USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 706 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 20 LYS NZ :NH3+ 179:sc= 0.978 (180deg=-0.0165) USER MOD Set 1.2: A 88 THR OG1 : rot -87:sc= 2.12 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 41:sc= 0.211 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -0.0102 X(o=-0.01,f=-0.01) USER MOD Single : A 35 THR OG1 : rot 142:sc= 1.25 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 HIS : no HD1:sc= -0.125 X(o=-0.12,f=0) USER MOD Single : A 43 TYR OH : rot 156:sc= 1.28 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 23:sc= 1.17 USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=-6.8e-05) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc=-0.00127 K(o=-0.0013,f=-1) USER MOD Single : A 72 SER OG : rot 180:sc= 0.00632 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 HIS : no HD1:sc=-0.00746 X(o=-0.0075,f=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 GLN : amide:sc= -0.149 X(o=-0.15,f=-0.24) USER MOD Single : A 84 THR OG1 : rot 90:sc= 0.0492 USER MOD Single : A 87 ASN : amide:sc= -0.0272 K(o=-0.027,f=-0.95) USER MOD Single : A 90 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 93 HIS : no HD1:sc= -0.479 X(o=-0.48,f=-0.042) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 9 26.527 43.317 20.140 1.00 0.00 N ATOM 2 CA LYS A 9 27.101 42.299 20.965 1.00 0.00 C ATOM 3 C LYS A 9 26.116 41.325 21.513 1.00 0.00 C ATOM 4 O LYS A 9 26.476 40.149 21.504 1.00 0.00 O ATOM 5 CB LYS A 9 28.091 42.857 22.000 1.00 0.00 C ATOM 6 CG LYS A 9 28.874 41.795 22.775 1.00 0.00 C ATOM 7 CD LYS A 9 30.088 42.352 23.521 1.00 0.00 C ATOM 8 CE LYS A 9 31.296 42.625 22.623 1.00 0.00 C ATOM 9 NZ LYS A 9 32.415 43.157 23.432 1.00 0.00 N ATOM 0 HA LYS A 9 27.706 41.690 20.293 1.00 0.00 H new ATOM 0 HB2 LYS A 9 28.799 43.510 21.490 1.00 0.00 H new ATOM 0 HB3 LYS A 9 27.542 43.475 22.711 1.00 0.00 H new ATOM 0 HG2 LYS A 9 28.207 41.314 23.491 1.00 0.00 H new ATOM 0 HG3 LYS A 9 29.207 41.023 22.081 1.00 0.00 H new ATOM 0 HD2 LYS A 9 29.802 43.278 24.020 1.00 0.00 H new ATOM 0 HD3 LYS A 9 30.379 41.647 24.300 1.00 0.00 H new ATOM 0 HE2 LYS A 9 31.602 41.707 22.122 1.00 0.00 H new ATOM 0 HE3 LYS A 9 31.027 43.339 21.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 33.232 43.340 22.816 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 32.121 44.043 23.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 32.679 42.462 24.159 1.00 0.00 H new ATOM 23 N PRO A 10 24.930 41.615 21.961 1.00 0.00 N ATOM 24 CA PRO A 10 23.911 40.656 22.274 1.00 0.00 C ATOM 25 C PRO A 10 23.400 39.806 21.162 1.00 0.00 C ATOM 26 O PRO A 10 22.226 39.892 20.803 1.00 0.00 O ATOM 27 CB PRO A 10 22.779 41.465 22.902 1.00 0.00 C ATOM 28 CG PRO A 10 23.511 42.650 23.555 1.00 0.00 C ATOM 29 CD PRO A 10 24.594 42.925 22.499 1.00 0.00 C ATOM 0 HA PRO A 10 24.355 39.909 22.932 1.00 0.00 H new ATOM 0 HB2 PRO A 10 22.060 41.799 22.154 1.00 0.00 H new ATOM 0 HB3 PRO A 10 22.226 40.880 23.637 1.00 0.00 H new ATOM 0 HG2 PRO A 10 22.856 43.507 23.710 1.00 0.00 H new ATOM 0 HG3 PRO A 10 23.934 42.392 24.526 1.00 0.00 H new ATOM 0 HD2 PRO A 10 24.225 43.591 21.718 1.00 0.00 H new ATOM 0 HD3 PRO A 10 25.466 43.406 22.942 1.00 0.00 H new ATOM 37 N GLY A 11 24.251 38.954 20.563 1.00 0.00 N ATOM 38 CA GLY A 11 23.967 38.139 19.424 1.00 0.00 C ATOM 39 C GLY A 11 24.894 38.400 18.287 1.00 0.00 C ATOM 40 O GLY A 11 24.542 38.157 17.134 1.00 0.00 O ATOM 0 H GLY A 11 25.205 38.827 20.900 1.00 0.00 H new ATOM 0 HA2 GLY A 11 24.033 37.089 19.708 1.00 0.00 H new ATOM 0 HA3 GLY A 11 22.942 38.318 19.100 1.00 0.00 H new ATOM 44 N ASP A 12 26.129 38.855 18.563 1.00 0.00 N ATOM 45 CA ASP A 12 27.176 38.893 17.588 1.00 0.00 C ATOM 46 C ASP A 12 27.804 37.546 17.492 1.00 0.00 C ATOM 47 O ASP A 12 27.725 36.728 18.407 1.00 0.00 O ATOM 48 CB ASP A 12 28.196 39.990 17.934 1.00 0.00 C ATOM 49 CG ASP A 12 29.077 40.416 16.767 1.00 0.00 C ATOM 50 OD1 ASP A 12 28.836 39.996 15.603 1.00 0.00 O ATOM 51 OD2 ASP A 12 30.024 41.215 16.996 1.00 0.00 O ATOM 0 H ASP A 12 26.407 39.203 19.481 1.00 0.00 H new ATOM 0 HA ASP A 12 26.765 39.146 16.610 1.00 0.00 H new ATOM 0 HB2 ASP A 12 27.661 40.863 18.308 1.00 0.00 H new ATOM 0 HB3 ASP A 12 28.833 39.635 18.744 1.00 0.00 H new ATOM 56 N THR A 13 28.437 37.252 16.342 1.00 0.00 N ATOM 57 CA THR A 13 29.052 35.995 16.047 1.00 0.00 C ATOM 58 C THR A 13 30.527 36.179 15.931 1.00 0.00 C ATOM 59 O THR A 13 31.019 37.227 15.516 1.00 0.00 O ATOM 60 CB THR A 13 28.566 35.323 14.797 1.00 0.00 C ATOM 61 OG1 THR A 13 28.281 36.253 13.762 1.00 0.00 O ATOM 62 CG2 THR A 13 27.260 34.576 15.120 1.00 0.00 C ATOM 0 H THR A 13 28.524 37.925 15.580 1.00 0.00 H new ATOM 0 HA THR A 13 28.775 35.343 16.876 1.00 0.00 H new ATOM 0 HB THR A 13 29.354 34.652 14.455 1.00 0.00 H new ATOM 0 HG1 THR A 13 27.970 35.772 12.967 1.00 0.00 H new ATOM 0 HG21 THR A 13 26.892 34.081 14.221 1.00 0.00 H new ATOM 0 HG22 THR A 13 27.449 33.831 15.893 1.00 0.00 H new ATOM 0 HG23 THR A 13 26.513 35.286 15.475 1.00 0.00 H new ATOM 70 N PHE A 14 31.298 35.133 16.276 1.00 0.00 N ATOM 71 CA PHE A 14 32.726 35.209 16.249 1.00 0.00 C ATOM 72 C PHE A 14 33.237 33.868 15.852 1.00 0.00 C ATOM 73 O PHE A 14 32.889 32.856 16.459 1.00 0.00 O ATOM 74 CB PHE A 14 33.398 35.552 17.589 1.00 0.00 C ATOM 75 CG PHE A 14 32.592 36.460 18.454 1.00 0.00 C ATOM 76 CD1 PHE A 14 32.618 37.828 18.312 1.00 0.00 C ATOM 77 CD2 PHE A 14 31.793 35.906 19.426 1.00 0.00 C ATOM 78 CE1 PHE A 14 31.840 38.625 19.119 1.00 0.00 C ATOM 79 CE2 PHE A 14 31.023 36.694 20.250 1.00 0.00 C ATOM 80 CZ PHE A 14 31.045 38.059 20.087 1.00 0.00 C ATOM 0 H PHE A 14 30.930 34.230 16.575 1.00 0.00 H new ATOM 0 HA PHE A 14 32.967 36.018 15.559 1.00 0.00 H new ATOM 0 HB2 PHE A 14 33.594 34.628 18.133 1.00 0.00 H new ATOM 0 HB3 PHE A 14 34.364 36.017 17.391 1.00 0.00 H new ATOM 0 HD1 PHE A 14 33.253 38.278 17.563 1.00 0.00 H new ATOM 0 HD2 PHE A 14 31.769 34.833 19.545 1.00 0.00 H new ATOM 0 HE1 PHE A 14 31.854 39.697 18.992 1.00 0.00 H new ATOM 0 HE2 PHE A 14 30.408 36.245 21.016 1.00 0.00 H new ATOM 0 HZ PHE A 14 30.437 38.688 20.721 1.00 0.00 H new ATOM 90 N GLU A 15 34.106 33.800 14.828 1.00 0.00 N ATOM 91 CA GLU A 15 34.899 32.635 14.588 1.00 0.00 C ATOM 92 C GLU A 15 36.153 32.759 15.383 1.00 0.00 C ATOM 93 O GLU A 15 36.969 33.654 15.171 1.00 0.00 O ATOM 94 CB GLU A 15 35.244 32.342 13.118 1.00 0.00 C ATOM 95 CG GLU A 15 34.103 31.726 12.307 1.00 0.00 C ATOM 96 CD GLU A 15 34.577 30.925 11.104 1.00 0.00 C ATOM 97 OE1 GLU A 15 35.808 30.693 10.962 1.00 0.00 O ATOM 98 OE2 GLU A 15 33.736 30.462 10.288 1.00 0.00 O ATOM 0 H GLU A 15 34.260 34.557 14.162 1.00 0.00 H new ATOM 0 HA GLU A 15 34.286 31.787 14.893 1.00 0.00 H new ATOM 0 HB2 GLU A 15 35.553 33.271 12.639 1.00 0.00 H new ATOM 0 HB3 GLU A 15 36.100 31.668 13.087 1.00 0.00 H new ATOM 0 HG2 GLU A 15 33.515 31.077 12.957 1.00 0.00 H new ATOM 0 HG3 GLU A 15 33.440 32.521 11.966 1.00 0.00 H new ATOM 105 N VAL A 16 36.322 31.878 16.385 1.00 0.00 N ATOM 106 CA VAL A 16 37.344 31.970 17.381 1.00 0.00 C ATOM 107 C VAL A 16 38.476 31.069 17.024 1.00 0.00 C ATOM 108 O VAL A 16 38.353 29.846 17.053 1.00 0.00 O ATOM 109 CB VAL A 16 36.774 31.690 18.741 1.00 0.00 C ATOM 110 CG1 VAL A 16 37.830 31.312 19.793 1.00 0.00 C ATOM 111 CG2 VAL A 16 36.010 32.952 19.176 1.00 0.00 C ATOM 0 H VAL A 16 35.719 31.065 16.506 1.00 0.00 H new ATOM 0 HA VAL A 16 37.741 32.985 17.417 1.00 0.00 H new ATOM 0 HB VAL A 16 36.122 30.819 18.671 1.00 0.00 H new ATOM 0 HG11 VAL A 16 37.341 31.125 20.749 1.00 0.00 H new ATOM 0 HG12 VAL A 16 38.357 30.413 19.473 1.00 0.00 H new ATOM 0 HG13 VAL A 16 38.542 32.130 19.904 1.00 0.00 H new ATOM 0 HG21 VAL A 16 35.577 32.793 20.164 1.00 0.00 H new ATOM 0 HG22 VAL A 16 36.696 33.798 19.213 1.00 0.00 H new ATOM 0 HG23 VAL A 16 35.215 33.161 18.460 1.00 0.00 H new ATOM 121 N GLU A 17 39.625 31.659 16.649 1.00 0.00 N ATOM 122 CA GLU A 17 40.790 30.953 16.215 1.00 0.00 C ATOM 123 C GLU A 17 41.825 30.959 17.286 1.00 0.00 C ATOM 124 O GLU A 17 42.714 31.809 17.339 1.00 0.00 O ATOM 125 CB GLU A 17 41.322 31.547 14.900 1.00 0.00 C ATOM 126 CG GLU A 17 40.496 31.094 13.695 1.00 0.00 C ATOM 127 CD GLU A 17 40.738 31.931 12.447 1.00 0.00 C ATOM 128 OE1 GLU A 17 41.901 32.007 11.967 1.00 0.00 O ATOM 129 OE2 GLU A 17 39.752 32.494 11.901 1.00 0.00 O ATOM 0 H GLU A 17 39.747 32.672 16.648 1.00 0.00 H new ATOM 0 HA GLU A 17 40.525 29.914 16.018 1.00 0.00 H new ATOM 0 HB2 GLU A 17 41.308 32.635 14.961 1.00 0.00 H new ATOM 0 HB3 GLU A 17 42.361 31.249 14.761 1.00 0.00 H new ATOM 0 HG2 GLU A 17 40.729 30.052 13.475 1.00 0.00 H new ATOM 0 HG3 GLU A 17 39.438 31.137 13.953 1.00 0.00 H new ATOM 136 N LEU A 18 41.754 29.971 18.196 1.00 0.00 N ATOM 137 CA LEU A 18 42.665 29.830 19.289 1.00 0.00 C ATOM 138 C LEU A 18 43.827 28.983 18.897 1.00 0.00 C ATOM 139 O LEU A 18 43.717 28.042 18.112 1.00 0.00 O ATOM 140 CB LEU A 18 42.038 29.131 20.508 1.00 0.00 C ATOM 141 CG LEU A 18 40.906 29.905 21.205 1.00 0.00 C ATOM 142 CD1 LEU A 18 40.225 28.990 22.238 1.00 0.00 C ATOM 143 CD2 LEU A 18 41.383 31.206 21.872 1.00 0.00 C ATOM 0 H LEU A 18 41.038 29.245 18.170 1.00 0.00 H new ATOM 0 HA LEU A 18 42.957 30.848 19.548 1.00 0.00 H new ATOM 0 HB2 LEU A 18 41.651 28.163 20.190 1.00 0.00 H new ATOM 0 HB3 LEU A 18 42.824 28.936 21.237 1.00 0.00 H new ATOM 0 HG LEU A 18 40.194 30.202 20.435 1.00 0.00 H new ATOM 0 HD11 LEU A 18 39.422 29.536 22.734 1.00 0.00 H new ATOM 0 HD12 LEU A 18 39.812 28.116 21.734 1.00 0.00 H new ATOM 0 HD13 LEU A 18 40.957 28.669 22.979 1.00 0.00 H new ATOM 0 HD21 LEU A 18 40.537 31.704 22.345 1.00 0.00 H new ATOM 0 HD22 LEU A 18 42.135 30.974 22.626 1.00 0.00 H new ATOM 0 HD23 LEU A 18 41.816 31.864 21.118 1.00 0.00 H new ATOM 155 N ALA A 19 45.006 29.278 19.473 1.00 0.00 N ATOM 156 CA ALA A 19 46.111 28.376 19.543 1.00 0.00 C ATOM 157 C ALA A 19 46.194 27.833 20.928 1.00 0.00 C ATOM 158 O ALA A 19 46.434 28.558 21.892 1.00 0.00 O ATOM 159 CB ALA A 19 47.432 29.026 19.097 1.00 0.00 C ATOM 0 H ALA A 19 45.196 30.181 19.907 1.00 0.00 H new ATOM 0 HA ALA A 19 45.944 27.558 18.842 1.00 0.00 H new ATOM 0 HB1 ALA A 19 48.239 28.297 19.170 1.00 0.00 H new ATOM 0 HB2 ALA A 19 47.341 29.365 18.065 1.00 0.00 H new ATOM 0 HB3 ALA A 19 47.654 29.878 19.740 1.00 0.00 H new ATOM 165 N LYS A 20 45.935 26.523 21.088 1.00 0.00 N ATOM 166 CA LYS A 20 45.985 25.813 22.329 1.00 0.00 C ATOM 167 C LYS A 20 47.375 25.650 22.840 1.00 0.00 C ATOM 168 O LYS A 20 48.253 25.144 22.142 1.00 0.00 O ATOM 169 CB LYS A 20 45.365 24.423 22.107 1.00 0.00 C ATOM 170 CG LYS A 20 45.077 23.633 23.385 1.00 0.00 C ATOM 171 CD LYS A 20 44.741 22.164 23.122 1.00 0.00 C ATOM 172 CE LYS A 20 43.465 21.907 22.317 1.00 0.00 C ATOM 173 NZ LYS A 20 43.296 20.448 22.135 1.00 0.00 N ATOM 0 H LYS A 20 45.675 25.924 20.304 1.00 0.00 H new ATOM 0 HA LYS A 20 45.434 26.388 23.073 1.00 0.00 H new ATOM 0 HB2 LYS A 20 44.434 24.541 21.553 1.00 0.00 H new ATOM 0 HB3 LYS A 20 46.037 23.838 21.479 1.00 0.00 H new ATOM 0 HG2 LYS A 20 45.945 23.689 24.042 1.00 0.00 H new ATOM 0 HG3 LYS A 20 44.246 24.100 23.914 1.00 0.00 H new ATOM 0 HD2 LYS A 20 45.579 21.708 22.595 1.00 0.00 H new ATOM 0 HD3 LYS A 20 44.652 21.654 24.081 1.00 0.00 H new ATOM 0 HE2 LYS A 20 42.602 22.324 22.836 1.00 0.00 H new ATOM 0 HE3 LYS A 20 43.525 22.403 21.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 42.422 20.263 21.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 44.108 20.067 21.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 43.239 19.986 23.065 1.00 0.00 H new ATOM 187 N THR A 21 47.660 26.059 24.089 1.00 0.00 N ATOM 188 CA THR A 21 48.954 25.931 24.684 1.00 0.00 C ATOM 189 C THR A 21 48.978 24.813 25.668 1.00 0.00 C ATOM 190 O THR A 21 48.187 24.808 26.611 1.00 0.00 O ATOM 191 CB THR A 21 49.421 27.161 25.403 1.00 0.00 C ATOM 192 OG1 THR A 21 48.449 27.667 26.305 1.00 0.00 O ATOM 193 CG2 THR A 21 49.686 28.260 24.361 1.00 0.00 C ATOM 0 H THR A 21 46.970 26.492 24.703 1.00 0.00 H new ATOM 0 HA THR A 21 49.624 25.746 23.844 1.00 0.00 H new ATOM 0 HB THR A 21 50.313 26.889 25.968 1.00 0.00 H new ATOM 0 HG1 THR A 21 48.015 26.922 26.770 1.00 0.00 H new ATOM 0 HG21 THR A 21 50.027 29.164 24.865 1.00 0.00 H new ATOM 0 HG22 THR A 21 50.452 27.922 23.663 1.00 0.00 H new ATOM 0 HG23 THR A 21 48.767 28.473 23.815 1.00 0.00 H new ATOM 201 N ASP A 22 49.883 23.832 25.498 1.00 0.00 N ATOM 202 CA ASP A 22 50.171 22.793 26.438 1.00 0.00 C ATOM 203 C ASP A 22 49.022 21.882 26.700 1.00 0.00 C ATOM 204 O ASP A 22 48.902 21.248 27.746 1.00 0.00 O ATOM 205 CB ASP A 22 50.786 23.421 27.700 1.00 0.00 C ATOM 206 CG ASP A 22 51.450 22.421 28.636 1.00 0.00 C ATOM 207 OD1 ASP A 22 52.417 21.735 28.211 1.00 0.00 O ATOM 208 OD2 ASP A 22 51.035 22.340 29.823 1.00 0.00 O ATOM 0 H ASP A 22 50.448 23.761 24.652 1.00 0.00 H new ATOM 0 HA ASP A 22 50.908 22.120 26.001 1.00 0.00 H new ATOM 0 HB2 ASP A 22 51.524 24.165 27.399 1.00 0.00 H new ATOM 0 HB3 ASP A 22 50.005 23.950 28.246 1.00 0.00 H new ATOM 213 N GLY A 23 48.080 21.770 25.745 1.00 0.00 N ATOM 214 CA GLY A 23 46.883 21.008 25.916 1.00 0.00 C ATOM 215 C GLY A 23 45.782 21.709 26.637 1.00 0.00 C ATOM 216 O GLY A 23 44.749 21.104 26.916 1.00 0.00 O ATOM 0 H GLY A 23 48.153 22.220 24.833 1.00 0.00 H new ATOM 0 HA2 GLY A 23 46.519 20.708 24.933 1.00 0.00 H new ATOM 0 HA3 GLY A 23 47.127 20.095 26.458 1.00 0.00 H new ATOM 220 N SER A 24 45.940 23.000 26.980 1.00 0.00 N ATOM 221 CA SER A 24 44.954 23.766 27.676 1.00 0.00 C ATOM 222 C SER A 24 44.265 24.727 26.770 1.00 0.00 C ATOM 223 O SER A 24 44.809 25.771 26.413 1.00 0.00 O ATOM 224 CB SER A 24 45.540 24.582 28.841 1.00 0.00 C ATOM 225 OG SER A 24 45.831 23.756 29.958 1.00 0.00 O ATOM 0 H SER A 24 46.785 23.529 26.765 1.00 0.00 H new ATOM 0 HA SER A 24 44.253 23.028 28.066 1.00 0.00 H new ATOM 0 HB2 SER A 24 46.449 25.086 28.513 1.00 0.00 H new ATOM 0 HB3 SER A 24 44.833 25.358 29.135 1.00 0.00 H new ATOM 0 HG SER A 24 46.203 24.303 30.681 1.00 0.00 H new ATOM 231 N LEU A 25 43.017 24.432 26.363 1.00 0.00 N ATOM 232 CA LEU A 25 42.208 25.337 25.609 1.00 0.00 C ATOM 233 C LEU A 25 41.561 26.351 26.487 1.00 0.00 C ATOM 234 O LEU A 25 41.588 27.543 26.186 1.00 0.00 O ATOM 235 CB LEU A 25 41.148 24.611 24.762 1.00 0.00 C ATOM 236 CG LEU A 25 40.668 25.422 23.546 1.00 0.00 C ATOM 237 CD1 LEU A 25 41.757 25.595 22.475 1.00 0.00 C ATOM 238 CD2 LEU A 25 39.427 24.769 22.914 1.00 0.00 C ATOM 0 H LEU A 25 42.560 23.542 26.563 1.00 0.00 H new ATOM 0 HA LEU A 25 42.882 25.850 24.923 1.00 0.00 H new ATOM 0 HB2 LEU A 25 41.559 23.663 24.416 1.00 0.00 H new ATOM 0 HB3 LEU A 25 40.290 24.376 25.392 1.00 0.00 H new ATOM 0 HG LEU A 25 40.415 26.414 23.921 1.00 0.00 H new ATOM 0 HD11 LEU A 25 41.359 26.175 21.642 1.00 0.00 H new ATOM 0 HD12 LEU A 25 42.611 26.117 22.906 1.00 0.00 H new ATOM 0 HD13 LEU A 25 42.074 24.616 22.116 1.00 0.00 H new ATOM 0 HD21 LEU A 25 39.103 25.358 22.056 1.00 0.00 H new ATOM 0 HD22 LEU A 25 39.674 23.758 22.589 1.00 0.00 H new ATOM 0 HD23 LEU A 25 38.623 24.727 23.649 1.00 0.00 H new ATOM 250 N GLY A 26 40.976 25.952 27.631 1.00 0.00 N ATOM 251 CA GLY A 26 40.495 26.815 28.664 1.00 0.00 C ATOM 252 C GLY A 26 39.014 26.774 28.833 1.00 0.00 C ATOM 253 O GLY A 26 38.446 27.762 29.294 1.00 0.00 O ATOM 0 H GLY A 26 40.831 24.966 27.847 1.00 0.00 H new ATOM 0 HA2 GLY A 26 40.968 26.539 29.606 1.00 0.00 H new ATOM 0 HA3 GLY A 26 40.799 27.838 28.443 1.00 0.00 H new ATOM 257 N ILE A 27 38.331 25.660 28.514 1.00 0.00 N ATOM 258 CA ILE A 27 36.904 25.655 28.426 1.00 0.00 C ATOM 259 C ILE A 27 36.263 24.359 28.784 1.00 0.00 C ATOM 260 O ILE A 27 36.656 23.267 28.374 1.00 0.00 O ATOM 261 CB ILE A 27 36.428 26.162 27.097 1.00 0.00 C ATOM 262 CG1 ILE A 27 34.906 26.116 26.878 1.00 0.00 C ATOM 263 CG2 ILE A 27 37.203 25.484 25.955 1.00 0.00 C ATOM 264 CD1 ILE A 27 34.461 26.870 25.626 1.00 0.00 C ATOM 0 H ILE A 27 38.769 24.760 28.316 1.00 0.00 H new ATOM 0 HA ILE A 27 36.574 26.352 29.196 1.00 0.00 H new ATOM 0 HB ILE A 27 36.650 27.229 27.096 1.00 0.00 H new ATOM 0 HG12 ILE A 27 34.586 25.077 26.803 1.00 0.00 H new ATOM 0 HG13 ILE A 27 34.406 26.541 27.748 1.00 0.00 H new ATOM 0 HG21 ILE A 27 36.846 25.863 24.998 1.00 0.00 H new ATOM 0 HG22 ILE A 27 38.266 25.702 26.057 1.00 0.00 H new ATOM 0 HG23 ILE A 27 37.047 24.406 26.000 1.00 0.00 H new ATOM 0 HD11 ILE A 27 33.378 26.801 25.526 1.00 0.00 H new ATOM 0 HD12 ILE A 27 34.752 27.917 25.709 1.00 0.00 H new ATOM 0 HD13 ILE A 27 34.935 26.430 24.749 1.00 0.00 H new ATOM 276 N SER A 28 35.179 24.472 29.572 1.00 0.00 N ATOM 277 CA SER A 28 34.239 23.433 29.857 1.00 0.00 C ATOM 278 C SER A 28 32.945 23.772 29.197 1.00 0.00 C ATOM 279 O SER A 28 32.405 24.856 29.410 1.00 0.00 O ATOM 280 CB SER A 28 33.917 23.269 31.352 1.00 0.00 C ATOM 281 OG SER A 28 35.002 22.717 32.081 1.00 0.00 O ATOM 0 H SER A 28 34.945 25.347 30.040 1.00 0.00 H new ATOM 0 HA SER A 28 34.696 22.511 29.498 1.00 0.00 H new ATOM 0 HB2 SER A 28 33.656 24.240 31.773 1.00 0.00 H new ATOM 0 HB3 SER A 28 33.043 22.627 31.465 1.00 0.00 H new ATOM 0 HG SER A 28 34.753 22.633 33.025 1.00 0.00 H new ATOM 287 N VAL A 29 32.379 22.862 28.385 1.00 0.00 N ATOM 288 CA VAL A 29 31.120 23.041 27.730 1.00 0.00 C ATOM 289 C VAL A 29 30.036 22.254 28.384 1.00 0.00 C ATOM 290 O VAL A 29 30.274 21.460 29.292 1.00 0.00 O ATOM 291 CB VAL A 29 31.167 22.720 26.266 1.00 0.00 C ATOM 292 CG1 VAL A 29 32.074 23.742 25.562 1.00 0.00 C ATOM 293 CG2 VAL A 29 31.650 21.282 26.009 1.00 0.00 C ATOM 0 H VAL A 29 32.816 21.964 28.176 1.00 0.00 H new ATOM 0 HA VAL A 29 30.894 24.103 27.828 1.00 0.00 H new ATOM 0 HB VAL A 29 30.158 22.784 25.860 1.00 0.00 H new ATOM 0 HG11 VAL A 29 32.116 23.518 24.496 1.00 0.00 H new ATOM 0 HG12 VAL A 29 31.673 24.745 25.707 1.00 0.00 H new ATOM 0 HG13 VAL A 29 33.078 23.689 25.983 1.00 0.00 H new ATOM 0 HG21 VAL A 29 31.669 21.091 24.936 1.00 0.00 H new ATOM 0 HG22 VAL A 29 32.653 21.156 26.418 1.00 0.00 H new ATOM 0 HG23 VAL A 29 30.971 20.579 26.491 1.00 0.00 H new ATOM 303 N THR A 30 28.773 22.459 27.970 1.00 0.00 N ATOM 304 CA THR A 30 27.643 21.714 28.432 1.00 0.00 C ATOM 305 C THR A 30 26.529 21.776 27.445 1.00 0.00 C ATOM 306 O THR A 30 26.629 22.463 26.429 1.00 0.00 O ATOM 307 CB THR A 30 27.169 22.168 29.781 1.00 0.00 C ATOM 308 OG1 THR A 30 26.480 21.137 30.473 1.00 0.00 O ATOM 309 CG2 THR A 30 26.307 23.441 29.767 1.00 0.00 C ATOM 0 H THR A 30 28.529 23.174 27.285 1.00 0.00 H new ATOM 0 HA THR A 30 27.970 20.679 28.535 1.00 0.00 H new ATOM 0 HB THR A 30 28.088 22.421 30.311 1.00 0.00 H new ATOM 0 HG1 THR A 30 26.188 21.469 31.348 1.00 0.00 H new ATOM 0 HG21 THR A 30 26.012 23.692 30.786 1.00 0.00 H new ATOM 0 HG22 THR A 30 26.881 24.265 29.343 1.00 0.00 H new ATOM 0 HG23 THR A 30 25.416 23.271 29.162 1.00 0.00 H new ATOM 317 N GLY A 31 25.414 21.071 27.707 1.00 0.00 N ATOM 318 CA GLY A 31 24.192 21.188 26.974 1.00 0.00 C ATOM 319 C GLY A 31 23.844 19.932 26.252 1.00 0.00 C ATOM 320 O GLY A 31 23.796 18.849 26.831 1.00 0.00 O ATOM 0 H GLY A 31 25.362 20.389 28.464 1.00 0.00 H new ATOM 0 HA2 GLY A 31 23.384 21.447 27.658 1.00 0.00 H new ATOM 0 HA3 GLY A 31 24.277 22.005 26.257 1.00 0.00 H new ATOM 324 N GLY A 32 23.568 20.054 24.942 1.00 0.00 N ATOM 325 CA GLY A 32 23.178 18.967 24.099 1.00 0.00 C ATOM 326 C GLY A 32 21.697 18.893 23.963 1.00 0.00 C ATOM 327 O GLY A 32 20.956 18.987 24.941 1.00 0.00 O ATOM 0 H GLY A 32 23.619 20.946 24.450 1.00 0.00 H new ATOM 0 HA2 GLY A 32 23.630 19.087 23.115 1.00 0.00 H new ATOM 0 HA3 GLY A 32 23.555 18.031 24.511 1.00 0.00 H new ATOM 331 N VAL A 33 21.191 18.702 22.732 1.00 0.00 N ATOM 332 CA VAL A 33 19.798 18.812 22.427 1.00 0.00 C ATOM 333 C VAL A 33 18.918 17.776 23.040 1.00 0.00 C ATOM 334 O VAL A 33 17.715 17.989 23.186 1.00 0.00 O ATOM 335 CB VAL A 33 19.560 18.830 20.946 1.00 0.00 C ATOM 336 CG1 VAL A 33 20.298 20.026 20.320 1.00 0.00 C ATOM 337 CG2 VAL A 33 19.971 17.514 20.263 1.00 0.00 C ATOM 0 H VAL A 33 21.767 18.464 21.925 1.00 0.00 H new ATOM 0 HA VAL A 33 19.516 19.762 22.881 1.00 0.00 H new ATOM 0 HB VAL A 33 18.487 18.937 20.784 1.00 0.00 H new ATOM 0 HG11 VAL A 33 20.124 20.038 19.244 1.00 0.00 H new ATOM 0 HG12 VAL A 33 19.926 20.952 20.758 1.00 0.00 H new ATOM 0 HG13 VAL A 33 21.367 19.936 20.514 1.00 0.00 H new ATOM 0 HG21 VAL A 33 19.777 17.583 19.193 1.00 0.00 H new ATOM 0 HG22 VAL A 33 21.033 17.335 20.428 1.00 0.00 H new ATOM 0 HG23 VAL A 33 19.394 16.690 20.684 1.00 0.00 H new ATOM 347 N ASN A 34 19.484 16.610 23.398 1.00 0.00 N ATOM 348 CA ASN A 34 18.795 15.473 23.923 1.00 0.00 C ATOM 349 C ASN A 34 18.889 15.385 25.407 1.00 0.00 C ATOM 350 O ASN A 34 18.426 14.415 26.005 1.00 0.00 O ATOM 351 CB ASN A 34 19.385 14.231 23.234 1.00 0.00 C ATOM 352 CG ASN A 34 18.495 12.998 23.283 1.00 0.00 C ATOM 353 OD1 ASN A 34 18.736 12.054 24.035 1.00 0.00 O ATOM 354 ND2 ASN A 34 17.455 12.968 22.406 1.00 0.00 N ATOM 0 H ASN A 34 20.488 16.452 23.315 1.00 0.00 H new ATOM 0 HA ASN A 34 17.728 15.555 23.715 1.00 0.00 H new ATOM 0 HB2 ASN A 34 19.591 14.473 22.191 1.00 0.00 H new ATOM 0 HB3 ASN A 34 20.341 13.992 23.701 1.00 0.00 H new ATOM 0 HD21 ASN A 34 16.851 12.148 22.360 1.00 0.00 H new ATOM 0 HD22 ASN A 34 17.280 13.766 21.795 1.00 0.00 H new ATOM 361 N THR A 35 19.494 16.373 26.090 1.00 0.00 N ATOM 362 CA THR A 35 19.744 16.330 27.497 1.00 0.00 C ATOM 363 C THR A 35 18.576 16.853 28.261 1.00 0.00 C ATOM 364 O THR A 35 17.425 16.531 27.973 1.00 0.00 O ATOM 365 CB THR A 35 21.028 16.998 27.891 1.00 0.00 C ATOM 366 OG1 THR A 35 22.062 16.744 26.952 1.00 0.00 O ATOM 367 CG2 THR A 35 21.576 16.424 29.210 1.00 0.00 C ATOM 0 H THR A 35 19.821 17.232 25.647 1.00 0.00 H new ATOM 0 HA THR A 35 19.874 15.281 27.762 1.00 0.00 H new ATOM 0 HB THR A 35 20.785 18.058 27.962 1.00 0.00 H new ATOM 0 HG1 THR A 35 22.607 17.551 26.839 1.00 0.00 H new ATOM 0 HG21 THR A 35 22.507 16.929 29.468 1.00 0.00 H new ATOM 0 HG22 THR A 35 20.847 16.579 30.005 1.00 0.00 H new ATOM 0 HG23 THR A 35 21.763 15.357 29.092 1.00 0.00 H new ATOM 375 N SER A 36 18.765 17.702 29.288 1.00 0.00 N ATOM 376 CA SER A 36 17.698 18.292 30.038 1.00 0.00 C ATOM 377 C SER A 36 17.133 19.453 29.295 1.00 0.00 C ATOM 378 O SER A 36 15.950 19.780 29.372 1.00 0.00 O ATOM 379 CB SER A 36 18.137 18.863 31.396 1.00 0.00 C ATOM 380 OG SER A 36 18.902 17.946 32.166 1.00 0.00 O ATOM 0 H SER A 36 19.691 17.987 29.607 1.00 0.00 H new ATOM 0 HA SER A 36 16.984 17.483 30.191 1.00 0.00 H new ATOM 0 HB2 SER A 36 18.723 19.767 31.231 1.00 0.00 H new ATOM 0 HB3 SER A 36 17.253 19.156 31.963 1.00 0.00 H new ATOM 0 HG SER A 36 19.154 18.363 33.016 1.00 0.00 H new ATOM 386 N VAL A 37 18.018 20.132 28.543 1.00 0.00 N ATOM 387 CA VAL A 37 17.723 21.238 27.686 1.00 0.00 C ATOM 388 C VAL A 37 17.246 20.749 26.361 1.00 0.00 C ATOM 389 O VAL A 37 18.002 20.465 25.433 1.00 0.00 O ATOM 390 CB VAL A 37 18.878 22.193 27.614 1.00 0.00 C ATOM 391 CG1 VAL A 37 19.091 22.768 29.025 1.00 0.00 C ATOM 392 CG2 VAL A 37 20.201 21.559 27.155 1.00 0.00 C ATOM 0 H VAL A 37 19.009 19.890 28.534 1.00 0.00 H new ATOM 0 HA VAL A 37 16.903 21.819 28.108 1.00 0.00 H new ATOM 0 HB VAL A 37 18.622 22.947 26.870 1.00 0.00 H new ATOM 0 HG11 VAL A 37 19.926 23.469 29.010 1.00 0.00 H new ATOM 0 HG12 VAL A 37 18.188 23.286 29.347 1.00 0.00 H new ATOM 0 HG13 VAL A 37 19.310 21.957 29.719 1.00 0.00 H new ATOM 0 HG21 VAL A 37 20.981 22.320 27.132 1.00 0.00 H new ATOM 0 HG22 VAL A 37 20.486 20.769 27.850 1.00 0.00 H new ATOM 0 HG23 VAL A 37 20.076 21.138 26.158 1.00 0.00 H new ATOM 402 N ARG A 38 15.919 20.601 26.205 1.00 0.00 N ATOM 403 CA ARG A 38 15.332 20.036 25.030 1.00 0.00 C ATOM 404 C ARG A 38 15.467 20.943 23.856 1.00 0.00 C ATOM 405 O ARG A 38 14.870 22.017 23.805 1.00 0.00 O ATOM 406 CB ARG A 38 13.852 19.679 25.245 1.00 0.00 C ATOM 407 CG ARG A 38 13.227 18.926 24.070 1.00 0.00 C ATOM 408 CD ARG A 38 11.703 18.799 24.144 1.00 0.00 C ATOM 409 NE ARG A 38 11.268 18.101 22.902 1.00 0.00 N ATOM 410 CZ ARG A 38 11.114 18.706 21.688 1.00 0.00 C ATOM 411 NH1 ARG A 38 11.294 20.045 21.492 1.00 0.00 N ATOM 412 NH2 ARG A 38 10.798 17.949 20.596 1.00 0.00 N ATOM 0 H ARG A 38 15.238 20.880 26.911 1.00 0.00 H new ATOM 0 HA ARG A 38 15.881 19.117 24.823 1.00 0.00 H new ATOM 0 HB2 ARG A 38 13.761 19.071 26.145 1.00 0.00 H new ATOM 0 HB3 ARG A 38 13.288 20.595 25.420 1.00 0.00 H new ATOM 0 HG2 ARG A 38 13.493 19.435 23.144 1.00 0.00 H new ATOM 0 HG3 ARG A 38 13.661 17.928 24.021 1.00 0.00 H new ATOM 0 HD2 ARG A 38 11.405 18.236 25.028 1.00 0.00 H new ATOM 0 HD3 ARG A 38 11.236 19.781 24.219 1.00 0.00 H new ATOM 0 HE ARG A 38 11.072 17.102 22.963 1.00 0.00 H new ATOM 0 HH11 ARG A 38 11.557 20.644 22.275 1.00 0.00 H new ATOM 0 HH12 ARG A 38 11.166 20.446 20.563 1.00 0.00 H new ATOM 0 HH21 ARG A 38 10.679 16.940 20.692 1.00 0.00 H new ATOM 0 HH22 ARG A 38 10.681 18.392 19.685 1.00 0.00 H new ATOM 426 N HIS A 39 16.314 20.548 22.887 1.00 0.00 N ATOM 427 CA HIS A 39 16.790 21.359 21.810 1.00 0.00 C ATOM 428 C HIS A 39 17.513 22.575 22.276 1.00 0.00 C ATOM 429 O HIS A 39 17.303 23.693 21.807 1.00 0.00 O ATOM 430 CB HIS A 39 15.752 21.705 20.729 1.00 0.00 C ATOM 431 CG HIS A 39 15.148 20.533 20.014 1.00 0.00 C ATOM 432 ND1 HIS A 39 14.634 20.643 18.739 1.00 0.00 N ATOM 433 CD2 HIS A 39 14.936 19.241 20.383 1.00 0.00 C ATOM 434 CE1 HIS A 39 14.150 19.418 18.399 1.00 0.00 C ATOM 435 NE2 HIS A 39 14.316 18.538 19.370 1.00 0.00 N ATOM 0 H HIS A 39 16.690 19.600 22.855 1.00 0.00 H new ATOM 0 HA HIS A 39 17.508 20.708 21.311 1.00 0.00 H new ATOM 0 HB2 HIS A 39 14.949 22.279 21.192 1.00 0.00 H new ATOM 0 HB3 HIS A 39 16.224 22.354 19.992 1.00 0.00 H new ATOM 0 HD2 HIS A 39 15.215 18.822 21.339 1.00 0.00 H new ATOM 0 HE1 HIS A 39 13.686 19.192 17.450 1.00 0.00 H new ATOM 0 HE2 HIS A 39 14.045 17.555 19.371 1.00 0.00 H new ATOM 443 N GLY A 40 18.412 22.390 23.260 1.00 0.00 N ATOM 444 CA GLY A 40 19.161 23.441 23.874 1.00 0.00 C ATOM 445 C GLY A 40 20.227 24.051 23.031 1.00 0.00 C ATOM 446 O GLY A 40 20.250 25.262 22.814 1.00 0.00 O ATOM 0 H GLY A 40 18.625 21.469 23.643 1.00 0.00 H new ATOM 0 HA2 GLY A 40 18.469 24.227 24.177 1.00 0.00 H new ATOM 0 HA3 GLY A 40 19.620 23.052 24.783 1.00 0.00 H new ATOM 450 N GLY A 41 21.179 23.217 22.577 1.00 0.00 N ATOM 451 CA GLY A 41 22.426 23.629 22.010 1.00 0.00 C ATOM 452 C GLY A 41 23.576 23.341 22.912 1.00 0.00 C ATOM 453 O GLY A 41 23.410 22.748 23.978 1.00 0.00 O ATOM 0 H GLY A 41 21.074 22.203 22.607 1.00 0.00 H new ATOM 0 HA2 GLY A 41 22.576 23.120 21.058 1.00 0.00 H new ATOM 0 HA3 GLY A 41 22.391 24.698 21.798 1.00 0.00 H new ATOM 457 N ILE A 42 24.798 23.724 22.503 1.00 0.00 N ATOM 458 CA ILE A 42 26.004 23.553 23.253 1.00 0.00 C ATOM 459 C ILE A 42 26.417 24.857 23.842 1.00 0.00 C ATOM 460 O ILE A 42 26.550 25.845 23.120 1.00 0.00 O ATOM 461 CB ILE A 42 27.109 23.000 22.402 1.00 0.00 C ATOM 462 CG1 ILE A 42 26.675 21.773 21.583 1.00 0.00 C ATOM 463 CG2 ILE A 42 28.344 22.663 23.254 1.00 0.00 C ATOM 464 CD1 ILE A 42 26.203 20.570 22.401 1.00 0.00 C ATOM 0 H ILE A 42 24.953 24.177 21.602 1.00 0.00 H new ATOM 0 HA ILE A 42 25.809 22.836 24.050 1.00 0.00 H new ATOM 0 HB ILE A 42 27.370 23.784 21.691 1.00 0.00 H new ATOM 0 HG12 ILE A 42 25.870 22.072 20.911 1.00 0.00 H new ATOM 0 HG13 ILE A 42 27.512 21.460 20.958 1.00 0.00 H new ATOM 0 HG21 ILE A 42 29.130 22.264 22.613 1.00 0.00 H new ATOM 0 HG22 ILE A 42 28.702 23.566 23.749 1.00 0.00 H new ATOM 0 HG23 ILE A 42 28.076 21.920 24.005 1.00 0.00 H new ATOM 0 HD11 ILE A 42 25.920 19.761 21.728 1.00 0.00 H new ATOM 0 HD12 ILE A 42 27.009 20.235 23.053 1.00 0.00 H new ATOM 0 HD13 ILE A 42 25.342 20.856 23.006 1.00 0.00 H new ATOM 476 N TYR A 43 26.632 24.951 25.166 1.00 0.00 N ATOM 477 CA TYR A 43 26.884 26.196 25.826 1.00 0.00 C ATOM 478 C TYR A 43 28.130 26.158 26.642 1.00 0.00 C ATOM 479 O TYR A 43 28.617 25.102 27.041 1.00 0.00 O ATOM 480 CB TYR A 43 25.738 26.614 26.762 1.00 0.00 C ATOM 481 CG TYR A 43 24.501 26.911 25.987 1.00 0.00 C ATOM 482 CD1 TYR A 43 24.243 28.179 25.522 1.00 0.00 C ATOM 483 CD2 TYR A 43 23.594 25.907 25.738 1.00 0.00 C ATOM 484 CE1 TYR A 43 23.093 28.445 24.815 1.00 0.00 C ATOM 485 CE2 TYR A 43 22.450 26.165 25.020 1.00 0.00 C ATOM 486 CZ TYR A 43 22.203 27.432 24.548 1.00 0.00 C ATOM 487 OH TYR A 43 21.060 27.662 23.753 1.00 0.00 O ATOM 0 H TYR A 43 26.631 24.146 25.792 1.00 0.00 H new ATOM 0 HA TYR A 43 26.983 26.921 25.018 1.00 0.00 H new ATOM 0 HB2 TYR A 43 25.540 25.818 27.480 1.00 0.00 H new ATOM 0 HB3 TYR A 43 26.033 27.493 27.335 1.00 0.00 H new ATOM 0 HD1 TYR A 43 24.949 28.973 25.713 1.00 0.00 H new ATOM 0 HD2 TYR A 43 23.782 24.910 26.109 1.00 0.00 H new ATOM 0 HE1 TYR A 43 22.890 29.448 24.470 1.00 0.00 H new ATOM 0 HE2 TYR A 43 21.744 25.371 24.827 1.00 0.00 H new ATOM 0 HH TYR A 43 20.764 26.817 23.354 1.00 0.00 H new ATOM 497 N VAL A 44 28.699 27.339 26.940 1.00 0.00 N ATOM 498 CA VAL A 44 29.835 27.514 27.792 1.00 0.00 C ATOM 499 C VAL A 44 29.495 27.385 29.237 1.00 0.00 C ATOM 500 O VAL A 44 28.691 28.142 29.779 1.00 0.00 O ATOM 501 CB VAL A 44 30.525 28.822 27.542 1.00 0.00 C ATOM 502 CG1 VAL A 44 31.804 28.954 28.385 1.00 0.00 C ATOM 503 CG2 VAL A 44 30.880 28.930 26.050 1.00 0.00 C ATOM 0 H VAL A 44 28.347 28.220 26.566 1.00 0.00 H new ATOM 0 HA VAL A 44 30.520 26.705 27.539 1.00 0.00 H new ATOM 0 HB VAL A 44 29.848 29.626 27.829 1.00 0.00 H new ATOM 0 HG11 VAL A 44 32.278 29.913 28.179 1.00 0.00 H new ATOM 0 HG12 VAL A 44 31.550 28.895 29.443 1.00 0.00 H new ATOM 0 HG13 VAL A 44 32.492 28.147 28.131 1.00 0.00 H new ATOM 0 HG21 VAL A 44 31.382 29.879 25.863 1.00 0.00 H new ATOM 0 HG22 VAL A 44 31.542 28.109 25.773 1.00 0.00 H new ATOM 0 HG23 VAL A 44 29.969 28.878 25.454 1.00 0.00 H new ATOM 513 N LYS A 45 30.115 26.425 29.945 1.00 0.00 N ATOM 514 CA LYS A 45 29.889 26.186 31.337 1.00 0.00 C ATOM 515 C LYS A 45 30.871 26.905 32.196 1.00 0.00 C ATOM 516 O LYS A 45 30.496 27.542 33.179 1.00 0.00 O ATOM 517 CB LYS A 45 29.909 24.679 31.642 1.00 0.00 C ATOM 518 CG LYS A 45 29.402 24.331 33.043 1.00 0.00 C ATOM 519 CD LYS A 45 29.201 22.834 33.286 1.00 0.00 C ATOM 520 CE LYS A 45 30.483 22.019 33.475 1.00 0.00 C ATOM 521 NZ LYS A 45 31.062 22.205 34.824 1.00 0.00 N ATOM 0 H LYS A 45 30.800 25.791 29.533 1.00 0.00 H new ATOM 0 HA LYS A 45 28.900 26.579 31.573 1.00 0.00 H new ATOM 0 HB2 LYS A 45 29.298 24.159 30.904 1.00 0.00 H new ATOM 0 HB3 LYS A 45 30.928 24.308 31.531 1.00 0.00 H new ATOM 0 HG2 LYS A 45 30.109 24.715 33.778 1.00 0.00 H new ATOM 0 HG3 LYS A 45 28.456 24.845 33.212 1.00 0.00 H new ATOM 0 HD2 LYS A 45 28.577 22.708 34.171 1.00 0.00 H new ATOM 0 HD3 LYS A 45 28.648 22.418 32.444 1.00 0.00 H new ATOM 0 HE2 LYS A 45 30.268 20.962 33.315 1.00 0.00 H new ATOM 0 HE3 LYS A 45 31.214 22.313 32.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 31.928 21.636 34.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 31.291 23.209 34.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 30.374 21.900 35.542 1.00 0.00 H new ATOM 535 N ALA A 46 32.175 26.830 31.872 1.00 0.00 N ATOM 536 CA ALA A 46 33.181 27.507 32.628 1.00 0.00 C ATOM 537 C ALA A 46 34.414 27.725 31.821 1.00 0.00 C ATOM 538 O ALA A 46 34.708 26.961 30.904 1.00 0.00 O ATOM 539 CB ALA A 46 33.551 26.720 33.897 1.00 0.00 C ATOM 0 H ALA A 46 32.533 26.296 31.080 1.00 0.00 H new ATOM 0 HA ALA A 46 32.762 28.473 32.911 1.00 0.00 H new ATOM 0 HB1 ALA A 46 34.319 27.261 34.450 1.00 0.00 H new ATOM 0 HB2 ALA A 46 32.667 26.603 34.523 1.00 0.00 H new ATOM 0 HB3 ALA A 46 33.930 25.737 33.618 1.00 0.00 H new ATOM 545 N ILE A 47 35.175 28.785 32.147 1.00 0.00 N ATOM 546 CA ILE A 47 36.442 29.123 31.573 1.00 0.00 C ATOM 547 C ILE A 47 37.520 28.867 32.569 1.00 0.00 C ATOM 548 O ILE A 47 37.477 29.313 33.715 1.00 0.00 O ATOM 549 CB ILE A 47 36.406 30.496 30.972 1.00 0.00 C ATOM 550 CG1 ILE A 47 36.857 30.490 29.501 1.00 0.00 C ATOM 551 CG2 ILE A 47 37.169 31.566 31.771 1.00 0.00 C ATOM 552 CD1 ILE A 47 35.890 29.779 28.556 1.00 0.00 C ATOM 0 H ILE A 47 34.884 29.452 32.862 1.00 0.00 H new ATOM 0 HA ILE A 47 36.677 28.479 30.725 1.00 0.00 H new ATOM 0 HB ILE A 47 35.356 30.785 31.018 1.00 0.00 H new ATOM 0 HG12 ILE A 47 36.984 31.520 29.167 1.00 0.00 H new ATOM 0 HG13 ILE A 47 37.833 30.010 29.433 1.00 0.00 H new ATOM 0 HG21 ILE A 47 37.089 32.526 31.262 1.00 0.00 H new ATOM 0 HG22 ILE A 47 36.741 31.648 32.770 1.00 0.00 H new ATOM 0 HG23 ILE A 47 38.219 31.283 31.848 1.00 0.00 H new ATOM 0 HD11 ILE A 47 36.280 29.819 27.539 1.00 0.00 H new ATOM 0 HD12 ILE A 47 35.781 28.739 28.862 1.00 0.00 H new ATOM 0 HD13 ILE A 47 34.918 30.272 28.592 1.00 0.00 H new ATOM 564 N ILE A 48 38.493 28.013 32.203 1.00 0.00 N ATOM 565 CA ILE A 48 39.574 27.543 33.011 1.00 0.00 C ATOM 566 C ILE A 48 40.685 28.521 33.180 1.00 0.00 C ATOM 567 O ILE A 48 41.236 28.900 32.147 1.00 0.00 O ATOM 568 CB ILE A 48 40.152 26.254 32.505 1.00 0.00 C ATOM 569 CG1 ILE A 48 39.051 25.284 32.047 1.00 0.00 C ATOM 570 CG2 ILE A 48 41.077 25.605 33.548 1.00 0.00 C ATOM 571 CD1 ILE A 48 38.127 24.755 33.144 1.00 0.00 C ATOM 0 H ILE A 48 38.524 27.620 31.262 1.00 0.00 H new ATOM 0 HA ILE A 48 39.111 27.387 33.986 1.00 0.00 H new ATOM 0 HB ILE A 48 40.760 26.490 31.632 1.00 0.00 H new ATOM 0 HG12 ILE A 48 38.441 25.786 31.296 1.00 0.00 H new ATOM 0 HG13 ILE A 48 39.524 24.433 31.556 1.00 0.00 H new ATOM 0 HG21 ILE A 48 41.478 24.673 33.149 1.00 0.00 H new ATOM 0 HG22 ILE A 48 41.898 26.284 33.779 1.00 0.00 H new ATOM 0 HG23 ILE A 48 40.512 25.397 34.456 1.00 0.00 H new ATOM 0 HD11 ILE A 48 37.391 24.081 32.706 1.00 0.00 H new ATOM 0 HD12 ILE A 48 38.715 24.216 33.887 1.00 0.00 H new ATOM 0 HD13 ILE A 48 37.615 25.590 33.622 1.00 0.00 H new ATOM 583 N PRO A 49 41.132 28.940 34.327 1.00 0.00 N ATOM 584 CA PRO A 49 42.203 29.885 34.455 1.00 0.00 C ATOM 585 C PRO A 49 43.499 29.512 33.821 1.00 0.00 C ATOM 586 O PRO A 49 44.021 28.432 34.092 1.00 0.00 O ATOM 587 CB PRO A 49 42.378 30.067 35.961 1.00 0.00 C ATOM 588 CG PRO A 49 40.953 29.875 36.500 1.00 0.00 C ATOM 589 CD PRO A 49 40.422 28.760 35.583 1.00 0.00 C ATOM 0 HA PRO A 49 41.931 30.791 33.914 1.00 0.00 H new ATOM 0 HB2 PRO A 49 43.069 29.335 36.378 1.00 0.00 H new ATOM 0 HB3 PRO A 49 42.772 31.053 36.205 1.00 0.00 H new ATOM 0 HG2 PRO A 49 40.948 29.579 37.549 1.00 0.00 H new ATOM 0 HG3 PRO A 49 40.360 30.786 36.423 1.00 0.00 H new ATOM 0 HD2 PRO A 49 40.613 27.774 36.007 1.00 0.00 H new ATOM 0 HD3 PRO A 49 39.344 28.843 35.443 1.00 0.00 H new ATOM 597 N LYS A 50 44.018 30.401 32.956 1.00 0.00 N ATOM 598 CA LYS A 50 45.230 30.306 32.203 1.00 0.00 C ATOM 599 C LYS A 50 45.092 29.526 30.941 1.00 0.00 C ATOM 600 O LYS A 50 46.090 29.147 30.329 1.00 0.00 O ATOM 601 CB LYS A 50 46.488 29.950 33.013 1.00 0.00 C ATOM 602 CG LYS A 50 46.746 30.910 34.175 1.00 0.00 C ATOM 603 CD LYS A 50 48.092 30.666 34.861 1.00 0.00 C ATOM 604 CE LYS A 50 48.324 31.457 36.150 1.00 0.00 C ATOM 605 NZ LYS A 50 48.298 32.915 35.898 1.00 0.00 N ATOM 0 H LYS A 50 43.535 31.279 32.766 1.00 0.00 H new ATOM 0 HA LYS A 50 45.413 31.335 31.895 1.00 0.00 H new ATOM 0 HB2 LYS A 50 46.387 28.937 33.402 1.00 0.00 H new ATOM 0 HB3 LYS A 50 47.353 29.952 32.349 1.00 0.00 H new ATOM 0 HG2 LYS A 50 46.712 31.935 33.807 1.00 0.00 H new ATOM 0 HG3 LYS A 50 45.946 30.808 34.909 1.00 0.00 H new ATOM 0 HD2 LYS A 50 48.178 29.603 35.086 1.00 0.00 H new ATOM 0 HD3 LYS A 50 48.888 30.908 34.158 1.00 0.00 H new ATOM 0 HE2 LYS A 50 47.558 31.198 36.881 1.00 0.00 H new ATOM 0 HE3 LYS A 50 49.285 31.178 36.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 48.458 33.424 36.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 49.045 33.163 35.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 47.372 33.183 35.508 1.00 0.00 H new ATOM 619 N GLY A 51 43.865 29.280 30.449 1.00 0.00 N ATOM 620 CA GLY A 51 43.683 28.732 29.141 1.00 0.00 C ATOM 621 C GLY A 51 43.702 29.745 28.048 1.00 0.00 C ATOM 622 O GLY A 51 43.491 30.936 28.270 1.00 0.00 O ATOM 0 H GLY A 51 42.999 29.460 30.957 1.00 0.00 H new ATOM 0 HA2 GLY A 51 44.466 27.997 28.954 1.00 0.00 H new ATOM 0 HA3 GLY A 51 42.733 28.199 29.111 1.00 0.00 H new ATOM 626 N ALA A 52 43.901 29.289 26.798 1.00 0.00 N ATOM 627 CA ALA A 52 43.769 30.050 25.594 1.00 0.00 C ATOM 628 C ALA A 52 42.503 30.826 25.476 1.00 0.00 C ATOM 629 O ALA A 52 42.500 32.047 25.324 1.00 0.00 O ATOM 630 CB ALA A 52 43.946 29.117 24.385 1.00 0.00 C ATOM 0 H ALA A 52 44.173 28.323 26.617 1.00 0.00 H new ATOM 0 HA ALA A 52 44.554 30.805 25.623 1.00 0.00 H new ATOM 0 HB1 ALA A 52 43.846 29.692 23.464 1.00 0.00 H new ATOM 0 HB2 ALA A 52 44.934 28.658 24.421 1.00 0.00 H new ATOM 0 HB3 ALA A 52 43.183 28.339 24.411 1.00 0.00 H new ATOM 636 N ALA A 53 41.358 30.130 25.588 1.00 0.00 N ATOM 637 CA ALA A 53 40.011 30.607 25.526 1.00 0.00 C ATOM 638 C ALA A 53 39.691 31.563 26.624 1.00 0.00 C ATOM 639 O ALA A 53 39.143 32.639 26.388 1.00 0.00 O ATOM 640 CB ALA A 53 39.041 29.419 25.637 1.00 0.00 C ATOM 0 H ALA A 53 41.382 29.121 25.739 1.00 0.00 H new ATOM 0 HA ALA A 53 39.903 31.126 24.574 1.00 0.00 H new ATOM 0 HB1 ALA A 53 38.014 29.782 25.590 1.00 0.00 H new ATOM 0 HB2 ALA A 53 39.219 28.726 24.815 1.00 0.00 H new ATOM 0 HB3 ALA A 53 39.201 28.906 26.585 1.00 0.00 H new ATOM 646 N GLU A 54 40.056 31.181 27.861 1.00 0.00 N ATOM 647 CA GLU A 54 39.961 31.983 29.039 1.00 0.00 C ATOM 648 C GLU A 54 40.506 33.365 28.923 1.00 0.00 C ATOM 649 O GLU A 54 39.804 34.361 29.096 1.00 0.00 O ATOM 650 CB GLU A 54 40.692 31.274 30.191 1.00 0.00 C ATOM 651 CG GLU A 54 40.697 32.011 31.532 1.00 0.00 C ATOM 652 CD GLU A 54 41.860 32.956 31.798 1.00 0.00 C ATOM 653 OE1 GLU A 54 43.038 32.567 31.581 1.00 0.00 O ATOM 654 OE2 GLU A 54 41.614 34.106 32.251 1.00 0.00 O ATOM 0 H GLU A 54 40.441 30.255 28.048 1.00 0.00 H new ATOM 0 HA GLU A 54 38.892 32.095 29.220 1.00 0.00 H new ATOM 0 HB2 GLU A 54 40.235 30.295 30.338 1.00 0.00 H new ATOM 0 HB3 GLU A 54 41.725 31.102 29.889 1.00 0.00 H new ATOM 0 HG2 GLU A 54 39.772 32.583 31.607 1.00 0.00 H new ATOM 0 HG3 GLU A 54 40.677 31.266 32.328 1.00 0.00 H new ATOM 661 N SER A 55 41.816 33.448 28.634 1.00 0.00 N ATOM 662 CA SER A 55 42.538 34.681 28.627 1.00 0.00 C ATOM 663 C SER A 55 42.138 35.580 27.507 1.00 0.00 C ATOM 664 O SER A 55 42.121 36.801 27.659 1.00 0.00 O ATOM 665 CB SER A 55 44.054 34.438 28.544 1.00 0.00 C ATOM 666 OG SER A 55 44.563 33.925 29.767 1.00 0.00 O ATOM 0 H SER A 55 42.388 32.637 28.399 1.00 0.00 H new ATOM 0 HA SER A 55 42.288 35.172 29.568 1.00 0.00 H new ATOM 0 HB2 SER A 55 44.268 33.738 27.736 1.00 0.00 H new ATOM 0 HB3 SER A 55 44.561 35.371 28.300 1.00 0.00 H new ATOM 0 HG SER A 55 43.839 33.492 30.267 1.00 0.00 H new ATOM 672 N ASP A 56 41.756 35.006 26.352 1.00 0.00 N ATOM 673 CA ASP A 56 41.263 35.690 25.198 1.00 0.00 C ATOM 674 C ASP A 56 40.037 36.494 25.465 1.00 0.00 C ATOM 675 O ASP A 56 40.076 37.723 25.490 1.00 0.00 O ATOM 676 CB ASP A 56 41.073 34.640 24.091 1.00 0.00 C ATOM 677 CG ASP A 56 40.865 35.265 22.719 1.00 0.00 C ATOM 678 OD1 ASP A 56 39.740 35.759 22.437 1.00 0.00 O ATOM 679 OD2 ASP A 56 41.829 35.254 21.907 1.00 0.00 O ATOM 0 H ASP A 56 41.795 33.996 26.217 1.00 0.00 H new ATOM 0 HA ASP A 56 41.987 36.439 24.877 1.00 0.00 H new ATOM 0 HB2 ASP A 56 41.946 33.988 24.060 1.00 0.00 H new ATOM 0 HB3 ASP A 56 40.215 34.013 24.334 1.00 0.00 H new ATOM 684 N GLY A 57 38.885 35.845 25.710 1.00 0.00 N ATOM 685 CA GLY A 57 37.701 36.536 26.118 1.00 0.00 C ATOM 686 C GLY A 57 36.751 36.859 25.015 1.00 0.00 C ATOM 687 O GLY A 57 35.806 37.621 25.213 1.00 0.00 O ATOM 0 H GLY A 57 38.773 34.835 25.625 1.00 0.00 H new ATOM 0 HA2 GLY A 57 37.181 35.929 26.860 1.00 0.00 H new ATOM 0 HA3 GLY A 57 37.991 37.464 26.611 1.00 0.00 H new ATOM 691 N ARG A 58 36.901 36.245 23.828 1.00 0.00 N ATOM 692 CA ARG A 58 35.840 36.141 22.875 1.00 0.00 C ATOM 693 C ARG A 58 34.721 35.299 23.386 1.00 0.00 C ATOM 694 O ARG A 58 33.566 35.457 22.994 1.00 0.00 O ATOM 695 CB ARG A 58 36.303 35.508 21.553 1.00 0.00 C ATOM 696 CG ARG A 58 37.104 36.387 20.590 1.00 0.00 C ATOM 697 CD ARG A 58 36.305 37.407 19.775 1.00 0.00 C ATOM 698 NE ARG A 58 36.145 38.649 20.584 1.00 0.00 N ATOM 699 CZ ARG A 58 36.865 39.789 20.371 1.00 0.00 C ATOM 700 NH1 ARG A 58 37.919 39.841 19.506 1.00 0.00 N ATOM 701 NH2 ARG A 58 36.501 40.920 21.043 1.00 0.00 N ATOM 0 H ARG A 58 37.774 35.813 23.525 1.00 0.00 H new ATOM 0 HA ARG A 58 35.508 37.165 22.706 1.00 0.00 H new ATOM 0 HB2 ARG A 58 36.908 34.634 21.793 1.00 0.00 H new ATOM 0 HB3 ARG A 58 35.420 35.149 21.025 1.00 0.00 H new ATOM 0 HG2 ARG A 58 37.858 36.924 21.165 1.00 0.00 H new ATOM 0 HG3 ARG A 58 37.636 35.736 19.896 1.00 0.00 H new ATOM 0 HD2 ARG A 58 36.819 37.629 18.840 1.00 0.00 H new ATOM 0 HD3 ARG A 58 35.329 36.999 19.513 1.00 0.00 H new ATOM 0 HE ARG A 58 35.459 38.647 21.339 1.00 0.00 H new ATOM 0 HH11 ARG A 58 38.196 39.007 18.989 1.00 0.00 H new ATOM 0 HH12 ARG A 58 38.430 40.714 19.377 1.00 0.00 H new ATOM 0 HH21 ARG A 58 35.709 40.899 21.685 1.00 0.00 H new ATOM 0 HH22 ARG A 58 37.021 41.786 20.903 1.00 0.00 H new ATOM 715 N ILE A 59 35.039 34.366 24.301 1.00 0.00 N ATOM 716 CA ILE A 59 34.145 33.439 24.922 1.00 0.00 C ATOM 717 C ILE A 59 33.908 33.856 26.333 1.00 0.00 C ATOM 718 O ILE A 59 34.854 34.116 27.074 1.00 0.00 O ATOM 719 CB ILE A 59 34.736 32.061 24.899 1.00 0.00 C ATOM 720 CG1 ILE A 59 35.067 31.637 23.458 1.00 0.00 C ATOM 721 CG2 ILE A 59 33.760 31.061 25.542 1.00 0.00 C ATOM 722 CD1 ILE A 59 35.819 30.312 23.350 1.00 0.00 C ATOM 0 H ILE A 59 35.997 34.252 24.631 1.00 0.00 H new ATOM 0 HA ILE A 59 33.201 33.429 24.377 1.00 0.00 H new ATOM 0 HB ILE A 59 35.663 32.069 25.473 1.00 0.00 H new ATOM 0 HG12 ILE A 59 34.139 31.562 22.891 1.00 0.00 H new ATOM 0 HG13 ILE A 59 35.664 32.419 22.989 1.00 0.00 H new ATOM 0 HG21 ILE A 59 34.196 30.062 25.522 1.00 0.00 H new ATOM 0 HG22 ILE A 59 33.569 31.352 26.575 1.00 0.00 H new ATOM 0 HG23 ILE A 59 32.823 31.059 24.986 1.00 0.00 H new ATOM 0 HD11 ILE A 59 36.012 30.088 22.301 1.00 0.00 H new ATOM 0 HD12 ILE A 59 36.765 30.386 23.886 1.00 0.00 H new ATOM 0 HD13 ILE A 59 35.217 29.515 23.786 1.00 0.00 H new ATOM 734 N HIS A 60 32.636 33.922 26.763 1.00 0.00 N ATOM 735 CA HIS A 60 32.237 34.097 28.126 1.00 0.00 C ATOM 736 C HIS A 60 31.275 33.036 28.537 1.00 0.00 C ATOM 737 O HIS A 60 30.761 32.251 27.741 1.00 0.00 O ATOM 738 CB HIS A 60 31.575 35.467 28.353 1.00 0.00 C ATOM 739 CG HIS A 60 32.513 36.638 28.369 1.00 0.00 C ATOM 740 ND1 HIS A 60 33.539 36.809 29.275 1.00 0.00 N ATOM 741 CD2 HIS A 60 32.457 37.797 27.659 1.00 0.00 C ATOM 742 CE1 HIS A 60 34.049 38.054 29.068 1.00 0.00 C ATOM 743 NE2 HIS A 60 33.406 38.693 28.108 1.00 0.00 N ATOM 0 H HIS A 60 31.843 33.849 26.126 1.00 0.00 H new ATOM 0 HA HIS A 60 33.144 34.033 28.728 1.00 0.00 H new ATOM 0 HB2 HIS A 60 30.833 35.628 27.571 1.00 0.00 H new ATOM 0 HB3 HIS A 60 31.038 35.440 29.301 1.00 0.00 H new ATOM 0 HD2 HIS A 60 31.764 37.990 26.853 1.00 0.00 H new ATOM 0 HE1 HIS A 60 34.879 38.469 29.622 1.00 0.00 H new ATOM 0 HE2 HIS A 60 33.574 39.641 27.772 1.00 0.00 H new ATOM 751 N LYS A 61 30.978 32.957 29.847 1.00 0.00 N ATOM 752 CA LYS A 61 30.077 32.007 30.423 1.00 0.00 C ATOM 753 C LYS A 61 28.688 32.113 29.894 1.00 0.00 C ATOM 754 O LYS A 61 28.100 33.190 29.816 1.00 0.00 O ATOM 755 CB LYS A 61 30.070 32.129 31.955 1.00 0.00 C ATOM 756 CG LYS A 61 29.375 30.983 32.693 1.00 0.00 C ATOM 757 CD LYS A 61 29.552 31.003 34.213 1.00 0.00 C ATOM 758 CE LYS A 61 30.994 30.758 34.662 1.00 0.00 C ATOM 759 NZ LYS A 61 31.126 30.577 36.124 1.00 0.00 N ATOM 0 H LYS A 61 31.386 33.587 30.538 1.00 0.00 H new ATOM 0 HA LYS A 61 30.447 31.023 30.134 1.00 0.00 H new ATOM 0 HB2 LYS A 61 31.101 32.193 32.304 1.00 0.00 H new ATOM 0 HB3 LYS A 61 29.582 33.065 32.227 1.00 0.00 H new ATOM 0 HG2 LYS A 61 28.310 31.014 32.464 1.00 0.00 H new ATOM 0 HG3 LYS A 61 29.756 30.037 32.309 1.00 0.00 H new ATOM 0 HD2 LYS A 61 29.219 31.967 34.597 1.00 0.00 H new ATOM 0 HD3 LYS A 61 28.908 30.244 34.656 1.00 0.00 H new ATOM 0 HE2 LYS A 61 31.380 29.873 34.156 1.00 0.00 H new ATOM 0 HE3 LYS A 61 31.613 31.599 34.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 32.125 30.415 36.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 30.786 31.430 36.612 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 30.560 29.758 36.425 1.00 0.00 H new ATOM 773 N GLY A 62 28.098 30.985 29.460 1.00 0.00 N ATOM 774 CA GLY A 62 26.775 30.961 28.921 1.00 0.00 C ATOM 775 C GLY A 62 26.666 31.271 27.468 1.00 0.00 C ATOM 776 O GLY A 62 25.549 31.323 26.955 1.00 0.00 O ATOM 0 H GLY A 62 28.550 30.071 29.484 1.00 0.00 H new ATOM 0 HA2 GLY A 62 26.348 29.973 29.096 1.00 0.00 H new ATOM 0 HA3 GLY A 62 26.164 31.675 29.473 1.00 0.00 H new ATOM 780 N ASP A 63 27.780 31.466 26.740 1.00 0.00 N ATOM 781 CA ASP A 63 27.730 31.682 25.328 1.00 0.00 C ATOM 782 C ASP A 63 27.461 30.417 24.587 1.00 0.00 C ATOM 783 O ASP A 63 27.587 29.318 25.125 1.00 0.00 O ATOM 784 CB ASP A 63 29.014 32.347 24.803 1.00 0.00 C ATOM 785 CG ASP A 63 29.100 33.806 25.227 1.00 0.00 C ATOM 786 OD1 ASP A 63 28.036 34.446 25.441 1.00 0.00 O ATOM 787 OD2 ASP A 63 30.243 34.331 25.301 1.00 0.00 O ATOM 0 H ASP A 63 28.721 31.474 27.133 1.00 0.00 H new ATOM 0 HA ASP A 63 26.900 32.365 25.148 1.00 0.00 H new ATOM 0 HB2 ASP A 63 29.884 31.807 25.177 1.00 0.00 H new ATOM 0 HB3 ASP A 63 29.041 32.281 23.715 1.00 0.00 H new ATOM 792 N ARG A 64 27.025 30.519 23.320 1.00 0.00 N ATOM 793 CA ARG A 64 26.538 29.412 22.556 1.00 0.00 C ATOM 794 C ARG A 64 27.506 29.035 21.488 1.00 0.00 C ATOM 795 O ARG A 64 27.760 29.791 20.551 1.00 0.00 O ATOM 796 CB ARG A 64 25.196 29.785 21.903 1.00 0.00 C ATOM 797 CG ARG A 64 24.643 28.830 20.843 1.00 0.00 C ATOM 798 CD ARG A 64 24.338 27.409 21.320 1.00 0.00 C ATOM 799 NE ARG A 64 23.304 26.856 20.399 1.00 0.00 N ATOM 800 CZ ARG A 64 23.508 25.908 19.439 1.00 0.00 C ATOM 801 NH1 ARG A 64 24.720 25.342 19.164 1.00 0.00 N ATOM 802 NH2 ARG A 64 22.430 25.456 18.734 1.00 0.00 N ATOM 0 H ARG A 64 27.011 31.402 22.809 1.00 0.00 H new ATOM 0 HA ARG A 64 26.407 28.565 23.230 1.00 0.00 H new ATOM 0 HB2 ARG A 64 24.451 29.880 22.693 1.00 0.00 H new ATOM 0 HB3 ARG A 64 25.304 30.769 21.447 1.00 0.00 H new ATOM 0 HG2 ARG A 64 23.728 29.260 20.436 1.00 0.00 H new ATOM 0 HG3 ARG A 64 25.360 28.772 20.024 1.00 0.00 H new ATOM 0 HD2 ARG A 64 25.238 26.795 21.304 1.00 0.00 H new ATOM 0 HD3 ARG A 64 23.976 27.416 22.348 1.00 0.00 H new ATOM 0 HE ARG A 64 22.356 27.220 20.496 1.00 0.00 H new ATOM 0 HH11 ARG A 64 25.546 25.624 19.692 1.00 0.00 H new ATOM 0 HH12 ARG A 64 24.799 24.637 18.431 1.00 0.00 H new ATOM 0 HH21 ARG A 64 21.500 25.827 18.930 1.00 0.00 H new ATOM 0 HH22 ARG A 64 22.554 24.748 18.011 1.00 0.00 H new ATOM 816 N VAL A 65 28.061 27.812 21.548 1.00 0.00 N ATOM 817 CA VAL A 65 28.998 27.346 20.574 1.00 0.00 C ATOM 818 C VAL A 65 28.236 26.790 19.421 1.00 0.00 C ATOM 819 O VAL A 65 27.286 26.029 19.601 1.00 0.00 O ATOM 820 CB VAL A 65 29.971 26.339 21.113 1.00 0.00 C ATOM 821 CG1 VAL A 65 31.095 26.119 20.088 1.00 0.00 C ATOM 822 CG2 VAL A 65 30.568 26.862 22.431 1.00 0.00 C ATOM 0 H VAL A 65 27.856 27.136 22.284 1.00 0.00 H new ATOM 0 HA VAL A 65 29.609 28.192 20.260 1.00 0.00 H new ATOM 0 HB VAL A 65 29.459 25.395 21.297 1.00 0.00 H new ATOM 0 HG11 VAL A 65 31.804 25.388 20.477 1.00 0.00 H new ATOM 0 HG12 VAL A 65 30.669 25.751 19.154 1.00 0.00 H new ATOM 0 HG13 VAL A 65 31.610 27.062 19.905 1.00 0.00 H new ATOM 0 HG21 VAL A 65 31.275 26.132 22.825 1.00 0.00 H new ATOM 0 HG22 VAL A 65 31.083 27.805 22.248 1.00 0.00 H new ATOM 0 HG23 VAL A 65 29.769 27.020 23.155 1.00 0.00 H new ATOM 832 N LEU A 66 28.579 27.200 18.187 1.00 0.00 N ATOM 833 CA LEU A 66 27.797 26.987 17.009 1.00 0.00 C ATOM 834 C LEU A 66 28.439 26.027 16.067 1.00 0.00 C ATOM 835 O LEU A 66 27.774 25.215 15.425 1.00 0.00 O ATOM 836 CB LEU A 66 27.580 28.365 16.362 1.00 0.00 C ATOM 837 CG LEU A 66 26.247 28.566 15.621 1.00 0.00 C ATOM 838 CD1 LEU A 66 25.040 28.392 16.558 1.00 0.00 C ATOM 839 CD2 LEU A 66 26.223 29.973 15.001 1.00 0.00 C ATOM 0 H LEU A 66 29.445 27.705 18.002 1.00 0.00 H new ATOM 0 HA LEU A 66 26.843 26.530 17.270 1.00 0.00 H new ATOM 0 HB2 LEU A 66 27.657 29.125 17.140 1.00 0.00 H new ATOM 0 HB3 LEU A 66 28.393 28.545 15.659 1.00 0.00 H new ATOM 0 HG LEU A 66 26.172 27.807 14.843 1.00 0.00 H new ATOM 0 HD11 LEU A 66 24.118 28.542 15.996 1.00 0.00 H new ATOM 0 HD12 LEU A 66 25.048 27.387 16.979 1.00 0.00 H new ATOM 0 HD13 LEU A 66 25.097 29.124 17.364 1.00 0.00 H new ATOM 0 HD21 LEU A 66 25.281 30.122 14.474 1.00 0.00 H new ATOM 0 HD22 LEU A 66 26.320 30.720 15.789 1.00 0.00 H new ATOM 0 HD23 LEU A 66 27.051 30.076 14.300 1.00 0.00 H new ATOM 851 N ALA A 67 29.778 26.052 15.946 1.00 0.00 N ATOM 852 CA ALA A 67 30.487 25.076 15.177 1.00 0.00 C ATOM 853 C ALA A 67 31.855 24.880 15.734 1.00 0.00 C ATOM 854 O ALA A 67 32.434 25.782 16.337 1.00 0.00 O ATOM 855 CB ALA A 67 30.614 25.467 13.695 1.00 0.00 C ATOM 0 H ALA A 67 30.374 26.754 16.384 1.00 0.00 H new ATOM 0 HA ALA A 67 29.909 24.154 15.237 1.00 0.00 H new ATOM 0 HB1 ALA A 67 31.160 24.691 13.159 1.00 0.00 H new ATOM 0 HB2 ALA A 67 29.620 25.576 13.261 1.00 0.00 H new ATOM 0 HB3 ALA A 67 31.152 26.412 13.613 1.00 0.00 H new ATOM 861 N VAL A 68 32.422 23.676 15.539 1.00 0.00 N ATOM 862 CA VAL A 68 33.794 23.404 15.840 1.00 0.00 C ATOM 863 C VAL A 68 34.466 22.962 14.586 1.00 0.00 C ATOM 864 O VAL A 68 34.145 21.911 14.034 1.00 0.00 O ATOM 865 CB VAL A 68 33.968 22.334 16.877 1.00 0.00 C ATOM 866 CG1 VAL A 68 35.450 22.207 17.266 1.00 0.00 C ATOM 867 CG2 VAL A 68 33.113 22.613 18.124 1.00 0.00 C ATOM 0 H VAL A 68 31.916 22.874 15.164 1.00 0.00 H new ATOM 0 HA VAL A 68 34.231 24.318 16.242 1.00 0.00 H new ATOM 0 HB VAL A 68 33.630 21.392 16.445 1.00 0.00 H new ATOM 0 HG11 VAL A 68 35.563 21.427 18.019 1.00 0.00 H new ATOM 0 HG12 VAL A 68 36.037 21.948 16.385 1.00 0.00 H new ATOM 0 HG13 VAL A 68 35.803 23.156 17.670 1.00 0.00 H new ATOM 0 HG21 VAL A 68 33.264 21.818 18.854 1.00 0.00 H new ATOM 0 HG22 VAL A 68 33.407 23.567 18.561 1.00 0.00 H new ATOM 0 HG23 VAL A 68 32.061 22.652 17.842 1.00 0.00 H new ATOM 877 N ASN A 69 35.431 23.741 14.067 1.00 0.00 N ATOM 878 CA ASN A 69 36.322 23.408 12.998 1.00 0.00 C ATOM 879 C ASN A 69 35.671 22.951 11.738 1.00 0.00 C ATOM 880 O ASN A 69 36.021 21.925 11.159 1.00 0.00 O ATOM 881 CB ASN A 69 37.388 22.433 13.524 1.00 0.00 C ATOM 882 CG ASN A 69 38.719 22.515 12.790 1.00 0.00 C ATOM 883 OD1 ASN A 69 38.962 23.351 11.921 1.00 0.00 O ATOM 884 ND2 ASN A 69 39.659 21.621 13.196 1.00 0.00 N ATOM 0 H ASN A 69 35.601 24.681 14.425 1.00 0.00 H new ATOM 0 HA ASN A 69 36.801 24.334 12.679 1.00 0.00 H new ATOM 0 HB2 ASN A 69 37.556 22.631 14.583 1.00 0.00 H new ATOM 0 HB3 ASN A 69 37.005 21.416 13.447 1.00 0.00 H new ATOM 0 HD21 ASN A 69 40.589 21.634 12.778 1.00 0.00 H new ATOM 0 HD22 ASN A 69 39.434 20.937 13.918 1.00 0.00 H new ATOM 891 N GLY A 70 34.658 23.699 11.264 1.00 0.00 N ATOM 892 CA GLY A 70 33.901 23.372 10.095 1.00 0.00 C ATOM 893 C GLY A 70 32.711 22.511 10.348 1.00 0.00 C ATOM 894 O GLY A 70 31.803 22.427 9.522 1.00 0.00 O ATOM 0 H GLY A 70 34.355 24.564 11.712 1.00 0.00 H new ATOM 0 HA2 GLY A 70 33.570 24.297 9.622 1.00 0.00 H new ATOM 0 HA3 GLY A 70 34.555 22.866 9.384 1.00 0.00 H new ATOM 898 N VAL A 71 32.658 21.823 11.503 1.00 0.00 N ATOM 899 CA VAL A 71 31.595 20.935 11.855 1.00 0.00 C ATOM 900 C VAL A 71 30.591 21.678 12.667 1.00 0.00 C ATOM 901 O VAL A 71 30.804 22.001 13.835 1.00 0.00 O ATOM 902 CB VAL A 71 32.051 19.700 12.574 1.00 0.00 C ATOM 903 CG1 VAL A 71 30.886 18.711 12.739 1.00 0.00 C ATOM 904 CG2 VAL A 71 33.200 19.033 11.798 1.00 0.00 C ATOM 0 H VAL A 71 33.383 21.888 12.218 1.00 0.00 H new ATOM 0 HA VAL A 71 31.149 20.581 10.926 1.00 0.00 H new ATOM 0 HB VAL A 71 32.407 19.986 13.564 1.00 0.00 H new ATOM 0 HG11 VAL A 71 31.236 17.821 13.263 1.00 0.00 H new ATOM 0 HG12 VAL A 71 30.089 19.181 13.315 1.00 0.00 H new ATOM 0 HG13 VAL A 71 30.507 18.429 11.757 1.00 0.00 H new ATOM 0 HG21 VAL A 71 33.525 18.137 12.327 1.00 0.00 H new ATOM 0 HG22 VAL A 71 32.855 18.760 10.801 1.00 0.00 H new ATOM 0 HG23 VAL A 71 34.035 19.728 11.716 1.00 0.00 H new ATOM 914 N SER A 72 29.434 22.006 12.064 1.00 0.00 N ATOM 915 CA SER A 72 28.366 22.691 12.722 1.00 0.00 C ATOM 916 C SER A 72 27.662 21.810 13.697 1.00 0.00 C ATOM 917 O SER A 72 27.417 20.629 13.457 1.00 0.00 O ATOM 918 CB SER A 72 27.360 23.295 11.728 1.00 0.00 C ATOM 919 OG SER A 72 26.975 22.339 10.751 1.00 0.00 O ATOM 0 H SER A 72 29.236 21.787 11.088 1.00 0.00 H new ATOM 0 HA SER A 72 28.826 23.513 13.271 1.00 0.00 H new ATOM 0 HB2 SER A 72 26.479 23.647 12.265 1.00 0.00 H new ATOM 0 HB3 SER A 72 27.803 24.163 11.239 1.00 0.00 H new ATOM 0 HG SER A 72 26.334 22.745 10.131 1.00 0.00 H new ATOM 925 N LEU A 73 27.315 22.356 14.876 1.00 0.00 N ATOM 926 CA LEU A 73 26.831 21.585 15.978 1.00 0.00 C ATOM 927 C LEU A 73 25.356 21.377 15.933 1.00 0.00 C ATOM 928 O LEU A 73 24.677 21.270 16.954 1.00 0.00 O ATOM 929 CB LEU A 73 27.246 22.243 17.305 1.00 0.00 C ATOM 930 CG LEU A 73 28.755 22.177 17.593 1.00 0.00 C ATOM 931 CD1 LEU A 73 29.135 23.189 18.688 1.00 0.00 C ATOM 932 CD2 LEU A 73 29.208 20.768 18.012 1.00 0.00 C ATOM 0 H LEU A 73 27.372 23.356 15.068 1.00 0.00 H new ATOM 0 HA LEU A 73 27.286 20.597 15.905 1.00 0.00 H new ATOM 0 HB2 LEU A 73 26.934 23.287 17.293 1.00 0.00 H new ATOM 0 HB3 LEU A 73 26.710 21.759 18.121 1.00 0.00 H new ATOM 0 HG LEU A 73 29.268 22.428 16.664 1.00 0.00 H new ATOM 0 HD11 LEU A 73 30.206 23.131 18.881 1.00 0.00 H new ATOM 0 HD12 LEU A 73 28.880 24.196 18.357 1.00 0.00 H new ATOM 0 HD13 LEU A 73 28.588 22.958 19.602 1.00 0.00 H new ATOM 0 HD21 LEU A 73 30.281 20.773 18.204 1.00 0.00 H new ATOM 0 HD22 LEU A 73 28.679 20.470 18.917 1.00 0.00 H new ATOM 0 HD23 LEU A 73 28.986 20.062 17.212 1.00 0.00 H new ATOM 944 N GLU A 74 24.757 21.277 14.734 1.00 0.00 N ATOM 945 CA GLU A 74 23.354 21.066 14.558 1.00 0.00 C ATOM 946 C GLU A 74 22.922 19.702 14.974 1.00 0.00 C ATOM 947 O GLU A 74 23.549 18.695 14.650 1.00 0.00 O ATOM 948 CB GLU A 74 22.864 21.399 13.139 1.00 0.00 C ATOM 949 CG GLU A 74 23.526 20.605 12.012 1.00 0.00 C ATOM 950 CD GLU A 74 22.731 20.716 10.719 1.00 0.00 C ATOM 951 OE1 GLU A 74 21.549 20.279 10.704 1.00 0.00 O ATOM 952 OE2 GLU A 74 23.272 21.236 9.707 1.00 0.00 O ATOM 0 H GLU A 74 25.268 21.346 13.854 1.00 0.00 H new ATOM 0 HA GLU A 74 22.873 21.777 15.230 1.00 0.00 H new ATOM 0 HB2 GLU A 74 21.788 21.230 13.096 1.00 0.00 H new ATOM 0 HB3 GLU A 74 23.028 22.461 12.957 1.00 0.00 H new ATOM 0 HG2 GLU A 74 24.539 20.973 11.851 1.00 0.00 H new ATOM 0 HG3 GLU A 74 23.609 19.558 12.302 1.00 0.00 H new ATOM 959 N GLY A 75 21.862 19.631 15.800 1.00 0.00 N ATOM 960 CA GLY A 75 21.336 18.435 16.379 1.00 0.00 C ATOM 961 C GLY A 75 22.216 17.733 17.355 1.00 0.00 C ATOM 962 O GLY A 75 21.937 16.604 17.757 1.00 0.00 O ATOM 0 H GLY A 75 21.341 20.462 16.080 1.00 0.00 H new ATOM 0 HA2 GLY A 75 20.398 18.680 16.878 1.00 0.00 H new ATOM 0 HA3 GLY A 75 21.097 17.741 15.573 1.00 0.00 H new ATOM 966 N ALA A 76 23.340 18.355 17.751 1.00 0.00 N ATOM 967 CA ALA A 76 24.359 17.738 18.543 1.00 0.00 C ATOM 968 C ALA A 76 24.006 17.482 19.968 1.00 0.00 C ATOM 969 O ALA A 76 23.353 18.265 20.655 1.00 0.00 O ATOM 970 CB ALA A 76 25.675 18.529 18.451 1.00 0.00 C ATOM 0 H ALA A 76 23.548 19.324 17.511 1.00 0.00 H new ATOM 0 HA ALA A 76 24.479 16.747 18.104 1.00 0.00 H new ATOM 0 HB1 ALA A 76 26.436 18.042 19.061 1.00 0.00 H new ATOM 0 HB2 ALA A 76 26.008 18.562 17.414 1.00 0.00 H new ATOM 0 HB3 ALA A 76 25.515 19.545 18.813 1.00 0.00 H new ATOM 976 N THR A 77 24.476 16.329 20.476 1.00 0.00 N ATOM 977 CA THR A 77 24.379 15.936 21.847 1.00 0.00 C ATOM 978 C THR A 77 25.538 16.465 22.620 1.00 0.00 C ATOM 979 O THR A 77 26.474 17.047 22.073 1.00 0.00 O ATOM 980 CB THR A 77 24.307 14.446 21.998 1.00 0.00 C ATOM 981 OG1 THR A 77 25.385 13.794 21.342 1.00 0.00 O ATOM 982 CG2 THR A 77 23.008 13.942 21.345 1.00 0.00 C ATOM 0 H THR A 77 24.949 15.634 19.899 1.00 0.00 H new ATOM 0 HA THR A 77 23.454 16.358 22.241 1.00 0.00 H new ATOM 0 HB THR A 77 24.347 14.222 23.064 1.00 0.00 H new ATOM 0 HG1 THR A 77 25.304 12.825 21.464 1.00 0.00 H new ATOM 0 HG21 THR A 77 22.945 12.859 21.449 1.00 0.00 H new ATOM 0 HG22 THR A 77 22.151 14.404 21.835 1.00 0.00 H new ATOM 0 HG23 THR A 77 23.006 14.206 20.287 1.00 0.00 H new ATOM 990 N HIS A 78 25.540 16.262 23.950 1.00 0.00 N ATOM 991 CA HIS A 78 26.624 16.604 24.818 1.00 0.00 C ATOM 992 C HIS A 78 27.866 15.856 24.472 1.00 0.00 C ATOM 993 O HIS A 78 28.963 16.410 24.440 1.00 0.00 O ATOM 994 CB HIS A 78 26.210 16.314 26.270 1.00 0.00 C ATOM 995 CG HIS A 78 27.116 16.761 27.378 1.00 0.00 C ATOM 996 ND1 HIS A 78 26.811 16.489 28.697 1.00 0.00 N ATOM 997 CD2 HIS A 78 28.288 17.452 27.408 1.00 0.00 C ATOM 998 CE1 HIS A 78 27.811 17.016 29.453 1.00 0.00 C ATOM 999 NE2 HIS A 78 28.724 17.612 28.707 1.00 0.00 N ATOM 0 H HIS A 78 24.752 15.841 24.442 1.00 0.00 H new ATOM 0 HA HIS A 78 26.845 17.665 24.698 1.00 0.00 H new ATOM 0 HB2 HIS A 78 25.235 16.773 26.434 1.00 0.00 H new ATOM 0 HB3 HIS A 78 26.075 15.237 26.367 1.00 0.00 H new ATOM 0 HD2 HIS A 78 28.805 17.824 26.536 1.00 0.00 H new ATOM 0 HE1 HIS A 78 27.854 16.955 30.530 1.00 0.00 H new ATOM 0 HE2 HIS A 78 29.569 18.088 29.023 1.00 0.00 H new ATOM 1007 N LYS A 79 27.714 14.564 24.132 1.00 0.00 N ATOM 1008 CA LYS A 79 28.733 13.693 23.633 1.00 0.00 C ATOM 1009 C LYS A 79 29.447 14.190 22.425 1.00 0.00 C ATOM 1010 O LYS A 79 30.676 14.162 22.370 1.00 0.00 O ATOM 1011 CB LYS A 79 28.090 12.335 23.304 1.00 0.00 C ATOM 1012 CG LYS A 79 29.063 11.156 23.230 1.00 0.00 C ATOM 1013 CD LYS A 79 29.376 10.559 24.603 1.00 0.00 C ATOM 1014 CE LYS A 79 28.232 9.720 25.175 1.00 0.00 C ATOM 1015 NZ LYS A 79 28.586 9.184 26.508 1.00 0.00 N ATOM 0 H LYS A 79 26.812 14.094 24.212 1.00 0.00 H new ATOM 0 HA LYS A 79 29.487 13.624 24.417 1.00 0.00 H new ATOM 0 HB2 LYS A 79 27.335 12.116 24.059 1.00 0.00 H new ATOM 0 HB3 LYS A 79 27.571 12.418 22.349 1.00 0.00 H new ATOM 0 HG2 LYS A 79 28.640 10.382 22.590 1.00 0.00 H new ATOM 0 HG3 LYS A 79 29.991 11.485 22.762 1.00 0.00 H new ATOM 0 HD2 LYS A 79 30.269 9.938 24.526 1.00 0.00 H new ATOM 0 HD3 LYS A 79 29.608 11.366 25.298 1.00 0.00 H new ATOM 0 HE2 LYS A 79 27.331 10.329 25.251 1.00 0.00 H new ATOM 0 HE3 LYS A 79 28.004 8.898 24.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 27.795 8.618 26.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 29.432 8.585 26.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 28.780 9.972 27.159 1.00 0.00 H new ATOM 1029 N GLN A 80 28.713 14.675 21.407 1.00 0.00 N ATOM 1030 CA GLN A 80 29.258 15.168 20.180 1.00 0.00 C ATOM 1031 C GLN A 80 30.248 16.269 20.349 1.00 0.00 C ATOM 1032 O GLN A 80 31.368 16.188 19.848 1.00 0.00 O ATOM 1033 CB GLN A 80 28.154 15.666 19.231 1.00 0.00 C ATOM 1034 CG GLN A 80 27.400 14.556 18.497 1.00 0.00 C ATOM 1035 CD GLN A 80 28.353 13.796 17.586 1.00 0.00 C ATOM 1036 OE1 GLN A 80 29.085 14.382 16.791 1.00 0.00 O ATOM 1037 NE2 GLN A 80 28.393 12.443 17.726 1.00 0.00 N ATOM 0 H GLN A 80 27.695 14.726 21.441 1.00 0.00 H new ATOM 0 HA GLN A 80 29.778 14.309 19.756 1.00 0.00 H new ATOM 0 HB2 GLN A 80 27.439 16.256 19.804 1.00 0.00 H new ATOM 0 HB3 GLN A 80 28.600 16.334 18.494 1.00 0.00 H new ATOM 0 HG2 GLN A 80 26.950 13.873 19.217 1.00 0.00 H new ATOM 0 HG3 GLN A 80 26.586 14.983 17.911 1.00 0.00 H new ATOM 0 HE21 GLN A 80 27.775 11.981 18.393 1.00 0.00 H new ATOM 0 HE22 GLN A 80 29.041 11.891 17.164 1.00 0.00 H new ATOM 1046 N ALA A 81 29.880 17.324 21.097 1.00 0.00 N ATOM 1047 CA ALA A 81 30.733 18.432 21.401 1.00 0.00 C ATOM 1048 C ALA A 81 31.964 18.041 22.146 1.00 0.00 C ATOM 1049 O ALA A 81 33.060 18.488 21.814 1.00 0.00 O ATOM 1050 CB ALA A 81 29.944 19.474 22.208 1.00 0.00 C ATOM 0 H ALA A 81 28.950 17.409 21.507 1.00 0.00 H new ATOM 0 HA ALA A 81 31.065 18.851 20.451 1.00 0.00 H new ATOM 0 HB1 ALA A 81 30.591 20.320 22.441 1.00 0.00 H new ATOM 0 HB2 ALA A 81 29.092 19.820 21.622 1.00 0.00 H new ATOM 0 HB3 ALA A 81 29.588 19.023 23.134 1.00 0.00 H new ATOM 1056 N VAL A 82 31.855 17.145 23.142 1.00 0.00 N ATOM 1057 CA VAL A 82 32.966 16.675 23.911 1.00 0.00 C ATOM 1058 C VAL A 82 33.917 15.902 23.064 1.00 0.00 C ATOM 1059 O VAL A 82 35.116 16.175 23.078 1.00 0.00 O ATOM 1060 CB VAL A 82 32.553 15.887 25.119 1.00 0.00 C ATOM 1061 CG1 VAL A 82 33.764 15.268 25.838 1.00 0.00 C ATOM 1062 CG2 VAL A 82 31.831 16.839 26.088 1.00 0.00 C ATOM 0 H VAL A 82 30.965 16.734 23.422 1.00 0.00 H new ATOM 0 HA VAL A 82 33.478 17.562 24.284 1.00 0.00 H new ATOM 0 HB VAL A 82 31.902 15.073 24.799 1.00 0.00 H new ATOM 0 HG11 VAL A 82 33.423 14.706 26.707 1.00 0.00 H new ATOM 0 HG12 VAL A 82 34.289 14.599 25.156 1.00 0.00 H new ATOM 0 HG13 VAL A 82 34.439 16.060 26.161 1.00 0.00 H new ATOM 0 HG21 VAL A 82 31.521 16.288 26.976 1.00 0.00 H new ATOM 0 HG22 VAL A 82 32.506 17.644 26.378 1.00 0.00 H new ATOM 0 HG23 VAL A 82 30.954 17.261 25.598 1.00 0.00 H new ATOM 1072 N GLU A 83 33.437 14.946 22.248 1.00 0.00 N ATOM 1073 CA GLU A 83 34.279 14.181 21.382 1.00 0.00 C ATOM 1074 C GLU A 83 34.963 14.981 20.327 1.00 0.00 C ATOM 1075 O GLU A 83 36.146 14.797 20.049 1.00 0.00 O ATOM 1076 CB GLU A 83 33.545 13.019 20.691 1.00 0.00 C ATOM 1077 CG GLU A 83 33.185 11.869 21.635 1.00 0.00 C ATOM 1078 CD GLU A 83 32.822 10.591 20.893 1.00 0.00 C ATOM 1079 OE1 GLU A 83 32.809 10.572 19.634 1.00 0.00 O ATOM 1080 OE2 GLU A 83 32.582 9.562 21.580 1.00 0.00 O ATOM 0 H GLU A 83 32.449 14.701 22.189 1.00 0.00 H new ATOM 0 HA GLU A 83 35.032 13.789 22.066 1.00 0.00 H new ATOM 0 HB2 GLU A 83 32.633 13.399 20.232 1.00 0.00 H new ATOM 0 HB3 GLU A 83 34.170 12.634 19.886 1.00 0.00 H new ATOM 0 HG2 GLU A 83 34.027 11.672 22.299 1.00 0.00 H new ATOM 0 HG3 GLU A 83 32.347 12.170 22.264 1.00 0.00 H new ATOM 1087 N THR A 84 34.234 15.935 19.719 1.00 0.00 N ATOM 1088 CA THR A 84 34.711 16.877 18.754 1.00 0.00 C ATOM 1089 C THR A 84 35.783 17.763 19.290 1.00 0.00 C ATOM 1090 O THR A 84 36.827 17.919 18.660 1.00 0.00 O ATOM 1091 CB THR A 84 33.567 17.666 18.190 1.00 0.00 C ATOM 1092 OG1 THR A 84 32.852 16.878 17.251 1.00 0.00 O ATOM 1093 CG2 THR A 84 33.983 18.938 17.432 1.00 0.00 C ATOM 0 H THR A 84 33.241 16.055 19.917 1.00 0.00 H new ATOM 0 HA THR A 84 35.174 16.310 17.946 1.00 0.00 H new ATOM 0 HB THR A 84 32.975 17.950 19.060 1.00 0.00 H new ATOM 0 HG1 THR A 84 32.142 16.383 17.712 1.00 0.00 H new ATOM 0 HG21 THR A 84 33.094 19.446 17.059 1.00 0.00 H new ATOM 0 HG22 THR A 84 34.525 19.602 18.106 1.00 0.00 H new ATOM 0 HG23 THR A 84 34.626 18.668 16.594 1.00 0.00 H new ATOM 1101 N LEU A 85 35.604 18.344 20.490 1.00 0.00 N ATOM 1102 CA LEU A 85 36.587 19.136 21.161 1.00 0.00 C ATOM 1103 C LEU A 85 37.769 18.363 21.635 1.00 0.00 C ATOM 1104 O LEU A 85 38.877 18.892 21.705 1.00 0.00 O ATOM 1105 CB LEU A 85 35.988 19.878 22.367 1.00 0.00 C ATOM 1106 CG LEU A 85 35.006 21.004 22.003 1.00 0.00 C ATOM 1107 CD1 LEU A 85 34.252 21.448 23.268 1.00 0.00 C ATOM 1108 CD2 LEU A 85 35.700 22.200 21.329 1.00 0.00 C ATOM 0 H LEU A 85 34.734 18.257 21.016 1.00 0.00 H new ATOM 0 HA LEU A 85 36.927 19.842 20.403 1.00 0.00 H new ATOM 0 HB2 LEU A 85 35.474 19.157 23.002 1.00 0.00 H new ATOM 0 HB3 LEU A 85 36.801 20.300 22.958 1.00 0.00 H new ATOM 0 HG LEU A 85 34.300 20.611 21.272 1.00 0.00 H new ATOM 0 HD11 LEU A 85 33.555 22.246 23.014 1.00 0.00 H new ATOM 0 HD12 LEU A 85 33.701 20.602 23.679 1.00 0.00 H new ATOM 0 HD13 LEU A 85 34.965 21.811 24.008 1.00 0.00 H new ATOM 0 HD21 LEU A 85 34.960 22.965 21.094 1.00 0.00 H new ATOM 0 HD22 LEU A 85 36.448 22.615 22.005 1.00 0.00 H new ATOM 0 HD23 LEU A 85 36.184 21.869 20.410 1.00 0.00 H new ATOM 1120 N ARG A 86 37.610 17.069 21.970 1.00 0.00 N ATOM 1121 CA ARG A 86 38.681 16.187 22.315 1.00 0.00 C ATOM 1122 C ARG A 86 39.645 15.976 21.199 1.00 0.00 C ATOM 1123 O ARG A 86 40.855 15.885 21.402 1.00 0.00 O ATOM 1124 CB ARG A 86 38.149 14.831 22.810 1.00 0.00 C ATOM 1125 CG ARG A 86 38.746 14.368 24.140 1.00 0.00 C ATOM 1126 CD ARG A 86 38.210 12.998 24.564 1.00 0.00 C ATOM 1127 NE ARG A 86 38.945 12.581 25.792 1.00 0.00 N ATOM 1128 CZ ARG A 86 38.553 11.551 26.599 1.00 0.00 C ATOM 1129 NH1 ARG A 86 37.439 10.801 26.355 1.00 0.00 N ATOM 1130 NH2 ARG A 86 39.303 11.250 27.699 1.00 0.00 N ATOM 0 H ARG A 86 36.695 16.619 22.001 1.00 0.00 H new ATOM 0 HA ARG A 86 39.222 16.678 23.124 1.00 0.00 H new ATOM 0 HB2 ARG A 86 37.066 14.895 22.914 1.00 0.00 H new ATOM 0 HB3 ARG A 86 38.352 14.075 22.051 1.00 0.00 H new ATOM 0 HG2 ARG A 86 39.832 14.321 24.053 1.00 0.00 H new ATOM 0 HG3 ARG A 86 38.519 15.101 24.914 1.00 0.00 H new ATOM 0 HD2 ARG A 86 37.139 13.051 24.759 1.00 0.00 H new ATOM 0 HD3 ARG A 86 38.353 12.268 23.767 1.00 0.00 H new ATOM 0 HE ARG A 86 39.789 13.094 26.044 1.00 0.00 H new ATOM 0 HH11 ARG A 86 36.859 11.000 25.540 1.00 0.00 H new ATOM 0 HH12 ARG A 86 37.187 10.041 26.987 1.00 0.00 H new ATOM 0 HH21 ARG A 86 40.142 11.791 27.908 1.00 0.00 H new ATOM 0 HH22 ARG A 86 39.024 10.484 28.312 1.00 0.00 H new ATOM 1144 N ASN A 87 39.154 15.924 19.948 1.00 0.00 N ATOM 1145 CA ASN A 87 39.963 15.768 18.778 1.00 0.00 C ATOM 1146 C ASN A 87 40.296 17.082 18.157 1.00 0.00 C ATOM 1147 O ASN A 87 40.139 17.301 16.957 1.00 0.00 O ATOM 1148 CB ASN A 87 39.233 14.810 17.822 1.00 0.00 C ATOM 1149 CG ASN A 87 40.183 14.100 16.868 1.00 0.00 C ATOM 1150 OD1 ASN A 87 41.393 14.316 16.833 1.00 0.00 O ATOM 1151 ND2 ASN A 87 39.600 13.194 16.037 1.00 0.00 N ATOM 0 H ASN A 87 38.157 15.993 19.743 1.00 0.00 H new ATOM 0 HA ASN A 87 40.928 15.334 19.039 1.00 0.00 H new ATOM 0 HB2 ASN A 87 38.687 14.068 18.404 1.00 0.00 H new ATOM 0 HB3 ASN A 87 38.496 15.369 17.246 1.00 0.00 H new ATOM 0 HD21 ASN A 87 40.169 12.677 15.367 1.00 0.00 H new ATOM 0 HD22 ASN A 87 38.594 13.032 16.085 1.00 0.00 H new ATOM 1158 N THR A 88 40.786 18.036 18.969 1.00 0.00 N ATOM 1159 CA THR A 88 41.339 19.283 18.540 1.00 0.00 C ATOM 1160 C THR A 88 42.819 19.277 18.711 1.00 0.00 C ATOM 1161 O THR A 88 43.333 18.814 19.727 1.00 0.00 O ATOM 1162 CB THR A 88 40.786 20.494 19.231 1.00 0.00 C ATOM 1163 OG1 THR A 88 40.848 20.403 20.648 1.00 0.00 O ATOM 1164 CG2 THR A 88 39.312 20.690 18.837 1.00 0.00 C ATOM 0 H THR A 88 40.796 17.930 19.983 1.00 0.00 H new ATOM 0 HA THR A 88 41.054 19.365 17.491 1.00 0.00 H new ATOM 0 HB THR A 88 41.403 21.335 18.914 1.00 0.00 H new ATOM 0 HG1 THR A 88 40.043 19.955 20.983 1.00 0.00 H new ATOM 0 HG21 THR A 88 38.915 21.571 19.341 1.00 0.00 H new ATOM 0 HG22 THR A 88 39.239 20.826 17.758 1.00 0.00 H new ATOM 0 HG23 THR A 88 38.737 19.812 19.132 1.00 0.00 H new ATOM 1172 N GLY A 89 43.557 19.840 17.738 1.00 0.00 N ATOM 1173 CA GLY A 89 44.973 20.021 17.824 1.00 0.00 C ATOM 1174 C GLY A 89 45.349 21.361 18.356 1.00 0.00 C ATOM 1175 O GLY A 89 44.697 21.905 19.246 1.00 0.00 O ATOM 0 H GLY A 89 43.156 20.180 16.864 1.00 0.00 H new ATOM 0 HA2 GLY A 89 45.396 19.248 18.466 1.00 0.00 H new ATOM 0 HA3 GLY A 89 45.413 19.890 16.835 1.00 0.00 H new ATOM 1179 N GLN A 90 46.435 21.951 17.825 1.00 0.00 N ATOM 1180 CA GLN A 90 46.937 23.224 18.241 1.00 0.00 C ATOM 1181 C GLN A 90 46.050 24.362 17.865 1.00 0.00 C ATOM 1182 O GLN A 90 45.566 25.086 18.733 1.00 0.00 O ATOM 1183 CB GLN A 90 48.356 23.485 17.708 1.00 0.00 C ATOM 1184 CG GLN A 90 49.002 24.734 18.310 1.00 0.00 C ATOM 1185 CD GLN A 90 50.355 25.055 17.690 1.00 0.00 C ATOM 1186 OE1 GLN A 90 50.754 24.549 16.643 1.00 0.00 O ATOM 1187 NE2 GLN A 90 51.100 25.980 18.352 1.00 0.00 N ATOM 0 H GLN A 90 46.984 21.526 17.078 1.00 0.00 H new ATOM 0 HA GLN A 90 46.966 23.172 19.329 1.00 0.00 H new ATOM 0 HB2 GLN A 90 48.983 22.620 17.922 1.00 0.00 H new ATOM 0 HB3 GLN A 90 48.317 23.590 16.624 1.00 0.00 H new ATOM 0 HG2 GLN A 90 48.334 25.585 18.174 1.00 0.00 H new ATOM 0 HG3 GLN A 90 49.124 24.593 19.384 1.00 0.00 H new ATOM 0 HE21 GLN A 90 50.752 26.389 19.219 1.00 0.00 H new ATOM 0 HE22 GLN A 90 52.006 26.265 17.981 1.00 0.00 H new ATOM 1196 N VAL A 91 45.803 24.582 16.562 1.00 0.00 N ATOM 1197 CA VAL A 91 45.019 25.683 16.095 1.00 0.00 C ATOM 1198 C VAL A 91 43.592 25.269 15.970 1.00 0.00 C ATOM 1199 O VAL A 91 43.230 24.343 15.247 1.00 0.00 O ATOM 1200 CB VAL A 91 45.518 26.284 14.814 1.00 0.00 C ATOM 1201 CG1 VAL A 91 44.815 27.628 14.558 1.00 0.00 C ATOM 1202 CG2 VAL A 91 47.037 26.503 14.907 1.00 0.00 C ATOM 0 H VAL A 91 46.156 23.982 15.816 1.00 0.00 H new ATOM 0 HA VAL A 91 45.112 26.473 16.841 1.00 0.00 H new ATOM 0 HB VAL A 91 45.299 25.605 13.990 1.00 0.00 H new ATOM 0 HG11 VAL A 91 45.182 28.059 13.626 1.00 0.00 H new ATOM 0 HG12 VAL A 91 43.739 27.468 14.485 1.00 0.00 H new ATOM 0 HG13 VAL A 91 45.025 28.311 15.381 1.00 0.00 H new ATOM 0 HG21 VAL A 91 47.399 26.940 13.976 1.00 0.00 H new ATOM 0 HG22 VAL A 91 47.257 27.178 15.734 1.00 0.00 H new ATOM 0 HG23 VAL A 91 47.533 25.547 15.076 1.00 0.00 H new ATOM 1212 N VAL A 92 42.713 25.930 16.744 1.00 0.00 N ATOM 1213 CA VAL A 92 41.359 25.547 16.998 1.00 0.00 C ATOM 1214 C VAL A 92 40.439 26.601 16.486 1.00 0.00 C ATOM 1215 O VAL A 92 40.390 27.706 17.026 1.00 0.00 O ATOM 1216 CB VAL A 92 41.154 25.378 18.474 1.00 0.00 C ATOM 1217 CG1 VAL A 92 39.692 25.036 18.804 1.00 0.00 C ATOM 1218 CG2 VAL A 92 42.046 24.219 18.951 1.00 0.00 C ATOM 0 H VAL A 92 42.967 26.792 17.226 1.00 0.00 H new ATOM 0 HA VAL A 92 41.148 24.605 16.492 1.00 0.00 H new ATOM 0 HB VAL A 92 41.408 26.314 18.972 1.00 0.00 H new ATOM 0 HG11 VAL A 92 39.580 24.921 19.882 1.00 0.00 H new ATOM 0 HG12 VAL A 92 39.043 25.839 18.455 1.00 0.00 H new ATOM 0 HG13 VAL A 92 39.415 24.105 18.309 1.00 0.00 H new ATOM 0 HG21 VAL A 92 41.914 24.076 20.024 1.00 0.00 H new ATOM 0 HG22 VAL A 92 41.767 23.305 18.426 1.00 0.00 H new ATOM 0 HG23 VAL A 92 43.090 24.453 18.742 1.00 0.00 H new ATOM 1228 N HIS A 93 39.671 26.314 15.420 1.00 0.00 N ATOM 1229 CA HIS A 93 38.741 27.239 14.853 1.00 0.00 C ATOM 1230 C HIS A 93 37.353 26.953 15.312 1.00 0.00 C ATOM 1231 O HIS A 93 36.712 26.019 14.834 1.00 0.00 O ATOM 1232 CB HIS A 93 38.732 27.185 13.316 1.00 0.00 C ATOM 1233 CG HIS A 93 40.026 27.473 12.615 1.00 0.00 C ATOM 1234 ND1 HIS A 93 40.080 27.749 11.263 1.00 0.00 N ATOM 1235 CD2 HIS A 93 41.321 27.456 13.031 1.00 0.00 C ATOM 1236 CE1 HIS A 93 41.393 27.885 10.933 1.00 0.00 C ATOM 1237 NE2 HIS A 93 42.178 27.710 11.981 1.00 0.00 N ATOM 0 H HIS A 93 39.698 25.415 14.940 1.00 0.00 H new ATOM 0 HA HIS A 93 39.065 28.225 15.185 1.00 0.00 H new ATOM 0 HB2 HIS A 93 38.397 26.192 13.014 1.00 0.00 H new ATOM 0 HB3 HIS A 93 37.987 27.895 12.957 1.00 0.00 H new ATOM 0 HD2 HIS A 93 41.636 27.269 14.047 1.00 0.00 H new ATOM 0 HE1 HIS A 93 41.749 28.108 9.938 1.00 0.00 H new ATOM 0 HE2 HIS A 93 43.197 27.753 12.008 1.00 0.00 H new ATOM 1245 N LEU A 94 36.798 27.726 16.263 1.00 0.00 N ATOM 1246 CA LEU A 94 35.422 27.643 16.644 1.00 0.00 C ATOM 1247 C LEU A 94 34.571 28.602 15.887 1.00 0.00 C ATOM 1248 O LEU A 94 35.070 29.502 15.211 1.00 0.00 O ATOM 1249 CB LEU A 94 35.190 27.927 18.138 1.00 0.00 C ATOM 1250 CG LEU A 94 36.124 27.183 19.108 1.00 0.00 C ATOM 1251 CD1 LEU A 94 35.800 27.587 20.556 1.00 0.00 C ATOM 1252 CD2 LEU A 94 36.018 25.657 18.950 1.00 0.00 C ATOM 0 H LEU A 94 37.322 28.430 16.782 1.00 0.00 H new ATOM 0 HA LEU A 94 35.144 26.614 16.416 1.00 0.00 H new ATOM 0 HB2 LEU A 94 35.298 28.998 18.307 1.00 0.00 H new ATOM 0 HB3 LEU A 94 34.160 27.668 18.383 1.00 0.00 H new ATOM 0 HG LEU A 94 37.148 27.467 18.867 1.00 0.00 H new ATOM 0 HD11 LEU A 94 36.464 27.057 21.239 1.00 0.00 H new ATOM 0 HD12 LEU A 94 35.940 28.661 20.674 1.00 0.00 H new ATOM 0 HD13 LEU A 94 34.766 27.329 20.783 1.00 0.00 H new ATOM 0 HD21 LEU A 94 36.694 25.171 19.653 1.00 0.00 H new ATOM 0 HD22 LEU A 94 34.995 25.341 19.152 1.00 0.00 H new ATOM 0 HD23 LEU A 94 36.290 25.377 17.932 1.00 0.00 H new ATOM 1264 N LEU A 95 33.236 28.460 15.971 1.00 0.00 N ATOM 1265 CA LEU A 95 32.283 29.495 15.715 1.00 0.00 C ATOM 1266 C LEU A 95 31.351 29.548 16.877 1.00 0.00 C ATOM 1267 O LEU A 95 30.924 28.505 17.372 1.00 0.00 O ATOM 1268 CB LEU A 95 31.497 29.228 14.421 1.00 0.00 C ATOM 1269 CG LEU A 95 30.343 30.185 14.078 1.00 0.00 C ATOM 1270 CD1 LEU A 95 30.772 31.644 13.846 1.00 0.00 C ATOM 1271 CD2 LEU A 95 29.594 29.659 12.842 1.00 0.00 C ATOM 0 H LEU A 95 32.799 27.576 16.231 1.00 0.00 H new ATOM 0 HA LEU A 95 32.801 30.445 15.586 1.00 0.00 H new ATOM 0 HB2 LEU A 95 32.203 29.242 13.590 1.00 0.00 H new ATOM 0 HB3 LEU A 95 31.090 28.218 14.477 1.00 0.00 H new ATOM 0 HG LEU A 95 29.694 30.204 14.954 1.00 0.00 H new ATOM 0 HD11 LEU A 95 29.896 32.248 13.610 1.00 0.00 H new ATOM 0 HD12 LEU A 95 31.247 32.031 14.747 1.00 0.00 H new ATOM 0 HD13 LEU A 95 31.477 31.688 13.016 1.00 0.00 H new ATOM 0 HD21 LEU A 95 28.776 30.336 12.597 1.00 0.00 H new ATOM 0 HD22 LEU A 95 30.281 29.600 11.998 1.00 0.00 H new ATOM 0 HD23 LEU A 95 29.194 28.667 13.054 1.00 0.00 H new ATOM 1283 N LEU A 96 30.979 30.744 17.367 1.00 0.00 N ATOM 1284 CA LEU A 96 30.000 30.871 18.402 1.00 0.00 C ATOM 1285 C LEU A 96 29.147 32.083 18.246 1.00 0.00 C ATOM 1286 O LEU A 96 29.507 33.031 17.550 1.00 0.00 O ATOM 1287 CB LEU A 96 30.633 30.859 19.803 1.00 0.00 C ATOM 1288 CG LEU A 96 31.666 31.962 20.090 1.00 0.00 C ATOM 1289 CD1 LEU A 96 31.216 32.837 21.271 1.00 0.00 C ATOM 1290 CD2 LEU A 96 33.043 31.333 20.362 1.00 0.00 C ATOM 0 H LEU A 96 31.361 31.632 17.042 1.00 0.00 H new ATOM 0 HA LEU A 96 29.360 29.995 18.301 1.00 0.00 H new ATOM 0 HB2 LEU A 96 29.834 30.937 20.541 1.00 0.00 H new ATOM 0 HB3 LEU A 96 31.113 29.892 19.954 1.00 0.00 H new ATOM 0 HG LEU A 96 31.746 32.605 19.214 1.00 0.00 H new ATOM 0 HD11 LEU A 96 31.962 33.610 21.456 1.00 0.00 H new ATOM 0 HD12 LEU A 96 30.260 33.304 21.034 1.00 0.00 H new ATOM 0 HD13 LEU A 96 31.107 32.218 22.162 1.00 0.00 H new ATOM 0 HD21 LEU A 96 33.769 32.120 20.564 1.00 0.00 H new ATOM 0 HD22 LEU A 96 32.976 30.670 21.225 1.00 0.00 H new ATOM 0 HD23 LEU A 96 33.361 30.762 19.490 1.00 0.00 H new ATOM 1302 N GLU A 97 27.983 32.078 18.918 1.00 0.00 N ATOM 1303 CA GLU A 97 27.175 33.233 19.164 1.00 0.00 C ATOM 1304 C GLU A 97 27.512 33.734 20.527 1.00 0.00 C ATOM 1305 O GLU A 97 27.714 32.960 21.462 1.00 0.00 O ATOM 1306 CB GLU A 97 25.661 32.975 19.228 1.00 0.00 C ATOM 1307 CG GLU A 97 24.993 32.242 18.063 1.00 0.00 C ATOM 1308 CD GLU A 97 23.505 32.048 18.317 1.00 0.00 C ATOM 1309 OE1 GLU A 97 23.118 31.562 19.413 1.00 0.00 O ATOM 1310 OE2 GLU A 97 22.675 32.359 17.422 1.00 0.00 O ATOM 0 H GLU A 97 27.584 31.225 19.310 1.00 0.00 H new ATOM 0 HA GLU A 97 27.381 33.909 18.334 1.00 0.00 H new ATOM 0 HB2 GLU A 97 25.460 32.406 20.136 1.00 0.00 H new ATOM 0 HB3 GLU A 97 25.165 33.939 19.340 1.00 0.00 H new ATOM 0 HG2 GLU A 97 25.137 32.808 17.143 1.00 0.00 H new ATOM 0 HG3 GLU A 97 25.470 31.272 17.918 1.00 0.00 H new ATOM 1317 N LYS A 98 27.495 35.064 20.724 1.00 0.00 N ATOM 1318 CA LYS A 98 27.445 35.642 22.031 1.00 0.00 C ATOM 1319 C LYS A 98 26.048 35.533 22.537 1.00 0.00 C ATOM 1320 O LYS A 98 25.103 35.906 21.843 1.00 0.00 O ATOM 1321 CB LYS A 98 27.881 37.117 22.001 1.00 0.00 C ATOM 1322 CG LYS A 98 28.768 37.521 23.181 1.00 0.00 C ATOM 1323 CD LYS A 98 28.009 37.815 24.476 1.00 0.00 C ATOM 1324 CE LYS A 98 28.887 37.653 25.719 1.00 0.00 C ATOM 1325 NZ LYS A 98 28.134 38.061 26.926 1.00 0.00 N ATOM 0 H LYS A 98 27.516 35.747 19.967 1.00 0.00 H new ATOM 0 HA LYS A 98 28.131 35.109 22.689 1.00 0.00 H new ATOM 0 HB2 LYS A 98 28.418 37.309 21.072 1.00 0.00 H new ATOM 0 HB3 LYS A 98 26.993 37.749 21.992 1.00 0.00 H new ATOM 0 HG2 LYS A 98 29.486 36.723 23.369 1.00 0.00 H new ATOM 0 HG3 LYS A 98 29.341 38.405 22.902 1.00 0.00 H new ATOM 0 HD2 LYS A 98 27.618 38.832 24.441 1.00 0.00 H new ATOM 0 HD3 LYS A 98 27.152 37.146 24.551 1.00 0.00 H new ATOM 0 HE2 LYS A 98 29.209 36.616 25.814 1.00 0.00 H new ATOM 0 HE3 LYS A 98 29.788 38.259 25.620 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 28.737 37.948 27.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 27.848 39.057 26.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 27.287 37.465 27.025 1.00 0.00 H new ATOM 1339 N GLY A 99 25.874 34.971 23.746 1.00 0.00 N ATOM 1340 CA GLY A 99 24.628 34.527 24.289 1.00 0.00 C ATOM 1341 C GLY A 99 23.525 35.530 24.313 1.00 0.00 C ATOM 1342 O GLY A 99 23.507 36.443 25.135 1.00 0.00 O ATOM 0 H GLY A 99 26.654 34.817 24.385 1.00 0.00 H new ATOM 0 HA2 GLY A 99 24.293 33.663 23.715 1.00 0.00 H new ATOM 0 HA3 GLY A 99 24.802 34.184 25.309 1.00 0.00 H new ATOM 1346 N GLN A 100 22.565 35.393 23.380 1.00 0.00 N ATOM 1347 CA GLN A 100 21.608 36.395 23.028 1.00 0.00 C ATOM 1348 C GLN A 100 20.628 36.771 24.086 1.00 0.00 C ATOM 1349 O GLN A 100 20.644 37.891 24.593 1.00 0.00 O ATOM 1350 CB GLN A 100 20.884 35.923 21.756 1.00 0.00 C ATOM 1351 CG GLN A 100 20.277 37.102 20.992 1.00 0.00 C ATOM 1352 CD GLN A 100 19.183 36.702 20.013 1.00 0.00 C ATOM 1353 OE1 GLN A 100 18.037 37.123 20.165 1.00 0.00 O ATOM 1354 NE2 GLN A 100 19.520 35.885 18.979 1.00 0.00 N ATOM 0 H GLN A 100 22.451 34.534 22.842 1.00 0.00 H new ATOM 0 HA GLN A 100 22.168 37.317 22.871 1.00 0.00 H new ATOM 0 HB2 GLN A 100 21.585 35.392 21.112 1.00 0.00 H new ATOM 0 HB3 GLN A 100 20.098 35.217 22.023 1.00 0.00 H new ATOM 0 HG2 GLN A 100 19.868 37.815 21.708 1.00 0.00 H new ATOM 0 HG3 GLN A 100 21.069 37.616 20.447 1.00 0.00 H new ATOM 0 HE21 GLN A 100 20.480 35.554 18.883 1.00 0.00 H new ATOM 0 HE22 GLN A 100 18.813 35.603 18.300 1.00 0.00 H new ATOM 1363 N VAL A 101 19.714 35.855 24.456 1.00 0.00 N ATOM 1364 CA VAL A 101 18.773 36.035 25.516 1.00 0.00 C ATOM 1365 C VAL A 101 19.175 35.150 26.646 1.00 0.00 C ATOM 1366 O VAL A 101 19.562 34.016 26.369 1.00 0.00 O ATOM 1367 CB VAL A 101 17.358 35.814 25.069 1.00 0.00 C ATOM 1368 CG1 VAL A 101 17.063 34.356 24.684 1.00 0.00 C ATOM 1369 CG2 VAL A 101 16.363 36.302 26.136 1.00 0.00 C ATOM 0 H VAL A 101 19.628 34.949 23.995 1.00 0.00 H new ATOM 0 HA VAL A 101 18.791 37.072 25.853 1.00 0.00 H new ATOM 0 HB VAL A 101 17.230 36.406 24.163 1.00 0.00 H new ATOM 0 HG11 VAL A 101 16.023 34.266 24.370 1.00 0.00 H new ATOM 0 HG12 VAL A 101 17.716 34.057 23.864 1.00 0.00 H new ATOM 0 HG13 VAL A 101 17.240 33.710 25.544 1.00 0.00 H new ATOM 0 HG21 VAL A 101 15.344 36.131 25.789 1.00 0.00 H new ATOM 0 HG22 VAL A 101 16.527 35.754 27.064 1.00 0.00 H new ATOM 0 HG23 VAL A 101 16.512 37.367 26.313 1.00 0.00 H new ATOM 1379 N PRO A 102 19.165 35.541 27.886 1.00 0.00 N ATOM 1380 CA PRO A 102 19.475 34.659 28.973 1.00 0.00 C ATOM 1381 C PRO A 102 18.498 33.550 29.161 1.00 0.00 C ATOM 1382 O PRO A 102 17.268 33.790 29.288 1.00 0.00 O ATOM 1383 CB PRO A 102 19.504 35.556 30.210 1.00 0.00 C ATOM 1384 CG PRO A 102 19.942 36.919 29.651 1.00 0.00 C ATOM 1385 CD PRO A 102 19.221 36.937 28.294 1.00 0.00 C ATOM 1386 OXT PRO A 102 18.931 32.367 29.201 1.00 0.00 O ATOM 0 HA PRO A 102 20.420 34.152 28.776 1.00 0.00 H new ATOM 0 HB2 PRO A 102 18.526 35.613 30.688 1.00 0.00 H new ATOM 0 HB3 PRO A 102 20.204 35.185 30.959 1.00 0.00 H new ATOM 0 HG2 PRO A 102 19.632 37.744 30.292 1.00 0.00 H new ATOM 0 HG3 PRO A 102 21.024 36.989 29.542 1.00 0.00 H new ATOM 0 HD2 PRO A 102 18.222 37.364 28.382 1.00 0.00 H new ATOM 0 HD3 PRO A 102 19.763 37.541 27.566 1.00 0.00 H new TER 1394 PRO A 102