1.00 25.00 H new ATOM 0 HA3 GLY A 637 9.721 -2.341 -6.738 1.00 25.00 H new ATOM 854 N ASP A 638 10.019 0.451 -5.604 1.00 25.00 N ATOM 855 CA ASP A 638 10.592 1.802 -5.663 1.00 25.00 C ATOM 856 C ASP A 638 11.301 2.178 -4.355 1.00 25.00 C ATOM 857 O ASP A 638 12.128 3.095 -4.336 1.00 25.00 O ATOM 858 CB ASP A 638 9.508 2.839 -5.984 1.00 25.00 C ATOM 859 CG ASP A 638 9.013 2.750 -7.417 1.00 25.00 C ATOM 860 OD1 ASP A 638 9.693 2.100 -8.241 1.00 25.00 O ATOM 861 OD2 ASP A 638 7.951 3.330 -7.716 1.00 25.00 O ATOM 0 H ASP A 638 9.038 0.429 -5.327 1.00 25.00 H new ATOM 0 HA ASP A 638 11.334 1.801 -6.462 1.00 25.00 H new ATOM 0 HB2 ASP A 638 8.667 2.700 -5.305 1.00 25.00 H new ATOM 0 HB3 ASP A 638 9.903 3.839 -5.802 1.00 25.00 H new ATOM 866 N MET A 639 10.973 1.459 -3.265 1.00 25.00 N ATOM 867 CA MET A 639 11.607 1.681 -1.955 1.00 25.00 C ATOM 868 C MET A 639 13.070 1.209 -1.926 1.00 25.00 C ATOM 869 O MET A 639 13.859 1.678 -1.102 1.00 25.00 O ATOM 870 CB MET A 639 10.830 0.971 -0.841 1.00 25.00 C ATOM 871 CG MET A 639 9.407 1.461 -0.684 1.00 25.00 C ATOM 872 SD MET A 639 8.579 0.753 0.742 1.00 25.00 S ATOM 873 CE MET A 639 8.676 -0.980 0.343 1.00 25.00 C ATOM 0 H MET A 639 10.271 0.719 -3.268 1.00 25.00 H new ATOM 0 HA MET A 639 11.591 2.758 -1.787 1.00 25.00 H new ATOM 0 HB2 MET A 639 10.816 -0.100 -1.046 1.00 25.00 H new ATOM 0 HB3 MET A 639 11.358 1.108 0.103 1.00 25.00 H new ATOM 0 HG2 MET A 639 9.410 2.547 -0.594 1.00 25.00 H new ATOM 0 HG3 MET A 639 8.843 1.217 -1.584 1.00 25.00 H new ATOM 0 HE1 MET A 639 7.670 -1.382 0.220 1.00 25.00 H new ATOM 0 HE2 MET A 639 9.235 -1.109 -0.584 1.00 25.00 H new ATOM 0 HE3 MET A 639 9.182 -1.511 1.149 1.00 25.00 H new ATOM 883 N TYR A 640 13.420 0.288 -2.837 1.00 25.00 N ATOM 884 CA TYR A 640 14.773 -0.279 -2.905 1.00 25.00 C ATOM 885 C TYR A 640 15.733 0.664 -3.651 1.00 25.00 C ATOM 886 O TYR A 640 16.934 0.684 -3.369 1.00 25.00 O ATOM 887 CB TYR A 640 14.725 -1.655 -3.596 1.00 25.00 C ATOM 888 CG TYR A 640 15.426 -1.713 -4.944 1.00 25.00 C ATOM 889 CD1 TYR A 640 16.687 -2.289 -5.068 1.00 25.00 C ATOM 890 CD2 TYR A 640 14.827 -1.197 -6.090 1.00 25.00 C ATOM 891 CE1 TYR A 640 17.330 -2.349 -6.289 1.00 25.00 C ATOM 892 CE2 TYR A 640 15.464 -1.253 -7.314 1.00 25.00 C ATOM 893 CZ TYR A 640 16.715 -1.828 -7.409 1.00 25.00 C ATOM 894 OH TYR A 640 17.350 -1.883 -8.627 1.00 25.00 O ATOM 0 H TYR A 640 12.780 -0.081 -3.540 1.00 25.00 H new ATOM 0 HA TYR A 640 15.149 -0.400 -1.889 1.00 25.00 H new ATOM 0 HB2 TYR A 640 15.176 -2.395 -2.935 1.00 25.00 H new ATOM 0 HB3 TYR A 640 13.682 -1.943 -3.731 1.00 25.00 H new ATOM 0 HD1 TYR A 640 17.172 -2.697 -4.193 1.00 25.00 H new ATOM 0 HD2 TYR A 640 13.848 -0.746 -6.021 1.00 25.00 H new ATOM 0 HE1 TYR A 640 18.308 -2.801 -6.367 1.00 25.00 H new ATOM 0 HE2 TYR A 640 14.985 -0.848 -8.193 1.00 25.00 H new ATOM 0 HH TYR A 640 16.781 -1.474 -9.312 1.00 25.00 H new ATOM 904 N GLU A 641 15.186 1.439 -4.600 1.00 25.00 N ATOM 905 CA GLU A 641 15.971 2.407 -5.381 1.00 25.00 C ATOM 906 C GLU A 641 16.038 3.778 -4.690 1.00 25.00 C ATOM 907 O GLU A 641 16.948 4.568 -4.962 1.00 25.00 O ATOM 908 CB GLU A 641 15.381 2.566 -6.789 1.00 25.00 C ATOM 909 CG GLU A 641 16.200 3.453 -7.709 1.00 25.00 C ATOM 910 CD GLU A 641 17.517 2.821 -8.114 1.00 25.00 C ATOM 911 OE1 GLU A 641 17.676 1.597 -7.913 1.00 25.00 O ATOM 912 OE2 GLU A 641 18.391 3.548 -8.635 1.00 25.00 O ATOM 0 H GLU A 641 14.196 1.413 -4.846 1.00 25.00 H new ATOM 0 HA GLU A 641 16.986 2.015 -5.454 1.00 25.00 H new ATOM 0 HB2 GLU A 641 15.284 1.580 -7.244 1.00 25.00 H new ATOM 0 HB3 GLU A 641 14.375 2.978 -6.705 1.00 25.00 H new ATOM 0 HG2 GLU A 641 15.619 3.676 -8.604 1.00 25.00 H new ATOM 0 HG3 GLU A 641 16.396 4.403 -7.211 1.00 25.00 H new ATOM 919 N SER A 642 15.075 4.045 -3.797 1.00 25.00 N ATOM 920 CA SER A 642 14.983 5.336 -3.104 1.00 25.00 C ATOM 921 C SER A 642 15.681 5.302 -1.735 1.00 25.00 C ATOM 922 O SER A 642 16.253 6.308 -1.307 1.00 25.00 O ATOM 923 CB SER A 642 13.509 5.738 -2.940 1.00 25.00 C ATOM 924 OG SER A 642 12.783 4.766 -2.202 1.00 25.00 O ATOM 0 H SER A 642 14.346 3.380 -3.537 1.00 25.00 H new ATOM 0 HA SER A 642 15.497 6.079 -3.714 1.00 25.00 H new ATOM 0 HB2 SER A 642 13.448 6.701 -2.433 1.00 25.00 H new ATOM 0 HB3 SER A 642 13.054 5.865 -3.922 1.00 25.00 H new ATOM 0 HG SER A 642 12.405 4.103 -2.817 1.00 25.00 H new ATOM 930 N ALA A 643 15.629 4.143 -1.061 1.00 25.00 N ATOM 931 CA ALA A 643 16.226 3.986 0.268 1.00 25.00 C ATOM 932 C ALA A 643 17.564 3.248 0.204 1.00 25.00 C ATOM 933 O ALA A 643 17.754 2.361 -0.633 1.00 25.00 O ATOM 934 CB ALA A 643 15.267 3.248 1.191 1.00 25.00 C ATOM 0 H ALA A 643 15.178 3.301 -1.418 1.00 25.00 H new ATOM 0 HA ALA A 643 16.415 4.983 0.665 1.00 25.00 H new ATOM 0 HB1 ALA A 643 15.722 3.138 2.175 1.00 25.00 H new ATOM 0 HB2 ALA A 643 14.340 3.815 1.281 1.00 25.00 H new ATOM 0 HB3 ALA A 643 15.051 2.262 0.779 1.00 25.00 H new ATOM 940 N ASN A 644 18.484 3.632 1.098 1.00 25.00 N ATOM 941 CA ASN A 644 19.799 2.985 1.205 1.00 25.00 C ATOM 942 C ASN A 644 19.960 2.249 2.547 1.00 25.00 C ATOM 943 O ASN A 644 20.955 1.548 2.764 1.00 25.00 O ATOM 944 CB ASN A 644 20.933 4.018 1.015 1.00 25.00 C ATOM 945 CG ASN A 644 21.462 4.093 -0.414 1.00 25.00 C ATOM 946 OD1 ASN A 644 22.004 3.121 -0.940 1.00 25.00 O ATOM 947 ND2 ASN A 644 21.291 5.249 -1.049 1.00 25.00 N ATOM 0 H ASN A 644 18.341 4.393 1.762 1.00 25.00 H new ATOM 0 HA ASN A 644 19.866 2.243 0.409 1.00 25.00 H new ATOM 0 HB2 ASN A 644 20.569 5.002 1.310 1.00 25.00 H new ATOM 0 HB3 ASN A 644 21.756 3.768 1.685 1.00 25.00 H new ATOM 0 HD21 ASN A 644 21.614 5.355 -2.010 1.00 25.00 H new ATOM 0 HD22 ASN A 644 20.836 6.029 -0.575 1.00 25.00 H new ATOM 954 N SER A 645 18.967 2.410 3.433 1.00 25.00 N ATOM 955 CA SER A 645 19.000 1.816 4.773 1.00 25.00 C ATOM 956 C SER A 645 17.678 1.112 5.084 1.00 25.00 C ATOM 957 O SER A 645 16.629 1.473 4.544 1.00 25.00 O ATOM 958 CB SER A 645 19.269 2.901 5.823 1.00 25.00 C ATOM 959 OG SER A 645 18.220 3.854 5.856 1.00 25.00 O ATOM 0 H SER A 645 18.125 2.952 3.241 1.00 25.00 H new ATOM 0 HA SER A 645 19.803 1.080 4.802 1.00 25.00 H new ATOM 0 HB2 SER A 645 19.377 2.441 6.805 1.00 25.00 H new ATOM 0 HB3 SER A 645 20.211 3.401 5.600 1.00 25.00 H new ATOM 0 HG SER A 645 18.416 4.533 6.535 1.00 25.00 H new ATOM 965 N ARG A 646 17.749 0.106 5.972 1.00 25.00 N ATOM 966 CA ARG A 646 16.593 -0.739 6.326 1.00 25.00 C ATOM 967 C ARG A 646 15.532 0.002 7.146 1.00 25.00 C ATOM 968 O ARG A 646 14.363 -0.395 7.144 1.00 25.00 O ATOM 969 CB ARG A 646 17.062 -1.982 7.099 1.00 25.00 C ATOM 970 CG ARG A 646 16.527 -2.071 8.529 1.00 25.00 C ATOM 971 CD ARG A 646 17.202 -3.186 9.334 1.00 25.00 C ATOM 972 NE ARG A 646 17.093 -2.972 10.785 1.00 25.00 N ATOM 973 CZ ARG A 646 17.926 -2.215 11.515 1.00 25.00 C ATOM 974 NH1 ARG A 646 18.953 -1.579 10.954 1.00 25.00 N ATOM 975 NH2 ARG A 646 17.728 -2.098 12.821 1.00 25.00 N ATOM 0 H ARG A 646 18.606 -0.145 6.464 1.00 25.00 H new ATOM 0 HA ARG A 646 16.126 -1.031 5.385 1.00 25.00 H new ATOM 0 HB2 ARG A 646 16.755 -2.873 6.552 1.00 25.00 H new ATOM 0 HB3 ARG A 646 18.152 -1.987 7.130 1.00 25.00 H new ATOM 0 HG2 ARG A 646 16.683 -1.117 9.033 1.00 25.00 H new ATOM 0 HG3 ARG A 646 15.451 -2.246 8.502 1.00 25.00 H new ATOM 0 HD2 ARG A 646 16.749 -4.143 9.075 1.00 25.00 H new ATOM 0 HD3 ARG A 646 18.254 -3.246 9.056 1.00 25.00 H new ATOM 0 HE ARG A 646 16.326 -3.434 11.273 1.00 25.00 H new ATOM 0 HH11 ARG A 646 19.118 -1.662 9.951 1.00 25.00 H new ATOM 0 HH12 ARG A 646 19.574 -1.008 11.527 1.00 25.00 H new ATOM 0 HH21 ARG A 646 16.947 -2.582 13.264 1.00 25.00 H new ATOM 0 HH22 ARG A 646 18.357 -1.524 13.383 1.00 25.00 H new ATOM 989 N ASP A 647 15.945 1.063 7.851 1.00 25.00 N ATOM 990 CA ASP A 647 15.023 1.866 8.666 1.00 25.00 C ATOM 991 C ASP A 647 14.252 2.887 7.818 1.00 25.00 C ATOM 992 O ASP A 647 13.130 3.257 8.165 1.00 25.00 O ATOM 993 CB ASP A 647 15.778 2.582 9.794 1.00 25.00 C ATOM 994 CG ASP A 647 16.277 1.629 10.866 1.00 25.00 C ATOM 995 OD1 ASP A 647 15.851 0.455 10.862 1.00 25.00 O ATOM 996 OD2 ASP A 647 17.092 2.058 11.710 1.00 25.00 O ATOM 0 H ASP A 647 16.912 1.386 7.874 1.00 25.00 H new ATOM 0 HA ASP A 647 14.298 1.179 9.103 1.00 25.00 H new ATOM 0 HB2 ASP A 647 16.625 3.122 9.372 1.00 25.00 H new ATOM 0 HB3 ASP A 647 15.122 3.324 10.250 1.00 25.00 H new ATOM 1001 N GLU A 648 14.867 3.336 6.710 1.00 25.00 N ATOM 1002 CA GLU A 648 14.221 4.258 5.765 1.00 25.00 C ATOM 1003 C GLU A 648 13.388 3.475 4.738 1.00 25.00 C ATOM 1004 O GLU A 648 12.322 3.931 4.318 1.00 25.00 O ATOM 1005 CB GLU A 648 15.284 5.130 5.065 1.00 25.00 C ATOM 1006 CG GLU A 648 16.041 6.087 5.989 1.00 25.00 C ATOM 1007 CD GLU A 648 17.104 6.887 5.261 1.00 25.00 C ATOM 1008 OE1 GLU A 648 17.332 6.621 4.063 1.00 25.00 O ATOM 1009 OE2 GLU A 648 17.709 7.780 5.891 1.00 25.00 O ATOM 0 H GLU A 648 15.817 3.072 6.448 1.00 25.00 H new ATOM 0 HA GLU A 648 13.547 4.915 6.315 1.00 25.00 H new ATOM 0 HB2 GLU A 648 16.004 4.475 4.574 1.00 25.00 H new ATOM 0 HB3 GLU A 648 14.798 5.712 4.282 1.00 25.00 H new ATOM 0 HG2 GLU A 648 15.332 6.772 6.455 1.00 25.00 H new ATOM 0 HG3 GLU A 648 16.508 5.517 6.792 1.00 25.00 H new ATOM 1016 N TYR A 649 13.896 2.296 4.348 1.00 25.00 N ATOM 1017 CA TYR A 649 13.206 1.389 3.422 1.00 25.00 C ATOM 1018 C TYR A 649 11.843 0.945 3.994 1.00 25.00 C ATOM 1019 O TYR A 649 10.811 1.080 3.329 1.00 25.00 O ATOM 1020 CB TYR A 649 14.148 0.189 3.117 1.00 25.00 C ATOM 1021 CG TYR A 649 13.596 -0.894 2.198 1.00 25.00 C ATOM 1022 CD1 TYR A 649 13.664 -0.738 0.820 1.00 25.00 C ATOM 1023 CD2 TYR A 649 13.014 -2.052 2.701 1.00 25.00 C ATOM 1024 CE1 TYR A 649 13.174 -1.699 -0.034 1.00 25.00 C ATOM 1025 CE2 TYR A 649 12.517 -3.023 1.848 1.00 25.00 C ATOM 1026 CZ TYR A 649 12.600 -2.841 0.482 1.00 25.00 C ATOM 1027 OH TYR A 649 12.108 -3.804 -0.369 1.00 25.00 O ATOM 0 H TYR A 649 14.799 1.945 4.667 1.00 25.00 H new ATOM 0 HA TYR A 649 12.983 1.902 2.486 1.00 25.00 H new ATOM 0 HB2 TYR A 649 15.064 0.579 2.673 1.00 25.00 H new ATOM 0 HB3 TYR A 649 14.425 -0.276 4.063 1.00 25.00 H new ATOM 0 HD1 TYR A 649 14.111 0.156 0.410 1.00 25.00 H new ATOM 0 HD2 TYR A 649 12.949 -2.196 3.769 1.00 25.00 H new ATOM 0 HE1 TYR A 649 13.239 -1.559 -1.103 1.00 25.00 H new ATOM 0 HE2 TYR A 649 12.066 -3.919 2.250 1.00 25.00 H new ATOM 0 HH TYR A 649 11.738 -4.545 0.155 1.00 25.00 H new ATOM 1037 N TYR A 650 11.866 0.418 5.226 1.00 25.00 N ATOM 1038 CA TYR A 650 10.653 -0.024 5.920 1.00 25.00 C ATOM 1039 C TYR A 650 9.763 1.151 6.377 1.00 25.00 C ATOM 1040 O TYR A 650 8.586 0.950 6.691 1.00 25.00 O ATOM 1041 CB TYR A 650 11.039 -0.893 7.129 1.00 25.00 C ATOM 1042 CG TYR A 650 11.728 -2.189 6.740 1.00 25.00 C ATOM 1043 CD1 TYR A 650 12.936 -2.558 7.325 1.00 25.00 C ATOM 1044 CD2 TYR A 650 11.184 -3.029 5.774 1.00 25.00 C ATOM 1045 CE1 TYR A 650 13.577 -3.719 6.959 1.00 25.00 C ATOM 1046 CE2 TYR A 650 11.820 -4.201 5.408 1.00 25.00 C ATOM 1047 CZ TYR A 650 13.018 -4.539 6.003 1.00 25.00 C ATOM 1048 OH TYR A 650 13.660 -5.701 5.639 1.00 25.00 O ATOM 0 H TYR A 650 12.722 0.287 5.765 1.00 25.00 H new ATOM 0 HA TYR A 650 10.067 -0.606 5.209 1.00 25.00 H new ATOM 0 HB2 TYR A 650 11.697 -0.322 7.783 1.00 25.00 H new ATOM 0 HB3 TYR A 650 10.142 -1.124 7.703 1.00 25.00 H new ATOM 0 HD1 TYR A 650 13.377 -1.922 8.079 1.00 25.00 H new ATOM 0 HD2 TYR A 650 10.250 -2.762 5.302 1.00 25.00 H new ATOM 0 HE1 TYR A 650 14.516 -3.987 7.420 1.00 25.00 H new ATOM 0 HE2 TYR A 650 11.382 -4.847 4.662 1.00 25.00 H new ATOM 0 HH TYR A 650 14.173 -6.044 6.401 1.00 25.00 H new ATOM 1058 N HIS A 651 10.328 2.368 6.403 1.00 25.00 N ATOM 1059 CA HIS A 651 9.595 3.565 6.840 1.00 25.00 C ATOM 1060 C HIS A 651 8.779 4.185 5.695 1.00 25.00 C ATOM 1061 O HIS A 651 7.784 4.868 5.942 1.00 25.00 O ATOM 1062 CB HIS A 651 10.573 4.604 7.416 1.00 25.00 C ATOM 1063 CG HIS A 651 10.435 4.837 8.897 1.00 25.00 C ATOM 1064 ND1 HIS A 651 9.638 5.829 9.429 1.00 25.00 N ATOM 1065 CD2 HIS A 651 11.009 4.210 9.956 1.00 25.00 C ATOM 1066 CE1 HIS A 651 9.728 5.805 10.748 1.00 25.00 C ATOM 1067 NE2 HIS A 651 10.553 4.832 11.090 1.00 25.00 N ATOM 0 H HIS A 651 11.293 2.549 6.126 1.00 25.00 H new ATOM 0 HA HIS A 651 8.894 3.258 7.616 1.00 25.00 H new ATOM 0 HB2 HIS A 651 11.592 4.281 7.205 1.00 25.00 H new ATOM 0 HB3 HIS A 651 10.425 5.551 6.897 1.00 25.00 H new ATOM 0 HD2 HIS A 651 11.696 3.378 9.913 1.00 25.00 H new ATOM 0 HE1 HIS A 651 9.215 6.468 11.429 1.00 25.00 H new ATOM 0 HE2 HIS A 651 10.810 4.583 12.045 1.00 25.00 H new ATOM 1076 N LEU A 652 9.206 3.932 4.448 1.00 25.00 N ATOM 1077 CA LEU A 652 8.535 4.466 3.261 1.00 25.00 C ATOM 1078 C LEU A 652 7.211 3.746 2.980 1.00 25.00 C ATOM 1079 O LEU A 652 6.251 4.363 2.513 1.00 25.00 O ATOM 1080 CB LEU A 652 9.463 4.357 2.055 1.00 25.00 C ATOM 1081 CG LEU A 652 10.609 5.374 2.011 1.00 25.00 C ATOM 1082 CD1 LEU A 652 11.572 5.014 0.903 1.00 25.00 C ATOM 1083 CD2 LEU A 652 10.080 6.788 1.805 1.00 25.00 C ATOM 0 H LEU A 652 10.021 3.355 4.239 1.00 25.00 H new ATOM 0 HA LEU A 652 8.300 5.514 3.450 1.00 25.00 H new ATOM 0 HB2 LEU A 652 9.889 3.354 2.036 1.00 25.00 H new ATOM 0 HB3 LEU A 652 8.867 4.467 1.149 1.00 25.00 H new ATOM 0 HG LEU A 652 11.131 5.344 2.968 1.00 25.00 H new ATOM 0 HD11 LEU A 652 12.384 5.740 0.877 1.00 25.00 H new ATOM 0 HD12 LEU A 652 11.980 4.020 1.084 1.00 25.00 H new ATOM 0 HD13 LEU A 652 11.047 5.022 -0.052 1.00 25.00 H new ATOM 0 HD21 LEU A 652 10.915 7.488 1.778 1.00 25.00 H new ATOM 0 HD22 LEU A 652 9.533 6.838 0.863 1.00 25.00 H new ATOM 0 HD23 LEU A 652 9.413 7.050 2.626 1.00 25.00 H new ATOM 1095 N LEU A 653 7.179 2.434 3.264 1.00 25.00 N ATOM 1096 CA LEU A 653 5.951 1.630 3.153 1.00 25.00 C ATOM 1097 C LEU A 653 5.020 1.844 4.357 1.00 25.00 C ATOM 1098 O LEU A 653 3.797 1.752 4.223 1.00 25.00 O ATOM 1099 CB LEU A 653 6.289 0.136 3.034 1.00 25.00 C ATOM 1100 CG LEU A 653 5.100 -0.828 2.915 1.00 25.00 C ATOM 1101 CD1 LEU A 653 5.241 -1.657 1.657 1.00 25.00 C ATOM 1102 CD2 LEU A 653 4.991 -1.740 4.128 1.00 25.00 C ATOM 0 H LEU A 653 7.994 1.905 3.574 1.00 25.00 H new ATOM 0 HA LEU A 653 5.434 1.961 2.252 1.00 25.00 H new ATOM 0 HB2 LEU A 653 6.928 -0.001 2.161 1.00 25.00 H new ATOM 0 HB3 LEU A 653 6.875 -0.152 3.907 1.00 25.00 H new ATOM 0 HG LEU A 653 4.188 -0.233 2.865 1.00 25.00 H new ATOM 0 HD11 LEU A 653 4.396 -2.340 1.575 1.00 25.00 H new ATOM 0 HD12 LEU A 653 5.261 -0.999 0.788 1.00 25.00 H new ATOM 0 HD13 LEU A 653 6.168 -2.229 1.700 1.00 25.00 H new ATOM 0 HD21 LEU A 653 4.138 -2.407 4.006 1.00 25.00 H new ATOM 0 HD22 LEU A 653 5.903 -2.330 4.223 1.00 25.00 H new ATOM 0 HD23 LEU A 653 4.855 -1.137 5.026 1.00 25.00 H new ATOM 1114 N ALA A 654 5.616 2.133 5.529 1.00 25.00 N ATOM 1115 CA ALA A 654 4.859 2.351 6.772 1.00 25.00 C ATOM 1116 C ALA A 654 4.235 3.750 6.830 1.00 25.00 C ATOM 1117 O ALA A 654 3.219 3.947 7.503 1.00 25.00 O ATOM 1118 CB ALA A 654 5.756 2.130 7.980 1.00 25.00 C ATOM 0 H ALA A 654 6.626 2.221 5.639 1.00 25.00 H new ATOM 0 HA ALA A 654 4.044 1.627 6.787 1.00 25.00 H new ATOM 0 HB1 ALA A 654 5.184 2.294 8.893 1.00 25.00 H new ATOM 0 HB2 ALA A 654 6.136 1.108 7.969 1.00 25.00 H new ATOM 0 HB3 ALA A 654 6.592 2.829 7.945 1.00 25.00 H new ATOM 1124 N GLU A 655 4.846 4.716 6.121 1.00 25.00 N ATOM 1125 CA GLU A 655 4.334 6.096 6.087 1.00 25.00 C ATOM 1126 C GLU A 655 3.134 6.237 5.141 1.00 25.00 C ATOM 1127 O GLU A 655 2.271 7.090 5.361 1.00 25.00 O ATOM 1128 CB GLU A 655 5.449 7.107 5.733 1.00 25.00 C ATOM 1129 CG GLU A 655 6.358 7.505 6.896 1.00 25.00 C ATOM 1130 CD GLU A 655 7.473 8.443 6.474 1.00 25.00 C ATOM 1131 OE1 GLU A 655 7.524 8.803 5.278 1.00 25.00 O ATOM 1132 OE2 GLU A 655 8.293 8.817 7.337 1.00 25.00 O ATOM 0 H GLU A 655 5.690 4.567 5.567 1.00 25.00 H new ATOM 0 HA GLU A 655 3.983 6.330 7.092 1.00 25.00 H new ATOM 0 HB2 GLU A 655 6.065 6.682 4.940 1.00 25.00 H new ATOM 0 HB3 GLU A 655 4.986 8.008 5.329 1.00 25.00 H new ATOM 0 HG2 GLU A 655 5.760 7.984 7.671 1.00 25.00 H new ATOM 0 HG3 GLU A 655 6.791 6.607 7.337 1.00 25.00 H new ATOM 1139 N LYS A 656 3.085 5.396 4.091 1.00 25.00 N ATOM 1140 CA LYS A 656 1.896 5.301 3.228 1.00 25.00 C ATOM 1141 C LYS A 656 0.765 4.629 4.005 1.00 25.00 C ATOM 1142 O LYS A 656 -0.408 4.946 3.818 1.00 25.00 O ATOM 1143 CB LYS A 656 2.163 4.486 1.944 1.00 25.00 C ATOM 1144 CG LYS A 656 3.252 5.027 1.009 1.00 25.00 C ATOM 1145 CD LYS A 656 3.165 6.538 0.816 1.00 25.00 C ATOM 1146 CE LYS A 656 4.394 7.081 0.104 1.00 25.00 C ATOM 1147 NZ LYS A 656 4.503 6.566 -1.288 1.00 25.00 N ATOM 0 H LYS A 656 3.850 4.777 3.822 1.00 25.00 H new ATOM 0 HA LYS A 656 1.626 6.315 2.933 1.00 25.00 H new ATOM 0 HB2 LYS A 656 2.434 3.471 2.234 1.00 25.00 H new ATOM 0 HB3 LYS A 656 1.232 4.419 1.382 1.00 25.00 H new ATOM 0 HG2 LYS A 656 4.232 4.772 1.413 1.00 25.00 H new ATOM 0 HG3 LYS A 656 3.170 4.536 0.040 1.00 25.00 H new ATOM 0 HD2 LYS A 656 2.272 6.781 0.240 1.00 25.00 H new ATOM 0 HD3 LYS A 656 3.061 7.024 1.786 1.00 25.00 H new ATOM 0 HE2 LYS A 656 4.351 8.170 0.086 1.00 25.00 H new ATOM 0 HE3 LYS A 656 5.288 6.807 0.663 1.00 25.00 H new ATOM 0 HZ1 LYS A 656 5.344 6.973 -1.744 1.00 25.00 H new ATOM 0 HZ2 LYS A 656 4.587 5.530 -1.269 1.00 25.00 H new ATOM 0 HZ3 LYS A 656 3.654 6.835 -1.825 1.00 25.00 H new ATOM 1161 N ILE A 657 1.164 3.732 4.922 1.00 25.00 N ATOM 1162 CA ILE A 657 0.240 2.951 5.752 1.00 25.00 C ATOM 1163 C ILE A 657 -0.492 3.855 6.763 1.00 25.00 C ATOM 1164 O ILE A 657 -1.618 3.557 7.165 1.00 25.00 O ATOM 1165 CB ILE A 657 1.024 1.776 6.444 1.00 25.00 C ATOM 1166 CG1 ILE A 657 1.111 0.585 5.456 1.00 25.00 C ATOM 1167 CG2 ILE A 657 0.421 1.348 7.794 1.00 25.00 C ATOM 1168 CD1 ILE A 657 1.981 -0.586 5.902 1.00 25.00 C ATOM 0 H ILE A 657 2.146 3.529 5.107 1.00 25.00 H new ATOM 0 HA ILE A 657 -0.534 2.510 5.124 1.00 25.00 H new ATOM 0 HB ILE A 657 2.025 2.135 6.684 1.00 25.00 H new ATOM 0 HG12 ILE A 657 0.102 0.215 5.273 1.00 25.00 H new ATOM 0 HG13 ILE A 657 1.492 0.954 4.504 1.00 25.00 H new ATOM 0 HG21 ILE A 657 1.012 0.534 8.215 1.00 25.00 H new ATOM 0 HG22 ILE A 657 0.429 2.194 8.481 1.00 25.00 H new ATOM 0 HG23 ILE A 657 -0.605 1.012 7.644 1.00 25.00 H new ATOM 0 HD11 ILE A 657 1.969 -1.361 5.135 1.00 25.00 H new ATOM 0 HD12 ILE A 657 3.004 -0.242 6.054 1.00 25.00 H new ATOM 0 HD13 ILE A 657 1.592 -0.993 6.835 1.00 25.00 H new ATOM 1180 N TYR A 658 0.158 4.953 7.153 1.00 25.00 N ATOM 1181 CA TYR A 658 -0.430 5.903 8.092 1.00 25.00 C ATOM 1182 C TYR A 658 -1.328 6.912 7.357 1.00 25.00 C ATOM 1183 O TYR A 658 -2.340 7.356 7.902 1.00 25.00 O ATOM 1184 CB TYR A 658 0.685 6.630 8.860 1.00 25.00 C ATOM 1185 CG TYR A 658 1.414 5.774 9.884 1.00 25.00 C ATOM 1186 CD1 TYR A 658 2.779 5.535 9.773 1.00 25.00 C ATOM 1187 CD2 TYR A 658 0.737 5.212 10.961 1.00 25.00 C ATOM 1188 CE1 TYR A 658 3.447 4.760 10.704 1.00 25.00 C ATOM 1189 CE2 TYR A 658 1.398 4.437 11.895 1.00 25.00 C ATOM 1190 CZ TYR A 658 2.751 4.213 11.762 1.00 25.00 C ATOM 1191 OH TYR A 658 3.413 3.443 12.690 1.00 25.00 O ATOM 0 H TYR A 658 1.093 5.204 6.831 1.00 25.00 H new ATOM 0 HA TYR A 658 -1.052 5.357 8.802 1.00 25.00 H new ATOM 0 HB2 TYR A 658 1.412 7.012 8.143 1.00 25.00 H new ATOM 0 HB3 TYR A 658 0.254 7.493 9.368 1.00 25.00 H new ATOM 0 HD1 TYR A 658 3.327 5.962 8.946 1.00 25.00 H new ATOM 0 HD2 TYR A 658 -0.324 5.384 11.069 1.00 25.00 H new ATOM 0 HE1 TYR A 658 4.508 4.584 10.603 1.00 25.00 H new ATOM 0 HE2 TYR A 658 0.856 4.009 12.726 1.00 25.00 H new ATOM 0 HH TYR A 658 2.779 3.135 13.371 1.00 25.00 H new ATOM 1201 N LYS A 659 -0.949 7.248 6.109 1.00 25.00 N ATOM 1202 CA LYS A 659 -1.682 8.233 5.286 1.00 25.00 C ATOM 1203 C LYS A 659 -2.979 7.655 4.712 1.00 25.00 C ATOM 1204 O LYS A 659 -3.974 8.373 4.573 1.00 25.00 O ATOM 1205 CB LYS A 659 -0.803 8.752 4.136 1.00 25.00 C ATOM 1206 CG LYS A 659 -1.528 9.611 3.099 1.00 25.00 C ATOM 1207 CD LYS A 659 -1.990 10.956 3.667 1.00 25.00 C ATOM 1208 CE LYS A 659 -2.605 11.843 2.600 1.00 25.00 C ATOM 1209 NZ LYS A 659 -3.061 13.156 3.142 1.00 25.00 N ATOM 0 H LYS A 659 -0.133 6.849 5.645 1.00 25.00 H new ATOM 0 HA LYS A 659 -1.940 9.059 5.948 1.00 25.00 H new ATOM 0 HB2 LYS A 659 0.015 9.335 4.560 1.00 25.00 H new ATOM 0 HB3 LYS A 659 -0.356 7.898 3.628 1.00 25.00 H new ATOM 0 HG2 LYS A 659 -0.866 9.787 2.251 1.00 25.00 H new ATOM 0 HG3 LYS A 659 -2.392 9.065 2.720 1.00 25.00 H new ATOM 0 HD2 LYS A 659 -2.718 10.784 4.459 1.00 25.00 H new ATOM 0 HD3 LYS A 659 -1.142 11.469 4.120 1.00 25.00 H new ATOM 0 HE2 LYS A 659 -1.875 12.014 1.809 1.00 25.00 H new ATOM 0 HE3 LYS A 659 -3.451 11.327 2.147 1.00 25.00 H new ATOM 0 HZ1 LYS A 659 -2.975 13.885 2.405 1.00 25.00 H new ATOM 0 HZ2 LYS A 659 -4.054 13.082 3.441 1.00 25.00 H new ATOM 0 HZ3 LYS A 659 -2.472 13.418 3.958 1.00 25.00 H new ATOM 1223 N ILE A 660 -2.956 6.355 4.379 1.00 25.00 N ATOM 1224 CA ILE A 660 -4.155 5.636 3.903 1.00 25.00 C ATOM 1225 C ILE A 660 -5.174 5.500 5.054 1.00 25.00 C ATOM 1226 O ILE A 660 -6.388 5.504 4.833 1.00 25.00 O ATOM 1227 CB ILE A 660 -3.778 4.226 3.333 1.00 25.00 C ATOM 1228 CG1 ILE A 660 -2.965 4.369 2.031 1.00 25.00 C ATOM 1229 CG2 ILE A 660 -5.033 3.382 3.073 1.00 25.00 C ATOM 1230 CD1 ILE A 660 -2.134 3.146 1.663 1.00 25.00 C ATOM 0 H ILE A 660 -2.118 5.776 4.430 1.00 25.00 H new ATOM 0 HA ILE A 660 -4.605 6.211 3.094 1.00 25.00 H new ATOM 0 HB ILE A 660 -3.168 3.718 4.080 1.00 25.00 H new ATOM 0 HG12 ILE A 660 -3.651 4.585 1.212 1.00 25.00 H new ATOM 0 HG13 ILE A 660 -2.301 5.228 2.126 1.00 25.00 H new ATOM 0 HG21 ILE A 660 -4.742 2.409 2.678 1.00 25.00 H new ATOM 0 HG22 ILE A 660 -5.580 3.246 4.006 1.00 25.00 H new ATOM 0 HG23 ILE A 660 -5.670 3.891 2.350 1.00 25.00 H new ATOM 0 HD11 ILE A 660 -1.597 3.337 0.734 1.00 25.00 H new ATOM 0 HD12 ILE A 660 -1.419 2.939 2.460 1.00 25.00 H new ATOM 0 HD13 ILE A 660 -2.791 2.286 1.532 1.00 25.00 H new ATOM 1242 N GLN A 661 -4.640 5.386 6.273 1.00 25.00 N ATOM 1243 CA GLN A 661 -5.435 5.348 7.501 1.00 25.00 C ATOM 1244 C GLN A 661 -5.967 6.739 7.891 1.00 25.00 C ATOM 1245 O GLN A 661 -6.922 6.844 8.666 1.00 25.00 O ATOM 1246 CB GLN A 661 -4.589 4.750 8.630 1.00 25.00 C ATOM 1247 CG GLN A 661 -4.461 3.221 8.574 1.00 25.00 C ATOM 1248 CD GLN A 661 -3.769 2.578 9.775 1.00 25.00 C ATOM 1249 OE1 GLN A 661 -4.425 1.944 10.602 1.00 25.00 O ATOM 1250 NE2 GLN A 661 -2.458 2.732 9.885 1.00 25.00 N ATOM 0 H GLN A 661 -3.635 5.317 6.436 1.00 25.00 H new ATOM 0 HA GLN A 661 -6.308 4.720 7.325 1.00 25.00 H new ATOM 0 HB2 GLN A 661 -3.592 5.189 8.594 1.00 25.00 H new ATOM 0 HB3 GLN A 661 -5.028 5.033 9.587 1.00 25.00 H new ATOM 0 HG2 GLN A 661 -5.459 2.793 8.479 1.00 25.00 H new ATOM 0 HG3 GLN A 661 -3.911 2.952 7.672 1.00 25.00 H new ATOM 0 HE21 GLN A 661 -1.946 3.264 9.181 1.00 25.00 H new ATOM 0 HE22 GLN A 661 -1.960 2.319 10.674 1.00 25.00 H new ATOM 1259 N LYS A 662 -5.340 7.799 7.345 1.00 25.00 N ATOM 1260 CA LYS A 662 -5.783 9.188 7.573 1.00 25.00 C ATOM 1261 C LYS A 662 -6.968 9.566 6.674 1.00 25.00 C ATOM 1262 O LYS A 662 -7.906 10.228 7.128 1.00 25.00 O ATOM 1263 CB LYS A 662 -4.638 10.189 7.330 1.00 25.00 C ATOM 1264 CG LYS A 662 -4.929 11.657 7.692 1.00 25.00 C ATOM 1265 CD LYS A 662 -5.287 11.887 9.167 1.00 25.00 C ATOM 1266 CE LYS A 662 -5.402 13.356 9.508 1.00 25.00 C ATOM 1267 NZ LYS A 662 -6.661 13.963 8.994 1.00 25.00 N ATOM 0 H LYS A 662 -4.522 7.719 6.741 1.00 25.00 H new ATOM 0 HA LYS A 662 -6.098 9.240 8.615 1.00 25.00 H new ATOM 0 HB2 LYS A 662 -3.770 9.861 7.901 1.00 25.00 H new ATOM 0 HB3 LYS A 662 -4.362 10.144 6.276 1.00 25.00 H new ATOM 0 HG2 LYS A 662 -4.055 12.260 7.445 1.00 25.00 H new ATOM 0 HG3 LYS A 662 -5.750 12.016 7.071 1.00 25.00 H new ATOM 0 HD2 LYS A 662 -6.230 11.389 9.391 1.00 25.00 H new ATOM 0 HD3 LYS A 662 -4.527 11.428 9.799 1.00 25.00 H new ATOM 0 HE2 LYS A 662 -5.358 13.479 10.590 1.00 25.00 H new ATOM 0 HE3 LYS A 662 -4.548 13.890 9.092 1.00 25.00 H new ATOM 0 HZ1 LYS A 662 -6.692 14.970 9.253 1.00 25.00 H new ATOM 0 HZ2 LYS A 662 -6.693 13.871 7.959 1.00 25.00 H new ATOM 0 HZ3 LYS A 662 -7.478 13.473 9.411 1.00 25.00 H new ATOM 1281 N GLU A 663 -6.913 9.139 5.400 1.00 25.00 N ATOM 1282 CA GLU A 663 -7.932 9.480 4.401 1.00 25.00 C ATOM 1283 C GLU A 663 -9.260 8.751 4.669 1.00 25.00 C ATOM 1284 O GLU A 663 -10.339 9.340 4.555 1.00 25.00 O ATOM 1285 CB GLU A 663 -7.373 9.188 2.987 1.00 25.00 C ATOM 1286 CG GLU A 663 -6.138 9.990 2.553 1.00 25.00 C ATOM 1287 CD GLU A 663 -6.375 11.491 2.577 1.00 25.00 C ATOM 1288 OE1 GLU A 663 -7.346 11.946 1.939 1.00 25.00 O ATOM 1289 OE2 GLU A 663 -5.590 12.212 3.226 1.00 25.00 O ATOM 0 H GLU A 663 -6.163 8.550 5.039 1.00 25.00 H new ATOM 0 HA GLU A 663 -8.161 10.544 4.470 1.00 25.00 H new ATOM 0 HB2 GLU A 663 -7.127 8.128 2.931 1.00 25.00 H new ATOM 0 HB3 GLU A 663 -8.168 9.369 2.263 1.00 25.00 H new ATOM 0 HG2 GLU A 663 -5.303 9.748 3.210 1.00 25.00 H new ATOM 0 HG3 GLU A 663 -5.849 9.688 1.546 1.00 25.00 H new ATOM 1296 N LEU A 664 -9.151 7.465 5.021 1.00 25.00 N ATOM 1297 CA LEU A 664 -10.302 6.641 5.413 1.00 25.00 C ATOM 1298 C LEU A 664 -10.863 7.029 6.791 1.00 25.00 C ATOM 1299 O LEU A 664 -12.004 6.690 7.113 1.00 25.00 O ATOM 1300 CB LEU A 664 -9.922 5.155 5.420 1.00 25.00 C ATOM 1301 CG LEU A 664 -9.632 4.530 4.049 1.00 25.00 C ATOM 1302 CD1 LEU A 664 -9.109 3.118 4.221 1.00 25.00 C ATOM 1303 CD2 LEU A 664 -10.880 4.524 3.168 1.00 25.00 C ATOM 0 H LEU A 664 -8.262 6.965 5.042 1.00 25.00 H new ATOM 0 HA LEU A 664 -11.081 6.823 4.672 1.00 25.00 H new ATOM 0 HB2 LEU A 664 -9.041 5.028 6.049 1.00 25.00 H new ATOM 0 HB3 LEU A 664 -10.731 4.595 5.889 1.00 25.00 H new ATOM 0 HG LEU A 664 -8.873 5.137 3.555 1.00 25.00 H new ATOM 0 HD11 LEU A 664 -8.906 2.683 3.242 1.00 25.00 H new ATOM 0 HD12 LEU A 664 -8.190 3.139 4.806 1.00 25.00 H new ATOM 0 HD13 LEU A 664 -9.855 2.514 4.739 1.00 25.00 H new ATOM 0 HD21 LEU A 664 -10.642 4.075 2.204 1.00 25.00 H new ATOM 0 HD22 LEU A 664 -11.666 3.945 3.654 1.00 25.00 H new ATOM 0 HD23 LEU A 664 -11.224 5.547 3.017 1.00 25.00 H new ATOM 1315 N GLU A 665 -10.049 7.738 7.595 1.00 25.00 N ATOM 1316 CA GLU A 665 -10.441 8.163 8.952 1.00 25.00 C ATOM 1317 C GLU A 665 -11.592 9.188 8.903 1.00 25.00 C ATOM 1318 O GLU A 665 -12.441 9.216 9.798 1.00 25.00 O ATOM 1319 CB GLU A 665 -9.205 8.729 9.685 1.00 25.00 C ATOM 1320 CG GLU A 665 -8.704 7.908 10.882 1.00 25.00 C ATOM 1321 CD GLU A 665 -9.715 7.794 12.013 1.00 25.00 C ATOM 1322 OE1 GLU A 665 -10.282 8.835 12.411 1.00 25.00 O ATOM 1323 OE2 GLU A 665 -9.928 6.668 12.507 1.00 25.00 O ATOM 0 H GLU A 665 -9.110 8.030 7.326 1.00 25.00 H new ATOM 0 HA GLU A 665 -10.812 7.301 9.506 1.00 25.00 H new ATOM 0 HB2 GLU A 665 -8.391 8.822 8.966 1.00 25.00 H new ATOM 0 HB3 GLU A 665 -9.441 9.735 10.032 1.00 25.00 H new ATOM 0 HG2 GLU A 665 -8.441 6.907 10.540 1.00 25.00 H new ATOM 0 HG3 GLU A 665 -7.792 8.363 11.267 1.00 25.00 H new ATOM 1330 N GLU A 666 -11.614 10.014 7.843 1.00 25.00 N ATOM 1331 CA GLU A 666 -12.711 10.967 7.604 1.00 25.00 C ATOM 1332 C GLU A 666 -13.957 10.248 7.062 1.00 25.00 C ATOM 1333 O GLU A 666 -15.078 10.748 7.185 1.00 25.00 O ATOM 1334 CB GLU A 666 -12.271 12.065 6.625 1.00 25.00 C ATOM 1335 CG GLU A 666 -11.405 13.147 7.258 1.00 25.00 C ATOM 1336 CD GLU A 666 -12.223 14.240 7.919 1.00 25.00 C ATOM 1337 OE1 GLU A 666 -13.467 14.201 7.810 1.00 25.00 O ATOM 1338 OE2 GLU A 666 -11.618 15.139 8.544 1.00 25.00 O ATOM 0 H GLU A 666 -10.880 10.040 7.135 1.00 25.00 H new ATOM 0 HA GLU A 666 -12.966 11.428 8.558 1.00 25.00 H new ATOM 0 HB2 GLU A 666 -11.720 11.606 5.804 1.00 25.00 H new ATOM 0 HB3 GLU A 666 -13.158 12.530 6.193 1.00 25.00 H new ATOM 0 HG2 GLU A 666 -10.747 12.693 7.999 1.00 25.00 H new ATOM 0 HG3 GLU A 666 -10.766 13.589 6.493 1.00 25.00 H new ATOM 1345 N LYS A 667 -13.731 9.072 6.461 1.00 25.00 N ATOM 1346 CA LYS A 667 -14.806 8.192 5.987 1.00 25.00 C ATOM 1347 C LYS A 667 -15.293 7.262 7.120 1.00 25.00 C ATOM 1348 O LYS A 667 -16.388 6.694 7.038 1.00 25.00 O ATOM 1349 CB LYS A 667 -14.299 7.400 4.759 1.00 25.00 C ATOM 1350 CG LYS A 667 -14.169 8.201 3.452 1.00 25.00 C ATOM 1351 CD LYS A 667 -12.885 9.031 3.397 1.00 25.00 C ATOM 1352 CE LYS A 667 -12.741 9.809 2.094 1.00 25.00 C ATOM 1353 NZ LYS A 667 -11.446 10.545 2.011 1.00 25.00 N ATOM 0 H LYS A 667 -12.795 8.704 6.290 1.00 25.00 H new ATOM 0 HA LYS A 667 -15.667 8.787 5.683 1.00 25.00 H new ATOM 0 HB2 LYS A 667 -13.325 6.976 5.001 1.00 25.00 H new ATOM 0 HB3 LYS A 667 -14.976 6.564 4.585 1.00 25.00 H new ATOM 0 HG2 LYS A 667 -14.190 7.514 2.606 1.00 25.00 H new ATOM 0 HG3 LYS A 667 -15.029 8.862 3.348 1.00 25.00 H new ATOM 0 HD2 LYS A 667 -12.872 9.728 4.235 1.00 25.00 H new ATOM 0 HD3 LYS A 667 -12.026 8.371 3.518 1.00 25.00 H new ATOM 0 HE2 LYS A 667 -12.819 9.121 1.253 1.00 25.00 H new ATOM 0 HE3 LYS A 667 -13.565 10.517 2.004 1.00 25.00 H new ATOM 0 HZ1 LYS A 667 -11.630 11.552 1.829 1.00 25.00 H new ATOM 0 HZ2 LYS A 667 -10.931 10.444 2.909 1.00 25.00 H new ATOM 0 HZ3 LYS A 667 -10.873 10.153 1.237 1.00 25.00 H new ATOM 1367 N ARG A 668 -14.475 7.136 8.176 1.00 25.00 N ATOM 1368 CA ARG A 668 -14.765 6.242 9.300 1.00 25.00 C ATOM 1369 C ARG A 668 -15.678 6.921 10.339 1.00 25.00 C ATOM 1370 O ARG A 668 -16.719 6.368 10.704 1.00 25.00 O ATOM 1371 CB ARG A 668 -13.450 5.784 9.948 1.00 25.00 C ATOM 1372 CG ARG A 668 -13.635 4.768 11.063 1.00 25.00 C ATOM 1373 CD ARG A 668 -12.299 4.331 11.646 1.00 25.00 C ATOM 1374 NE ARG A 668 -11.414 3.740 10.628 1.00 25.00 N ATOM 1375 CZ ARG A 668 -10.145 3.363 10.840 1.00 25.00 C ATOM 1376 NH1 ARG A 668 -9.573 3.498 12.036 1.00 25.00 N ATOM 1377 NH2 ARG A 668 -9.442 2.846 9.843 1.00 25.00 N ATOM 0 H ARG A 668 -13.599 7.650 8.272 1.00 25.00 H new ATOM 0 HA ARG A 668 -15.299 5.371 8.919 1.00 25.00 H new ATOM 0 HB2 ARG A 668 -12.808 5.353 9.180 1.00 25.00 H new ATOM 0 HB3 ARG A 668 -12.930 6.655 10.346 1.00 25.00 H new ATOM 0 HG2 ARG A 668 -14.253 5.199 11.850 1.00 25.00 H new ATOM 0 HG3 ARG A 668 -14.168 3.898 10.679 1.00 25.00 H new ATOM 0 HD2 ARG A 668 -11.805 5.190 12.100 1.00 25.00 H new ATOM 0 HD3 ARG A 668 -12.471 3.605 12.441 1.00 25.00 H new ATOM 0 HE ARG A 668 -11.795 3.608 9.691 1.00 25.00 H new ATOM 0 HH11 ARG A 668 -10.102 3.895 12.813 1.00 25.00 H new ATOM 0 HH12 ARG A 668 -8.606 3.204 12.175 1.00 25.00 H new ATOM 0 HH21 ARG A 668 -9.867 2.737 8.922 1.00 25.00 H new ATOM 0 HH22 ARG A 668 -8.476 2.557 9.996 1.00 25.00 H new ATOM 1391 N ARG A 669 -15.277 8.115 10.806 1.00 25.00 N ATOM 1392 CA ARG A 669 -16.040 8.856 11.822 1.00 25.00 C ATOM 1393 C ARG A 669 -17.039 9.836 11.195 1.00 25.00 C ATOM 1394 O ARG A 669 -18.202 9.885 11.605 1.00 25.00 O ATOM 1395 CB ARG A 669 -15.095 9.608 12.771 1.00 25.00 C ATOM 1396 CG ARG A 669 -14.287 8.704 13.685 1.00 25.00 C ATOM 1397 CD ARG A 669 -13.527 9.521 14.707 1.00 25.00 C ATOM 1398 NE ARG A 669 -12.377 10.215 14.115 1.00 25.00 N ATOM 1399 CZ ARG A 669 -12.276 11.546 13.976 1.00 25.00 C ATOM 1400 NH1 ARG A 669 -13.253 12.359 14.377 1.00 25.00 N ATOM 1401 NH2 ARG A 669 -11.185 12.065 13.430 1.00 25.00 N ATOM 0 H ARG A 669 -14.428 8.587 10.495 1.00 25.00 H new ATOM 0 HA ARG A 669 -16.609 8.120 12.390 1.00 25.00 H new ATOM 0 HB2 ARG A 669 -14.410 10.214 12.179 1.00 25.00 H new ATOM 0 HB3 ARG A 669 -15.681 10.294 13.382 1.00 25.00 H new ATOM 0 HG2 ARG A 669 -14.951 8.004 14.192 1.00 25.00 H new ATOM 0 HG3 ARG A 669 -13.589 8.111 13.094 1.00 25.00 H new ATOM 0 HD2 ARG A 669 -14.198 10.252 15.158 1.00 25.00 H new ATOM 0 HD3 ARG A 669 -13.182 8.868 15.509 1.00 25.00 H new ATOM 0 HE ARG A 669 -11.598 9.644 13.785 1.00 25.00 H new ATOM 0 HH11 ARG A 669 -14.097 11.972 14.799 1.00 25.00 H new ATOM 0 HH12 ARG A 669 -13.156 13.368 14.262 1.00 25.00 H new ATOM 0 HH21 ARG A 669 -10.430 11.454 13.119 1.00 25.00 H new ATOM 0 HH22 ARG A 669 -11.101 13.076 13.321 1.00 25.00 H new ATOM 1415 N SER A 670 -16.577 10.612 10.201 1.00 25.00 N ATOM 1416 CA SER A 670 -17.402 11.638 9.556 1.00 25.00 C ATOM 1417 C SER A 670 -18.212 11.079 8.379 1.00 25.00 C ATOM 1418 O SER A 670 -19.228 11.662 7.992 1.00 25.00 O ATOM 1419 CB SER A 670 -16.520 12.792 9.080 1.00 25.00 C ATOM 1420 OG SER A 670 -16.464 12.848 7.665 1.00 25.00 O ATOM 0 H SER A 670 -15.630 10.545 9.827 1.00 25.00 H new ATOM 0 HA SER A 670 -18.114 11.998 10.299 1.00 25.00 H new ATOM 0 HB2 SER A 670 -16.909 13.733 9.468 1.00 25.00 H new ATOM 0 HB3 SER A 670 -15.514 12.673 9.481 1.00 25.00 H new ATOM 0 HG SER A 670 -15.734 12.278 7.344 1.00 25.00 H new ATOM 1426 N ARG A 671 -17.750 9.937 7.817 1.00 25.00 N ATOM 1427 CA ARG A 671 -18.403 9.237 6.678 1.00 25.00 C ATOM 1428 C ARG A 671 -18.293 10.030 5.353 1.00 25.00 C ATOM 1429 O ARG A 671 -18.754 9.566 4.304 1.00 25.00 O ATOM 1430 CB ARG A 671 -19.870 8.890 7.000 1.00 25.00 C ATOM 1431 CG ARG A 671 -20.034 7.961 8.198 1.00 25.00 C ATOM 1432 CD ARG A 671 -21.483 7.582 8.402 1.00 25.00 C ATOM 1433 NE ARG A 671 -21.697 6.752 9.597 1.00 25.00 N ATOM 1434 CZ ARG A 671 -21.520 5.421 9.648 1.00 25.00 C ATOM 1435 NH1 ARG A 671 -21.121 4.736 8.579 1.00 25.00 N ATOM 1436 NH2 ARG A 671 -21.744 4.777 10.786 1.00 25.00 N ATOM 0 H ARG A 671 -16.905 9.468 8.143 1.00 25.00 H new ATOM 0 HA ARG A 671 -17.859 8.304 6.532 1.00 25.00 H new ATOM 0 HB2 ARG A 671 -20.419 9.813 7.190 1.00 25.00 H new ATOM 0 HB3 ARG A 671 -20.324 8.424 6.126 1.00 25.00 H new ATOM 0 HG2 ARG A 671 -19.438 7.061 8.048 1.00 25.00 H new ATOM 0 HG3 ARG A 671 -19.653 8.449 9.095 1.00 25.00 H new ATOM 0 HD2 ARG A 671 -22.082 8.489 8.484 1.00 25.00 H new ATOM 0 HD3 ARG A 671 -21.839 7.043 7.524 1.00 25.00 H new ATOM 0 HE ARG A 671 -22.002 7.221 10.450 1.00 25.00 H new ATOM 0 HH11 ARG A 671 -20.943 5.221 7.699 1.00 25.00 H new ATOM 0 HH12 ARG A 671 -20.993 3.726 8.639 1.00 25.00 H new ATOM 0 HH21 ARG A 671 -22.048 5.292 11.612 1.00 25.00 H new ATOM 0 HH22 ARG A 671 -21.612 3.767 10.835 1.00 25.00 H new ATOM 1450 N LEU A 672 -17.662 11.208 5.413 1.00 25.00 N ATOM 1451 CA LEU A 672 -17.447 12.047 4.228 1.00 25.00 C ATOM 1452 C LEU A 672 -15.953 12.178 3.918 1.00 25.00 C ATOM 1453 O LEU A 672 -15.481 11.477 2.999 1.00 25.00 O ATOM 1454 CB LEU A 672 -18.088 13.442 4.404 1.00 25.00 C ATOM 1455 CG LEU A 672 -19.606 13.471 4.670 1.00 25.00 C ATOM 1456 CD1 LEU A 672 -20.097 14.879 4.991 1.00 25.00 C ATOM 1457 CD2 LEU A 672 -20.360 12.908 3.474 1.00 25.00 C ATOM 1458 OXT LEU A 672 -15.263 12.968 4.602 1.00 25.00 O ATOM 0 H LEU A 672 -17.289 11.604 6.276 1.00 25.00 H new ATOM 0 HA LEU A 672 -17.933 11.558 3.384 1.00 25.00 H new ATOM 0 HB2 LEU A 672 -17.587 13.946 5.230 1.00 25.00 H new ATOM 0 HB3 LEU A 672 -17.888 14.026 3.506 1.00 25.00 H new ATOM 0 HG LEU A 672 -19.801 12.848 5.543 1.00 25.00 H new ATOM 0 HD11 LEU A 672 -21.172 14.857 5.172 1.00 25.00 H new ATOM 0 HD12 LEU A 672 -19.587 15.248 5.880 1.00 25.00 H new ATOM 0 HD13 LEU A 672 -19.884 15.539 4.150 1.00 25.00 H new ATOM 0 HD21 LEU A 672 -21.431 12.934 3.674 1.00 25.00 H new ATOM 0 HD22 LEU A 672 -20.141 13.508 2.591 1.00 25.00 H new ATOM 0 HD23 LEU A 672 -20.048 11.878 3.299 1.00 25.00 H new TER 1470 LEU A 672 ATOM 1471 N GLY B 519 13.480 24.049 14.174 1.00 25.00 N ATOM 1472 CA GLY B 519 12.276 24.879 13.891 1.00 25.00 C ATOM 1473 C GLY B 519 11.875 24.838 12.431 1.00 25.00 C ATOM 1474 O GLY B 519 12.607 25.331 11.569 1.00 25.00 O ATOM 0 HA2 GLY B 519 11.445 24.529 14.503 1.00 25.00 H new ATOM 0 HA3 GLY B 519 12.473 25.911 14.182 1.00 25.00 H new ATOM 1480 N SER B 520 10.707 24.244 12.159 1.00 25.00 N ATOM 1481 CA SER B 520 10.184 24.133 10.795 1.00 25.00 C ATOM 1482 C SER B 520 9.049 25.151 10.562 1.00 25.00 C ATOM 1483 O SER B 520 8.124 25.233 11.378 1.00 25.00 O ATOM 1484 CB SER B 520 9.680 22.706 10.538 1.00 25.00 C ATOM 1485 OG SER B 520 9.112 22.581 9.243 1.00 25.00 O ATOM 0 H SER B 520 10.104 23.831 12.871 1.00 25.00 H new ATOM 0 HA SER B 520 10.991 24.354 10.096 1.00 25.00 H new ATOM 0 HB2 SER B 520 10.506 22.003 10.644 1.00 25.00 H new ATOM 0 HB3 SER B 520 8.937 22.440 11.290 1.00 25.00 H new ATOM 0 HG SER B 520 8.802 21.661 9.109 1.00 25.00 H new ATOM 1491 N PRO B 521 9.097 25.953 9.445 1.00 25.00 N ATOM 1492 CA PRO B 521 8.064 26.977 9.153 1.00 25.00 C ATOM 1493 C PRO B 521 6.714 26.389 8.699 1.00 25.00 C ATOM 1494 O PRO B 521 5.685 27.071 8.760 1.00 25.00 O ATOM 1495 CB PRO B 521 8.705 27.800 8.027 1.00 25.00 C ATOM 1496 CG PRO B 521 9.667 26.876 7.381 1.00 25.00 C ATOM 1497 CD PRO B 521 10.158 25.950 8.395 1.00 25.00 C ATOM 0 HA PRO B 521 7.809 27.551 10.044 1.00 25.00 H new ATOM 0 HB2 PRO B 521 7.955 28.150 7.317 1.00 25.00 H new ATOM 0 HB3 PRO B 521 9.208 28.683 8.420 1.00 25.00 H new ATOM 0 HG2 PRO B 521 9.185 26.331 6.570 1.00 25.00 H new ATOM 0 HG3 PRO B 521 10.494 27.434 6.943 1.00 25.00 H new ATOM 0 HD2 PRO B 521 10.307 24.952 7.983 1.00 25.00 H new ATOM 0 HD3 PRO B 521 11.117 26.274 8.798 1.00 25.00 H new ATOM 1505 N GLY B 522 6.738 25.130 8.246 1.00 25.00 N ATOM 1506 CA GLY B 522 5.529 24.466 7.780 1.00 25.00 C ATOM 1507 C GLY B 522 5.798 23.494 6.647 1.00 25.00 C ATOM 1508 O GLY B 522 6.834 23.580 5.979 1.00 25.00 O ATOM 0 H GLY B 522 7.581 24.558 8.195 1.00 25.00 H new ATOM 0 HA2 GLY B 522 5.069 23.931 8.611 1.00 25.00 H new ATOM 0 HA3 GLY B 522 4.812 25.216 7.448 1.00 25.00 H new ATOM 1512 N TYR B 523 4.857 22.569 6.433 1.00 25.00 N ATOM 1513 CA TYR B 523 4.976 21.561 5.376 1.00 25.00 C ATOM 1514 C TYR B 523 4.031 21.876 4.197 1.00 25.00 C ATOM 1515 O TYR B 523 2.841 22.125 4.418 1.00 25.00 O ATOM 1516 CB TYR B 523 4.707 20.144 5.937 1.00 25.00 C ATOM 1517 CG TYR B 523 5.720 19.641 6.960 1.00 25.00 C ATOM 1518 CD1 TYR B 523 5.525 19.847 8.322 1.00 25.00 C ATOM 1519 CD2 TYR B 523 6.861 18.953 6.560 1.00 25.00 C ATOM 1520 CE1 TYR B 523 6.440 19.390 9.253 1.00 25.00 C ATOM 1521 CE2 TYR B 523 7.778 18.492 7.484 1.00 25.00 C ATOM 1522 CZ TYR B 523 7.564 18.712 8.829 1.00 25.00 C ATOM 1523 OH TYR B 523 8.474 18.254 9.751 1.00 25.00 O ATOM 0 H TYR B 523 4.000 22.498 6.982 1.00 25.00 H new ATOM 0 HA TYR B 523 5.998 21.589 4.999 1.00 25.00 H new ATOM 0 HB2 TYR B 523 3.718 20.135 6.396 1.00 25.00 H new ATOM 0 HB3 TYR B 523 4.678 19.442 5.104 1.00 25.00 H new ATOM 0 HD1 TYR B 523 4.644 20.373 8.658 1.00 25.00 H new ATOM 0 HD2 TYR B 523 7.033 18.776 5.508 1.00 25.00 H new ATOM 0 HE1 TYR B 523 6.275 19.563 10.306 1.00 25.00 H new ATOM 0 HE2 TYR B 523 8.659 17.961 7.155 1.00 25.00 H new ATOM 0 HH TYR B 523 9.207 17.797 9.288 1.00 25.00 H new ATOM 1533 N PRO B 524 4.541 21.880 2.918 1.00 25.00 N ATOM 1534 CA PRO B 524 3.705 22.182 1.735 1.00 25.00 C ATOM 1535 C PRO B 524 2.722 21.054 1.385 1.00 25.00 C ATOM 1536 O PRO B 524 3.045 19.871 1.529 1.00 25.00 O ATOM 1537 CB PRO B 524 4.733 22.380 0.613 1.00 25.00 C ATOM 1538 CG PRO B 524 5.931 21.593 1.044 1.00 25.00 C ATOM 1539 CD PRO B 524 5.958 21.618 2.528 1.00 25.00 C ATOM 0 HA PRO B 524 3.067 23.049 1.906 1.00 25.00 H new ATOM 0 HB2 PRO B 524 4.349 22.023 -0.342 1.00 25.00 H new ATOM 0 HB3 PRO B 524 4.979 23.434 0.484 1.00 25.00 H new ATOM 0 HG2 PRO B 524 5.871 20.568 0.677 1.00 25.00 H new ATOM 0 HG3 PRO B 524 6.844 22.026 0.635 1.00 25.00 H new ATOM 0 HD2 PRO B 524 6.314 20.672 2.935 1.00 25.00 H new ATOM 0 HD3 PRO B 524 6.624 22.396 2.901 1.00 25.00 H new ATOM 1547 N ASN B 525 1.528 21.444 0.923 1.00 25.00 N ATOM 1548 CA ASN B 525 0.476 20.488 0.570 1.00 25.00 C ATOM 1549 C ASN B 525 0.302 20.421 -0.951 1.00 25.00 C ATOM 1550 O ASN B 525 0.262 21.455 -1.627 1.00 25.00 O ATOM 1551 CB ASN B 525 -0.845 20.894 1.252 1.00 25.00 C ATOM 1552 CG ASN B 525 -0.826 20.748 2.772 1.00 25.00 C ATOM 1553 OD1 ASN B 525 -0.783 19.639 3.311 1.00 25.00 O ATOM 1554 ND2 ASN B 525 -0.858 21.877 3.469 1.00 25.00 N ATOM 0 H ASN B 525 1.267 22.420 0.785 1.00 25.00 H new ATOM 0 HA ASN B 525 0.763 19.497 0.921 1.00 25.00 H new ATOM 0 HB2 ASN B 525 -1.070 21.930 0.999 1.00 25.00 H new ATOM 0 HB3 ASN B 525 -1.653 20.285 0.848 1.00 25.00 H new ATOM 0 HD21 ASN B 525 -0.847 21.847 4.489 1.00 25.00 H new ATOM 0 HD22 ASN B 525 -0.893 22.774 2.985 1.00 25.00 H new ATOM 1561 N GLY B 526 0.205 19.193 -1.472 1.00 25.00 N ATOM 1562 CA GLY B 526 0.031 18.984 -2.903 1.00 25.00 C ATOM 1563 C GLY B 526 1.025 17.991 -3.473 1.00 25.00 C ATOM 1564 O GLY B 526 1.691 18.280 -4.470 1.00 25.00 O ATOM 0 H GLY B 526 0.245 18.335 -0.922 1.00 25.00 H new ATOM 0 HA2 GLY B 526 -0.982 18.629 -3.094 1.00 25.00 H new ATOM 0 HA3 GLY B 526 0.138 19.937 -3.421 1.00 25.00 H new ATOM 1568 N LEU B 527 1.114 16.808 -2.828 1.00 25.00 N ATOM 1569 CA LEU B 527 2.032 15.707 -3.220 1.00 25.00 C ATOM 1570 C LEU B 527 3.503 16.145 -3.153 1.00 25.00 C ATOM 1571 O LEU B 527 3.926 17.064 -3.864 1.00 25.00 O ATOM 1572 CB LEU B 527 1.693 15.167 -4.633 1.00 25.00 C ATOM 1573 CG LEU B 527 2.510 13.955 -5.126 1.00 25.00 C ATOM 1574 CD1 LEU B 527 1.576 12.875 -5.653 1.00 25.00 C ATOM 1575 CD2 LEU B 527 3.492 14.357 -6.225 1.00 25.00 C ATOM 0 H LEU B 527 0.546 16.584 -2.011 1.00 25.00 H new ATOM 0 HA LEU B 527 1.888 14.901 -2.501 1.00 25.00 H new ATOM 0 HB2 LEU B 527 0.638 14.895 -4.649 1.00 25.00 H new ATOM 0 HB3 LEU B 527 1.824 15.979 -5.348 1.00 25.00 H new ATOM 0 HG LEU B 527 3.078 13.570 -4.279 1.00 25.00 H new ATOM 0 HD11 LEU B 527 2.162 12.024 -5.999 1.00 25.00 H new ATOM 0 HD12 LEU B 527 0.905 12.554 -4.856 1.00 25.00 H new ATOM 0 HD13 LEU B 527 0.991 13.273 -6.482 1.00 25.00 H new ATOM 0 HD21 LEU B 527 4.052 13.481 -6.551 1.00 25.00 H new ATOM 0 HD22 LEU B 527 2.942 14.771 -7.070 1.00 25.00 H new ATOM 0 HD23 LEU B 527 4.183 15.107 -5.839 1.00 25.00 H new ATOM 1587 N LEU B 528 4.264 15.475 -2.287 1.00 25.00 N ATOM 1588 CA LEU B 528 5.704 15.711 -2.166 1.00 25.00 C ATOM 1589 C LEU B 528 6.486 14.426 -2.481 1.00 25.00 C ATOM 1590 O LEU B 528 7.721 14.431 -2.528 1.00 25.00 O ATOM 1591 CB LEU B 528 6.035 16.226 -0.747 1.00 25.00 C ATOM 1592 CG LEU B 528 5.404 17.571 -0.330 1.00 25.00 C ATOM 1593 CD1 LEU B 528 5.749 17.929 1.114 1.00 25.00 C ATOM 1594 CD2 LEU B 528 5.852 18.679 -1.270 1.00 25.00 C ATOM 0 H LEU B 528 3.904 14.760 -1.655 1.00 25.00 H new ATOM 0 HA LEU B 528 6.002 16.471 -2.888 1.00 25.00 H new ATOM 0 HB2 LEU B 528 5.723 15.467 -0.029 1.00 25.00 H new ATOM 0 HB3 LEU B 528 7.118 16.318 -0.663 1.00 25.00 H new ATOM 0 HG LEU B 528 4.321 17.464 -0.396 1.00 25.00 H new ATOM 0 HD11 LEU B 528 5.288 18.882 1.373 1.00 25.00 H new ATOM 0 HD12 LEU B 528 5.375 17.152 1.781 1.00 25.00 H new ATOM 0 HD13 LEU B 528 6.831 18.009 1.221 1.00 25.00 H new ATOM 0 HD21 LEU B 528 5.399 19.622 -0.963 1.00 25.00 H new ATOM 0 HD22 LEU B 528 6.938 18.770 -1.234 1.00 25.00 H new ATOM 0 HD23 LEU B 528 5.541 18.441 -2.287 1.00 25.00 H new ATOM 1606 N SER B 529 5.741 13.334 -2.714 1.00 25.00 N ATOM 1607 CA SER B 529 6.322 12.009 -2.994 1.00 25.00 C ATOM 1608 C SER B 529 5.276 11.068 -3.600 1.00 25.00 C ATOM 1609 O SER B 529 5.570 10.333 -4.546 1.00 25.00 O ATOM 1610 CB SER B 529 6.919 11.373 -1.720 1.00 25.00 C ATOM 1611 OG SER B 529 5.922 11.145 -0.736 1.00 25.00 O ATOM 0 H SER B 529 4.721 13.343 -2.714 1.00 25.00 H new ATOM 0 HA SER B 529 7.126 12.157 -3.715 1.00 25.00 H new ATOM 0 HB2 SER B 529 7.402 10.430 -1.975 1.00 25.00 H new ATOM 0 HB3 SER B 529 7.691 12.027 -1.313 1.00 25.00 H new ATOM 0 HG SER B 529 6.332 10.740 0.057 1.00 25.00 H new ATOM 1617 N GLY B 530 4.057 11.105 -3.042 1.00 25.00 N ATOM 1618 CA GLY B 530 2.972 10.264 -3.524 1.00 25.00 C ATOM 1619 C GLY B 530 2.047 9.811 -2.410 1.00 25.00 C ATOM 1620 O GLY B 530 2.037 8.631 -2.047 1.00 25.00 O ATOM 0 H GLY B 530 3.807 11.709 -2.259 1.00 25.00 H new ATOM 0 HA2 GLY B 530 2.396 10.812 -4.270 1.00 25.00 H new ATOM 0 HA3 GLY B 530 3.389 9.389 -4.023 1.00 25.00 H new ATOM 1624 N ASP B 531 1.269 10.757 -1.871 1.00 25.00 N ATOM 1625 CA ASP B 531 0.323 10.472 -0.784 1.00 25.00 C ATOM 1626 C ASP B 531 -1.097 10.905 -1.163 1.00 25.00 C ATOM 1627 O ASP B 531 -2.049 10.691 -0.405 1.00 25.00 O ATOM 1628 CB ASP B 531 0.760 11.175 0.512 1.00 25.00 C ATOM 1629 CG ASP B 531 2.172 10.809 0.936 1.00 25.00 C ATOM 1630 OD1 ASP B 531 2.454 9.601 1.076 1.00 25.00 O ATOM 1631 OD2 ASP B 531 2.992 11.730 1.129 1.00 25.00 O ATOM 0 H ASP B 531 1.276 11.732 -2.171 1.00 25.00 H new ATOM 0 HA ASP B 531 0.321 9.395 -0.617 1.00 25.00 H new ATOM 0 HB2 ASP B 531 0.696 12.254 0.373 1.00 25.00 H new ATOM 0 HB3 ASP B 531 0.067 10.915 1.312 1.00 25.00 H new ATOM 1636 N GLU B 532 -1.219 11.500 -2.353 1.00 25.00 N ATOM 1637 CA GLU B 532 -2.488 11.999 -2.867 1.00 25.00 C ATOM 1638 C GLU B 532 -3.134 11.037 -3.863 1.00 25.00 C ATOM 1639 O GLU B 532 -4.253 11.264 -4.337 1.00 25.00 O ATOM 1640 CB GLU B 532 -2.269 13.360 -3.506 1.00 25.00 C ATOM 1641 CG GLU B 532 -2.054 14.480 -2.497 1.00 25.00 C ATOM 1642 CD GLU B 532 -2.500 15.846 -3.001 1.00 25.00 C ATOM 1643 OE1 GLU B 532 -2.704 15.988 -4.226 1.00 25.00 O ATOM 1644 OE2 GLU B 532 -2.648 16.765 -2.170 1.00 25.00 O ATOM 0 H GLU B 532 -0.433 11.648 -2.987 1.00 25.00 H new ATOM 0 HA GLU B 532 -3.178 12.088 -2.028 1.00 25.00 H new ATOM 0 HB2 GLU B 532 -1.404 13.307 -4.167 1.00 25.00 H new ATOM 0 HB3 GLU B 532 -3.131 13.603 -4.128 1.00 25.00 H new ATOM 0 HG2 GLU B 532 -2.598 14.244 -1.582 1.00 25.00 H new ATOM 0 HG3 GLU B 532 -0.997 14.525 -2.236 1.00 25.00 H new ATOM 1651 N ASP B 533 -2.413 9.963 -4.161 1.00 25.00 N ATOM 1652 CA ASP B 533 -2.839 8.966 -5.150 1.00 25.00 C ATOM 1653 C ASP B 533 -3.670 7.844 -4.496 1.00 25.00 C ATOM 1654 O ASP B 533 -4.426 7.151 -5.183 1.00 25.00 O ATOM 1655 CB ASP B 533 -1.607 8.383 -5.861 1.00 25.00 C ATOM 1656 CG ASP B 533 -0.968 9.354 -6.842 1.00 25.00 C ATOM 1657 OD1 ASP B 533 -1.674 10.271 -7.312 1.00 25.00 O ATOM 1658 OD2 ASP B 533 0.236 9.197 -7.138 1.00 25.00 O ATOM 0 H ASP B 533 -1.514 9.754 -3.726 1.00 25.00 H new ATOM 0 HA ASP B 533 -3.477 9.459 -5.883 1.00 25.00 H new ATOM 0 HB2 ASP B 533 -0.868 8.092 -5.114 1.00 25.00 H new ATOM 0 HB3 ASP B 533 -1.897 7.477 -6.393 1.00 25.00 H new ATOM 1663 N PHE B 534 -3.524 7.679 -3.170 1.00 25.00 N ATOM 1664 CA PHE B 534 -4.283 6.665 -2.418 1.00 25.00 C ATOM 1665 C PHE B 534 -5.649 7.197 -1.974 1.00 25.00 C ATOM 1666 O PHE B 534 -6.530 6.423 -1.589 1.00 25.00 O ATOM 1667 CB PHE B 534 -3.501 6.198 -1.176 1.00 25.00 C ATOM 1668 CG PHE B 534 -2.245 5.411 -1.460 1.00 25.00 C ATOM 1669 CD1 PHE B 534 -1.005 6.033 -1.454 1.00 25.00 C ATOM 1670 CD2 PHE B 534 -2.304 4.045 -1.712 1.00 25.00 C ATOM 1671 CE1 PHE B 534 0.150 5.313 -1.695 1.00 25.00 C ATOM 1672 CE2 PHE B 534 -1.150 3.323 -1.957 1.00 25.00 C ATOM 1673 CZ PHE B 534 0.076 3.958 -1.947 1.00 25.00 C ATOM 0 H PHE B 534 -2.888 8.234 -2.597 1.00 25.00 H new ATOM 0 HA PHE B 534 -4.434 5.822 -3.092 1.00 25.00 H new ATOM 0 HB2 PHE B 534 -3.235 7.074 -0.585 1.00 25.00 H new ATOM 0 HB3 PHE B 534 -4.161 5.587 -0.561 1.00 25.00 H new ATOM 0 HD1 PHE B 534 -0.941 7.093 -1.259 1.00 25.00 H new ATOM 0 HD2 PHE B 534 -3.260 3.543 -1.716 1.00 25.00 H new ATOM 0 HE1 PHE B 534 1.109 5.810 -1.686 1.00 25.00 H new ATOM 0 HE2 PHE B 534 -1.208 2.263 -2.156 1.00 25.00 H new ATOM 0 HZ PHE B 534 0.977 3.394 -2.136 1.00 25.00 H new ATOM 1683 N SER B 535 -5.816 8.519 -2.041 1.00 25.00 N ATOM 1684 CA SER B 535 -7.057 9.180 -1.625 1.00 25.00 C ATOM 1685 C SER B 535 -8.134 9.103 -2.714 1.00 25.00 C ATOM 1686 O SER B 535 -9.331 9.140 -2.416 1.00 25.00 O ATOM 1687 CB SER B 535 -6.779 10.642 -1.257 1.00 25.00 C ATOM 1688 OG SER B 535 -6.263 11.369 -2.360 1.00 25.00 O ATOM 0 H SER B 535 -5.100 9.160 -2.383 1.00 25.00 H new ATOM 0 HA SER B 535 -7.435 8.654 -0.749 1.00 25.00 H new ATOM 0 HB2 SER B 535 -7.699 11.112 -0.909 1.00 25.00 H new ATOM 0 HB3 SER B 535 -6.069 10.681 -0.431 1.00 25.00 H new ATOM 0 HG SER B 535 -5.424 10.960 -2.658 1.00 25.00 H new ATOM 1694 N SER B 536 -7.690 8.993 -3.974 1.00 25.00 N ATOM 1695 CA SER B 536 -8.595 8.911 -5.120 1.00 25.00 C ATOM 1696 C SER B 536 -8.964 7.461 -5.459 1.00 25.00 C ATOM 1697 O SER B 536 -10.141 7.150 -5.642 1.00 25.00 O ATOM 1698 CB SER B 536 -7.969 9.603 -6.341 1.00 25.00 C ATOM 1699 OG SER B 536 -6.707 9.043 -6.666 1.00 25.00 O ATOM 0 H SER B 536 -6.701 8.959 -4.222 1.00 25.00 H new ATOM 0 HA SER B 536 -9.517 9.426 -4.848 1.00 25.00 H new ATOM 0 HB2 SER B 536 -8.640 9.512 -7.196 1.00 25.00 H new ATOM 0 HB3 SER B 536 -7.854 10.668 -6.138 1.00 25.00 H new ATOM 0 HG SER B 536 -6.336 9.504 -7.447 1.00 25.00 H new ATOM 1705 N ILE B 537 -7.953 6.580 -5.517 1.00 25.00 N ATOM 1706 CA ILE B 537 -8.144 5.199 -5.994 1.00 25.00 C ATOM 1707 C ILE B 537 -8.588 4.256 -4.870 1.00 25.00 C ATOM 1708 O ILE B 537 -9.460 3.410 -5.086 1.00 25.00 O ATOM 1709 CB ILE B 537 -6.846 4.633 -6.675 1.00 25.00 C ATOM 1710 CG1 ILE B 537 -6.200 5.662 -7.647 1.00 25.00 C ATOM 1711 CG2 ILE B 537 -7.123 3.308 -7.409 1.00 25.00 C ATOM 1712 CD1 ILE B 537 -4.830 5.281 -8.203 1.00 25.00 C ATOM 0 H ILE B 537 -6.996 6.798 -5.240 1.00 25.00 H new ATOM 0 HA ILE B 537 -8.939 5.245 -6.738 1.00 25.00 H new ATOM 0 HB ILE B 537 -6.135 4.439 -5.872 1.00 25.00 H new ATOM 0 HG12 ILE B 537 -6.880 5.819 -8.484 1.00 25.00 H new ATOM 0 HG13 ILE B 537 -6.108 6.616 -7.128 1.00 25.00 H new ATOM 0 HG21 ILE B 537 -6.203 2.947 -7.868 1.00 25.00 H new ATOM 0 HG22 ILE B 537 -7.489 2.568 -6.698 1.00 25.00 H new ATOM 0 HG23 ILE B 537 -7.874 3.470 -8.182 1.00 25.00 H new ATOM 0 HD11 ILE B 537 -4.475 6.069 -8.868 1.00 25.00 H new ATOM 0 HD12 ILE B 537 -4.126 5.155 -7.381 1.00 25.00 H new ATOM 0 HD13 ILE B 537 -4.910 4.346 -8.758 1.00 25.00 H new ATOM 1724 N ALA B 538 -7.994 4.405 -3.683 1.00 25.00 N ATOM 1725 CA ALA B 538 -8.255 3.484 -2.576 1.00 25.00 C ATOM 1726 C ALA B 538 -9.568 3.785 -1.854 1.00 25.00 C ATOM 1727 O ALA B 538 -10.039 2.991 -1.032 1.00 25.00 O ATOM 1728 CB ALA B 538 -7.085 3.471 -1.606 1.00 25.00 C ATOM 0 H ALA B 538 -7.333 5.151 -3.465 1.00 25.00 H new ATOM 0 HA ALA B 538 -8.363 2.489 -3.007 1.00 25.00 H new ATOM 0 HB1 ALA B 538 -7.297 2.781 -0.790 1.00 25.00 H new ATOM 0 HB2 ALA B 538 -6.183 3.150 -2.128 1.00 25.00 H new ATOM 0 HB3 ALA B 538 -6.934 4.473 -1.204 1.00 25.00 H new ATOM 1734 N ASP B 539 -10.144 4.933 -2.181 1.00 25.00 N ATOM 1735 CA ASP B 539 -11.460 5.326 -1.675 1.00 25.00 C ATOM 1736 C ASP B 539 -12.533 5.056 -2.747 1.00 25.00 C ATOM 1737 O ASP B 539 -13.734 5.088 -2.460 1.00 25.00 O ATOM 1738 CB ASP B 539 -11.439 6.804 -1.242 1.00 25.00 C ATOM 1739 CG ASP B 539 -10.615 7.061 0.010 1.00 25.00 C ATOM 1740 OD1 ASP B 539 -10.174 6.079 0.646 1.00 25.00 O ATOM 1741 OD2 ASP B 539 -10.418 8.245 0.354 1.00 25.00 O ATOM 0 H ASP B 539 -9.717 5.620 -2.803 1.00 25.00 H new ATOM 0 HA ASP B 539 -11.710 4.730 -0.797 1.00 25.00 H new ATOM 0 HB2 ASP B 539 -11.042 7.407 -2.058 1.00 25.00 H new ATOM 0 HB3 ASP B 539 -12.462 7.137 -1.068 1.00 25.00 H new ATOM 1746 N MET B 540 -12.074 4.785 -3.980 1.00 25.00 N ATOM 1747 CA MET B 540 -12.945 4.329 -5.069 1.00 25.00 C ATOM 1748 C MET B 540 -13.026 2.802 -5.109 1.00 25.00 C ATOM 1749 O MET B 540 -14.026 2.237 -5.562 1.00 25.00 O ATOM 1750 CB MET B 540 -12.449 4.841 -6.416 1.00 25.00 C ATOM 1751 CG MET B 540 -12.933 6.252 -6.748 1.00 25.00 C ATOM 1752 SD MET B 540 -12.174 6.938 -8.238 1.00 25.00 S ATOM 1753 CE MET B 540 -12.844 5.864 -9.501 1.00 25.00 C ATOM 0 H MET B 540 -11.094 4.876 -4.246 1.00 25.00 H new ATOM 0 HA MET B 540 -13.939 4.732 -4.876 1.00 25.00 H new ATOM 0 HB2 MET B 540 -11.359 4.829 -6.421 1.00 25.00 H new ATOM 0 HB3 MET B 540 -12.779 4.159 -7.199 1.00 25.00 H new ATOM 0 HG2 MET B 540 -14.016 6.237 -6.875 1.00 25.00 H new ATOM 0 HG3 MET B 540 -12.720 6.909 -5.905 1.00 25.00 H new ATOM 0 HE1 MET B 540 -12.594 6.260 -10.485 1.00 25.00 H new ATOM 0 HE2 MET B 540 -12.419 4.866 -9.393 1.00 25.00 H new ATOM 0 HE3 MET B 540 -13.928 5.810 -9.396 1.00 25.00 H new ATOM 1763 N ASP B 541 -11.961 2.150 -4.625 1.00 25.00 N ATOM 1764 CA ASP B 541 -11.851 0.691 -4.642 1.00 25.00 C ATOM 1765 C ASP B 541 -12.435 0.062 -3.362 1.00 25.00 C ATOM 1766 O ASP B 541 -12.765 -1.128 -3.355 1.00 25.00 O ATOM 1767 CB ASP B 541 -10.381 0.288 -4.819 1.00 25.00 C ATOM 1768 CG ASP B 541 -9.962 0.159 -6.276 1.00 25.00 C ATOM 1769 OD1 ASP B 541 -10.718 -0.451 -7.060 1.00 25.00 O ATOM 1770 OD2 ASP B 541 -8.878 0.669 -6.629 1.00 25.00 O ATOM 0 H ASP B 541 -11.155 2.620 -4.212 1.00 25.00 H new ATOM 0 HA ASP B 541 -12.434 0.314 -5.482 1.00 25.00 H new ATOM 0 HB2 ASP B 541 -9.747 1.028 -4.330 1.00 25.00 H new ATOM 0 HB3 ASP B 541 -10.209 -0.662 -4.313 1.00 25.00 H new ATOM 1775 N PHE B 542 -12.567 0.865 -2.288 1.00 25.00 N ATOM 1776 CA PHE B 542 -13.088 0.376 -1.001 1.00 25.00 C ATOM 1777 C PHE B 542 -14.611 0.145 -1.055 1.00 25.00 C ATOM 1778 O PHE B 542 -15.148 -0.656 -0.285 1.00 25.00 O ATOM 1779 CB PHE B 542 -12.739 1.372 0.119 1.00 25.00 C ATOM 1780 CG PHE B 542 -13.079 0.900 1.514 1.00 25.00 C ATOM 1781 CD1 PHE B 542 -12.269 -0.017 2.171 1.00 25.00 C ATOM 1782 CD2 PHE B 542 -14.212 1.370 2.163 1.00 25.00 C ATOM 1783 CE1 PHE B 542 -12.583 -0.452 3.444 1.00 25.00 C ATOM 1784 CE2 PHE B 542 -14.529 0.939 3.436 1.00 25.00 C ATOM 1785 CZ PHE B 542 -13.713 0.026 4.079 1.00 25.00 C ATOM 0 H PHE B 542 -12.319 1.855 -2.289 1.00 25.00 H new ATOM 0 HA PHE B 542 -12.617 -0.584 -0.791 1.00 25.00 H new ATOM 0 HB2 PHE B 542 -11.672 1.589 0.074 1.00 25.00 H new ATOM 0 HB3 PHE B 542 -13.263 2.309 -0.070 1.00 25.00 H new ATOM 0 HD1 PHE B 542 -11.384 -0.394 1.681 1.00 25.00 H new ATOM 0 HD2 PHE B 542 -14.854 2.082 1.666 1.00 25.00 H new ATOM 0 HE1 PHE B 542 -11.945 -1.166 3.943 1.00 25.00 H new ATOM 0 HE2 PHE B 542 -15.413 1.315 3.929 1.00 25.00 H new ATOM 0 HZ PHE B 542 -13.959 -0.312 5.075 1.00 25.00 H new ATOM 1795 N SER B 543 -15.290 0.850 -1.974 1.00 25.00 N ATOM 1796 CA SER B 543 -16.745 0.737 -2.140 1.00 25.00 C ATOM 1797 C SER B 543 -17.130 -0.489 -2.984 1.00 25.00 C ATOM 1798 O SER B 543 -18.253 -0.993 -2.876 1.00 25.00 O ATOM 1799 CB SER B 543 -17.299 2.016 -2.776 1.00 25.00 C ATOM 1800 OG SER B 543 -16.766 2.225 -4.075 1.00 25.00 O ATOM 0 H SER B 543 -14.849 1.508 -2.617 1.00 25.00 H new ATOM 0 HA SER B 543 -17.185 0.604 -1.152 1.00 25.00 H new ATOM 0 HB2 SER B 543 -18.386 1.954 -2.833 1.00 25.00 H new ATOM 0 HB3 SER B 543 -17.062 2.871 -2.143 1.00 25.00 H new ATOM 0 HG SER B 543 -17.140 3.048 -4.454 1.00 25.00 H new ATOM 1806 N ALA B 544 -16.190 -0.958 -3.818 1.00 25.00 N ATOM 1807 CA ALA B 544 -16.413 -2.125 -4.681 1.00 25.00 C ATOM 1808 C ALA B 544 -16.153 -3.447 -3.945 1.00 25.00 C ATOM 1809 O ALA B 544 -16.677 -4.491 -4.339 1.00 25.00 O ATOM 1810 CB ALA B 544 -15.540 -2.031 -5.925 1.00 25.00 C ATOM 0 H ALA B 544 -15.263 -0.543 -3.912 1.00 25.00 H new ATOM 0 HA ALA B 544 -17.463 -2.120 -4.974 1.00 25.00 H new ATOM 0 HB1 ALA B 544 -15.713 -2.901 -6.558 1.00 25.00 H new ATOM 0 HB2 ALA B 544 -15.790 -1.125 -6.477 1.00 25.00 H new ATOM 0 HB3 ALA B 544 -14.491 -1.999 -5.632 1.00 25.00 H new ATOM 1816 N LEU B 545 -15.346 -3.387 -2.874 1.00 25.00 N ATOM 1817 CA LEU B 545 -14.996 -4.565 -2.074 1.00 25.00 C ATOM 1818 C LEU B 545 -16.077 -4.912 -1.038 1.00 25.00 C ATOM 1819 O LEU B 545 -16.073 -6.015 -0.482 1.00 25.00 O ATOM 1820 CB LEU B 545 -13.652 -4.327 -1.379 1.00 25.00 C ATOM 1821 CG LEU B 545 -12.445 -4.161 -2.319 1.00 25.00 C ATOM 1822 CD1 LEU B 545 -11.260 -3.542 -1.594 1.00 25.00 C ATOM 1823 CD2 LEU B 545 -12.034 -5.504 -2.918 1.00 25.00 C ATOM 0 H LEU B 545 -14.920 -2.522 -2.541 1.00 25.00 H new ATOM 0 HA LEU B 545 -14.921 -5.416 -2.750 1.00 25.00 H new ATOM 0 HB2 LEU B 545 -13.735 -3.434 -0.760 1.00 25.00 H new ATOM 0 HB3 LEU B 545 -13.456 -5.163 -0.707 1.00 25.00 H new ATOM 0 HG LEU B 545 -12.750 -3.490 -3.122 1.00 25.00 H new ATOM 0 HD11 LEU B 545 -10.424 -3.438 -2.286 1.00 25.00 H new ATOM 0 HD12 LEU B 545 -11.539 -2.560 -1.213 1.00 25.00 H new ATOM 0 HD13 LEU B 545 -10.966 -4.184 -0.763 1.00 25.00 H new ATOM 0 HD21 LEU B 545 -11.179 -5.361 -3.579 1.00 25.00 H new ATOM 0 HD22 LEU B 545 -11.763 -6.192 -2.117 1.00 25.00 H new ATOM 0 HD23 LEU B 545 -12.866 -5.919 -3.486 1.00 25.00 H new ATOM 1835 N LEU B 546 -17.000 -3.969 -0.788 1.00 25.00 N ATOM 1836 CA LEU B 546 -18.130 -4.198 0.130 1.00 25.00 C ATOM 1837 C LEU B 546 -19.250 -4.968 -0.572 1.00 25.00 C ATOM 1838 O LEU B 546 -19.962 -5.760 0.049 1.00 25.00 O ATOM 1839 CB LEU B 546 -18.684 -2.860 0.661 1.00 25.00 C ATOM 1840 CG LEU B 546 -17.822 -2.125 1.696 1.00 25.00 C ATOM 1841 CD1 LEU B 546 -18.420 -0.762 2.007 1.00 25.00 C ATOM 1842 CD2 LEU B 546 -17.691 -2.939 2.974 1.00 25.00 C ATOM 0 H LEU B 546 -16.987 -3.040 -1.209 1.00 25.00 H new ATOM 0 HA LEU B 546 -17.761 -4.789 0.969 1.00 25.00 H new ATOM 0 HB2 LEU B 546 -18.840 -2.194 -0.188 1.00 25.00 H new ATOM 0 HB3 LEU B 546 -19.663 -3.047 1.103 1.00 25.00 H new ATOM 0 HG LEU B 546 -16.827 -1.990 1.272 1.00 25.00 H new ATOM 0 HD11 LEU B 546 -17.799 -0.251 2.743 1.00 25.00 H new ATOM 0 HD12 LEU B 546 -18.465 -0.168 1.094 1.00 25.00 H new ATOM 0 HD13 LEU B 546 -19.426 -0.889 2.407 1.00 25.00 H new ATOM 0 HD21 LEU B 546 -17.075 -2.395 3.690 1.00 25.00 H new ATOM 0 HD22 LEU B 546 -18.680 -3.108 3.400 1.00 25.00 H new ATOM 0 HD23 LEU B 546 -17.224 -3.898 2.748 1.00 25.00 H new ATOM 1854 N SER B 547 -19.388 -4.710 -1.876 1.00 25.00 N ATOM 1855 CA SER B 547 -20.373 -5.391 -2.730 1.00 25.00 C ATOM 1856 C SER B 547 -19.934 -6.821 -3.100 1.00 25.00 C ATOM 1857 O SER B 547 -20.756 -7.628 -3.546 1.00 25.00 O ATOM 1858 CB SER B 547 -20.627 -4.568 -4.000 1.00 25.00 C ATOM 1859 OG SER B 547 -19.488 -4.553 -4.847 1.00 25.00 O ATOM 0 H SER B 547 -18.821 -4.023 -2.372 1.00 25.00 H new ATOM 0 HA SER B 547 -21.298 -5.475 -2.159 1.00 25.00 H new ATOM 0 HB2 SER B 547 -21.478 -4.984 -4.540 1.00 25.00 H new ATOM 0 HB3 SER B 547 -20.891 -3.547 -3.726 1.00 25.00 H new ATOM 0 HG SER B 547 -18.675 -4.514 -4.301 1.00 25.00 H new ATOM 1865 N GLN B 548 -18.638 -7.124 -2.902 1.00 25.00 N ATOM 1866 CA GLN B 548 -18.059 -8.427 -3.282 1.00 25.00 C ATOM 1867 C GLN B 548 -18.483 -9.569 -2.348 1.00 25.00 C ATOM 1868 O GLN B 548 -18.283 -10.746 -2.668 1.00 25.00 O ATOM 1869 CB GLN B 548 -16.525 -8.347 -3.327 1.00 25.00 C ATOM 1870 CG GLN B 548 -15.959 -7.601 -4.540 1.00 25.00 C ATOM 1871 CD GLN B 548 -16.286 -8.234 -5.898 1.00 25.00 C ATOM 1872 OE1 GLN B 548 -16.675 -7.535 -6.833 1.00 25.00 O ATOM 1873 NE2 GLN B 548 -16.112 -9.551 -6.023 1.00 25.00 N ATOM 0 H GLN B 548 -17.969 -6.481 -2.479 1.00 25.00 H new ATOM 0 HA GLN B 548 -18.450 -8.654 -4.274 1.00 25.00 H new ATOM 0 HB2 GLN B 548 -16.173 -7.857 -2.419 1.00 25.00 H new ATOM 0 HB3 GLN B 548 -16.121 -9.359 -3.319 1.00 25.00 H new ATOM 0 HG2 GLN B 548 -16.340 -6.580 -4.530 1.00 25.00 H new ATOM 0 HG3 GLN B 548 -14.876 -7.538 -4.436 1.00 25.00 H new ATOM 0 HE21 GLN B 548 -15.788 -10.100 -5.227 1.00 25.00 H new ATOM 0 HE22 GLN B 548 -16.303 -10.008 -6.915 1.00 25.00 H new ATOM 1882 N ILE B 549 -19.076 -9.212 -1.209 1.00 25.00 N ATOM 1883 CA ILE B 549 -19.519 -10.200 -0.210 1.00 25.00 C ATOM 1884 C ILE B 549 -21.044 -10.398 -0.221 1.00 25.00 C ATOM 1885 O ILE B 549 -21.562 -11.306 0.438 1.00 25.00 O ATOM 1886 CB ILE B 549 -19.024 -9.852 1.236 1.00 25.00 C ATOM 1887 CG1 ILE B 549 -19.479 -8.453 1.717 1.00 25.00 C ATOM 1888 CG2 ILE B 549 -17.506 -9.959 1.315 1.00 25.00 C ATOM 1889 CD1 ILE B 549 -19.249 -8.188 3.195 1.00 25.00 C ATOM 0 H ILE B 549 -19.264 -8.244 -0.949 1.00 25.00 H new ATOM 0 HA ILE B 549 -19.056 -11.142 -0.503 1.00 25.00 H new ATOM 0 HB ILE B 549 -19.484 -10.581 1.903 1.00 25.00 H new ATOM 0 HG12 ILE B 549 -18.951 -7.695 1.139 1.00 25.00 H new ATOM 0 HG13 ILE B 549 -20.541 -8.336 1.501 1.00 25.00 H new ATOM 0 HG21 ILE B 549 -17.176 -9.715 2.325 1.00 25.00 H new ATOM 0 HG22 ILE B 549 -17.200 -10.976 1.069 1.00 25.00 H new ATOM 0 HG23 ILE B 549 -17.055 -9.263 0.608 1.00 25.00 H new ATOM 0 HD11 ILE B 549 -19.597 -7.185 3.443 1.00 25.00 H new ATOM 0 HD12 ILE B 549 -19.800 -8.920 3.786 1.00 25.00 H new ATOM 0 HD13 ILE B 549 -18.185 -8.268 3.418 1.00 25.00 H new ATOM 1901 N SER B 550 -21.750 -9.547 -0.980 1.00 25.00 N ATOM 1902 CA SER B 550 -23.211 -9.617 -1.089 1.00 25.00 C ATOM 1903 C SER B 550 -23.638 -10.339 -2.374 1.00 25.00 C ATOM 1904 O SER B 550 -24.635 -11.068 -2.376 1.00 25.00 O ATOM 1905 CB SER B 550 -23.812 -8.204 -1.046 1.00 25.00 C ATOM 1906 OG SER B 550 -23.279 -7.383 -2.073 1.00 25.00 O ATOM 0 H SER B 550 -21.328 -8.799 -1.530 1.00 25.00 H new ATOM 0 HA SER B 550 -23.587 -10.190 -0.242 1.00 25.00 H new ATOM 0 HB2 SER B 550 -24.895 -8.264 -1.152 1.00 25.00 H new ATOM 0 HB3 SER B 550 -23.611 -7.751 -0.075 1.00 25.00 H new ATOM 0 HG SER B 550 -23.682 -6.491 -2.021 1.00 25.00 H new ATOM 1912 N SER B 551 -22.878 -10.129 -3.458 1.00 25.00 N ATOM 1913 CA SER B 551 -23.167 -10.755 -4.751 1.00 25.00 C ATOM 1914 C SER B 551 -22.047 -11.721 -5.156 1.00 25.00 C ATOM 1915 O SER B 551 -20.971 -11.248 -5.590 1.00 25.00 O ATOM 1916 CB SER B 551 -23.385 -9.683 -5.831 1.00 25.00 C ATOM 1917 OG SER B 551 -23.592 -10.266 -7.109 1.00 25.00 O ATOM 1918 OXT SER B 551 -22.257 -12.946 -5.035 1.00 25.00 O ATOM 0 H SER B 551 -22.055 -9.527 -3.462 1.00 25.00 H new ATOM 0 HA SER B 551 -24.086 -11.333 -4.652 1.00 25.00 H new ATOM 0 HB2 SER B 551 -24.246 -9.069 -5.567 1.00 25.00 H new ATOM 0 HB3 SER B 551 -22.520 -9.021 -5.868 1.00 25.00 H new ATOM 0 HG SER B 551 -23.729 -9.558 -7.773 1.00 25.00 H new TER 1924 SER B 551