USER MOD reduce.3.24.130724 H: found=0, std=0, add=709, rem=0, adj=15 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 80 GLN : amide:sc= -0.824 X(o=0.41,f=0.84) USER MOD Set 1.2: A 84 THR OG1 : rot 94:sc= 1.24 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 20 LYS NZ :NH3+ -173:sc= 0.00531 (180deg=0.00233) USER MOD Single : A 21 THR OG1 : rot 39:sc= 0.477 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= 0.00587 X(o=0.0059,f=0) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 180:sc= 0.0158 USER MOD Single : A 39 HIS : no HD1:sc= -0.234 X(o=-0.23,f=-0.23) USER MOD Single : A 43 TYR OH : rot -153:sc= 1.19 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 180:sc= 0 USER MOD Single : A 60 HIS : no HD1:sc= -0.31 X(o=-0.31,f=-0.31) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 72 SER OG : rot -161:sc= 1.22 USER MOD Single : A 77 THR OG1 : rot 180:sc= -0.0845 USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 ASN : amide:sc= -0.0179 K(o=-0.018,f=-1) USER MOD Single : A 88 THR OG1 : rot 80:sc= 0.0281 USER MOD Single : A 90 GLN : amide:sc= -0.0536 X(o=-0.054,f=-0.28) USER MOD Single : A 93 HIS : no HD1:sc= -0.0541 X(o=-0.054,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 155:sc= 1.11 (180deg=0.669) USER MOD Single : A 100 GLN : amide:sc= 0.995 K(o=1,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 9 31.673 43.289 24.811 1.00 0.00 N ATOM 2 CA LYS A 9 30.906 42.255 25.434 1.00 0.00 C ATOM 3 C LYS A 9 29.777 41.781 24.586 1.00 0.00 C ATOM 4 O LYS A 9 29.706 40.562 24.442 1.00 0.00 O ATOM 5 CB LYS A 9 30.482 42.581 26.876 1.00 0.00 C ATOM 6 CG LYS A 9 31.628 42.957 27.818 1.00 0.00 C ATOM 7 CD LYS A 9 32.590 41.805 28.117 1.00 0.00 C ATOM 8 CE LYS A 9 33.695 42.177 29.108 1.00 0.00 C ATOM 9 NZ LYS A 9 34.547 40.992 29.356 1.00 0.00 N ATOM 0 HA LYS A 9 31.588 41.410 25.526 1.00 0.00 H new ATOM 0 HB2 LYS A 9 29.767 43.404 26.851 1.00 0.00 H new ATOM 0 HB3 LYS A 9 29.960 41.718 27.289 1.00 0.00 H new ATOM 0 HG2 LYS A 9 32.190 43.782 27.379 1.00 0.00 H new ATOM 0 HG3 LYS A 9 31.209 43.320 28.756 1.00 0.00 H new ATOM 0 HD2 LYS A 9 32.024 40.963 28.515 1.00 0.00 H new ATOM 0 HD3 LYS A 9 33.046 41.471 27.185 1.00 0.00 H new ATOM 0 HE2 LYS A 9 34.296 42.995 28.710 1.00 0.00 H new ATOM 0 HE3 LYS A 9 33.258 42.528 30.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 35.300 41.240 30.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 33.968 40.225 29.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 34.973 40.677 28.461 1.00 0.00 H new ATOM 23 N PRO A 10 28.882 42.523 24.003 1.00 0.00 N ATOM 24 CA PRO A 10 28.027 42.064 22.948 1.00 0.00 C ATOM 25 C PRO A 10 28.732 41.930 21.641 1.00 0.00 C ATOM 26 O PRO A 10 29.935 42.171 21.551 1.00 0.00 O ATOM 27 CB PRO A 10 26.888 43.080 22.891 1.00 0.00 C ATOM 28 CG PRO A 10 27.189 44.132 23.970 1.00 0.00 C ATOM 29 CD PRO A 10 28.695 43.951 24.215 1.00 0.00 C ATOM 0 HA PRO A 10 27.663 41.056 23.148 1.00 0.00 H new ATOM 0 HB2 PRO A 10 26.828 43.541 21.905 1.00 0.00 H new ATOM 0 HB3 PRO A 10 25.928 42.598 23.076 1.00 0.00 H new ATOM 0 HG2 PRO A 10 26.954 45.140 23.628 1.00 0.00 H new ATOM 0 HG3 PRO A 10 26.609 43.959 24.876 1.00 0.00 H new ATOM 0 HD2 PRO A 10 29.292 44.545 23.523 1.00 0.00 H new ATOM 0 HD3 PRO A 10 28.981 44.252 25.223 1.00 0.00 H new ATOM 37 N GLY A 11 27.998 41.531 20.587 1.00 0.00 N ATOM 38 CA GLY A 11 28.563 41.042 19.368 1.00 0.00 C ATOM 39 C GLY A 11 28.046 39.666 19.116 1.00 0.00 C ATOM 40 O GLY A 11 28.606 38.681 19.596 1.00 0.00 O ATOM 0 H GLY A 11 26.978 41.549 20.583 1.00 0.00 H new ATOM 0 HA2 GLY A 11 28.301 41.701 18.540 1.00 0.00 H new ATOM 0 HA3 GLY A 11 29.651 41.030 19.434 1.00 0.00 H new ATOM 44 N ASP A 12 26.980 39.580 18.301 1.00 0.00 N ATOM 45 CA ASP A 12 26.128 38.467 18.019 1.00 0.00 C ATOM 46 C ASP A 12 26.875 37.251 17.590 1.00 0.00 C ATOM 47 O ASP A 12 26.823 36.242 18.291 1.00 0.00 O ATOM 48 CB ASP A 12 25.160 38.945 16.924 1.00 0.00 C ATOM 49 CG ASP A 12 24.120 37.922 16.488 1.00 0.00 C ATOM 50 OD1 ASP A 12 23.114 37.743 17.225 1.00 0.00 O ATOM 51 OD2 ASP A 12 24.272 37.340 15.381 1.00 0.00 O ATOM 0 H ASP A 12 26.681 40.400 17.774 1.00 0.00 H new ATOM 0 HA ASP A 12 25.602 38.159 18.923 1.00 0.00 H new ATOM 0 HB2 ASP A 12 24.643 39.835 17.282 1.00 0.00 H new ATOM 0 HB3 ASP A 12 25.742 39.243 16.052 1.00 0.00 H new ATOM 56 N THR A 13 27.635 37.281 16.481 1.00 0.00 N ATOM 57 CA THR A 13 28.585 36.253 16.190 1.00 0.00 C ATOM 58 C THR A 13 29.969 36.747 16.435 1.00 0.00 C ATOM 59 O THR A 13 30.279 37.919 16.226 1.00 0.00 O ATOM 60 CB THR A 13 28.566 35.691 14.799 1.00 0.00 C ATOM 61 OG1 THR A 13 28.558 36.692 13.792 1.00 0.00 O ATOM 62 CG2 THR A 13 27.301 34.832 14.631 1.00 0.00 C ATOM 0 H THR A 13 27.591 38.022 15.782 1.00 0.00 H new ATOM 0 HA THR A 13 28.284 35.446 16.858 1.00 0.00 H new ATOM 0 HB THR A 13 29.479 35.108 14.677 1.00 0.00 H new ATOM 0 HG1 THR A 13 28.547 36.267 12.909 1.00 0.00 H new ATOM 0 HG21 THR A 13 27.274 34.417 13.624 1.00 0.00 H new ATOM 0 HG22 THR A 13 27.313 34.020 15.358 1.00 0.00 H new ATOM 0 HG23 THR A 13 26.418 35.450 14.792 1.00 0.00 H new ATOM 70 N PHE A 14 30.872 35.820 16.801 1.00 0.00 N ATOM 71 CA PHE A 14 32.282 36.037 16.707 1.00 0.00 C ATOM 72 C PHE A 14 32.952 34.739 16.411 1.00 0.00 C ATOM 73 O PHE A 14 32.367 33.659 16.482 1.00 0.00 O ATOM 74 CB PHE A 14 32.922 36.801 17.879 1.00 0.00 C ATOM 75 CG PHE A 14 32.587 36.234 19.215 1.00 0.00 C ATOM 76 CD1 PHE A 14 33.275 35.144 19.694 1.00 0.00 C ATOM 77 CD2 PHE A 14 31.637 36.834 20.007 1.00 0.00 C ATOM 78 CE1 PHE A 14 33.032 34.669 20.961 1.00 0.00 C ATOM 79 CE2 PHE A 14 31.390 36.360 21.274 1.00 0.00 C ATOM 80 CZ PHE A 14 32.088 35.278 21.755 1.00 0.00 C ATOM 0 H PHE A 14 30.618 34.903 17.169 1.00 0.00 H new ATOM 0 HA PHE A 14 32.441 36.729 15.880 1.00 0.00 H new ATOM 0 HB2 PHE A 14 34.005 36.800 17.754 1.00 0.00 H new ATOM 0 HB3 PHE A 14 32.598 37.841 17.844 1.00 0.00 H new ATOM 0 HD1 PHE A 14 34.011 34.658 19.071 1.00 0.00 H new ATOM 0 HD2 PHE A 14 31.082 37.681 19.632 1.00 0.00 H new ATOM 0 HE1 PHE A 14 33.582 33.818 21.333 1.00 0.00 H new ATOM 0 HE2 PHE A 14 30.646 36.839 21.893 1.00 0.00 H new ATOM 0 HZ PHE A 14 31.896 34.908 22.751 1.00 0.00 H new ATOM 90 N GLU A 15 34.220 34.843 15.976 1.00 0.00 N ATOM 91 CA GLU A 15 35.004 33.795 15.400 1.00 0.00 C ATOM 92 C GLU A 15 36.270 33.722 16.183 1.00 0.00 C ATOM 93 O GLU A 15 36.784 34.738 16.649 1.00 0.00 O ATOM 94 CB GLU A 15 35.298 34.113 13.924 1.00 0.00 C ATOM 95 CG GLU A 15 34.069 34.511 13.105 1.00 0.00 C ATOM 96 CD GLU A 15 34.417 35.336 11.874 1.00 0.00 C ATOM 97 OE1 GLU A 15 35.149 36.349 12.027 1.00 0.00 O ATOM 98 OE2 GLU A 15 33.947 34.990 10.756 1.00 0.00 O ATOM 0 H GLU A 15 34.733 35.723 16.031 1.00 0.00 H new ATOM 0 HA GLU A 15 34.477 32.841 15.434 1.00 0.00 H new ATOM 0 HB2 GLU A 15 36.027 34.922 13.878 1.00 0.00 H new ATOM 0 HB3 GLU A 15 35.760 33.240 13.462 1.00 0.00 H new ATOM 0 HG2 GLU A 15 33.539 33.611 12.794 1.00 0.00 H new ATOM 0 HG3 GLU A 15 33.387 35.080 13.737 1.00 0.00 H new ATOM 105 N VAL A 16 36.807 32.510 16.412 1.00 0.00 N ATOM 106 CA VAL A 16 37.934 32.278 17.259 1.00 0.00 C ATOM 107 C VAL A 16 38.890 31.373 16.562 1.00 0.00 C ATOM 108 O VAL A 16 38.600 30.198 16.340 1.00 0.00 O ATOM 109 CB VAL A 16 37.460 31.739 18.577 1.00 0.00 C ATOM 110 CG1 VAL A 16 38.547 31.013 19.387 1.00 0.00 C ATOM 111 CG2 VAL A 16 36.918 32.891 19.440 1.00 0.00 C ATOM 0 H VAL A 16 36.440 31.657 15.989 1.00 0.00 H new ATOM 0 HA VAL A 16 38.467 33.205 17.469 1.00 0.00 H new ATOM 0 HB VAL A 16 36.689 31.007 18.336 1.00 0.00 H new ATOM 0 HG11 VAL A 16 38.123 30.654 20.325 1.00 0.00 H new ATOM 0 HG12 VAL A 16 38.925 30.167 18.813 1.00 0.00 H new ATOM 0 HG13 VAL A 16 39.365 31.702 19.598 1.00 0.00 H new ATOM 0 HG21 VAL A 16 36.574 32.498 20.397 1.00 0.00 H new ATOM 0 HG22 VAL A 16 37.709 33.621 19.611 1.00 0.00 H new ATOM 0 HG23 VAL A 16 36.086 33.371 18.925 1.00 0.00 H new ATOM 121 N GLU A 17 40.074 31.885 16.181 1.00 0.00 N ATOM 122 CA GLU A 17 41.193 31.135 15.698 1.00 0.00 C ATOM 123 C GLU A 17 42.192 31.037 16.800 1.00 0.00 C ATOM 124 O GLU A 17 42.992 31.943 17.022 1.00 0.00 O ATOM 125 CB GLU A 17 41.883 31.790 14.489 1.00 0.00 C ATOM 126 CG GLU A 17 41.167 31.543 13.160 1.00 0.00 C ATOM 127 CD GLU A 17 41.708 32.427 12.046 1.00 0.00 C ATOM 128 OE1 GLU A 17 42.793 32.138 11.476 1.00 0.00 O ATOM 129 OE2 GLU A 17 41.042 33.450 11.731 1.00 0.00 O ATOM 0 H GLU A 17 40.261 32.887 16.212 1.00 0.00 H new ATOM 0 HA GLU A 17 40.822 30.161 15.378 1.00 0.00 H new ATOM 0 HB2 GLU A 17 41.951 32.864 14.660 1.00 0.00 H new ATOM 0 HB3 GLU A 17 42.903 31.413 14.417 1.00 0.00 H new ATOM 0 HG2 GLU A 17 41.278 30.496 12.878 1.00 0.00 H new ATOM 0 HG3 GLU A 17 40.100 31.728 13.284 1.00 0.00 H new ATOM 136 N LEU A 18 42.134 29.938 17.573 1.00 0.00 N ATOM 137 CA LEU A 18 42.824 29.794 18.817 1.00 0.00 C ATOM 138 C LEU A 18 43.718 28.602 18.867 1.00 0.00 C ATOM 139 O LEU A 18 43.345 27.487 18.505 1.00 0.00 O ATOM 140 CB LEU A 18 41.765 29.646 19.922 1.00 0.00 C ATOM 141 CG LEU A 18 42.285 29.563 21.367 1.00 0.00 C ATOM 142 CD1 LEU A 18 42.821 30.918 21.860 1.00 0.00 C ATOM 143 CD2 LEU A 18 41.133 29.064 22.257 1.00 0.00 C ATOM 0 H LEU A 18 41.584 29.117 17.321 1.00 0.00 H new ATOM 0 HA LEU A 18 43.456 30.673 18.947 1.00 0.00 H new ATOM 0 HB2 LEU A 18 41.081 30.492 19.854 1.00 0.00 H new ATOM 0 HB3 LEU A 18 41.182 28.748 19.717 1.00 0.00 H new ATOM 0 HG LEU A 18 43.124 28.869 21.413 1.00 0.00 H new ATOM 0 HD11 LEU A 18 43.179 30.817 22.885 1.00 0.00 H new ATOM 0 HD12 LEU A 18 43.642 31.239 21.219 1.00 0.00 H new ATOM 0 HD13 LEU A 18 42.023 31.659 21.826 1.00 0.00 H new ATOM 0 HD21 LEU A 18 41.475 28.995 23.290 1.00 0.00 H new ATOM 0 HD22 LEU A 18 40.298 29.762 22.196 1.00 0.00 H new ATOM 0 HD23 LEU A 18 40.809 28.081 21.916 1.00 0.00 H new ATOM 155 N ALA A 19 44.955 28.774 19.364 1.00 0.00 N ATOM 156 CA ALA A 19 45.932 27.744 19.546 1.00 0.00 C ATOM 157 C ALA A 19 45.974 27.316 20.972 1.00 0.00 C ATOM 158 O ALA A 19 45.927 28.146 21.880 1.00 0.00 O ATOM 159 CB ALA A 19 47.316 28.267 19.123 1.00 0.00 C ATOM 0 H ALA A 19 45.295 29.690 19.657 1.00 0.00 H new ATOM 0 HA ALA A 19 45.660 26.887 18.930 1.00 0.00 H new ATOM 0 HB1 ALA A 19 48.060 27.482 19.262 1.00 0.00 H new ATOM 0 HB2 ALA A 19 47.289 28.560 18.073 1.00 0.00 H new ATOM 0 HB3 ALA A 19 47.581 29.130 19.734 1.00 0.00 H new ATOM 165 N LYS A 20 46.059 26.002 21.242 1.00 0.00 N ATOM 166 CA LYS A 20 46.090 25.494 22.579 1.00 0.00 C ATOM 167 C LYS A 20 47.332 25.799 23.345 1.00 0.00 C ATOM 168 O LYS A 20 48.372 26.153 22.793 1.00 0.00 O ATOM 169 CB LYS A 20 45.828 23.979 22.602 1.00 0.00 C ATOM 170 CG LYS A 20 46.877 23.120 21.894 1.00 0.00 C ATOM 171 CD LYS A 20 46.684 21.623 22.139 1.00 0.00 C ATOM 172 CE LYS A 20 45.390 21.039 21.570 1.00 0.00 C ATOM 173 NZ LYS A 20 45.238 19.604 21.898 1.00 0.00 N ATOM 0 H LYS A 20 46.107 25.281 20.522 1.00 0.00 H new ATOM 0 HA LYS A 20 45.287 26.027 23.087 1.00 0.00 H new ATOM 0 HB2 LYS A 20 45.759 23.655 23.641 1.00 0.00 H new ATOM 0 HB3 LYS A 20 44.858 23.788 22.144 1.00 0.00 H new ATOM 0 HG2 LYS A 20 46.837 23.316 20.822 1.00 0.00 H new ATOM 0 HG3 LYS A 20 47.870 23.414 22.235 1.00 0.00 H new ATOM 0 HD2 LYS A 20 47.529 21.087 21.706 1.00 0.00 H new ATOM 0 HD3 LYS A 20 46.707 21.440 23.213 1.00 0.00 H new ATOM 0 HE2 LYS A 20 44.538 21.593 21.964 1.00 0.00 H new ATOM 0 HE3 LYS A 20 45.380 21.166 20.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 44.412 19.219 21.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 46.092 19.089 21.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 45.102 19.495 22.923 1.00 0.00 H new ATOM 187 N THR A 21 47.260 25.676 24.682 1.00 0.00 N ATOM 188 CA THR A 21 48.376 25.872 25.556 1.00 0.00 C ATOM 189 C THR A 21 48.442 24.711 26.488 1.00 0.00 C ATOM 190 O THR A 21 47.533 24.512 27.292 1.00 0.00 O ATOM 191 CB THR A 21 48.332 27.130 26.370 1.00 0.00 C ATOM 192 OG1 THR A 21 47.130 27.278 27.109 1.00 0.00 O ATOM 193 CG2 THR A 21 48.445 28.345 25.432 1.00 0.00 C ATOM 0 H THR A 21 46.399 25.433 25.171 1.00 0.00 H new ATOM 0 HA THR A 21 49.254 25.960 24.916 1.00 0.00 H new ATOM 0 HB THR A 21 49.162 27.069 27.074 1.00 0.00 H new ATOM 0 HG1 THR A 21 46.852 26.406 27.460 1.00 0.00 H new ATOM 0 HG21 THR A 21 48.413 29.262 26.020 1.00 0.00 H new ATOM 0 HG22 THR A 21 49.387 28.296 24.885 1.00 0.00 H new ATOM 0 HG23 THR A 21 47.615 28.338 24.726 1.00 0.00 H new ATOM 201 N ASP A 22 49.509 23.894 26.409 1.00 0.00 N ATOM 202 CA ASP A 22 49.730 22.708 27.177 1.00 0.00 C ATOM 203 C ASP A 22 48.580 21.762 27.168 1.00 0.00 C ATOM 204 O ASP A 22 47.973 21.447 28.190 1.00 0.00 O ATOM 205 CB ASP A 22 50.268 23.071 28.572 1.00 0.00 C ATOM 206 CG ASP A 22 50.776 21.872 29.358 1.00 0.00 C ATOM 207 OD1 ASP A 22 51.528 21.040 28.781 1.00 0.00 O ATOM 208 OD2 ASP A 22 50.455 21.750 30.570 1.00 0.00 O ATOM 0 H ASP A 22 50.273 24.078 25.759 1.00 0.00 H new ATOM 0 HA ASP A 22 50.510 22.127 26.685 1.00 0.00 H new ATOM 0 HB2 ASP A 22 51.077 23.794 28.464 1.00 0.00 H new ATOM 0 HB3 ASP A 22 49.478 23.560 29.141 1.00 0.00 H new ATOM 213 N GLY A 23 48.185 21.285 25.974 1.00 0.00 N ATOM 214 CA GLY A 23 47.102 20.365 25.813 1.00 0.00 C ATOM 215 C GLY A 23 45.742 20.972 25.760 1.00 0.00 C ATOM 216 O GLY A 23 44.862 20.475 25.060 1.00 0.00 O ATOM 0 H GLY A 23 48.632 21.547 25.095 1.00 0.00 H new ATOM 0 HA2 GLY A 23 47.263 19.799 24.896 1.00 0.00 H new ATOM 0 HA3 GLY A 23 47.130 19.652 26.637 1.00 0.00 H new ATOM 220 N SER A 24 45.511 22.043 26.540 1.00 0.00 N ATOM 221 CA SER A 24 44.220 22.544 26.896 1.00 0.00 C ATOM 222 C SER A 24 43.890 23.805 26.173 1.00 0.00 C ATOM 223 O SER A 24 44.755 24.623 25.862 1.00 0.00 O ATOM 224 CB SER A 24 44.127 22.859 28.399 1.00 0.00 C ATOM 225 OG SER A 24 44.340 21.698 29.190 1.00 0.00 O ATOM 0 H SER A 24 46.270 22.591 26.945 1.00 0.00 H new ATOM 0 HA SER A 24 43.520 21.755 26.622 1.00 0.00 H new ATOM 0 HB2 SER A 24 44.865 23.618 28.659 1.00 0.00 H new ATOM 0 HB3 SER A 24 43.146 23.278 28.624 1.00 0.00 H new ATOM 0 HG SER A 24 44.276 21.933 30.139 1.00 0.00 H new ATOM 231 N LEU A 25 42.592 24.031 25.904 1.00 0.00 N ATOM 232 CA LEU A 25 42.092 25.252 25.353 1.00 0.00 C ATOM 233 C LEU A 25 41.608 26.102 26.477 1.00 0.00 C ATOM 234 O LEU A 25 42.077 27.222 26.672 1.00 0.00 O ATOM 235 CB LEU A 25 40.972 25.038 24.321 1.00 0.00 C ATOM 236 CG LEU A 25 41.393 24.496 22.944 1.00 0.00 C ATOM 237 CD1 LEU A 25 42.348 25.440 22.194 1.00 0.00 C ATOM 238 CD2 LEU A 25 41.934 23.057 22.964 1.00 0.00 C ATOM 0 H LEU A 25 41.864 23.338 26.077 1.00 0.00 H new ATOM 0 HA LEU A 25 42.903 25.739 24.812 1.00 0.00 H new ATOM 0 HB2 LEU A 25 40.243 24.350 24.749 1.00 0.00 H new ATOM 0 HB3 LEU A 25 40.462 25.990 24.170 1.00 0.00 H new ATOM 0 HG LEU A 25 40.459 24.456 22.383 1.00 0.00 H new ATOM 0 HD11 LEU A 25 42.609 25.003 21.230 1.00 0.00 H new ATOM 0 HD12 LEU A 25 41.860 26.402 22.036 1.00 0.00 H new ATOM 0 HD13 LEU A 25 43.253 25.585 22.783 1.00 0.00 H new ATOM 0 HD21 LEU A 25 42.206 22.757 21.952 1.00 0.00 H new ATOM 0 HD22 LEU A 25 42.813 23.008 23.606 1.00 0.00 H new ATOM 0 HD23 LEU A 25 41.166 22.385 23.348 1.00 0.00 H new ATOM 250 N GLY A 26 40.665 25.611 27.302 1.00 0.00 N ATOM 251 CA GLY A 26 40.222 26.251 28.501 1.00 0.00 C ATOM 252 C GLY A 26 38.749 26.472 28.535 1.00 0.00 C ATOM 253 O GLY A 26 38.272 27.353 29.248 1.00 0.00 O ATOM 0 H GLY A 26 40.190 24.726 27.124 1.00 0.00 H new ATOM 0 HA2 GLY A 26 40.512 25.644 29.358 1.00 0.00 H new ATOM 0 HA3 GLY A 26 40.730 27.210 28.603 1.00 0.00 H new ATOM 257 N ILE A 27 37.980 25.678 27.768 1.00 0.00 N ATOM 258 CA ILE A 27 36.562 25.795 27.627 1.00 0.00 C ATOM 259 C ILE A 27 35.889 24.586 28.180 1.00 0.00 C ATOM 260 O ILE A 27 36.177 23.455 27.793 1.00 0.00 O ATOM 261 CB ILE A 27 36.159 26.003 26.198 1.00 0.00 C ATOM 262 CG1 ILE A 27 37.061 25.248 25.208 1.00 0.00 C ATOM 263 CG2 ILE A 27 36.176 27.519 25.934 1.00 0.00 C ATOM 264 CD1 ILE A 27 36.571 25.312 23.762 1.00 0.00 C ATOM 0 H ILE A 27 38.370 24.913 27.217 1.00 0.00 H new ATOM 0 HA ILE A 27 36.246 26.673 28.190 1.00 0.00 H new ATOM 0 HB ILE A 27 35.161 25.594 26.039 1.00 0.00 H new ATOM 0 HG12 ILE A 27 38.068 25.661 25.260 1.00 0.00 H new ATOM 0 HG13 ILE A 27 37.128 24.204 25.514 1.00 0.00 H new ATOM 0 HG21 ILE A 27 35.887 27.712 24.901 1.00 0.00 H new ATOM 0 HG22 ILE A 27 35.474 28.013 26.605 1.00 0.00 H new ATOM 0 HG23 ILE A 27 37.179 27.908 26.109 1.00 0.00 H new ATOM 0 HD11 ILE A 27 37.256 24.758 23.121 1.00 0.00 H new ATOM 0 HD12 ILE A 27 35.576 24.872 23.695 1.00 0.00 H new ATOM 0 HD13 ILE A 27 36.531 26.352 23.437 1.00 0.00 H new ATOM 276 N SER A 28 34.941 24.785 29.113 1.00 0.00 N ATOM 277 CA SER A 28 34.070 23.757 29.591 1.00 0.00 C ATOM 278 C SER A 28 32.682 24.058 29.144 1.00 0.00 C ATOM 279 O SER A 28 32.188 25.172 29.319 1.00 0.00 O ATOM 280 CB SER A 28 34.111 23.613 31.123 1.00 0.00 C ATOM 281 OG SER A 28 33.387 22.471 31.559 1.00 0.00 O ATOM 0 H SER A 28 34.775 25.692 29.549 1.00 0.00 H new ATOM 0 HA SER A 28 34.410 22.808 29.177 1.00 0.00 H new ATOM 0 HB2 SER A 28 35.147 23.537 31.455 1.00 0.00 H new ATOM 0 HB3 SER A 28 33.693 24.508 31.585 1.00 0.00 H new ATOM 0 HG SER A 28 33.434 22.407 32.536 1.00 0.00 H new ATOM 287 N VAL A 29 32.006 23.082 28.513 1.00 0.00 N ATOM 288 CA VAL A 29 30.709 23.238 27.931 1.00 0.00 C ATOM 289 C VAL A 29 29.664 22.504 28.698 1.00 0.00 C ATOM 290 O VAL A 29 29.940 21.639 29.527 1.00 0.00 O ATOM 291 CB VAL A 29 30.663 22.834 26.487 1.00 0.00 C ATOM 292 CG1 VAL A 29 31.542 23.793 25.667 1.00 0.00 C ATOM 293 CG2 VAL A 29 31.104 21.374 26.282 1.00 0.00 C ATOM 0 H VAL A 29 32.381 22.140 28.403 1.00 0.00 H new ATOM 0 HA VAL A 29 30.495 24.306 27.981 1.00 0.00 H new ATOM 0 HB VAL A 29 29.631 22.899 26.143 1.00 0.00 H new ATOM 0 HG11 VAL A 29 31.513 23.505 24.616 1.00 0.00 H new ATOM 0 HG12 VAL A 29 31.168 24.811 25.774 1.00 0.00 H new ATOM 0 HG13 VAL A 29 32.569 23.744 26.028 1.00 0.00 H new ATOM 0 HG21 VAL A 29 31.055 21.125 25.222 1.00 0.00 H new ATOM 0 HG22 VAL A 29 32.127 21.250 26.637 1.00 0.00 H new ATOM 0 HG23 VAL A 29 30.443 20.712 26.841 1.00 0.00 H new ATOM 303 N THR A 30 28.388 22.851 28.452 1.00 0.00 N ATOM 304 CA THR A 30 27.244 22.172 28.978 1.00 0.00 C ATOM 305 C THR A 30 26.280 21.961 27.862 1.00 0.00 C ATOM 306 O THR A 30 26.389 22.561 26.793 1.00 0.00 O ATOM 307 CB THR A 30 26.592 22.909 30.110 1.00 0.00 C ATOM 308 OG1 THR A 30 25.747 22.086 30.900 1.00 0.00 O ATOM 309 CG2 THR A 30 25.803 24.153 29.666 1.00 0.00 C ATOM 0 H THR A 30 28.142 23.643 27.858 1.00 0.00 H new ATOM 0 HA THR A 30 27.570 21.220 29.396 1.00 0.00 H new ATOM 0 HB THR A 30 27.434 23.237 30.719 1.00 0.00 H new ATOM 0 HG1 THR A 30 25.352 22.619 31.621 1.00 0.00 H new ATOM 0 HG21 THR A 30 25.360 24.633 30.538 1.00 0.00 H new ATOM 0 HG22 THR A 30 26.476 24.852 29.169 1.00 0.00 H new ATOM 0 HG23 THR A 30 25.014 23.856 28.976 1.00 0.00 H new ATOM 317 N GLY A 31 25.287 21.076 28.059 1.00 0.00 N ATOM 318 CA GLY A 31 24.187 20.889 27.165 1.00 0.00 C ATOM 319 C GLY A 31 24.374 19.728 26.250 1.00 0.00 C ATOM 320 O GLY A 31 25.081 18.770 26.560 1.00 0.00 O ATOM 0 H GLY A 31 25.249 20.465 28.875 1.00 0.00 H new ATOM 0 HA2 GLY A 31 23.275 20.745 27.744 1.00 0.00 H new ATOM 0 HA3 GLY A 31 24.049 21.793 26.573 1.00 0.00 H new ATOM 324 N GLY A 32 23.700 19.784 25.087 1.00 0.00 N ATOM 325 CA GLY A 32 23.563 18.703 24.161 1.00 0.00 C ATOM 326 C GLY A 32 22.237 18.044 24.323 1.00 0.00 C ATOM 327 O GLY A 32 21.716 17.937 25.432 1.00 0.00 O ATOM 0 H GLY A 32 23.224 20.631 24.776 1.00 0.00 H new ATOM 0 HA2 GLY A 32 23.670 19.074 23.142 1.00 0.00 H new ATOM 0 HA3 GLY A 32 24.359 17.976 24.321 1.00 0.00 H new ATOM 331 N VAL A 33 21.634 17.550 23.226 1.00 0.00 N ATOM 332 CA VAL A 33 20.302 17.030 23.205 1.00 0.00 C ATOM 333 C VAL A 33 20.056 15.889 24.130 1.00 0.00 C ATOM 334 O VAL A 33 18.972 15.726 24.688 1.00 0.00 O ATOM 335 CB VAL A 33 19.854 16.600 21.839 1.00 0.00 C ATOM 336 CG1 VAL A 33 18.335 16.809 21.721 1.00 0.00 C ATOM 337 CG2 VAL A 33 20.561 17.394 20.727 1.00 0.00 C ATOM 0 H VAL A 33 22.094 17.512 22.316 1.00 0.00 H new ATOM 0 HA VAL A 33 19.721 17.887 23.546 1.00 0.00 H new ATOM 0 HB VAL A 33 20.111 15.548 21.715 1.00 0.00 H new ATOM 0 HG11 VAL A 33 18.001 16.499 20.731 1.00 0.00 H new ATOM 0 HG12 VAL A 33 17.826 16.214 22.479 1.00 0.00 H new ATOM 0 HG13 VAL A 33 18.100 17.863 21.870 1.00 0.00 H new ATOM 0 HG21 VAL A 33 20.208 17.051 19.754 1.00 0.00 H new ATOM 0 HG22 VAL A 33 20.339 18.455 20.840 1.00 0.00 H new ATOM 0 HG23 VAL A 33 21.638 17.239 20.797 1.00 0.00 H new ATOM 347 N ASN A 34 21.075 15.033 24.327 1.00 0.00 N ATOM 348 CA ASN A 34 20.994 13.807 25.060 1.00 0.00 C ATOM 349 C ASN A 34 20.954 13.963 26.541 1.00 0.00 C ATOM 350 O ASN A 34 20.517 13.051 27.241 1.00 0.00 O ATOM 351 CB ASN A 34 22.161 12.892 24.649 1.00 0.00 C ATOM 352 CG ASN A 34 21.770 11.421 24.640 1.00 0.00 C ATOM 353 OD1 ASN A 34 21.504 10.857 23.580 1.00 0.00 O ATOM 354 ND2 ASN A 34 21.726 10.764 25.830 1.00 0.00 N ATOM 0 H ASN A 34 22.008 15.207 23.953 1.00 0.00 H new ATOM 0 HA ASN A 34 20.035 13.360 24.799 1.00 0.00 H new ATOM 0 HB2 ASN A 34 22.511 13.178 23.657 1.00 0.00 H new ATOM 0 HB3 ASN A 34 22.994 13.039 25.336 1.00 0.00 H new ATOM 0 HD21 ASN A 34 21.467 9.778 25.859 1.00 0.00 H new ATOM 0 HD22 ASN A 34 21.952 11.257 26.694 1.00 0.00 H new ATOM 361 N THR A 35 21.387 15.106 27.102 1.00 0.00 N ATOM 362 CA THR A 35 21.260 15.357 28.503 1.00 0.00 C ATOM 363 C THR A 35 19.997 16.120 28.711 1.00 0.00 C ATOM 364 O THR A 35 19.421 16.679 27.778 1.00 0.00 O ATOM 365 CB THR A 35 22.459 16.006 29.130 1.00 0.00 C ATOM 366 OG1 THR A 35 22.358 16.117 30.541 1.00 0.00 O ATOM 367 CG2 THR A 35 22.715 17.418 28.574 1.00 0.00 C ATOM 0 H THR A 35 21.829 15.862 26.579 1.00 0.00 H new ATOM 0 HA THR A 35 21.210 14.403 29.028 1.00 0.00 H new ATOM 0 HB THR A 35 23.287 15.344 28.877 1.00 0.00 H new ATOM 0 HG1 THR A 35 23.166 16.545 30.894 1.00 0.00 H new ATOM 0 HG21 THR A 35 23.593 17.846 29.058 1.00 0.00 H new ATOM 0 HG22 THR A 35 22.886 17.360 27.499 1.00 0.00 H new ATOM 0 HG23 THR A 35 21.848 18.049 28.770 1.00 0.00 H new ATOM 375 N SER A 36 19.473 16.163 29.948 1.00 0.00 N ATOM 376 CA SER A 36 18.164 16.648 30.258 1.00 0.00 C ATOM 377 C SER A 36 18.079 18.131 30.371 1.00 0.00 C ATOM 378 O SER A 36 17.441 18.685 31.266 1.00 0.00 O ATOM 379 CB SER A 36 17.602 15.969 31.518 1.00 0.00 C ATOM 380 OG SER A 36 18.545 15.960 32.581 1.00 0.00 O ATOM 0 H SER A 36 19.986 15.845 30.771 1.00 0.00 H new ATOM 0 HA SER A 36 17.543 16.378 29.404 1.00 0.00 H new ATOM 0 HB2 SER A 36 16.699 16.489 31.838 1.00 0.00 H new ATOM 0 HB3 SER A 36 17.313 14.945 31.280 1.00 0.00 H new ATOM 0 HG SER A 36 18.151 15.522 33.364 1.00 0.00 H new ATOM 386 N VAL A 37 18.661 18.857 29.401 1.00 0.00 N ATOM 387 CA VAL A 37 18.560 20.278 29.272 1.00 0.00 C ATOM 388 C VAL A 37 17.416 20.633 28.386 1.00 0.00 C ATOM 389 O VAL A 37 17.223 20.074 27.308 1.00 0.00 O ATOM 390 CB VAL A 37 19.813 20.937 28.776 1.00 0.00 C ATOM 391 CG1 VAL A 37 20.912 20.761 29.837 1.00 0.00 C ATOM 392 CG2 VAL A 37 20.289 20.405 27.414 1.00 0.00 C ATOM 0 H VAL A 37 19.231 18.432 28.670 1.00 0.00 H new ATOM 0 HA VAL A 37 18.393 20.659 30.280 1.00 0.00 H new ATOM 0 HB VAL A 37 19.591 21.992 28.618 1.00 0.00 H new ATOM 0 HG11 VAL A 37 21.831 21.235 29.491 1.00 0.00 H new ATOM 0 HG12 VAL A 37 20.594 21.224 30.771 1.00 0.00 H new ATOM 0 HG13 VAL A 37 21.092 19.699 30.002 1.00 0.00 H new ATOM 0 HG21 VAL A 37 21.199 20.926 27.118 1.00 0.00 H new ATOM 0 HG22 VAL A 37 20.491 19.337 27.491 1.00 0.00 H new ATOM 0 HG23 VAL A 37 19.514 20.574 26.666 1.00 0.00 H new ATOM 402 N ARG A 38 16.594 21.609 28.813 1.00 0.00 N ATOM 403 CA ARG A 38 15.614 22.245 27.989 1.00 0.00 C ATOM 404 C ARG A 38 16.269 23.164 27.016 1.00 0.00 C ATOM 405 O ARG A 38 15.796 23.364 25.898 1.00 0.00 O ATOM 406 CB ARG A 38 14.569 22.947 28.872 1.00 0.00 C ATOM 407 CG ARG A 38 13.201 23.195 28.235 1.00 0.00 C ATOM 408 CD ARG A 38 13.073 24.457 27.380 1.00 0.00 C ATOM 409 NE ARG A 38 11.669 24.471 26.881 1.00 0.00 N ATOM 410 CZ ARG A 38 11.275 25.072 25.720 1.00 0.00 C ATOM 411 NH1 ARG A 38 12.127 25.759 24.904 1.00 0.00 N ATOM 412 NH2 ARG A 38 9.962 25.036 25.346 1.00 0.00 N ATOM 0 H ARG A 38 16.613 21.968 29.768 1.00 0.00 H new ATOM 0 HA ARG A 38 15.085 21.498 27.398 1.00 0.00 H new ATOM 0 HB2 ARG A 38 14.424 22.349 29.772 1.00 0.00 H new ATOM 0 HB3 ARG A 38 14.978 23.906 29.189 1.00 0.00 H new ATOM 0 HG2 ARG A 38 12.951 22.334 27.615 1.00 0.00 H new ATOM 0 HG3 ARG A 38 12.457 23.243 29.030 1.00 0.00 H new ATOM 0 HD2 ARG A 38 13.288 25.350 27.967 1.00 0.00 H new ATOM 0 HD3 ARG A 38 13.782 24.442 26.552 1.00 0.00 H new ATOM 0 HE ARG A 38 10.958 24.002 27.442 1.00 0.00 H new ATOM 0 HH11 ARG A 38 13.113 25.843 25.151 1.00 0.00 H new ATOM 0 HH12 ARG A 38 11.777 26.189 24.047 1.00 0.00 H new ATOM 0 HH21 ARG A 38 9.277 24.561 25.934 1.00 0.00 H new ATOM 0 HH22 ARG A 38 9.666 25.485 24.479 1.00 0.00 H new ATOM 426 N HIS A 39 17.429 23.716 27.415 1.00 0.00 N ATOM 427 CA HIS A 39 18.292 24.596 26.689 1.00 0.00 C ATOM 428 C HIS A 39 18.552 24.254 25.263 1.00 0.00 C ATOM 429 O HIS A 39 18.563 25.143 24.414 1.00 0.00 O ATOM 430 CB HIS A 39 19.656 24.757 27.380 1.00 0.00 C ATOM 431 CG HIS A 39 19.609 25.100 28.839 1.00 0.00 C ATOM 432 ND1 HIS A 39 20.386 24.492 29.803 1.00 0.00 N ATOM 433 CD2 HIS A 39 18.925 26.082 29.486 1.00 0.00 C ATOM 434 CE1 HIS A 39 20.123 25.115 30.983 1.00 0.00 C ATOM 435 NE2 HIS A 39 19.230 26.077 30.832 1.00 0.00 N ATOM 0 H HIS A 39 17.799 23.523 28.346 1.00 0.00 H new ATOM 0 HA HIS A 39 17.718 25.523 26.690 1.00 0.00 H new ATOM 0 HB2 HIS A 39 20.215 23.828 27.262 1.00 0.00 H new ATOM 0 HB3 HIS A 39 20.216 25.534 26.861 1.00 0.00 H new ATOM 0 HD2 HIS A 39 18.239 26.769 29.013 1.00 0.00 H new ATOM 0 HE1 HIS A 39 20.585 24.856 31.924 1.00 0.00 H new ATOM 0 HE2 HIS A 39 18.848 26.686 31.556 1.00 0.00 H new ATOM 443 N GLY A 40 18.774 22.968 24.933 1.00 0.00 N ATOM 444 CA GLY A 40 18.825 22.473 23.592 1.00 0.00 C ATOM 445 C GLY A 40 19.897 23.041 22.728 1.00 0.00 C ATOM 446 O GLY A 40 19.632 23.669 21.704 1.00 0.00 O ATOM 0 H GLY A 40 18.925 22.241 25.633 1.00 0.00 H new ATOM 0 HA2 GLY A 40 18.951 21.391 23.629 1.00 0.00 H new ATOM 0 HA3 GLY A 40 17.863 22.666 23.118 1.00 0.00 H new ATOM 450 N GLY A 41 21.167 22.839 23.121 1.00 0.00 N ATOM 451 CA GLY A 41 22.288 23.367 22.408 1.00 0.00 C ATOM 452 C GLY A 41 23.511 23.111 23.220 1.00 0.00 C ATOM 453 O GLY A 41 23.421 22.561 24.317 1.00 0.00 O ATOM 0 H GLY A 41 21.420 22.299 23.949 1.00 0.00 H new ATOM 0 HA2 GLY A 41 22.374 22.895 21.429 1.00 0.00 H new ATOM 0 HA3 GLY A 41 22.161 24.436 22.236 1.00 0.00 H new ATOM 457 N ILE A 42 24.683 23.512 22.696 1.00 0.00 N ATOM 458 CA ILE A 42 25.941 23.417 23.369 1.00 0.00 C ATOM 459 C ILE A 42 26.288 24.783 23.855 1.00 0.00 C ATOM 460 O ILE A 42 26.375 25.722 23.065 1.00 0.00 O ATOM 461 CB ILE A 42 27.004 22.872 22.462 1.00 0.00 C ATOM 462 CG1 ILE A 42 26.591 21.540 21.811 1.00 0.00 C ATOM 463 CG2 ILE A 42 28.351 22.721 23.189 1.00 0.00 C ATOM 464 CD1 ILE A 42 26.393 20.376 22.780 1.00 0.00 C ATOM 0 H ILE A 42 24.757 23.920 21.764 1.00 0.00 H new ATOM 0 HA ILE A 42 25.872 22.724 24.208 1.00 0.00 H new ATOM 0 HB ILE A 42 27.128 23.604 21.664 1.00 0.00 H new ATOM 0 HG12 ILE A 42 25.663 21.695 21.261 1.00 0.00 H new ATOM 0 HG13 ILE A 42 27.351 21.259 21.082 1.00 0.00 H new ATOM 0 HG21 ILE A 42 29.095 22.324 22.498 1.00 0.00 H new ATOM 0 HG22 ILE A 42 28.679 23.694 23.554 1.00 0.00 H new ATOM 0 HG23 ILE A 42 28.236 22.038 24.031 1.00 0.00 H new ATOM 0 HD11 ILE A 42 26.104 19.484 22.224 1.00 0.00 H new ATOM 0 HD12 ILE A 42 27.324 20.185 23.314 1.00 0.00 H new ATOM 0 HD13 ILE A 42 25.610 20.627 23.495 1.00 0.00 H new ATOM 476 N TYR A 43 26.457 24.973 25.176 1.00 0.00 N ATOM 477 CA TYR A 43 26.615 26.271 25.754 1.00 0.00 C ATOM 478 C TYR A 43 27.830 26.314 26.616 1.00 0.00 C ATOM 479 O TYR A 43 28.270 25.294 27.142 1.00 0.00 O ATOM 480 CB TYR A 43 25.406 26.685 26.610 1.00 0.00 C ATOM 481 CG TYR A 43 24.149 26.703 25.809 1.00 0.00 C ATOM 482 CD1 TYR A 43 23.810 27.804 25.059 1.00 0.00 C ATOM 483 CD2 TYR A 43 23.312 25.613 25.810 1.00 0.00 C ATOM 484 CE1 TYR A 43 22.658 27.815 24.307 1.00 0.00 C ATOM 485 CE2 TYR A 43 22.158 25.618 25.063 1.00 0.00 C ATOM 486 CZ TYR A 43 21.830 26.719 24.306 1.00 0.00 C ATOM 487 OH TYR A 43 20.654 26.720 23.525 1.00 0.00 O ATOM 0 H TYR A 43 26.484 24.212 25.854 1.00 0.00 H new ATOM 0 HA TYR A 43 26.708 26.967 24.920 1.00 0.00 H new ATOM 0 HB2 TYR A 43 25.296 25.993 27.445 1.00 0.00 H new ATOM 0 HB3 TYR A 43 25.582 27.673 27.035 1.00 0.00 H new ATOM 0 HD1 TYR A 43 24.455 28.670 25.060 1.00 0.00 H new ATOM 0 HD2 TYR A 43 23.563 24.746 26.402 1.00 0.00 H new ATOM 0 HE1 TYR A 43 22.405 28.684 23.718 1.00 0.00 H new ATOM 0 HE2 TYR A 43 21.508 24.756 25.070 1.00 0.00 H new ATOM 0 HH TYR A 43 19.992 26.121 23.930 1.00 0.00 H new ATOM 497 N VAL A 44 28.440 27.498 26.803 1.00 0.00 N ATOM 498 CA VAL A 44 29.597 27.676 27.623 1.00 0.00 C ATOM 499 C VAL A 44 29.278 27.660 29.078 1.00 0.00 C ATOM 500 O VAL A 44 28.483 28.465 29.560 1.00 0.00 O ATOM 501 CB VAL A 44 30.383 28.908 27.286 1.00 0.00 C ATOM 502 CG1 VAL A 44 31.721 28.936 28.046 1.00 0.00 C ATOM 503 CG2 VAL A 44 30.669 28.927 25.775 1.00 0.00 C ATOM 0 H VAL A 44 28.116 28.362 26.368 1.00 0.00 H new ATOM 0 HA VAL A 44 30.225 26.814 27.399 1.00 0.00 H new ATOM 0 HB VAL A 44 29.797 29.780 27.577 1.00 0.00 H new ATOM 0 HG11 VAL A 44 32.270 29.840 27.783 1.00 0.00 H new ATOM 0 HG12 VAL A 44 31.530 28.927 29.119 1.00 0.00 H new ATOM 0 HG13 VAL A 44 32.312 28.061 27.775 1.00 0.00 H new ATOM 0 HG21 VAL A 44 31.240 29.821 25.524 1.00 0.00 H new ATOM 0 HG22 VAL A 44 31.242 28.041 25.502 1.00 0.00 H new ATOM 0 HG23 VAL A 44 29.727 28.933 25.226 1.00 0.00 H new ATOM 513 N LYS A 45 29.892 26.742 29.845 1.00 0.00 N ATOM 514 CA LYS A 45 29.628 26.533 31.235 1.00 0.00 C ATOM 515 C LYS A 45 30.614 27.224 32.113 1.00 0.00 C ATOM 516 O LYS A 45 30.246 27.851 33.106 1.00 0.00 O ATOM 517 CB LYS A 45 29.626 25.025 31.538 1.00 0.00 C ATOM 518 CG LYS A 45 28.986 24.625 32.870 1.00 0.00 C ATOM 519 CD LYS A 45 29.936 24.503 34.062 1.00 0.00 C ATOM 520 CE LYS A 45 30.819 23.253 34.031 1.00 0.00 C ATOM 521 NZ LYS A 45 31.589 23.132 35.290 1.00 0.00 N ATOM 0 H LYS A 45 30.608 26.115 29.478 1.00 0.00 H new ATOM 0 HA LYS A 45 28.649 26.962 31.450 1.00 0.00 H new ATOM 0 HB2 LYS A 45 29.101 24.510 30.733 1.00 0.00 H new ATOM 0 HB3 LYS A 45 30.656 24.668 31.527 1.00 0.00 H new ATOM 0 HG2 LYS A 45 28.219 25.359 33.116 1.00 0.00 H new ATOM 0 HG3 LYS A 45 28.481 23.669 32.735 1.00 0.00 H new ATOM 0 HD2 LYS A 45 30.575 25.385 34.096 1.00 0.00 H new ATOM 0 HD3 LYS A 45 29.350 24.498 34.981 1.00 0.00 H new ATOM 0 HE2 LYS A 45 30.200 22.367 33.889 1.00 0.00 H new ATOM 0 HE3 LYS A 45 31.502 23.304 33.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 32.183 22.279 35.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 32.193 23.970 35.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 30.932 23.062 36.093 1.00 0.00 H new ATOM 535 N ALA A 46 31.918 27.111 31.807 1.00 0.00 N ATOM 536 CA ALA A 46 32.937 27.716 32.608 1.00 0.00 C ATOM 537 C ALA A 46 34.187 27.891 31.816 1.00 0.00 C ATOM 538 O ALA A 46 34.436 27.165 30.855 1.00 0.00 O ATOM 539 CB ALA A 46 33.258 26.853 33.840 1.00 0.00 C ATOM 0 H ALA A 46 32.269 26.597 30.999 1.00 0.00 H new ATOM 0 HA ALA A 46 32.562 28.686 32.933 1.00 0.00 H new ATOM 0 HB1 ALA A 46 34.036 27.337 34.431 1.00 0.00 H new ATOM 0 HB2 ALA A 46 32.360 26.737 34.447 1.00 0.00 H new ATOM 0 HB3 ALA A 46 33.606 25.872 33.516 1.00 0.00 H new ATOM 545 N ILE A 47 35.021 28.869 32.213 1.00 0.00 N ATOM 546 CA ILE A 47 36.302 29.113 31.627 1.00 0.00 C ATOM 547 C ILE A 47 37.375 28.770 32.602 1.00 0.00 C ATOM 548 O ILE A 47 37.352 29.162 33.768 1.00 0.00 O ATOM 549 CB ILE A 47 36.359 30.491 31.038 1.00 0.00 C ATOM 550 CG1 ILE A 47 36.918 30.468 29.605 1.00 0.00 C ATOM 551 CG2 ILE A 47 37.101 31.533 31.892 1.00 0.00 C ATOM 552 CD1 ILE A 47 35.985 29.860 28.558 1.00 0.00 C ATOM 0 H ILE A 47 34.794 29.514 32.970 1.00 0.00 H new ATOM 0 HA ILE A 47 36.477 28.456 30.775 1.00 0.00 H new ATOM 0 HB ILE A 47 35.320 30.821 31.017 1.00 0.00 H new ATOM 0 HG12 ILE A 47 37.157 31.489 29.308 1.00 0.00 H new ATOM 0 HG13 ILE A 47 37.854 29.909 29.605 1.00 0.00 H new ATOM 0 HG21 ILE A 47 37.088 32.497 31.383 1.00 0.00 H new ATOM 0 HG22 ILE A 47 36.608 31.628 32.860 1.00 0.00 H new ATOM 0 HG23 ILE A 47 38.133 31.214 32.040 1.00 0.00 H new ATOM 0 HD11 ILE A 47 36.467 29.889 27.581 1.00 0.00 H new ATOM 0 HD12 ILE A 47 35.765 28.826 28.824 1.00 0.00 H new ATOM 0 HD13 ILE A 47 35.057 30.431 28.522 1.00 0.00 H new ATOM 564 N ILE A 48 38.322 27.909 32.187 1.00 0.00 N ATOM 565 CA ILE A 48 39.370 27.362 32.991 1.00 0.00 C ATOM 566 C ILE A 48 40.492 28.310 33.241 1.00 0.00 C ATOM 567 O ILE A 48 41.124 28.672 32.250 1.00 0.00 O ATOM 568 CB ILE A 48 39.916 26.089 32.416 1.00 0.00 C ATOM 569 CG1 ILE A 48 38.794 25.154 31.932 1.00 0.00 C ATOM 570 CG2 ILE A 48 40.826 25.383 33.436 1.00 0.00 C ATOM 571 CD1 ILE A 48 37.865 24.619 33.020 1.00 0.00 C ATOM 0 H ILE A 48 38.356 27.573 31.224 1.00 0.00 H new ATOM 0 HA ILE A 48 38.897 27.152 33.950 1.00 0.00 H new ATOM 0 HB ILE A 48 40.515 26.349 31.543 1.00 0.00 H new ATOM 0 HG12 ILE A 48 38.193 25.688 31.196 1.00 0.00 H new ATOM 0 HG13 ILE A 48 39.248 24.307 31.418 1.00 0.00 H new ATOM 0 HG21 ILE A 48 41.213 24.461 33.002 1.00 0.00 H new ATOM 0 HG22 ILE A 48 41.657 26.038 33.697 1.00 0.00 H new ATOM 0 HG23 ILE A 48 40.253 25.149 34.333 1.00 0.00 H new ATOM 0 HD11 ILE A 48 37.112 23.972 32.570 1.00 0.00 H new ATOM 0 HD12 ILE A 48 38.445 24.050 33.747 1.00 0.00 H new ATOM 0 HD13 ILE A 48 37.373 25.453 33.521 1.00 0.00 H new ATOM 583 N PRO A 49 40.864 28.733 34.413 1.00 0.00 N ATOM 584 CA PRO A 49 41.901 29.704 34.601 1.00 0.00 C ATOM 585 C PRO A 49 43.246 29.324 34.083 1.00 0.00 C ATOM 586 O PRO A 49 43.773 28.277 34.456 1.00 0.00 O ATOM 587 CB PRO A 49 41.955 29.941 36.108 1.00 0.00 C ATOM 588 CG PRO A 49 40.506 29.689 36.556 1.00 0.00 C ATOM 589 CD PRO A 49 40.100 28.527 35.635 1.00 0.00 C ATOM 0 HA PRO A 49 41.656 30.593 34.019 1.00 0.00 H new ATOM 0 HB2 PRO A 49 42.652 29.261 36.598 1.00 0.00 H new ATOM 0 HB3 PRO A 49 42.279 30.954 36.345 1.00 0.00 H new ATOM 0 HG2 PRO A 49 40.443 29.418 37.610 1.00 0.00 H new ATOM 0 HG3 PRO A 49 39.874 30.566 36.414 1.00 0.00 H new ATOM 0 HD2 PRO A 49 40.333 27.564 36.089 1.00 0.00 H new ATOM 0 HD3 PRO A 49 39.028 28.536 35.437 1.00 0.00 H new ATOM 597 N LYS A 50 43.813 30.165 33.200 1.00 0.00 N ATOM 598 CA LYS A 50 45.047 29.986 32.500 1.00 0.00 C ATOM 599 C LYS A 50 44.980 29.015 31.371 1.00 0.00 C ATOM 600 O LYS A 50 45.964 28.373 31.010 1.00 0.00 O ATOM 601 CB LYS A 50 46.303 29.867 33.380 1.00 0.00 C ATOM 602 CG LYS A 50 46.424 31.045 34.350 1.00 0.00 C ATOM 603 CD LYS A 50 47.850 31.326 34.826 1.00 0.00 C ATOM 604 CE LYS A 50 48.500 30.178 35.601 1.00 0.00 C ATOM 605 NZ LYS A 50 49.834 30.597 36.086 1.00 0.00 N ATOM 0 H LYS A 50 43.366 31.049 32.955 1.00 0.00 H new ATOM 0 HA LYS A 50 45.193 30.951 32.014 1.00 0.00 H new ATOM 0 HB2 LYS A 50 46.267 28.934 33.942 1.00 0.00 H new ATOM 0 HB3 LYS A 50 47.189 29.824 32.747 1.00 0.00 H new ATOM 0 HG2 LYS A 50 46.032 31.940 33.867 1.00 0.00 H new ATOM 0 HG3 LYS A 50 45.795 30.851 35.219 1.00 0.00 H new ATOM 0 HD2 LYS A 50 48.469 31.559 33.960 1.00 0.00 H new ATOM 0 HD3 LYS A 50 47.840 32.214 35.458 1.00 0.00 H new ATOM 0 HE2 LYS A 50 47.870 29.892 36.443 1.00 0.00 H new ATOM 0 HE3 LYS A 50 48.594 29.301 34.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 50.273 29.815 36.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 50.435 30.849 35.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 49.733 31.422 36.712 1.00 0.00 H new ATOM 619 N GLY A 51 43.813 28.919 30.708 1.00 0.00 N ATOM 620 CA GLY A 51 43.727 28.371 29.390 1.00 0.00 C ATOM 621 C GLY A 51 44.007 29.374 28.324 1.00 0.00 C ATOM 622 O GLY A 51 43.930 30.584 28.530 1.00 0.00 O ATOM 0 H GLY A 51 42.919 29.225 31.091 1.00 0.00 H new ATOM 0 HA2 GLY A 51 44.433 27.545 29.299 1.00 0.00 H new ATOM 0 HA3 GLY A 51 42.730 27.957 29.239 1.00 0.00 H new ATOM 626 N ALA A 52 44.308 28.895 27.104 1.00 0.00 N ATOM 627 CA ALA A 52 44.328 29.631 25.877 1.00 0.00 C ATOM 628 C ALA A 52 43.101 30.437 25.620 1.00 0.00 C ATOM 629 O ALA A 52 43.148 31.655 25.457 1.00 0.00 O ATOM 630 CB ALA A 52 44.530 28.639 24.719 1.00 0.00 C ATOM 0 H ALA A 52 44.557 27.916 26.966 1.00 0.00 H new ATOM 0 HA ALA A 52 45.146 30.347 25.956 1.00 0.00 H new ATOM 0 HB1 ALA A 52 44.548 29.182 23.774 1.00 0.00 H new ATOM 0 HB2 ALA A 52 45.474 28.111 24.852 1.00 0.00 H new ATOM 0 HB3 ALA A 52 43.711 27.920 24.709 1.00 0.00 H new ATOM 636 N ALA A 53 41.945 29.750 25.625 1.00 0.00 N ATOM 637 CA ALA A 53 40.622 30.239 25.392 1.00 0.00 C ATOM 638 C ALA A 53 40.199 31.210 26.438 1.00 0.00 C ATOM 639 O ALA A 53 39.749 32.313 26.133 1.00 0.00 O ATOM 640 CB ALA A 53 39.604 29.086 25.391 1.00 0.00 C ATOM 0 H ALA A 53 41.940 28.747 25.812 1.00 0.00 H new ATOM 0 HA ALA A 53 40.645 30.733 24.420 1.00 0.00 H new ATOM 0 HB1 ALA A 53 38.605 29.483 25.212 1.00 0.00 H new ATOM 0 HB2 ALA A 53 39.859 28.376 24.604 1.00 0.00 H new ATOM 0 HB3 ALA A 53 39.626 28.581 26.356 1.00 0.00 H new ATOM 646 N GLU A 54 40.392 30.834 27.715 1.00 0.00 N ATOM 647 CA GLU A 54 40.117 31.641 28.863 1.00 0.00 C ATOM 648 C GLU A 54 40.510 33.075 28.769 1.00 0.00 C ATOM 649 O GLU A 54 39.700 33.996 28.860 1.00 0.00 O ATOM 650 CB GLU A 54 40.833 31.009 30.068 1.00 0.00 C ATOM 651 CG GLU A 54 40.685 31.755 31.394 1.00 0.00 C ATOM 652 CD GLU A 54 41.794 32.736 31.746 1.00 0.00 C ATOM 653 OE1 GLU A 54 42.999 32.367 31.716 1.00 0.00 O ATOM 654 OE2 GLU A 54 41.457 33.901 32.090 1.00 0.00 O ATOM 0 H GLU A 54 40.761 29.915 27.959 1.00 0.00 H new ATOM 0 HA GLU A 54 39.031 31.656 28.960 1.00 0.00 H new ATOM 0 HB2 GLU A 54 40.457 29.994 30.199 1.00 0.00 H new ATOM 0 HB3 GLU A 54 41.895 30.928 29.835 1.00 0.00 H new ATOM 0 HG2 GLU A 54 39.741 32.299 31.376 1.00 0.00 H new ATOM 0 HG3 GLU A 54 40.614 31.018 32.194 1.00 0.00 H new ATOM 661 N SER A 55 41.821 33.282 28.545 1.00 0.00 N ATOM 662 CA SER A 55 42.475 34.553 28.555 1.00 0.00 C ATOM 663 C SER A 55 42.116 35.438 27.411 1.00 0.00 C ATOM 664 O SER A 55 42.140 36.661 27.536 1.00 0.00 O ATOM 665 CB SER A 55 43.991 34.303 28.601 1.00 0.00 C ATOM 666 OG SER A 55 44.721 35.464 28.971 1.00 0.00 O ATOM 0 H SER A 55 42.462 32.514 28.345 1.00 0.00 H new ATOM 0 HA SER A 55 42.134 35.095 29.437 1.00 0.00 H new ATOM 0 HB2 SER A 55 44.203 33.503 29.310 1.00 0.00 H new ATOM 0 HB3 SER A 55 44.330 33.961 27.623 1.00 0.00 H new ATOM 0 HG SER A 55 45.679 35.257 28.988 1.00 0.00 H new ATOM 672 N ASP A 56 41.750 34.853 26.256 1.00 0.00 N ATOM 673 CA ASP A 56 41.499 35.523 25.017 1.00 0.00 C ATOM 674 C ASP A 56 40.443 36.570 25.106 1.00 0.00 C ATOM 675 O ASP A 56 40.693 37.734 24.795 1.00 0.00 O ATOM 676 CB ASP A 56 41.202 34.460 23.946 1.00 0.00 C ATOM 677 CG ASP A 56 40.964 35.062 22.569 1.00 0.00 C ATOM 678 OD1 ASP A 56 41.943 35.448 21.876 1.00 0.00 O ATOM 679 OD2 ASP A 56 39.771 35.211 22.194 1.00 0.00 O ATOM 0 H ASP A 56 41.621 33.844 26.184 1.00 0.00 H new ATOM 0 HA ASP A 56 42.391 36.083 24.736 1.00 0.00 H new ATOM 0 HB2 ASP A 56 42.037 33.761 23.893 1.00 0.00 H new ATOM 0 HB3 ASP A 56 40.324 33.886 24.243 1.00 0.00 H new ATOM 684 N GLY A 57 39.221 36.228 25.551 1.00 0.00 N ATOM 685 CA GLY A 57 38.263 37.202 25.970 1.00 0.00 C ATOM 686 C GLY A 57 37.056 37.327 25.103 1.00 0.00 C ATOM 687 O GLY A 57 36.120 38.059 25.421 1.00 0.00 O ATOM 0 H GLY A 57 38.894 35.264 25.621 1.00 0.00 H new ATOM 0 HA2 GLY A 57 37.939 36.956 26.981 1.00 0.00 H new ATOM 0 HA3 GLY A 57 38.756 38.173 26.020 1.00 0.00 H new ATOM 691 N ARG A 58 37.008 36.608 23.969 1.00 0.00 N ATOM 692 CA ARG A 58 35.821 36.480 23.181 1.00 0.00 C ATOM 693 C ARG A 58 34.855 35.554 23.835 1.00 0.00 C ATOM 694 O ARG A 58 33.763 35.966 24.224 1.00 0.00 O ATOM 695 CB ARG A 58 36.159 36.053 21.743 1.00 0.00 C ATOM 696 CG ARG A 58 36.695 37.206 20.891 1.00 0.00 C ATOM 697 CD ARG A 58 37.025 36.787 19.457 1.00 0.00 C ATOM 698 NE ARG A 58 37.456 38.038 18.773 1.00 0.00 N ATOM 699 CZ ARG A 58 38.170 38.068 17.610 1.00 0.00 C ATOM 700 NH1 ARG A 58 38.382 36.958 16.845 1.00 0.00 N ATOM 701 NH2 ARG A 58 38.690 39.256 17.183 1.00 0.00 N ATOM 0 H ARG A 58 37.810 36.104 23.590 1.00 0.00 H new ATOM 0 HA ARG A 58 35.338 37.455 23.115 1.00 0.00 H new ATOM 0 HB2 ARG A 58 36.899 35.254 21.771 1.00 0.00 H new ATOM 0 HB3 ARG A 58 35.266 35.644 21.271 1.00 0.00 H new ATOM 0 HG2 ARG A 58 35.957 38.008 20.869 1.00 0.00 H new ATOM 0 HG3 ARG A 58 37.591 37.611 21.361 1.00 0.00 H new ATOM 0 HD2 ARG A 58 37.815 36.036 19.438 1.00 0.00 H new ATOM 0 HD3 ARG A 58 36.157 36.349 18.965 1.00 0.00 H new ATOM 0 HE ARG A 58 37.202 38.928 19.201 1.00 0.00 H new ATOM 0 HH11 ARG A 58 38.000 36.058 17.135 1.00 0.00 H new ATOM 0 HH12 ARG A 58 38.922 37.028 15.983 1.00 0.00 H new ATOM 0 HH21 ARG A 58 38.542 40.104 17.731 1.00 0.00 H new ATOM 0 HH22 ARG A 58 39.226 39.296 16.316 1.00 0.00 H new ATOM 715 N ILE A 59 35.229 34.275 24.024 1.00 0.00 N ATOM 716 CA ILE A 59 34.422 33.241 24.595 1.00 0.00 C ATOM 717 C ILE A 59 34.130 33.445 26.043 1.00 0.00 C ATOM 718 O ILE A 59 35.035 33.609 26.859 1.00 0.00 O ATOM 719 CB ILE A 59 35.068 31.906 24.370 1.00 0.00 C ATOM 720 CG1 ILE A 59 35.074 31.599 22.863 1.00 0.00 C ATOM 721 CG2 ILE A 59 34.401 30.777 25.173 1.00 0.00 C ATOM 722 CD1 ILE A 59 35.968 30.419 22.481 1.00 0.00 C ATOM 0 H ILE A 59 36.156 33.943 23.760 1.00 0.00 H new ATOM 0 HA ILE A 59 33.459 33.278 24.086 1.00 0.00 H new ATOM 0 HB ILE A 59 36.093 31.958 24.737 1.00 0.00 H new ATOM 0 HG12 ILE A 59 34.054 31.391 22.539 1.00 0.00 H new ATOM 0 HG13 ILE A 59 35.406 32.485 22.322 1.00 0.00 H new ATOM 0 HG21 ILE A 59 34.911 29.835 24.970 1.00 0.00 H new ATOM 0 HG22 ILE A 59 34.464 31.001 26.238 1.00 0.00 H new ATOM 0 HG23 ILE A 59 33.354 30.693 24.882 1.00 0.00 H new ATOM 0 HD11 ILE A 59 35.922 30.262 21.403 1.00 0.00 H new ATOM 0 HD12 ILE A 59 36.996 30.632 22.773 1.00 0.00 H new ATOM 0 HD13 ILE A 59 35.624 29.521 22.994 1.00 0.00 H new ATOM 734 N HIS A 60 32.837 33.434 26.411 1.00 0.00 N ATOM 735 CA HIS A 60 32.404 33.577 27.766 1.00 0.00 C ATOM 736 C HIS A 60 31.238 32.720 28.126 1.00 0.00 C ATOM 737 O HIS A 60 30.468 32.239 27.297 1.00 0.00 O ATOM 738 CB HIS A 60 32.090 35.049 28.080 1.00 0.00 C ATOM 739 CG HIS A 60 32.038 35.382 29.542 1.00 0.00 C ATOM 740 ND1 HIS A 60 30.878 35.618 30.251 1.00 0.00 N ATOM 741 CD2 HIS A 60 33.050 35.490 30.444 1.00 0.00 C ATOM 742 CE1 HIS A 60 31.245 35.848 31.540 1.00 0.00 C ATOM 743 NE2 HIS A 60 32.555 35.780 31.698 1.00 0.00 N ATOM 0 H HIS A 60 32.071 33.322 25.747 1.00 0.00 H new ATOM 0 HA HIS A 60 33.237 33.232 28.378 1.00 0.00 H new ATOM 0 HB2 HIS A 60 32.844 35.676 27.605 1.00 0.00 H new ATOM 0 HB3 HIS A 60 31.132 35.306 27.629 1.00 0.00 H new ATOM 0 HD2 HIS A 60 34.097 35.366 30.210 1.00 0.00 H new ATOM 0 HE1 HIS A 60 30.549 36.061 32.338 1.00 0.00 H new ATOM 0 HE2 HIS A 60 33.085 35.913 32.560 1.00 0.00 H new ATOM 751 N LYS A 61 31.065 32.489 29.440 1.00 0.00 N ATOM 752 CA LYS A 61 30.009 31.755 30.063 1.00 0.00 C ATOM 753 C LYS A 61 28.634 32.187 29.682 1.00 0.00 C ATOM 754 O LYS A 61 28.284 33.363 29.763 1.00 0.00 O ATOM 755 CB LYS A 61 30.170 31.855 31.589 1.00 0.00 C ATOM 756 CG LYS A 61 29.206 30.990 32.404 1.00 0.00 C ATOM 757 CD LYS A 61 29.537 31.024 33.897 1.00 0.00 C ATOM 758 CE LYS A 61 29.012 32.264 34.625 1.00 0.00 C ATOM 759 NZ LYS A 61 29.715 32.428 35.917 1.00 0.00 N ATOM 0 H LYS A 61 31.727 32.851 30.127 1.00 0.00 H new ATOM 0 HA LYS A 61 30.102 30.729 29.708 1.00 0.00 H new ATOM 0 HB2 LYS A 61 31.191 31.577 31.850 1.00 0.00 H new ATOM 0 HB3 LYS A 61 30.038 32.896 31.885 1.00 0.00 H new ATOM 0 HG2 LYS A 61 28.185 31.339 32.250 1.00 0.00 H new ATOM 0 HG3 LYS A 61 29.249 29.962 32.045 1.00 0.00 H new ATOM 0 HD2 LYS A 61 29.122 30.135 34.371 1.00 0.00 H new ATOM 0 HD3 LYS A 61 30.619 30.975 34.020 1.00 0.00 H new ATOM 0 HE2 LYS A 61 29.160 33.149 34.006 1.00 0.00 H new ATOM 0 HE3 LYS A 61 27.939 32.169 34.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 29.353 33.272 36.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 29.552 31.589 36.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 30.735 32.538 35.746 1.00 0.00 H new ATOM 773 N GLY A 62 27.800 31.230 29.237 1.00 0.00 N ATOM 774 CA GLY A 62 26.458 31.474 28.809 1.00 0.00 C ATOM 775 C GLY A 62 26.291 31.597 27.334 1.00 0.00 C ATOM 776 O GLY A 62 25.161 31.684 26.855 1.00 0.00 O ATOM 0 H GLY A 62 28.071 30.249 29.173 1.00 0.00 H new ATOM 0 HA2 GLY A 62 25.823 30.664 29.167 1.00 0.00 H new ATOM 0 HA3 GLY A 62 26.101 32.390 29.280 1.00 0.00 H new ATOM 780 N ASP A 63 27.381 31.624 26.547 1.00 0.00 N ATOM 781 CA ASP A 63 27.285 31.762 25.127 1.00 0.00 C ATOM 782 C ASP A 63 26.967 30.474 24.449 1.00 0.00 C ATOM 783 O ASP A 63 27.188 29.388 24.984 1.00 0.00 O ATOM 784 CB ASP A 63 28.616 32.280 24.555 1.00 0.00 C ATOM 785 CG ASP A 63 28.981 33.705 24.946 1.00 0.00 C ATOM 786 OD1 ASP A 63 28.100 34.487 25.392 1.00 0.00 O ATOM 787 OD2 ASP A 63 30.174 34.053 24.741 1.00 0.00 O ATOM 0 H ASP A 63 28.336 31.550 26.898 1.00 0.00 H new ATOM 0 HA ASP A 63 26.474 32.466 24.940 1.00 0.00 H new ATOM 0 HB2 ASP A 63 29.416 31.615 24.881 1.00 0.00 H new ATOM 0 HB3 ASP A 63 28.574 32.219 23.468 1.00 0.00 H new ATOM 792 N ARG A 64 26.465 30.531 23.203 1.00 0.00 N ATOM 793 CA ARG A 64 25.996 29.419 22.435 1.00 0.00 C ATOM 794 C ARG A 64 26.968 29.054 21.367 1.00 0.00 C ATOM 795 O ARG A 64 27.481 29.925 20.667 1.00 0.00 O ATOM 796 CB ARG A 64 24.662 29.836 21.793 1.00 0.00 C ATOM 797 CG ARG A 64 23.993 28.825 20.860 1.00 0.00 C ATOM 798 CD ARG A 64 22.687 29.367 20.277 1.00 0.00 C ATOM 799 NE ARG A 64 22.141 28.308 19.382 1.00 0.00 N ATOM 800 CZ ARG A 64 22.231 28.308 18.020 1.00 0.00 C ATOM 801 NH1 ARG A 64 22.626 29.387 17.282 1.00 0.00 N ATOM 802 NH2 ARG A 64 21.920 27.167 17.337 1.00 0.00 N ATOM 0 H ARG A 64 26.381 31.414 22.699 1.00 0.00 H new ATOM 0 HA ARG A 64 25.874 28.550 23.081 1.00 0.00 H new ATOM 0 HB2 ARG A 64 23.961 30.074 22.593 1.00 0.00 H new ATOM 0 HB3 ARG A 64 24.829 30.755 21.232 1.00 0.00 H new ATOM 0 HG2 ARG A 64 24.676 28.572 20.049 1.00 0.00 H new ATOM 0 HG3 ARG A 64 23.792 27.904 21.407 1.00 0.00 H new ATOM 0 HD2 ARG A 64 21.979 29.605 21.071 1.00 0.00 H new ATOM 0 HD3 ARG A 64 22.865 30.288 19.722 1.00 0.00 H new ATOM 0 HE ARG A 64 21.663 27.522 19.822 1.00 0.00 H new ATOM 0 HH11 ARG A 64 22.875 30.260 17.748 1.00 0.00 H new ATOM 0 HH12 ARG A 64 22.672 29.320 16.265 1.00 0.00 H new ATOM 0 HH21 ARG A 64 21.626 26.333 17.845 1.00 0.00 H new ATOM 0 HH22 ARG A 64 21.982 27.149 16.319 1.00 0.00 H new ATOM 816 N VAL A 65 27.312 27.766 21.192 1.00 0.00 N ATOM 817 CA VAL A 65 28.283 27.328 20.239 1.00 0.00 C ATOM 818 C VAL A 65 27.648 27.008 18.930 1.00 0.00 C ATOM 819 O VAL A 65 26.590 26.381 18.890 1.00 0.00 O ATOM 820 CB VAL A 65 29.072 26.154 20.738 1.00 0.00 C ATOM 821 CG1 VAL A 65 30.225 25.818 19.778 1.00 0.00 C ATOM 822 CG2 VAL A 65 29.653 26.463 22.128 1.00 0.00 C ATOM 0 H VAL A 65 26.901 27.004 21.732 1.00 0.00 H new ATOM 0 HA VAL A 65 28.977 28.156 20.094 1.00 0.00 H new ATOM 0 HB VAL A 65 28.399 25.298 20.798 1.00 0.00 H new ATOM 0 HG11 VAL A 65 30.781 24.963 20.163 1.00 0.00 H new ATOM 0 HG12 VAL A 65 29.821 25.575 18.795 1.00 0.00 H new ATOM 0 HG13 VAL A 65 30.891 26.677 19.695 1.00 0.00 H new ATOM 0 HG21 VAL A 65 30.224 25.605 22.482 1.00 0.00 H new ATOM 0 HG22 VAL A 65 30.307 27.333 22.064 1.00 0.00 H new ATOM 0 HG23 VAL A 65 28.840 26.670 22.824 1.00 0.00 H new ATOM 832 N LEU A 66 28.234 27.426 17.794 1.00 0.00 N ATOM 833 CA LEU A 66 27.716 27.129 16.495 1.00 0.00 C ATOM 834 C LEU A 66 28.467 26.006 15.866 1.00 0.00 C ATOM 835 O LEU A 66 27.891 24.968 15.545 1.00 0.00 O ATOM 836 CB LEU A 66 27.735 28.343 15.551 1.00 0.00 C ATOM 837 CG LEU A 66 26.437 29.167 15.535 1.00 0.00 C ATOM 838 CD1 LEU A 66 25.975 29.600 16.936 1.00 0.00 C ATOM 839 CD2 LEU A 66 26.604 30.395 14.621 1.00 0.00 C ATOM 0 H LEU A 66 29.088 27.984 17.778 1.00 0.00 H new ATOM 0 HA LEU A 66 26.676 26.841 16.646 1.00 0.00 H new ATOM 0 HB2 LEU A 66 28.560 28.996 15.838 1.00 0.00 H new ATOM 0 HB3 LEU A 66 27.941 27.995 14.539 1.00 0.00 H new ATOM 0 HG LEU A 66 25.656 28.516 15.142 1.00 0.00 H new ATOM 0 HD11 LEU A 66 25.054 30.177 16.853 1.00 0.00 H new ATOM 0 HD12 LEU A 66 25.796 28.717 17.549 1.00 0.00 H new ATOM 0 HD13 LEU A 66 26.747 30.213 17.400 1.00 0.00 H new ATOM 0 HD21 LEU A 66 25.680 30.973 14.616 1.00 0.00 H new ATOM 0 HD22 LEU A 66 27.419 31.017 14.992 1.00 0.00 H new ATOM 0 HD23 LEU A 66 26.832 30.066 13.607 1.00 0.00 H new ATOM 851 N ALA A 67 29.786 26.160 15.649 1.00 0.00 N ATOM 852 CA ALA A 67 30.516 25.200 14.882 1.00 0.00 C ATOM 853 C ALA A 67 31.938 25.095 15.311 1.00 0.00 C ATOM 854 O ALA A 67 32.667 26.084 15.349 1.00 0.00 O ATOM 855 CB ALA A 67 30.483 25.555 13.385 1.00 0.00 C ATOM 0 H ALA A 67 30.341 26.940 16.000 1.00 0.00 H new ATOM 0 HA ALA A 67 30.028 24.240 15.053 1.00 0.00 H new ATOM 0 HB1 ALA A 67 31.045 24.810 12.822 1.00 0.00 H new ATOM 0 HB2 ALA A 67 29.450 25.569 13.037 1.00 0.00 H new ATOM 0 HB3 ALA A 67 30.930 26.537 13.234 1.00 0.00 H new ATOM 861 N VAL A 68 32.388 23.868 15.630 1.00 0.00 N ATOM 862 CA VAL A 68 33.738 23.589 16.011 1.00 0.00 C ATOM 863 C VAL A 68 34.482 23.054 14.837 1.00 0.00 C ATOM 864 O VAL A 68 34.191 21.959 14.359 1.00 0.00 O ATOM 865 CB VAL A 68 33.863 22.574 17.109 1.00 0.00 C ATOM 866 CG1 VAL A 68 35.334 22.489 17.552 1.00 0.00 C ATOM 867 CG2 VAL A 68 32.974 22.934 18.310 1.00 0.00 C ATOM 0 H VAL A 68 31.791 23.041 15.622 1.00 0.00 H new ATOM 0 HA VAL A 68 34.144 24.533 16.374 1.00 0.00 H new ATOM 0 HB VAL A 68 33.531 21.608 16.728 1.00 0.00 H new ATOM 0 HG11 VAL A 68 35.432 21.753 18.350 1.00 0.00 H new ATOM 0 HG12 VAL A 68 35.952 22.191 16.705 1.00 0.00 H new ATOM 0 HG13 VAL A 68 35.662 23.463 17.915 1.00 0.00 H new ATOM 0 HG21 VAL A 68 33.089 22.178 19.087 1.00 0.00 H new ATOM 0 HG22 VAL A 68 33.270 23.907 18.703 1.00 0.00 H new ATOM 0 HG23 VAL A 68 31.932 22.973 17.993 1.00 0.00 H new ATOM 877 N ASN A 69 35.492 23.774 14.316 1.00 0.00 N ATOM 878 CA ASN A 69 36.446 23.313 13.355 1.00 0.00 C ATOM 879 C ASN A 69 35.868 22.850 12.063 1.00 0.00 C ATOM 880 O ASN A 69 36.364 21.917 11.430 1.00 0.00 O ATOM 881 CB ASN A 69 37.384 22.296 14.027 1.00 0.00 C ATOM 882 CG ASN A 69 38.788 22.306 13.438 1.00 0.00 C ATOM 883 OD1 ASN A 69 39.473 23.327 13.443 1.00 0.00 O ATOM 884 ND2 ASN A 69 39.284 21.122 12.988 1.00 0.00 N ATOM 0 H ASN A 69 35.652 24.745 14.585 1.00 0.00 H new ATOM 0 HA ASN A 69 37.035 24.173 13.036 1.00 0.00 H new ATOM 0 HB2 ASN A 69 37.441 22.512 15.094 1.00 0.00 H new ATOM 0 HB3 ASN A 69 36.960 21.297 13.926 1.00 0.00 H new ATOM 0 HD21 ASN A 69 40.243 21.068 12.645 1.00 0.00 H new ATOM 0 HD22 ASN A 69 38.697 20.288 12.993 1.00 0.00 H new ATOM 891 N GLY A 70 34.786 23.503 11.601 1.00 0.00 N ATOM 892 CA GLY A 70 34.068 23.161 10.414 1.00 0.00 C ATOM 893 C GLY A 70 32.864 22.315 10.651 1.00 0.00 C ATOM 894 O GLY A 70 32.051 22.103 9.752 1.00 0.00 O ATOM 0 H GLY A 70 34.393 24.312 12.082 1.00 0.00 H new ATOM 0 HA2 GLY A 70 33.761 24.078 9.912 1.00 0.00 H new ATOM 0 HA3 GLY A 70 34.740 22.636 9.735 1.00 0.00 H new ATOM 898 N VAL A 71 32.693 21.781 11.874 1.00 0.00 N ATOM 899 CA VAL A 71 31.628 20.892 12.220 1.00 0.00 C ATOM 900 C VAL A 71 30.549 21.649 12.916 1.00 0.00 C ATOM 901 O VAL A 71 30.697 22.066 14.065 1.00 0.00 O ATOM 902 CB VAL A 71 32.082 19.737 13.062 1.00 0.00 C ATOM 903 CG1 VAL A 71 30.948 18.711 13.230 1.00 0.00 C ATOM 904 CG2 VAL A 71 33.322 19.083 12.431 1.00 0.00 C ATOM 0 H VAL A 71 33.322 21.977 12.653 1.00 0.00 H new ATOM 0 HA VAL A 71 31.246 20.468 11.292 1.00 0.00 H new ATOM 0 HB VAL A 71 32.350 20.107 14.052 1.00 0.00 H new ATOM 0 HG11 VAL A 71 31.297 17.881 13.844 1.00 0.00 H new ATOM 0 HG12 VAL A 71 30.095 19.187 13.714 1.00 0.00 H new ATOM 0 HG13 VAL A 71 30.647 18.337 12.251 1.00 0.00 H new ATOM 0 HG21 VAL A 71 33.645 18.245 13.049 1.00 0.00 H new ATOM 0 HG22 VAL A 71 33.075 18.723 11.432 1.00 0.00 H new ATOM 0 HG23 VAL A 71 34.126 19.816 12.364 1.00 0.00 H new ATOM 914 N SER A 72 29.404 21.868 12.247 1.00 0.00 N ATOM 915 CA SER A 72 28.284 22.552 12.818 1.00 0.00 C ATOM 916 C SER A 72 27.588 21.700 13.822 1.00 0.00 C ATOM 917 O SER A 72 27.205 20.567 13.532 1.00 0.00 O ATOM 918 CB SER A 72 27.263 23.006 11.762 1.00 0.00 C ATOM 919 OG SER A 72 26.312 23.907 12.309 1.00 0.00 O ATOM 0 H SER A 72 29.252 21.563 11.286 1.00 0.00 H new ATOM 0 HA SER A 72 28.694 23.439 13.302 1.00 0.00 H new ATOM 0 HB2 SER A 72 27.784 23.485 10.933 1.00 0.00 H new ATOM 0 HB3 SER A 72 26.748 22.136 11.355 1.00 0.00 H new ATOM 0 HG SER A 72 25.520 23.937 11.732 1.00 0.00 H new ATOM 925 N LEU A 73 27.395 22.205 15.052 1.00 0.00 N ATOM 926 CA LEU A 73 26.943 21.424 16.163 1.00 0.00 C ATOM 927 C LEU A 73 25.461 21.289 16.237 1.00 0.00 C ATOM 928 O LEU A 73 24.858 21.268 17.308 1.00 0.00 O ATOM 929 CB LEU A 73 27.452 21.988 17.499 1.00 0.00 C ATOM 930 CG LEU A 73 28.979 22.051 17.675 1.00 0.00 C ATOM 931 CD1 LEU A 73 29.274 22.491 19.118 1.00 0.00 C ATOM 932 CD2 LEU A 73 29.692 20.716 17.395 1.00 0.00 C ATOM 0 H LEU A 73 27.558 23.185 15.282 1.00 0.00 H new ATOM 0 HA LEU A 73 27.362 20.433 15.991 1.00 0.00 H new ATOM 0 HB2 LEU A 73 27.052 22.995 17.620 1.00 0.00 H new ATOM 0 HB3 LEU A 73 27.039 21.382 18.306 1.00 0.00 H new ATOM 0 HG LEU A 73 29.364 22.760 16.942 1.00 0.00 H new ATOM 0 HD11 LEU A 73 30.352 22.544 19.269 1.00 0.00 H new ATOM 0 HD12 LEU A 73 28.834 23.472 19.296 1.00 0.00 H new ATOM 0 HD13 LEU A 73 28.845 21.769 19.813 1.00 0.00 H new ATOM 0 HD21 LEU A 73 30.765 20.839 17.540 1.00 0.00 H new ATOM 0 HD22 LEU A 73 29.319 19.954 18.079 1.00 0.00 H new ATOM 0 HD23 LEU A 73 29.497 20.408 16.368 1.00 0.00 H new ATOM 944 N GLU A 74 24.786 21.154 15.082 1.00 0.00 N ATOM 945 CA GLU A 74 23.370 21.009 14.950 1.00 0.00 C ATOM 946 C GLU A 74 22.943 19.638 15.346 1.00 0.00 C ATOM 947 O GLU A 74 23.409 18.642 14.794 1.00 0.00 O ATOM 948 CB GLU A 74 22.969 21.253 13.486 1.00 0.00 C ATOM 949 CG GLU A 74 23.153 22.705 13.040 1.00 0.00 C ATOM 950 CD GLU A 74 23.133 22.867 11.526 1.00 0.00 C ATOM 951 OE1 GLU A 74 22.221 22.315 10.857 1.00 0.00 O ATOM 952 OE2 GLU A 74 24.015 23.594 10.994 1.00 0.00 O ATOM 0 H GLU A 74 25.263 21.146 14.180 1.00 0.00 H new ATOM 0 HA GLU A 74 22.883 21.734 15.602 1.00 0.00 H new ATOM 0 HB2 GLU A 74 23.563 20.605 12.841 1.00 0.00 H new ATOM 0 HB3 GLU A 74 21.926 20.968 13.350 1.00 0.00 H new ATOM 0 HG2 GLU A 74 22.363 23.317 13.476 1.00 0.00 H new ATOM 0 HG3 GLU A 74 24.099 23.082 13.428 1.00 0.00 H new ATOM 959 N GLY A 75 22.066 19.510 16.358 1.00 0.00 N ATOM 960 CA GLY A 75 21.658 18.239 16.873 1.00 0.00 C ATOM 961 C GLY A 75 22.695 17.542 17.686 1.00 0.00 C ATOM 962 O GLY A 75 22.574 16.355 17.985 1.00 0.00 O ATOM 0 H GLY A 75 21.632 20.304 16.828 1.00 0.00 H new ATOM 0 HA2 GLY A 75 20.767 18.378 17.485 1.00 0.00 H new ATOM 0 HA3 GLY A 75 21.375 17.597 16.039 1.00 0.00 H new ATOM 966 N ALA A 76 23.779 18.244 18.061 1.00 0.00 N ATOM 967 CA ALA A 76 24.893 17.674 18.752 1.00 0.00 C ATOM 968 C ALA A 76 24.619 17.295 20.167 1.00 0.00 C ATOM 969 O ALA A 76 23.922 17.982 20.913 1.00 0.00 O ATOM 970 CB ALA A 76 26.131 18.584 18.685 1.00 0.00 C ATOM 0 H ALA A 76 23.883 19.242 17.877 1.00 0.00 H new ATOM 0 HA ALA A 76 25.093 16.745 18.219 1.00 0.00 H new ATOM 0 HB1 ALA A 76 26.956 18.116 19.222 1.00 0.00 H new ATOM 0 HB2 ALA A 76 26.415 18.736 17.644 1.00 0.00 H new ATOM 0 HB3 ALA A 76 25.900 19.546 19.142 1.00 0.00 H new ATOM 976 N THR A 77 25.177 16.144 20.584 1.00 0.00 N ATOM 977 CA THR A 77 25.086 15.631 21.916 1.00 0.00 C ATOM 978 C THR A 77 26.221 16.107 22.755 1.00 0.00 C ATOM 979 O THR A 77 27.096 16.842 22.298 1.00 0.00 O ATOM 980 CB THR A 77 24.971 14.136 21.944 1.00 0.00 C ATOM 981 OG1 THR A 77 26.127 13.500 21.420 1.00 0.00 O ATOM 982 CG2 THR A 77 23.775 13.715 21.072 1.00 0.00 C ATOM 0 H THR A 77 25.717 15.543 19.962 1.00 0.00 H new ATOM 0 HA THR A 77 24.164 16.023 22.346 1.00 0.00 H new ATOM 0 HB THR A 77 24.847 13.836 22.985 1.00 0.00 H new ATOM 0 HG1 THR A 77 26.011 12.528 21.458 1.00 0.00 H new ATOM 0 HG21 THR A 77 23.680 12.629 21.084 1.00 0.00 H new ATOM 0 HG22 THR A 77 22.862 14.163 21.465 1.00 0.00 H new ATOM 0 HG23 THR A 77 23.934 14.054 20.048 1.00 0.00 H new ATOM 990 N HIS A 78 26.272 15.689 24.032 1.00 0.00 N ATOM 991 CA HIS A 78 27.313 16.055 24.942 1.00 0.00 C ATOM 992 C HIS A 78 28.596 15.411 24.546 1.00 0.00 C ATOM 993 O HIS A 78 29.633 16.066 24.448 1.00 0.00 O ATOM 994 CB HIS A 78 26.918 15.664 26.376 1.00 0.00 C ATOM 995 CG HIS A 78 27.807 16.167 27.476 1.00 0.00 C ATOM 996 ND1 HIS A 78 27.731 15.659 28.758 1.00 0.00 N ATOM 997 CD2 HIS A 78 28.718 17.174 27.533 1.00 0.00 C ATOM 998 CE1 HIS A 78 28.599 16.374 29.523 1.00 0.00 C ATOM 999 NE2 HIS A 78 29.212 17.303 28.815 1.00 0.00 N ATOM 0 H HIS A 78 25.567 15.078 24.444 1.00 0.00 H new ATOM 0 HA HIS A 78 27.454 17.135 24.907 1.00 0.00 H new ATOM 0 HB2 HIS A 78 25.907 16.026 26.562 1.00 0.00 H new ATOM 0 HB3 HIS A 78 26.883 14.576 26.436 1.00 0.00 H new ATOM 0 HD2 HIS A 78 29.013 17.786 26.694 1.00 0.00 H new ATOM 0 HE1 HIS A 78 28.765 16.203 30.576 1.00 0.00 H new ATOM 0 HE2 HIS A 78 29.905 17.975 29.145 1.00 0.00 H new ATOM 1007 N LYS A 79 28.558 14.108 24.216 1.00 0.00 N ATOM 1008 CA LYS A 79 29.640 13.382 23.627 1.00 0.00 C ATOM 1009 C LYS A 79 30.146 13.952 22.346 1.00 0.00 C ATOM 1010 O LYS A 79 31.356 14.061 22.153 1.00 0.00 O ATOM 1011 CB LYS A 79 29.277 11.901 23.433 1.00 0.00 C ATOM 1012 CG LYS A 79 29.800 10.975 24.533 1.00 0.00 C ATOM 1013 CD LYS A 79 29.186 11.201 25.916 1.00 0.00 C ATOM 1014 CE LYS A 79 29.873 10.377 27.007 1.00 0.00 C ATOM 1015 NZ LYS A 79 29.352 10.746 28.342 1.00 0.00 N ATOM 0 H LYS A 79 27.730 13.532 24.368 1.00 0.00 H new ATOM 0 HA LYS A 79 30.456 13.474 24.344 1.00 0.00 H new ATOM 0 HB2 LYS A 79 28.192 11.809 23.382 1.00 0.00 H new ATOM 0 HB3 LYS A 79 29.671 11.565 22.474 1.00 0.00 H new ATOM 0 HG2 LYS A 79 29.617 9.943 24.235 1.00 0.00 H new ATOM 0 HG3 LYS A 79 30.880 11.098 24.607 1.00 0.00 H new ATOM 0 HD2 LYS A 79 29.251 12.259 26.170 1.00 0.00 H new ATOM 0 HD3 LYS A 79 28.127 10.945 25.885 1.00 0.00 H new ATOM 0 HE2 LYS A 79 29.708 9.315 26.827 1.00 0.00 H new ATOM 0 HE3 LYS A 79 30.950 10.543 26.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 29.829 10.177 29.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 29.532 11.755 28.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 28.328 10.565 28.377 1.00 0.00 H new ATOM 1029 N GLN A 80 29.263 14.408 21.440 1.00 0.00 N ATOM 1030 CA GLN A 80 29.619 14.999 20.188 1.00 0.00 C ATOM 1031 C GLN A 80 30.501 16.194 20.313 1.00 0.00 C ATOM 1032 O GLN A 80 31.565 16.254 19.699 1.00 0.00 O ATOM 1033 CB GLN A 80 28.316 15.372 19.459 1.00 0.00 C ATOM 1034 CG GLN A 80 28.320 15.352 17.929 1.00 0.00 C ATOM 1035 CD GLN A 80 28.690 16.629 17.187 1.00 0.00 C ATOM 1036 OE1 GLN A 80 27.905 17.123 16.380 1.00 0.00 O ATOM 1037 NE2 GLN A 80 29.905 17.191 17.423 1.00 0.00 N ATOM 0 H GLN A 80 28.255 14.362 21.587 1.00 0.00 H new ATOM 0 HA GLN A 80 30.202 14.269 19.626 1.00 0.00 H new ATOM 0 HB2 GLN A 80 27.536 14.692 19.800 1.00 0.00 H new ATOM 0 HB3 GLN A 80 28.029 16.373 19.779 1.00 0.00 H new ATOM 0 HG2 GLN A 80 29.010 14.571 17.609 1.00 0.00 H new ATOM 0 HG3 GLN A 80 27.325 15.053 17.599 1.00 0.00 H new ATOM 0 HE21 GLN A 80 30.542 16.765 18.097 1.00 0.00 H new ATOM 0 HE22 GLN A 80 30.180 18.038 16.926 1.00 0.00 H new ATOM 1046 N ALA A 81 30.099 17.189 21.123 1.00 0.00 N ATOM 1047 CA ALA A 81 30.842 18.383 21.380 1.00 0.00 C ATOM 1048 C ALA A 81 32.082 18.154 22.173 1.00 0.00 C ATOM 1049 O ALA A 81 33.136 18.683 21.821 1.00 0.00 O ATOM 1050 CB ALA A 81 29.934 19.387 22.110 1.00 0.00 C ATOM 0 H ALA A 81 29.211 17.159 21.624 1.00 0.00 H new ATOM 0 HA ALA A 81 31.166 18.775 20.416 1.00 0.00 H new ATOM 0 HB1 ALA A 81 30.491 20.302 22.311 1.00 0.00 H new ATOM 0 HB2 ALA A 81 29.071 19.618 21.486 1.00 0.00 H new ATOM 0 HB3 ALA A 81 29.596 18.954 23.051 1.00 0.00 H new ATOM 1056 N VAL A 82 32.047 17.342 23.245 1.00 0.00 N ATOM 1057 CA VAL A 82 33.166 17.091 24.100 1.00 0.00 C ATOM 1058 C VAL A 82 34.259 16.374 23.385 1.00 0.00 C ATOM 1059 O VAL A 82 35.407 16.812 23.420 1.00 0.00 O ATOM 1060 CB VAL A 82 32.807 16.358 25.359 1.00 0.00 C ATOM 1061 CG1 VAL A 82 34.046 15.868 26.125 1.00 0.00 C ATOM 1062 CG2 VAL A 82 32.007 17.321 26.254 1.00 0.00 C ATOM 0 H VAL A 82 31.205 16.840 23.527 1.00 0.00 H new ATOM 0 HA VAL A 82 33.524 18.077 24.396 1.00 0.00 H new ATOM 0 HB VAL A 82 32.224 15.476 25.092 1.00 0.00 H new ATOM 0 HG11 VAL A 82 33.732 15.344 27.028 1.00 0.00 H new ATOM 0 HG12 VAL A 82 34.620 15.190 25.493 1.00 0.00 H new ATOM 0 HG13 VAL A 82 34.666 16.722 26.398 1.00 0.00 H new ATOM 0 HG21 VAL A 82 31.732 16.814 27.179 1.00 0.00 H new ATOM 0 HG22 VAL A 82 32.617 18.194 26.486 1.00 0.00 H new ATOM 0 HG23 VAL A 82 31.104 17.638 25.732 1.00 0.00 H new ATOM 1072 N GLU A 83 33.963 15.278 22.664 1.00 0.00 N ATOM 1073 CA GLU A 83 34.977 14.553 21.963 1.00 0.00 C ATOM 1074 C GLU A 83 35.577 15.354 20.860 1.00 0.00 C ATOM 1075 O GLU A 83 36.772 15.271 20.580 1.00 0.00 O ATOM 1076 CB GLU A 83 34.493 13.199 21.418 1.00 0.00 C ATOM 1077 CG GLU A 83 34.021 12.177 22.455 1.00 0.00 C ATOM 1078 CD GLU A 83 35.114 11.584 23.332 1.00 0.00 C ATOM 1079 OE1 GLU A 83 35.569 12.278 24.280 1.00 0.00 O ATOM 1080 OE2 GLU A 83 35.489 10.398 23.136 1.00 0.00 O ATOM 0 H GLU A 83 33.023 14.894 22.566 1.00 0.00 H new ATOM 0 HA GLU A 83 35.744 14.350 22.710 1.00 0.00 H new ATOM 0 HB2 GLU A 83 33.674 13.384 20.723 1.00 0.00 H new ATOM 0 HB3 GLU A 83 35.304 12.752 20.843 1.00 0.00 H new ATOM 0 HG2 GLU A 83 33.281 12.653 23.098 1.00 0.00 H new ATOM 0 HG3 GLU A 83 33.515 11.364 21.935 1.00 0.00 H new ATOM 1087 N THR A 84 34.777 16.231 20.229 1.00 0.00 N ATOM 1088 CA THR A 84 35.190 17.177 19.238 1.00 0.00 C ATOM 1089 C THR A 84 36.083 18.239 19.780 1.00 0.00 C ATOM 1090 O THR A 84 37.107 18.552 19.176 1.00 0.00 O ATOM 1091 CB THR A 84 34.003 17.764 18.534 1.00 0.00 C ATOM 1092 OG1 THR A 84 33.369 16.752 17.765 1.00 0.00 O ATOM 1093 CG2 THR A 84 34.337 18.901 17.552 1.00 0.00 C ATOM 0 H THR A 84 33.777 16.283 20.424 1.00 0.00 H new ATOM 0 HA THR A 84 35.786 16.627 18.510 1.00 0.00 H new ATOM 0 HB THR A 84 33.375 18.172 19.327 1.00 0.00 H new ATOM 0 HG1 THR A 84 32.652 16.341 18.292 1.00 0.00 H new ATOM 0 HG21 THR A 84 33.419 19.264 17.090 1.00 0.00 H new ATOM 0 HG22 THR A 84 34.819 19.717 18.090 1.00 0.00 H new ATOM 0 HG23 THR A 84 35.009 18.529 16.779 1.00 0.00 H new ATOM 1101 N LEU A 85 35.775 18.840 20.943 1.00 0.00 N ATOM 1102 CA LEU A 85 36.611 19.788 21.612 1.00 0.00 C ATOM 1103 C LEU A 85 37.865 19.211 22.173 1.00 0.00 C ATOM 1104 O LEU A 85 38.872 19.904 22.313 1.00 0.00 O ATOM 1105 CB LEU A 85 35.883 20.474 22.780 1.00 0.00 C ATOM 1106 CG LEU A 85 34.805 21.498 22.384 1.00 0.00 C ATOM 1107 CD1 LEU A 85 34.179 22.076 23.665 1.00 0.00 C ATOM 1108 CD2 LEU A 85 35.368 22.628 21.507 1.00 0.00 C ATOM 0 H LEU A 85 34.903 18.657 21.440 1.00 0.00 H new ATOM 0 HA LEU A 85 36.866 20.499 20.826 1.00 0.00 H new ATOM 0 HB2 LEU A 85 35.418 19.705 23.397 1.00 0.00 H new ATOM 0 HB3 LEU A 85 36.624 20.976 23.402 1.00 0.00 H new ATOM 0 HG LEU A 85 34.048 20.987 21.788 1.00 0.00 H new ATOM 0 HD11 LEU A 85 33.413 22.804 23.399 1.00 0.00 H new ATOM 0 HD12 LEU A 85 33.729 21.271 24.245 1.00 0.00 H new ATOM 0 HD13 LEU A 85 34.952 22.564 24.260 1.00 0.00 H new ATOM 0 HD21 LEU A 85 34.569 23.325 21.254 1.00 0.00 H new ATOM 0 HD22 LEU A 85 36.151 23.156 22.052 1.00 0.00 H new ATOM 0 HD23 LEU A 85 35.784 22.206 20.592 1.00 0.00 H new ATOM 1120 N ARG A 86 37.870 17.923 22.561 1.00 0.00 N ATOM 1121 CA ARG A 86 39.064 17.237 22.948 1.00 0.00 C ATOM 1122 C ARG A 86 39.946 16.901 21.796 1.00 0.00 C ATOM 1123 O ARG A 86 41.147 17.166 21.823 1.00 0.00 O ATOM 1124 CB ARG A 86 38.769 16.042 23.870 1.00 0.00 C ATOM 1125 CG ARG A 86 38.170 16.478 25.209 1.00 0.00 C ATOM 1126 CD ARG A 86 38.778 15.806 26.441 1.00 0.00 C ATOM 1127 NE ARG A 86 40.133 16.391 26.647 1.00 0.00 N ATOM 1128 CZ ARG A 86 40.932 16.057 27.703 1.00 0.00 C ATOM 1129 NH1 ARG A 86 40.540 15.188 28.679 1.00 0.00 N ATOM 1130 NH2 ARG A 86 42.181 16.597 27.822 1.00 0.00 N ATOM 0 H ARG A 86 37.029 17.347 22.607 1.00 0.00 H new ATOM 0 HA ARG A 86 39.647 17.939 23.545 1.00 0.00 H new ATOM 0 HB2 ARG A 86 38.080 15.361 23.370 1.00 0.00 H new ATOM 0 HB3 ARG A 86 39.690 15.488 24.049 1.00 0.00 H new ATOM 0 HG2 ARG A 86 38.287 17.557 25.308 1.00 0.00 H new ATOM 0 HG3 ARG A 86 37.099 16.274 25.194 1.00 0.00 H new ATOM 0 HD2 ARG A 86 38.151 15.972 27.317 1.00 0.00 H new ATOM 0 HD3 ARG A 86 38.844 14.728 26.296 1.00 0.00 H new ATOM 0 HE ARG A 86 40.479 17.071 25.970 1.00 0.00 H new ATOM 0 HH11 ARG A 86 39.616 14.758 28.638 1.00 0.00 H new ATOM 0 HH12 ARG A 86 41.171 14.968 29.450 1.00 0.00 H new ATOM 0 HH21 ARG A 86 42.522 17.254 27.120 1.00 0.00 H new ATOM 0 HH22 ARG A 86 42.773 16.344 28.613 1.00 0.00 H new ATOM 1144 N ASN A 87 39.404 16.332 20.704 1.00 0.00 N ATOM 1145 CA ASN A 87 40.147 15.901 19.561 1.00 0.00 C ATOM 1146 C ASN A 87 40.318 16.961 18.528 1.00 0.00 C ATOM 1147 O ASN A 87 39.999 16.784 17.354 1.00 0.00 O ATOM 1148 CB ASN A 87 39.478 14.638 18.994 1.00 0.00 C ATOM 1149 CG ASN A 87 40.400 13.833 18.090 1.00 0.00 C ATOM 1150 OD1 ASN A 87 41.621 13.837 18.238 1.00 0.00 O ATOM 1151 ND2 ASN A 87 39.811 13.091 17.114 1.00 0.00 N ATOM 0 H ASN A 87 38.402 16.165 20.614 1.00 0.00 H new ATOM 0 HA ASN A 87 41.164 15.669 19.879 1.00 0.00 H new ATOM 0 HB2 ASN A 87 39.146 14.008 19.819 1.00 0.00 H new ATOM 0 HB3 ASN A 87 38.588 14.925 18.434 1.00 0.00 H new ATOM 0 HD21 ASN A 87 40.384 12.524 16.488 1.00 0.00 H new ATOM 0 HD22 ASN A 87 38.797 13.101 17.008 1.00 0.00 H new ATOM 1158 N THR A 88 40.877 18.123 18.911 1.00 0.00 N ATOM 1159 CA THR A 88 41.190 19.229 18.060 1.00 0.00 C ATOM 1160 C THR A 88 42.517 19.056 17.404 1.00 0.00 C ATOM 1161 O THR A 88 43.230 18.084 17.649 1.00 0.00 O ATOM 1162 CB THR A 88 41.161 20.549 18.772 1.00 0.00 C ATOM 1163 OG1 THR A 88 41.990 20.584 19.926 1.00 0.00 O ATOM 1164 CG2 THR A 88 39.719 20.811 19.237 1.00 0.00 C ATOM 0 H THR A 88 41.127 18.301 19.884 1.00 0.00 H new ATOM 0 HA THR A 88 40.406 19.240 17.303 1.00 0.00 H new ATOM 0 HB THR A 88 41.528 21.299 18.071 1.00 0.00 H new ATOM 0 HG1 THR A 88 42.922 20.723 19.655 1.00 0.00 H new ATOM 0 HG21 THR A 88 39.673 21.767 19.758 1.00 0.00 H new ATOM 0 HG22 THR A 88 39.057 20.837 18.372 1.00 0.00 H new ATOM 0 HG23 THR A 88 39.404 20.015 19.911 1.00 0.00 H new ATOM 1172 N GLY A 89 42.933 19.997 16.538 1.00 0.00 N ATOM 1173 CA GLY A 89 44.286 20.122 16.091 1.00 0.00 C ATOM 1174 C GLY A 89 45.081 20.925 17.062 1.00 0.00 C ATOM 1175 O GLY A 89 44.712 21.053 18.228 1.00 0.00 O ATOM 0 H GLY A 89 42.307 20.694 16.135 1.00 0.00 H new ATOM 0 HA2 GLY A 89 44.731 19.133 15.976 1.00 0.00 H new ATOM 0 HA3 GLY A 89 44.309 20.598 15.111 1.00 0.00 H new ATOM 1179 N GLN A 90 46.205 21.536 16.645 1.00 0.00 N ATOM 1180 CA GLN A 90 46.914 22.492 17.439 1.00 0.00 C ATOM 1181 C GLN A 90 46.154 23.770 17.535 1.00 0.00 C ATOM 1182 O GLN A 90 45.888 24.287 18.620 1.00 0.00 O ATOM 1183 CB GLN A 90 48.343 22.698 16.910 1.00 0.00 C ATOM 1184 CG GLN A 90 49.375 23.174 17.935 1.00 0.00 C ATOM 1185 CD GLN A 90 49.297 24.659 18.260 1.00 0.00 C ATOM 1186 OE1 GLN A 90 49.190 25.516 17.384 1.00 0.00 O ATOM 1187 NE2 GLN A 90 49.419 24.991 19.573 1.00 0.00 N ATOM 0 H GLN A 90 46.631 21.362 15.735 1.00 0.00 H new ATOM 0 HA GLN A 90 47.007 22.099 18.452 1.00 0.00 H new ATOM 0 HB2 GLN A 90 48.691 21.757 16.484 1.00 0.00 H new ATOM 0 HB3 GLN A 90 48.307 23.422 16.096 1.00 0.00 H new ATOM 0 HG2 GLN A 90 49.244 22.605 18.856 1.00 0.00 H new ATOM 0 HG3 GLN A 90 50.373 22.948 17.560 1.00 0.00 H new ATOM 0 HE21 GLN A 90 49.506 24.259 20.278 1.00 0.00 H new ATOM 0 HE22 GLN A 90 49.423 25.972 19.853 1.00 0.00 H new ATOM 1196 N VAL A 91 45.727 24.295 16.373 1.00 0.00 N ATOM 1197 CA VAL A 91 44.882 25.442 16.245 1.00 0.00 C ATOM 1198 C VAL A 91 43.471 25.010 16.034 1.00 0.00 C ATOM 1199 O VAL A 91 43.163 24.081 15.288 1.00 0.00 O ATOM 1200 CB VAL A 91 45.314 26.361 15.140 1.00 0.00 C ATOM 1201 CG1 VAL A 91 44.463 27.641 15.080 1.00 0.00 C ATOM 1202 CG2 VAL A 91 46.786 26.745 15.362 1.00 0.00 C ATOM 0 H VAL A 91 45.987 23.896 15.471 1.00 0.00 H new ATOM 0 HA VAL A 91 44.962 26.007 17.174 1.00 0.00 H new ATOM 0 HB VAL A 91 45.183 25.834 14.195 1.00 0.00 H new ATOM 0 HG11 VAL A 91 44.814 28.274 14.265 1.00 0.00 H new ATOM 0 HG12 VAL A 91 43.419 27.376 14.910 1.00 0.00 H new ATOM 0 HG13 VAL A 91 44.552 28.181 16.022 1.00 0.00 H new ATOM 0 HG21 VAL A 91 47.112 27.413 14.565 1.00 0.00 H new ATOM 0 HG22 VAL A 91 46.890 27.249 16.323 1.00 0.00 H new ATOM 0 HG23 VAL A 91 47.402 25.845 15.356 1.00 0.00 H new ATOM 1212 N VAL A 92 42.543 25.674 16.744 1.00 0.00 N ATOM 1213 CA VAL A 92 41.123 25.497 16.760 1.00 0.00 C ATOM 1214 C VAL A 92 40.496 26.651 16.056 1.00 0.00 C ATOM 1215 O VAL A 92 40.718 27.808 16.411 1.00 0.00 O ATOM 1216 CB VAL A 92 40.652 25.480 18.184 1.00 0.00 C ATOM 1217 CG1 VAL A 92 39.126 25.605 18.327 1.00 0.00 C ATOM 1218 CG2 VAL A 92 41.076 24.116 18.755 1.00 0.00 C ATOM 0 H VAL A 92 42.823 26.421 17.380 1.00 0.00 H new ATOM 0 HA VAL A 92 40.852 24.562 16.269 1.00 0.00 H new ATOM 0 HB VAL A 92 41.085 26.334 18.706 1.00 0.00 H new ATOM 0 HG11 VAL A 92 38.857 25.586 19.383 1.00 0.00 H new ATOM 0 HG12 VAL A 92 38.795 26.545 17.885 1.00 0.00 H new ATOM 0 HG13 VAL A 92 38.643 24.773 17.814 1.00 0.00 H new ATOM 0 HG21 VAL A 92 40.759 24.043 19.795 1.00 0.00 H new ATOM 0 HG22 VAL A 92 40.609 23.319 18.177 1.00 0.00 H new ATOM 0 HG23 VAL A 92 42.160 24.019 18.698 1.00 0.00 H new ATOM 1228 N HIS A 93 39.648 26.377 15.049 1.00 0.00 N ATOM 1229 CA HIS A 93 38.798 27.385 14.494 1.00 0.00 C ATOM 1230 C HIS A 93 37.406 27.154 14.974 1.00 0.00 C ATOM 1231 O HIS A 93 36.785 26.169 14.578 1.00 0.00 O ATOM 1232 CB HIS A 93 38.771 27.322 12.958 1.00 0.00 C ATOM 1233 CG HIS A 93 38.214 28.562 12.321 1.00 0.00 C ATOM 1234 ND1 HIS A 93 37.908 28.659 10.979 1.00 0.00 N ATOM 1235 CD2 HIS A 93 38.000 29.802 12.836 1.00 0.00 C ATOM 1236 CE1 HIS A 93 37.527 29.944 10.751 1.00 0.00 C ATOM 1237 NE2 HIS A 93 37.560 30.666 11.855 1.00 0.00 N ATOM 0 H HIS A 93 39.551 25.457 14.619 1.00 0.00 H new ATOM 0 HA HIS A 93 39.183 28.356 14.806 1.00 0.00 H new ATOM 0 HB2 HIS A 93 39.784 27.157 12.591 1.00 0.00 H new ATOM 0 HB3 HIS A 93 38.175 26.464 12.647 1.00 0.00 H new ATOM 0 HD2 HIS A 93 38.153 30.073 13.870 1.00 0.00 H new ATOM 0 HE1 HIS A 93 37.233 30.327 9.785 1.00 0.00 H new ATOM 0 HE2 HIS A 93 37.313 31.650 11.960 1.00 0.00 H new ATOM 1245 N LEU A 94 36.834 28.000 15.850 1.00 0.00 N ATOM 1246 CA LEU A 94 35.426 27.936 16.087 1.00 0.00 C ATOM 1247 C LEU A 94 34.650 29.194 15.900 1.00 0.00 C ATOM 1248 O LEU A 94 35.145 30.311 16.044 1.00 0.00 O ATOM 1249 CB LEU A 94 35.023 27.122 17.327 1.00 0.00 C ATOM 1250 CG LEU A 94 35.650 27.458 18.691 1.00 0.00 C ATOM 1251 CD1 LEU A 94 34.871 28.578 19.400 1.00 0.00 C ATOM 1252 CD2 LEU A 94 35.590 26.162 19.519 1.00 0.00 C ATOM 0 H LEU A 94 37.333 28.712 16.383 1.00 0.00 H new ATOM 0 HA LEU A 94 35.092 27.342 15.236 1.00 0.00 H new ATOM 0 HB2 LEU A 94 33.942 27.206 17.435 1.00 0.00 H new ATOM 0 HB3 LEU A 94 35.242 26.075 17.116 1.00 0.00 H new ATOM 0 HG LEU A 94 36.673 27.814 18.570 1.00 0.00 H new ATOM 0 HD11 LEU A 94 35.338 28.794 20.361 1.00 0.00 H new ATOM 0 HD12 LEU A 94 34.881 29.476 18.782 1.00 0.00 H new ATOM 0 HD13 LEU A 94 33.841 28.260 19.560 1.00 0.00 H new ATOM 0 HD21 LEU A 94 36.023 26.339 20.503 1.00 0.00 H new ATOM 0 HD22 LEU A 94 34.552 25.849 19.630 1.00 0.00 H new ATOM 0 HD23 LEU A 94 36.152 25.379 19.010 1.00 0.00 H new ATOM 1264 N LEU A 95 33.369 29.008 15.533 1.00 0.00 N ATOM 1265 CA LEU A 95 32.396 30.023 15.271 1.00 0.00 C ATOM 1266 C LEU A 95 31.331 29.901 16.305 1.00 0.00 C ATOM 1267 O LEU A 95 30.858 28.805 16.598 1.00 0.00 O ATOM 1268 CB LEU A 95 31.775 29.782 13.885 1.00 0.00 C ATOM 1269 CG LEU A 95 30.589 30.679 13.490 1.00 0.00 C ATOM 1270 CD1 LEU A 95 31.008 32.146 13.294 1.00 0.00 C ATOM 1271 CD2 LEU A 95 29.923 30.120 12.222 1.00 0.00 C ATOM 0 H LEU A 95 32.985 28.071 15.410 1.00 0.00 H new ATOM 0 HA LEU A 95 32.853 31.012 15.296 1.00 0.00 H new ATOM 0 HB2 LEU A 95 32.558 29.905 13.136 1.00 0.00 H new ATOM 0 HB3 LEU A 95 31.447 28.744 13.836 1.00 0.00 H new ATOM 0 HG LEU A 95 29.870 30.671 14.309 1.00 0.00 H new ATOM 0 HD11 LEU A 95 30.137 32.739 13.016 1.00 0.00 H new ATOM 0 HD12 LEU A 95 31.428 32.532 14.223 1.00 0.00 H new ATOM 0 HD13 LEU A 95 31.756 32.208 12.504 1.00 0.00 H new ATOM 0 HD21 LEU A 95 29.083 30.755 11.942 1.00 0.00 H new ATOM 0 HD22 LEU A 95 30.649 30.099 11.409 1.00 0.00 H new ATOM 0 HD23 LEU A 95 29.565 29.109 12.415 1.00 0.00 H new ATOM 1283 N LEU A 96 30.901 31.025 16.906 1.00 0.00 N ATOM 1284 CA LEU A 96 29.891 30.942 17.916 1.00 0.00 C ATOM 1285 C LEU A 96 29.066 32.177 18.039 1.00 0.00 C ATOM 1286 O LEU A 96 29.300 33.181 17.368 1.00 0.00 O ATOM 1287 CB LEU A 96 30.448 30.401 19.243 1.00 0.00 C ATOM 1288 CG LEU A 96 31.406 31.256 20.090 1.00 0.00 C ATOM 1289 CD1 LEU A 96 32.738 31.567 19.389 1.00 0.00 C ATOM 1290 CD2 LEU A 96 30.707 32.492 20.682 1.00 0.00 C ATOM 0 H LEU A 96 31.240 31.965 16.702 1.00 0.00 H new ATOM 0 HA LEU A 96 29.172 30.195 17.581 1.00 0.00 H new ATOM 0 HB2 LEU A 96 29.594 30.153 19.874 1.00 0.00 H new ATOM 0 HB3 LEU A 96 30.962 29.466 19.020 1.00 0.00 H new ATOM 0 HG LEU A 96 31.694 30.640 20.942 1.00 0.00 H new ATOM 0 HD11 LEU A 96 33.362 32.173 20.046 1.00 0.00 H new ATOM 0 HD12 LEU A 96 33.253 30.635 19.157 1.00 0.00 H new ATOM 0 HD13 LEU A 96 32.544 32.114 18.466 1.00 0.00 H new ATOM 0 HD21 LEU A 96 31.421 33.066 21.272 1.00 0.00 H new ATOM 0 HD22 LEU A 96 30.321 33.114 19.874 1.00 0.00 H new ATOM 0 HD23 LEU A 96 29.883 32.173 21.320 1.00 0.00 H new ATOM 1302 N GLU A 97 28.025 32.118 18.890 1.00 0.00 N ATOM 1303 CA GLU A 97 27.059 33.150 19.099 1.00 0.00 C ATOM 1304 C GLU A 97 27.068 33.616 20.514 1.00 0.00 C ATOM 1305 O GLU A 97 27.049 32.821 21.453 1.00 0.00 O ATOM 1306 CB GLU A 97 25.664 32.594 18.766 1.00 0.00 C ATOM 1307 CG GLU A 97 24.501 33.584 18.854 1.00 0.00 C ATOM 1308 CD GLU A 97 23.169 32.848 18.854 1.00 0.00 C ATOM 1309 OE1 GLU A 97 22.888 32.071 17.902 1.00 0.00 O ATOM 1310 OE2 GLU A 97 22.385 33.041 19.820 1.00 0.00 O ATOM 0 H GLU A 97 27.849 31.296 19.468 1.00 0.00 H new ATOM 0 HA GLU A 97 27.305 33.995 18.456 1.00 0.00 H new ATOM 0 HB2 GLU A 97 25.690 32.186 17.755 1.00 0.00 H new ATOM 0 HB3 GLU A 97 25.457 31.763 19.440 1.00 0.00 H new ATOM 0 HG2 GLU A 97 24.593 34.181 19.761 1.00 0.00 H new ATOM 0 HG3 GLU A 97 24.541 34.275 18.012 1.00 0.00 H new ATOM 1317 N LYS A 98 27.090 34.940 20.751 1.00 0.00 N ATOM 1318 CA LYS A 98 27.108 35.500 22.067 1.00 0.00 C ATOM 1319 C LYS A 98 25.776 35.507 22.731 1.00 0.00 C ATOM 1320 O LYS A 98 24.732 35.672 22.102 1.00 0.00 O ATOM 1321 CB LYS A 98 27.711 36.912 21.977 1.00 0.00 C ATOM 1322 CG LYS A 98 28.447 37.399 23.227 1.00 0.00 C ATOM 1323 CD LYS A 98 27.573 38.160 24.226 1.00 0.00 C ATOM 1324 CE LYS A 98 27.907 37.860 25.689 1.00 0.00 C ATOM 1325 NZ LYS A 98 29.300 38.234 26.021 1.00 0.00 N ATOM 0 H LYS A 98 27.095 35.639 20.008 1.00 0.00 H new ATOM 0 HA LYS A 98 27.724 34.865 22.703 1.00 0.00 H new ATOM 0 HB2 LYS A 98 28.404 36.938 21.136 1.00 0.00 H new ATOM 0 HB3 LYS A 98 26.910 37.616 21.752 1.00 0.00 H new ATOM 0 HG2 LYS A 98 28.887 36.539 23.731 1.00 0.00 H new ATOM 0 HG3 LYS A 98 29.270 38.044 22.920 1.00 0.00 H new ATOM 0 HD2 LYS A 98 27.683 39.230 24.050 1.00 0.00 H new ATOM 0 HD3 LYS A 98 26.527 37.912 24.043 1.00 0.00 H new ATOM 0 HE2 LYS A 98 27.220 38.403 26.338 1.00 0.00 H new ATOM 0 HE3 LYS A 98 27.759 36.798 25.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 29.375 38.424 27.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 29.939 37.454 25.767 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 29.567 39.087 25.489 1.00 0.00 H new ATOM 1339 N GLY A 99 25.741 35.326 24.064 1.00 0.00 N ATOM 1340 CA GLY A 99 24.570 35.489 24.870 1.00 0.00 C ATOM 1341 C GLY A 99 24.375 36.917 25.247 1.00 0.00 C ATOM 1342 O GLY A 99 24.753 37.347 26.336 1.00 0.00 O ATOM 0 H GLY A 99 26.563 35.055 24.603 1.00 0.00 H new ATOM 0 HA2 GLY A 99 23.697 35.131 24.325 1.00 0.00 H new ATOM 0 HA3 GLY A 99 24.656 34.880 25.770 1.00 0.00 H new ATOM 1346 N GLN A 100 23.844 37.725 24.312 1.00 0.00 N ATOM 1347 CA GLN A 100 23.971 39.149 24.313 1.00 0.00 C ATOM 1348 C GLN A 100 22.984 39.895 25.143 1.00 0.00 C ATOM 1349 O GLN A 100 22.065 39.330 25.733 1.00 0.00 O ATOM 1350 CB GLN A 100 23.918 39.626 22.852 1.00 0.00 C ATOM 1351 CG GLN A 100 22.572 39.408 22.159 1.00 0.00 C ATOM 1352 CD GLN A 100 22.703 39.558 20.651 1.00 0.00 C ATOM 1353 OE1 GLN A 100 22.729 40.663 20.110 1.00 0.00 O ATOM 1354 NE2 GLN A 100 22.818 38.407 19.937 1.00 0.00 N ATOM 0 H GLN A 100 23.304 37.371 23.523 1.00 0.00 H new ATOM 0 HA GLN A 100 24.925 39.374 24.791 1.00 0.00 H new ATOM 0 HB2 GLN A 100 24.159 40.688 22.822 1.00 0.00 H new ATOM 0 HB3 GLN A 100 24.691 39.107 22.286 1.00 0.00 H new ATOM 0 HG2 GLN A 100 22.193 38.414 22.397 1.00 0.00 H new ATOM 0 HG3 GLN A 100 21.844 40.126 22.537 1.00 0.00 H new ATOM 0 HE21 GLN A 100 22.793 37.506 20.414 1.00 0.00 H new ATOM 0 HE22 GLN A 100 22.930 38.444 18.924 1.00 0.00 H new ATOM 1363 N VAL A 101 23.128 41.232 25.206 1.00 0.00 N ATOM 1364 CA VAL A 101 22.307 42.096 25.996 1.00 0.00 C ATOM 1365 C VAL A 101 21.406 42.892 25.116 1.00 0.00 C ATOM 1366 O VAL A 101 21.919 43.634 24.280 1.00 0.00 O ATOM 1367 CB VAL A 101 23.139 43.003 26.854 1.00 0.00 C ATOM 1368 CG1 VAL A 101 22.267 43.983 27.656 1.00 0.00 C ATOM 1369 CG2 VAL A 101 23.943 42.151 27.850 1.00 0.00 C ATOM 0 H VAL A 101 23.848 41.731 24.684 1.00 0.00 H new ATOM 0 HA VAL A 101 21.700 41.477 26.657 1.00 0.00 H new ATOM 0 HB VAL A 101 23.796 43.575 26.199 1.00 0.00 H new ATOM 0 HG11 VAL A 101 22.905 44.623 28.265 1.00 0.00 H new ATOM 0 HG12 VAL A 101 21.685 44.598 26.969 1.00 0.00 H new ATOM 0 HG13 VAL A 101 21.591 43.423 28.303 1.00 0.00 H new ATOM 0 HG21 VAL A 101 24.551 42.802 28.478 1.00 0.00 H new ATOM 0 HG22 VAL A 101 23.258 41.580 28.476 1.00 0.00 H new ATOM 0 HG23 VAL A 101 24.591 41.466 27.303 1.00 0.00 H new ATOM 1379 N PRO A 102 20.111 42.804 25.190 1.00 0.00 N ATOM 1380 CA PRO A 102 19.230 43.747 24.565 1.00 0.00 C ATOM 1381 C PRO A 102 19.165 45.052 25.281 1.00 0.00 C ATOM 1382 O PRO A 102 19.415 46.099 24.625 1.00 0.00 O ATOM 1383 CB PRO A 102 17.873 43.048 24.539 1.00 0.00 C ATOM 1384 CG PRO A 102 17.915 42.083 25.734 1.00 0.00 C ATOM 1385 CD PRO A 102 19.394 41.664 25.739 1.00 0.00 C ATOM 1386 OXT PRO A 102 18.842 45.128 26.496 1.00 0.00 O ATOM 0 HA PRO A 102 19.582 44.013 23.568 1.00 0.00 H new ATOM 0 HB2 PRO A 102 17.056 43.763 24.635 1.00 0.00 H new ATOM 0 HB3 PRO A 102 17.720 42.513 23.602 1.00 0.00 H new ATOM 0 HG2 PRO A 102 17.624 42.570 26.665 1.00 0.00 H new ATOM 0 HG3 PRO A 102 17.248 41.232 25.597 1.00 0.00 H new ATOM 0 HD2 PRO A 102 19.735 41.432 26.748 1.00 0.00 H new ATOM 0 HD3 PRO A 102 19.553 40.770 25.136 1.00 0.00 H new TER 1394 PRO A 102