USER MOD reduce.3.24.130724 H: found=0, std=0, add=458, rem=0, adj=10 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+ 161:sc= -0.204 (180deg=-0.999) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 MET CE :methyl -151:sc= -0.647 (180deg=-2.73!) USER MOD Single : A 137 ASN : amide:sc= -1.3! C(o=-1.3!,f=-7.6!) USER MOD Single : A 145 ASN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 153 TYR OH : rot 180:sc= 0 USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 SER OG : rot 180:sc= 0 USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 169 THR OG1 : rot 180:sc= 0 USER MOD Single : A 176 SER OG : rot 180:sc= 0 USER MOD Single : A 177 GLN : amide:sc= -3.41! C(o=-3.4!,f=-10!) USER MOD Single : A 180 LYS NZ :NH3+ -109:sc= -1.8 (180deg=-4.94!) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 123 8.962 -12.608 27.243 1.00 0.00 N ATOM 2 CA ARG A 123 8.318 -11.554 28.077 1.00 0.00 C ATOM 3 C ARG A 123 7.653 -10.520 27.167 1.00 0.00 C ATOM 4 O ARG A 123 6.444 -10.432 27.092 1.00 0.00 O ATOM 5 CB ARG A 123 9.379 -10.867 28.939 1.00 0.00 C ATOM 6 CG ARG A 123 9.153 -11.224 30.409 1.00 0.00 C ATOM 7 CD ARG A 123 8.808 -9.957 31.194 1.00 0.00 C ATOM 8 NE ARG A 123 9.721 -9.835 32.364 1.00 0.00 N ATOM 9 CZ ARG A 123 9.357 -10.301 33.528 1.00 0.00 C ATOM 10 NH1 ARG A 123 8.525 -9.622 34.269 1.00 0.00 N ATOM 11 NH2 ARG A 123 9.825 -11.443 33.949 1.00 0.00 N ATOM 0 HA ARG A 123 7.565 -12.009 28.721 1.00 0.00 H new ATOM 0 HB2 ARG A 123 10.375 -11.181 28.627 1.00 0.00 H new ATOM 0 HB3 ARG A 123 9.328 -9.787 28.804 1.00 0.00 H new ATOM 0 HG2 ARG A 123 8.346 -11.951 30.498 1.00 0.00 H new ATOM 0 HG3 ARG A 123 10.048 -11.689 30.823 1.00 0.00 H new ATOM 0 HD2 ARG A 123 8.903 -9.081 30.552 1.00 0.00 H new ATOM 0 HD3 ARG A 123 7.772 -9.995 31.530 1.00 0.00 H new ATOM 0 HE ARG A 123 10.631 -9.387 32.256 1.00 0.00 H new ATOM 0 HH11 ARG A 123 8.160 -8.729 33.939 1.00 0.00 H new ATOM 0 HH12 ARG A 123 8.240 -9.985 35.179 1.00 0.00 H new ATOM 0 HH21 ARG A 123 10.476 -11.973 33.369 1.00 0.00 H new ATOM 0 HH22 ARG A 123 9.540 -11.807 34.858 1.00 0.00 H new ATOM 25 N PRO A 124 8.467 -9.721 26.460 1.00 0.00 N ATOM 26 CA PRO A 124 7.965 -8.686 25.549 1.00 0.00 C ATOM 27 C PRO A 124 7.011 -9.266 24.500 1.00 0.00 C ATOM 28 O PRO A 124 7.193 -10.371 24.026 1.00 0.00 O ATOM 29 CB PRO A 124 9.229 -8.160 24.872 1.00 0.00 C ATOM 30 CG PRO A 124 10.199 -9.289 24.960 1.00 0.00 C ATOM 31 CD PRO A 124 9.897 -10.003 26.246 1.00 0.00 C ATOM 0 HA PRO A 124 7.397 -7.919 26.075 1.00 0.00 H new ATOM 0 HB2 PRO A 124 9.037 -7.882 23.836 1.00 0.00 H new ATOM 0 HB3 PRO A 124 9.608 -7.271 25.376 1.00 0.00 H new ATOM 0 HG2 PRO A 124 10.093 -9.960 24.108 1.00 0.00 H new ATOM 0 HG3 PRO A 124 11.225 -8.922 24.951 1.00 0.00 H new ATOM 0 HD2 PRO A 124 10.089 -11.073 26.167 1.00 0.00 H new ATOM 0 HD3 PRO A 124 10.508 -9.629 27.067 1.00 0.00 H new ATOM 39 N LYS A 125 5.996 -8.531 24.136 1.00 0.00 N ATOM 40 CA LYS A 125 5.034 -9.042 23.119 1.00 0.00 C ATOM 41 C LYS A 125 5.288 -8.345 21.781 1.00 0.00 C ATOM 42 O LYS A 125 5.793 -7.241 21.732 1.00 0.00 O ATOM 43 CB LYS A 125 3.604 -8.753 23.582 1.00 0.00 C ATOM 44 CG LYS A 125 3.317 -9.533 24.866 1.00 0.00 C ATOM 45 CD LYS A 125 1.854 -9.330 25.269 1.00 0.00 C ATOM 46 CE LYS A 125 1.601 -10.000 26.622 1.00 0.00 C ATOM 47 NZ LYS A 125 2.562 -9.467 27.628 1.00 0.00 N ATOM 0 H LYS A 125 5.791 -7.600 24.498 1.00 0.00 H new ATOM 0 HA LYS A 125 5.168 -10.117 22.999 1.00 0.00 H new ATOM 0 HB2 LYS A 125 3.476 -7.685 23.756 1.00 0.00 H new ATOM 0 HB3 LYS A 125 2.894 -9.037 22.805 1.00 0.00 H new ATOM 0 HG2 LYS A 125 3.520 -10.593 24.713 1.00 0.00 H new ATOM 0 HG3 LYS A 125 3.976 -9.194 25.665 1.00 0.00 H new ATOM 0 HD2 LYS A 125 1.626 -8.266 25.330 1.00 0.00 H new ATOM 0 HD3 LYS A 125 1.195 -9.754 24.512 1.00 0.00 H new ATOM 0 HE2 LYS A 125 0.577 -9.813 26.947 1.00 0.00 H new ATOM 0 HE3 LYS A 125 1.715 -11.080 26.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 2.205 -9.660 28.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 3.486 -9.928 27.504 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 2.667 -8.441 27.498 1.00 0.00 H new ATOM 61 N THR A 126 4.943 -8.981 20.695 1.00 0.00 N ATOM 62 CA THR A 126 5.167 -8.353 19.362 1.00 0.00 C ATOM 63 C THR A 126 3.858 -7.739 18.861 1.00 0.00 C ATOM 64 O THR A 126 3.623 -7.641 17.674 1.00 0.00 O ATOM 65 CB THR A 126 5.642 -9.418 18.370 1.00 0.00 C ATOM 66 OG1 THR A 126 4.603 -10.362 18.157 1.00 0.00 O ATOM 67 CG2 THR A 126 6.874 -10.130 18.934 1.00 0.00 C ATOM 0 H THR A 126 4.516 -9.907 20.673 1.00 0.00 H new ATOM 0 HA THR A 126 5.924 -7.574 19.450 1.00 0.00 H new ATOM 0 HB THR A 126 5.901 -8.943 17.424 1.00 0.00 H new ATOM 0 HG1 THR A 126 4.905 -11.043 17.521 1.00 0.00 H new ATOM 0 HG21 THR A 126 7.212 -10.888 18.227 1.00 0.00 H new ATOM 0 HG22 THR A 126 7.671 -9.404 19.096 1.00 0.00 H new ATOM 0 HG23 THR A 126 6.618 -10.605 19.881 1.00 0.00 H new ATOM 75 N LEU A 127 3.004 -7.324 19.757 1.00 0.00 N ATOM 76 CA LEU A 127 1.714 -6.716 19.328 1.00 0.00 C ATOM 77 C LEU A 127 1.873 -5.198 19.233 1.00 0.00 C ATOM 78 O LEU A 127 1.735 -4.486 20.207 1.00 0.00 O ATOM 79 CB LEU A 127 0.628 -7.051 20.353 1.00 0.00 C ATOM 80 CG LEU A 127 0.517 -8.570 20.500 1.00 0.00 C ATOM 81 CD1 LEU A 127 -0.653 -8.910 21.425 1.00 0.00 C ATOM 82 CD2 LEU A 127 0.280 -9.199 19.126 1.00 0.00 C ATOM 0 H LEU A 127 3.144 -7.380 20.766 1.00 0.00 H new ATOM 0 HA LEU A 127 1.430 -7.114 18.354 1.00 0.00 H new ATOM 0 HB2 LEU A 127 0.869 -6.598 21.315 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -0.328 -6.635 20.035 1.00 0.00 H new ATOM 0 HG LEU A 127 1.441 -8.962 20.925 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -0.732 -9.992 21.529 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -0.485 -8.462 22.404 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -1.578 -8.518 21.001 1.00 0.00 H new ATOM 0 HD21 LEU A 127 0.201 -10.281 19.230 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.644 -8.807 18.701 1.00 0.00 H new ATOM 0 HD23 LEU A 127 1.114 -8.958 18.467 1.00 0.00 H new ATOM 94 N PHE A 128 2.165 -4.696 18.063 1.00 0.00 N ATOM 95 CA PHE A 128 2.334 -3.225 17.904 1.00 0.00 C ATOM 96 C PHE A 128 0.996 -2.595 17.511 1.00 0.00 C ATOM 97 O PHE A 128 0.337 -3.038 16.593 1.00 0.00 O ATOM 98 CB PHE A 128 3.369 -2.947 16.812 1.00 0.00 C ATOM 99 CG PHE A 128 4.671 -3.623 17.168 1.00 0.00 C ATOM 100 CD1 PHE A 128 5.596 -2.971 17.992 1.00 0.00 C ATOM 101 CD2 PHE A 128 4.953 -4.903 16.675 1.00 0.00 C ATOM 102 CE1 PHE A 128 6.803 -3.598 18.323 1.00 0.00 C ATOM 103 CE2 PHE A 128 6.160 -5.530 17.006 1.00 0.00 C ATOM 104 CZ PHE A 128 7.085 -4.878 17.829 1.00 0.00 C ATOM 0 H PHE A 128 2.294 -5.242 17.211 1.00 0.00 H new ATOM 0 HA PHE A 128 2.674 -2.795 18.846 1.00 0.00 H new ATOM 0 HB2 PHE A 128 3.007 -3.314 15.851 1.00 0.00 H new ATOM 0 HB3 PHE A 128 3.522 -1.873 16.706 1.00 0.00 H new ATOM 0 HD1 PHE A 128 5.378 -1.984 18.372 1.00 0.00 H new ATOM 0 HD2 PHE A 128 4.239 -5.406 16.040 1.00 0.00 H new ATOM 0 HE1 PHE A 128 7.516 -3.095 18.959 1.00 0.00 H new ATOM 0 HE2 PHE A 128 6.377 -6.517 16.626 1.00 0.00 H new ATOM 0 HZ PHE A 128 8.016 -5.362 18.083 1.00 0.00 H new ATOM 114 N GLU A 129 0.591 -1.563 18.200 1.00 0.00 N ATOM 115 CA GLU A 129 -0.703 -0.906 17.865 1.00 0.00 C ATOM 116 C GLU A 129 -0.460 0.575 17.563 1.00 0.00 C ATOM 117 O GLU A 129 0.499 1.161 18.023 1.00 0.00 O ATOM 118 CB GLU A 129 -1.663 -1.036 19.049 1.00 0.00 C ATOM 119 CG GLU A 129 -2.797 -1.996 18.683 1.00 0.00 C ATOM 120 CD GLU A 129 -2.803 -3.174 19.659 1.00 0.00 C ATOM 121 OE1 GLU A 129 -2.783 -2.928 20.854 1.00 0.00 O ATOM 122 OE2 GLU A 129 -2.829 -4.301 19.195 1.00 0.00 O ATOM 0 H GLU A 129 1.100 -1.147 18.980 1.00 0.00 H new ATOM 0 HA GLU A 129 -1.140 -1.388 16.990 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -1.129 -1.404 19.925 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -2.069 -0.059 19.310 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -3.754 -1.476 18.719 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -2.668 -2.356 17.662 1.00 0.00 H new ATOM 129 N PRO A 130 -1.354 1.186 16.773 1.00 0.00 N ATOM 130 CA PRO A 130 -1.245 2.602 16.401 1.00 0.00 C ATOM 131 C PRO A 130 -1.051 3.500 17.628 1.00 0.00 C ATOM 132 O PRO A 130 -1.791 3.424 18.588 1.00 0.00 O ATOM 133 CB PRO A 130 -2.589 2.905 15.741 1.00 0.00 C ATOM 134 CG PRO A 130 -3.528 1.904 16.324 1.00 0.00 C ATOM 135 CD PRO A 130 -2.718 0.664 16.576 1.00 0.00 C ATOM 0 HA PRO A 130 -0.387 2.789 15.756 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -2.914 3.924 15.953 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -2.529 2.808 14.657 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -3.968 2.276 17.249 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -4.351 1.698 15.640 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -3.073 0.123 17.453 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -2.767 -0.027 15.734 1.00 0.00 H new ATOM 143 N GLY A 131 -0.060 4.349 17.603 1.00 0.00 N ATOM 144 CA GLY A 131 0.180 5.250 18.766 1.00 0.00 C ATOM 145 C GLY A 131 1.157 4.584 19.738 1.00 0.00 C ATOM 146 O GLY A 131 1.460 5.114 20.788 1.00 0.00 O ATOM 0 H GLY A 131 0.594 4.458 16.828 1.00 0.00 H new ATOM 0 HA2 GLY A 131 0.584 6.203 18.424 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -0.761 5.466 19.272 1.00 0.00 H new ATOM 150 N GLU A 132 1.654 3.425 19.398 1.00 0.00 N ATOM 151 CA GLU A 132 2.610 2.730 20.305 1.00 0.00 C ATOM 152 C GLU A 132 4.036 3.184 19.988 1.00 0.00 C ATOM 153 O GLU A 132 4.394 3.385 18.844 1.00 0.00 O ATOM 154 CB GLU A 132 2.498 1.218 20.100 1.00 0.00 C ATOM 155 CG GLU A 132 3.289 0.495 21.191 1.00 0.00 C ATOM 156 CD GLU A 132 3.117 -1.016 21.029 1.00 0.00 C ATOM 157 OE1 GLU A 132 2.120 -1.421 20.453 1.00 0.00 O ATOM 158 OE2 GLU A 132 3.986 -1.744 21.482 1.00 0.00 O ATOM 0 H GLU A 132 1.439 2.931 18.532 1.00 0.00 H new ATOM 0 HA GLU A 132 2.373 2.975 21.340 1.00 0.00 H new ATOM 0 HB2 GLU A 132 1.452 0.913 20.131 1.00 0.00 H new ATOM 0 HB3 GLU A 132 2.881 0.944 19.117 1.00 0.00 H new ATOM 0 HG2 GLU A 132 4.344 0.761 21.127 1.00 0.00 H new ATOM 0 HG3 GLU A 132 2.941 0.808 22.175 1.00 0.00 H new ATOM 165 N MET A 133 4.854 3.348 20.991 1.00 0.00 N ATOM 166 CA MET A 133 6.255 3.789 20.746 1.00 0.00 C ATOM 167 C MET A 133 7.101 2.590 20.313 1.00 0.00 C ATOM 168 O MET A 133 6.994 1.511 20.862 1.00 0.00 O ATOM 169 CB MET A 133 6.835 4.385 22.030 1.00 0.00 C ATOM 170 CG MET A 133 6.014 5.609 22.440 1.00 0.00 C ATOM 171 SD MET A 133 6.237 6.923 21.215 1.00 0.00 S ATOM 172 CE MET A 133 8.043 6.994 21.285 1.00 0.00 C ATOM 0 H MET A 133 4.612 3.195 21.970 1.00 0.00 H new ATOM 0 HA MET A 133 6.265 4.543 19.959 1.00 0.00 H new ATOM 0 HB2 MET A 133 6.822 3.641 22.827 1.00 0.00 H new ATOM 0 HB3 MET A 133 7.876 4.668 21.875 1.00 0.00 H new ATOM 0 HG2 MET A 133 4.960 5.344 22.517 1.00 0.00 H new ATOM 0 HG3 MET A 133 6.327 5.958 23.424 1.00 0.00 H new ATOM 0 HE1 MET A 133 8.377 8.003 21.043 1.00 0.00 H new ATOM 0 HE2 MET A 133 8.379 6.731 22.288 1.00 0.00 H new ATOM 0 HE3 MET A 133 8.463 6.291 20.566 1.00 0.00 H new ATOM 182 N VAL A 134 7.943 2.770 19.332 1.00 0.00 N ATOM 183 CA VAL A 134 8.796 1.641 18.865 1.00 0.00 C ATOM 184 C VAL A 134 10.255 2.098 18.813 1.00 0.00 C ATOM 185 O VAL A 134 10.572 3.233 19.112 1.00 0.00 O ATOM 186 CB VAL A 134 8.346 1.207 17.468 1.00 0.00 C ATOM 187 CG1 VAL A 134 8.835 -0.216 17.191 1.00 0.00 C ATOM 188 CG2 VAL A 134 6.819 1.246 17.389 1.00 0.00 C ATOM 0 H VAL A 134 8.077 3.650 18.834 1.00 0.00 H new ATOM 0 HA VAL A 134 8.701 0.801 19.553 1.00 0.00 H new ATOM 0 HB VAL A 134 8.766 1.885 16.725 1.00 0.00 H new ATOM 0 HG11 VAL A 134 8.514 -0.524 16.196 1.00 0.00 H new ATOM 0 HG12 VAL A 134 9.923 -0.244 17.246 1.00 0.00 H new ATOM 0 HG13 VAL A 134 8.417 -0.895 17.934 1.00 0.00 H new ATOM 0 HG21 VAL A 134 6.498 0.937 16.394 1.00 0.00 H new ATOM 0 HG22 VAL A 134 6.399 0.569 18.133 1.00 0.00 H new ATOM 0 HG23 VAL A 134 6.470 2.260 17.584 1.00 0.00 H new ATOM 198 N ARG A 135 11.149 1.225 18.436 1.00 0.00 N ATOM 199 CA ARG A 135 12.586 1.612 18.365 1.00 0.00 C ATOM 200 C ARG A 135 13.208 1.033 17.093 1.00 0.00 C ATOM 201 O ARG A 135 12.895 -0.067 16.684 1.00 0.00 O ATOM 202 CB ARG A 135 13.323 1.064 19.590 1.00 0.00 C ATOM 203 CG ARG A 135 14.757 1.596 19.603 1.00 0.00 C ATOM 204 CD ARG A 135 15.546 0.909 20.719 1.00 0.00 C ATOM 205 NE ARG A 135 14.876 1.155 22.026 1.00 0.00 N ATOM 206 CZ ARG A 135 14.920 0.248 22.964 1.00 0.00 C ATOM 207 NH1 ARG A 135 14.431 -0.942 22.744 1.00 0.00 N ATOM 208 NH2 ARG A 135 15.454 0.530 24.121 1.00 0.00 N ATOM 0 H ARG A 135 10.946 0.260 18.174 1.00 0.00 H new ATOM 0 HA ARG A 135 12.669 2.699 18.347 1.00 0.00 H new ATOM 0 HB2 ARG A 135 12.805 1.361 20.502 1.00 0.00 H new ATOM 0 HB3 ARG A 135 13.328 -0.026 19.567 1.00 0.00 H new ATOM 0 HG2 ARG A 135 15.233 1.412 18.640 1.00 0.00 H new ATOM 0 HG3 ARG A 135 14.754 2.675 19.756 1.00 0.00 H new ATOM 0 HD2 ARG A 135 15.610 -0.162 20.527 1.00 0.00 H new ATOM 0 HD3 ARG A 135 16.567 1.290 20.744 1.00 0.00 H new ATOM 0 HE ARG A 135 14.382 2.033 22.188 1.00 0.00 H new ATOM 0 HH11 ARG A 135 14.015 -1.163 21.839 1.00 0.00 H new ATOM 0 HH12 ARG A 135 14.465 -1.651 23.477 1.00 0.00 H new ATOM 0 HH21 ARG A 135 15.837 1.460 24.293 1.00 0.00 H new ATOM 0 HH22 ARG A 135 15.488 -0.179 24.853 1.00 0.00 H new ATOM 222 N VAL A 136 14.087 1.765 16.465 1.00 0.00 N ATOM 223 CA VAL A 136 14.726 1.253 15.219 1.00 0.00 C ATOM 224 C VAL A 136 16.203 0.959 15.486 1.00 0.00 C ATOM 225 O VAL A 136 16.912 1.757 16.065 1.00 0.00 O ATOM 226 CB VAL A 136 14.607 2.307 14.116 1.00 0.00 C ATOM 227 CG1 VAL A 136 15.225 1.765 12.824 1.00 0.00 C ATOM 228 CG2 VAL A 136 13.131 2.630 13.878 1.00 0.00 C ATOM 0 H VAL A 136 14.390 2.693 16.760 1.00 0.00 H new ATOM 0 HA VAL A 136 14.225 0.338 14.904 1.00 0.00 H new ATOM 0 HB VAL A 136 15.133 3.212 14.419 1.00 0.00 H new ATOM 0 HG11 VAL A 136 15.141 2.515 12.038 1.00 0.00 H new ATOM 0 HG12 VAL A 136 16.277 1.533 12.993 1.00 0.00 H new ATOM 0 HG13 VAL A 136 14.698 0.860 12.520 1.00 0.00 H new ATOM 0 HG21 VAL A 136 13.045 3.381 13.092 1.00 0.00 H new ATOM 0 HG22 VAL A 136 12.605 1.725 13.574 1.00 0.00 H new ATOM 0 HG23 VAL A 136 12.690 3.015 14.797 1.00 0.00 H new ATOM 238 N ASN A 137 16.675 -0.184 15.065 1.00 0.00 N ATOM 239 CA ASN A 137 18.106 -0.530 15.294 1.00 0.00 C ATOM 240 C ASN A 137 18.767 -0.869 13.956 1.00 0.00 C ATOM 241 O ASN A 137 19.795 -1.513 13.906 1.00 0.00 O ATOM 242 CB ASN A 137 18.197 -1.737 16.228 1.00 0.00 C ATOM 243 CG ASN A 137 17.463 -2.925 15.601 1.00 0.00 C ATOM 244 OD1 ASN A 137 17.318 -2.997 14.397 1.00 0.00 O ATOM 245 ND2 ASN A 137 16.989 -3.865 16.373 1.00 0.00 N ATOM 0 H ASN A 137 16.131 -0.892 14.573 1.00 0.00 H new ATOM 0 HA ASN A 137 18.617 0.319 15.749 1.00 0.00 H new ATOM 0 HB2 ASN A 137 19.241 -1.994 16.406 1.00 0.00 H new ATOM 0 HB3 ASN A 137 17.758 -1.495 17.196 1.00 0.00 H new ATOM 0 HD21 ASN A 137 16.497 -4.660 15.965 1.00 0.00 H new ATOM 0 HD22 ASN A 137 17.111 -3.804 17.384 1.00 0.00 H new ATOM 252 N ASP A 138 18.182 -0.441 12.871 1.00 0.00 N ATOM 253 CA ASP A 138 18.776 -0.739 11.537 1.00 0.00 C ATOM 254 C ASP A 138 18.576 0.461 10.610 1.00 0.00 C ATOM 255 O ASP A 138 17.656 1.238 10.773 1.00 0.00 O ATOM 256 CB ASP A 138 18.089 -1.968 10.937 1.00 0.00 C ATOM 257 CG ASP A 138 18.845 -2.413 9.684 1.00 0.00 C ATOM 258 OD1 ASP A 138 19.874 -1.826 9.396 1.00 0.00 O ATOM 259 OD2 ASP A 138 18.381 -3.335 9.032 1.00 0.00 O ATOM 0 H ASP A 138 17.319 0.102 12.850 1.00 0.00 H new ATOM 0 HA ASP A 138 19.842 -0.937 11.649 1.00 0.00 H new ATOM 0 HB2 ASP A 138 18.065 -2.777 11.667 1.00 0.00 H new ATOM 0 HB3 ASP A 138 17.054 -1.734 10.687 1.00 0.00 H new ATOM 264 N GLY A 139 19.431 0.620 9.637 1.00 0.00 N ATOM 265 CA GLY A 139 19.289 1.771 8.701 1.00 0.00 C ATOM 266 C GLY A 139 19.618 3.071 9.439 1.00 0.00 C ATOM 267 O GLY A 139 19.795 3.085 10.641 1.00 0.00 O ATOM 0 H GLY A 139 20.221 0.003 9.450 1.00 0.00 H new ATOM 0 HA2 GLY A 139 19.957 1.645 7.849 1.00 0.00 H new ATOM 0 HA3 GLY A 139 18.273 1.811 8.307 1.00 0.00 H new ATOM 271 N PRO A 140 19.697 4.184 8.697 1.00 0.00 N ATOM 272 CA PRO A 140 20.005 5.499 9.274 1.00 0.00 C ATOM 273 C PRO A 140 19.071 5.839 10.441 1.00 0.00 C ATOM 274 O PRO A 140 19.346 6.719 11.232 1.00 0.00 O ATOM 275 CB PRO A 140 19.762 6.465 8.114 1.00 0.00 C ATOM 276 CG PRO A 140 18.789 5.758 7.232 1.00 0.00 C ATOM 277 CD PRO A 140 19.100 4.293 7.354 1.00 0.00 C ATOM 0 HA PRO A 140 21.017 5.542 9.678 1.00 0.00 H new ATOM 0 HB2 PRO A 140 19.360 7.415 8.467 1.00 0.00 H new ATOM 0 HB3 PRO A 140 20.688 6.688 7.584 1.00 0.00 H new ATOM 0 HG2 PRO A 140 17.764 5.965 7.539 1.00 0.00 H new ATOM 0 HG3 PRO A 140 18.886 6.092 6.199 1.00 0.00 H new ATOM 0 HD2 PRO A 140 18.202 3.682 7.262 1.00 0.00 H new ATOM 0 HD3 PRO A 140 19.791 3.962 6.579 1.00 0.00 H new ATOM 285 N PHE A 141 17.971 5.148 10.552 1.00 0.00 N ATOM 286 CA PHE A 141 17.022 5.431 11.666 1.00 0.00 C ATOM 287 C PHE A 141 17.413 4.601 12.891 1.00 0.00 C ATOM 288 O PHE A 141 16.678 4.514 13.854 1.00 0.00 O ATOM 289 CB PHE A 141 15.602 5.061 11.233 1.00 0.00 C ATOM 290 CG PHE A 141 15.193 5.920 10.060 1.00 0.00 C ATOM 291 CD1 PHE A 141 14.667 7.199 10.279 1.00 0.00 C ATOM 292 CD2 PHE A 141 15.339 5.437 8.754 1.00 0.00 C ATOM 293 CE1 PHE A 141 14.286 7.995 9.191 1.00 0.00 C ATOM 294 CE2 PHE A 141 14.958 6.232 7.667 1.00 0.00 C ATOM 295 CZ PHE A 141 14.432 7.511 7.886 1.00 0.00 C ATOM 0 H PHE A 141 17.688 4.399 9.920 1.00 0.00 H new ATOM 0 HA PHE A 141 17.061 6.491 11.916 1.00 0.00 H new ATOM 0 HB2 PHE A 141 15.557 4.007 10.959 1.00 0.00 H new ATOM 0 HB3 PHE A 141 14.909 5.205 12.062 1.00 0.00 H new ATOM 0 HD1 PHE A 141 14.555 7.572 11.286 1.00 0.00 H new ATOM 0 HD2 PHE A 141 15.746 4.451 8.585 1.00 0.00 H new ATOM 0 HE1 PHE A 141 13.880 8.981 9.359 1.00 0.00 H new ATOM 0 HE2 PHE A 141 15.070 5.859 6.660 1.00 0.00 H new ATOM 0 HZ PHE A 141 14.139 8.125 7.047 1.00 0.00 H new ATOM 305 N ALA A 142 18.565 3.990 12.861 1.00 0.00 N ATOM 306 CA ALA A 142 19.001 3.164 14.023 1.00 0.00 C ATOM 307 C ALA A 142 19.185 4.062 15.250 1.00 0.00 C ATOM 308 O ALA A 142 19.590 5.203 15.142 1.00 0.00 O ATOM 309 CB ALA A 142 20.327 2.478 13.691 1.00 0.00 C ATOM 0 H ALA A 142 19.223 4.027 12.083 1.00 0.00 H new ATOM 0 HA ALA A 142 18.244 2.410 14.236 1.00 0.00 H new ATOM 0 HB1 ALA A 142 20.647 1.874 14.540 1.00 0.00 H new ATOM 0 HB2 ALA A 142 20.197 1.838 12.818 1.00 0.00 H new ATOM 0 HB3 ALA A 142 21.084 3.233 13.478 1.00 0.00 H new ATOM 315 N ASP A 143 18.891 3.554 16.415 1.00 0.00 N ATOM 316 CA ASP A 143 19.049 4.375 17.649 1.00 0.00 C ATOM 317 C ASP A 143 18.096 5.571 17.596 1.00 0.00 C ATOM 318 O ASP A 143 18.477 6.693 17.864 1.00 0.00 O ATOM 319 CB ASP A 143 20.491 4.877 17.745 1.00 0.00 C ATOM 320 CG ASP A 143 21.447 3.683 17.750 1.00 0.00 C ATOM 321 OD1 ASP A 143 20.981 2.576 17.964 1.00 0.00 O ATOM 322 OD2 ASP A 143 22.629 3.895 17.538 1.00 0.00 O ATOM 0 H ASP A 143 18.548 2.605 16.566 1.00 0.00 H new ATOM 0 HA ASP A 143 18.816 3.765 18.522 1.00 0.00 H new ATOM 0 HB2 ASP A 143 20.716 5.533 16.904 1.00 0.00 H new ATOM 0 HB3 ASP A 143 20.623 5.466 18.653 1.00 0.00 H new ATOM 327 N PHE A 144 16.858 5.342 17.252 1.00 0.00 N ATOM 328 CA PHE A 144 15.885 6.468 17.185 1.00 0.00 C ATOM 329 C PHE A 144 14.513 5.990 17.665 1.00 0.00 C ATOM 330 O PHE A 144 14.093 4.887 17.376 1.00 0.00 O ATOM 331 CB PHE A 144 15.776 6.965 15.743 1.00 0.00 C ATOM 332 CG PHE A 144 16.945 7.869 15.433 1.00 0.00 C ATOM 333 CD1 PHE A 144 16.952 9.188 15.902 1.00 0.00 C ATOM 334 CD2 PHE A 144 18.022 7.389 14.678 1.00 0.00 C ATOM 335 CE1 PHE A 144 18.035 10.028 15.615 1.00 0.00 C ATOM 336 CE2 PHE A 144 19.106 8.229 14.392 1.00 0.00 C ATOM 337 CZ PHE A 144 19.112 9.548 14.861 1.00 0.00 C ATOM 0 H PHE A 144 16.479 4.425 17.015 1.00 0.00 H new ATOM 0 HA PHE A 144 16.229 7.281 17.824 1.00 0.00 H new ATOM 0 HB2 PHE A 144 15.764 6.119 15.055 1.00 0.00 H new ATOM 0 HB3 PHE A 144 14.839 7.503 15.602 1.00 0.00 H new ATOM 0 HD1 PHE A 144 16.122 9.558 16.485 1.00 0.00 H new ATOM 0 HD2 PHE A 144 18.017 6.371 14.316 1.00 0.00 H new ATOM 0 HE1 PHE A 144 18.039 11.046 15.975 1.00 0.00 H new ATOM 0 HE2 PHE A 144 19.937 7.859 13.810 1.00 0.00 H new ATOM 0 HZ PHE A 144 19.948 10.195 14.641 1.00 0.00 H new ATOM 347 N ASN A 145 13.810 6.813 18.395 1.00 0.00 N ATOM 348 CA ASN A 145 12.466 6.407 18.891 1.00 0.00 C ATOM 349 C ASN A 145 11.390 6.932 17.938 1.00 0.00 C ATOM 350 O ASN A 145 11.490 8.024 17.416 1.00 0.00 O ATOM 351 CB ASN A 145 12.239 6.991 20.288 1.00 0.00 C ATOM 352 CG ASN A 145 13.311 6.462 21.242 1.00 0.00 C ATOM 353 OD1 ASN A 145 13.908 5.433 20.994 1.00 0.00 O ATOM 354 ND2 ASN A 145 13.582 7.125 22.333 1.00 0.00 N ATOM 0 H ASN A 145 14.109 7.749 18.669 1.00 0.00 H new ATOM 0 HA ASN A 145 12.410 5.319 18.938 1.00 0.00 H new ATOM 0 HB2 ASN A 145 12.277 8.080 20.249 1.00 0.00 H new ATOM 0 HB3 ASN A 145 11.248 6.719 20.651 1.00 0.00 H new ATOM 0 HD21 ASN A 145 14.294 6.779 22.976 1.00 0.00 H new ATOM 0 HD22 ASN A 145 13.082 7.989 22.542 1.00 0.00 H new ATOM 361 N GLY A 146 10.362 6.163 17.708 1.00 0.00 N ATOM 362 CA GLY A 146 9.282 6.621 16.788 1.00 0.00 C ATOM 363 C GLY A 146 7.955 5.981 17.199 1.00 0.00 C ATOM 364 O GLY A 146 7.906 5.131 18.066 1.00 0.00 O ATOM 0 H GLY A 146 10.223 5.239 18.116 1.00 0.00 H new ATOM 0 HA2 GLY A 146 9.199 7.707 16.820 1.00 0.00 H new ATOM 0 HA3 GLY A 146 9.526 6.350 15.761 1.00 0.00 H new ATOM 368 N VAL A 147 6.876 6.380 16.583 1.00 0.00 N ATOM 369 CA VAL A 147 5.553 5.794 16.939 1.00 0.00 C ATOM 370 C VAL A 147 4.970 5.078 15.720 1.00 0.00 C ATOM 371 O VAL A 147 5.264 5.416 14.590 1.00 0.00 O ATOM 372 CB VAL A 147 4.603 6.910 17.381 1.00 0.00 C ATOM 373 CG1 VAL A 147 3.310 6.295 17.920 1.00 0.00 C ATOM 374 CG2 VAL A 147 5.267 7.742 18.478 1.00 0.00 C ATOM 0 H VAL A 147 6.854 7.087 15.848 1.00 0.00 H new ATOM 0 HA VAL A 147 5.677 5.081 17.754 1.00 0.00 H new ATOM 0 HB VAL A 147 4.374 7.550 16.529 1.00 0.00 H new ATOM 0 HG11 VAL A 147 2.633 7.089 18.235 1.00 0.00 H new ATOM 0 HG12 VAL A 147 2.835 5.702 17.138 1.00 0.00 H new ATOM 0 HG13 VAL A 147 3.539 5.655 18.772 1.00 0.00 H new ATOM 0 HG21 VAL A 147 4.590 8.536 18.792 1.00 0.00 H new ATOM 0 HG22 VAL A 147 5.497 7.103 19.330 1.00 0.00 H new ATOM 0 HG23 VAL A 147 6.188 8.181 18.095 1.00 0.00 H new ATOM 384 N VAL A 148 4.144 4.091 15.938 1.00 0.00 N ATOM 385 CA VAL A 148 3.544 3.356 14.788 1.00 0.00 C ATOM 386 C VAL A 148 2.246 4.044 14.363 1.00 0.00 C ATOM 387 O VAL A 148 1.253 4.002 15.060 1.00 0.00 O ATOM 388 CB VAL A 148 3.245 1.914 15.204 1.00 0.00 C ATOM 389 CG1 VAL A 148 2.642 1.158 14.018 1.00 0.00 C ATOM 390 CG2 VAL A 148 4.540 1.229 15.641 1.00 0.00 C ATOM 0 H VAL A 148 3.859 3.762 16.861 1.00 0.00 H new ATOM 0 HA VAL A 148 4.244 3.355 13.953 1.00 0.00 H new ATOM 0 HB VAL A 148 2.538 1.914 16.034 1.00 0.00 H new ATOM 0 HG11 VAL A 148 2.428 0.130 14.312 1.00 0.00 H new ATOM 0 HG12 VAL A 148 1.718 1.646 13.707 1.00 0.00 H new ATOM 0 HG13 VAL A 148 3.349 1.158 13.189 1.00 0.00 H new ATOM 0 HG21 VAL A 148 4.326 0.202 15.937 1.00 0.00 H new ATOM 0 HG22 VAL A 148 5.248 1.228 14.813 1.00 0.00 H new ATOM 0 HG23 VAL A 148 4.970 1.768 16.485 1.00 0.00 H new ATOM 400 N GLU A 149 2.246 4.677 13.221 1.00 0.00 N ATOM 401 CA GLU A 149 1.012 5.367 12.752 1.00 0.00 C ATOM 402 C GLU A 149 -0.057 4.325 12.416 1.00 0.00 C ATOM 403 O GLU A 149 -1.222 4.496 12.717 1.00 0.00 O ATOM 404 CB GLU A 149 1.332 6.190 11.503 1.00 0.00 C ATOM 405 CG GLU A 149 2.297 7.320 11.871 1.00 0.00 C ATOM 406 CD GLU A 149 1.640 8.234 12.907 1.00 0.00 C ATOM 407 OE1 GLU A 149 0.431 8.159 13.051 1.00 0.00 O ATOM 408 OE2 GLU A 149 2.357 8.991 13.539 1.00 0.00 O ATOM 0 H GLU A 149 3.047 4.746 12.593 1.00 0.00 H new ATOM 0 HA GLU A 149 0.643 6.027 13.537 1.00 0.00 H new ATOM 0 HB2 GLU A 149 1.776 5.553 10.738 1.00 0.00 H new ATOM 0 HB3 GLU A 149 0.415 6.603 11.081 1.00 0.00 H new ATOM 0 HG2 GLU A 149 3.223 6.906 12.270 1.00 0.00 H new ATOM 0 HG3 GLU A 149 2.561 7.892 10.981 1.00 0.00 H new ATOM 415 N GLU A 150 0.329 3.245 11.795 1.00 0.00 N ATOM 416 CA GLU A 150 -0.665 2.192 11.441 1.00 0.00 C ATOM 417 C GLU A 150 0.042 0.838 11.343 1.00 0.00 C ATOM 418 O GLU A 150 1.237 0.764 11.140 1.00 0.00 O ATOM 419 CB GLU A 150 -1.309 2.529 10.095 1.00 0.00 C ATOM 420 CG GLU A 150 -2.029 3.876 10.198 1.00 0.00 C ATOM 421 CD GLU A 150 -2.736 4.180 8.876 1.00 0.00 C ATOM 422 OE1 GLU A 150 -2.513 3.448 7.926 1.00 0.00 O ATOM 423 OE2 GLU A 150 -3.487 5.140 8.835 1.00 0.00 O ATOM 0 H GLU A 150 1.290 3.046 11.517 1.00 0.00 H new ATOM 0 HA GLU A 150 -1.436 2.146 12.210 1.00 0.00 H new ATOM 0 HB2 GLU A 150 -0.548 2.570 9.316 1.00 0.00 H new ATOM 0 HB3 GLU A 150 -2.014 1.748 9.811 1.00 0.00 H new ATOM 0 HG2 GLU A 150 -2.753 3.852 11.012 1.00 0.00 H new ATOM 0 HG3 GLU A 150 -1.314 4.665 10.430 1.00 0.00 H new ATOM 430 N VAL A 151 -0.687 -0.234 11.489 1.00 0.00 N ATOM 431 CA VAL A 151 -0.055 -1.581 11.405 1.00 0.00 C ATOM 432 C VAL A 151 -0.710 -2.382 10.278 1.00 0.00 C ATOM 433 O VAL A 151 -1.896 -2.277 10.036 1.00 0.00 O ATOM 434 CB VAL A 151 -0.249 -2.318 12.732 1.00 0.00 C ATOM 435 CG1 VAL A 151 0.484 -3.661 12.682 1.00 0.00 C ATOM 436 CG2 VAL A 151 0.317 -1.471 13.873 1.00 0.00 C ATOM 0 H VAL A 151 -1.692 -0.236 11.663 1.00 0.00 H new ATOM 0 HA VAL A 151 1.010 -1.471 11.202 1.00 0.00 H new ATOM 0 HB VAL A 151 -1.312 -2.490 12.900 1.00 0.00 H new ATOM 0 HG11 VAL A 151 0.346 -4.186 13.627 1.00 0.00 H new ATOM 0 HG12 VAL A 151 0.081 -4.265 11.869 1.00 0.00 H new ATOM 0 HG13 VAL A 151 1.547 -3.489 12.514 1.00 0.00 H new ATOM 0 HG21 VAL A 151 0.179 -1.995 14.819 1.00 0.00 H new ATOM 0 HG22 VAL A 151 1.380 -1.299 13.705 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -0.204 -0.514 13.909 1.00 0.00 H new ATOM 446 N ASP A 152 0.053 -3.183 9.586 1.00 0.00 N ATOM 447 CA ASP A 152 -0.526 -3.989 8.475 1.00 0.00 C ATOM 448 C ASP A 152 -0.253 -5.473 8.725 1.00 0.00 C ATOM 449 O ASP A 152 0.799 -5.985 8.394 1.00 0.00 O ATOM 450 CB ASP A 152 0.113 -3.567 7.150 1.00 0.00 C ATOM 451 CG ASP A 152 -0.347 -2.154 6.790 1.00 0.00 C ATOM 452 OD1 ASP A 152 -1.262 -1.667 7.432 1.00 0.00 O ATOM 453 OD2 ASP A 152 0.225 -1.581 5.876 1.00 0.00 O ATOM 0 H ASP A 152 1.052 -3.314 9.742 1.00 0.00 H new ATOM 0 HA ASP A 152 -1.602 -3.821 8.428 1.00 0.00 H new ATOM 0 HB2 ASP A 152 1.199 -3.598 7.232 1.00 0.00 H new ATOM 0 HB3 ASP A 152 -0.167 -4.264 6.360 1.00 0.00 H new ATOM 458 N TYR A 153 -1.190 -6.170 9.306 1.00 0.00 N ATOM 459 CA TYR A 153 -0.983 -7.621 9.575 1.00 0.00 C ATOM 460 C TYR A 153 -0.895 -8.379 8.249 1.00 0.00 C ATOM 461 O TYR A 153 -0.069 -9.253 8.076 1.00 0.00 O ATOM 462 CB TYR A 153 -2.156 -8.161 10.394 1.00 0.00 C ATOM 463 CG TYR A 153 -2.169 -7.500 11.752 1.00 0.00 C ATOM 464 CD1 TYR A 153 -1.309 -7.954 12.760 1.00 0.00 C ATOM 465 CD2 TYR A 153 -3.040 -6.433 12.004 1.00 0.00 C ATOM 466 CE1 TYR A 153 -1.320 -7.341 14.019 1.00 0.00 C ATOM 467 CE2 TYR A 153 -3.051 -5.820 13.262 1.00 0.00 C ATOM 468 CZ TYR A 153 -2.192 -6.274 14.270 1.00 0.00 C ATOM 469 OH TYR A 153 -2.203 -5.670 15.510 1.00 0.00 O ATOM 0 H TYR A 153 -2.091 -5.797 9.606 1.00 0.00 H new ATOM 0 HA TYR A 153 -0.057 -7.758 10.133 1.00 0.00 H new ATOM 0 HB2 TYR A 153 -3.095 -7.968 9.875 1.00 0.00 H new ATOM 0 HB3 TYR A 153 -2.069 -9.242 10.505 1.00 0.00 H new ATOM 0 HD1 TYR A 153 -0.637 -8.777 12.566 1.00 0.00 H new ATOM 0 HD2 TYR A 153 -3.704 -6.083 11.227 1.00 0.00 H new ATOM 0 HE1 TYR A 153 -0.656 -7.691 14.796 1.00 0.00 H new ATOM 0 HE2 TYR A 153 -3.722 -4.996 13.455 1.00 0.00 H new ATOM 0 HH TYR A 153 -2.864 -4.947 15.516 1.00 0.00 H new ATOM 479 N GLU A 154 -1.740 -8.050 7.311 1.00 0.00 N ATOM 480 CA GLU A 154 -1.706 -8.752 5.997 1.00 0.00 C ATOM 481 C GLU A 154 -0.331 -8.559 5.352 1.00 0.00 C ATOM 482 O GLU A 154 0.248 -9.482 4.816 1.00 0.00 O ATOM 483 CB GLU A 154 -2.784 -8.171 5.080 1.00 0.00 C ATOM 484 CG GLU A 154 -4.165 -8.450 5.678 1.00 0.00 C ATOM 485 CD GLU A 154 -4.385 -9.961 5.769 1.00 0.00 C ATOM 486 OE1 GLU A 154 -3.662 -10.687 5.107 1.00 0.00 O ATOM 487 OE2 GLU A 154 -5.274 -10.368 6.501 1.00 0.00 O ATOM 0 H GLU A 154 -2.453 -7.325 7.398 1.00 0.00 H new ATOM 0 HA GLU A 154 -1.892 -9.815 6.148 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -2.637 -7.097 4.962 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -2.709 -8.614 4.087 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -4.242 -8.000 6.668 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -4.939 -7.995 5.060 1.00 0.00 H new ATOM 494 N LYS A 155 0.195 -7.366 5.401 1.00 0.00 N ATOM 495 CA LYS A 155 1.531 -7.116 4.791 1.00 0.00 C ATOM 496 C LYS A 155 2.626 -7.425 5.815 1.00 0.00 C ATOM 497 O LYS A 155 3.796 -7.474 5.491 1.00 0.00 O ATOM 498 CB LYS A 155 1.630 -5.650 4.367 1.00 0.00 C ATOM 499 CG LYS A 155 0.574 -5.355 3.298 1.00 0.00 C ATOM 500 CD LYS A 155 0.727 -3.912 2.814 1.00 0.00 C ATOM 501 CE LYS A 155 -0.406 -3.579 1.841 1.00 0.00 C ATOM 502 NZ LYS A 155 -1.059 -2.305 2.256 1.00 0.00 N ATOM 0 H LYS A 155 -0.242 -6.554 5.837 1.00 0.00 H new ATOM 0 HA LYS A 155 1.658 -7.757 3.919 1.00 0.00 H new ATOM 0 HB2 LYS A 155 1.481 -5.000 5.229 1.00 0.00 H new ATOM 0 HB3 LYS A 155 2.626 -5.440 3.977 1.00 0.00 H new ATOM 0 HG2 LYS A 155 0.686 -6.044 2.461 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -0.425 -5.509 3.706 1.00 0.00 H new ATOM 0 HD2 LYS A 155 0.705 -3.228 3.662 1.00 0.00 H new ATOM 0 HD3 LYS A 155 1.692 -3.782 2.324 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -0.014 -3.486 0.828 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -1.137 -4.387 1.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -1.829 -2.078 1.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -1.446 -2.410 3.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -0.358 -1.537 2.247 1.00 0.00 H new ATOM 516 N SER A 156 2.256 -7.636 7.049 1.00 0.00 N ATOM 517 CA SER A 156 3.275 -7.942 8.090 1.00 0.00 C ATOM 518 C SER A 156 4.325 -6.828 8.118 1.00 0.00 C ATOM 519 O SER A 156 5.510 -7.077 8.022 1.00 0.00 O ATOM 520 CB SER A 156 3.954 -9.274 7.764 1.00 0.00 C ATOM 521 OG SER A 156 3.249 -10.331 8.396 1.00 0.00 O ATOM 0 H SER A 156 1.292 -7.609 7.380 1.00 0.00 H new ATOM 0 HA SER A 156 2.790 -8.010 9.064 1.00 0.00 H new ATOM 0 HB2 SER A 156 3.974 -9.430 6.685 1.00 0.00 H new ATOM 0 HB3 SER A 156 4.990 -9.259 8.103 1.00 0.00 H new ATOM 0 HG SER A 156 3.682 -11.185 8.186 1.00 0.00 H new ATOM 527 N ARG A 157 3.899 -5.602 8.249 1.00 0.00 N ATOM 528 CA ARG A 157 4.872 -4.475 8.283 1.00 0.00 C ATOM 529 C ARG A 157 4.438 -3.457 9.339 1.00 0.00 C ATOM 530 O ARG A 157 3.305 -3.449 9.780 1.00 0.00 O ATOM 531 CB ARG A 157 4.919 -3.799 6.911 1.00 0.00 C ATOM 532 CG ARG A 157 5.569 -4.746 5.899 1.00 0.00 C ATOM 533 CD ARG A 157 7.030 -4.982 6.286 1.00 0.00 C ATOM 534 NE ARG A 157 7.681 -5.849 5.264 1.00 0.00 N ATOM 535 CZ ARG A 157 7.565 -7.146 5.340 1.00 0.00 C ATOM 536 NH1 ARG A 157 7.950 -7.773 6.418 1.00 0.00 N ATOM 537 NH2 ARG A 157 7.064 -7.817 4.339 1.00 0.00 N ATOM 0 H ARG A 157 2.919 -5.332 8.334 1.00 0.00 H new ATOM 0 HA ARG A 157 5.861 -4.858 8.533 1.00 0.00 H new ATOM 0 HB2 ARG A 157 3.911 -3.539 6.587 1.00 0.00 H new ATOM 0 HB3 ARG A 157 5.485 -2.869 6.971 1.00 0.00 H new ATOM 0 HG2 ARG A 157 5.031 -5.694 5.874 1.00 0.00 H new ATOM 0 HG3 ARG A 157 5.511 -4.320 4.897 1.00 0.00 H new ATOM 0 HD2 ARG A 157 7.556 -4.030 6.359 1.00 0.00 H new ATOM 0 HD3 ARG A 157 7.086 -5.453 7.267 1.00 0.00 H new ATOM 0 HE ARG A 157 8.217 -5.428 4.505 1.00 0.00 H new ATOM 0 HH11 ARG A 157 8.341 -7.249 7.201 1.00 0.00 H new ATOM 0 HH12 ARG A 157 7.859 -8.787 6.478 1.00 0.00 H new ATOM 0 HH21 ARG A 157 6.763 -7.327 3.496 1.00 0.00 H new ATOM 0 HH22 ARG A 157 6.974 -8.831 4.399 1.00 0.00 H new ATOM 551 N LEU A 158 5.331 -2.599 9.750 1.00 0.00 N ATOM 552 CA LEU A 158 4.971 -1.584 10.780 1.00 0.00 C ATOM 553 C LEU A 158 5.232 -0.181 10.229 1.00 0.00 C ATOM 554 O LEU A 158 6.287 0.101 9.695 1.00 0.00 O ATOM 555 CB LEU A 158 5.824 -1.804 12.030 1.00 0.00 C ATOM 556 CG LEU A 158 5.319 -3.032 12.787 1.00 0.00 C ATOM 557 CD1 LEU A 158 5.834 -4.295 12.100 1.00 0.00 C ATOM 558 CD2 LEU A 158 5.835 -2.993 14.227 1.00 0.00 C ATOM 0 H LEU A 158 6.294 -2.557 9.417 1.00 0.00 H new ATOM 0 HA LEU A 158 3.916 -1.684 11.034 1.00 0.00 H new ATOM 0 HB2 LEU A 158 6.868 -1.941 11.750 1.00 0.00 H new ATOM 0 HB3 LEU A 158 5.779 -0.925 12.672 1.00 0.00 H new ATOM 0 HG LEU A 158 4.229 -3.034 12.791 1.00 0.00 H new ATOM 0 HD11 LEU A 158 5.476 -5.173 12.637 1.00 0.00 H new ATOM 0 HD12 LEU A 158 5.470 -4.325 11.073 1.00 0.00 H new ATOM 0 HD13 LEU A 158 6.924 -4.290 12.099 1.00 0.00 H new ATOM 0 HD21 LEU A 158 5.475 -3.869 14.766 1.00 0.00 H new ATOM 0 HD22 LEU A 158 6.925 -2.992 14.223 1.00 0.00 H new ATOM 0 HD23 LEU A 158 5.473 -2.090 14.719 1.00 0.00 H new ATOM 570 N LYS A 159 4.282 0.704 10.358 1.00 0.00 N ATOM 571 CA LYS A 159 4.477 2.089 9.846 1.00 0.00 C ATOM 572 C LYS A 159 4.917 2.995 10.998 1.00 0.00 C ATOM 573 O LYS A 159 4.109 3.459 11.778 1.00 0.00 O ATOM 574 CB LYS A 159 3.163 2.609 9.262 1.00 0.00 C ATOM 575 CG LYS A 159 2.758 1.745 8.066 1.00 0.00 C ATOM 576 CD LYS A 159 1.604 2.415 7.319 1.00 0.00 C ATOM 577 CE LYS A 159 1.105 1.485 6.211 1.00 0.00 C ATOM 578 NZ LYS A 159 1.531 2.019 4.886 1.00 0.00 N ATOM 0 H LYS A 159 3.378 0.527 10.796 1.00 0.00 H new ATOM 0 HA LYS A 159 5.241 2.087 9.069 1.00 0.00 H new ATOM 0 HB2 LYS A 159 2.381 2.587 10.021 1.00 0.00 H new ATOM 0 HB3 LYS A 159 3.277 3.648 8.952 1.00 0.00 H new ATOM 0 HG2 LYS A 159 3.608 1.610 7.397 1.00 0.00 H new ATOM 0 HG3 LYS A 159 2.458 0.753 8.405 1.00 0.00 H new ATOM 0 HD2 LYS A 159 0.793 2.642 8.010 1.00 0.00 H new ATOM 0 HD3 LYS A 159 1.934 3.362 6.892 1.00 0.00 H new ATOM 0 HE2 LYS A 159 1.505 0.481 6.356 1.00 0.00 H new ATOM 0 HE3 LYS A 159 0.019 1.404 6.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 1.192 1.388 4.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 1.129 2.968 4.749 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 2.569 2.074 4.851 1.00 0.00 H new ATOM 592 N VAL A 160 6.192 3.248 11.114 1.00 0.00 N ATOM 593 CA VAL A 160 6.680 4.120 12.219 1.00 0.00 C ATOM 594 C VAL A 160 7.461 5.300 11.637 1.00 0.00 C ATOM 595 O VAL A 160 8.136 5.177 10.634 1.00 0.00 O ATOM 596 CB VAL A 160 7.594 3.310 13.141 1.00 0.00 C ATOM 597 CG1 VAL A 160 7.972 4.157 14.358 1.00 0.00 C ATOM 598 CG2 VAL A 160 6.863 2.048 13.603 1.00 0.00 C ATOM 0 H VAL A 160 6.916 2.889 10.492 1.00 0.00 H new ATOM 0 HA VAL A 160 5.828 4.495 12.786 1.00 0.00 H new ATOM 0 HB VAL A 160 8.498 3.028 12.601 1.00 0.00 H new ATOM 0 HG11 VAL A 160 8.623 3.580 15.015 1.00 0.00 H new ATOM 0 HG12 VAL A 160 8.493 5.056 14.028 1.00 0.00 H new ATOM 0 HG13 VAL A 160 7.069 4.440 14.899 1.00 0.00 H new ATOM 0 HG21 VAL A 160 7.514 1.471 14.260 1.00 0.00 H new ATOM 0 HG22 VAL A 160 5.959 2.328 14.143 1.00 0.00 H new ATOM 0 HG23 VAL A 160 6.595 1.445 12.736 1.00 0.00 H new ATOM 608 N SER A 161 7.375 6.444 12.260 1.00 0.00 N ATOM 609 CA SER A 161 8.114 7.631 11.745 1.00 0.00 C ATOM 610 C SER A 161 9.214 8.013 12.738 1.00 0.00 C ATOM 611 O SER A 161 9.076 7.831 13.932 1.00 0.00 O ATOM 612 CB SER A 161 7.144 8.804 11.581 1.00 0.00 C ATOM 613 OG SER A 161 6.694 9.229 12.860 1.00 0.00 O ATOM 0 H SER A 161 6.825 6.607 13.103 1.00 0.00 H new ATOM 0 HA SER A 161 8.561 7.393 10.780 1.00 0.00 H new ATOM 0 HB2 SER A 161 7.637 9.628 11.065 1.00 0.00 H new ATOM 0 HB3 SER A 161 6.295 8.505 10.966 1.00 0.00 H new ATOM 0 HG SER A 161 6.074 9.981 12.756 1.00 0.00 H new ATOM 619 N VAL A 162 10.306 8.541 12.256 1.00 0.00 N ATOM 620 CA VAL A 162 11.412 8.931 13.176 1.00 0.00 C ATOM 621 C VAL A 162 11.573 10.452 13.170 1.00 0.00 C ATOM 622 O VAL A 162 11.690 11.069 12.130 1.00 0.00 O ATOM 623 CB VAL A 162 12.716 8.280 12.711 1.00 0.00 C ATOM 624 CG1 VAL A 162 13.794 8.485 13.776 1.00 0.00 C ATOM 625 CG2 VAL A 162 12.490 6.784 12.493 1.00 0.00 C ATOM 0 H VAL A 162 10.480 8.719 11.267 1.00 0.00 H new ATOM 0 HA VAL A 162 11.177 8.596 14.186 1.00 0.00 H new ATOM 0 HB VAL A 162 13.038 8.737 11.775 1.00 0.00 H new ATOM 0 HG11 VAL A 162 14.724 8.022 13.446 1.00 0.00 H new ATOM 0 HG12 VAL A 162 13.955 9.552 13.930 1.00 0.00 H new ATOM 0 HG13 VAL A 162 13.473 8.028 14.712 1.00 0.00 H new ATOM 0 HG21 VAL A 162 13.419 6.320 12.162 1.00 0.00 H new ATOM 0 HG22 VAL A 162 12.168 6.325 13.428 1.00 0.00 H new ATOM 0 HG23 VAL A 162 11.721 6.639 11.734 1.00 0.00 H new ATOM 635 N SER A 163 11.582 11.061 14.324 1.00 0.00 N ATOM 636 CA SER A 163 11.739 12.541 14.382 1.00 0.00 C ATOM 637 C SER A 163 13.220 12.904 14.240 1.00 0.00 C ATOM 638 O SER A 163 13.900 13.163 15.212 1.00 0.00 O ATOM 639 CB SER A 163 11.216 13.057 15.724 1.00 0.00 C ATOM 640 OG SER A 163 11.315 14.473 15.759 1.00 0.00 O ATOM 0 H SER A 163 11.488 10.598 15.228 1.00 0.00 H new ATOM 0 HA SER A 163 11.173 12.998 13.570 1.00 0.00 H new ATOM 0 HB2 SER A 163 10.179 12.751 15.864 1.00 0.00 H new ATOM 0 HB3 SER A 163 11.790 12.622 16.542 1.00 0.00 H new ATOM 0 HG SER A 163 10.978 14.803 16.618 1.00 0.00 H new ATOM 646 N ILE A 164 13.723 12.924 13.035 1.00 0.00 N ATOM 647 CA ILE A 164 15.158 13.270 12.836 1.00 0.00 C ATOM 648 C ILE A 164 15.275 14.749 12.464 1.00 0.00 C ATOM 649 O ILE A 164 14.505 15.264 11.678 1.00 0.00 O ATOM 650 CB ILE A 164 15.740 12.413 11.710 1.00 0.00 C ATOM 651 CG1 ILE A 164 15.538 10.931 12.039 1.00 0.00 C ATOM 652 CG2 ILE A 164 17.235 12.705 11.567 1.00 0.00 C ATOM 653 CD1 ILE A 164 16.098 10.075 10.901 1.00 0.00 C ATOM 0 H ILE A 164 13.203 12.716 12.182 1.00 0.00 H new ATOM 0 HA ILE A 164 15.710 13.080 13.757 1.00 0.00 H new ATOM 0 HB ILE A 164 15.233 12.649 10.775 1.00 0.00 H new ATOM 0 HG12 ILE A 164 16.039 10.684 12.975 1.00 0.00 H new ATOM 0 HG13 ILE A 164 14.478 10.720 12.179 1.00 0.00 H new ATOM 0 HG21 ILE A 164 17.650 12.095 10.765 1.00 0.00 H new ATOM 0 HG22 ILE A 164 17.379 13.760 11.332 1.00 0.00 H new ATOM 0 HG23 ILE A 164 17.743 12.469 12.502 1.00 0.00 H new ATOM 0 HD11 ILE A 164 15.954 9.020 11.135 1.00 0.00 H new ATOM 0 HD12 ILE A 164 15.577 10.316 9.974 1.00 0.00 H new ATOM 0 HD13 ILE A 164 17.162 10.279 10.782 1.00 0.00 H new ATOM 665 N PHE A 165 16.231 15.438 13.024 1.00 0.00 N ATOM 666 CA PHE A 165 16.392 16.883 12.701 1.00 0.00 C ATOM 667 C PHE A 165 15.156 17.649 13.174 1.00 0.00 C ATOM 668 O PHE A 165 14.934 18.783 12.799 1.00 0.00 O ATOM 669 CB PHE A 165 16.551 17.055 11.190 1.00 0.00 C ATOM 670 CG PHE A 165 17.004 18.463 10.889 1.00 0.00 C ATOM 671 CD1 PHE A 165 18.359 18.800 10.988 1.00 0.00 C ATOM 672 CD2 PHE A 165 16.068 19.434 10.512 1.00 0.00 C ATOM 673 CE1 PHE A 165 18.779 20.106 10.710 1.00 0.00 C ATOM 674 CE2 PHE A 165 16.488 20.740 10.233 1.00 0.00 C ATOM 675 CZ PHE A 165 17.843 21.076 10.332 1.00 0.00 C ATOM 0 H PHE A 165 16.906 15.063 13.690 1.00 0.00 H new ATOM 0 HA PHE A 165 17.277 17.272 13.204 1.00 0.00 H new ATOM 0 HB2 PHE A 165 17.277 16.338 10.806 1.00 0.00 H new ATOM 0 HB3 PHE A 165 15.605 16.851 10.688 1.00 0.00 H new ATOM 0 HD1 PHE A 165 19.081 18.052 11.279 1.00 0.00 H new ATOM 0 HD2 PHE A 165 15.022 19.175 10.436 1.00 0.00 H new ATOM 0 HE1 PHE A 165 19.825 20.365 10.787 1.00 0.00 H new ATOM 0 HE2 PHE A 165 15.766 21.488 9.941 1.00 0.00 H new ATOM 0 HZ PHE A 165 18.167 22.084 10.117 1.00 0.00 H new ATOM 685 N GLY A 166 14.346 17.037 13.993 1.00 0.00 N ATOM 686 CA GLY A 166 13.122 17.728 14.488 1.00 0.00 C ATOM 687 C GLY A 166 11.994 17.557 13.467 1.00 0.00 C ATOM 688 O GLY A 166 10.953 18.176 13.568 1.00 0.00 O ATOM 0 H GLY A 166 14.479 16.088 14.341 1.00 0.00 H new ATOM 0 HA2 GLY A 166 12.822 17.315 15.451 1.00 0.00 H new ATOM 0 HA3 GLY A 166 13.327 18.787 14.646 1.00 0.00 H new ATOM 692 N ARG A 167 12.192 16.721 12.484 1.00 0.00 N ATOM 693 CA ARG A 167 11.133 16.512 11.458 1.00 0.00 C ATOM 694 C ARG A 167 10.672 15.053 11.493 1.00 0.00 C ATOM 695 O ARG A 167 11.458 14.148 11.689 1.00 0.00 O ATOM 696 CB ARG A 167 11.694 16.835 10.072 1.00 0.00 C ATOM 697 CG ARG A 167 12.004 18.331 9.983 1.00 0.00 C ATOM 698 CD ARG A 167 12.402 18.684 8.548 1.00 0.00 C ATOM 699 NE ARG A 167 13.544 17.825 8.124 1.00 0.00 N ATOM 700 CZ ARG A 167 13.812 17.675 6.855 1.00 0.00 C ATOM 701 NH1 ARG A 167 14.012 18.722 6.102 1.00 0.00 N ATOM 702 NH2 ARG A 167 13.879 16.478 6.341 1.00 0.00 N ATOM 0 H ARG A 167 13.042 16.174 12.348 1.00 0.00 H new ATOM 0 HA ARG A 167 10.288 17.167 11.669 1.00 0.00 H new ATOM 0 HB2 ARG A 167 12.598 16.254 9.889 1.00 0.00 H new ATOM 0 HB3 ARG A 167 10.974 16.555 9.302 1.00 0.00 H new ATOM 0 HG2 ARG A 167 11.133 18.913 10.284 1.00 0.00 H new ATOM 0 HG3 ARG A 167 12.811 18.588 10.669 1.00 0.00 H new ATOM 0 HD2 ARG A 167 11.555 18.538 7.878 1.00 0.00 H new ATOM 0 HD3 ARG A 167 12.681 19.736 8.485 1.00 0.00 H new ATOM 0 HE ARG A 167 14.116 17.354 8.825 1.00 0.00 H new ATOM 0 HH11 ARG A 167 13.959 19.658 6.505 1.00 0.00 H new ATOM 0 HH12 ARG A 167 14.221 18.605 5.111 1.00 0.00 H new ATOM 0 HH21 ARG A 167 13.722 15.660 6.930 1.00 0.00 H new ATOM 0 HH22 ARG A 167 14.088 16.360 5.350 1.00 0.00 H new ATOM 716 N ALA A 168 9.401 14.818 11.305 1.00 0.00 N ATOM 717 CA ALA A 168 8.893 13.418 11.328 1.00 0.00 C ATOM 718 C ALA A 168 9.153 12.758 9.972 1.00 0.00 C ATOM 719 O ALA A 168 8.912 13.338 8.932 1.00 0.00 O ATOM 720 CB ALA A 168 7.389 13.426 11.609 1.00 0.00 C ATOM 0 H ALA A 168 8.695 15.534 11.137 1.00 0.00 H new ATOM 0 HA ALA A 168 9.407 12.858 12.110 1.00 0.00 H new ATOM 0 HB1 ALA A 168 7.017 12.402 11.626 1.00 0.00 H new ATOM 0 HB2 ALA A 168 7.202 13.896 12.574 1.00 0.00 H new ATOM 0 HB3 ALA A 168 6.876 13.986 10.827 1.00 0.00 H new ATOM 726 N THR A 169 9.644 11.548 9.974 1.00 0.00 N ATOM 727 CA THR A 169 9.919 10.853 8.686 1.00 0.00 C ATOM 728 C THR A 169 9.261 9.472 8.701 1.00 0.00 C ATOM 729 O THR A 169 9.914 8.465 8.890 1.00 0.00 O ATOM 730 CB THR A 169 11.431 10.694 8.505 1.00 0.00 C ATOM 731 OG1 THR A 169 12.032 11.978 8.408 1.00 0.00 O ATOM 732 CG2 THR A 169 11.714 9.900 7.228 1.00 0.00 C ATOM 0 H THR A 169 9.866 11.012 10.813 1.00 0.00 H new ATOM 0 HA THR A 169 9.513 11.441 7.863 1.00 0.00 H new ATOM 0 HB THR A 169 11.845 10.161 9.361 1.00 0.00 H new ATOM 0 HG1 THR A 169 13.000 11.878 8.294 1.00 0.00 H new ATOM 0 HG21 THR A 169 12.791 9.788 7.100 1.00 0.00 H new ATOM 0 HG22 THR A 169 11.253 8.915 7.302 1.00 0.00 H new ATOM 0 HG23 THR A 169 11.301 10.431 6.370 1.00 0.00 H new ATOM 740 N PRO A 170 7.936 9.430 8.495 1.00 0.00 N ATOM 741 CA PRO A 170 7.176 8.174 8.484 1.00 0.00 C ATOM 742 C PRO A 170 7.777 7.154 7.511 1.00 0.00 C ATOM 743 O PRO A 170 7.677 7.295 6.309 1.00 0.00 O ATOM 744 CB PRO A 170 5.789 8.599 8.003 1.00 0.00 C ATOM 745 CG PRO A 170 6.028 9.845 7.220 1.00 0.00 C ATOM 746 CD PRO A 170 7.188 10.538 7.876 1.00 0.00 C ATOM 0 HA PRO A 170 7.174 7.689 9.460 1.00 0.00 H new ATOM 0 HB2 PRO A 170 5.329 7.826 7.387 1.00 0.00 H new ATOM 0 HB3 PRO A 170 5.117 8.781 8.842 1.00 0.00 H new ATOM 0 HG2 PRO A 170 6.252 9.613 6.179 1.00 0.00 H new ATOM 0 HG3 PRO A 170 5.143 10.481 7.222 1.00 0.00 H new ATOM 0 HD2 PRO A 170 7.796 11.079 7.151 1.00 0.00 H new ATOM 0 HD3 PRO A 170 6.856 11.264 8.618 1.00 0.00 H new ATOM 754 N VAL A 171 8.399 6.128 8.023 1.00 0.00 N ATOM 755 CA VAL A 171 9.003 5.100 7.129 1.00 0.00 C ATOM 756 C VAL A 171 8.497 3.713 7.532 1.00 0.00 C ATOM 757 O VAL A 171 8.067 3.500 8.648 1.00 0.00 O ATOM 758 CB VAL A 171 10.527 5.144 7.256 1.00 0.00 C ATOM 759 CG1 VAL A 171 11.024 6.559 6.947 1.00 0.00 C ATOM 760 CG2 VAL A 171 10.933 4.761 8.680 1.00 0.00 C ATOM 0 H VAL A 171 8.515 5.957 9.022 1.00 0.00 H new ATOM 0 HA VAL A 171 8.719 5.305 6.097 1.00 0.00 H new ATOM 0 HB VAL A 171 10.970 4.441 6.551 1.00 0.00 H new ATOM 0 HG11 VAL A 171 12.110 6.591 7.037 1.00 0.00 H new ATOM 0 HG12 VAL A 171 10.736 6.832 5.932 1.00 0.00 H new ATOM 0 HG13 VAL A 171 10.580 7.262 7.652 1.00 0.00 H new ATOM 0 HG21 VAL A 171 12.019 4.793 8.770 1.00 0.00 H new ATOM 0 HG22 VAL A 171 10.490 5.463 9.386 1.00 0.00 H new ATOM 0 HG23 VAL A 171 10.580 3.754 8.901 1.00 0.00 H new ATOM 770 N GLU A 172 8.545 2.769 6.632 1.00 0.00 N ATOM 771 CA GLU A 172 8.065 1.398 6.966 1.00 0.00 C ATOM 772 C GLU A 172 9.232 0.564 7.500 1.00 0.00 C ATOM 773 O GLU A 172 10.279 0.482 6.890 1.00 0.00 O ATOM 774 CB GLU A 172 7.498 0.736 5.709 1.00 0.00 C ATOM 775 CG GLU A 172 6.301 1.544 5.203 1.00 0.00 C ATOM 776 CD GLU A 172 5.685 0.841 3.992 1.00 0.00 C ATOM 777 OE1 GLU A 172 6.281 -0.113 3.519 1.00 0.00 O ATOM 778 OE2 GLU A 172 4.630 1.270 3.556 1.00 0.00 O ATOM 0 H GLU A 172 8.895 2.887 5.681 1.00 0.00 H new ATOM 0 HA GLU A 172 7.286 1.461 7.726 1.00 0.00 H new ATOM 0 HB2 GLU A 172 8.265 0.680 4.937 1.00 0.00 H new ATOM 0 HB3 GLU A 172 7.193 -0.287 5.930 1.00 0.00 H new ATOM 0 HG2 GLU A 172 5.558 1.647 5.994 1.00 0.00 H new ATOM 0 HG3 GLU A 172 6.618 2.551 4.930 1.00 0.00 H new ATOM 785 N LEU A 173 9.059 -0.055 8.635 1.00 0.00 N ATOM 786 CA LEU A 173 10.158 -0.883 9.207 1.00 0.00 C ATOM 787 C LEU A 173 9.664 -2.317 9.411 1.00 0.00 C ATOM 788 O LEU A 173 8.482 -2.564 9.541 1.00 0.00 O ATOM 789 CB LEU A 173 10.593 -0.296 10.552 1.00 0.00 C ATOM 790 CG LEU A 173 11.073 1.144 10.352 1.00 0.00 C ATOM 791 CD1 LEU A 173 12.042 1.199 9.169 1.00 0.00 C ATOM 792 CD2 LEU A 173 9.871 2.048 10.069 1.00 0.00 C ATOM 0 H LEU A 173 8.204 -0.023 9.191 1.00 0.00 H new ATOM 0 HA LEU A 173 11.005 -0.885 8.521 1.00 0.00 H new ATOM 0 HB2 LEU A 173 9.761 -0.318 11.256 1.00 0.00 H new ATOM 0 HB3 LEU A 173 11.392 -0.900 10.983 1.00 0.00 H new ATOM 0 HG LEU A 173 11.581 1.486 11.254 1.00 0.00 H new ATOM 0 HD11 LEU A 173 12.384 2.224 9.026 1.00 0.00 H new ATOM 0 HD12 LEU A 173 12.898 0.555 9.370 1.00 0.00 H new ATOM 0 HD13 LEU A 173 11.535 0.857 8.267 1.00 0.00 H new ATOM 0 HD21 LEU A 173 10.212 3.073 9.927 1.00 0.00 H new ATOM 0 HD22 LEU A 173 9.363 1.706 9.167 1.00 0.00 H new ATOM 0 HD23 LEU A 173 9.180 2.009 10.911 1.00 0.00 H new ATOM 804 N ASP A 174 10.560 -3.265 9.439 1.00 0.00 N ATOM 805 CA ASP A 174 10.142 -4.683 9.633 1.00 0.00 C ATOM 806 C ASP A 174 9.961 -4.965 11.126 1.00 0.00 C ATOM 807 O ASP A 174 10.349 -4.182 11.970 1.00 0.00 O ATOM 808 CB ASP A 174 11.217 -5.613 9.066 1.00 0.00 C ATOM 809 CG ASP A 174 11.322 -5.409 7.554 1.00 0.00 C ATOM 810 OD1 ASP A 174 10.412 -4.826 6.989 1.00 0.00 O ATOM 811 OD2 ASP A 174 12.313 -5.840 6.985 1.00 0.00 O ATOM 0 H ASP A 174 11.564 -3.119 9.336 1.00 0.00 H new ATOM 0 HA ASP A 174 9.199 -4.856 9.115 1.00 0.00 H new ATOM 0 HB2 ASP A 174 12.177 -5.407 9.539 1.00 0.00 H new ATOM 0 HB3 ASP A 174 10.969 -6.651 9.287 1.00 0.00 H new ATOM 816 N PHE A 175 9.371 -6.082 11.458 1.00 0.00 N ATOM 817 CA PHE A 175 9.162 -6.420 12.895 1.00 0.00 C ATOM 818 C PHE A 175 10.514 -6.483 13.609 1.00 0.00 C ATOM 819 O PHE A 175 10.702 -5.896 14.656 1.00 0.00 O ATOM 820 CB PHE A 175 8.470 -7.782 13.001 1.00 0.00 C ATOM 821 CG PHE A 175 6.985 -7.615 12.785 1.00 0.00 C ATOM 822 CD1 PHE A 175 6.508 -7.057 11.593 1.00 0.00 C ATOM 823 CD2 PHE A 175 6.084 -8.018 13.778 1.00 0.00 C ATOM 824 CE1 PHE A 175 5.131 -6.905 11.393 1.00 0.00 C ATOM 825 CE2 PHE A 175 4.707 -7.865 13.579 1.00 0.00 C ATOM 826 CZ PHE A 175 4.230 -7.308 12.386 1.00 0.00 C ATOM 0 H PHE A 175 9.025 -6.775 10.795 1.00 0.00 H new ATOM 0 HA PHE A 175 8.540 -5.655 13.360 1.00 0.00 H new ATOM 0 HB2 PHE A 175 8.880 -8.468 12.260 1.00 0.00 H new ATOM 0 HB3 PHE A 175 8.658 -8.221 13.981 1.00 0.00 H new ATOM 0 HD1 PHE A 175 7.203 -6.744 10.828 1.00 0.00 H new ATOM 0 HD2 PHE A 175 6.452 -8.447 14.698 1.00 0.00 H new ATOM 0 HE1 PHE A 175 4.763 -6.477 10.472 1.00 0.00 H new ATOM 0 HE2 PHE A 175 4.013 -8.176 14.345 1.00 0.00 H new ATOM 0 HZ PHE A 175 3.168 -7.189 12.232 1.00 0.00 H new ATOM 836 N SER A 176 11.458 -7.194 13.053 1.00 0.00 N ATOM 837 CA SER A 176 12.795 -7.298 13.704 1.00 0.00 C ATOM 838 C SER A 176 13.598 -6.023 13.437 1.00 0.00 C ATOM 839 O SER A 176 14.552 -5.723 14.128 1.00 0.00 O ATOM 840 CB SER A 176 13.547 -8.502 13.134 1.00 0.00 C ATOM 841 OG SER A 176 13.890 -8.249 11.779 1.00 0.00 O ATOM 0 H SER A 176 11.361 -7.707 12.177 1.00 0.00 H new ATOM 0 HA SER A 176 12.665 -7.425 14.779 1.00 0.00 H new ATOM 0 HB2 SER A 176 14.447 -8.692 13.719 1.00 0.00 H new ATOM 0 HB3 SER A 176 12.928 -9.396 13.202 1.00 0.00 H new ATOM 0 HG SER A 176 14.373 -9.020 11.415 1.00 0.00 H new ATOM 847 N GLN A 177 13.225 -5.270 12.439 1.00 0.00 N ATOM 848 CA GLN A 177 13.973 -4.018 12.131 1.00 0.00 C ATOM 849 C GLN A 177 13.771 -3.010 13.266 1.00 0.00 C ATOM 850 O GLN A 177 14.587 -2.137 13.485 1.00 0.00 O ATOM 851 CB GLN A 177 13.454 -3.421 10.822 1.00 0.00 C ATOM 852 CG GLN A 177 14.316 -2.217 10.434 1.00 0.00 C ATOM 853 CD GLN A 177 13.847 -1.667 9.086 1.00 0.00 C ATOM 854 OE1 GLN A 177 12.924 -2.187 8.491 1.00 0.00 O ATOM 855 NE2 GLN A 177 14.449 -0.627 8.575 1.00 0.00 N ATOM 0 H GLN A 177 12.436 -5.467 11.824 1.00 0.00 H new ATOM 0 HA GLN A 177 15.034 -4.246 12.031 1.00 0.00 H new ATOM 0 HB2 GLN A 177 13.481 -4.171 10.032 1.00 0.00 H new ATOM 0 HB3 GLN A 177 12.414 -3.116 10.936 1.00 0.00 H new ATOM 0 HG2 GLN A 177 14.245 -1.444 11.199 1.00 0.00 H new ATOM 0 HG3 GLN A 177 15.364 -2.511 10.374 1.00 0.00 H new ATOM 0 HE21 GLN A 177 15.224 -0.190 9.074 1.00 0.00 H new ATOM 0 HE22 GLN A 177 14.144 -0.252 7.677 1.00 0.00 H new ATOM 864 N VAL A 178 12.688 -3.121 13.986 1.00 0.00 N ATOM 865 CA VAL A 178 12.438 -2.167 15.103 1.00 0.00 C ATOM 866 C VAL A 178 12.157 -2.946 16.390 1.00 0.00 C ATOM 867 O VAL A 178 11.763 -4.095 16.358 1.00 0.00 O ATOM 868 CB VAL A 178 11.231 -1.291 14.765 1.00 0.00 C ATOM 869 CG1 VAL A 178 11.385 -0.737 13.345 1.00 0.00 C ATOM 870 CG2 VAL A 178 9.952 -2.128 14.849 1.00 0.00 C ATOM 0 H VAL A 178 11.967 -3.830 13.849 1.00 0.00 H new ATOM 0 HA VAL A 178 13.317 -1.538 15.245 1.00 0.00 H new ATOM 0 HB VAL A 178 11.172 -0.465 15.474 1.00 0.00 H new ATOM 0 HG11 VAL A 178 10.525 -0.112 13.103 1.00 0.00 H new ATOM 0 HG12 VAL A 178 12.295 -0.141 13.284 1.00 0.00 H new ATOM 0 HG13 VAL A 178 11.444 -1.563 12.637 1.00 0.00 H new ATOM 0 HG21 VAL A 178 9.092 -1.503 14.608 1.00 0.00 H new ATOM 0 HG22 VAL A 178 10.011 -2.954 14.140 1.00 0.00 H new ATOM 0 HG23 VAL A 178 9.842 -2.524 15.859 1.00 0.00 H new ATOM 880 N GLU A 179 12.357 -2.330 17.523 1.00 0.00 N ATOM 881 CA GLU A 179 12.100 -3.035 18.810 1.00 0.00 C ATOM 882 C GLU A 179 10.886 -2.409 19.500 1.00 0.00 C ATOM 883 O GLU A 179 10.581 -1.249 19.309 1.00 0.00 O ATOM 884 CB GLU A 179 13.325 -2.902 19.717 1.00 0.00 C ATOM 885 CG GLU A 179 14.585 -3.267 18.930 1.00 0.00 C ATOM 886 CD GLU A 179 15.784 -3.310 19.878 1.00 0.00 C ATOM 887 OE1 GLU A 179 15.658 -2.812 20.986 1.00 0.00 O ATOM 888 OE2 GLU A 179 16.809 -3.840 19.483 1.00 0.00 O ATOM 0 H GLU A 179 12.687 -1.369 17.613 1.00 0.00 H new ATOM 0 HA GLU A 179 11.904 -4.089 18.614 1.00 0.00 H new ATOM 0 HB2 GLU A 179 13.402 -1.882 20.095 1.00 0.00 H new ATOM 0 HB3 GLU A 179 13.222 -3.556 20.583 1.00 0.00 H new ATOM 0 HG2 GLU A 179 14.456 -4.235 18.445 1.00 0.00 H new ATOM 0 HG3 GLU A 179 14.758 -2.536 18.141 1.00 0.00 H new ATOM 895 N LYS A 180 10.189 -3.169 20.300 1.00 0.00 N ATOM 896 CA LYS A 180 8.994 -2.618 20.999 1.00 0.00 C ATOM 897 C LYS A 180 9.446 -1.669 22.112 1.00 0.00 C ATOM 898 O LYS A 180 10.329 -1.981 22.886 1.00 0.00 O ATOM 899 CB LYS A 180 8.184 -3.764 21.605 1.00 0.00 C ATOM 900 CG LYS A 180 6.771 -3.276 21.928 1.00 0.00 C ATOM 901 CD LYS A 180 5.975 -4.412 22.574 1.00 0.00 C ATOM 902 CE LYS A 180 4.620 -4.546 21.878 1.00 0.00 C ATOM 903 NZ LYS A 180 4.813 -4.493 20.401 1.00 0.00 N ATOM 0 H LYS A 180 10.396 -4.148 20.500 1.00 0.00 H new ATOM 0 HA LYS A 180 8.375 -2.073 20.286 1.00 0.00 H new ATOM 0 HB2 LYS A 180 8.141 -4.601 20.908 1.00 0.00 H new ATOM 0 HB3 LYS A 180 8.670 -4.128 22.510 1.00 0.00 H new ATOM 0 HG2 LYS A 180 6.815 -2.420 22.601 1.00 0.00 H new ATOM 0 HG3 LYS A 180 6.274 -2.941 21.018 1.00 0.00 H new ATOM 0 HD2 LYS A 180 6.529 -5.348 22.498 1.00 0.00 H new ATOM 0 HD3 LYS A 180 5.832 -4.212 23.636 1.00 0.00 H new ATOM 0 HE2 LYS A 180 4.146 -5.486 22.160 1.00 0.00 H new ATOM 0 HE3 LYS A 180 3.954 -3.744 22.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 180 4.442 -3.593 20.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 180 5.827 -4.565 20.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 180 4.305 -5.284 19.956 1.00 0.00 H new ATOM 917 N ALA A 181 8.850 -0.511 22.196 1.00 0.00 N ATOM 918 CA ALA A 181 9.246 0.455 23.259 1.00 0.00 C ATOM 919 C ALA A 181 8.836 -0.094 24.627 1.00 0.00 C ATOM 920 O ALA A 181 9.518 -0.915 25.207 1.00 0.00 O ATOM 921 CB ALA A 181 8.546 1.795 23.016 1.00 0.00 C ATOM 0 H ALA A 181 8.106 -0.192 21.575 1.00 0.00 H new ATOM 0 HA ALA A 181 10.326 0.599 23.235 1.00 0.00 H new ATOM 0 HB1 ALA A 181 8.835 2.503 23.793 1.00 0.00 H new ATOM 0 HB2 ALA A 181 8.838 2.187 22.042 1.00 0.00 H new ATOM 0 HB3 ALA A 181 7.466 1.651 23.040 1.00 0.00 H new TER 927 ALA A 181