USER MOD reduce.3.24.130724 H: found=0, std=0, add=791, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 789 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 Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -2.77 K(o=-2.8,f=-2.2) USER MOD Single : A 70 ASN : amide:sc= -0.41 X(o=-0.41,f=-0.31) USER MOD Single : A 72 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= -0.284 X(o=-0.28,f=-0.29) USER MOD Single : A 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 542 GLN : amide:sc=-0.00786 K(o=-0.0079,f=-1) USER MOD Single : B 546 THR OG1 : rot 180:sc= -0.523 USER MOD Single : B 548 SER OG : rot 180:sc=-0.00157 USER MOD Single : B 549 MET CE :methyl -173:sc= -0.0166 (180deg=-0.0714) USER MOD Single : B 552 SER OG : rot 180:sc= 0 USER MOD Single : B 556 GLN : amide:sc= 0 X(o=0,f=-0.076) USER MOD Single : B 558 GLN : amide:sc= -3.11 X(o=-3.1,f=-3.5!) USER MOD Single : B 559 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 560 GLN : amide:sc= -0.449 X(o=-0.45,f=0) USER MOD Single : B 561 MET CE :methyl -115:sc= -2.49 (180deg=-4.08) USER MOD Single : B 571 GLN : amide:sc= -1.6 K(o=-1.6,f=-2.1) USER MOD Single : B 573 MET CE :methyl -129:sc= -3.46! (180deg=-6.5!) USER MOD Single : B 574 HIS : no HD1:sc= -3.17! C(o=-3.2!,f=-4!) USER MOD Single : B 576 THR OG1 : rot 157:sc= -0.906 USER MOD Single : B 580 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 582 THR OG1 : rot -10:sc= -0.902 USER MOD Single : B 584 MET CE :methyl 156:sc= -11.4! (180deg=-14!) USER MOD Single : B 590 ASN : amide:sc= -0.934 K(o=-0.93,f=-3.7!) USER MOD Single : B 591 SER OG : rot 180:sc= 0 USER MOD Single : B 595 HIS : no HE2:sc= 0.133 K(o=0.13,f=-0.59) USER MOD Single : B 596 MET CE :methyl -122:sc= -3.33 (180deg=-6.56!) USER MOD Single : B 599 SER OG : rot 180:sc= 0 USER MOD Single : B 602 SER OG : rot 180:sc= -0.2 USER MOD Single : B 605 SER OG : rot 180:sc= 0 USER MOD Single : B 606 LYS NZ :NH3+ -162:sc= -1.05 (180deg=-1.82) USER MOD Single : B 615 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 617 HIS : no HD1:sc= -0.203 X(o=-0.2,f=-0.6) USER MOD Single : B 618 GLN : amide:sc= -0.113 K(o=-0.11,f=-2.1!) USER MOD Single : B 620 LYS NZ :NH3+ -169:sc= -0.0119 (180deg=-0.145) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 64 2.255 1.404 -3.262 1.00 0.00 N ATOM 2 CA ALA A 64 3.296 0.415 -3.007 1.00 0.00 C ATOM 3 C ALA A 64 3.001 -0.892 -3.735 1.00 0.00 C ATOM 4 O ALA A 64 2.011 -1.564 -3.448 1.00 0.00 O ATOM 5 CB ALA A 64 3.435 0.169 -1.512 1.00 0.00 C ATOM 0 HA ALA A 64 4.238 0.808 -3.388 1.00 0.00 H new ATOM 0 HB1 ALA A 64 4.215 -0.571 -1.336 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.700 1.101 -1.013 1.00 0.00 H new ATOM 0 HB3 ALA A 64 2.489 -0.199 -1.114 1.00 0.00 H new ATOM 11 N PHE A 65 3.868 -1.246 -4.678 1.00 0.00 N ATOM 12 CA PHE A 65 3.699 -2.472 -5.449 1.00 0.00 C ATOM 13 C PHE A 65 4.910 -3.387 -5.287 1.00 0.00 C ATOM 14 O PHE A 65 5.760 -3.163 -4.426 1.00 0.00 O ATOM 15 CB PHE A 65 3.487 -2.145 -6.928 1.00 0.00 C ATOM 16 CG PHE A 65 2.561 -0.985 -7.159 1.00 0.00 C ATOM 17 CD1 PHE A 65 1.412 -0.837 -6.398 1.00 0.00 C ATOM 18 CD2 PHE A 65 2.839 -0.043 -8.136 1.00 0.00 C ATOM 19 CE1 PHE A 65 0.558 0.228 -6.609 1.00 0.00 C ATOM 20 CE2 PHE A 65 1.988 1.025 -8.350 1.00 0.00 C ATOM 21 CZ PHE A 65 0.847 1.161 -7.585 1.00 0.00 C ATOM 0 H PHE A 65 4.694 -0.702 -4.926 1.00 0.00 H new ATOM 0 HA PHE A 65 2.819 -2.992 -5.070 1.00 0.00 H new ATOM 0 HB2 PHE A 65 4.452 -1.926 -7.385 1.00 0.00 H new ATOM 0 HB3 PHE A 65 3.087 -3.025 -7.433 1.00 0.00 H new ATOM 0 HD1 PHE A 65 1.182 -1.562 -5.632 1.00 0.00 H new ATOM 0 HD2 PHE A 65 3.731 -0.144 -8.737 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -0.335 0.331 -6.011 1.00 0.00 H new ATOM 0 HE2 PHE A 65 2.216 1.752 -9.115 1.00 0.00 H new ATOM 0 HZ PHE A 65 0.182 1.996 -7.750 1.00 0.00 H new ATOM 31 N SER A 66 4.981 -4.418 -6.123 1.00 0.00 N ATOM 32 CA SER A 66 6.084 -5.370 -6.071 1.00 0.00 C ATOM 33 C SER A 66 6.975 -5.237 -7.303 1.00 0.00 C ATOM 34 O SER A 66 8.150 -5.602 -7.275 1.00 0.00 O ATOM 35 CB SER A 66 5.549 -6.799 -5.966 1.00 0.00 C ATOM 36 OG SER A 66 6.543 -7.681 -5.474 1.00 0.00 O ATOM 0 H SER A 66 4.287 -4.615 -6.844 1.00 0.00 H new ATOM 0 HA SER A 66 6.681 -5.148 -5.186 1.00 0.00 H new ATOM 0 HB2 SER A 66 4.682 -6.818 -5.306 1.00 0.00 H new ATOM 0 HB3 SER A 66 5.211 -7.137 -6.946 1.00 0.00 H new ATOM 0 HG SER A 66 6.176 -8.588 -5.415 1.00 0.00 H new ATOM 42 N ARG A 67 6.405 -4.713 -8.383 1.00 0.00 N ATOM 43 CA ARG A 67 7.145 -4.533 -9.626 1.00 0.00 C ATOM 44 C ARG A 67 7.580 -3.080 -9.795 1.00 0.00 C ATOM 45 O ARG A 67 8.761 -2.758 -9.674 1.00 0.00 O ATOM 46 CB ARG A 67 6.291 -4.963 -10.820 1.00 0.00 C ATOM 47 CG ARG A 67 7.090 -5.180 -12.094 1.00 0.00 C ATOM 48 CD ARG A 67 7.860 -6.491 -12.052 1.00 0.00 C ATOM 49 NE ARG A 67 8.599 -6.732 -13.288 1.00 0.00 N ATOM 50 CZ ARG A 67 9.426 -7.756 -13.462 1.00 0.00 C ATOM 51 NH1 ARG A 67 9.618 -8.631 -12.485 1.00 0.00 N ATOM 52 NH2 ARG A 67 10.063 -7.908 -14.617 1.00 0.00 N ATOM 0 H ARG A 67 5.433 -4.406 -8.422 1.00 0.00 H new ATOM 0 HA ARG A 67 8.037 -5.158 -9.582 1.00 0.00 H new ATOM 0 HB2 ARG A 67 5.768 -5.885 -10.568 1.00 0.00 H new ATOM 0 HB3 ARG A 67 5.530 -4.205 -11.003 1.00 0.00 H new ATOM 0 HG2 ARG A 67 6.417 -5.179 -12.951 1.00 0.00 H new ATOM 0 HG3 ARG A 67 7.786 -4.353 -12.234 1.00 0.00 H new ATOM 0 HD2 ARG A 67 8.554 -6.477 -11.212 1.00 0.00 H new ATOM 0 HD3 ARG A 67 7.166 -7.313 -11.878 1.00 0.00 H new ATOM 0 HE ARG A 67 8.473 -6.078 -14.060 1.00 0.00 H new ATOM 0 HH11 ARG A 67 9.130 -8.519 -11.597 1.00 0.00 H new ATOM 0 HH12 ARG A 67 10.254 -9.417 -12.622 1.00 0.00 H new ATOM 0 HH21 ARG A 67 9.917 -7.238 -15.372 1.00 0.00 H new ATOM 0 HH22 ARG A 67 10.698 -8.695 -14.749 1.00 0.00 H new ATOM 66 N GLN A 68 6.616 -2.208 -10.074 1.00 0.00 N ATOM 67 CA GLN A 68 6.900 -0.790 -10.260 1.00 0.00 C ATOM 68 C GLN A 68 5.612 0.001 -10.460 1.00 0.00 C ATOM 69 O GLN A 68 4.572 -0.562 -10.805 1.00 0.00 O ATOM 70 CB GLN A 68 7.828 -0.588 -11.459 1.00 0.00 C ATOM 71 CG GLN A 68 7.110 -0.625 -12.798 1.00 0.00 C ATOM 72 CD GLN A 68 6.473 -1.972 -13.081 1.00 0.00 C ATOM 73 OE1 GLN A 68 5.418 -2.298 -12.538 1.00 0.00 O ATOM 74 NE2 GLN A 68 7.112 -2.762 -13.936 1.00 0.00 N ATOM 0 H GLN A 68 5.633 -2.459 -10.176 1.00 0.00 H new ATOM 0 HA GLN A 68 7.394 -0.423 -9.361 1.00 0.00 H new ATOM 0 HB2 GLN A 68 8.338 0.370 -11.356 1.00 0.00 H new ATOM 0 HB3 GLN A 68 8.597 -1.361 -11.447 1.00 0.00 H new ATOM 0 HG2 GLN A 68 6.341 0.147 -12.815 1.00 0.00 H new ATOM 0 HG3 GLN A 68 7.818 -0.388 -13.592 1.00 0.00 H new ATOM 0 HE21 GLN A 68 7.985 -2.451 -14.363 1.00 0.00 H new ATOM 0 HE22 GLN A 68 6.730 -3.680 -14.166 1.00 0.00 H new ATOM 83 N LEU A 69 5.687 1.309 -10.242 1.00 0.00 N ATOM 84 CA LEU A 69 4.527 2.179 -10.398 1.00 0.00 C ATOM 85 C LEU A 69 4.640 3.016 -11.668 1.00 0.00 C ATOM 86 O LEU A 69 5.677 3.020 -12.329 1.00 0.00 O ATOM 87 CB LEU A 69 4.384 3.095 -9.180 1.00 0.00 C ATOM 88 CG LEU A 69 5.597 3.965 -8.849 1.00 0.00 C ATOM 89 CD1 LEU A 69 5.529 5.285 -9.601 1.00 0.00 C ATOM 90 CD2 LEU A 69 5.685 4.207 -7.349 1.00 0.00 C ATOM 0 H LEU A 69 6.540 1.791 -9.956 1.00 0.00 H new ATOM 0 HA LEU A 69 3.640 1.550 -10.478 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.526 3.748 -9.340 1.00 0.00 H new ATOM 0 HB3 LEU A 69 4.157 2.478 -8.311 1.00 0.00 H new ATOM 0 HG LEU A 69 6.496 3.437 -9.166 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.401 5.891 -9.353 1.00 0.00 H new ATOM 0 HD12 LEU A 69 5.515 5.092 -10.674 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.623 5.820 -9.316 1.00 0.00 H new ATOM 0 HD21 LEU A 69 6.554 4.828 -7.131 1.00 0.00 H new ATOM 0 HD22 LEU A 69 4.782 4.714 -7.009 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.782 3.253 -6.832 1.00 0.00 H new ATOM 102 N ASN A 70 3.567 3.726 -12.000 1.00 0.00 N ATOM 103 CA ASN A 70 3.547 4.569 -13.190 1.00 0.00 C ATOM 104 C ASN A 70 3.627 6.045 -12.812 1.00 0.00 C ATOM 105 O ASN A 70 2.969 6.494 -11.873 1.00 0.00 O ATOM 106 CB ASN A 70 2.278 4.308 -14.004 1.00 0.00 C ATOM 107 CG ASN A 70 1.019 4.438 -13.170 1.00 0.00 C ATOM 108 OD1 ASN A 70 0.611 3.497 -12.490 1.00 0.00 O ATOM 109 ND2 ASN A 70 0.395 5.610 -13.219 1.00 0.00 N ATOM 0 H ASN A 70 2.700 3.735 -11.462 1.00 0.00 H new ATOM 0 HA ASN A 70 4.418 4.319 -13.796 1.00 0.00 H new ATOM 0 HB2 ASN A 70 2.233 5.010 -14.837 1.00 0.00 H new ATOM 0 HB3 ASN A 70 2.324 3.307 -14.433 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -0.458 5.757 -12.679 1.00 0.00 H new ATOM 0 HD22 ASN A 70 0.769 6.363 -13.797 1.00 0.00 H new ATOM 116 N VAL A 71 4.437 6.797 -13.551 1.00 0.00 N ATOM 117 CA VAL A 71 4.602 8.223 -13.296 1.00 0.00 C ATOM 118 C VAL A 71 3.425 9.020 -13.846 1.00 0.00 C ATOM 119 O VAL A 71 3.352 10.236 -13.676 1.00 0.00 O ATOM 120 CB VAL A 71 5.906 8.757 -13.918 1.00 0.00 C ATOM 121 CG1 VAL A 71 5.809 8.766 -15.436 1.00 0.00 C ATOM 122 CG2 VAL A 71 6.217 10.148 -13.388 1.00 0.00 C ATOM 0 H VAL A 71 4.989 6.442 -14.331 1.00 0.00 H new ATOM 0 HA VAL A 71 4.647 8.348 -12.214 1.00 0.00 H new ATOM 0 HB VAL A 71 6.722 8.093 -13.634 1.00 0.00 H new ATOM 0 HG11 VAL A 71 6.739 9.146 -15.858 1.00 0.00 H new ATOM 0 HG12 VAL A 71 5.635 7.752 -15.796 1.00 0.00 H new ATOM 0 HG13 VAL A 71 4.983 9.406 -15.744 1.00 0.00 H new ATOM 0 HG21 VAL A 71 7.141 10.510 -13.838 1.00 0.00 H new ATOM 0 HG22 VAL A 71 5.401 10.825 -13.641 1.00 0.00 H new ATOM 0 HG23 VAL A 71 6.332 10.107 -12.305 1.00 0.00 H new ATOM 132 N ASN A 72 2.505 8.325 -14.508 1.00 0.00 N ATOM 133 CA ASN A 72 1.330 8.968 -15.084 1.00 0.00 C ATOM 134 C ASN A 72 0.379 9.446 -13.991 1.00 0.00 C ATOM 135 O ASN A 72 -0.465 10.310 -14.222 1.00 0.00 O ATOM 136 CB ASN A 72 0.602 8.002 -16.022 1.00 0.00 C ATOM 137 CG ASN A 72 1.114 8.083 -17.447 1.00 0.00 C ATOM 138 OD1 ASN A 72 0.775 9.006 -18.188 1.00 0.00 O ATOM 139 ND2 ASN A 72 1.935 7.115 -17.837 1.00 0.00 N ATOM 0 H ASN A 72 2.551 7.317 -14.659 1.00 0.00 H new ATOM 0 HA ASN A 72 1.665 9.835 -15.654 1.00 0.00 H new ATOM 0 HB2 ASN A 72 0.721 6.983 -15.653 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -0.465 8.223 -16.009 1.00 0.00 H new ATOM 0 HD21 ASN A 72 2.312 7.117 -18.785 1.00 0.00 H new ATOM 0 HD22 ASN A 72 2.189 6.370 -17.189 1.00 0.00 H new ATOM 146 N ALA A 73 0.524 8.876 -12.799 1.00 0.00 N ATOM 147 CA ALA A 73 -0.319 9.245 -11.668 1.00 0.00 C ATOM 148 C ALA A 73 -0.210 10.736 -11.366 1.00 0.00 C ATOM 149 O ALA A 73 0.875 11.246 -11.087 1.00 0.00 O ATOM 150 CB ALA A 73 0.056 8.427 -10.441 1.00 0.00 C ATOM 0 H ALA A 73 1.217 8.157 -12.592 1.00 0.00 H new ATOM 0 HA ALA A 73 -1.354 9.029 -11.932 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -0.581 8.713 -9.604 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -0.080 7.367 -10.655 1.00 0.00 H new ATOM 0 HB3 ALA A 73 1.098 8.614 -10.184 1.00 0.00 H new ATOM 156 N LYS A 74 -1.342 11.430 -11.424 1.00 0.00 N ATOM 157 CA LYS A 74 -1.375 12.863 -11.156 1.00 0.00 C ATOM 158 C LYS A 74 -0.708 13.183 -9.822 1.00 0.00 C ATOM 159 O LYS A 74 -0.555 12.322 -8.955 1.00 0.00 O ATOM 160 CB LYS A 74 -2.819 13.368 -11.150 1.00 0.00 C ATOM 161 CG LYS A 74 -3.346 13.722 -12.531 1.00 0.00 C ATOM 162 CD LYS A 74 -3.342 15.224 -12.761 1.00 0.00 C ATOM 163 CE LYS A 74 -4.345 15.625 -13.832 1.00 0.00 C ATOM 164 NZ LYS A 74 -3.897 16.829 -14.587 1.00 0.00 N ATOM 0 H LYS A 74 -2.249 11.023 -11.654 1.00 0.00 H new ATOM 0 HA LYS A 74 -0.823 13.368 -11.948 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -3.460 12.604 -10.710 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -2.885 14.247 -10.509 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -2.735 13.235 -13.291 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -4.360 13.338 -12.644 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -3.579 15.737 -11.829 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -2.343 15.545 -13.057 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -4.489 14.795 -14.524 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -5.311 15.825 -13.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -4.607 17.071 -15.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -3.784 17.628 -13.931 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -2.987 16.630 -15.050 1.00 0.00 H new ATOM 178 N PRO A 75 -0.302 14.450 -9.651 1.00 0.00 N ATOM 179 CA PRO A 75 0.353 14.912 -8.424 1.00 0.00 C ATOM 180 C PRO A 75 -0.603 14.955 -7.237 1.00 0.00 C ATOM 181 O PRO A 75 -0.731 13.981 -6.495 1.00 0.00 O ATOM 182 CB PRO A 75 0.823 16.324 -8.784 1.00 0.00 C ATOM 183 CG PRO A 75 -0.100 16.767 -9.865 1.00 0.00 C ATOM 184 CD PRO A 75 -0.452 15.529 -10.642 1.00 0.00 C ATOM 0 HA PRO A 75 1.158 14.245 -8.116 1.00 0.00 H new ATOM 0 HB2 PRO A 75 0.772 16.990 -7.922 1.00 0.00 H new ATOM 0 HB3 PRO A 75 1.859 16.322 -9.124 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -0.993 17.234 -9.449 1.00 0.00 H new ATOM 0 HG3 PRO A 75 0.377 17.508 -10.506 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -1.468 15.576 -11.034 1.00 0.00 H new ATOM 0 HD3 PRO A 75 0.212 15.387 -11.494 1.00 0.00 H new ATOM 192 N PHE A 76 -1.272 16.090 -7.063 1.00 0.00 N ATOM 193 CA PHE A 76 -2.217 16.260 -5.966 1.00 0.00 C ATOM 194 C PHE A 76 -2.986 17.570 -6.108 1.00 0.00 C ATOM 195 O PHE A 76 -2.929 18.227 -7.147 1.00 0.00 O ATOM 196 CB PHE A 76 -1.483 16.229 -4.623 1.00 0.00 C ATOM 197 CG PHE A 76 -0.549 17.388 -4.424 1.00 0.00 C ATOM 198 CD1 PHE A 76 0.617 17.491 -5.165 1.00 0.00 C ATOM 199 CD2 PHE A 76 -0.838 18.376 -3.496 1.00 0.00 C ATOM 200 CE1 PHE A 76 1.479 18.557 -4.984 1.00 0.00 C ATOM 201 CE2 PHE A 76 0.019 19.444 -3.311 1.00 0.00 C ATOM 202 CZ PHE A 76 1.180 19.534 -4.055 1.00 0.00 C ATOM 0 H PHE A 76 -1.177 16.906 -7.668 1.00 0.00 H new ATOM 0 HA PHE A 76 -2.929 15.436 -6.002 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -2.217 16.221 -3.817 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -0.918 15.300 -4.548 1.00 0.00 H new ATOM 0 HD1 PHE A 76 0.856 16.730 -5.893 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -1.743 18.310 -2.911 1.00 0.00 H new ATOM 0 HE1 PHE A 76 2.385 18.625 -5.568 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -0.218 20.208 -2.585 1.00 0.00 H new ATOM 0 HZ PHE A 76 1.852 20.367 -3.910 1.00 0.00 H new ATOM 212 N VAL A 77 -3.706 17.944 -5.054 1.00 0.00 N ATOM 213 CA VAL A 77 -4.486 19.175 -5.060 1.00 0.00 C ATOM 214 C VAL A 77 -3.877 20.216 -4.128 1.00 0.00 C ATOM 215 O VAL A 77 -4.298 20.383 -2.983 1.00 0.00 O ATOM 216 CB VAL A 77 -5.945 18.917 -4.640 1.00 0.00 C ATOM 217 CG1 VAL A 77 -6.726 20.222 -4.590 1.00 0.00 C ATOM 218 CG2 VAL A 77 -6.605 17.927 -5.588 1.00 0.00 C ATOM 0 H VAL A 77 -3.765 17.412 -4.186 1.00 0.00 H new ATOM 0 HA VAL A 77 -4.471 19.554 -6.082 1.00 0.00 H new ATOM 0 HB VAL A 77 -5.945 18.483 -3.640 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -7.755 20.019 -4.291 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -6.264 20.895 -3.867 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.719 20.688 -5.575 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -7.635 17.756 -5.276 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.594 18.330 -6.601 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -6.059 16.984 -5.567 1.00 0.00 H new ATOM 228 N PRO A 78 -2.861 20.936 -4.627 1.00 0.00 N ATOM 229 CA PRO A 78 -2.173 21.975 -3.856 1.00 0.00 C ATOM 230 C PRO A 78 -3.051 23.198 -3.618 1.00 0.00 C ATOM 231 O PRO A 78 -4.210 23.232 -4.030 1.00 0.00 O ATOM 232 CB PRO A 78 -0.977 22.339 -4.740 1.00 0.00 C ATOM 233 CG PRO A 78 -1.407 21.988 -6.122 1.00 0.00 C ATOM 234 CD PRO A 78 -2.308 20.791 -5.984 1.00 0.00 C ATOM 0 HA PRO A 78 -1.895 21.627 -2.861 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -0.732 23.398 -4.658 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -0.086 21.783 -4.449 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -1.933 22.820 -6.590 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -0.547 21.759 -6.752 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -3.093 20.790 -6.740 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -1.756 19.858 -6.096 1.00 0.00 H new ATOM 242 N ASN A 79 -2.491 24.202 -2.950 1.00 0.00 N ATOM 243 CA ASN A 79 -3.225 25.428 -2.656 1.00 0.00 C ATOM 244 C ASN A 79 -2.599 26.621 -3.373 1.00 0.00 C ATOM 245 O ASN A 79 -2.701 27.758 -2.913 1.00 0.00 O ATOM 246 CB ASN A 79 -3.252 25.682 -1.148 1.00 0.00 C ATOM 247 CG ASN A 79 -4.287 26.718 -0.755 1.00 0.00 C ATOM 248 OD1 ASN A 79 -5.486 26.522 -0.955 1.00 0.00 O ATOM 249 ND2 ASN A 79 -3.827 27.830 -0.192 1.00 0.00 N ATOM 0 H ASN A 79 -1.532 24.191 -2.602 1.00 0.00 H new ATOM 0 HA ASN A 79 -4.247 25.305 -3.015 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -3.462 24.747 -0.629 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -2.267 26.014 -0.820 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -4.476 28.563 0.093 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -2.825 27.950 -0.045 1.00 0.00 H new ATOM 256 N VAL A 80 -1.952 26.353 -4.503 1.00 0.00 N ATOM 257 CA VAL A 80 -1.311 27.403 -5.284 1.00 0.00 C ATOM 258 C VAL A 80 -2.225 27.891 -6.403 1.00 0.00 C ATOM 259 O VAL A 80 -2.120 29.033 -6.851 1.00 0.00 O ATOM 260 CB VAL A 80 0.017 26.917 -5.896 1.00 0.00 C ATOM 261 CG1 VAL A 80 -0.228 25.759 -6.851 1.00 0.00 C ATOM 262 CG2 VAL A 80 0.727 28.061 -6.603 1.00 0.00 C ATOM 0 H VAL A 80 -1.858 25.417 -4.898 1.00 0.00 H new ATOM 0 HA VAL A 80 -1.107 28.227 -4.600 1.00 0.00 H new ATOM 0 HB VAL A 80 0.661 26.563 -5.091 1.00 0.00 H new ATOM 0 HG11 VAL A 80 0.721 25.429 -7.274 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -0.691 24.934 -6.311 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.890 26.084 -7.654 1.00 0.00 H new ATOM 0 HG21 VAL A 80 1.663 27.700 -7.029 1.00 0.00 H new ATOM 0 HG22 VAL A 80 0.091 28.448 -7.399 1.00 0.00 H new ATOM 0 HG23 VAL A 80 0.937 28.856 -5.888 1.00 0.00 H new ATOM 272 N HIS A 81 -3.122 27.018 -6.850 1.00 0.00 N ATOM 273 CA HIS A 81 -4.056 27.360 -7.916 1.00 0.00 C ATOM 274 C HIS A 81 -5.173 26.325 -8.013 1.00 0.00 C ATOM 275 O HIS A 81 -4.946 25.189 -8.429 1.00 0.00 O ATOM 276 CB HIS A 81 -3.322 27.460 -9.254 1.00 0.00 C ATOM 277 CG HIS A 81 -4.071 28.237 -10.292 1.00 0.00 C ATOM 278 ND1 HIS A 81 -3.867 29.582 -10.518 1.00 0.00 N ATOM 279 CD2 HIS A 81 -5.028 27.850 -11.168 1.00 0.00 C ATOM 280 CE1 HIS A 81 -4.667 29.989 -11.488 1.00 0.00 C ATOM 281 NE2 HIS A 81 -5.382 28.957 -11.900 1.00 0.00 N ATOM 0 H HIS A 81 -3.222 26.069 -6.490 1.00 0.00 H new ATOM 0 HA HIS A 81 -4.499 28.327 -7.679 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -2.351 27.928 -9.092 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -3.132 26.455 -9.631 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -5.437 26.856 -11.272 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -4.726 30.994 -11.878 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -6.083 28.979 -12.641 1.00 0.00 H new ATOM 289 N ALA A 82 -6.379 26.725 -7.623 1.00 0.00 N ATOM 290 CA ALA A 82 -7.531 25.833 -7.667 1.00 0.00 C ATOM 291 C ALA A 82 -8.017 25.633 -9.099 1.00 0.00 C ATOM 292 O ALA A 82 -8.600 24.592 -9.396 1.00 0.00 O ATOM 293 CB ALA A 82 -8.654 26.379 -6.798 1.00 0.00 C ATOM 0 H ALA A 82 -6.583 27.661 -7.273 1.00 0.00 H new ATOM 0 HA ALA A 82 -7.223 24.863 -7.277 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -9.508 25.703 -6.840 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -8.309 26.464 -5.768 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -8.951 27.362 -7.163 1.00 0.00 H new TER 299 ALA A 82 ATOM 300 N GLY B 541 7.217 24.379 15.006 1.00 0.00 N ATOM 301 CA GLY B 541 6.863 25.739 15.368 1.00 0.00 C ATOM 302 C GLY B 541 5.389 25.889 15.689 1.00 0.00 C ATOM 303 O GLY B 541 5.027 26.423 16.737 1.00 0.00 O ATOM 0 HA2 GLY B 541 7.453 26.047 16.231 1.00 0.00 H new ATOM 0 HA3 GLY B 541 7.123 26.409 14.549 1.00 0.00 H new ATOM 307 N GLN B 542 4.537 25.418 14.784 1.00 0.00 N ATOM 308 CA GLN B 542 3.095 25.506 14.975 1.00 0.00 C ATOM 309 C GLN B 542 2.353 24.767 13.866 1.00 0.00 C ATOM 310 O GLN B 542 2.929 24.449 12.827 1.00 0.00 O ATOM 311 CB GLN B 542 2.652 26.969 15.014 1.00 0.00 C ATOM 312 CG GLN B 542 2.059 27.390 16.350 1.00 0.00 C ATOM 313 CD GLN B 542 1.072 28.533 16.216 1.00 0.00 C ATOM 314 OE1 GLN B 542 1.016 29.203 15.185 1.00 0.00 O ATOM 315 NE2 GLN B 542 0.285 28.761 17.261 1.00 0.00 N ATOM 0 H GLN B 542 4.821 24.972 13.912 1.00 0.00 H new ATOM 0 HA GLN B 542 2.851 25.035 15.927 1.00 0.00 H new ATOM 0 HB2 GLN B 542 3.508 27.605 14.789 1.00 0.00 H new ATOM 0 HB3 GLN B 542 1.915 27.138 14.229 1.00 0.00 H new ATOM 0 HG2 GLN B 542 1.560 26.536 16.807 1.00 0.00 H new ATOM 0 HG3 GLN B 542 2.863 27.687 17.023 1.00 0.00 H new ATOM 0 HE21 GLN B 542 0.365 28.181 18.096 1.00 0.00 H new ATOM 0 HE22 GLN B 542 -0.400 29.516 17.229 1.00 0.00 H new ATOM 324 N GLU B 543 1.071 24.498 14.096 1.00 0.00 N ATOM 325 CA GLU B 543 0.251 23.795 13.115 1.00 0.00 C ATOM 326 C GLU B 543 0.924 22.499 12.673 1.00 0.00 C ATOM 327 O GLU B 543 1.360 22.355 11.531 1.00 0.00 O ATOM 328 CB GLU B 543 -0.008 24.688 11.901 1.00 0.00 C ATOM 329 CG GLU B 543 -0.666 26.013 12.249 1.00 0.00 C ATOM 330 CD GLU B 543 -2.164 25.885 12.451 1.00 0.00 C ATOM 331 OE1 GLU B 543 -2.750 24.908 11.938 1.00 0.00 O ATOM 332 OE2 GLU B 543 -2.750 26.760 13.121 1.00 0.00 O ATOM 0 H GLU B 543 0.579 24.756 14.951 1.00 0.00 H new ATOM 0 HA GLU B 543 -0.701 23.548 13.585 1.00 0.00 H new ATOM 0 HB2 GLU B 543 0.938 24.883 11.396 1.00 0.00 H new ATOM 0 HB3 GLU B 543 -0.642 24.152 11.195 1.00 0.00 H new ATOM 0 HG2 GLU B 543 -0.213 26.412 13.157 1.00 0.00 H new ATOM 0 HG3 GLU B 543 -0.470 26.732 11.453 1.00 0.00 H new ATOM 339 N PRO B 544 1.011 21.532 13.598 1.00 0.00 N ATOM 340 CA PRO B 544 1.629 20.230 13.328 1.00 0.00 C ATOM 341 C PRO B 544 0.795 19.379 12.376 1.00 0.00 C ATOM 342 O PRO B 544 -0.362 19.696 12.096 1.00 0.00 O ATOM 343 CB PRO B 544 1.696 19.576 14.710 1.00 0.00 C ATOM 344 CG PRO B 544 0.604 20.223 15.490 1.00 0.00 C ATOM 345 CD PRO B 544 0.512 21.635 14.980 1.00 0.00 C ATOM 0 HA PRO B 544 2.599 20.332 12.842 1.00 0.00 H new ATOM 0 HB2 PRO B 544 1.550 18.498 14.645 1.00 0.00 H new ATOM 0 HB3 PRO B 544 2.667 19.739 15.178 1.00 0.00 H new ATOM 0 HG2 PRO B 544 -0.340 19.696 15.352 1.00 0.00 H new ATOM 0 HG3 PRO B 544 0.824 20.207 16.557 1.00 0.00 H new ATOM 0 HD2 PRO B 544 -0.512 22.007 15.011 1.00 0.00 H new ATOM 0 HD3 PRO B 544 1.118 22.318 15.576 1.00 0.00 H new ATOM 353 N LEU B 545 1.389 18.299 11.882 1.00 0.00 N ATOM 354 CA LEU B 545 0.700 17.401 10.961 1.00 0.00 C ATOM 355 C LEU B 545 0.583 16.000 11.552 1.00 0.00 C ATOM 356 O LEU B 545 1.552 15.454 12.082 1.00 0.00 O ATOM 357 CB LEU B 545 1.441 17.343 9.624 1.00 0.00 C ATOM 358 CG LEU B 545 0.585 17.042 8.394 1.00 0.00 C ATOM 359 CD1 LEU B 545 -0.015 15.648 8.489 1.00 0.00 C ATOM 360 CD2 LEU B 545 -0.511 18.087 8.238 1.00 0.00 C ATOM 0 H LEU B 545 2.346 18.023 12.103 1.00 0.00 H new ATOM 0 HA LEU B 545 -0.305 17.791 10.796 1.00 0.00 H new ATOM 0 HB2 LEU B 545 1.942 18.298 9.468 1.00 0.00 H new ATOM 0 HB3 LEU B 545 2.219 16.583 9.695 1.00 0.00 H new ATOM 0 HG LEU B 545 1.224 17.080 7.512 1.00 0.00 H new ATOM 0 HD11 LEU B 545 -0.621 15.452 7.605 1.00 0.00 H new ATOM 0 HD12 LEU B 545 0.785 14.911 8.551 1.00 0.00 H new ATOM 0 HD13 LEU B 545 -0.640 15.581 9.379 1.00 0.00 H new ATOM 0 HD21 LEU B 545 -1.111 17.857 7.357 1.00 0.00 H new ATOM 0 HD22 LEU B 545 -1.148 18.081 9.122 1.00 0.00 H new ATOM 0 HD23 LEU B 545 -0.060 19.073 8.122 1.00 0.00 H new ATOM 372 N THR B 546 -0.610 15.420 11.455 1.00 0.00 N ATOM 373 CA THR B 546 -0.854 14.082 11.979 1.00 0.00 C ATOM 374 C THR B 546 -2.085 13.455 11.334 1.00 0.00 C ATOM 375 O THR B 546 -2.851 14.133 10.650 1.00 0.00 O ATOM 376 CB THR B 546 -1.043 14.103 13.507 1.00 0.00 C ATOM 377 OG1 THR B 546 -0.332 15.209 14.074 1.00 0.00 O ATOM 378 CG2 THR B 546 -0.552 12.805 14.131 1.00 0.00 C ATOM 0 H THR B 546 -1.422 15.856 11.018 1.00 0.00 H new ATOM 0 HA THR B 546 0.024 13.483 11.738 1.00 0.00 H new ATOM 0 HB THR B 546 -2.107 14.210 13.717 1.00 0.00 H new ATOM 0 HG1 THR B 546 -0.459 15.216 15.046 1.00 0.00 H new ATOM 0 HG21 THR B 546 -0.696 12.843 15.211 1.00 0.00 H new ATOM 0 HG22 THR B 546 -1.115 11.968 13.719 1.00 0.00 H new ATOM 0 HG23 THR B 546 0.507 12.673 13.910 1.00 0.00 H new ATOM 386 N ALA B 547 -2.268 12.158 11.557 1.00 0.00 N ATOM 387 CA ALA B 547 -3.408 11.441 11.000 1.00 0.00 C ATOM 388 C ALA B 547 -4.720 12.132 11.359 1.00 0.00 C ATOM 389 O ALA B 547 -5.704 12.035 10.626 1.00 0.00 O ATOM 390 CB ALA B 547 -3.417 10.001 11.491 1.00 0.00 C ATOM 0 H ALA B 547 -1.641 11.582 12.119 1.00 0.00 H new ATOM 0 HA ALA B 547 -3.311 11.443 9.914 1.00 0.00 H new ATOM 0 HB1 ALA B 547 -4.274 9.477 11.067 1.00 0.00 H new ATOM 0 HB2 ALA B 547 -2.498 9.505 11.179 1.00 0.00 H new ATOM 0 HB3 ALA B 547 -3.486 9.988 12.579 1.00 0.00 H new ATOM 396 N SER B 548 -4.727 12.827 12.492 1.00 0.00 N ATOM 397 CA SER B 548 -5.919 13.531 12.950 1.00 0.00 C ATOM 398 C SER B 548 -6.362 14.573 11.927 1.00 0.00 C ATOM 399 O SER B 548 -7.554 14.748 11.680 1.00 0.00 O ATOM 400 CB SER B 548 -5.654 14.203 14.298 1.00 0.00 C ATOM 401 OG SER B 548 -4.477 14.990 14.253 1.00 0.00 O ATOM 0 H SER B 548 -3.920 12.918 13.110 1.00 0.00 H new ATOM 0 HA SER B 548 -6.719 12.800 13.068 1.00 0.00 H new ATOM 0 HB2 SER B 548 -6.504 14.829 14.569 1.00 0.00 H new ATOM 0 HB3 SER B 548 -5.558 13.443 15.074 1.00 0.00 H new ATOM 0 HG SER B 548 -4.331 15.410 15.126 1.00 0.00 H new ATOM 407 N MET B 549 -5.391 15.263 11.337 1.00 0.00 N ATOM 408 CA MET B 549 -5.680 16.287 10.340 1.00 0.00 C ATOM 409 C MET B 549 -6.541 15.723 9.215 1.00 0.00 C ATOM 410 O MET B 549 -7.426 16.405 8.695 1.00 0.00 O ATOM 411 CB MET B 549 -4.379 16.853 9.768 1.00 0.00 C ATOM 412 CG MET B 549 -3.531 17.586 10.795 1.00 0.00 C ATOM 413 SD MET B 549 -4.114 19.263 11.108 1.00 0.00 S ATOM 414 CE MET B 549 -3.060 20.199 10.003 1.00 0.00 C ATOM 0 H MET B 549 -4.398 15.132 11.532 1.00 0.00 H new ATOM 0 HA MET B 549 -6.233 17.089 10.829 1.00 0.00 H new ATOM 0 HB2 MET B 549 -3.794 16.038 9.342 1.00 0.00 H new ATOM 0 HB3 MET B 549 -4.617 17.535 8.952 1.00 0.00 H new ATOM 0 HG2 MET B 549 -3.533 17.025 11.729 1.00 0.00 H new ATOM 0 HG3 MET B 549 -2.498 17.623 10.448 1.00 0.00 H new ATOM 0 HE1 MET B 549 -3.212 21.265 10.171 1.00 0.00 H new ATOM 0 HE2 MET B 549 -2.017 19.947 10.194 1.00 0.00 H new ATOM 0 HE3 MET B 549 -3.308 19.956 8.970 1.00 0.00 H new ATOM 424 N LEU B 550 -6.277 14.476 8.842 1.00 0.00 N ATOM 425 CA LEU B 550 -7.028 13.820 7.777 1.00 0.00 C ATOM 426 C LEU B 550 -8.158 12.971 8.351 1.00 0.00 C ATOM 427 O LEU B 550 -8.599 12.005 7.729 1.00 0.00 O ATOM 428 CB LEU B 550 -6.098 12.948 6.932 1.00 0.00 C ATOM 429 CG LEU B 550 -5.303 13.673 5.845 1.00 0.00 C ATOM 430 CD1 LEU B 550 -4.196 14.513 6.463 1.00 0.00 C ATOM 431 CD2 LEU B 550 -4.726 12.674 4.852 1.00 0.00 C ATOM 0 H LEU B 550 -5.548 13.898 9.261 1.00 0.00 H new ATOM 0 HA LEU B 550 -7.464 14.593 7.145 1.00 0.00 H new ATOM 0 HB2 LEU B 550 -5.394 12.451 7.599 1.00 0.00 H new ATOM 0 HB3 LEU B 550 -6.694 12.168 6.459 1.00 0.00 H new ATOM 0 HG LEU B 550 -5.980 14.339 5.310 1.00 0.00 H new ATOM 0 HD11 LEU B 550 -3.641 15.021 5.674 1.00 0.00 H new ATOM 0 HD12 LEU B 550 -4.632 15.253 7.134 1.00 0.00 H new ATOM 0 HD13 LEU B 550 -3.520 13.868 7.024 1.00 0.00 H new ATOM 0 HD21 LEU B 550 -4.163 13.207 4.085 1.00 0.00 H new ATOM 0 HD22 LEU B 550 -4.064 11.983 5.374 1.00 0.00 H new ATOM 0 HD23 LEU B 550 -5.537 12.116 4.385 1.00 0.00 H new ATOM 443 N ALA B 551 -8.623 13.340 9.540 1.00 0.00 N ATOM 444 CA ALA B 551 -9.704 12.615 10.195 1.00 0.00 C ATOM 445 C ALA B 551 -11.018 13.383 10.098 1.00 0.00 C ATOM 446 O ALA B 551 -12.080 12.792 9.901 1.00 0.00 O ATOM 447 CB ALA B 551 -9.354 12.347 11.651 1.00 0.00 C ATOM 0 H ALA B 551 -8.268 14.137 10.069 1.00 0.00 H new ATOM 0 HA ALA B 551 -9.831 11.662 9.682 1.00 0.00 H new ATOM 0 HB1 ALA B 551 -10.171 11.805 12.128 1.00 0.00 H new ATOM 0 HB2 ALA B 551 -8.443 11.750 11.702 1.00 0.00 H new ATOM 0 HB3 ALA B 551 -9.197 13.294 12.168 1.00 0.00 H new ATOM 453 N SER B 552 -10.939 14.702 10.239 1.00 0.00 N ATOM 454 CA SER B 552 -12.123 15.550 10.172 1.00 0.00 C ATOM 455 C SER B 552 -12.131 16.372 8.887 1.00 0.00 C ATOM 456 O SER B 552 -12.697 17.463 8.838 1.00 0.00 O ATOM 457 CB SER B 552 -12.180 16.480 11.386 1.00 0.00 C ATOM 458 OG SER B 552 -11.171 17.473 11.315 1.00 0.00 O ATOM 0 H SER B 552 -10.067 15.207 10.400 1.00 0.00 H new ATOM 0 HA SER B 552 -13.002 14.905 10.176 1.00 0.00 H new ATOM 0 HB2 SER B 552 -13.160 16.955 11.438 1.00 0.00 H new ATOM 0 HB3 SER B 552 -12.059 15.898 12.300 1.00 0.00 H new ATOM 0 HG SER B 552 -11.229 18.056 12.101 1.00 0.00 H new ATOM 464 N ALA B 553 -11.497 15.839 7.847 1.00 0.00 N ATOM 465 CA ALA B 553 -11.431 16.520 6.561 1.00 0.00 C ATOM 466 C ALA B 553 -11.935 15.622 5.437 1.00 0.00 C ATOM 467 O ALA B 553 -11.994 14.399 5.567 1.00 0.00 O ATOM 468 CB ALA B 553 -10.008 16.976 6.277 1.00 0.00 C ATOM 0 H ALA B 553 -11.022 14.937 7.871 1.00 0.00 H new ATOM 0 HA ALA B 553 -12.078 17.396 6.609 1.00 0.00 H new ATOM 0 HB1 ALA B 553 -9.974 17.483 5.313 1.00 0.00 H new ATOM 0 HB2 ALA B 553 -9.683 17.662 7.059 1.00 0.00 H new ATOM 0 HB3 ALA B 553 -9.346 16.110 6.255 1.00 0.00 H new ATOM 474 N PRO B 554 -12.309 16.239 4.306 1.00 0.00 N ATOM 475 CA PRO B 554 -12.815 15.513 3.138 1.00 0.00 C ATOM 476 C PRO B 554 -11.729 14.696 2.448 1.00 0.00 C ATOM 477 O PRO B 554 -10.538 14.845 2.722 1.00 0.00 O ATOM 478 CB PRO B 554 -13.313 16.629 2.215 1.00 0.00 C ATOM 479 CG PRO B 554 -12.516 17.826 2.605 1.00 0.00 C ATOM 480 CD PRO B 554 -12.266 17.694 4.082 1.00 0.00 C ATOM 0 HA PRO B 554 -13.585 14.790 3.409 1.00 0.00 H new ATOM 0 HB2 PRO B 554 -13.158 16.374 1.167 1.00 0.00 H new ATOM 0 HB3 PRO B 554 -14.381 16.804 2.346 1.00 0.00 H new ATOM 0 HG2 PRO B 554 -11.577 17.867 2.052 1.00 0.00 H new ATOM 0 HG3 PRO B 554 -13.058 18.745 2.382 1.00 0.00 H new ATOM 0 HD2 PRO B 554 -11.302 18.116 4.366 1.00 0.00 H new ATOM 0 HD3 PRO B 554 -13.026 18.213 4.666 1.00 0.00 H new ATOM 488 N PRO B 555 -12.145 13.812 1.529 1.00 0.00 N ATOM 489 CA PRO B 555 -11.223 12.954 0.780 1.00 0.00 C ATOM 490 C PRO B 555 -10.380 13.741 -0.218 1.00 0.00 C ATOM 491 O PRO B 555 -9.447 13.205 -0.814 1.00 0.00 O ATOM 492 CB PRO B 555 -12.154 11.986 0.047 1.00 0.00 C ATOM 493 CG PRO B 555 -13.443 12.722 -0.078 1.00 0.00 C ATOM 494 CD PRO B 555 -13.550 13.582 1.151 1.00 0.00 C ATOM 0 HA PRO B 555 -10.503 12.461 1.434 1.00 0.00 H new ATOM 0 HB2 PRO B 555 -11.755 11.717 -0.931 1.00 0.00 H new ATOM 0 HB3 PRO B 555 -12.280 11.059 0.606 1.00 0.00 H new ATOM 0 HG2 PRO B 555 -13.459 13.330 -0.982 1.00 0.00 H new ATOM 0 HG3 PRO B 555 -14.283 12.030 -0.144 1.00 0.00 H new ATOM 0 HD2 PRO B 555 -14.069 14.518 0.943 1.00 0.00 H new ATOM 0 HD3 PRO B 555 -14.103 13.081 1.945 1.00 0.00 H new ATOM 502 N GLN B 556 -10.716 15.015 -0.393 1.00 0.00 N ATOM 503 CA GLN B 556 -9.989 15.876 -1.320 1.00 0.00 C ATOM 504 C GLN B 556 -8.944 16.708 -0.584 1.00 0.00 C ATOM 505 O GLN B 556 -7.830 16.894 -1.073 1.00 0.00 O ATOM 506 CB GLN B 556 -10.960 16.795 -2.062 1.00 0.00 C ATOM 507 CG GLN B 556 -10.378 17.397 -3.331 1.00 0.00 C ATOM 508 CD GLN B 556 -11.439 17.989 -4.237 1.00 0.00 C ATOM 509 OE1 GLN B 556 -12.400 18.600 -3.769 1.00 0.00 O ATOM 510 NE2 GLN B 556 -11.271 17.811 -5.542 1.00 0.00 N ATOM 0 H GLN B 556 -11.486 15.474 0.094 1.00 0.00 H new ATOM 0 HA GLN B 556 -9.477 15.240 -2.043 1.00 0.00 H new ATOM 0 HB2 GLN B 556 -11.858 16.232 -2.316 1.00 0.00 H new ATOM 0 HB3 GLN B 556 -11.266 17.601 -1.395 1.00 0.00 H new ATOM 0 HG2 GLN B 556 -9.660 18.172 -3.064 1.00 0.00 H new ATOM 0 HG3 GLN B 556 -9.829 16.628 -3.875 1.00 0.00 H new ATOM 0 HE21 GLN B 556 -10.459 17.298 -5.886 1.00 0.00 H new ATOM 0 HE22 GLN B 556 -11.953 18.187 -6.200 1.00 0.00 H new ATOM 519 N GLU B 557 -9.311 17.205 0.593 1.00 0.00 N ATOM 520 CA GLU B 557 -8.404 18.018 1.394 1.00 0.00 C ATOM 521 C GLU B 557 -7.217 17.192 1.879 1.00 0.00 C ATOM 522 O GLU B 557 -6.170 17.736 2.226 1.00 0.00 O ATOM 523 CB GLU B 557 -9.145 18.618 2.592 1.00 0.00 C ATOM 524 CG GLU B 557 -9.954 19.857 2.248 1.00 0.00 C ATOM 525 CD GLU B 557 -9.120 21.124 2.274 1.00 0.00 C ATOM 526 OE1 GLU B 557 -7.876 21.014 2.296 1.00 0.00 O ATOM 527 OE2 GLU B 557 -9.711 22.224 2.274 1.00 0.00 O ATOM 0 H GLU B 557 -10.229 17.059 1.012 1.00 0.00 H new ATOM 0 HA GLU B 557 -8.030 18.826 0.765 1.00 0.00 H new ATOM 0 HB2 GLU B 557 -9.811 17.864 3.011 1.00 0.00 H new ATOM 0 HB3 GLU B 557 -8.421 18.870 3.367 1.00 0.00 H new ATOM 0 HG2 GLU B 557 -10.394 19.736 1.258 1.00 0.00 H new ATOM 0 HG3 GLU B 557 -10.779 19.955 2.953 1.00 0.00 H new ATOM 534 N GLN B 558 -7.390 15.874 1.900 1.00 0.00 N ATOM 535 CA GLN B 558 -6.333 14.972 2.343 1.00 0.00 C ATOM 536 C GLN B 558 -5.070 15.163 1.510 1.00 0.00 C ATOM 537 O GLN B 558 -4.029 15.571 2.025 1.00 0.00 O ATOM 538 CB GLN B 558 -6.802 13.519 2.253 1.00 0.00 C ATOM 539 CG GLN B 558 -8.043 13.229 3.081 1.00 0.00 C ATOM 540 CD GLN B 558 -7.935 11.934 3.862 1.00 0.00 C ATOM 541 OE1 GLN B 558 -7.226 11.010 3.459 1.00 0.00 O ATOM 542 NE2 GLN B 558 -8.638 11.858 4.986 1.00 0.00 N ATOM 0 H GLN B 558 -8.251 15.407 1.616 1.00 0.00 H new ATOM 0 HA GLN B 558 -6.101 15.208 3.382 1.00 0.00 H new ATOM 0 HB2 GLN B 558 -7.006 13.275 1.210 1.00 0.00 H new ATOM 0 HB3 GLN B 558 -5.995 12.864 2.581 1.00 0.00 H new ATOM 0 HG2 GLN B 558 -8.214 14.053 3.774 1.00 0.00 H new ATOM 0 HG3 GLN B 558 -8.911 13.181 2.423 1.00 0.00 H new ATOM 0 HE21 GLN B 558 -9.212 12.647 5.283 1.00 0.00 H new ATOM 0 HE22 GLN B 558 -8.604 11.011 5.553 1.00 0.00 H new ATOM 551 N LYS B 559 -5.167 14.864 0.219 1.00 0.00 N ATOM 552 CA LYS B 559 -4.034 15.003 -0.687 1.00 0.00 C ATOM 553 C LYS B 559 -3.415 16.393 -0.575 1.00 0.00 C ATOM 554 O LYS B 559 -2.202 16.554 -0.709 1.00 0.00 O ATOM 555 CB LYS B 559 -4.473 14.744 -2.130 1.00 0.00 C ATOM 556 CG LYS B 559 -5.736 15.488 -2.525 1.00 0.00 C ATOM 557 CD LYS B 559 -6.119 15.211 -3.969 1.00 0.00 C ATOM 558 CE LYS B 559 -6.379 13.731 -4.203 1.00 0.00 C ATOM 559 NZ LYS B 559 -7.065 13.487 -5.502 1.00 0.00 N ATOM 0 H LYS B 559 -6.020 14.523 -0.224 1.00 0.00 H new ATOM 0 HA LYS B 559 -3.283 14.266 -0.404 1.00 0.00 H new ATOM 0 HB2 LYS B 559 -3.666 15.032 -2.804 1.00 0.00 H new ATOM 0 HB3 LYS B 559 -4.634 13.675 -2.265 1.00 0.00 H new ATOM 0 HG2 LYS B 559 -6.554 15.192 -1.868 1.00 0.00 H new ATOM 0 HG3 LYS B 559 -5.587 16.559 -2.386 1.00 0.00 H new ATOM 0 HD2 LYS B 559 -7.010 15.783 -4.226 1.00 0.00 H new ATOM 0 HD3 LYS B 559 -5.321 15.550 -4.630 1.00 0.00 H new ATOM 0 HE2 LYS B 559 -5.434 13.189 -4.184 1.00 0.00 H new ATOM 0 HE3 LYS B 559 -6.989 13.337 -3.390 1.00 0.00 H new ATOM 0 HZ1 LYS B 559 -7.224 12.467 -5.624 1.00 0.00 H new ATOM 0 HZ2 LYS B 559 -7.979 13.984 -5.511 1.00 0.00 H new ATOM 0 HZ3 LYS B 559 -6.472 13.840 -6.280 1.00 0.00 H new ATOM 573 N GLN B 560 -4.256 17.392 -0.328 1.00 0.00 N ATOM 574 CA GLN B 560 -3.790 18.768 -0.197 1.00 0.00 C ATOM 575 C GLN B 560 -2.833 18.908 0.982 1.00 0.00 C ATOM 576 O GLN B 560 -1.629 19.089 0.798 1.00 0.00 O ATOM 577 CB GLN B 560 -4.977 19.716 -0.022 1.00 0.00 C ATOM 578 CG GLN B 560 -4.585 21.185 -0.004 1.00 0.00 C ATOM 579 CD GLN B 560 -5.745 22.102 -0.338 1.00 0.00 C ATOM 580 OE1 GLN B 560 -6.250 22.822 0.524 1.00 0.00 O ATOM 581 NE2 GLN B 560 -6.173 22.082 -1.595 1.00 0.00 N ATOM 0 H GLN B 560 -5.263 17.275 -0.215 1.00 0.00 H new ATOM 0 HA GLN B 560 -3.255 19.033 -1.109 1.00 0.00 H new ATOM 0 HB2 GLN B 560 -5.688 19.548 -0.831 1.00 0.00 H new ATOM 0 HB3 GLN B 560 -5.490 19.474 0.909 1.00 0.00 H new ATOM 0 HG2 GLN B 560 -4.196 21.441 0.981 1.00 0.00 H new ATOM 0 HG3 GLN B 560 -3.778 21.351 -0.718 1.00 0.00 H new ATOM 0 HE21 GLN B 560 -5.725 21.470 -2.277 1.00 0.00 H new ATOM 0 HE22 GLN B 560 -6.950 22.679 -1.879 1.00 0.00 H new ATOM 590 N MET B 561 -3.376 18.825 2.192 1.00 0.00 N ATOM 591 CA MET B 561 -2.569 18.942 3.401 1.00 0.00 C ATOM 592 C MET B 561 -1.472 17.883 3.427 1.00 0.00 C ATOM 593 O MET B 561 -0.288 18.204 3.545 1.00 0.00 O ATOM 594 CB MET B 561 -3.452 18.810 4.643 1.00 0.00 C ATOM 595 CG MET B 561 -4.620 19.782 4.665 1.00 0.00 C ATOM 596 SD MET B 561 -5.859 19.352 5.903 1.00 0.00 S ATOM 597 CE MET B 561 -6.464 17.798 5.250 1.00 0.00 C ATOM 0 H MET B 561 -4.371 18.677 2.361 1.00 0.00 H new ATOM 0 HA MET B 561 -2.099 19.926 3.401 1.00 0.00 H new ATOM 0 HB2 MET B 561 -3.837 17.792 4.699 1.00 0.00 H new ATOM 0 HB3 MET B 561 -2.841 18.969 5.532 1.00 0.00 H new ATOM 0 HG2 MET B 561 -4.248 20.787 4.863 1.00 0.00 H new ATOM 0 HG3 MET B 561 -5.088 19.804 3.681 1.00 0.00 H new ATOM 0 HE1 MET B 561 -7.510 17.907 4.962 1.00 0.00 H new ATOM 0 HE2 MET B 561 -5.875 17.516 4.377 1.00 0.00 H new ATOM 0 HE3 MET B 561 -6.376 17.024 6.012 1.00 0.00 H new ATOM 607 N LEU B 562 -1.871 16.621 3.318 1.00 0.00 N ATOM 608 CA LEU B 562 -0.921 15.514 3.329 1.00 0.00 C ATOM 609 C LEU B 562 0.206 15.754 2.330 1.00 0.00 C ATOM 610 O LEU B 562 1.376 15.823 2.703 1.00 0.00 O ATOM 611 CB LEU B 562 -1.635 14.200 3.005 1.00 0.00 C ATOM 612 CG LEU B 562 -0.765 12.943 3.021 1.00 0.00 C ATOM 613 CD1 LEU B 562 -1.565 11.747 3.513 1.00 0.00 C ATOM 614 CD2 LEU B 562 -0.194 12.672 1.636 1.00 0.00 C ATOM 0 H LEU B 562 -2.846 16.338 3.221 1.00 0.00 H new ATOM 0 HA LEU B 562 -0.488 15.448 4.327 1.00 0.00 H new ATOM 0 HB2 LEU B 562 -2.447 14.065 3.720 1.00 0.00 H new ATOM 0 HB3 LEU B 562 -2.090 14.290 2.019 1.00 0.00 H new ATOM 0 HG LEU B 562 0.065 13.107 3.709 1.00 0.00 H new ATOM 0 HD11 LEU B 562 -0.930 10.861 3.518 1.00 0.00 H new ATOM 0 HD12 LEU B 562 -1.925 11.941 4.523 1.00 0.00 H new ATOM 0 HD13 LEU B 562 -2.415 11.580 2.851 1.00 0.00 H new ATOM 0 HD21 LEU B 562 0.423 11.774 1.666 1.00 0.00 H new ATOM 0 HD22 LEU B 562 -1.010 12.528 0.928 1.00 0.00 H new ATOM 0 HD23 LEU B 562 0.415 13.520 1.321 1.00 0.00 H new ATOM 626 N GLY B 563 -0.155 15.881 1.056 1.00 0.00 N ATOM 627 CA GLY B 563 0.837 16.114 0.023 1.00 0.00 C ATOM 628 C GLY B 563 1.673 17.350 0.290 1.00 0.00 C ATOM 629 O GLY B 563 2.880 17.352 0.054 1.00 0.00 O ATOM 0 H GLY B 563 -1.117 15.827 0.721 1.00 0.00 H new ATOM 0 HA2 GLY B 563 1.491 15.245 -0.050 1.00 0.00 H new ATOM 0 HA3 GLY B 563 0.337 16.219 -0.940 1.00 0.00 H new ATOM 633 N GLU B 564 1.029 18.403 0.783 1.00 0.00 N ATOM 634 CA GLU B 564 1.722 19.651 1.079 1.00 0.00 C ATOM 635 C GLU B 564 2.846 19.424 2.086 1.00 0.00 C ATOM 636 O GLU B 564 3.971 19.884 1.891 1.00 0.00 O ATOM 637 CB GLU B 564 0.739 20.690 1.622 1.00 0.00 C ATOM 638 CG GLU B 564 0.005 21.460 0.537 1.00 0.00 C ATOM 639 CD GLU B 564 -1.331 22.002 1.007 1.00 0.00 C ATOM 640 OE1 GLU B 564 -1.653 21.828 2.201 1.00 0.00 O ATOM 641 OE2 GLU B 564 -2.053 22.599 0.182 1.00 0.00 O ATOM 0 H GLU B 564 0.029 18.417 0.986 1.00 0.00 H new ATOM 0 HA GLU B 564 2.158 20.023 0.152 1.00 0.00 H new ATOM 0 HB2 GLU B 564 0.009 20.189 2.258 1.00 0.00 H new ATOM 0 HB3 GLU B 564 1.280 21.395 2.253 1.00 0.00 H new ATOM 0 HG2 GLU B 564 0.629 22.287 0.198 1.00 0.00 H new ATOM 0 HG3 GLU B 564 -0.154 20.808 -0.322 1.00 0.00 H new ATOM 648 N ARG B 565 2.532 18.711 3.163 1.00 0.00 N ATOM 649 CA ARG B 565 3.514 18.424 4.202 1.00 0.00 C ATOM 650 C ARG B 565 4.499 17.355 3.738 1.00 0.00 C ATOM 651 O ARG B 565 5.634 17.293 4.213 1.00 0.00 O ATOM 652 CB ARG B 565 2.814 17.966 5.482 1.00 0.00 C ATOM 653 CG ARG B 565 3.571 18.323 6.751 1.00 0.00 C ATOM 654 CD ARG B 565 3.103 19.652 7.323 1.00 0.00 C ATOM 655 NE ARG B 565 3.998 20.748 6.963 1.00 0.00 N ATOM 656 CZ ARG B 565 3.668 22.031 7.065 1.00 0.00 C ATOM 657 NH1 ARG B 565 2.469 22.376 7.515 1.00 0.00 N ATOM 658 NH2 ARG B 565 4.537 22.971 6.717 1.00 0.00 N ATOM 0 H ARG B 565 1.606 18.322 3.339 1.00 0.00 H new ATOM 0 HA ARG B 565 4.068 19.340 4.407 1.00 0.00 H new ATOM 0 HB2 ARG B 565 1.821 18.414 5.523 1.00 0.00 H new ATOM 0 HB3 ARG B 565 2.675 16.886 5.444 1.00 0.00 H new ATOM 0 HG2 ARG B 565 3.431 17.537 7.493 1.00 0.00 H new ATOM 0 HG3 ARG B 565 4.639 18.373 6.537 1.00 0.00 H new ATOM 0 HD2 ARG B 565 2.099 19.870 6.959 1.00 0.00 H new ATOM 0 HD3 ARG B 565 3.040 19.577 8.409 1.00 0.00 H new ATOM 0 HE ARG B 565 4.928 20.516 6.614 1.00 0.00 H new ATOM 0 HH11 ARG B 565 1.798 21.656 7.784 1.00 0.00 H new ATOM 0 HH12 ARG B 565 2.218 23.361 7.593 1.00 0.00 H new ATOM 0 HH21 ARG B 565 5.460 22.709 6.371 1.00 0.00 H new ATOM 0 HH22 ARG B 565 4.282 23.956 6.796 1.00 0.00 H new ATOM 672 N LEU B 566 4.058 16.515 2.807 1.00 0.00 N ATOM 673 CA LEU B 566 4.901 15.448 2.279 1.00 0.00 C ATOM 674 C LEU B 566 5.934 16.002 1.304 1.00 0.00 C ATOM 675 O LEU B 566 7.007 15.426 1.126 1.00 0.00 O ATOM 676 CB LEU B 566 4.042 14.391 1.583 1.00 0.00 C ATOM 677 CG LEU B 566 3.926 13.044 2.297 1.00 0.00 C ATOM 678 CD1 LEU B 566 2.871 13.108 3.390 1.00 0.00 C ATOM 679 CD2 LEU B 566 3.599 11.939 1.302 1.00 0.00 C ATOM 0 H LEU B 566 3.122 16.552 2.403 1.00 0.00 H new ATOM 0 HA LEU B 566 5.428 14.987 3.115 1.00 0.00 H new ATOM 0 HB2 LEU B 566 3.039 14.797 1.450 1.00 0.00 H new ATOM 0 HB3 LEU B 566 4.450 14.218 0.587 1.00 0.00 H new ATOM 0 HG LEU B 566 4.886 12.817 2.760 1.00 0.00 H new ATOM 0 HD11 LEU B 566 2.803 12.140 3.887 1.00 0.00 H new ATOM 0 HD12 LEU B 566 3.147 13.871 4.118 1.00 0.00 H new ATOM 0 HD13 LEU B 566 1.906 13.359 2.950 1.00 0.00 H new ATOM 0 HD21 LEU B 566 3.520 10.987 1.828 1.00 0.00 H new ATOM 0 HD22 LEU B 566 2.652 12.161 0.810 1.00 0.00 H new ATOM 0 HD23 LEU B 566 4.390 11.876 0.555 1.00 0.00 H new ATOM 691 N PHE B 567 5.604 17.126 0.675 1.00 0.00 N ATOM 692 CA PHE B 567 6.505 17.759 -0.281 1.00 0.00 C ATOM 693 C PHE B 567 7.904 17.913 0.308 1.00 0.00 C ATOM 694 O PHE B 567 8.891 17.416 -0.234 1.00 0.00 O ATOM 695 CB PHE B 567 5.961 19.128 -0.696 1.00 0.00 C ATOM 696 CG PHE B 567 5.888 19.319 -2.184 1.00 0.00 C ATOM 697 CD1 PHE B 567 7.031 19.234 -2.963 1.00 0.00 C ATOM 698 CD2 PHE B 567 4.677 19.581 -2.804 1.00 0.00 C ATOM 699 CE1 PHE B 567 6.967 19.410 -4.332 1.00 0.00 C ATOM 700 CE2 PHE B 567 4.607 19.757 -4.173 1.00 0.00 C ATOM 701 CZ PHE B 567 5.753 19.670 -4.938 1.00 0.00 C ATOM 0 H PHE B 567 4.720 17.616 0.810 1.00 0.00 H new ATOM 0 HA PHE B 567 6.569 17.118 -1.160 1.00 0.00 H new ATOM 0 HB2 PHE B 567 4.965 19.258 -0.272 1.00 0.00 H new ATOM 0 HB3 PHE B 567 6.594 19.906 -0.269 1.00 0.00 H new ATOM 0 HD1 PHE B 567 7.982 19.028 -2.495 1.00 0.00 H new ATOM 0 HD2 PHE B 567 3.777 19.648 -2.211 1.00 0.00 H new ATOM 0 HE1 PHE B 567 7.865 19.344 -4.928 1.00 0.00 H new ATOM 0 HE2 PHE B 567 3.657 19.962 -4.644 1.00 0.00 H new ATOM 0 HZ PHE B 567 5.701 19.805 -6.008 1.00 0.00 H new ATOM 711 N PRO B 568 7.992 18.618 1.446 1.00 0.00 N ATOM 712 CA PRO B 568 9.265 18.853 2.134 1.00 0.00 C ATOM 713 C PRO B 568 9.828 17.583 2.762 1.00 0.00 C ATOM 714 O PRO B 568 11.039 17.356 2.750 1.00 0.00 O ATOM 715 CB PRO B 568 8.898 19.869 3.219 1.00 0.00 C ATOM 716 CG PRO B 568 7.446 19.649 3.469 1.00 0.00 C ATOM 717 CD PRO B 568 6.856 19.238 2.148 1.00 0.00 C ATOM 0 HA PRO B 568 10.040 19.199 1.450 1.00 0.00 H new ATOM 0 HB2 PRO B 568 9.484 19.710 4.124 1.00 0.00 H new ATOM 0 HB3 PRO B 568 9.093 20.889 2.888 1.00 0.00 H new ATOM 0 HG2 PRO B 568 7.292 18.876 4.222 1.00 0.00 H new ATOM 0 HG3 PRO B 568 6.972 20.557 3.842 1.00 0.00 H new ATOM 0 HD2 PRO B 568 6.032 18.536 2.277 1.00 0.00 H new ATOM 0 HD3 PRO B 568 6.463 20.094 1.599 1.00 0.00 H new ATOM 725 N LEU B 569 8.944 16.758 3.311 1.00 0.00 N ATOM 726 CA LEU B 569 9.353 15.509 3.944 1.00 0.00 C ATOM 727 C LEU B 569 10.179 14.657 2.985 1.00 0.00 C ATOM 728 O LEU B 569 11.148 14.013 3.389 1.00 0.00 O ATOM 729 CB LEU B 569 8.126 14.725 4.412 1.00 0.00 C ATOM 730 CG LEU B 569 8.356 13.738 5.557 1.00 0.00 C ATOM 731 CD1 LEU B 569 9.288 12.619 5.118 1.00 0.00 C ATOM 732 CD2 LEU B 569 8.918 14.456 6.775 1.00 0.00 C ATOM 0 H LEU B 569 7.939 16.931 3.331 1.00 0.00 H new ATOM 0 HA LEU B 569 9.971 15.754 4.808 1.00 0.00 H new ATOM 0 HB2 LEU B 569 7.361 15.437 4.721 1.00 0.00 H new ATOM 0 HB3 LEU B 569 7.724 14.176 3.561 1.00 0.00 H new ATOM 0 HG LEU B 569 7.397 13.298 5.830 1.00 0.00 H new ATOM 0 HD11 LEU B 569 9.440 11.926 5.946 1.00 0.00 H new ATOM 0 HD12 LEU B 569 8.846 12.087 4.276 1.00 0.00 H new ATOM 0 HD13 LEU B 569 10.247 13.041 4.817 1.00 0.00 H new ATOM 0 HD21 LEU B 569 9.075 13.738 7.580 1.00 0.00 H new ATOM 0 HD22 LEU B 569 9.868 14.924 6.515 1.00 0.00 H new ATOM 0 HD23 LEU B 569 8.214 15.221 7.103 1.00 0.00 H new ATOM 744 N ILE B 570 9.791 14.661 1.714 1.00 0.00 N ATOM 745 CA ILE B 570 10.497 13.892 0.698 1.00 0.00 C ATOM 746 C ILE B 570 11.813 14.562 0.318 1.00 0.00 C ATOM 747 O ILE B 570 12.796 13.889 0.009 1.00 0.00 O ATOM 748 CB ILE B 570 9.640 13.713 -0.569 1.00 0.00 C ATOM 749 CG1 ILE B 570 8.448 12.799 -0.280 1.00 0.00 C ATOM 750 CG2 ILE B 570 10.484 13.149 -1.703 1.00 0.00 C ATOM 751 CD1 ILE B 570 7.335 12.917 -1.298 1.00 0.00 C ATOM 0 H ILE B 570 8.991 15.189 1.364 1.00 0.00 H new ATOM 0 HA ILE B 570 10.702 12.912 1.129 1.00 0.00 H new ATOM 0 HB ILE B 570 9.260 14.688 -0.874 1.00 0.00 H new ATOM 0 HG12 ILE B 570 8.792 11.765 -0.248 1.00 0.00 H new ATOM 0 HG13 ILE B 570 8.052 13.033 0.708 1.00 0.00 H new ATOM 0 HG21 ILE B 570 9.865 13.028 -2.592 1.00 0.00 H new ATOM 0 HG22 ILE B 570 11.303 13.834 -1.922 1.00 0.00 H new ATOM 0 HG23 ILE B 570 10.889 12.181 -1.408 1.00 0.00 H new ATOM 0 HD11 ILE B 570 6.523 12.241 -1.030 1.00 0.00 H new ATOM 0 HD12 ILE B 570 6.963 13.942 -1.314 1.00 0.00 H new ATOM 0 HD13 ILE B 570 7.715 12.654 -2.285 1.00 0.00 H new ATOM 763 N GLN B 571 11.824 15.890 0.344 1.00 0.00 N ATOM 764 CA GLN B 571 13.020 16.651 0.003 1.00 0.00 C ATOM 765 C GLN B 571 14.180 16.282 0.922 1.00 0.00 C ATOM 766 O GLN B 571 15.343 16.520 0.596 1.00 0.00 O ATOM 767 CB GLN B 571 12.739 18.152 0.094 1.00 0.00 C ATOM 768 CG GLN B 571 11.748 18.650 -0.945 1.00 0.00 C ATOM 769 CD GLN B 571 11.175 20.010 -0.601 1.00 0.00 C ATOM 770 OE1 GLN B 571 9.966 20.228 -0.689 1.00 0.00 O ATOM 771 NE2 GLN B 571 12.042 20.935 -0.206 1.00 0.00 N ATOM 0 H GLN B 571 11.018 16.462 0.598 1.00 0.00 H new ATOM 0 HA GLN B 571 13.298 16.403 -1.021 1.00 0.00 H new ATOM 0 HB2 GLN B 571 12.356 18.382 1.088 1.00 0.00 H new ATOM 0 HB3 GLN B 571 13.677 18.696 -0.020 1.00 0.00 H new ATOM 0 HG2 GLN B 571 12.241 18.703 -1.916 1.00 0.00 H new ATOM 0 HG3 GLN B 571 10.934 17.931 -1.040 1.00 0.00 H new ATOM 0 HE21 GLN B 571 13.035 20.711 -0.147 1.00 0.00 H new ATOM 0 HE22 GLN B 571 11.715 21.869 0.039 1.00 0.00 H new ATOM 780 N ALA B 572 13.856 15.701 2.072 1.00 0.00 N ATOM 781 CA ALA B 572 14.871 15.298 3.038 1.00 0.00 C ATOM 782 C ALA B 572 15.925 14.409 2.387 1.00 0.00 C ATOM 783 O ALA B 572 17.077 14.377 2.819 1.00 0.00 O ATOM 784 CB ALA B 572 14.225 14.580 4.214 1.00 0.00 C ATOM 0 H ALA B 572 12.898 15.499 2.358 1.00 0.00 H new ATOM 0 HA ALA B 572 15.367 16.197 3.404 1.00 0.00 H new ATOM 0 HB1 ALA B 572 14.995 14.285 4.927 1.00 0.00 H new ATOM 0 HB2 ALA B 572 13.515 15.247 4.702 1.00 0.00 H new ATOM 0 HB3 ALA B 572 13.702 13.693 3.856 1.00 0.00 H new ATOM 790 N MET B 573 15.523 13.687 1.346 1.00 0.00 N ATOM 791 CA MET B 573 16.434 12.798 0.635 1.00 0.00 C ATOM 792 C MET B 573 16.470 13.131 -0.853 1.00 0.00 C ATOM 793 O MET B 573 17.525 13.078 -1.486 1.00 0.00 O ATOM 794 CB MET B 573 16.015 11.340 0.833 1.00 0.00 C ATOM 795 CG MET B 573 14.568 11.067 0.457 1.00 0.00 C ATOM 796 SD MET B 573 13.690 10.118 1.714 1.00 0.00 S ATOM 797 CE MET B 573 12.429 11.291 2.205 1.00 0.00 C ATOM 0 H MET B 573 14.572 13.700 0.976 1.00 0.00 H new ATOM 0 HA MET B 573 17.434 12.941 1.045 1.00 0.00 H new ATOM 0 HB2 MET B 573 16.664 10.700 0.236 1.00 0.00 H new ATOM 0 HB3 MET B 573 16.169 11.065 1.876 1.00 0.00 H new ATOM 0 HG2 MET B 573 14.053 12.014 0.297 1.00 0.00 H new ATOM 0 HG3 MET B 573 14.538 10.525 -0.488 1.00 0.00 H new ATOM 0 HE1 MET B 573 12.429 11.392 3.290 1.00 0.00 H new ATOM 0 HE2 MET B 573 12.637 12.260 1.751 1.00 0.00 H new ATOM 0 HE3 MET B 573 11.453 10.936 1.873 1.00 0.00 H new ATOM 807 N HIS B 574 15.311 13.475 -1.406 1.00 0.00 N ATOM 808 CA HIS B 574 15.211 13.817 -2.820 1.00 0.00 C ATOM 809 C HIS B 574 14.575 15.193 -3.002 1.00 0.00 C ATOM 810 O HIS B 574 13.423 15.321 -3.416 1.00 0.00 O ATOM 811 CB HIS B 574 14.393 12.762 -3.565 1.00 0.00 C ATOM 812 CG HIS B 574 15.212 11.612 -4.064 1.00 0.00 C ATOM 813 ND1 HIS B 574 15.475 10.491 -3.306 1.00 0.00 N ATOM 814 CD2 HIS B 574 15.826 11.412 -5.254 1.00 0.00 C ATOM 815 CE1 HIS B 574 16.217 9.652 -4.007 1.00 0.00 C ATOM 816 NE2 HIS B 574 16.443 10.188 -5.193 1.00 0.00 N ATOM 0 H HIS B 574 14.429 13.524 -0.897 1.00 0.00 H new ATOM 0 HA HIS B 574 16.219 13.844 -3.234 1.00 0.00 H new ATOM 0 HB2 HIS B 574 13.615 12.383 -2.903 1.00 0.00 H new ATOM 0 HB3 HIS B 574 13.891 13.233 -4.410 1.00 0.00 H new ATOM 0 HD2 HIS B 574 15.829 12.090 -6.095 1.00 0.00 H new ATOM 0 HE1 HIS B 574 16.577 8.692 -3.668 1.00 0.00 H new ATOM 0 HE2 HIS B 574 16.988 9.761 -5.942 1.00 0.00 H new ATOM 824 N PRO B 575 15.343 16.246 -2.685 1.00 0.00 N ATOM 825 CA PRO B 575 14.875 17.630 -2.805 1.00 0.00 C ATOM 826 C PRO B 575 14.712 18.063 -4.258 1.00 0.00 C ATOM 827 O PRO B 575 14.197 19.145 -4.541 1.00 0.00 O ATOM 828 CB PRO B 575 15.985 18.439 -2.128 1.00 0.00 C ATOM 829 CG PRO B 575 17.203 17.591 -2.255 1.00 0.00 C ATOM 830 CD PRO B 575 16.725 16.167 -2.185 1.00 0.00 C ATOM 0 HA PRO B 575 13.892 17.768 -2.355 1.00 0.00 H new ATOM 0 HB2 PRO B 575 16.123 19.405 -2.613 1.00 0.00 H new ATOM 0 HB3 PRO B 575 15.749 18.638 -1.083 1.00 0.00 H new ATOM 0 HG2 PRO B 575 17.717 17.784 -3.197 1.00 0.00 H new ATOM 0 HG3 PRO B 575 17.912 17.804 -1.455 1.00 0.00 H new ATOM 0 HD2 PRO B 575 17.337 15.507 -2.799 1.00 0.00 H new ATOM 0 HD3 PRO B 575 16.762 15.780 -1.167 1.00 0.00 H new ATOM 838 N THR B 576 15.153 17.210 -5.178 1.00 0.00 N ATOM 839 CA THR B 576 15.056 17.504 -6.602 1.00 0.00 C ATOM 840 C THR B 576 13.769 16.941 -7.194 1.00 0.00 C ATOM 841 O THR B 576 12.956 17.677 -7.753 1.00 0.00 O ATOM 842 CB THR B 576 16.258 16.932 -7.377 1.00 0.00 C ATOM 843 OG1 THR B 576 16.580 15.626 -6.886 1.00 0.00 O ATOM 844 CG2 THR B 576 17.469 17.842 -7.246 1.00 0.00 C ATOM 0 H THR B 576 15.581 16.310 -4.962 1.00 0.00 H new ATOM 0 HA THR B 576 15.053 18.590 -6.701 1.00 0.00 H new ATOM 0 HB THR B 576 15.986 16.867 -8.430 1.00 0.00 H new ATOM 0 HG1 THR B 576 17.063 15.127 -7.577 1.00 0.00 H new ATOM 0 HG21 THR B 576 18.305 17.417 -7.802 1.00 0.00 H new ATOM 0 HG22 THR B 576 17.229 18.827 -7.647 1.00 0.00 H new ATOM 0 HG23 THR B 576 17.742 17.935 -6.195 1.00 0.00 H new ATOM 852 N LEU B 577 13.589 15.630 -7.066 1.00 0.00 N ATOM 853 CA LEU B 577 12.400 14.967 -7.588 1.00 0.00 C ATOM 854 C LEU B 577 11.311 14.884 -6.523 1.00 0.00 C ATOM 855 O LEU B 577 10.348 14.131 -6.663 1.00 0.00 O ATOM 856 CB LEU B 577 12.751 13.564 -8.086 1.00 0.00 C ATOM 857 CG LEU B 577 13.704 13.494 -9.280 1.00 0.00 C ATOM 858 CD1 LEU B 577 13.277 14.474 -10.362 1.00 0.00 C ATOM 859 CD2 LEU B 577 15.133 13.774 -8.838 1.00 0.00 C ATOM 0 H LEU B 577 14.252 15.006 -6.605 1.00 0.00 H new ATOM 0 HA LEU B 577 12.022 15.557 -8.423 1.00 0.00 H new ATOM 0 HB2 LEU B 577 13.194 13.007 -7.260 1.00 0.00 H new ATOM 0 HB3 LEU B 577 11.826 13.054 -8.355 1.00 0.00 H new ATOM 0 HG LEU B 577 13.664 12.487 -9.695 1.00 0.00 H new ATOM 0 HD11 LEU B 577 13.967 14.410 -11.204 1.00 0.00 H new ATOM 0 HD12 LEU B 577 12.270 14.228 -10.699 1.00 0.00 H new ATOM 0 HD13 LEU B 577 13.288 15.487 -9.960 1.00 0.00 H new ATOM 0 HD21 LEU B 577 15.798 13.720 -9.700 1.00 0.00 H new ATOM 0 HD22 LEU B 577 15.189 14.770 -8.398 1.00 0.00 H new ATOM 0 HD23 LEU B 577 15.437 13.033 -8.099 1.00 0.00 H new ATOM 871 N ALA B 578 11.471 15.663 -5.458 1.00 0.00 N ATOM 872 CA ALA B 578 10.500 15.680 -4.371 1.00 0.00 C ATOM 873 C ALA B 578 9.083 15.859 -4.904 1.00 0.00 C ATOM 874 O ALA B 578 8.128 15.318 -4.349 1.00 0.00 O ATOM 875 CB ALA B 578 10.837 16.785 -3.381 1.00 0.00 C ATOM 0 H ALA B 578 12.264 16.291 -5.325 1.00 0.00 H new ATOM 0 HA ALA B 578 10.548 14.720 -3.858 1.00 0.00 H new ATOM 0 HB1 ALA B 578 10.104 16.787 -2.574 1.00 0.00 H new ATOM 0 HB2 ALA B 578 11.831 16.613 -2.968 1.00 0.00 H new ATOM 0 HB3 ALA B 578 10.818 17.748 -3.891 1.00 0.00 H new ATOM 881 N GLY B 579 8.953 16.622 -5.985 1.00 0.00 N ATOM 882 CA GLY B 579 7.648 16.859 -6.574 1.00 0.00 C ATOM 883 C GLY B 579 7.005 15.587 -7.090 1.00 0.00 C ATOM 884 O GLY B 579 6.046 15.085 -6.504 1.00 0.00 O ATOM 0 H GLY B 579 9.728 17.080 -6.463 1.00 0.00 H new ATOM 0 HA2 GLY B 579 6.995 17.317 -5.831 1.00 0.00 H new ATOM 0 HA3 GLY B 579 7.747 17.571 -7.393 1.00 0.00 H new ATOM 888 N LYS B 580 7.534 15.064 -8.191 1.00 0.00 N ATOM 889 CA LYS B 580 7.006 13.842 -8.787 1.00 0.00 C ATOM 890 C LYS B 580 6.830 12.754 -7.733 1.00 0.00 C ATOM 891 O LYS B 580 5.829 12.036 -7.731 1.00 0.00 O ATOM 892 CB LYS B 580 7.939 13.348 -9.895 1.00 0.00 C ATOM 893 CG LYS B 580 7.215 12.974 -11.177 1.00 0.00 C ATOM 894 CD LYS B 580 8.104 13.161 -12.395 1.00 0.00 C ATOM 895 CE LYS B 580 7.283 13.361 -13.660 1.00 0.00 C ATOM 896 NZ LYS B 580 6.926 14.792 -13.868 1.00 0.00 N ATOM 0 H LYS B 580 8.328 15.467 -8.689 1.00 0.00 H new ATOM 0 HA LYS B 580 6.030 14.068 -9.216 1.00 0.00 H new ATOM 0 HB2 LYS B 580 8.672 14.124 -10.115 1.00 0.00 H new ATOM 0 HB3 LYS B 580 8.492 12.481 -9.533 1.00 0.00 H new ATOM 0 HG2 LYS B 580 6.887 11.936 -11.121 1.00 0.00 H new ATOM 0 HG3 LYS B 580 6.319 13.586 -11.282 1.00 0.00 H new ATOM 0 HD2 LYS B 580 8.755 14.022 -12.243 1.00 0.00 H new ATOM 0 HD3 LYS B 580 8.749 12.290 -12.513 1.00 0.00 H new ATOM 0 HE2 LYS B 580 7.846 12.998 -14.520 1.00 0.00 H new ATOM 0 HE3 LYS B 580 6.373 12.764 -13.601 1.00 0.00 H new ATOM 0 HZ1 LYS B 580 6.367 14.887 -14.740 1.00 0.00 H new ATOM 0 HZ2 LYS B 580 6.367 15.131 -13.059 1.00 0.00 H new ATOM 0 HZ3 LYS B 580 7.795 15.358 -13.950 1.00 0.00 H new ATOM 910 N ILE B 581 7.806 12.639 -6.839 1.00 0.00 N ATOM 911 CA ILE B 581 7.756 11.641 -5.779 1.00 0.00 C ATOM 912 C ILE B 581 6.477 11.772 -4.959 1.00 0.00 C ATOM 913 O ILE B 581 5.679 10.837 -4.876 1.00 0.00 O ATOM 914 CB ILE B 581 8.969 11.758 -4.838 1.00 0.00 C ATOM 915 CG1 ILE B 581 10.263 11.456 -5.597 1.00 0.00 C ATOM 916 CG2 ILE B 581 8.813 10.816 -3.652 1.00 0.00 C ATOM 917 CD1 ILE B 581 11.493 12.062 -4.960 1.00 0.00 C ATOM 0 H ILE B 581 8.641 13.225 -6.828 1.00 0.00 H new ATOM 0 HA ILE B 581 7.775 10.665 -6.264 1.00 0.00 H new ATOM 0 HB ILE B 581 9.020 12.780 -4.462 1.00 0.00 H new ATOM 0 HG12 ILE B 581 10.393 10.376 -5.662 1.00 0.00 H new ATOM 0 HG13 ILE B 581 10.171 11.828 -6.617 1.00 0.00 H new ATOM 0 HG21 ILE B 581 9.678 10.910 -2.996 1.00 0.00 H new ATOM 0 HG22 ILE B 581 7.909 11.073 -3.100 1.00 0.00 H new ATOM 0 HG23 ILE B 581 8.740 9.789 -4.010 1.00 0.00 H new ATOM 0 HD11 ILE B 581 12.372 11.807 -5.552 1.00 0.00 H new ATOM 0 HD12 ILE B 581 11.385 13.146 -4.919 1.00 0.00 H new ATOM 0 HD13 ILE B 581 11.610 11.671 -3.949 1.00 0.00 H new ATOM 929 N THR B 582 6.285 12.941 -4.355 1.00 0.00 N ATOM 930 CA THR B 582 5.102 13.196 -3.542 1.00 0.00 C ATOM 931 C THR B 582 3.826 12.989 -4.349 1.00 0.00 C ATOM 932 O THR B 582 2.794 12.594 -3.807 1.00 0.00 O ATOM 933 CB THR B 582 5.110 14.628 -2.973 1.00 0.00 C ATOM 934 OG1 THR B 582 4.606 14.625 -1.633 1.00 0.00 O ATOM 935 CG2 THR B 582 4.269 15.557 -3.835 1.00 0.00 C ATOM 0 H THR B 582 6.934 13.726 -4.414 1.00 0.00 H new ATOM 0 HA THR B 582 5.126 12.485 -2.716 1.00 0.00 H new ATOM 0 HB THR B 582 6.138 14.990 -2.973 1.00 0.00 H new ATOM 0 HG1 THR B 582 4.219 13.748 -1.431 1.00 0.00 H new ATOM 0 HG21 THR B 582 4.290 16.562 -3.414 1.00 0.00 H new ATOM 0 HG22 THR B 582 4.673 15.579 -4.847 1.00 0.00 H new ATOM 0 HG23 THR B 582 3.241 15.196 -3.863 1.00 0.00 H new ATOM 943 N GLY B 583 3.902 13.259 -5.649 1.00 0.00 N ATOM 944 CA GLY B 583 2.745 13.095 -6.509 1.00 0.00 C ATOM 945 C GLY B 583 2.279 11.655 -6.587 1.00 0.00 C ATOM 946 O GLY B 583 1.130 11.349 -6.266 1.00 0.00 O ATOM 0 H GLY B 583 4.744 13.588 -6.121 1.00 0.00 H new ATOM 0 HA2 GLY B 583 1.930 13.718 -6.139 1.00 0.00 H new ATOM 0 HA3 GLY B 583 2.988 13.450 -7.511 1.00 0.00 H new ATOM 950 N MET B 584 3.171 10.768 -7.015 1.00 0.00 N ATOM 951 CA MET B 584 2.844 9.352 -7.133 1.00 0.00 C ATOM 952 C MET B 584 2.578 8.738 -5.762 1.00 0.00 C ATOM 953 O MET B 584 1.640 7.958 -5.591 1.00 0.00 O ATOM 954 CB MET B 584 3.980 8.600 -7.830 1.00 0.00 C ATOM 955 CG MET B 584 4.327 9.158 -9.201 1.00 0.00 C ATOM 956 SD MET B 584 5.950 8.624 -9.777 1.00 0.00 S ATOM 957 CE MET B 584 7.020 9.540 -8.670 1.00 0.00 C ATOM 0 H MET B 584 4.126 11.005 -7.286 1.00 0.00 H new ATOM 0 HA MET B 584 1.938 9.264 -7.732 1.00 0.00 H new ATOM 0 HB2 MET B 584 4.868 8.633 -7.198 1.00 0.00 H new ATOM 0 HB3 MET B 584 3.701 7.551 -7.934 1.00 0.00 H new ATOM 0 HG2 MET B 584 3.569 8.844 -9.919 1.00 0.00 H new ATOM 0 HG3 MET B 584 4.299 10.247 -9.164 1.00 0.00 H new ATOM 0 HE1 MET B 584 7.982 9.033 -8.591 1.00 0.00 H new ATOM 0 HE2 MET B 584 7.172 10.546 -9.060 1.00 0.00 H new ATOM 0 HE3 MET B 584 6.559 9.599 -7.684 1.00 0.00 H new ATOM 967 N LEU B 585 3.409 9.095 -4.789 1.00 0.00 N ATOM 968 CA LEU B 585 3.263 8.579 -3.432 1.00 0.00 C ATOM 969 C LEU B 585 1.921 8.988 -2.835 1.00 0.00 C ATOM 970 O LEU B 585 1.352 8.272 -2.010 1.00 0.00 O ATOM 971 CB LEU B 585 4.404 9.086 -2.548 1.00 0.00 C ATOM 972 CG LEU B 585 5.631 8.180 -2.450 1.00 0.00 C ATOM 973 CD1 LEU B 585 6.169 7.858 -3.836 1.00 0.00 C ATOM 974 CD2 LEU B 585 6.709 8.831 -1.595 1.00 0.00 C ATOM 0 H LEU B 585 4.190 9.739 -4.914 1.00 0.00 H new ATOM 0 HA LEU B 585 3.302 7.491 -3.477 1.00 0.00 H new ATOM 0 HB2 LEU B 585 4.724 10.058 -2.924 1.00 0.00 H new ATOM 0 HB3 LEU B 585 4.014 9.246 -1.543 1.00 0.00 H new ATOM 0 HG LEU B 585 5.332 7.247 -1.973 1.00 0.00 H new ATOM 0 HD11 LEU B 585 7.042 7.212 -3.746 1.00 0.00 H new ATOM 0 HD12 LEU B 585 5.399 7.349 -4.416 1.00 0.00 H new ATOM 0 HD13 LEU B 585 6.451 8.782 -4.340 1.00 0.00 H new ATOM 0 HD21 LEU B 585 7.575 8.171 -1.537 1.00 0.00 H new ATOM 0 HD22 LEU B 585 7.005 9.780 -2.043 1.00 0.00 H new ATOM 0 HD23 LEU B 585 6.320 9.009 -0.592 1.00 0.00 H new ATOM 986 N LEU B 586 1.418 10.143 -3.257 1.00 0.00 N ATOM 987 CA LEU B 586 0.141 10.647 -2.766 1.00 0.00 C ATOM 988 C LEU B 586 -1.021 10.037 -3.545 1.00 0.00 C ATOM 989 O LEU B 586 -2.161 10.044 -3.082 1.00 0.00 O ATOM 990 CB LEU B 586 0.097 12.172 -2.874 1.00 0.00 C ATOM 991 CG LEU B 586 -1.230 12.834 -2.497 1.00 0.00 C ATOM 992 CD1 LEU B 586 -0.990 14.221 -1.923 1.00 0.00 C ATOM 993 CD2 LEU B 586 -2.151 12.907 -3.706 1.00 0.00 C ATOM 0 H LEU B 586 1.876 10.748 -3.939 1.00 0.00 H new ATOM 0 HA LEU B 586 0.043 10.360 -1.719 1.00 0.00 H new ATOM 0 HB2 LEU B 586 0.880 12.584 -2.237 1.00 0.00 H new ATOM 0 HB3 LEU B 586 0.341 12.451 -3.899 1.00 0.00 H new ATOM 0 HG LEU B 586 -1.714 12.226 -1.733 1.00 0.00 H new ATOM 0 HD11 LEU B 586 -1.945 14.676 -1.661 1.00 0.00 H new ATOM 0 HD12 LEU B 586 -0.368 14.143 -1.031 1.00 0.00 H new ATOM 0 HD13 LEU B 586 -0.485 14.839 -2.665 1.00 0.00 H new ATOM 0 HD21 LEU B 586 -3.090 13.381 -3.420 1.00 0.00 H new ATOM 0 HD22 LEU B 586 -1.674 13.493 -4.492 1.00 0.00 H new ATOM 0 HD23 LEU B 586 -2.350 11.900 -4.073 1.00 0.00 H new ATOM 1005 N GLU B 587 -0.722 9.509 -4.727 1.00 0.00 N ATOM 1006 CA GLU B 587 -1.742 8.894 -5.568 1.00 0.00 C ATOM 1007 C GLU B 587 -2.107 7.505 -5.053 1.00 0.00 C ATOM 1008 O GLU B 587 -3.275 7.215 -4.793 1.00 0.00 O ATOM 1009 CB GLU B 587 -1.253 8.801 -7.015 1.00 0.00 C ATOM 1010 CG GLU B 587 -2.321 8.334 -7.990 1.00 0.00 C ATOM 1011 CD GLU B 587 -2.742 9.421 -8.959 1.00 0.00 C ATOM 1012 OE1 GLU B 587 -2.713 10.607 -8.570 1.00 0.00 O ATOM 1013 OE2 GLU B 587 -3.102 9.085 -10.107 1.00 0.00 O ATOM 0 H GLU B 587 0.217 9.495 -5.124 1.00 0.00 H new ATOM 0 HA GLU B 587 -2.633 9.521 -5.532 1.00 0.00 H new ATOM 0 HB2 GLU B 587 -0.888 9.779 -7.330 1.00 0.00 H new ATOM 0 HB3 GLU B 587 -0.407 8.115 -7.060 1.00 0.00 H new ATOM 0 HG2 GLU B 587 -1.946 7.478 -8.551 1.00 0.00 H new ATOM 0 HG3 GLU B 587 -3.193 7.993 -7.432 1.00 0.00 H new ATOM 1020 N ILE B 588 -1.100 6.650 -4.909 1.00 0.00 N ATOM 1021 CA ILE B 588 -1.314 5.292 -4.425 1.00 0.00 C ATOM 1022 C ILE B 588 -2.461 5.241 -3.421 1.00 0.00 C ATOM 1023 O ILE B 588 -3.469 4.572 -3.649 1.00 0.00 O ATOM 1024 CB ILE B 588 -0.044 4.722 -3.765 1.00 0.00 C ATOM 1025 CG1 ILE B 588 0.839 5.858 -3.243 1.00 0.00 C ATOM 1026 CG2 ILE B 588 0.724 3.859 -4.754 1.00 0.00 C ATOM 1027 CD1 ILE B 588 1.806 5.423 -2.164 1.00 0.00 C ATOM 0 H ILE B 588 -0.128 6.874 -5.121 1.00 0.00 H new ATOM 0 HA ILE B 588 -1.566 4.684 -5.294 1.00 0.00 H new ATOM 0 HB ILE B 588 -0.339 4.099 -2.921 1.00 0.00 H new ATOM 0 HG12 ILE B 588 1.402 6.282 -4.075 1.00 0.00 H new ATOM 0 HG13 ILE B 588 0.203 6.652 -2.851 1.00 0.00 H new ATOM 0 HG21 ILE B 588 1.619 3.463 -4.273 1.00 0.00 H new ATOM 0 HG22 ILE B 588 0.093 3.033 -5.083 1.00 0.00 H new ATOM 0 HG23 ILE B 588 1.011 4.461 -5.616 1.00 0.00 H new ATOM 0 HD11 ILE B 588 2.399 6.278 -1.841 1.00 0.00 H new ATOM 0 HD12 ILE B 588 1.249 5.026 -1.315 1.00 0.00 H new ATOM 0 HD13 ILE B 588 2.467 4.651 -2.558 1.00 0.00 H new ATOM 1039 N ASP B 589 -2.301 5.954 -2.312 1.00 0.00 N ATOM 1040 CA ASP B 589 -3.325 5.993 -1.274 1.00 0.00 C ATOM 1041 C ASP B 589 -2.844 6.791 -0.066 1.00 0.00 C ATOM 1042 O ASP B 589 -1.960 6.351 0.669 1.00 0.00 O ATOM 1043 CB ASP B 589 -3.702 4.573 -0.846 1.00 0.00 C ATOM 1044 CG ASP B 589 -5.182 4.293 -1.010 1.00 0.00 C ATOM 1045 OD1 ASP B 589 -5.781 4.811 -1.977 1.00 0.00 O ATOM 1046 OD2 ASP B 589 -5.743 3.555 -0.173 1.00 0.00 O ATOM 0 H ASP B 589 -1.472 6.513 -2.108 1.00 0.00 H new ATOM 0 HA ASP B 589 -4.206 6.486 -1.685 1.00 0.00 H new ATOM 0 HB2 ASP B 589 -3.132 3.855 -1.436 1.00 0.00 H new ATOM 0 HB3 ASP B 589 -3.420 4.424 0.196 1.00 0.00 H new ATOM 1051 N ASN B 590 -3.431 7.966 0.132 1.00 0.00 N ATOM 1052 CA ASN B 590 -3.061 8.827 1.250 1.00 0.00 C ATOM 1053 C ASN B 590 -3.114 8.060 2.568 1.00 0.00 C ATOM 1054 O ASN B 590 -2.202 8.153 3.390 1.00 0.00 O ATOM 1055 CB ASN B 590 -3.990 10.041 1.316 1.00 0.00 C ATOM 1056 CG ASN B 590 -4.226 10.663 -0.047 1.00 0.00 C ATOM 1057 OD1 ASN B 590 -4.832 10.049 -0.925 1.00 0.00 O ATOM 1058 ND2 ASN B 590 -3.747 11.887 -0.229 1.00 0.00 N ATOM 0 H ASN B 590 -4.165 8.344 -0.467 1.00 0.00 H new ATOM 0 HA ASN B 590 -2.039 9.169 1.090 1.00 0.00 H new ATOM 0 HB2 ASN B 590 -4.946 9.741 1.746 1.00 0.00 H new ATOM 0 HB3 ASN B 590 -3.561 10.788 1.984 1.00 0.00 H new ATOM 0 HD21 ASN B 590 -3.875 12.357 -1.125 1.00 0.00 H new ATOM 0 HD22 ASN B 590 -3.251 12.358 0.527 1.00 0.00 H new ATOM 1065 N SER B 591 -4.188 7.301 2.762 1.00 0.00 N ATOM 1066 CA SER B 591 -4.362 6.520 3.981 1.00 0.00 C ATOM 1067 C SER B 591 -3.155 5.620 4.226 1.00 0.00 C ATOM 1068 O SER B 591 -2.743 5.414 5.367 1.00 0.00 O ATOM 1069 CB SER B 591 -5.634 5.674 3.892 1.00 0.00 C ATOM 1070 OG SER B 591 -6.236 5.523 5.166 1.00 0.00 O ATOM 0 H SER B 591 -4.951 7.210 2.091 1.00 0.00 H new ATOM 0 HA SER B 591 -4.453 7.213 4.818 1.00 0.00 H new ATOM 0 HB2 SER B 591 -6.339 6.143 3.206 1.00 0.00 H new ATOM 0 HB3 SER B 591 -5.394 4.693 3.481 1.00 0.00 H new ATOM 0 HG SER B 591 -7.048 4.980 5.082 1.00 0.00 H new ATOM 1076 N GLU B 592 -2.594 5.086 3.146 1.00 0.00 N ATOM 1077 CA GLU B 592 -1.434 4.207 3.244 1.00 0.00 C ATOM 1078 C GLU B 592 -0.206 4.977 3.720 1.00 0.00 C ATOM 1079 O GLU B 592 0.640 4.439 4.435 1.00 0.00 O ATOM 1080 CB GLU B 592 -1.147 3.552 1.891 1.00 0.00 C ATOM 1081 CG GLU B 592 -0.208 2.361 1.978 1.00 0.00 C ATOM 1082 CD GLU B 592 1.253 2.765 1.939 1.00 0.00 C ATOM 1083 OE1 GLU B 592 1.550 3.863 1.422 1.00 0.00 O ATOM 1084 OE2 GLU B 592 2.099 1.984 2.423 1.00 0.00 O ATOM 0 H GLU B 592 -2.923 5.246 2.194 1.00 0.00 H new ATOM 0 HA GLU B 592 -1.659 3.430 3.975 1.00 0.00 H new ATOM 0 HB2 GLU B 592 -2.088 3.230 1.446 1.00 0.00 H new ATOM 0 HB3 GLU B 592 -0.716 4.296 1.221 1.00 0.00 H new ATOM 0 HG2 GLU B 592 -0.405 1.814 2.900 1.00 0.00 H new ATOM 0 HG3 GLU B 592 -0.415 1.679 1.153 1.00 0.00 H new ATOM 1091 N LEU B 593 -0.115 6.240 3.318 1.00 0.00 N ATOM 1092 CA LEU B 593 1.010 7.086 3.702 1.00 0.00 C ATOM 1093 C LEU B 593 0.910 7.491 5.169 1.00 0.00 C ATOM 1094 O LEU B 593 1.922 7.617 5.860 1.00 0.00 O ATOM 1095 CB LEU B 593 1.060 8.334 2.819 1.00 0.00 C ATOM 1096 CG LEU B 593 0.524 8.171 1.396 1.00 0.00 C ATOM 1097 CD1 LEU B 593 0.656 9.474 0.623 1.00 0.00 C ATOM 1098 CD2 LEU B 593 1.254 7.046 0.677 1.00 0.00 C ATOM 0 H LEU B 593 -0.806 6.701 2.726 1.00 0.00 H new ATOM 0 HA LEU B 593 1.927 6.514 3.563 1.00 0.00 H new ATOM 0 HB2 LEU B 593 0.494 9.125 3.311 1.00 0.00 H new ATOM 0 HB3 LEU B 593 2.095 8.672 2.760 1.00 0.00 H new ATOM 0 HG LEU B 593 -0.533 7.913 1.454 1.00 0.00 H new ATOM 0 HD11 LEU B 593 0.270 9.339 -0.387 1.00 0.00 H new ATOM 0 HD12 LEU B 593 0.087 10.255 1.127 1.00 0.00 H new ATOM 0 HD13 LEU B 593 1.706 9.763 0.574 1.00 0.00 H new ATOM 0 HD21 LEU B 593 0.860 6.944 -0.334 1.00 0.00 H new ATOM 0 HD22 LEU B 593 2.319 7.275 0.630 1.00 0.00 H new ATOM 0 HD23 LEU B 593 1.107 6.112 1.219 1.00 0.00 H new ATOM 1110 N LEU B 594 -0.316 7.691 5.640 1.00 0.00 N ATOM 1111 CA LEU B 594 -0.549 8.080 7.027 1.00 0.00 C ATOM 1112 C LEU B 594 -0.101 6.980 7.983 1.00 0.00 C ATOM 1113 O LEU B 594 0.058 7.211 9.182 1.00 0.00 O ATOM 1114 CB LEU B 594 -2.030 8.392 7.248 1.00 0.00 C ATOM 1115 CG LEU B 594 -2.519 9.740 6.715 1.00 0.00 C ATOM 1116 CD1 LEU B 594 -4.016 9.888 6.932 1.00 0.00 C ATOM 1117 CD2 LEU B 594 -1.765 10.882 7.381 1.00 0.00 C ATOM 0 H LEU B 594 -1.164 7.590 5.082 1.00 0.00 H new ATOM 0 HA LEU B 594 0.039 8.975 7.231 1.00 0.00 H new ATOM 0 HB2 LEU B 594 -2.620 7.604 6.781 1.00 0.00 H new ATOM 0 HB3 LEU B 594 -2.234 8.352 8.318 1.00 0.00 H new ATOM 0 HG LEU B 594 -2.323 9.779 5.643 1.00 0.00 H new ATOM 0 HD11 LEU B 594 -4.346 10.853 6.547 1.00 0.00 H new ATOM 0 HD12 LEU B 594 -4.540 9.089 6.407 1.00 0.00 H new ATOM 0 HD13 LEU B 594 -4.237 9.828 7.998 1.00 0.00 H new ATOM 0 HD21 LEU B 594 -2.126 11.833 6.990 1.00 0.00 H new ATOM 0 HD22 LEU B 594 -1.929 10.847 8.458 1.00 0.00 H new ATOM 0 HD23 LEU B 594 -0.699 10.785 7.173 1.00 0.00 H new ATOM 1129 N HIS B 595 0.102 5.781 7.445 1.00 0.00 N ATOM 1130 CA HIS B 595 0.535 4.645 8.250 1.00 0.00 C ATOM 1131 C HIS B 595 1.892 4.131 7.780 1.00 0.00 C ATOM 1132 O HIS B 595 2.558 3.374 8.486 1.00 0.00 O ATOM 1133 CB HIS B 595 -0.500 3.521 8.182 1.00 0.00 C ATOM 1134 CG HIS B 595 -0.625 2.745 9.457 1.00 0.00 C ATOM 1135 ND1 HIS B 595 0.407 2.004 9.991 1.00 0.00 N ATOM 1136 CD2 HIS B 595 -1.670 2.598 10.305 1.00 0.00 C ATOM 1137 CE1 HIS B 595 0.003 1.433 11.112 1.00 0.00 C ATOM 1138 NE2 HIS B 595 -1.254 1.778 11.325 1.00 0.00 N ATOM 0 H HIS B 595 -0.027 5.572 6.455 1.00 0.00 H new ATOM 0 HA HIS B 595 0.631 4.979 9.283 1.00 0.00 H new ATOM 0 HB2 HIS B 595 -1.471 3.947 7.929 1.00 0.00 H new ATOM 0 HB3 HIS B 595 -0.231 2.839 7.376 1.00 0.00 H new ATOM 0 HD1 HIS B 595 1.338 1.911 9.584 1.00 0.00 H new ATOM 0 HD2 HIS B 595 -2.648 3.043 10.199 1.00 0.00 H new ATOM 0 HE1 HIS B 595 0.599 0.793 11.746 1.00 0.00 H new ATOM 1146 N MET B 596 2.296 4.548 6.585 1.00 0.00 N ATOM 1147 CA MET B 596 3.575 4.130 6.021 1.00 0.00 C ATOM 1148 C MET B 596 4.688 5.090 6.429 1.00 0.00 C ATOM 1149 O MET B 596 5.868 4.739 6.393 1.00 0.00 O ATOM 1150 CB MET B 596 3.484 4.054 4.496 1.00 0.00 C ATOM 1151 CG MET B 596 4.838 3.979 3.810 1.00 0.00 C ATOM 1152 SD MET B 596 5.402 5.584 3.210 1.00 0.00 S ATOM 1153 CE MET B 596 4.074 6.011 2.087 1.00 0.00 C ATOM 0 H MET B 596 1.757 5.175 5.988 1.00 0.00 H new ATOM 0 HA MET B 596 3.811 3.141 6.413 1.00 0.00 H new ATOM 0 HB2 MET B 596 2.896 3.179 4.218 1.00 0.00 H new ATOM 0 HB3 MET B 596 2.947 4.928 4.128 1.00 0.00 H new ATOM 0 HG2 MET B 596 5.573 3.577 4.508 1.00 0.00 H new ATOM 0 HG3 MET B 596 4.779 3.283 2.973 1.00 0.00 H new ATOM 0 HE1 MET B 596 4.480 6.173 1.088 1.00 0.00 H new ATOM 0 HE2 MET B 596 3.348 5.198 2.056 1.00 0.00 H new ATOM 0 HE3 MET B 596 3.584 6.922 2.432 1.00 0.00 H new ATOM 1163 N LEU B 597 4.306 6.302 6.815 1.00 0.00 N ATOM 1164 CA LEU B 597 5.272 7.313 7.229 1.00 0.00 C ATOM 1165 C LEU B 597 5.938 6.924 8.545 1.00 0.00 C ATOM 1166 O LEU B 597 6.887 7.571 8.987 1.00 0.00 O ATOM 1167 CB LEU B 597 4.587 8.673 7.374 1.00 0.00 C ATOM 1168 CG LEU B 597 3.800 8.894 8.666 1.00 0.00 C ATOM 1169 CD1 LEU B 597 2.889 7.709 8.945 1.00 0.00 C ATOM 1170 CD2 LEU B 597 4.747 9.128 9.834 1.00 0.00 C ATOM 0 H LEU B 597 3.334 6.609 6.850 1.00 0.00 H new ATOM 0 HA LEU B 597 6.041 7.381 6.460 1.00 0.00 H new ATOM 0 HB2 LEU B 597 5.347 9.450 7.298 1.00 0.00 H new ATOM 0 HB3 LEU B 597 3.909 8.807 6.531 1.00 0.00 H new ATOM 0 HG LEU B 597 3.180 9.782 8.544 1.00 0.00 H new ATOM 0 HD11 LEU B 597 2.337 7.884 9.868 1.00 0.00 H new ATOM 0 HD12 LEU B 597 2.187 7.587 8.120 1.00 0.00 H new ATOM 0 HD13 LEU B 597 3.489 6.805 9.047 1.00 0.00 H new ATOM 0 HD21 LEU B 597 4.169 9.283 10.745 1.00 0.00 H new ATOM 0 HD22 LEU B 597 5.394 8.259 9.958 1.00 0.00 H new ATOM 0 HD23 LEU B 597 5.357 10.009 9.637 1.00 0.00 H new ATOM 1182 N GLU B 598 5.434 5.861 9.166 1.00 0.00 N ATOM 1183 CA GLU B 598 5.982 5.385 10.431 1.00 0.00 C ATOM 1184 C GLU B 598 7.056 4.328 10.195 1.00 0.00 C ATOM 1185 O GLU B 598 7.819 3.990 11.100 1.00 0.00 O ATOM 1186 CB GLU B 598 4.869 4.810 11.309 1.00 0.00 C ATOM 1187 CG GLU B 598 3.730 5.784 11.564 1.00 0.00 C ATOM 1188 CD GLU B 598 3.031 5.531 12.886 1.00 0.00 C ATOM 1189 OE1 GLU B 598 2.324 4.508 12.995 1.00 0.00 O ATOM 1190 OE2 GLU B 598 3.191 6.355 13.810 1.00 0.00 O ATOM 0 H GLU B 598 4.648 5.314 8.814 1.00 0.00 H new ATOM 0 HA GLU B 598 6.438 6.233 10.943 1.00 0.00 H new ATOM 0 HB2 GLU B 598 4.470 3.914 10.834 1.00 0.00 H new ATOM 0 HB3 GLU B 598 5.294 4.503 12.265 1.00 0.00 H new ATOM 0 HG2 GLU B 598 4.118 6.802 11.552 1.00 0.00 H new ATOM 0 HG3 GLU B 598 3.005 5.709 10.754 1.00 0.00 H new ATOM 1197 N SER B 599 7.108 3.808 8.973 1.00 0.00 N ATOM 1198 CA SER B 599 8.086 2.785 8.618 1.00 0.00 C ATOM 1199 C SER B 599 9.267 3.398 7.873 1.00 0.00 C ATOM 1200 O SER B 599 9.117 4.013 6.817 1.00 0.00 O ATOM 1201 CB SER B 599 7.432 1.702 7.758 1.00 0.00 C ATOM 1202 OG SER B 599 7.144 0.546 8.526 1.00 0.00 O ATOM 0 H SER B 599 6.485 4.078 8.212 1.00 0.00 H new ATOM 0 HA SER B 599 8.455 2.334 9.539 1.00 0.00 H new ATOM 0 HB2 SER B 599 6.513 2.088 7.318 1.00 0.00 H new ATOM 0 HB3 SER B 599 8.094 1.439 6.933 1.00 0.00 H new ATOM 0 HG SER B 599 6.725 -0.131 7.954 1.00 0.00 H new ATOM 1208 N PRO B 600 10.473 3.228 8.435 1.00 0.00 N ATOM 1209 CA PRO B 600 11.705 3.756 7.841 1.00 0.00 C ATOM 1210 C PRO B 600 12.090 3.025 6.559 1.00 0.00 C ATOM 1211 O PRO B 600 12.389 3.652 5.543 1.00 0.00 O ATOM 1212 CB PRO B 600 12.754 3.516 8.929 1.00 0.00 C ATOM 1213 CG PRO B 600 12.224 2.370 9.721 1.00 0.00 C ATOM 1214 CD PRO B 600 10.727 2.505 9.693 1.00 0.00 C ATOM 0 HA PRO B 600 11.603 4.802 7.552 1.00 0.00 H new ATOM 0 HB2 PRO B 600 13.727 3.282 8.496 1.00 0.00 H new ATOM 0 HB3 PRO B 600 12.887 4.400 9.552 1.00 0.00 H new ATOM 0 HG2 PRO B 600 12.538 1.419 9.290 1.00 0.00 H new ATOM 0 HG3 PRO B 600 12.599 2.396 10.744 1.00 0.00 H new ATOM 0 HD2 PRO B 600 10.236 1.532 9.704 1.00 0.00 H new ATOM 0 HD3 PRO B 600 10.357 3.058 10.556 1.00 0.00 H new ATOM 1222 N GLU B 601 12.081 1.697 6.615 1.00 0.00 N ATOM 1223 CA GLU B 601 12.430 0.882 5.457 1.00 0.00 C ATOM 1224 C GLU B 601 11.418 1.074 4.331 1.00 0.00 C ATOM 1225 O GLU B 601 11.717 0.826 3.163 1.00 0.00 O ATOM 1226 CB GLU B 601 12.500 -0.595 5.847 1.00 0.00 C ATOM 1227 CG GLU B 601 13.723 -0.948 6.678 1.00 0.00 C ATOM 1228 CD GLU B 601 14.986 -1.044 5.844 1.00 0.00 C ATOM 1229 OE1 GLU B 601 14.895 -1.471 4.675 1.00 0.00 O ATOM 1230 OE2 GLU B 601 16.066 -0.692 6.363 1.00 0.00 O ATOM 0 H GLU B 601 11.836 1.163 7.449 1.00 0.00 H new ATOM 0 HA GLU B 601 13.409 1.203 5.101 1.00 0.00 H new ATOM 0 HB2 GLU B 601 11.602 -0.857 6.407 1.00 0.00 H new ATOM 0 HB3 GLU B 601 12.499 -1.202 4.941 1.00 0.00 H new ATOM 0 HG2 GLU B 601 13.861 -0.195 7.454 1.00 0.00 H new ATOM 0 HG3 GLU B 601 13.552 -1.899 7.183 1.00 0.00 H new ATOM 1237 N SER B 602 10.217 1.518 4.692 1.00 0.00 N ATOM 1238 CA SER B 602 9.159 1.739 3.714 1.00 0.00 C ATOM 1239 C SER B 602 9.315 3.100 3.043 1.00 0.00 C ATOM 1240 O SER B 602 9.274 3.210 1.816 1.00 0.00 O ATOM 1241 CB SER B 602 7.787 1.643 4.385 1.00 0.00 C ATOM 1242 OG SER B 602 7.552 0.336 4.878 1.00 0.00 O ATOM 0 H SER B 602 9.954 1.731 5.654 1.00 0.00 H new ATOM 0 HA SER B 602 9.237 0.966 2.950 1.00 0.00 H new ATOM 0 HB2 SER B 602 7.728 2.360 5.204 1.00 0.00 H new ATOM 0 HB3 SER B 602 7.009 1.911 3.670 1.00 0.00 H new ATOM 0 HG SER B 602 6.670 0.301 5.304 1.00 0.00 H new ATOM 1248 N LEU B 603 9.494 4.136 3.855 1.00 0.00 N ATOM 1249 CA LEU B 603 9.657 5.492 3.342 1.00 0.00 C ATOM 1250 C LEU B 603 10.729 5.539 2.257 1.00 0.00 C ATOM 1251 O LEU B 603 10.470 5.972 1.134 1.00 0.00 O ATOM 1252 CB LEU B 603 10.024 6.448 4.479 1.00 0.00 C ATOM 1253 CG LEU B 603 10.197 7.917 4.091 1.00 0.00 C ATOM 1254 CD1 LEU B 603 11.595 8.164 3.546 1.00 0.00 C ATOM 1255 CD2 LEU B 603 9.144 8.326 3.071 1.00 0.00 C ATOM 0 H LEU B 603 9.530 4.063 4.872 1.00 0.00 H new ATOM 0 HA LEU B 603 8.709 5.805 2.904 1.00 0.00 H new ATOM 0 HB2 LEU B 603 9.251 6.384 5.245 1.00 0.00 H new ATOM 0 HB3 LEU B 603 10.952 6.101 4.933 1.00 0.00 H new ATOM 0 HG LEU B 603 10.065 8.527 4.984 1.00 0.00 H new ATOM 0 HD11 LEU B 603 11.700 9.215 3.275 1.00 0.00 H new ATOM 0 HD12 LEU B 603 12.332 7.910 4.308 1.00 0.00 H new ATOM 0 HD13 LEU B 603 11.756 7.544 2.664 1.00 0.00 H new ATOM 0 HD21 LEU B 603 9.282 9.374 2.806 1.00 0.00 H new ATOM 0 HD22 LEU B 603 9.244 7.710 2.178 1.00 0.00 H new ATOM 0 HD23 LEU B 603 8.151 8.187 3.498 1.00 0.00 H new ATOM 1267 N ARG B 604 11.931 5.088 2.601 1.00 0.00 N ATOM 1268 CA ARG B 604 13.041 5.078 1.656 1.00 0.00 C ATOM 1269 C ARG B 604 12.671 4.309 0.391 1.00 0.00 C ATOM 1270 O ARG B 604 13.054 4.693 -0.715 1.00 0.00 O ATOM 1271 CB ARG B 604 14.281 4.454 2.300 1.00 0.00 C ATOM 1272 CG ARG B 604 15.589 4.922 1.682 1.00 0.00 C ATOM 1273 CD ARG B 604 16.740 3.998 2.050 1.00 0.00 C ATOM 1274 NE ARG B 604 18.034 4.563 1.678 1.00 0.00 N ATOM 1275 CZ ARG B 604 18.592 5.596 2.299 1.00 0.00 C ATOM 1276 NH1 ARG B 604 17.971 6.174 3.318 1.00 0.00 N ATOM 1277 NH2 ARG B 604 19.773 6.052 1.902 1.00 0.00 N ATOM 0 H ARG B 604 12.161 4.725 3.526 1.00 0.00 H new ATOM 0 HA ARG B 604 13.262 6.110 1.382 1.00 0.00 H new ATOM 0 HB2 ARG B 604 14.286 4.692 3.364 1.00 0.00 H new ATOM 0 HB3 ARG B 604 14.217 3.369 2.216 1.00 0.00 H new ATOM 0 HG2 ARG B 604 15.486 4.963 0.598 1.00 0.00 H new ATOM 0 HG3 ARG B 604 15.811 5.934 2.020 1.00 0.00 H new ATOM 0 HD2 ARG B 604 16.723 3.807 3.123 1.00 0.00 H new ATOM 0 HD3 ARG B 604 16.607 3.037 1.553 1.00 0.00 H new ATOM 0 HE ARG B 604 18.537 4.141 0.898 1.00 0.00 H new ATOM 0 HH11 ARG B 604 17.063 5.825 3.626 1.00 0.00 H new ATOM 0 HH12 ARG B 604 18.401 6.967 3.794 1.00 0.00 H new ATOM 0 HH21 ARG B 604 20.254 5.609 1.119 1.00 0.00 H new ATOM 0 HH22 ARG B 604 20.200 6.845 2.380 1.00 0.00 H new ATOM 1291 N SER B 605 11.925 3.222 0.561 1.00 0.00 N ATOM 1292 CA SER B 605 11.507 2.397 -0.566 1.00 0.00 C ATOM 1293 C SER B 605 10.579 3.176 -1.494 1.00 0.00 C ATOM 1294 O SER B 605 10.732 3.143 -2.715 1.00 0.00 O ATOM 1295 CB SER B 605 10.805 1.133 -0.068 1.00 0.00 C ATOM 1296 OG SER B 605 10.487 0.268 -1.144 1.00 0.00 O ATOM 0 H SER B 605 11.598 2.892 1.469 1.00 0.00 H new ATOM 0 HA SER B 605 12.398 2.112 -1.126 1.00 0.00 H new ATOM 0 HB2 SER B 605 11.447 0.613 0.643 1.00 0.00 H new ATOM 0 HB3 SER B 605 9.894 1.405 0.465 1.00 0.00 H new ATOM 0 HG SER B 605 10.040 -0.533 -0.799 1.00 0.00 H new ATOM 1302 N LYS B 606 9.616 3.876 -0.905 1.00 0.00 N ATOM 1303 CA LYS B 606 8.662 4.665 -1.676 1.00 0.00 C ATOM 1304 C LYS B 606 9.378 5.728 -2.504 1.00 0.00 C ATOM 1305 O LYS B 606 9.248 5.768 -3.727 1.00 0.00 O ATOM 1306 CB LYS B 606 7.646 5.328 -0.744 1.00 0.00 C ATOM 1307 CG LYS B 606 6.761 4.339 -0.006 1.00 0.00 C ATOM 1308 CD LYS B 606 6.031 3.417 -0.969 1.00 0.00 C ATOM 1309 CE LYS B 606 5.172 4.202 -1.949 1.00 0.00 C ATOM 1310 NZ LYS B 606 4.472 3.309 -2.913 1.00 0.00 N ATOM 0 H LYS B 606 9.475 3.913 0.105 1.00 0.00 H new ATOM 0 HA LYS B 606 8.138 3.993 -2.355 1.00 0.00 H new ATOM 0 HB2 LYS B 606 8.179 5.939 -0.016 1.00 0.00 H new ATOM 0 HB3 LYS B 606 7.017 6.001 -1.326 1.00 0.00 H new ATOM 0 HG2 LYS B 606 7.368 3.746 0.677 1.00 0.00 H new ATOM 0 HG3 LYS B 606 6.036 4.881 0.601 1.00 0.00 H new ATOM 0 HD2 LYS B 606 6.755 2.816 -1.519 1.00 0.00 H new ATOM 0 HD3 LYS B 606 5.404 2.725 -0.407 1.00 0.00 H new ATOM 0 HE2 LYS B 606 4.437 4.789 -1.398 1.00 0.00 H new ATOM 0 HE3 LYS B 606 5.798 4.907 -2.496 1.00 0.00 H new ATOM 0 HZ1 LYS B 606 4.153 3.865 -3.732 1.00 0.00 H new ATOM 0 HZ2 LYS B 606 5.124 2.564 -3.232 1.00 0.00 H new ATOM 0 HZ3 LYS B 606 3.650 2.874 -2.449 1.00 0.00 H new ATOM 1324 N VAL B 607 10.135 6.586 -1.828 1.00 0.00 N ATOM 1325 CA VAL B 607 10.874 7.648 -2.502 1.00 0.00 C ATOM 1326 C VAL B 607 11.760 7.085 -3.607 1.00 0.00 C ATOM 1327 O VAL B 607 11.728 7.557 -4.743 1.00 0.00 O ATOM 1328 CB VAL B 607 11.748 8.439 -1.510 1.00 0.00 C ATOM 1329 CG1 VAL B 607 12.513 9.538 -2.232 1.00 0.00 C ATOM 1330 CG2 VAL B 607 10.894 9.018 -0.392 1.00 0.00 C ATOM 0 H VAL B 607 10.253 6.567 -0.815 1.00 0.00 H new ATOM 0 HA VAL B 607 10.136 8.320 -2.940 1.00 0.00 H new ATOM 0 HB VAL B 607 12.473 7.756 -1.066 1.00 0.00 H new ATOM 0 HG11 VAL B 607 13.125 10.086 -1.516 1.00 0.00 H new ATOM 0 HG12 VAL B 607 13.155 9.095 -2.993 1.00 0.00 H new ATOM 0 HG13 VAL B 607 11.808 10.222 -2.705 1.00 0.00 H new ATOM 0 HG21 VAL B 607 11.528 9.573 0.299 1.00 0.00 H new ATOM 0 HG22 VAL B 607 10.145 9.687 -0.816 1.00 0.00 H new ATOM 0 HG23 VAL B 607 10.396 8.209 0.142 1.00 0.00 H new ATOM 1340 N ASP B 608 12.550 6.073 -3.266 1.00 0.00 N ATOM 1341 CA ASP B 608 13.446 5.443 -4.229 1.00 0.00 C ATOM 1342 C ASP B 608 12.672 4.952 -5.449 1.00 0.00 C ATOM 1343 O ASP B 608 13.004 5.292 -6.584 1.00 0.00 O ATOM 1344 CB ASP B 608 14.191 4.276 -3.579 1.00 0.00 C ATOM 1345 CG ASP B 608 15.095 3.551 -4.555 1.00 0.00 C ATOM 1346 OD1 ASP B 608 15.957 4.213 -5.171 1.00 0.00 O ATOM 1347 OD2 ASP B 608 14.942 2.321 -4.704 1.00 0.00 O ATOM 0 H ASP B 608 12.588 5.671 -2.329 1.00 0.00 H new ATOM 0 HA ASP B 608 14.171 6.189 -4.555 1.00 0.00 H new ATOM 0 HB2 ASP B 608 14.786 4.648 -2.745 1.00 0.00 H new ATOM 0 HB3 ASP B 608 13.468 3.572 -3.166 1.00 0.00 H new ATOM 1352 N GLU B 609 11.640 4.150 -5.206 1.00 0.00 N ATOM 1353 CA GLU B 609 10.822 3.610 -6.285 1.00 0.00 C ATOM 1354 C GLU B 609 10.337 4.724 -7.209 1.00 0.00 C ATOM 1355 O GLU B 609 10.520 4.661 -8.424 1.00 0.00 O ATOM 1356 CB GLU B 609 9.624 2.849 -5.715 1.00 0.00 C ATOM 1357 CG GLU B 609 9.948 1.421 -5.306 1.00 0.00 C ATOM 1358 CD GLU B 609 8.765 0.711 -4.678 1.00 0.00 C ATOM 1359 OE1 GLU B 609 7.673 1.313 -4.620 1.00 0.00 O ATOM 1360 OE2 GLU B 609 8.932 -0.448 -4.243 1.00 0.00 O ATOM 0 H GLU B 609 11.351 3.860 -4.272 1.00 0.00 H new ATOM 0 HA GLU B 609 11.438 2.922 -6.864 1.00 0.00 H new ATOM 0 HB2 GLU B 609 9.241 3.388 -4.849 1.00 0.00 H new ATOM 0 HB3 GLU B 609 8.827 2.833 -6.459 1.00 0.00 H new ATOM 0 HG2 GLU B 609 10.279 0.863 -6.182 1.00 0.00 H new ATOM 0 HG3 GLU B 609 10.779 1.429 -4.600 1.00 0.00 H new ATOM 1367 N ALA B 610 9.717 5.743 -6.623 1.00 0.00 N ATOM 1368 CA ALA B 610 9.207 6.872 -7.391 1.00 0.00 C ATOM 1369 C ALA B 610 10.286 7.448 -8.302 1.00 0.00 C ATOM 1370 O ALA B 610 10.135 7.469 -9.524 1.00 0.00 O ATOM 1371 CB ALA B 610 8.671 7.947 -6.458 1.00 0.00 C ATOM 0 H ALA B 610 9.556 5.810 -5.618 1.00 0.00 H new ATOM 0 HA ALA B 610 8.391 6.514 -8.019 1.00 0.00 H new ATOM 0 HB1 ALA B 610 8.294 8.784 -7.046 1.00 0.00 H new ATOM 0 HB2 ALA B 610 7.863 7.534 -5.854 1.00 0.00 H new ATOM 0 HB3 ALA B 610 9.472 8.294 -5.805 1.00 0.00 H new ATOM 1377 N VAL B 611 11.375 7.915 -7.699 1.00 0.00 N ATOM 1378 CA VAL B 611 12.479 8.492 -8.456 1.00 0.00 C ATOM 1379 C VAL B 611 12.915 7.565 -9.586 1.00 0.00 C ATOM 1380 O VAL B 611 13.273 8.019 -10.672 1.00 0.00 O ATOM 1381 CB VAL B 611 13.690 8.781 -7.549 1.00 0.00 C ATOM 1382 CG1 VAL B 611 14.826 9.393 -8.355 1.00 0.00 C ATOM 1383 CG2 VAL B 611 13.288 9.694 -6.401 1.00 0.00 C ATOM 0 H VAL B 611 11.516 7.905 -6.689 1.00 0.00 H new ATOM 0 HA VAL B 611 12.117 9.430 -8.878 1.00 0.00 H new ATOM 0 HB VAL B 611 14.041 7.839 -7.128 1.00 0.00 H new ATOM 0 HG11 VAL B 611 15.673 9.591 -7.698 1.00 0.00 H new ATOM 0 HG12 VAL B 611 15.129 8.700 -9.140 1.00 0.00 H new ATOM 0 HG13 VAL B 611 14.491 10.327 -8.805 1.00 0.00 H new ATOM 0 HG21 VAL B 611 14.155 9.888 -5.770 1.00 0.00 H new ATOM 0 HG22 VAL B 611 12.911 10.636 -6.800 1.00 0.00 H new ATOM 0 HG23 VAL B 611 12.509 9.213 -5.809 1.00 0.00 H new ATOM 1393 N ALA B 612 12.880 6.263 -9.322 1.00 0.00 N ATOM 1394 CA ALA B 612 13.269 5.271 -10.317 1.00 0.00 C ATOM 1395 C ALA B 612 12.311 5.279 -11.503 1.00 0.00 C ATOM 1396 O ALA B 612 12.732 5.179 -12.655 1.00 0.00 O ATOM 1397 CB ALA B 612 13.323 3.886 -9.689 1.00 0.00 C ATOM 0 H ALA B 612 12.586 5.871 -8.428 1.00 0.00 H new ATOM 0 HA ALA B 612 14.262 5.530 -10.684 1.00 0.00 H new ATOM 0 HB1 ALA B 612 13.615 3.155 -10.444 1.00 0.00 H new ATOM 0 HB2 ALA B 612 14.052 3.882 -8.879 1.00 0.00 H new ATOM 0 HB3 ALA B 612 12.341 3.627 -9.294 1.00 0.00 H new ATOM 1403 N VAL B 613 11.019 5.398 -11.213 1.00 0.00 N ATOM 1404 CA VAL B 613 10.000 5.419 -12.256 1.00 0.00 C ATOM 1405 C VAL B 613 10.157 6.642 -13.153 1.00 0.00 C ATOM 1406 O VAL B 613 10.007 6.554 -14.373 1.00 0.00 O ATOM 1407 CB VAL B 613 8.582 5.415 -11.656 1.00 0.00 C ATOM 1408 CG1 VAL B 613 7.535 5.499 -12.757 1.00 0.00 C ATOM 1409 CG2 VAL B 613 8.369 4.176 -10.799 1.00 0.00 C ATOM 0 H VAL B 613 10.653 5.481 -10.264 1.00 0.00 H new ATOM 0 HA VAL B 613 10.137 4.516 -12.850 1.00 0.00 H new ATOM 0 HB VAL B 613 8.474 6.292 -11.018 1.00 0.00 H new ATOM 0 HG11 VAL B 613 6.539 5.495 -12.313 1.00 0.00 H new ATOM 0 HG12 VAL B 613 7.676 6.419 -13.324 1.00 0.00 H new ATOM 0 HG13 VAL B 613 7.639 4.643 -13.424 1.00 0.00 H new ATOM 0 HG21 VAL B 613 7.362 4.190 -10.383 1.00 0.00 H new ATOM 0 HG22 VAL B 613 8.496 3.284 -11.412 1.00 0.00 H new ATOM 0 HG23 VAL B 613 9.096 4.166 -9.987 1.00 0.00 H new ATOM 1419 N LEU B 614 10.462 7.781 -12.542 1.00 0.00 N ATOM 1420 CA LEU B 614 10.640 9.024 -13.285 1.00 0.00 C ATOM 1421 C LEU B 614 11.620 8.832 -14.439 1.00 0.00 C ATOM 1422 O LEU B 614 11.513 9.492 -15.472 1.00 0.00 O ATOM 1423 CB LEU B 614 11.140 10.130 -12.355 1.00 0.00 C ATOM 1424 CG LEU B 614 10.436 10.239 -11.002 1.00 0.00 C ATOM 1425 CD1 LEU B 614 10.751 11.572 -10.342 1.00 0.00 C ATOM 1426 CD2 LEU B 614 8.933 10.066 -11.168 1.00 0.00 C ATOM 0 H LEU B 614 10.591 7.870 -11.534 1.00 0.00 H new ATOM 0 HA LEU B 614 9.674 9.314 -13.697 1.00 0.00 H new ATOM 0 HB2 LEU B 614 12.204 9.974 -12.177 1.00 0.00 H new ATOM 0 HB3 LEU B 614 11.040 11.084 -12.872 1.00 0.00 H new ATOM 0 HG LEU B 614 10.805 9.442 -10.357 1.00 0.00 H new ATOM 0 HD11 LEU B 614 10.241 11.631 -9.380 1.00 0.00 H new ATOM 0 HD12 LEU B 614 11.827 11.657 -10.188 1.00 0.00 H new ATOM 0 HD13 LEU B 614 10.411 12.385 -10.984 1.00 0.00 H new ATOM 0 HD21 LEU B 614 8.448 10.146 -10.195 1.00 0.00 H new ATOM 0 HD22 LEU B 614 8.548 10.841 -11.831 1.00 0.00 H new ATOM 0 HD23 LEU B 614 8.725 9.086 -11.597 1.00 0.00 H new ATOM 1438 N GLN B 615 12.572 7.923 -14.255 1.00 0.00 N ATOM 1439 CA GLN B 615 13.569 7.644 -15.281 1.00 0.00 C ATOM 1440 C GLN B 615 12.904 7.356 -16.623 1.00 0.00 C ATOM 1441 O GLN B 615 13.471 7.633 -17.680 1.00 0.00 O ATOM 1442 CB GLN B 615 14.441 6.458 -14.866 1.00 0.00 C ATOM 1443 CG GLN B 615 15.553 6.144 -15.854 1.00 0.00 C ATOM 1444 CD GLN B 615 16.696 5.375 -15.222 1.00 0.00 C ATOM 1445 OE1 GLN B 615 16.652 4.148 -15.117 1.00 0.00 O ATOM 1446 NE2 GLN B 615 17.729 6.092 -14.795 1.00 0.00 N ATOM 0 H GLN B 615 12.674 7.368 -13.405 1.00 0.00 H new ATOM 0 HA GLN B 615 14.198 8.528 -15.390 1.00 0.00 H new ATOM 0 HB2 GLN B 615 14.881 6.665 -13.891 1.00 0.00 H new ATOM 0 HB3 GLN B 615 13.810 5.577 -14.750 1.00 0.00 H new ATOM 0 HG2 GLN B 615 15.145 5.565 -16.682 1.00 0.00 H new ATOM 0 HG3 GLN B 615 15.935 7.075 -16.273 1.00 0.00 H new ATOM 0 HE21 GLN B 615 17.725 7.106 -14.902 1.00 0.00 H new ATOM 0 HE22 GLN B 615 18.527 5.628 -14.360 1.00 0.00 H new ATOM 1455 N ALA B 616 11.699 6.798 -16.572 1.00 0.00 N ATOM 1456 CA ALA B 616 10.956 6.474 -17.784 1.00 0.00 C ATOM 1457 C ALA B 616 10.556 7.738 -18.537 1.00 0.00 C ATOM 1458 O ALA B 616 10.554 7.765 -19.768 1.00 0.00 O ATOM 1459 CB ALA B 616 9.724 5.649 -17.442 1.00 0.00 C ATOM 0 H ALA B 616 11.217 6.561 -15.705 1.00 0.00 H new ATOM 0 HA ALA B 616 11.605 5.886 -18.433 1.00 0.00 H new ATOM 0 HB1 ALA B 616 9.178 5.414 -18.356 1.00 0.00 H new ATOM 0 HB2 ALA B 616 10.030 4.724 -16.954 1.00 0.00 H new ATOM 0 HB3 ALA B 616 9.080 6.218 -16.771 1.00 0.00 H new ATOM 1465 N HIS B 617 10.217 8.784 -17.790 1.00 0.00 N ATOM 1466 CA HIS B 617 9.814 10.052 -18.389 1.00 0.00 C ATOM 1467 C HIS B 617 10.973 11.045 -18.387 1.00 0.00 C ATOM 1468 O HIS B 617 11.580 11.305 -19.425 1.00 0.00 O ATOM 1469 CB HIS B 617 8.622 10.641 -17.634 1.00 0.00 C ATOM 1470 CG HIS B 617 8.161 11.959 -18.177 1.00 0.00 C ATOM 1471 ND1 HIS B 617 8.428 12.378 -19.463 1.00 0.00 N ATOM 1472 CD2 HIS B 617 7.445 12.952 -17.600 1.00 0.00 C ATOM 1473 CE1 HIS B 617 7.898 13.573 -19.653 1.00 0.00 C ATOM 1474 NE2 HIS B 617 7.295 13.944 -18.538 1.00 0.00 N ATOM 0 H HIS B 617 10.213 8.779 -16.770 1.00 0.00 H new ATOM 0 HA HIS B 617 9.522 9.862 -19.422 1.00 0.00 H new ATOM 0 HB2 HIS B 617 7.794 9.933 -17.670 1.00 0.00 H new ATOM 0 HB3 HIS B 617 8.891 10.764 -16.585 1.00 0.00 H new ATOM 0 HD2 HIS B 617 7.063 12.962 -16.590 1.00 0.00 H new ATOM 0 HE1 HIS B 617 7.949 14.149 -20.565 1.00 0.00 H new ATOM 0 HE2 HIS B 617 6.799 14.824 -18.397 1.00 0.00 H new ATOM 1482 N GLN B 618 11.271 11.597 -17.215 1.00 0.00 N ATOM 1483 CA GLN B 618 12.355 12.563 -17.080 1.00 0.00 C ATOM 1484 C GLN B 618 12.816 12.665 -15.630 1.00 0.00 C ATOM 1485 O GLN B 618 12.010 12.571 -14.705 1.00 0.00 O ATOM 1486 CB GLN B 618 11.909 13.937 -17.584 1.00 0.00 C ATOM 1487 CG GLN B 618 10.878 14.607 -16.690 1.00 0.00 C ATOM 1488 CD GLN B 618 10.037 15.627 -17.432 1.00 0.00 C ATOM 1489 OE1 GLN B 618 10.126 15.751 -18.654 1.00 0.00 O ATOM 1490 NE2 GLN B 618 9.215 16.365 -16.696 1.00 0.00 N ATOM 0 H GLN B 618 10.778 11.392 -16.346 1.00 0.00 H new ATOM 0 HA GLN B 618 13.193 12.217 -17.685 1.00 0.00 H new ATOM 0 HB2 GLN B 618 12.781 14.585 -17.667 1.00 0.00 H new ATOM 0 HB3 GLN B 618 11.494 13.830 -18.586 1.00 0.00 H new ATOM 0 HG2 GLN B 618 10.225 13.846 -16.261 1.00 0.00 H new ATOM 0 HG3 GLN B 618 11.386 15.096 -15.859 1.00 0.00 H new ATOM 0 HE21 GLN B 618 9.173 16.229 -15.686 1.00 0.00 H new ATOM 0 HE22 GLN B 618 8.625 17.068 -17.140 1.00 0.00 H new ATOM 1499 N ALA B 619 14.117 12.857 -15.440 1.00 0.00 N ATOM 1500 CA ALA B 619 14.684 12.973 -14.102 1.00 0.00 C ATOM 1501 C ALA B 619 15.779 14.034 -14.060 1.00 0.00 C ATOM 1502 O ALA B 619 16.965 13.714 -13.975 1.00 0.00 O ATOM 1503 CB ALA B 619 15.230 11.630 -13.642 1.00 0.00 C ATOM 0 H ALA B 619 14.798 12.935 -16.195 1.00 0.00 H new ATOM 0 HA ALA B 619 13.889 13.281 -13.423 1.00 0.00 H new ATOM 0 HB1 ALA B 619 15.650 11.732 -12.641 1.00 0.00 H new ATOM 0 HB2 ALA B 619 14.424 10.896 -13.624 1.00 0.00 H new ATOM 0 HB3 ALA B 619 16.008 11.298 -14.330 1.00 0.00 H new ATOM 1509 N LYS B 620 15.375 15.298 -14.123 1.00 0.00 N ATOM 1510 CA LYS B 620 16.321 16.407 -14.091 1.00 0.00 C ATOM 1511 C LYS B 620 17.402 16.230 -15.153 1.00 0.00 C ATOM 1512 O LYS B 620 18.530 16.690 -14.985 1.00 0.00 O ATOM 1513 CB LYS B 620 16.964 16.517 -12.707 1.00 0.00 C ATOM 1514 CG LYS B 620 15.959 16.680 -11.580 1.00 0.00 C ATOM 1515 CD LYS B 620 15.060 17.884 -11.805 1.00 0.00 C ATOM 1516 CE LYS B 620 15.863 19.176 -11.856 1.00 0.00 C ATOM 1517 NZ LYS B 620 16.546 19.456 -10.563 1.00 0.00 N ATOM 0 H LYS B 620 14.398 15.580 -14.197 1.00 0.00 H new ATOM 0 HA LYS B 620 15.773 17.325 -14.304 1.00 0.00 H new ATOM 0 HB2 LYS B 620 17.563 15.625 -12.522 1.00 0.00 H new ATOM 0 HB3 LYS B 620 17.647 17.367 -12.699 1.00 0.00 H new ATOM 0 HG2 LYS B 620 15.350 15.780 -11.501 1.00 0.00 H new ATOM 0 HG3 LYS B 620 16.487 16.791 -10.633 1.00 0.00 H new ATOM 0 HD2 LYS B 620 14.509 17.759 -12.737 1.00 0.00 H new ATOM 0 HD3 LYS B 620 14.322 17.944 -11.005 1.00 0.00 H new ATOM 0 HE2 LYS B 620 16.605 19.111 -12.652 1.00 0.00 H new ATOM 0 HE3 LYS B 620 15.201 20.006 -12.104 1.00 0.00 H new ATOM 0 HZ1 LYS B 620 16.925 20.424 -10.573 1.00 0.00 H new ATOM 0 HZ2 LYS B 620 15.865 19.359 -9.783 1.00 0.00 H new ATOM 0 HZ3 LYS B 620 17.325 18.781 -10.429 1.00 0.00 H new ATOM 1531 N GLU B 621 17.048 15.561 -16.246 1.00 0.00 N ATOM 1532 CA GLU B 621 17.989 15.325 -17.335 1.00 0.00 C ATOM 1533 C GLU B 621 17.626 16.161 -18.559 1.00 0.00 C ATOM 1534 O GLU B 621 17.398 15.626 -19.643 1.00 0.00 O ATOM 1535 CB GLU B 621 18.011 13.840 -17.706 1.00 0.00 C ATOM 1536 CG GLU B 621 18.753 12.973 -16.703 1.00 0.00 C ATOM 1537 CD GLU B 621 18.936 11.548 -17.187 1.00 0.00 C ATOM 1538 OE1 GLU B 621 18.959 11.337 -18.417 1.00 0.00 O ATOM 1539 OE2 GLU B 621 19.058 10.643 -16.334 1.00 0.00 O ATOM 0 H GLU B 621 16.117 15.173 -16.401 1.00 0.00 H new ATOM 0 HA GLU B 621 18.981 15.622 -16.995 1.00 0.00 H new ATOM 0 HB2 GLU B 621 16.986 13.481 -17.795 1.00 0.00 H new ATOM 0 HB3 GLU B 621 18.475 13.726 -18.686 1.00 0.00 H new ATOM 0 HG2 GLU B 621 19.730 13.412 -16.501 1.00 0.00 H new ATOM 0 HG3 GLU B 621 18.206 12.965 -15.760 1.00 0.00 H new ATOM 1546 N ALA B 622 17.574 17.476 -18.375 1.00 0.00 N ATOM 1547 CA ALA B 622 17.240 18.387 -19.463 1.00 0.00 C ATOM 1548 C ALA B 622 18.380 19.364 -19.729 1.00 0.00 C ATOM 1549 O ALA B 622 18.675 20.227 -18.903 1.00 0.00 O ATOM 1550 CB ALA B 622 15.958 19.141 -19.145 1.00 0.00 C ATOM 0 H ALA B 622 17.759 17.934 -17.483 1.00 0.00 H new ATOM 0 HA ALA B 622 17.085 17.796 -20.366 1.00 0.00 H new ATOM 0 HB1 ALA B 622 15.721 19.818 -19.966 1.00 0.00 H new ATOM 0 HB2 ALA B 622 15.142 18.431 -19.012 1.00 0.00 H new ATOM 0 HB3 ALA B 622 16.092 19.716 -18.228 1.00 0.00 H new ATOM 1556 N ALA B 623 19.017 19.223 -20.887 1.00 0.00 N ATOM 1557 CA ALA B 623 20.123 20.095 -21.262 1.00 0.00 C ATOM 1558 C ALA B 623 19.621 21.334 -21.995 1.00 0.00 C ATOM 1559 O ALA B 623 19.587 21.368 -23.226 1.00 0.00 O ATOM 1560 CB ALA B 623 21.122 19.338 -22.125 1.00 0.00 C ATOM 0 H ALA B 623 18.786 18.513 -21.582 1.00 0.00 H new ATOM 0 HA ALA B 623 20.621 20.422 -20.349 1.00 0.00 H new ATOM 0 HB1 ALA B 623 21.943 20.001 -22.398 1.00 0.00 H new ATOM 0 HB2 ALA B 623 21.513 18.487 -21.567 1.00 0.00 H new ATOM 0 HB3 ALA B 623 20.627 18.983 -23.029 1.00 0.00 H new TER 1566 ALA B 623