USER MOD reduce.3.24.130724 H: found=0, std=0, add=950, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 956 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 592 HIS : no HD1:sc= -4.02! K(o=-4!,f=-1.5) USER MOD Set 1.2: A 640 TYR OH : rot 150:sc=-0.00302 USER MOD Set 2.1: A 601 SER OG : rot -32:sc= 0.728 USER MOD Set 2.2: A 602 HIS : no HD1:sc= 0 X(o=0.73,f=0.73) USER MOD Single : A 589 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 594 HIS : no HD1:sc= -0.416 X(o=-0.42,f=-0.92) USER MOD Single : A 596 THR OG1 : rot -170:sc= 0.214 USER MOD Single : A 597 GLN : amide:sc= -0.755 K(o=-0.75,f=0) USER MOD Single : A 605 HIS : no HD1:sc=-0.00756 X(o=-0.0076,f=-0.0076) USER MOD Single : A 606 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 609 GLN : amide:sc= -0.138 K(o=-0.14,f=-4.1!) USER MOD Single : A 614 THR OG1 : rot -130:sc= -0.0534 USER MOD Single : A 621 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 625 MET CE :methyl -164:sc= 0 (180deg=-0.392) USER MOD Single : A 627 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 631 TYR OH : rot 180:sc= 0 USER MOD Single : A 633 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 634 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.037) USER MOD Single : A 639 MET CE :methyl -163:sc= -0.412 (180deg=-1.33) USER MOD Single : A 642 SER OG : rot 91:sc= 0.779 USER MOD Single : A 644 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 645 SER OG : rot 180:sc= 0 USER MOD Single : A 649 TYR OH : rot 180:sc= 0 USER MOD Single : A 650 TYR OH : rot 180:sc= -1.37 USER MOD Single : A 651 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 656 LYS NZ :NH3+ 157:sc= 0.121 (180deg=-0.0695) USER MOD Single : A 658 TYR OH : rot 180:sc= 0 USER MOD Single : A 659 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 661 GLN : amide:sc=-0.00111 K(o=-0.0011,f=-0.57) USER MOD Single : A 662 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 667 LYS NZ :NH3+ -117:sc= 0.307 (180deg=-0.106) USER MOD Single : A 670 SER OG : rot -30:sc= 0.445 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 K(o=0,f=-0.65) USER MOD Single : B 529 SER OG : rot 170:sc= 0 USER MOD Single : B 535 SER OG : rot -72:sc= 1.11 USER MOD Single : B 536 SER OG : rot 180:sc= 0 USER MOD Single : B 540 MET CE :methyl 175:sc= 0 (180deg=-0.0344) USER MOD Single : B 543 SER OG : rot -66:sc= 0.226 USER MOD Single : B 547 SER OG : rot -34:sc= 0.395 USER MOD Single : B 548 GLN : amide:sc= -0.123 X(o=-0.12,f=-0.16) USER MOD Single : B 550 SER OG : rot -80:sc= 0.248 USER MOD Single : B 551 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 586 28.039 -2.479 -7.037 1.00 25.00 N ATOM 2 CA GLY A 586 27.200 -3.123 -5.990 1.00 25.00 C ATOM 3 C GLY A 586 27.765 -2.931 -4.596 1.00 25.00 C ATOM 4 O GLY A 586 28.878 -3.378 -4.305 1.00 25.00 O ATOM 0 HA2 GLY A 586 26.192 -2.709 -6.031 1.00 25.00 H new ATOM 0 HA3 GLY A 586 27.116 -4.189 -6.201 1.00 25.00 H new ATOM 10 N VAL A 587 26.990 -2.258 -3.736 1.00 25.00 N ATOM 11 CA VAL A 587 27.399 -1.993 -2.348 1.00 25.00 C ATOM 12 C VAL A 587 26.922 -3.134 -1.433 1.00 25.00 C ATOM 13 O VAL A 587 25.811 -3.648 -1.597 1.00 25.00 O ATOM 14 CB VAL A 587 26.854 -0.624 -1.827 1.00 25.00 C ATOM 15 CG1 VAL A 587 27.324 -0.337 -0.400 1.00 25.00 C ATOM 16 CG2 VAL A 587 27.266 0.528 -2.743 1.00 25.00 C ATOM 0 H VAL A 587 26.072 -1.885 -3.977 1.00 25.00 H new ATOM 0 HA VAL A 587 28.488 -1.940 -2.330 1.00 25.00 H new ATOM 0 HB VAL A 587 25.767 -0.701 -1.827 1.00 25.00 H new ATOM 0 HG11 VAL A 587 26.925 0.623 -0.072 1.00 25.00 H new ATOM 0 HG12 VAL A 587 26.969 -1.124 0.265 1.00 25.00 H new ATOM 0 HG13 VAL A 587 28.413 -0.305 -0.375 1.00 25.00 H new ATOM 0 HG21 VAL A 587 26.870 1.465 -2.350 1.00 25.00 H new ATOM 0 HG22 VAL A 587 28.354 0.585 -2.789 1.00 25.00 H new ATOM 0 HG23 VAL A 587 26.869 0.357 -3.744 1.00 25.00 H new ATOM 26 N ARG A 588 27.774 -3.512 -0.470 1.00 25.00 N ATOM 27 CA ARG A 588 27.493 -4.637 0.431 1.00 25.00 C ATOM 28 C ARG A 588 26.798 -4.159 1.704 1.00 25.00 C ATOM 29 O ARG A 588 27.325 -3.311 2.431 1.00 25.00 O ATOM 30 CB ARG A 588 28.783 -5.389 0.787 1.00 25.00 C ATOM 31 CG ARG A 588 28.565 -6.619 1.665 1.00 25.00 C ATOM 32 CD ARG A 588 29.877 -7.316 2.010 1.00 25.00 C ATOM 33 NE ARG A 588 29.672 -8.579 2.736 1.00 25.00 N ATOM 34 CZ ARG A 588 29.448 -9.768 2.154 1.00 25.00 C ATOM 35 NH1 ARG A 588 29.390 -9.889 0.829 1.00 25.00 N ATOM 36 NH2 ARG A 588 29.280 -10.845 2.910 1.00 25.00 N ATOM 0 H ARG A 588 28.668 -3.052 -0.295 1.00 25.00 H new ATOM 0 HA ARG A 588 26.824 -5.320 -0.093 1.00 25.00 H new ATOM 0 HB2 ARG A 588 29.278 -5.696 -0.134 1.00 25.00 H new ATOM 0 HB3 ARG A 588 29.460 -4.705 1.299 1.00 25.00 H new ATOM 0 HG2 ARG A 588 28.059 -6.323 2.584 1.00 25.00 H new ATOM 0 HG3 ARG A 588 27.907 -7.319 1.151 1.00 25.00 H new ATOM 0 HD2 ARG A 588 30.431 -7.514 1.093 1.00 25.00 H new ATOM 0 HD3 ARG A 588 30.491 -6.649 2.615 1.00 25.00 H new ATOM 0 HE ARG A 588 29.702 -8.549 3.755 1.00 25.00 H new ATOM 0 HH11 ARG A 588 29.517 -9.069 0.236 1.00 25.00 H new ATOM 0 HH12 ARG A 588 29.219 -10.802 0.407 1.00 25.00 H new ATOM 0 HH21 ARG A 588 29.321 -10.766 3.926 1.00 25.00 H new ATOM 0 HH22 ARG A 588 29.109 -11.752 2.475 1.00 25.00 H new ATOM 50 N LYS A 589 25.614 -4.723 1.961 1.00 25.00 N ATOM 51 CA LYS A 589 24.787 -4.347 3.110 1.00 25.00 C ATOM 52 C LYS A 589 24.156 -5.578 3.761 1.00 25.00 C ATOM 53 O LYS A 589 23.974 -6.614 3.113 1.00 25.00 O ATOM 54 CB LYS A 589 23.688 -3.362 2.674 1.00 25.00 C ATOM 55 CG LYS A 589 24.196 -2.079 2.007 1.00 25.00 C ATOM 56 CD LYS A 589 24.730 -1.056 3.006 1.00 25.00 C ATOM 57 CE LYS A 589 24.921 0.315 2.365 1.00 25.00 C ATOM 58 NZ LYS A 589 25.515 1.306 3.311 1.00 25.00 N ATOM 0 H LYS A 589 25.203 -5.452 1.379 1.00 25.00 H new ATOM 0 HA LYS A 589 25.431 -3.864 3.845 1.00 25.00 H new ATOM 0 HB2 LYS A 589 23.017 -3.872 1.983 1.00 25.00 H new ATOM 0 HB3 LYS A 589 23.097 -3.090 3.549 1.00 25.00 H new ATOM 0 HG2 LYS A 589 24.985 -2.333 1.299 1.00 25.00 H new ATOM 0 HG3 LYS A 589 23.385 -1.629 1.434 1.00 25.00 H new ATOM 0 HD2 LYS A 589 24.039 -0.972 3.845 1.00 25.00 H new ATOM 0 HD3 LYS A 589 25.681 -1.404 3.410 1.00 25.00 H new ATOM 0 HE2 LYS A 589 25.566 0.218 1.492 1.00 25.00 H new ATOM 0 HE3 LYS A 589 23.959 0.685 2.011 1.00 25.00 H new ATOM 0 HZ1 LYS A 589 25.626 2.222 2.830 1.00 25.00 H new ATOM 0 HZ2 LYS A 589 24.888 1.420 4.133 1.00 25.00 H new ATOM 0 HZ3 LYS A 589 26.445 0.968 3.629 1.00 25.00 H new ATOM 72 N GLY A 590 23.823 -5.440 5.054 1.00 25.00 N ATOM 73 CA GLY A 590 23.266 -6.541 5.836 1.00 25.00 C ATOM 74 C GLY A 590 21.778 -6.776 5.609 1.00 25.00 C ATOM 75 O GLY A 590 21.270 -7.851 5.933 1.00 25.00 O ATOM 0 H GLY A 590 23.933 -4.571 5.576 1.00 25.00 H new ATOM 0 HA2 GLY A 590 23.808 -7.455 5.594 1.00 25.00 H new ATOM 0 HA3 GLY A 590 23.434 -6.342 6.894 1.00 25.00 H new ATOM 79 N TRP A 591 21.078 -5.766 5.067 1.00 25.00 N ATOM 80 CA TRP A 591 19.640 -5.869 4.770 1.00 25.00 C ATOM 81 C TRP A 591 19.398 -6.527 3.401 1.00 25.00 C ATOM 82 O TRP A 591 18.440 -7.281 3.226 1.00 25.00 O ATOM 83 CB TRP A 591 18.977 -4.473 4.835 1.00 25.00 C ATOM 84 CG TRP A 591 19.352 -3.521 3.720 1.00 25.00 C ATOM 85 CD1 TRP A 591 20.565 -2.924 3.518 1.00 25.00 C ATOM 86 CD2 TRP A 591 18.492 -3.045 2.669 1.00 25.00 C ATOM 87 NE1 TRP A 591 20.518 -2.125 2.398 1.00 25.00 N ATOM 88 CE2 TRP A 591 19.257 -2.180 1.863 1.00 25.00 C ATOM 89 CE3 TRP A 591 17.154 -3.274 2.327 1.00 25.00 C ATOM 90 CZ2 TRP A 591 18.727 -1.543 0.742 1.00 25.00 C ATOM 91 CZ3 TRP A 591 16.631 -2.640 1.216 1.00 25.00 C ATOM 92 CH2 TRP A 591 17.416 -1.784 0.435 1.00 25.00 C ATOM 0 H TRP A 591 21.488 -4.864 4.824 1.00 25.00 H new ATOM 0 HA TRP A 591 19.182 -6.507 5.526 1.00 25.00 H new ATOM 0 HB2 TRP A 591 17.895 -4.603 4.829 1.00 25.00 H new ATOM 0 HB3 TRP A 591 19.237 -4.010 5.787 1.00 25.00 H new ATOM 0 HD1 TRP A 591 21.433 -3.059 4.146 1.00 25.00 H new ATOM 0 HE1 TRP A 591 21.296 -1.580 2.026 1.00 25.00 H new ATOM 0 HE3 TRP A 591 16.541 -3.935 2.921 1.00 25.00 H new ATOM 0 HZ2 TRP A 591 19.330 -0.882 0.137 1.00 25.00 H new ATOM 0 HZ3 TRP A 591 15.599 -2.808 0.946 1.00 25.00 H new ATOM 0 HH2 TRP A 591 16.978 -1.304 -0.428 1.00 25.00 H new ATOM 103 N HIS A 592 20.295 -6.233 2.450 1.00 25.00 N ATOM 104 CA HIS A 592 20.202 -6.720 1.063 1.00 25.00 C ATOM 105 C HIS A 592 20.312 -8.258 0.977 1.00 25.00 C ATOM 106 O HIS A 592 19.619 -8.885 0.171 1.00 25.00 O ATOM 107 CB HIS A 592 21.309 -6.056 0.223 1.00 25.00 C ATOM 108 CG HIS A 592 21.444 -6.578 -1.180 1.00 25.00 C ATOM 109 ND1 HIS A 592 21.685 -5.765 -2.269 1.00 25.00 N ATOM 110 CD2 HIS A 592 21.361 -7.839 -1.669 1.00 25.00 C ATOM 111 CE1 HIS A 592 21.744 -6.503 -3.364 1.00 25.00 C ATOM 112 NE2 HIS A 592 21.551 -7.764 -3.026 1.00 25.00 N ATOM 0 H HIS A 592 21.112 -5.647 2.621 1.00 25.00 H new ATOM 0 HA HIS A 592 19.221 -6.451 0.671 1.00 25.00 H new ATOM 0 HB2 HIS A 592 21.116 -4.984 0.178 1.00 25.00 H new ATOM 0 HB3 HIS A 592 22.262 -6.188 0.736 1.00 25.00 H new ATOM 0 HD2 HIS A 592 21.179 -8.737 -1.097 1.00 25.00 H new ATOM 0 HE1 HIS A 592 21.920 -6.137 -4.365 1.00 25.00 H new ATOM 0 HE2 HIS A 592 21.544 -8.555 -3.670 1.00 25.00 H new ATOM 121 N GLU A 593 21.186 -8.846 1.808 1.00 25.00 N ATOM 122 CA GLU A 593 21.371 -10.306 1.851 1.00 25.00 C ATOM 123 C GLU A 593 20.398 -10.970 2.836 1.00 25.00 C ATOM 124 O GLU A 593 20.287 -12.199 2.883 1.00 25.00 O ATOM 125 CB GLU A 593 22.815 -10.650 2.227 1.00 25.00 C ATOM 126 CG GLU A 593 23.834 -10.224 1.183 1.00 25.00 C ATOM 127 CD GLU A 593 25.260 -10.554 1.584 1.00 25.00 C ATOM 128 OE1 GLU A 593 25.464 -11.002 2.732 1.00 25.00 O ATOM 129 OE2 GLU A 593 26.171 -10.362 0.751 1.00 25.00 O ATOM 0 H GLU A 593 21.777 -8.332 2.461 1.00 25.00 H new ATOM 0 HA GLU A 593 21.158 -10.694 0.855 1.00 25.00 H new ATOM 0 HB2 GLU A 593 23.058 -10.172 3.176 1.00 25.00 H new ATOM 0 HB3 GLU A 593 22.895 -11.726 2.382 1.00 25.00 H new ATOM 0 HG2 GLU A 593 23.605 -10.714 0.237 1.00 25.00 H new ATOM 0 HG3 GLU A 593 23.748 -9.151 1.015 1.00 25.00 H new ATOM 136 N HIS A 594 19.692 -10.136 3.608 1.00 25.00 N ATOM 137 CA HIS A 594 18.724 -10.596 4.604 1.00 25.00 C ATOM 138 C HIS A 594 17.287 -10.571 4.046 1.00 25.00 C ATOM 139 O HIS A 594 16.433 -11.338 4.504 1.00 25.00 O ATOM 140 CB HIS A 594 18.865 -9.716 5.871 1.00 25.00 C ATOM 141 CG HIS A 594 19.831 -10.207 6.915 1.00 25.00 C ATOM 142 ND1 HIS A 594 21.120 -10.610 6.637 1.00 25.00 N ATOM 143 CD2 HIS A 594 19.673 -10.343 8.252 1.00 25.00 C ATOM 144 CE1 HIS A 594 21.715 -10.974 7.762 1.00 25.00 C ATOM 145 NE2 HIS A 594 20.857 -10.820 8.756 1.00 25.00 N ATOM 0 H HIS A 594 19.778 -9.121 3.558 1.00 25.00 H new ATOM 0 HA HIS A 594 18.931 -11.634 4.864 1.00 25.00 H new ATOM 0 HB2 HIS A 594 19.173 -8.717 5.562 1.00 25.00 H new ATOM 0 HB3 HIS A 594 17.882 -9.619 6.332 1.00 25.00 H new ATOM 0 HD2 HIS A 594 18.781 -10.118 8.817 1.00 25.00 H new ATOM 0 HE1 HIS A 594 22.729 -11.335 7.852 1.00 25.00 H new ATOM 0 HE2 HIS A 594 21.045 -11.023 9.738 1.00 25.00 H new ATOM 154 N VAL A 595 17.031 -9.700 3.058 1.00 25.00 N ATOM 155 CA VAL A 595 15.691 -9.560 2.474 1.00 25.00 C ATOM 156 C VAL A 595 15.450 -10.648 1.412 1.00 25.00 C ATOM 157 O VAL A 595 16.323 -10.932 0.586 1.00 25.00 O ATOM 158 CB VAL A 595 15.464 -8.123 1.880 1.00 25.00 C ATOM 159 CG1 VAL A 595 14.245 -8.039 0.953 1.00 25.00 C ATOM 160 CG2 VAL A 595 15.293 -7.111 3.004 1.00 25.00 C ATOM 0 H VAL A 595 17.733 -9.084 2.648 1.00 25.00 H new ATOM 0 HA VAL A 595 14.962 -9.694 3.273 1.00 25.00 H new ATOM 0 HB VAL A 595 16.349 -7.897 1.286 1.00 25.00 H new ATOM 0 HG11 VAL A 595 14.144 -7.021 0.576 1.00 25.00 H new ATOM 0 HG12 VAL A 595 14.377 -8.724 0.116 1.00 25.00 H new ATOM 0 HG13 VAL A 595 13.347 -8.312 1.507 1.00 25.00 H new ATOM 0 HG21 VAL A 595 15.136 -6.119 2.580 1.00 25.00 H new ATOM 0 HG22 VAL A 595 14.432 -7.385 3.613 1.00 25.00 H new ATOM 0 HG23 VAL A 595 16.188 -7.103 3.625 1.00 25.00 H new ATOM 170 N THR A 596 14.252 -11.240 1.458 1.00 25.00 N ATOM 171 CA THR A 596 13.864 -12.313 0.539 1.00 25.00 C ATOM 172 C THR A 596 12.839 -11.830 -0.489 1.00 25.00 C ATOM 173 O THR A 596 12.441 -10.661 -0.482 1.00 25.00 O ATOM 174 CB THR A 596 13.258 -13.521 1.301 1.00 25.00 C ATOM 175 OG1 THR A 596 12.125 -13.104 2.074 1.00 25.00 O ATOM 176 CG2 THR A 596 14.278 -14.179 2.211 1.00 25.00 C ATOM 0 H THR A 596 13.527 -10.990 2.131 1.00 25.00 H new ATOM 0 HA THR A 596 14.776 -12.622 0.027 1.00 25.00 H new ATOM 0 HB THR A 596 12.944 -14.252 0.556 1.00 25.00 H new ATOM 0 HG1 THR A 596 11.849 -13.832 2.669 1.00 25.00 H new ATOM 0 HG21 THR A 596 13.816 -15.020 2.727 1.00 25.00 H new ATOM 0 HG22 THR A 596 15.119 -14.536 1.617 1.00 25.00 H new ATOM 0 HG23 THR A 596 14.633 -13.454 2.944 1.00 25.00 H new ATOM 184 N GLN A 597 12.423 -12.746 -1.373 1.00 25.00 N ATOM 185 CA GLN A 597 11.288 -12.516 -2.273 1.00 25.00 C ATOM 186 C GLN A 597 9.967 -12.698 -1.513 1.00 25.00 C ATOM 187 O GLN A 597 8.915 -12.226 -1.955 1.00 25.00 O ATOM 188 CB GLN A 597 11.332 -13.471 -3.482 1.00 25.00 C ATOM 189 CG GLN A 597 12.508 -13.251 -4.440 1.00 25.00 C ATOM 190 CD GLN A 597 12.546 -14.194 -5.646 1.00 25.00 C ATOM 191 OE1 GLN A 597 13.492 -14.162 -6.432 1.00 25.00 O ATOM 192 NE2 GLN A 597 11.507 -15.013 -5.819 1.00 25.00 N ATOM 0 H GLN A 597 12.861 -13.661 -1.483 1.00 25.00 H new ATOM 0 HA GLN A 597 11.355 -11.493 -2.644 1.00 25.00 H new ATOM 0 HB2 GLN A 597 11.370 -14.496 -3.114 1.00 25.00 H new ATOM 0 HB3 GLN A 597 10.403 -13.367 -4.042 1.00 25.00 H new ATOM 0 HG2 GLN A 597 12.475 -12.224 -4.802 1.00 25.00 H new ATOM 0 HG3 GLN A 597 13.438 -13.362 -3.882 1.00 25.00 H new ATOM 0 HE21 GLN A 597 10.740 -15.013 -5.147 1.00 25.00 H new ATOM 0 HE22 GLN A 597 11.480 -15.640 -6.623 1.00 25.00 H new ATOM 201 N ASP A 598 10.047 -13.382 -0.355 1.00 25.00 N ATOM 202 CA ASP A 598 8.879 -13.651 0.489 1.00 25.00 C ATOM 203 C ASP A 598 8.561 -12.452 1.400 1.00 25.00 C ATOM 204 O ASP A 598 7.410 -12.284 1.815 1.00 25.00 O ATOM 205 CB ASP A 598 9.121 -14.921 1.324 1.00 25.00 C ATOM 206 CG ASP A 598 9.124 -16.198 0.495 1.00 25.00 C ATOM 207 OD1 ASP A 598 8.646 -16.158 -0.659 1.00 25.00 O ATOM 208 OD2 ASP A 598 9.604 -17.234 1.001 1.00 25.00 O ATOM 0 H ASP A 598 10.920 -13.759 0.015 1.00 25.00 H new ATOM 0 HA ASP A 598 8.015 -13.810 -0.157 1.00 25.00 H new ATOM 0 HB2 ASP A 598 10.076 -14.830 1.841 1.00 25.00 H new ATOM 0 HB3 ASP A 598 8.349 -14.996 2.090 1.00 25.00 H new ATOM 213 N LEU A 599 9.581 -11.623 1.710 1.00 25.00 N ATOM 214 CA LEU A 599 9.362 -10.379 2.467 1.00 25.00 C ATOM 215 C LEU A 599 8.531 -9.378 1.662 1.00 25.00 C ATOM 216 O LEU A 599 7.514 -8.895 2.146 1.00 25.00 O ATOM 217 CB LEU A 599 10.696 -9.715 2.887 1.00 25.00 C ATOM 218 CG LEU A 599 10.622 -8.367 3.636 1.00 25.00 C ATOM 219 CD1 LEU A 599 10.090 -8.605 5.032 1.00 25.00 C ATOM 220 CD2 LEU A 599 11.979 -7.684 3.759 1.00 25.00 C ATOM 0 H LEU A 599 10.552 -11.793 1.450 1.00 25.00 H new ATOM 0 HA LEU A 599 8.815 -10.658 3.367 1.00 25.00 H new ATOM 0 HB2 LEU A 599 11.237 -10.420 3.518 1.00 25.00 H new ATOM 0 HB3 LEU A 599 11.294 -9.567 1.988 1.00 25.00 H new ATOM 0 HG LEU A 599 9.967 -7.716 3.057 1.00 25.00 H new ATOM 0 HD11 LEU A 599 10.035 -7.657 5.567 1.00 25.00 H new ATOM 0 HD12 LEU A 599 9.095 -9.046 4.972 1.00 25.00 H new ATOM 0 HD13 LEU A 599 10.756 -9.284 5.564 1.00 25.00 H new ATOM 0 HD21 LEU A 599 11.865 -6.741 4.294 1.00 25.00 H new ATOM 0 HD22 LEU A 599 12.664 -8.331 4.307 1.00 25.00 H new ATOM 0 HD23 LEU A 599 12.380 -7.490 2.764 1.00 25.00 H new ATOM 232 N ARG A 600 8.946 -9.119 0.411 1.00 25.00 N ATOM 233 CA ARG A 600 8.310 -8.101 -0.457 1.00 25.00 C ATOM 234 C ARG A 600 6.808 -8.356 -0.635 1.00 25.00 C ATOM 235 O ARG A 600 6.024 -7.417 -0.795 1.00 25.00 O ATOM 236 CB ARG A 600 8.978 -8.080 -1.840 1.00 25.00 C ATOM 237 CG ARG A 600 10.444 -7.667 -1.816 1.00 25.00 C ATOM 238 CD ARG A 600 11.148 -7.965 -3.136 1.00 25.00 C ATOM 239 NE ARG A 600 10.542 -7.254 -4.273 1.00 25.00 N ATOM 240 CZ ARG A 600 10.881 -7.439 -5.559 1.00 25.00 C ATOM 241 NH1 ARG A 600 11.835 -8.302 -5.906 1.00 25.00 N ATOM 242 NH2 ARG A 600 10.257 -6.749 -6.505 1.00 25.00 N ATOM 0 H ARG A 600 9.727 -9.604 -0.030 1.00 25.00 H new ATOM 0 HA ARG A 600 8.442 -7.138 0.037 1.00 25.00 H new ATOM 0 HB2 ARG A 600 8.898 -9.072 -2.285 1.00 25.00 H new ATOM 0 HB3 ARG A 600 8.429 -7.395 -2.486 1.00 25.00 H new ATOM 0 HG2 ARG A 600 10.516 -6.601 -1.600 1.00 25.00 H new ATOM 0 HG3 ARG A 600 10.954 -8.191 -1.008 1.00 25.00 H new ATOM 0 HD2 ARG A 600 12.198 -7.685 -3.055 1.00 25.00 H new ATOM 0 HD3 ARG A 600 11.118 -9.038 -3.325 1.00 25.00 H new ATOM 0 HE ARG A 600 9.812 -6.571 -4.070 1.00 25.00 H new ATOM 0 HH11 ARG A 600 12.324 -8.838 -5.189 1.00 25.00 H new ATOM 0 HH12 ARG A 600 12.077 -8.427 -6.889 1.00 25.00 H new ATOM 0 HH21 ARG A 600 9.526 -6.084 -6.253 1.00 25.00 H new ATOM 0 HH22 ARG A 600 10.508 -6.884 -7.484 1.00 25.00 H new ATOM 256 N SER A 601 6.433 -9.638 -0.601 1.00 25.00 N ATOM 257 CA SER A 601 5.030 -10.056 -0.702 1.00 25.00 C ATOM 258 C SER A 601 4.290 -9.856 0.634 1.00 25.00 C ATOM 259 O SER A 601 3.075 -9.650 0.650 1.00 25.00 O ATOM 260 CB SER A 601 4.956 -11.530 -1.122 1.00 25.00 C ATOM 261 OG SER A 601 5.464 -12.384 -0.108 1.00 25.00 O ATOM 0 H SER A 601 7.089 -10.413 -0.503 1.00 25.00 H new ATOM 0 HA SER A 601 4.544 -9.435 -1.455 1.00 25.00 H new ATOM 0 HB2 SER A 601 3.922 -11.796 -1.340 1.00 25.00 H new ATOM 0 HB3 SER A 601 5.523 -11.677 -2.041 1.00 25.00 H new ATOM 0 HG SER A 601 6.181 -11.925 0.377 1.00 25.00 H new ATOM 267 N HIS A 602 5.046 -9.922 1.743 1.00 25.00 N ATOM 268 CA HIS A 602 4.505 -9.693 3.094 1.00 25.00 C ATOM 269 C HIS A 602 4.465 -8.187 3.416 1.00 25.00 C ATOM 270 O HIS A 602 3.719 -7.752 4.297 1.00 25.00 O ATOM 271 CB HIS A 602 5.360 -10.451 4.126 1.00 25.00 C ATOM 272 CG HIS A 602 5.250 -11.950 4.051 1.00 25.00 C ATOM 273 ND1 HIS A 602 6.034 -12.801 4.805 1.00 25.00 N ATOM 274 CD2 HIS A 602 4.434 -12.745 3.319 1.00 25.00 C ATOM 275 CE1 HIS A 602 5.705 -14.052 4.536 1.00 25.00 C ATOM 276 NE2 HIS A 602 4.738 -14.045 3.638 1.00 25.00 N ATOM 0 H HIS A 602 6.044 -10.134 1.729 1.00 25.00 H new ATOM 0 HA HIS A 602 3.483 -10.069 3.137 1.00 25.00 H new ATOM 0 HB2 HIS A 602 6.404 -10.169 3.990 1.00 25.00 H new ATOM 0 HB3 HIS A 602 5.070 -10.128 5.126 1.00 25.00 H new ATOM 0 HD2 HIS A 602 3.683 -12.417 2.615 1.00 25.00 H new ATOM 0 HE1 HIS A 602 6.152 -14.931 4.976 1.00 25.00 H new ATOM 0 HE2 HIS A 602 4.289 -14.872 3.245 1.00 25.00 H new ATOM 285 N LEU A 603 5.279 -7.414 2.685 1.00 25.00 N ATOM 286 CA LEU A 603 5.307 -5.945 2.783 1.00 25.00 C ATOM 287 C LEU A 603 4.116 -5.353 2.012 1.00 25.00 C ATOM 288 O LEU A 603 3.529 -4.347 2.418 1.00 25.00 O ATOM 289 CB LEU A 603 6.637 -5.409 2.200 1.00 25.00 C ATOM 290 CG LEU A 603 7.953 -5.546 3.034 1.00 25.00 C ATOM 291 CD1 LEU A 603 9.149 -5.083 2.242 1.00 25.00 C ATOM 292 CD2 LEU A 603 7.939 -4.786 4.346 1.00 25.00 C ATOM 0 H LEU A 603 5.940 -7.790 2.005 1.00 25.00 H new ATOM 0 HA LEU A 603 5.234 -5.650 3.830 1.00 25.00 H new ATOM 0 HB2 LEU A 603 6.801 -5.910 1.246 1.00 25.00 H new ATOM 0 HB3 LEU A 603 6.496 -4.350 1.984 1.00 25.00 H new ATOM 0 HG LEU A 603 8.021 -6.609 3.264 1.00 25.00 H new ATOM 0 HD11 LEU A 603 10.049 -5.190 2.847 1.00 25.00 H new ATOM 0 HD12 LEU A 603 9.244 -5.687 1.340 1.00 25.00 H new ATOM 0 HD13 LEU A 603 9.019 -4.037 1.966 1.00 25.00 H new ATOM 0 HD21 LEU A 603 8.888 -4.934 4.862 1.00 25.00 H new ATOM 0 HD22 LEU A 603 7.794 -3.724 4.150 1.00 25.00 H new ATOM 0 HD23 LEU A 603 7.125 -5.154 4.971 1.00 25.00 H new ATOM 304 N VAL A 604 3.788 -6.011 0.888 1.00 25.00 N ATOM 305 CA VAL A 604 2.585 -5.734 0.092 1.00 25.00 C ATOM 306 C VAL A 604 1.322 -6.233 0.825 1.00 25.00 C ATOM 307 O VAL A 604 0.276 -5.583 0.771 1.00 25.00 O ATOM 308 CB VAL A 604 2.734 -6.399 -1.318 1.00 25.00 C ATOM 309 CG1 VAL A 604 1.438 -6.417 -2.120 1.00 25.00 C ATOM 310 CG2 VAL A 604 3.808 -5.691 -2.125 1.00 25.00 C ATOM 0 H VAL A 604 4.361 -6.761 0.502 1.00 25.00 H new ATOM 0 HA VAL A 604 2.475 -4.658 -0.042 1.00 25.00 H new ATOM 0 HB VAL A 604 3.015 -7.436 -1.133 1.00 25.00 H new ATOM 0 HG11 VAL A 604 1.614 -6.892 -3.085 1.00 25.00 H new ATOM 0 HG12 VAL A 604 0.680 -6.977 -1.573 1.00 25.00 H new ATOM 0 HG13 VAL A 604 1.092 -5.395 -2.276 1.00 25.00 H new ATOM 0 HG21 VAL A 604 3.900 -6.164 -3.102 1.00 25.00 H new ATOM 0 HG22 VAL A 604 3.535 -4.643 -2.253 1.00 25.00 H new ATOM 0 HG23 VAL A 604 4.761 -5.756 -1.599 1.00 25.00 H new ATOM 320 N HIS A 605 1.438 -7.388 1.504 1.00 25.00 N ATOM 321 CA HIS A 605 0.344 -7.934 2.322 1.00 25.00 C ATOM 322 C HIS A 605 0.164 -7.103 3.604 1.00 25.00 C ATOM 323 O HIS A 605 -0.866 -7.188 4.270 1.00 25.00 O ATOM 324 CB HIS A 605 0.613 -9.410 2.663 1.00 25.00 C ATOM 325 CG HIS A 605 -0.495 -10.079 3.432 1.00 25.00 C ATOM 326 ND1 HIS A 605 -1.740 -10.331 2.895 1.00 25.00 N ATOM 327 CD2 HIS A 605 -0.541 -10.536 4.710 1.00 25.00 C ATOM 328 CE1 HIS A 605 -2.502 -10.911 3.806 1.00 25.00 C ATOM 329 NE2 HIS A 605 -1.798 -11.047 4.913 1.00 25.00 N ATOM 0 H HIS A 605 2.281 -7.962 1.501 1.00 25.00 H new ATOM 0 HA HIS A 605 -0.580 -7.879 1.747 1.00 25.00 H new ATOM 0 HB2 HIS A 605 0.781 -9.960 1.737 1.00 25.00 H new ATOM 0 HB3 HIS A 605 1.533 -9.475 3.243 1.00 25.00 H new ATOM 0 HD2 HIS A 605 0.262 -10.503 5.432 1.00 25.00 H new ATOM 0 HE1 HIS A 605 -3.527 -11.221 3.667 1.00 25.00 H new ATOM 0 HE2 HIS A 605 -2.134 -11.465 5.781 1.00 25.00 H new ATOM 338 N LYS A 606 1.189 -6.306 3.926 1.00 25.00 N ATOM 339 CA LYS A 606 1.153 -5.363 5.049 1.00 25.00 C ATOM 340 C LYS A 606 0.498 -4.051 4.589 1.00 25.00 C ATOM 341 O LYS A 606 -0.020 -3.272 5.393 1.00 25.00 O ATOM 342 CB LYS A 606 2.593 -5.110 5.520 1.00 25.00 C ATOM 343 CG LYS A 606 2.734 -4.212 6.737 1.00 25.00 C ATOM 344 CD LYS A 606 4.188 -4.120 7.164 1.00 25.00 C ATOM 345 CE LYS A 606 4.344 -3.322 8.440 1.00 25.00 C ATOM 346 NZ LYS A 606 5.770 -3.184 8.843 1.00 25.00 N ATOM 0 H LYS A 606 2.070 -6.297 3.413 1.00 25.00 H new ATOM 0 HA LYS A 606 0.570 -5.772 5.874 1.00 25.00 H new ATOM 0 HB2 LYS A 606 3.058 -6.070 5.743 1.00 25.00 H new ATOM 0 HB3 LYS A 606 3.154 -4.668 4.697 1.00 25.00 H new ATOM 0 HG2 LYS A 606 2.352 -3.217 6.508 1.00 25.00 H new ATOM 0 HG3 LYS A 606 2.132 -4.604 7.557 1.00 25.00 H new ATOM 0 HD2 LYS A 606 4.589 -5.123 7.310 1.00 25.00 H new ATOM 0 HD3 LYS A 606 4.772 -3.655 6.370 1.00 25.00 H new ATOM 0 HE2 LYS A 606 3.909 -2.332 8.303 1.00 25.00 H new ATOM 0 HE3 LYS A 606 3.787 -3.807 9.241 1.00 25.00 H new ATOM 0 HZ1 LYS A 606 5.830 -2.631 9.722 1.00 25.00 H new ATOM 0 HZ2 LYS A 606 6.180 -4.127 8.999 1.00 25.00 H new ATOM 0 HZ3 LYS A 606 6.298 -2.698 8.090 1.00 25.00 H new ATOM 360 N LEU A 607 0.543 -3.850 3.270 1.00 25.00 N ATOM 361 CA LEU A 607 0.021 -2.664 2.603 1.00 25.00 C ATOM 362 C LEU A 607 -1.473 -2.812 2.278 1.00 25.00 C ATOM 363 O LEU A 607 -2.259 -1.901 2.530 1.00 25.00 O ATOM 364 CB LEU A 607 0.836 -2.459 1.328 1.00 25.00 C ATOM 365 CG LEU A 607 0.610 -1.136 0.581 1.00 25.00 C ATOM 366 CD1 LEU A 607 0.360 -0.030 1.578 1.00 25.00 C ATOM 367 CD2 LEU A 607 1.807 -0.764 -0.290 1.00 25.00 C ATOM 0 H LEU A 607 0.954 -4.525 2.625 1.00 25.00 H new ATOM 0 HA LEU A 607 0.111 -1.799 3.260 1.00 25.00 H new ATOM 0 HB2 LEU A 607 1.893 -2.532 1.582 1.00 25.00 H new ATOM 0 HB3 LEU A 607 0.615 -3.279 0.645 1.00 25.00 H new ATOM 0 HG LEU A 607 -0.255 -1.266 -0.070 1.00 25.00 H new ATOM 0 HD11 LEU A 607 0.200 0.909 1.048 1.00 25.00 H new ATOM 0 HD12 LEU A 607 -0.523 -0.267 2.171 1.00 25.00 H new ATOM 0 HD13 LEU A 607 1.223 0.068 2.236 1.00 25.00 H new ATOM 0 HD21 LEU A 607 1.606 0.178 -0.801 1.00 25.00 H new ATOM 0 HD22 LEU A 607 2.693 -0.656 0.336 1.00 25.00 H new ATOM 0 HD23 LEU A 607 1.978 -1.548 -1.028 1.00 25.00 H new ATOM 379 N VAL A 608 -1.845 -3.988 1.743 1.00 25.00 N ATOM 380 CA VAL A 608 -3.228 -4.294 1.324 1.00 25.00 C ATOM 381 C VAL A 608 -4.179 -4.419 2.540 1.00 25.00 C ATOM 382 O VAL A 608 -5.381 -4.174 2.409 1.00 25.00 O ATOM 383 CB VAL A 608 -3.255 -5.598 0.451 1.00 25.00 C ATOM 384 CG1 VAL A 608 -2.421 -5.469 -0.821 1.00 25.00 C ATOM 385 CG2 VAL A 608 -2.763 -6.803 1.254 1.00 25.00 C ATOM 0 H VAL A 608 -1.194 -4.757 1.588 1.00 25.00 H new ATOM 0 HA VAL A 608 -3.588 -3.462 0.719 1.00 25.00 H new ATOM 0 HB VAL A 608 -4.295 -5.748 0.160 1.00 25.00 H new ATOM 0 HG11 VAL A 608 -2.475 -6.399 -1.387 1.00 25.00 H new ATOM 0 HG12 VAL A 608 -2.808 -4.651 -1.429 1.00 25.00 H new ATOM 0 HG13 VAL A 608 -1.383 -5.265 -0.557 1.00 25.00 H new ATOM 0 HG21 VAL A 608 -2.791 -7.694 0.627 1.00 25.00 H new ATOM 0 HG22 VAL A 608 -1.740 -6.626 1.587 1.00 25.00 H new ATOM 0 HG23 VAL A 608 -3.406 -6.949 2.122 1.00 25.00 H new ATOM 395 N GLN A 609 -3.633 -4.787 3.712 1.00 25.00 N ATOM 396 CA GLN A 609 -4.416 -4.908 4.946 1.00 25.00 C ATOM 397 C GLN A 609 -4.608 -3.545 5.597 1.00 25.00 C ATOM 398 O GLN A 609 -5.664 -3.257 6.163 1.00 25.00 O ATOM 399 CB GLN A 609 -3.712 -5.846 5.930 1.00 25.00 C ATOM 400 CG GLN A 609 -3.614 -7.291 5.460 1.00 25.00 C ATOM 401 CD GLN A 609 -4.960 -7.955 5.177 1.00 25.00 C ATOM 402 OE1 GLN A 609 -5.879 -7.932 5.998 1.00 25.00 O ATOM 403 NE2 GLN A 609 -5.078 -8.559 3.998 1.00 25.00 N ATOM 0 H GLN A 609 -2.644 -5.007 3.827 1.00 25.00 H new ATOM 0 HA GLN A 609 -5.392 -5.319 4.689 1.00 25.00 H new ATOM 0 HB2 GLN A 609 -2.707 -5.469 6.117 1.00 25.00 H new ATOM 0 HB3 GLN A 609 -4.244 -5.821 6.881 1.00 25.00 H new ATOM 0 HG2 GLN A 609 -3.008 -7.325 4.555 1.00 25.00 H new ATOM 0 HG3 GLN A 609 -3.088 -7.872 6.218 1.00 25.00 H new ATOM 0 HE21 GLN A 609 -4.296 -8.557 3.344 1.00 25.00 H new ATOM 0 HE22 GLN A 609 -5.951 -9.024 3.748 1.00 25.00 H new ATOM 412 N ALA A 610 -3.560 -2.717 5.508 1.00 25.00 N ATOM 413 CA ALA A 610 -3.603 -1.329 5.987 1.00 25.00 C ATOM 414 C ALA A 610 -4.594 -0.479 5.178 1.00 25.00 C ATOM 415 O ALA A 610 -5.203 0.450 5.711 1.00 25.00 O ATOM 416 CB ALA A 610 -2.217 -0.717 5.921 1.00 25.00 C ATOM 0 H ALA A 610 -2.663 -2.988 5.105 1.00 25.00 H new ATOM 0 HA ALA A 610 -3.947 -1.343 7.021 1.00 25.00 H new ATOM 0 HB1 ALA A 610 -2.256 0.312 6.278 1.00 25.00 H new ATOM 0 HB2 ALA A 610 -1.535 -1.292 6.547 1.00 25.00 H new ATOM 0 HB3 ALA A 610 -1.862 -0.731 4.891 1.00 25.00 H new ATOM 422 N ILE A 611 -4.748 -0.821 3.890 1.00 25.00 N ATOM 423 CA ILE A 611 -5.708 -0.152 3.005 1.00 25.00 C ATOM 424 C ILE A 611 -7.101 -0.789 3.180 1.00 25.00 C ATOM 425 O ILE A 611 -8.093 -0.077 3.363 1.00 25.00 O ATOM 426 CB ILE A 611 -5.243 -0.205 1.507 1.00 25.00 C ATOM 427 CG1 ILE A 611 -3.897 0.522 1.345 1.00 25.00 C ATOM 428 CG2 ILE A 611 -6.284 0.439 0.586 1.00 25.00 C ATOM 429 CD1 ILE A 611 -3.220 0.343 -0.008 1.00 25.00 C ATOM 0 H ILE A 611 -4.214 -1.563 3.437 1.00 25.00 H new ATOM 0 HA ILE A 611 -5.763 0.901 3.282 1.00 25.00 H new ATOM 0 HB ILE A 611 -5.129 -1.252 1.227 1.00 25.00 H new ATOM 0 HG12 ILE A 611 -4.055 1.587 1.516 1.00 25.00 H new ATOM 0 HG13 ILE A 611 -3.218 0.172 2.122 1.00 25.00 H new ATOM 0 HG21 ILE A 611 -5.937 0.389 -0.446 1.00 25.00 H new ATOM 0 HG22 ILE A 611 -7.230 -0.095 0.677 1.00 25.00 H new ATOM 0 HG23 ILE A 611 -6.426 1.481 0.871 1.00 25.00 H new ATOM 0 HD11 ILE A 611 -2.280 0.894 -0.020 1.00 25.00 H new ATOM 0 HD12 ILE A 611 -3.023 -0.715 -0.179 1.00 25.00 H new ATOM 0 HD13 ILE A 611 -3.873 0.722 -0.794 1.00 25.00 H new ATOM 441 N PHE A 612 -7.157 -2.130 3.118 1.00 25.00 N ATOM 442 CA PHE A 612 -8.383 -2.878 3.384 1.00 25.00 C ATOM 443 C PHE A 612 -8.069 -4.180 4.169 1.00 25.00 C ATOM 444 O PHE A 612 -7.519 -5.124 3.591 1.00 25.00 O ATOM 445 CB PHE A 612 -9.114 -3.185 2.055 1.00 25.00 C ATOM 446 CG PHE A 612 -8.242 -3.793 0.984 1.00 25.00 C ATOM 447 CD1 PHE A 612 -7.986 -5.155 0.963 1.00 25.00 C ATOM 448 CD2 PHE A 612 -7.678 -2.993 0.007 1.00 25.00 C ATOM 449 CE1 PHE A 612 -7.185 -5.708 -0.017 1.00 25.00 C ATOM 450 CE2 PHE A 612 -6.874 -3.539 -0.976 1.00 25.00 C ATOM 451 CZ PHE A 612 -6.642 -4.926 -0.983 1.00 25.00 C ATOM 0 H PHE A 612 -6.356 -2.716 2.883 1.00 25.00 H new ATOM 0 HA PHE A 612 -9.042 -2.270 4.004 1.00 25.00 H new ATOM 0 HB2 PHE A 612 -9.942 -3.864 2.259 1.00 25.00 H new ATOM 0 HB3 PHE A 612 -9.547 -2.261 1.672 1.00 25.00 H new ATOM 0 HD1 PHE A 612 -8.418 -5.791 1.722 1.00 25.00 H new ATOM 0 HD2 PHE A 612 -7.868 -1.930 0.012 1.00 25.00 H new ATOM 0 HE1 PHE A 612 -6.990 -6.770 -0.014 1.00 25.00 H new ATOM 0 HE2 PHE A 612 -6.429 -2.907 -1.730 1.00 25.00 H new ATOM 0 HZ PHE A 612 -6.032 -5.368 -1.757 1.00 25.00 H new ATOM 461 N PRO A 613 -8.402 -4.258 5.502 1.00 25.00 N ATOM 462 CA PRO A 613 -8.258 -5.503 6.283 1.00 25.00 C ATOM 463 C PRO A 613 -9.363 -6.521 5.973 1.00 25.00 C ATOM 464 O PRO A 613 -10.531 -6.150 5.817 1.00 25.00 O ATOM 465 CB PRO A 613 -8.359 -5.046 7.752 1.00 25.00 C ATOM 466 CG PRO A 613 -9.202 -3.814 7.747 1.00 25.00 C ATOM 467 CD PRO A 613 -8.899 -3.165 6.365 1.00 25.00 C ATOM 0 HA PRO A 613 -7.321 -6.008 6.048 1.00 25.00 H new ATOM 0 HB2 PRO A 613 -8.808 -5.822 8.371 1.00 25.00 H new ATOM 0 HB3 PRO A 613 -7.371 -4.840 8.165 1.00 25.00 H new ATOM 0 HG2 PRO A 613 -10.260 -4.052 7.854 1.00 25.00 H new ATOM 0 HG3 PRO A 613 -8.941 -3.147 8.569 1.00 25.00 H new ATOM 0 HD2 PRO A 613 -9.795 -2.711 5.942 1.00 25.00 H new ATOM 0 HD3 PRO A 613 -8.155 -2.374 6.460 1.00 25.00 H new ATOM 475 N THR A 614 -8.981 -7.804 5.883 1.00 25.00 N ATOM 476 CA THR A 614 -9.928 -8.882 5.588 1.00 25.00 C ATOM 477 C THR A 614 -9.456 -10.234 6.167 1.00 25.00 C ATOM 478 O THR A 614 -8.307 -10.632 5.951 1.00 25.00 O ATOM 479 CB THR A 614 -10.238 -9.026 4.068 1.00 25.00 C ATOM 480 OG1 THR A 614 -10.633 -7.762 3.513 1.00 25.00 O ATOM 481 CG2 THR A 614 -11.319 -10.062 3.793 1.00 25.00 C ATOM 0 H THR A 614 -8.019 -8.118 6.011 1.00 25.00 H new ATOM 0 HA THR A 614 -10.857 -8.596 6.081 1.00 25.00 H new ATOM 0 HB THR A 614 -9.319 -9.367 3.591 1.00 25.00 H new ATOM 0 HG1 THR A 614 -11.463 -7.873 3.004 1.00 25.00 H new ATOM 0 HG21 THR A 614 -11.498 -10.125 2.720 1.00 25.00 H new ATOM 0 HG22 THR A 614 -10.994 -11.034 4.164 1.00 25.00 H new ATOM 0 HG23 THR A 614 -12.240 -9.770 4.298 1.00 25.00 H new ATOM 489 N PRO A 615 -10.345 -10.948 6.928 1.00 25.00 N ATOM 490 CA PRO A 615 -10.083 -12.318 7.438 1.00 25.00 C ATOM 491 C PRO A 615 -9.560 -13.299 6.374 1.00 25.00 C ATOM 492 O PRO A 615 -8.477 -13.871 6.528 1.00 25.00 O ATOM 493 CB PRO A 615 -11.462 -12.766 7.917 1.00 25.00 C ATOM 494 CG PRO A 615 -12.130 -11.514 8.354 1.00 25.00 C ATOM 495 CD PRO A 615 -11.661 -10.448 7.401 1.00 25.00 C ATOM 0 HA PRO A 615 -9.303 -12.309 8.199 1.00 25.00 H new ATOM 0 HB2 PRO A 615 -12.020 -13.255 7.118 1.00 25.00 H new ATOM 0 HB3 PRO A 615 -11.384 -13.481 8.736 1.00 25.00 H new ATOM 0 HG2 PRO A 615 -13.215 -11.617 8.323 1.00 25.00 H new ATOM 0 HG3 PRO A 615 -11.863 -11.266 9.381 1.00 25.00 H new ATOM 0 HD2 PRO A 615 -12.359 -10.316 6.574 1.00 25.00 H new ATOM 0 HD3 PRO A 615 -11.567 -9.482 7.897 1.00 25.00 H new ATOM 503 N ASP A 616 -10.346 -13.478 5.306 1.00 25.00 N ATOM 504 CA ASP A 616 -10.013 -14.411 4.222 1.00 25.00 C ATOM 505 C ASP A 616 -9.185 -13.731 3.116 1.00 25.00 C ATOM 506 O ASP A 616 -9.669 -12.793 2.472 1.00 25.00 O ATOM 507 CB ASP A 616 -11.291 -15.016 3.620 1.00 25.00 C ATOM 508 CG ASP A 616 -11.019 -16.242 2.766 1.00 25.00 C ATOM 509 OD1 ASP A 616 -9.837 -16.494 2.448 1.00 25.00 O ATOM 510 OD2 ASP A 616 -11.986 -16.951 2.419 1.00 25.00 O ATOM 0 H ASP A 616 -11.227 -12.983 5.168 1.00 25.00 H new ATOM 0 HA ASP A 616 -9.407 -15.207 4.655 1.00 25.00 H new ATOM 0 HB2 ASP A 616 -11.974 -15.285 4.426 1.00 25.00 H new ATOM 0 HB3 ASP A 616 -11.794 -14.262 3.014 1.00 25.00 H new ATOM 515 N PRO A 617 -7.906 -14.182 2.886 1.00 25.00 N ATOM 516 CA PRO A 617 -7.064 -13.681 1.766 1.00 25.00 C ATOM 517 C PRO A 617 -7.614 -14.013 0.362 1.00 25.00 C ATOM 518 O PRO A 617 -7.121 -13.488 -0.640 1.00 25.00 O ATOM 519 CB PRO A 617 -5.722 -14.400 1.984 1.00 25.00 C ATOM 520 CG PRO A 617 -6.070 -15.643 2.729 1.00 25.00 C ATOM 521 CD PRO A 617 -7.150 -15.160 3.718 1.00 25.00 C ATOM 0 HA PRO A 617 -7.011 -12.592 1.782 1.00 25.00 H new ATOM 0 HB2 PRO A 617 -5.238 -14.631 1.035 1.00 25.00 H new ATOM 0 HB3 PRO A 617 -5.029 -13.780 2.552 1.00 25.00 H new ATOM 0 HG2 PRO A 617 -6.449 -16.420 2.065 1.00 25.00 H new ATOM 0 HG3 PRO A 617 -5.206 -16.060 3.246 1.00 25.00 H new ATOM 0 HD2 PRO A 617 -7.782 -15.977 4.065 1.00 25.00 H new ATOM 0 HD3 PRO A 617 -6.716 -14.695 4.603 1.00 25.00 H new ATOM 529 N ALA A 618 -8.640 -14.880 0.309 1.00 25.00 N ATOM 530 CA ALA A 618 -9.231 -15.337 -0.959 1.00 25.00 C ATOM 531 C ALA A 618 -10.129 -14.274 -1.615 1.00 25.00 C ATOM 532 O ALA A 618 -10.528 -14.424 -2.775 1.00 25.00 O ATOM 533 CB ALA A 618 -10.018 -16.620 -0.727 1.00 25.00 C ATOM 0 H ALA A 618 -9.080 -15.281 1.138 1.00 25.00 H new ATOM 0 HA ALA A 618 -8.409 -15.524 -1.650 1.00 25.00 H new ATOM 0 HB1 ALA A 618 -10.454 -16.955 -1.668 1.00 25.00 H new ATOM 0 HB2 ALA A 618 -9.351 -17.391 -0.341 1.00 25.00 H new ATOM 0 HB3 ALA A 618 -10.813 -16.434 -0.005 1.00 25.00 H new ATOM 539 N ALA A 619 -10.433 -13.202 -0.867 1.00 25.00 N ATOM 540 CA ALA A 619 -11.258 -12.096 -1.371 1.00 25.00 C ATOM 541 C ALA A 619 -10.426 -11.070 -2.148 1.00 25.00 C ATOM 542 O ALA A 619 -10.977 -10.236 -2.875 1.00 25.00 O ATOM 543 CB ALA A 619 -11.967 -11.409 -0.215 1.00 25.00 C ATOM 0 H ALA A 619 -10.117 -13.079 0.095 1.00 25.00 H new ATOM 0 HA ALA A 619 -11.992 -12.520 -2.057 1.00 25.00 H new ATOM 0 HB1 ALA A 619 -12.577 -10.590 -0.597 1.00 25.00 H new ATOM 0 HB2 ALA A 619 -12.605 -12.128 0.299 1.00 25.00 H new ATOM 0 HB3 ALA A 619 -11.228 -11.016 0.483 1.00 25.00 H new ATOM 549 N LEU A 620 -9.099 -11.151 -1.994 1.00 25.00 N ATOM 550 CA LEU A 620 -8.169 -10.200 -2.602 1.00 25.00 C ATOM 551 C LEU A 620 -7.807 -10.585 -4.049 1.00 25.00 C ATOM 552 O LEU A 620 -6.986 -9.919 -4.690 1.00 25.00 O ATOM 553 CB LEU A 620 -6.894 -10.109 -1.743 1.00 25.00 C ATOM 554 CG LEU A 620 -7.086 -9.729 -0.260 1.00 25.00 C ATOM 555 CD1 LEU A 620 -5.884 -8.940 0.237 1.00 25.00 C ATOM 556 CD2 LEU A 620 -8.363 -8.920 -0.045 1.00 25.00 C ATOM 0 H LEU A 620 -8.643 -11.879 -1.444 1.00 25.00 H new ATOM 0 HA LEU A 620 -8.662 -9.229 -2.641 1.00 25.00 H new ATOM 0 HB2 LEU A 620 -6.386 -11.072 -1.785 1.00 25.00 H new ATOM 0 HB3 LEU A 620 -6.228 -9.377 -2.199 1.00 25.00 H new ATOM 0 HG LEU A 620 -7.176 -10.654 0.309 1.00 25.00 H new ATOM 0 HD11 LEU A 620 -6.030 -8.677 1.285 1.00 25.00 H new ATOM 0 HD12 LEU A 620 -4.984 -9.547 0.137 1.00 25.00 H new ATOM 0 HD13 LEU A 620 -5.776 -8.031 -0.354 1.00 25.00 H new ATOM 0 HD21 LEU A 620 -8.463 -8.672 1.012 1.00 25.00 H new ATOM 0 HD22 LEU A 620 -8.315 -8.002 -0.631 1.00 25.00 H new ATOM 0 HD23 LEU A 620 -9.224 -9.508 -0.362 1.00 25.00 H new ATOM 568 N LYS A 621 -8.439 -11.654 -4.556 1.00 25.00 N ATOM 569 CA LYS A 621 -8.143 -12.192 -5.894 1.00 25.00 C ATOM 570 C LYS A 621 -9.138 -11.658 -6.934 1.00 25.00 C ATOM 571 O LYS A 621 -9.232 -12.179 -8.053 1.00 25.00 O ATOM 572 CB LYS A 621 -8.175 -13.734 -5.872 1.00 25.00 C ATOM 573 CG LYS A 621 -7.039 -14.403 -5.092 1.00 25.00 C ATOM 574 CD LYS A 621 -7.124 -15.926 -5.114 1.00 25.00 C ATOM 575 CE LYS A 621 -5.958 -16.551 -4.380 1.00 25.00 C ATOM 576 NZ LYS A 621 -6.068 -18.036 -4.286 1.00 25.00 N ATOM 0 H LYS A 621 -9.164 -12.167 -4.055 1.00 25.00 H new ATOM 0 HA LYS A 621 -7.143 -11.863 -6.176 1.00 25.00 H new ATOM 0 HB2 LYS A 621 -9.125 -14.055 -5.444 1.00 25.00 H new ATOM 0 HB3 LYS A 621 -8.150 -14.096 -6.900 1.00 25.00 H new ATOM 0 HG2 LYS A 621 -6.083 -14.091 -5.512 1.00 25.00 H new ATOM 0 HG3 LYS A 621 -7.061 -14.057 -4.059 1.00 25.00 H new ATOM 0 HD2 LYS A 621 -8.059 -16.247 -4.656 1.00 25.00 H new ATOM 0 HD3 LYS A 621 -7.138 -16.277 -6.146 1.00 25.00 H new ATOM 0 HE2 LYS A 621 -5.031 -16.291 -4.890 1.00 25.00 H new ATOM 0 HE3 LYS A 621 -5.898 -16.131 -3.376 1.00 25.00 H new ATOM 0 HZ1 LYS A 621 -5.245 -18.413 -3.775 1.00 25.00 H new ATOM 0 HZ2 LYS A 621 -6.938 -18.288 -3.775 1.00 25.00 H new ATOM 0 HZ3 LYS A 621 -6.098 -18.443 -5.243 1.00 25.00 H new ATOM 590 N ASP A 622 -9.864 -10.599 -6.554 1.00 25.00 N ATOM 591 CA ASP A 622 -10.939 -10.030 -7.370 1.00 25.00 C ATOM 592 C ASP A 622 -10.382 -9.183 -8.532 1.00 25.00 C ATOM 593 O ASP A 622 -9.198 -8.832 -8.536 1.00 25.00 O ATOM 594 CB ASP A 622 -11.856 -9.198 -6.464 1.00 25.00 C ATOM 595 CG ASP A 622 -13.260 -9.023 -7.024 1.00 25.00 C ATOM 596 OD1 ASP A 622 -13.522 -9.533 -8.135 1.00 25.00 O ATOM 597 OD2 ASP A 622 -14.090 -8.379 -6.352 1.00 25.00 O ATOM 0 H ASP A 622 -9.720 -10.113 -5.669 1.00 25.00 H new ATOM 0 HA ASP A 622 -11.512 -10.839 -7.824 1.00 25.00 H new ATOM 0 HB2 ASP A 622 -11.920 -9.676 -5.486 1.00 25.00 H new ATOM 0 HB3 ASP A 622 -11.409 -8.216 -6.310 1.00 25.00 H new ATOM 602 N ARG A 623 -11.246 -8.856 -9.505 1.00 25.00 N ATOM 603 CA ARG A 623 -10.840 -8.132 -10.720 1.00 25.00 C ATOM 604 C ARG A 623 -10.509 -6.652 -10.426 1.00 25.00 C ATOM 605 O ARG A 623 -9.408 -6.185 -10.737 1.00 25.00 O ATOM 606 CB ARG A 623 -11.966 -8.252 -11.777 1.00 25.00 C ATOM 607 CG ARG A 623 -12.277 -9.673 -12.262 1.00 25.00 C ATOM 608 CD ARG A 623 -11.270 -10.177 -13.295 1.00 25.00 C ATOM 609 NE ARG A 623 -10.038 -10.698 -12.685 1.00 25.00 N ATOM 610 CZ ARG A 623 -8.800 -10.466 -13.149 1.00 25.00 C ATOM 611 NH1 ARG A 623 -8.597 -9.722 -14.235 1.00 25.00 N ATOM 612 NH2 ARG A 623 -7.756 -10.985 -12.517 1.00 25.00 N ATOM 0 H ARG A 623 -12.240 -9.084 -9.473 1.00 25.00 H new ATOM 0 HA ARG A 623 -9.926 -8.582 -11.107 1.00 25.00 H new ATOM 0 HB2 ARG A 623 -12.877 -7.823 -11.360 1.00 25.00 H new ATOM 0 HB3 ARG A 623 -11.694 -7.645 -12.641 1.00 25.00 H new ATOM 0 HG2 ARG A 623 -12.285 -10.350 -11.408 1.00 25.00 H new ATOM 0 HG3 ARG A 623 -13.277 -9.694 -12.695 1.00 25.00 H new ATOM 0 HD2 ARG A 623 -11.733 -10.961 -13.894 1.00 25.00 H new ATOM 0 HD3 ARG A 623 -11.017 -9.364 -13.975 1.00 25.00 H new ATOM 0 HE ARG A 623 -10.131 -11.277 -11.850 1.00 25.00 H new ATOM 0 HH11 ARG A 623 -9.391 -9.316 -14.731 1.00 25.00 H new ATOM 0 HH12 ARG A 623 -7.648 -9.558 -14.571 1.00 25.00 H new ATOM 0 HH21 ARG A 623 -7.897 -11.556 -11.684 1.00 25.00 H new ATOM 0 HH22 ARG A 623 -6.812 -10.813 -12.864 1.00 25.00 H new ATOM 626 N ARG A 624 -11.465 -5.937 -9.816 1.00 25.00 N ATOM 627 CA ARG A 624 -11.327 -4.499 -9.519 1.00 25.00 C ATOM 628 C ARG A 624 -10.306 -4.234 -8.391 1.00 25.00 C ATOM 629 O ARG A 624 -9.795 -3.117 -8.262 1.00 25.00 O ATOM 630 CB ARG A 624 -12.703 -3.920 -9.151 1.00 25.00 C ATOM 631 CG ARG A 624 -13.701 -3.869 -10.309 1.00 25.00 C ATOM 632 CD ARG A 624 -15.053 -3.313 -9.874 1.00 25.00 C ATOM 633 NE ARG A 624 -14.981 -1.897 -9.481 1.00 25.00 N ATOM 634 CZ ARG A 624 -15.961 -1.223 -8.860 1.00 25.00 C ATOM 635 NH1 ARG A 624 -17.114 -1.814 -8.546 1.00 25.00 N ATOM 636 NH2 ARG A 624 -15.784 0.055 -8.555 1.00 25.00 N ATOM 0 H ARG A 624 -12.354 -6.335 -9.514 1.00 25.00 H new ATOM 0 HA ARG A 624 -10.947 -4.003 -10.412 1.00 25.00 H new ATOM 0 HB2 ARG A 624 -13.131 -4.517 -8.346 1.00 25.00 H new ATOM 0 HB3 ARG A 624 -12.566 -2.911 -8.762 1.00 25.00 H new ATOM 0 HG2 ARG A 624 -13.296 -3.251 -11.110 1.00 25.00 H new ATOM 0 HG3 ARG A 624 -13.835 -4.871 -10.716 1.00 25.00 H new ATOM 0 HD2 ARG A 624 -15.767 -3.424 -10.690 1.00 25.00 H new ATOM 0 HD3 ARG A 624 -15.431 -3.900 -9.037 1.00 25.00 H new ATOM 0 HE ARG A 624 -14.122 -1.390 -9.697 1.00 25.00 H new ATOM 0 HH11 ARG A 624 -17.263 -2.796 -8.778 1.00 25.00 H new ATOM 0 HH12 ARG A 624 -17.847 -1.284 -8.074 1.00 25.00 H new ATOM 0 HH21 ARG A 624 -14.907 0.519 -8.792 1.00 25.00 H new ATOM 0 HH22 ARG A 624 -16.524 0.574 -8.083 1.00 25.00 H new ATOM 650 N MET A 625 -10.016 -5.268 -7.588 1.00 25.00 N ATOM 651 CA MET A 625 -9.048 -5.168 -6.486 1.00 25.00 C ATOM 652 C MET A 625 -7.604 -5.258 -7.003 1.00 25.00 C ATOM 653 O MET A 625 -6.713 -4.585 -6.479 1.00 25.00 O ATOM 654 CB MET A 625 -9.317 -6.278 -5.455 1.00 25.00 C ATOM 655 CG MET A 625 -8.431 -6.223 -4.203 1.00 25.00 C ATOM 656 SD MET A 625 -9.374 -6.284 -2.665 1.00 25.00 S ATOM 657 CE MET A 625 -9.949 -4.593 -2.551 1.00 25.00 C ATOM 0 H MET A 625 -10.442 -6.190 -7.683 1.00 25.00 H new ATOM 0 HA MET A 625 -9.170 -4.196 -6.009 1.00 25.00 H new ATOM 0 HB2 MET A 625 -10.361 -6.223 -5.147 1.00 25.00 H new ATOM 0 HB3 MET A 625 -9.178 -7.245 -5.939 1.00 25.00 H new ATOM 0 HG2 MET A 625 -7.729 -7.057 -4.225 1.00 25.00 H new ATOM 0 HG3 MET A 625 -7.840 -5.308 -4.224 1.00 25.00 H new ATOM 0 HE1 MET A 625 -10.297 -4.395 -1.537 1.00 25.00 H new ATOM 0 HE2 MET A 625 -9.132 -3.914 -2.794 1.00 25.00 H new ATOM 0 HE3 MET A 625 -10.769 -4.439 -3.253 1.00 25.00 H new ATOM 667 N GLU A 626 -7.392 -6.102 -8.024 1.00 25.00 N ATOM 668 CA GLU A 626 -6.065 -6.309 -8.635 1.00 25.00 C ATOM 669 C GLU A 626 -5.394 -5.006 -9.114 1.00 25.00 C ATOM 670 O GLU A 626 -4.172 -4.967 -9.288 1.00 25.00 O ATOM 671 CB GLU A 626 -6.145 -7.317 -9.784 1.00 25.00 C ATOM 672 CG GLU A 626 -4.781 -7.799 -10.257 1.00 25.00 C ATOM 673 CD GLU A 626 -4.875 -8.832 -11.365 1.00 25.00 C ATOM 674 OE1 GLU A 626 -5.965 -8.962 -11.963 1.00 25.00 O ATOM 675 OE2 GLU A 626 -3.861 -9.509 -11.635 1.00 25.00 O ATOM 0 H GLU A 626 -8.132 -6.660 -8.450 1.00 25.00 H new ATOM 0 HA GLU A 626 -5.433 -6.709 -7.842 1.00 25.00 H new ATOM 0 HB2 GLU A 626 -6.736 -8.176 -9.465 1.00 25.00 H new ATOM 0 HB3 GLU A 626 -6.672 -6.861 -10.622 1.00 25.00 H new ATOM 0 HG2 GLU A 626 -4.201 -6.946 -10.610 1.00 25.00 H new ATOM 0 HG3 GLU A 626 -4.239 -8.226 -9.413 1.00 25.00 H new ATOM 682 N ASN A 627 -6.198 -3.948 -9.319 1.00 25.00 N ATOM 683 CA ASN A 627 -5.679 -2.624 -9.709 1.00 25.00 C ATOM 684 C ASN A 627 -4.985 -1.916 -8.532 1.00 25.00 C ATOM 685 O ASN A 627 -4.033 -1.157 -8.736 1.00 25.00 O ATOM 686 CB ASN A 627 -6.810 -1.741 -10.257 1.00 25.00 C ATOM 687 CG ASN A 627 -7.344 -2.227 -11.594 1.00 25.00 C ATOM 688 OD1 ASN A 627 -6.655 -2.935 -12.330 1.00 25.00 O ATOM 689 ND2 ASN A 627 -8.574 -1.844 -11.916 1.00 25.00 N ATOM 0 H ASN A 627 -7.213 -3.984 -9.221 1.00 25.00 H new ATOM 0 HA ASN A 627 -4.937 -2.784 -10.492 1.00 25.00 H new ATOM 0 HB2 ASN A 627 -7.625 -1.713 -9.534 1.00 25.00 H new ATOM 0 HB3 ASN A 627 -6.446 -0.719 -10.366 1.00 25.00 H new ATOM 0 HD21 ASN A 627 -8.983 -2.137 -12.803 1.00 25.00 H new ATOM 0 HD22 ASN A 627 -9.109 -1.257 -11.276 1.00 25.00 H new ATOM 696 N LEU A 628 -5.471 -2.176 -7.307 1.00 25.00 N ATOM 697 CA LEU A 628 -4.863 -1.638 -6.080 1.00 25.00 C ATOM 698 C LEU A 628 -3.724 -2.560 -5.592 1.00 25.00 C ATOM 699 O LEU A 628 -2.731 -2.082 -5.037 1.00 25.00 O ATOM 700 CB LEU A 628 -5.975 -1.366 -5.013 1.00 25.00 C ATOM 701 CG LEU A 628 -5.629 -0.629 -3.688 1.00 25.00 C ATOM 702 CD1 LEU A 628 -4.887 0.683 -3.888 1.00 25.00 C ATOM 703 CD2 LEU A 628 -6.895 -0.333 -2.918 1.00 25.00 C ATOM 0 H LEU A 628 -6.290 -2.761 -7.140 1.00 25.00 H new ATOM 0 HA LEU A 628 -4.392 -0.676 -6.280 1.00 25.00 H new ATOM 0 HB2 LEU A 628 -6.761 -0.793 -5.505 1.00 25.00 H new ATOM 0 HB3 LEU A 628 -6.405 -2.330 -4.743 1.00 25.00 H new ATOM 0 HG LEU A 628 -4.969 -1.303 -3.142 1.00 25.00 H new ATOM 0 HD11 LEU A 628 -4.682 1.136 -2.918 1.00 25.00 H new ATOM 0 HD12 LEU A 628 -3.947 0.494 -4.406 1.00 25.00 H new ATOM 0 HD13 LEU A 628 -5.500 1.360 -4.483 1.00 25.00 H new ATOM 0 HD21 LEU A 628 -6.645 0.183 -1.991 1.00 25.00 H new ATOM 0 HD22 LEU A 628 -7.548 0.299 -3.520 1.00 25.00 H new ATOM 0 HD23 LEU A 628 -7.407 -1.267 -2.686 1.00 25.00 H new ATOM 715 N VAL A 629 -3.878 -3.876 -5.821 1.00 25.00 N ATOM 716 CA VAL A 629 -2.801 -4.866 -5.598 1.00 25.00 C ATOM 717 C VAL A 629 -1.569 -4.512 -6.454 1.00 25.00 C ATOM 718 O VAL A 629 -0.427 -4.701 -6.028 1.00 25.00 O ATOM 719 CB VAL A 629 -3.299 -6.306 -5.953 1.00 25.00 C ATOM 720 CG1 VAL A 629 -2.205 -7.372 -5.841 1.00 25.00 C ATOM 721 CG2 VAL A 629 -4.492 -6.692 -5.086 1.00 25.00 C ATOM 0 H VAL A 629 -4.747 -4.285 -6.164 1.00 25.00 H new ATOM 0 HA VAL A 629 -2.522 -4.841 -4.545 1.00 25.00 H new ATOM 0 HB VAL A 629 -3.600 -6.271 -7.000 1.00 25.00 H new ATOM 0 HG11 VAL A 629 -2.619 -8.346 -6.101 1.00 25.00 H new ATOM 0 HG12 VAL A 629 -1.390 -7.130 -6.523 1.00 25.00 H new ATOM 0 HG13 VAL A 629 -1.827 -7.399 -4.819 1.00 25.00 H new ATOM 0 HG21 VAL A 629 -4.823 -7.697 -5.349 1.00 25.00 H new ATOM 0 HG22 VAL A 629 -4.201 -6.669 -4.036 1.00 25.00 H new ATOM 0 HG23 VAL A 629 -5.306 -5.987 -5.253 1.00 25.00 H new ATOM 731 N ALA A 630 -1.840 -3.994 -7.657 1.00 25.00 N ATOM 732 CA ALA A 630 -0.801 -3.603 -8.605 1.00 25.00 C ATOM 733 C ALA A 630 -0.215 -2.226 -8.271 1.00 25.00 C ATOM 734 O ALA A 630 0.883 -1.886 -8.723 1.00 25.00 O ATOM 735 CB ALA A 630 -1.375 -3.628 -10.009 1.00 25.00 C ATOM 0 H ALA A 630 -2.788 -3.835 -7.997 1.00 25.00 H new ATOM 0 HA ALA A 630 0.021 -4.316 -8.537 1.00 25.00 H new ATOM 0 HB1 ALA A 630 -0.604 -3.337 -10.722 1.00 25.00 H new ATOM 0 HB2 ALA A 630 -1.723 -4.634 -10.242 1.00 25.00 H new ATOM 0 HB3 ALA A 630 -2.210 -2.931 -10.073 1.00 25.00 H new ATOM 741 N TYR A 631 -0.960 -1.441 -7.473 1.00 25.00 N ATOM 742 CA TYR A 631 -0.456 -0.186 -6.904 1.00 25.00 C ATOM 743 C TYR A 631 0.582 -0.477 -5.803 1.00 25.00 C ATOM 744 O TYR A 631 1.616 0.191 -5.728 1.00 25.00 O ATOM 745 CB TYR A 631 -1.647 0.676 -6.373 1.00 25.00 C ATOM 746 CG TYR A 631 -1.600 2.168 -6.709 1.00 25.00 C ATOM 747 CD1 TYR A 631 -0.410 2.883 -6.588 1.00 25.00 C ATOM 748 CD2 TYR A 631 -2.725 2.844 -7.174 1.00 25.00 C ATOM 749 CE1 TYR A 631 -0.348 4.223 -6.922 1.00 25.00 C ATOM 750 CE2 TYR A 631 -2.667 4.181 -7.506 1.00 25.00 C ATOM 751 CZ TYR A 631 -1.551 4.896 -7.253 1.00 25.00 C ATOM 752 OH TYR A 631 -1.418 6.198 -7.716 1.00 25.00 O ATOM 0 H TYR A 631 -1.920 -1.659 -7.208 1.00 25.00 H new ATOM 0 HA TYR A 631 0.048 0.389 -7.681 1.00 25.00 H new ATOM 0 HB2 TYR A 631 -2.574 0.263 -6.772 1.00 25.00 H new ATOM 0 HB3 TYR A 631 -1.691 0.570 -5.289 1.00 25.00 H new ATOM 0 HD1 TYR A 631 0.477 2.383 -6.228 1.00 25.00 H new ATOM 0 HD2 TYR A 631 -3.659 2.312 -7.276 1.00 25.00 H new ATOM 0 HE1 TYR A 631 0.597 4.746 -6.931 1.00 25.00 H new ATOM 0 HE2 TYR A 631 -3.518 4.658 -7.970 1.00 25.00 H new ATOM 0 HH TYR A 631 -2.304 6.567 -7.915 1.00 25.00 H new ATOM 762 N ALA A 632 0.291 -1.483 -4.967 1.00 25.00 N ATOM 763 CA ALA A 632 1.158 -1.833 -3.840 1.00 25.00 C ATOM 764 C ALA A 632 2.313 -2.742 -4.273 1.00 25.00 C ATOM 765 O ALA A 632 3.363 -2.772 -3.625 1.00 25.00 O ATOM 766 CB ALA A 632 0.350 -2.489 -2.736 1.00 25.00 C ATOM 0 H ALA A 632 -0.540 -2.068 -5.053 1.00 25.00 H new ATOM 0 HA ALA A 632 1.593 -0.909 -3.459 1.00 25.00 H new ATOM 0 HB1 ALA A 632 1.008 -2.743 -1.905 1.00 25.00 H new ATOM 0 HB2 ALA A 632 -0.421 -1.800 -2.390 1.00 25.00 H new ATOM 0 HB3 ALA A 632 -0.119 -3.396 -3.118 1.00 25.00 H new ATOM 772 N LYS A 633 2.105 -3.476 -5.379 1.00 25.00 N ATOM 773 CA LYS A 633 3.146 -4.321 -5.981 1.00 25.00 C ATOM 774 C LYS A 633 4.200 -3.459 -6.698 1.00 25.00 C ATOM 775 O LYS A 633 5.339 -3.887 -6.904 1.00 25.00 O ATOM 776 CB LYS A 633 2.503 -5.287 -6.990 1.00 25.00 C ATOM 777 CG LYS A 633 1.977 -6.594 -6.392 1.00 25.00 C ATOM 778 CD LYS A 633 1.326 -7.485 -7.448 1.00 25.00 C ATOM 779 CE LYS A 633 1.230 -8.940 -6.997 1.00 25.00 C ATOM 780 NZ LYS A 633 0.132 -9.677 -7.689 1.00 25.00 N ATOM 0 H LYS A 633 1.215 -3.499 -5.877 1.00 25.00 H new ATOM 0 HA LYS A 633 3.637 -4.885 -5.188 1.00 25.00 H new ATOM 0 HB2 LYS A 633 1.679 -4.774 -7.486 1.00 25.00 H new ATOM 0 HB3 LYS A 633 3.237 -5.527 -7.759 1.00 25.00 H new ATOM 0 HG2 LYS A 633 2.798 -7.133 -5.919 1.00 25.00 H new ATOM 0 HG3 LYS A 633 1.252 -6.369 -5.610 1.00 25.00 H new ATOM 0 HD2 LYS A 633 0.328 -7.109 -7.672 1.00 25.00 H new ATOM 0 HD3 LYS A 633 1.902 -7.430 -8.372 1.00 25.00 H new ATOM 0 HE2 LYS A 633 2.179 -9.441 -7.190 1.00 25.00 H new ATOM 0 HE3 LYS A 633 1.065 -8.974 -5.920 1.00 25.00 H new ATOM 0 HZ1 LYS A 633 0.106 -10.660 -7.350 1.00 25.00 H new ATOM 0 HZ2 LYS A 633 -0.778 -9.216 -7.485 1.00 25.00 H new ATOM 0 HZ3 LYS A 633 0.301 -9.669 -8.715 1.00 25.00 H new ATOM 794 N LYS A 634 3.786 -2.234 -7.062 1.00 25.00 N ATOM 795 CA LYS A 634 4.629 -1.276 -7.785 1.00 25.00 C ATOM 796 C LYS A 634 5.504 -0.453 -6.822 1.00 25.00 C ATOM 797 O LYS A 634 6.651 -0.132 -7.149 1.00 25.00 O ATOM 798 CB LYS A 634 3.726 -0.351 -8.628 1.00 25.00 C ATOM 799 CG LYS A 634 4.471 0.661 -9.511 1.00 25.00 C ATOM 800 CD LYS A 634 3.517 1.553 -10.310 1.00 25.00 C ATOM 801 CE LYS A 634 4.250 2.456 -11.300 1.00 25.00 C ATOM 802 NZ LYS A 634 5.199 3.377 -10.616 1.00 25.00 N ATOM 0 H LYS A 634 2.850 -1.881 -6.860 1.00 25.00 H new ATOM 0 HA LYS A 634 5.305 -1.826 -8.439 1.00 25.00 H new ATOM 0 HB2 LYS A 634 3.094 -0.969 -9.265 1.00 25.00 H new ATOM 0 HB3 LYS A 634 3.064 0.195 -7.956 1.00 25.00 H new ATOM 0 HG2 LYS A 634 5.109 1.285 -8.885 1.00 25.00 H new ATOM 0 HG3 LYS A 634 5.126 0.126 -10.199 1.00 25.00 H new ATOM 0 HD2 LYS A 634 2.807 0.927 -10.851 1.00 25.00 H new ATOM 0 HD3 LYS A 634 2.938 2.169 -9.621 1.00 25.00 H new ATOM 0 HE2 LYS A 634 4.794 1.842 -12.017 1.00 25.00 H new ATOM 0 HE3 LYS A 634 3.523 3.039 -11.866 1.00 25.00 H new ATOM 0 HZ1 LYS A 634 5.625 4.018 -11.315 1.00 25.00 H new ATOM 0 HZ2 LYS A 634 4.688 3.934 -9.902 1.00 25.00 H new ATOM 0 HZ3 LYS A 634 5.947 2.823 -10.153 1.00 25.00 H new ATOM 816 N VAL A 635 4.955 -0.121 -5.643 1.00 25.00 N ATOM 817 CA VAL A 635 5.637 0.768 -4.686 1.00 25.00 C ATOM 818 C VAL A 635 6.809 0.070 -3.975 1.00 25.00 C ATOM 819 O VAL A 635 7.887 0.652 -3.844 1.00 25.00 O ATOM 820 CB VAL A 635 4.656 1.386 -3.634 1.00 25.00 C ATOM 821 CG1 VAL A 635 5.420 2.015 -2.479 1.00 25.00 C ATOM 822 CG2 VAL A 635 3.692 2.410 -4.243 1.00 25.00 C ATOM 0 H VAL A 635 4.043 -0.453 -5.329 1.00 25.00 H new ATOM 0 HA VAL A 635 6.041 1.585 -5.284 1.00 25.00 H new ATOM 0 HB VAL A 635 4.053 0.558 -3.260 1.00 25.00 H new ATOM 0 HG11 VAL A 635 4.715 2.437 -1.763 1.00 25.00 H new ATOM 0 HG12 VAL A 635 6.026 1.254 -1.987 1.00 25.00 H new ATOM 0 HG13 VAL A 635 6.068 2.805 -2.859 1.00 25.00 H new ATOM 0 HG21 VAL A 635 3.038 2.802 -3.464 1.00 25.00 H new ATOM 0 HG22 VAL A 635 4.261 3.228 -4.685 1.00 25.00 H new ATOM 0 HG23 VAL A 635 3.090 1.929 -5.014 1.00 25.00 H new ATOM 832 N GLU A 636 6.589 -1.191 -3.559 1.00 25.00 N ATOM 833 CA GLU A 636 7.571 -1.986 -2.790 1.00 25.00 C ATOM 834 C GLU A 636 8.928 -2.100 -3.515 1.00 25.00 C ATOM 835 O GLU A 636 9.978 -2.172 -2.867 1.00 25.00 O ATOM 836 CB GLU A 636 7.004 -3.399 -2.553 1.00 25.00 C ATOM 837 CG GLU A 636 6.696 -4.205 -3.817 1.00 25.00 C ATOM 838 CD GLU A 636 7.867 -5.040 -4.315 1.00 25.00 C ATOM 839 OE1 GLU A 636 8.881 -5.128 -3.592 1.00 25.00 O ATOM 840 OE2 GLU A 636 7.766 -5.605 -5.423 1.00 25.00 O ATOM 0 H GLU A 636 5.721 -1.692 -3.747 1.00 25.00 H new ATOM 0 HA GLU A 636 7.743 -1.473 -1.844 1.00 25.00 H new ATOM 0 HB2 GLU A 636 7.716 -3.961 -1.949 1.00 25.00 H new ATOM 0 HB3 GLU A 636 6.089 -3.311 -1.967 1.00 25.00 H new ATOM 0 HG2 GLU A 636 5.850 -4.864 -3.619 1.00 25.00 H new ATOM 0 HG3 GLU A 636 6.388 -3.520 -4.607 1.00 25.00 H new ATOM 847 N GLY A 637 8.886 -2.109 -4.858 1.00 25.00 N ATOM 848 CA GLY A 637 10.100 -2.191 -5.670 1.00 25.00 C ATOM 849 C GLY A 637 10.866 -0.875 -5.743 1.00 25.00 C ATOM 850 O GLY A 637 12.053 -0.864 -6.078 1.00 25.00 O ATOM 0 H GLY A 637 8.023 -2.060 -5.399 1.00 25.00 H new ATOM 0 HA2 GLY A 637 10.753 -2.961 -5.259 1.00 25.00 H new ATOM 0 HA3 GLY A 637 9.833 -2.505 -6.679 1.00 25.00 H new ATOM 854 N ASP A 638 10.176 0.231 -5.428 1.00 25.00 N ATOM 855 CA ASP A 638 10.780 1.568 -5.428 1.00 25.00 C ATOM 856 C ASP A 638 11.489 1.856 -4.090 1.00 25.00 C ATOM 857 O ASP A 638 12.348 2.741 -4.018 1.00 25.00 O ATOM 858 CB ASP A 638 9.698 2.625 -5.706 1.00 25.00 C ATOM 859 CG ASP A 638 9.274 2.682 -7.167 1.00 25.00 C ATOM 860 OD1 ASP A 638 10.021 2.168 -8.023 1.00 25.00 O ATOM 861 OD2 ASP A 638 8.192 3.242 -7.450 1.00 25.00 O ATOM 0 H ASP A 638 9.190 0.223 -5.168 1.00 25.00 H new ATOM 0 HA ASP A 638 11.532 1.611 -6.216 1.00 25.00 H new ATOM 0 HB2 ASP A 638 8.825 2.412 -5.089 1.00 25.00 H new ATOM 0 HB3 ASP A 638 10.070 3.604 -5.404 1.00 25.00 H new ATOM 866 N MET A 639 11.127 1.096 -3.040 1.00 25.00 N ATOM 867 CA MET A 639 11.750 1.234 -1.712 1.00 25.00 C ATOM 868 C MET A 639 13.160 0.628 -1.666 1.00 25.00 C ATOM 869 O MET A 639 13.965 0.979 -0.797 1.00 25.00 O ATOM 870 CB MET A 639 10.884 0.584 -0.625 1.00 25.00 C ATOM 871 CG MET A 639 9.498 1.175 -0.521 1.00 25.00 C ATOM 872 SD MET A 639 8.616 0.619 0.937 1.00 25.00 S ATOM 873 CE MET A 639 9.121 -1.091 0.970 1.00 25.00 C ATOM 0 H MET A 639 10.404 0.378 -3.087 1.00 25.00 H new ATOM 0 HA MET A 639 11.831 2.304 -1.521 1.00 25.00 H new ATOM 0 HB2 MET A 639 10.800 -0.483 -0.829 1.00 25.00 H new ATOM 0 HB3 MET A 639 11.386 0.686 0.337 1.00 25.00 H new ATOM 0 HG2 MET A 639 9.572 2.262 -0.503 1.00 25.00 H new ATOM 0 HG3 MET A 639 8.926 0.909 -1.410 1.00 25.00 H new ATOM 0 HE1 MET A 639 8.448 -1.657 1.614 1.00 25.00 H new ATOM 0 HE2 MET A 639 9.086 -1.500 -0.040 1.00 25.00 H new ATOM 0 HE3 MET A 639 10.138 -1.163 1.356 1.00 25.00 H new ATOM 883 N TYR A 640 13.445 -0.277 -2.612 1.00 25.00 N ATOM 884 CA TYR A 640 14.731 -0.982 -2.678 1.00 25.00 C ATOM 885 C TYR A 640 15.820 -0.095 -3.304 1.00 25.00 C ATOM 886 O TYR A 640 16.997 -0.203 -2.950 1.00 25.00 O ATOM 887 CB TYR A 640 14.553 -2.272 -3.497 1.00 25.00 C ATOM 888 CG TYR A 640 15.676 -3.282 -3.353 1.00 25.00 C ATOM 889 CD1 TYR A 640 15.753 -4.101 -2.232 1.00 25.00 C ATOM 890 CD2 TYR A 640 16.646 -3.430 -4.339 1.00 25.00 C ATOM 891 CE1 TYR A 640 16.761 -5.035 -2.096 1.00 25.00 C ATOM 892 CE2 TYR A 640 17.660 -4.363 -4.207 1.00 25.00 C ATOM 893 CZ TYR A 640 17.711 -5.161 -3.085 1.00 25.00 C ATOM 894 OH TYR A 640 18.713 -6.095 -2.951 1.00 25.00 O ATOM 0 H TYR A 640 12.792 -0.540 -3.351 1.00 25.00 H new ATOM 0 HA TYR A 640 15.052 -1.229 -1.666 1.00 25.00 H new ATOM 0 HB2 TYR A 640 13.617 -2.746 -3.201 1.00 25.00 H new ATOM 0 HB3 TYR A 640 14.456 -2.006 -4.550 1.00 25.00 H new ATOM 0 HD1 TYR A 640 15.011 -4.005 -1.453 1.00 25.00 H new ATOM 0 HD2 TYR A 640 16.607 -2.808 -5.221 1.00 25.00 H new ATOM 0 HE1 TYR A 640 16.804 -5.663 -1.219 1.00 25.00 H new ATOM 0 HE2 TYR A 640 18.408 -4.465 -4.980 1.00 25.00 H new ATOM 0 HH TYR A 640 18.991 -6.406 -3.838 1.00 25.00 H new ATOM 904 N GLU A 641 15.406 0.778 -4.238 1.00 25.00 N ATOM 905 CA GLU A 641 16.322 1.699 -4.927 1.00 25.00 C ATOM 906 C GLU A 641 16.479 3.031 -4.176 1.00 25.00 C ATOM 907 O GLU A 641 17.514 3.694 -4.298 1.00 25.00 O ATOM 908 CB GLU A 641 15.831 1.975 -6.361 1.00 25.00 C ATOM 909 CG GLU A 641 15.818 0.758 -7.279 1.00 25.00 C ATOM 910 CD GLU A 641 17.183 0.104 -7.439 1.00 25.00 C ATOM 911 OE1 GLU A 641 18.156 0.827 -7.743 1.00 25.00 O ATOM 912 OE2 GLU A 641 17.276 -1.129 -7.260 1.00 25.00 O ATOM 0 H GLU A 641 14.434 0.864 -4.534 1.00 25.00 H new ATOM 0 HA GLU A 641 17.297 1.212 -4.958 1.00 25.00 H new ATOM 0 HB2 GLU A 641 14.823 2.386 -6.312 1.00 25.00 H new ATOM 0 HB3 GLU A 641 16.466 2.741 -6.806 1.00 25.00 H new ATOM 0 HG2 GLU A 641 15.116 0.023 -6.885 1.00 25.00 H new ATOM 0 HG3 GLU A 641 15.450 1.057 -8.260 1.00 25.00 H new ATOM 919 N SER A 642 15.451 3.409 -3.400 1.00 25.00 N ATOM 920 CA SER A 642 15.413 4.714 -2.725 1.00 25.00 C ATOM 921 C SER A 642 16.070 4.669 -1.336 1.00 25.00 C ATOM 922 O SER A 642 16.868 5.549 -0.998 1.00 25.00 O ATOM 923 CB SER A 642 13.959 5.197 -2.612 1.00 25.00 C ATOM 924 OG SER A 642 13.373 5.388 -3.891 1.00 25.00 O ATOM 0 H SER A 642 14.633 2.826 -3.225 1.00 25.00 H new ATOM 0 HA SER A 642 15.988 5.417 -3.329 1.00 25.00 H new ATOM 0 HB2 SER A 642 13.376 4.469 -2.048 1.00 25.00 H new ATOM 0 HB3 SER A 642 13.928 6.132 -2.053 1.00 25.00 H new ATOM 0 HG SER A 642 12.930 4.561 -4.175 1.00 25.00 H new ATOM 930 N ALA A 643 15.730 3.643 -0.543 1.00 25.00 N ATOM 931 CA ALA A 643 16.254 3.495 0.819 1.00 25.00 C ATOM 932 C ALA A 643 17.630 2.820 0.844 1.00 25.00 C ATOM 933 O ALA A 643 17.970 2.043 -0.055 1.00 25.00 O ATOM 934 CB ALA A 643 15.269 2.702 1.657 1.00 25.00 C ATOM 0 H ALA A 643 15.090 2.900 -0.825 1.00 25.00 H new ATOM 0 HA ALA A 643 16.380 4.494 1.236 1.00 25.00 H new ATOM 0 HB1 ALA A 643 15.658 2.592 2.669 1.00 25.00 H new ATOM 0 HB2 ALA A 643 14.314 3.227 1.690 1.00 25.00 H new ATOM 0 HB3 ALA A 643 15.126 1.716 1.214 1.00 25.00 H new ATOM 940 N ASN A 644 18.412 3.131 1.889 1.00 25.00 N ATOM 941 CA ASN A 644 19.758 2.567 2.069 1.00 25.00 C ATOM 942 C ASN A 644 19.840 1.659 3.310 1.00 25.00 C ATOM 943 O ASN A 644 20.805 0.903 3.467 1.00 25.00 O ATOM 944 CB ASN A 644 20.812 3.693 2.159 1.00 25.00 C ATOM 945 CG ASN A 644 20.992 4.470 0.858 1.00 25.00 C ATOM 946 OD1 ASN A 644 21.473 3.931 -0.139 1.00 25.00 O ATOM 947 ND2 ASN A 644 20.591 5.737 0.866 1.00 25.00 N ATOM 0 H ASN A 644 18.132 3.776 2.628 1.00 25.00 H new ATOM 0 HA ASN A 644 19.970 1.951 1.195 1.00 25.00 H new ATOM 0 HB2 ASN A 644 20.523 4.386 2.949 1.00 25.00 H new ATOM 0 HB3 ASN A 644 21.769 3.260 2.449 1.00 25.00 H new ATOM 0 HD21 ASN A 644 20.676 6.304 0.023 1.00 25.00 H new ATOM 0 HD22 ASN A 644 20.198 6.142 1.716 1.00 25.00 H new ATOM 954 N SER A 645 18.823 1.744 4.179 1.00 25.00 N ATOM 955 CA SER A 645 18.778 0.962 5.421 1.00 25.00 C ATOM 956 C SER A 645 17.410 0.290 5.581 1.00 25.00 C ATOM 957 O SER A 645 16.433 0.697 4.948 1.00 25.00 O ATOM 958 CB SER A 645 19.074 1.868 6.630 1.00 25.00 C ATOM 959 OG SER A 645 18.031 2.807 6.844 1.00 25.00 O ATOM 0 H SER A 645 18.015 2.352 4.042 1.00 25.00 H new ATOM 0 HA SER A 645 19.541 0.185 5.371 1.00 25.00 H new ATOM 0 HB2 SER A 645 19.202 1.255 7.522 1.00 25.00 H new ATOM 0 HB3 SER A 645 20.013 2.397 6.469 1.00 25.00 H new ATOM 0 HG SER A 645 18.248 3.366 7.619 1.00 25.00 H new ATOM 965 N ARG A 646 17.358 -0.745 6.440 1.00 25.00 N ATOM 966 CA ARG A 646 16.153 -1.572 6.618 1.00 25.00 C ATOM 967 C ARG A 646 15.061 -0.838 7.419 1.00 25.00 C ATOM 968 O ARG A 646 13.878 -1.172 7.305 1.00 25.00 O ATOM 969 CB ARG A 646 16.527 -2.894 7.307 1.00 25.00 C ATOM 970 CG ARG A 646 15.357 -3.866 7.478 1.00 25.00 C ATOM 971 CD ARG A 646 15.796 -5.185 8.106 1.00 25.00 C ATOM 972 NE ARG A 646 16.534 -4.990 9.362 1.00 25.00 N ATOM 973 CZ ARG A 646 15.971 -4.724 10.551 1.00 25.00 C ATOM 974 NH1 ARG A 646 14.649 -4.619 10.681 1.00 25.00 N ATOM 975 NH2 ARG A 646 16.740 -4.564 11.619 1.00 25.00 N ATOM 0 H ARG A 646 18.144 -1.029 7.025 1.00 25.00 H new ATOM 0 HA ARG A 646 15.742 -1.780 5.630 1.00 25.00 H new ATOM 0 HB2 ARG A 646 17.310 -3.384 6.728 1.00 25.00 H new ATOM 0 HB3 ARG A 646 16.947 -2.673 8.288 1.00 25.00 H new ATOM 0 HG2 ARG A 646 14.591 -3.405 8.102 1.00 25.00 H new ATOM 0 HG3 ARG A 646 14.903 -4.061 6.507 1.00 25.00 H new ATOM 0 HD2 ARG A 646 14.919 -5.804 8.296 1.00 25.00 H new ATOM 0 HD3 ARG A 646 16.423 -5.729 7.400 1.00 25.00 H new ATOM 0 HE ARG A 646 17.551 -5.062 9.327 1.00 25.00 H new ATOM 0 HH11 ARG A 646 14.045 -4.741 9.868 1.00 25.00 H new ATOM 0 HH12 ARG A 646 14.241 -4.416 11.594 1.00 25.00 H new ATOM 0 HH21 ARG A 646 17.753 -4.643 11.534 1.00 25.00 H new ATOM 0 HH22 ARG A 646 16.318 -4.362 12.525 1.00 25.00 H new ATOM 989 N ASP A 647 15.471 0.148 8.233 1.00 25.00 N ATOM 990 CA ASP A 647 14.530 0.979 9.002 1.00 25.00 C ATOM 991 C ASP A 647 13.936 2.100 8.139 1.00 25.00 C ATOM 992 O ASP A 647 12.834 2.583 8.414 1.00 25.00 O ATOM 993 CB ASP A 647 15.219 1.577 10.236 1.00 25.00 C ATOM 994 CG ASP A 647 15.496 0.544 11.315 1.00 25.00 C ATOM 995 OD1 ASP A 647 15.021 -0.603 11.175 1.00 25.00 O ATOM 996 OD2 ASP A 647 16.189 0.883 12.297 1.00 25.00 O ATOM 0 H ASP A 647 16.452 0.390 8.376 1.00 25.00 H new ATOM 0 HA ASP A 647 13.715 0.333 9.328 1.00 25.00 H new ATOM 0 HB2 ASP A 647 16.158 2.040 9.933 1.00 25.00 H new ATOM 0 HB3 ASP A 647 14.592 2.368 10.649 1.00 25.00 H new ATOM 1001 N GLU A 648 14.680 2.501 7.096 1.00 25.00 N ATOM 1002 CA GLU A 648 14.217 3.506 6.133 1.00 25.00 C ATOM 1003 C GLU A 648 13.380 2.837 5.032 1.00 25.00 C ATOM 1004 O GLU A 648 12.341 3.360 4.633 1.00 25.00 O ATOM 1005 CB GLU A 648 15.422 4.257 5.532 1.00 25.00 C ATOM 1006 CG GLU A 648 15.056 5.482 4.695 1.00 25.00 C ATOM 1007 CD GLU A 648 14.320 6.539 5.496 1.00 25.00 C ATOM 1008 OE1 GLU A 648 14.764 6.848 6.622 1.00 25.00 O ATOM 1009 OE2 GLU A 648 13.298 7.056 5.000 1.00 25.00 O ATOM 0 H GLU A 648 15.613 2.139 6.899 1.00 25.00 H new ATOM 0 HA GLU A 648 13.585 4.230 6.647 1.00 25.00 H new ATOM 0 HB2 GLU A 648 16.079 4.571 6.343 1.00 25.00 H new ATOM 0 HB3 GLU A 648 15.991 3.566 4.910 1.00 25.00 H new ATOM 0 HG2 GLU A 648 15.964 5.916 4.277 1.00 25.00 H new ATOM 0 HG3 GLU A 648 14.435 5.171 3.855 1.00 25.00 H new ATOM 1016 N TYR A 649 13.847 1.666 4.570 1.00 25.00 N ATOM 1017 CA TYR A 649 13.158 0.862 3.547 1.00 25.00 C ATOM 1018 C TYR A 649 11.722 0.510 3.985 1.00 25.00 C ATOM 1019 O TYR A 649 10.769 0.702 3.225 1.00 25.00 O ATOM 1020 CB TYR A 649 14.014 -0.399 3.270 1.00 25.00 C ATOM 1021 CG TYR A 649 13.413 -1.436 2.336 1.00 25.00 C ATOM 1022 CD1 TYR A 649 13.516 -1.320 0.948 1.00 25.00 C ATOM 1023 CD2 TYR A 649 12.754 -2.541 2.853 1.00 25.00 C ATOM 1024 CE1 TYR A 649 12.977 -2.283 0.117 1.00 25.00 C ATOM 1025 CE2 TYR A 649 12.211 -3.499 2.030 1.00 25.00 C ATOM 1026 CZ TYR A 649 12.284 -3.346 0.661 1.00 25.00 C ATOM 1027 OH TYR A 649 11.747 -4.396 -0.056 1.00 25.00 O ATOM 0 H TYR A 649 14.718 1.248 4.897 1.00 25.00 H new ATOM 0 HA TYR A 649 13.055 1.434 2.625 1.00 25.00 H new ATOM 0 HB2 TYR A 649 14.969 -0.078 2.854 1.00 25.00 H new ATOM 0 HB3 TYR A 649 14.228 -0.882 4.223 1.00 25.00 H new ATOM 0 HD1 TYR A 649 14.023 -0.468 0.520 1.00 25.00 H new ATOM 0 HD2 TYR A 649 12.666 -2.651 3.924 1.00 25.00 H new ATOM 0 HE1 TYR A 649 13.097 -2.205 -0.953 1.00 25.00 H new ATOM 0 HE2 TYR A 649 11.729 -4.368 2.454 1.00 25.00 H new ATOM 0 HH TYR A 649 11.307 -5.020 0.558 1.00 25.00 H new ATOM 1037 N TYR A 650 11.598 -0.005 5.213 1.00 25.00 N ATOM 1038 CA TYR A 650 10.299 -0.277 5.840 1.00 25.00 C ATOM 1039 C TYR A 650 9.493 1.005 6.135 1.00 25.00 C ATOM 1040 O TYR A 650 8.283 0.933 6.379 1.00 25.00 O ATOM 1041 CB TYR A 650 10.511 -1.067 7.140 1.00 25.00 C ATOM 1042 CG TYR A 650 11.031 -2.479 6.932 1.00 25.00 C ATOM 1043 CD1 TYR A 650 11.077 -3.047 5.661 1.00 25.00 C ATOM 1044 CD2 TYR A 650 11.470 -3.247 8.006 1.00 25.00 C ATOM 1045 CE1 TYR A 650 11.539 -4.330 5.468 1.00 25.00 C ATOM 1046 CE2 TYR A 650 11.937 -4.535 7.819 1.00 25.00 C ATOM 1047 CZ TYR A 650 12.000 -5.060 6.553 1.00 25.00 C ATOM 1048 OH TYR A 650 12.424 -6.356 6.362 1.00 25.00 O ATOM 0 H TYR A 650 12.396 -0.245 5.801 1.00 25.00 H new ATOM 0 HA TYR A 650 9.716 -0.862 5.129 1.00 25.00 H new ATOM 0 HB2 TYR A 650 11.212 -0.523 7.772 1.00 25.00 H new ATOM 0 HB3 TYR A 650 9.566 -1.116 7.681 1.00 25.00 H new ATOM 0 HD1 TYR A 650 10.744 -2.470 4.811 1.00 25.00 H new ATOM 0 HD2 TYR A 650 11.446 -2.830 9.002 1.00 25.00 H new ATOM 0 HE1 TYR A 650 11.542 -4.764 4.479 1.00 25.00 H new ATOM 0 HE2 TYR A 650 12.251 -5.126 8.667 1.00 25.00 H new ATOM 0 HH TYR A 650 12.718 -6.733 7.217 1.00 25.00 H new ATOM 1058 N HIS A 651 10.164 2.170 6.102 1.00 25.00 N ATOM 1059 CA HIS A 651 9.534 3.450 6.458 1.00 25.00 C ATOM 1060 C HIS A 651 8.742 4.054 5.287 1.00 25.00 C ATOM 1061 O HIS A 651 7.628 4.532 5.497 1.00 25.00 O ATOM 1062 CB HIS A 651 10.593 4.440 6.975 1.00 25.00 C ATOM 1063 CG HIS A 651 10.058 5.809 7.303 1.00 25.00 C ATOM 1064 ND1 HIS A 651 9.204 6.049 8.358 1.00 25.00 N ATOM 1065 CD2 HIS A 651 10.248 7.006 6.695 1.00 25.00 C ATOM 1066 CE1 HIS A 651 8.891 7.334 8.386 1.00 25.00 C ATOM 1067 NE2 HIS A 651 9.512 7.935 7.388 1.00 25.00 N ATOM 0 H HIS A 651 11.144 2.249 5.832 1.00 25.00 H new ATOM 0 HA HIS A 651 8.817 3.252 7.255 1.00 25.00 H new ATOM 0 HB2 HIS A 651 11.058 4.022 7.868 1.00 25.00 H new ATOM 0 HB3 HIS A 651 11.377 4.540 6.224 1.00 25.00 H new ATOM 0 HD2 HIS A 651 10.863 7.194 5.828 1.00 25.00 H new ATOM 0 HE1 HIS A 651 8.239 7.810 9.103 1.00 25.00 H new ATOM 0 HE2 HIS A 651 9.454 8.929 7.167 1.00 25.00 H new ATOM 1076 N LEU A 652 9.302 4.019 4.057 1.00 25.00 N ATOM 1077 CA LEU A 652 8.603 4.526 2.863 1.00 25.00 C ATOM 1078 C LEU A 652 7.271 3.790 2.611 1.00 25.00 C ATOM 1079 O LEU A 652 6.378 4.324 1.947 1.00 25.00 O ATOM 1080 CB LEU A 652 9.500 4.396 1.612 1.00 25.00 C ATOM 1081 CG LEU A 652 10.830 5.193 1.544 1.00 25.00 C ATOM 1082 CD1 LEU A 652 11.658 4.853 0.309 1.00 25.00 C ATOM 1083 CD2 LEU A 652 10.593 6.692 1.647 1.00 25.00 C ATOM 0 H LEU A 652 10.233 3.646 3.869 1.00 25.00 H new ATOM 0 HA LEU A 652 8.381 5.576 3.052 1.00 25.00 H new ATOM 0 HB2 LEU A 652 9.744 3.340 1.493 1.00 25.00 H new ATOM 0 HB3 LEU A 652 8.901 4.684 0.748 1.00 25.00 H new ATOM 0 HG LEU A 652 11.414 4.884 2.411 1.00 25.00 H new ATOM 0 HD11 LEU A 652 12.577 5.440 0.314 1.00 25.00 H new ATOM 0 HD12 LEU A 652 11.905 3.792 0.318 1.00 25.00 H new ATOM 0 HD13 LEU A 652 11.084 5.084 -0.589 1.00 25.00 H new ATOM 0 HD21 LEU A 652 11.548 7.216 1.596 1.00 25.00 H new ATOM 0 HD22 LEU A 652 9.956 7.017 0.824 1.00 25.00 H new ATOM 0 HD23 LEU A 652 10.105 6.919 2.595 1.00 25.00 H new ATOM 1095 N LEU A 653 7.157 2.566 3.152 1.00 25.00 N ATOM 1096 CA LEU A 653 5.936 1.758 3.046 1.00 25.00 C ATOM 1097 C LEU A 653 4.967 2.080 4.186 1.00 25.00 C ATOM 1098 O LEU A 653 3.748 2.087 3.991 1.00 25.00 O ATOM 1099 CB LEU A 653 6.278 0.264 3.071 1.00 25.00 C ATOM 1100 CG LEU A 653 5.094 -0.708 2.984 1.00 25.00 C ATOM 1101 CD1 LEU A 653 5.048 -1.338 1.614 1.00 25.00 C ATOM 1102 CD2 LEU A 653 5.170 -1.787 4.047 1.00 25.00 C ATOM 0 H LEU A 653 7.907 2.112 3.673 1.00 25.00 H new ATOM 0 HA LEU A 653 5.456 2.001 2.098 1.00 25.00 H new ATOM 0 HB2 LEU A 653 6.954 0.054 2.242 1.00 25.00 H new ATOM 0 HB3 LEU A 653 6.826 0.054 3.990 1.00 25.00 H new ATOM 0 HG LEU A 653 4.182 -0.137 3.157 1.00 25.00 H new ATOM 0 HD11 LEU A 653 4.205 -2.027 1.559 1.00 25.00 H new ATOM 0 HD12 LEU A 653 4.931 -0.560 0.860 1.00 25.00 H new ATOM 0 HD13 LEU A 653 5.975 -1.883 1.433 1.00 25.00 H new ATOM 0 HD21 LEU A 653 4.313 -2.454 3.950 1.00 25.00 H new ATOM 0 HD22 LEU A 653 6.090 -2.358 3.921 1.00 25.00 H new ATOM 0 HD23 LEU A 653 5.161 -1.326 5.035 1.00 25.00 H new ATOM 1114 N ALA A 654 5.529 2.347 5.378 1.00 25.00 N ATOM 1115 CA ALA A 654 4.745 2.723 6.562 1.00 25.00 C ATOM 1116 C ALA A 654 4.206 4.155 6.448 1.00 25.00 C ATOM 1117 O ALA A 654 3.226 4.510 7.109 1.00 25.00 O ATOM 1118 CB ALA A 654 5.589 2.577 7.819 1.00 25.00 C ATOM 0 H ALA A 654 6.535 2.308 5.545 1.00 25.00 H new ATOM 0 HA ALA A 654 3.890 2.049 6.624 1.00 25.00 H new ATOM 0 HB1 ALA A 654 4.997 2.859 8.690 1.00 25.00 H new ATOM 0 HB2 ALA A 654 5.914 1.542 7.921 1.00 25.00 H new ATOM 0 HB3 ALA A 654 6.462 3.226 7.749 1.00 25.00 H new ATOM 1124 N GLU A 655 4.860 4.966 5.598 1.00 25.00 N ATOM 1125 CA GLU A 655 4.445 6.357 5.355 1.00 25.00 C ATOM 1126 C GLU A 655 3.200 6.441 4.471 1.00 25.00 C ATOM 1127 O GLU A 655 2.341 7.289 4.707 1.00 25.00 O ATOM 1128 CB GLU A 655 5.584 7.178 4.734 1.00 25.00 C ATOM 1129 CG GLU A 655 5.241 8.644 4.504 1.00 25.00 C ATOM 1130 CD GLU A 655 6.407 9.438 3.948 1.00 25.00 C ATOM 1131 OE1 GLU A 655 7.479 8.837 3.722 1.00 25.00 O ATOM 1132 OE2 GLU A 655 6.251 10.660 3.741 1.00 25.00 O ATOM 0 H GLU A 655 5.682 4.679 5.066 1.00 25.00 H new ATOM 0 HA GLU A 655 4.195 6.780 6.328 1.00 25.00 H new ATOM 0 HB2 GLU A 655 6.457 7.118 5.384 1.00 25.00 H new ATOM 0 HB3 GLU A 655 5.864 6.728 3.782 1.00 25.00 H new ATOM 0 HG2 GLU A 655 4.399 8.712 3.815 1.00 25.00 H new ATOM 0 HG3 GLU A 655 4.919 9.090 5.445 1.00 25.00 H new ATOM 1139 N LYS A 656 3.105 5.561 3.457 1.00 25.00 N ATOM 1140 CA LYS A 656 1.879 5.434 2.638 1.00 25.00 C ATOM 1141 C LYS A 656 0.754 4.839 3.489 1.00 25.00 C ATOM 1142 O LYS A 656 -0.417 5.134 3.278 1.00 25.00 O ATOM 1143 CB LYS A 656 2.101 4.524 1.413 1.00 25.00 C ATOM 1144 CG LYS A 656 3.010 5.085 0.311 1.00 25.00 C ATOM 1145 CD LYS A 656 2.410 6.306 -0.380 1.00 25.00 C ATOM 1146 CE LYS A 656 3.317 6.815 -1.490 1.00 25.00 C ATOM 1147 NZ LYS A 656 2.708 7.959 -2.222 1.00 25.00 N ATOM 0 H LYS A 656 3.857 4.929 3.184 1.00 25.00 H new ATOM 0 HA LYS A 656 1.614 6.431 2.286 1.00 25.00 H new ATOM 0 HB2 LYS A 656 2.523 3.580 1.759 1.00 25.00 H new ATOM 0 HB3 LYS A 656 1.130 4.297 0.974 1.00 25.00 H new ATOM 0 HG2 LYS A 656 3.974 5.354 0.742 1.00 25.00 H new ATOM 0 HG3 LYS A 656 3.198 4.308 -0.430 1.00 25.00 H new ATOM 0 HD2 LYS A 656 1.435 6.050 -0.793 1.00 25.00 H new ATOM 0 HD3 LYS A 656 2.248 7.097 0.352 1.00 25.00 H new ATOM 0 HE2 LYS A 656 4.273 7.123 -1.066 1.00 25.00 H new ATOM 0 HE3 LYS A 656 3.525 6.005 -2.190 1.00 25.00 H new ATOM 0 HZ1 LYS A 656 3.457 8.517 -2.679 1.00 25.00 H new ATOM 0 HZ2 LYS A 656 2.054 7.599 -2.946 1.00 25.00 H new ATOM 0 HZ3 LYS A 656 2.187 8.561 -1.553 1.00 25.00 H new ATOM 1161 N ILE A 657 1.149 4.039 4.494 1.00 25.00 N ATOM 1162 CA ILE A 657 0.205 3.325 5.362 1.00 25.00 C ATOM 1163 C ILE A 657 -0.494 4.301 6.325 1.00 25.00 C ATOM 1164 O ILE A 657 -1.699 4.195 6.555 1.00 25.00 O ATOM 1165 CB ILE A 657 0.943 2.156 6.116 1.00 25.00 C ATOM 1166 CG1 ILE A 657 1.050 0.930 5.169 1.00 25.00 C ATOM 1167 CG2 ILE A 657 0.280 1.781 7.457 1.00 25.00 C ATOM 1168 CD1 ILE A 657 1.888 -0.241 5.684 1.00 25.00 C ATOM 0 H ILE A 657 2.128 3.871 4.725 1.00 25.00 H new ATOM 0 HA ILE A 657 -0.578 2.875 4.751 1.00 25.00 H new ATOM 0 HB ILE A 657 1.941 2.505 6.380 1.00 25.00 H new ATOM 0 HG12 ILE A 657 0.043 0.567 4.961 1.00 25.00 H new ATOM 0 HG13 ILE A 657 1.471 1.264 4.221 1.00 25.00 H new ATOM 0 HG21 ILE A 657 0.838 0.970 7.924 1.00 25.00 H new ATOM 0 HG22 ILE A 657 0.279 2.648 8.117 1.00 25.00 H new ATOM 0 HG23 ILE A 657 -0.746 1.460 7.278 1.00 25.00 H new ATOM 0 HD11 ILE A 657 1.893 -1.039 4.942 1.00 25.00 H new ATOM 0 HD12 ILE A 657 2.910 0.094 5.863 1.00 25.00 H new ATOM 0 HD13 ILE A 657 1.460 -0.613 6.615 1.00 25.00 H new ATOM 1180 N TYR A 658 0.276 5.247 6.873 1.00 25.00 N ATOM 1181 CA TYR A 658 -0.268 6.278 7.761 1.00 25.00 C ATOM 1182 C TYR A 658 -0.969 7.375 6.943 1.00 25.00 C ATOM 1183 O TYR A 658 -1.883 8.044 7.431 1.00 25.00 O ATOM 1184 CB TYR A 658 0.863 6.886 8.602 1.00 25.00 C ATOM 1185 CG TYR A 658 1.378 5.985 9.716 1.00 25.00 C ATOM 1186 CD1 TYR A 658 2.694 5.529 9.717 1.00 25.00 C ATOM 1187 CD2 TYR A 658 0.550 5.596 10.762 1.00 25.00 C ATOM 1188 CE1 TYR A 658 3.166 4.713 10.728 1.00 25.00 C ATOM 1189 CE2 TYR A 658 1.016 4.781 11.776 1.00 25.00 C ATOM 1190 CZ TYR A 658 2.323 4.335 11.749 1.00 25.00 C ATOM 1191 OH TYR A 658 2.790 3.530 12.763 1.00 25.00 O ATOM 0 H TYR A 658 1.281 5.319 6.716 1.00 25.00 H new ATOM 0 HA TYR A 658 -1.002 5.821 8.425 1.00 25.00 H new ATOM 0 HB2 TYR A 658 1.694 7.138 7.943 1.00 25.00 H new ATOM 0 HB3 TYR A 658 0.510 7.819 9.041 1.00 25.00 H new ATOM 0 HD1 TYR A 658 3.357 5.818 8.915 1.00 25.00 H new ATOM 0 HD2 TYR A 658 -0.475 5.936 10.783 1.00 25.00 H new ATOM 0 HE1 TYR A 658 4.191 4.374 10.717 1.00 25.00 H new ATOM 0 HE2 TYR A 658 0.361 4.494 12.586 1.00 25.00 H new ATOM 0 HH TYR A 658 2.068 3.358 13.403 1.00 25.00 H new ATOM 1201 N LYS A 659 -0.521 7.525 5.693 1.00 25.00 N ATOM 1202 CA LYS A 659 -1.024 8.539 4.763 1.00 25.00 C ATOM 1203 C LYS A 659 -2.386 8.140 4.142 1.00 25.00 C ATOM 1204 O LYS A 659 -3.234 9.008 3.910 1.00 25.00 O ATOM 1205 CB LYS A 659 0.082 8.802 3.707 1.00 25.00 C ATOM 1206 CG LYS A 659 -0.226 9.795 2.573 1.00 25.00 C ATOM 1207 CD LYS A 659 -0.566 11.212 3.055 1.00 25.00 C ATOM 1208 CE LYS A 659 -0.813 12.184 1.911 1.00 25.00 C ATOM 1209 NZ LYS A 659 -1.173 13.549 2.387 1.00 25.00 N ATOM 0 H LYS A 659 0.211 6.937 5.294 1.00 25.00 H new ATOM 0 HA LYS A 659 -1.235 9.467 5.294 1.00 25.00 H new ATOM 0 HB2 LYS A 659 0.968 9.159 4.232 1.00 25.00 H new ATOM 0 HB3 LYS A 659 0.344 7.847 3.253 1.00 25.00 H new ATOM 0 HG2 LYS A 659 0.635 9.847 1.906 1.00 25.00 H new ATOM 0 HG3 LYS A 659 -1.061 9.412 1.986 1.00 25.00 H new ATOM 0 HD2 LYS A 659 -1.452 11.172 3.688 1.00 25.00 H new ATOM 0 HD3 LYS A 659 0.251 11.586 3.673 1.00 25.00 H new ATOM 0 HE2 LYS A 659 0.081 12.244 1.290 1.00 25.00 H new ATOM 0 HE3 LYS A 659 -1.614 11.800 1.280 1.00 25.00 H new ATOM 0 HZ1 LYS A 659 -1.331 14.172 1.569 1.00 25.00 H new ATOM 0 HZ2 LYS A 659 -2.041 13.500 2.957 1.00 25.00 H new ATOM 0 HZ3 LYS A 659 -0.399 13.930 2.968 1.00 25.00 H new ATOM 1223 N ILE A 660 -2.590 6.839 3.884 1.00 25.00 N ATOM 1224 CA ILE A 660 -3.871 6.334 3.346 1.00 25.00 C ATOM 1225 C ILE A 660 -4.907 6.193 4.479 1.00 25.00 C ATOM 1226 O ILE A 660 -6.108 6.364 4.257 1.00 25.00 O ATOM 1227 CB ILE A 660 -3.680 4.971 2.598 1.00 25.00 C ATOM 1228 CG1 ILE A 660 -2.836 5.175 1.324 1.00 25.00 C ATOM 1229 CG2 ILE A 660 -5.035 4.343 2.236 1.00 25.00 C ATOM 1230 CD1 ILE A 660 -2.380 3.886 0.656 1.00 25.00 C ATOM 0 H ILE A 660 -1.888 6.115 4.038 1.00 25.00 H new ATOM 0 HA ILE A 660 -4.241 7.058 2.620 1.00 25.00 H new ATOM 0 HB ILE A 660 -3.156 4.290 3.269 1.00 25.00 H new ATOM 0 HG12 ILE A 660 -3.417 5.755 0.607 1.00 25.00 H new ATOM 0 HG13 ILE A 660 -1.958 5.769 1.577 1.00 25.00 H new ATOM 0 HG21 ILE A 660 -4.871 3.398 1.718 1.00 25.00 H new ATOM 0 HG22 ILE A 660 -5.607 4.163 3.146 1.00 25.00 H new ATOM 0 HG23 ILE A 660 -5.589 5.021 1.587 1.00 25.00 H new ATOM 0 HD11 ILE A 660 -1.793 4.124 -0.231 1.00 25.00 H new ATOM 0 HD12 ILE A 660 -1.769 3.312 1.352 1.00 25.00 H new ATOM 0 HD13 ILE A 660 -3.251 3.298 0.368 1.00 25.00 H new ATOM 1242 N GLN A 661 -4.415 5.884 5.685 1.00 25.00 N ATOM 1243 CA GLN A 661 -5.243 5.816 6.900 1.00 25.00 C ATOM 1244 C GLN A 661 -5.865 7.179 7.260 1.00 25.00 C ATOM 1245 O GLN A 661 -6.842 7.241 8.012 1.00 25.00 O ATOM 1246 CB GLN A 661 -4.409 5.287 8.072 1.00 25.00 C ATOM 1247 CG GLN A 661 -4.162 3.771 8.044 1.00 25.00 C ATOM 1248 CD GLN A 661 -3.184 3.241 9.098 1.00 25.00 C ATOM 1249 OE1 GLN A 661 -2.661 4.014 9.901 1.00 25.00 O ATOM 1250 NE2 GLN A 661 -2.953 1.929 9.131 1.00 25.00 N ATOM 0 H GLN A 661 -3.430 5.673 5.848 1.00 25.00 H new ATOM 0 HA GLN A 661 -6.066 5.130 6.698 1.00 25.00 H new ATOM 0 HB2 GLN A 661 -3.447 5.799 8.077 1.00 25.00 H new ATOM 0 HB3 GLN A 661 -4.912 5.543 9.004 1.00 25.00 H new ATOM 0 HG2 GLN A 661 -5.118 3.263 8.172 1.00 25.00 H new ATOM 0 HG3 GLN A 661 -3.787 3.500 7.057 1.00 25.00 H new ATOM 0 HE21 GLN A 661 -3.402 1.315 8.451 1.00 25.00 H new ATOM 0 HE22 GLN A 661 -2.327 1.539 9.836 1.00 25.00 H new ATOM 1259 N LYS A 662 -5.284 8.263 6.712 1.00 25.00 N ATOM 1260 CA LYS A 662 -5.800 9.634 6.897 1.00 25.00 C ATOM 1261 C LYS A 662 -7.184 9.817 6.259 1.00 25.00 C ATOM 1262 O LYS A 662 -8.061 10.456 6.846 1.00 25.00 O ATOM 1263 CB LYS A 662 -4.839 10.673 6.294 1.00 25.00 C ATOM 1264 CG LYS A 662 -5.265 12.147 6.428 1.00 25.00 C ATOM 1265 CD LYS A 662 -5.432 12.631 7.873 1.00 25.00 C ATOM 1266 CE LYS A 662 -5.660 14.123 7.955 1.00 25.00 C ATOM 1267 NZ LYS A 662 -7.052 14.503 7.588 1.00 25.00 N ATOM 0 H LYS A 662 -4.447 8.214 6.131 1.00 25.00 H new ATOM 0 HA LYS A 662 -5.884 9.788 7.973 1.00 25.00 H new ATOM 0 HB2 LYS A 662 -3.864 10.553 6.766 1.00 25.00 H new ATOM 0 HB3 LYS A 662 -4.710 10.448 5.235 1.00 25.00 H new ATOM 0 HG2 LYS A 662 -4.523 12.773 5.932 1.00 25.00 H new ATOM 0 HG3 LYS A 662 -6.207 12.289 5.899 1.00 25.00 H new ATOM 0 HD2 LYS A 662 -6.272 12.111 8.333 1.00 25.00 H new ATOM 0 HD3 LYS A 662 -4.543 12.369 8.447 1.00 25.00 H new ATOM 0 HE2 LYS A 662 -5.447 14.466 8.968 1.00 25.00 H new ATOM 0 HE3 LYS A 662 -4.960 14.632 7.292 1.00 25.00 H new ATOM 0 HZ1 LYS A 662 -7.160 15.535 7.659 1.00 25.00 H new ATOM 0 HZ2 LYS A 662 -7.249 14.201 6.613 1.00 25.00 H new ATOM 0 HZ3 LYS A 662 -7.721 14.039 8.236 1.00 25.00 H new ATOM 1281 N GLU A 663 -7.363 9.251 5.053 1.00 25.00 N ATOM 1282 CA GLU A 663 -8.615 9.367 4.302 1.00 25.00 C ATOM 1283 C GLU A 663 -9.733 8.522 4.946 1.00 25.00 C ATOM 1284 O GLU A 663 -10.888 8.953 5.009 1.00 25.00 O ATOM 1285 CB GLU A 663 -8.354 9.006 2.812 1.00 25.00 C ATOM 1286 CG GLU A 663 -7.412 9.922 2.017 1.00 25.00 C ATOM 1287 CD GLU A 663 -7.775 11.395 2.137 1.00 25.00 C ATOM 1288 OE1 GLU A 663 -8.981 11.702 2.229 1.00 25.00 O ATOM 1289 OE2 GLU A 663 -6.859 12.243 2.141 1.00 25.00 O ATOM 0 H GLU A 663 -6.645 8.704 4.578 1.00 25.00 H new ATOM 0 HA GLU A 663 -8.972 10.396 4.335 1.00 25.00 H new ATOM 0 HB2 GLU A 663 -7.949 7.995 2.776 1.00 25.00 H new ATOM 0 HB3 GLU A 663 -9.315 8.983 2.298 1.00 25.00 H new ATOM 0 HG2 GLU A 663 -6.390 9.775 2.367 1.00 25.00 H new ATOM 0 HG3 GLU A 663 -7.433 9.632 0.966 1.00 25.00 H new ATOM 1296 N LEU A 664 -9.363 7.317 5.416 1.00 25.00 N ATOM 1297 CA LEU A 664 -10.274 6.442 6.173 1.00 25.00 C ATOM 1298 C LEU A 664 -10.638 7.028 7.547 1.00 25.00 C ATOM 1299 O LEU A 664 -11.658 6.654 8.131 1.00 25.00 O ATOM 1300 CB LEU A 664 -9.653 5.041 6.391 1.00 25.00 C ATOM 1301 CG LEU A 664 -9.464 4.122 5.156 1.00 25.00 C ATOM 1302 CD1 LEU A 664 -8.607 2.900 5.483 1.00 25.00 C ATOM 1303 CD2 LEU A 664 -10.803 3.695 4.566 1.00 25.00 C ATOM 0 H LEU A 664 -8.431 6.925 5.283 1.00 25.00 H new ATOM 0 HA LEU A 664 -11.179 6.361 5.571 1.00 25.00 H new ATOM 0 HB2 LEU A 664 -8.677 5.178 6.856 1.00 25.00 H new ATOM 0 HB3 LEU A 664 -10.276 4.509 7.110 1.00 25.00 H new ATOM 0 HG LEU A 664 -8.935 4.709 4.405 1.00 25.00 H new ATOM 0 HD11 LEU A 664 -8.499 2.282 4.591 1.00 25.00 H new ATOM 0 HD12 LEU A 664 -7.623 3.225 5.820 1.00 25.00 H new ATOM 0 HD13 LEU A 664 -9.087 2.319 6.271 1.00 25.00 H new ATOM 0 HD21 LEU A 664 -10.632 3.052 3.703 1.00 25.00 H new ATOM 0 HD22 LEU A 664 -11.374 3.149 5.317 1.00 25.00 H new ATOM 0 HD23 LEU A 664 -11.362 4.578 4.256 1.00 25.00 H new ATOM 1315 N GLU A 665 -9.795 7.947 8.053 1.00 25.00 N ATOM 1316 CA GLU A 665 -9.973 8.543 9.388 1.00 25.00 C ATOM 1317 C GLU A 665 -11.181 9.502 9.425 1.00 25.00 C ATOM 1318 O GLU A 665 -11.778 9.711 10.486 1.00 25.00 O ATOM 1319 CB GLU A 665 -8.679 9.259 9.811 1.00 25.00 C ATOM 1320 CG GLU A 665 -8.696 9.820 11.231 1.00 25.00 C ATOM 1321 CD GLU A 665 -7.369 10.434 11.634 1.00 25.00 C ATOM 1322 OE1 GLU A 665 -6.450 10.468 10.789 1.00 25.00 O ATOM 1323 OE2 GLU A 665 -7.249 10.881 12.794 1.00 25.00 O ATOM 0 H GLU A 665 -8.978 8.295 7.552 1.00 25.00 H new ATOM 0 HA GLU A 665 -10.183 7.744 10.099 1.00 25.00 H new ATOM 0 HB2 GLU A 665 -7.847 8.561 9.721 1.00 25.00 H new ATOM 0 HB3 GLU A 665 -8.487 10.075 9.115 1.00 25.00 H new ATOM 0 HG2 GLU A 665 -9.479 10.574 11.310 1.00 25.00 H new ATOM 0 HG3 GLU A 665 -8.950 9.022 11.929 1.00 25.00 H new ATOM 1330 N GLU A 666 -11.527 10.076 8.261 1.00 25.00 N ATOM 1331 CA GLU A 666 -12.735 10.905 8.117 1.00 25.00 C ATOM 1332 C GLU A 666 -13.985 10.024 7.998 1.00 25.00 C ATOM 1333 O GLU A 666 -15.090 10.445 8.353 1.00 25.00 O ATOM 1334 CB GLU A 666 -12.625 11.816 6.885 1.00 25.00 C ATOM 1335 CG GLU A 666 -13.825 12.729 6.676 1.00 25.00 C ATOM 1336 CD GLU A 666 -13.923 13.817 7.727 1.00 25.00 C ATOM 1337 OE1 GLU A 666 -12.928 14.037 8.449 1.00 25.00 O ATOM 1338 OE2 GLU A 666 -14.995 14.453 7.827 1.00 25.00 O ATOM 0 H GLU A 666 -10.984 9.980 7.403 1.00 25.00 H new ATOM 0 HA GLU A 666 -12.823 11.526 9.009 1.00 25.00 H new ATOM 0 HB2 GLU A 666 -11.728 12.429 6.979 1.00 25.00 H new ATOM 0 HB3 GLU A 666 -12.496 11.195 5.998 1.00 25.00 H new ATOM 0 HG2 GLU A 666 -13.760 13.188 5.689 1.00 25.00 H new ATOM 0 HG3 GLU A 666 -14.737 12.132 6.691 1.00 25.00 H new ATOM 1345 N LYS A 667 -13.783 8.799 7.492 1.00 25.00 N ATOM 1346 CA LYS A 667 -14.844 7.797 7.362 1.00 25.00 C ATOM 1347 C LYS A 667 -14.999 6.977 8.662 1.00 25.00 C ATOM 1348 O LYS A 667 -16.032 6.333 8.875 1.00 25.00 O ATOM 1349 CB LYS A 667 -14.537 6.903 6.143 1.00 25.00 C ATOM 1350 CG LYS A 667 -14.543 7.613 4.789 1.00 25.00 C ATOM 1351 CD LYS A 667 -14.234 6.655 3.652 1.00 25.00 C ATOM 1352 CE LYS A 667 -14.227 7.366 2.314 1.00 25.00 C ATOM 1353 NZ LYS A 667 -13.177 8.419 2.246 1.00 25.00 N ATOM 0 H LYS A 667 -12.874 8.477 7.161 1.00 25.00 H new ATOM 0 HA LYS A 667 -15.801 8.293 7.199 1.00 25.00 H new ATOM 0 HB2 LYS A 667 -13.559 6.443 6.288 1.00 25.00 H new ATOM 0 HB3 LYS A 667 -15.268 6.095 6.113 1.00 25.00 H new ATOM 0 HG2 LYS A 667 -15.517 8.073 4.623 1.00 25.00 H new ATOM 0 HG3 LYS A 667 -13.808 8.418 4.797 1.00 25.00 H new ATOM 0 HD2 LYS A 667 -13.264 6.188 3.822 1.00 25.00 H new ATOM 0 HD3 LYS A 667 -14.975 5.856 3.637 1.00 25.00 H new ATOM 0 HE2 LYS A 667 -14.063 6.639 1.518 1.00 25.00 H new ATOM 0 HE3 LYS A 667 -15.204 7.817 2.138 1.00 25.00 H new ATOM 0 HZ1 LYS A 667 -13.626 9.349 2.123 1.00 25.00 H new ATOM 0 HZ2 LYS A 667 -12.624 8.415 3.127 1.00 25.00 H new ATOM 0 HZ3 LYS A 667 -12.547 8.230 1.440 1.00 25.00 H new ATOM 1367 N ARG A 668 -13.970 7.022 9.523 1.00 25.00 N ATOM 1368 CA ARG A 668 -13.961 6.277 10.790 1.00 25.00 C ATOM 1369 C ARG A 668 -14.810 6.988 11.860 1.00 25.00 C ATOM 1370 O ARG A 668 -15.336 6.341 12.772 1.00 25.00 O ATOM 1371 CB ARG A 668 -12.514 6.106 11.283 1.00 25.00 C ATOM 1372 CG ARG A 668 -11.801 4.881 10.731 1.00 25.00 C ATOM 1373 CD ARG A 668 -10.369 4.833 11.223 1.00 25.00 C ATOM 1374 NE ARG A 668 -9.653 3.648 10.729 1.00 25.00 N ATOM 1375 CZ ARG A 668 -8.333 3.441 10.856 1.00 25.00 C ATOM 1376 NH1 ARG A 668 -7.553 4.321 11.483 1.00 25.00 N ATOM 1377 NH2 ARG A 668 -7.792 2.342 10.350 1.00 25.00 N ATOM 0 H ARG A 668 -13.127 7.572 9.361 1.00 25.00 H new ATOM 0 HA ARG A 668 -14.400 5.295 10.614 1.00 25.00 H new ATOM 0 HB2 ARG A 668 -11.944 6.995 11.013 1.00 25.00 H new ATOM 0 HB3 ARG A 668 -12.519 6.049 12.371 1.00 25.00 H new ATOM 0 HG2 ARG A 668 -12.328 3.977 11.038 1.00 25.00 H new ATOM 0 HG3 ARG A 668 -11.817 4.904 9.641 1.00 25.00 H new ATOM 0 HD2 ARG A 668 -9.845 5.733 10.901 1.00 25.00 H new ATOM 0 HD3 ARG A 668 -10.361 4.833 12.313 1.00 25.00 H new ATOM 0 HE ARG A 668 -10.200 2.930 10.254 1.00 25.00 H new ATOM 0 HH11 ARG A 668 -7.957 5.171 11.877 1.00 25.00 H new ATOM 0 HH12 ARG A 668 -6.552 4.145 11.569 1.00 25.00 H new ATOM 0 HH21 ARG A 668 -8.378 1.660 9.868 1.00 25.00 H new ATOM 0 HH22 ARG A 668 -6.790 2.178 10.443 1.00 25.00 H new ATOM 1391 N ARG A 669 -14.930 8.317 11.736 1.00 25.00 N ATOM 1392 CA ARG A 669 -15.723 9.130 12.671 1.00 25.00 C ATOM 1393 C ARG A 669 -17.175 9.296 12.193 1.00 25.00 C ATOM 1394 O ARG A 669 -18.029 9.780 12.944 1.00 25.00 O ATOM 1395 CB ARG A 669 -15.075 10.509 12.863 1.00 25.00 C ATOM 1396 CG ARG A 669 -13.712 10.469 13.542 1.00 25.00 C ATOM 1397 CD ARG A 669 -13.114 11.860 13.673 1.00 25.00 C ATOM 1398 NE ARG A 669 -11.799 11.853 14.332 1.00 25.00 N ATOM 1399 CZ ARG A 669 -10.933 12.878 14.325 1.00 25.00 C ATOM 1400 NH1 ARG A 669 -11.219 14.020 13.699 1.00 25.00 N ATOM 1401 NH2 ARG A 669 -9.771 12.757 14.951 1.00 25.00 N ATOM 0 H ARG A 669 -14.485 8.855 10.993 1.00 25.00 H new ATOM 0 HA ARG A 669 -15.742 8.603 13.625 1.00 25.00 H new ATOM 0 HB2 ARG A 669 -14.969 10.987 11.889 1.00 25.00 H new ATOM 0 HB3 ARG A 669 -15.745 11.134 13.454 1.00 25.00 H new ATOM 0 HG2 ARG A 669 -13.810 10.019 14.530 1.00 25.00 H new ATOM 0 HG3 ARG A 669 -13.037 9.834 12.968 1.00 25.00 H new ATOM 0 HD2 ARG A 669 -13.017 12.304 12.682 1.00 25.00 H new ATOM 0 HD3 ARG A 669 -13.797 12.493 14.240 1.00 25.00 H new ATOM 0 HE ARG A 669 -11.525 11.007 14.831 1.00 25.00 H new ATOM 0 HH11 ARG A 669 -12.110 14.126 13.214 1.00 25.00 H new ATOM 0 HH12 ARG A 669 -10.547 14.787 13.706 1.00 25.00 H new ATOM 0 HH21 ARG A 669 -9.540 11.889 15.434 1.00 25.00 H new ATOM 0 HH22 ARG A 669 -9.108 13.532 14.950 1.00 25.00 H new ATOM 1415 N SER A 670 -17.444 8.881 10.944 1.00 25.00 N ATOM 1416 CA SER A 670 -18.772 9.008 10.340 1.00 25.00 C ATOM 1417 C SER A 670 -19.656 7.789 10.630 1.00 25.00 C ATOM 1418 O SER A 670 -20.866 7.934 10.832 1.00 25.00 O ATOM 1419 CB SER A 670 -18.644 9.208 8.832 1.00 25.00 C ATOM 1420 OG SER A 670 -18.072 8.070 8.209 1.00 25.00 O ATOM 0 H SER A 670 -16.750 8.452 10.332 1.00 25.00 H new ATOM 0 HA SER A 670 -19.252 9.878 10.788 1.00 25.00 H new ATOM 0 HB2 SER A 670 -19.627 9.404 8.404 1.00 25.00 H new ATOM 0 HB3 SER A 670 -18.028 10.084 8.630 1.00 25.00 H new ATOM 0 HG SER A 670 -17.463 7.625 8.835 1.00 25.00 H new ATOM 1426 N ARG A 671 -19.047 6.593 10.651 1.00 25.00 N ATOM 1427 CA ARG A 671 -19.766 5.345 10.897 1.00 25.00 C ATOM 1428 C ARG A 671 -19.927 5.056 12.389 1.00 25.00 C ATOM 1429 O ARG A 671 -20.813 4.298 12.797 1.00 25.00 O ATOM 1430 CB ARG A 671 -19.032 4.194 10.235 1.00 25.00 C ATOM 1431 CG ARG A 671 -19.087 4.225 8.730 1.00 25.00 C ATOM 1432 CD ARG A 671 -18.351 3.051 8.144 1.00 25.00 C ATOM 1433 NE ARG A 671 -18.379 3.049 6.677 1.00 25.00 N ATOM 1434 CZ ARG A 671 -17.713 2.181 5.901 1.00 25.00 C ATOM 1435 NH1 ARG A 671 -16.956 1.219 6.429 1.00 25.00 N ATOM 1436 NH2 ARG A 671 -17.810 2.277 4.582 1.00 25.00 N ATOM 0 H ARG A 671 -18.046 6.470 10.498 1.00 25.00 H new ATOM 0 HA ARG A 671 -20.764 5.452 10.471 1.00 25.00 H new ATOM 0 HB2 ARG A 671 -17.989 4.210 10.552 1.00 25.00 H new ATOM 0 HB3 ARG A 671 -19.458 3.254 10.586 1.00 25.00 H new ATOM 0 HG2 ARG A 671 -20.126 4.211 8.399 1.00 25.00 H new ATOM 0 HG3 ARG A 671 -18.649 5.154 8.365 1.00 25.00 H new ATOM 0 HD2 ARG A 671 -17.316 3.068 8.485 1.00 25.00 H new ATOM 0 HD3 ARG A 671 -18.794 2.126 8.514 1.00 25.00 H new ATOM 0 HE ARG A 671 -18.946 3.759 6.214 1.00 25.00 H new ATOM 0 HH11 ARG A 671 -16.875 1.132 7.442 1.00 25.00 H new ATOM 0 HH12 ARG A 671 -16.458 0.570 5.820 1.00 25.00 H new ATOM 0 HH21 ARG A 671 -18.388 3.007 4.165 1.00 25.00 H new ATOM 0 HH22 ARG A 671 -17.307 1.621 3.985 1.00 25.00 H new ATOM 1450 N LEU A 672 -19.061 5.677 13.183 1.00 25.00 N ATOM 1451 CA LEU A 672 -18.988 5.432 14.623 1.00 25.00 C ATOM 1452 C LEU A 672 -19.428 6.669 15.412 1.00 25.00 C ATOM 1453 O LEU A 672 -20.567 6.663 15.923 1.00 25.00 O ATOM 1454 CB LEU A 672 -17.557 5.008 15.027 1.00 25.00 C ATOM 1455 CG LEU A 672 -17.020 3.703 14.400 1.00 25.00 C ATOM 1456 CD1 LEU A 672 -15.572 3.424 14.807 1.00 25.00 C ATOM 1457 CD2 LEU A 672 -17.912 2.530 14.781 1.00 25.00 C ATOM 1458 OXT LEU A 672 -18.640 7.639 15.498 1.00 25.00 O ATOM 0 H LEU A 672 -18.388 6.366 12.848 1.00 25.00 H new ATOM 0 HA LEU A 672 -19.671 4.618 14.865 1.00 25.00 H new ATOM 0 HB2 LEU A 672 -16.875 5.817 14.766 1.00 25.00 H new ATOM 0 HB3 LEU A 672 -17.526 4.903 16.111 1.00 25.00 H new ATOM 0 HG LEU A 672 -17.035 3.830 13.317 1.00 25.00 H new ATOM 0 HD11 LEU A 672 -15.236 2.497 14.343 1.00 25.00 H new ATOM 0 HD12 LEU A 672 -14.937 4.246 14.477 1.00 25.00 H new ATOM 0 HD13 LEU A 672 -15.510 3.330 15.891 1.00 25.00 H new ATOM 0 HD21 LEU A 672 -17.522 1.616 14.333 1.00 25.00 H new ATOM 0 HD22 LEU A 672 -17.929 2.423 15.866 1.00 25.00 H new ATOM 0 HD23 LEU A 672 -18.924 2.709 14.418 1.00 25.00 H new TER 1470 LEU A 672 ATOM 1471 N GLY B 519 -13.337 13.878 -30.300 1.00 25.00 N ATOM 1472 CA GLY B 519 -14.174 13.570 -29.107 1.00 25.00 C ATOM 1473 C GLY B 519 -13.807 12.244 -28.469 1.00 25.00 C ATOM 1474 O GLY B 519 -14.339 11.199 -28.852 1.00 25.00 O ATOM 0 HA2 GLY B 519 -14.061 14.367 -28.372 1.00 25.00 H new ATOM 0 HA3 GLY B 519 -15.224 13.551 -29.399 1.00 25.00 H new ATOM 1480 N SER B 520 -12.893 12.296 -27.494 1.00 25.00 N ATOM 1481 CA SER B 520 -12.430 11.097 -26.791 1.00 25.00 C ATOM 1482 C SER B 520 -12.763 11.182 -25.287 1.00 25.00 C ATOM 1483 O SER B 520 -12.487 12.209 -24.658 1.00 25.00 O ATOM 1484 CB SER B 520 -10.918 10.919 -26.992 1.00 25.00 C ATOM 1485 OG SER B 520 -10.428 9.795 -26.278 1.00 25.00 O ATOM 0 H SER B 520 -12.458 13.161 -27.173 1.00 25.00 H new ATOM 0 HA SER B 520 -12.947 10.232 -27.207 1.00 25.00 H new ATOM 0 HB2 SER B 520 -10.703 10.799 -28.054 1.00 25.00 H new ATOM 0 HB3 SER B 520 -10.397 11.817 -26.660 1.00 25.00 H new ATOM 0 HG SER B 520 -9.463 9.708 -26.428 1.00 25.00 H new ATOM 1491 N PRO B 521 -13.369 10.108 -24.679 1.00 25.00 N ATOM 1492 CA PRO B 521 -13.718 10.104 -23.238 1.00 25.00 C ATOM 1493 C PRO B 521 -12.495 9.970 -22.315 1.00 25.00 C ATOM 1494 O PRO B 521 -11.558 9.223 -22.617 1.00 25.00 O ATOM 1495 CB PRO B 521 -14.638 8.881 -23.109 1.00 25.00 C ATOM 1496 CG PRO B 521 -14.247 7.989 -24.226 1.00 25.00 C ATOM 1497 CD PRO B 521 -13.787 8.832 -25.334 1.00 25.00 C ATOM 0 HA PRO B 521 -14.178 11.043 -22.931 1.00 25.00 H new ATOM 0 HB2 PRO B 521 -14.507 8.388 -22.146 1.00 25.00 H new ATOM 0 HB3 PRO B 521 -15.687 9.167 -23.181 1.00 25.00 H new ATOM 0 HG2 PRO B 521 -13.457 7.307 -23.911 1.00 25.00 H new ATOM 0 HG3 PRO B 521 -15.092 7.375 -24.538 1.00 25.00 H new ATOM 0 HD2 PRO B 521 -12.957 8.369 -25.868 1.00 25.00 H new ATOM 0 HD3 PRO B 521 -14.581 9.000 -26.062 1.00 25.00 H new ATOM 1505 N GLY B 522 -12.526 10.702 -21.197 1.00 25.00 N ATOM 1506 CA GLY B 522 -11.432 10.666 -20.235 1.00 25.00 C ATOM 1507 C GLY B 522 -11.147 12.027 -19.629 1.00 25.00 C ATOM 1508 O GLY B 522 -11.134 13.038 -20.339 1.00 25.00 O ATOM 0 H GLY B 522 -13.294 11.322 -20.941 1.00 25.00 H new ATOM 0 HA2 GLY B 522 -11.675 9.961 -19.440 1.00 25.00 H new ATOM 0 HA3 GLY B 522 -10.532 10.295 -20.726 1.00 25.00 H new ATOM 1512 N TYR B 523 -10.918 12.049 -18.310 1.00 25.00 N ATOM 1513 CA TYR B 523 -10.643 13.291 -17.585 1.00 25.00 C ATOM 1514 C TYR B 523 -9.315 13.177 -16.802 1.00 25.00 C ATOM 1515 O TYR B 523 -9.183 12.291 -15.951 1.00 25.00 O ATOM 1516 CB TYR B 523 -11.815 13.614 -16.635 1.00 25.00 C ATOM 1517 CG TYR B 523 -11.666 14.910 -15.857 1.00 25.00 C ATOM 1518 CD1 TYR B 523 -11.959 16.137 -16.444 1.00 25.00 C ATOM 1519 CD2 TYR B 523 -11.225 14.906 -14.537 1.00 25.00 C ATOM 1520 CE1 TYR B 523 -11.819 17.318 -15.740 1.00 25.00 C ATOM 1521 CE2 TYR B 523 -11.084 16.083 -13.827 1.00 25.00 C ATOM 1522 CZ TYR B 523 -11.404 17.287 -14.432 1.00 25.00 C ATOM 1523 OH TYR B 523 -11.240 18.460 -13.728 1.00 25.00 O ATOM 0 H TYR B 523 -10.918 11.215 -17.723 1.00 25.00 H new ATOM 0 HA TYR B 523 -10.542 14.106 -18.302 1.00 25.00 H new ATOM 0 HB2 TYR B 523 -12.735 13.660 -17.218 1.00 25.00 H new ATOM 0 HB3 TYR B 523 -11.927 12.793 -15.927 1.00 25.00 H new ATOM 0 HD1 TYR B 523 -12.302 16.167 -17.468 1.00 25.00 H new ATOM 0 HD2 TYR B 523 -10.989 13.967 -14.059 1.00 25.00 H new ATOM 0 HE1 TYR B 523 -12.035 18.262 -16.217 1.00 25.00 H new ATOM 0 HE2 TYR B 523 -10.727 16.064 -12.808 1.00 25.00 H new ATOM 0 HH TYR B 523 -10.943 18.256 -12.817 1.00 25.00 H new ATOM 1533 N PRO B 524 -8.298 14.062 -17.080 1.00 25.00 N ATOM 1534 CA PRO B 524 -7.000 14.021 -16.372 1.00 25.00 C ATOM 1535 C PRO B 524 -7.062 14.611 -14.952 1.00 25.00 C ATOM 1536 O PRO B 524 -7.826 15.546 -14.692 1.00 25.00 O ATOM 1537 CB PRO B 524 -6.085 14.859 -17.273 1.00 25.00 C ATOM 1538 CG PRO B 524 -6.995 15.856 -17.928 1.00 25.00 C ATOM 1539 CD PRO B 524 -8.320 15.142 -18.112 1.00 25.00 C ATOM 0 HA PRO B 524 -6.657 12.998 -16.219 1.00 25.00 H new ATOM 0 HB2 PRO B 524 -5.307 15.356 -16.693 1.00 25.00 H new ATOM 0 HB3 PRO B 524 -5.582 14.237 -18.014 1.00 25.00 H new ATOM 0 HG2 PRO B 524 -7.112 16.745 -17.309 1.00 25.00 H new ATOM 0 HG3 PRO B 524 -6.591 16.185 -18.885 1.00 25.00 H new ATOM 0 HD2 PRO B 524 -9.162 15.819 -17.963 1.00 25.00 H new ATOM 0 HD3 PRO B 524 -8.415 14.731 -19.117 1.00 25.00 H new ATOM 1547 N ASN B 525 -6.249 14.048 -14.048 1.00 25.00 N ATOM 1548 CA ASN B 525 -6.199 14.499 -12.651 1.00 25.00 C ATOM 1549 C ASN B 525 -4.937 15.326 -12.362 1.00 25.00 C ATOM 1550 O ASN B 525 -4.980 16.266 -11.562 1.00 25.00 O ATOM 1551 CB ASN B 525 -6.307 13.301 -11.681 1.00 25.00 C ATOM 1552 CG ASN B 525 -7.646 12.573 -11.742 1.00 25.00 C ATOM 1553 OD1 ASN B 525 -8.678 13.171 -12.045 1.00 25.00 O ATOM 1554 ND2 ASN B 525 -7.630 11.278 -11.446 1.00 25.00 N ATOM 0 H ASN B 525 -5.615 13.277 -14.260 1.00 25.00 H new ATOM 0 HA ASN B 525 -7.058 15.150 -12.489 1.00 25.00 H new ATOM 0 HB2 ASN B 525 -5.509 12.593 -11.904 1.00 25.00 H new ATOM 0 HB3 ASN B 525 -6.143 13.655 -10.663 1.00 25.00 H new ATOM 0 HD21 ASN B 525 -8.496 10.740 -11.465 1.00 25.00 H new ATOM 0 HD22 ASN B 525 -6.751 10.822 -11.200 1.00 25.00 H new ATOM 1561 N GLY B 526 -3.822 14.966 -13.016 1.00 25.00 N ATOM 1562 CA GLY B 526 -2.577 15.710 -12.863 1.00 25.00 C ATOM 1563 C GLY B 526 -1.516 14.954 -12.079 1.00 25.00 C ATOM 1564 O GLY B 526 -1.718 13.797 -11.700 1.00 25.00 O ATOM 0 H GLY B 526 -3.764 14.169 -13.650 1.00 25.00 H new ATOM 0 HA2 GLY B 526 -2.184 15.954 -13.850 1.00 25.00 H new ATOM 0 HA3 GLY B 526 -2.786 16.654 -12.361 1.00 25.00 H new ATOM 1568 N LEU B 527 -0.380 15.622 -11.848 1.00 25.00 N ATOM 1569 CA LEU B 527 0.736 15.048 -11.095 1.00 25.00 C ATOM 1570 C LEU B 527 1.203 16.016 -9.989 1.00 25.00 C ATOM 1571 O LEU B 527 0.490 16.968 -9.657 1.00 25.00 O ATOM 1572 CB LEU B 527 1.903 14.624 -12.056 1.00 25.00 C ATOM 1573 CG LEU B 527 1.649 13.572 -13.177 1.00 25.00 C ATOM 1574 CD1 LEU B 527 2.862 13.396 -14.074 1.00 25.00 C ATOM 1575 CD2 LEU B 527 1.199 12.230 -12.609 1.00 25.00 C ATOM 0 H LEU B 527 -0.211 16.572 -12.177 1.00 25.00 H new ATOM 0 HA LEU B 527 0.393 14.140 -10.599 1.00 25.00 H new ATOM 0 HB2 LEU B 527 2.270 15.530 -12.539 1.00 25.00 H new ATOM 0 HB3 LEU B 527 2.713 14.244 -11.433 1.00 25.00 H new ATOM 0 HG LEU B 527 0.836 13.963 -13.788 1.00 25.00 H new ATOM 0 HD11 LEU B 527 2.642 12.654 -14.842 1.00 25.00 H new ATOM 0 HD12 LEU B 527 3.105 14.347 -14.548 1.00 25.00 H new ATOM 0 HD13 LEU B 527 3.710 13.060 -13.477 1.00 25.00 H new ATOM 0 HD21 LEU B 527 1.033 11.527 -13.425 1.00 25.00 H new ATOM 0 HD22 LEU B 527 1.969 11.840 -11.944 1.00 25.00 H new ATOM 0 HD23 LEU B 527 0.272 12.363 -12.051 1.00 25.00 H new ATOM 1587 N LEU B 528 2.412 15.761 -9.425 1.00 25.00 N ATOM 1588 CA LEU B 528 3.006 16.537 -8.313 1.00 25.00 C ATOM 1589 C LEU B 528 2.211 16.380 -6.998 1.00 25.00 C ATOM 1590 O LEU B 528 2.734 16.641 -5.911 1.00 25.00 O ATOM 1591 CB LEU B 528 3.183 18.012 -8.746 1.00 25.00 C ATOM 1592 CG LEU B 528 4.099 18.316 -9.950 1.00 25.00 C ATOM 1593 CD1 LEU B 528 3.978 19.781 -10.334 1.00 25.00 C ATOM 1594 CD2 LEU B 528 5.558 17.995 -9.635 1.00 25.00 C ATOM 0 H LEU B 528 3.009 14.996 -9.738 1.00 25.00 H new ATOM 0 HA LEU B 528 3.994 16.133 -8.092 1.00 25.00 H new ATOM 0 HB2 LEU B 528 2.195 18.414 -8.970 1.00 25.00 H new ATOM 0 HB3 LEU B 528 3.565 18.567 -7.889 1.00 25.00 H new ATOM 0 HG LEU B 528 3.780 17.686 -10.780 1.00 25.00 H new ATOM 0 HD11 LEU B 528 4.627 19.989 -11.185 1.00 25.00 H new ATOM 0 HD12 LEU B 528 2.945 20.003 -10.603 1.00 25.00 H new ATOM 0 HD13 LEU B 528 4.275 20.404 -9.490 1.00 25.00 H new ATOM 0 HD21 LEU B 528 6.176 18.221 -10.504 1.00 25.00 H new ATOM 0 HD22 LEU B 528 5.888 18.597 -8.789 1.00 25.00 H new ATOM 0 HD23 LEU B 528 5.653 16.938 -9.387 1.00 25.00 H new ATOM 1606 N SER B 529 0.963 15.938 -7.125 1.00 25.00 N ATOM 1607 CA SER B 529 0.087 15.668 -5.987 1.00 25.00 C ATOM 1608 C SER B 529 -0.620 14.322 -6.188 1.00 25.00 C ATOM 1609 O SER B 529 -1.845 14.253 -6.366 1.00 25.00 O ATOM 1610 CB SER B 529 -0.930 16.808 -5.807 1.00 25.00 C ATOM 1611 OG SER B 529 -1.785 16.563 -4.703 1.00 25.00 O ATOM 0 H SER B 529 0.527 15.755 -8.029 1.00 25.00 H new ATOM 0 HA SER B 529 0.686 15.613 -5.078 1.00 25.00 H new ATOM 0 HB2 SER B 529 -0.402 17.750 -5.659 1.00 25.00 H new ATOM 0 HB3 SER B 529 -1.525 16.915 -6.714 1.00 25.00 H new ATOM 0 HG SER B 529 -2.306 17.370 -4.508 1.00 25.00 H new ATOM 1617 N GLY B 530 0.179 13.246 -6.164 1.00 25.00 N ATOM 1618 CA GLY B 530 -0.339 11.906 -6.411 1.00 25.00 C ATOM 1619 C GLY B 530 -0.653 11.143 -5.133 1.00 25.00 C ATOM 1620 O GLY B 530 -0.397 9.938 -5.049 1.00 25.00 O ATOM 0 H GLY B 530 1.181 13.284 -5.976 1.00 25.00 H new ATOM 0 HA2 GLY B 530 -1.243 11.978 -7.016 1.00 25.00 H new ATOM 0 HA3 GLY B 530 0.390 11.343 -6.994 1.00 25.00 H new ATOM 1624 N ASP B 531 -1.209 11.851 -4.141 1.00 25.00 N ATOM 1625 CA ASP B 531 -1.574 11.250 -2.851 1.00 25.00 C ATOM 1626 C ASP B 531 -3.017 11.596 -2.476 1.00 25.00 C ATOM 1627 O ASP B 531 -3.533 11.139 -1.449 1.00 25.00 O ATOM 1628 CB ASP B 531 -0.616 11.720 -1.744 1.00 25.00 C ATOM 1629 CG ASP B 531 0.837 11.389 -2.041 1.00 25.00 C ATOM 1630 OD1 ASP B 531 1.159 10.189 -2.164 1.00 25.00 O ATOM 1631 OD2 ASP B 531 1.649 12.331 -2.148 1.00 25.00 O ATOM 0 H ASP B 531 -1.417 12.847 -4.208 1.00 25.00 H new ATOM 0 HA ASP B 531 -1.492 10.168 -2.951 1.00 25.00 H new ATOM 0 HB2 ASP B 531 -0.719 12.797 -1.614 1.00 25.00 H new ATOM 0 HB3 ASP B 531 -0.904 11.256 -0.800 1.00 25.00 H new ATOM 1636 N GLU B 532 -3.660 12.396 -3.332 1.00 25.00 N ATOM 1637 CA GLU B 532 -5.039 12.826 -3.142 1.00 25.00 C ATOM 1638 C GLU B 532 -6.022 11.914 -3.876 1.00 25.00 C ATOM 1639 O GLU B 532 -7.244 12.056 -3.754 1.00 25.00 O ATOM 1640 CB GLU B 532 -5.183 14.264 -3.625 1.00 25.00 C ATOM 1641 CG GLU B 532 -4.362 15.269 -2.837 1.00 25.00 C ATOM 1642 CD GLU B 532 -4.622 16.702 -3.262 1.00 25.00 C ATOM 1643 OE1 GLU B 532 -5.410 16.906 -4.211 1.00 25.00 O ATOM 1644 OE2 GLU B 532 -4.036 17.619 -2.651 1.00 25.00 O ATOM 0 H GLU B 532 -3.230 12.763 -4.181 1.00 25.00 H new ATOM 0 HA GLU B 532 -5.278 12.767 -2.080 1.00 25.00 H new ATOM 0 HB2 GLU B 532 -4.890 14.315 -4.674 1.00 25.00 H new ATOM 0 HB3 GLU B 532 -6.234 14.550 -3.573 1.00 25.00 H new ATOM 0 HG2 GLU B 532 -4.587 15.163 -1.776 1.00 25.00 H new ATOM 0 HG3 GLU B 532 -3.303 15.044 -2.962 1.00 25.00 H new ATOM 1651 N ASP B 533 -5.458 10.977 -4.627 1.00 25.00 N ATOM 1652 CA ASP B 533 -6.210 10.013 -5.420 1.00 25.00 C ATOM 1653 C ASP B 533 -6.597 8.768 -4.605 1.00 25.00 C ATOM 1654 O ASP B 533 -7.395 7.948 -5.062 1.00 25.00 O ATOM 1655 CB ASP B 533 -5.371 9.608 -6.630 1.00 25.00 C ATOM 1656 CG ASP B 533 -5.285 10.700 -7.682 1.00 25.00 C ATOM 1657 OD1 ASP B 533 -6.089 11.653 -7.616 1.00 25.00 O ATOM 1658 OD2 ASP B 533 -4.413 10.601 -8.571 1.00 25.00 O ATOM 0 H ASP B 533 -4.447 10.864 -4.704 1.00 25.00 H new ATOM 0 HA ASP B 533 -7.138 10.485 -5.742 1.00 25.00 H new ATOM 0 HB2 ASP B 533 -4.365 9.350 -6.298 1.00 25.00 H new ATOM 0 HB3 ASP B 533 -5.799 8.711 -7.079 1.00 25.00 H new ATOM 1663 N PHE B 534 -6.034 8.644 -3.394 1.00 25.00 N ATOM 1664 CA PHE B 534 -6.318 7.509 -2.496 1.00 25.00 C ATOM 1665 C PHE B 534 -7.590 7.735 -1.695 1.00 25.00 C ATOM 1666 O PHE B 534 -8.118 6.824 -1.052 1.00 25.00 O ATOM 1667 CB PHE B 534 -5.129 7.264 -1.555 1.00 25.00 C ATOM 1668 CG PHE B 534 -3.935 6.664 -2.246 1.00 25.00 C ATOM 1669 CD1 PHE B 534 -2.900 7.478 -2.662 1.00 25.00 C ATOM 1670 CD2 PHE B 534 -3.848 5.302 -2.478 1.00 25.00 C ATOM 1671 CE1 PHE B 534 -1.795 6.953 -3.292 1.00 25.00 C ATOM 1672 CE2 PHE B 534 -2.745 4.765 -3.111 1.00 25.00 C ATOM 1673 CZ PHE B 534 -1.751 5.526 -3.522 1.00 25.00 C ATOM 0 H PHE B 534 -5.374 9.320 -3.010 1.00 25.00 H new ATOM 0 HA PHE B 534 -6.469 6.624 -3.115 1.00 25.00 H new ATOM 0 HB2 PHE B 534 -4.837 8.209 -1.096 1.00 25.00 H new ATOM 0 HB3 PHE B 534 -5.444 6.602 -0.748 1.00 25.00 H new ATOM 0 HD1 PHE B 534 -2.959 8.543 -2.490 1.00 25.00 H new ATOM 0 HD2 PHE B 534 -4.651 4.653 -2.161 1.00 25.00 H new ATOM 0 HE1 PHE B 534 -0.982 7.590 -3.607 1.00 25.00 H new ATOM 0 HE2 PHE B 534 -2.696 3.698 -3.273 1.00 25.00 H new ATOM 0 HZ PHE B 534 -0.906 5.085 -4.029 1.00 25.00 H new ATOM 1683 N SER B 535 -8.059 8.966 -1.756 1.00 25.00 N ATOM 1684 CA SER B 535 -9.313 9.377 -1.123 1.00 25.00 C ATOM 1685 C SER B 535 -10.500 9.067 -2.044 1.00 25.00 C ATOM 1686 O SER B 535 -11.588 8.723 -1.572 1.00 25.00 O ATOM 1687 CB SER B 535 -9.270 10.873 -0.786 1.00 25.00 C ATOM 1688 OG SER B 535 -9.151 11.666 -1.957 1.00 25.00 O ATOM 0 H SER B 535 -7.582 9.721 -2.249 1.00 25.00 H new ATOM 0 HA SER B 535 -9.439 8.816 -0.197 1.00 25.00 H new ATOM 0 HB2 SER B 535 -10.175 11.152 -0.247 1.00 25.00 H new ATOM 0 HB3 SER B 535 -8.429 11.074 -0.122 1.00 25.00 H new ATOM 0 HG SER B 535 -8.249 11.568 -2.328 1.00 25.00 H new ATOM 1694 N SER B 536 -10.268 9.196 -3.359 1.00 25.00 N ATOM 1695 CA SER B 536 -11.283 8.907 -4.373 1.00 25.00 C ATOM 1696 C SER B 536 -11.229 7.447 -4.846 1.00 25.00 C ATOM 1697 O SER B 536 -12.268 6.799 -4.958 1.00 25.00 O ATOM 1698 CB SER B 536 -11.124 9.856 -5.558 1.00 25.00 C ATOM 1699 OG SER B 536 -9.867 9.688 -6.198 1.00 25.00 O ATOM 0 H SER B 536 -9.375 9.502 -3.744 1.00 25.00 H new ATOM 0 HA SER B 536 -12.260 9.061 -3.914 1.00 25.00 H new ATOM 0 HB2 SER B 536 -11.925 9.680 -6.276 1.00 25.00 H new ATOM 0 HB3 SER B 536 -11.224 10.886 -5.216 1.00 25.00 H new ATOM 0 HG SER B 536 -9.799 10.309 -6.953 1.00 25.00 H new ATOM 1705 N ILE B 537 -10.014 6.935 -5.108 1.00 25.00 N ATOM 1706 CA ILE B 537 -9.839 5.604 -5.716 1.00 25.00 C ATOM 1707 C ILE B 537 -9.819 4.482 -4.668 1.00 25.00 C ATOM 1708 O ILE B 537 -10.472 3.453 -4.859 1.00 25.00 O ATOM 1709 CB ILE B 537 -8.538 5.529 -6.599 1.00 25.00 C ATOM 1710 CG1 ILE B 537 -8.614 6.473 -7.835 1.00 25.00 C ATOM 1711 CG2 ILE B 537 -8.225 4.088 -7.044 1.00 25.00 C ATOM 1712 CD1 ILE B 537 -7.306 6.699 -8.588 1.00 25.00 C ATOM 0 H ILE B 537 -9.140 7.421 -4.909 1.00 25.00 H new ATOM 0 HA ILE B 537 -10.706 5.454 -6.359 1.00 25.00 H new ATOM 0 HB ILE B 537 -7.721 5.872 -5.964 1.00 25.00 H new ATOM 0 HG12 ILE B 537 -9.346 6.066 -8.533 1.00 25.00 H new ATOM 0 HG13 ILE B 537 -8.992 7.441 -7.505 1.00 25.00 H new ATOM 0 HG21 ILE B 537 -7.320 4.083 -7.651 1.00 25.00 H new ATOM 0 HG22 ILE B 537 -8.076 3.460 -6.166 1.00 25.00 H new ATOM 0 HG23 ILE B 537 -9.057 3.700 -7.631 1.00 25.00 H new ATOM 0 HD11 ILE B 537 -7.481 7.372 -9.427 1.00 25.00 H new ATOM 0 HD12 ILE B 537 -6.571 7.141 -7.916 1.00 25.00 H new ATOM 0 HD13 ILE B 537 -6.931 5.745 -8.960 1.00 25.00 H new ATOM 1724 N ALA B 538 -9.080 4.683 -3.572 1.00 25.00 N ATOM 1725 CA ALA B 538 -8.838 3.610 -2.600 1.00 25.00 C ATOM 1726 C ALA B 538 -10.036 3.336 -1.690 1.00 25.00 C ATOM 1727 O ALA B 538 -10.063 2.335 -0.971 1.00 25.00 O ATOM 1728 CB ALA B 538 -7.584 3.899 -1.788 1.00 25.00 C ATOM 0 H ALA B 538 -8.641 5.573 -3.336 1.00 25.00 H new ATOM 0 HA ALA B 538 -8.685 2.696 -3.175 1.00 25.00 H new ATOM 0 HB1 ALA B 538 -7.420 3.093 -1.073 1.00 25.00 H new ATOM 0 HB2 ALA B 538 -6.726 3.971 -2.457 1.00 25.00 H new ATOM 0 HB3 ALA B 538 -7.706 4.840 -1.252 1.00 25.00 H new ATOM 1734 N ASP B 539 -11.013 4.229 -1.746 1.00 25.00 N ATOM 1735 CA ASP B 539 -12.283 4.063 -1.031 1.00 25.00 C ATOM 1736 C ASP B 539 -13.371 3.587 -2.008 1.00 25.00 C ATOM 1737 O ASP B 539 -14.414 3.073 -1.591 1.00 25.00 O ATOM 1738 CB ASP B 539 -12.668 5.391 -0.334 1.00 25.00 C ATOM 1739 CG ASP B 539 -11.779 5.761 0.845 1.00 25.00 C ATOM 1740 OD1 ASP B 539 -11.700 4.966 1.805 1.00 25.00 O ATOM 1741 OD2 ASP B 539 -11.178 6.854 0.812 1.00 25.00 O ATOM 0 H ASP B 539 -10.954 5.092 -2.287 1.00 25.00 H new ATOM 0 HA ASP B 539 -12.179 3.302 -0.257 1.00 25.00 H new ATOM 0 HB2 ASP B 539 -12.632 6.196 -1.068 1.00 25.00 H new ATOM 0 HB3 ASP B 539 -13.699 5.320 0.012 1.00 25.00 H new ATOM 1746 N MET B 540 -13.101 3.764 -3.307 1.00 25.00 N ATOM 1747 CA MET B 540 -13.925 3.193 -4.377 1.00 25.00 C ATOM 1748 C MET B 540 -13.528 1.742 -4.657 1.00 25.00 C ATOM 1749 O MET B 540 -14.322 0.962 -5.194 1.00 25.00 O ATOM 1750 CB MET B 540 -13.763 4.010 -5.658 1.00 25.00 C ATOM 1751 CG MET B 540 -14.789 5.130 -5.815 1.00 25.00 C ATOM 1752 SD MET B 540 -14.485 6.189 -7.251 1.00 25.00 S ATOM 1753 CE MET B 540 -14.853 5.089 -8.623 1.00 25.00 C ATOM 0 H MET B 540 -12.306 4.307 -3.645 1.00 25.00 H new ATOM 0 HA MET B 540 -14.964 3.220 -4.050 1.00 25.00 H new ATOM 0 HB2 MET B 540 -12.763 4.443 -5.677 1.00 25.00 H new ATOM 0 HB3 MET B 540 -13.837 3.341 -6.515 1.00 25.00 H new ATOM 0 HG2 MET B 540 -15.783 4.692 -5.900 1.00 25.00 H new ATOM 0 HG3 MET B 540 -14.787 5.743 -4.914 1.00 25.00 H new ATOM 0 HE1 MET B 540 -14.791 5.643 -9.560 1.00 25.00 H new ATOM 0 HE2 MET B 540 -14.133 4.271 -8.637 1.00 25.00 H new ATOM 0 HE3 MET B 540 -15.859 4.685 -8.506 1.00 25.00 H new ATOM 1763 N ASP B 541 -12.292 1.399 -4.277 1.00 25.00 N ATOM 1764 CA ASP B 541 -11.719 0.084 -4.552 1.00 25.00 C ATOM 1765 C ASP B 541 -12.095 -0.951 -3.480 1.00 25.00 C ATOM 1766 O ASP B 541 -12.228 -2.136 -3.803 1.00 25.00 O ATOM 1767 CB ASP B 541 -10.195 0.195 -4.673 1.00 25.00 C ATOM 1768 CG ASP B 541 -9.738 0.655 -6.048 1.00 25.00 C ATOM 1769 OD1 ASP B 541 -10.545 0.580 -6.998 1.00 25.00 O ATOM 1770 OD2 ASP B 541 -8.573 1.088 -6.172 1.00 25.00 O ATOM 0 H ASP B 541 -11.665 2.026 -3.772 1.00 25.00 H new ATOM 0 HA ASP B 541 -12.137 -0.266 -5.496 1.00 25.00 H new ATOM 0 HB2 ASP B 541 -9.827 0.894 -3.922 1.00 25.00 H new ATOM 0 HB3 ASP B 541 -9.747 -0.774 -4.453 1.00 25.00 H new ATOM 1775 N PHE B 542 -12.270 -0.520 -2.211 1.00 25.00 N ATOM 1776 CA PHE B 542 -12.583 -1.469 -1.136 1.00 25.00 C ATOM 1777 C PHE B 542 -14.088 -1.761 -1.026 1.00 25.00 C ATOM 1778 O PHE B 542 -14.492 -2.770 -0.440 1.00 25.00 O ATOM 1779 CB PHE B 542 -11.994 -1.025 0.224 1.00 25.00 C ATOM 1780 CG PHE B 542 -12.260 -1.882 1.451 1.00 25.00 C ATOM 1781 CD1 PHE B 542 -12.482 -3.251 1.338 1.00 25.00 C ATOM 1782 CD2 PHE B 542 -12.220 -1.324 2.716 1.00 25.00 C ATOM 1783 CE1 PHE B 542 -12.663 -4.034 2.458 1.00 25.00 C ATOM 1784 CE2 PHE B 542 -12.408 -2.105 3.840 1.00 25.00 C ATOM 1785 CZ PHE B 542 -12.628 -3.460 3.709 1.00 25.00 C ATOM 0 H PHE B 542 -12.201 0.454 -1.917 1.00 25.00 H new ATOM 0 HA PHE B 542 -12.098 -2.406 -1.411 1.00 25.00 H new ATOM 0 HB2 PHE B 542 -10.913 -0.944 0.105 1.00 25.00 H new ATOM 0 HB3 PHE B 542 -12.367 -0.023 0.434 1.00 25.00 H new ATOM 0 HD1 PHE B 542 -12.513 -3.706 0.359 1.00 25.00 H new ATOM 0 HD2 PHE B 542 -12.040 -0.265 2.826 1.00 25.00 H new ATOM 0 HE1 PHE B 542 -12.832 -5.096 2.354 1.00 25.00 H new ATOM 0 HE2 PHE B 542 -12.383 -1.654 4.821 1.00 25.00 H new ATOM 0 HZ PHE B 542 -12.773 -4.071 4.588 1.00 25.00 H new ATOM 1795 N SER B 543 -14.901 -0.868 -1.600 1.00 25.00 N ATOM 1796 CA SER B 543 -16.370 -1.001 -1.607 1.00 25.00 C ATOM 1797 C SER B 543 -16.844 -2.233 -2.402 1.00 25.00 C ATOM 1798 O SER B 543 -17.953 -2.729 -2.179 1.00 25.00 O ATOM 1799 CB SER B 543 -17.002 0.271 -2.183 1.00 25.00 C ATOM 1800 OG SER B 543 -16.607 0.485 -3.530 1.00 25.00 O ATOM 0 H SER B 543 -14.563 -0.030 -2.074 1.00 25.00 H new ATOM 0 HA SER B 543 -16.691 -1.141 -0.575 1.00 25.00 H new ATOM 0 HB2 SER B 543 -18.088 0.195 -2.129 1.00 25.00 H new ATOM 0 HB3 SER B 543 -16.712 1.129 -1.577 1.00 25.00 H new ATOM 0 HG SER B 543 -15.645 0.670 -3.563 1.00 25.00 H new ATOM 1806 N ALA B 544 -15.995 -2.716 -3.321 1.00 25.00 N ATOM 1807 CA ALA B 544 -16.310 -3.884 -4.154 1.00 25.00 C ATOM 1808 C ALA B 544 -16.036 -5.208 -3.424 1.00 25.00 C ATOM 1809 O ALA B 544 -16.618 -6.240 -3.768 1.00 25.00 O ATOM 1810 CB ALA B 544 -15.519 -3.826 -5.454 1.00 25.00 C ATOM 0 H ALA B 544 -15.077 -2.311 -3.506 1.00 25.00 H new ATOM 0 HA ALA B 544 -17.377 -3.851 -4.375 1.00 25.00 H new ATOM 0 HB1 ALA B 544 -15.759 -4.696 -6.065 1.00 25.00 H new ATOM 0 HB2 ALA B 544 -15.779 -2.918 -5.998 1.00 25.00 H new ATOM 0 HB3 ALA B 544 -14.452 -3.823 -5.231 1.00 25.00 H new ATOM 1816 N LEU B 545 -15.152 -5.163 -2.414 1.00 25.00 N ATOM 1817 CA LEU B 545 -14.786 -6.343 -1.624 1.00 25.00 C ATOM 1818 C LEU B 545 -15.804 -6.651 -0.515 1.00 25.00 C ATOM 1819 O LEU B 545 -15.798 -7.753 0.045 1.00 25.00 O ATOM 1820 CB LEU B 545 -13.399 -6.144 -1.022 1.00 25.00 C ATOM 1821 CG LEU B 545 -12.722 -7.431 -0.525 1.00 25.00 C ATOM 1822 CD1 LEU B 545 -12.287 -8.327 -1.677 1.00 25.00 C ATOM 1823 CD2 LEU B 545 -11.546 -7.087 0.367 1.00 25.00 C ATOM 0 H LEU B 545 -14.674 -4.309 -2.125 1.00 25.00 H new ATOM 0 HA LEU B 545 -14.783 -7.200 -2.298 1.00 25.00 H new ATOM 0 HB2 LEU B 545 -12.757 -5.678 -1.770 1.00 25.00 H new ATOM 0 HB3 LEU B 545 -13.477 -5.446 -0.189 1.00 25.00 H new ATOM 0 HG LEU B 545 -13.455 -7.993 0.055 1.00 25.00 H new ATOM 0 HD11 LEU B 545 -11.813 -9.225 -1.281 1.00 25.00 H new ATOM 0 HD12 LEU B 545 -13.158 -8.607 -2.269 1.00 25.00 H new ATOM 0 HD13 LEU B 545 -11.578 -7.791 -2.307 1.00 25.00 H new ATOM 0 HD21 LEU B 545 -11.072 -8.005 0.715 1.00 25.00 H new ATOM 0 HD22 LEU B 545 -10.823 -6.496 -0.196 1.00 25.00 H new ATOM 0 HD23 LEU B 545 -11.896 -6.512 1.224 1.00 25.00 H new ATOM 1835 N LEU B 546 -16.675 -5.677 -0.206 1.00 25.00 N ATOM 1836 CA LEU B 546 -17.737 -5.859 0.797 1.00 25.00 C ATOM 1837 C LEU B 546 -18.954 -6.547 0.179 1.00 25.00 C ATOM 1838 O LEU B 546 -19.654 -7.317 0.842 1.00 25.00 O ATOM 1839 CB LEU B 546 -18.165 -4.505 1.396 1.00 25.00 C ATOM 1840 CG LEU B 546 -17.121 -3.781 2.255 1.00 25.00 C ATOM 1841 CD1 LEU B 546 -17.643 -2.420 2.690 1.00 25.00 C ATOM 1842 CD2 LEU B 546 -16.753 -4.608 3.478 1.00 25.00 C ATOM 0 H LEU B 546 -16.664 -4.753 -0.638 1.00 25.00 H new ATOM 0 HA LEU B 546 -17.335 -6.488 1.591 1.00 25.00 H new ATOM 0 HB2 LEU B 546 -18.452 -3.845 0.578 1.00 25.00 H new ATOM 0 HB3 LEU B 546 -19.056 -4.666 2.003 1.00 25.00 H new ATOM 0 HG LEU B 546 -16.226 -3.643 1.649 1.00 25.00 H new ATOM 0 HD11 LEU B 546 -16.890 -1.919 3.299 1.00 25.00 H new ATOM 0 HD12 LEU B 546 -17.859 -1.815 1.810 1.00 25.00 H new ATOM 0 HD13 LEU B 546 -18.554 -2.549 3.274 1.00 25.00 H new ATOM 0 HD21 LEU B 546 -16.011 -4.072 4.070 1.00 25.00 H new ATOM 0 HD22 LEU B 546 -17.644 -4.780 4.082 1.00 25.00 H new ATOM 0 HD23 LEU B 546 -16.340 -5.565 3.159 1.00 25.00 H new ATOM 1854 N SER B 547 -19.185 -6.250 -1.104 1.00 25.00 N ATOM 1855 CA SER B 547 -20.285 -6.843 -1.878 1.00 25.00 C ATOM 1856 C SER B 547 -19.991 -8.295 -2.295 1.00 25.00 C ATOM 1857 O SER B 547 -20.906 -9.034 -2.672 1.00 25.00 O ATOM 1858 CB SER B 547 -20.579 -5.985 -3.117 1.00 25.00 C ATOM 1859 OG SER B 547 -19.516 -6.044 -4.055 1.00 25.00 O ATOM 0 H SER B 547 -18.616 -5.592 -1.637 1.00 25.00 H new ATOM 0 HA SER B 547 -21.162 -6.865 -1.231 1.00 25.00 H new ATOM 0 HB2 SER B 547 -21.500 -6.328 -3.588 1.00 25.00 H new ATOM 0 HB3 SER B 547 -20.741 -4.951 -2.814 1.00 25.00 H new ATOM 0 HG SER B 547 -18.663 -6.121 -3.578 1.00 25.00 H new ATOM 1865 N GLN B 548 -18.709 -8.693 -2.219 1.00 25.00 N ATOM 1866 CA GLN B 548 -18.281 -10.052 -2.592 1.00 25.00 C ATOM 1867 C GLN B 548 -18.486 -11.056 -1.452 1.00 25.00 C ATOM 1868 O GLN B 548 -18.406 -12.270 -1.660 1.00 25.00 O ATOM 1869 CB GLN B 548 -16.809 -10.059 -3.030 1.00 25.00 C ATOM 1870 CG GLN B 548 -16.557 -9.516 -4.437 1.00 25.00 C ATOM 1871 CD GLN B 548 -17.231 -10.327 -5.536 1.00 25.00 C ATOM 1872 OE1 GLN B 548 -17.145 -11.556 -5.558 1.00 25.00 O ATOM 1873 NE2 GLN B 548 -17.900 -9.640 -6.456 1.00 25.00 N ATOM 0 H GLN B 548 -17.950 -8.091 -1.902 1.00 25.00 H new ATOM 0 HA GLN B 548 -18.908 -10.361 -3.428 1.00 25.00 H new ATOM 0 HB2 GLN B 548 -16.230 -9.470 -2.319 1.00 25.00 H new ATOM 0 HB3 GLN B 548 -16.434 -11.081 -2.977 1.00 25.00 H new ATOM 0 HG2 GLN B 548 -16.911 -8.486 -4.488 1.00 25.00 H new ATOM 0 HG3 GLN B 548 -15.483 -9.493 -4.621 1.00 25.00 H new ATOM 0 HE21 GLN B 548 -17.946 -8.623 -6.400 1.00 25.00 H new ATOM 0 HE22 GLN B 548 -18.368 -10.130 -7.219 1.00 25.00 H new ATOM 1882 N ILE B 549 -18.757 -10.531 -0.256 1.00 25.00 N ATOM 1883 CA ILE B 549 -18.946 -11.356 0.946 1.00 25.00 C ATOM 1884 C ILE B 549 -20.440 -11.435 1.313 1.00 25.00 C ATOM 1885 O ILE B 549 -20.900 -12.452 1.841 1.00 25.00 O ATOM 1886 CB ILE B 549 -18.127 -10.805 2.167 1.00 25.00 C ATOM 1887 CG1 ILE B 549 -16.586 -10.926 1.951 1.00 25.00 C ATOM 1888 CG2 ILE B 549 -18.538 -11.493 3.479 1.00 25.00 C ATOM 1889 CD1 ILE B 549 -15.699 -10.228 2.985 1.00 25.00 C ATOM 0 H ILE B 549 -18.852 -9.529 -0.090 1.00 25.00 H new ATOM 0 HA ILE B 549 -18.575 -12.355 0.716 1.00 25.00 H new ATOM 0 HB ILE B 549 -18.367 -9.744 2.243 1.00 25.00 H new ATOM 0 HG12 ILE B 549 -16.325 -11.984 1.935 1.00 25.00 H new ATOM 0 HG13 ILE B 549 -16.346 -10.523 0.967 1.00 25.00 H new ATOM 0 HG21 ILE B 549 -17.951 -11.087 4.302 1.00 25.00 H new ATOM 0 HG22 ILE B 549 -19.597 -11.316 3.667 1.00 25.00 H new ATOM 0 HG23 ILE B 549 -18.358 -12.565 3.399 1.00 25.00 H new ATOM 0 HD11 ILE B 549 -14.651 -10.383 2.729 1.00 25.00 H new ATOM 0 HD12 ILE B 549 -15.918 -9.160 2.990 1.00 25.00 H new ATOM 0 HD13 ILE B 549 -15.896 -10.643 3.973 1.00 25.00 H new ATOM 1901 N SER B 550 -21.181 -10.355 1.024 1.00 25.00 N ATOM 1902 CA SER B 550 -22.611 -10.274 1.345 1.00 25.00 C ATOM 1903 C SER B 550 -23.486 -10.665 0.147 1.00 25.00 C ATOM 1904 O SER B 550 -24.501 -11.346 0.316 1.00 25.00 O ATOM 1905 CB SER B 550 -22.968 -8.858 1.824 1.00 25.00 C ATOM 1906 OG SER B 550 -22.710 -7.889 0.820 1.00 25.00 O ATOM 0 H SER B 550 -20.810 -9.522 0.566 1.00 25.00 H new ATOM 0 HA SER B 550 -22.811 -10.986 2.146 1.00 25.00 H new ATOM 0 HB2 SER B 550 -24.021 -8.822 2.104 1.00 25.00 H new ATOM 0 HB3 SER B 550 -22.392 -8.619 2.718 1.00 25.00 H new ATOM 0 HG SER B 550 -21.754 -7.673 0.812 1.00 25.00 H new ATOM 1912 N SER B 551 -23.076 -10.228 -1.066 1.00 25.00 N ATOM 1913 CA SER B 551 -23.799 -10.498 -2.334 1.00 25.00 C ATOM 1914 C SER B 551 -25.231 -9.933 -2.307 1.00 25.00 C ATOM 1915 O SER B 551 -25.441 -8.841 -2.875 1.00 25.00 O ATOM 1916 CB SER B 551 -23.807 -12.006 -2.670 1.00 25.00 C ATOM 1917 OG SER B 551 -22.497 -12.491 -2.915 1.00 25.00 O ATOM 1918 OXT SER B 551 -26.123 -10.579 -1.711 1.00 25.00 O ATOM 0 H SER B 551 -22.229 -9.674 -1.195 1.00 25.00 H new ATOM 0 HA SER B 551 -23.257 -9.981 -3.126 1.00 25.00 H new ATOM 0 HB2 SER B 551 -24.253 -12.561 -1.845 1.00 25.00 H new ATOM 0 HB3 SER B 551 -24.431 -12.181 -3.547 1.00 25.00 H new ATOM 0 HG SER B 551 -22.536 -13.448 -3.123 1.00 25.00 H new TER 1924 SER B 551