USER MOD reduce.3.24.130724 H: found=0, std=0, add=950, rem=0, adj=27 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 640 TYR OH : rot 112:sc= -3.58 USER MOD Set 1.2: A 649 TYR OH : rot 50:sc= 1.39 USER MOD Set 2.1: A 609 GLN : amide:sc= -0.379 K(o=0.23,f=-2.7!) USER MOD Set 2.2: A 614 THR OG1 : rot 42:sc= 0.61 USER MOD Set 3.1: A 601 SER OG : rot -31:sc= 0.745 USER MOD Set 3.2: A 602 HIS : no HD1:sc= -0.0188 X(o=0.73,f=0.74) USER MOD Single : A 589 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 592 HIS : no HD1:sc= -1.13 K(o=-1.1,f=0.32) USER MOD Single : A 594 HIS : no HE2:sc= 0.0469 X(o=0.047,f=-0.22) USER MOD Single : A 596 THR OG1 : rot -150:sc= 0.188 USER MOD Single : A 597 GLN : amide:sc= -0.965 K(o=-0.97,f=0) USER MOD Single : A 605 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 606 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 621 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 625 MET CE :methyl -141:sc= -0.418 (180deg=-1.47) USER MOD Single : A 627 ASN : amide:sc= -0.0721 K(o=-0.072,f=-1.7!) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 639 MET CE :methyl -117:sc= -9.67! (180deg=-10.6!) USER MOD Single : A 642 SER OG : rot 180:sc= -0.419 USER MOD Single : A 644 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 645 SER OG : rot 180:sc= -0.0152 USER MOD Single : A 650 TYR OH : rot 80:sc= -0.175 USER MOD Single : A 651 HIS : no HD1:sc= 0 X(o=0,f=-0.0082) USER MOD Single : A 656 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0479) 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= -0.18 K(o=-0.18,f=-0.81) USER MOD Single : A 662 LYS NZ :NH3+ -115:sc= 0.293 (180deg=-0.141) USER MOD Single : A 667 LYS NZ :NH3+ 171:sc= 0.187 (180deg=0.0779) USER MOD Single : A 670 SER OG : rot -72:sc= 0.128 USER MOD Single : B 520 SER OG : rot 180:sc= 0 USER MOD Single : B 523 TYR OH : rot 180:sc= 0 USER MOD Single : B 525 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 529 SER OG : rot 180:sc= -0.0384 USER MOD Single : B 535 SER OG : rot 160:sc= -0.396 USER MOD Single : B 536 SER OG : rot -73:sc= 0.579 USER MOD Single : B 540 MET CE :methyl -171:sc= 0 (180deg=-0.076) USER MOD Single : B 543 SER OG : rot 180:sc= 0 USER MOD Single : B 547 SER OG : rot -26:sc= 0.208 USER MOD Single : B 548 GLN : amide:sc= -0.33 X(o=-0.33,f=-0.35) USER MOD Single : B 550 SER OG : rot -84:sc= 1.23 USER MOD Single : B 551 SER OG : rot -20:sc= 0.021 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 586 27.518 -2.494 -9.230 1.00 25.00 N ATOM 2 CA GLY A 586 26.556 -2.433 -8.094 1.00 25.00 C ATOM 3 C GLY A 586 27.119 -3.040 -6.825 1.00 25.00 C ATOM 4 O GLY A 586 27.562 -4.193 -6.828 1.00 25.00 O ATOM 0 HA2 GLY A 586 26.285 -1.394 -7.907 1.00 25.00 H new ATOM 0 HA3 GLY A 586 25.640 -2.957 -8.369 1.00 25.00 H new ATOM 10 N VAL A 587 27.099 -2.258 -5.739 1.00 25.00 N ATOM 11 CA VAL A 587 27.610 -2.704 -4.435 1.00 25.00 C ATOM 12 C VAL A 587 26.483 -3.359 -3.620 1.00 25.00 C ATOM 13 O VAL A 587 25.397 -2.791 -3.476 1.00 25.00 O ATOM 14 CB VAL A 587 28.243 -1.525 -3.623 1.00 25.00 C ATOM 15 CG1 VAL A 587 28.753 -1.984 -2.256 1.00 25.00 C ATOM 16 CG2 VAL A 587 29.381 -0.865 -4.399 1.00 25.00 C ATOM 0 H VAL A 587 26.732 -1.306 -5.737 1.00 25.00 H new ATOM 0 HA VAL A 587 28.395 -3.436 -4.623 1.00 25.00 H new ATOM 0 HB VAL A 587 27.450 -0.794 -3.466 1.00 25.00 H new ATOM 0 HG11 VAL A 587 29.185 -1.136 -1.725 1.00 25.00 H new ATOM 0 HG12 VAL A 587 27.924 -2.391 -1.677 1.00 25.00 H new ATOM 0 HG13 VAL A 587 29.514 -2.753 -2.391 1.00 25.00 H new ATOM 0 HG21 VAL A 587 29.800 -0.050 -3.808 1.00 25.00 H new ATOM 0 HG22 VAL A 587 30.158 -1.602 -4.603 1.00 25.00 H new ATOM 0 HG23 VAL A 587 28.999 -0.471 -5.341 1.00 25.00 H new ATOM 26 N ARG A 588 26.764 -4.561 -3.102 1.00 25.00 N ATOM 27 CA ARG A 588 25.803 -5.308 -2.284 1.00 25.00 C ATOM 28 C ARG A 588 25.984 -4.987 -0.799 1.00 25.00 C ATOM 29 O ARG A 588 27.095 -5.077 -0.266 1.00 25.00 O ATOM 30 CB ARG A 588 25.940 -6.829 -2.513 1.00 25.00 C ATOM 31 CG ARG A 588 25.584 -7.306 -3.928 1.00 25.00 C ATOM 32 CD ARG A 588 25.913 -8.783 -4.158 1.00 25.00 C ATOM 33 NE ARG A 588 27.360 -9.044 -4.148 1.00 25.00 N ATOM 34 CZ ARG A 588 27.920 -10.263 -4.116 1.00 25.00 C ATOM 35 NH1 ARG A 588 27.173 -11.366 -4.094 1.00 25.00 N ATOM 36 NH2 ARG A 588 29.241 -10.374 -4.106 1.00 25.00 N ATOM 0 H ARG A 588 27.655 -5.039 -3.237 1.00 25.00 H new ATOM 0 HA ARG A 588 24.803 -5.000 -2.591 1.00 25.00 H new ATOM 0 HB2 ARG A 588 26.966 -7.123 -2.294 1.00 25.00 H new ATOM 0 HB3 ARG A 588 25.300 -7.348 -1.799 1.00 25.00 H new ATOM 0 HG2 ARG A 588 24.521 -7.144 -4.104 1.00 25.00 H new ATOM 0 HG3 ARG A 588 26.123 -6.701 -4.657 1.00 25.00 H new ATOM 0 HD2 ARG A 588 25.433 -9.384 -3.385 1.00 25.00 H new ATOM 0 HD3 ARG A 588 25.496 -9.101 -5.114 1.00 25.00 H new ATOM 0 HE ARG A 588 27.985 -8.238 -4.167 1.00 25.00 H new ATOM 0 HH11 ARG A 588 26.156 -11.293 -4.101 1.00 25.00 H new ATOM 0 HH12 ARG A 588 27.618 -12.283 -4.070 1.00 25.00 H new ATOM 0 HH21 ARG A 588 29.823 -9.537 -4.123 1.00 25.00 H new ATOM 0 HH22 ARG A 588 29.675 -11.297 -4.082 1.00 25.00 H new ATOM 50 N LYS A 589 24.881 -4.608 -0.145 1.00 25.00 N ATOM 51 CA LYS A 589 24.894 -4.269 1.282 1.00 25.00 C ATOM 52 C LYS A 589 24.156 -5.335 2.108 1.00 25.00 C ATOM 53 O LYS A 589 23.711 -6.345 1.553 1.00 25.00 O ATOM 54 CB LYS A 589 24.284 -2.870 1.515 1.00 25.00 C ATOM 55 CG LYS A 589 25.019 -1.716 0.826 1.00 25.00 C ATOM 56 CD LYS A 589 24.401 -0.361 1.153 1.00 25.00 C ATOM 57 CE LYS A 589 25.027 0.747 0.321 1.00 25.00 C ATOM 58 NZ LYS A 589 24.407 2.071 0.602 1.00 25.00 N ATOM 0 H LYS A 589 23.964 -4.528 -0.584 1.00 25.00 H new ATOM 0 HA LYS A 589 25.931 -4.247 1.616 1.00 25.00 H new ATOM 0 HB2 LYS A 589 23.250 -2.880 1.169 1.00 25.00 H new ATOM 0 HB3 LYS A 589 24.260 -2.676 2.587 1.00 25.00 H new ATOM 0 HG2 LYS A 589 26.065 -1.720 1.132 1.00 25.00 H new ATOM 0 HG3 LYS A 589 25.002 -1.870 -0.253 1.00 25.00 H new ATOM 0 HD2 LYS A 589 23.327 -0.395 0.969 1.00 25.00 H new ATOM 0 HD3 LYS A 589 24.536 -0.144 2.213 1.00 25.00 H new ATOM 0 HE2 LYS A 589 26.096 0.796 0.527 1.00 25.00 H new ATOM 0 HE3 LYS A 589 24.917 0.512 -0.738 1.00 25.00 H new ATOM 0 HZ1 LYS A 589 24.862 2.799 0.015 1.00 25.00 H new ATOM 0 HZ2 LYS A 589 23.391 2.033 0.381 1.00 25.00 H new ATOM 0 HZ3 LYS A 589 24.534 2.308 1.607 1.00 25.00 H new ATOM 72 N GLY A 590 24.028 -5.110 3.428 1.00 25.00 N ATOM 73 CA GLY A 590 23.388 -6.085 4.318 1.00 25.00 C ATOM 74 C GLY A 590 21.905 -6.308 4.030 1.00 25.00 C ATOM 75 O GLY A 590 21.421 -7.441 4.106 1.00 25.00 O ATOM 0 H GLY A 590 24.358 -4.266 3.896 1.00 25.00 H new ATOM 0 HA2 GLY A 590 23.911 -7.037 4.233 1.00 25.00 H new ATOM 0 HA3 GLY A 590 23.501 -5.750 5.349 1.00 25.00 H new ATOM 79 N TRP A 591 21.198 -5.225 3.676 1.00 25.00 N ATOM 80 CA TRP A 591 19.749 -5.262 3.407 1.00 25.00 C ATOM 81 C TRP A 591 19.407 -6.054 2.132 1.00 25.00 C ATOM 82 O TRP A 591 18.387 -6.739 2.081 1.00 25.00 O ATOM 83 CB TRP A 591 19.194 -3.824 3.319 1.00 25.00 C ATOM 84 CG TRP A 591 19.716 -2.985 2.173 1.00 25.00 C ATOM 85 CD1 TRP A 591 20.774 -2.119 2.197 1.00 25.00 C ATOM 86 CD2 TRP A 591 19.180 -2.924 0.841 1.00 25.00 C ATOM 87 NE1 TRP A 591 20.937 -1.537 0.962 1.00 25.00 N ATOM 88 CE2 TRP A 591 19.969 -2.011 0.114 1.00 25.00 C ATOM 89 CE3 TRP A 591 18.112 -3.555 0.189 1.00 25.00 C ATOM 90 CZ2 TRP A 591 19.723 -1.715 -1.226 1.00 25.00 C ATOM 91 CZ3 TRP A 591 17.872 -3.258 -1.139 1.00 25.00 C ATOM 92 CH2 TRP A 591 18.674 -2.347 -1.833 1.00 25.00 C ATOM 0 H TRP A 591 21.612 -4.299 3.568 1.00 25.00 H new ATOM 0 HA TRP A 591 19.275 -5.785 4.238 1.00 25.00 H new ATOM 0 HB2 TRP A 591 18.108 -3.878 3.240 1.00 25.00 H new ATOM 0 HB3 TRP A 591 19.420 -3.310 4.253 1.00 25.00 H new ATOM 0 HD1 TRP A 591 21.392 -1.921 3.060 1.00 25.00 H new ATOM 0 HE1 TRP A 591 21.661 -0.862 0.716 1.00 25.00 H new ATOM 0 HE3 TRP A 591 17.487 -4.261 0.715 1.00 25.00 H new ATOM 0 HZ2 TRP A 591 20.340 -1.011 -1.765 1.00 25.00 H new ATOM 0 HZ3 TRP A 591 17.050 -3.738 -1.650 1.00 25.00 H new ATOM 0 HH2 TRP A 591 18.460 -2.138 -2.871 1.00 25.00 H new ATOM 103 N HIS A 592 20.280 -5.961 1.119 1.00 25.00 N ATOM 104 CA HIS A 592 20.072 -6.628 -0.177 1.00 25.00 C ATOM 105 C HIS A 592 20.180 -8.162 -0.050 1.00 25.00 C ATOM 106 O HIS A 592 19.480 -8.897 -0.754 1.00 25.00 O ATOM 107 CB HIS A 592 21.096 -6.096 -1.201 1.00 25.00 C ATOM 108 CG HIS A 592 21.018 -6.726 -2.569 1.00 25.00 C ATOM 109 ND1 HIS A 592 20.198 -6.247 -3.568 1.00 25.00 N ATOM 110 CD2 HIS A 592 21.678 -7.784 -3.104 1.00 25.00 C ATOM 111 CE1 HIS A 592 20.353 -6.981 -4.656 1.00 25.00 C ATOM 112 NE2 HIS A 592 21.246 -7.921 -4.401 1.00 25.00 N ATOM 0 H HIS A 592 21.146 -5.425 1.173 1.00 25.00 H new ATOM 0 HA HIS A 592 19.063 -6.402 -0.522 1.00 25.00 H new ATOM 0 HB2 HIS A 592 20.957 -5.020 -1.305 1.00 25.00 H new ATOM 0 HB3 HIS A 592 22.099 -6.251 -0.803 1.00 25.00 H new ATOM 0 HD2 HIS A 592 22.407 -8.403 -2.603 1.00 25.00 H new ATOM 0 HE1 HIS A 592 19.837 -6.837 -5.594 1.00 25.00 H new ATOM 0 HE2 HIS A 592 21.563 -8.632 -5.060 1.00 25.00 H new ATOM 121 N GLU A 593 21.059 -8.627 0.851 1.00 25.00 N ATOM 122 CA GLU A 593 21.243 -10.050 1.116 1.00 25.00 C ATOM 123 C GLU A 593 20.245 -10.542 2.186 1.00 25.00 C ATOM 124 O GLU A 593 20.076 -11.750 2.382 1.00 25.00 O ATOM 125 CB GLU A 593 22.696 -10.284 1.565 1.00 25.00 C ATOM 126 CG GLU A 593 23.744 -9.935 0.522 1.00 25.00 C ATOM 127 CD GLU A 593 23.537 -10.640 -0.810 1.00 25.00 C ATOM 128 OE1 GLU A 593 23.424 -11.884 -0.811 1.00 25.00 O ATOM 129 OE2 GLU A 593 23.489 -9.947 -1.849 1.00 25.00 O ATOM 0 H GLU A 593 21.659 -8.022 1.412 1.00 25.00 H new ATOM 0 HA GLU A 593 21.049 -10.620 0.208 1.00 25.00 H new ATOM 0 HB2 GLU A 593 22.885 -9.694 2.462 1.00 25.00 H new ATOM 0 HB3 GLU A 593 22.813 -11.332 1.842 1.00 25.00 H new ATOM 0 HG2 GLU A 593 23.736 -8.857 0.358 1.00 25.00 H new ATOM 0 HG3 GLU A 593 24.730 -10.192 0.910 1.00 25.00 H new ATOM 136 N HIS A 594 19.589 -9.588 2.858 1.00 25.00 N ATOM 137 CA HIS A 594 18.622 -9.880 3.919 1.00 25.00 C ATOM 138 C HIS A 594 17.173 -9.852 3.388 1.00 25.00 C ATOM 139 O HIS A 594 16.299 -10.525 3.944 1.00 25.00 O ATOM 140 CB HIS A 594 18.840 -8.869 5.070 1.00 25.00 C ATOM 141 CG HIS A 594 19.590 -9.380 6.269 1.00 25.00 C ATOM 142 ND1 HIS A 594 20.767 -8.830 6.727 1.00 25.00 N ATOM 143 CD2 HIS A 594 19.294 -10.396 7.112 1.00 25.00 C ATOM 144 CE1 HIS A 594 21.167 -9.490 7.801 1.00 25.00 C ATOM 145 NE2 HIS A 594 20.289 -10.444 8.055 1.00 25.00 N ATOM 0 H HIS A 594 19.715 -8.592 2.680 1.00 25.00 H new ATOM 0 HA HIS A 594 18.782 -10.890 4.295 1.00 25.00 H new ATOM 0 HB2 HIS A 594 19.376 -8.007 4.672 1.00 25.00 H new ATOM 0 HB3 HIS A 594 17.865 -8.512 5.402 1.00 25.00 H new ATOM 0 HD1 HIS A 594 21.253 -8.039 6.305 1.00 25.00 H new ATOM 0 HD2 HIS A 594 18.435 -11.048 7.053 1.00 25.00 H new ATOM 0 HE1 HIS A 594 22.060 -9.284 8.373 1.00 25.00 H new ATOM 154 N VAL A 595 16.929 -9.079 2.319 1.00 25.00 N ATOM 155 CA VAL A 595 15.591 -8.987 1.716 1.00 25.00 C ATOM 156 C VAL A 595 15.425 -10.096 0.666 1.00 25.00 C ATOM 157 O VAL A 595 16.259 -10.239 -0.234 1.00 25.00 O ATOM 158 CB VAL A 595 15.327 -7.579 1.081 1.00 25.00 C ATOM 159 CG1 VAL A 595 13.985 -7.510 0.343 1.00 25.00 C ATOM 160 CG2 VAL A 595 15.358 -6.500 2.150 1.00 25.00 C ATOM 0 H VAL A 595 17.638 -8.511 1.856 1.00 25.00 H new ATOM 0 HA VAL A 595 14.853 -9.120 2.507 1.00 25.00 H new ATOM 0 HB VAL A 595 16.122 -7.413 0.354 1.00 25.00 H new ATOM 0 HG11 VAL A 595 13.852 -6.513 -0.078 1.00 25.00 H new ATOM 0 HG12 VAL A 595 13.973 -8.247 -0.460 1.00 25.00 H new ATOM 0 HG13 VAL A 595 13.175 -7.720 1.041 1.00 25.00 H new ATOM 0 HG21 VAL A 595 15.173 -5.528 1.692 1.00 25.00 H new ATOM 0 HG22 VAL A 595 14.588 -6.703 2.894 1.00 25.00 H new ATOM 0 HG23 VAL A 595 16.336 -6.493 2.632 1.00 25.00 H new ATOM 170 N THR A 596 14.345 -10.865 0.799 1.00 25.00 N ATOM 171 CA THR A 596 14.081 -11.997 -0.090 1.00 25.00 C ATOM 172 C THR A 596 12.893 -11.735 -1.010 1.00 25.00 C ATOM 173 O THR A 596 12.265 -10.673 -0.958 1.00 25.00 O ATOM 174 CB THR A 596 13.798 -13.302 0.703 1.00 25.00 C ATOM 175 OG1 THR A 596 12.631 -13.143 1.523 1.00 25.00 O ATOM 176 CG2 THR A 596 14.982 -13.697 1.571 1.00 25.00 C ATOM 0 H THR A 596 13.635 -10.724 1.518 1.00 25.00 H new ATOM 0 HA THR A 596 14.985 -12.119 -0.686 1.00 25.00 H new ATOM 0 HB THR A 596 13.628 -14.097 -0.023 1.00 25.00 H new ATOM 0 HG1 THR A 596 12.714 -13.704 2.322 1.00 25.00 H new ATOM 0 HG21 THR A 596 14.747 -14.614 2.111 1.00 25.00 H new ATOM 0 HG22 THR A 596 15.857 -13.860 0.941 1.00 25.00 H new ATOM 0 HG23 THR A 596 15.192 -12.900 2.284 1.00 25.00 H new ATOM 184 N GLN A 597 12.607 -12.729 -1.856 1.00 25.00 N ATOM 185 CA GLN A 597 11.371 -12.793 -2.631 1.00 25.00 C ATOM 186 C GLN A 597 10.173 -13.061 -1.687 1.00 25.00 C ATOM 187 O GLN A 597 9.024 -12.768 -2.031 1.00 25.00 O ATOM 188 CB GLN A 597 11.551 -13.895 -3.710 1.00 25.00 C ATOM 189 CG GLN A 597 12.516 -13.604 -4.869 1.00 25.00 C ATOM 190 CD GLN A 597 12.776 -14.783 -5.796 1.00 25.00 C ATOM 191 OE1 GLN A 597 13.560 -14.672 -6.740 1.00 25.00 O ATOM 192 NE2 GLN A 597 12.102 -15.899 -5.566 1.00 25.00 N ATOM 0 H GLN A 597 13.234 -13.517 -2.021 1.00 25.00 H new ATOM 0 HA GLN A 597 11.159 -11.849 -3.132 1.00 25.00 H new ATOM 0 HB2 GLN A 597 11.890 -14.802 -3.210 1.00 25.00 H new ATOM 0 HB3 GLN A 597 10.571 -14.112 -4.135 1.00 25.00 H new ATOM 0 HG2 GLN A 597 12.116 -12.779 -5.458 1.00 25.00 H new ATOM 0 HG3 GLN A 597 13.467 -13.269 -4.456 1.00 25.00 H new ATOM 0 HE21 GLN A 597 11.461 -15.954 -4.774 1.00 25.00 H new ATOM 0 HE22 GLN A 597 12.223 -16.704 -6.181 1.00 25.00 H new ATOM 201 N ASP A 598 10.473 -13.601 -0.492 1.00 25.00 N ATOM 202 CA ASP A 598 9.455 -13.924 0.509 1.00 25.00 C ATOM 203 C ASP A 598 9.070 -12.701 1.350 1.00 25.00 C ATOM 204 O ASP A 598 7.917 -12.586 1.775 1.00 25.00 O ATOM 205 CB ASP A 598 9.949 -15.054 1.419 1.00 25.00 C ATOM 206 CG ASP A 598 9.982 -16.403 0.721 1.00 25.00 C ATOM 207 OD1 ASP A 598 9.382 -16.523 -0.368 1.00 25.00 O ATOM 208 OD2 ASP A 598 10.608 -17.337 1.264 1.00 25.00 O ATOM 0 H ASP A 598 11.425 -13.823 -0.199 1.00 25.00 H new ATOM 0 HA ASP A 598 8.563 -14.251 -0.025 1.00 25.00 H new ATOM 0 HB2 ASP A 598 10.949 -14.813 1.780 1.00 25.00 H new ATOM 0 HB3 ASP A 598 9.302 -15.119 2.294 1.00 25.00 H new ATOM 213 N LEU A 599 10.037 -11.790 1.595 1.00 25.00 N ATOM 214 CA LEU A 599 9.746 -10.528 2.294 1.00 25.00 C ATOM 215 C LEU A 599 8.884 -9.593 1.444 1.00 25.00 C ATOM 216 O LEU A 599 7.907 -9.034 1.940 1.00 25.00 O ATOM 217 CB LEU A 599 11.039 -9.795 2.727 1.00 25.00 C ATOM 218 CG LEU A 599 11.303 -9.684 4.245 1.00 25.00 C ATOM 219 CD1 LEU A 599 12.692 -9.122 4.491 1.00 25.00 C ATOM 220 CD2 LEU A 599 10.293 -8.789 4.953 1.00 25.00 C ATOM 0 H LEU A 599 11.013 -11.906 1.321 1.00 25.00 H new ATOM 0 HA LEU A 599 9.186 -10.799 3.189 1.00 25.00 H new ATOM 0 HB2 LEU A 599 11.887 -10.305 2.271 1.00 25.00 H new ATOM 0 HB3 LEU A 599 11.013 -8.787 2.312 1.00 25.00 H new ATOM 0 HG LEU A 599 11.211 -10.692 4.650 1.00 25.00 H new ATOM 0 HD11 LEU A 599 12.869 -9.047 5.564 1.00 25.00 H new ATOM 0 HD12 LEU A 599 13.436 -9.782 4.045 1.00 25.00 H new ATOM 0 HD13 LEU A 599 12.769 -8.132 4.041 1.00 25.00 H new ATOM 0 HD21 LEU A 599 10.527 -8.747 6.017 1.00 25.00 H new ATOM 0 HD22 LEU A 599 10.339 -7.785 4.532 1.00 25.00 H new ATOM 0 HD23 LEU A 599 9.290 -9.194 4.817 1.00 25.00 H new ATOM 232 N ARG A 600 9.223 -9.463 0.152 1.00 25.00 N ATOM 233 CA ARG A 600 8.518 -8.540 -0.754 1.00 25.00 C ATOM 234 C ARG A 600 7.030 -8.914 -0.927 1.00 25.00 C ATOM 235 O ARG A 600 6.214 -8.064 -1.279 1.00 25.00 O ATOM 236 CB ARG A 600 9.238 -8.467 -2.122 1.00 25.00 C ATOM 237 CG ARG A 600 10.586 -7.747 -2.117 1.00 25.00 C ATOM 238 CD ARG A 600 11.284 -7.874 -3.463 1.00 25.00 C ATOM 239 NE ARG A 600 10.527 -7.229 -4.541 1.00 25.00 N ATOM 240 CZ ARG A 600 11.061 -6.774 -5.685 1.00 25.00 C ATOM 241 NH1 ARG A 600 12.366 -6.887 -5.931 1.00 25.00 N ATOM 242 NH2 ARG A 600 10.280 -6.200 -6.589 1.00 25.00 N ATOM 0 H ARG A 600 9.980 -9.985 -0.290 1.00 25.00 H new ATOM 0 HA ARG A 600 8.542 -7.551 -0.296 1.00 25.00 H new ATOM 0 HB2 ARG A 600 9.389 -9.482 -2.488 1.00 25.00 H new ATOM 0 HB3 ARG A 600 8.581 -7.966 -2.833 1.00 25.00 H new ATOM 0 HG2 ARG A 600 10.437 -6.694 -1.880 1.00 25.00 H new ATOM 0 HG3 ARG A 600 11.221 -8.164 -1.335 1.00 25.00 H new ATOM 0 HD2 ARG A 600 12.276 -7.427 -3.400 1.00 25.00 H new ATOM 0 HD3 ARG A 600 11.424 -8.929 -3.700 1.00 25.00 H new ATOM 0 HE ARG A 600 9.521 -7.118 -4.412 1.00 25.00 H new ATOM 0 HH11 ARG A 600 12.978 -7.326 -5.243 1.00 25.00 H new ATOM 0 HH12 ARG A 600 12.752 -6.535 -6.807 1.00 25.00 H new ATOM 0 HH21 ARG A 600 9.280 -6.106 -6.413 1.00 25.00 H new ATOM 0 HH22 ARG A 600 10.679 -5.852 -7.461 1.00 25.00 H new ATOM 256 N SER A 601 6.702 -10.191 -0.674 1.00 25.00 N ATOM 257 CA SER A 601 5.329 -10.695 -0.791 1.00 25.00 C ATOM 258 C SER A 601 4.515 -10.433 0.489 1.00 25.00 C ATOM 259 O SER A 601 3.308 -10.185 0.420 1.00 25.00 O ATOM 260 CB SER A 601 5.352 -12.200 -1.095 1.00 25.00 C ATOM 261 OG SER A 601 5.865 -12.941 0.000 1.00 25.00 O ATOM 0 H SER A 601 7.378 -10.898 -0.384 1.00 25.00 H new ATOM 0 HA SER A 601 4.845 -10.160 -1.609 1.00 25.00 H new ATOM 0 HB2 SER A 601 4.343 -12.541 -1.327 1.00 25.00 H new ATOM 0 HB3 SER A 601 5.962 -12.385 -1.979 1.00 25.00 H new ATOM 0 HG SER A 601 6.520 -12.397 0.485 1.00 25.00 H new ATOM 267 N HIS A 602 5.192 -10.492 1.650 1.00 25.00 N ATOM 268 CA HIS A 602 4.549 -10.294 2.961 1.00 25.00 C ATOM 269 C HIS A 602 4.295 -8.806 3.233 1.00 25.00 C ATOM 270 O HIS A 602 3.325 -8.451 3.901 1.00 25.00 O ATOM 271 CB HIS A 602 5.433 -10.906 4.065 1.00 25.00 C ATOM 272 CG HIS A 602 5.656 -12.387 3.941 1.00 25.00 C ATOM 273 ND1 HIS A 602 6.584 -13.078 4.696 1.00 25.00 N ATOM 274 CD2 HIS A 602 5.064 -13.308 3.144 1.00 25.00 C ATOM 275 CE1 HIS A 602 6.552 -14.357 4.367 1.00 25.00 C ATOM 276 NE2 HIS A 602 5.638 -14.522 3.429 1.00 25.00 N ATOM 0 H HIS A 602 6.194 -10.677 1.706 1.00 25.00 H new ATOM 0 HA HIS A 602 3.582 -10.796 2.956 1.00 25.00 H new ATOM 0 HB2 HIS A 602 6.401 -10.405 4.057 1.00 25.00 H new ATOM 0 HB3 HIS A 602 4.976 -10.701 5.033 1.00 25.00 H new ATOM 0 HD2 HIS A 602 4.285 -13.122 2.419 1.00 25.00 H new ATOM 0 HE1 HIS A 602 7.168 -15.135 4.793 1.00 25.00 H new ATOM 0 HE2 HIS A 602 5.397 -15.409 2.987 1.00 25.00 H new ATOM 285 N LEU A 603 5.193 -7.956 2.723 1.00 25.00 N ATOM 286 CA LEU A 603 5.039 -6.505 2.765 1.00 25.00 C ATOM 287 C LEU A 603 3.918 -5.999 1.847 1.00 25.00 C ATOM 288 O LEU A 603 3.339 -4.938 2.090 1.00 25.00 O ATOM 289 CB LEU A 603 6.372 -5.875 2.405 1.00 25.00 C ATOM 290 CG LEU A 603 7.484 -6.186 3.413 1.00 25.00 C ATOM 291 CD1 LEU A 603 8.867 -5.854 2.880 1.00 25.00 C ATOM 292 CD2 LEU A 603 7.244 -5.478 4.714 1.00 25.00 C ATOM 0 H LEU A 603 6.052 -8.262 2.267 1.00 25.00 H new ATOM 0 HA LEU A 603 4.743 -6.214 3.773 1.00 25.00 H new ATOM 0 HB2 LEU A 603 6.677 -6.226 1.419 1.00 25.00 H new ATOM 0 HB3 LEU A 603 6.248 -4.794 2.334 1.00 25.00 H new ATOM 0 HG LEU A 603 7.454 -7.262 3.583 1.00 25.00 H new ATOM 0 HD11 LEU A 603 9.615 -6.094 3.635 1.00 25.00 H new ATOM 0 HD12 LEU A 603 9.060 -6.438 1.980 1.00 25.00 H new ATOM 0 HD13 LEU A 603 8.920 -4.792 2.642 1.00 25.00 H new ATOM 0 HD21 LEU A 603 8.047 -5.716 5.411 1.00 25.00 H new ATOM 0 HD22 LEU A 603 7.218 -4.402 4.543 1.00 25.00 H new ATOM 0 HD23 LEU A 603 6.292 -5.801 5.134 1.00 25.00 H new ATOM 304 N VAL A 604 3.630 -6.777 0.801 1.00 25.00 N ATOM 305 CA VAL A 604 2.507 -6.532 -0.100 1.00 25.00 C ATOM 306 C VAL A 604 1.212 -7.107 0.509 1.00 25.00 C ATOM 307 O VAL A 604 0.110 -6.657 0.184 1.00 25.00 O ATOM 308 CB VAL A 604 2.844 -7.138 -1.494 1.00 25.00 C ATOM 309 CG1 VAL A 604 1.631 -7.277 -2.402 1.00 25.00 C ATOM 310 CG2 VAL A 604 3.875 -6.255 -2.172 1.00 25.00 C ATOM 0 H VAL A 604 4.177 -7.602 0.555 1.00 25.00 H new ATOM 0 HA VAL A 604 2.340 -5.463 -0.234 1.00 25.00 H new ATOM 0 HB VAL A 604 3.226 -8.145 -1.324 1.00 25.00 H new ATOM 0 HG11 VAL A 604 1.938 -7.705 -3.356 1.00 25.00 H new ATOM 0 HG12 VAL A 604 0.897 -7.930 -1.931 1.00 25.00 H new ATOM 0 HG13 VAL A 604 1.188 -6.295 -2.571 1.00 25.00 H new ATOM 0 HG21 VAL A 604 4.121 -6.668 -3.150 1.00 25.00 H new ATOM 0 HG22 VAL A 604 3.470 -5.250 -2.293 1.00 25.00 H new ATOM 0 HG23 VAL A 604 4.776 -6.212 -1.560 1.00 25.00 H new ATOM 320 N HIS A 605 1.374 -8.099 1.399 1.00 25.00 N ATOM 321 CA HIS A 605 0.275 -8.609 2.226 1.00 25.00 C ATOM 322 C HIS A 605 0.111 -7.723 3.476 1.00 25.00 C ATOM 323 O HIS A 605 -0.930 -7.748 4.141 1.00 25.00 O ATOM 324 CB HIS A 605 0.541 -10.071 2.626 1.00 25.00 C ATOM 325 CG HIS A 605 -0.622 -10.748 3.301 1.00 25.00 C ATOM 326 ND1 HIS A 605 -1.766 -11.127 2.628 1.00 25.00 N ATOM 327 CD2 HIS A 605 -0.819 -11.101 4.598 1.00 25.00 C ATOM 328 CE1 HIS A 605 -2.612 -11.681 3.479 1.00 25.00 C ATOM 329 NE2 HIS A 605 -2.061 -11.678 4.679 1.00 25.00 N ATOM 0 H HIS A 605 2.266 -8.566 1.563 1.00 25.00 H new ATOM 0 HA HIS A 605 -0.650 -8.578 1.650 1.00 25.00 H new ATOM 0 HB2 HIS A 605 0.808 -10.637 1.734 1.00 25.00 H new ATOM 0 HB3 HIS A 605 1.402 -10.102 3.293 1.00 25.00 H new ATOM 0 HD2 HIS A 605 -0.127 -10.955 5.414 1.00 25.00 H new ATOM 0 HE1 HIS A 605 -3.589 -12.070 3.234 1.00 25.00 H new ATOM 0 HE2 HIS A 605 -2.489 -12.045 5.529 1.00 25.00 H new ATOM 338 N LYS A 606 1.165 -6.943 3.768 1.00 25.00 N ATOM 339 CA LYS A 606 1.169 -5.953 4.856 1.00 25.00 C ATOM 340 C LYS A 606 0.495 -4.665 4.370 1.00 25.00 C ATOM 341 O LYS A 606 0.045 -3.832 5.163 1.00 25.00 O ATOM 342 CB LYS A 606 2.621 -5.662 5.270 1.00 25.00 C ATOM 343 CG LYS A 606 2.788 -4.748 6.477 1.00 25.00 C ATOM 344 CD LYS A 606 4.246 -4.411 6.713 1.00 25.00 C ATOM 345 CE LYS A 606 4.402 -3.511 7.927 1.00 25.00 C ATOM 346 NZ LYS A 606 5.807 -3.040 8.109 1.00 25.00 N ATOM 0 H LYS A 606 2.044 -6.983 3.252 1.00 25.00 H new ATOM 0 HA LYS A 606 0.622 -6.342 5.715 1.00 25.00 H new ATOM 0 HB2 LYS A 606 3.117 -6.609 5.482 1.00 25.00 H new ATOM 0 HB3 LYS A 606 3.139 -5.214 4.422 1.00 25.00 H new ATOM 0 HG2 LYS A 606 2.221 -3.830 6.322 1.00 25.00 H new ATOM 0 HG3 LYS A 606 2.376 -5.232 7.363 1.00 25.00 H new ATOM 0 HD2 LYS A 606 4.817 -5.328 6.859 1.00 25.00 H new ATOM 0 HD3 LYS A 606 4.657 -3.916 5.833 1.00 25.00 H new ATOM 0 HE2 LYS A 606 3.743 -2.649 7.824 1.00 25.00 H new ATOM 0 HE3 LYS A 606 4.084 -4.050 8.819 1.00 25.00 H new ATOM 0 HZ1 LYS A 606 5.862 -2.430 8.949 1.00 25.00 H new ATOM 0 HZ2 LYS A 606 6.434 -3.860 8.234 1.00 25.00 H new ATOM 0 HZ3 LYS A 606 6.104 -2.502 7.270 1.00 25.00 H new ATOM 360 N LEU A 607 0.443 -4.543 3.044 1.00 25.00 N ATOM 361 CA LEU A 607 -0.080 -3.375 2.353 1.00 25.00 C ATOM 362 C LEU A 607 -1.598 -3.472 2.178 1.00 25.00 C ATOM 363 O LEU A 607 -2.331 -2.549 2.535 1.00 25.00 O ATOM 364 CB LEU A 607 0.596 -3.306 0.972 1.00 25.00 C ATOM 365 CG LEU A 607 1.740 -2.287 0.728 1.00 25.00 C ATOM 366 CD1 LEU A 607 2.830 -2.769 -0.218 1.00 25.00 C ATOM 367 CD2 LEU A 607 1.156 -0.983 0.258 1.00 25.00 C ATOM 0 H LEU A 607 0.772 -5.272 2.411 1.00 25.00 H new ATOM 0 HA LEU A 607 0.130 -2.479 2.938 1.00 25.00 H new ATOM 0 HB2 LEU A 607 0.991 -4.298 0.752 1.00 25.00 H new ATOM 0 HB3 LEU A 607 -0.183 -3.103 0.237 1.00 25.00 H new ATOM 0 HG LEU A 607 2.244 -2.156 1.685 1.00 25.00 H new ATOM 0 HD11 LEU A 607 3.586 -1.992 -0.328 1.00 25.00 H new ATOM 0 HD12 LEU A 607 3.292 -3.669 0.187 1.00 25.00 H new ATOM 0 HD13 LEU A 607 2.394 -2.992 -1.192 1.00 25.00 H new ATOM 0 HD21 LEU A 607 1.959 -0.266 0.086 1.00 25.00 H new ATOM 0 HD22 LEU A 607 0.608 -1.143 -0.670 1.00 25.00 H new ATOM 0 HD23 LEU A 607 0.478 -0.593 1.017 1.00 25.00 H new ATOM 379 N VAL A 608 -2.049 -4.619 1.646 1.00 25.00 N ATOM 380 CA VAL A 608 -3.465 -4.862 1.325 1.00 25.00 C ATOM 381 C VAL A 608 -4.340 -4.913 2.599 1.00 25.00 C ATOM 382 O VAL A 608 -5.534 -4.609 2.540 1.00 25.00 O ATOM 383 CB VAL A 608 -3.624 -6.184 0.497 1.00 25.00 C ATOM 384 CG1 VAL A 608 -5.090 -6.568 0.298 1.00 25.00 C ATOM 385 CG2 VAL A 608 -2.940 -6.063 -0.865 1.00 25.00 C ATOM 0 H VAL A 608 -1.440 -5.407 1.426 1.00 25.00 H new ATOM 0 HA VAL A 608 -3.812 -4.025 0.720 1.00 25.00 H new ATOM 0 HB VAL A 608 -3.142 -6.972 1.076 1.00 25.00 H new ATOM 0 HG11 VAL A 608 -5.149 -7.490 -0.281 1.00 25.00 H new ATOM 0 HG12 VAL A 608 -5.562 -6.718 1.269 1.00 25.00 H new ATOM 0 HG13 VAL A 608 -5.606 -5.770 -0.236 1.00 25.00 H new ATOM 0 HG21 VAL A 608 -3.065 -6.993 -1.419 1.00 25.00 H new ATOM 0 HG22 VAL A 608 -3.389 -5.243 -1.426 1.00 25.00 H new ATOM 0 HG23 VAL A 608 -1.878 -5.866 -0.722 1.00 25.00 H new ATOM 395 N GLN A 609 -3.733 -5.275 3.741 1.00 25.00 N ATOM 396 CA GLN A 609 -4.466 -5.385 5.011 1.00 25.00 C ATOM 397 C GLN A 609 -4.626 -4.012 5.686 1.00 25.00 C ATOM 398 O GLN A 609 -5.585 -3.788 6.431 1.00 25.00 O ATOM 399 CB GLN A 609 -3.802 -6.404 5.959 1.00 25.00 C ATOM 400 CG GLN A 609 -3.889 -7.844 5.488 1.00 25.00 C ATOM 401 CD GLN A 609 -5.316 -8.322 5.248 1.00 25.00 C ATOM 402 OE1 GLN A 609 -6.222 -8.064 6.045 1.00 25.00 O ATOM 403 NE2 GLN A 609 -5.523 -9.034 4.148 1.00 25.00 N ATOM 0 H GLN A 609 -2.740 -5.496 3.810 1.00 25.00 H new ATOM 0 HA GLN A 609 -5.465 -5.756 4.781 1.00 25.00 H new ATOM 0 HB2 GLN A 609 -2.752 -6.137 6.083 1.00 25.00 H new ATOM 0 HB3 GLN A 609 -4.268 -6.326 6.941 1.00 25.00 H new ATOM 0 HG2 GLN A 609 -3.319 -7.951 4.565 1.00 25.00 H new ATOM 0 HG3 GLN A 609 -3.418 -8.489 6.230 1.00 25.00 H new ATOM 0 HE21 GLN A 609 -4.749 -9.227 3.512 1.00 25.00 H new ATOM 0 HE22 GLN A 609 -6.456 -9.388 3.938 1.00 25.00 H new ATOM 412 N ALA A 610 -3.674 -3.105 5.413 1.00 25.00 N ATOM 413 CA ALA A 610 -3.733 -1.732 5.908 1.00 25.00 C ATOM 414 C ALA A 610 -4.664 -0.868 5.050 1.00 25.00 C ATOM 415 O ALA A 610 -5.329 0.035 5.561 1.00 25.00 O ATOM 416 CB ALA A 610 -2.338 -1.140 5.928 1.00 25.00 C ATOM 0 H ALA A 610 -2.850 -3.307 4.847 1.00 25.00 H new ATOM 0 HA ALA A 610 -4.137 -1.748 6.920 1.00 25.00 H new ATOM 0 HB1 ALA A 610 -2.383 -0.115 6.297 1.00 25.00 H new ATOM 0 HB2 ALA A 610 -1.700 -1.734 6.582 1.00 25.00 H new ATOM 0 HB3 ALA A 610 -1.927 -1.144 4.919 1.00 25.00 H new ATOM 422 N ILE A 611 -4.710 -1.169 3.743 1.00 25.00 N ATOM 423 CA ILE A 611 -5.559 -0.437 2.792 1.00 25.00 C ATOM 424 C ILE A 611 -7.025 -0.909 2.917 1.00 25.00 C ATOM 425 O ILE A 611 -7.939 -0.085 2.996 1.00 25.00 O ATOM 426 CB ILE A 611 -5.028 -0.585 1.323 1.00 25.00 C ATOM 427 CG1 ILE A 611 -3.672 0.136 1.177 1.00 25.00 C ATOM 428 CG2 ILE A 611 -6.028 -0.015 0.314 1.00 25.00 C ATOM 429 CD1 ILE A 611 -2.948 -0.084 -0.147 1.00 25.00 C ATOM 0 H ILE A 611 -4.165 -1.920 3.319 1.00 25.00 H new ATOM 0 HA ILE A 611 -5.520 0.624 3.038 1.00 25.00 H new ATOM 0 HB ILE A 611 -4.900 -1.647 1.116 1.00 25.00 H new ATOM 0 HG12 ILE A 611 -3.834 1.206 1.309 1.00 25.00 H new ATOM 0 HG13 ILE A 611 -3.019 -0.190 1.986 1.00 25.00 H new ATOM 0 HG21 ILE A 611 -5.633 -0.131 -0.695 1.00 25.00 H new ATOM 0 HG22 ILE A 611 -6.974 -0.550 0.397 1.00 25.00 H new ATOM 0 HG23 ILE A 611 -6.190 1.043 0.520 1.00 25.00 H new ATOM 0 HD11 ILE A 611 -2.008 0.467 -0.143 1.00 25.00 H new ATOM 0 HD12 ILE A 611 -2.745 -1.147 -0.279 1.00 25.00 H new ATOM 0 HD13 ILE A 611 -3.573 0.270 -0.967 1.00 25.00 H new ATOM 441 N PHE A 612 -7.228 -2.237 2.928 1.00 25.00 N ATOM 442 CA PHE A 612 -8.533 -2.831 3.209 1.00 25.00 C ATOM 443 C PHE A 612 -8.359 -4.141 4.014 1.00 25.00 C ATOM 444 O PHE A 612 -7.854 -5.129 3.468 1.00 25.00 O ATOM 445 CB PHE A 612 -9.308 -3.087 1.893 1.00 25.00 C ATOM 446 CG PHE A 612 -10.674 -3.699 2.084 1.00 25.00 C ATOM 447 CD1 PHE A 612 -11.754 -2.899 2.412 1.00 25.00 C ATOM 448 CD2 PHE A 612 -10.876 -5.061 1.924 1.00 25.00 C ATOM 449 CE1 PHE A 612 -13.013 -3.441 2.580 1.00 25.00 C ATOM 450 CE2 PHE A 612 -12.132 -5.612 2.090 1.00 25.00 C ATOM 451 CZ PHE A 612 -13.204 -4.800 2.418 1.00 25.00 C ATOM 0 H PHE A 612 -6.493 -2.920 2.743 1.00 25.00 H new ATOM 0 HA PHE A 612 -9.115 -2.133 3.811 1.00 25.00 H new ATOM 0 HB2 PHE A 612 -9.418 -2.142 1.360 1.00 25.00 H new ATOM 0 HB3 PHE A 612 -8.714 -3.744 1.258 1.00 25.00 H new ATOM 0 HD1 PHE A 612 -11.611 -1.836 2.538 1.00 25.00 H new ATOM 0 HD2 PHE A 612 -10.043 -5.698 1.667 1.00 25.00 H new ATOM 0 HE1 PHE A 612 -13.846 -2.804 2.837 1.00 25.00 H new ATOM 0 HE2 PHE A 612 -12.277 -6.675 1.964 1.00 25.00 H new ATOM 0 HZ PHE A 612 -14.187 -5.228 2.547 1.00 25.00 H new ATOM 461 N PRO A 613 -8.770 -4.187 5.327 1.00 25.00 N ATOM 462 CA PRO A 613 -8.759 -5.438 6.117 1.00 25.00 C ATOM 463 C PRO A 613 -9.719 -6.491 5.551 1.00 25.00 C ATOM 464 O PRO A 613 -10.842 -6.164 5.153 1.00 25.00 O ATOM 465 CB PRO A 613 -9.214 -5.001 7.519 1.00 25.00 C ATOM 466 CG PRO A 613 -8.862 -3.561 7.612 1.00 25.00 C ATOM 467 CD PRO A 613 -9.239 -3.049 6.153 1.00 25.00 C ATOM 0 HA PRO A 613 -7.775 -5.907 6.108 1.00 25.00 H new ATOM 0 HB2 PRO A 613 -10.285 -5.154 7.651 1.00 25.00 H new ATOM 0 HB3 PRO A 613 -8.712 -5.580 8.294 1.00 25.00 H new ATOM 0 HG2 PRO A 613 -9.432 -3.048 8.387 1.00 25.00 H new ATOM 0 HG3 PRO A 613 -7.807 -3.410 7.840 1.00 25.00 H new ATOM 0 HD2 PRO A 613 -10.309 -2.871 6.041 1.00 25.00 H new ATOM 0 HD3 PRO A 613 -8.733 -2.118 5.899 1.00 25.00 H new ATOM 475 N THR A 614 -9.265 -7.748 5.516 1.00 25.00 N ATOM 476 CA THR A 614 -10.039 -8.835 4.923 1.00 25.00 C ATOM 477 C THR A 614 -10.797 -9.665 5.968 1.00 25.00 C ATOM 478 O THR A 614 -10.179 -10.327 6.809 1.00 25.00 O ATOM 479 CB THR A 614 -9.174 -9.791 4.086 1.00 25.00 C ATOM 480 OG1 THR A 614 -8.104 -10.332 4.872 1.00 25.00 O ATOM 481 CG2 THR A 614 -8.628 -9.098 2.850 1.00 25.00 C ATOM 0 H THR A 614 -8.362 -8.035 5.894 1.00 25.00 H new ATOM 0 HA THR A 614 -10.756 -8.334 4.273 1.00 25.00 H new ATOM 0 HB THR A 614 -9.811 -10.613 3.759 1.00 25.00 H new ATOM 0 HG1 THR A 614 -8.440 -10.573 5.760 1.00 25.00 H new ATOM 0 HG21 THR A 614 -8.020 -9.799 2.278 1.00 25.00 H new ATOM 0 HG22 THR A 614 -9.456 -8.749 2.233 1.00 25.00 H new ATOM 0 HG23 THR A 614 -8.015 -8.248 3.150 1.00 25.00 H new ATOM 489 N PRO A 615 -12.163 -9.624 5.936 1.00 25.00 N ATOM 490 CA PRO A 615 -13.018 -10.580 6.671 1.00 25.00 C ATOM 491 C PRO A 615 -12.930 -11.994 6.091 1.00 25.00 C ATOM 492 O PRO A 615 -12.711 -12.967 6.816 1.00 25.00 O ATOM 493 CB PRO A 615 -14.437 -10.041 6.460 1.00 25.00 C ATOM 494 CG PRO A 615 -14.280 -8.582 6.203 1.00 25.00 C ATOM 495 CD PRO A 615 -12.984 -8.620 5.226 1.00 25.00 C ATOM 0 HA PRO A 615 -12.719 -10.657 7.716 1.00 25.00 H new ATOM 0 HB2 PRO A 615 -14.923 -10.536 5.620 1.00 25.00 H new ATOM 0 HB3 PRO A 615 -15.058 -10.219 7.338 1.00 25.00 H new ATOM 0 HG2 PRO A 615 -15.155 -8.145 5.722 1.00 25.00 H new ATOM 0 HG3 PRO A 615 -14.100 -8.013 7.115 1.00 25.00 H new ATOM 0 HD2 PRO A 615 -13.235 -8.928 4.211 1.00 25.00 H new ATOM 0 HD3 PRO A 615 -12.488 -7.652 5.152 1.00 25.00 H new ATOM 503 N ASP A 616 -13.110 -12.070 4.770 1.00 25.00 N ATOM 504 CA ASP A 616 -13.081 -13.333 4.033 1.00 25.00 C ATOM 505 C ASP A 616 -11.778 -13.496 3.232 1.00 25.00 C ATOM 506 O ASP A 616 -11.372 -12.591 2.497 1.00 25.00 O ATOM 507 CB ASP A 616 -14.316 -13.437 3.122 1.00 25.00 C ATOM 508 CG ASP A 616 -14.689 -14.856 2.725 1.00 25.00 C ATOM 509 OD1 ASP A 616 -13.792 -15.595 2.276 1.00 25.00 O ATOM 510 OD2 ASP A 616 -15.876 -15.223 2.861 1.00 25.00 O ATOM 0 H ASP A 616 -13.280 -11.255 4.181 1.00 25.00 H new ATOM 0 HA ASP A 616 -13.110 -14.150 4.754 1.00 25.00 H new ATOM 0 HB2 ASP A 616 -15.166 -12.980 3.629 1.00 25.00 H new ATOM 0 HB3 ASP A 616 -14.135 -12.856 2.218 1.00 25.00 H new ATOM 515 N PRO A 617 -11.108 -14.677 3.386 1.00 25.00 N ATOM 516 CA PRO A 617 -9.885 -15.031 2.625 1.00 25.00 C ATOM 517 C PRO A 617 -10.127 -15.258 1.118 1.00 25.00 C ATOM 518 O PRO A 617 -9.175 -15.267 0.332 1.00 25.00 O ATOM 519 CB PRO A 617 -9.437 -16.344 3.287 1.00 25.00 C ATOM 520 CG PRO A 617 -10.684 -16.919 3.871 1.00 25.00 C ATOM 521 CD PRO A 617 -11.474 -15.751 4.350 1.00 25.00 C ATOM 0 HA PRO A 617 -9.154 -14.223 2.660 1.00 25.00 H new ATOM 0 HB2 PRO A 617 -8.991 -17.022 2.559 1.00 25.00 H new ATOM 0 HB3 PRO A 617 -8.686 -16.163 4.056 1.00 25.00 H new ATOM 0 HG2 PRO A 617 -11.239 -17.490 3.127 1.00 25.00 H new ATOM 0 HG3 PRO A 617 -10.456 -17.601 4.690 1.00 25.00 H new ATOM 0 HD2 PRO A 617 -12.544 -15.956 4.338 1.00 25.00 H new ATOM 0 HD3 PRO A 617 -11.213 -15.480 5.373 1.00 25.00 H new ATOM 529 N ALA A 618 -11.399 -15.450 0.732 1.00 25.00 N ATOM 530 CA ALA A 618 -11.764 -15.686 -0.672 1.00 25.00 C ATOM 531 C ALA A 618 -11.958 -14.375 -1.448 1.00 25.00 C ATOM 532 O ALA A 618 -12.031 -14.387 -2.681 1.00 25.00 O ATOM 533 CB ALA A 618 -13.013 -16.554 -0.759 1.00 25.00 C ATOM 0 H ALA A 618 -12.191 -15.446 1.374 1.00 25.00 H new ATOM 0 HA ALA A 618 -10.934 -16.215 -1.140 1.00 25.00 H new ATOM 0 HB1 ALA A 618 -13.269 -16.719 -1.806 1.00 25.00 H new ATOM 0 HB2 ALA A 618 -12.824 -17.513 -0.276 1.00 25.00 H new ATOM 0 HB3 ALA A 618 -13.841 -16.052 -0.258 1.00 25.00 H new ATOM 539 N ALA A 619 -12.038 -13.245 -0.718 1.00 25.00 N ATOM 540 CA ALA A 619 -12.098 -11.904 -1.335 1.00 25.00 C ATOM 541 C ALA A 619 -10.779 -11.515 -2.025 1.00 25.00 C ATOM 542 O ALA A 619 -10.719 -10.507 -2.739 1.00 25.00 O ATOM 543 CB ALA A 619 -12.444 -10.858 -0.286 1.00 25.00 C ATOM 0 H ALA A 619 -12.063 -13.234 0.302 1.00 25.00 H new ATOM 0 HA ALA A 619 -12.875 -11.942 -2.098 1.00 25.00 H new ATOM 0 HB1 ALA A 619 -12.485 -9.874 -0.753 1.00 25.00 H new ATOM 0 HB2 ALA A 619 -13.413 -11.091 0.155 1.00 25.00 H new ATOM 0 HB3 ALA A 619 -11.682 -10.858 0.493 1.00 25.00 H new ATOM 549 N LEU A 620 -9.735 -12.328 -1.813 1.00 25.00 N ATOM 550 CA LEU A 620 -8.397 -12.054 -2.339 1.00 25.00 C ATOM 551 C LEU A 620 -8.247 -12.499 -3.806 1.00 25.00 C ATOM 552 O LEU A 620 -7.216 -12.235 -4.437 1.00 25.00 O ATOM 553 CB LEU A 620 -7.331 -12.768 -1.471 1.00 25.00 C ATOM 554 CG LEU A 620 -7.143 -12.305 0.003 1.00 25.00 C ATOM 555 CD1 LEU A 620 -6.374 -13.333 0.831 1.00 25.00 C ATOM 556 CD2 LEU A 620 -6.468 -10.941 0.089 1.00 25.00 C ATOM 0 H LEU A 620 -9.797 -13.191 -1.273 1.00 25.00 H new ATOM 0 HA LEU A 620 -8.249 -10.975 -2.301 1.00 25.00 H new ATOM 0 HB2 LEU A 620 -7.573 -13.831 -1.457 1.00 25.00 H new ATOM 0 HB3 LEU A 620 -6.370 -12.666 -1.976 1.00 25.00 H new ATOM 0 HG LEU A 620 -8.144 -12.213 0.426 1.00 25.00 H new ATOM 0 HD11 LEU A 620 -6.266 -12.969 1.853 1.00 25.00 H new ATOM 0 HD12 LEU A 620 -6.920 -14.277 0.837 1.00 25.00 H new ATOM 0 HD13 LEU A 620 -5.387 -13.487 0.394 1.00 25.00 H new ATOM 0 HD21 LEU A 620 -6.356 -10.656 1.135 1.00 25.00 H new ATOM 0 HD22 LEU A 620 -5.486 -10.991 -0.381 1.00 25.00 H new ATOM 0 HD23 LEU A 620 -7.079 -10.200 -0.426 1.00 25.00 H new ATOM 568 N LYS A 621 -9.283 -13.161 -4.339 1.00 25.00 N ATOM 569 CA LYS A 621 -9.268 -13.672 -5.715 1.00 25.00 C ATOM 570 C LYS A 621 -10.097 -12.755 -6.638 1.00 25.00 C ATOM 571 O LYS A 621 -10.428 -13.120 -7.773 1.00 25.00 O ATOM 572 CB LYS A 621 -9.803 -15.123 -5.732 1.00 25.00 C ATOM 573 CG LYS A 621 -8.974 -16.149 -4.942 1.00 25.00 C ATOM 574 CD LYS A 621 -9.571 -17.553 -4.988 1.00 25.00 C ATOM 575 CE LYS A 621 -8.743 -18.530 -4.184 1.00 25.00 C ATOM 576 NZ LYS A 621 -9.330 -19.902 -4.165 1.00 25.00 N ATOM 0 H LYS A 621 -10.147 -13.356 -3.833 1.00 25.00 H new ATOM 0 HA LYS A 621 -8.245 -13.677 -6.091 1.00 25.00 H new ATOM 0 HB2 LYS A 621 -10.818 -15.121 -5.335 1.00 25.00 H new ATOM 0 HB3 LYS A 621 -9.866 -15.455 -6.768 1.00 25.00 H new ATOM 0 HG2 LYS A 621 -7.961 -16.177 -5.343 1.00 25.00 H new ATOM 0 HG3 LYS A 621 -8.897 -15.826 -3.904 1.00 25.00 H new ATOM 0 HD2 LYS A 621 -10.589 -17.530 -4.599 1.00 25.00 H new ATOM 0 HD3 LYS A 621 -9.632 -17.891 -6.023 1.00 25.00 H new ATOM 0 HE2 LYS A 621 -7.736 -18.575 -4.600 1.00 25.00 H new ATOM 0 HE3 LYS A 621 -8.649 -18.165 -3.161 1.00 25.00 H new ATOM 0 HZ1 LYS A 621 -8.724 -20.531 -3.601 1.00 25.00 H new ATOM 0 HZ2 LYS A 621 -10.280 -19.867 -3.744 1.00 25.00 H new ATOM 0 HZ3 LYS A 621 -9.396 -20.265 -5.137 1.00 25.00 H new ATOM 590 N ASP A 622 -10.406 -11.553 -6.134 1.00 25.00 N ATOM 591 CA ASP A 622 -11.228 -10.579 -6.850 1.00 25.00 C ATOM 592 C ASP A 622 -10.363 -9.714 -7.782 1.00 25.00 C ATOM 593 O ASP A 622 -9.169 -9.515 -7.538 1.00 25.00 O ATOM 594 CB ASP A 622 -11.970 -9.705 -5.827 1.00 25.00 C ATOM 595 CG ASP A 622 -13.127 -8.924 -6.431 1.00 25.00 C ATOM 596 OD1 ASP A 622 -12.866 -7.962 -7.182 1.00 25.00 O ATOM 597 OD2 ASP A 622 -14.292 -9.278 -6.153 1.00 25.00 O ATOM 0 H ASP A 622 -10.091 -11.232 -5.218 1.00 25.00 H new ATOM 0 HA ASP A 622 -11.953 -11.105 -7.471 1.00 25.00 H new ATOM 0 HB2 ASP A 622 -12.348 -10.338 -5.024 1.00 25.00 H new ATOM 0 HB3 ASP A 622 -11.265 -9.006 -5.377 1.00 25.00 H new ATOM 602 N ARG A 623 -11.000 -9.209 -8.850 1.00 25.00 N ATOM 603 CA ARG A 623 -10.331 -8.399 -9.877 1.00 25.00 C ATOM 604 C ARG A 623 -10.053 -6.968 -9.380 1.00 25.00 C ATOM 605 O ARG A 623 -8.943 -6.456 -9.542 1.00 25.00 O ATOM 606 CB ARG A 623 -11.202 -8.384 -11.158 1.00 25.00 C ATOM 607 CG ARG A 623 -10.646 -7.566 -12.322 1.00 25.00 C ATOM 608 CD ARG A 623 -9.306 -8.104 -12.808 1.00 25.00 C ATOM 609 NE ARG A 623 -8.734 -7.281 -13.881 1.00 25.00 N ATOM 610 CZ ARG A 623 -7.437 -7.253 -14.217 1.00 25.00 C ATOM 611 NH1 ARG A 623 -6.540 -7.998 -13.570 1.00 25.00 N ATOM 612 NH2 ARG A 623 -7.036 -6.472 -15.210 1.00 25.00 N ATOM 0 H ARG A 623 -11.995 -9.352 -9.025 1.00 25.00 H new ATOM 0 HA ARG A 623 -9.363 -8.847 -10.102 1.00 25.00 H new ATOM 0 HB2 ARG A 623 -11.342 -9.412 -11.493 1.00 25.00 H new ATOM 0 HB3 ARG A 623 -12.188 -7.995 -10.902 1.00 25.00 H new ATOM 0 HG2 ARG A 623 -11.360 -7.575 -13.145 1.00 25.00 H new ATOM 0 HG3 ARG A 623 -10.529 -6.527 -12.012 1.00 25.00 H new ATOM 0 HD2 ARG A 623 -8.608 -8.144 -11.972 1.00 25.00 H new ATOM 0 HD3 ARG A 623 -9.435 -9.126 -13.165 1.00 25.00 H new ATOM 0 HE ARG A 623 -9.371 -6.686 -14.410 1.00 25.00 H new ATOM 0 HH11 ARG A 623 -6.837 -8.603 -12.804 1.00 25.00 H new ATOM 0 HH12 ARG A 623 -5.557 -7.963 -13.841 1.00 25.00 H new ATOM 0 HH21 ARG A 623 -7.713 -5.898 -15.712 1.00 25.00 H new ATOM 0 HH22 ARG A 623 -6.050 -6.445 -15.472 1.00 25.00 H new ATOM 626 N ARG A 624 -11.078 -6.337 -8.790 1.00 25.00 N ATOM 627 CA ARG A 624 -10.972 -4.972 -8.239 1.00 25.00 C ATOM 628 C ARG A 624 -9.997 -4.894 -7.048 1.00 25.00 C ATOM 629 O ARG A 624 -9.484 -3.817 -6.732 1.00 25.00 O ATOM 630 CB ARG A 624 -12.359 -4.461 -7.817 1.00 25.00 C ATOM 631 CG ARG A 624 -13.282 -4.147 -8.992 1.00 25.00 C ATOM 632 CD ARG A 624 -14.676 -3.756 -8.523 1.00 25.00 C ATOM 633 NE ARG A 624 -15.379 -4.884 -7.894 1.00 25.00 N ATOM 634 CZ ARG A 624 -16.690 -4.910 -7.613 1.00 25.00 C ATOM 635 NH1 ARG A 624 -17.481 -3.879 -7.900 1.00 25.00 N ATOM 636 NH2 ARG A 624 -17.213 -5.986 -7.039 1.00 25.00 N ATOM 0 H ARG A 624 -12.002 -6.754 -8.680 1.00 25.00 H new ATOM 0 HA ARG A 624 -10.572 -4.337 -9.029 1.00 25.00 H new ATOM 0 HB2 ARG A 624 -12.835 -5.209 -7.183 1.00 25.00 H new ATOM 0 HB3 ARG A 624 -12.237 -3.562 -7.212 1.00 25.00 H new ATOM 0 HG2 ARG A 624 -12.856 -3.336 -9.583 1.00 25.00 H new ATOM 0 HG3 ARG A 624 -13.348 -5.017 -9.645 1.00 25.00 H new ATOM 0 HD2 ARG A 624 -14.602 -2.932 -7.813 1.00 25.00 H new ATOM 0 HD3 ARG A 624 -15.256 -3.394 -9.372 1.00 25.00 H new ATOM 0 HE ARG A 624 -14.828 -5.708 -7.653 1.00 25.00 H new ATOM 0 HH11 ARG A 624 -17.093 -3.046 -8.343 1.00 25.00 H new ATOM 0 HH12 ARG A 624 -18.475 -3.922 -7.677 1.00 25.00 H new ATOM 0 HH21 ARG A 624 -16.619 -6.784 -6.815 1.00 25.00 H new ATOM 0 HH22 ARG A 624 -18.209 -6.015 -6.822 1.00 25.00 H new ATOM 650 N MET A 625 -9.737 -6.046 -6.407 1.00 25.00 N ATOM 651 CA MET A 625 -8.771 -6.143 -5.301 1.00 25.00 C ATOM 652 C MET A 625 -7.333 -6.153 -5.841 1.00 25.00 C ATOM 653 O MET A 625 -6.449 -5.502 -5.277 1.00 25.00 O ATOM 654 CB MET A 625 -9.051 -7.422 -4.482 1.00 25.00 C ATOM 655 CG MET A 625 -8.181 -7.623 -3.231 1.00 25.00 C ATOM 656 SD MET A 625 -8.437 -6.378 -1.944 1.00 25.00 S ATOM 657 CE MET A 625 -9.508 -7.238 -0.791 1.00 25.00 C ATOM 0 H MET A 625 -10.188 -6.931 -6.640 1.00 25.00 H new ATOM 0 HA MET A 625 -8.882 -5.273 -4.653 1.00 25.00 H new ATOM 0 HB2 MET A 625 -10.097 -7.412 -4.175 1.00 25.00 H new ATOM 0 HB3 MET A 625 -8.919 -8.284 -5.135 1.00 25.00 H new ATOM 0 HG2 MET A 625 -8.386 -8.609 -2.814 1.00 25.00 H new ATOM 0 HG3 MET A 625 -7.132 -7.614 -3.526 1.00 25.00 H new ATOM 0 HE1 MET A 625 -10.256 -6.546 -0.404 1.00 25.00 H new ATOM 0 HE2 MET A 625 -10.006 -8.062 -1.302 1.00 25.00 H new ATOM 0 HE3 MET A 625 -8.914 -7.629 0.035 1.00 25.00 H new ATOM 667 N GLU A 626 -7.121 -6.895 -6.938 1.00 25.00 N ATOM 668 CA GLU A 626 -5.809 -7.017 -7.582 1.00 25.00 C ATOM 669 C GLU A 626 -5.321 -5.690 -8.189 1.00 25.00 C ATOM 670 O GLU A 626 -4.122 -5.520 -8.435 1.00 25.00 O ATOM 671 CB GLU A 626 -5.829 -8.112 -8.652 1.00 25.00 C ATOM 672 CG GLU A 626 -4.464 -8.378 -9.274 1.00 25.00 C ATOM 673 CD GLU A 626 -4.506 -9.455 -10.342 1.00 25.00 C ATOM 674 OE1 GLU A 626 -5.334 -9.339 -11.270 1.00 25.00 O ATOM 675 OE2 GLU A 626 -3.711 -10.413 -10.250 1.00 25.00 O ATOM 0 H GLU A 626 -7.857 -7.427 -7.403 1.00 25.00 H new ATOM 0 HA GLU A 626 -5.102 -7.293 -6.799 1.00 25.00 H new ATOM 0 HB2 GLU A 626 -6.204 -9.035 -8.209 1.00 25.00 H new ATOM 0 HB3 GLU A 626 -6.529 -7.828 -9.438 1.00 25.00 H new ATOM 0 HG2 GLU A 626 -4.082 -7.455 -9.710 1.00 25.00 H new ATOM 0 HG3 GLU A 626 -3.765 -8.675 -8.492 1.00 25.00 H new ATOM 682 N ASN A 627 -6.261 -4.757 -8.423 1.00 25.00 N ATOM 683 CA ASN A 627 -5.954 -3.443 -9.012 1.00 25.00 C ATOM 684 C ASN A 627 -5.078 -2.587 -8.075 1.00 25.00 C ATOM 685 O ASN A 627 -4.155 -1.915 -8.544 1.00 25.00 O ATOM 686 CB ASN A 627 -7.263 -2.707 -9.356 1.00 25.00 C ATOM 687 CG ASN A 627 -7.874 -3.146 -10.680 1.00 25.00 C ATOM 688 OD1 ASN A 627 -7.204 -3.750 -11.517 1.00 25.00 O ATOM 689 ND2 ASN A 627 -9.153 -2.838 -10.874 1.00 25.00 N ATOM 0 H ASN A 627 -7.249 -4.892 -8.210 1.00 25.00 H new ATOM 0 HA ASN A 627 -5.383 -3.607 -9.926 1.00 25.00 H new ATOM 0 HB2 ASN A 627 -7.986 -2.874 -8.558 1.00 25.00 H new ATOM 0 HB3 ASN A 627 -7.070 -1.635 -9.391 1.00 25.00 H new ATOM 0 HD21 ASN A 627 -9.615 -3.104 -11.744 1.00 25.00 H new ATOM 0 HD22 ASN A 627 -9.672 -2.336 -10.153 1.00 25.00 H new ATOM 696 N LEU A 628 -5.370 -2.614 -6.762 1.00 25.00 N ATOM 697 CA LEU A 628 -4.559 -1.875 -5.783 1.00 25.00 C ATOM 698 C LEU A 628 -3.362 -2.716 -5.319 1.00 25.00 C ATOM 699 O LEU A 628 -2.368 -2.172 -4.833 1.00 25.00 O ATOM 700 CB LEU A 628 -5.417 -1.341 -4.604 1.00 25.00 C ATOM 701 CG LEU A 628 -6.495 -0.281 -4.893 1.00 25.00 C ATOM 702 CD1 LEU A 628 -7.378 -0.060 -3.674 1.00 25.00 C ATOM 703 CD2 LEU A 628 -5.831 1.022 -5.277 1.00 25.00 C ATOM 0 H LEU A 628 -6.151 -3.133 -6.360 1.00 25.00 H new ATOM 0 HA LEU A 628 -4.154 -0.992 -6.278 1.00 25.00 H new ATOM 0 HB2 LEU A 628 -5.910 -2.196 -4.141 1.00 25.00 H new ATOM 0 HB3 LEU A 628 -4.736 -0.925 -3.862 1.00 25.00 H new ATOM 0 HG LEU A 628 -7.119 -0.636 -5.713 1.00 25.00 H new ATOM 0 HD11 LEU A 628 -8.132 0.693 -3.903 1.00 25.00 H new ATOM 0 HD12 LEU A 628 -7.869 -0.995 -3.406 1.00 25.00 H new ATOM 0 HD13 LEU A 628 -6.766 0.281 -2.839 1.00 25.00 H new ATOM 0 HD21 LEU A 628 -6.594 1.773 -5.482 1.00 25.00 H new ATOM 0 HD22 LEU A 628 -5.197 1.363 -4.458 1.00 25.00 H new ATOM 0 HD23 LEU A 628 -5.222 0.871 -6.168 1.00 25.00 H new ATOM 715 N VAL A 629 -3.483 -4.050 -5.452 1.00 25.00 N ATOM 716 CA VAL A 629 -2.342 -4.971 -5.287 1.00 25.00 C ATOM 717 C VAL A 629 -1.211 -4.537 -6.232 1.00 25.00 C ATOM 718 O VAL A 629 -0.037 -4.548 -5.865 1.00 25.00 O ATOM 719 CB VAL A 629 -2.765 -6.445 -5.594 1.00 25.00 C ATOM 720 CG1 VAL A 629 -1.571 -7.340 -5.942 1.00 25.00 C ATOM 721 CG2 VAL A 629 -3.544 -7.041 -4.425 1.00 25.00 C ATOM 0 H VAL A 629 -4.363 -4.516 -5.674 1.00 25.00 H new ATOM 0 HA VAL A 629 -1.998 -4.931 -4.254 1.00 25.00 H new ATOM 0 HB VAL A 629 -3.409 -6.407 -6.472 1.00 25.00 H new ATOM 0 HG11 VAL A 629 -1.922 -8.352 -6.146 1.00 25.00 H new ATOM 0 HG12 VAL A 629 -1.066 -6.946 -6.824 1.00 25.00 H new ATOM 0 HG13 VAL A 629 -0.874 -7.360 -5.104 1.00 25.00 H new ATOM 0 HG21 VAL A 629 -3.827 -8.067 -4.662 1.00 25.00 H new ATOM 0 HG22 VAL A 629 -2.920 -7.034 -3.531 1.00 25.00 H new ATOM 0 HG23 VAL A 629 -4.441 -6.449 -4.246 1.00 25.00 H new ATOM 731 N ALA A 630 -1.620 -4.133 -7.439 1.00 25.00 N ATOM 732 CA ALA A 630 -0.720 -3.619 -8.465 1.00 25.00 C ATOM 733 C ALA A 630 -0.160 -2.237 -8.089 1.00 25.00 C ATOM 734 O ALA A 630 0.861 -1.806 -8.635 1.00 25.00 O ATOM 735 CB ALA A 630 -1.468 -3.579 -9.784 1.00 25.00 C ATOM 0 H ALA A 630 -2.597 -4.156 -7.730 1.00 25.00 H new ATOM 0 HA ALA A 630 0.142 -4.280 -8.556 1.00 25.00 H new ATOM 0 HB1 ALA A 630 -0.810 -3.197 -10.564 1.00 25.00 H new ATOM 0 HB2 ALA A 630 -1.796 -4.585 -10.047 1.00 25.00 H new ATOM 0 HB3 ALA A 630 -2.336 -2.927 -9.690 1.00 25.00 H new ATOM 741 N TYR A 631 -0.842 -1.554 -7.152 1.00 25.00 N ATOM 742 CA TYR A 631 -0.313 -0.343 -6.513 1.00 25.00 C ATOM 743 C TYR A 631 0.749 -0.723 -5.459 1.00 25.00 C ATOM 744 O TYR A 631 1.772 -0.044 -5.331 1.00 25.00 O ATOM 745 CB TYR A 631 -1.470 0.501 -5.882 1.00 25.00 C ATOM 746 CG TYR A 631 -1.036 1.817 -5.241 1.00 25.00 C ATOM 747 CD1 TYR A 631 -0.034 2.594 -5.820 1.00 25.00 C ATOM 748 CD2 TYR A 631 -1.668 2.302 -4.097 1.00 25.00 C ATOM 749 CE1 TYR A 631 0.319 3.814 -5.277 1.00 25.00 C ATOM 750 CE2 TYR A 631 -1.308 3.515 -3.547 1.00 25.00 C ATOM 751 CZ TYR A 631 -0.173 4.154 -4.006 1.00 25.00 C ATOM 752 OH TYR A 631 0.026 5.485 -3.601 1.00 25.00 O ATOM 0 H TYR A 631 -1.768 -1.826 -6.821 1.00 25.00 H new ATOM 0 HA TYR A 631 0.167 0.276 -7.271 1.00 25.00 H new ATOM 0 HB2 TYR A 631 -2.205 0.717 -6.657 1.00 25.00 H new ATOM 0 HB3 TYR A 631 -1.971 -0.105 -5.127 1.00 25.00 H new ATOM 0 HD1 TYR A 631 0.473 2.238 -6.705 1.00 25.00 H new ATOM 0 HD2 TYR A 631 -2.451 1.720 -3.634 1.00 25.00 H new ATOM 0 HE1 TYR A 631 0.961 4.493 -5.819 1.00 25.00 H new ATOM 0 HE2 TYR A 631 -1.907 3.960 -2.766 1.00 25.00 H new ATOM 0 HH TYR A 631 -0.353 5.615 -2.707 1.00 25.00 H new ATOM 762 N ALA A 632 0.491 -1.815 -4.722 1.00 25.00 N ATOM 763 CA ALA A 632 1.375 -2.258 -3.639 1.00 25.00 C ATOM 764 C ALA A 632 2.614 -2.990 -4.170 1.00 25.00 C ATOM 765 O ALA A 632 3.683 -2.930 -3.554 1.00 25.00 O ATOM 766 CB ALA A 632 0.624 -3.156 -2.680 1.00 25.00 C ATOM 0 H ALA A 632 -0.327 -2.408 -4.860 1.00 25.00 H new ATOM 0 HA ALA A 632 1.714 -1.364 -3.115 1.00 25.00 H new ATOM 0 HB1 ALA A 632 1.293 -3.477 -1.882 1.00 25.00 H new ATOM 0 HB2 ALA A 632 -0.216 -2.609 -2.251 1.00 25.00 H new ATOM 0 HB3 ALA A 632 0.253 -4.030 -3.215 1.00 25.00 H new ATOM 772 N LYS A 633 2.460 -3.684 -5.317 1.00 25.00 N ATOM 773 CA LYS A 633 3.581 -4.383 -5.977 1.00 25.00 C ATOM 774 C LYS A 633 4.628 -3.379 -6.492 1.00 25.00 C ATOM 775 O LYS A 633 5.803 -3.716 -6.660 1.00 25.00 O ATOM 776 CB LYS A 633 3.095 -5.234 -7.177 1.00 25.00 C ATOM 777 CG LYS A 633 2.237 -6.465 -6.849 1.00 25.00 C ATOM 778 CD LYS A 633 1.940 -7.333 -8.071 1.00 25.00 C ATOM 779 CE LYS A 633 1.289 -8.658 -7.691 1.00 25.00 C ATOM 780 NZ LYS A 633 0.940 -9.483 -8.885 1.00 25.00 N ATOM 0 H LYS A 633 1.569 -3.775 -5.805 1.00 25.00 H new ATOM 0 HA LYS A 633 4.026 -5.036 -5.226 1.00 25.00 H new ATOM 0 HB2 LYS A 633 2.522 -4.588 -7.842 1.00 25.00 H new ATOM 0 HB3 LYS A 633 3.971 -5.568 -7.733 1.00 25.00 H new ATOM 0 HG2 LYS A 633 2.749 -7.068 -6.099 1.00 25.00 H new ATOM 0 HG3 LYS A 633 1.296 -6.137 -6.407 1.00 25.00 H new ATOM 0 HD2 LYS A 633 1.283 -6.789 -8.750 1.00 25.00 H new ATOM 0 HD3 LYS A 633 2.867 -7.527 -8.611 1.00 25.00 H new ATOM 0 HE2 LYS A 633 1.966 -9.221 -7.049 1.00 25.00 H new ATOM 0 HE3 LYS A 633 0.387 -8.463 -7.111 1.00 25.00 H new ATOM 0 HZ1 LYS A 633 0.500 -10.373 -8.575 1.00 25.00 H new ATOM 0 HZ2 LYS A 633 0.273 -8.958 -9.486 1.00 25.00 H new ATOM 0 HZ3 LYS A 633 1.803 -9.693 -9.426 1.00 25.00 H new ATOM 794 N LYS A 634 4.165 -2.140 -6.728 1.00 25.00 N ATOM 795 CA LYS A 634 4.981 -1.069 -7.307 1.00 25.00 C ATOM 796 C LYS A 634 5.795 -0.319 -6.236 1.00 25.00 C ATOM 797 O LYS A 634 6.927 0.095 -6.502 1.00 25.00 O ATOM 798 CB LYS A 634 4.055 -0.093 -8.067 1.00 25.00 C ATOM 799 CG LYS A 634 4.766 1.082 -8.754 1.00 25.00 C ATOM 800 CD LYS A 634 5.798 0.623 -9.791 1.00 25.00 C ATOM 801 CE LYS A 634 6.743 1.747 -10.232 1.00 25.00 C ATOM 802 NZ LYS A 634 7.742 1.286 -11.238 1.00 25.00 N ATOM 0 H LYS A 634 3.208 -1.856 -6.520 1.00 25.00 H new ATOM 0 HA LYS A 634 5.701 -1.514 -7.994 1.00 25.00 H new ATOM 0 HB2 LYS A 634 3.503 -0.654 -8.821 1.00 25.00 H new ATOM 0 HB3 LYS A 634 3.321 0.306 -7.367 1.00 25.00 H new ATOM 0 HG2 LYS A 634 4.025 1.716 -9.241 1.00 25.00 H new ATOM 0 HG3 LYS A 634 5.262 1.693 -8.000 1.00 25.00 H new ATOM 0 HD2 LYS A 634 6.385 -0.195 -9.374 1.00 25.00 H new ATOM 0 HD3 LYS A 634 5.278 0.229 -10.664 1.00 25.00 H new ATOM 0 HE2 LYS A 634 6.159 2.565 -10.653 1.00 25.00 H new ATOM 0 HE3 LYS A 634 7.265 2.143 -9.361 1.00 25.00 H new ATOM 0 HZ1 LYS A 634 8.358 2.080 -11.505 1.00 25.00 H new ATOM 0 HZ2 LYS A 634 8.319 0.523 -10.830 1.00 25.00 H new ATOM 0 HZ3 LYS A 634 7.247 0.933 -12.082 1.00 25.00 H new ATOM 816 N VAL A 635 5.220 -0.155 -5.035 1.00 25.00 N ATOM 817 CA VAL A 635 5.829 0.689 -3.991 1.00 25.00 C ATOM 818 C VAL A 635 7.042 0.020 -3.314 1.00 25.00 C ATOM 819 O VAL A 635 7.893 0.705 -2.754 1.00 25.00 O ATOM 820 CB VAL A 635 4.792 1.169 -2.923 1.00 25.00 C ATOM 821 CG1 VAL A 635 3.712 2.028 -3.572 1.00 25.00 C ATOM 822 CG2 VAL A 635 4.152 0.017 -2.140 1.00 25.00 C ATOM 0 H VAL A 635 4.340 -0.592 -4.762 1.00 25.00 H new ATOM 0 HA VAL A 635 6.195 1.573 -4.514 1.00 25.00 H new ATOM 0 HB VAL A 635 5.350 1.766 -2.202 1.00 25.00 H new ATOM 0 HG11 VAL A 635 3.000 2.352 -2.813 1.00 25.00 H new ATOM 0 HG12 VAL A 635 4.171 2.901 -4.035 1.00 25.00 H new ATOM 0 HG13 VAL A 635 3.192 1.445 -4.332 1.00 25.00 H new ATOM 0 HG21 VAL A 635 3.443 0.419 -1.416 1.00 25.00 H new ATOM 0 HG22 VAL A 635 3.630 -0.646 -2.830 1.00 25.00 H new ATOM 0 HG23 VAL A 635 4.927 -0.542 -1.616 1.00 25.00 H new ATOM 832 N GLU A 636 7.121 -1.315 -3.388 1.00 25.00 N ATOM 833 CA GLU A 636 8.258 -2.071 -2.826 1.00 25.00 C ATOM 834 C GLU A 636 9.542 -1.847 -3.651 1.00 25.00 C ATOM 835 O GLU A 636 10.649 -1.876 -3.105 1.00 25.00 O ATOM 836 CB GLU A 636 7.947 -3.578 -2.814 1.00 25.00 C ATOM 837 CG GLU A 636 7.908 -4.253 -4.185 1.00 25.00 C ATOM 838 CD GLU A 636 7.526 -5.720 -4.133 1.00 25.00 C ATOM 839 OE1 GLU A 636 7.062 -6.184 -3.068 1.00 25.00 O ATOM 840 OE2 GLU A 636 7.719 -6.412 -5.152 1.00 25.00 O ATOM 0 H GLU A 636 6.412 -1.899 -3.832 1.00 25.00 H new ATOM 0 HA GLU A 636 8.415 -1.710 -1.809 1.00 25.00 H new ATOM 0 HB2 GLU A 636 8.696 -4.081 -2.202 1.00 25.00 H new ATOM 0 HB3 GLU A 636 6.984 -3.729 -2.327 1.00 25.00 H new ATOM 0 HG2 GLU A 636 7.197 -3.724 -4.820 1.00 25.00 H new ATOM 0 HG3 GLU A 636 8.887 -4.158 -4.655 1.00 25.00 H new ATOM 847 N GLY A 637 9.369 -1.622 -4.967 1.00 25.00 N ATOM 848 CA GLY A 637 10.500 -1.494 -5.888 1.00 25.00 C ATOM 849 C GLY A 637 11.094 -0.093 -5.944 1.00 25.00 C ATOM 850 O GLY A 637 12.308 0.056 -6.113 1.00 25.00 O ATOM 0 H GLY A 637 8.455 -1.526 -5.410 1.00 25.00 H new ATOM 0 HA2 GLY A 637 11.279 -2.197 -5.592 1.00 25.00 H new ATOM 0 HA3 GLY A 637 10.176 -1.781 -6.888 1.00 25.00 H new ATOM 854 N ASP A 638 10.239 0.932 -5.802 1.00 25.00 N ATOM 855 CA ASP A 638 10.685 2.338 -5.778 1.00 25.00 C ATOM 856 C ASP A 638 11.400 2.675 -4.462 1.00 25.00 C ATOM 857 O ASP A 638 12.144 3.657 -4.378 1.00 25.00 O ATOM 858 CB ASP A 638 9.497 3.286 -5.989 1.00 25.00 C ATOM 859 CG ASP A 638 8.952 3.240 -7.404 1.00 25.00 C ATOM 860 OD1 ASP A 638 9.647 2.705 -8.293 1.00 25.00 O ATOM 861 OD2 ASP A 638 7.826 3.738 -7.624 1.00 25.00 O ATOM 0 H ASP A 638 9.231 0.815 -5.702 1.00 25.00 H new ATOM 0 HA ASP A 638 11.394 2.472 -6.595 1.00 25.00 H new ATOM 0 HB2 ASP A 638 8.702 3.026 -5.290 1.00 25.00 H new ATOM 0 HB3 ASP A 638 9.806 4.305 -5.756 1.00 25.00 H new ATOM 866 N MET A 639 11.159 1.838 -3.443 1.00 25.00 N ATOM 867 CA MET A 639 11.805 1.956 -2.130 1.00 25.00 C ATOM 868 C MET A 639 13.264 1.476 -2.158 1.00 25.00 C ATOM 869 O MET A 639 14.073 1.876 -1.319 1.00 25.00 O ATOM 870 CB MET A 639 11.025 1.134 -1.110 1.00 25.00 C ATOM 871 CG MET A 639 9.741 1.792 -0.639 1.00 25.00 C ATOM 872 SD MET A 639 9.002 1.011 0.804 1.00 25.00 S ATOM 873 CE MET A 639 9.363 -0.693 0.426 1.00 25.00 C ATOM 0 H MET A 639 10.507 1.056 -3.508 1.00 25.00 H new ATOM 0 HA MET A 639 11.807 3.011 -1.854 1.00 25.00 H new ATOM 0 HB2 MET A 639 10.785 0.165 -1.547 1.00 25.00 H new ATOM 0 HB3 MET A 639 11.663 0.946 -0.246 1.00 25.00 H new ATOM 0 HG2 MET A 639 9.945 2.838 -0.409 1.00 25.00 H new ATOM 0 HG3 MET A 639 9.019 1.780 -1.455 1.00 25.00 H new ATOM 0 HE1 MET A 639 8.431 -1.243 0.298 1.00 25.00 H new ATOM 0 HE2 MET A 639 9.945 -0.746 -0.494 1.00 25.00 H new ATOM 0 HE3 MET A 639 9.935 -1.134 1.243 1.00 25.00 H new ATOM 883 N TYR A 640 13.582 0.616 -3.140 1.00 25.00 N ATOM 884 CA TYR A 640 14.911 -0.001 -3.266 1.00 25.00 C ATOM 885 C TYR A 640 15.952 0.994 -3.800 1.00 25.00 C ATOM 886 O TYR A 640 17.140 0.886 -3.483 1.00 25.00 O ATOM 887 CB TYR A 640 14.815 -1.219 -4.198 1.00 25.00 C ATOM 888 CG TYR A 640 14.219 -2.457 -3.555 1.00 25.00 C ATOM 889 CD1 TYR A 640 13.078 -3.055 -4.081 1.00 25.00 C ATOM 890 CD2 TYR A 640 14.801 -3.033 -2.431 1.00 25.00 C ATOM 891 CE1 TYR A 640 12.534 -4.187 -3.505 1.00 25.00 C ATOM 892 CE2 TYR A 640 14.261 -4.164 -1.851 1.00 25.00 C ATOM 893 CZ TYR A 640 13.128 -4.737 -2.391 1.00 25.00 C ATOM 894 OH TYR A 640 12.588 -5.864 -1.817 1.00 25.00 O ATOM 0 H TYR A 640 12.926 0.330 -3.867 1.00 25.00 H new ATOM 0 HA TYR A 640 15.240 -0.314 -2.275 1.00 25.00 H new ATOM 0 HB2 TYR A 640 14.213 -0.950 -5.066 1.00 25.00 H new ATOM 0 HB3 TYR A 640 15.813 -1.460 -4.565 1.00 25.00 H new ATOM 0 HD1 TYR A 640 12.609 -2.627 -4.955 1.00 25.00 H new ATOM 0 HD2 TYR A 640 15.689 -2.589 -2.005 1.00 25.00 H new ATOM 0 HE1 TYR A 640 11.648 -4.638 -3.926 1.00 25.00 H new ATOM 0 HE2 TYR A 640 14.724 -4.599 -0.977 1.00 25.00 H new ATOM 0 HH TYR A 640 13.198 -6.620 -1.945 1.00 25.00 H new ATOM 904 N GLU A 641 15.488 1.958 -4.608 1.00 25.00 N ATOM 905 CA GLU A 641 16.354 3.003 -5.174 1.00 25.00 C ATOM 906 C GLU A 641 16.464 4.220 -4.243 1.00 25.00 C ATOM 907 O GLU A 641 17.426 4.989 -4.331 1.00 25.00 O ATOM 908 CB GLU A 641 15.831 3.451 -6.547 1.00 25.00 C ATOM 909 CG GLU A 641 15.897 2.378 -7.619 1.00 25.00 C ATOM 910 CD GLU A 641 17.309 1.878 -7.863 1.00 25.00 C ATOM 911 OE1 GLU A 641 18.185 2.707 -8.183 1.00 25.00 O ATOM 912 OE2 GLU A 641 17.536 0.656 -7.738 1.00 25.00 O ATOM 0 H GLU A 641 14.510 2.036 -4.886 1.00 25.00 H new ATOM 0 HA GLU A 641 17.348 2.570 -5.287 1.00 25.00 H new ATOM 0 HB2 GLU A 641 14.797 3.779 -6.440 1.00 25.00 H new ATOM 0 HB3 GLU A 641 16.407 4.315 -6.878 1.00 25.00 H new ATOM 0 HG2 GLU A 641 15.265 1.540 -7.327 1.00 25.00 H new ATOM 0 HG3 GLU A 641 15.491 2.775 -8.549 1.00 25.00 H new ATOM 919 N SER A 642 15.473 4.379 -3.351 1.00 25.00 N ATOM 920 CA SER A 642 15.403 5.537 -2.453 1.00 25.00 C ATOM 921 C SER A 642 16.004 5.232 -1.072 1.00 25.00 C ATOM 922 O SER A 642 16.663 6.094 -0.482 1.00 25.00 O ATOM 923 CB SER A 642 13.946 5.996 -2.304 1.00 25.00 C ATOM 924 OG SER A 642 13.126 4.961 -1.783 1.00 25.00 O ATOM 0 H SER A 642 14.707 3.715 -3.234 1.00 25.00 H new ATOM 0 HA SER A 642 15.995 6.336 -2.898 1.00 25.00 H new ATOM 0 HB2 SER A 642 13.902 6.863 -1.645 1.00 25.00 H new ATOM 0 HB3 SER A 642 13.562 6.313 -3.274 1.00 25.00 H new ATOM 0 HG SER A 642 12.205 5.285 -1.699 1.00 25.00 H new ATOM 930 N ALA A 643 15.776 4.011 -0.567 1.00 25.00 N ATOM 931 CA ALA A 643 16.250 3.616 0.764 1.00 25.00 C ATOM 932 C ALA A 643 17.635 2.971 0.702 1.00 25.00 C ATOM 933 O ALA A 643 17.974 2.297 -0.276 1.00 25.00 O ATOM 934 CB ALA A 643 15.258 2.669 1.423 1.00 25.00 C ATOM 0 H ALA A 643 15.265 3.280 -1.062 1.00 25.00 H new ATOM 0 HA ALA A 643 16.331 4.521 1.365 1.00 25.00 H new ATOM 0 HB1 ALA A 643 15.625 2.386 2.409 1.00 25.00 H new ATOM 0 HB2 ALA A 643 14.293 3.166 1.524 1.00 25.00 H new ATOM 0 HB3 ALA A 643 15.144 1.776 0.808 1.00 25.00 H new ATOM 940 N ASN A 644 18.426 3.190 1.759 1.00 25.00 N ATOM 941 CA ASN A 644 19.784 2.646 1.852 1.00 25.00 C ATOM 942 C ASN A 644 19.916 1.687 3.049 1.00 25.00 C ATOM 943 O ASN A 644 20.868 0.902 3.115 1.00 25.00 O ATOM 944 CB ASN A 644 20.800 3.798 1.976 1.00 25.00 C ATOM 945 CG ASN A 644 20.793 4.739 0.780 1.00 25.00 C ATOM 946 OD1 ASN A 644 21.214 4.371 -0.317 1.00 25.00 O ATOM 947 ND2 ASN A 644 20.327 5.966 0.995 1.00 25.00 N ATOM 0 H ASN A 644 18.145 3.745 2.567 1.00 25.00 H new ATOM 0 HA ASN A 644 19.991 2.080 0.944 1.00 25.00 H new ATOM 0 HB2 ASN A 644 20.583 4.368 2.879 1.00 25.00 H new ATOM 0 HB3 ASN A 644 21.800 3.380 2.095 1.00 25.00 H new ATOM 0 HD21 ASN A 644 20.309 6.645 0.234 1.00 25.00 H new ATOM 0 HD22 ASN A 644 19.988 6.228 1.921 1.00 25.00 H new ATOM 954 N SER A 645 18.950 1.744 3.978 1.00 25.00 N ATOM 955 CA SER A 645 18.998 0.940 5.205 1.00 25.00 C ATOM 956 C SER A 645 17.660 0.222 5.457 1.00 25.00 C ATOM 957 O SER A 645 16.727 0.347 4.658 1.00 25.00 O ATOM 958 CB SER A 645 19.373 1.829 6.405 1.00 25.00 C ATOM 959 OG SER A 645 18.346 2.763 6.700 1.00 25.00 O ATOM 0 H SER A 645 18.126 2.340 3.901 1.00 25.00 H new ATOM 0 HA SER A 645 19.764 0.174 5.081 1.00 25.00 H new ATOM 0 HB2 SER A 645 19.560 1.204 7.278 1.00 25.00 H new ATOM 0 HB3 SER A 645 20.300 2.361 6.190 1.00 25.00 H new ATOM 0 HG SER A 645 18.613 3.311 7.467 1.00 25.00 H new ATOM 965 N ARG A 646 17.576 -0.528 6.571 1.00 25.00 N ATOM 966 CA ARG A 646 16.367 -1.298 6.915 1.00 25.00 C ATOM 967 C ARG A 646 15.274 -0.419 7.536 1.00 25.00 C ATOM 968 O ARG A 646 14.082 -0.664 7.325 1.00 25.00 O ATOM 969 CB ARG A 646 16.710 -2.448 7.886 1.00 25.00 C ATOM 970 CG ARG A 646 15.579 -3.455 8.143 1.00 25.00 C ATOM 971 CD ARG A 646 15.997 -4.601 9.069 1.00 25.00 C ATOM 972 NE ARG A 646 16.258 -4.143 10.436 1.00 25.00 N ATOM 973 CZ ARG A 646 15.318 -3.882 11.350 1.00 25.00 C ATOM 974 NH1 ARG A 646 14.027 -4.102 11.099 1.00 25.00 N ATOM 975 NH2 ARG A 646 15.678 -3.408 12.532 1.00 25.00 N ATOM 0 H ARG A 646 18.333 -0.617 7.249 1.00 25.00 H new ATOM 0 HA ARG A 646 15.982 -1.707 5.981 1.00 25.00 H new ATOM 0 HB2 ARG A 646 17.571 -2.988 7.493 1.00 25.00 H new ATOM 0 HB3 ARG A 646 17.013 -2.017 8.840 1.00 25.00 H new ATOM 0 HG2 ARG A 646 14.728 -2.933 8.581 1.00 25.00 H new ATOM 0 HG3 ARG A 646 15.244 -3.868 7.191 1.00 25.00 H new ATOM 0 HD2 ARG A 646 15.212 -5.357 9.085 1.00 25.00 H new ATOM 0 HD3 ARG A 646 16.892 -5.079 8.671 1.00 25.00 H new ATOM 0 HE ARG A 646 17.232 -4.013 10.711 1.00 25.00 H new ATOM 0 HH11 ARG A 646 13.740 -4.477 10.195 1.00 25.00 H new ATOM 0 HH12 ARG A 646 13.327 -3.896 11.811 1.00 25.00 H new ATOM 0 HH21 ARG A 646 16.664 -3.246 12.738 1.00 25.00 H new ATOM 0 HH22 ARG A 646 14.970 -3.205 13.237 1.00 25.00 H new ATOM 989 N ASP A 647 15.689 0.613 8.287 1.00 25.00 N ATOM 990 CA ASP A 647 14.755 1.470 9.029 1.00 25.00 C ATOM 991 C ASP A 647 14.102 2.534 8.126 1.00 25.00 C ATOM 992 O ASP A 647 13.033 3.051 8.457 1.00 25.00 O ATOM 993 CB ASP A 647 15.487 2.135 10.207 1.00 25.00 C ATOM 994 CG ASP A 647 15.908 1.149 11.288 1.00 25.00 C ATOM 995 OD1 ASP A 647 15.417 0.001 11.268 1.00 25.00 O ATOM 996 OD2 ASP A 647 16.730 1.528 12.149 1.00 25.00 O ATOM 0 H ASP A 647 16.669 0.874 8.396 1.00 25.00 H new ATOM 0 HA ASP A 647 13.951 0.840 9.409 1.00 25.00 H new ATOM 0 HB2 ASP A 647 16.371 2.651 9.832 1.00 25.00 H new ATOM 0 HB3 ASP A 647 14.839 2.892 10.648 1.00 25.00 H new ATOM 1001 N GLU A 648 14.749 2.854 6.993 1.00 25.00 N ATOM 1002 CA GLU A 648 14.203 3.814 6.025 1.00 25.00 C ATOM 1003 C GLU A 648 13.268 3.095 5.043 1.00 25.00 C ATOM 1004 O GLU A 648 12.159 3.559 4.784 1.00 25.00 O ATOM 1005 CB GLU A 648 15.354 4.532 5.287 1.00 25.00 C ATOM 1006 CG GLU A 648 16.266 5.377 6.180 1.00 25.00 C ATOM 1007 CD GLU A 648 15.512 6.461 6.927 1.00 25.00 C ATOM 1008 OE1 GLU A 648 14.783 7.238 6.274 1.00 25.00 O ATOM 1009 OE2 GLU A 648 15.649 6.532 8.168 1.00 25.00 O ATOM 0 H GLU A 648 15.651 2.460 6.727 1.00 25.00 H new ATOM 0 HA GLU A 648 13.620 4.569 6.552 1.00 25.00 H new ATOM 0 HB2 GLU A 648 15.961 3.784 4.777 1.00 25.00 H new ATOM 0 HB3 GLU A 648 14.927 5.175 4.517 1.00 25.00 H new ATOM 0 HG2 GLU A 648 16.767 4.728 6.898 1.00 25.00 H new ATOM 0 HG3 GLU A 648 17.043 5.836 5.568 1.00 25.00 H new ATOM 1016 N TYR A 649 13.725 1.944 4.532 1.00 25.00 N ATOM 1017 CA TYR A 649 12.949 1.106 3.605 1.00 25.00 C ATOM 1018 C TYR A 649 11.573 0.727 4.193 1.00 25.00 C ATOM 1019 O TYR A 649 10.539 0.942 3.553 1.00 25.00 O ATOM 1020 CB TYR A 649 13.794 -0.145 3.263 1.00 25.00 C ATOM 1021 CG TYR A 649 13.123 -1.185 2.378 1.00 25.00 C ATOM 1022 CD1 TYR A 649 13.077 -1.044 0.996 1.00 25.00 C ATOM 1023 CD2 TYR A 649 12.549 -2.318 2.940 1.00 25.00 C ATOM 1024 CE1 TYR A 649 12.473 -2.002 0.204 1.00 25.00 C ATOM 1025 CE2 TYR A 649 11.945 -3.274 2.160 1.00 25.00 C ATOM 1026 CZ TYR A 649 11.873 -3.096 0.793 1.00 25.00 C ATOM 1027 OH TYR A 649 11.284 -4.134 0.100 1.00 25.00 O ATOM 0 H TYR A 649 14.647 1.566 4.750 1.00 25.00 H new ATOM 0 HA TYR A 649 12.739 1.665 2.693 1.00 25.00 H new ATOM 0 HB2 TYR A 649 14.710 0.184 2.772 1.00 25.00 H new ATOM 0 HB3 TYR A 649 14.087 -0.626 4.196 1.00 25.00 H new ATOM 0 HD1 TYR A 649 13.520 -0.174 0.535 1.00 25.00 H new ATOM 0 HD2 TYR A 649 12.578 -2.450 4.012 1.00 25.00 H new ATOM 0 HE1 TYR A 649 12.471 -1.895 -0.871 1.00 25.00 H new ATOM 0 HE2 TYR A 649 11.528 -4.161 2.614 1.00 25.00 H new ATOM 0 HH TYR A 649 11.902 -4.461 -0.587 1.00 25.00 H new ATOM 1037 N TYR A 650 11.587 0.168 5.410 1.00 25.00 N ATOM 1038 CA TYR A 650 10.365 -0.262 6.098 1.00 25.00 C ATOM 1039 C TYR A 650 9.501 0.916 6.586 1.00 25.00 C ATOM 1040 O TYR A 650 8.305 0.738 6.837 1.00 25.00 O ATOM 1041 CB TYR A 650 10.735 -1.172 7.279 1.00 25.00 C ATOM 1042 CG TYR A 650 11.165 -2.566 6.859 1.00 25.00 C ATOM 1043 CD1 TYR A 650 12.211 -3.216 7.507 1.00 25.00 C ATOM 1044 CD2 TYR A 650 10.532 -3.229 5.812 1.00 25.00 C ATOM 1045 CE1 TYR A 650 12.611 -4.473 7.128 1.00 25.00 C ATOM 1046 CE2 TYR A 650 10.930 -4.496 5.428 1.00 25.00 C ATOM 1047 CZ TYR A 650 11.970 -5.113 6.090 1.00 25.00 C ATOM 1048 OH TYR A 650 12.367 -6.376 5.714 1.00 25.00 O ATOM 0 H TYR A 650 12.441 0.002 5.942 1.00 25.00 H new ATOM 0 HA TYR A 650 9.762 -0.809 5.373 1.00 25.00 H new ATOM 0 HB2 TYR A 650 11.541 -0.707 7.846 1.00 25.00 H new ATOM 0 HB3 TYR A 650 9.879 -1.251 7.949 1.00 25.00 H new ATOM 0 HD1 TYR A 650 12.717 -2.722 8.323 1.00 25.00 H new ATOM 0 HD2 TYR A 650 9.718 -2.747 5.292 1.00 25.00 H new ATOM 0 HE1 TYR A 650 13.427 -4.959 7.642 1.00 25.00 H new ATOM 0 HE2 TYR A 650 10.429 -4.999 4.614 1.00 25.00 H new ATOM 0 HH TYR A 650 11.983 -7.036 6.328 1.00 25.00 H new ATOM 1058 N HIS A 651 10.103 2.111 6.712 1.00 25.00 N ATOM 1059 CA HIS A 651 9.373 3.310 7.151 1.00 25.00 C ATOM 1060 C HIS A 651 8.671 3.999 5.970 1.00 25.00 C ATOM 1061 O HIS A 651 7.589 4.568 6.132 1.00 25.00 O ATOM 1062 CB HIS A 651 10.320 4.287 7.850 1.00 25.00 C ATOM 1063 CG HIS A 651 9.675 5.580 8.281 1.00 25.00 C ATOM 1064 ND1 HIS A 651 10.003 6.800 7.725 1.00 25.00 N ATOM 1065 CD2 HIS A 651 8.714 5.842 9.206 1.00 25.00 C ATOM 1066 CE1 HIS A 651 9.278 7.751 8.286 1.00 25.00 C ATOM 1067 NE2 HIS A 651 8.487 7.196 9.187 1.00 25.00 N ATOM 0 H HIS A 651 11.091 2.271 6.516 1.00 25.00 H new ATOM 0 HA HIS A 651 8.608 2.994 7.860 1.00 25.00 H new ATOM 0 HB2 HIS A 651 10.745 3.798 8.726 1.00 25.00 H new ATOM 0 HB3 HIS A 651 11.148 4.514 7.179 1.00 25.00 H new ATOM 0 HD2 HIS A 651 8.220 5.119 9.839 1.00 25.00 H new ATOM 0 HE1 HIS A 651 9.324 8.804 8.048 1.00 25.00 H new ATOM 0 HE2 HIS A 651 7.816 7.693 9.773 1.00 25.00 H new ATOM 1076 N LEU A 652 9.305 3.941 4.787 1.00 25.00 N ATOM 1077 CA LEU A 652 8.727 4.445 3.536 1.00 25.00 C ATOM 1078 C LEU A 652 7.461 3.678 3.129 1.00 25.00 C ATOM 1079 O LEU A 652 6.489 4.273 2.659 1.00 25.00 O ATOM 1080 CB LEU A 652 9.778 4.342 2.437 1.00 25.00 C ATOM 1081 CG LEU A 652 10.966 5.319 2.502 1.00 25.00 C ATOM 1082 CD1 LEU A 652 12.069 4.991 1.501 1.00 25.00 C ATOM 1083 CD2 LEU A 652 10.450 6.720 2.258 1.00 25.00 C ATOM 0 H LEU A 652 10.237 3.541 4.674 1.00 25.00 H new ATOM 0 HA LEU A 652 8.432 5.483 3.688 1.00 25.00 H new ATOM 0 HB2 LEU A 652 10.175 3.327 2.444 1.00 25.00 H new ATOM 0 HB3 LEU A 652 9.278 4.482 1.478 1.00 25.00 H new ATOM 0 HG LEU A 652 11.414 5.231 3.492 1.00 25.00 H new ATOM 0 HD11 LEU A 652 12.876 5.717 1.598 1.00 25.00 H new ATOM 0 HD12 LEU A 652 12.454 3.991 1.699 1.00 25.00 H new ATOM 0 HD13 LEU A 652 11.666 5.031 0.489 1.00 25.00 H new ATOM 0 HD21 LEU A 652 11.280 7.426 2.301 1.00 25.00 H new ATOM 0 HD22 LEU A 652 9.982 6.769 1.275 1.00 25.00 H new ATOM 0 HD23 LEU A 652 9.716 6.976 3.022 1.00 25.00 H new ATOM 1095 N LEU A 653 7.500 2.350 3.305 1.00 25.00 N ATOM 1096 CA LEU A 653 6.326 1.486 3.080 1.00 25.00 C ATOM 1097 C LEU A 653 5.272 1.625 4.193 1.00 25.00 C ATOM 1098 O LEU A 653 4.085 1.378 3.957 1.00 25.00 O ATOM 1099 CB LEU A 653 6.755 0.013 2.965 1.00 25.00 C ATOM 1100 CG LEU A 653 5.740 -0.944 2.318 1.00 25.00 C ATOM 1101 CD1 LEU A 653 4.839 -0.187 1.369 1.00 25.00 C ATOM 1102 CD2 LEU A 653 6.435 -2.070 1.563 1.00 25.00 C ATOM 0 H LEU A 653 8.335 1.846 3.604 1.00 25.00 H new ATOM 0 HA LEU A 653 5.871 1.814 2.146 1.00 25.00 H new ATOM 0 HB2 LEU A 653 7.680 -0.030 2.390 1.00 25.00 H new ATOM 0 HB3 LEU A 653 6.984 -0.356 3.965 1.00 25.00 H new ATOM 0 HG LEU A 653 5.146 -1.382 3.120 1.00 25.00 H new ATOM 0 HD11 LEU A 653 4.125 -0.876 0.918 1.00 25.00 H new ATOM 0 HD12 LEU A 653 4.300 0.586 1.917 1.00 25.00 H new ATOM 0 HD13 LEU A 653 5.441 0.276 0.587 1.00 25.00 H new ATOM 0 HD21 LEU A 653 5.687 -2.726 1.119 1.00 25.00 H new ATOM 0 HD22 LEU A 653 7.061 -1.649 0.776 1.00 25.00 H new ATOM 0 HD23 LEU A 653 7.056 -2.642 2.253 1.00 25.00 H new ATOM 1114 N ALA A 654 5.713 2.025 5.397 1.00 25.00 N ATOM 1115 CA ALA A 654 4.818 2.184 6.554 1.00 25.00 C ATOM 1116 C ALA A 654 4.125 3.549 6.563 1.00 25.00 C ATOM 1117 O ALA A 654 3.027 3.683 7.113 1.00 25.00 O ATOM 1118 CB ALA A 654 5.592 1.992 7.847 1.00 25.00 C ATOM 0 H ALA A 654 6.689 2.245 5.594 1.00 25.00 H new ATOM 0 HA ALA A 654 4.045 1.420 6.472 1.00 25.00 H new ATOM 0 HB1 ALA A 654 4.918 2.112 8.696 1.00 25.00 H new ATOM 0 HB2 ALA A 654 6.025 0.992 7.867 1.00 25.00 H new ATOM 0 HB3 ALA A 654 6.388 2.734 7.908 1.00 25.00 H new ATOM 1124 N GLU A 655 4.771 4.559 5.954 1.00 25.00 N ATOM 1125 CA GLU A 655 4.217 5.922 5.910 1.00 25.00 C ATOM 1126 C GLU A 655 3.056 6.042 4.911 1.00 25.00 C ATOM 1127 O GLU A 655 2.133 6.825 5.138 1.00 25.00 O ATOM 1128 CB GLU A 655 5.316 6.969 5.623 1.00 25.00 C ATOM 1129 CG GLU A 655 4.866 8.426 5.709 1.00 25.00 C ATOM 1130 CD GLU A 655 5.744 9.359 4.896 1.00 25.00 C ATOM 1131 OE1 GLU A 655 6.769 8.891 4.356 1.00 25.00 O ATOM 1132 OE2 GLU A 655 5.405 10.558 4.800 1.00 25.00 O ATOM 0 H GLU A 655 5.673 4.457 5.488 1.00 25.00 H new ATOM 0 HA GLU A 655 3.809 6.131 6.899 1.00 25.00 H new ATOM 0 HB2 GLU A 655 6.134 6.816 6.327 1.00 25.00 H new ATOM 0 HB3 GLU A 655 5.716 6.788 4.626 1.00 25.00 H new ATOM 0 HG2 GLU A 655 3.837 8.505 5.359 1.00 25.00 H new ATOM 0 HG3 GLU A 655 4.873 8.743 6.752 1.00 25.00 H new ATOM 1139 N LYS A 656 3.102 5.255 3.818 1.00 25.00 N ATOM 1140 CA LYS A 656 1.962 5.155 2.884 1.00 25.00 C ATOM 1141 C LYS A 656 0.801 4.450 3.585 1.00 25.00 C ATOM 1142 O LYS A 656 -0.367 4.728 3.318 1.00 25.00 O ATOM 1143 CB LYS A 656 2.306 4.355 1.610 1.00 25.00 C ATOM 1144 CG LYS A 656 3.375 4.974 0.694 1.00 25.00 C ATOM 1145 CD LYS A 656 3.641 4.142 -0.564 1.00 25.00 C ATOM 1146 CE LYS A 656 4.775 4.722 -1.407 1.00 25.00 C ATOM 1147 NZ LYS A 656 4.445 6.077 -1.928 1.00 25.00 N ATOM 0 H LYS A 656 3.908 4.684 3.561 1.00 25.00 H new ATOM 0 HA LYS A 656 1.700 6.171 2.588 1.00 25.00 H new ATOM 0 HB2 LYS A 656 2.642 3.362 1.908 1.00 25.00 H new ATOM 0 HB3 LYS A 656 1.392 4.222 1.031 1.00 25.00 H new ATOM 0 HG2 LYS A 656 3.058 5.975 0.401 1.00 25.00 H new ATOM 0 HG3 LYS A 656 4.304 5.085 1.253 1.00 25.00 H new ATOM 0 HD2 LYS A 656 3.889 3.120 -0.277 1.00 25.00 H new ATOM 0 HD3 LYS A 656 2.732 4.092 -1.164 1.00 25.00 H new ATOM 0 HE2 LYS A 656 5.683 4.776 -0.806 1.00 25.00 H new ATOM 0 HE3 LYS A 656 4.985 4.054 -2.242 1.00 25.00 H new ATOM 0 HZ1 LYS A 656 5.186 6.385 -2.589 1.00 25.00 H new ATOM 0 HZ2 LYS A 656 3.531 6.045 -2.423 1.00 25.00 H new ATOM 0 HZ3 LYS A 656 4.387 6.749 -1.136 1.00 25.00 H new ATOM 1161 N ILE A 657 1.163 3.562 4.523 1.00 25.00 N ATOM 1162 CA ILE A 657 0.206 2.768 5.293 1.00 25.00 C ATOM 1163 C ILE A 657 -0.578 3.660 6.278 1.00 25.00 C ATOM 1164 O ILE A 657 -1.738 3.382 6.582 1.00 25.00 O ATOM 1165 CB ILE A 657 0.963 1.579 6.003 1.00 25.00 C ATOM 1166 CG1 ILE A 657 1.233 0.465 4.956 1.00 25.00 C ATOM 1167 CG2 ILE A 657 0.232 1.035 7.245 1.00 25.00 C ATOM 1168 CD1 ILE A 657 2.065 -0.723 5.440 1.00 25.00 C ATOM 0 H ILE A 657 2.136 3.377 4.767 1.00 25.00 H new ATOM 0 HA ILE A 657 -0.537 2.331 4.626 1.00 25.00 H new ATOM 0 HB ILE A 657 1.908 1.963 6.388 1.00 25.00 H new ATOM 0 HG12 ILE A 657 0.274 0.090 4.599 1.00 25.00 H new ATOM 0 HG13 ILE A 657 1.739 0.913 4.101 1.00 25.00 H new ATOM 0 HG21 ILE A 657 0.811 0.220 7.680 1.00 25.00 H new ATOM 0 HG22 ILE A 657 0.119 1.833 7.979 1.00 25.00 H new ATOM 0 HG23 ILE A 657 -0.752 0.667 6.956 1.00 25.00 H new ATOM 0 HD11 ILE A 657 2.189 -1.436 4.625 1.00 25.00 H new ATOM 0 HD12 ILE A 657 3.044 -0.372 5.767 1.00 25.00 H new ATOM 0 HD13 ILE A 657 1.556 -1.208 6.273 1.00 25.00 H new ATOM 1180 N TYR A 658 0.069 4.727 6.761 1.00 25.00 N ATOM 1181 CA TYR A 658 -0.567 5.670 7.681 1.00 25.00 C ATOM 1182 C TYR A 658 -1.360 6.745 6.915 1.00 25.00 C ATOM 1183 O TYR A 658 -2.401 7.204 7.391 1.00 25.00 O ATOM 1184 CB TYR A 658 0.495 6.328 8.576 1.00 25.00 C ATOM 1185 CG TYR A 658 1.274 5.357 9.447 1.00 25.00 C ATOM 1186 CD1 TYR A 658 0.709 4.156 9.867 1.00 25.00 C ATOM 1187 CD2 TYR A 658 2.574 5.642 9.851 1.00 25.00 C ATOM 1188 CE1 TYR A 658 1.416 3.273 10.660 1.00 25.00 C ATOM 1189 CE2 TYR A 658 3.286 4.763 10.643 1.00 25.00 C ATOM 1190 CZ TYR A 658 2.694 3.573 11.043 1.00 25.00 C ATOM 1191 OH TYR A 658 3.410 2.701 11.832 1.00 25.00 O ATOM 0 H TYR A 658 1.035 4.957 6.528 1.00 25.00 H new ATOM 0 HA TYR A 658 -1.268 5.117 8.306 1.00 25.00 H new ATOM 0 HB2 TYR A 658 1.197 6.873 7.945 1.00 25.00 H new ATOM 0 HB3 TYR A 658 0.007 7.061 9.218 1.00 25.00 H new ATOM 0 HD1 TYR A 658 -0.299 3.910 9.568 1.00 25.00 H new ATOM 0 HD2 TYR A 658 3.035 6.568 9.540 1.00 25.00 H new ATOM 0 HE1 TYR A 658 0.960 2.347 10.977 1.00 25.00 H new ATOM 0 HE2 TYR A 658 4.295 4.999 10.948 1.00 25.00 H new ATOM 0 HH TYR A 658 4.300 3.073 12.007 1.00 25.00 H new ATOM 1201 N LYS A 659 -0.859 7.128 5.723 1.00 25.00 N ATOM 1202 CA LYS A 659 -1.487 8.180 4.894 1.00 25.00 C ATOM 1203 C LYS A 659 -2.790 7.706 4.254 1.00 25.00 C ATOM 1204 O LYS A 659 -3.746 8.475 4.145 1.00 25.00 O ATOM 1205 CB LYS A 659 -0.533 8.668 3.790 1.00 25.00 C ATOM 1206 CG LYS A 659 0.662 9.485 4.277 1.00 25.00 C ATOM 1207 CD LYS A 659 1.515 10.027 3.123 1.00 25.00 C ATOM 1208 CE LYS A 659 2.635 10.930 3.607 1.00 25.00 C ATOM 1209 NZ LYS A 659 3.485 11.443 2.492 1.00 25.00 N ATOM 0 H LYS A 659 -0.018 6.723 5.311 1.00 25.00 H new ATOM 0 HA LYS A 659 -1.711 9.006 5.569 1.00 25.00 H new ATOM 0 HB2 LYS A 659 -0.162 7.801 3.244 1.00 25.00 H new ATOM 0 HB3 LYS A 659 -1.101 9.271 3.082 1.00 25.00 H new ATOM 0 HG2 LYS A 659 0.305 10.318 4.883 1.00 25.00 H new ATOM 0 HG3 LYS A 659 1.283 8.864 4.923 1.00 25.00 H new ATOM 0 HD2 LYS A 659 1.940 9.192 2.565 1.00 25.00 H new ATOM 0 HD3 LYS A 659 0.878 10.580 2.433 1.00 25.00 H new ATOM 0 HE2 LYS A 659 2.207 11.773 4.150 1.00 25.00 H new ATOM 0 HE3 LYS A 659 3.260 10.381 4.312 1.00 25.00 H new ATOM 0 HZ1 LYS A 659 4.233 12.053 2.878 1.00 25.00 H new ATOM 0 HZ2 LYS A 659 3.917 10.642 1.988 1.00 25.00 H new ATOM 0 HZ3 LYS A 659 2.898 11.991 1.832 1.00 25.00 H new ATOM 1223 N ILE A 660 -2.816 6.432 3.839 1.00 25.00 N ATOM 1224 CA ILE A 660 -4.018 5.812 3.256 1.00 25.00 C ATOM 1225 C ILE A 660 -5.096 5.627 4.344 1.00 25.00 C ATOM 1226 O ILE A 660 -6.294 5.683 4.063 1.00 25.00 O ATOM 1227 CB ILE A 660 -3.665 4.453 2.564 1.00 25.00 C ATOM 1228 CG1 ILE A 660 -2.841 4.716 1.286 1.00 25.00 C ATOM 1229 CG2 ILE A 660 -4.935 3.660 2.227 1.00 25.00 C ATOM 1230 CD1 ILE A 660 -2.172 3.486 0.685 1.00 25.00 C ATOM 0 H ILE A 660 -2.013 5.805 3.896 1.00 25.00 H new ATOM 0 HA ILE A 660 -4.418 6.473 2.487 1.00 25.00 H new ATOM 0 HB ILE A 660 -3.071 3.856 3.257 1.00 25.00 H new ATOM 0 HG12 ILE A 660 -3.495 5.158 0.535 1.00 25.00 H new ATOM 0 HG13 ILE A 660 -2.072 5.454 1.513 1.00 25.00 H new ATOM 0 HG21 ILE A 660 -4.661 2.720 1.747 1.00 25.00 H new ATOM 0 HG22 ILE A 660 -5.488 3.452 3.143 1.00 25.00 H new ATOM 0 HG23 ILE A 660 -5.560 4.244 1.551 1.00 25.00 H new ATOM 0 HD11 ILE A 660 -1.618 3.773 -0.208 1.00 25.00 H new ATOM 0 HD12 ILE A 660 -1.487 3.052 1.413 1.00 25.00 H new ATOM 0 HD13 ILE A 660 -2.932 2.751 0.420 1.00 25.00 H new ATOM 1242 N GLN A 661 -4.633 5.422 5.581 1.00 25.00 N ATOM 1243 CA GLN A 661 -5.501 5.360 6.764 1.00 25.00 C ATOM 1244 C GLN A 661 -6.085 6.739 7.124 1.00 25.00 C ATOM 1245 O GLN A 661 -7.093 6.825 7.832 1.00 25.00 O ATOM 1246 CB GLN A 661 -4.710 4.792 7.950 1.00 25.00 C ATOM 1247 CG GLN A 661 -4.381 3.297 7.835 1.00 25.00 C ATOM 1248 CD GLN A 661 -3.450 2.748 8.920 1.00 25.00 C ATOM 1249 OE1 GLN A 661 -2.989 3.500 9.778 1.00 25.00 O ATOM 1250 NE2 GLN A 661 -3.181 1.441 8.911 1.00 25.00 N ATOM 0 H GLN A 661 -3.643 5.294 5.792 1.00 25.00 H new ATOM 0 HA GLN A 661 -6.341 4.705 6.532 1.00 25.00 H new ATOM 0 HB2 GLN A 661 -3.779 5.350 8.051 1.00 25.00 H new ATOM 0 HB3 GLN A 661 -5.281 4.957 8.864 1.00 25.00 H new ATOM 0 HG2 GLN A 661 -5.314 2.733 7.860 1.00 25.00 H new ATOM 0 HG3 GLN A 661 -3.925 3.116 6.862 1.00 25.00 H new ATOM 0 HE21 GLN A 661 -3.578 0.843 8.186 1.00 25.00 H new ATOM 0 HE22 GLN A 661 -2.578 1.039 9.629 1.00 25.00 H new ATOM 1259 N LYS A 662 -5.439 7.808 6.628 1.00 25.00 N ATOM 1260 CA LYS A 662 -5.906 9.190 6.833 1.00 25.00 C ATOM 1261 C LYS A 662 -7.035 9.561 5.861 1.00 25.00 C ATOM 1262 O LYS A 662 -7.977 10.267 6.229 1.00 25.00 O ATOM 1263 CB LYS A 662 -4.754 10.195 6.658 1.00 25.00 C ATOM 1264 CG LYS A 662 -5.113 11.686 6.833 1.00 25.00 C ATOM 1265 CD LYS A 662 -3.918 12.640 6.738 1.00 25.00 C ATOM 1266 CE LYS A 662 -3.341 12.701 5.343 1.00 25.00 C ATOM 1267 NZ LYS A 662 -4.283 13.311 4.365 1.00 25.00 N ATOM 0 H LYS A 662 -4.583 7.740 6.077 1.00 25.00 H new ATOM 0 HA LYS A 662 -6.286 9.240 7.853 1.00 25.00 H new ATOM 0 HB2 LYS A 662 -3.971 9.946 7.374 1.00 25.00 H new ATOM 0 HB3 LYS A 662 -4.331 10.060 5.663 1.00 25.00 H new ATOM 0 HG2 LYS A 662 -5.844 11.963 6.074 1.00 25.00 H new ATOM 0 HG3 LYS A 662 -5.593 11.820 7.802 1.00 25.00 H new ATOM 0 HD2 LYS A 662 -4.229 13.639 7.044 1.00 25.00 H new ATOM 0 HD3 LYS A 662 -3.144 12.319 7.435 1.00 25.00 H new ATOM 0 HE2 LYS A 662 -2.416 13.277 5.360 1.00 25.00 H new ATOM 0 HE3 LYS A 662 -3.083 11.694 5.015 1.00 25.00 H new ATOM 0 HZ1 LYS A 662 -4.562 12.598 3.660 1.00 25.00 H new ATOM 0 HZ2 LYS A 662 -5.129 13.653 4.864 1.00 25.00 H new ATOM 0 HZ3 LYS A 662 -3.818 14.108 3.886 1.00 25.00 H new ATOM 1281 N GLU A 663 -6.914 9.074 4.616 1.00 25.00 N ATOM 1282 CA GLU A 663 -7.852 9.383 3.523 1.00 25.00 C ATOM 1283 C GLU A 663 -9.240 8.792 3.781 1.00 25.00 C ATOM 1284 O GLU A 663 -10.255 9.467 3.584 1.00 25.00 O ATOM 1285 CB GLU A 663 -7.310 8.835 2.193 1.00 25.00 C ATOM 1286 CG GLU A 663 -6.095 9.581 1.669 1.00 25.00 C ATOM 1287 CD GLU A 663 -6.350 11.058 1.445 1.00 25.00 C ATOM 1288 OE1 GLU A 663 -7.334 11.389 0.750 1.00 25.00 O ATOM 1289 OE2 GLU A 663 -5.573 11.885 1.968 1.00 25.00 O ATOM 0 H GLU A 663 -6.157 8.450 4.337 1.00 25.00 H new ATOM 0 HA GLU A 663 -7.946 10.468 3.471 1.00 25.00 H new ATOM 0 HB2 GLU A 663 -7.051 7.784 2.323 1.00 25.00 H new ATOM 0 HB3 GLU A 663 -8.101 8.878 1.444 1.00 25.00 H new ATOM 0 HG2 GLU A 663 -5.273 9.464 2.375 1.00 25.00 H new ATOM 0 HG3 GLU A 663 -5.776 9.128 0.730 1.00 25.00 H new ATOM 1296 N LEU A 664 -9.267 7.523 4.220 1.00 25.00 N ATOM 1297 CA LEU A 664 -10.523 6.832 4.564 1.00 25.00 C ATOM 1298 C LEU A 664 -11.164 7.394 5.844 1.00 25.00 C ATOM 1299 O LEU A 664 -12.361 7.202 6.079 1.00 25.00 O ATOM 1300 CB LEU A 664 -10.299 5.310 4.726 1.00 25.00 C ATOM 1301 CG LEU A 664 -9.996 4.484 3.449 1.00 25.00 C ATOM 1302 CD1 LEU A 664 -9.490 3.080 3.780 1.00 25.00 C ATOM 1303 CD2 LEU A 664 -11.211 4.412 2.533 1.00 25.00 C ATOM 0 H LEU A 664 -8.431 6.952 4.346 1.00 25.00 H new ATOM 0 HA LEU A 664 -11.207 7.009 3.734 1.00 25.00 H new ATOM 0 HB2 LEU A 664 -9.473 5.165 5.422 1.00 25.00 H new ATOM 0 HB3 LEU A 664 -11.188 4.889 5.194 1.00 25.00 H new ATOM 0 HG LEU A 664 -9.198 5.006 2.920 1.00 25.00 H new ATOM 0 HD11 LEU A 664 -9.291 2.538 2.856 1.00 25.00 H new ATOM 0 HD12 LEU A 664 -8.572 3.152 4.363 1.00 25.00 H new ATOM 0 HD13 LEU A 664 -10.246 2.548 4.357 1.00 25.00 H new ATOM 0 HD21 LEU A 664 -10.965 3.826 1.647 1.00 25.00 H new ATOM 0 HD22 LEU A 664 -12.038 3.939 3.062 1.00 25.00 H new ATOM 0 HD23 LEU A 664 -11.501 5.419 2.233 1.00 25.00 H new ATOM 1315 N GLU A 665 -10.356 8.091 6.662 1.00 25.00 N ATOM 1316 CA GLU A 665 -10.834 8.729 7.898 1.00 25.00 C ATOM 1317 C GLU A 665 -11.696 9.970 7.584 1.00 25.00 C ATOM 1318 O GLU A 665 -12.436 10.454 8.445 1.00 25.00 O ATOM 1319 CB GLU A 665 -9.634 9.096 8.789 1.00 25.00 C ATOM 1320 CG GLU A 665 -9.224 8.011 9.784 1.00 25.00 C ATOM 1321 CD GLU A 665 -9.579 8.365 11.215 1.00 25.00 C ATOM 1322 OE1 GLU A 665 -9.090 9.404 11.709 1.00 25.00 O ATOM 1323 OE2 GLU A 665 -10.347 7.605 11.844 1.00 25.00 O ATOM 0 H GLU A 665 -9.361 8.227 6.486 1.00 25.00 H new ATOM 0 HA GLU A 665 -11.467 8.024 8.437 1.00 25.00 H new ATOM 0 HB2 GLU A 665 -8.781 9.326 8.150 1.00 25.00 H new ATOM 0 HB3 GLU A 665 -9.873 10.005 9.341 1.00 25.00 H new ATOM 0 HG2 GLU A 665 -9.711 7.074 9.514 1.00 25.00 H new ATOM 0 HG3 GLU A 665 -8.149 7.844 9.711 1.00 25.00 H new ATOM 1330 N GLU A 666 -11.587 10.472 6.338 1.00 25.00 N ATOM 1331 CA GLU A 666 -12.434 11.574 5.845 1.00 25.00 C ATOM 1332 C GLU A 666 -13.895 11.123 5.682 1.00 25.00 C ATOM 1333 O GLU A 666 -14.813 11.948 5.670 1.00 25.00 O ATOM 1334 CB GLU A 666 -11.903 12.105 4.505 1.00 25.00 C ATOM 1335 CG GLU A 666 -10.571 12.838 4.613 1.00 25.00 C ATOM 1336 CD GLU A 666 -10.629 14.020 5.562 1.00 25.00 C ATOM 1337 OE1 GLU A 666 -11.540 14.861 5.410 1.00 25.00 O ATOM 1338 OE2 GLU A 666 -9.764 14.102 6.460 1.00 25.00 O ATOM 0 H GLU A 666 -10.916 10.128 5.651 1.00 25.00 H new ATOM 0 HA GLU A 666 -12.399 12.373 6.586 1.00 25.00 H new ATOM 0 HB2 GLU A 666 -11.791 11.270 3.813 1.00 25.00 H new ATOM 0 HB3 GLU A 666 -12.643 12.779 4.074 1.00 25.00 H new ATOM 0 HG2 GLU A 666 -9.804 12.142 4.953 1.00 25.00 H new ATOM 0 HG3 GLU A 666 -10.271 13.185 3.624 1.00 25.00 H new ATOM 1345 N LYS A 667 -14.087 9.798 5.559 1.00 25.00 N ATOM 1346 CA LYS A 667 -15.423 9.183 5.527 1.00 25.00 C ATOM 1347 C LYS A 667 -15.958 8.984 6.953 1.00 25.00 C ATOM 1348 O LYS A 667 -17.163 8.805 7.157 1.00 25.00 O ATOM 1349 CB LYS A 667 -15.386 7.828 4.807 1.00 25.00 C ATOM 1350 CG LYS A 667 -15.106 7.904 3.302 1.00 25.00 C ATOM 1351 CD LYS A 667 -13.626 8.158 2.993 1.00 25.00 C ATOM 1352 CE LYS A 667 -13.335 8.334 1.504 1.00 25.00 C ATOM 1353 NZ LYS A 667 -12.222 9.292 1.236 1.00 25.00 N ATOM 0 H LYS A 667 -13.323 9.127 5.479 1.00 25.00 H new ATOM 0 HA LYS A 667 -16.085 9.856 4.982 1.00 25.00 H new ATOM 0 HB2 LYS A 667 -14.622 7.206 5.273 1.00 25.00 H new ATOM 0 HB3 LYS A 667 -16.342 7.326 4.959 1.00 25.00 H new ATOM 0 HG2 LYS A 667 -15.418 6.972 2.830 1.00 25.00 H new ATOM 0 HG3 LYS A 667 -15.707 8.700 2.863 1.00 25.00 H new ATOM 0 HD2 LYS A 667 -13.300 9.051 3.527 1.00 25.00 H new ATOM 0 HD3 LYS A 667 -13.035 7.325 3.374 1.00 25.00 H new ATOM 0 HE2 LYS A 667 -13.085 7.365 1.071 1.00 25.00 H new ATOM 0 HE3 LYS A 667 -14.237 8.684 1.002 1.00 25.00 H new ATOM 0 HZ1 LYS A 667 -11.969 9.257 0.228 1.00 25.00 H new ATOM 0 HZ2 LYS A 667 -12.526 10.255 1.483 1.00 25.00 H new ATOM 0 HZ3 LYS A 667 -11.395 9.032 1.810 1.00 25.00 H new ATOM 1367 N ARG A 668 -15.036 9.025 7.929 1.00 25.00 N ATOM 1368 CA ARG A 668 -15.355 8.822 9.347 1.00 25.00 C ATOM 1369 C ARG A 668 -15.780 10.143 10.020 1.00 25.00 C ATOM 1370 O ARG A 668 -16.509 10.127 11.017 1.00 25.00 O ATOM 1371 CB ARG A 668 -14.124 8.232 10.059 1.00 25.00 C ATOM 1372 CG ARG A 668 -13.739 6.831 9.614 1.00 25.00 C ATOM 1373 CD ARG A 668 -12.563 6.338 10.428 1.00 25.00 C ATOM 1374 NE ARG A 668 -12.176 4.965 10.085 1.00 25.00 N ATOM 1375 CZ ARG A 668 -11.141 4.304 10.626 1.00 25.00 C ATOM 1376 NH1 ARG A 668 -10.352 4.881 11.533 1.00 25.00 N ATOM 1377 NH2 ARG A 668 -10.892 3.056 10.252 1.00 25.00 N ATOM 0 H ARG A 668 -14.047 9.200 7.754 1.00 25.00 H new ATOM 0 HA ARG A 668 -16.194 8.130 9.423 1.00 25.00 H new ATOM 0 HB2 ARG A 668 -13.275 8.896 9.896 1.00 25.00 H new ATOM 0 HB3 ARG A 668 -14.315 8.217 11.132 1.00 25.00 H new ATOM 0 HG2 ARG A 668 -14.586 6.156 9.736 1.00 25.00 H new ATOM 0 HG3 ARG A 668 -13.484 6.834 8.554 1.00 25.00 H new ATOM 0 HD2 ARG A 668 -11.713 7.002 10.270 1.00 25.00 H new ATOM 0 HD3 ARG A 668 -12.813 6.387 11.488 1.00 25.00 H new ATOM 0 HE ARG A 668 -12.734 4.477 9.384 1.00 25.00 H new ATOM 0 HH11 ARG A 668 -10.530 5.841 11.827 1.00 25.00 H new ATOM 0 HH12 ARG A 668 -9.570 4.362 11.933 1.00 25.00 H new ATOM 0 HH21 ARG A 668 -11.486 2.604 9.557 1.00 25.00 H new ATOM 0 HH22 ARG A 668 -10.107 2.548 10.660 1.00 25.00 H new ATOM 1391 N ARG A 669 -15.321 11.271 9.460 1.00 25.00 N ATOM 1392 CA ARG A 669 -15.577 12.603 10.035 1.00 25.00 C ATOM 1393 C ARG A 669 -16.862 13.239 9.482 1.00 25.00 C ATOM 1394 O ARG A 669 -17.294 14.294 9.959 1.00 25.00 O ATOM 1395 CB ARG A 669 -14.382 13.533 9.774 1.00 25.00 C ATOM 1396 CG ARG A 669 -13.103 13.112 10.479 1.00 25.00 C ATOM 1397 CD ARG A 669 -11.968 14.057 10.148 1.00 25.00 C ATOM 1398 NE ARG A 669 -10.721 13.678 10.822 1.00 25.00 N ATOM 1399 CZ ARG A 669 -9.523 14.231 10.582 1.00 25.00 C ATOM 1400 NH1 ARG A 669 -9.377 15.200 9.680 1.00 25.00 N ATOM 1401 NH2 ARG A 669 -8.461 13.807 11.255 1.00 25.00 N ATOM 0 H ARG A 669 -14.767 11.289 8.604 1.00 25.00 H new ATOM 0 HA ARG A 669 -15.711 12.469 11.108 1.00 25.00 H new ATOM 0 HB2 ARG A 669 -14.196 13.575 8.701 1.00 25.00 H new ATOM 0 HB3 ARG A 669 -14.644 14.542 10.092 1.00 25.00 H new ATOM 0 HG2 ARG A 669 -13.265 13.096 11.557 1.00 25.00 H new ATOM 0 HG3 ARG A 669 -12.836 12.098 10.182 1.00 25.00 H new ATOM 0 HD2 ARG A 669 -11.808 14.068 9.070 1.00 25.00 H new ATOM 0 HD3 ARG A 669 -12.244 15.070 10.439 1.00 25.00 H new ATOM 0 HE ARG A 669 -10.769 12.940 11.524 1.00 25.00 H new ATOM 0 HH11 ARG A 669 -10.186 15.535 9.156 1.00 25.00 H new ATOM 0 HH12 ARG A 669 -8.457 15.607 9.513 1.00 25.00 H new ATOM 0 HH21 ARG A 669 -8.559 13.066 11.949 1.00 25.00 H new ATOM 0 HH22 ARG A 669 -7.546 14.222 11.079 1.00 25.00 H new ATOM 1415 N SER A 670 -17.474 12.585 8.483 1.00 25.00 N ATOM 1416 CA SER A 670 -18.690 13.094 7.834 1.00 25.00 C ATOM 1417 C SER A 670 -19.965 12.735 8.622 1.00 25.00 C ATOM 1418 O SER A 670 -21.059 13.203 8.285 1.00 25.00 O ATOM 1419 CB SER A 670 -18.775 12.553 6.405 1.00 25.00 C ATOM 1420 OG SER A 670 -18.840 11.136 6.385 1.00 25.00 O ATOM 0 H SER A 670 -17.143 11.697 8.106 1.00 25.00 H new ATOM 0 HA SER A 670 -18.626 14.182 7.812 1.00 25.00 H new ATOM 0 HB2 SER A 670 -19.655 12.965 5.911 1.00 25.00 H new ATOM 0 HB3 SER A 670 -17.906 12.886 5.837 1.00 25.00 H new ATOM 0 HG SER A 670 -17.965 10.765 6.622 1.00 25.00 H new ATOM 1426 N ARG A 671 -19.813 11.915 9.672 1.00 25.00 N ATOM 1427 CA ARG A 671 -20.943 11.490 10.508 1.00 25.00 C ATOM 1428 C ARG A 671 -21.062 12.358 11.776 1.00 25.00 C ATOM 1429 O ARG A 671 -22.010 12.209 12.556 1.00 25.00 O ATOM 1430 CB ARG A 671 -20.795 10.010 10.863 1.00 25.00 C ATOM 1431 CG ARG A 671 -20.825 9.084 9.658 1.00 25.00 C ATOM 1432 CD ARG A 671 -20.760 7.648 10.099 1.00 25.00 C ATOM 1433 NE ARG A 671 -20.568 6.725 8.973 1.00 25.00 N ATOM 1434 CZ ARG A 671 -20.396 5.398 9.092 1.00 25.00 C ATOM 1435 NH1 ARG A 671 -20.397 4.806 10.285 1.00 25.00 N ATOM 1436 NH2 ARG A 671 -20.222 4.661 8.004 1.00 25.00 N ATOM 0 H ARG A 671 -18.914 11.532 9.963 1.00 25.00 H new ATOM 0 HA ARG A 671 -21.864 11.625 9.941 1.00 25.00 H new ATOM 0 HB2 ARG A 671 -19.856 9.866 11.397 1.00 25.00 H new ATOM 0 HB3 ARG A 671 -21.596 9.728 11.546 1.00 25.00 H new ATOM 0 HG2 ARG A 671 -21.736 9.254 9.083 1.00 25.00 H new ATOM 0 HG3 ARG A 671 -19.986 9.307 8.999 1.00 25.00 H new ATOM 0 HD2 ARG A 671 -19.942 7.525 10.809 1.00 25.00 H new ATOM 0 HD3 ARG A 671 -21.680 7.390 10.624 1.00 25.00 H new ATOM 0 HE ARG A 671 -20.565 7.120 8.033 1.00 25.00 H new ATOM 0 HH11 ARG A 671 -20.530 5.362 11.130 1.00 25.00 H new ATOM 0 HH12 ARG A 671 -20.265 3.797 10.354 1.00 25.00 H new ATOM 0 HH21 ARG A 671 -20.219 5.102 7.084 1.00 25.00 H new ATOM 0 HH22 ARG A 671 -20.091 3.653 8.087 1.00 25.00 H new ATOM 1450 N LEU A 672 -20.099 13.267 11.957 1.00 25.00 N ATOM 1451 CA LEU A 672 -20.075 14.172 13.111 1.00 25.00 C ATOM 1452 C LEU A 672 -20.434 15.600 12.688 1.00 25.00 C ATOM 1453 O LEU A 672 -19.564 16.296 12.116 1.00 25.00 O ATOM 1454 CB LEU A 672 -18.689 14.147 13.812 1.00 25.00 C ATOM 1455 CG LEU A 672 -18.173 12.792 14.378 1.00 25.00 C ATOM 1456 CD1 LEU A 672 -16.721 12.877 14.841 1.00 25.00 C ATOM 1457 CD2 LEU A 672 -19.064 12.271 15.506 1.00 25.00 C ATOM 1458 OXT LEU A 672 -21.588 16.010 12.932 1.00 25.00 O ATOM 0 H LEU A 672 -19.319 13.396 11.313 1.00 25.00 H new ATOM 0 HA LEU A 672 -20.823 13.824 13.824 1.00 25.00 H new ATOM 0 HB2 LEU A 672 -17.950 14.513 13.100 1.00 25.00 H new ATOM 0 HB3 LEU A 672 -18.720 14.861 14.635 1.00 25.00 H new ATOM 0 HG LEU A 672 -18.218 12.080 13.554 1.00 25.00 H new ATOM 0 HD11 LEU A 672 -16.405 11.908 15.228 1.00 25.00 H new ATOM 0 HD12 LEU A 672 -16.087 13.156 14.000 1.00 25.00 H new ATOM 0 HD13 LEU A 672 -16.633 13.628 15.627 1.00 25.00 H new ATOM 0 HD21 LEU A 672 -18.669 11.324 15.873 1.00 25.00 H new ATOM 0 HD22 LEU A 672 -19.083 12.996 16.319 1.00 25.00 H new ATOM 0 HD23 LEU A 672 -20.076 12.121 15.130 1.00 25.00 H new TER 1470 LEU A 672 ATOM 1471 N GLY B 519 -5.907 16.504 -28.711 1.00 25.00 N ATOM 1472 CA GLY B 519 -7.214 15.922 -28.298 1.00 25.00 C ATOM 1473 C GLY B 519 -7.729 16.517 -27.003 1.00 25.00 C ATOM 1474 O GLY B 519 -7.662 15.875 -25.952 1.00 25.00 O ATOM 0 HA2 GLY B 519 -7.947 16.087 -29.087 1.00 25.00 H new ATOM 0 HA3 GLY B 519 -7.108 14.843 -28.182 1.00 25.00 H new ATOM 1480 N SER B 520 -8.252 17.760 -27.091 1.00 25.00 N ATOM 1481 CA SER B 520 -8.799 18.520 -25.938 1.00 25.00 C ATOM 1482 C SER B 520 -7.717 18.812 -24.869 1.00 25.00 C ATOM 1483 O SER B 520 -7.087 17.878 -24.362 1.00 25.00 O ATOM 1484 CB SER B 520 -10.002 17.793 -25.300 1.00 25.00 C ATOM 1485 OG SER B 520 -10.403 18.418 -24.091 1.00 25.00 O ATOM 0 H SER B 520 -8.308 18.271 -27.972 1.00 25.00 H new ATOM 0 HA SER B 520 -9.145 19.476 -26.332 1.00 25.00 H new ATOM 0 HB2 SER B 520 -10.837 17.784 -26.001 1.00 25.00 H new ATOM 0 HB3 SER B 520 -9.739 16.754 -25.104 1.00 25.00 H new ATOM 0 HG SER B 520 -11.167 17.936 -23.712 1.00 25.00 H new ATOM 1491 N PRO B 521 -7.480 20.117 -24.505 1.00 25.00 N ATOM 1492 CA PRO B 521 -6.458 20.486 -23.497 1.00 25.00 C ATOM 1493 C PRO B 521 -6.870 20.146 -22.053 1.00 25.00 C ATOM 1494 O PRO B 521 -8.047 20.251 -21.695 1.00 25.00 O ATOM 1495 CB PRO B 521 -6.322 22.003 -23.685 1.00 25.00 C ATOM 1496 CG PRO B 521 -7.620 22.435 -24.258 1.00 25.00 C ATOM 1497 CD PRO B 521 -8.158 21.331 -25.052 1.00 25.00 C ATOM 0 HA PRO B 521 -5.530 19.932 -23.641 1.00 25.00 H new ATOM 0 HB2 PRO B 521 -6.123 22.502 -22.737 1.00 25.00 H new ATOM 0 HB3 PRO B 521 -5.495 22.246 -24.353 1.00 25.00 H new ATOM 0 HG2 PRO B 521 -8.315 22.706 -23.463 1.00 25.00 H new ATOM 0 HG3 PRO B 521 -7.486 23.320 -24.880 1.00 25.00 H new ATOM 0 HD2 PRO B 521 -9.241 21.260 -24.952 1.00 25.00 H new ATOM 0 HD3 PRO B 521 -7.943 21.462 -26.113 1.00 25.00 H new ATOM 1505 N GLY B 522 -5.885 19.739 -21.246 1.00 25.00 N ATOM 1506 CA GLY B 522 -6.137 19.389 -19.854 1.00 25.00 C ATOM 1507 C GLY B 522 -5.145 18.372 -19.315 1.00 25.00 C ATOM 1508 O GLY B 522 -4.152 18.052 -19.976 1.00 25.00 O ATOM 0 H GLY B 522 -4.911 19.646 -21.536 1.00 25.00 H new ATOM 0 HA2 GLY B 522 -6.094 20.291 -19.244 1.00 25.00 H new ATOM 0 HA3 GLY B 522 -7.147 18.989 -19.761 1.00 25.00 H new ATOM 1512 N TYR B 523 -5.420 17.869 -18.104 1.00 25.00 N ATOM 1513 CA TYR B 523 -4.561 16.876 -17.455 1.00 25.00 C ATOM 1514 C TYR B 523 -5.308 15.533 -17.284 1.00 25.00 C ATOM 1515 O TYR B 523 -6.091 15.380 -16.338 1.00 25.00 O ATOM 1516 CB TYR B 523 -4.070 17.394 -16.088 1.00 25.00 C ATOM 1517 CG TYR B 523 -3.335 18.722 -16.145 1.00 25.00 C ATOM 1518 CD1 TYR B 523 -4.009 19.922 -15.941 1.00 25.00 C ATOM 1519 CD2 TYR B 523 -1.969 18.776 -16.410 1.00 25.00 C ATOM 1520 CE1 TYR B 523 -3.346 21.134 -15.999 1.00 25.00 C ATOM 1521 CE2 TYR B 523 -1.301 19.983 -16.467 1.00 25.00 C ATOM 1522 CZ TYR B 523 -1.985 21.156 -16.236 1.00 25.00 C ATOM 1523 OH TYR B 523 -1.329 22.363 -16.320 1.00 25.00 O ATOM 0 H TYR B 523 -6.236 18.137 -17.554 1.00 25.00 H new ATOM 0 HA TYR B 523 -3.694 16.708 -18.094 1.00 25.00 H new ATOM 0 HB2 TYR B 523 -4.928 17.496 -15.423 1.00 25.00 H new ATOM 0 HB3 TYR B 523 -3.411 16.647 -15.646 1.00 25.00 H new ATOM 0 HD1 TYR B 523 -5.069 19.907 -15.734 1.00 25.00 H new ATOM 0 HD2 TYR B 523 -1.423 17.859 -16.574 1.00 25.00 H new ATOM 0 HE1 TYR B 523 -3.888 22.057 -15.860 1.00 25.00 H new ATOM 0 HE2 TYR B 523 -0.245 20.007 -16.692 1.00 25.00 H new ATOM 0 HH TYR B 523 -0.376 22.207 -16.489 1.00 25.00 H new ATOM 1533 N PRO B 524 -5.100 14.533 -18.206 1.00 25.00 N ATOM 1534 CA PRO B 524 -5.737 13.197 -18.096 1.00 25.00 C ATOM 1535 C PRO B 524 -5.204 12.372 -16.914 1.00 25.00 C ATOM 1536 O PRO B 524 -5.976 11.699 -16.225 1.00 25.00 O ATOM 1537 CB PRO B 524 -5.389 12.504 -19.427 1.00 25.00 C ATOM 1538 CG PRO B 524 -5.116 13.618 -20.389 1.00 25.00 C ATOM 1539 CD PRO B 524 -4.271 14.613 -19.434 1.00 25.00 C ATOM 0 HA PRO B 524 -6.808 13.289 -17.915 1.00 25.00 H new ATOM 0 HB2 PRO B 524 -4.520 11.856 -19.318 1.00 25.00 H new ATOM 0 HB3 PRO B 524 -6.212 11.878 -19.772 1.00 25.00 H new ATOM 0 HG2 PRO B 524 -4.545 13.289 -21.257 1.00 25.00 H new ATOM 0 HG3 PRO B 524 -6.030 14.078 -20.765 1.00 25.00 H new ATOM 0 HD2 PRO B 524 -3.249 14.271 -19.273 1.00 25.00 H new ATOM 0 HD3 PRO B 524 -4.210 15.625 -19.833 1.00 25.00 H new ATOM 1547 N ASN B 525 -3.882 12.434 -16.697 1.00 25.00 N ATOM 1548 CA ASN B 525 -3.233 11.714 -15.599 1.00 25.00 C ATOM 1549 C ASN B 525 -2.362 12.676 -14.784 1.00 25.00 C ATOM 1550 O ASN B 525 -1.561 13.430 -15.349 1.00 25.00 O ATOM 1551 CB ASN B 525 -2.387 10.550 -16.154 1.00 25.00 C ATOM 1552 CG ASN B 525 -3.214 9.444 -16.805 1.00 25.00 C ATOM 1553 OD1 ASN B 525 -3.282 9.329 -18.032 1.00 25.00 O ATOM 1554 ND2 ASN B 525 -3.851 8.623 -15.979 1.00 25.00 N ATOM 0 H ASN B 525 -3.241 12.980 -17.273 1.00 25.00 H new ATOM 0 HA ASN B 525 -3.998 11.300 -14.943 1.00 25.00 H new ATOM 0 HB2 ASN B 525 -1.682 10.943 -16.886 1.00 25.00 H new ATOM 0 HB3 ASN B 525 -1.799 10.121 -15.343 1.00 25.00 H new ATOM 0 HD21 ASN B 525 -4.421 7.865 -16.353 1.00 25.00 H new ATOM 0 HD22 ASN B 525 -3.770 8.750 -14.970 1.00 25.00 H new ATOM 1561 N GLY B 526 -2.533 12.641 -13.458 1.00 25.00 N ATOM 1562 CA GLY B 526 -1.778 13.516 -12.574 1.00 25.00 C ATOM 1563 C GLY B 526 -1.121 12.765 -11.433 1.00 25.00 C ATOM 1564 O GLY B 526 -1.791 12.384 -10.469 1.00 25.00 O ATOM 0 H GLY B 526 -3.185 12.018 -12.982 1.00 25.00 H new ATOM 0 HA2 GLY B 526 -1.013 14.036 -13.150 1.00 25.00 H new ATOM 0 HA3 GLY B 526 -2.443 14.278 -12.167 1.00 25.00 H new ATOM 1568 N LEU B 527 0.195 12.551 -11.551 1.00 25.00 N ATOM 1569 CA LEU B 527 0.969 11.846 -10.526 1.00 25.00 C ATOM 1570 C LEU B 527 2.134 12.707 -10.005 1.00 25.00 C ATOM 1571 O LEU B 527 3.189 12.188 -9.618 1.00 25.00 O ATOM 1572 CB LEU B 527 1.461 10.451 -11.039 1.00 25.00 C ATOM 1573 CG LEU B 527 0.434 9.294 -11.244 1.00 25.00 C ATOM 1574 CD1 LEU B 527 0.315 8.902 -12.706 1.00 25.00 C ATOM 1575 CD2 LEU B 527 0.759 8.077 -10.387 1.00 25.00 C ATOM 0 H LEU B 527 0.747 12.859 -12.351 1.00 25.00 H new ATOM 0 HA LEU B 527 0.304 11.663 -9.682 1.00 25.00 H new ATOM 0 HB2 LEU B 527 1.962 10.614 -11.993 1.00 25.00 H new ATOM 0 HB3 LEU B 527 2.217 10.095 -10.339 1.00 25.00 H new ATOM 0 HG LEU B 527 -0.532 9.678 -10.916 1.00 25.00 H new ATOM 0 HD11 LEU B 527 -0.409 8.094 -12.808 1.00 25.00 H new ATOM 0 HD12 LEU B 527 -0.017 9.762 -13.287 1.00 25.00 H new ATOM 0 HD13 LEU B 527 1.285 8.568 -13.073 1.00 25.00 H new ATOM 0 HD21 LEU B 527 0.017 7.299 -10.564 1.00 25.00 H new ATOM 0 HD22 LEU B 527 1.748 7.701 -10.649 1.00 25.00 H new ATOM 0 HD23 LEU B 527 0.745 8.359 -9.334 1.00 25.00 H new ATOM 1587 N LEU B 528 1.917 14.030 -9.969 1.00 25.00 N ATOM 1588 CA LEU B 528 2.945 14.985 -9.534 1.00 25.00 C ATOM 1589 C LEU B 528 3.037 15.058 -7.993 1.00 25.00 C ATOM 1590 O LEU B 528 3.804 15.857 -7.446 1.00 25.00 O ATOM 1591 CB LEU B 528 2.642 16.376 -10.137 1.00 25.00 C ATOM 1592 CG LEU B 528 2.816 16.529 -11.664 1.00 25.00 C ATOM 1593 CD1 LEU B 528 2.383 17.913 -12.143 1.00 25.00 C ATOM 1594 CD2 LEU B 528 4.259 16.258 -12.060 1.00 25.00 C ATOM 0 H LEU B 528 1.034 14.464 -10.238 1.00 25.00 H new ATOM 0 HA LEU B 528 3.914 14.641 -9.894 1.00 25.00 H new ATOM 0 HB2 LEU B 528 1.615 16.639 -9.885 1.00 25.00 H new ATOM 0 HB3 LEU B 528 3.287 17.106 -9.647 1.00 25.00 H new ATOM 0 HG LEU B 528 2.171 15.795 -12.148 1.00 25.00 H new ATOM 0 HD11 LEU B 528 2.520 17.984 -13.222 1.00 25.00 H new ATOM 0 HD12 LEU B 528 1.332 18.070 -11.899 1.00 25.00 H new ATOM 0 HD13 LEU B 528 2.988 18.674 -11.650 1.00 25.00 H new ATOM 0 HD21 LEU B 528 4.367 16.369 -13.139 1.00 25.00 H new ATOM 0 HD22 LEU B 528 4.914 16.967 -11.554 1.00 25.00 H new ATOM 0 HD23 LEU B 528 4.531 15.243 -11.771 1.00 25.00 H new ATOM 1606 N SER B 529 2.259 14.206 -7.310 1.00 25.00 N ATOM 1607 CA SER B 529 2.256 14.146 -5.843 1.00 25.00 C ATOM 1608 C SER B 529 2.318 12.697 -5.348 1.00 25.00 C ATOM 1609 O SER B 529 3.103 12.376 -4.451 1.00 25.00 O ATOM 1610 CB SER B 529 1.022 14.862 -5.267 1.00 25.00 C ATOM 1611 OG SER B 529 -0.176 14.165 -5.577 1.00 25.00 O ATOM 0 H SER B 529 1.621 13.546 -7.754 1.00 25.00 H new ATOM 0 HA SER B 529 3.148 14.662 -5.488 1.00 25.00 H new ATOM 0 HB2 SER B 529 1.123 14.950 -4.185 1.00 25.00 H new ATOM 0 HB3 SER B 529 0.969 15.875 -5.666 1.00 25.00 H new ATOM 0 HG SER B 529 -0.941 14.644 -5.196 1.00 25.00 H new ATOM 1617 N GLY B 530 1.479 11.833 -5.942 1.00 25.00 N ATOM 1618 CA GLY B 530 1.485 10.407 -5.621 1.00 25.00 C ATOM 1619 C GLY B 530 0.527 10.022 -4.504 1.00 25.00 C ATOM 1620 O GLY B 530 0.487 8.856 -4.099 1.00 25.00 O ATOM 0 H GLY B 530 0.791 12.102 -6.645 1.00 25.00 H new ATOM 0 HA2 GLY B 530 1.228 9.842 -6.517 1.00 25.00 H new ATOM 0 HA3 GLY B 530 2.495 10.113 -5.337 1.00 25.00 H new ATOM 1624 N ASP B 531 -0.246 10.997 -4.018 1.00 25.00 N ATOM 1625 CA ASP B 531 -1.190 10.777 -2.920 1.00 25.00 C ATOM 1626 C ASP B 531 -2.629 11.123 -3.325 1.00 25.00 C ATOM 1627 O ASP B 531 -3.576 10.876 -2.570 1.00 25.00 O ATOM 1628 CB ASP B 531 -0.749 11.588 -1.684 1.00 25.00 C ATOM 1629 CG ASP B 531 0.490 11.034 -0.988 1.00 25.00 C ATOM 1630 OD1 ASP B 531 0.494 9.833 -0.648 1.00 25.00 O ATOM 1631 OD2 ASP B 531 1.452 11.805 -0.790 1.00 25.00 O ATOM 0 H ASP B 531 -0.235 11.954 -4.371 1.00 25.00 H new ATOM 0 HA ASP B 531 -1.181 9.716 -2.670 1.00 25.00 H new ATOM 0 HB2 ASP B 531 -0.553 12.616 -1.988 1.00 25.00 H new ATOM 0 HB3 ASP B 531 -1.572 11.618 -0.969 1.00 25.00 H new ATOM 1636 N GLU B 532 -2.772 11.685 -4.527 1.00 25.00 N ATOM 1637 CA GLU B 532 -4.053 12.154 -5.035 1.00 25.00 C ATOM 1638 C GLU B 532 -4.519 11.371 -6.263 1.00 25.00 C ATOM 1639 O GLU B 532 -5.629 11.583 -6.764 1.00 25.00 O ATOM 1640 CB GLU B 532 -3.939 13.638 -5.366 1.00 25.00 C ATOM 1641 CG GLU B 532 -3.715 14.527 -4.157 1.00 25.00 C ATOM 1642 CD GLU B 532 -3.904 16.000 -4.469 1.00 25.00 C ATOM 1643 OE1 GLU B 532 -4.973 16.362 -5.001 1.00 25.00 O ATOM 1644 OE2 GLU B 532 -2.980 16.791 -4.183 1.00 25.00 O ATOM 0 H GLU B 532 -1.996 11.826 -5.174 1.00 25.00 H new ATOM 0 HA GLU B 532 -4.803 11.994 -4.261 1.00 25.00 H new ATOM 0 HB2 GLU B 532 -3.116 13.781 -6.066 1.00 25.00 H new ATOM 0 HB3 GLU B 532 -4.849 13.957 -5.874 1.00 25.00 H new ATOM 0 HG2 GLU B 532 -4.405 14.236 -3.365 1.00 25.00 H new ATOM 0 HG3 GLU B 532 -2.706 14.367 -3.776 1.00 25.00 H new ATOM 1651 N ASP B 533 -3.667 10.467 -6.729 1.00 25.00 N ATOM 1652 CA ASP B 533 -3.917 9.707 -7.959 1.00 25.00 C ATOM 1653 C ASP B 533 -4.648 8.386 -7.670 1.00 25.00 C ATOM 1654 O ASP B 533 -5.660 8.090 -8.312 1.00 25.00 O ATOM 1655 CB ASP B 533 -2.591 9.453 -8.699 1.00 25.00 C ATOM 1656 CG ASP B 533 -2.779 8.815 -10.070 1.00 25.00 C ATOM 1657 OD1 ASP B 533 -3.431 9.440 -10.931 1.00 25.00 O ATOM 1658 OD2 ASP B 533 -2.269 7.694 -10.276 1.00 25.00 O ATOM 0 H ASP B 533 -2.785 10.236 -6.271 1.00 25.00 H new ATOM 0 HA ASP B 533 -4.569 10.301 -8.599 1.00 25.00 H new ATOM 0 HB2 ASP B 533 -2.061 10.398 -8.815 1.00 25.00 H new ATOM 0 HB3 ASP B 533 -1.960 8.807 -8.089 1.00 25.00 H new ATOM 1663 N PHE B 534 -4.137 7.598 -6.708 1.00 25.00 N ATOM 1664 CA PHE B 534 -4.766 6.320 -6.347 1.00 25.00 C ATOM 1665 C PHE B 534 -5.837 6.512 -5.260 1.00 25.00 C ATOM 1666 O PHE B 534 -6.617 5.600 -4.979 1.00 25.00 O ATOM 1667 CB PHE B 534 -3.703 5.273 -5.929 1.00 25.00 C ATOM 1668 CG PHE B 534 -2.832 4.737 -7.042 1.00 25.00 C ATOM 1669 CD1 PHE B 534 -1.686 5.407 -7.438 1.00 25.00 C ATOM 1670 CD2 PHE B 534 -3.176 3.562 -7.694 1.00 25.00 C ATOM 1671 CE1 PHE B 534 -0.898 4.913 -8.459 1.00 25.00 C ATOM 1672 CE2 PHE B 534 -2.397 3.065 -8.712 1.00 25.00 C ATOM 1673 CZ PHE B 534 -1.252 3.741 -9.097 1.00 25.00 C ATOM 0 H PHE B 534 -3.298 7.822 -6.172 1.00 25.00 H new ATOM 0 HA PHE B 534 -5.272 5.934 -7.232 1.00 25.00 H new ATOM 0 HB2 PHE B 534 -3.058 5.720 -5.172 1.00 25.00 H new ATOM 0 HB3 PHE B 534 -4.214 4.434 -5.457 1.00 25.00 H new ATOM 0 HD1 PHE B 534 -1.406 6.325 -6.943 1.00 25.00 H new ATOM 0 HD2 PHE B 534 -4.068 3.030 -7.398 1.00 25.00 H new ATOM 0 HE1 PHE B 534 -0.006 5.443 -8.758 1.00 25.00 H new ATOM 0 HE2 PHE B 534 -2.678 2.149 -9.210 1.00 25.00 H new ATOM 0 HZ PHE B 534 -0.637 3.352 -9.895 1.00 25.00 H new ATOM 1683 N SER B 535 -5.850 7.711 -4.659 1.00 25.00 N ATOM 1684 CA SER B 535 -6.838 8.088 -3.633 1.00 25.00 C ATOM 1685 C SER B 535 -8.248 8.204 -4.232 1.00 25.00 C ATOM 1686 O SER B 535 -9.248 8.075 -3.519 1.00 25.00 O ATOM 1687 CB SER B 535 -6.436 9.417 -2.983 1.00 25.00 C ATOM 1688 OG SER B 535 -6.597 10.503 -3.881 1.00 25.00 O ATOM 0 H SER B 535 -5.177 8.448 -4.869 1.00 25.00 H new ATOM 0 HA SER B 535 -6.855 7.304 -2.876 1.00 25.00 H new ATOM 0 HB2 SER B 535 -7.042 9.586 -2.093 1.00 25.00 H new ATOM 0 HB3 SER B 535 -5.397 9.364 -2.656 1.00 25.00 H new ATOM 0 HG SER B 535 -6.649 11.341 -3.375 1.00 25.00 H new ATOM 1694 N SER B 536 -8.303 8.446 -5.550 1.00 25.00 N ATOM 1695 CA SER B 536 -9.560 8.476 -6.302 1.00 25.00 C ATOM 1696 C SER B 536 -10.052 7.054 -6.591 1.00 25.00 C ATOM 1697 O SER B 536 -11.254 6.813 -6.713 1.00 25.00 O ATOM 1698 CB SER B 536 -9.363 9.248 -7.614 1.00 25.00 C ATOM 1699 OG SER B 536 -8.385 8.632 -8.440 1.00 25.00 O ATOM 0 H SER B 536 -7.477 8.626 -6.121 1.00 25.00 H new ATOM 0 HA SER B 536 -10.315 8.982 -5.700 1.00 25.00 H new ATOM 0 HB2 SER B 536 -10.310 9.304 -8.150 1.00 25.00 H new ATOM 0 HB3 SER B 536 -9.061 10.272 -7.393 1.00 25.00 H new ATOM 0 HG SER B 536 -7.494 8.783 -8.061 1.00 25.00 H new ATOM 1705 N ILE B 537 -9.093 6.127 -6.692 1.00 25.00 N ATOM 1706 CA ILE B 537 -9.374 4.713 -6.952 1.00 25.00 C ATOM 1707 C ILE B 537 -9.636 3.945 -5.642 1.00 25.00 C ATOM 1708 O ILE B 537 -10.429 3.001 -5.628 1.00 25.00 O ATOM 1709 CB ILE B 537 -8.199 4.042 -7.755 1.00 25.00 C ATOM 1710 CG1 ILE B 537 -8.021 4.679 -9.169 1.00 25.00 C ATOM 1711 CG2 ILE B 537 -8.361 2.515 -7.870 1.00 25.00 C ATOM 1712 CD1 ILE B 537 -6.745 4.302 -9.924 1.00 25.00 C ATOM 0 H ILE B 537 -8.100 6.337 -6.595 1.00 25.00 H new ATOM 0 HA ILE B 537 -10.277 4.666 -7.560 1.00 25.00 H new ATOM 0 HB ILE B 537 -7.294 4.235 -7.179 1.00 25.00 H new ATOM 0 HG12 ILE B 537 -8.877 4.398 -9.782 1.00 25.00 H new ATOM 0 HG13 ILE B 537 -8.048 5.763 -9.062 1.00 25.00 H new ATOM 0 HG21 ILE B 537 -7.524 2.102 -8.433 1.00 25.00 H new ATOM 0 HG22 ILE B 537 -8.380 2.075 -6.873 1.00 25.00 H new ATOM 0 HG23 ILE B 537 -9.294 2.286 -8.386 1.00 25.00 H new ATOM 0 HD11 ILE B 537 -6.733 4.804 -10.891 1.00 25.00 H new ATOM 0 HD12 ILE B 537 -5.875 4.610 -9.344 1.00 25.00 H new ATOM 0 HD13 ILE B 537 -6.717 3.223 -10.075 1.00 25.00 H new ATOM 1724 N ALA B 538 -8.974 4.361 -4.552 1.00 25.00 N ATOM 1725 CA ALA B 538 -9.052 3.640 -3.276 1.00 25.00 C ATOM 1726 C ALA B 538 -10.303 3.982 -2.465 1.00 25.00 C ATOM 1727 O ALA B 538 -10.627 3.303 -1.485 1.00 25.00 O ATOM 1728 CB ALA B 538 -7.791 3.872 -2.455 1.00 25.00 C ATOM 0 H ALA B 538 -8.381 5.190 -4.530 1.00 25.00 H new ATOM 0 HA ALA B 538 -9.130 2.581 -3.520 1.00 25.00 H new ATOM 0 HB1 ALA B 538 -7.866 3.330 -1.512 1.00 25.00 H new ATOM 0 HB2 ALA B 538 -6.924 3.515 -3.011 1.00 25.00 H new ATOM 0 HB3 ALA B 538 -7.679 4.937 -2.253 1.00 25.00 H new ATOM 1734 N ASP B 539 -10.992 5.031 -2.891 1.00 25.00 N ATOM 1735 CA ASP B 539 -12.268 5.433 -2.293 1.00 25.00 C ATOM 1736 C ASP B 539 -13.431 4.956 -3.181 1.00 25.00 C ATOM 1737 O ASP B 539 -14.598 4.991 -2.777 1.00 25.00 O ATOM 1738 CB ASP B 539 -12.298 6.960 -2.080 1.00 25.00 C ATOM 1739 CG ASP B 539 -11.270 7.456 -1.074 1.00 25.00 C ATOM 1740 OD1 ASP B 539 -10.877 6.668 -0.188 1.00 25.00 O ATOM 1741 OD2 ASP B 539 -10.857 8.631 -1.176 1.00 25.00 O ATOM 0 H ASP B 539 -10.688 5.630 -3.659 1.00 25.00 H new ATOM 0 HA ASP B 539 -12.378 4.964 -1.315 1.00 25.00 H new ATOM 0 HB2 ASP B 539 -12.127 7.455 -3.036 1.00 25.00 H new ATOM 0 HB3 ASP B 539 -13.293 7.252 -1.744 1.00 25.00 H new ATOM 1746 N MET B 540 -13.078 4.503 -4.389 1.00 25.00 N ATOM 1747 CA MET B 540 -14.018 3.866 -5.314 1.00 25.00 C ATOM 1748 C MET B 540 -14.000 2.346 -5.144 1.00 25.00 C ATOM 1749 O MET B 540 -15.001 1.671 -5.400 1.00 25.00 O ATOM 1750 CB MET B 540 -13.652 4.219 -6.757 1.00 25.00 C ATOM 1751 CG MET B 540 -13.945 5.669 -7.137 1.00 25.00 C ATOM 1752 SD MET B 540 -15.711 6.069 -7.141 1.00 25.00 S ATOM 1753 CE MET B 540 -16.302 5.185 -8.587 1.00 25.00 C ATOM 0 H MET B 540 -12.127 4.569 -4.753 1.00 25.00 H new ATOM 0 HA MET B 540 -15.019 4.234 -5.089 1.00 25.00 H new ATOM 0 HB2 MET B 540 -12.591 4.022 -6.910 1.00 25.00 H new ATOM 0 HB3 MET B 540 -14.199 3.560 -7.431 1.00 25.00 H new ATOM 0 HG2 MET B 540 -13.432 6.330 -6.439 1.00 25.00 H new ATOM 0 HG3 MET B 540 -13.533 5.868 -8.126 1.00 25.00 H new ATOM 0 HE1 MET B 540 -17.332 5.474 -8.794 1.00 25.00 H new ATOM 0 HE2 MET B 540 -15.676 5.431 -9.445 1.00 25.00 H new ATOM 0 HE3 MET B 540 -16.257 4.112 -8.401 1.00 25.00 H new ATOM 1763 N ASP B 541 -12.847 1.826 -4.702 1.00 25.00 N ATOM 1764 CA ASP B 541 -12.642 0.388 -4.527 1.00 25.00 C ATOM 1765 C ASP B 541 -13.017 -0.071 -3.107 1.00 25.00 C ATOM 1766 O ASP B 541 -13.261 -1.261 -2.886 1.00 25.00 O ATOM 1767 CB ASP B 541 -11.182 0.034 -4.836 1.00 25.00 C ATOM 1768 CG ASP B 541 -10.902 -0.100 -6.323 1.00 25.00 C ATOM 1769 OD1 ASP B 541 -11.865 -0.284 -7.095 1.00 25.00 O ATOM 1770 OD2 ASP B 541 -9.718 -0.017 -6.711 1.00 25.00 O ATOM 0 H ASP B 541 -12.034 2.391 -4.457 1.00 25.00 H new ATOM 0 HA ASP B 541 -13.298 -0.136 -5.222 1.00 25.00 H new ATOM 0 HB2 ASP B 541 -10.532 0.803 -4.418 1.00 25.00 H new ATOM 0 HB3 ASP B 541 -10.929 -0.902 -4.339 1.00 25.00 H new ATOM 1775 N PHE B 542 -13.067 0.878 -2.151 1.00 25.00 N ATOM 1776 CA PHE B 542 -13.436 0.569 -0.758 1.00 25.00 C ATOM 1777 C PHE B 542 -14.941 0.268 -0.643 1.00 25.00 C ATOM 1778 O PHE B 542 -15.363 -0.496 0.230 1.00 25.00 O ATOM 1779 CB PHE B 542 -13.049 1.743 0.157 1.00 25.00 C ATOM 1780 CG PHE B 542 -13.276 1.507 1.633 1.00 25.00 C ATOM 1781 CD1 PHE B 542 -12.499 0.598 2.338 1.00 25.00 C ATOM 1782 CD2 PHE B 542 -14.282 2.186 2.305 1.00 25.00 C ATOM 1783 CE1 PHE B 542 -12.721 0.374 3.685 1.00 25.00 C ATOM 1784 CE2 PHE B 542 -14.506 1.966 3.651 1.00 25.00 C ATOM 1785 CZ PHE B 542 -13.725 1.059 4.341 1.00 25.00 C ATOM 0 H PHE B 542 -12.857 1.862 -2.319 1.00 25.00 H new ATOM 0 HA PHE B 542 -12.891 -0.321 -0.443 1.00 25.00 H new ATOM 0 HB2 PHE B 542 -11.996 1.974 -0.000 1.00 25.00 H new ATOM 0 HB3 PHE B 542 -13.617 2.622 -0.146 1.00 25.00 H new ATOM 0 HD1 PHE B 542 -11.713 0.060 1.829 1.00 25.00 H new ATOM 0 HD2 PHE B 542 -14.897 2.895 1.770 1.00 25.00 H new ATOM 0 HE1 PHE B 542 -12.110 -0.336 4.223 1.00 25.00 H new ATOM 0 HE2 PHE B 542 -15.291 2.503 4.163 1.00 25.00 H new ATOM 0 HZ PHE B 542 -13.899 0.886 5.393 1.00 25.00 H new ATOM 1795 N SER B 543 -15.733 0.883 -1.536 1.00 25.00 N ATOM 1796 CA SER B 543 -17.179 0.638 -1.621 1.00 25.00 C ATOM 1797 C SER B 543 -17.481 -0.635 -2.429 1.00 25.00 C ATOM 1798 O SER B 543 -18.544 -1.243 -2.263 1.00 25.00 O ATOM 1799 CB SER B 543 -17.875 1.844 -2.257 1.00 25.00 C ATOM 1800 OG SER B 543 -17.428 2.059 -3.587 1.00 25.00 O ATOM 0 H SER B 543 -15.389 1.561 -2.216 1.00 25.00 H new ATOM 0 HA SER B 543 -17.560 0.493 -0.610 1.00 25.00 H new ATOM 0 HB2 SER B 543 -18.953 1.686 -2.255 1.00 25.00 H new ATOM 0 HB3 SER B 543 -17.682 2.734 -1.659 1.00 25.00 H new ATOM 0 HG SER B 543 -17.892 2.835 -3.967 1.00 25.00 H new ATOM 1806 N ALA B 544 -16.533 -1.026 -3.299 1.00 25.00 N ATOM 1807 CA ALA B 544 -16.663 -2.235 -4.125 1.00 25.00 C ATOM 1808 C ALA B 544 -16.316 -3.500 -3.331 1.00 25.00 C ATOM 1809 O ALA B 544 -16.868 -4.575 -3.589 1.00 25.00 O ATOM 1810 CB ALA B 544 -15.778 -2.124 -5.360 1.00 25.00 C ATOM 0 H ALA B 544 -15.662 -0.516 -3.447 1.00 25.00 H new ATOM 0 HA ALA B 544 -17.704 -2.317 -4.438 1.00 25.00 H new ATOM 0 HB1 ALA B 544 -15.882 -3.025 -5.964 1.00 25.00 H new ATOM 0 HB2 ALA B 544 -16.080 -1.256 -5.947 1.00 25.00 H new ATOM 0 HB3 ALA B 544 -14.738 -2.011 -5.053 1.00 25.00 H new ATOM 1816 N LEU B 545 -15.396 -3.355 -2.367 1.00 25.00 N ATOM 1817 CA LEU B 545 -15.023 -4.434 -1.452 1.00 25.00 C ATOM 1818 C LEU B 545 -16.016 -4.544 -0.286 1.00 25.00 C ATOM 1819 O LEU B 545 -16.080 -5.572 0.395 1.00 25.00 O ATOM 1820 CB LEU B 545 -13.613 -4.179 -0.913 1.00 25.00 C ATOM 1821 CG LEU B 545 -12.472 -4.256 -1.939 1.00 25.00 C ATOM 1822 CD1 LEU B 545 -11.155 -3.841 -1.307 1.00 25.00 C ATOM 1823 CD2 LEU B 545 -12.338 -5.665 -2.511 1.00 25.00 C ATOM 0 H LEU B 545 -14.891 -2.484 -2.203 1.00 25.00 H new ATOM 0 HA LEU B 545 -15.045 -5.375 -2.002 1.00 25.00 H new ATOM 0 HB2 LEU B 545 -13.595 -3.191 -0.454 1.00 25.00 H new ATOM 0 HB3 LEU B 545 -13.412 -4.902 -0.122 1.00 25.00 H new ATOM 0 HG LEU B 545 -12.715 -3.570 -2.750 1.00 25.00 H new ATOM 0 HD11 LEU B 545 -10.360 -3.902 -2.050 1.00 25.00 H new ATOM 0 HD12 LEU B 545 -11.233 -2.817 -0.943 1.00 25.00 H new ATOM 0 HD13 LEU B 545 -10.926 -4.506 -0.474 1.00 25.00 H new ATOM 0 HD21 LEU B 545 -11.523 -5.688 -3.234 1.00 25.00 H new ATOM 0 HD22 LEU B 545 -12.127 -6.367 -1.704 1.00 25.00 H new ATOM 0 HD23 LEU B 545 -13.268 -5.948 -3.004 1.00 25.00 H new ATOM 1835 N LEU B 546 -16.787 -3.467 -0.078 1.00 25.00 N ATOM 1836 CA LEU B 546 -17.810 -3.404 0.971 1.00 25.00 C ATOM 1837 C LEU B 546 -19.151 -3.968 0.466 1.00 25.00 C ATOM 1838 O LEU B 546 -19.947 -4.490 1.252 1.00 25.00 O ATOM 1839 CB LEU B 546 -17.963 -1.938 1.441 1.00 25.00 C ATOM 1840 CG LEU B 546 -16.985 -1.431 2.516 1.00 25.00 C ATOM 1841 CD1 LEU B 546 -17.231 0.033 2.837 1.00 25.00 C ATOM 1842 CD2 LEU B 546 -17.098 -2.275 3.776 1.00 25.00 C ATOM 0 H LEU B 546 -16.717 -2.615 -0.634 1.00 25.00 H new ATOM 0 HA LEU B 546 -17.499 -4.019 1.816 1.00 25.00 H new ATOM 0 HB2 LEU B 546 -17.867 -1.293 0.568 1.00 25.00 H new ATOM 0 HB3 LEU B 546 -18.977 -1.811 1.821 1.00 25.00 H new ATOM 0 HG LEU B 546 -15.974 -1.523 2.120 1.00 25.00 H new ATOM 0 HD11 LEU B 546 -16.525 0.362 3.599 1.00 25.00 H new ATOM 0 HD12 LEU B 546 -17.096 0.631 1.936 1.00 25.00 H new ATOM 0 HD13 LEU B 546 -18.249 0.158 3.207 1.00 25.00 H new ATOM 0 HD21 LEU B 546 -16.400 -1.904 4.526 1.00 25.00 H new ATOM 0 HD22 LEU B 546 -18.115 -2.214 4.164 1.00 25.00 H new ATOM 0 HD23 LEU B 546 -16.860 -3.313 3.541 1.00 25.00 H new ATOM 1854 N SER B 547 -19.377 -3.853 -0.848 1.00 25.00 N ATOM 1855 CA SER B 547 -20.610 -4.330 -1.494 1.00 25.00 C ATOM 1856 C SER B 547 -20.626 -5.860 -1.662 1.00 25.00 C ATOM 1857 O SER B 547 -21.698 -6.455 -1.815 1.00 25.00 O ATOM 1858 CB SER B 547 -20.776 -3.649 -2.858 1.00 25.00 C ATOM 1859 OG SER B 547 -19.736 -4.013 -3.752 1.00 25.00 O ATOM 0 H SER B 547 -18.713 -3.428 -1.494 1.00 25.00 H new ATOM 0 HA SER B 547 -21.445 -4.068 -0.844 1.00 25.00 H new ATOM 0 HB2 SER B 547 -21.739 -3.924 -3.288 1.00 25.00 H new ATOM 0 HB3 SER B 547 -20.782 -2.567 -2.727 1.00 25.00 H new ATOM 0 HG SER B 547 -18.936 -4.256 -3.241 1.00 25.00 H new ATOM 1865 N GLN B 548 -19.438 -6.485 -1.629 1.00 25.00 N ATOM 1866 CA GLN B 548 -19.312 -7.934 -1.853 1.00 25.00 C ATOM 1867 C GLN B 548 -19.389 -8.747 -0.549 1.00 25.00 C ATOM 1868 O GLN B 548 -19.562 -9.970 -0.584 1.00 25.00 O ATOM 1869 CB GLN B 548 -18.022 -8.259 -2.632 1.00 25.00 C ATOM 1870 CG GLN B 548 -17.969 -7.678 -4.036 1.00 25.00 C ATOM 1871 CD GLN B 548 -19.055 -8.212 -4.959 1.00 25.00 C ATOM 1872 OE1 GLN B 548 -19.726 -7.457 -5.668 1.00 25.00 O ATOM 1873 NE2 GLN B 548 -19.237 -9.527 -4.951 1.00 25.00 N ATOM 0 H GLN B 548 -18.553 -6.011 -1.450 1.00 25.00 H new ATOM 0 HA GLN B 548 -20.168 -8.234 -2.457 1.00 25.00 H new ATOM 0 HB2 GLN B 548 -17.168 -7.887 -2.066 1.00 25.00 H new ATOM 0 HB3 GLN B 548 -17.915 -9.342 -2.696 1.00 25.00 H new ATOM 0 HG2 GLN B 548 -18.057 -6.593 -3.975 1.00 25.00 H new ATOM 0 HG3 GLN B 548 -16.994 -7.894 -4.473 1.00 25.00 H new ATOM 0 HE21 GLN B 548 -18.662 -10.118 -4.351 1.00 25.00 H new ATOM 0 HE22 GLN B 548 -19.952 -9.947 -5.545 1.00 25.00 H new ATOM 1882 N ILE B 549 -19.267 -8.056 0.584 1.00 25.00 N ATOM 1883 CA ILE B 549 -19.306 -8.700 1.908 1.00 25.00 C ATOM 1884 C ILE B 549 -20.638 -8.459 2.634 1.00 25.00 C ATOM 1885 O ILE B 549 -21.074 -9.299 3.428 1.00 25.00 O ATOM 1886 CB ILE B 549 -18.119 -8.265 2.824 1.00 25.00 C ATOM 1887 CG1 ILE B 549 -16.746 -8.506 2.142 1.00 25.00 C ATOM 1888 CG2 ILE B 549 -18.207 -8.996 4.167 1.00 25.00 C ATOM 1889 CD1 ILE B 549 -15.591 -7.719 2.744 1.00 25.00 C ATOM 0 H ILE B 549 -19.139 -7.045 0.617 1.00 25.00 H new ATOM 0 HA ILE B 549 -19.208 -9.768 1.712 1.00 25.00 H new ATOM 0 HB ILE B 549 -18.198 -7.192 3.000 1.00 25.00 H new ATOM 0 HG12 ILE B 549 -16.511 -9.569 2.195 1.00 25.00 H new ATOM 0 HG13 ILE B 549 -16.830 -8.251 1.086 1.00 25.00 H new ATOM 0 HG21 ILE B 549 -17.377 -8.689 4.803 1.00 25.00 H new ATOM 0 HG22 ILE B 549 -19.149 -8.748 4.655 1.00 25.00 H new ATOM 0 HG23 ILE B 549 -18.158 -10.072 4.000 1.00 25.00 H new ATOM 0 HD11 ILE B 549 -14.673 -7.950 2.204 1.00 25.00 H new ATOM 0 HD12 ILE B 549 -15.798 -6.652 2.666 1.00 25.00 H new ATOM 0 HD13 ILE B 549 -15.474 -7.990 3.793 1.00 25.00 H new ATOM 1901 N SER B 550 -21.273 -7.311 2.357 1.00 25.00 N ATOM 1902 CA SER B 550 -22.546 -6.950 2.990 1.00 25.00 C ATOM 1903 C SER B 550 -23.721 -7.117 2.022 1.00 25.00 C ATOM 1904 O SER B 550 -24.782 -7.610 2.411 1.00 25.00 O ATOM 1905 CB SER B 550 -22.495 -5.508 3.510 1.00 25.00 C ATOM 1906 OG SER B 550 -22.340 -4.584 2.445 1.00 25.00 O ATOM 0 H SER B 550 -20.923 -6.616 1.697 1.00 25.00 H new ATOM 0 HA SER B 550 -22.701 -7.628 3.829 1.00 25.00 H new ATOM 0 HB2 SER B 550 -23.410 -5.284 4.059 1.00 25.00 H new ATOM 0 HB3 SER B 550 -21.668 -5.401 4.211 1.00 25.00 H new ATOM 0 HG SER B 550 -21.390 -4.501 2.220 1.00 25.00 H new ATOM 1912 N SER B 551 -23.514 -6.701 0.750 1.00 25.00 N ATOM 1913 CA SER B 551 -24.538 -6.770 -0.321 1.00 25.00 C ATOM 1914 C SER B 551 -25.813 -5.992 0.044 1.00 25.00 C ATOM 1915 O SER B 551 -26.657 -6.533 0.793 1.00 25.00 O ATOM 1916 CB SER B 551 -24.878 -8.231 -0.684 1.00 25.00 C ATOM 1917 OG SER B 551 -23.720 -8.940 -1.090 1.00 25.00 O ATOM 1918 OXT SER B 551 -25.952 -4.843 -0.426 1.00 25.00 O ATOM 0 H SER B 551 -22.628 -6.306 0.436 1.00 25.00 H new ATOM 0 HA SER B 551 -24.103 -6.292 -1.199 1.00 25.00 H new ATOM 0 HB2 SER B 551 -25.329 -8.727 0.176 1.00 25.00 H new ATOM 0 HB3 SER B 551 -25.617 -8.247 -1.485 1.00 25.00 H new ATOM 0 HG SER B 551 -23.024 -8.304 -1.357 1.00 25.00 H new TER 1924 SER B 551