USER MOD reduce.3.24.130724 H: found=0, std=0, add=458, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 459 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 MET CE :methyl -133:sc= -0.114 (180deg=-0.888) USER MOD Single : A 137 ASN : amide:sc= -1.45! C(o=-1.4!,f=-8.2!) USER MOD Single : A 145 ASN : amide:sc= -1.22! C(o=-1.2!,f=-5.2!) USER MOD Single : A 153 TYR OH : rot 82:sc= 0.253 USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 SER OG : rot -50:sc= 0.316 USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 SER OG : rot -160:sc= -0.178 USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 169 THR OG1 : rot 78:sc= 0.374 USER MOD Single : A 176 SER OG : rot 180:sc= 0 USER MOD Single : A 177 GLN : amide:sc= 0.786 K(o=0.79,f=-7.1!) USER MOD Single : A 180 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 123 13.822 -10.847 23.734 1.00 0.00 N ATOM 2 CA ARG A 123 12.478 -11.424 23.451 1.00 0.00 C ATOM 3 C ARG A 123 11.498 -10.296 23.123 1.00 0.00 C ATOM 4 O ARG A 123 10.532 -10.076 23.827 1.00 0.00 O ATOM 5 CB ARG A 123 11.982 -12.189 24.680 1.00 0.00 C ATOM 6 CG ARG A 123 10.903 -13.188 24.257 1.00 0.00 C ATOM 7 CD ARG A 123 10.666 -14.192 25.387 1.00 0.00 C ATOM 8 NE ARG A 123 11.261 -15.506 25.016 1.00 0.00 N ATOM 9 CZ ARG A 123 11.735 -16.293 25.943 1.00 0.00 C ATOM 10 NH1 ARG A 123 10.942 -17.129 26.557 1.00 0.00 N ATOM 11 NH2 ARG A 123 13.000 -16.244 26.257 1.00 0.00 N ATOM 0 HA ARG A 123 12.546 -12.105 22.602 1.00 0.00 H new ATOM 0 HB2 ARG A 123 12.812 -12.713 25.155 1.00 0.00 H new ATOM 0 HB3 ARG A 123 11.580 -11.494 25.417 1.00 0.00 H new ATOM 0 HG2 ARG A 123 9.977 -12.662 24.023 1.00 0.00 H new ATOM 0 HG3 ARG A 123 11.211 -13.710 23.351 1.00 0.00 H new ATOM 0 HD2 ARG A 123 11.112 -13.827 26.312 1.00 0.00 H new ATOM 0 HD3 ARG A 123 9.597 -14.303 25.571 1.00 0.00 H new ATOM 0 HE ARG A 123 11.298 -15.791 24.037 1.00 0.00 H new ATOM 0 HH11 ARG A 123 9.953 -17.167 26.312 1.00 0.00 H new ATOM 0 HH12 ARG A 123 11.312 -17.744 27.282 1.00 0.00 H new ATOM 0 HH21 ARG A 123 13.619 -15.590 25.778 1.00 0.00 H new ATOM 0 HH22 ARG A 123 13.370 -16.859 26.982 1.00 0.00 H new ATOM 25 N PRO A 124 11.756 -9.569 22.026 1.00 0.00 N ATOM 26 CA PRO A 124 10.900 -8.457 21.594 1.00 0.00 C ATOM 27 C PRO A 124 9.449 -8.904 21.389 1.00 0.00 C ATOM 28 O PRO A 124 9.185 -10.016 20.975 1.00 0.00 O ATOM 29 CB PRO A 124 11.509 -8.033 20.258 1.00 0.00 C ATOM 30 CG PRO A 124 12.205 -9.254 19.758 1.00 0.00 C ATOM 31 CD PRO A 124 12.704 -9.980 20.975 1.00 0.00 C ATOM 0 HA PRO A 124 10.864 -7.657 22.334 1.00 0.00 H new ATOM 0 HB2 PRO A 124 10.741 -7.701 19.560 1.00 0.00 H new ATOM 0 HB3 PRO A 124 12.205 -7.204 20.385 1.00 0.00 H new ATOM 0 HG2 PRO A 124 11.525 -9.881 19.182 1.00 0.00 H new ATOM 0 HG3 PRO A 124 13.030 -8.989 19.097 1.00 0.00 H new ATOM 0 HD2 PRO A 124 12.700 -11.060 20.829 1.00 0.00 H new ATOM 0 HD3 PRO A 124 13.727 -9.696 21.222 1.00 0.00 H new ATOM 39 N LYS A 125 8.508 -8.047 21.675 1.00 0.00 N ATOM 40 CA LYS A 125 7.078 -8.424 21.496 1.00 0.00 C ATOM 41 C LYS A 125 6.619 -8.032 20.090 1.00 0.00 C ATOM 42 O LYS A 125 7.027 -7.021 19.553 1.00 0.00 O ATOM 43 CB LYS A 125 6.224 -7.693 22.534 1.00 0.00 C ATOM 44 CG LYS A 125 6.606 -8.171 23.936 1.00 0.00 C ATOM 45 CD LYS A 125 5.670 -7.534 24.965 1.00 0.00 C ATOM 46 CE LYS A 125 6.128 -7.912 26.375 1.00 0.00 C ATOM 47 NZ LYS A 125 5.114 -8.803 27.005 1.00 0.00 N ATOM 0 H LYS A 125 8.668 -7.102 22.025 1.00 0.00 H new ATOM 0 HA LYS A 125 6.967 -9.500 21.627 1.00 0.00 H new ATOM 0 HB2 LYS A 125 6.374 -6.617 22.452 1.00 0.00 H new ATOM 0 HB3 LYS A 125 5.167 -7.882 22.349 1.00 0.00 H new ATOM 0 HG2 LYS A 125 6.540 -9.258 23.992 1.00 0.00 H new ATOM 0 HG3 LYS A 125 7.640 -7.903 24.154 1.00 0.00 H new ATOM 0 HD2 LYS A 125 5.669 -6.450 24.850 1.00 0.00 H new ATOM 0 HD3 LYS A 125 4.647 -7.873 24.800 1.00 0.00 H new ATOM 0 HE2 LYS A 125 7.094 -8.416 26.332 1.00 0.00 H new ATOM 0 HE3 LYS A 125 6.263 -7.014 26.978 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 5.425 -9.060 27.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 4.201 -8.307 27.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 5.006 -9.665 26.433 1.00 0.00 H new ATOM 61 N THR A 126 5.772 -8.823 19.490 1.00 0.00 N ATOM 62 CA THR A 126 5.289 -8.494 18.119 1.00 0.00 C ATOM 63 C THR A 126 3.908 -7.841 18.209 1.00 0.00 C ATOM 64 O THR A 126 3.220 -7.683 17.220 1.00 0.00 O ATOM 65 CB THR A 126 5.194 -9.777 17.290 1.00 0.00 C ATOM 66 OG1 THR A 126 4.187 -10.618 17.836 1.00 0.00 O ATOM 67 CG2 THR A 126 6.539 -10.505 17.317 1.00 0.00 C ATOM 0 H THR A 126 5.394 -9.682 19.889 1.00 0.00 H new ATOM 0 HA THR A 126 5.987 -7.805 17.643 1.00 0.00 H new ATOM 0 HB THR A 126 4.940 -9.527 16.260 1.00 0.00 H new ATOM 0 HG1 THR A 126 4.124 -11.439 17.305 1.00 0.00 H new ATOM 0 HG21 THR A 126 6.470 -11.419 16.726 1.00 0.00 H new ATOM 0 HG22 THR A 126 7.311 -9.859 16.898 1.00 0.00 H new ATOM 0 HG23 THR A 126 6.796 -10.757 18.346 1.00 0.00 H new ATOM 75 N LEU A 127 3.497 -7.460 19.387 1.00 0.00 N ATOM 76 CA LEU A 127 2.161 -6.818 19.539 1.00 0.00 C ATOM 77 C LEU A 127 2.313 -5.298 19.449 1.00 0.00 C ATOM 78 O LEU A 127 2.669 -4.643 20.407 1.00 0.00 O ATOM 79 CB LEU A 127 1.566 -7.192 20.898 1.00 0.00 C ATOM 80 CG LEU A 127 1.426 -8.712 20.993 1.00 0.00 C ATOM 81 CD1 LEU A 127 0.725 -9.080 22.302 1.00 0.00 C ATOM 82 CD2 LEU A 127 0.599 -9.223 19.811 1.00 0.00 C ATOM 0 H LEU A 127 4.029 -7.566 20.251 1.00 0.00 H new ATOM 0 HA LEU A 127 1.499 -7.165 18.746 1.00 0.00 H new ATOM 0 HB2 LEU A 127 2.205 -6.824 21.700 1.00 0.00 H new ATOM 0 HB3 LEU A 127 0.593 -6.718 21.024 1.00 0.00 H new ATOM 0 HG LEU A 127 2.415 -9.169 20.970 1.00 0.00 H new ATOM 0 HD11 LEU A 127 0.625 -10.163 22.369 1.00 0.00 H new ATOM 0 HD12 LEU A 127 1.313 -8.717 23.144 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -0.264 -8.623 22.326 1.00 0.00 H new ATOM 0 HD21 LEU A 127 0.499 -10.306 19.878 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.390 -8.765 19.834 1.00 0.00 H new ATOM 0 HD23 LEU A 127 1.098 -8.962 18.878 1.00 0.00 H new ATOM 94 N PHE A 128 2.045 -4.733 18.303 1.00 0.00 N ATOM 95 CA PHE A 128 2.175 -3.257 18.153 1.00 0.00 C ATOM 96 C PHE A 128 0.808 -2.656 17.818 1.00 0.00 C ATOM 97 O PHE A 128 -0.001 -3.265 17.146 1.00 0.00 O ATOM 98 CB PHE A 128 3.160 -2.943 17.025 1.00 0.00 C ATOM 99 CG PHE A 128 4.481 -3.617 17.308 1.00 0.00 C ATOM 100 CD1 PHE A 128 5.383 -3.039 18.210 1.00 0.00 C ATOM 101 CD2 PHE A 128 4.804 -4.820 16.669 1.00 0.00 C ATOM 102 CE1 PHE A 128 6.607 -3.665 18.472 1.00 0.00 C ATOM 103 CE2 PHE A 128 6.029 -5.445 16.931 1.00 0.00 C ATOM 104 CZ PHE A 128 6.931 -4.867 17.833 1.00 0.00 C ATOM 0 H PHE A 128 1.742 -5.230 17.465 1.00 0.00 H new ATOM 0 HA PHE A 128 2.542 -2.828 19.086 1.00 0.00 H new ATOM 0 HB2 PHE A 128 2.760 -3.289 16.072 1.00 0.00 H new ATOM 0 HB3 PHE A 128 3.300 -1.865 16.940 1.00 0.00 H new ATOM 0 HD1 PHE A 128 5.134 -2.111 18.703 1.00 0.00 H new ATOM 0 HD2 PHE A 128 4.108 -5.266 15.974 1.00 0.00 H new ATOM 0 HE1 PHE A 128 7.302 -3.220 19.168 1.00 0.00 H new ATOM 0 HE2 PHE A 128 6.278 -6.373 16.438 1.00 0.00 H new ATOM 0 HZ PHE A 128 7.876 -5.349 18.035 1.00 0.00 H new ATOM 114 N GLU A 129 0.543 -1.465 18.280 1.00 0.00 N ATOM 115 CA GLU A 129 -0.771 -0.827 17.988 1.00 0.00 C ATOM 116 C GLU A 129 -0.558 0.653 17.663 1.00 0.00 C ATOM 117 O GLU A 129 0.448 1.236 18.014 1.00 0.00 O ATOM 118 CB GLU A 129 -1.684 -0.956 19.209 1.00 0.00 C ATOM 119 CG GLU A 129 -2.748 -2.022 18.939 1.00 0.00 C ATOM 120 CD GLU A 129 -4.096 -1.547 19.487 1.00 0.00 C ATOM 121 OE1 GLU A 129 -4.272 -1.595 20.694 1.00 0.00 O ATOM 122 OE2 GLU A 129 -4.928 -1.144 18.692 1.00 0.00 O ATOM 0 H GLU A 129 1.180 -0.906 18.847 1.00 0.00 H new ATOM 0 HA GLU A 129 -1.234 -1.323 17.135 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -1.098 -1.226 20.088 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -2.159 0.001 19.424 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -2.825 -2.211 17.868 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -2.463 -2.963 19.410 1.00 0.00 H new ATOM 129 N PRO A 130 -1.532 1.268 16.976 1.00 0.00 N ATOM 130 CA PRO A 130 -1.458 2.685 16.597 1.00 0.00 C ATOM 131 C PRO A 130 -1.184 3.584 17.806 1.00 0.00 C ATOM 132 O PRO A 130 -1.850 3.499 18.819 1.00 0.00 O ATOM 133 CB PRO A 130 -2.849 2.978 16.034 1.00 0.00 C ATOM 134 CG PRO A 130 -3.737 1.972 16.684 1.00 0.00 C ATOM 135 CD PRO A 130 -2.903 0.737 16.877 1.00 0.00 C ATOM 0 HA PRO A 130 -0.648 2.878 15.893 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -3.165 3.995 16.267 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -2.866 2.880 14.949 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -4.111 2.342 17.639 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -4.607 1.761 16.062 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -3.190 0.194 17.777 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -3.008 0.046 16.041 1.00 0.00 H new ATOM 143 N GLY A 131 -0.209 4.446 17.707 1.00 0.00 N ATOM 144 CA GLY A 131 0.106 5.349 18.850 1.00 0.00 C ATOM 145 C GLY A 131 1.143 4.685 19.759 1.00 0.00 C ATOM 146 O GLY A 131 1.568 5.252 20.747 1.00 0.00 O ATOM 0 H GLY A 131 0.383 4.564 16.885 1.00 0.00 H new ATOM 0 HA2 GLY A 131 0.488 6.300 18.480 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -0.801 5.567 19.415 1.00 0.00 H new ATOM 150 N GLU A 132 1.556 3.490 19.436 1.00 0.00 N ATOM 151 CA GLU A 132 2.565 2.796 20.285 1.00 0.00 C ATOM 152 C GLU A 132 3.971 3.207 19.845 1.00 0.00 C ATOM 153 O GLU A 132 4.275 3.258 18.669 1.00 0.00 O ATOM 154 CB GLU A 132 2.406 1.282 20.132 1.00 0.00 C ATOM 155 CG GLU A 132 1.039 0.855 20.672 1.00 0.00 C ATOM 156 CD GLU A 132 0.941 1.217 22.155 1.00 0.00 C ATOM 157 OE1 GLU A 132 1.977 1.436 22.761 1.00 0.00 O ATOM 158 OE2 GLU A 132 -0.169 1.269 22.660 1.00 0.00 O ATOM 0 H GLU A 132 1.239 2.965 18.621 1.00 0.00 H new ATOM 0 HA GLU A 132 2.414 3.074 21.328 1.00 0.00 H new ATOM 0 HB2 GLU A 132 2.499 1.000 19.083 1.00 0.00 H new ATOM 0 HB3 GLU A 132 3.200 0.766 20.672 1.00 0.00 H new ATOM 0 HG2 GLU A 132 0.245 1.349 20.113 1.00 0.00 H new ATOM 0 HG3 GLU A 132 0.902 -0.218 20.539 1.00 0.00 H new ATOM 165 N MET A 133 4.834 3.501 20.779 1.00 0.00 N ATOM 166 CA MET A 133 6.219 3.908 20.413 1.00 0.00 C ATOM 167 C MET A 133 7.046 2.664 20.082 1.00 0.00 C ATOM 168 O MET A 133 6.849 1.608 20.650 1.00 0.00 O ATOM 169 CB MET A 133 6.861 4.650 21.588 1.00 0.00 C ATOM 170 CG MET A 133 8.356 4.836 21.318 1.00 0.00 C ATOM 171 SD MET A 133 9.091 5.818 22.649 1.00 0.00 S ATOM 172 CE MET A 133 8.383 7.413 22.170 1.00 0.00 C ATOM 0 H MET A 133 4.639 3.477 21.780 1.00 0.00 H new ATOM 0 HA MET A 133 6.186 4.564 19.543 1.00 0.00 H new ATOM 0 HB2 MET A 133 6.382 5.619 21.725 1.00 0.00 H new ATOM 0 HB3 MET A 133 6.714 4.088 22.511 1.00 0.00 H new ATOM 0 HG2 MET A 133 8.848 3.866 21.253 1.00 0.00 H new ATOM 0 HG3 MET A 133 8.504 5.334 20.360 1.00 0.00 H new ATOM 0 HE1 MET A 133 9.162 8.176 22.184 1.00 0.00 H new ATOM 0 HE2 MET A 133 7.966 7.339 21.166 1.00 0.00 H new ATOM 0 HE3 MET A 133 7.594 7.686 22.871 1.00 0.00 H new ATOM 182 N VAL A 134 7.969 2.779 19.168 1.00 0.00 N ATOM 183 CA VAL A 134 8.806 1.602 18.802 1.00 0.00 C ATOM 184 C VAL A 134 10.281 2.011 18.798 1.00 0.00 C ATOM 185 O VAL A 134 10.620 3.149 19.052 1.00 0.00 O ATOM 186 CB VAL A 134 8.408 1.108 17.410 1.00 0.00 C ATOM 187 CG1 VAL A 134 8.863 -0.342 17.232 1.00 0.00 C ATOM 188 CG2 VAL A 134 6.888 1.188 17.255 1.00 0.00 C ATOM 0 H VAL A 134 8.180 3.637 18.659 1.00 0.00 H new ATOM 0 HA VAL A 134 8.652 0.803 19.528 1.00 0.00 H new ATOM 0 HB VAL A 134 8.884 1.733 16.654 1.00 0.00 H new ATOM 0 HG11 VAL A 134 8.579 -0.693 16.240 1.00 0.00 H new ATOM 0 HG12 VAL A 134 9.946 -0.399 17.341 1.00 0.00 H new ATOM 0 HG13 VAL A 134 8.388 -0.968 17.988 1.00 0.00 H new ATOM 0 HG21 VAL A 134 6.604 0.836 16.263 1.00 0.00 H new ATOM 0 HG22 VAL A 134 6.412 0.564 18.011 1.00 0.00 H new ATOM 0 HG23 VAL A 134 6.563 2.221 17.380 1.00 0.00 H new ATOM 198 N ARG A 135 11.161 1.091 18.511 1.00 0.00 N ATOM 199 CA ARG A 135 12.612 1.429 18.491 1.00 0.00 C ATOM 200 C ARG A 135 13.236 0.924 17.188 1.00 0.00 C ATOM 201 O ARG A 135 12.948 -0.165 16.733 1.00 0.00 O ATOM 202 CB ARG A 135 13.306 0.763 19.681 1.00 0.00 C ATOM 203 CG ARG A 135 14.733 1.302 19.807 1.00 0.00 C ATOM 204 CD ARG A 135 15.462 0.554 20.925 1.00 0.00 C ATOM 205 NE ARG A 135 16.805 1.165 21.137 1.00 0.00 N ATOM 206 CZ ARG A 135 17.845 0.401 21.329 1.00 0.00 C ATOM 207 NH1 ARG A 135 17.754 -0.643 22.106 1.00 0.00 N ATOM 208 NH2 ARG A 135 18.978 0.682 20.743 1.00 0.00 N ATOM 0 H ARG A 135 10.938 0.121 18.290 1.00 0.00 H new ATOM 0 HA ARG A 135 12.735 2.510 18.557 1.00 0.00 H new ATOM 0 HB2 ARG A 135 12.749 0.960 20.597 1.00 0.00 H new ATOM 0 HB3 ARG A 135 13.325 -0.318 19.546 1.00 0.00 H new ATOM 0 HG2 ARG A 135 15.265 1.177 18.864 1.00 0.00 H new ATOM 0 HG3 ARG A 135 14.712 2.370 20.023 1.00 0.00 H new ATOM 0 HD2 ARG A 135 14.881 0.598 21.846 1.00 0.00 H new ATOM 0 HD3 ARG A 135 15.567 -0.499 20.665 1.00 0.00 H new ATOM 0 HE ARG A 135 16.911 2.179 21.132 1.00 0.00 H new ATOM 0 HH11 ARG A 135 16.869 -0.862 22.564 1.00 0.00 H new ATOM 0 HH12 ARG A 135 18.568 -1.240 22.256 1.00 0.00 H new ATOM 0 HH21 ARG A 135 19.049 1.498 20.136 1.00 0.00 H new ATOM 0 HH22 ARG A 135 19.791 0.085 20.893 1.00 0.00 H new ATOM 222 N VAL A 136 14.089 1.706 16.585 1.00 0.00 N ATOM 223 CA VAL A 136 14.729 1.269 15.313 1.00 0.00 C ATOM 224 C VAL A 136 16.190 0.901 15.578 1.00 0.00 C ATOM 225 O VAL A 136 16.916 1.628 16.227 1.00 0.00 O ATOM 226 CB VAL A 136 14.667 2.408 14.293 1.00 0.00 C ATOM 227 CG1 VAL A 136 15.242 1.929 12.958 1.00 0.00 C ATOM 228 CG2 VAL A 136 13.212 2.838 14.096 1.00 0.00 C ATOM 0 H VAL A 136 14.370 2.628 16.918 1.00 0.00 H new ATOM 0 HA VAL A 136 14.201 0.400 14.920 1.00 0.00 H new ATOM 0 HB VAL A 136 15.250 3.254 14.657 1.00 0.00 H new ATOM 0 HG11 VAL A 136 15.198 2.740 12.231 1.00 0.00 H new ATOM 0 HG12 VAL A 136 16.279 1.622 13.097 1.00 0.00 H new ATOM 0 HG13 VAL A 136 14.659 1.083 12.593 1.00 0.00 H new ATOM 0 HG21 VAL A 136 13.168 3.649 13.369 1.00 0.00 H new ATOM 0 HG22 VAL A 136 12.629 1.992 13.732 1.00 0.00 H new ATOM 0 HG23 VAL A 136 12.802 3.179 15.046 1.00 0.00 H new ATOM 238 N ASN A 137 16.627 -0.224 15.081 1.00 0.00 N ATOM 239 CA ASN A 137 18.041 -0.638 15.305 1.00 0.00 C ATOM 240 C ASN A 137 18.633 -1.161 13.996 1.00 0.00 C ATOM 241 O ASN A 137 19.612 -1.881 13.990 1.00 0.00 O ATOM 242 CB ASN A 137 18.086 -1.742 16.363 1.00 0.00 C ATOM 243 CG ASN A 137 17.306 -2.959 15.863 1.00 0.00 C ATOM 244 OD1 ASN A 137 16.988 -3.053 14.694 1.00 0.00 O ATOM 245 ND2 ASN A 137 16.982 -3.903 16.704 1.00 0.00 N ATOM 0 H ASN A 137 16.066 -0.874 14.530 1.00 0.00 H new ATOM 0 HA ASN A 137 18.621 0.219 15.648 1.00 0.00 H new ATOM 0 HB2 ASN A 137 19.119 -2.019 16.571 1.00 0.00 H new ATOM 0 HB3 ASN A 137 17.658 -1.382 17.299 1.00 0.00 H new ATOM 0 HD21 ASN A 137 16.462 -4.719 16.380 1.00 0.00 H new ATOM 0 HD22 ASN A 137 17.248 -3.825 17.686 1.00 0.00 H new ATOM 252 N ASP A 138 18.048 -0.806 12.885 1.00 0.00 N ATOM 253 CA ASP A 138 18.578 -1.284 11.577 1.00 0.00 C ATOM 254 C ASP A 138 18.488 -0.156 10.547 1.00 0.00 C ATOM 255 O ASP A 138 17.598 0.670 10.593 1.00 0.00 O ATOM 256 CB ASP A 138 17.753 -2.480 11.098 1.00 0.00 C ATOM 257 CG ASP A 138 18.396 -3.074 9.843 1.00 0.00 C ATOM 258 OD1 ASP A 138 19.473 -2.626 9.485 1.00 0.00 O ATOM 259 OD2 ASP A 138 17.801 -3.966 9.262 1.00 0.00 O ATOM 0 H ASP A 138 17.226 -0.205 12.827 1.00 0.00 H new ATOM 0 HA ASP A 138 19.619 -1.585 11.695 1.00 0.00 H new ATOM 0 HB2 ASP A 138 17.697 -3.234 11.883 1.00 0.00 H new ATOM 0 HB3 ASP A 138 16.731 -2.168 10.883 1.00 0.00 H new ATOM 264 N GLY A 139 19.403 -0.114 9.617 1.00 0.00 N ATOM 265 CA GLY A 139 19.368 0.960 8.585 1.00 0.00 C ATOM 266 C GLY A 139 19.725 2.300 9.233 1.00 0.00 C ATOM 267 O GLY A 139 19.935 2.386 10.426 1.00 0.00 O ATOM 0 H GLY A 139 20.173 -0.777 9.528 1.00 0.00 H new ATOM 0 HA2 GLY A 139 20.071 0.732 7.784 1.00 0.00 H new ATOM 0 HA3 GLY A 139 18.377 1.014 8.134 1.00 0.00 H new ATOM 271 N PRO A 140 19.794 3.365 8.421 1.00 0.00 N ATOM 272 CA PRO A 140 20.126 4.710 8.908 1.00 0.00 C ATOM 273 C PRO A 140 19.192 5.152 10.038 1.00 0.00 C ATOM 274 O PRO A 140 19.506 6.041 10.805 1.00 0.00 O ATOM 275 CB PRO A 140 19.918 5.598 7.681 1.00 0.00 C ATOM 276 CG PRO A 140 18.937 4.852 6.841 1.00 0.00 C ATOM 277 CD PRO A 140 19.214 3.393 7.067 1.00 0.00 C ATOM 0 HA PRO A 140 21.134 4.758 9.319 1.00 0.00 H new ATOM 0 HB2 PRO A 140 19.535 6.579 7.962 1.00 0.00 H new ATOM 0 HB3 PRO A 140 20.854 5.762 7.147 1.00 0.00 H new ATOM 0 HG2 PRO A 140 17.914 5.102 7.123 1.00 0.00 H new ATOM 0 HG3 PRO A 140 19.050 5.111 5.788 1.00 0.00 H new ATOM 0 HD2 PRO A 140 18.304 2.796 7.007 1.00 0.00 H new ATOM 0 HD3 PRO A 140 19.906 2.995 6.325 1.00 0.00 H new ATOM 285 N PHE A 141 18.045 4.538 10.147 1.00 0.00 N ATOM 286 CA PHE A 141 17.093 4.924 11.227 1.00 0.00 C ATOM 287 C PHE A 141 17.440 4.164 12.510 1.00 0.00 C ATOM 288 O PHE A 141 16.725 4.226 13.490 1.00 0.00 O ATOM 289 CB PHE A 141 15.667 4.574 10.797 1.00 0.00 C ATOM 290 CG PHE A 141 15.306 5.364 9.562 1.00 0.00 C ATOM 291 CD1 PHE A 141 14.814 6.669 9.685 1.00 0.00 C ATOM 292 CD2 PHE A 141 15.463 4.792 8.294 1.00 0.00 C ATOM 293 CE1 PHE A 141 14.479 7.402 8.540 1.00 0.00 C ATOM 294 CE2 PHE A 141 15.128 5.524 7.149 1.00 0.00 C ATOM 295 CZ PHE A 141 14.636 6.829 7.272 1.00 0.00 C ATOM 0 H PHE A 141 17.726 3.786 9.535 1.00 0.00 H new ATOM 0 HA PHE A 141 17.166 5.996 11.410 1.00 0.00 H new ATOM 0 HB2 PHE A 141 15.589 3.506 10.594 1.00 0.00 H new ATOM 0 HB3 PHE A 141 14.967 4.798 11.602 1.00 0.00 H new ATOM 0 HD1 PHE A 141 14.693 7.110 10.663 1.00 0.00 H new ATOM 0 HD2 PHE A 141 15.843 3.785 8.199 1.00 0.00 H new ATOM 0 HE1 PHE A 141 14.100 8.409 8.635 1.00 0.00 H new ATOM 0 HE2 PHE A 141 15.249 5.082 6.171 1.00 0.00 H new ATOM 0 HZ PHE A 141 14.377 7.394 6.389 1.00 0.00 H new ATOM 305 N ALA A 142 18.531 3.447 12.511 1.00 0.00 N ATOM 306 CA ALA A 142 18.919 2.685 13.731 1.00 0.00 C ATOM 307 C ALA A 142 19.262 3.664 14.856 1.00 0.00 C ATOM 308 O ALA A 142 19.739 4.756 14.618 1.00 0.00 O ATOM 309 CB ALA A 142 20.140 1.816 13.423 1.00 0.00 C ATOM 0 H ALA A 142 19.169 3.356 11.721 1.00 0.00 H new ATOM 0 HA ALA A 142 18.089 2.050 14.041 1.00 0.00 H new ATOM 0 HB1 ALA A 142 20.424 1.258 14.315 1.00 0.00 H new ATOM 0 HB2 ALA A 142 19.897 1.119 12.621 1.00 0.00 H new ATOM 0 HB3 ALA A 142 20.970 2.451 13.113 1.00 0.00 H new ATOM 315 N ASP A 143 19.022 3.283 16.081 1.00 0.00 N ATOM 316 CA ASP A 143 19.334 4.192 17.219 1.00 0.00 C ATOM 317 C ASP A 143 18.313 5.331 17.258 1.00 0.00 C ATOM 318 O ASP A 143 18.609 6.429 17.684 1.00 0.00 O ATOM 319 CB ASP A 143 20.738 4.772 17.038 1.00 0.00 C ATOM 320 CG ASP A 143 21.239 5.323 18.375 1.00 0.00 C ATOM 321 OD1 ASP A 143 20.528 5.178 19.356 1.00 0.00 O ATOM 322 OD2 ASP A 143 22.323 5.881 18.395 1.00 0.00 O ATOM 0 H ASP A 143 18.623 2.381 16.342 1.00 0.00 H new ATOM 0 HA ASP A 143 19.289 3.632 18.153 1.00 0.00 H new ATOM 0 HB2 ASP A 143 21.417 4.001 16.673 1.00 0.00 H new ATOM 0 HB3 ASP A 143 20.722 5.564 16.289 1.00 0.00 H new ATOM 327 N PHE A 144 17.112 5.078 16.815 1.00 0.00 N ATOM 328 CA PHE A 144 16.073 6.146 16.827 1.00 0.00 C ATOM 329 C PHE A 144 14.739 5.556 17.289 1.00 0.00 C ATOM 330 O PHE A 144 14.468 4.387 17.100 1.00 0.00 O ATOM 331 CB PHE A 144 15.915 6.720 15.418 1.00 0.00 C ATOM 332 CG PHE A 144 17.144 7.521 15.060 1.00 0.00 C ATOM 333 CD1 PHE A 144 17.268 8.845 15.497 1.00 0.00 C ATOM 334 CD2 PHE A 144 18.159 6.940 14.290 1.00 0.00 C ATOM 335 CE1 PHE A 144 18.407 9.588 15.165 1.00 0.00 C ATOM 336 CE2 PHE A 144 19.298 7.683 13.958 1.00 0.00 C ATOM 337 CZ PHE A 144 19.422 9.007 14.395 1.00 0.00 C ATOM 0 H PHE A 144 16.805 4.178 16.445 1.00 0.00 H new ATOM 0 HA PHE A 144 16.376 6.939 17.511 1.00 0.00 H new ATOM 0 HB2 PHE A 144 15.771 5.913 14.699 1.00 0.00 H new ATOM 0 HB3 PHE A 144 15.029 7.352 15.369 1.00 0.00 H new ATOM 0 HD1 PHE A 144 16.485 9.293 16.090 1.00 0.00 H new ATOM 0 HD2 PHE A 144 18.063 5.919 13.952 1.00 0.00 H new ATOM 0 HE1 PHE A 144 18.503 10.609 15.503 1.00 0.00 H new ATOM 0 HE2 PHE A 144 20.081 7.235 13.365 1.00 0.00 H new ATOM 0 HZ PHE A 144 20.300 9.580 14.138 1.00 0.00 H new ATOM 347 N ASN A 145 13.904 6.355 17.894 1.00 0.00 N ATOM 348 CA ASN A 145 12.588 5.839 18.367 1.00 0.00 C ATOM 349 C ASN A 145 11.461 6.582 17.646 1.00 0.00 C ATOM 350 O ASN A 145 11.669 7.622 17.054 1.00 0.00 O ATOM 351 CB ASN A 145 12.465 6.063 19.875 1.00 0.00 C ATOM 352 CG ASN A 145 12.297 7.557 20.157 1.00 0.00 C ATOM 353 OD1 ASN A 145 12.542 8.381 19.298 1.00 0.00 O ATOM 354 ND2 ASN A 145 11.886 7.945 21.333 1.00 0.00 N ATOM 0 H ASN A 145 14.076 7.343 18.081 1.00 0.00 H new ATOM 0 HA ASN A 145 12.516 4.773 18.152 1.00 0.00 H new ATOM 0 HB2 ASN A 145 11.612 5.510 20.267 1.00 0.00 H new ATOM 0 HB3 ASN A 145 13.351 5.684 20.383 1.00 0.00 H new ATOM 0 HD21 ASN A 145 11.771 8.939 21.531 1.00 0.00 H new ATOM 0 HD22 ASN A 145 11.680 7.254 22.055 1.00 0.00 H new ATOM 361 N GLY A 146 10.267 6.056 17.692 1.00 0.00 N ATOM 362 CA GLY A 146 9.129 6.733 17.010 1.00 0.00 C ATOM 363 C GLY A 146 7.822 6.027 17.376 1.00 0.00 C ATOM 364 O GLY A 146 7.796 5.139 18.205 1.00 0.00 O ATOM 0 H GLY A 146 10.031 5.187 18.172 1.00 0.00 H new ATOM 0 HA2 GLY A 146 9.084 7.781 17.307 1.00 0.00 H new ATOM 0 HA3 GLY A 146 9.275 6.714 15.930 1.00 0.00 H new ATOM 368 N VAL A 147 6.736 6.414 16.765 1.00 0.00 N ATOM 369 CA VAL A 147 5.432 5.765 17.078 1.00 0.00 C ATOM 370 C VAL A 147 4.858 5.134 15.808 1.00 0.00 C ATOM 371 O VAL A 147 5.115 5.585 14.709 1.00 0.00 O ATOM 372 CB VAL A 147 4.456 6.814 17.614 1.00 0.00 C ATOM 373 CG1 VAL A 147 3.120 6.146 17.946 1.00 0.00 C ATOM 374 CG2 VAL A 147 5.036 7.452 18.878 1.00 0.00 C ATOM 0 H VAL A 147 6.696 7.152 16.062 1.00 0.00 H new ATOM 0 HA VAL A 147 5.583 4.991 17.831 1.00 0.00 H new ATOM 0 HB VAL A 147 4.299 7.584 16.858 1.00 0.00 H new ATOM 0 HG11 VAL A 147 2.425 6.893 18.328 1.00 0.00 H new ATOM 0 HG12 VAL A 147 2.706 5.692 17.045 1.00 0.00 H new ATOM 0 HG13 VAL A 147 3.276 5.376 18.702 1.00 0.00 H new ATOM 0 HG21 VAL A 147 4.341 8.200 19.260 1.00 0.00 H new ATOM 0 HG22 VAL A 147 5.194 6.683 19.634 1.00 0.00 H new ATOM 0 HG23 VAL A 147 5.987 7.929 18.641 1.00 0.00 H new ATOM 384 N VAL A 148 4.083 4.094 15.949 1.00 0.00 N ATOM 385 CA VAL A 148 3.494 3.436 14.749 1.00 0.00 C ATOM 386 C VAL A 148 2.096 4.003 14.491 1.00 0.00 C ATOM 387 O VAL A 148 1.129 3.603 15.108 1.00 0.00 O ATOM 388 CB VAL A 148 3.403 1.926 14.991 1.00 0.00 C ATOM 389 CG1 VAL A 148 2.816 1.666 16.380 1.00 0.00 C ATOM 390 CG2 VAL A 148 2.504 1.289 13.928 1.00 0.00 C ATOM 0 H VAL A 148 3.832 3.672 16.843 1.00 0.00 H new ATOM 0 HA VAL A 148 4.125 3.626 13.881 1.00 0.00 H new ATOM 0 HB VAL A 148 4.400 1.489 14.930 1.00 0.00 H new ATOM 0 HG11 VAL A 148 2.751 0.592 16.552 1.00 0.00 H new ATOM 0 HG12 VAL A 148 3.458 2.117 17.137 1.00 0.00 H new ATOM 0 HG13 VAL A 148 1.820 2.104 16.442 1.00 0.00 H new ATOM 0 HG21 VAL A 148 2.440 0.215 14.102 1.00 0.00 H new ATOM 0 HG22 VAL A 148 1.507 1.726 13.986 1.00 0.00 H new ATOM 0 HG23 VAL A 148 2.924 1.472 12.939 1.00 0.00 H new ATOM 400 N GLU A 149 1.981 4.931 13.581 1.00 0.00 N ATOM 401 CA GLU A 149 0.646 5.521 13.284 1.00 0.00 C ATOM 402 C GLU A 149 -0.231 4.474 12.594 1.00 0.00 C ATOM 403 O GLU A 149 -1.423 4.402 12.819 1.00 0.00 O ATOM 404 CB GLU A 149 0.816 6.731 12.363 1.00 0.00 C ATOM 405 CG GLU A 149 1.641 7.804 13.077 1.00 0.00 C ATOM 406 CD GLU A 149 0.867 8.318 14.293 1.00 0.00 C ATOM 407 OE1 GLU A 149 -0.324 8.064 14.363 1.00 0.00 O ATOM 408 OE2 GLU A 149 1.479 8.956 15.133 1.00 0.00 O ATOM 0 H GLU A 149 2.754 5.306 13.031 1.00 0.00 H new ATOM 0 HA GLU A 149 0.173 5.836 14.214 1.00 0.00 H new ATOM 0 HB2 GLU A 149 1.311 6.432 11.439 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -0.160 7.131 12.087 1.00 0.00 H new ATOM 0 HG2 GLU A 149 2.600 7.392 13.391 1.00 0.00 H new ATOM 0 HG3 GLU A 149 1.856 8.627 12.395 1.00 0.00 H new ATOM 415 N GLU A 150 0.350 3.661 11.755 1.00 0.00 N ATOM 416 CA GLU A 150 -0.450 2.619 11.052 1.00 0.00 C ATOM 417 C GLU A 150 0.294 1.283 11.105 1.00 0.00 C ATOM 418 O GLU A 150 1.508 1.239 11.137 1.00 0.00 O ATOM 419 CB GLU A 150 -0.655 3.030 9.592 1.00 0.00 C ATOM 420 CG GLU A 150 -1.598 2.037 8.910 1.00 0.00 C ATOM 421 CD GLU A 150 -1.721 2.389 7.426 1.00 0.00 C ATOM 422 OE1 GLU A 150 -1.070 3.330 7.004 1.00 0.00 O ATOM 423 OE2 GLU A 150 -2.465 1.710 6.736 1.00 0.00 O ATOM 0 H GLU A 150 1.344 3.673 11.526 1.00 0.00 H new ATOM 0 HA GLU A 150 -1.419 2.516 11.540 1.00 0.00 H new ATOM 0 HB2 GLU A 150 -1.071 4.036 9.541 1.00 0.00 H new ATOM 0 HB3 GLU A 150 0.303 3.054 9.072 1.00 0.00 H new ATOM 0 HG2 GLU A 150 -1.219 1.022 9.024 1.00 0.00 H new ATOM 0 HG3 GLU A 150 -2.579 2.066 9.384 1.00 0.00 H new ATOM 430 N VAL A 151 -0.423 0.193 11.116 1.00 0.00 N ATOM 431 CA VAL A 151 0.245 -1.138 11.169 1.00 0.00 C ATOM 432 C VAL A 151 -0.278 -2.017 10.031 1.00 0.00 C ATOM 433 O VAL A 151 -1.406 -1.884 9.599 1.00 0.00 O ATOM 434 CB VAL A 151 -0.057 -1.807 12.511 1.00 0.00 C ATOM 435 CG1 VAL A 151 0.687 -3.142 12.594 1.00 0.00 C ATOM 436 CG2 VAL A 151 0.402 -0.896 13.650 1.00 0.00 C ATOM 0 H VAL A 151 -1.442 0.167 11.091 1.00 0.00 H new ATOM 0 HA VAL A 151 1.322 -1.009 11.062 1.00 0.00 H new ATOM 0 HB VAL A 151 -1.129 -1.982 12.596 1.00 0.00 H new ATOM 0 HG11 VAL A 151 0.472 -3.619 13.550 1.00 0.00 H new ATOM 0 HG12 VAL A 151 0.360 -3.792 11.782 1.00 0.00 H new ATOM 0 HG13 VAL A 151 1.759 -2.967 12.509 1.00 0.00 H new ATOM 0 HG21 VAL A 151 0.187 -1.373 14.606 1.00 0.00 H new ATOM 0 HG22 VAL A 151 1.474 -0.720 13.565 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -0.128 0.055 13.591 1.00 0.00 H new ATOM 446 N ASP A 152 0.533 -2.915 9.542 1.00 0.00 N ATOM 447 CA ASP A 152 0.083 -3.802 8.433 1.00 0.00 C ATOM 448 C ASP A 152 0.525 -5.239 8.718 1.00 0.00 C ATOM 449 O ASP A 152 1.581 -5.668 8.299 1.00 0.00 O ATOM 450 CB ASP A 152 0.704 -3.329 7.117 1.00 0.00 C ATOM 451 CG ASP A 152 0.136 -1.956 6.750 1.00 0.00 C ATOM 452 OD1 ASP A 152 -0.891 -1.595 7.301 1.00 0.00 O ATOM 453 OD2 ASP A 152 0.737 -1.290 5.924 1.00 0.00 O ATOM 0 H ASP A 152 1.488 -3.072 9.863 1.00 0.00 H new ATOM 0 HA ASP A 152 -1.004 -3.764 8.356 1.00 0.00 H new ATOM 0 HB2 ASP A 152 1.788 -3.272 7.214 1.00 0.00 H new ATOM 0 HB3 ASP A 152 0.492 -4.046 6.324 1.00 0.00 H new ATOM 458 N TYR A 153 -0.276 -5.986 9.428 1.00 0.00 N ATOM 459 CA TYR A 153 0.100 -7.394 9.739 1.00 0.00 C ATOM 460 C TYR A 153 0.122 -8.213 8.447 1.00 0.00 C ATOM 461 O TYR A 153 0.952 -9.082 8.266 1.00 0.00 O ATOM 462 CB TYR A 153 -0.923 -7.993 10.706 1.00 0.00 C ATOM 463 CG TYR A 153 -0.902 -7.221 12.003 1.00 0.00 C ATOM 464 CD1 TYR A 153 0.099 -7.470 12.950 1.00 0.00 C ATOM 465 CD2 TYR A 153 -1.884 -6.257 12.260 1.00 0.00 C ATOM 466 CE1 TYR A 153 0.118 -6.754 14.153 1.00 0.00 C ATOM 467 CE2 TYR A 153 -1.865 -5.541 13.462 1.00 0.00 C ATOM 468 CZ TYR A 153 -0.864 -5.790 14.409 1.00 0.00 C ATOM 469 OH TYR A 153 -0.845 -5.084 15.595 1.00 0.00 O ATOM 0 H TYR A 153 -1.174 -5.682 9.806 1.00 0.00 H new ATOM 0 HA TYR A 153 1.088 -7.414 10.198 1.00 0.00 H new ATOM 0 HB2 TYR A 153 -1.919 -7.958 10.266 1.00 0.00 H new ATOM 0 HB3 TYR A 153 -0.693 -9.042 10.891 1.00 0.00 H new ATOM 0 HD1 TYR A 153 0.856 -8.214 12.752 1.00 0.00 H new ATOM 0 HD2 TYR A 153 -2.657 -6.066 11.530 1.00 0.00 H new ATOM 0 HE1 TYR A 153 0.890 -6.945 14.883 1.00 0.00 H new ATOM 0 HE2 TYR A 153 -2.622 -4.797 13.659 1.00 0.00 H new ATOM 0 HH TYR A 153 -0.203 -4.347 15.527 1.00 0.00 H new ATOM 479 N GLU A 154 -0.784 -7.945 7.548 1.00 0.00 N ATOM 480 CA GLU A 154 -0.814 -8.709 6.269 1.00 0.00 C ATOM 481 C GLU A 154 0.484 -8.463 5.497 1.00 0.00 C ATOM 482 O GLU A 154 1.084 -9.376 4.966 1.00 0.00 O ATOM 483 CB GLU A 154 -2.004 -8.247 5.426 1.00 0.00 C ATOM 484 CG GLU A 154 -2.130 -9.139 4.190 1.00 0.00 C ATOM 485 CD GLU A 154 -2.556 -10.546 4.616 1.00 0.00 C ATOM 486 OE1 GLU A 154 -3.166 -10.666 5.666 1.00 0.00 O ATOM 487 OE2 GLU A 154 -2.266 -11.478 3.885 1.00 0.00 O ATOM 0 H GLU A 154 -1.505 -7.230 7.644 1.00 0.00 H new ATOM 0 HA GLU A 154 -0.913 -9.773 6.484 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -2.920 -8.292 6.015 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -1.869 -7.208 5.126 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -2.861 -8.720 3.499 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -1.178 -9.181 3.660 1.00 0.00 H new ATOM 494 N LYS A 155 0.921 -7.235 5.430 1.00 0.00 N ATOM 495 CA LYS A 155 2.180 -6.932 4.692 1.00 0.00 C ATOM 496 C LYS A 155 3.375 -7.065 5.639 1.00 0.00 C ATOM 497 O LYS A 155 4.508 -6.852 5.256 1.00 0.00 O ATOM 498 CB LYS A 155 2.120 -5.505 4.145 1.00 0.00 C ATOM 499 CG LYS A 155 0.974 -5.392 3.137 1.00 0.00 C ATOM 500 CD LYS A 155 0.975 -3.992 2.519 1.00 0.00 C ATOM 501 CE LYS A 155 -0.252 -3.832 1.618 1.00 0.00 C ATOM 502 NZ LYS A 155 -0.998 -2.602 2.009 1.00 0.00 N ATOM 0 H LYS A 155 0.461 -6.429 5.854 1.00 0.00 H new ATOM 0 HA LYS A 155 2.293 -7.634 3.866 1.00 0.00 H new ATOM 0 HB2 LYS A 155 1.972 -4.797 4.961 1.00 0.00 H new ATOM 0 HB3 LYS A 155 3.065 -5.247 3.667 1.00 0.00 H new ATOM 0 HG2 LYS A 155 1.086 -6.145 2.357 1.00 0.00 H new ATOM 0 HG3 LYS A 155 0.021 -5.583 3.631 1.00 0.00 H new ATOM 0 HD2 LYS A 155 0.964 -3.236 3.304 1.00 0.00 H new ATOM 0 HD3 LYS A 155 1.886 -3.838 1.941 1.00 0.00 H new ATOM 0 HE2 LYS A 155 0.056 -3.767 0.574 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -0.898 -4.706 1.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -1.832 -2.493 1.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -1.304 -2.682 3.000 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -0.380 -1.773 1.903 1.00 0.00 H new ATOM 516 N SER A 156 3.133 -7.415 6.874 1.00 0.00 N ATOM 517 CA SER A 156 4.258 -7.559 7.840 1.00 0.00 C ATOM 518 C SER A 156 5.103 -6.284 7.831 1.00 0.00 C ATOM 519 O SER A 156 6.308 -6.327 7.675 1.00 0.00 O ATOM 520 CB SER A 156 5.128 -8.751 7.438 1.00 0.00 C ATOM 521 OG SER A 156 6.082 -8.336 6.472 1.00 0.00 O ATOM 0 H SER A 156 2.206 -7.607 7.254 1.00 0.00 H new ATOM 0 HA SER A 156 3.859 -7.724 8.841 1.00 0.00 H new ATOM 0 HB2 SER A 156 5.634 -9.157 8.314 1.00 0.00 H new ATOM 0 HB3 SER A 156 4.506 -9.548 7.031 1.00 0.00 H new ATOM 0 HG SER A 156 5.628 -7.853 5.750 1.00 0.00 H new ATOM 527 N ARG A 157 4.482 -5.149 7.996 1.00 0.00 N ATOM 528 CA ARG A 157 5.249 -3.872 7.997 1.00 0.00 C ATOM 529 C ARG A 157 4.608 -2.893 8.982 1.00 0.00 C ATOM 530 O ARG A 157 3.401 -2.806 9.088 1.00 0.00 O ATOM 531 CB ARG A 157 5.233 -3.266 6.592 1.00 0.00 C ATOM 532 CG ARG A 157 6.018 -4.169 5.638 1.00 0.00 C ATOM 533 CD ARG A 157 7.512 -4.062 5.948 1.00 0.00 C ATOM 534 NE ARG A 157 7.975 -2.670 5.685 1.00 0.00 N ATOM 535 CZ ARG A 157 8.605 -2.391 4.577 1.00 0.00 C ATOM 536 NH1 ARG A 157 8.379 -3.096 3.502 1.00 0.00 N ATOM 537 NH2 ARG A 157 9.462 -1.407 4.543 1.00 0.00 N ATOM 0 H ARG A 157 3.476 -5.051 8.130 1.00 0.00 H new ATOM 0 HA ARG A 157 6.279 -4.067 8.297 1.00 0.00 H new ATOM 0 HB2 ARG A 157 4.206 -3.156 6.243 1.00 0.00 H new ATOM 0 HB3 ARG A 157 5.672 -2.269 6.610 1.00 0.00 H new ATOM 0 HG2 ARG A 157 5.687 -5.202 5.743 1.00 0.00 H new ATOM 0 HG3 ARG A 157 5.828 -3.877 4.605 1.00 0.00 H new ATOM 0 HD2 ARG A 157 7.698 -4.328 6.988 1.00 0.00 H new ATOM 0 HD3 ARG A 157 8.073 -4.766 5.333 1.00 0.00 H new ATOM 0 HE ARG A 157 7.799 -1.936 6.371 1.00 0.00 H new ATOM 0 HH11 ARG A 157 7.710 -3.865 3.528 1.00 0.00 H new ATOM 0 HH12 ARG A 157 8.872 -2.878 2.636 1.00 0.00 H new ATOM 0 HH21 ARG A 157 9.639 -0.856 5.383 1.00 0.00 H new ATOM 0 HH22 ARG A 157 9.954 -1.189 3.677 1.00 0.00 H new ATOM 551 N LEU A 158 5.406 -2.157 9.706 1.00 0.00 N ATOM 552 CA LEU A 158 4.841 -1.186 10.684 1.00 0.00 C ATOM 553 C LEU A 158 5.057 0.239 10.173 1.00 0.00 C ATOM 554 O LEU A 158 6.129 0.593 9.724 1.00 0.00 O ATOM 555 CB LEU A 158 5.543 -1.355 12.033 1.00 0.00 C ATOM 556 CG LEU A 158 5.458 -2.819 12.473 1.00 0.00 C ATOM 557 CD1 LEU A 158 5.999 -2.956 13.897 1.00 0.00 C ATOM 558 CD2 LEU A 158 3.999 -3.279 12.434 1.00 0.00 C ATOM 0 H LEU A 158 6.425 -2.186 9.662 1.00 0.00 H new ATOM 0 HA LEU A 158 3.773 -1.371 10.803 1.00 0.00 H new ATOM 0 HB2 LEU A 158 6.586 -1.048 11.953 1.00 0.00 H new ATOM 0 HB3 LEU A 158 5.078 -0.712 12.780 1.00 0.00 H new ATOM 0 HG LEU A 158 6.052 -3.436 11.799 1.00 0.00 H new ATOM 0 HD11 LEU A 158 5.939 -3.998 14.210 1.00 0.00 H new ATOM 0 HD12 LEU A 158 7.038 -2.628 13.924 1.00 0.00 H new ATOM 0 HD13 LEU A 158 5.406 -2.339 14.572 1.00 0.00 H new ATOM 0 HD21 LEU A 158 3.938 -4.321 12.747 1.00 0.00 H new ATOM 0 HD22 LEU A 158 3.405 -2.662 13.108 1.00 0.00 H new ATOM 0 HD23 LEU A 158 3.614 -3.182 11.419 1.00 0.00 H new ATOM 570 N LYS A 159 4.046 1.062 10.239 1.00 0.00 N ATOM 571 CA LYS A 159 4.194 2.464 9.757 1.00 0.00 C ATOM 572 C LYS A 159 4.604 3.362 10.926 1.00 0.00 C ATOM 573 O LYS A 159 3.773 3.866 11.656 1.00 0.00 O ATOM 574 CB LYS A 159 2.862 2.950 9.183 1.00 0.00 C ATOM 575 CG LYS A 159 3.043 4.347 8.585 1.00 0.00 C ATOM 576 CD LYS A 159 1.687 4.883 8.122 1.00 0.00 C ATOM 577 CE LYS A 159 1.891 6.183 7.343 1.00 0.00 C ATOM 578 NZ LYS A 159 1.487 5.980 5.923 1.00 0.00 N ATOM 0 H LYS A 159 3.124 0.824 10.606 1.00 0.00 H new ATOM 0 HA LYS A 159 4.959 2.504 8.981 1.00 0.00 H new ATOM 0 HB2 LYS A 159 2.510 2.258 8.418 1.00 0.00 H new ATOM 0 HB3 LYS A 159 2.104 2.973 9.965 1.00 0.00 H new ATOM 0 HG2 LYS A 159 3.477 5.018 9.326 1.00 0.00 H new ATOM 0 HG3 LYS A 159 3.737 4.308 7.745 1.00 0.00 H new ATOM 0 HD2 LYS A 159 1.188 4.145 7.494 1.00 0.00 H new ATOM 0 HD3 LYS A 159 1.041 5.060 8.982 1.00 0.00 H new ATOM 0 HE2 LYS A 159 1.301 6.983 7.789 1.00 0.00 H new ATOM 0 HE3 LYS A 159 2.935 6.490 7.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 1.626 6.864 5.393 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 2.068 5.228 5.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 0.485 5.706 5.883 1.00 0.00 H new ATOM 592 N VAL A 160 5.880 3.566 11.111 1.00 0.00 N ATOM 593 CA VAL A 160 6.341 4.430 12.234 1.00 0.00 C ATOM 594 C VAL A 160 7.219 5.557 11.685 1.00 0.00 C ATOM 595 O VAL A 160 7.996 5.362 10.771 1.00 0.00 O ATOM 596 CB VAL A 160 7.150 3.590 13.224 1.00 0.00 C ATOM 597 CG1 VAL A 160 7.528 4.449 14.432 1.00 0.00 C ATOM 598 CG2 VAL A 160 6.309 2.398 13.687 1.00 0.00 C ATOM 0 H VAL A 160 6.622 3.172 10.533 1.00 0.00 H new ATOM 0 HA VAL A 160 5.476 4.858 12.741 1.00 0.00 H new ATOM 0 HB VAL A 160 8.056 3.228 12.739 1.00 0.00 H new ATOM 0 HG11 VAL A 160 8.104 3.851 15.138 1.00 0.00 H new ATOM 0 HG12 VAL A 160 8.127 5.298 14.102 1.00 0.00 H new ATOM 0 HG13 VAL A 160 6.622 4.811 14.918 1.00 0.00 H new ATOM 0 HG21 VAL A 160 6.885 1.799 14.392 1.00 0.00 H new ATOM 0 HG22 VAL A 160 5.402 2.759 14.173 1.00 0.00 H new ATOM 0 HG23 VAL A 160 6.040 1.786 12.826 1.00 0.00 H new ATOM 608 N SER A 161 7.102 6.735 12.235 1.00 0.00 N ATOM 609 CA SER A 161 7.930 7.872 11.744 1.00 0.00 C ATOM 610 C SER A 161 9.031 8.177 12.762 1.00 0.00 C ATOM 611 O SER A 161 8.853 8.010 13.952 1.00 0.00 O ATOM 612 CB SER A 161 7.045 9.107 11.565 1.00 0.00 C ATOM 613 OG SER A 161 6.601 9.560 12.835 1.00 0.00 O ATOM 0 H SER A 161 6.469 6.959 13.003 1.00 0.00 H new ATOM 0 HA SER A 161 8.382 7.607 10.788 1.00 0.00 H new ATOM 0 HB2 SER A 161 7.602 9.896 11.060 1.00 0.00 H new ATOM 0 HB3 SER A 161 6.190 8.866 10.934 1.00 0.00 H new ATOM 0 HG SER A 161 5.809 10.125 12.722 1.00 0.00 H new ATOM 619 N VAL A 162 10.169 8.622 12.304 1.00 0.00 N ATOM 620 CA VAL A 162 11.279 8.937 13.246 1.00 0.00 C ATOM 621 C VAL A 162 11.466 10.453 13.327 1.00 0.00 C ATOM 622 O VAL A 162 11.516 11.137 12.324 1.00 0.00 O ATOM 623 CB VAL A 162 12.572 8.290 12.745 1.00 0.00 C ATOM 624 CG1 VAL A 162 13.654 8.412 13.820 1.00 0.00 C ATOM 625 CG2 VAL A 162 12.319 6.813 12.440 1.00 0.00 C ATOM 0 H VAL A 162 10.378 8.781 11.318 1.00 0.00 H new ATOM 0 HA VAL A 162 11.037 8.548 14.235 1.00 0.00 H new ATOM 0 HB VAL A 162 12.903 8.796 11.838 1.00 0.00 H new ATOM 0 HG11 VAL A 162 14.575 7.951 13.463 1.00 0.00 H new ATOM 0 HG12 VAL A 162 13.835 9.465 14.036 1.00 0.00 H new ATOM 0 HG13 VAL A 162 13.324 7.907 14.728 1.00 0.00 H new ATOM 0 HG21 VAL A 162 13.240 6.352 12.083 1.00 0.00 H new ATOM 0 HG22 VAL A 162 11.987 6.306 13.346 1.00 0.00 H new ATOM 0 HG23 VAL A 162 11.549 6.727 11.673 1.00 0.00 H new ATOM 635 N SER A 163 11.570 10.985 14.514 1.00 0.00 N ATOM 636 CA SER A 163 11.754 12.457 14.658 1.00 0.00 C ATOM 637 C SER A 163 13.170 12.838 14.222 1.00 0.00 C ATOM 638 O SER A 163 14.072 12.941 15.029 1.00 0.00 O ATOM 639 CB SER A 163 11.546 12.857 16.120 1.00 0.00 C ATOM 640 OG SER A 163 10.189 12.643 16.481 1.00 0.00 O ATOM 0 H SER A 163 11.536 10.464 15.390 1.00 0.00 H new ATOM 0 HA SER A 163 11.028 12.977 14.033 1.00 0.00 H new ATOM 0 HB2 SER A 163 12.202 12.272 16.765 1.00 0.00 H new ATOM 0 HB3 SER A 163 11.811 13.905 16.263 1.00 0.00 H new ATOM 0 HG SER A 163 10.056 12.897 17.418 1.00 0.00 H new ATOM 646 N ILE A 164 13.372 13.048 12.950 1.00 0.00 N ATOM 647 CA ILE A 164 14.730 13.421 12.463 1.00 0.00 C ATOM 648 C ILE A 164 14.735 14.892 12.042 1.00 0.00 C ATOM 649 O ILE A 164 13.797 15.380 11.444 1.00 0.00 O ATOM 650 CB ILE A 164 15.101 12.546 11.265 1.00 0.00 C ATOM 651 CG1 ILE A 164 14.953 11.071 11.644 1.00 0.00 C ATOM 652 CG2 ILE A 164 16.550 12.825 10.859 1.00 0.00 C ATOM 653 CD1 ILE A 164 15.255 10.198 10.425 1.00 0.00 C ATOM 0 H ILE A 164 12.656 12.977 12.227 1.00 0.00 H new ATOM 0 HA ILE A 164 15.456 13.269 13.262 1.00 0.00 H new ATOM 0 HB ILE A 164 14.439 12.774 10.430 1.00 0.00 H new ATOM 0 HG12 ILE A 164 15.633 10.824 12.459 1.00 0.00 H new ATOM 0 HG13 ILE A 164 13.942 10.876 12.003 1.00 0.00 H new ATOM 0 HG21 ILE A 164 16.815 12.202 10.005 1.00 0.00 H new ATOM 0 HG22 ILE A 164 16.656 13.875 10.588 1.00 0.00 H new ATOM 0 HG23 ILE A 164 17.212 12.597 11.694 1.00 0.00 H new ATOM 0 HD11 ILE A 164 15.150 9.147 10.695 1.00 0.00 H new ATOM 0 HD12 ILE A 164 14.557 10.439 9.623 1.00 0.00 H new ATOM 0 HD13 ILE A 164 16.274 10.385 10.087 1.00 0.00 H new ATOM 665 N PHE A 165 15.786 15.603 12.348 1.00 0.00 N ATOM 666 CA PHE A 165 15.851 17.041 11.965 1.00 0.00 C ATOM 667 C PHE A 165 14.708 17.801 12.639 1.00 0.00 C ATOM 668 O PHE A 165 14.357 18.895 12.241 1.00 0.00 O ATOM 669 CB PHE A 165 15.723 17.170 10.446 1.00 0.00 C ATOM 670 CG PHE A 165 16.865 16.440 9.780 1.00 0.00 C ATOM 671 CD1 PHE A 165 18.133 17.030 9.720 1.00 0.00 C ATOM 672 CD2 PHE A 165 16.656 15.172 9.224 1.00 0.00 C ATOM 673 CE1 PHE A 165 19.192 16.353 9.103 1.00 0.00 C ATOM 674 CE2 PHE A 165 17.715 14.495 8.607 1.00 0.00 C ATOM 675 CZ PHE A 165 18.983 15.086 8.546 1.00 0.00 C ATOM 0 H PHE A 165 16.602 15.250 12.847 1.00 0.00 H new ATOM 0 HA PHE A 165 16.805 17.460 12.287 1.00 0.00 H new ATOM 0 HB2 PHE A 165 14.771 16.757 10.114 1.00 0.00 H new ATOM 0 HB3 PHE A 165 15.732 18.221 10.158 1.00 0.00 H new ATOM 0 HD1 PHE A 165 18.294 18.008 10.150 1.00 0.00 H new ATOM 0 HD2 PHE A 165 15.678 14.716 9.271 1.00 0.00 H new ATOM 0 HE1 PHE A 165 20.170 16.808 9.057 1.00 0.00 H new ATOM 0 HE2 PHE A 165 17.554 13.517 8.178 1.00 0.00 H new ATOM 0 HZ PHE A 165 19.800 14.564 8.069 1.00 0.00 H new ATOM 685 N GLY A 166 14.123 17.232 13.657 1.00 0.00 N ATOM 686 CA GLY A 166 13.003 17.923 14.356 1.00 0.00 C ATOM 687 C GLY A 166 11.693 17.657 13.610 1.00 0.00 C ATOM 688 O GLY A 166 10.657 18.197 13.945 1.00 0.00 O ATOM 0 H GLY A 166 14.372 16.318 14.035 1.00 0.00 H new ATOM 0 HA2 GLY A 166 12.927 17.567 15.384 1.00 0.00 H new ATOM 0 HA3 GLY A 166 13.196 18.995 14.403 1.00 0.00 H new ATOM 692 N ARG A 167 11.728 16.828 12.602 1.00 0.00 N ATOM 693 CA ARG A 167 10.483 16.530 11.839 1.00 0.00 C ATOM 694 C ARG A 167 10.237 15.020 11.836 1.00 0.00 C ATOM 695 O ARG A 167 11.159 14.231 11.785 1.00 0.00 O ATOM 696 CB ARG A 167 10.636 17.026 10.400 1.00 0.00 C ATOM 697 CG ARG A 167 10.746 18.552 10.394 1.00 0.00 C ATOM 698 CD ARG A 167 10.831 19.052 8.950 1.00 0.00 C ATOM 699 NE ARG A 167 9.517 18.853 8.277 1.00 0.00 N ATOM 700 CZ ARG A 167 9.441 18.876 6.975 1.00 0.00 C ATOM 701 NH1 ARG A 167 9.346 20.016 6.347 1.00 0.00 N ATOM 702 NH2 ARG A 167 9.459 17.759 6.300 1.00 0.00 N ATOM 0 H ARG A 167 12.564 16.345 12.274 1.00 0.00 H new ATOM 0 HA ARG A 167 9.639 17.035 12.308 1.00 0.00 H new ATOM 0 HB2 ARG A 167 11.523 16.585 9.945 1.00 0.00 H new ATOM 0 HB3 ARG A 167 9.781 16.710 9.803 1.00 0.00 H new ATOM 0 HG2 ARG A 167 9.882 18.991 10.892 1.00 0.00 H new ATOM 0 HG3 ARG A 167 11.629 18.866 10.951 1.00 0.00 H new ATOM 0 HD2 ARG A 167 11.103 20.107 8.935 1.00 0.00 H new ATOM 0 HD3 ARG A 167 11.612 18.514 8.413 1.00 0.00 H new ATOM 0 HE ARG A 167 8.677 18.699 8.834 1.00 0.00 H new ATOM 0 HH11 ARG A 167 9.331 20.889 6.874 1.00 0.00 H new ATOM 0 HH12 ARG A 167 9.287 20.034 5.329 1.00 0.00 H new ATOM 0 HH21 ARG A 167 9.532 16.868 6.791 1.00 0.00 H new ATOM 0 HH22 ARG A 167 9.400 17.777 5.282 1.00 0.00 H new ATOM 716 N ALA A 168 8.999 14.612 11.890 1.00 0.00 N ATOM 717 CA ALA A 168 8.695 13.153 11.891 1.00 0.00 C ATOM 718 C ALA A 168 9.030 12.562 10.520 1.00 0.00 C ATOM 719 O ALA A 168 8.814 13.181 9.497 1.00 0.00 O ATOM 720 CB ALA A 168 7.210 12.941 12.189 1.00 0.00 C ATOM 0 H ALA A 168 8.185 15.225 11.933 1.00 0.00 H new ATOM 0 HA ALA A 168 9.293 12.658 12.656 1.00 0.00 H new ATOM 0 HB1 ALA A 168 6.988 11.874 12.190 1.00 0.00 H new ATOM 0 HB2 ALA A 168 6.971 13.362 13.166 1.00 0.00 H new ATOM 0 HB3 ALA A 168 6.611 13.436 11.424 1.00 0.00 H new ATOM 726 N THR A 169 9.555 11.367 10.491 1.00 0.00 N ATOM 727 CA THR A 169 9.902 10.738 9.186 1.00 0.00 C ATOM 728 C THR A 169 9.200 9.383 9.070 1.00 0.00 C ATOM 729 O THR A 169 9.810 8.343 9.221 1.00 0.00 O ATOM 730 CB THR A 169 11.417 10.536 9.104 1.00 0.00 C ATOM 731 OG1 THR A 169 12.074 11.737 9.481 1.00 0.00 O ATOM 732 CG2 THR A 169 11.808 10.165 7.672 1.00 0.00 C ATOM 0 H THR A 169 9.758 10.800 11.314 1.00 0.00 H new ATOM 0 HA THR A 169 9.577 11.386 8.372 1.00 0.00 H new ATOM 0 HB THR A 169 11.714 9.732 9.778 1.00 0.00 H new ATOM 0 HG1 THR A 169 12.065 11.822 10.457 1.00 0.00 H new ATOM 0 HG21 THR A 169 12.887 10.021 7.615 1.00 0.00 H new ATOM 0 HG22 THR A 169 11.304 9.243 7.384 1.00 0.00 H new ATOM 0 HG23 THR A 169 11.512 10.966 6.995 1.00 0.00 H new ATOM 740 N PRO A 170 7.888 9.402 8.797 1.00 0.00 N ATOM 741 CA PRO A 170 7.090 8.177 8.658 1.00 0.00 C ATOM 742 C PRO A 170 7.772 7.155 7.743 1.00 0.00 C ATOM 743 O PRO A 170 7.809 7.314 6.539 1.00 0.00 O ATOM 744 CB PRO A 170 5.791 8.665 8.019 1.00 0.00 C ATOM 745 CG PRO A 170 6.172 9.917 7.302 1.00 0.00 C ATOM 746 CD PRO A 170 7.264 10.551 8.116 1.00 0.00 C ATOM 0 HA PRO A 170 6.947 7.672 9.613 1.00 0.00 H new ATOM 0 HB2 PRO A 170 5.384 7.923 7.332 1.00 0.00 H new ATOM 0 HB3 PRO A 170 5.026 8.856 8.772 1.00 0.00 H new ATOM 0 HG2 PRO A 170 6.517 9.697 6.292 1.00 0.00 H new ATOM 0 HG3 PRO A 170 5.317 10.587 7.208 1.00 0.00 H new ATOM 0 HD2 PRO A 170 7.978 11.082 7.487 1.00 0.00 H new ATOM 0 HD3 PRO A 170 6.867 11.274 8.828 1.00 0.00 H new ATOM 754 N VAL A 171 8.310 6.108 8.305 1.00 0.00 N ATOM 755 CA VAL A 171 8.987 5.078 7.468 1.00 0.00 C ATOM 756 C VAL A 171 8.439 3.694 7.820 1.00 0.00 C ATOM 757 O VAL A 171 7.948 3.469 8.909 1.00 0.00 O ATOM 758 CB VAL A 171 10.494 5.113 7.734 1.00 0.00 C ATOM 759 CG1 VAL A 171 11.028 6.520 7.457 1.00 0.00 C ATOM 760 CG2 VAL A 171 10.762 4.744 9.195 1.00 0.00 C ATOM 0 H VAL A 171 8.310 5.921 9.308 1.00 0.00 H new ATOM 0 HA VAL A 171 8.800 5.286 6.415 1.00 0.00 H new ATOM 0 HB VAL A 171 10.996 4.399 7.081 1.00 0.00 H new ATOM 0 HG11 VAL A 171 12.101 6.546 7.646 1.00 0.00 H new ATOM 0 HG12 VAL A 171 10.837 6.784 6.417 1.00 0.00 H new ATOM 0 HG13 VAL A 171 10.527 7.234 8.110 1.00 0.00 H new ATOM 0 HG21 VAL A 171 11.835 4.769 9.386 1.00 0.00 H new ATOM 0 HG22 VAL A 171 10.261 5.458 9.848 1.00 0.00 H new ATOM 0 HG23 VAL A 171 10.381 3.742 9.393 1.00 0.00 H new ATOM 770 N GLU A 172 8.517 2.764 6.908 1.00 0.00 N ATOM 771 CA GLU A 172 7.999 1.396 7.192 1.00 0.00 C ATOM 772 C GLU A 172 9.146 0.507 7.675 1.00 0.00 C ATOM 773 O GLU A 172 10.145 0.346 7.003 1.00 0.00 O ATOM 774 CB GLU A 172 7.396 0.804 5.917 1.00 0.00 C ATOM 775 CG GLU A 172 6.224 1.672 5.456 1.00 0.00 C ATOM 776 CD GLU A 172 5.556 1.024 4.242 1.00 0.00 C ATOM 777 OE1 GLU A 172 6.102 0.058 3.735 1.00 0.00 O ATOM 778 OE2 GLU A 172 4.510 1.506 3.839 1.00 0.00 O ATOM 0 H GLU A 172 8.917 2.892 5.979 1.00 0.00 H new ATOM 0 HA GLU A 172 7.232 1.451 7.964 1.00 0.00 H new ATOM 0 HB2 GLU A 172 8.153 0.751 5.135 1.00 0.00 H new ATOM 0 HB3 GLU A 172 7.057 -0.215 6.102 1.00 0.00 H new ATOM 0 HG2 GLU A 172 5.502 1.786 6.264 1.00 0.00 H new ATOM 0 HG3 GLU A 172 6.576 2.671 5.200 1.00 0.00 H new ATOM 785 N LEU A 173 9.011 -0.073 8.837 1.00 0.00 N ATOM 786 CA LEU A 173 10.094 -0.952 9.361 1.00 0.00 C ATOM 787 C LEU A 173 9.511 -2.320 9.722 1.00 0.00 C ATOM 788 O LEU A 173 8.371 -2.432 10.128 1.00 0.00 O ATOM 789 CB LEU A 173 10.709 -0.315 10.609 1.00 0.00 C ATOM 790 CG LEU A 173 11.182 1.102 10.279 1.00 0.00 C ATOM 791 CD1 LEU A 173 11.815 1.730 11.522 1.00 0.00 C ATOM 792 CD2 LEU A 173 12.216 1.045 9.153 1.00 0.00 C ATOM 0 H LEU A 173 8.198 0.024 9.445 1.00 0.00 H new ATOM 0 HA LEU A 173 10.863 -1.074 8.598 1.00 0.00 H new ATOM 0 HB2 LEU A 173 9.975 -0.286 11.415 1.00 0.00 H new ATOM 0 HB3 LEU A 173 11.547 -0.916 10.962 1.00 0.00 H new ATOM 0 HG LEU A 173 10.331 1.705 9.961 1.00 0.00 H new ATOM 0 HD11 LEU A 173 12.152 2.740 11.288 1.00 0.00 H new ATOM 0 HD12 LEU A 173 11.078 1.770 12.324 1.00 0.00 H new ATOM 0 HD13 LEU A 173 12.666 1.128 11.841 1.00 0.00 H new ATOM 0 HD21 LEU A 173 12.553 2.054 8.917 1.00 0.00 H new ATOM 0 HD22 LEU A 173 13.067 0.443 9.471 1.00 0.00 H new ATOM 0 HD23 LEU A 173 11.765 0.597 8.267 1.00 0.00 H new ATOM 804 N ASP A 174 10.283 -3.362 9.578 1.00 0.00 N ATOM 805 CA ASP A 174 9.772 -4.720 9.913 1.00 0.00 C ATOM 806 C ASP A 174 9.739 -4.891 11.433 1.00 0.00 C ATOM 807 O ASP A 174 10.336 -4.127 12.166 1.00 0.00 O ATOM 808 CB ASP A 174 10.694 -5.777 9.301 1.00 0.00 C ATOM 809 CG ASP A 174 10.597 -5.717 7.775 1.00 0.00 C ATOM 810 OD1 ASP A 174 9.679 -5.082 7.284 1.00 0.00 O ATOM 811 OD2 ASP A 174 11.444 -6.307 7.124 1.00 0.00 O ATOM 0 H ASP A 174 11.246 -3.331 9.243 1.00 0.00 H new ATOM 0 HA ASP A 174 8.766 -4.839 9.512 1.00 0.00 H new ATOM 0 HB2 ASP A 174 11.723 -5.605 9.618 1.00 0.00 H new ATOM 0 HB3 ASP A 174 10.413 -6.769 9.655 1.00 0.00 H new ATOM 816 N PHE A 175 9.046 -5.887 11.914 1.00 0.00 N ATOM 817 CA PHE A 175 8.977 -6.103 13.386 1.00 0.00 C ATOM 818 C PHE A 175 10.384 -6.351 13.932 1.00 0.00 C ATOM 819 O PHE A 175 10.750 -5.857 14.980 1.00 0.00 O ATOM 820 CB PHE A 175 8.092 -7.317 13.683 1.00 0.00 C ATOM 821 CG PHE A 175 6.851 -7.265 12.822 1.00 0.00 C ATOM 822 CD1 PHE A 175 6.382 -6.037 12.338 1.00 0.00 C ATOM 823 CD2 PHE A 175 6.168 -8.447 12.509 1.00 0.00 C ATOM 824 CE1 PHE A 175 5.232 -5.992 11.541 1.00 0.00 C ATOM 825 CE2 PHE A 175 5.018 -8.401 11.712 1.00 0.00 C ATOM 826 CZ PHE A 175 4.550 -7.174 11.229 1.00 0.00 C ATOM 0 H PHE A 175 8.525 -6.560 11.351 1.00 0.00 H new ATOM 0 HA PHE A 175 8.553 -5.219 13.863 1.00 0.00 H new ATOM 0 HB2 PHE A 175 8.643 -8.237 13.489 1.00 0.00 H new ATOM 0 HB3 PHE A 175 7.815 -7.328 14.737 1.00 0.00 H new ATOM 0 HD1 PHE A 175 6.908 -5.125 12.580 1.00 0.00 H new ATOM 0 HD2 PHE A 175 6.529 -9.394 12.883 1.00 0.00 H new ATOM 0 HE1 PHE A 175 4.871 -5.045 11.167 1.00 0.00 H new ATOM 0 HE2 PHE A 175 4.492 -9.313 11.470 1.00 0.00 H new ATOM 0 HZ PHE A 175 3.662 -7.139 10.615 1.00 0.00 H new ATOM 836 N SER A 176 11.177 -7.113 13.229 1.00 0.00 N ATOM 837 CA SER A 176 12.561 -7.391 13.709 1.00 0.00 C ATOM 838 C SER A 176 13.441 -6.164 13.460 1.00 0.00 C ATOM 839 O SER A 176 14.420 -5.942 14.145 1.00 0.00 O ATOM 840 CB SER A 176 13.132 -8.591 12.951 1.00 0.00 C ATOM 841 OG SER A 176 12.237 -9.688 13.059 1.00 0.00 O ATOM 0 H SER A 176 10.927 -7.555 12.344 1.00 0.00 H new ATOM 0 HA SER A 176 12.539 -7.613 14.776 1.00 0.00 H new ATOM 0 HB2 SER A 176 13.284 -8.334 11.903 1.00 0.00 H new ATOM 0 HB3 SER A 176 14.107 -8.861 13.358 1.00 0.00 H new ATOM 0 HG SER A 176 12.601 -10.457 12.572 1.00 0.00 H new ATOM 847 N GLN A 177 13.100 -5.366 12.486 1.00 0.00 N ATOM 848 CA GLN A 177 13.917 -4.154 12.195 1.00 0.00 C ATOM 849 C GLN A 177 13.757 -3.146 13.334 1.00 0.00 C ATOM 850 O GLN A 177 14.621 -2.329 13.580 1.00 0.00 O ATOM 851 CB GLN A 177 13.444 -3.522 10.884 1.00 0.00 C ATOM 852 CG GLN A 177 13.942 -4.360 9.705 1.00 0.00 C ATOM 853 CD GLN A 177 13.411 -3.768 8.398 1.00 0.00 C ATOM 854 OE1 GLN A 177 12.571 -2.889 8.412 1.00 0.00 O ATOM 855 NE2 GLN A 177 13.867 -4.215 7.260 1.00 0.00 N ATOM 0 H GLN A 177 12.291 -5.501 11.879 1.00 0.00 H new ATOM 0 HA GLN A 177 14.966 -4.436 12.104 1.00 0.00 H new ATOM 0 HB2 GLN A 177 12.356 -3.463 10.868 1.00 0.00 H new ATOM 0 HB3 GLN A 177 13.820 -2.502 10.803 1.00 0.00 H new ATOM 0 HG2 GLN A 177 15.032 -4.378 9.692 1.00 0.00 H new ATOM 0 HG3 GLN A 177 13.608 -5.392 9.812 1.00 0.00 H new ATOM 0 HE21 GLN A 177 14.572 -4.952 7.247 1.00 0.00 H new ATOM 0 HE22 GLN A 177 13.519 -3.827 6.383 1.00 0.00 H new ATOM 864 N VAL A 178 12.656 -3.199 14.034 1.00 0.00 N ATOM 865 CA VAL A 178 12.441 -2.244 15.157 1.00 0.00 C ATOM 866 C VAL A 178 12.058 -3.020 16.419 1.00 0.00 C ATOM 867 O VAL A 178 11.599 -4.143 16.353 1.00 0.00 O ATOM 868 CB VAL A 178 11.316 -1.273 14.793 1.00 0.00 C ATOM 869 CG1 VAL A 178 11.625 -0.616 13.446 1.00 0.00 C ATOM 870 CG2 VAL A 178 9.994 -2.038 14.695 1.00 0.00 C ATOM 0 H VAL A 178 11.897 -3.862 13.876 1.00 0.00 H new ATOM 0 HA VAL A 178 13.358 -1.684 15.339 1.00 0.00 H new ATOM 0 HB VAL A 178 11.236 -0.505 15.562 1.00 0.00 H new ATOM 0 HG11 VAL A 178 10.824 0.076 13.186 1.00 0.00 H new ATOM 0 HG12 VAL A 178 12.567 -0.071 13.514 1.00 0.00 H new ATOM 0 HG13 VAL A 178 11.705 -1.384 12.676 1.00 0.00 H new ATOM 0 HG21 VAL A 178 9.192 -1.347 14.436 1.00 0.00 H new ATOM 0 HG22 VAL A 178 10.074 -2.806 13.926 1.00 0.00 H new ATOM 0 HG23 VAL A 178 9.773 -2.507 15.654 1.00 0.00 H new ATOM 880 N GLU A 179 12.243 -2.431 17.569 1.00 0.00 N ATOM 881 CA GLU A 179 11.890 -3.137 18.833 1.00 0.00 C ATOM 882 C GLU A 179 10.714 -2.425 19.504 1.00 0.00 C ATOM 883 O GLU A 179 10.551 -1.227 19.385 1.00 0.00 O ATOM 884 CB GLU A 179 13.095 -3.130 19.774 1.00 0.00 C ATOM 885 CG GLU A 179 14.314 -3.701 19.046 1.00 0.00 C ATOM 886 CD GLU A 179 15.476 -3.844 20.031 1.00 0.00 C ATOM 887 OE1 GLU A 179 15.381 -3.289 21.114 1.00 0.00 O ATOM 888 OE2 GLU A 179 16.441 -4.506 19.686 1.00 0.00 O ATOM 0 H GLU A 179 12.623 -1.492 17.688 1.00 0.00 H new ATOM 0 HA GLU A 179 11.610 -4.166 18.608 1.00 0.00 H new ATOM 0 HB2 GLU A 179 13.302 -2.114 20.110 1.00 0.00 H new ATOM 0 HB3 GLU A 179 12.879 -3.722 20.663 1.00 0.00 H new ATOM 0 HG2 GLU A 179 14.070 -4.670 18.612 1.00 0.00 H new ATOM 0 HG3 GLU A 179 14.599 -3.046 18.223 1.00 0.00 H new ATOM 895 N LYS A 180 9.893 -3.153 20.211 1.00 0.00 N ATOM 896 CA LYS A 180 8.729 -2.517 20.890 1.00 0.00 C ATOM 897 C LYS A 180 9.226 -1.645 22.045 1.00 0.00 C ATOM 898 O LYS A 180 10.085 -2.039 22.808 1.00 0.00 O ATOM 899 CB LYS A 180 7.801 -3.605 21.436 1.00 0.00 C ATOM 900 CG LYS A 180 6.469 -2.978 21.852 1.00 0.00 C ATOM 901 CD LYS A 180 5.541 -4.065 22.397 1.00 0.00 C ATOM 902 CE LYS A 180 4.137 -3.488 22.592 1.00 0.00 C ATOM 903 NZ LYS A 180 3.962 -3.080 24.015 1.00 0.00 N ATOM 0 H LYS A 180 9.978 -4.160 20.348 1.00 0.00 H new ATOM 0 HA LYS A 180 8.185 -1.899 20.176 1.00 0.00 H new ATOM 0 HB2 LYS A 180 7.634 -4.370 20.677 1.00 0.00 H new ATOM 0 HB3 LYS A 180 8.265 -4.099 22.290 1.00 0.00 H new ATOM 0 HG2 LYS A 180 6.636 -2.214 22.611 1.00 0.00 H new ATOM 0 HG3 LYS A 180 6.005 -2.484 20.998 1.00 0.00 H new ATOM 0 HD2 LYS A 180 5.506 -4.908 21.707 1.00 0.00 H new ATOM 0 HD3 LYS A 180 5.925 -4.444 23.344 1.00 0.00 H new ATOM 0 HE2 LYS A 180 3.990 -2.630 21.936 1.00 0.00 H new ATOM 0 HE3 LYS A 180 3.386 -4.230 22.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 180 3.008 -2.688 24.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 180 4.085 -3.909 24.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 180 4.670 -2.359 24.259 1.00 0.00 H new ATOM 917 N ALA A 181 8.692 -0.462 22.179 1.00 0.00 N ATOM 918 CA ALA A 181 9.135 0.434 23.285 1.00 0.00 C ATOM 919 C ALA A 181 8.098 0.406 24.410 1.00 0.00 C ATOM 920 O ALA A 181 8.435 0.364 25.577 1.00 0.00 O ATOM 921 CB ALA A 181 9.276 1.863 22.757 1.00 0.00 C ATOM 0 H ALA A 181 7.969 -0.077 21.571 1.00 0.00 H new ATOM 0 HA ALA A 181 10.096 0.091 23.668 1.00 0.00 H new ATOM 0 HB1 ALA A 181 9.600 2.519 23.565 1.00 0.00 H new ATOM 0 HB2 ALA A 181 10.014 1.883 21.955 1.00 0.00 H new ATOM 0 HB3 ALA A 181 8.315 2.206 22.374 1.00 0.00 H new TER 927 ALA A 181