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= 0 X(o=0,f=0) USER MOD Single : A 70 ASN : amide:sc= -1.24 K(o=-1.2,f=-6.8!) USER MOD Single : A 72 ASN : amide:sc= -0.922 K(o=-0.92,f=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= -0.0992 X(o=-0.099,f=-0.003) USER MOD Single : A 81 HIS : no HD1:sc=-0.00178 X(o=-0.0018,f=-0.12) USER MOD Single : B 542 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 546 THR OG1 : rot 180:sc= 0 USER MOD Single : B 548 SER OG : rot 180:sc= 0 USER MOD Single : B 549 MET CE :methyl -135:sc= -1.7! (180deg=-2.8!) USER MOD Single : B 552 SER OG : rot -52:sc= 0.617 USER MOD Single : B 556 GLN : amide:sc= -0.805 K(o=-0.8,f=-6!) USER MOD Single : B 558 GLN : amide:sc= -1.7 K(o=-1.7,f=-3.4!) USER MOD Single : B 559 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 560 GLN : amide:sc= -0.733 K(o=-0.73,f=-0.11) USER MOD Single : B 561 MET CE :methyl -113:sc= -1.45 (180deg=-2.35) USER MOD Single : B 571 GLN : amide:sc= -1.59 K(o=-1.6,f=-2.4!) USER MOD Single : B 573 MET CE :methyl -141:sc= -2.77 (180deg=-7.31!) USER MOD Single : B 574 HIS : no HD1:sc= -6.17! C(o=-6.2!,f=-6.9!) USER MOD Single : B 576 THR OG1 : rot 180:sc= -0.7 USER MOD Single : B 580 LYS NZ :NH3+ 173:sc= -0.353 (180deg=-0.359) USER MOD Single : B 582 THR OG1 : rot 180:sc= -0.416 USER MOD Single : B 584 MET CE :methyl 158:sc= -10.5! (180deg=-11.8!) USER MOD Single : B 590 ASN : amide:sc= -0.983 K(o=-0.98,f=-3.3!) USER MOD Single : B 591 SER OG : rot 180:sc= 0 USER MOD Single : B 595 HIS : no HE2:sc= 0.224 K(o=0.22,f=-1.4) USER MOD Single : B 596 MET CE :methyl -167:sc= -2.52! (180deg=-3.48) USER MOD Single : B 599 SER OG : rot 47:sc= 0.026 USER MOD Single : B 602 SER OG : rot 90:sc= -1.18 USER MOD Single : B 605 SER OG : rot 180:sc= 0 USER MOD Single : B 606 LYS NZ :NH3+ -177:sc= -0.686 (180deg=-0.706) USER MOD Single : B 615 GLN : amide:sc= -0.465 X(o=-0.47,f=-0.6) USER MOD Single : B 617 HIS : no HD1:sc= -0.157 K(o=-0.16,f=-0.8) USER MOD Single : B 618 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : B 620 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 64 5.649 -0.206 -5.032 1.00 0.00 N ATOM 2 CA ALA A 64 4.386 0.368 -4.586 1.00 0.00 C ATOM 3 C ALA A 64 3.316 -0.709 -4.436 1.00 0.00 C ATOM 4 O ALA A 64 2.582 -0.735 -3.447 1.00 0.00 O ATOM 5 CB ALA A 64 3.922 1.443 -5.558 1.00 0.00 C ATOM 0 HA ALA A 64 4.547 0.822 -3.608 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.977 1.863 -5.212 1.00 0.00 H new ATOM 0 HB2 ALA A 64 4.672 2.232 -5.613 1.00 0.00 H new ATOM 0 HB3 ALA A 64 3.784 1.005 -6.546 1.00 0.00 H new ATOM 11 N PHE A 65 3.233 -1.595 -5.422 1.00 0.00 N ATOM 12 CA PHE A 65 2.251 -2.673 -5.400 1.00 0.00 C ATOM 13 C PHE A 65 2.925 -4.027 -5.604 1.00 0.00 C ATOM 14 O PHE A 65 2.922 -4.875 -4.712 1.00 0.00 O ATOM 15 CB PHE A 65 1.192 -2.450 -6.482 1.00 0.00 C ATOM 16 CG PHE A 65 1.015 -1.007 -6.858 1.00 0.00 C ATOM 17 CD1 PHE A 65 1.813 -0.428 -7.832 1.00 0.00 C ATOM 18 CD2 PHE A 65 0.051 -0.228 -6.238 1.00 0.00 C ATOM 19 CE1 PHE A 65 1.652 0.899 -8.182 1.00 0.00 C ATOM 20 CE2 PHE A 65 -0.114 1.100 -6.583 1.00 0.00 C ATOM 21 CZ PHE A 65 0.688 1.665 -7.555 1.00 0.00 C ATOM 0 H PHE A 65 3.834 -1.588 -6.246 1.00 0.00 H new ATOM 0 HA PHE A 65 1.768 -2.670 -4.423 1.00 0.00 H new ATOM 0 HB2 PHE A 65 1.467 -3.018 -7.371 1.00 0.00 H new ATOM 0 HB3 PHE A 65 0.238 -2.846 -6.133 1.00 0.00 H new ATOM 0 HD1 PHE A 65 2.570 -1.021 -8.323 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -0.579 -0.664 -5.476 1.00 0.00 H new ATOM 0 HE1 PHE A 65 2.279 1.337 -8.945 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -0.870 1.696 -6.093 1.00 0.00 H new ATOM 0 HZ PHE A 65 0.562 2.703 -7.824 1.00 0.00 H new ATOM 31 N SER A 66 3.502 -4.222 -6.785 1.00 0.00 N ATOM 32 CA SER A 66 4.176 -5.473 -7.110 1.00 0.00 C ATOM 33 C SER A 66 5.660 -5.237 -7.378 1.00 0.00 C ATOM 34 O SER A 66 6.503 -6.066 -7.035 1.00 0.00 O ATOM 35 CB SER A 66 3.524 -6.128 -8.329 1.00 0.00 C ATOM 36 OG SER A 66 2.413 -6.921 -7.948 1.00 0.00 O ATOM 0 H SER A 66 3.516 -3.529 -7.533 1.00 0.00 H new ATOM 0 HA SER A 66 4.080 -6.141 -6.254 1.00 0.00 H new ATOM 0 HB2 SER A 66 3.202 -5.359 -9.031 1.00 0.00 H new ATOM 0 HB3 SER A 66 4.256 -6.747 -8.848 1.00 0.00 H new ATOM 0 HG SER A 66 2.013 -7.327 -8.745 1.00 0.00 H new ATOM 42 N ARG A 67 5.970 -4.101 -7.993 1.00 0.00 N ATOM 43 CA ARG A 67 7.350 -3.755 -8.309 1.00 0.00 C ATOM 44 C ARG A 67 7.475 -2.274 -8.655 1.00 0.00 C ATOM 45 O ARG A 67 7.971 -1.481 -7.856 1.00 0.00 O ATOM 46 CB ARG A 67 7.857 -4.606 -9.475 1.00 0.00 C ATOM 47 CG ARG A 67 9.246 -4.217 -9.955 1.00 0.00 C ATOM 48 CD ARG A 67 9.810 -5.245 -10.922 1.00 0.00 C ATOM 49 NE ARG A 67 11.238 -5.050 -11.157 1.00 0.00 N ATOM 50 CZ ARG A 67 12.042 -5.997 -11.629 1.00 0.00 C ATOM 51 NH1 ARG A 67 11.559 -7.199 -11.914 1.00 0.00 N ATOM 52 NH2 ARG A 67 13.331 -5.744 -11.816 1.00 0.00 N ATOM 0 H ARG A 67 5.284 -3.404 -8.283 1.00 0.00 H new ATOM 0 HA ARG A 67 7.959 -3.957 -7.428 1.00 0.00 H new ATOM 0 HB2 ARG A 67 7.867 -5.653 -9.172 1.00 0.00 H new ATOM 0 HB3 ARG A 67 7.158 -4.521 -10.307 1.00 0.00 H new ATOM 0 HG2 ARG A 67 9.204 -3.243 -10.442 1.00 0.00 H new ATOM 0 HG3 ARG A 67 9.913 -4.117 -9.099 1.00 0.00 H new ATOM 0 HD2 ARG A 67 9.641 -6.246 -10.526 1.00 0.00 H new ATOM 0 HD3 ARG A 67 9.275 -5.183 -11.870 1.00 0.00 H new ATOM 0 HE ARG A 67 11.641 -4.137 -10.947 1.00 0.00 H new ATOM 0 HH11 ARG A 67 10.569 -7.398 -11.771 1.00 0.00 H new ATOM 0 HH12 ARG A 67 12.178 -7.925 -12.276 1.00 0.00 H new ATOM 0 HH21 ARG A 67 13.707 -4.821 -11.597 1.00 0.00 H new ATOM 0 HH22 ARG A 67 13.946 -6.472 -12.178 1.00 0.00 H new ATOM 66 N GLN A 68 7.021 -1.911 -9.850 1.00 0.00 N ATOM 67 CA GLN A 68 7.083 -0.526 -10.302 1.00 0.00 C ATOM 68 C GLN A 68 5.691 0.096 -10.343 1.00 0.00 C ATOM 69 O GLN A 68 4.683 -0.612 -10.348 1.00 0.00 O ATOM 70 CB GLN A 68 7.732 -0.446 -11.685 1.00 0.00 C ATOM 71 CG GLN A 68 8.085 0.970 -12.110 1.00 0.00 C ATOM 72 CD GLN A 68 8.912 1.008 -13.381 1.00 0.00 C ATOM 73 OE1 GLN A 68 10.133 1.153 -13.336 1.00 0.00 O ATOM 74 NE2 GLN A 68 8.247 0.878 -14.523 1.00 0.00 N ATOM 0 H GLN A 68 6.606 -2.556 -10.522 1.00 0.00 H new ATOM 0 HA GLN A 68 7.691 0.034 -9.591 1.00 0.00 H new ATOM 0 HB2 GLN A 68 8.637 -1.054 -11.688 1.00 0.00 H new ATOM 0 HB3 GLN A 68 7.054 -0.879 -12.421 1.00 0.00 H new ATOM 0 HG2 GLN A 68 7.168 1.540 -12.260 1.00 0.00 H new ATOM 0 HG3 GLN A 68 8.636 1.460 -11.307 1.00 0.00 H new ATOM 0 HE21 GLN A 68 7.234 0.760 -14.513 1.00 0.00 H new ATOM 0 HE22 GLN A 68 8.749 0.896 -15.411 1.00 0.00 H new ATOM 83 N LEU A 69 5.642 1.423 -10.372 1.00 0.00 N ATOM 84 CA LEU A 69 4.373 2.141 -10.413 1.00 0.00 C ATOM 85 C LEU A 69 4.272 2.998 -11.671 1.00 0.00 C ATOM 86 O LEU A 69 5.163 2.979 -12.520 1.00 0.00 O ATOM 87 CB LEU A 69 4.221 3.020 -9.170 1.00 0.00 C ATOM 88 CG LEU A 69 5.438 3.864 -8.792 1.00 0.00 C ATOM 89 CD1 LEU A 69 5.512 5.112 -9.659 1.00 0.00 C ATOM 90 CD2 LEU A 69 5.391 4.238 -7.318 1.00 0.00 C ATOM 0 H LEU A 69 6.466 2.024 -10.368 1.00 0.00 H new ATOM 0 HA LEU A 69 3.569 1.406 -10.431 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.374 3.689 -9.324 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.972 2.379 -8.324 1.00 0.00 H new ATOM 0 HG LEU A 69 6.336 3.271 -8.967 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.385 5.701 -9.376 1.00 0.00 H new ATOM 0 HD12 LEU A 69 5.594 4.823 -10.707 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.611 5.708 -9.517 1.00 0.00 H new ATOM 0 HD21 LEU A 69 6.265 4.839 -7.067 1.00 0.00 H new ATOM 0 HD22 LEU A 69 4.486 4.812 -7.117 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.388 3.332 -6.713 1.00 0.00 H new ATOM 102 N ASN A 70 3.183 3.751 -11.782 1.00 0.00 N ATOM 103 CA ASN A 70 2.966 4.617 -12.936 1.00 0.00 C ATOM 104 C ASN A 70 3.506 6.020 -12.672 1.00 0.00 C ATOM 105 O ASN A 70 3.322 6.573 -11.588 1.00 0.00 O ATOM 106 CB ASN A 70 1.476 4.687 -13.275 1.00 0.00 C ATOM 107 CG ASN A 70 1.169 5.745 -14.317 1.00 0.00 C ATOM 108 OD1 ASN A 70 1.833 5.824 -15.351 1.00 0.00 O ATOM 109 ND2 ASN A 70 0.160 6.565 -14.049 1.00 0.00 N ATOM 0 H ASN A 70 2.437 3.779 -11.087 1.00 0.00 H new ATOM 0 HA ASN A 70 3.504 4.193 -13.784 1.00 0.00 H new ATOM 0 HB2 ASN A 70 1.143 3.715 -13.639 1.00 0.00 H new ATOM 0 HB3 ASN A 70 0.909 4.899 -12.368 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -0.092 7.297 -14.713 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -0.363 6.463 -13.179 1.00 0.00 H new ATOM 116 N VAL A 71 4.172 6.590 -13.671 1.00 0.00 N ATOM 117 CA VAL A 71 4.737 7.928 -13.548 1.00 0.00 C ATOM 118 C VAL A 71 3.756 8.986 -14.043 1.00 0.00 C ATOM 119 O VAL A 71 3.871 10.161 -13.699 1.00 0.00 O ATOM 120 CB VAL A 71 6.054 8.056 -14.336 1.00 0.00 C ATOM 121 CG1 VAL A 71 5.834 7.720 -15.803 1.00 0.00 C ATOM 122 CG2 VAL A 71 6.633 9.454 -14.182 1.00 0.00 C ATOM 0 H VAL A 71 4.333 6.146 -14.575 1.00 0.00 H new ATOM 0 HA VAL A 71 4.939 8.090 -12.489 1.00 0.00 H new ATOM 0 HB VAL A 71 6.771 7.343 -13.929 1.00 0.00 H new ATOM 0 HG11 VAL A 71 6.776 7.816 -16.343 1.00 0.00 H new ATOM 0 HG12 VAL A 71 5.468 6.697 -15.891 1.00 0.00 H new ATOM 0 HG13 VAL A 71 5.101 8.406 -16.227 1.00 0.00 H new ATOM 0 HG21 VAL A 71 7.563 9.527 -14.745 1.00 0.00 H new ATOM 0 HG22 VAL A 71 5.921 10.187 -14.562 1.00 0.00 H new ATOM 0 HG23 VAL A 71 6.830 9.652 -13.128 1.00 0.00 H new ATOM 132 N ASN A 72 2.792 8.559 -14.852 1.00 0.00 N ATOM 133 CA ASN A 72 1.791 9.469 -15.395 1.00 0.00 C ATOM 134 C ASN A 72 0.844 9.952 -14.300 1.00 0.00 C ATOM 135 O ASN A 72 0.136 10.944 -14.471 1.00 0.00 O ATOM 136 CB ASN A 72 0.995 8.782 -16.506 1.00 0.00 C ATOM 137 CG ASN A 72 1.621 8.981 -17.873 1.00 0.00 C ATOM 138 OD1 ASN A 72 0.936 9.326 -18.837 1.00 0.00 O ATOM 139 ND2 ASN A 72 2.927 8.763 -17.963 1.00 0.00 N ATOM 0 H ASN A 72 2.683 7.588 -15.146 1.00 0.00 H new ATOM 0 HA ASN A 72 2.310 10.333 -15.810 1.00 0.00 H new ATOM 0 HB2 ASN A 72 0.925 7.715 -16.293 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -0.023 9.172 -16.515 1.00 0.00 H new ATOM 0 HD21 ASN A 72 3.403 8.880 -18.857 1.00 0.00 H new ATOM 0 HD22 ASN A 72 3.455 8.478 -17.138 1.00 0.00 H new ATOM 146 N ALA A 73 0.839 9.244 -13.175 1.00 0.00 N ATOM 147 CA ALA A 73 -0.018 9.602 -12.052 1.00 0.00 C ATOM 148 C ALA A 73 0.150 11.070 -11.679 1.00 0.00 C ATOM 149 O ALA A 73 1.229 11.498 -11.266 1.00 0.00 O ATOM 150 CB ALA A 73 0.284 8.713 -10.854 1.00 0.00 C ATOM 0 H ALA A 73 1.419 8.420 -13.018 1.00 0.00 H new ATOM 0 HA ALA A 73 -1.054 9.448 -12.354 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -0.363 8.991 -10.022 1.00 0.00 H new ATOM 0 HB2 ALA A 73 0.106 7.671 -11.120 1.00 0.00 H new ATOM 0 HB3 ALA A 73 1.326 8.839 -10.561 1.00 0.00 H new ATOM 156 N LYS A 74 -0.922 11.841 -11.827 1.00 0.00 N ATOM 157 CA LYS A 74 -0.894 13.262 -11.505 1.00 0.00 C ATOM 158 C LYS A 74 -0.340 13.492 -10.102 1.00 0.00 C ATOM 159 O LYS A 74 -0.317 12.592 -9.263 1.00 0.00 O ATOM 160 CB LYS A 74 -2.300 13.858 -11.613 1.00 0.00 C ATOM 161 CG LYS A 74 -2.597 14.473 -12.970 1.00 0.00 C ATOM 162 CD LYS A 74 -4.080 14.757 -13.141 1.00 0.00 C ATOM 163 CE LYS A 74 -4.374 15.392 -14.491 1.00 0.00 C ATOM 164 NZ LYS A 74 -4.141 16.863 -14.474 1.00 0.00 N ATOM 0 H LYS A 74 -1.822 11.504 -12.169 1.00 0.00 H new ATOM 0 HA LYS A 74 -0.239 13.758 -12.221 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -3.033 13.078 -11.409 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -2.423 14.620 -10.843 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -2.033 15.399 -13.082 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -2.262 13.798 -13.758 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -4.643 13.829 -13.044 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -4.419 15.420 -12.345 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -3.744 14.933 -15.253 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -5.409 15.191 -14.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -4.352 17.259 -15.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -4.760 17.304 -13.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -3.147 17.054 -14.233 1.00 0.00 H new ATOM 178 N PRO A 75 0.116 14.726 -9.840 1.00 0.00 N ATOM 179 CA PRO A 75 0.677 15.103 -8.539 1.00 0.00 C ATOM 180 C PRO A 75 -0.383 15.156 -7.445 1.00 0.00 C ATOM 181 O PRO A 75 -0.634 14.163 -6.761 1.00 0.00 O ATOM 182 CB PRO A 75 1.254 16.497 -8.793 1.00 0.00 C ATOM 183 CG PRO A 75 0.463 17.034 -9.935 1.00 0.00 C ATOM 184 CD PRO A 75 0.119 15.848 -10.794 1.00 0.00 C ATOM 0 HA PRO A 75 1.413 14.380 -8.187 1.00 0.00 H new ATOM 0 HB2 PRO A 75 1.158 17.132 -7.912 1.00 0.00 H new ATOM 0 HB3 PRO A 75 2.316 16.448 -9.036 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -0.438 17.536 -9.584 1.00 0.00 H new ATOM 0 HG3 PRO A 75 1.039 17.769 -10.497 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -0.851 15.969 -11.276 1.00 0.00 H new ATOM 0 HD3 PRO A 75 0.852 15.700 -11.587 1.00 0.00 H new ATOM 192 N PHE A 76 -1.003 16.320 -7.284 1.00 0.00 N ATOM 193 CA PHE A 76 -2.037 16.503 -6.271 1.00 0.00 C ATOM 194 C PHE A 76 -2.714 17.862 -6.424 1.00 0.00 C ATOM 195 O PHE A 76 -2.518 18.557 -7.421 1.00 0.00 O ATOM 196 CB PHE A 76 -1.436 16.374 -4.870 1.00 0.00 C ATOM 197 CG PHE A 76 -0.458 17.463 -4.535 1.00 0.00 C ATOM 198 CD1 PHE A 76 0.765 17.537 -5.184 1.00 0.00 C ATOM 199 CD2 PHE A 76 -0.760 18.412 -3.572 1.00 0.00 C ATOM 200 CE1 PHE A 76 1.667 18.538 -4.876 1.00 0.00 C ATOM 201 CE2 PHE A 76 0.139 19.415 -3.261 1.00 0.00 C ATOM 202 CZ PHE A 76 1.354 19.479 -3.915 1.00 0.00 C ATOM 0 H PHE A 76 -0.808 17.151 -7.842 1.00 0.00 H new ATOM 0 HA PHE A 76 -2.788 15.725 -6.409 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -2.241 16.381 -4.136 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -0.936 15.409 -4.785 1.00 0.00 H new ATOM 0 HD1 PHE A 76 1.015 16.805 -5.938 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -1.709 18.368 -3.058 1.00 0.00 H new ATOM 0 HE1 PHE A 76 2.617 18.584 -5.387 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -0.108 20.148 -2.507 1.00 0.00 H new ATOM 0 HZ PHE A 76 2.057 20.263 -3.675 1.00 0.00 H new ATOM 212 N VAL A 77 -3.512 18.234 -5.428 1.00 0.00 N ATOM 213 CA VAL A 77 -4.218 19.509 -5.450 1.00 0.00 C ATOM 214 C VAL A 77 -3.648 20.471 -4.414 1.00 0.00 C ATOM 215 O VAL A 77 -4.173 20.616 -3.310 1.00 0.00 O ATOM 216 CB VAL A 77 -5.724 19.322 -5.187 1.00 0.00 C ATOM 217 CG1 VAL A 77 -6.413 18.746 -6.414 1.00 0.00 C ATOM 218 CG2 VAL A 77 -5.945 18.431 -3.974 1.00 0.00 C ATOM 0 H VAL A 77 -3.685 17.670 -4.596 1.00 0.00 H new ATOM 0 HA VAL A 77 -4.080 19.929 -6.446 1.00 0.00 H new ATOM 0 HB VAL A 77 -6.163 20.298 -4.978 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -7.476 18.621 -6.209 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -6.283 19.425 -7.257 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.974 17.778 -6.657 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -7.014 18.309 -3.802 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -5.493 17.455 -4.152 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.487 18.889 -3.098 1.00 0.00 H new ATOM 228 N PRO A 78 -2.546 21.145 -4.775 1.00 0.00 N ATOM 229 CA PRO A 78 -1.881 22.107 -3.891 1.00 0.00 C ATOM 230 C PRO A 78 -2.707 23.372 -3.684 1.00 0.00 C ATOM 231 O PRO A 78 -3.784 23.521 -4.258 1.00 0.00 O ATOM 232 CB PRO A 78 -0.582 22.431 -4.633 1.00 0.00 C ATOM 233 CG PRO A 78 -0.888 22.165 -6.067 1.00 0.00 C ATOM 234 CD PRO A 78 -1.866 21.022 -6.076 1.00 0.00 C ATOM 0 HA PRO A 78 -1.727 21.702 -2.891 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -0.285 23.468 -4.477 1.00 0.00 H new ATOM 0 HB3 PRO A 78 0.241 21.808 -4.282 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -1.314 23.047 -6.545 1.00 0.00 H new ATOM 0 HG3 PRO A 78 0.017 21.909 -6.618 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -2.569 21.101 -6.906 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -1.361 20.061 -6.176 1.00 0.00 H new ATOM 242 N ASN A 79 -2.193 24.280 -2.860 1.00 0.00 N ATOM 243 CA ASN A 79 -2.884 25.533 -2.577 1.00 0.00 C ATOM 244 C ASN A 79 -2.160 26.710 -3.223 1.00 0.00 C ATOM 245 O ASN A 79 -2.029 27.777 -2.623 1.00 0.00 O ATOM 246 CB ASN A 79 -2.990 25.751 -1.067 1.00 0.00 C ATOM 247 CG ASN A 79 -4.140 26.666 -0.694 1.00 0.00 C ATOM 248 OD1 ASN A 79 -3.938 27.723 -0.096 1.00 0.00 O ATOM 249 ND2 ASN A 79 -5.355 26.264 -1.047 1.00 0.00 N ATOM 0 H ASN A 79 -1.301 24.172 -2.377 1.00 0.00 H new ATOM 0 HA ASN A 79 -3.887 25.470 -2.999 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -3.120 24.789 -0.572 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -2.057 26.176 -0.698 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -6.167 26.839 -0.824 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -5.476 25.380 -1.542 1.00 0.00 H new ATOM 256 N VAL A 80 -1.694 26.510 -4.452 1.00 0.00 N ATOM 257 CA VAL A 80 -0.985 27.555 -5.181 1.00 0.00 C ATOM 258 C VAL A 80 -1.840 28.111 -6.314 1.00 0.00 C ATOM 259 O VAL A 80 -2.175 27.398 -7.261 1.00 0.00 O ATOM 260 CB VAL A 80 0.342 27.033 -5.763 1.00 0.00 C ATOM 261 CG1 VAL A 80 1.091 28.150 -6.472 1.00 0.00 C ATOM 262 CG2 VAL A 80 1.199 26.418 -4.666 1.00 0.00 C ATOM 0 H VAL A 80 -1.795 25.633 -4.964 1.00 0.00 H new ATOM 0 HA VAL A 80 -0.772 28.350 -4.466 1.00 0.00 H new ATOM 0 HB VAL A 80 0.117 26.258 -6.495 1.00 0.00 H new ATOM 0 HG11 VAL A 80 2.026 27.762 -6.876 1.00 0.00 H new ATOM 0 HG12 VAL A 80 0.478 28.540 -7.285 1.00 0.00 H new ATOM 0 HG13 VAL A 80 1.307 28.950 -5.764 1.00 0.00 H new ATOM 0 HG21 VAL A 80 2.133 26.054 -5.095 1.00 0.00 H new ATOM 0 HG22 VAL A 80 1.416 27.171 -3.909 1.00 0.00 H new ATOM 0 HG23 VAL A 80 0.662 25.587 -4.208 1.00 0.00 H new ATOM 272 N HIS A 81 -2.191 29.389 -6.211 1.00 0.00 N ATOM 273 CA HIS A 81 -3.007 30.042 -7.228 1.00 0.00 C ATOM 274 C HIS A 81 -2.195 31.087 -7.988 1.00 0.00 C ATOM 275 O HIS A 81 -1.915 30.926 -9.175 1.00 0.00 O ATOM 276 CB HIS A 81 -4.231 30.698 -6.587 1.00 0.00 C ATOM 277 CG HIS A 81 -5.354 30.936 -7.548 1.00 0.00 C ATOM 278 ND1 HIS A 81 -5.935 29.931 -8.292 1.00 0.00 N ATOM 279 CD2 HIS A 81 -6.006 32.075 -7.883 1.00 0.00 C ATOM 280 CE1 HIS A 81 -6.893 30.441 -9.045 1.00 0.00 C ATOM 281 NE2 HIS A 81 -6.958 31.740 -8.815 1.00 0.00 N ATOM 0 H HIS A 81 -1.923 29.993 -5.434 1.00 0.00 H new ATOM 0 HA HIS A 81 -3.340 29.282 -7.934 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -4.587 30.066 -5.773 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -3.934 31.649 -6.145 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -5.813 33.063 -7.491 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -7.517 29.889 -9.732 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -7.609 32.389 -9.257 1.00 0.00 H new ATOM 289 N ALA A 82 -1.821 32.157 -7.295 1.00 0.00 N ATOM 290 CA ALA A 82 -1.040 33.227 -7.903 1.00 0.00 C ATOM 291 C ALA A 82 0.426 33.138 -7.495 1.00 0.00 C ATOM 292 O ALA A 82 1.298 33.260 -8.354 1.00 0.00 O ATOM 293 CB ALA A 82 -1.615 34.583 -7.521 1.00 0.00 C ATOM 0 H ALA A 82 -2.046 32.306 -6.311 1.00 0.00 H new ATOM 0 HA ALA A 82 -1.096 33.113 -8.986 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -1.022 35.373 -7.982 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -2.645 34.653 -7.870 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -1.590 34.696 -6.437 1.00 0.00 H new TER 299 ALA A 82 ATOM 300 N GLY B 541 9.855 18.811 14.417 1.00 0.00 N ATOM 301 CA GLY B 541 10.060 19.930 15.319 1.00 0.00 C ATOM 302 C GLY B 541 9.006 19.998 16.407 1.00 0.00 C ATOM 303 O GLY B 541 9.332 20.067 17.591 1.00 0.00 O ATOM 0 HA2 GLY B 541 11.046 19.848 15.777 1.00 0.00 H new ATOM 0 HA3 GLY B 541 10.050 20.859 14.749 1.00 0.00 H new ATOM 307 N GLN B 542 7.739 19.980 16.003 1.00 0.00 N ATOM 308 CA GLN B 542 6.635 20.042 16.953 1.00 0.00 C ATOM 309 C GLN B 542 5.297 19.852 16.246 1.00 0.00 C ATOM 310 O GLN B 542 5.106 20.319 15.124 1.00 0.00 O ATOM 311 CB GLN B 542 6.647 21.380 17.695 1.00 0.00 C ATOM 312 CG GLN B 542 6.750 21.238 19.205 1.00 0.00 C ATOM 313 CD GLN B 542 6.108 22.395 19.945 1.00 0.00 C ATOM 314 OE1 GLN B 542 6.788 23.328 20.372 1.00 0.00 O ATOM 315 NE2 GLN B 542 4.790 22.340 20.099 1.00 0.00 N ATOM 0 H GLN B 542 7.453 19.923 15.026 1.00 0.00 H new ATOM 0 HA GLN B 542 6.763 19.234 17.673 1.00 0.00 H new ATOM 0 HB2 GLN B 542 7.486 21.977 17.337 1.00 0.00 H new ATOM 0 HB3 GLN B 542 5.738 21.929 17.451 1.00 0.00 H new ATOM 0 HG2 GLN B 542 6.274 20.307 19.512 1.00 0.00 H new ATOM 0 HG3 GLN B 542 7.800 21.168 19.489 1.00 0.00 H new ATOM 0 HE21 GLN B 542 4.266 21.547 19.729 1.00 0.00 H new ATOM 0 HE22 GLN B 542 4.302 23.091 20.588 1.00 0.00 H new ATOM 324 N GLU B 543 4.375 19.162 16.910 1.00 0.00 N ATOM 325 CA GLU B 543 3.056 18.909 16.343 1.00 0.00 C ATOM 326 C GLU B 543 3.170 18.306 14.946 1.00 0.00 C ATOM 327 O GLU B 543 2.826 18.931 13.943 1.00 0.00 O ATOM 328 CB GLU B 543 2.244 20.205 16.286 1.00 0.00 C ATOM 329 CG GLU B 543 0.745 19.980 16.184 1.00 0.00 C ATOM 330 CD GLU B 543 0.077 19.870 17.541 1.00 0.00 C ATOM 331 OE1 GLU B 543 0.470 20.622 18.457 1.00 0.00 O ATOM 332 OE2 GLU B 543 -0.837 19.031 17.687 1.00 0.00 O ATOM 0 H GLU B 543 4.517 18.769 17.840 1.00 0.00 H new ATOM 0 HA GLU B 543 2.543 18.195 16.987 1.00 0.00 H new ATOM 0 HB2 GLU B 543 2.454 20.795 17.178 1.00 0.00 H new ATOM 0 HB3 GLU B 543 2.574 20.793 15.430 1.00 0.00 H new ATOM 0 HG2 GLU B 543 0.295 20.802 15.628 1.00 0.00 H new ATOM 0 HG3 GLU B 543 0.556 19.069 15.615 1.00 0.00 H new ATOM 339 N PRO B 544 3.666 17.062 14.878 1.00 0.00 N ATOM 340 CA PRO B 544 3.838 16.346 13.611 1.00 0.00 C ATOM 341 C PRO B 544 2.506 15.955 12.981 1.00 0.00 C ATOM 342 O PRO B 544 1.453 16.070 13.609 1.00 0.00 O ATOM 343 CB PRO B 544 4.628 15.098 14.012 1.00 0.00 C ATOM 344 CG PRO B 544 4.297 14.887 15.449 1.00 0.00 C ATOM 345 CD PRO B 544 4.097 16.258 16.034 1.00 0.00 C ATOM 0 HA PRO B 544 4.337 16.959 12.861 1.00 0.00 H new ATOM 0 HB2 PRO B 544 4.341 14.237 13.409 1.00 0.00 H new ATOM 0 HB3 PRO B 544 5.699 15.244 13.869 1.00 0.00 H new ATOM 0 HG2 PRO B 544 3.397 14.282 15.557 1.00 0.00 H new ATOM 0 HG3 PRO B 544 5.101 14.358 15.961 1.00 0.00 H new ATOM 0 HD2 PRO B 544 3.345 16.253 16.823 1.00 0.00 H new ATOM 0 HD3 PRO B 544 5.016 16.646 16.473 1.00 0.00 H new ATOM 353 N LEU B 545 2.558 15.491 11.737 1.00 0.00 N ATOM 354 CA LEU B 545 1.355 15.081 11.021 1.00 0.00 C ATOM 355 C LEU B 545 0.574 14.043 11.820 1.00 0.00 C ATOM 356 O LEU B 545 1.157 13.203 12.507 1.00 0.00 O ATOM 357 CB LEU B 545 1.722 14.515 9.649 1.00 0.00 C ATOM 358 CG LEU B 545 0.565 14.339 8.664 1.00 0.00 C ATOM 359 CD1 LEU B 545 -0.169 15.656 8.463 1.00 0.00 C ATOM 360 CD2 LEU B 545 1.073 13.802 7.335 1.00 0.00 C ATOM 0 H LEU B 545 3.421 15.389 11.203 1.00 0.00 H new ATOM 0 HA LEU B 545 0.724 15.960 10.887 1.00 0.00 H new ATOM 0 HB2 LEU B 545 2.464 15.172 9.194 1.00 0.00 H new ATOM 0 HB3 LEU B 545 2.200 13.546 9.794 1.00 0.00 H new ATOM 0 HG LEU B 545 -0.135 13.616 9.081 1.00 0.00 H new ATOM 0 HD11 LEU B 545 -0.989 15.512 7.759 1.00 0.00 H new ATOM 0 HD12 LEU B 545 -0.567 16.000 9.418 1.00 0.00 H new ATOM 0 HD13 LEU B 545 0.522 16.401 8.068 1.00 0.00 H new ATOM 0 HD21 LEU B 545 0.236 13.683 6.647 1.00 0.00 H new ATOM 0 HD22 LEU B 545 1.794 14.501 6.912 1.00 0.00 H new ATOM 0 HD23 LEU B 545 1.553 12.836 7.492 1.00 0.00 H new ATOM 372 N THR B 546 -0.751 14.105 11.725 1.00 0.00 N ATOM 373 CA THR B 546 -1.613 13.170 12.438 1.00 0.00 C ATOM 374 C THR B 546 -2.823 12.785 11.594 1.00 0.00 C ATOM 375 O THR B 546 -3.378 13.614 10.874 1.00 0.00 O ATOM 376 CB THR B 546 -2.101 13.762 13.774 1.00 0.00 C ATOM 377 OG1 THR B 546 -3.036 14.819 13.529 1.00 0.00 O ATOM 378 CG2 THR B 546 -0.931 14.293 14.590 1.00 0.00 C ATOM 0 H THR B 546 -1.250 14.793 11.161 1.00 0.00 H new ATOM 0 HA THR B 546 -1.016 12.281 12.640 1.00 0.00 H new ATOM 0 HB THR B 546 -2.589 12.969 14.341 1.00 0.00 H new ATOM 0 HG1 THR B 546 -3.343 15.189 14.383 1.00 0.00 H new ATOM 0 HG21 THR B 546 -1.300 14.706 15.529 1.00 0.00 H new ATOM 0 HG22 THR B 546 -0.235 13.481 14.800 1.00 0.00 H new ATOM 0 HG23 THR B 546 -0.419 15.073 14.027 1.00 0.00 H new ATOM 386 N ALA B 547 -3.226 11.522 11.688 1.00 0.00 N ATOM 387 CA ALA B 547 -4.372 11.028 10.935 1.00 0.00 C ATOM 388 C ALA B 547 -5.635 11.809 11.283 1.00 0.00 C ATOM 389 O ALA B 547 -6.591 11.840 10.508 1.00 0.00 O ATOM 390 CB ALA B 547 -4.577 9.544 11.200 1.00 0.00 C ATOM 0 H ALA B 547 -2.776 10.822 12.278 1.00 0.00 H new ATOM 0 HA ALA B 547 -4.168 11.172 9.874 1.00 0.00 H new ATOM 0 HB1 ALA B 547 -5.436 9.188 10.631 1.00 0.00 H new ATOM 0 HB2 ALA B 547 -3.687 8.994 10.895 1.00 0.00 H new ATOM 0 HB3 ALA B 547 -4.755 9.386 12.264 1.00 0.00 H new ATOM 396 N SER B 548 -5.633 12.438 12.454 1.00 0.00 N ATOM 397 CA SER B 548 -6.781 13.216 12.906 1.00 0.00 C ATOM 398 C SER B 548 -7.048 14.387 11.966 1.00 0.00 C ATOM 399 O SER B 548 -8.191 14.650 11.594 1.00 0.00 O ATOM 400 CB SER B 548 -6.547 13.730 14.328 1.00 0.00 C ATOM 401 OG SER B 548 -6.343 12.658 15.231 1.00 0.00 O ATOM 0 H SER B 548 -4.849 12.424 13.107 1.00 0.00 H new ATOM 0 HA SER B 548 -7.655 12.564 12.902 1.00 0.00 H new ATOM 0 HB2 SER B 548 -5.680 14.390 14.341 1.00 0.00 H new ATOM 0 HB3 SER B 548 -7.404 14.322 14.649 1.00 0.00 H new ATOM 0 HG SER B 548 -6.194 13.013 16.132 1.00 0.00 H new ATOM 407 N MET B 549 -5.984 15.088 11.587 1.00 0.00 N ATOM 408 CA MET B 549 -6.103 16.231 10.690 1.00 0.00 C ATOM 409 C MET B 549 -6.881 15.857 9.433 1.00 0.00 C ATOM 410 O MET B 549 -7.677 16.648 8.925 1.00 0.00 O ATOM 411 CB MET B 549 -4.716 16.753 10.309 1.00 0.00 C ATOM 412 CG MET B 549 -4.100 17.664 11.359 1.00 0.00 C ATOM 413 SD MET B 549 -3.157 19.020 10.636 1.00 0.00 S ATOM 414 CE MET B 549 -2.112 18.130 9.486 1.00 0.00 C ATOM 0 H MET B 549 -5.031 14.884 11.887 1.00 0.00 H new ATOM 0 HA MET B 549 -6.648 17.017 11.213 1.00 0.00 H new ATOM 0 HB2 MET B 549 -4.052 15.906 10.140 1.00 0.00 H new ATOM 0 HB3 MET B 549 -4.787 17.295 9.366 1.00 0.00 H new ATOM 0 HG2 MET B 549 -4.890 18.072 11.989 1.00 0.00 H new ATOM 0 HG3 MET B 549 -3.448 17.077 12.006 1.00 0.00 H new ATOM 0 HE1 MET B 549 -1.089 18.500 9.563 1.00 0.00 H new ATOM 0 HE2 MET B 549 -2.132 17.067 9.724 1.00 0.00 H new ATOM 0 HE3 MET B 549 -2.477 18.281 8.470 1.00 0.00 H new ATOM 424 N LEU B 550 -6.647 14.648 8.935 1.00 0.00 N ATOM 425 CA LEU B 550 -7.326 14.169 7.736 1.00 0.00 C ATOM 426 C LEU B 550 -8.667 13.533 8.088 1.00 0.00 C ATOM 427 O LEU B 550 -9.591 13.519 7.275 1.00 0.00 O ATOM 428 CB LEU B 550 -6.447 13.159 6.997 1.00 0.00 C ATOM 429 CG LEU B 550 -5.488 13.738 5.956 1.00 0.00 C ATOM 430 CD1 LEU B 550 -4.377 14.524 6.633 1.00 0.00 C ATOM 431 CD2 LEU B 550 -4.909 12.629 5.090 1.00 0.00 C ATOM 0 H LEU B 550 -5.992 13.981 9.343 1.00 0.00 H new ATOM 0 HA LEU B 550 -7.510 15.024 7.086 1.00 0.00 H new ATOM 0 HB2 LEU B 550 -5.862 12.609 7.734 1.00 0.00 H new ATOM 0 HB3 LEU B 550 -7.096 12.437 6.502 1.00 0.00 H new ATOM 0 HG LEU B 550 -6.047 14.419 5.314 1.00 0.00 H new ATOM 0 HD11 LEU B 550 -3.704 14.928 5.877 1.00 0.00 H new ATOM 0 HD12 LEU B 550 -4.809 15.342 7.209 1.00 0.00 H new ATOM 0 HD13 LEU B 550 -3.820 13.866 7.299 1.00 0.00 H new ATOM 0 HD21 LEU B 550 -4.229 13.059 4.355 1.00 0.00 H new ATOM 0 HD22 LEU B 550 -4.365 11.923 5.718 1.00 0.00 H new ATOM 0 HD23 LEU B 550 -5.717 12.109 4.576 1.00 0.00 H new ATOM 443 N ALA B 551 -8.766 13.008 9.305 1.00 0.00 N ATOM 444 CA ALA B 551 -9.995 12.374 9.765 1.00 0.00 C ATOM 445 C ALA B 551 -11.143 13.377 9.821 1.00 0.00 C ATOM 446 O ALA B 551 -12.270 13.067 9.436 1.00 0.00 O ATOM 447 CB ALA B 551 -9.781 11.738 11.131 1.00 0.00 C ATOM 0 H ALA B 551 -8.010 13.009 9.990 1.00 0.00 H new ATOM 0 HA ALA B 551 -10.262 11.595 9.051 1.00 0.00 H new ATOM 0 HB1 ALA B 551 -10.707 11.268 11.463 1.00 0.00 H new ATOM 0 HB2 ALA B 551 -8.996 10.985 11.063 1.00 0.00 H new ATOM 0 HB3 ALA B 551 -9.487 12.505 11.847 1.00 0.00 H new ATOM 453 N SER B 552 -10.848 14.580 10.305 1.00 0.00 N ATOM 454 CA SER B 552 -11.857 15.627 10.415 1.00 0.00 C ATOM 455 C SER B 552 -11.810 16.556 9.206 1.00 0.00 C ATOM 456 O SER B 552 -12.068 17.754 9.320 1.00 0.00 O ATOM 457 CB SER B 552 -11.649 16.431 11.700 1.00 0.00 C ATOM 458 OG SER B 552 -12.715 17.340 11.911 1.00 0.00 O ATOM 0 H SER B 552 -9.919 14.853 10.627 1.00 0.00 H new ATOM 0 HA SER B 552 -12.837 15.152 10.447 1.00 0.00 H new ATOM 0 HB2 SER B 552 -11.573 15.752 12.549 1.00 0.00 H new ATOM 0 HB3 SER B 552 -10.707 16.977 11.643 1.00 0.00 H new ATOM 0 HG SER B 552 -12.851 17.877 11.103 1.00 0.00 H new ATOM 464 N ALA B 553 -11.478 15.995 8.049 1.00 0.00 N ATOM 465 CA ALA B 553 -11.398 16.771 6.818 1.00 0.00 C ATOM 466 C ALA B 553 -11.957 15.986 5.636 1.00 0.00 C ATOM 467 O ALA B 553 -12.075 14.761 5.673 1.00 0.00 O ATOM 468 CB ALA B 553 -9.959 17.184 6.546 1.00 0.00 C ATOM 0 H ALA B 553 -11.260 15.005 7.938 1.00 0.00 H new ATOM 0 HA ALA B 553 -12.004 17.668 6.944 1.00 0.00 H new ATOM 0 HB1 ALA B 553 -9.915 17.763 5.623 1.00 0.00 H new ATOM 0 HB2 ALA B 553 -9.592 17.791 7.373 1.00 0.00 H new ATOM 0 HB3 ALA B 553 -9.338 16.294 6.446 1.00 0.00 H new ATOM 474 N PRO B 554 -12.313 16.706 4.561 1.00 0.00 N ATOM 475 CA PRO B 554 -12.866 16.096 3.348 1.00 0.00 C ATOM 476 C PRO B 554 -11.828 15.283 2.583 1.00 0.00 C ATOM 477 O PRO B 554 -10.629 15.346 2.857 1.00 0.00 O ATOM 478 CB PRO B 554 -13.318 17.302 2.520 1.00 0.00 C ATOM 479 CG PRO B 554 -12.460 18.426 2.988 1.00 0.00 C ATOM 480 CD PRO B 554 -12.201 18.170 4.447 1.00 0.00 C ATOM 0 HA PRO B 554 -13.667 15.392 3.574 1.00 0.00 H new ATOM 0 HB2 PRO B 554 -13.187 17.121 1.453 1.00 0.00 H new ATOM 0 HB3 PRO B 554 -14.375 17.518 2.679 1.00 0.00 H new ATOM 0 HG2 PRO B 554 -11.526 18.464 2.427 1.00 0.00 H new ATOM 0 HG3 PRO B 554 -12.959 19.384 2.842 1.00 0.00 H new ATOM 0 HD2 PRO B 554 -11.214 18.522 4.748 1.00 0.00 H new ATOM 0 HD3 PRO B 554 -12.928 18.679 5.080 1.00 0.00 H new ATOM 488 N PRO B 555 -12.296 14.502 1.598 1.00 0.00 N ATOM 489 CA PRO B 555 -11.423 13.662 0.772 1.00 0.00 C ATOM 490 C PRO B 555 -10.546 14.484 -0.166 1.00 0.00 C ATOM 491 O PRO B 555 -9.655 13.948 -0.824 1.00 0.00 O ATOM 492 CB PRO B 555 -12.409 12.808 -0.030 1.00 0.00 C ATOM 493 CG PRO B 555 -13.658 13.618 -0.081 1.00 0.00 C ATOM 494 CD PRO B 555 -13.712 14.377 1.216 1.00 0.00 C ATOM 0 HA PRO B 555 -10.726 13.081 1.376 1.00 0.00 H new ATOM 0 HB2 PRO B 555 -12.030 12.601 -1.031 1.00 0.00 H new ATOM 0 HB3 PRO B 555 -12.581 11.845 0.451 1.00 0.00 H new ATOM 0 HG2 PRO B 555 -13.647 14.299 -0.932 1.00 0.00 H new ATOM 0 HG3 PRO B 555 -14.533 12.979 -0.196 1.00 0.00 H new ATOM 0 HD2 PRO B 555 -14.182 15.353 1.091 1.00 0.00 H new ATOM 0 HD3 PRO B 555 -14.286 13.841 1.972 1.00 0.00 H new ATOM 502 N GLN B 556 -10.803 15.787 -0.220 1.00 0.00 N ATOM 503 CA GLN B 556 -10.036 16.682 -1.077 1.00 0.00 C ATOM 504 C GLN B 556 -8.875 17.307 -0.311 1.00 0.00 C ATOM 505 O GLN B 556 -7.732 17.277 -0.765 1.00 0.00 O ATOM 506 CB GLN B 556 -10.939 17.779 -1.643 1.00 0.00 C ATOM 507 CG GLN B 556 -10.498 18.287 -3.006 1.00 0.00 C ATOM 508 CD GLN B 556 -9.525 19.446 -2.910 1.00 0.00 C ATOM 509 OE1 GLN B 556 -8.916 19.675 -1.865 1.00 0.00 O ATOM 510 NE2 GLN B 556 -9.372 20.183 -4.004 1.00 0.00 N ATOM 0 H GLN B 556 -11.537 16.246 0.320 1.00 0.00 H new ATOM 0 HA GLN B 556 -9.630 16.095 -1.901 1.00 0.00 H new ATOM 0 HB2 GLN B 556 -11.957 17.397 -1.719 1.00 0.00 H new ATOM 0 HB3 GLN B 556 -10.964 18.615 -0.944 1.00 0.00 H new ATOM 0 HG2 GLN B 556 -10.033 17.472 -3.560 1.00 0.00 H new ATOM 0 HG3 GLN B 556 -11.374 18.599 -3.574 1.00 0.00 H new ATOM 0 HE21 GLN B 556 -9.897 19.957 -4.849 1.00 0.00 H new ATOM 0 HE22 GLN B 556 -8.729 20.975 -4.000 1.00 0.00 H new ATOM 519 N GLU B 557 -9.177 17.873 0.854 1.00 0.00 N ATOM 520 CA GLU B 557 -8.158 18.506 1.682 1.00 0.00 C ATOM 521 C GLU B 557 -7.089 17.498 2.095 1.00 0.00 C ATOM 522 O GLU B 557 -5.959 17.871 2.409 1.00 0.00 O ATOM 523 CB GLU B 557 -8.794 19.130 2.925 1.00 0.00 C ATOM 524 CG GLU B 557 -8.069 20.368 3.425 1.00 0.00 C ATOM 525 CD GLU B 557 -8.486 20.763 4.828 1.00 0.00 C ATOM 526 OE1 GLU B 557 -9.457 20.172 5.346 1.00 0.00 O ATOM 527 OE2 GLU B 557 -7.843 21.663 5.408 1.00 0.00 O ATOM 0 H GLU B 557 -10.119 17.906 1.245 1.00 0.00 H new ATOM 0 HA GLU B 557 -7.684 19.291 1.093 1.00 0.00 H new ATOM 0 HB2 GLU B 557 -9.828 19.391 2.701 1.00 0.00 H new ATOM 0 HB3 GLU B 557 -8.818 18.387 3.722 1.00 0.00 H new ATOM 0 HG2 GLU B 557 -6.994 20.187 3.407 1.00 0.00 H new ATOM 0 HG3 GLU B 557 -8.264 21.198 2.745 1.00 0.00 H new ATOM 534 N GLN B 558 -7.456 16.221 2.092 1.00 0.00 N ATOM 535 CA GLN B 558 -6.529 15.160 2.468 1.00 0.00 C ATOM 536 C GLN B 558 -5.236 15.257 1.666 1.00 0.00 C ATOM 537 O GLN B 558 -4.200 15.674 2.185 1.00 0.00 O ATOM 538 CB GLN B 558 -7.176 13.790 2.253 1.00 0.00 C ATOM 539 CG GLN B 558 -8.373 13.534 3.154 1.00 0.00 C ATOM 540 CD GLN B 558 -8.276 12.214 3.893 1.00 0.00 C ATOM 541 OE1 GLN B 558 -7.555 11.307 3.476 1.00 0.00 O ATOM 542 NE2 GLN B 558 -9.003 12.100 4.998 1.00 0.00 N ATOM 0 H GLN B 558 -8.388 15.896 1.834 1.00 0.00 H new ATOM 0 HA GLN B 558 -6.289 15.279 3.524 1.00 0.00 H new ATOM 0 HB2 GLN B 558 -7.490 13.705 1.213 1.00 0.00 H new ATOM 0 HB3 GLN B 558 -6.430 13.014 2.425 1.00 0.00 H new ATOM 0 HG2 GLN B 558 -8.459 14.345 3.877 1.00 0.00 H new ATOM 0 HG3 GLN B 558 -9.283 13.544 2.554 1.00 0.00 H new ATOM 0 HE21 GLN B 558 -9.587 12.877 5.307 1.00 0.00 H new ATOM 0 HE22 GLN B 558 -8.978 11.235 5.538 1.00 0.00 H new ATOM 551 N LYS B 559 -5.303 14.869 0.397 1.00 0.00 N ATOM 552 CA LYS B 559 -4.138 14.912 -0.479 1.00 0.00 C ATOM 553 C LYS B 559 -3.483 16.289 -0.445 1.00 0.00 C ATOM 554 O LYS B 559 -2.266 16.410 -0.583 1.00 0.00 O ATOM 555 CB LYS B 559 -4.539 14.562 -1.914 1.00 0.00 C ATOM 556 CG LYS B 559 -5.740 15.345 -2.417 1.00 0.00 C ATOM 557 CD LYS B 559 -6.136 14.916 -3.821 1.00 0.00 C ATOM 558 CE LYS B 559 -7.619 15.139 -4.073 1.00 0.00 C ATOM 559 NZ LYS B 559 -8.006 14.770 -5.463 1.00 0.00 N ATOM 0 H LYS B 559 -6.152 14.521 -0.048 1.00 0.00 H new ATOM 0 HA LYS B 559 -3.418 14.177 -0.120 1.00 0.00 H new ATOM 0 HB2 LYS B 559 -3.692 14.747 -2.575 1.00 0.00 H new ATOM 0 HB3 LYS B 559 -4.761 13.496 -1.971 1.00 0.00 H new ATOM 0 HG2 LYS B 559 -6.581 15.198 -1.740 1.00 0.00 H new ATOM 0 HG3 LYS B 559 -5.509 16.410 -2.412 1.00 0.00 H new ATOM 0 HD2 LYS B 559 -5.553 15.476 -4.552 1.00 0.00 H new ATOM 0 HD3 LYS B 559 -5.896 13.862 -3.962 1.00 0.00 H new ATOM 0 HE2 LYS B 559 -8.201 14.549 -3.365 1.00 0.00 H new ATOM 0 HE3 LYS B 559 -7.865 16.186 -3.893 1.00 0.00 H new ATOM 0 HZ1 LYS B 559 -9.024 14.936 -5.596 1.00 0.00 H new ATOM 0 HZ2 LYS B 559 -7.470 15.351 -6.139 1.00 0.00 H new ATOM 0 HZ3 LYS B 559 -7.795 13.765 -5.627 1.00 0.00 H new ATOM 573 N GLN B 560 -4.297 17.323 -0.259 1.00 0.00 N ATOM 574 CA GLN B 560 -3.795 18.691 -0.206 1.00 0.00 C ATOM 575 C GLN B 560 -2.824 18.870 0.956 1.00 0.00 C ATOM 576 O GLN B 560 -1.637 19.118 0.753 1.00 0.00 O ATOM 577 CB GLN B 560 -4.956 19.678 -0.073 1.00 0.00 C ATOM 578 CG GLN B 560 -4.522 21.134 -0.099 1.00 0.00 C ATOM 579 CD GLN B 560 -5.696 22.094 -0.061 1.00 0.00 C ATOM 580 OE1 GLN B 560 -5.739 23.069 -0.811 1.00 0.00 O ATOM 581 NE2 GLN B 560 -6.656 21.820 0.815 1.00 0.00 N ATOM 0 H GLN B 560 -5.307 17.239 -0.142 1.00 0.00 H new ATOM 0 HA GLN B 560 -3.262 18.892 -1.135 1.00 0.00 H new ATOM 0 HB2 GLN B 560 -5.664 19.504 -0.883 1.00 0.00 H new ATOM 0 HB3 GLN B 560 -5.484 19.481 0.860 1.00 0.00 H new ATOM 0 HG2 GLN B 560 -3.870 21.330 0.752 1.00 0.00 H new ATOM 0 HG3 GLN B 560 -3.936 21.318 -0.999 1.00 0.00 H new ATOM 0 HE21 GLN B 560 -6.578 21.000 1.417 1.00 0.00 H new ATOM 0 HE22 GLN B 560 -7.471 22.429 0.886 1.00 0.00 H new ATOM 590 N MET B 561 -3.339 18.742 2.175 1.00 0.00 N ATOM 591 CA MET B 561 -2.516 18.889 3.370 1.00 0.00 C ATOM 592 C MET B 561 -1.419 17.831 3.409 1.00 0.00 C ATOM 593 O MET B 561 -0.235 18.153 3.521 1.00 0.00 O ATOM 594 CB MET B 561 -3.383 18.788 4.627 1.00 0.00 C ATOM 595 CG MET B 561 -4.577 19.729 4.620 1.00 0.00 C ATOM 596 SD MET B 561 -5.701 19.435 5.998 1.00 0.00 S ATOM 597 CE MET B 561 -6.407 17.857 5.528 1.00 0.00 C ATOM 0 H MET B 561 -4.321 18.537 2.361 1.00 0.00 H new ATOM 0 HA MET B 561 -2.046 19.872 3.338 1.00 0.00 H new ATOM 0 HB2 MET B 561 -3.739 17.763 4.731 1.00 0.00 H new ATOM 0 HB3 MET B 561 -2.768 19.002 5.501 1.00 0.00 H new ATOM 0 HG2 MET B 561 -4.223 20.759 4.658 1.00 0.00 H new ATOM 0 HG3 MET B 561 -5.120 19.613 3.682 1.00 0.00 H new ATOM 0 HE1 MET B 561 -7.465 17.986 5.298 1.00 0.00 H new ATOM 0 HE2 MET B 561 -5.889 17.474 4.649 1.00 0.00 H new ATOM 0 HE3 MET B 561 -6.298 17.150 6.350 1.00 0.00 H new ATOM 607 N LEU B 562 -1.818 16.567 3.315 1.00 0.00 N ATOM 608 CA LEU B 562 -0.868 15.461 3.339 1.00 0.00 C ATOM 609 C LEU B 562 0.240 15.672 2.312 1.00 0.00 C ATOM 610 O LEU B 562 1.418 15.749 2.661 1.00 0.00 O ATOM 611 CB LEU B 562 -1.587 14.139 3.065 1.00 0.00 C ATOM 612 CG LEU B 562 -0.717 12.882 3.099 1.00 0.00 C ATOM 613 CD1 LEU B 562 -1.504 11.702 3.648 1.00 0.00 C ATOM 614 CD2 LEU B 562 -0.179 12.567 1.711 1.00 0.00 C ATOM 0 H LEU B 562 -2.793 16.283 3.221 1.00 0.00 H new ATOM 0 HA LEU B 562 -0.417 15.424 4.331 1.00 0.00 H new ATOM 0 HB2 LEU B 562 -2.385 14.024 3.798 1.00 0.00 H new ATOM 0 HB3 LEU B 562 -2.061 14.202 2.085 1.00 0.00 H new ATOM 0 HG LEU B 562 0.129 13.068 3.761 1.00 0.00 H new ATOM 0 HD11 LEU B 562 -0.868 10.817 3.665 1.00 0.00 H new ATOM 0 HD12 LEU B 562 -1.839 11.927 4.661 1.00 0.00 H new ATOM 0 HD13 LEU B 562 -2.370 11.515 3.013 1.00 0.00 H new ATOM 0 HD21 LEU B 562 0.438 11.669 1.755 1.00 0.00 H new ATOM 0 HD22 LEU B 562 -1.011 12.402 1.027 1.00 0.00 H new ATOM 0 HD23 LEU B 562 0.423 13.404 1.355 1.00 0.00 H new ATOM 626 N GLY B 563 -0.146 15.768 1.043 1.00 0.00 N ATOM 627 CA GLY B 563 0.827 15.972 -0.015 1.00 0.00 C ATOM 628 C GLY B 563 1.675 17.208 0.208 1.00 0.00 C ATOM 629 O GLY B 563 2.872 17.205 -0.075 1.00 0.00 O ATOM 0 H GLY B 563 -1.115 15.708 0.729 1.00 0.00 H new ATOM 0 HA2 GLY B 563 1.475 15.098 -0.082 1.00 0.00 H new ATOM 0 HA3 GLY B 563 0.308 16.058 -0.970 1.00 0.00 H new ATOM 633 N GLU B 564 1.052 18.268 0.715 1.00 0.00 N ATOM 634 CA GLU B 564 1.759 19.517 0.972 1.00 0.00 C ATOM 635 C GLU B 564 2.851 19.319 2.019 1.00 0.00 C ATOM 636 O GLU B 564 3.959 19.839 1.883 1.00 0.00 O ATOM 637 CB GLU B 564 0.780 20.596 1.439 1.00 0.00 C ATOM 638 CG GLU B 564 0.135 21.367 0.300 1.00 0.00 C ATOM 639 CD GLU B 564 1.038 22.451 -0.256 1.00 0.00 C ATOM 640 OE1 GLU B 564 1.427 23.351 0.516 1.00 0.00 O ATOM 641 OE2 GLU B 564 1.355 22.398 -1.463 1.00 0.00 O ATOM 0 H GLU B 564 0.061 18.286 0.955 1.00 0.00 H new ATOM 0 HA GLU B 564 2.226 19.838 0.041 1.00 0.00 H new ATOM 0 HB2 GLU B 564 -0.001 20.130 2.040 1.00 0.00 H new ATOM 0 HB3 GLU B 564 1.306 21.296 2.088 1.00 0.00 H new ATOM 0 HG2 GLU B 564 -0.129 20.674 -0.499 1.00 0.00 H new ATOM 0 HG3 GLU B 564 -0.793 21.817 0.651 1.00 0.00 H new ATOM 648 N ARG B 565 2.530 18.563 3.065 1.00 0.00 N ATOM 649 CA ARG B 565 3.482 18.297 4.136 1.00 0.00 C ATOM 650 C ARG B 565 4.520 17.267 3.698 1.00 0.00 C ATOM 651 O ARG B 565 5.671 17.305 4.135 1.00 0.00 O ATOM 652 CB ARG B 565 2.752 17.801 5.385 1.00 0.00 C ATOM 653 CG ARG B 565 3.460 18.150 6.684 1.00 0.00 C ATOM 654 CD ARG B 565 2.856 17.407 7.865 1.00 0.00 C ATOM 655 NE ARG B 565 3.652 17.568 9.079 1.00 0.00 N ATOM 656 CZ ARG B 565 4.841 17.004 9.257 1.00 0.00 C ATOM 657 NH1 ARG B 565 5.370 16.247 8.306 1.00 0.00 N ATOM 658 NH2 ARG B 565 5.506 17.198 10.390 1.00 0.00 N ATOM 0 H ARG B 565 1.618 18.124 3.193 1.00 0.00 H new ATOM 0 HA ARG B 565 3.996 19.229 4.370 1.00 0.00 H new ATOM 0 HB2 ARG B 565 1.749 18.227 5.402 1.00 0.00 H new ATOM 0 HB3 ARG B 565 2.638 16.719 5.323 1.00 0.00 H new ATOM 0 HG2 ARG B 565 4.518 17.903 6.600 1.00 0.00 H new ATOM 0 HG3 ARG B 565 3.396 19.224 6.857 1.00 0.00 H new ATOM 0 HD2 ARG B 565 1.845 17.772 8.044 1.00 0.00 H new ATOM 0 HD3 ARG B 565 2.774 16.347 7.623 1.00 0.00 H new ATOM 0 HE ARG B 565 3.274 18.145 9.831 1.00 0.00 H new ATOM 0 HH11 ARG B 565 4.864 16.096 7.434 1.00 0.00 H new ATOM 0 HH12 ARG B 565 6.284 15.816 8.447 1.00 0.00 H new ATOM 0 HH21 ARG B 565 5.104 17.781 11.124 1.00 0.00 H new ATOM 0 HH22 ARG B 565 6.419 16.764 10.526 1.00 0.00 H new ATOM 672 N LEU B 566 4.105 16.348 2.834 1.00 0.00 N ATOM 673 CA LEU B 566 4.997 15.306 2.337 1.00 0.00 C ATOM 674 C LEU B 566 5.959 15.866 1.293 1.00 0.00 C ATOM 675 O LEU B 566 7.055 15.341 1.099 1.00 0.00 O ATOM 676 CB LEU B 566 4.187 14.156 1.736 1.00 0.00 C ATOM 677 CG LEU B 566 4.126 12.873 2.565 1.00 0.00 C ATOM 678 CD1 LEU B 566 2.963 12.925 3.544 1.00 0.00 C ATOM 679 CD2 LEU B 566 4.008 11.657 1.658 1.00 0.00 C ATOM 0 H LEU B 566 3.156 16.303 2.463 1.00 0.00 H new ATOM 0 HA LEU B 566 5.580 14.930 3.178 1.00 0.00 H new ATOM 0 HB2 LEU B 566 3.168 14.505 1.568 1.00 0.00 H new ATOM 0 HB3 LEU B 566 4.606 13.914 0.759 1.00 0.00 H new ATOM 0 HG LEU B 566 5.051 12.787 3.135 1.00 0.00 H new ATOM 0 HD11 LEU B 566 2.935 12.003 4.125 1.00 0.00 H new ATOM 0 HD12 LEU B 566 3.090 13.774 4.216 1.00 0.00 H new ATOM 0 HD13 LEU B 566 2.029 13.035 2.994 1.00 0.00 H new ATOM 0 HD21 LEU B 566 3.966 10.753 2.265 1.00 0.00 H new ATOM 0 HD22 LEU B 566 3.100 11.736 1.061 1.00 0.00 H new ATOM 0 HD23 LEU B 566 4.874 11.610 0.997 1.00 0.00 H new ATOM 691 N PHE B 567 5.541 16.936 0.625 1.00 0.00 N ATOM 692 CA PHE B 567 6.366 17.568 -0.398 1.00 0.00 C ATOM 693 C PHE B 567 7.779 17.819 0.120 1.00 0.00 C ATOM 694 O PHE B 567 8.767 17.349 -0.445 1.00 0.00 O ATOM 695 CB PHE B 567 5.734 18.887 -0.848 1.00 0.00 C ATOM 696 CG PHE B 567 6.732 19.882 -1.369 1.00 0.00 C ATOM 697 CD1 PHE B 567 7.593 19.545 -2.401 1.00 0.00 C ATOM 698 CD2 PHE B 567 6.809 21.155 -0.826 1.00 0.00 C ATOM 699 CE1 PHE B 567 8.512 20.458 -2.882 1.00 0.00 C ATOM 700 CE2 PHE B 567 7.726 22.072 -1.303 1.00 0.00 C ATOM 701 CZ PHE B 567 8.579 21.723 -2.332 1.00 0.00 C ATOM 0 H PHE B 567 4.636 17.383 0.774 1.00 0.00 H new ATOM 0 HA PHE B 567 6.426 16.891 -1.250 1.00 0.00 H new ATOM 0 HB2 PHE B 567 4.998 18.682 -1.625 1.00 0.00 H new ATOM 0 HB3 PHE B 567 5.197 19.328 -0.009 1.00 0.00 H new ATOM 0 HD1 PHE B 567 7.545 18.557 -2.835 1.00 0.00 H new ATOM 0 HD2 PHE B 567 6.145 21.433 -0.021 1.00 0.00 H new ATOM 0 HE1 PHE B 567 9.177 20.183 -3.687 1.00 0.00 H new ATOM 0 HE2 PHE B 567 7.776 23.061 -0.872 1.00 0.00 H new ATOM 0 HZ PHE B 567 9.297 22.438 -2.706 1.00 0.00 H new ATOM 711 N PRO B 568 7.879 18.577 1.222 1.00 0.00 N ATOM 712 CA PRO B 568 9.166 18.908 1.841 1.00 0.00 C ATOM 713 C PRO B 568 9.822 17.697 2.497 1.00 0.00 C ATOM 714 O PRO B 568 11.035 17.506 2.398 1.00 0.00 O ATOM 715 CB PRO B 568 8.794 19.951 2.898 1.00 0.00 C ATOM 716 CG PRO B 568 7.367 19.669 3.222 1.00 0.00 C ATOM 717 CD PRO B 568 6.743 19.170 1.948 1.00 0.00 C ATOM 0 HA PRO B 568 9.891 19.263 1.108 1.00 0.00 H new ATOM 0 HB2 PRO B 568 9.426 19.862 3.782 1.00 0.00 H new ATOM 0 HB3 PRO B 568 8.921 20.964 2.516 1.00 0.00 H new ATOM 0 HG2 PRO B 568 7.287 18.924 4.014 1.00 0.00 H new ATOM 0 HG3 PRO B 568 6.863 20.568 3.577 1.00 0.00 H new ATOM 0 HD2 PRO B 568 5.963 18.434 2.144 1.00 0.00 H new ATOM 0 HD3 PRO B 568 6.283 19.980 1.382 1.00 0.00 H new ATOM 725 N LEU B 569 9.014 16.882 3.165 1.00 0.00 N ATOM 726 CA LEU B 569 9.516 15.688 3.837 1.00 0.00 C ATOM 727 C LEU B 569 10.323 14.821 2.875 1.00 0.00 C ATOM 728 O LEU B 569 11.312 14.200 3.266 1.00 0.00 O ATOM 729 CB LEU B 569 8.354 14.879 4.418 1.00 0.00 C ATOM 730 CG LEU B 569 8.675 14.038 5.654 1.00 0.00 C ATOM 731 CD1 LEU B 569 9.696 12.963 5.318 1.00 0.00 C ATOM 732 CD2 LEU B 569 9.181 14.922 6.784 1.00 0.00 C ATOM 0 H LEU B 569 8.008 17.026 3.256 1.00 0.00 H new ATOM 0 HA LEU B 569 10.171 16.006 4.648 1.00 0.00 H new ATOM 0 HB2 LEU B 569 7.548 15.568 4.671 1.00 0.00 H new ATOM 0 HB3 LEU B 569 7.974 14.216 3.641 1.00 0.00 H new ATOM 0 HG LEU B 569 7.759 13.549 5.985 1.00 0.00 H new ATOM 0 HD11 LEU B 569 9.912 12.375 6.210 1.00 0.00 H new ATOM 0 HD12 LEU B 569 9.296 12.311 4.541 1.00 0.00 H new ATOM 0 HD13 LEU B 569 10.613 13.431 4.961 1.00 0.00 H new ATOM 0 HD21 LEU B 569 9.404 14.306 7.655 1.00 0.00 H new ATOM 0 HD22 LEU B 569 10.085 15.440 6.464 1.00 0.00 H new ATOM 0 HD23 LEU B 569 8.416 15.654 7.043 1.00 0.00 H new ATOM 744 N ILE B 570 9.896 14.786 1.618 1.00 0.00 N ATOM 745 CA ILE B 570 10.581 13.998 0.601 1.00 0.00 C ATOM 746 C ILE B 570 11.876 14.674 0.162 1.00 0.00 C ATOM 747 O ILE B 570 12.860 14.005 -0.154 1.00 0.00 O ATOM 748 CB ILE B 570 9.688 13.774 -0.634 1.00 0.00 C ATOM 749 CG1 ILE B 570 8.469 12.929 -0.262 1.00 0.00 C ATOM 750 CG2 ILE B 570 10.482 13.107 -1.748 1.00 0.00 C ATOM 751 CD1 ILE B 570 7.387 12.931 -1.320 1.00 0.00 C ATOM 0 H ILE B 570 9.079 15.294 1.279 1.00 0.00 H new ATOM 0 HA ILE B 570 10.812 13.033 1.052 1.00 0.00 H new ATOM 0 HB ILE B 570 9.339 14.743 -0.993 1.00 0.00 H new ATOM 0 HG12 ILE B 570 8.789 11.903 -0.083 1.00 0.00 H new ATOM 0 HG13 ILE B 570 8.052 13.300 0.674 1.00 0.00 H new ATOM 0 HG21 ILE B 570 9.837 12.955 -2.614 1.00 0.00 H new ATOM 0 HG22 ILE B 570 11.322 13.743 -2.028 1.00 0.00 H new ATOM 0 HG23 ILE B 570 10.857 12.144 -1.401 1.00 0.00 H new ATOM 0 HD11 ILE B 570 6.553 12.312 -0.989 1.00 0.00 H new ATOM 0 HD12 ILE B 570 7.039 13.951 -1.483 1.00 0.00 H new ATOM 0 HD13 ILE B 570 7.788 12.532 -2.251 1.00 0.00 H new ATOM 763 N GLN B 571 11.868 16.003 0.148 1.00 0.00 N ATOM 764 CA GLN B 571 13.043 16.769 -0.251 1.00 0.00 C ATOM 765 C GLN B 571 14.250 16.399 0.605 1.00 0.00 C ATOM 766 O GLN B 571 15.395 16.609 0.204 1.00 0.00 O ATOM 767 CB GLN B 571 12.762 18.269 -0.137 1.00 0.00 C ATOM 768 CG GLN B 571 11.697 18.763 -1.102 1.00 0.00 C ATOM 769 CD GLN B 571 11.476 20.260 -1.010 1.00 0.00 C ATOM 770 OE1 GLN B 571 11.268 20.803 0.075 1.00 0.00 O ATOM 771 NE2 GLN B 571 11.520 20.936 -2.152 1.00 0.00 N ATOM 0 H GLN B 571 11.062 16.571 0.408 1.00 0.00 H new ATOM 0 HA GLN B 571 13.269 16.527 -1.289 1.00 0.00 H new ATOM 0 HB2 GLN B 571 12.450 18.495 0.883 1.00 0.00 H new ATOM 0 HB3 GLN B 571 13.686 18.818 -0.317 1.00 0.00 H new ATOM 0 HG2 GLN B 571 11.987 18.504 -2.120 1.00 0.00 H new ATOM 0 HG3 GLN B 571 10.759 18.248 -0.897 1.00 0.00 H new ATOM 0 HE21 GLN B 571 11.695 20.445 -3.029 1.00 0.00 H new ATOM 0 HE22 GLN B 571 11.378 21.946 -2.152 1.00 0.00 H new ATOM 780 N ALA B 572 13.986 15.849 1.785 1.00 0.00 N ATOM 781 CA ALA B 572 15.051 15.449 2.697 1.00 0.00 C ATOM 782 C ALA B 572 16.081 14.577 1.988 1.00 0.00 C ATOM 783 O ALA B 572 17.268 14.614 2.312 1.00 0.00 O ATOM 784 CB ALA B 572 14.470 14.714 3.896 1.00 0.00 C ATOM 0 H ALA B 572 13.044 15.670 2.132 1.00 0.00 H new ATOM 0 HA ALA B 572 15.555 16.350 3.046 1.00 0.00 H new ATOM 0 HB1 ALA B 572 15.276 14.421 4.569 1.00 0.00 H new ATOM 0 HB2 ALA B 572 13.777 15.369 4.424 1.00 0.00 H new ATOM 0 HB3 ALA B 572 13.940 13.824 3.556 1.00 0.00 H new ATOM 790 N MET B 573 15.620 13.792 1.019 1.00 0.00 N ATOM 791 CA MET B 573 16.503 12.911 0.264 1.00 0.00 C ATOM 792 C MET B 573 16.465 13.247 -1.223 1.00 0.00 C ATOM 793 O MET B 573 17.469 13.118 -1.924 1.00 0.00 O ATOM 794 CB MET B 573 16.105 11.449 0.478 1.00 0.00 C ATOM 795 CG MET B 573 14.638 11.171 0.192 1.00 0.00 C ATOM 796 SD MET B 573 13.824 10.283 1.534 1.00 0.00 S ATOM 797 CE MET B 573 12.675 11.528 2.115 1.00 0.00 C ATOM 0 H MET B 573 14.640 13.748 0.739 1.00 0.00 H new ATOM 0 HA MET B 573 17.520 13.060 0.627 1.00 0.00 H new ATOM 0 HB2 MET B 573 16.718 10.816 -0.164 1.00 0.00 H new ATOM 0 HB3 MET B 573 16.326 11.168 1.508 1.00 0.00 H new ATOM 0 HG2 MET B 573 14.120 12.115 0.020 1.00 0.00 H new ATOM 0 HG3 MET B 573 14.555 10.589 -0.726 1.00 0.00 H new ATOM 0 HE1 MET B 573 12.619 11.492 3.203 1.00 0.00 H new ATOM 0 HE2 MET B 573 13.018 12.514 1.802 1.00 0.00 H new ATOM 0 HE3 MET B 573 11.688 11.337 1.694 1.00 0.00 H new ATOM 807 N HIS B 574 15.302 13.680 -1.698 1.00 0.00 N ATOM 808 CA HIS B 574 15.134 14.035 -3.103 1.00 0.00 C ATOM 809 C HIS B 574 14.468 15.401 -3.241 1.00 0.00 C ATOM 810 O HIS B 574 13.285 15.512 -3.564 1.00 0.00 O ATOM 811 CB HIS B 574 14.303 12.974 -3.824 1.00 0.00 C ATOM 812 CG HIS B 574 15.123 11.868 -4.412 1.00 0.00 C ATOM 813 ND1 HIS B 574 15.285 10.643 -3.801 1.00 0.00 N ATOM 814 CD2 HIS B 574 15.830 11.807 -5.565 1.00 0.00 C ATOM 815 CE1 HIS B 574 16.056 9.877 -4.552 1.00 0.00 C ATOM 816 NE2 HIS B 574 16.400 10.560 -5.628 1.00 0.00 N ATOM 0 H HIS B 574 14.462 13.794 -1.131 1.00 0.00 H new ATOM 0 HA HIS B 574 16.122 14.083 -3.561 1.00 0.00 H new ATOM 0 HB2 HIS B 574 13.584 12.549 -3.123 1.00 0.00 H new ATOM 0 HB3 HIS B 574 13.729 13.452 -4.618 1.00 0.00 H new ATOM 0 HD2 HIS B 574 15.927 12.593 -6.299 1.00 0.00 H new ATOM 0 HE1 HIS B 574 16.354 8.864 -4.324 1.00 0.00 H new ATOM 0 HE2 HIS B 574 16.993 10.217 -6.384 1.00 0.00 H new ATOM 824 N PRO B 575 15.243 16.466 -2.992 1.00 0.00 N ATOM 825 CA PRO B 575 14.750 17.844 -3.083 1.00 0.00 C ATOM 826 C PRO B 575 14.465 18.264 -4.521 1.00 0.00 C ATOM 827 O PRO B 575 13.917 19.338 -4.768 1.00 0.00 O ATOM 828 CB PRO B 575 15.898 18.671 -2.501 1.00 0.00 C ATOM 829 CG PRO B 575 17.114 17.838 -2.720 1.00 0.00 C ATOM 830 CD PRO B 575 16.663 16.409 -2.603 1.00 0.00 C ATOM 0 HA PRO B 575 13.804 17.974 -2.557 1.00 0.00 H new ATOM 0 HB2 PRO B 575 15.984 19.636 -3.001 1.00 0.00 H new ATOM 0 HB3 PRO B 575 15.742 18.874 -1.441 1.00 0.00 H new ATOM 0 HG2 PRO B 575 17.548 18.031 -3.701 1.00 0.00 H new ATOM 0 HG3 PRO B 575 17.882 18.067 -1.981 1.00 0.00 H new ATOM 0 HD2 PRO B 575 17.234 15.753 -3.260 1.00 0.00 H new ATOM 0 HD3 PRO B 575 16.787 16.030 -1.588 1.00 0.00 H new ATOM 838 N THR B 576 14.842 17.410 -5.468 1.00 0.00 N ATOM 839 CA THR B 576 14.628 17.693 -6.881 1.00 0.00 C ATOM 840 C THR B 576 13.378 16.990 -7.400 1.00 0.00 C ATOM 841 O THR B 576 12.477 17.627 -7.948 1.00 0.00 O ATOM 842 CB THR B 576 15.837 17.259 -7.731 1.00 0.00 C ATOM 843 OG1 THR B 576 16.386 16.041 -7.215 1.00 0.00 O ATOM 844 CG2 THR B 576 16.908 18.339 -7.740 1.00 0.00 C ATOM 0 H THR B 576 15.297 16.517 -5.281 1.00 0.00 H new ATOM 0 HA THR B 576 14.499 18.772 -6.971 1.00 0.00 H new ATOM 0 HB THR B 576 15.496 17.099 -8.754 1.00 0.00 H new ATOM 0 HG1 THR B 576 17.153 15.771 -7.762 1.00 0.00 H new ATOM 0 HG21 THR B 576 17.752 18.010 -8.347 1.00 0.00 H new ATOM 0 HG22 THR B 576 16.496 19.257 -8.159 1.00 0.00 H new ATOM 0 HG23 THR B 576 17.245 18.526 -6.720 1.00 0.00 H new ATOM 852 N LEU B 577 13.329 15.675 -7.223 1.00 0.00 N ATOM 853 CA LEU B 577 12.188 14.884 -7.673 1.00 0.00 C ATOM 854 C LEU B 577 11.114 14.814 -6.592 1.00 0.00 C ATOM 855 O LEU B 577 10.147 14.063 -6.712 1.00 0.00 O ATOM 856 CB LEU B 577 12.639 13.473 -8.054 1.00 0.00 C ATOM 857 CG LEU B 577 13.582 13.370 -9.252 1.00 0.00 C ATOM 858 CD1 LEU B 577 13.070 14.214 -10.409 1.00 0.00 C ATOM 859 CD2 LEU B 577 14.990 13.796 -8.861 1.00 0.00 C ATOM 0 H LEU B 577 14.066 15.133 -6.771 1.00 0.00 H new ATOM 0 HA LEU B 577 11.762 15.371 -8.550 1.00 0.00 H new ATOM 0 HB2 LEU B 577 13.131 13.025 -7.191 1.00 0.00 H new ATOM 0 HB3 LEU B 577 11.753 12.874 -8.262 1.00 0.00 H new ATOM 0 HG LEU B 577 13.615 12.330 -9.575 1.00 0.00 H new ATOM 0 HD11 LEU B 577 13.755 14.128 -11.253 1.00 0.00 H new ATOM 0 HD12 LEU B 577 12.082 13.863 -10.706 1.00 0.00 H new ATOM 0 HD13 LEU B 577 13.006 15.257 -10.098 1.00 0.00 H new ATOM 0 HD21 LEU B 577 15.648 13.716 -9.726 1.00 0.00 H new ATOM 0 HD22 LEU B 577 14.974 14.828 -8.511 1.00 0.00 H new ATOM 0 HD23 LEU B 577 15.358 13.149 -8.065 1.00 0.00 H new ATOM 871 N ALA B 578 11.292 15.602 -5.537 1.00 0.00 N ATOM 872 CA ALA B 578 10.336 15.632 -4.437 1.00 0.00 C ATOM 873 C ALA B 578 8.910 15.791 -4.952 1.00 0.00 C ATOM 874 O ALA B 578 7.970 15.229 -4.391 1.00 0.00 O ATOM 875 CB ALA B 578 10.678 16.757 -3.471 1.00 0.00 C ATOM 0 H ALA B 578 12.089 16.228 -5.421 1.00 0.00 H new ATOM 0 HA ALA B 578 10.399 14.681 -3.908 1.00 0.00 H new ATOM 0 HB1 ALA B 578 9.956 16.768 -2.655 1.00 0.00 H new ATOM 0 HB2 ALA B 578 11.679 16.599 -3.068 1.00 0.00 H new ATOM 0 HB3 ALA B 578 10.645 17.711 -3.997 1.00 0.00 H new ATOM 881 N GLY B 579 8.755 16.561 -6.025 1.00 0.00 N ATOM 882 CA GLY B 579 7.440 16.780 -6.598 1.00 0.00 C ATOM 883 C GLY B 579 6.808 15.499 -7.106 1.00 0.00 C ATOM 884 O GLY B 579 5.840 15.004 -6.528 1.00 0.00 O ATOM 0 H GLY B 579 9.517 17.037 -6.508 1.00 0.00 H new ATOM 0 HA2 GLY B 579 6.790 17.229 -5.847 1.00 0.00 H new ATOM 0 HA3 GLY B 579 7.519 17.493 -7.419 1.00 0.00 H new ATOM 888 N LYS B 580 7.355 14.961 -8.190 1.00 0.00 N ATOM 889 CA LYS B 580 6.839 13.730 -8.777 1.00 0.00 C ATOM 890 C LYS B 580 6.702 12.639 -7.720 1.00 0.00 C ATOM 891 O LYS B 580 5.716 11.901 -7.701 1.00 0.00 O ATOM 892 CB LYS B 580 7.760 13.252 -9.902 1.00 0.00 C ATOM 893 CG LYS B 580 7.309 13.690 -11.285 1.00 0.00 C ATOM 894 CD LYS B 580 8.493 13.992 -12.188 1.00 0.00 C ATOM 895 CE LYS B 580 8.664 12.927 -13.260 1.00 0.00 C ATOM 896 NZ LYS B 580 9.775 13.254 -14.195 1.00 0.00 N ATOM 0 H LYS B 580 8.156 15.358 -8.681 1.00 0.00 H new ATOM 0 HA LYS B 580 5.851 13.939 -9.188 1.00 0.00 H new ATOM 0 HB2 LYS B 580 8.767 13.629 -9.721 1.00 0.00 H new ATOM 0 HB3 LYS B 580 7.818 12.164 -9.875 1.00 0.00 H new ATOM 0 HG2 LYS B 580 6.698 12.907 -11.734 1.00 0.00 H new ATOM 0 HG3 LYS B 580 6.680 14.576 -11.200 1.00 0.00 H new ATOM 0 HD2 LYS B 580 8.353 14.965 -12.659 1.00 0.00 H new ATOM 0 HD3 LYS B 580 9.401 14.056 -11.589 1.00 0.00 H new ATOM 0 HE2 LYS B 580 8.859 11.964 -12.787 1.00 0.00 H new ATOM 0 HE3 LYS B 580 7.735 12.825 -13.821 1.00 0.00 H new ATOM 0 HZ1 LYS B 580 9.937 12.451 -14.836 1.00 0.00 H new ATOM 0 HZ2 LYS B 580 9.524 14.096 -14.751 1.00 0.00 H new ATOM 0 HZ3 LYS B 580 10.641 13.443 -13.652 1.00 0.00 H new ATOM 910 N ILE B 581 7.694 12.544 -6.842 1.00 0.00 N ATOM 911 CA ILE B 581 7.682 11.545 -5.781 1.00 0.00 C ATOM 912 C ILE B 581 6.408 11.643 -4.949 1.00 0.00 C ATOM 913 O ILE B 581 5.626 10.694 -4.876 1.00 0.00 O ATOM 914 CB ILE B 581 8.901 11.695 -4.852 1.00 0.00 C ATOM 915 CG1 ILE B 581 10.193 11.403 -5.618 1.00 0.00 C ATOM 916 CG2 ILE B 581 8.770 10.770 -3.652 1.00 0.00 C ATOM 917 CD1 ILE B 581 11.418 12.042 -5.003 1.00 0.00 C ATOM 0 H ILE B 581 8.517 13.147 -6.844 1.00 0.00 H new ATOM 0 HA ILE B 581 7.723 10.570 -6.266 1.00 0.00 H new ATOM 0 HB ILE B 581 8.939 12.723 -4.491 1.00 0.00 H new ATOM 0 HG12 ILE B 581 10.341 10.324 -5.666 1.00 0.00 H new ATOM 0 HG13 ILE B 581 10.085 11.756 -6.644 1.00 0.00 H new ATOM 0 HG21 ILE B 581 9.639 10.888 -3.005 1.00 0.00 H new ATOM 0 HG22 ILE B 581 7.867 11.021 -3.096 1.00 0.00 H new ATOM 0 HG23 ILE B 581 8.710 9.737 -3.994 1.00 0.00 H new ATOM 0 HD11 ILE B 581 12.296 11.792 -5.598 1.00 0.00 H new ATOM 0 HD12 ILE B 581 11.291 13.124 -4.980 1.00 0.00 H new ATOM 0 HD13 ILE B 581 11.551 11.670 -3.987 1.00 0.00 H new ATOM 929 N THR B 582 6.203 12.797 -4.323 1.00 0.00 N ATOM 930 CA THR B 582 5.024 13.020 -3.496 1.00 0.00 C ATOM 931 C THR B 582 3.744 12.837 -4.304 1.00 0.00 C ATOM 932 O THR B 582 2.710 12.441 -3.766 1.00 0.00 O ATOM 933 CB THR B 582 5.029 14.431 -2.878 1.00 0.00 C ATOM 934 OG1 THR B 582 4.500 14.385 -1.548 1.00 0.00 O ATOM 935 CG2 THR B 582 4.210 15.395 -3.722 1.00 0.00 C ATOM 0 H THR B 582 6.839 13.593 -4.373 1.00 0.00 H new ATOM 0 HA THR B 582 5.055 12.281 -2.696 1.00 0.00 H new ATOM 0 HB THR B 582 6.059 14.786 -2.847 1.00 0.00 H new ATOM 0 HG1 THR B 582 4.508 15.285 -1.161 1.00 0.00 H new ATOM 0 HG21 THR B 582 4.229 16.385 -3.265 1.00 0.00 H new ATOM 0 HG22 THR B 582 4.633 15.450 -4.725 1.00 0.00 H new ATOM 0 HG23 THR B 582 3.180 15.042 -3.781 1.00 0.00 H new ATOM 943 N GLY B 583 3.820 13.126 -5.599 1.00 0.00 N ATOM 944 CA GLY B 583 2.660 12.986 -6.460 1.00 0.00 C ATOM 945 C GLY B 583 2.173 11.553 -6.548 1.00 0.00 C ATOM 946 O GLY B 583 1.028 11.258 -6.208 1.00 0.00 O ATOM 0 H GLY B 583 4.664 13.455 -6.068 1.00 0.00 H new ATOM 0 HA2 GLY B 583 1.855 13.618 -6.085 1.00 0.00 H new ATOM 0 HA3 GLY B 583 2.908 13.344 -7.459 1.00 0.00 H new ATOM 950 N MET B 584 3.044 10.661 -7.008 1.00 0.00 N ATOM 951 CA MET B 584 2.696 9.251 -7.141 1.00 0.00 C ATOM 952 C MET B 584 2.370 8.642 -5.781 1.00 0.00 C ATOM 953 O MET B 584 1.396 7.901 -5.639 1.00 0.00 O ATOM 954 CB MET B 584 3.843 8.480 -7.796 1.00 0.00 C ATOM 955 CG MET B 584 4.299 9.076 -9.118 1.00 0.00 C ATOM 956 SD MET B 584 5.919 8.471 -9.631 1.00 0.00 S ATOM 957 CE MET B 584 6.991 9.430 -8.564 1.00 0.00 C ATOM 0 H MET B 584 3.996 10.889 -7.295 1.00 0.00 H new ATOM 0 HA MET B 584 1.812 9.179 -7.774 1.00 0.00 H new ATOM 0 HB2 MET B 584 4.689 8.450 -7.109 1.00 0.00 H new ATOM 0 HB3 MET B 584 3.530 7.449 -7.960 1.00 0.00 H new ATOM 0 HG2 MET B 584 3.566 8.841 -9.890 1.00 0.00 H new ATOM 0 HG3 MET B 584 4.332 10.162 -9.030 1.00 0.00 H new ATOM 0 HE1 MET B 584 7.952 8.925 -8.465 1.00 0.00 H new ATOM 0 HE2 MET B 584 7.144 10.419 -8.996 1.00 0.00 H new ATOM 0 HE3 MET B 584 6.531 9.530 -7.581 1.00 0.00 H new ATOM 967 N LEU B 585 3.189 8.958 -4.784 1.00 0.00 N ATOM 968 CA LEU B 585 2.987 8.441 -3.435 1.00 0.00 C ATOM 969 C LEU B 585 1.650 8.905 -2.869 1.00 0.00 C ATOM 970 O LEU B 585 1.033 8.213 -2.057 1.00 0.00 O ATOM 971 CB LEU B 585 4.126 8.892 -2.519 1.00 0.00 C ATOM 972 CG LEU B 585 5.348 7.974 -2.465 1.00 0.00 C ATOM 973 CD1 LEU B 585 5.816 7.624 -3.869 1.00 0.00 C ATOM 974 CD2 LEU B 585 6.471 8.627 -1.673 1.00 0.00 C ATOM 0 H LEU B 585 3.999 9.570 -4.884 1.00 0.00 H new ATOM 0 HA LEU B 585 2.980 7.352 -3.487 1.00 0.00 H new ATOM 0 HB2 LEU B 585 4.453 9.881 -2.840 1.00 0.00 H new ATOM 0 HB3 LEU B 585 3.732 8.999 -1.508 1.00 0.00 H new ATOM 0 HG LEU B 585 5.063 7.051 -1.959 1.00 0.00 H new ATOM 0 HD11 LEU B 585 6.686 6.970 -3.810 1.00 0.00 H new ATOM 0 HD12 LEU B 585 5.014 7.114 -4.403 1.00 0.00 H new ATOM 0 HD13 LEU B 585 6.083 8.537 -4.402 1.00 0.00 H new ATOM 0 HD21 LEU B 585 7.332 7.960 -1.645 1.00 0.00 H new ATOM 0 HD22 LEU B 585 6.754 9.565 -2.150 1.00 0.00 H new ATOM 0 HD23 LEU B 585 6.132 8.825 -0.656 1.00 0.00 H new ATOM 986 N LEU B 586 1.205 10.079 -3.302 1.00 0.00 N ATOM 987 CA LEU B 586 -0.062 10.636 -2.840 1.00 0.00 C ATOM 988 C LEU B 586 -1.234 10.029 -3.604 1.00 0.00 C ATOM 989 O LEU B 586 -2.375 10.071 -3.145 1.00 0.00 O ATOM 990 CB LEU B 586 -0.064 12.157 -3.004 1.00 0.00 C ATOM 991 CG LEU B 586 -1.405 12.855 -2.776 1.00 0.00 C ATOM 992 CD1 LEU B 586 -1.194 14.218 -2.136 1.00 0.00 C ATOM 993 CD2 LEU B 586 -2.165 12.990 -4.087 1.00 0.00 C ATOM 0 H LEU B 586 1.703 10.664 -3.973 1.00 0.00 H new ATOM 0 HA LEU B 586 -0.175 10.391 -1.784 1.00 0.00 H new ATOM 0 HB2 LEU B 586 0.664 12.578 -2.311 1.00 0.00 H new ATOM 0 HB3 LEU B 586 0.280 12.394 -4.011 1.00 0.00 H new ATOM 0 HG LEU B 586 -2.000 12.246 -2.096 1.00 0.00 H new ATOM 0 HD11 LEU B 586 -2.159 14.701 -1.981 1.00 0.00 H new ATOM 0 HD12 LEU B 586 -0.691 14.096 -1.177 1.00 0.00 H new ATOM 0 HD13 LEU B 586 -0.580 14.836 -2.791 1.00 0.00 H new ATOM 0 HD21 LEU B 586 -3.117 13.489 -3.906 1.00 0.00 H new ATOM 0 HD22 LEU B 586 -1.575 13.578 -4.791 1.00 0.00 H new ATOM 0 HD23 LEU B 586 -2.348 12.000 -4.505 1.00 0.00 H new ATOM 1005 N GLU B 587 -0.944 9.465 -4.772 1.00 0.00 N ATOM 1006 CA GLU B 587 -1.975 8.848 -5.599 1.00 0.00 C ATOM 1007 C GLU B 587 -2.359 7.475 -5.056 1.00 0.00 C ATOM 1008 O GLU B 587 -3.525 7.220 -4.753 1.00 0.00 O ATOM 1009 CB GLU B 587 -1.491 8.720 -7.045 1.00 0.00 C ATOM 1010 CG GLU B 587 -2.606 8.439 -8.038 1.00 0.00 C ATOM 1011 CD GLU B 587 -3.682 9.508 -8.024 1.00 0.00 C ATOM 1012 OE1 GLU B 587 -4.628 9.387 -7.218 1.00 0.00 O ATOM 1013 OE2 GLU B 587 -3.578 10.465 -8.819 1.00 0.00 O ATOM 0 H GLU B 587 -0.005 9.422 -5.167 1.00 0.00 H new ATOM 0 HA GLU B 587 -2.857 9.489 -5.574 1.00 0.00 H new ATOM 0 HB2 GLU B 587 -0.984 9.641 -7.332 1.00 0.00 H new ATOM 0 HB3 GLU B 587 -0.754 7.919 -7.103 1.00 0.00 H new ATOM 0 HG2 GLU B 587 -2.185 8.366 -9.041 1.00 0.00 H new ATOM 0 HG3 GLU B 587 -3.056 7.473 -7.810 1.00 0.00 H new ATOM 1020 N ILE B 588 -1.371 6.595 -4.936 1.00 0.00 N ATOM 1021 CA ILE B 588 -1.605 5.249 -4.429 1.00 0.00 C ATOM 1022 C ILE B 588 -2.704 5.243 -3.373 1.00 0.00 C ATOM 1023 O ILE B 588 -3.750 4.619 -3.553 1.00 0.00 O ATOM 1024 CB ILE B 588 -0.324 4.644 -3.825 1.00 0.00 C ATOM 1025 CG1 ILE B 588 0.626 5.755 -3.373 1.00 0.00 C ATOM 1026 CG2 ILE B 588 0.359 3.733 -4.835 1.00 0.00 C ATOM 1027 CD1 ILE B 588 1.608 5.314 -2.310 1.00 0.00 C ATOM 0 H ILE B 588 -0.401 6.790 -5.183 1.00 0.00 H new ATOM 0 HA ILE B 588 -1.918 4.642 -5.278 1.00 0.00 H new ATOM 0 HB ILE B 588 -0.596 4.048 -2.954 1.00 0.00 H new ATOM 0 HG12 ILE B 588 1.179 6.123 -4.237 1.00 0.00 H new ATOM 0 HG13 ILE B 588 0.040 6.590 -2.991 1.00 0.00 H new ATOM 0 HG21 ILE B 588 1.263 3.313 -4.393 1.00 0.00 H new ATOM 0 HG22 ILE B 588 -0.318 2.925 -5.113 1.00 0.00 H new ATOM 0 HG23 ILE B 588 0.622 4.307 -5.723 1.00 0.00 H new ATOM 0 HD11 ILE B 588 2.250 6.152 -2.037 1.00 0.00 H new ATOM 0 HD12 ILE B 588 1.063 4.973 -1.430 1.00 0.00 H new ATOM 0 HD13 ILE B 588 2.220 4.499 -2.696 1.00 0.00 H new ATOM 1039 N ASP B 589 -2.461 5.943 -2.270 1.00 0.00 N ATOM 1040 CA ASP B 589 -3.432 6.021 -1.184 1.00 0.00 C ATOM 1041 C ASP B 589 -2.857 6.787 0.004 1.00 0.00 C ATOM 1042 O ASP B 589 -1.930 6.322 0.664 1.00 0.00 O ATOM 1043 CB ASP B 589 -3.853 4.618 -0.747 1.00 0.00 C ATOM 1044 CG ASP B 589 -5.331 4.362 -0.968 1.00 0.00 C ATOM 1045 OD1 ASP B 589 -6.138 5.278 -0.703 1.00 0.00 O ATOM 1046 OD2 ASP B 589 -5.681 3.247 -1.407 1.00 0.00 O ATOM 0 H ASP B 589 -1.600 6.464 -2.104 1.00 0.00 H new ATOM 0 HA ASP B 589 -4.308 6.557 -1.549 1.00 0.00 H new ATOM 0 HB2 ASP B 589 -3.273 3.879 -1.299 1.00 0.00 H new ATOM 0 HB3 ASP B 589 -3.618 4.484 0.309 1.00 0.00 H new ATOM 1051 N ASN B 590 -3.415 7.964 0.268 1.00 0.00 N ATOM 1052 CA ASN B 590 -2.957 8.795 1.375 1.00 0.00 C ATOM 1053 C ASN B 590 -2.925 7.999 2.676 1.00 0.00 C ATOM 1054 O ASN B 590 -1.955 8.063 3.431 1.00 0.00 O ATOM 1055 CB ASN B 590 -3.866 10.016 1.534 1.00 0.00 C ATOM 1056 CG ASN B 590 -3.994 10.812 0.249 1.00 0.00 C ATOM 1057 OD1 ASN B 590 -3.129 10.746 -0.624 1.00 0.00 O ATOM 1058 ND2 ASN B 590 -5.079 11.569 0.129 1.00 0.00 N ATOM 0 H ASN B 590 -4.185 8.363 -0.269 1.00 0.00 H new ATOM 0 HA ASN B 590 -1.945 9.130 1.150 1.00 0.00 H new ATOM 0 HB2 ASN B 590 -4.855 9.690 1.856 1.00 0.00 H new ATOM 0 HB3 ASN B 590 -3.471 10.660 2.320 1.00 0.00 H new ATOM 0 HD21 ASN B 590 -5.221 12.127 -0.713 1.00 0.00 H new ATOM 0 HD22 ASN B 590 -5.770 11.592 0.879 1.00 0.00 H new ATOM 1065 N SER B 591 -3.992 7.248 2.931 1.00 0.00 N ATOM 1066 CA SER B 591 -4.088 6.441 4.142 1.00 0.00 C ATOM 1067 C SER B 591 -2.841 5.581 4.321 1.00 0.00 C ATOM 1068 O SER B 591 -2.284 5.499 5.415 1.00 0.00 O ATOM 1069 CB SER B 591 -5.332 5.552 4.090 1.00 0.00 C ATOM 1070 OG SER B 591 -6.406 6.136 4.806 1.00 0.00 O ATOM 0 H SER B 591 -4.802 7.182 2.315 1.00 0.00 H new ATOM 0 HA SER B 591 -4.168 7.116 4.994 1.00 0.00 H new ATOM 0 HB2 SER B 591 -5.626 5.393 3.053 1.00 0.00 H new ATOM 0 HB3 SER B 591 -5.101 4.573 4.509 1.00 0.00 H new ATOM 0 HG SER B 591 -7.190 5.550 4.756 1.00 0.00 H new ATOM 1076 N GLU B 592 -2.409 4.942 3.238 1.00 0.00 N ATOM 1077 CA GLU B 592 -1.228 4.088 3.276 1.00 0.00 C ATOM 1078 C GLU B 592 0.006 4.883 3.692 1.00 0.00 C ATOM 1079 O GLU B 592 0.855 4.390 4.435 1.00 0.00 O ATOM 1080 CB GLU B 592 -0.996 3.440 1.909 1.00 0.00 C ATOM 1081 CG GLU B 592 0.050 2.338 1.928 1.00 0.00 C ATOM 1082 CD GLU B 592 -0.530 0.989 2.305 1.00 0.00 C ATOM 1083 OE1 GLU B 592 -1.745 0.923 2.585 1.00 0.00 O ATOM 1084 OE2 GLU B 592 0.232 0.000 2.321 1.00 0.00 O ATOM 0 H GLU B 592 -2.859 5.000 2.324 1.00 0.00 H new ATOM 0 HA GLU B 592 -1.400 3.306 4.016 1.00 0.00 H new ATOM 0 HB2 GLU B 592 -1.938 3.029 1.546 1.00 0.00 H new ATOM 0 HB3 GLU B 592 -0.689 4.208 1.199 1.00 0.00 H new ATOM 0 HG2 GLU B 592 0.515 2.267 0.945 1.00 0.00 H new ATOM 0 HG3 GLU B 592 0.837 2.601 2.635 1.00 0.00 H new ATOM 1091 N LEU B 593 0.099 6.115 3.206 1.00 0.00 N ATOM 1092 CA LEU B 593 1.230 6.981 3.525 1.00 0.00 C ATOM 1093 C LEU B 593 1.251 7.322 5.012 1.00 0.00 C ATOM 1094 O LEU B 593 2.316 7.394 5.627 1.00 0.00 O ATOM 1095 CB LEU B 593 1.165 8.265 2.696 1.00 0.00 C ATOM 1096 CG LEU B 593 0.592 8.125 1.286 1.00 0.00 C ATOM 1097 CD1 LEU B 593 0.694 9.443 0.535 1.00 0.00 C ATOM 1098 CD2 LEU B 593 1.310 7.019 0.526 1.00 0.00 C ATOM 0 H LEU B 593 -0.595 6.538 2.589 1.00 0.00 H new ATOM 0 HA LEU B 593 2.147 6.445 3.281 1.00 0.00 H new ATOM 0 HB2 LEU B 593 0.565 8.995 3.240 1.00 0.00 H new ATOM 0 HB3 LEU B 593 2.172 8.675 2.618 1.00 0.00 H new ATOM 0 HG LEU B 593 -0.462 7.858 1.368 1.00 0.00 H new ATOM 0 HD11 LEU B 593 0.281 9.324 -0.467 1.00 0.00 H new ATOM 0 HD12 LEU B 593 0.134 10.211 1.069 1.00 0.00 H new ATOM 0 HD13 LEU B 593 1.740 9.741 0.463 1.00 0.00 H new ATOM 0 HD21 LEU B 593 0.889 6.933 -0.476 1.00 0.00 H new ATOM 0 HD22 LEU B 593 2.371 7.256 0.455 1.00 0.00 H new ATOM 0 HD23 LEU B 593 1.184 6.074 1.054 1.00 0.00 H new ATOM 1110 N LEU B 594 0.070 7.528 5.583 1.00 0.00 N ATOM 1111 CA LEU B 594 -0.047 7.859 6.999 1.00 0.00 C ATOM 1112 C LEU B 594 0.471 6.719 7.870 1.00 0.00 C ATOM 1113 O LEU B 594 0.743 6.904 9.056 1.00 0.00 O ATOM 1114 CB LEU B 594 -1.504 8.165 7.352 1.00 0.00 C ATOM 1115 CG LEU B 594 -1.928 9.630 7.245 1.00 0.00 C ATOM 1116 CD1 LEU B 594 -3.432 9.765 7.420 1.00 0.00 C ATOM 1117 CD2 LEU B 594 -1.191 10.475 8.274 1.00 0.00 C ATOM 0 H LEU B 594 -0.820 7.472 5.088 1.00 0.00 H new ATOM 0 HA LEU B 594 0.561 8.743 7.192 1.00 0.00 H new ATOM 0 HB2 LEU B 594 -2.147 7.573 6.700 1.00 0.00 H new ATOM 0 HB3 LEU B 594 -1.688 7.828 8.372 1.00 0.00 H new ATOM 0 HG LEU B 594 -1.665 9.993 6.251 1.00 0.00 H new ATOM 0 HD11 LEU B 594 -3.715 10.815 7.341 1.00 0.00 H new ATOM 0 HD12 LEU B 594 -3.941 9.192 6.645 1.00 0.00 H new ATOM 0 HD13 LEU B 594 -3.720 9.385 8.400 1.00 0.00 H new ATOM 0 HD21 LEU B 594 -1.505 11.515 8.183 1.00 0.00 H new ATOM 0 HD22 LEU B 594 -1.422 10.112 9.276 1.00 0.00 H new ATOM 0 HD23 LEU B 594 -0.117 10.404 8.101 1.00 0.00 H new ATOM 1129 N HIS B 595 0.607 5.540 7.272 1.00 0.00 N ATOM 1130 CA HIS B 595 1.096 4.369 7.992 1.00 0.00 C ATOM 1131 C HIS B 595 2.484 3.969 7.501 1.00 0.00 C ATOM 1132 O HIS B 595 3.193 3.213 8.164 1.00 0.00 O ATOM 1133 CB HIS B 595 0.126 3.199 7.825 1.00 0.00 C ATOM 1134 CG HIS B 595 0.079 2.285 9.010 1.00 0.00 C ATOM 1135 ND1 HIS B 595 1.140 2.120 9.875 1.00 0.00 N ATOM 1136 CD2 HIS B 595 -0.910 1.486 9.473 1.00 0.00 C ATOM 1137 CE1 HIS B 595 0.806 1.257 10.818 1.00 0.00 C ATOM 1138 NE2 HIS B 595 -0.433 0.857 10.597 1.00 0.00 N ATOM 0 H HIS B 595 0.386 5.370 6.291 1.00 0.00 H new ATOM 0 HA HIS B 595 1.164 4.626 9.049 1.00 0.00 H new ATOM 0 HB2 HIS B 595 -0.874 3.591 7.639 1.00 0.00 H new ATOM 0 HB3 HIS B 595 0.412 2.624 6.944 1.00 0.00 H new ATOM 0 HD1 HIS B 595 2.042 2.591 9.799 1.00 0.00 H new ATOM 0 HD2 HIS B 595 -1.892 1.365 9.039 1.00 0.00 H new ATOM 0 HE1 HIS B 595 1.439 0.934 11.631 1.00 0.00 H new ATOM 1146 N MET B 596 2.864 4.482 6.335 1.00 0.00 N ATOM 1147 CA MET B 596 4.167 4.178 5.756 1.00 0.00 C ATOM 1148 C MET B 596 5.211 5.198 6.200 1.00 0.00 C ATOM 1149 O MET B 596 6.377 4.859 6.404 1.00 0.00 O ATOM 1150 CB MET B 596 4.078 4.154 4.229 1.00 0.00 C ATOM 1151 CG MET B 596 3.517 2.855 3.674 1.00 0.00 C ATOM 1152 SD MET B 596 3.877 2.636 1.920 1.00 0.00 S ATOM 1153 CE MET B 596 3.512 4.274 1.293 1.00 0.00 C ATOM 0 H MET B 596 2.288 5.109 5.773 1.00 0.00 H new ATOM 0 HA MET B 596 4.473 3.194 6.110 1.00 0.00 H new ATOM 0 HB2 MET B 596 3.452 4.982 3.897 1.00 0.00 H new ATOM 0 HB3 MET B 596 5.072 4.318 3.813 1.00 0.00 H new ATOM 0 HG2 MET B 596 3.931 2.016 4.233 1.00 0.00 H new ATOM 0 HG3 MET B 596 2.438 2.836 3.825 1.00 0.00 H new ATOM 0 HE1 MET B 596 3.461 4.244 0.205 1.00 0.00 H new ATOM 0 HE2 MET B 596 2.555 4.611 1.692 1.00 0.00 H new ATOM 0 HE3 MET B 596 4.297 4.965 1.601 1.00 0.00 H new ATOM 1163 N LEU B 597 4.784 6.447 6.347 1.00 0.00 N ATOM 1164 CA LEU B 597 5.682 7.518 6.767 1.00 0.00 C ATOM 1165 C LEU B 597 6.209 7.266 8.176 1.00 0.00 C ATOM 1166 O LEU B 597 7.157 7.912 8.619 1.00 0.00 O ATOM 1167 CB LEU B 597 4.961 8.866 6.713 1.00 0.00 C ATOM 1168 CG LEU B 597 4.210 9.276 7.980 1.00 0.00 C ATOM 1169 CD1 LEU B 597 3.346 8.130 8.483 1.00 0.00 C ATOM 1170 CD2 LEU B 597 5.186 9.723 9.058 1.00 0.00 C ATOM 0 H LEU B 597 3.822 6.744 6.182 1.00 0.00 H new ATOM 0 HA LEU B 597 6.529 7.538 6.081 1.00 0.00 H new ATOM 0 HB2 LEU B 597 5.694 9.639 6.483 1.00 0.00 H new ATOM 0 HB3 LEU B 597 4.252 8.843 5.886 1.00 0.00 H new ATOM 0 HG LEU B 597 3.559 10.116 7.737 1.00 0.00 H new ATOM 0 HD11 LEU B 597 2.819 8.440 9.385 1.00 0.00 H new ATOM 0 HD12 LEU B 597 2.622 7.857 7.716 1.00 0.00 H new ATOM 0 HD13 LEU B 597 3.977 7.271 8.709 1.00 0.00 H new ATOM 0 HD21 LEU B 597 4.633 10.011 9.952 1.00 0.00 H new ATOM 0 HD22 LEU B 597 5.863 8.903 9.298 1.00 0.00 H new ATOM 0 HD23 LEU B 597 5.762 10.575 8.697 1.00 0.00 H new ATOM 1182 N GLU B 598 5.588 6.320 8.874 1.00 0.00 N ATOM 1183 CA GLU B 598 5.995 5.982 10.233 1.00 0.00 C ATOM 1184 C GLU B 598 6.963 4.802 10.233 1.00 0.00 C ATOM 1185 O GLU B 598 6.984 4.004 11.169 1.00 0.00 O ATOM 1186 CB GLU B 598 4.771 5.652 11.089 1.00 0.00 C ATOM 1187 CG GLU B 598 4.027 4.409 10.634 1.00 0.00 C ATOM 1188 CD GLU B 598 3.359 3.676 11.781 1.00 0.00 C ATOM 1189 OE1 GLU B 598 2.240 4.074 12.168 1.00 0.00 O ATOM 1190 OE2 GLU B 598 3.954 2.704 12.293 1.00 0.00 O ATOM 0 H GLU B 598 4.802 5.775 8.521 1.00 0.00 H new ATOM 0 HA GLU B 598 6.504 6.847 10.658 1.00 0.00 H new ATOM 0 HB2 GLU B 598 5.087 5.517 12.123 1.00 0.00 H new ATOM 0 HB3 GLU B 598 4.087 6.501 11.073 1.00 0.00 H new ATOM 0 HG2 GLU B 598 3.273 4.690 9.899 1.00 0.00 H new ATOM 0 HG3 GLU B 598 4.724 3.736 10.134 1.00 0.00 H new ATOM 1197 N SER B 599 7.761 4.699 9.175 1.00 0.00 N ATOM 1198 CA SER B 599 8.728 3.615 9.050 1.00 0.00 C ATOM 1199 C SER B 599 9.809 3.966 8.033 1.00 0.00 C ATOM 1200 O SER B 599 9.536 4.499 6.957 1.00 0.00 O ATOM 1201 CB SER B 599 8.024 2.321 8.637 1.00 0.00 C ATOM 1202 OG SER B 599 7.951 1.411 9.722 1.00 0.00 O ATOM 0 H SER B 599 7.757 5.353 8.392 1.00 0.00 H new ATOM 0 HA SER B 599 9.201 3.469 10.021 1.00 0.00 H new ATOM 0 HB2 SER B 599 7.019 2.548 8.280 1.00 0.00 H new ATOM 0 HB3 SER B 599 8.560 1.860 7.807 1.00 0.00 H new ATOM 0 HG SER B 599 7.638 1.881 10.523 1.00 0.00 H new ATOM 1208 N PRO B 600 11.069 3.660 8.380 1.00 0.00 N ATOM 1209 CA PRO B 600 12.217 3.933 7.511 1.00 0.00 C ATOM 1210 C PRO B 600 12.236 3.039 6.276 1.00 0.00 C ATOM 1211 O PRO B 600 12.399 3.518 5.155 1.00 0.00 O ATOM 1212 CB PRO B 600 13.420 3.631 8.409 1.00 0.00 C ATOM 1213 CG PRO B 600 12.908 2.659 9.414 1.00 0.00 C ATOM 1214 CD PRO B 600 11.467 3.023 9.646 1.00 0.00 C ATOM 0 HA PRO B 600 12.202 4.951 7.123 1.00 0.00 H new ATOM 0 HB2 PRO B 600 14.246 3.210 7.836 1.00 0.00 H new ATOM 0 HB3 PRO B 600 13.793 4.536 8.888 1.00 0.00 H new ATOM 0 HG2 PRO B 600 12.998 1.636 9.049 1.00 0.00 H new ATOM 0 HG3 PRO B 600 13.479 2.718 10.340 1.00 0.00 H new ATOM 0 HD2 PRO B 600 10.860 2.144 9.862 1.00 0.00 H new ATOM 0 HD3 PRO B 600 11.355 3.703 10.491 1.00 0.00 H new ATOM 1222 N GLU B 601 12.069 1.738 6.491 1.00 0.00 N ATOM 1223 CA GLU B 601 12.067 0.777 5.394 1.00 0.00 C ATOM 1224 C GLU B 601 10.948 1.084 4.404 1.00 0.00 C ATOM 1225 O GLU B 601 10.986 0.649 3.253 1.00 0.00 O ATOM 1226 CB GLU B 601 11.910 -0.646 5.933 1.00 0.00 C ATOM 1227 CG GLU B 601 13.223 -1.290 6.346 1.00 0.00 C ATOM 1228 CD GLU B 601 13.111 -2.793 6.509 1.00 0.00 C ATOM 1229 OE1 GLU B 601 13.303 -3.515 5.508 1.00 0.00 O ATOM 1230 OE2 GLU B 601 12.830 -3.247 7.638 1.00 0.00 O ATOM 0 H GLU B 601 11.933 1.325 7.414 1.00 0.00 H new ATOM 0 HA GLU B 601 13.021 0.857 4.873 1.00 0.00 H new ATOM 0 HB2 GLU B 601 11.238 -0.628 6.791 1.00 0.00 H new ATOM 0 HB3 GLU B 601 11.436 -1.264 5.170 1.00 0.00 H new ATOM 0 HG2 GLU B 601 13.984 -1.065 5.599 1.00 0.00 H new ATOM 0 HG3 GLU B 601 13.559 -0.851 7.285 1.00 0.00 H new ATOM 1237 N SER B 602 9.951 1.836 4.860 1.00 0.00 N ATOM 1238 CA SER B 602 8.818 2.198 4.017 1.00 0.00 C ATOM 1239 C SER B 602 9.073 3.523 3.304 1.00 0.00 C ATOM 1240 O SER B 602 9.008 3.604 2.077 1.00 0.00 O ATOM 1241 CB SER B 602 7.542 2.293 4.854 1.00 0.00 C ATOM 1242 OG SER B 602 6.399 2.436 4.028 1.00 0.00 O ATOM 0 H SER B 602 9.905 2.206 5.809 1.00 0.00 H new ATOM 0 HA SER B 602 8.693 1.419 3.265 1.00 0.00 H new ATOM 0 HB2 SER B 602 7.440 1.399 5.470 1.00 0.00 H new ATOM 0 HB3 SER B 602 7.612 3.142 5.534 1.00 0.00 H new ATOM 0 HG SER B 602 6.046 1.550 3.802 1.00 0.00 H new ATOM 1248 N LEU B 603 9.363 4.559 4.083 1.00 0.00 N ATOM 1249 CA LEU B 603 9.627 5.883 3.529 1.00 0.00 C ATOM 1250 C LEU B 603 10.688 5.812 2.435 1.00 0.00 C ATOM 1251 O LEU B 603 10.424 6.140 1.278 1.00 0.00 O ATOM 1252 CB LEU B 603 10.080 6.839 4.633 1.00 0.00 C ATOM 1253 CG LEU B 603 10.318 8.289 4.210 1.00 0.00 C ATOM 1254 CD1 LEU B 603 11.697 8.444 3.587 1.00 0.00 C ATOM 1255 CD2 LEU B 603 9.238 8.745 3.240 1.00 0.00 C ATOM 0 H LEU B 603 9.421 4.508 5.100 1.00 0.00 H new ATOM 0 HA LEU B 603 8.702 6.258 3.090 1.00 0.00 H new ATOM 0 HB2 LEU B 603 9.330 6.831 5.423 1.00 0.00 H new ATOM 0 HB3 LEU B 603 11.003 6.452 5.065 1.00 0.00 H new ATOM 0 HG LEU B 603 10.271 8.919 5.098 1.00 0.00 H new ATOM 0 HD11 LEU B 603 11.848 9.482 3.292 1.00 0.00 H new ATOM 0 HD12 LEU B 603 12.458 8.158 4.313 1.00 0.00 H new ATOM 0 HD13 LEU B 603 11.774 7.803 2.709 1.00 0.00 H new ATOM 0 HD21 LEU B 603 9.423 9.779 2.949 1.00 0.00 H new ATOM 0 HD22 LEU B 603 9.254 8.111 2.354 1.00 0.00 H new ATOM 0 HD23 LEU B 603 8.263 8.672 3.721 1.00 0.00 H new ATOM 1267 N ARG B 604 11.888 5.380 2.808 1.00 0.00 N ATOM 1268 CA ARG B 604 12.988 5.265 1.859 1.00 0.00 C ATOM 1269 C ARG B 604 12.590 4.399 0.667 1.00 0.00 C ATOM 1270 O ARG B 604 13.007 4.652 -0.463 1.00 0.00 O ATOM 1271 CB ARG B 604 14.222 4.673 2.543 1.00 0.00 C ATOM 1272 CG ARG B 604 14.949 5.658 3.445 1.00 0.00 C ATOM 1273 CD ARG B 604 16.150 5.013 4.119 1.00 0.00 C ATOM 1274 NE ARG B 604 17.283 4.879 3.207 1.00 0.00 N ATOM 1275 CZ ARG B 604 18.063 5.894 2.850 1.00 0.00 C ATOM 1276 NH1 ARG B 604 17.834 7.110 3.326 1.00 0.00 N ATOM 1277 NH2 ARG B 604 19.075 5.693 2.016 1.00 0.00 N ATOM 0 H ARG B 604 12.123 5.104 3.761 1.00 0.00 H new ATOM 0 HA ARG B 604 13.227 6.265 1.497 1.00 0.00 H new ATOM 0 HB2 ARG B 604 13.920 3.808 3.133 1.00 0.00 H new ATOM 0 HB3 ARG B 604 14.913 4.314 1.780 1.00 0.00 H new ATOM 0 HG2 ARG B 604 15.277 6.517 2.859 1.00 0.00 H new ATOM 0 HG3 ARG B 604 14.262 6.033 4.204 1.00 0.00 H new ATOM 0 HD2 ARG B 604 16.447 5.611 4.980 1.00 0.00 H new ATOM 0 HD3 ARG B 604 15.869 4.029 4.496 1.00 0.00 H new ATOM 0 HE ARG B 604 17.487 3.956 2.823 1.00 0.00 H new ATOM 0 HH11 ARG B 604 17.057 7.268 3.968 1.00 0.00 H new ATOM 0 HH12 ARG B 604 18.434 7.887 3.050 1.00 0.00 H new ATOM 0 HH21 ARG B 604 19.255 4.759 1.648 1.00 0.00 H new ATOM 0 HH22 ARG B 604 19.673 6.473 1.743 1.00 0.00 H new ATOM 1291 N SER B 605 11.781 3.377 0.929 1.00 0.00 N ATOM 1292 CA SER B 605 11.330 2.471 -0.121 1.00 0.00 C ATOM 1293 C SER B 605 10.489 3.214 -1.155 1.00 0.00 C ATOM 1294 O SER B 605 10.731 3.114 -2.358 1.00 0.00 O ATOM 1295 CB SER B 605 10.521 1.321 0.482 1.00 0.00 C ATOM 1296 OG SER B 605 9.544 0.852 -0.431 1.00 0.00 O ATOM 0 H SER B 605 11.425 3.156 1.859 1.00 0.00 H new ATOM 0 HA SER B 605 12.210 2.064 -0.619 1.00 0.00 H new ATOM 0 HB2 SER B 605 11.190 0.505 0.754 1.00 0.00 H new ATOM 0 HB3 SER B 605 10.036 1.655 1.399 1.00 0.00 H new ATOM 0 HG SER B 605 9.041 0.116 -0.023 1.00 0.00 H new ATOM 1302 N LYS B 606 9.498 3.959 -0.677 1.00 0.00 N ATOM 1303 CA LYS B 606 8.619 4.720 -1.557 1.00 0.00 C ATOM 1304 C LYS B 606 9.415 5.726 -2.383 1.00 0.00 C ATOM 1305 O LYS B 606 9.371 5.707 -3.613 1.00 0.00 O ATOM 1306 CB LYS B 606 7.550 5.448 -0.739 1.00 0.00 C ATOM 1307 CG LYS B 606 6.568 4.514 -0.053 1.00 0.00 C ATOM 1308 CD LYS B 606 5.869 3.608 -1.052 1.00 0.00 C ATOM 1309 CE LYS B 606 5.125 4.411 -2.107 1.00 0.00 C ATOM 1310 NZ LYS B 606 4.434 3.531 -3.090 1.00 0.00 N ATOM 0 H LYS B 606 9.283 4.052 0.316 1.00 0.00 H new ATOM 0 HA LYS B 606 8.133 4.021 -2.237 1.00 0.00 H new ATOM 0 HB2 LYS B 606 8.039 6.065 0.015 1.00 0.00 H new ATOM 0 HB3 LYS B 606 6.999 6.123 -1.395 1.00 0.00 H new ATOM 0 HG2 LYS B 606 7.095 3.907 0.683 1.00 0.00 H new ATOM 0 HG3 LYS B 606 5.826 5.100 0.490 1.00 0.00 H new ATOM 0 HD2 LYS B 606 6.603 2.963 -1.535 1.00 0.00 H new ATOM 0 HD3 LYS B 606 5.169 2.958 -0.527 1.00 0.00 H new ATOM 0 HE2 LYS B 606 4.394 5.058 -1.622 1.00 0.00 H new ATOM 0 HE3 LYS B 606 5.827 5.060 -2.631 1.00 0.00 H new ATOM 0 HZ1 LYS B 606 3.981 4.116 -3.821 1.00 0.00 H new ATOM 0 HZ2 LYS B 606 5.127 2.896 -3.535 1.00 0.00 H new ATOM 0 HZ3 LYS B 606 3.710 2.966 -2.601 1.00 0.00 H new ATOM 1324 N VAL B 607 10.143 6.602 -1.698 1.00 0.00 N ATOM 1325 CA VAL B 607 10.951 7.614 -2.369 1.00 0.00 C ATOM 1326 C VAL B 607 11.838 6.988 -3.440 1.00 0.00 C ATOM 1327 O VAL B 607 11.849 7.431 -4.588 1.00 0.00 O ATOM 1328 CB VAL B 607 11.837 8.379 -1.367 1.00 0.00 C ATOM 1329 CG1 VAL B 607 12.703 9.399 -2.091 1.00 0.00 C ATOM 1330 CG2 VAL B 607 10.981 9.052 -0.305 1.00 0.00 C ATOM 0 H VAL B 607 10.190 6.632 -0.680 1.00 0.00 H new ATOM 0 HA VAL B 607 10.258 8.313 -2.838 1.00 0.00 H new ATOM 0 HB VAL B 607 12.495 7.665 -0.872 1.00 0.00 H new ATOM 0 HG11 VAL B 607 13.322 9.930 -1.368 1.00 0.00 H new ATOM 0 HG12 VAL B 607 13.343 8.888 -2.810 1.00 0.00 H new ATOM 0 HG13 VAL B 607 12.065 10.111 -2.615 1.00 0.00 H new ATOM 0 HG21 VAL B 607 11.623 9.588 0.394 1.00 0.00 H new ATOM 0 HG22 VAL B 607 10.297 9.755 -0.781 1.00 0.00 H new ATOM 0 HG23 VAL B 607 10.409 8.297 0.234 1.00 0.00 H new ATOM 1340 N ASP B 608 12.580 5.955 -3.056 1.00 0.00 N ATOM 1341 CA ASP B 608 13.469 5.266 -3.984 1.00 0.00 C ATOM 1342 C ASP B 608 12.697 4.747 -5.192 1.00 0.00 C ATOM 1343 O ASP B 608 13.067 5.009 -6.336 1.00 0.00 O ATOM 1344 CB ASP B 608 14.178 4.108 -3.280 1.00 0.00 C ATOM 1345 CG ASP B 608 15.044 3.299 -4.225 1.00 0.00 C ATOM 1346 OD1 ASP B 608 15.515 3.867 -5.233 1.00 0.00 O ATOM 1347 OD2 ASP B 608 15.252 2.097 -3.956 1.00 0.00 O ATOM 0 H ASP B 608 12.583 5.577 -2.109 1.00 0.00 H new ATOM 0 HA ASP B 608 14.215 5.981 -4.332 1.00 0.00 H new ATOM 0 HB2 ASP B 608 14.796 4.501 -2.472 1.00 0.00 H new ATOM 0 HB3 ASP B 608 13.435 3.454 -2.824 1.00 0.00 H new ATOM 1352 N GLU B 609 11.624 4.008 -4.930 1.00 0.00 N ATOM 1353 CA GLU B 609 10.801 3.450 -5.997 1.00 0.00 C ATOM 1354 C GLU B 609 10.347 4.542 -6.961 1.00 0.00 C ATOM 1355 O GLU B 609 10.563 4.447 -8.169 1.00 0.00 O ATOM 1356 CB GLU B 609 9.583 2.734 -5.410 1.00 0.00 C ATOM 1357 CG GLU B 609 9.268 1.412 -6.090 1.00 0.00 C ATOM 1358 CD GLU B 609 8.697 0.384 -5.132 1.00 0.00 C ATOM 1359 OE1 GLU B 609 8.216 0.785 -4.051 1.00 0.00 O ATOM 1360 OE2 GLU B 609 8.733 -0.820 -5.462 1.00 0.00 O ATOM 0 H GLU B 609 11.304 3.782 -3.988 1.00 0.00 H new ATOM 0 HA GLU B 609 11.405 2.730 -6.549 1.00 0.00 H new ATOM 0 HB2 GLU B 609 9.754 2.555 -4.348 1.00 0.00 H new ATOM 0 HB3 GLU B 609 8.715 3.389 -5.487 1.00 0.00 H new ATOM 0 HG2 GLU B 609 8.557 1.584 -6.898 1.00 0.00 H new ATOM 0 HG3 GLU B 609 10.176 1.015 -6.543 1.00 0.00 H new ATOM 1367 N ALA B 610 9.717 5.578 -6.418 1.00 0.00 N ATOM 1368 CA ALA B 610 9.234 6.689 -7.229 1.00 0.00 C ATOM 1369 C ALA B 610 10.331 7.216 -8.148 1.00 0.00 C ATOM 1370 O ALA B 610 10.187 7.210 -9.370 1.00 0.00 O ATOM 1371 CB ALA B 610 8.708 7.804 -6.338 1.00 0.00 C ATOM 0 H ALA B 610 9.529 5.671 -5.420 1.00 0.00 H new ATOM 0 HA ALA B 610 8.419 6.323 -7.853 1.00 0.00 H new ATOM 0 HB1 ALA B 610 8.351 8.627 -6.957 1.00 0.00 H new ATOM 0 HB2 ALA B 610 7.887 7.426 -5.728 1.00 0.00 H new ATOM 0 HB3 ALA B 610 9.508 8.159 -5.689 1.00 0.00 H new ATOM 1377 N VAL B 611 11.428 7.672 -7.551 1.00 0.00 N ATOM 1378 CA VAL B 611 12.550 8.202 -8.316 1.00 0.00 C ATOM 1379 C VAL B 611 12.952 7.248 -9.435 1.00 0.00 C ATOM 1380 O VAL B 611 13.228 7.672 -10.557 1.00 0.00 O ATOM 1381 CB VAL B 611 13.771 8.462 -7.414 1.00 0.00 C ATOM 1382 CG1 VAL B 611 14.923 9.033 -8.226 1.00 0.00 C ATOM 1383 CG2 VAL B 611 13.399 9.396 -6.271 1.00 0.00 C ATOM 0 H VAL B 611 11.563 7.685 -6.540 1.00 0.00 H new ATOM 0 HA VAL B 611 12.220 9.146 -8.749 1.00 0.00 H new ATOM 0 HB VAL B 611 14.095 7.513 -6.987 1.00 0.00 H new ATOM 0 HG11 VAL B 611 15.777 9.210 -7.572 1.00 0.00 H new ATOM 0 HG12 VAL B 611 15.204 8.325 -9.006 1.00 0.00 H new ATOM 0 HG13 VAL B 611 14.615 9.973 -8.683 1.00 0.00 H new ATOM 0 HG21 VAL B 611 14.273 9.569 -5.643 1.00 0.00 H new ATOM 0 HG22 VAL B 611 13.049 10.346 -6.676 1.00 0.00 H new ATOM 0 HG23 VAL B 611 12.608 8.943 -5.674 1.00 0.00 H new ATOM 1393 N ALA B 612 12.983 5.957 -9.121 1.00 0.00 N ATOM 1394 CA ALA B 612 13.349 4.942 -10.101 1.00 0.00 C ATOM 1395 C ALA B 612 12.354 4.909 -11.256 1.00 0.00 C ATOM 1396 O ALA B 612 12.728 4.672 -12.405 1.00 0.00 O ATOM 1397 CB ALA B 612 13.436 3.575 -9.438 1.00 0.00 C ATOM 0 H ALA B 612 12.759 5.590 -8.196 1.00 0.00 H new ATOM 0 HA ALA B 612 14.327 5.200 -10.506 1.00 0.00 H new ATOM 0 HB1 ALA B 612 13.710 2.827 -10.182 1.00 0.00 H new ATOM 0 HB2 ALA B 612 14.191 3.599 -8.652 1.00 0.00 H new ATOM 0 HB3 ALA B 612 12.469 3.319 -9.005 1.00 0.00 H new ATOM 1403 N VAL B 613 11.084 5.148 -10.944 1.00 0.00 N ATOM 1404 CA VAL B 613 10.034 5.146 -11.956 1.00 0.00 C ATOM 1405 C VAL B 613 10.197 6.316 -12.919 1.00 0.00 C ATOM 1406 O VAL B 613 10.032 6.166 -14.130 1.00 0.00 O ATOM 1407 CB VAL B 613 8.636 5.214 -11.314 1.00 0.00 C ATOM 1408 CG1 VAL B 613 7.561 5.318 -12.385 1.00 0.00 C ATOM 1409 CG2 VAL B 613 8.399 4.003 -10.424 1.00 0.00 C ATOM 0 H VAL B 613 10.757 5.346 -9.998 1.00 0.00 H new ATOM 0 HA VAL B 613 10.127 4.210 -12.507 1.00 0.00 H new ATOM 0 HB VAL B 613 8.583 6.108 -10.693 1.00 0.00 H new ATOM 0 HG11 VAL B 613 6.580 5.365 -11.912 1.00 0.00 H new ATOM 0 HG12 VAL B 613 7.722 6.219 -12.976 1.00 0.00 H new ATOM 0 HG13 VAL B 613 7.609 4.444 -13.035 1.00 0.00 H new ATOM 0 HG21 VAL B 613 7.406 4.068 -9.978 1.00 0.00 H new ATOM 0 HG22 VAL B 613 8.471 3.094 -11.020 1.00 0.00 H new ATOM 0 HG23 VAL B 613 9.150 3.979 -9.634 1.00 0.00 H new ATOM 1419 N LEU B 614 10.524 7.483 -12.373 1.00 0.00 N ATOM 1420 CA LEU B 614 10.710 8.681 -13.184 1.00 0.00 C ATOM 1421 C LEU B 614 11.875 8.507 -14.153 1.00 0.00 C ATOM 1422 O LEU B 614 11.975 9.219 -15.152 1.00 0.00 O ATOM 1423 CB LEU B 614 10.956 9.895 -12.287 1.00 0.00 C ATOM 1424 CG LEU B 614 10.076 9.998 -11.040 1.00 0.00 C ATOM 1425 CD1 LEU B 614 10.265 11.346 -10.363 1.00 0.00 C ATOM 1426 CD2 LEU B 614 8.614 9.780 -11.401 1.00 0.00 C ATOM 0 H LEU B 614 10.666 7.625 -11.373 1.00 0.00 H new ATOM 0 HA LEU B 614 9.801 8.843 -13.763 1.00 0.00 H new ATOM 0 HB2 LEU B 614 11.999 9.883 -11.971 1.00 0.00 H new ATOM 0 HB3 LEU B 614 10.814 10.797 -12.883 1.00 0.00 H new ATOM 0 HG LEU B 614 10.377 9.219 -10.340 1.00 0.00 H new ATOM 0 HD11 LEU B 614 9.631 11.401 -9.478 1.00 0.00 H new ATOM 0 HD12 LEU B 614 11.308 11.463 -10.070 1.00 0.00 H new ATOM 0 HD13 LEU B 614 9.991 12.142 -11.055 1.00 0.00 H new ATOM 0 HD21 LEU B 614 8.002 9.857 -10.502 1.00 0.00 H new ATOM 0 HD22 LEU B 614 8.300 10.537 -12.120 1.00 0.00 H new ATOM 0 HD23 LEU B 614 8.491 8.790 -11.840 1.00 0.00 H new ATOM 1438 N GLN B 615 12.751 7.554 -13.852 1.00 0.00 N ATOM 1439 CA GLN B 615 13.908 7.285 -14.698 1.00 0.00 C ATOM 1440 C GLN B 615 13.487 7.094 -16.151 1.00 0.00 C ATOM 1441 O GLN B 615 14.245 7.396 -17.072 1.00 0.00 O ATOM 1442 CB GLN B 615 14.652 6.044 -14.203 1.00 0.00 C ATOM 1443 CG GLN B 615 14.204 4.757 -14.877 1.00 0.00 C ATOM 1444 CD GLN B 615 14.707 3.518 -14.163 1.00 0.00 C ATOM 1445 OE1 GLN B 615 13.937 2.606 -13.860 1.00 0.00 O ATOM 1446 NE2 GLN B 615 16.005 3.478 -13.888 1.00 0.00 N ATOM 0 H GLN B 615 12.682 6.955 -13.029 1.00 0.00 H new ATOM 0 HA GLN B 615 14.575 8.145 -14.642 1.00 0.00 H new ATOM 0 HB2 GLN B 615 15.720 6.180 -14.371 1.00 0.00 H new ATOM 0 HB3 GLN B 615 14.508 5.950 -13.127 1.00 0.00 H new ATOM 0 HG2 GLN B 615 13.115 4.732 -14.916 1.00 0.00 H new ATOM 0 HG3 GLN B 615 14.560 4.748 -15.907 1.00 0.00 H new ATOM 0 HE21 GLN B 615 16.608 4.256 -14.157 1.00 0.00 H new ATOM 0 HE22 GLN B 615 16.400 2.669 -13.408 1.00 0.00 H new ATOM 1455 N ALA B 616 12.273 6.590 -16.349 1.00 0.00 N ATOM 1456 CA ALA B 616 11.751 6.360 -17.691 1.00 0.00 C ATOM 1457 C ALA B 616 11.323 7.670 -18.345 1.00 0.00 C ATOM 1458 O ALA B 616 11.569 7.892 -19.531 1.00 0.00 O ATOM 1459 CB ALA B 616 10.584 5.386 -17.643 1.00 0.00 C ATOM 0 H ALA B 616 11.633 6.333 -15.598 1.00 0.00 H new ATOM 0 HA ALA B 616 12.548 5.926 -18.295 1.00 0.00 H new ATOM 0 HB1 ALA B 616 10.204 5.223 -18.652 1.00 0.00 H new ATOM 0 HB2 ALA B 616 10.919 4.437 -17.224 1.00 0.00 H new ATOM 0 HB3 ALA B 616 9.791 5.798 -17.019 1.00 0.00 H new ATOM 1465 N HIS B 617 10.681 8.533 -17.565 1.00 0.00 N ATOM 1466 CA HIS B 617 10.218 9.822 -18.070 1.00 0.00 C ATOM 1467 C HIS B 617 11.377 10.808 -18.183 1.00 0.00 C ATOM 1468 O HIS B 617 11.775 11.187 -19.284 1.00 0.00 O ATOM 1469 CB HIS B 617 9.134 10.392 -17.154 1.00 0.00 C ATOM 1470 CG HIS B 617 8.276 11.427 -17.815 1.00 0.00 C ATOM 1471 ND1 HIS B 617 8.691 12.164 -18.904 1.00 0.00 N ATOM 1472 CD2 HIS B 617 7.019 11.844 -17.536 1.00 0.00 C ATOM 1473 CE1 HIS B 617 7.726 12.992 -19.265 1.00 0.00 C ATOM 1474 NE2 HIS B 617 6.700 12.817 -18.451 1.00 0.00 N ATOM 0 H HIS B 617 10.469 8.364 -16.582 1.00 0.00 H new ATOM 0 HA HIS B 617 9.798 9.667 -19.064 1.00 0.00 H new ATOM 0 HB2 HIS B 617 8.501 9.577 -16.803 1.00 0.00 H new ATOM 0 HB3 HIS B 617 9.606 10.830 -16.275 1.00 0.00 H new ATOM 0 HD2 HIS B 617 6.385 11.479 -16.742 1.00 0.00 H new ATOM 0 HE1 HIS B 617 7.769 13.693 -20.086 1.00 0.00 H new ATOM 0 HE2 HIS B 617 5.815 13.322 -18.495 1.00 0.00 H new ATOM 1482 N GLN B 618 11.910 11.221 -17.037 1.00 0.00 N ATOM 1483 CA GLN B 618 13.021 12.165 -17.009 1.00 0.00 C ATOM 1484 C GLN B 618 13.537 12.356 -15.586 1.00 0.00 C ATOM 1485 O GLN B 618 12.770 12.302 -14.626 1.00 0.00 O ATOM 1486 CB GLN B 618 12.589 13.511 -17.593 1.00 0.00 C ATOM 1487 CG GLN B 618 11.700 14.320 -16.663 1.00 0.00 C ATOM 1488 CD GLN B 618 11.322 15.669 -17.244 1.00 0.00 C ATOM 1489 OE1 GLN B 618 11.078 15.794 -18.444 1.00 0.00 O ATOM 1490 NE2 GLN B 618 11.274 16.687 -16.393 1.00 0.00 N ATOM 0 H GLN B 618 11.591 10.917 -16.117 1.00 0.00 H new ATOM 0 HA GLN B 618 13.828 11.756 -17.617 1.00 0.00 H new ATOM 0 HB2 GLN B 618 13.477 14.096 -17.833 1.00 0.00 H new ATOM 0 HB3 GLN B 618 12.059 13.338 -18.530 1.00 0.00 H new ATOM 0 HG2 GLN B 618 10.793 13.754 -16.449 1.00 0.00 H new ATOM 0 HG3 GLN B 618 12.214 14.469 -15.713 1.00 0.00 H new ATOM 0 HE21 GLN B 618 11.484 16.537 -15.406 1.00 0.00 H new ATOM 0 HE22 GLN B 618 11.027 17.619 -16.726 1.00 0.00 H new ATOM 1499 N ALA B 619 14.841 12.579 -15.460 1.00 0.00 N ATOM 1500 CA ALA B 619 15.459 12.780 -14.155 1.00 0.00 C ATOM 1501 C ALA B 619 15.419 14.249 -13.749 1.00 0.00 C ATOM 1502 O ALA B 619 14.716 14.626 -12.811 1.00 0.00 O ATOM 1503 CB ALA B 619 16.893 12.272 -14.166 1.00 0.00 C ATOM 0 H ALA B 619 15.490 12.625 -16.246 1.00 0.00 H new ATOM 0 HA ALA B 619 14.890 12.211 -13.420 1.00 0.00 H new ATOM 0 HB1 ALA B 619 17.342 12.429 -13.185 1.00 0.00 H new ATOM 0 HB2 ALA B 619 16.900 11.208 -14.403 1.00 0.00 H new ATOM 0 HB3 ALA B 619 17.466 12.815 -14.918 1.00 0.00 H new ATOM 1509 N LYS B 620 16.177 15.075 -14.461 1.00 0.00 N ATOM 1510 CA LYS B 620 16.229 16.505 -14.176 1.00 0.00 C ATOM 1511 C LYS B 620 15.962 17.321 -15.437 1.00 0.00 C ATOM 1512 O LYS B 620 16.444 18.445 -15.572 1.00 0.00 O ATOM 1513 CB LYS B 620 17.593 16.880 -13.592 1.00 0.00 C ATOM 1514 CG LYS B 620 17.555 18.107 -12.698 1.00 0.00 C ATOM 1515 CD LYS B 620 18.911 18.790 -12.631 1.00 0.00 C ATOM 1516 CE LYS B 620 18.771 20.279 -12.352 1.00 0.00 C ATOM 1517 NZ LYS B 620 20.096 20.953 -12.263 1.00 0.00 N ATOM 0 H LYS B 620 16.765 14.779 -15.241 1.00 0.00 H new ATOM 0 HA LYS B 620 15.453 16.733 -13.446 1.00 0.00 H new ATOM 0 HB2 LYS B 620 17.979 16.036 -13.020 1.00 0.00 H new ATOM 0 HB3 LYS B 620 18.292 17.058 -14.409 1.00 0.00 H new ATOM 0 HG2 LYS B 620 16.811 18.809 -13.074 1.00 0.00 H new ATOM 0 HG3 LYS B 620 17.242 17.818 -11.695 1.00 0.00 H new ATOM 0 HD2 LYS B 620 19.515 18.327 -11.850 1.00 0.00 H new ATOM 0 HD3 LYS B 620 19.441 18.643 -13.572 1.00 0.00 H new ATOM 0 HE2 LYS B 620 18.180 20.743 -13.142 1.00 0.00 H new ATOM 0 HE3 LYS B 620 18.226 20.424 -11.419 1.00 0.00 H new ATOM 0 HZ1 LYS B 620 19.958 21.966 -12.072 1.00 0.00 H new ATOM 0 HZ2 LYS B 620 20.651 20.528 -11.493 1.00 0.00 H new ATOM 0 HZ3 LYS B 620 20.606 20.836 -13.162 1.00 0.00 H new ATOM 1531 N GLU B 621 15.189 16.748 -16.354 1.00 0.00 N ATOM 1532 CA GLU B 621 14.858 17.424 -17.603 1.00 0.00 C ATOM 1533 C GLU B 621 16.122 17.814 -18.363 1.00 0.00 C ATOM 1534 O GLU B 621 16.201 18.897 -18.942 1.00 0.00 O ATOM 1535 CB GLU B 621 14.011 18.668 -17.326 1.00 0.00 C ATOM 1536 CG GLU B 621 13.157 19.099 -18.506 1.00 0.00 C ATOM 1537 CD GLU B 621 12.454 20.421 -18.267 1.00 0.00 C ATOM 1538 OE1 GLU B 621 12.953 21.217 -17.443 1.00 0.00 O ATOM 1539 OE2 GLU B 621 11.406 20.660 -18.901 1.00 0.00 O ATOM 0 H GLU B 621 14.781 15.818 -16.256 1.00 0.00 H new ATOM 0 HA GLU B 621 14.284 16.732 -18.220 1.00 0.00 H new ATOM 0 HB2 GLU B 621 13.363 18.473 -16.472 1.00 0.00 H new ATOM 0 HB3 GLU B 621 14.669 19.490 -17.045 1.00 0.00 H new ATOM 0 HG2 GLU B 621 13.785 19.181 -19.393 1.00 0.00 H new ATOM 0 HG3 GLU B 621 12.414 18.329 -18.712 1.00 0.00 H new ATOM 1546 N ALA B 622 17.109 16.924 -18.354 1.00 0.00 N ATOM 1547 CA ALA B 622 18.369 17.174 -19.043 1.00 0.00 C ATOM 1548 C ALA B 622 18.648 16.097 -20.086 1.00 0.00 C ATOM 1549 O ALA B 622 19.799 15.843 -20.437 1.00 0.00 O ATOM 1550 CB ALA B 622 19.512 17.250 -18.041 1.00 0.00 C ATOM 0 H ALA B 622 17.060 16.024 -17.877 1.00 0.00 H new ATOM 0 HA ALA B 622 18.289 18.130 -19.560 1.00 0.00 H new ATOM 0 HB1 ALA B 622 20.447 17.437 -18.569 1.00 0.00 H new ATOM 0 HB2 ALA B 622 19.325 18.060 -17.336 1.00 0.00 H new ATOM 0 HB3 ALA B 622 19.584 16.307 -17.499 1.00 0.00 H new ATOM 1556 N ALA B 623 17.586 15.467 -20.576 1.00 0.00 N ATOM 1557 CA ALA B 623 17.716 14.418 -21.580 1.00 0.00 C ATOM 1558 C ALA B 623 16.827 14.699 -22.787 1.00 0.00 C ATOM 1559 O ALA B 623 17.272 14.612 -23.932 1.00 0.00 O ATOM 1560 CB ALA B 623 17.377 13.063 -20.976 1.00 0.00 C ATOM 0 H ALA B 623 16.626 15.665 -20.294 1.00 0.00 H new ATOM 0 HA ALA B 623 18.751 14.403 -21.920 1.00 0.00 H new ATOM 0 HB1 ALA B 623 17.478 12.290 -21.737 1.00 0.00 H new ATOM 0 HB2 ALA B 623 18.058 12.852 -20.151 1.00 0.00 H new ATOM 0 HB3 ALA B 623 16.352 13.076 -20.606 1.00 0.00 H new TER 1566 ALA B 623