USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=16 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+ -174:sc= 0.208 (180deg=0.0591) USER MOD Set 1.2: A 88 THR OG1 : rot -88:sc= 1.44 USER MOD Set 2.1: A 77 THR OG1 : rot 180:sc= 0.229 USER MOD Set 2.2: A 80 GLN : amide:sc= 0 X(o=0.23,f=0.73) 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 180:sc= 0 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 X(o=0,f=0) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0.129 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 39 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 43 TYR OH : rot -162:sc= 1.25 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0148) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc=-0.00938 K(o=-0.0094,f=-0.64) USER MOD Single : A 72 SER OG : rot 170:sc= 0 USER MOD Single : A 78 HIS : no HD1:sc= -0.256 X(o=-0.26,f=-0.24) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot 86:sc= 1.29 USER MOD Single : A 87 ASN : amide:sc= -0.0392 X(o=-0.039,f=-0.062) USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 93 HIS : no HD1:sc= -0.0588 X(o=-0.059,f=0) USER MOD Single : A 98 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0331) USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 9 24.581 45.086 20.275 1.00 0.00 N ATOM 2 CA LYS A 9 25.082 43.898 19.657 1.00 0.00 C ATOM 3 C LYS A 9 26.207 43.339 20.459 1.00 0.00 C ATOM 4 O LYS A 9 27.333 43.786 20.245 1.00 0.00 O ATOM 5 CB LYS A 9 25.495 44.183 18.203 1.00 0.00 C ATOM 6 CG LYS A 9 25.778 42.931 17.372 1.00 0.00 C ATOM 7 CD LYS A 9 25.983 43.255 15.890 1.00 0.00 C ATOM 8 CE LYS A 9 26.180 42.015 15.017 1.00 0.00 C ATOM 9 NZ LYS A 9 26.312 42.390 13.592 1.00 0.00 N ATOM 0 HA LYS A 9 24.293 43.146 19.628 1.00 0.00 H new ATOM 0 HB2 LYS A 9 24.704 44.755 17.718 1.00 0.00 H new ATOM 0 HB3 LYS A 9 26.386 44.811 18.207 1.00 0.00 H new ATOM 0 HG2 LYS A 9 26.667 42.433 17.760 1.00 0.00 H new ATOM 0 HG3 LYS A 9 24.949 42.232 17.478 1.00 0.00 H new ATOM 0 HD2 LYS A 9 25.121 43.813 15.525 1.00 0.00 H new ATOM 0 HD3 LYS A 9 26.851 43.905 15.785 1.00 0.00 H new ATOM 0 HE2 LYS A 9 27.071 41.476 15.340 1.00 0.00 H new ATOM 0 HE3 LYS A 9 25.335 41.338 15.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 26.445 41.533 13.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 25.451 42.884 13.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 27.133 43.017 13.473 1.00 0.00 H new ATOM 23 N PRO A 10 26.065 42.392 21.336 1.00 0.00 N ATOM 24 CA PRO A 10 27.111 42.002 22.236 1.00 0.00 C ATOM 25 C PRO A 10 28.228 41.175 21.697 1.00 0.00 C ATOM 26 O PRO A 10 28.914 40.507 22.468 1.00 0.00 O ATOM 27 CB PRO A 10 26.414 41.230 23.354 1.00 0.00 C ATOM 28 CG PRO A 10 24.979 41.783 23.346 1.00 0.00 C ATOM 29 CD PRO A 10 24.762 41.976 21.836 1.00 0.00 C ATOM 0 HA PRO A 10 27.619 42.919 22.535 1.00 0.00 H new ATOM 0 HB2 PRO A 10 26.429 40.156 23.168 1.00 0.00 H new ATOM 0 HB3 PRO A 10 26.900 41.394 24.316 1.00 0.00 H new ATOM 0 HG2 PRO A 10 24.264 41.086 23.782 1.00 0.00 H new ATOM 0 HG3 PRO A 10 24.892 42.717 23.900 1.00 0.00 H new ATOM 0 HD2 PRO A 10 24.430 41.053 21.361 1.00 0.00 H new ATOM 0 HD3 PRO A 10 24.000 42.730 21.637 1.00 0.00 H new ATOM 37 N GLY A 11 28.474 41.226 20.375 1.00 0.00 N ATOM 38 CA GLY A 11 29.374 40.361 19.676 1.00 0.00 C ATOM 39 C GLY A 11 28.626 39.162 19.206 1.00 0.00 C ATOM 40 O GLY A 11 28.914 38.033 19.599 1.00 0.00 O ATOM 0 H GLY A 11 28.022 41.905 19.763 1.00 0.00 H new ATOM 0 HA2 GLY A 11 29.818 40.884 18.829 1.00 0.00 H new ATOM 0 HA3 GLY A 11 30.193 40.062 20.330 1.00 0.00 H new ATOM 44 N ASP A 12 27.592 39.372 18.372 1.00 0.00 N ATOM 45 CA ASP A 12 26.569 38.415 18.085 1.00 0.00 C ATOM 46 C ASP A 12 27.064 37.090 17.618 1.00 0.00 C ATOM 47 O ASP A 12 26.807 36.091 18.289 1.00 0.00 O ATOM 48 CB ASP A 12 25.538 39.023 17.120 1.00 0.00 C ATOM 49 CG ASP A 12 24.182 38.347 17.262 1.00 0.00 C ATOM 50 OD1 ASP A 12 23.386 38.818 18.119 1.00 0.00 O ATOM 51 OD2 ASP A 12 23.905 37.338 16.560 1.00 0.00 O ATOM 0 H ASP A 12 27.463 40.253 17.873 1.00 0.00 H new ATOM 0 HA ASP A 12 26.085 38.190 19.035 1.00 0.00 H new ATOM 0 HB2 ASP A 12 25.437 40.090 17.317 1.00 0.00 H new ATOM 0 HB3 ASP A 12 25.892 38.921 16.094 1.00 0.00 H new ATOM 56 N THR A 13 27.826 37.022 16.513 1.00 0.00 N ATOM 57 CA THR A 13 28.613 35.871 16.192 1.00 0.00 C ATOM 58 C THR A 13 30.046 36.246 16.023 1.00 0.00 C ATOM 59 O THR A 13 30.374 37.373 15.657 1.00 0.00 O ATOM 60 CB THR A 13 28.169 35.073 15.003 1.00 0.00 C ATOM 61 OG1 THR A 13 27.658 35.874 13.947 1.00 0.00 O ATOM 62 CG2 THR A 13 27.037 34.119 15.423 1.00 0.00 C ATOM 0 H THR A 13 27.898 37.777 15.831 1.00 0.00 H new ATOM 0 HA THR A 13 28.469 35.213 17.049 1.00 0.00 H new ATOM 0 HB THR A 13 29.054 34.546 14.646 1.00 0.00 H new ATOM 0 HG1 THR A 13 27.387 35.298 13.201 1.00 0.00 H new ATOM 0 HG21 THR A 13 26.712 33.538 14.560 1.00 0.00 H new ATOM 0 HG22 THR A 13 27.399 33.445 16.200 1.00 0.00 H new ATOM 0 HG23 THR A 13 26.197 34.698 15.807 1.00 0.00 H new ATOM 70 N PHE A 14 30.960 35.283 16.238 1.00 0.00 N ATOM 71 CA PHE A 14 32.372 35.487 16.137 1.00 0.00 C ATOM 72 C PHE A 14 33.012 34.260 15.585 1.00 0.00 C ATOM 73 O PHE A 14 32.565 33.139 15.825 1.00 0.00 O ATOM 74 CB PHE A 14 33.133 35.712 17.455 1.00 0.00 C ATOM 75 CG PHE A 14 32.428 36.480 18.520 1.00 0.00 C ATOM 76 CD1 PHE A 14 31.717 35.776 19.464 1.00 0.00 C ATOM 77 CD2 PHE A 14 32.666 37.819 18.721 1.00 0.00 C ATOM 78 CE1 PHE A 14 31.326 36.369 20.641 1.00 0.00 C ATOM 79 CE2 PHE A 14 32.278 38.423 19.895 1.00 0.00 C ATOM 80 CZ PHE A 14 31.626 37.692 20.860 1.00 0.00 C ATOM 0 H PHE A 14 30.707 34.328 16.491 1.00 0.00 H new ATOM 0 HA PHE A 14 32.441 36.387 15.526 1.00 0.00 H new ATOM 0 HB2 PHE A 14 33.402 34.737 17.862 1.00 0.00 H new ATOM 0 HB3 PHE A 14 34.064 36.229 17.224 1.00 0.00 H new ATOM 0 HD1 PHE A 14 31.462 34.743 19.278 1.00 0.00 H new ATOM 0 HD2 PHE A 14 33.159 38.399 17.955 1.00 0.00 H new ATOM 0 HE1 PHE A 14 30.789 35.801 21.386 1.00 0.00 H new ATOM 0 HE2 PHE A 14 32.485 39.470 20.058 1.00 0.00 H new ATOM 0 HZ PHE A 14 31.349 38.159 21.793 1.00 0.00 H new ATOM 90 N GLU A 15 34.131 34.443 14.862 1.00 0.00 N ATOM 91 CA GLU A 15 35.033 33.407 14.466 1.00 0.00 C ATOM 92 C GLU A 15 36.203 33.394 15.389 1.00 0.00 C ATOM 93 O GLU A 15 36.868 34.406 15.606 1.00 0.00 O ATOM 94 CB GLU A 15 35.551 33.558 13.026 1.00 0.00 C ATOM 95 CG GLU A 15 34.483 33.808 11.960 1.00 0.00 C ATOM 96 CD GLU A 15 35.137 33.923 10.590 1.00 0.00 C ATOM 97 OE1 GLU A 15 35.875 34.913 10.338 1.00 0.00 O ATOM 98 OE2 GLU A 15 34.941 33.017 9.737 1.00 0.00 O ATOM 0 H GLU A 15 34.422 35.365 14.536 1.00 0.00 H new ATOM 0 HA GLU A 15 34.471 32.474 14.512 1.00 0.00 H new ATOM 0 HB2 GLU A 15 36.264 34.382 13.000 1.00 0.00 H new ATOM 0 HB3 GLU A 15 36.099 32.654 12.760 1.00 0.00 H new ATOM 0 HG2 GLU A 15 33.759 32.993 11.960 1.00 0.00 H new ATOM 0 HG3 GLU A 15 33.935 34.722 12.189 1.00 0.00 H new ATOM 105 N VAL A 16 36.508 32.234 15.997 1.00 0.00 N ATOM 106 CA VAL A 16 37.556 32.079 16.956 1.00 0.00 C ATOM 107 C VAL A 16 38.528 31.084 16.418 1.00 0.00 C ATOM 108 O VAL A 16 38.365 29.876 16.582 1.00 0.00 O ATOM 109 CB VAL A 16 36.994 31.693 18.292 1.00 0.00 C ATOM 110 CG1 VAL A 16 38.036 31.195 19.307 1.00 0.00 C ATOM 111 CG2 VAL A 16 36.273 32.914 18.887 1.00 0.00 C ATOM 0 H VAL A 16 36.003 31.368 15.812 1.00 0.00 H new ATOM 0 HA VAL A 16 38.082 33.020 17.119 1.00 0.00 H new ATOM 0 HB VAL A 16 36.321 30.854 18.112 1.00 0.00 H new ATOM 0 HG11 VAL A 16 37.539 30.939 20.243 1.00 0.00 H new ATOM 0 HG12 VAL A 16 38.538 30.313 18.910 1.00 0.00 H new ATOM 0 HG13 VAL A 16 38.770 31.980 19.489 1.00 0.00 H new ATOM 0 HG21 VAL A 16 35.857 32.652 19.860 1.00 0.00 H new ATOM 0 HG22 VAL A 16 36.982 33.734 19.004 1.00 0.00 H new ATOM 0 HG23 VAL A 16 35.468 33.222 18.219 1.00 0.00 H new ATOM 121 N GLU A 17 39.601 31.547 15.753 1.00 0.00 N ATOM 122 CA GLU A 17 40.706 30.720 15.380 1.00 0.00 C ATOM 123 C GLU A 17 41.726 30.738 16.466 1.00 0.00 C ATOM 124 O GLU A 17 42.717 31.466 16.436 1.00 0.00 O ATOM 125 CB GLU A 17 41.344 31.136 14.044 1.00 0.00 C ATOM 126 CG GLU A 17 40.451 30.937 12.819 1.00 0.00 C ATOM 127 CD GLU A 17 39.676 32.163 12.357 1.00 0.00 C ATOM 128 OE1 GLU A 17 39.790 33.259 12.967 1.00 0.00 O ATOM 129 OE2 GLU A 17 38.988 32.050 11.307 1.00 0.00 O ATOM 0 H GLU A 17 39.703 32.521 15.467 1.00 0.00 H new ATOM 0 HA GLU A 17 40.323 29.710 15.238 1.00 0.00 H new ATOM 0 HB2 GLU A 17 41.626 32.187 14.104 1.00 0.00 H new ATOM 0 HB3 GLU A 17 42.263 30.567 13.903 1.00 0.00 H new ATOM 0 HG2 GLU A 17 41.072 30.591 11.993 1.00 0.00 H new ATOM 0 HG3 GLU A 17 39.739 30.142 13.038 1.00 0.00 H new ATOM 136 N LEU A 18 41.500 29.916 17.506 1.00 0.00 N ATOM 137 CA LEU A 18 42.259 29.911 18.719 1.00 0.00 C ATOM 138 C LEU A 18 43.325 28.870 18.696 1.00 0.00 C ATOM 139 O LEU A 18 43.105 27.707 18.358 1.00 0.00 O ATOM 140 CB LEU A 18 41.336 29.637 19.918 1.00 0.00 C ATOM 141 CG LEU A 18 42.012 29.639 21.299 1.00 0.00 C ATOM 142 CD1 LEU A 18 42.515 31.035 21.703 1.00 0.00 C ATOM 143 CD2 LEU A 18 41.017 29.101 22.341 1.00 0.00 C ATOM 0 H LEU A 18 40.753 29.222 17.501 1.00 0.00 H new ATOM 0 HA LEU A 18 42.725 30.892 18.813 1.00 0.00 H new ATOM 0 HB2 LEU A 18 40.544 30.386 19.921 1.00 0.00 H new ATOM 0 HB3 LEU A 18 40.858 28.669 19.770 1.00 0.00 H new ATOM 0 HG LEU A 18 42.890 28.995 21.250 1.00 0.00 H new ATOM 0 HD11 LEU A 18 42.984 30.982 22.685 1.00 0.00 H new ATOM 0 HD12 LEU A 18 43.243 31.385 20.971 1.00 0.00 H new ATOM 0 HD13 LEU A 18 41.675 31.728 21.739 1.00 0.00 H new ATOM 0 HD21 LEU A 18 41.486 29.098 23.325 1.00 0.00 H new ATOM 0 HD22 LEU A 18 40.133 29.738 22.363 1.00 0.00 H new ATOM 0 HD23 LEU A 18 40.726 28.085 22.075 1.00 0.00 H new ATOM 155 N ALA A 19 44.557 29.229 19.099 1.00 0.00 N ATOM 156 CA ALA A 19 45.637 28.309 19.272 1.00 0.00 C ATOM 157 C ALA A 19 45.830 28.010 20.720 1.00 0.00 C ATOM 158 O ALA A 19 45.755 28.896 21.570 1.00 0.00 O ATOM 159 CB ALA A 19 46.929 28.871 18.654 1.00 0.00 C ATOM 0 H ALA A 19 44.810 30.194 19.312 1.00 0.00 H new ATOM 0 HA ALA A 19 45.392 27.380 18.757 1.00 0.00 H new ATOM 0 HB1 ALA A 19 47.740 28.157 18.795 1.00 0.00 H new ATOM 0 HB2 ALA A 19 46.778 29.042 17.588 1.00 0.00 H new ATOM 0 HB3 ALA A 19 47.185 29.812 19.140 1.00 0.00 H new ATOM 165 N LYS A 20 46.085 26.730 21.046 1.00 0.00 N ATOM 166 CA LYS A 20 46.342 26.263 22.373 1.00 0.00 C ATOM 167 C LYS A 20 47.635 26.742 22.937 1.00 0.00 C ATOM 168 O LYS A 20 48.569 27.084 22.214 1.00 0.00 O ATOM 169 CB LYS A 20 46.360 24.725 22.398 1.00 0.00 C ATOM 170 CG LYS A 20 45.018 24.082 22.044 1.00 0.00 C ATOM 171 CD LYS A 20 45.106 22.556 21.964 1.00 0.00 C ATOM 172 CE LYS A 20 43.763 21.875 21.697 1.00 0.00 C ATOM 173 NZ LYS A 20 43.937 20.416 21.522 1.00 0.00 N ATOM 0 H LYS A 20 46.113 25.985 20.350 1.00 0.00 H new ATOM 0 HA LYS A 20 45.537 26.668 22.986 1.00 0.00 H new ATOM 0 HB2 LYS A 20 47.117 24.369 21.699 1.00 0.00 H new ATOM 0 HB3 LYS A 20 46.661 24.391 23.391 1.00 0.00 H new ATOM 0 HG2 LYS A 20 44.276 24.362 22.791 1.00 0.00 H new ATOM 0 HG3 LYS A 20 44.671 24.474 21.088 1.00 0.00 H new ATOM 0 HD2 LYS A 20 45.805 22.282 21.174 1.00 0.00 H new ATOM 0 HD3 LYS A 20 45.517 22.175 22.899 1.00 0.00 H new ATOM 0 HE2 LYS A 20 43.082 22.067 22.526 1.00 0.00 H new ATOM 0 HE3 LYS A 20 43.306 22.301 20.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 43.031 19.989 21.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 44.647 20.237 20.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 44.256 19.995 22.418 1.00 0.00 H new ATOM 187 N THR A 21 47.753 26.780 24.277 1.00 0.00 N ATOM 188 CA THR A 21 48.971 27.073 24.966 1.00 0.00 C ATOM 189 C THR A 21 49.174 25.995 25.975 1.00 0.00 C ATOM 190 O THR A 21 48.218 25.569 26.619 1.00 0.00 O ATOM 191 CB THR A 21 49.032 28.441 25.579 1.00 0.00 C ATOM 192 OG1 THR A 21 50.330 28.760 26.059 1.00 0.00 O ATOM 193 CG2 THR A 21 48.057 28.631 26.753 1.00 0.00 C ATOM 0 H THR A 21 46.969 26.600 24.904 1.00 0.00 H new ATOM 0 HA THR A 21 49.783 27.093 24.240 1.00 0.00 H new ATOM 0 HB THR A 21 48.750 29.105 24.762 1.00 0.00 H new ATOM 0 HG1 THR A 21 50.323 29.660 26.448 1.00 0.00 H new ATOM 0 HG21 THR A 21 48.155 29.642 27.147 1.00 0.00 H new ATOM 0 HG22 THR A 21 47.035 28.474 26.407 1.00 0.00 H new ATOM 0 HG23 THR A 21 48.288 27.911 27.538 1.00 0.00 H new ATOM 201 N ASP A 22 50.409 25.474 26.089 1.00 0.00 N ATOM 202 CA ASP A 22 50.830 24.358 26.879 1.00 0.00 C ATOM 203 C ASP A 22 49.845 23.253 27.050 1.00 0.00 C ATOM 204 O ASP A 22 49.528 22.833 28.161 1.00 0.00 O ATOM 205 CB ASP A 22 51.423 24.872 28.201 1.00 0.00 C ATOM 206 CG ASP A 22 52.387 23.909 28.880 1.00 0.00 C ATOM 207 OD1 ASP A 22 53.298 23.370 28.196 1.00 0.00 O ATOM 208 OD2 ASP A 22 52.290 23.710 30.121 1.00 0.00 O ATOM 0 H ASP A 22 51.191 25.878 25.574 1.00 0.00 H new ATOM 0 HA ASP A 22 51.605 23.851 26.304 1.00 0.00 H new ATOM 0 HB2 ASP A 22 51.942 25.811 28.010 1.00 0.00 H new ATOM 0 HB3 ASP A 22 50.607 25.093 28.889 1.00 0.00 H new ATOM 213 N GLY A 23 49.289 22.741 25.937 1.00 0.00 N ATOM 214 CA GLY A 23 48.384 21.634 25.929 1.00 0.00 C ATOM 215 C GLY A 23 46.952 21.908 26.240 1.00 0.00 C ATOM 216 O GLY A 23 46.142 20.986 26.159 1.00 0.00 O ATOM 0 H GLY A 23 49.478 23.113 25.006 1.00 0.00 H new ATOM 0 HA2 GLY A 23 48.430 21.170 24.944 1.00 0.00 H new ATOM 0 HA3 GLY A 23 48.748 20.898 26.646 1.00 0.00 H new ATOM 220 N SER A 24 46.581 23.143 26.621 1.00 0.00 N ATOM 221 CA SER A 24 45.284 23.448 27.141 1.00 0.00 C ATOM 222 C SER A 24 44.545 24.477 26.359 1.00 0.00 C ATOM 223 O SER A 24 45.113 25.386 25.755 1.00 0.00 O ATOM 224 CB SER A 24 45.348 23.952 28.593 1.00 0.00 C ATOM 225 OG SER A 24 45.777 22.916 29.464 1.00 0.00 O ATOM 0 H SER A 24 47.200 23.952 26.566 1.00 0.00 H new ATOM 0 HA SER A 24 44.752 22.499 27.076 1.00 0.00 H new ATOM 0 HB2 SER A 24 46.033 24.797 28.660 1.00 0.00 H new ATOM 0 HB3 SER A 24 44.367 24.311 28.902 1.00 0.00 H new ATOM 0 HG SER A 24 45.813 23.255 30.383 1.00 0.00 H new ATOM 231 N LEU A 25 43.204 24.377 26.379 1.00 0.00 N ATOM 232 CA LEU A 25 42.295 25.371 25.897 1.00 0.00 C ATOM 233 C LEU A 25 41.741 26.140 27.045 1.00 0.00 C ATOM 234 O LEU A 25 41.949 27.347 27.167 1.00 0.00 O ATOM 235 CB LEU A 25 41.110 24.742 25.147 1.00 0.00 C ATOM 236 CG LEU A 25 41.445 24.262 23.724 1.00 0.00 C ATOM 237 CD1 LEU A 25 40.308 23.390 23.164 1.00 0.00 C ATOM 238 CD2 LEU A 25 41.702 25.443 22.773 1.00 0.00 C ATOM 0 H LEU A 25 42.727 23.556 26.753 1.00 0.00 H new ATOM 0 HA LEU A 25 42.852 26.015 25.217 1.00 0.00 H new ATOM 0 HB2 LEU A 25 40.737 23.896 25.725 1.00 0.00 H new ATOM 0 HB3 LEU A 25 40.302 25.471 25.091 1.00 0.00 H new ATOM 0 HG LEU A 25 42.357 23.669 23.790 1.00 0.00 H new ATOM 0 HD11 LEU A 25 40.564 23.061 22.157 1.00 0.00 H new ATOM 0 HD12 LEU A 25 40.167 22.520 23.805 1.00 0.00 H new ATOM 0 HD13 LEU A 25 39.386 23.971 23.132 1.00 0.00 H new ATOM 0 HD21 LEU A 25 41.935 25.065 21.778 1.00 0.00 H new ATOM 0 HD22 LEU A 25 40.812 26.070 22.723 1.00 0.00 H new ATOM 0 HD23 LEU A 25 42.541 26.032 23.143 1.00 0.00 H new ATOM 250 N GLY A 26 41.047 25.474 27.986 1.00 0.00 N ATOM 251 CA GLY A 26 40.527 26.032 29.196 1.00 0.00 C ATOM 252 C GLY A 26 39.057 26.273 29.187 1.00 0.00 C ATOM 253 O GLY A 26 38.598 27.290 29.704 1.00 0.00 O ATOM 0 H GLY A 26 40.836 24.480 27.894 1.00 0.00 H new ATOM 0 HA2 GLY A 26 40.767 25.362 30.022 1.00 0.00 H new ATOM 0 HA3 GLY A 26 41.035 26.976 29.393 1.00 0.00 H new ATOM 257 N ILE A 27 38.258 25.337 28.643 1.00 0.00 N ATOM 258 CA ILE A 27 36.830 25.421 28.614 1.00 0.00 C ATOM 259 C ILE A 27 36.193 24.386 29.474 1.00 0.00 C ATOM 260 O ILE A 27 36.756 23.327 29.751 1.00 0.00 O ATOM 261 CB ILE A 27 36.298 25.223 27.224 1.00 0.00 C ATOM 262 CG1 ILE A 27 36.858 23.965 26.539 1.00 0.00 C ATOM 263 CG2 ILE A 27 36.596 26.484 26.396 1.00 0.00 C ATOM 264 CD1 ILE A 27 35.867 23.351 25.552 1.00 0.00 C ATOM 0 H ILE A 27 38.620 24.489 28.207 1.00 0.00 H new ATOM 0 HA ILE A 27 36.587 26.418 28.983 1.00 0.00 H new ATOM 0 HB ILE A 27 35.222 25.065 27.293 1.00 0.00 H new ATOM 0 HG12 ILE A 27 37.779 24.219 26.014 1.00 0.00 H new ATOM 0 HG13 ILE A 27 37.117 23.226 27.297 1.00 0.00 H new ATOM 0 HG21 ILE A 27 36.214 26.353 25.383 1.00 0.00 H new ATOM 0 HG22 ILE A 27 36.112 27.345 26.857 1.00 0.00 H new ATOM 0 HG23 ILE A 27 37.673 26.649 26.359 1.00 0.00 H new ATOM 0 HD11 ILE A 27 36.310 22.466 25.095 1.00 0.00 H new ATOM 0 HD12 ILE A 27 34.955 23.070 26.079 1.00 0.00 H new ATOM 0 HD13 ILE A 27 35.628 24.079 24.776 1.00 0.00 H new ATOM 276 N SER A 28 34.949 24.626 29.923 1.00 0.00 N ATOM 277 CA SER A 28 34.017 23.571 30.174 1.00 0.00 C ATOM 278 C SER A 28 32.715 23.902 29.530 1.00 0.00 C ATOM 279 O SER A 28 32.222 25.023 29.653 1.00 0.00 O ATOM 280 CB SER A 28 33.869 23.245 31.670 1.00 0.00 C ATOM 281 OG SER A 28 33.071 22.092 31.894 1.00 0.00 O ATOM 0 H SER A 28 34.586 25.560 30.114 1.00 0.00 H new ATOM 0 HA SER A 28 34.406 22.656 29.728 1.00 0.00 H new ATOM 0 HB2 SER A 28 34.856 23.091 32.105 1.00 0.00 H new ATOM 0 HB3 SER A 28 33.424 24.097 32.183 1.00 0.00 H new ATOM 0 HG SER A 28 33.006 21.922 32.857 1.00 0.00 H new ATOM 287 N VAL A 29 32.114 22.950 28.796 1.00 0.00 N ATOM 288 CA VAL A 29 30.918 23.123 28.031 1.00 0.00 C ATOM 289 C VAL A 29 29.810 22.292 28.582 1.00 0.00 C ATOM 290 O VAL A 29 30.036 21.343 29.330 1.00 0.00 O ATOM 291 CB VAL A 29 31.101 22.824 26.573 1.00 0.00 C ATOM 292 CG1 VAL A 29 31.968 23.925 25.939 1.00 0.00 C ATOM 293 CG2 VAL A 29 31.730 21.439 26.347 1.00 0.00 C ATOM 0 H VAL A 29 32.485 22.002 28.733 1.00 0.00 H new ATOM 0 HA VAL A 29 30.660 24.179 28.112 1.00 0.00 H new ATOM 0 HB VAL A 29 30.121 22.807 26.097 1.00 0.00 H new ATOM 0 HG11 VAL A 29 32.106 23.714 24.878 1.00 0.00 H new ATOM 0 HG12 VAL A 29 31.474 24.890 26.056 1.00 0.00 H new ATOM 0 HG13 VAL A 29 32.940 23.952 26.432 1.00 0.00 H new ATOM 0 HG21 VAL A 29 31.845 21.262 25.278 1.00 0.00 H new ATOM 0 HG22 VAL A 29 32.707 21.400 26.829 1.00 0.00 H new ATOM 0 HG23 VAL A 29 31.084 20.672 26.774 1.00 0.00 H new ATOM 303 N THR A 30 28.546 22.623 28.260 1.00 0.00 N ATOM 304 CA THR A 30 27.386 21.945 28.748 1.00 0.00 C ATOM 305 C THR A 30 26.290 21.987 27.740 1.00 0.00 C ATOM 306 O THR A 30 26.465 22.527 26.647 1.00 0.00 O ATOM 307 CB THR A 30 26.939 22.510 30.064 1.00 0.00 C ATOM 308 OG1 THR A 30 26.172 21.582 30.817 1.00 0.00 O ATOM 309 CG2 THR A 30 26.159 23.831 29.961 1.00 0.00 C ATOM 0 H THR A 30 28.324 23.396 27.633 1.00 0.00 H new ATOM 0 HA THR A 30 27.650 20.901 28.915 1.00 0.00 H new ATOM 0 HB THR A 30 27.875 22.723 30.581 1.00 0.00 H new ATOM 0 HG1 THR A 30 25.904 21.992 31.666 1.00 0.00 H new ATOM 0 HG21 THR A 30 25.876 24.165 30.959 1.00 0.00 H new ATOM 0 HG22 THR A 30 26.786 24.588 29.489 1.00 0.00 H new ATOM 0 HG23 THR A 30 25.261 23.678 29.362 1.00 0.00 H new ATOM 317 N GLY A 31 25.112 21.413 28.043 1.00 0.00 N ATOM 318 CA GLY A 31 23.909 21.607 27.295 1.00 0.00 C ATOM 319 C GLY A 31 23.468 20.416 26.516 1.00 0.00 C ATOM 320 O GLY A 31 23.230 19.341 27.063 1.00 0.00 O ATOM 0 H GLY A 31 24.993 20.789 28.841 1.00 0.00 H new ATOM 0 HA2 GLY A 31 23.111 21.893 27.981 1.00 0.00 H new ATOM 0 HA3 GLY A 31 24.053 22.441 26.609 1.00 0.00 H new ATOM 324 N GLY A 32 23.295 20.592 25.193 1.00 0.00 N ATOM 325 CA GLY A 32 22.909 19.559 24.283 1.00 0.00 C ATOM 326 C GLY A 32 21.473 19.626 23.894 1.00 0.00 C ATOM 327 O GLY A 32 20.673 20.389 24.435 1.00 0.00 O ATOM 0 H GLY A 32 23.430 21.495 24.738 1.00 0.00 H new ATOM 0 HA2 GLY A 32 23.525 19.625 23.386 1.00 0.00 H new ATOM 0 HA3 GLY A 32 23.111 18.589 24.738 1.00 0.00 H new ATOM 331 N VAL A 33 21.093 18.798 22.905 1.00 0.00 N ATOM 332 CA VAL A 33 19.802 18.810 22.291 1.00 0.00 C ATOM 333 C VAL A 33 18.735 18.160 23.103 1.00 0.00 C ATOM 334 O VAL A 33 17.564 18.524 23.022 1.00 0.00 O ATOM 335 CB VAL A 33 19.898 18.254 20.901 1.00 0.00 C ATOM 336 CG1 VAL A 33 20.215 16.749 20.885 1.00 0.00 C ATOM 337 CG2 VAL A 33 18.631 18.572 20.089 1.00 0.00 C ATOM 0 H VAL A 33 21.714 18.088 22.516 1.00 0.00 H new ATOM 0 HA VAL A 33 19.482 19.850 22.230 1.00 0.00 H new ATOM 0 HB VAL A 33 20.741 18.750 20.421 1.00 0.00 H new ATOM 0 HG11 VAL A 33 20.273 16.400 19.854 1.00 0.00 H new ATOM 0 HG12 VAL A 33 21.169 16.573 21.382 1.00 0.00 H new ATOM 0 HG13 VAL A 33 19.428 16.206 21.408 1.00 0.00 H new ATOM 0 HG21 VAL A 33 18.728 18.157 19.086 1.00 0.00 H new ATOM 0 HG22 VAL A 33 17.764 18.132 20.581 1.00 0.00 H new ATOM 0 HG23 VAL A 33 18.502 19.652 20.024 1.00 0.00 H new ATOM 347 N ASN A 34 19.085 17.176 23.952 1.00 0.00 N ATOM 348 CA ASN A 34 18.138 16.368 24.654 1.00 0.00 C ATOM 349 C ASN A 34 17.473 17.058 25.795 1.00 0.00 C ATOM 350 O ASN A 34 16.258 16.958 25.954 1.00 0.00 O ATOM 351 CB ASN A 34 18.761 15.066 25.188 1.00 0.00 C ATOM 352 CG ASN A 34 19.447 14.246 24.105 1.00 0.00 C ATOM 353 OD1 ASN A 34 20.649 13.995 24.179 1.00 0.00 O ATOM 354 ND2 ASN A 34 18.682 13.772 23.085 1.00 0.00 N ATOM 0 H ASN A 34 20.055 16.936 24.155 1.00 0.00 H new ATOM 0 HA ASN A 34 17.384 16.146 23.899 1.00 0.00 H new ATOM 0 HB2 ASN A 34 19.485 15.309 25.966 1.00 0.00 H new ATOM 0 HB3 ASN A 34 17.983 14.462 25.655 1.00 0.00 H new ATOM 0 HD21 ASN A 34 19.103 13.194 22.358 1.00 0.00 H new ATOM 0 HD22 ASN A 34 17.687 13.995 23.047 1.00 0.00 H new ATOM 361 N THR A 35 18.223 17.765 26.659 1.00 0.00 N ATOM 362 CA THR A 35 17.699 18.327 27.866 1.00 0.00 C ATOM 363 C THR A 35 17.120 19.689 27.685 1.00 0.00 C ATOM 364 O THR A 35 17.166 20.280 26.608 1.00 0.00 O ATOM 365 CB THR A 35 18.690 18.280 28.991 1.00 0.00 C ATOM 366 OG1 THR A 35 18.069 18.408 30.261 1.00 0.00 O ATOM 367 CG2 THR A 35 19.776 19.364 28.874 1.00 0.00 C ATOM 0 H THR A 35 19.216 17.951 26.516 1.00 0.00 H new ATOM 0 HA THR A 35 16.863 17.686 28.147 1.00 0.00 H new ATOM 0 HB THR A 35 19.156 17.298 28.909 1.00 0.00 H new ATOM 0 HG1 THR A 35 18.751 18.370 30.964 1.00 0.00 H new ATOM 0 HG21 THR A 35 20.465 19.281 29.715 1.00 0.00 H new ATOM 0 HG22 THR A 35 20.324 19.230 27.942 1.00 0.00 H new ATOM 0 HG23 THR A 35 19.309 20.349 28.883 1.00 0.00 H new ATOM 375 N SER A 36 16.524 20.264 28.745 1.00 0.00 N ATOM 376 CA SER A 36 15.768 21.478 28.737 1.00 0.00 C ATOM 377 C SER A 36 16.571 22.730 28.828 1.00 0.00 C ATOM 378 O SER A 36 16.235 23.670 29.547 1.00 0.00 O ATOM 379 CB SER A 36 14.692 21.481 29.836 1.00 0.00 C ATOM 380 OG SER A 36 15.228 21.332 31.143 1.00 0.00 O ATOM 0 H SER A 36 16.575 19.849 29.675 1.00 0.00 H new ATOM 0 HA SER A 36 15.304 21.486 27.751 1.00 0.00 H new ATOM 0 HB2 SER A 36 14.131 22.414 29.784 1.00 0.00 H new ATOM 0 HB3 SER A 36 13.985 20.673 29.646 1.00 0.00 H new ATOM 0 HG SER A 36 14.500 21.343 31.798 1.00 0.00 H new ATOM 386 N VAL A 37 17.656 22.845 28.044 1.00 0.00 N ATOM 387 CA VAL A 37 18.390 24.063 27.887 1.00 0.00 C ATOM 388 C VAL A 37 17.739 24.922 26.857 1.00 0.00 C ATOM 389 O VAL A 37 16.685 24.596 26.315 1.00 0.00 O ATOM 390 CB VAL A 37 19.845 23.856 27.589 1.00 0.00 C ATOM 391 CG1 VAL A 37 20.516 23.272 28.844 1.00 0.00 C ATOM 392 CG2 VAL A 37 20.045 22.955 26.358 1.00 0.00 C ATOM 0 H VAL A 37 18.035 22.068 27.503 1.00 0.00 H new ATOM 0 HA VAL A 37 18.365 24.573 28.850 1.00 0.00 H new ATOM 0 HB VAL A 37 20.311 24.810 27.342 1.00 0.00 H new ATOM 0 HG11 VAL A 37 21.577 23.113 28.649 1.00 0.00 H new ATOM 0 HG12 VAL A 37 20.400 23.967 29.676 1.00 0.00 H new ATOM 0 HG13 VAL A 37 20.048 22.321 29.098 1.00 0.00 H new ATOM 0 HG21 VAL A 37 21.111 22.826 26.171 1.00 0.00 H new ATOM 0 HG22 VAL A 37 19.589 21.982 26.541 1.00 0.00 H new ATOM 0 HG23 VAL A 37 19.577 23.417 25.489 1.00 0.00 H new ATOM 402 N ARG A 38 18.327 26.087 26.533 1.00 0.00 N ATOM 403 CA ARG A 38 17.780 27.005 25.583 1.00 0.00 C ATOM 404 C ARG A 38 17.895 26.485 24.191 1.00 0.00 C ATOM 405 O ARG A 38 18.968 26.509 23.589 1.00 0.00 O ATOM 406 CB ARG A 38 18.460 28.381 25.676 1.00 0.00 C ATOM 407 CG ARG A 38 17.971 29.317 26.783 1.00 0.00 C ATOM 408 CD ARG A 38 18.061 28.803 28.221 1.00 0.00 C ATOM 409 NE ARG A 38 17.912 29.988 29.111 1.00 0.00 N ATOM 410 CZ ARG A 38 17.365 29.979 30.362 1.00 0.00 C ATOM 411 NH1 ARG A 38 16.699 28.906 30.883 1.00 0.00 N ATOM 412 NH2 ARG A 38 17.518 31.092 31.136 1.00 0.00 N ATOM 0 H ARG A 38 19.207 26.399 26.943 1.00 0.00 H new ATOM 0 HA ARG A 38 16.724 27.117 25.828 1.00 0.00 H new ATOM 0 HB2 ARG A 38 19.530 28.223 25.812 1.00 0.00 H new ATOM 0 HB3 ARG A 38 18.332 28.889 24.720 1.00 0.00 H new ATOM 0 HG2 ARG A 38 18.541 30.244 26.719 1.00 0.00 H new ATOM 0 HG3 ARG A 38 16.930 29.568 26.578 1.00 0.00 H new ATOM 0 HD2 ARG A 38 17.279 28.070 28.419 1.00 0.00 H new ATOM 0 HD3 ARG A 38 19.015 28.306 28.395 1.00 0.00 H new ATOM 0 HE ARG A 38 18.247 30.883 28.755 1.00 0.00 H new ATOM 0 HH11 ARG A 38 16.591 28.056 30.330 1.00 0.00 H new ATOM 0 HH12 ARG A 38 16.310 28.955 31.825 1.00 0.00 H new ATOM 0 HH21 ARG A 38 18.029 31.898 30.775 1.00 0.00 H new ATOM 0 HH22 ARG A 38 17.122 31.118 32.075 1.00 0.00 H new ATOM 426 N HIS A 39 16.773 25.975 23.652 1.00 0.00 N ATOM 427 CA HIS A 39 16.547 25.509 22.320 1.00 0.00 C ATOM 428 C HIS A 39 17.426 24.433 21.781 1.00 0.00 C ATOM 429 O HIS A 39 17.499 24.224 20.571 1.00 0.00 O ATOM 430 CB HIS A 39 16.411 26.678 21.331 1.00 0.00 C ATOM 431 CG HIS A 39 15.156 26.602 20.512 1.00 0.00 C ATOM 432 ND1 HIS A 39 14.896 25.613 19.584 1.00 0.00 N ATOM 433 CD2 HIS A 39 14.022 27.349 20.577 1.00 0.00 C ATOM 434 CE1 HIS A 39 13.634 25.826 19.125 1.00 0.00 C ATOM 435 NE2 HIS A 39 13.067 26.867 19.706 1.00 0.00 N ATOM 0 H HIS A 39 15.930 25.880 24.218 1.00 0.00 H new ATOM 0 HA HIS A 39 15.597 24.984 22.425 1.00 0.00 H new ATOM 0 HB2 HIS A 39 16.423 27.618 21.882 1.00 0.00 H new ATOM 0 HB3 HIS A 39 17.274 26.687 20.665 1.00 0.00 H new ATOM 0 HD2 HIS A 39 13.887 28.204 21.223 1.00 0.00 H new ATOM 0 HE1 HIS A 39 13.153 25.216 18.375 1.00 0.00 H new ATOM 0 HE2 HIS A 39 12.129 27.234 19.546 1.00 0.00 H new ATOM 443 N GLY A 40 18.118 23.677 22.652 1.00 0.00 N ATOM 444 CA GLY A 40 18.969 22.593 22.271 1.00 0.00 C ATOM 445 C GLY A 40 20.267 23.003 21.664 1.00 0.00 C ATOM 446 O GLY A 40 20.505 22.803 20.474 1.00 0.00 O ATOM 0 H GLY A 40 18.083 23.827 23.660 1.00 0.00 H new ATOM 0 HA2 GLY A 40 19.172 21.982 23.151 1.00 0.00 H new ATOM 0 HA3 GLY A 40 18.435 21.962 21.561 1.00 0.00 H new ATOM 450 N GLY A 41 21.168 23.591 22.471 1.00 0.00 N ATOM 451 CA GLY A 41 22.469 23.995 22.036 1.00 0.00 C ATOM 452 C GLY A 41 23.544 23.706 23.026 1.00 0.00 C ATOM 453 O GLY A 41 23.299 23.248 24.141 1.00 0.00 O ATOM 0 H GLY A 41 20.986 23.791 23.455 1.00 0.00 H new ATOM 0 HA2 GLY A 41 22.703 23.489 21.099 1.00 0.00 H new ATOM 0 HA3 GLY A 41 22.457 25.065 21.826 1.00 0.00 H new ATOM 457 N ILE A 42 24.798 23.982 22.626 1.00 0.00 N ATOM 458 CA ILE A 42 25.990 23.717 23.369 1.00 0.00 C ATOM 459 C ILE A 42 26.463 24.999 23.964 1.00 0.00 C ATOM 460 O ILE A 42 26.775 25.938 23.233 1.00 0.00 O ATOM 461 CB ILE A 42 27.041 23.118 22.481 1.00 0.00 C ATOM 462 CG1 ILE A 42 26.556 21.819 21.819 1.00 0.00 C ATOM 463 CG2 ILE A 42 28.364 22.888 23.229 1.00 0.00 C ATOM 464 CD1 ILE A 42 26.266 20.665 22.778 1.00 0.00 C ATOM 0 H ILE A 42 24.991 24.419 21.725 1.00 0.00 H new ATOM 0 HA ILE A 42 25.785 22.998 24.162 1.00 0.00 H new ATOM 0 HB ILE A 42 27.230 23.845 21.691 1.00 0.00 H new ATOM 0 HG12 ILE A 42 25.650 22.036 21.253 1.00 0.00 H new ATOM 0 HG13 ILE A 42 27.309 21.493 21.102 1.00 0.00 H new ATOM 0 HG21 ILE A 42 29.096 22.453 22.548 1.00 0.00 H new ATOM 0 HG22 ILE A 42 28.739 23.840 23.606 1.00 0.00 H new ATOM 0 HG23 ILE A 42 28.196 22.208 24.064 1.00 0.00 H new ATOM 0 HD11 ILE A 42 25.930 19.797 22.211 1.00 0.00 H new ATOM 0 HD12 ILE A 42 27.173 20.412 23.327 1.00 0.00 H new ATOM 0 HD13 ILE A 42 25.488 20.963 23.481 1.00 0.00 H new ATOM 476 N TYR A 43 26.510 25.114 25.303 1.00 0.00 N ATOM 477 CA TYR A 43 26.731 26.368 25.953 1.00 0.00 C ATOM 478 C TYR A 43 27.923 26.276 26.844 1.00 0.00 C ATOM 479 O TYR A 43 28.221 25.222 27.404 1.00 0.00 O ATOM 480 CB TYR A 43 25.510 26.800 26.782 1.00 0.00 C ATOM 481 CG TYR A 43 24.348 27.148 25.916 1.00 0.00 C ATOM 482 CD1 TYR A 43 24.238 28.414 25.391 1.00 0.00 C ATOM 483 CD2 TYR A 43 23.364 26.228 25.639 1.00 0.00 C ATOM 484 CE1 TYR A 43 23.169 28.754 24.596 1.00 0.00 C ATOM 485 CE2 TYR A 43 22.293 26.558 24.841 1.00 0.00 C ATOM 486 CZ TYR A 43 22.201 27.821 24.306 1.00 0.00 C ATOM 487 OH TYR A 43 21.131 28.170 23.454 1.00 0.00 O ATOM 0 H TYR A 43 26.393 24.328 25.942 1.00 0.00 H new ATOM 0 HA TYR A 43 26.900 27.116 25.178 1.00 0.00 H new ATOM 0 HB2 TYR A 43 25.229 25.995 27.461 1.00 0.00 H new ATOM 0 HB3 TYR A 43 25.775 27.659 27.398 1.00 0.00 H new ATOM 0 HD1 TYR A 43 24.999 29.149 25.605 1.00 0.00 H new ATOM 0 HD2 TYR A 43 23.433 25.233 26.053 1.00 0.00 H new ATOM 0 HE1 TYR A 43 23.089 29.755 24.199 1.00 0.00 H new ATOM 0 HE2 TYR A 43 21.526 25.826 24.635 1.00 0.00 H new ATOM 0 HH TYR A 43 20.401 27.525 23.564 1.00 0.00 H new ATOM 497 N VAL A 44 28.653 27.387 27.047 1.00 0.00 N ATOM 498 CA VAL A 44 29.784 27.448 27.921 1.00 0.00 C ATOM 499 C VAL A 44 29.408 27.543 29.359 1.00 0.00 C ATOM 500 O VAL A 44 28.699 28.457 29.781 1.00 0.00 O ATOM 501 CB VAL A 44 30.782 28.494 27.522 1.00 0.00 C ATOM 502 CG1 VAL A 44 32.013 28.497 28.443 1.00 0.00 C ATOM 503 CG2 VAL A 44 31.231 28.166 26.088 1.00 0.00 C ATOM 0 H VAL A 44 28.449 28.274 26.587 1.00 0.00 H new ATOM 0 HA VAL A 44 30.288 26.489 27.803 1.00 0.00 H new ATOM 0 HB VAL A 44 30.319 29.478 27.595 1.00 0.00 H new ATOM 0 HG11 VAL A 44 32.709 29.270 28.117 1.00 0.00 H new ATOM 0 HG12 VAL A 44 31.700 28.699 29.468 1.00 0.00 H new ATOM 0 HG13 VAL A 44 32.503 27.525 28.398 1.00 0.00 H new ATOM 0 HG21 VAL A 44 31.960 28.905 25.757 1.00 0.00 H new ATOM 0 HG22 VAL A 44 31.684 27.175 26.066 1.00 0.00 H new ATOM 0 HG23 VAL A 44 30.368 28.185 25.423 1.00 0.00 H new ATOM 513 N LYS A 45 29.872 26.595 30.193 1.00 0.00 N ATOM 514 CA LYS A 45 29.560 26.561 31.588 1.00 0.00 C ATOM 515 C LYS A 45 30.605 27.208 32.429 1.00 0.00 C ATOM 516 O LYS A 45 30.275 27.910 33.384 1.00 0.00 O ATOM 517 CB LYS A 45 29.166 25.157 32.076 1.00 0.00 C ATOM 518 CG LYS A 45 30.283 24.152 32.363 1.00 0.00 C ATOM 519 CD LYS A 45 30.458 23.855 33.854 1.00 0.00 C ATOM 520 CE LYS A 45 29.399 22.890 34.389 1.00 0.00 C ATOM 521 NZ LYS A 45 29.484 22.744 35.860 1.00 0.00 N ATOM 0 H LYS A 45 30.479 25.833 29.890 1.00 0.00 H new ATOM 0 HA LYS A 45 28.667 27.173 31.714 1.00 0.00 H new ATOM 0 HB2 LYS A 45 28.580 25.274 32.988 1.00 0.00 H new ATOM 0 HB3 LYS A 45 28.507 24.717 31.328 1.00 0.00 H new ATOM 0 HG2 LYS A 45 30.070 23.222 31.836 1.00 0.00 H new ATOM 0 HG3 LYS A 45 31.221 24.537 31.963 1.00 0.00 H new ATOM 0 HD2 LYS A 45 31.448 23.432 34.023 1.00 0.00 H new ATOM 0 HD3 LYS A 45 30.410 24.788 34.415 1.00 0.00 H new ATOM 0 HE2 LYS A 45 28.407 23.250 34.116 1.00 0.00 H new ATOM 0 HE3 LYS A 45 29.525 21.915 33.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 28.751 22.082 36.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 30.422 22.376 36.119 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 29.339 23.670 36.310 1.00 0.00 H new ATOM 535 N ALA A 46 31.904 27.038 32.125 1.00 0.00 N ATOM 536 CA ALA A 46 32.938 27.603 32.935 1.00 0.00 C ATOM 537 C ALA A 46 34.174 27.856 32.143 1.00 0.00 C ATOM 538 O ALA A 46 34.374 27.259 31.085 1.00 0.00 O ATOM 539 CB ALA A 46 33.268 26.691 34.130 1.00 0.00 C ATOM 0 H ALA A 46 32.238 26.510 31.319 1.00 0.00 H new ATOM 0 HA ALA A 46 32.564 28.556 33.310 1.00 0.00 H new ATOM 0 HB1 ALA A 46 34.057 27.146 34.728 1.00 0.00 H new ATOM 0 HB2 ALA A 46 32.377 26.560 34.744 1.00 0.00 H new ATOM 0 HB3 ALA A 46 33.603 25.720 33.765 1.00 0.00 H new ATOM 545 N ILE A 47 35.047 28.756 32.632 1.00 0.00 N ATOM 546 CA ILE A 47 36.307 29.058 32.028 1.00 0.00 C ATOM 547 C ILE A 47 37.423 28.824 32.986 1.00 0.00 C ATOM 548 O ILE A 47 37.468 29.342 34.100 1.00 0.00 O ATOM 549 CB ILE A 47 36.313 30.388 31.335 1.00 0.00 C ATOM 550 CG1 ILE A 47 36.881 30.252 29.912 1.00 0.00 C ATOM 551 CG2 ILE A 47 37.059 31.510 32.076 1.00 0.00 C ATOM 552 CD1 ILE A 47 35.991 29.483 28.937 1.00 0.00 C ATOM 0 H ILE A 47 34.868 29.293 33.480 1.00 0.00 H new ATOM 0 HA ILE A 47 36.480 28.357 31.212 1.00 0.00 H new ATOM 0 HB ILE A 47 35.266 30.690 31.312 1.00 0.00 H new ATOM 0 HG12 ILE A 47 37.059 31.250 29.510 1.00 0.00 H new ATOM 0 HG13 ILE A 47 37.849 29.754 29.968 1.00 0.00 H new ATOM 0 HG21 ILE A 47 37.005 32.429 31.493 1.00 0.00 H new ATOM 0 HG22 ILE A 47 36.599 31.671 33.051 1.00 0.00 H new ATOM 0 HG23 ILE A 47 38.103 31.226 32.210 1.00 0.00 H new ATOM 0 HD11 ILE A 47 36.474 29.439 27.961 1.00 0.00 H new ATOM 0 HD12 ILE A 47 35.833 28.471 29.310 1.00 0.00 H new ATOM 0 HD13 ILE A 47 35.030 29.990 28.844 1.00 0.00 H new ATOM 564 N ILE A 48 38.350 27.926 32.604 1.00 0.00 N ATOM 565 CA ILE A 48 39.410 27.420 33.419 1.00 0.00 C ATOM 566 C ILE A 48 40.537 28.382 33.580 1.00 0.00 C ATOM 567 O ILE A 48 41.123 28.732 32.557 1.00 0.00 O ATOM 568 CB ILE A 48 39.959 26.126 32.899 1.00 0.00 C ATOM 569 CG1 ILE A 48 38.832 25.163 32.489 1.00 0.00 C ATOM 570 CG2 ILE A 48 40.895 25.466 33.926 1.00 0.00 C ATOM 571 CD1 ILE A 48 37.918 24.678 33.614 1.00 0.00 C ATOM 0 H ILE A 48 38.358 27.529 31.665 1.00 0.00 H new ATOM 0 HA ILE A 48 38.951 27.256 34.394 1.00 0.00 H new ATOM 0 HB ILE A 48 40.544 26.354 32.008 1.00 0.00 H new ATOM 0 HG12 ILE A 48 38.217 25.656 31.736 1.00 0.00 H new ATOM 0 HG13 ILE A 48 39.282 24.292 32.013 1.00 0.00 H new ATOM 0 HG21 ILE A 48 41.278 24.529 33.520 1.00 0.00 H new ATOM 0 HG22 ILE A 48 41.728 26.135 34.142 1.00 0.00 H new ATOM 0 HG23 ILE A 48 40.344 25.265 34.845 1.00 0.00 H new ATOM 0 HD11 ILE A 48 37.163 24.006 33.205 1.00 0.00 H new ATOM 0 HD12 ILE A 48 38.510 24.148 34.361 1.00 0.00 H new ATOM 0 HD13 ILE A 48 37.428 25.533 34.079 1.00 0.00 H new ATOM 583 N PRO A 49 40.954 28.827 34.728 1.00 0.00 N ATOM 584 CA PRO A 49 42.053 29.742 34.844 1.00 0.00 C ATOM 585 C PRO A 49 43.342 29.153 34.385 1.00 0.00 C ATOM 586 O PRO A 49 43.660 28.011 34.709 1.00 0.00 O ATOM 587 CB PRO A 49 42.084 30.138 36.318 1.00 0.00 C ATOM 588 CG PRO A 49 41.442 28.945 37.045 1.00 0.00 C ATOM 589 CD PRO A 49 40.396 28.472 36.023 1.00 0.00 C ATOM 0 HA PRO A 49 41.919 30.609 34.198 1.00 0.00 H new ATOM 0 HB2 PRO A 49 43.104 30.312 36.662 1.00 0.00 H new ATOM 0 HB3 PRO A 49 41.527 31.058 36.495 1.00 0.00 H new ATOM 0 HG2 PRO A 49 42.170 28.167 37.273 1.00 0.00 H new ATOM 0 HG3 PRO A 49 40.985 29.241 37.989 1.00 0.00 H new ATOM 0 HD2 PRO A 49 40.226 27.398 36.099 1.00 0.00 H new ATOM 0 HD3 PRO A 49 39.435 28.959 36.186 1.00 0.00 H new ATOM 597 N LYS A 50 44.080 29.945 33.587 1.00 0.00 N ATOM 598 CA LYS A 50 45.280 29.640 32.872 1.00 0.00 C ATOM 599 C LYS A 50 45.046 28.951 31.571 1.00 0.00 C ATOM 600 O LYS A 50 45.961 28.369 30.990 1.00 0.00 O ATOM 601 CB LYS A 50 46.406 29.012 33.710 1.00 0.00 C ATOM 602 CG LYS A 50 46.745 29.857 34.940 1.00 0.00 C ATOM 603 CD LYS A 50 48.014 29.414 35.672 1.00 0.00 C ATOM 604 CE LYS A 50 48.215 30.086 37.031 1.00 0.00 C ATOM 605 NZ LYS A 50 48.273 31.559 36.898 1.00 0.00 N ATOM 0 H LYS A 50 43.799 30.912 33.427 1.00 0.00 H new ATOM 0 HA LYS A 50 45.675 30.623 32.614 1.00 0.00 H new ATOM 0 HB2 LYS A 50 46.107 28.013 34.028 1.00 0.00 H new ATOM 0 HB3 LYS A 50 47.297 28.897 33.092 1.00 0.00 H new ATOM 0 HG2 LYS A 50 46.860 30.897 34.633 1.00 0.00 H new ATOM 0 HG3 LYS A 50 45.906 29.821 35.635 1.00 0.00 H new ATOM 0 HD2 LYS A 50 47.981 28.334 35.814 1.00 0.00 H new ATOM 0 HD3 LYS A 50 48.878 29.627 35.042 1.00 0.00 H new ATOM 0 HE2 LYS A 50 47.399 29.811 37.700 1.00 0.00 H new ATOM 0 HE3 LYS A 50 49.137 29.723 37.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 48.461 31.984 37.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 49.034 31.818 36.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 47.365 31.911 36.533 1.00 0.00 H new ATOM 619 N GLY A 51 43.836 29.045 30.993 1.00 0.00 N ATOM 620 CA GLY A 51 43.593 28.610 29.653 1.00 0.00 C ATOM 621 C GLY A 51 43.915 29.593 28.580 1.00 0.00 C ATOM 622 O GLY A 51 43.911 30.808 28.774 1.00 0.00 O ATOM 0 H GLY A 51 43.015 29.428 31.462 1.00 0.00 H new ATOM 0 HA2 GLY A 51 44.173 27.704 29.475 1.00 0.00 H new ATOM 0 HA3 GLY A 51 42.541 28.337 29.565 1.00 0.00 H new ATOM 626 N ALA A 52 44.202 29.097 27.364 1.00 0.00 N ATOM 627 CA ALA A 52 44.123 29.786 26.113 1.00 0.00 C ATOM 628 C ALA A 52 42.839 30.494 25.849 1.00 0.00 C ATOM 629 O ALA A 52 42.798 31.704 25.639 1.00 0.00 O ATOM 630 CB ALA A 52 44.414 28.811 24.960 1.00 0.00 C ATOM 0 H ALA A 52 44.515 28.133 27.247 1.00 0.00 H new ATOM 0 HA ALA A 52 44.878 30.569 26.177 1.00 0.00 H new ATOM 0 HB1 ALA A 52 44.352 29.342 24.010 1.00 0.00 H new ATOM 0 HB2 ALA A 52 45.415 28.395 25.079 1.00 0.00 H new ATOM 0 HB3 ALA A 52 43.682 28.004 24.973 1.00 0.00 H new ATOM 636 N ALA A 53 41.736 29.723 25.856 1.00 0.00 N ATOM 637 CA ALA A 53 40.376 30.096 25.619 1.00 0.00 C ATOM 638 C ALA A 53 39.884 31.058 26.645 1.00 0.00 C ATOM 639 O ALA A 53 39.307 32.096 26.322 1.00 0.00 O ATOM 640 CB ALA A 53 39.479 28.847 25.654 1.00 0.00 C ATOM 0 H ALA A 53 41.811 28.724 26.050 1.00 0.00 H new ATOM 0 HA ALA A 53 40.334 30.573 24.640 1.00 0.00 H new ATOM 0 HB1 ALA A 53 38.444 29.137 25.473 1.00 0.00 H new ATOM 0 HB2 ALA A 53 39.800 28.147 24.883 1.00 0.00 H new ATOM 0 HB3 ALA A 53 39.557 28.371 26.631 1.00 0.00 H new ATOM 646 N GLU A 54 40.168 30.735 27.919 1.00 0.00 N ATOM 647 CA GLU A 54 39.993 31.596 29.047 1.00 0.00 C ATOM 648 C GLU A 54 40.398 33.016 28.852 1.00 0.00 C ATOM 649 O GLU A 54 39.602 33.946 28.975 1.00 0.00 O ATOM 650 CB GLU A 54 40.749 31.002 30.247 1.00 0.00 C ATOM 651 CG GLU A 54 40.590 31.768 31.562 1.00 0.00 C ATOM 652 CD GLU A 54 41.788 32.600 31.994 1.00 0.00 C ATOM 653 OE1 GLU A 54 42.863 32.029 32.319 1.00 0.00 O ATOM 654 OE2 GLU A 54 41.672 33.853 32.051 1.00 0.00 O ATOM 0 H GLU A 54 40.541 29.821 28.176 1.00 0.00 H new ATOM 0 HA GLU A 54 38.917 31.639 29.216 1.00 0.00 H new ATOM 0 HB2 GLU A 54 40.409 29.977 30.399 1.00 0.00 H new ATOM 0 HB3 GLU A 54 41.809 30.953 30.000 1.00 0.00 H new ATOM 0 HG2 GLU A 54 39.727 32.427 31.474 1.00 0.00 H new ATOM 0 HG3 GLU A 54 40.365 31.052 32.352 1.00 0.00 H new ATOM 661 N SER A 55 41.688 33.212 28.524 1.00 0.00 N ATOM 662 CA SER A 55 42.278 34.497 28.314 1.00 0.00 C ATOM 663 C SER A 55 41.846 35.240 27.096 1.00 0.00 C ATOM 664 O SER A 55 41.770 36.467 27.112 1.00 0.00 O ATOM 665 CB SER A 55 43.810 34.373 28.278 1.00 0.00 C ATOM 666 OG SER A 55 44.469 35.607 28.519 1.00 0.00 O ATOM 0 H SER A 55 42.347 32.443 28.400 1.00 0.00 H new ATOM 0 HA SER A 55 41.920 35.084 29.160 1.00 0.00 H new ATOM 0 HB2 SER A 55 44.128 33.645 29.024 1.00 0.00 H new ATOM 0 HB3 SER A 55 44.116 33.987 27.305 1.00 0.00 H new ATOM 0 HG SER A 55 45.439 35.472 28.486 1.00 0.00 H new ATOM 672 N ASP A 56 41.560 34.563 25.970 1.00 0.00 N ATOM 673 CA ASP A 56 41.302 35.177 24.705 1.00 0.00 C ATOM 674 C ASP A 56 40.104 36.064 24.707 1.00 0.00 C ATOM 675 O ASP A 56 40.164 37.214 24.276 1.00 0.00 O ATOM 676 CB ASP A 56 41.233 34.115 23.595 1.00 0.00 C ATOM 677 CG ASP A 56 41.512 34.718 22.225 1.00 0.00 C ATOM 678 OD1 ASP A 56 42.675 35.132 21.977 1.00 0.00 O ATOM 679 OD2 ASP A 56 40.574 34.780 21.386 1.00 0.00 O ATOM 0 H ASP A 56 41.506 33.545 25.940 1.00 0.00 H new ATOM 0 HA ASP A 56 42.143 35.838 24.498 1.00 0.00 H new ATOM 0 HB2 ASP A 56 41.956 33.326 23.800 1.00 0.00 H new ATOM 0 HB3 ASP A 56 40.247 33.651 23.595 1.00 0.00 H new ATOM 684 N GLY A 57 38.970 35.606 25.266 1.00 0.00 N ATOM 685 CA GLY A 57 37.973 36.498 25.771 1.00 0.00 C ATOM 686 C GLY A 57 36.717 36.594 24.976 1.00 0.00 C ATOM 687 O GLY A 57 35.743 37.210 25.409 1.00 0.00 O ATOM 0 H GLY A 57 38.743 34.617 25.368 1.00 0.00 H new ATOM 0 HA2 GLY A 57 37.715 36.187 26.783 1.00 0.00 H new ATOM 0 HA3 GLY A 57 38.409 37.494 25.845 1.00 0.00 H new ATOM 691 N ARG A 58 36.662 35.958 23.792 1.00 0.00 N ATOM 692 CA ARG A 58 35.457 35.784 23.044 1.00 0.00 C ATOM 693 C ARG A 58 34.544 34.816 23.714 1.00 0.00 C ATOM 694 O ARG A 58 33.325 34.980 23.721 1.00 0.00 O ATOM 695 CB ARG A 58 35.769 35.341 21.604 1.00 0.00 C ATOM 696 CG ARG A 58 36.600 36.335 20.791 1.00 0.00 C ATOM 697 CD ARG A 58 35.854 37.513 20.162 1.00 0.00 C ATOM 698 NE ARG A 58 35.397 38.453 21.225 1.00 0.00 N ATOM 699 CZ ARG A 58 35.691 39.784 21.300 1.00 0.00 C ATOM 700 NH1 ARG A 58 36.591 40.411 20.488 1.00 0.00 N ATOM 701 NH2 ARG A 58 35.020 40.519 22.234 1.00 0.00 N ATOM 0 H ARG A 58 37.482 35.552 23.342 1.00 0.00 H new ATOM 0 HA ARG A 58 34.946 36.746 23.000 1.00 0.00 H new ATOM 0 HB2 ARG A 58 36.299 34.389 21.639 1.00 0.00 H new ATOM 0 HB3 ARG A 58 34.829 35.163 21.082 1.00 0.00 H new ATOM 0 HG2 ARG A 58 37.379 36.735 21.440 1.00 0.00 H new ATOM 0 HG3 ARG A 58 37.100 35.786 19.993 1.00 0.00 H new ATOM 0 HD2 ARG A 58 36.505 38.034 19.460 1.00 0.00 H new ATOM 0 HD3 ARG A 58 34.998 37.150 19.593 1.00 0.00 H new ATOM 0 HE ARG A 58 34.811 38.066 21.964 1.00 0.00 H new ATOM 0 HH11 ARG A 58 37.089 39.880 19.773 1.00 0.00 H new ATOM 0 HH12 ARG A 58 36.765 41.410 20.596 1.00 0.00 H new ATOM 0 HH21 ARG A 58 34.332 40.070 22.839 1.00 0.00 H new ATOM 0 HH22 ARG A 58 35.206 41.518 22.327 1.00 0.00 H new ATOM 715 N ILE A 59 35.141 33.790 24.345 1.00 0.00 N ATOM 716 CA ILE A 59 34.492 32.773 25.114 1.00 0.00 C ATOM 717 C ILE A 59 34.348 33.252 26.518 1.00 0.00 C ATOM 718 O ILE A 59 35.302 33.722 27.136 1.00 0.00 O ATOM 719 CB ILE A 59 35.286 31.502 25.044 1.00 0.00 C ATOM 720 CG1 ILE A 59 35.518 31.118 23.574 1.00 0.00 C ATOM 721 CG2 ILE A 59 34.542 30.394 25.809 1.00 0.00 C ATOM 722 CD1 ILE A 59 36.342 29.849 23.363 1.00 0.00 C ATOM 0 H ILE A 59 36.153 33.662 24.315 1.00 0.00 H new ATOM 0 HA ILE A 59 33.500 32.566 24.713 1.00 0.00 H new ATOM 0 HB ILE A 59 36.261 31.641 25.511 1.00 0.00 H new ATOM 0 HG12 ILE A 59 34.550 30.990 23.090 1.00 0.00 H new ATOM 0 HG13 ILE A 59 36.018 31.946 23.072 1.00 0.00 H new ATOM 0 HG21 ILE A 59 35.117 29.469 25.760 1.00 0.00 H new ATOM 0 HG22 ILE A 59 34.420 30.690 26.851 1.00 0.00 H new ATOM 0 HG23 ILE A 59 33.562 30.236 25.359 1.00 0.00 H new ATOM 0 HD11 ILE A 59 36.452 29.660 22.295 1.00 0.00 H new ATOM 0 HD12 ILE A 59 37.327 29.976 23.812 1.00 0.00 H new ATOM 0 HD13 ILE A 59 35.836 29.005 23.831 1.00 0.00 H new ATOM 734 N HIS A 60 33.132 33.179 27.088 1.00 0.00 N ATOM 735 CA HIS A 60 32.839 33.663 28.401 1.00 0.00 C ATOM 736 C HIS A 60 31.537 33.075 28.823 1.00 0.00 C ATOM 737 O HIS A 60 30.524 33.246 28.147 1.00 0.00 O ATOM 738 CB HIS A 60 32.758 35.198 28.463 1.00 0.00 C ATOM 739 CG HIS A 60 32.909 35.787 29.835 1.00 0.00 C ATOM 740 ND1 HIS A 60 31.938 35.800 30.815 1.00 0.00 N ATOM 741 CD2 HIS A 60 33.966 36.462 30.359 1.00 0.00 C ATOM 742 CE1 HIS A 60 32.453 36.469 31.880 1.00 0.00 C ATOM 743 NE2 HIS A 60 33.683 36.886 31.641 1.00 0.00 N ATOM 0 H HIS A 60 32.325 32.769 26.618 1.00 0.00 H new ATOM 0 HA HIS A 60 33.648 33.366 29.068 1.00 0.00 H new ATOM 0 HB2 HIS A 60 33.532 35.614 27.818 1.00 0.00 H new ATOM 0 HB3 HIS A 60 31.799 35.513 28.053 1.00 0.00 H new ATOM 0 HD2 HIS A 60 34.898 36.641 29.843 1.00 0.00 H new ATOM 0 HE1 HIS A 60 31.923 36.638 32.806 1.00 0.00 H new ATOM 0 HE2 HIS A 60 34.293 37.409 32.269 1.00 0.00 H new ATOM 751 N LYS A 61 31.521 32.365 29.965 1.00 0.00 N ATOM 752 CA LYS A 61 30.461 31.523 30.426 1.00 0.00 C ATOM 753 C LYS A 61 29.070 32.019 30.222 1.00 0.00 C ATOM 754 O LYS A 61 28.641 33.044 30.750 1.00 0.00 O ATOM 755 CB LYS A 61 30.667 31.013 31.863 1.00 0.00 C ATOM 756 CG LYS A 61 30.830 32.061 32.966 1.00 0.00 C ATOM 757 CD LYS A 61 32.284 32.493 33.177 1.00 0.00 C ATOM 758 CE LYS A 61 32.489 33.272 34.477 1.00 0.00 C ATOM 759 NZ LYS A 61 33.932 33.521 34.700 1.00 0.00 N ATOM 0 H LYS A 61 32.308 32.382 30.613 1.00 0.00 H new ATOM 0 HA LYS A 61 30.544 30.676 29.745 1.00 0.00 H new ATOM 0 HB2 LYS A 61 29.817 30.382 32.121 1.00 0.00 H new ATOM 0 HB3 LYS A 61 31.551 30.376 31.871 1.00 0.00 H new ATOM 0 HG2 LYS A 61 30.230 32.936 32.718 1.00 0.00 H new ATOM 0 HG3 LYS A 61 30.438 31.660 33.900 1.00 0.00 H new ATOM 0 HD2 LYS A 61 32.923 31.610 33.183 1.00 0.00 H new ATOM 0 HD3 LYS A 61 32.601 33.110 32.336 1.00 0.00 H new ATOM 0 HE2 LYS A 61 31.952 34.219 34.431 1.00 0.00 H new ATOM 0 HE3 LYS A 61 32.075 32.711 35.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 34.060 34.051 35.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 34.435 32.613 34.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 34.315 34.074 33.907 1.00 0.00 H new ATOM 773 N GLY A 62 28.332 31.312 29.348 1.00 0.00 N ATOM 774 CA GLY A 62 27.107 31.773 28.771 1.00 0.00 C ATOM 775 C GLY A 62 27.150 31.880 27.286 1.00 0.00 C ATOM 776 O GLY A 62 26.104 32.114 26.683 1.00 0.00 O ATOM 0 H GLY A 62 28.600 30.381 29.030 1.00 0.00 H new ATOM 0 HA2 GLY A 62 26.303 31.094 29.055 1.00 0.00 H new ATOM 0 HA3 GLY A 62 26.862 32.749 29.190 1.00 0.00 H new ATOM 780 N ASP A 63 28.307 31.728 26.618 1.00 0.00 N ATOM 781 CA ASP A 63 28.331 31.733 25.188 1.00 0.00 C ATOM 782 C ASP A 63 27.921 30.430 24.594 1.00 0.00 C ATOM 783 O ASP A 63 27.820 29.413 25.280 1.00 0.00 O ATOM 784 CB ASP A 63 29.647 32.272 24.604 1.00 0.00 C ATOM 785 CG ASP A 63 30.847 31.387 24.912 1.00 0.00 C ATOM 786 OD1 ASP A 63 31.313 31.429 26.083 1.00 0.00 O ATOM 787 OD2 ASP A 63 31.332 30.678 23.991 1.00 0.00 O ATOM 0 H ASP A 63 29.217 31.603 27.062 1.00 0.00 H new ATOM 0 HA ASP A 63 27.566 32.449 24.888 1.00 0.00 H new ATOM 0 HB2 ASP A 63 29.544 32.370 23.523 1.00 0.00 H new ATOM 0 HB3 ASP A 63 29.830 33.271 24.999 1.00 0.00 H new ATOM 792 N ARG A 64 27.600 30.423 23.288 1.00 0.00 N ATOM 793 CA ARG A 64 27.021 29.304 22.611 1.00 0.00 C ATOM 794 C ARG A 64 27.830 28.929 21.417 1.00 0.00 C ATOM 795 O ARG A 64 28.054 29.742 20.522 1.00 0.00 O ATOM 796 CB ARG A 64 25.617 29.717 22.136 1.00 0.00 C ATOM 797 CG ARG A 64 24.837 28.645 21.372 1.00 0.00 C ATOM 798 CD ARG A 64 23.581 29.234 20.726 1.00 0.00 C ATOM 799 NE ARG A 64 23.016 28.197 19.818 1.00 0.00 N ATOM 800 CZ ARG A 64 22.401 28.496 18.637 1.00 0.00 C ATOM 801 NH1 ARG A 64 22.268 29.776 18.181 1.00 0.00 N ATOM 802 NH2 ARG A 64 21.914 27.474 17.873 1.00 0.00 N ATOM 0 H ARG A 64 27.750 31.228 22.680 1.00 0.00 H new ATOM 0 HA ARG A 64 26.983 28.452 23.290 1.00 0.00 H new ATOM 0 HB2 ARG A 64 25.032 30.016 23.006 1.00 0.00 H new ATOM 0 HB3 ARG A 64 25.712 30.596 21.498 1.00 0.00 H new ATOM 0 HG2 ARG A 64 25.473 28.206 20.604 1.00 0.00 H new ATOM 0 HG3 ARG A 64 24.557 27.840 22.052 1.00 0.00 H new ATOM 0 HD2 ARG A 64 22.853 29.514 21.488 1.00 0.00 H new ATOM 0 HD3 ARG A 64 23.824 30.139 20.170 1.00 0.00 H new ATOM 0 HE ARG A 64 23.092 27.217 20.092 1.00 0.00 H new ATOM 0 HH11 ARG A 64 22.636 30.554 18.729 1.00 0.00 H new ATOM 0 HH12 ARG A 64 21.801 29.955 17.292 1.00 0.00 H new ATOM 0 HH21 ARG A 64 22.013 26.509 18.189 1.00 0.00 H new ATOM 0 HH22 ARG A 64 21.451 27.676 16.987 1.00 0.00 H new ATOM 816 N VAL A 65 28.277 27.666 21.308 1.00 0.00 N ATOM 817 CA VAL A 65 29.080 27.228 20.208 1.00 0.00 C ATOM 818 C VAL A 65 28.203 26.775 19.091 1.00 0.00 C ATOM 819 O VAL A 65 27.210 26.082 19.304 1.00 0.00 O ATOM 820 CB VAL A 65 30.034 26.139 20.603 1.00 0.00 C ATOM 821 CG1 VAL A 65 31.050 25.871 19.480 1.00 0.00 C ATOM 822 CG2 VAL A 65 30.794 26.564 21.871 1.00 0.00 C ATOM 0 H VAL A 65 28.079 26.937 21.993 1.00 0.00 H new ATOM 0 HA VAL A 65 29.681 28.075 19.877 1.00 0.00 H new ATOM 0 HB VAL A 65 29.463 25.229 20.789 1.00 0.00 H new ATOM 0 HG11 VAL A 65 31.732 25.078 19.788 1.00 0.00 H new ATOM 0 HG12 VAL A 65 30.522 25.565 18.577 1.00 0.00 H new ATOM 0 HG13 VAL A 65 31.618 26.779 19.278 1.00 0.00 H new ATOM 0 HG21 VAL A 65 31.488 25.775 22.161 1.00 0.00 H new ATOM 0 HG22 VAL A 65 31.349 27.481 21.672 1.00 0.00 H new ATOM 0 HG23 VAL A 65 30.084 26.738 22.680 1.00 0.00 H new ATOM 832 N LEU A 66 28.513 27.173 17.845 1.00 0.00 N ATOM 833 CA LEU A 66 27.743 26.871 16.678 1.00 0.00 C ATOM 834 C LEU A 66 28.418 25.839 15.842 1.00 0.00 C ATOM 835 O LEU A 66 27.786 24.900 15.361 1.00 0.00 O ATOM 836 CB LEU A 66 27.505 28.141 15.843 1.00 0.00 C ATOM 837 CG LEU A 66 26.220 28.922 16.172 1.00 0.00 C ATOM 838 CD1 LEU A 66 26.034 29.224 17.668 1.00 0.00 C ATOM 839 CD2 LEU A 66 26.177 30.231 15.368 1.00 0.00 C ATOM 0 H LEU A 66 29.341 27.733 17.641 1.00 0.00 H new ATOM 0 HA LEU A 66 26.782 26.476 17.009 1.00 0.00 H new ATOM 0 HB2 LEU A 66 28.358 28.807 15.976 1.00 0.00 H new ATOM 0 HB3 LEU A 66 27.480 27.862 14.790 1.00 0.00 H new ATOM 0 HG LEU A 66 25.394 28.270 15.888 1.00 0.00 H new ATOM 0 HD11 LEU A 66 25.106 29.776 17.815 1.00 0.00 H new ATOM 0 HD12 LEU A 66 25.992 28.288 18.226 1.00 0.00 H new ATOM 0 HD13 LEU A 66 26.872 29.822 18.025 1.00 0.00 H new ATOM 0 HD21 LEU A 66 25.264 30.776 15.608 1.00 0.00 H new ATOM 0 HD22 LEU A 66 27.042 30.843 15.623 1.00 0.00 H new ATOM 0 HD23 LEU A 66 26.194 30.004 14.302 1.00 0.00 H new ATOM 851 N ALA A 67 29.741 25.956 15.631 1.00 0.00 N ATOM 852 CA ALA A 67 30.458 25.047 14.792 1.00 0.00 C ATOM 853 C ALA A 67 31.870 24.896 15.242 1.00 0.00 C ATOM 854 O ALA A 67 32.562 25.878 15.513 1.00 0.00 O ATOM 855 CB ALA A 67 30.450 25.522 13.329 1.00 0.00 C ATOM 0 H ALA A 67 30.319 26.687 16.046 1.00 0.00 H new ATOM 0 HA ALA A 67 29.954 24.083 14.863 1.00 0.00 H new ATOM 0 HB1 ALA A 67 31.002 24.812 12.713 1.00 0.00 H new ATOM 0 HB2 ALA A 67 29.422 25.588 12.973 1.00 0.00 H new ATOM 0 HB3 ALA A 67 30.920 26.503 13.262 1.00 0.00 H new ATOM 861 N VAL A 68 32.345 23.643 15.343 1.00 0.00 N ATOM 862 CA VAL A 68 33.677 23.311 15.744 1.00 0.00 C ATOM 863 C VAL A 68 34.409 22.779 14.560 1.00 0.00 C ATOM 864 O VAL A 68 34.023 21.766 13.978 1.00 0.00 O ATOM 865 CB VAL A 68 33.715 22.262 16.815 1.00 0.00 C ATOM 866 CG1 VAL A 68 35.155 22.062 17.317 1.00 0.00 C ATOM 867 CG2 VAL A 68 32.810 22.640 18.001 1.00 0.00 C ATOM 0 H VAL A 68 31.775 22.823 15.136 1.00 0.00 H new ATOM 0 HA VAL A 68 34.133 24.218 16.141 1.00 0.00 H new ATOM 0 HB VAL A 68 33.347 21.333 16.379 1.00 0.00 H new ATOM 0 HG11 VAL A 68 35.167 21.298 18.094 1.00 0.00 H new ATOM 0 HG12 VAL A 68 35.789 21.746 16.488 1.00 0.00 H new ATOM 0 HG13 VAL A 68 35.532 23.000 17.725 1.00 0.00 H new ATOM 0 HG21 VAL A 68 32.860 21.859 18.760 1.00 0.00 H new ATOM 0 HG22 VAL A 68 33.147 23.584 18.429 1.00 0.00 H new ATOM 0 HG23 VAL A 68 31.782 22.745 17.655 1.00 0.00 H new ATOM 877 N ASN A 69 35.509 23.428 14.135 1.00 0.00 N ATOM 878 CA ASN A 69 36.406 22.987 13.114 1.00 0.00 C ATOM 879 C ASN A 69 35.808 22.957 11.749 1.00 0.00 C ATOM 880 O ASN A 69 36.248 22.236 10.856 1.00 0.00 O ATOM 881 CB ASN A 69 37.083 21.671 13.532 1.00 0.00 C ATOM 882 CG ASN A 69 38.486 21.492 12.969 1.00 0.00 C ATOM 883 OD1 ASN A 69 39.007 22.257 12.160 1.00 0.00 O ATOM 884 ND2 ASN A 69 39.188 20.441 13.470 1.00 0.00 N ATOM 0 H ASN A 69 35.789 24.324 14.535 1.00 0.00 H new ATOM 0 HA ASN A 69 37.188 23.740 13.020 1.00 0.00 H new ATOM 0 HB2 ASN A 69 37.131 21.628 14.620 1.00 0.00 H new ATOM 0 HB3 ASN A 69 36.463 20.836 13.207 1.00 0.00 H new ATOM 0 HD21 ASN A 69 40.152 20.284 13.175 1.00 0.00 H new ATOM 0 HD22 ASN A 69 38.751 19.809 14.141 1.00 0.00 H new ATOM 891 N GLY A 70 34.763 23.770 11.508 1.00 0.00 N ATOM 892 CA GLY A 70 33.993 23.773 10.304 1.00 0.00 C ATOM 893 C GLY A 70 32.815 22.859 10.330 1.00 0.00 C ATOM 894 O GLY A 70 31.970 22.896 9.438 1.00 0.00 O ATOM 0 H GLY A 70 34.440 24.459 12.187 1.00 0.00 H new ATOM 0 HA2 GLY A 70 33.647 24.788 10.110 1.00 0.00 H new ATOM 0 HA3 GLY A 70 34.639 23.492 9.472 1.00 0.00 H new ATOM 898 N VAL A 71 32.715 21.999 11.360 1.00 0.00 N ATOM 899 CA VAL A 71 31.684 21.017 11.500 1.00 0.00 C ATOM 900 C VAL A 71 30.627 21.579 12.386 1.00 0.00 C ATOM 901 O VAL A 71 30.860 21.958 13.534 1.00 0.00 O ATOM 902 CB VAL A 71 32.181 19.703 12.023 1.00 0.00 C ATOM 903 CG1 VAL A 71 31.049 18.663 12.078 1.00 0.00 C ATOM 904 CG2 VAL A 71 33.320 19.191 11.125 1.00 0.00 C ATOM 0 H VAL A 71 33.384 21.988 12.130 1.00 0.00 H new ATOM 0 HA VAL A 71 31.283 20.798 10.510 1.00 0.00 H new ATOM 0 HB VAL A 71 32.551 19.853 13.037 1.00 0.00 H new ATOM 0 HG11 VAL A 71 31.439 17.720 12.461 1.00 0.00 H new ATOM 0 HG12 VAL A 71 30.257 19.022 12.735 1.00 0.00 H new ATOM 0 HG13 VAL A 71 30.647 18.509 11.076 1.00 0.00 H new ATOM 0 HG21 VAL A 71 33.682 18.236 11.505 1.00 0.00 H new ATOM 0 HG22 VAL A 71 32.951 19.061 10.108 1.00 0.00 H new ATOM 0 HG23 VAL A 71 34.136 19.914 11.125 1.00 0.00 H new ATOM 914 N SER A 72 29.391 21.696 11.867 1.00 0.00 N ATOM 915 CA SER A 72 28.318 22.329 12.569 1.00 0.00 C ATOM 916 C SER A 72 27.755 21.467 13.646 1.00 0.00 C ATOM 917 O SER A 72 27.710 20.243 13.539 1.00 0.00 O ATOM 918 CB SER A 72 27.210 22.758 11.592 1.00 0.00 C ATOM 919 OG SER A 72 26.290 23.650 12.203 1.00 0.00 O ATOM 0 H SER A 72 29.133 21.345 10.945 1.00 0.00 H new ATOM 0 HA SER A 72 28.733 23.215 13.050 1.00 0.00 H new ATOM 0 HB2 SER A 72 27.658 23.237 10.721 1.00 0.00 H new ATOM 0 HB3 SER A 72 26.679 21.876 11.233 1.00 0.00 H new ATOM 0 HG SER A 72 25.698 24.028 11.520 1.00 0.00 H new ATOM 925 N LEU A 73 27.308 22.072 14.761 1.00 0.00 N ATOM 926 CA LEU A 73 26.828 21.342 15.893 1.00 0.00 C ATOM 927 C LEU A 73 25.359 21.097 15.855 1.00 0.00 C ATOM 928 O LEU A 73 24.772 20.608 16.818 1.00 0.00 O ATOM 929 CB LEU A 73 27.195 22.057 17.205 1.00 0.00 C ATOM 930 CG LEU A 73 28.705 22.132 17.485 1.00 0.00 C ATOM 931 CD1 LEU A 73 28.950 22.974 18.749 1.00 0.00 C ATOM 932 CD2 LEU A 73 29.353 20.747 17.654 1.00 0.00 C ATOM 0 H LEU A 73 27.279 23.085 14.879 1.00 0.00 H new ATOM 0 HA LEU A 73 27.321 20.371 15.850 1.00 0.00 H new ATOM 0 HB2 LEU A 73 26.792 23.069 17.178 1.00 0.00 H new ATOM 0 HB3 LEU A 73 26.709 21.542 18.034 1.00 0.00 H new ATOM 0 HG LEU A 73 29.171 22.598 16.616 1.00 0.00 H new ATOM 0 HD11 LEU A 73 30.020 23.028 18.949 1.00 0.00 H new ATOM 0 HD12 LEU A 73 28.558 23.980 18.598 1.00 0.00 H new ATOM 0 HD13 LEU A 73 28.446 22.512 19.598 1.00 0.00 H new ATOM 0 HD21 LEU A 73 30.419 20.865 17.849 1.00 0.00 H new ATOM 0 HD22 LEU A 73 28.886 20.227 18.490 1.00 0.00 H new ATOM 0 HD23 LEU A 73 29.214 20.166 16.742 1.00 0.00 H new ATOM 944 N GLU A 74 24.666 21.409 14.744 1.00 0.00 N ATOM 945 CA GLU A 74 23.247 21.301 14.604 1.00 0.00 C ATOM 946 C GLU A 74 22.745 19.899 14.603 1.00 0.00 C ATOM 947 O GLU A 74 22.949 19.139 13.657 1.00 0.00 O ATOM 948 CB GLU A 74 22.799 22.011 13.315 1.00 0.00 C ATOM 949 CG GLU A 74 23.080 23.515 13.348 1.00 0.00 C ATOM 950 CD GLU A 74 22.985 24.190 11.987 1.00 0.00 C ATOM 951 OE1 GLU A 74 22.456 23.598 11.010 1.00 0.00 O ATOM 952 OE2 GLU A 74 23.485 25.342 11.877 1.00 0.00 O ATOM 0 H GLU A 74 25.121 21.755 13.899 1.00 0.00 H new ATOM 0 HA GLU A 74 22.815 21.781 15.482 1.00 0.00 H new ATOM 0 HB2 GLU A 74 23.312 21.567 12.462 1.00 0.00 H new ATOM 0 HB3 GLU A 74 21.732 21.847 13.165 1.00 0.00 H new ATOM 0 HG2 GLU A 74 22.375 23.992 14.029 1.00 0.00 H new ATOM 0 HG3 GLU A 74 24.078 23.680 13.755 1.00 0.00 H new ATOM 959 N GLY A 75 22.081 19.477 15.694 1.00 0.00 N ATOM 960 CA GLY A 75 21.627 18.135 15.883 1.00 0.00 C ATOM 961 C GLY A 75 22.610 17.263 16.588 1.00 0.00 C ATOM 962 O GLY A 75 22.408 16.058 16.730 1.00 0.00 O ATOM 0 H GLY A 75 21.852 20.094 16.473 1.00 0.00 H new ATOM 0 HA2 GLY A 75 20.697 18.152 16.451 1.00 0.00 H new ATOM 0 HA3 GLY A 75 21.399 17.698 14.911 1.00 0.00 H new ATOM 966 N ALA A 76 23.741 17.836 17.036 1.00 0.00 N ATOM 967 CA ALA A 76 24.668 17.200 17.918 1.00 0.00 C ATOM 968 C ALA A 76 24.175 17.074 19.320 1.00 0.00 C ATOM 969 O ALA A 76 23.447 17.926 19.829 1.00 0.00 O ATOM 970 CB ALA A 76 26.035 17.905 17.900 1.00 0.00 C ATOM 0 H ALA A 76 24.021 18.781 16.773 1.00 0.00 H new ATOM 0 HA ALA A 76 24.780 16.186 17.533 1.00 0.00 H new ATOM 0 HB1 ALA A 76 26.716 17.396 18.582 1.00 0.00 H new ATOM 0 HB2 ALA A 76 26.445 17.878 16.890 1.00 0.00 H new ATOM 0 HB3 ALA A 76 25.914 18.941 18.215 1.00 0.00 H new ATOM 976 N THR A 77 24.584 16.006 20.026 1.00 0.00 N ATOM 977 CA THR A 77 24.387 15.851 21.434 1.00 0.00 C ATOM 978 C THR A 77 25.401 16.606 22.222 1.00 0.00 C ATOM 979 O THR A 77 26.374 17.148 21.698 1.00 0.00 O ATOM 980 CB THR A 77 24.410 14.420 21.887 1.00 0.00 C ATOM 981 OG1 THR A 77 25.640 13.784 21.573 1.00 0.00 O ATOM 982 CG2 THR A 77 23.284 13.632 21.198 1.00 0.00 C ATOM 0 H THR A 77 25.072 15.218 19.599 1.00 0.00 H new ATOM 0 HA THR A 77 23.391 16.255 21.618 1.00 0.00 H new ATOM 0 HB THR A 77 24.278 14.428 22.969 1.00 0.00 H new ATOM 0 HG1 THR A 77 25.617 12.855 21.885 1.00 0.00 H new ATOM 0 HG21 THR A 77 23.308 12.595 21.533 1.00 0.00 H new ATOM 0 HG22 THR A 77 22.321 14.074 21.455 1.00 0.00 H new ATOM 0 HG23 THR A 77 23.423 13.668 20.118 1.00 0.00 H new ATOM 990 N HIS A 78 25.221 16.624 23.555 1.00 0.00 N ATOM 991 CA HIS A 78 26.163 17.076 24.532 1.00 0.00 C ATOM 992 C HIS A 78 27.473 16.374 24.424 1.00 0.00 C ATOM 993 O HIS A 78 28.525 16.999 24.292 1.00 0.00 O ATOM 994 CB HIS A 78 25.546 16.865 25.925 1.00 0.00 C ATOM 995 CG HIS A 78 26.282 17.400 27.118 1.00 0.00 C ATOM 996 ND1 HIS A 78 25.688 17.453 28.363 1.00 0.00 N ATOM 997 CD2 HIS A 78 27.549 17.857 27.297 1.00 0.00 C ATOM 998 CE1 HIS A 78 26.613 17.955 29.225 1.00 0.00 C ATOM 999 NE2 HIS A 78 27.757 18.205 28.616 1.00 0.00 N ATOM 0 H HIS A 78 24.353 16.298 23.980 1.00 0.00 H new ATOM 0 HA HIS A 78 26.369 18.132 24.360 1.00 0.00 H new ATOM 0 HB2 HIS A 78 24.552 17.313 25.920 1.00 0.00 H new ATOM 0 HB3 HIS A 78 25.412 15.793 26.070 1.00 0.00 H new ATOM 0 HD2 HIS A 78 28.290 17.937 26.516 1.00 0.00 H new ATOM 0 HE1 HIS A 78 26.434 18.127 30.276 1.00 0.00 H new ATOM 0 HE2 HIS A 78 28.612 18.576 29.031 1.00 0.00 H new ATOM 1007 N LYS A 79 27.463 15.030 24.418 1.00 0.00 N ATOM 1008 CA LYS A 79 28.614 14.213 24.194 1.00 0.00 C ATOM 1009 C LYS A 79 29.322 14.460 22.906 1.00 0.00 C ATOM 1010 O LYS A 79 30.549 14.560 22.895 1.00 0.00 O ATOM 1011 CB LYS A 79 28.274 12.721 24.351 1.00 0.00 C ATOM 1012 CG LYS A 79 28.610 12.136 25.724 1.00 0.00 C ATOM 1013 CD LYS A 79 27.967 12.853 26.913 1.00 0.00 C ATOM 1014 CE LYS A 79 28.210 12.129 28.239 1.00 0.00 C ATOM 1015 NZ LYS A 79 27.587 12.870 29.359 1.00 0.00 N ATOM 0 H LYS A 79 26.614 14.488 24.577 1.00 0.00 H new ATOM 0 HA LYS A 79 29.320 14.511 24.969 1.00 0.00 H new ATOM 0 HB2 LYS A 79 27.210 12.582 24.161 1.00 0.00 H new ATOM 0 HB3 LYS A 79 28.810 12.157 23.588 1.00 0.00 H new ATOM 0 HG2 LYS A 79 28.302 11.091 25.741 1.00 0.00 H new ATOM 0 HG3 LYS A 79 29.692 12.152 25.853 1.00 0.00 H new ATOM 0 HD2 LYS A 79 28.363 13.866 26.979 1.00 0.00 H new ATOM 0 HD3 LYS A 79 26.894 12.941 26.743 1.00 0.00 H new ATOM 0 HE2 LYS A 79 27.799 11.121 28.190 1.00 0.00 H new ATOM 0 HE3 LYS A 79 29.281 12.028 28.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 27.762 12.364 30.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 27.998 13.824 29.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 26.562 12.944 29.199 1.00 0.00 H new ATOM 1029 N GLN A 80 28.621 14.628 21.771 1.00 0.00 N ATOM 1030 CA GLN A 80 29.211 14.874 20.492 1.00 0.00 C ATOM 1031 C GLN A 80 30.111 16.058 20.410 1.00 0.00 C ATOM 1032 O GLN A 80 31.188 15.989 19.819 1.00 0.00 O ATOM 1033 CB GLN A 80 28.099 15.049 19.445 1.00 0.00 C ATOM 1034 CG GLN A 80 28.041 13.941 18.391 1.00 0.00 C ATOM 1035 CD GLN A 80 27.715 12.568 18.961 1.00 0.00 C ATOM 1036 OE1 GLN A 80 28.590 11.765 19.283 1.00 0.00 O ATOM 1037 NE2 GLN A 80 26.395 12.263 19.075 1.00 0.00 N ATOM 0 H GLN A 80 27.602 14.591 21.743 1.00 0.00 H new ATOM 0 HA GLN A 80 29.839 14.003 20.305 1.00 0.00 H new ATOM 0 HB2 GLN A 80 27.138 15.096 19.958 1.00 0.00 H new ATOM 0 HB3 GLN A 80 28.239 16.006 18.941 1.00 0.00 H new ATOM 0 HG2 GLN A 80 27.291 14.202 17.644 1.00 0.00 H new ATOM 0 HG3 GLN A 80 29.000 13.892 17.876 1.00 0.00 H new ATOM 0 HE21 GLN A 80 25.688 12.946 18.801 1.00 0.00 H new ATOM 0 HE22 GLN A 80 26.111 11.351 19.434 1.00 0.00 H new ATOM 1046 N ALA A 81 29.729 17.197 21.015 1.00 0.00 N ATOM 1047 CA ALA A 81 30.534 18.376 21.095 1.00 0.00 C ATOM 1048 C ALA A 81 31.774 18.178 21.896 1.00 0.00 C ATOM 1049 O ALA A 81 32.837 18.682 21.536 1.00 0.00 O ATOM 1050 CB ALA A 81 29.698 19.512 21.709 1.00 0.00 C ATOM 0 H ALA A 81 28.821 17.300 21.467 1.00 0.00 H new ATOM 0 HA ALA A 81 30.849 18.628 20.082 1.00 0.00 H new ATOM 0 HB1 ALA A 81 30.304 20.416 21.774 1.00 0.00 H new ATOM 0 HB2 ALA A 81 28.828 19.703 21.081 1.00 0.00 H new ATOM 0 HB3 ALA A 81 29.369 19.223 22.707 1.00 0.00 H new ATOM 1056 N VAL A 82 31.725 17.379 22.977 1.00 0.00 N ATOM 1057 CA VAL A 82 32.859 17.071 23.792 1.00 0.00 C ATOM 1058 C VAL A 82 33.786 16.136 23.094 1.00 0.00 C ATOM 1059 O VAL A 82 34.992 16.371 23.042 1.00 0.00 O ATOM 1060 CB VAL A 82 32.482 16.551 25.148 1.00 0.00 C ATOM 1061 CG1 VAL A 82 33.744 16.302 25.992 1.00 0.00 C ATOM 1062 CG2 VAL A 82 31.602 17.589 25.863 1.00 0.00 C ATOM 0 H VAL A 82 30.865 16.932 23.295 1.00 0.00 H new ATOM 0 HA VAL A 82 33.383 18.012 23.959 1.00 0.00 H new ATOM 0 HB VAL A 82 31.938 15.614 25.028 1.00 0.00 H new ATOM 0 HG11 VAL A 82 33.457 15.925 26.974 1.00 0.00 H new ATOM 0 HG12 VAL A 82 34.377 15.569 25.492 1.00 0.00 H new ATOM 0 HG13 VAL A 82 34.294 17.236 26.109 1.00 0.00 H new ATOM 0 HG21 VAL A 82 31.326 17.215 26.849 1.00 0.00 H new ATOM 0 HG22 VAL A 82 32.155 18.522 25.971 1.00 0.00 H new ATOM 0 HG23 VAL A 82 30.700 17.767 25.277 1.00 0.00 H new ATOM 1072 N GLU A 83 33.255 15.082 22.448 1.00 0.00 N ATOM 1073 CA GLU A 83 33.959 14.182 21.588 1.00 0.00 C ATOM 1074 C GLU A 83 34.696 14.871 20.493 1.00 0.00 C ATOM 1075 O GLU A 83 35.804 14.494 20.113 1.00 0.00 O ATOM 1076 CB GLU A 83 32.977 13.185 20.949 1.00 0.00 C ATOM 1077 CG GLU A 83 32.949 11.782 21.560 1.00 0.00 C ATOM 1078 CD GLU A 83 32.233 11.639 22.895 1.00 0.00 C ATOM 1079 OE1 GLU A 83 32.777 12.089 23.939 1.00 0.00 O ATOM 1080 OE2 GLU A 83 31.171 10.959 22.931 1.00 0.00 O ATOM 0 H GLU A 83 32.267 14.844 22.533 1.00 0.00 H new ATOM 0 HA GLU A 83 34.688 13.673 22.218 1.00 0.00 H new ATOM 0 HB2 GLU A 83 31.973 13.606 21.009 1.00 0.00 H new ATOM 0 HB3 GLU A 83 33.221 13.093 19.891 1.00 0.00 H new ATOM 0 HG2 GLU A 83 32.477 11.108 20.845 1.00 0.00 H new ATOM 0 HG3 GLU A 83 33.978 11.444 21.686 1.00 0.00 H new ATOM 1087 N THR A 84 34.087 15.936 19.941 1.00 0.00 N ATOM 1088 CA THR A 84 34.610 16.791 18.921 1.00 0.00 C ATOM 1089 C THR A 84 35.676 17.696 19.436 1.00 0.00 C ATOM 1090 O THR A 84 36.775 17.731 18.887 1.00 0.00 O ATOM 1091 CB THR A 84 33.507 17.589 18.293 1.00 0.00 C ATOM 1092 OG1 THR A 84 32.571 16.725 17.665 1.00 0.00 O ATOM 1093 CG2 THR A 84 33.980 18.544 17.184 1.00 0.00 C ATOM 0 H THR A 84 33.152 16.221 20.233 1.00 0.00 H new ATOM 0 HA THR A 84 35.066 16.151 18.165 1.00 0.00 H new ATOM 0 HB THR A 84 33.082 18.164 19.116 1.00 0.00 H new ATOM 0 HG1 THR A 84 31.907 16.429 18.322 1.00 0.00 H new ATOM 0 HG21 THR A 84 33.124 19.085 16.780 1.00 0.00 H new ATOM 0 HG22 THR A 84 34.696 19.254 17.597 1.00 0.00 H new ATOM 0 HG23 THR A 84 34.455 17.970 16.388 1.00 0.00 H new ATOM 1101 N LEU A 85 35.433 18.448 20.525 1.00 0.00 N ATOM 1102 CA LEU A 85 36.365 19.366 21.103 1.00 0.00 C ATOM 1103 C LEU A 85 37.600 18.743 21.657 1.00 0.00 C ATOM 1104 O LEU A 85 38.678 19.333 21.604 1.00 0.00 O ATOM 1105 CB LEU A 85 35.685 20.220 22.186 1.00 0.00 C ATOM 1106 CG LEU A 85 34.711 21.269 21.624 1.00 0.00 C ATOM 1107 CD1 LEU A 85 33.759 21.786 22.714 1.00 0.00 C ATOM 1108 CD2 LEU A 85 35.457 22.444 20.969 1.00 0.00 C ATOM 0 H LEU A 85 34.545 18.414 21.026 1.00 0.00 H new ATOM 0 HA LEU A 85 36.693 19.990 20.272 1.00 0.00 H new ATOM 0 HB2 LEU A 85 35.144 19.563 22.868 1.00 0.00 H new ATOM 0 HB3 LEU A 85 36.452 20.726 22.772 1.00 0.00 H new ATOM 0 HG LEU A 85 34.119 20.773 20.854 1.00 0.00 H new ATOM 0 HD11 LEU A 85 33.083 22.526 22.286 1.00 0.00 H new ATOM 0 HD12 LEU A 85 33.180 20.955 23.115 1.00 0.00 H new ATOM 0 HD13 LEU A 85 34.338 22.245 23.515 1.00 0.00 H new ATOM 0 HD21 LEU A 85 34.735 23.164 20.584 1.00 0.00 H new ATOM 0 HD22 LEU A 85 36.094 22.929 21.709 1.00 0.00 H new ATOM 0 HD23 LEU A 85 36.072 22.073 20.149 1.00 0.00 H new ATOM 1120 N ARG A 86 37.533 17.503 22.171 1.00 0.00 N ATOM 1121 CA ARG A 86 38.693 16.791 22.613 1.00 0.00 C ATOM 1122 C ARG A 86 39.578 16.368 21.492 1.00 0.00 C ATOM 1123 O ARG A 86 40.794 16.248 21.644 1.00 0.00 O ATOM 1124 CB ARG A 86 38.310 15.635 23.554 1.00 0.00 C ATOM 1125 CG ARG A 86 37.994 14.260 22.962 1.00 0.00 C ATOM 1126 CD ARG A 86 39.178 13.291 22.984 1.00 0.00 C ATOM 1127 NE ARG A 86 38.693 11.977 22.476 1.00 0.00 N ATOM 1128 CZ ARG A 86 39.427 10.827 22.523 1.00 0.00 C ATOM 1129 NH1 ARG A 86 40.677 10.760 23.069 1.00 0.00 N ATOM 1130 NH2 ARG A 86 38.889 9.674 22.030 1.00 0.00 N ATOM 0 H ARG A 86 36.661 16.986 22.282 1.00 0.00 H new ATOM 0 HA ARG A 86 39.296 17.487 23.196 1.00 0.00 H new ATOM 0 HB2 ARG A 86 39.127 15.506 24.264 1.00 0.00 H new ATOM 0 HB3 ARG A 86 37.438 15.953 24.126 1.00 0.00 H new ATOM 0 HG2 ARG A 86 37.165 13.819 23.515 1.00 0.00 H new ATOM 0 HG3 ARG A 86 37.659 14.386 21.932 1.00 0.00 H new ATOM 0 HD2 ARG A 86 39.991 13.666 22.362 1.00 0.00 H new ATOM 0 HD3 ARG A 86 39.571 13.189 23.996 1.00 0.00 H new ATOM 0 HE ARG A 86 37.758 11.934 22.070 1.00 0.00 H new ATOM 0 HH11 ARG A 86 41.105 11.596 23.467 1.00 0.00 H new ATOM 0 HH12 ARG A 86 41.183 9.874 23.078 1.00 0.00 H new ATOM 0 HH21 ARG A 86 37.950 9.679 21.633 1.00 0.00 H new ATOM 0 HH22 ARG A 86 39.426 8.807 22.059 1.00 0.00 H new ATOM 1144 N ASN A 87 39.006 16.183 20.290 1.00 0.00 N ATOM 1145 CA ASN A 87 39.692 15.813 19.090 1.00 0.00 C ATOM 1146 C ASN A 87 40.132 16.989 18.288 1.00 0.00 C ATOM 1147 O ASN A 87 40.087 16.990 17.059 1.00 0.00 O ATOM 1148 CB ASN A 87 38.761 14.888 18.288 1.00 0.00 C ATOM 1149 CG ASN A 87 39.515 14.035 17.279 1.00 0.00 C ATOM 1150 OD1 ASN A 87 40.433 13.297 17.632 1.00 0.00 O ATOM 1151 ND2 ASN A 87 39.107 14.101 15.983 1.00 0.00 N ATOM 0 H ASN A 87 38.003 16.299 20.147 1.00 0.00 H new ATOM 0 HA ASN A 87 40.614 15.292 19.348 1.00 0.00 H new ATOM 0 HB2 ASN A 87 38.219 14.238 18.976 1.00 0.00 H new ATOM 0 HB3 ASN A 87 38.017 15.490 17.766 1.00 0.00 H new ATOM 0 HD21 ASN A 87 39.566 13.529 15.274 1.00 0.00 H new ATOM 0 HD22 ASN A 87 38.342 14.723 15.720 1.00 0.00 H new ATOM 1158 N THR A 88 40.616 18.054 18.952 1.00 0.00 N ATOM 1159 CA THR A 88 41.138 19.249 18.368 1.00 0.00 C ATOM 1160 C THR A 88 42.620 19.189 18.216 1.00 0.00 C ATOM 1161 O THR A 88 43.309 18.467 18.932 1.00 0.00 O ATOM 1162 CB THR A 88 40.796 20.488 19.141 1.00 0.00 C ATOM 1163 OG1 THR A 88 41.009 20.338 20.537 1.00 0.00 O ATOM 1164 CG2 THR A 88 39.317 20.841 18.910 1.00 0.00 C ATOM 0 H THR A 88 40.644 18.080 19.971 1.00 0.00 H new ATOM 0 HA THR A 88 40.661 19.309 17.390 1.00 0.00 H new ATOM 0 HB THR A 88 41.454 21.280 18.783 1.00 0.00 H new ATOM 0 HG1 THR A 88 40.203 19.967 20.953 1.00 0.00 H new ATOM 0 HG21 THR A 88 39.066 21.741 19.471 1.00 0.00 H new ATOM 0 HG22 THR A 88 39.146 21.016 17.848 1.00 0.00 H new ATOM 0 HG23 THR A 88 38.689 20.016 19.247 1.00 0.00 H new ATOM 1172 N GLY A 89 43.179 19.962 17.268 1.00 0.00 N ATOM 1173 CA GLY A 89 44.583 20.028 17.002 1.00 0.00 C ATOM 1174 C GLY A 89 45.251 21.144 17.728 1.00 0.00 C ATOM 1175 O GLY A 89 44.875 21.479 18.851 1.00 0.00 O ATOM 0 H GLY A 89 42.628 20.568 16.660 1.00 0.00 H new ATOM 0 HA2 GLY A 89 45.048 19.084 17.287 1.00 0.00 H new ATOM 0 HA3 GLY A 89 44.741 20.150 15.930 1.00 0.00 H new ATOM 1179 N GLN A 90 46.289 21.756 17.129 1.00 0.00 N ATOM 1180 CA GLN A 90 46.925 22.922 17.655 1.00 0.00 C ATOM 1181 C GLN A 90 46.054 24.129 17.574 1.00 0.00 C ATOM 1182 O GLN A 90 45.792 24.800 18.571 1.00 0.00 O ATOM 1183 CB GLN A 90 48.258 23.226 16.951 1.00 0.00 C ATOM 1184 CG GLN A 90 49.089 24.295 17.666 1.00 0.00 C ATOM 1185 CD GLN A 90 50.031 25.045 16.736 1.00 0.00 C ATOM 1186 OE1 GLN A 90 49.918 26.256 16.555 1.00 0.00 O ATOM 1187 NE2 GLN A 90 51.006 24.329 16.114 1.00 0.00 N ATOM 0 H GLN A 90 46.697 21.429 16.253 1.00 0.00 H new ATOM 0 HA GLN A 90 47.119 22.694 18.703 1.00 0.00 H new ATOM 0 HB2 GLN A 90 48.842 22.308 16.881 1.00 0.00 H new ATOM 0 HB3 GLN A 90 48.056 23.554 15.931 1.00 0.00 H new ATOM 0 HG2 GLN A 90 48.417 25.008 18.144 1.00 0.00 H new ATOM 0 HG3 GLN A 90 49.670 23.824 18.458 1.00 0.00 H new ATOM 0 HE21 GLN A 90 51.084 23.325 16.277 1.00 0.00 H new ATOM 0 HE22 GLN A 90 51.659 24.796 15.485 1.00 0.00 H new ATOM 1196 N VAL A 91 45.592 24.454 16.354 1.00 0.00 N ATOM 1197 CA VAL A 91 44.725 25.562 16.098 1.00 0.00 C ATOM 1198 C VAL A 91 43.326 25.055 16.011 1.00 0.00 C ATOM 1199 O VAL A 91 43.007 24.096 15.311 1.00 0.00 O ATOM 1200 CB VAL A 91 45.083 26.321 14.856 1.00 0.00 C ATOM 1201 CG1 VAL A 91 44.175 27.549 14.676 1.00 0.00 C ATOM 1202 CG2 VAL A 91 46.550 26.778 14.947 1.00 0.00 C ATOM 0 H VAL A 91 45.831 23.926 15.515 1.00 0.00 H new ATOM 0 HA VAL A 91 44.834 26.269 16.920 1.00 0.00 H new ATOM 0 HB VAL A 91 44.945 25.664 13.997 1.00 0.00 H new ATOM 0 HG11 VAL A 91 44.458 28.080 13.767 1.00 0.00 H new ATOM 0 HG12 VAL A 91 43.137 27.226 14.599 1.00 0.00 H new ATOM 0 HG13 VAL A 91 44.286 28.212 15.534 1.00 0.00 H new ATOM 0 HG21 VAL A 91 46.815 27.331 14.046 1.00 0.00 H new ATOM 0 HG22 VAL A 91 46.677 27.421 15.818 1.00 0.00 H new ATOM 0 HG23 VAL A 91 47.197 25.906 15.042 1.00 0.00 H new ATOM 1212 N VAL A 92 42.430 25.694 16.785 1.00 0.00 N ATOM 1213 CA VAL A 92 41.070 25.339 17.047 1.00 0.00 C ATOM 1214 C VAL A 92 40.176 26.382 16.470 1.00 0.00 C ATOM 1215 O VAL A 92 40.099 27.509 16.958 1.00 0.00 O ATOM 1216 CB VAL A 92 40.863 25.258 18.531 1.00 0.00 C ATOM 1217 CG1 VAL A 92 39.405 24.906 18.868 1.00 0.00 C ATOM 1218 CG2 VAL A 92 41.786 24.142 19.047 1.00 0.00 C ATOM 0 H VAL A 92 42.689 26.549 17.277 1.00 0.00 H new ATOM 0 HA VAL A 92 40.840 24.374 16.595 1.00 0.00 H new ATOM 0 HB VAL A 92 41.087 26.219 18.994 1.00 0.00 H new ATOM 0 HG11 VAL A 92 39.284 24.854 19.950 1.00 0.00 H new ATOM 0 HG12 VAL A 92 38.743 25.673 18.465 1.00 0.00 H new ATOM 0 HG13 VAL A 92 39.153 23.941 18.428 1.00 0.00 H new ATOM 0 HG21 VAL A 92 41.671 24.045 20.126 1.00 0.00 H new ATOM 0 HG22 VAL A 92 41.521 23.200 18.567 1.00 0.00 H new ATOM 0 HG23 VAL A 92 42.822 24.389 18.814 1.00 0.00 H new ATOM 1228 N HIS A 93 39.447 26.052 15.390 1.00 0.00 N ATOM 1229 CA HIS A 93 38.478 26.936 14.822 1.00 0.00 C ATOM 1230 C HIS A 93 37.147 26.736 15.462 1.00 0.00 C ATOM 1231 O HIS A 93 36.485 25.725 15.235 1.00 0.00 O ATOM 1232 CB HIS A 93 38.272 26.701 13.316 1.00 0.00 C ATOM 1233 CG HIS A 93 39.514 26.711 12.474 1.00 0.00 C ATOM 1234 ND1 HIS A 93 39.518 26.238 11.178 1.00 0.00 N ATOM 1235 CD2 HIS A 93 40.789 27.112 12.724 1.00 0.00 C ATOM 1236 CE1 HIS A 93 40.790 26.363 10.715 1.00 0.00 C ATOM 1237 NE2 HIS A 93 41.591 26.889 11.622 1.00 0.00 N ATOM 0 H HIS A 93 39.531 25.159 14.904 1.00 0.00 H new ATOM 0 HA HIS A 93 38.865 27.941 14.991 1.00 0.00 H new ATOM 0 HB2 HIS A 93 37.774 25.741 13.183 1.00 0.00 H new ATOM 0 HB3 HIS A 93 37.594 27.466 12.938 1.00 0.00 H new ATOM 0 HD2 HIS A 93 41.127 27.544 13.654 1.00 0.00 H new ATOM 0 HE1 HIS A 93 41.106 26.068 9.725 1.00 0.00 H new ATOM 0 HE2 HIS A 93 42.587 27.088 11.529 1.00 0.00 H new ATOM 1245 N LEU A 94 36.673 27.698 16.275 1.00 0.00 N ATOM 1246 CA LEU A 94 35.288 27.778 16.620 1.00 0.00 C ATOM 1247 C LEU A 94 34.596 28.828 15.823 1.00 0.00 C ATOM 1248 O LEU A 94 35.172 29.833 15.411 1.00 0.00 O ATOM 1249 CB LEU A 94 34.992 28.120 18.090 1.00 0.00 C ATOM 1250 CG LEU A 94 35.744 27.277 19.134 1.00 0.00 C ATOM 1251 CD1 LEU A 94 35.298 27.746 20.530 1.00 0.00 C ATOM 1252 CD2 LEU A 94 35.492 25.770 18.965 1.00 0.00 C ATOM 0 H LEU A 94 37.253 28.424 16.695 1.00 0.00 H new ATOM 0 HA LEU A 94 34.928 26.770 16.413 1.00 0.00 H new ATOM 0 HB2 LEU A 94 35.233 29.170 18.255 1.00 0.00 H new ATOM 0 HB3 LEU A 94 33.921 28.008 18.262 1.00 0.00 H new ATOM 0 HG LEU A 94 36.816 27.422 18.999 1.00 0.00 H new ATOM 0 HD11 LEU A 94 35.816 27.164 21.292 1.00 0.00 H new ATOM 0 HD12 LEU A 94 35.539 28.802 20.653 1.00 0.00 H new ATOM 0 HD13 LEU A 94 34.222 27.605 20.635 1.00 0.00 H new ATOM 0 HD21 LEU A 94 36.046 25.221 19.727 1.00 0.00 H new ATOM 0 HD22 LEU A 94 34.427 25.565 19.072 1.00 0.00 H new ATOM 0 HD23 LEU A 94 35.824 25.454 17.976 1.00 0.00 H new ATOM 1264 N LEU A 95 33.275 28.642 15.639 1.00 0.00 N ATOM 1265 CA LEU A 95 32.383 29.715 15.327 1.00 0.00 C ATOM 1266 C LEU A 95 31.347 29.693 16.398 1.00 0.00 C ATOM 1267 O LEU A 95 30.793 28.641 16.711 1.00 0.00 O ATOM 1268 CB LEU A 95 31.802 29.553 13.912 1.00 0.00 C ATOM 1269 CG LEU A 95 30.966 30.746 13.418 1.00 0.00 C ATOM 1270 CD1 LEU A 95 31.332 31.072 11.961 1.00 0.00 C ATOM 1271 CD2 LEU A 95 29.461 30.472 13.569 1.00 0.00 C ATOM 0 H LEU A 95 32.820 27.732 15.708 1.00 0.00 H new ATOM 0 HA LEU A 95 32.883 30.684 15.308 1.00 0.00 H new ATOM 0 HB2 LEU A 95 32.623 29.389 13.214 1.00 0.00 H new ATOM 0 HB3 LEU A 95 31.181 28.658 13.890 1.00 0.00 H new ATOM 0 HG LEU A 95 31.197 31.614 14.036 1.00 0.00 H new ATOM 0 HD11 LEU A 95 30.737 31.918 11.617 1.00 0.00 H new ATOM 0 HD12 LEU A 95 32.391 31.324 11.900 1.00 0.00 H new ATOM 0 HD13 LEU A 95 31.129 30.205 11.332 1.00 0.00 H new ATOM 0 HD21 LEU A 95 28.897 31.333 13.212 1.00 0.00 H new ATOM 0 HD22 LEU A 95 29.191 29.593 12.984 1.00 0.00 H new ATOM 0 HD23 LEU A 95 29.227 30.295 14.619 1.00 0.00 H new ATOM 1283 N LEU A 96 31.095 30.841 17.052 1.00 0.00 N ATOM 1284 CA LEU A 96 30.246 30.867 18.203 1.00 0.00 C ATOM 1285 C LEU A 96 29.404 32.095 18.241 1.00 0.00 C ATOM 1286 O LEU A 96 29.654 33.065 17.527 1.00 0.00 O ATOM 1287 CB LEU A 96 31.032 30.666 19.510 1.00 0.00 C ATOM 1288 CG LEU A 96 31.982 31.801 19.930 1.00 0.00 C ATOM 1289 CD1 LEU A 96 31.333 32.694 21.000 1.00 0.00 C ATOM 1290 CD2 LEU A 96 33.298 31.222 20.477 1.00 0.00 C ATOM 0 H LEU A 96 31.477 31.748 16.785 1.00 0.00 H new ATOM 0 HA LEU A 96 29.568 30.018 18.114 1.00 0.00 H new ATOM 0 HB2 LEU A 96 30.316 30.507 20.316 1.00 0.00 H new ATOM 0 HB3 LEU A 96 31.616 29.751 19.418 1.00 0.00 H new ATOM 0 HG LEU A 96 32.191 32.406 19.047 1.00 0.00 H new ATOM 0 HD11 LEU A 96 32.025 33.488 21.280 1.00 0.00 H new ATOM 0 HD12 LEU A 96 30.418 33.133 20.602 1.00 0.00 H new ATOM 0 HD13 LEU A 96 31.095 32.094 21.879 1.00 0.00 H new ATOM 0 HD21 LEU A 96 33.960 32.037 20.770 1.00 0.00 H new ATOM 0 HD22 LEU A 96 33.087 30.596 21.344 1.00 0.00 H new ATOM 0 HD23 LEU A 96 33.780 30.622 19.705 1.00 0.00 H new ATOM 1302 N GLU A 97 28.345 32.061 19.070 1.00 0.00 N ATOM 1303 CA GLU A 97 27.386 33.104 19.265 1.00 0.00 C ATOM 1304 C GLU A 97 27.463 33.581 20.673 1.00 0.00 C ATOM 1305 O GLU A 97 27.549 32.782 21.605 1.00 0.00 O ATOM 1306 CB GLU A 97 25.975 32.564 18.974 1.00 0.00 C ATOM 1307 CG GLU A 97 24.855 33.607 18.976 1.00 0.00 C ATOM 1308 CD GLU A 97 23.479 33.033 18.671 1.00 0.00 C ATOM 1309 OE1 GLU A 97 22.981 32.176 19.449 1.00 0.00 O ATOM 1310 OE2 GLU A 97 22.849 33.491 17.681 1.00 0.00 O ATOM 0 H GLU A 97 28.146 31.243 19.646 1.00 0.00 H new ATOM 0 HA GLU A 97 27.598 33.932 18.589 1.00 0.00 H new ATOM 0 HB2 GLU A 97 25.987 32.072 18.002 1.00 0.00 H new ATOM 0 HB3 GLU A 97 25.738 31.800 19.715 1.00 0.00 H new ATOM 0 HG2 GLU A 97 24.827 34.094 19.951 1.00 0.00 H new ATOM 0 HG3 GLU A 97 25.088 34.378 18.241 1.00 0.00 H new ATOM 1317 N LYS A 98 27.440 34.903 20.926 1.00 0.00 N ATOM 1318 CA LYS A 98 27.433 35.394 22.269 1.00 0.00 C ATOM 1319 C LYS A 98 26.092 35.292 22.912 1.00 0.00 C ATOM 1320 O LYS A 98 25.046 35.378 22.271 1.00 0.00 O ATOM 1321 CB LYS A 98 27.944 36.842 22.339 1.00 0.00 C ATOM 1322 CG LYS A 98 28.432 37.303 23.714 1.00 0.00 C ATOM 1323 CD LYS A 98 29.755 36.668 24.144 1.00 0.00 C ATOM 1324 CE LYS A 98 30.039 36.731 25.646 1.00 0.00 C ATOM 1325 NZ LYS A 98 29.948 38.119 26.154 1.00 0.00 N ATOM 0 H LYS A 98 27.426 35.626 20.207 1.00 0.00 H new ATOM 0 HA LYS A 98 28.114 34.752 22.829 1.00 0.00 H new ATOM 0 HB2 LYS A 98 28.761 36.955 21.626 1.00 0.00 H new ATOM 0 HB3 LYS A 98 27.144 37.507 22.015 1.00 0.00 H new ATOM 0 HG2 LYS A 98 28.546 38.387 23.704 1.00 0.00 H new ATOM 0 HG3 LYS A 98 27.669 37.070 24.457 1.00 0.00 H new ATOM 0 HD2 LYS A 98 29.759 35.624 23.831 1.00 0.00 H new ATOM 0 HD3 LYS A 98 30.569 37.163 23.614 1.00 0.00 H new ATOM 0 HE2 LYS A 98 29.329 36.099 26.179 1.00 0.00 H new ATOM 0 HE3 LYS A 98 31.033 36.333 25.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 30.276 38.150 27.140 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 30.543 38.742 25.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 28.960 38.442 26.108 1.00 0.00 H new ATOM 1339 N GLY A 99 26.082 35.078 24.240 1.00 0.00 N ATOM 1340 CA GLY A 99 24.908 35.015 25.054 1.00 0.00 C ATOM 1341 C GLY A 99 24.492 36.356 25.552 1.00 0.00 C ATOM 1342 O GLY A 99 25.239 37.032 26.258 1.00 0.00 O ATOM 0 H GLY A 99 26.940 34.942 24.774 1.00 0.00 H new ATOM 0 HA2 GLY A 99 24.093 34.575 24.479 1.00 0.00 H new ATOM 0 HA3 GLY A 99 25.092 34.356 25.902 1.00 0.00 H new ATOM 1346 N GLN A 100 23.271 36.791 25.190 1.00 0.00 N ATOM 1347 CA GLN A 100 22.772 38.107 25.439 1.00 0.00 C ATOM 1348 C GLN A 100 22.308 38.353 26.833 1.00 0.00 C ATOM 1349 O GLN A 100 22.336 37.478 27.697 1.00 0.00 O ATOM 1350 CB GLN A 100 21.624 38.409 24.460 1.00 0.00 C ATOM 1351 CG GLN A 100 22.139 38.532 23.025 1.00 0.00 C ATOM 1352 CD GLN A 100 21.048 38.898 22.028 1.00 0.00 C ATOM 1353 OE1 GLN A 100 19.957 39.385 22.323 1.00 0.00 O ATOM 1354 NE2 GLN A 100 21.384 38.684 20.729 1.00 0.00 N ATOM 0 H GLN A 100 22.601 36.197 24.701 1.00 0.00 H new ATOM 0 HA GLN A 100 23.619 38.776 25.289 1.00 0.00 H new ATOM 0 HB2 GLN A 100 20.878 37.616 24.515 1.00 0.00 H new ATOM 0 HB3 GLN A 100 21.128 39.335 24.752 1.00 0.00 H new ATOM 0 HG2 GLN A 100 22.923 39.288 22.990 1.00 0.00 H new ATOM 0 HG3 GLN A 100 22.594 37.588 22.726 1.00 0.00 H new ATOM 0 HE21 GLN A 100 22.291 38.280 20.497 1.00 0.00 H new ATOM 0 HE22 GLN A 100 20.729 38.928 19.986 1.00 0.00 H new ATOM 1363 N VAL A 101 21.860 39.592 27.103 1.00 0.00 N ATOM 1364 CA VAL A 101 21.442 40.041 28.395 1.00 0.00 C ATOM 1365 C VAL A 101 19.985 40.352 28.392 1.00 0.00 C ATOM 1366 O VAL A 101 19.407 40.513 27.318 1.00 0.00 O ATOM 1367 CB VAL A 101 22.240 41.214 28.882 1.00 0.00 C ATOM 1368 CG1 VAL A 101 23.718 40.806 28.997 1.00 0.00 C ATOM 1369 CG2 VAL A 101 22.117 42.434 27.954 1.00 0.00 C ATOM 0 H VAL A 101 21.786 40.315 26.387 1.00 0.00 H new ATOM 0 HA VAL A 101 21.627 39.226 29.094 1.00 0.00 H new ATOM 0 HB VAL A 101 21.842 41.503 29.855 1.00 0.00 H new ATOM 0 HG11 VAL A 101 24.303 41.655 29.351 1.00 0.00 H new ATOM 0 HG12 VAL A 101 23.814 39.980 29.702 1.00 0.00 H new ATOM 0 HG13 VAL A 101 24.086 40.493 28.020 1.00 0.00 H new ATOM 0 HG21 VAL A 101 22.713 43.255 28.352 1.00 0.00 H new ATOM 0 HG22 VAL A 101 22.478 42.172 26.959 1.00 0.00 H new ATOM 0 HG23 VAL A 101 21.073 42.741 27.892 1.00 0.00 H new ATOM 1379 N PRO A 102 19.313 40.440 29.502 1.00 0.00 N ATOM 1380 CA PRO A 102 17.978 40.961 29.547 1.00 0.00 C ATOM 1381 C PRO A 102 17.856 42.419 29.267 1.00 0.00 C ATOM 1382 O PRO A 102 16.893 42.822 28.561 1.00 0.00 O ATOM 1383 CB PRO A 102 17.500 40.657 30.966 1.00 0.00 C ATOM 1384 CG PRO A 102 18.284 39.392 31.354 1.00 0.00 C ATOM 1385 CD PRO A 102 19.645 39.689 30.702 1.00 0.00 C ATOM 1386 OXT PRO A 102 18.652 43.242 29.794 1.00 0.00 O ATOM 0 HA PRO A 102 17.383 40.499 28.760 1.00 0.00 H new ATOM 0 HB2 PRO A 102 17.712 41.483 31.645 1.00 0.00 H new ATOM 0 HB3 PRO A 102 16.424 40.486 30.998 1.00 0.00 H new ATOM 0 HG2 PRO A 102 18.361 39.268 32.434 1.00 0.00 H new ATOM 0 HG3 PRO A 102 17.826 38.484 30.961 1.00 0.00 H new ATOM 0 HD2 PRO A 102 20.287 40.266 31.367 1.00 0.00 H new ATOM 0 HD3 PRO A 102 20.179 38.770 30.461 1.00 0.00 H new TER 1394 PRO A 102