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+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 MET CE :methyl -125:sc= -0.0236 (180deg=-0.385) USER MOD Single : A 137 ASN : amide:sc= -2.34! C(o=-2.3!,f=-8.8!) USER MOD Single : A 145 ASN : amide:sc= 0 K(o=0,f=-1.1) 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 32:sc= 0.231 USER MOD Single : A 159 LYS NZ :NH3+ -148:sc= 0 (180deg=-0.00133) USER MOD Single : A 161 SER OG : rot 170:sc= 0 USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 169 THR OG1 : rot 81:sc= 0.00172 USER MOD Single : A 176 SER OG : rot 180:sc= 0 USER MOD Single : A 177 GLN : amide:sc= 0.528 K(o=0.53,f=-6!) USER MOD Single : A 180 LYS NZ :NH3+ -114:sc= -1.67 (180deg=-4.65!) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 123 11.201 -8.898 28.345 1.00 0.00 N ATOM 2 CA ARG A 123 11.104 -9.501 26.986 1.00 0.00 C ATOM 3 C ARG A 123 10.155 -8.665 26.125 1.00 0.00 C ATOM 4 O ARG A 123 8.994 -8.500 26.446 1.00 0.00 O ATOM 5 CB ARG A 123 10.566 -10.929 27.099 1.00 0.00 C ATOM 6 CG ARG A 123 11.318 -11.671 28.205 1.00 0.00 C ATOM 7 CD ARG A 123 12.290 -12.672 27.578 1.00 0.00 C ATOM 8 NE ARG A 123 12.417 -13.863 28.464 1.00 0.00 N ATOM 9 CZ ARG A 123 13.214 -14.841 28.132 1.00 0.00 C ATOM 10 NH1 ARG A 123 13.474 -15.073 26.874 1.00 0.00 N ATOM 11 NH2 ARG A 123 13.752 -15.588 29.057 1.00 0.00 N ATOM 0 HA ARG A 123 12.092 -9.520 26.525 1.00 0.00 H new ATOM 0 HB2 ARG A 123 9.499 -10.911 27.319 1.00 0.00 H new ATOM 0 HB3 ARG A 123 10.686 -11.451 26.150 1.00 0.00 H new ATOM 0 HG2 ARG A 123 11.862 -10.962 28.829 1.00 0.00 H new ATOM 0 HG3 ARG A 123 10.613 -12.190 28.854 1.00 0.00 H new ATOM 0 HD2 ARG A 123 11.933 -12.974 26.594 1.00 0.00 H new ATOM 0 HD3 ARG A 123 13.265 -12.207 27.434 1.00 0.00 H new ATOM 0 HE ARG A 123 11.881 -13.914 29.330 1.00 0.00 H new ATOM 0 HH11 ARG A 123 13.054 -14.490 26.150 1.00 0.00 H new ATOM 0 HH12 ARG A 123 14.097 -15.838 26.615 1.00 0.00 H new ATOM 0 HH21 ARG A 123 13.549 -15.407 30.040 1.00 0.00 H new ATOM 0 HH22 ARG A 123 14.375 -16.353 28.797 1.00 0.00 H new ATOM 25 N PRO A 124 10.663 -8.130 25.005 1.00 0.00 N ATOM 26 CA PRO A 124 9.863 -7.308 24.088 1.00 0.00 C ATOM 27 C PRO A 124 8.644 -8.070 23.559 1.00 0.00 C ATOM 28 O PRO A 124 8.705 -9.256 23.304 1.00 0.00 O ATOM 29 CB PRO A 124 10.829 -7.006 22.942 1.00 0.00 C ATOM 30 CG PRO A 124 11.811 -8.126 22.975 1.00 0.00 C ATOM 31 CD PRO A 124 11.959 -8.515 24.418 1.00 0.00 C ATOM 0 HA PRO A 124 9.468 -6.417 24.576 1.00 0.00 H new ATOM 0 HB2 PRO A 124 10.308 -6.963 21.985 1.00 0.00 H new ATOM 0 HB3 PRO A 124 11.321 -6.043 23.081 1.00 0.00 H new ATOM 0 HG2 PRO A 124 11.460 -8.969 22.379 1.00 0.00 H new ATOM 0 HG3 PRO A 124 12.768 -7.816 22.556 1.00 0.00 H new ATOM 0 HD2 PRO A 124 12.151 -9.582 24.530 1.00 0.00 H new ATOM 0 HD3 PRO A 124 12.788 -7.991 24.893 1.00 0.00 H new ATOM 39 N LYS A 125 7.538 -7.397 23.394 1.00 0.00 N ATOM 40 CA LYS A 125 6.318 -8.083 22.883 1.00 0.00 C ATOM 41 C LYS A 125 6.129 -7.753 21.401 1.00 0.00 C ATOM 42 O LYS A 125 6.511 -6.698 20.937 1.00 0.00 O ATOM 43 CB LYS A 125 5.098 -7.607 23.672 1.00 0.00 C ATOM 44 CG LYS A 125 5.260 -7.990 25.144 1.00 0.00 C ATOM 45 CD LYS A 125 3.936 -7.766 25.879 1.00 0.00 C ATOM 46 CE LYS A 125 3.632 -6.268 25.934 1.00 0.00 C ATOM 47 NZ LYS A 125 3.381 -5.864 27.346 1.00 0.00 N ATOM 0 H LYS A 125 7.427 -6.402 23.591 1.00 0.00 H new ATOM 0 HA LYS A 125 6.430 -9.161 23.003 1.00 0.00 H new ATOM 0 HB2 LYS A 125 4.989 -6.527 23.576 1.00 0.00 H new ATOM 0 HB3 LYS A 125 4.192 -8.056 23.266 1.00 0.00 H new ATOM 0 HG2 LYS A 125 5.563 -9.034 25.228 1.00 0.00 H new ATOM 0 HG3 LYS A 125 6.048 -7.392 25.602 1.00 0.00 H new ATOM 0 HD2 LYS A 125 3.130 -8.293 25.368 1.00 0.00 H new ATOM 0 HD3 LYS A 125 3.994 -8.174 26.888 1.00 0.00 H new ATOM 0 HE2 LYS A 125 4.468 -5.701 25.525 1.00 0.00 H new ATOM 0 HE3 LYS A 125 2.762 -6.040 25.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 3.174 -4.845 27.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 2.570 -6.396 27.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 4.224 -6.068 27.920 1.00 0.00 H new ATOM 61 N THR A 126 5.540 -8.647 20.656 1.00 0.00 N ATOM 62 CA THR A 126 5.326 -8.383 19.205 1.00 0.00 C ATOM 63 C THR A 126 3.946 -7.757 18.999 1.00 0.00 C ATOM 64 O THR A 126 3.443 -7.687 17.895 1.00 0.00 O ATOM 65 CB THR A 126 5.410 -9.701 18.429 1.00 0.00 C ATOM 66 OG1 THR A 126 4.339 -10.548 18.822 1.00 0.00 O ATOM 67 CG2 THR A 126 6.744 -10.387 18.728 1.00 0.00 C ATOM 0 H THR A 126 5.198 -9.548 20.989 1.00 0.00 H new ATOM 0 HA THR A 126 6.093 -7.698 18.843 1.00 0.00 H new ATOM 0 HB THR A 126 5.341 -9.500 17.360 1.00 0.00 H new ATOM 0 HG1 THR A 126 4.390 -11.391 18.325 1.00 0.00 H new ATOM 0 HG21 THR A 126 6.803 -11.325 18.175 1.00 0.00 H new ATOM 0 HG22 THR A 126 7.564 -9.736 18.426 1.00 0.00 H new ATOM 0 HG23 THR A 126 6.817 -10.590 19.796 1.00 0.00 H new ATOM 75 N LEU A 127 3.328 -7.300 20.054 1.00 0.00 N ATOM 76 CA LEU A 127 1.981 -6.677 19.917 1.00 0.00 C ATOM 77 C LEU A 127 2.135 -5.175 19.668 1.00 0.00 C ATOM 78 O LEU A 127 2.314 -4.400 20.586 1.00 0.00 O ATOM 79 CB LEU A 127 1.183 -6.902 21.203 1.00 0.00 C ATOM 80 CG LEU A 127 1.064 -8.403 21.473 1.00 0.00 C ATOM 81 CD1 LEU A 127 0.120 -8.637 22.654 1.00 0.00 C ATOM 82 CD2 LEU A 127 0.510 -9.103 20.231 1.00 0.00 C ATOM 0 H LEU A 127 3.697 -7.331 21.004 1.00 0.00 H new ATOM 0 HA LEU A 127 1.454 -7.131 19.078 1.00 0.00 H new ATOM 0 HB2 LEU A 127 1.676 -6.409 22.041 1.00 0.00 H new ATOM 0 HB3 LEU A 127 0.192 -6.458 21.111 1.00 0.00 H new ATOM 0 HG LEU A 127 2.048 -8.808 21.709 1.00 0.00 H new ATOM 0 HD11 LEU A 127 0.036 -9.707 22.846 1.00 0.00 H new ATOM 0 HD12 LEU A 127 0.515 -8.139 23.540 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -0.864 -8.232 22.419 1.00 0.00 H new ATOM 0 HD21 LEU A 127 0.425 -10.173 20.424 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.474 -8.698 19.993 1.00 0.00 H new ATOM 0 HD23 LEU A 127 1.183 -8.938 19.390 1.00 0.00 H new ATOM 94 N PHE A 128 2.069 -4.760 18.433 1.00 0.00 N ATOM 95 CA PHE A 128 2.213 -3.308 18.127 1.00 0.00 C ATOM 96 C PHE A 128 0.848 -2.729 17.751 1.00 0.00 C ATOM 97 O PHE A 128 0.108 -3.306 16.981 1.00 0.00 O ATOM 98 CB PHE A 128 3.186 -3.130 16.959 1.00 0.00 C ATOM 99 CG PHE A 128 4.517 -3.748 17.319 1.00 0.00 C ATOM 100 CD1 PHE A 128 5.419 -3.045 18.126 1.00 0.00 C ATOM 101 CD2 PHE A 128 4.846 -5.024 16.848 1.00 0.00 C ATOM 102 CE1 PHE A 128 6.651 -3.618 18.461 1.00 0.00 C ATOM 103 CE2 PHE A 128 6.078 -5.598 17.184 1.00 0.00 C ATOM 104 CZ PHE A 128 6.981 -4.895 17.991 1.00 0.00 C ATOM 0 H PHE A 128 1.922 -5.362 17.623 1.00 0.00 H new ATOM 0 HA PHE A 128 2.598 -2.786 19.003 1.00 0.00 H new ATOM 0 HB2 PHE A 128 2.785 -3.600 16.061 1.00 0.00 H new ATOM 0 HB3 PHE A 128 3.313 -2.071 16.734 1.00 0.00 H new ATOM 0 HD1 PHE A 128 5.164 -2.061 18.490 1.00 0.00 H new ATOM 0 HD2 PHE A 128 4.150 -5.566 16.225 1.00 0.00 H new ATOM 0 HE1 PHE A 128 7.348 -3.075 19.082 1.00 0.00 H new ATOM 0 HE2 PHE A 128 6.332 -6.583 16.821 1.00 0.00 H new ATOM 0 HZ PHE A 128 7.931 -5.337 18.251 1.00 0.00 H new ATOM 114 N GLU A 129 0.508 -1.590 18.292 1.00 0.00 N ATOM 115 CA GLU A 129 -0.810 -0.974 17.968 1.00 0.00 C ATOM 116 C GLU A 129 -0.636 0.537 17.800 1.00 0.00 C ATOM 117 O GLU A 129 0.223 1.142 18.409 1.00 0.00 O ATOM 118 CB GLU A 129 -1.801 -1.249 19.106 1.00 0.00 C ATOM 119 CG GLU A 129 -1.426 -2.550 19.819 1.00 0.00 C ATOM 120 CD GLU A 129 -2.378 -2.780 20.995 1.00 0.00 C ATOM 121 OE1 GLU A 129 -3.148 -1.883 21.292 1.00 0.00 O ATOM 122 OE2 GLU A 129 -2.320 -3.851 21.577 1.00 0.00 O ATOM 0 H GLU A 129 1.086 -1.060 18.944 1.00 0.00 H new ATOM 0 HA GLU A 129 -1.193 -1.404 17.043 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -1.794 -0.421 19.814 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -2.814 -1.320 18.709 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -1.481 -3.387 19.123 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -0.397 -2.499 20.175 1.00 0.00 H new ATOM 129 N PRO A 130 -1.472 1.156 16.952 1.00 0.00 N ATOM 130 CA PRO A 130 -1.411 2.603 16.701 1.00 0.00 C ATOM 131 C PRO A 130 -1.299 3.401 18.004 1.00 0.00 C ATOM 132 O PRO A 130 -2.068 3.213 18.926 1.00 0.00 O ATOM 133 CB PRO A 130 -2.742 2.905 16.015 1.00 0.00 C ATOM 134 CG PRO A 130 -3.656 1.823 16.476 1.00 0.00 C ATOM 135 CD PRO A 130 -2.802 0.599 16.645 1.00 0.00 C ATOM 0 HA PRO A 130 -0.540 2.879 16.107 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -3.119 3.889 16.296 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -2.639 2.901 14.930 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -4.138 2.094 17.415 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -4.449 1.647 15.749 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -3.167 -0.039 17.450 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -2.785 -0.008 15.740 1.00 0.00 H new ATOM 143 N GLY A 131 -0.345 4.287 18.086 1.00 0.00 N ATOM 144 CA GLY A 131 -0.184 5.095 19.328 1.00 0.00 C ATOM 145 C GLY A 131 0.828 4.414 20.253 1.00 0.00 C ATOM 146 O GLY A 131 1.074 4.861 21.356 1.00 0.00 O ATOM 0 H GLY A 131 0.330 4.486 17.347 1.00 0.00 H new ATOM 0 HA2 GLY A 131 0.154 6.101 19.079 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -1.144 5.198 19.834 1.00 0.00 H new ATOM 150 N GLU A 132 1.420 3.336 19.813 1.00 0.00 N ATOM 151 CA GLU A 132 2.415 2.630 20.668 1.00 0.00 C ATOM 152 C GLU A 132 3.829 3.042 20.251 1.00 0.00 C ATOM 153 O GLU A 132 4.132 3.159 19.080 1.00 0.00 O ATOM 154 CB GLU A 132 2.253 1.118 20.498 1.00 0.00 C ATOM 155 CG GLU A 132 0.882 0.690 21.023 1.00 0.00 C ATOM 156 CD GLU A 132 0.810 0.945 22.530 1.00 0.00 C ATOM 157 OE1 GLU A 132 1.857 1.133 23.129 1.00 0.00 O ATOM 158 OE2 GLU A 132 -0.290 0.952 23.058 1.00 0.00 O ATOM 0 H GLU A 132 1.257 2.915 18.899 1.00 0.00 H new ATOM 0 HA GLU A 132 2.251 2.897 21.712 1.00 0.00 H new ATOM 0 HB2 GLU A 132 2.353 0.847 19.447 1.00 0.00 H new ATOM 0 HB3 GLU A 132 3.041 0.594 21.039 1.00 0.00 H new ATOM 0 HG2 GLU A 132 0.096 1.245 20.512 1.00 0.00 H new ATOM 0 HG3 GLU A 132 0.714 -0.367 20.814 1.00 0.00 H new ATOM 165 N MET A 133 4.697 3.264 21.200 1.00 0.00 N ATOM 166 CA MET A 133 6.088 3.668 20.857 1.00 0.00 C ATOM 167 C MET A 133 6.868 2.446 20.368 1.00 0.00 C ATOM 168 O MET A 133 6.623 1.332 20.789 1.00 0.00 O ATOM 169 CB MET A 133 6.773 4.246 22.097 1.00 0.00 C ATOM 170 CG MET A 133 6.160 5.608 22.429 1.00 0.00 C ATOM 171 SD MET A 133 7.154 6.424 23.703 1.00 0.00 S ATOM 172 CE MET A 133 8.481 7.003 22.618 1.00 0.00 C ATOM 0 H MET A 133 4.502 3.183 22.198 1.00 0.00 H new ATOM 0 HA MET A 133 6.063 4.423 20.071 1.00 0.00 H new ATOM 0 HB2 MET A 133 6.655 3.566 22.941 1.00 0.00 H new ATOM 0 HB3 MET A 133 7.843 4.350 21.919 1.00 0.00 H new ATOM 0 HG2 MET A 133 6.118 6.228 21.533 1.00 0.00 H new ATOM 0 HG3 MET A 133 5.135 5.482 22.778 1.00 0.00 H new ATOM 0 HE1 MET A 133 9.440 6.646 22.994 1.00 0.00 H new ATOM 0 HE2 MET A 133 8.321 6.619 21.610 1.00 0.00 H new ATOM 0 HE3 MET A 133 8.483 8.093 22.595 1.00 0.00 H new ATOM 182 N VAL A 134 7.805 2.644 19.483 1.00 0.00 N ATOM 183 CA VAL A 134 8.601 1.493 18.968 1.00 0.00 C ATOM 184 C VAL A 134 10.076 1.889 18.894 1.00 0.00 C ATOM 185 O VAL A 134 10.447 3.000 19.217 1.00 0.00 O ATOM 186 CB VAL A 134 8.101 1.114 17.571 1.00 0.00 C ATOM 187 CG1 VAL A 134 8.525 -0.320 17.248 1.00 0.00 C ATOM 188 CG2 VAL A 134 6.575 1.217 17.530 1.00 0.00 C ATOM 0 H VAL A 134 8.055 3.553 19.093 1.00 0.00 H new ATOM 0 HA VAL A 134 8.487 0.640 19.638 1.00 0.00 H new ATOM 0 HB VAL A 134 8.531 1.794 16.835 1.00 0.00 H new ATOM 0 HG11 VAL A 134 8.169 -0.589 16.254 1.00 0.00 H new ATOM 0 HG12 VAL A 134 9.612 -0.393 17.276 1.00 0.00 H new ATOM 0 HG13 VAL A 134 8.096 -1.001 17.984 1.00 0.00 H new ATOM 0 HG21 VAL A 134 6.219 0.947 16.536 1.00 0.00 H new ATOM 0 HG22 VAL A 134 6.145 0.538 18.266 1.00 0.00 H new ATOM 0 HG23 VAL A 134 6.273 2.239 17.759 1.00 0.00 H new ATOM 198 N ARG A 135 10.924 0.991 18.473 1.00 0.00 N ATOM 199 CA ARG A 135 12.374 1.320 18.381 1.00 0.00 C ATOM 200 C ARG A 135 12.933 0.799 17.055 1.00 0.00 C ATOM 201 O ARG A 135 12.665 -0.315 16.652 1.00 0.00 O ATOM 202 CB ARG A 135 13.121 0.661 19.543 1.00 0.00 C ATOM 203 CG ARG A 135 14.578 1.126 19.541 1.00 0.00 C ATOM 204 CD ARG A 135 15.353 0.383 20.631 1.00 0.00 C ATOM 205 NE ARG A 135 16.754 0.889 20.679 1.00 0.00 N ATOM 206 CZ ARG A 135 17.406 0.898 21.809 1.00 0.00 C ATOM 207 NH1 ARG A 135 17.119 0.022 22.734 1.00 0.00 N ATOM 208 NH2 ARG A 135 18.344 1.781 22.014 1.00 0.00 N ATOM 0 H ARG A 135 10.675 0.044 18.189 1.00 0.00 H new ATOM 0 HA ARG A 135 12.505 2.401 18.431 1.00 0.00 H new ATOM 0 HB2 ARG A 135 12.646 0.921 20.489 1.00 0.00 H new ATOM 0 HB3 ARG A 135 13.074 -0.424 19.451 1.00 0.00 H new ATOM 0 HG2 ARG A 135 15.029 0.938 18.567 1.00 0.00 H new ATOM 0 HG3 ARG A 135 14.628 2.201 19.713 1.00 0.00 H new ATOM 0 HD2 ARG A 135 14.870 0.527 21.598 1.00 0.00 H new ATOM 0 HD3 ARG A 135 15.349 -0.688 20.429 1.00 0.00 H new ATOM 0 HE ARG A 135 17.203 1.228 19.828 1.00 0.00 H new ATOM 0 HH11 ARG A 135 16.386 -0.668 22.573 1.00 0.00 H new ATOM 0 HH12 ARG A 135 17.628 0.028 23.618 1.00 0.00 H new ATOM 0 HH21 ARG A 135 18.568 2.465 21.291 1.00 0.00 H new ATOM 0 HH22 ARG A 135 18.854 1.788 22.898 1.00 0.00 H new ATOM 222 N VAL A 136 13.708 1.598 16.374 1.00 0.00 N ATOM 223 CA VAL A 136 14.283 1.148 15.076 1.00 0.00 C ATOM 224 C VAL A 136 15.785 0.903 15.240 1.00 0.00 C ATOM 225 O VAL A 136 16.490 1.688 15.842 1.00 0.00 O ATOM 226 CB VAL A 136 14.056 2.228 14.016 1.00 0.00 C ATOM 227 CG1 VAL A 136 14.666 1.776 12.687 1.00 0.00 C ATOM 228 CG2 VAL A 136 12.555 2.459 13.836 1.00 0.00 C ATOM 0 H VAL A 136 13.967 2.542 16.660 1.00 0.00 H new ATOM 0 HA VAL A 136 13.796 0.224 14.764 1.00 0.00 H new ATOM 0 HB VAL A 136 14.530 3.156 14.336 1.00 0.00 H new ATOM 0 HG11 VAL A 136 14.504 2.545 11.932 1.00 0.00 H new ATOM 0 HG12 VAL A 136 15.736 1.612 12.815 1.00 0.00 H new ATOM 0 HG13 VAL A 136 14.193 0.848 12.366 1.00 0.00 H new ATOM 0 HG21 VAL A 136 12.393 3.228 13.081 1.00 0.00 H new ATOM 0 HG22 VAL A 136 12.080 1.531 13.517 1.00 0.00 H new ATOM 0 HG23 VAL A 136 12.121 2.782 14.782 1.00 0.00 H new ATOM 238 N ASN A 137 16.280 -0.181 14.708 1.00 0.00 N ATOM 239 CA ASN A 137 17.735 -0.476 14.833 1.00 0.00 C ATOM 240 C ASN A 137 18.297 -0.856 13.462 1.00 0.00 C ATOM 241 O ASN A 137 19.348 -1.458 13.357 1.00 0.00 O ATOM 242 CB ASN A 137 17.938 -1.637 15.808 1.00 0.00 C ATOM 243 CG ASN A 137 17.202 -2.874 15.289 1.00 0.00 C ATOM 244 OD1 ASN A 137 17.101 -3.078 14.096 1.00 0.00 O ATOM 245 ND2 ASN A 137 16.681 -3.712 16.142 1.00 0.00 N ATOM 0 H ASN A 137 15.739 -0.875 14.192 1.00 0.00 H new ATOM 0 HA ASN A 137 18.254 0.406 15.207 1.00 0.00 H new ATOM 0 HB2 ASN A 137 19.001 -1.852 15.917 1.00 0.00 H new ATOM 0 HB3 ASN A 137 17.564 -1.366 16.796 1.00 0.00 H new ATOM 0 HD21 ASN A 137 16.188 -4.540 15.807 1.00 0.00 H new ATOM 0 HD22 ASN A 137 16.767 -3.539 17.144 1.00 0.00 H new ATOM 252 N ASP A 138 17.606 -0.510 12.411 1.00 0.00 N ATOM 253 CA ASP A 138 18.101 -0.853 11.048 1.00 0.00 C ATOM 254 C ASP A 138 18.012 0.382 10.149 1.00 0.00 C ATOM 255 O ASP A 138 17.099 1.176 10.256 1.00 0.00 O ATOM 256 CB ASP A 138 17.241 -1.975 10.461 1.00 0.00 C ATOM 257 CG ASP A 138 17.843 -2.435 9.131 1.00 0.00 C ATOM 258 OD1 ASP A 138 18.911 -1.956 8.790 1.00 0.00 O ATOM 259 OD2 ASP A 138 17.224 -3.259 8.478 1.00 0.00 O ATOM 0 H ASP A 138 16.720 -0.005 12.437 1.00 0.00 H new ATOM 0 HA ASP A 138 19.138 -1.184 11.109 1.00 0.00 H new ATOM 0 HB2 ASP A 138 17.190 -2.811 11.158 1.00 0.00 H new ATOM 0 HB3 ASP A 138 16.220 -1.624 10.309 1.00 0.00 H new ATOM 264 N GLY A 139 18.956 0.552 9.263 1.00 0.00 N ATOM 265 CA GLY A 139 18.925 1.735 8.358 1.00 0.00 C ATOM 266 C GLY A 139 19.257 2.996 9.158 1.00 0.00 C ATOM 267 O GLY A 139 19.425 2.954 10.361 1.00 0.00 O ATOM 0 H GLY A 139 19.747 -0.078 9.127 1.00 0.00 H new ATOM 0 HA2 GLY A 139 19.643 1.606 7.548 1.00 0.00 H new ATOM 0 HA3 GLY A 139 17.941 1.830 7.900 1.00 0.00 H new ATOM 271 N PRO A 140 19.352 4.143 8.469 1.00 0.00 N ATOM 272 CA PRO A 140 19.666 5.427 9.109 1.00 0.00 C ATOM 273 C PRO A 140 18.721 5.726 10.277 1.00 0.00 C ATOM 274 O PRO A 140 19.015 6.533 11.135 1.00 0.00 O ATOM 275 CB PRO A 140 19.451 6.446 7.990 1.00 0.00 C ATOM 276 CG PRO A 140 18.482 5.790 7.065 1.00 0.00 C ATOM 277 CD PRO A 140 18.773 4.318 7.126 1.00 0.00 C ATOM 0 HA PRO A 140 20.672 5.440 9.529 1.00 0.00 H new ATOM 0 HB2 PRO A 140 19.055 7.384 8.379 1.00 0.00 H new ATOM 0 HB3 PRO A 140 20.387 6.681 7.483 1.00 0.00 H new ATOM 0 HG2 PRO A 140 17.455 5.996 7.367 1.00 0.00 H new ATOM 0 HG3 PRO A 140 18.597 6.168 6.049 1.00 0.00 H new ATOM 0 HD2 PRO A 140 17.869 3.723 6.997 1.00 0.00 H new ATOM 0 HD3 PRO A 140 19.469 4.013 6.345 1.00 0.00 H new ATOM 285 N PHE A 141 17.587 5.080 10.314 1.00 0.00 N ATOM 286 CA PHE A 141 16.625 5.328 11.425 1.00 0.00 C ATOM 287 C PHE A 141 16.941 4.388 12.591 1.00 0.00 C ATOM 288 O PHE A 141 16.162 4.244 13.513 1.00 0.00 O ATOM 289 CB PHE A 141 15.200 5.068 10.932 1.00 0.00 C ATOM 290 CG PHE A 141 14.903 5.972 9.759 1.00 0.00 C ATOM 291 CD1 PHE A 141 14.456 7.280 9.978 1.00 0.00 C ATOM 292 CD2 PHE A 141 15.076 5.501 8.452 1.00 0.00 C ATOM 293 CE1 PHE A 141 14.181 8.118 8.890 1.00 0.00 C ATOM 294 CE2 PHE A 141 14.801 6.338 7.364 1.00 0.00 C ATOM 295 CZ PHE A 141 14.354 7.647 7.583 1.00 0.00 C ATOM 0 H PHE A 141 17.286 4.392 9.624 1.00 0.00 H new ATOM 0 HA PHE A 141 16.711 6.362 11.758 1.00 0.00 H new ATOM 0 HB2 PHE A 141 15.090 4.024 10.638 1.00 0.00 H new ATOM 0 HB3 PHE A 141 14.486 5.250 11.736 1.00 0.00 H new ATOM 0 HD1 PHE A 141 14.323 7.643 10.986 1.00 0.00 H new ATOM 0 HD2 PHE A 141 15.422 4.492 8.283 1.00 0.00 H new ATOM 0 HE1 PHE A 141 13.836 9.127 9.059 1.00 0.00 H new ATOM 0 HE2 PHE A 141 14.934 5.974 6.356 1.00 0.00 H new ATOM 0 HZ PHE A 141 14.143 8.293 6.744 1.00 0.00 H new ATOM 305 N ALA A 142 18.077 3.748 12.558 1.00 0.00 N ATOM 306 CA ALA A 142 18.441 2.819 13.665 1.00 0.00 C ATOM 307 C ALA A 142 18.781 3.629 14.917 1.00 0.00 C ATOM 308 O ALA A 142 19.250 4.747 14.837 1.00 0.00 O ATOM 309 CB ALA A 142 19.655 1.985 13.251 1.00 0.00 C ATOM 0 H ALA A 142 18.769 3.828 11.813 1.00 0.00 H new ATOM 0 HA ALA A 142 17.601 2.157 13.877 1.00 0.00 H new ATOM 0 HB1 ALA A 142 19.922 1.305 14.060 1.00 0.00 H new ATOM 0 HB2 ALA A 142 19.413 1.409 12.358 1.00 0.00 H new ATOM 0 HB3 ALA A 142 20.496 2.646 13.040 1.00 0.00 H new ATOM 315 N ASP A 143 18.549 3.075 16.076 1.00 0.00 N ATOM 316 CA ASP A 143 18.860 3.814 17.330 1.00 0.00 C ATOM 317 C ASP A 143 17.986 5.067 17.413 1.00 0.00 C ATOM 318 O ASP A 143 18.464 6.154 17.669 1.00 0.00 O ATOM 319 CB ASP A 143 20.335 4.222 17.332 1.00 0.00 C ATOM 320 CG ASP A 143 21.205 2.984 17.106 1.00 0.00 C ATOM 321 OD1 ASP A 143 20.705 1.888 17.296 1.00 0.00 O ATOM 322 OD2 ASP A 143 22.360 3.153 16.748 1.00 0.00 O ATOM 0 H ASP A 143 18.157 2.142 16.207 1.00 0.00 H new ATOM 0 HA ASP A 143 18.660 3.172 18.188 1.00 0.00 H new ATOM 0 HB2 ASP A 143 20.521 4.958 16.550 1.00 0.00 H new ATOM 0 HB3 ASP A 143 20.592 4.693 18.281 1.00 0.00 H new ATOM 327 N PHE A 144 16.706 4.926 17.197 1.00 0.00 N ATOM 328 CA PHE A 144 15.805 6.110 17.263 1.00 0.00 C ATOM 329 C PHE A 144 14.450 5.690 17.835 1.00 0.00 C ATOM 330 O PHE A 144 13.958 4.612 17.566 1.00 0.00 O ATOM 331 CB PHE A 144 15.609 6.681 15.856 1.00 0.00 C ATOM 332 CG PHE A 144 16.818 7.500 15.474 1.00 0.00 C ATOM 333 CD1 PHE A 144 16.997 8.779 16.014 1.00 0.00 C ATOM 334 CD2 PHE A 144 17.763 6.980 14.581 1.00 0.00 C ATOM 335 CE1 PHE A 144 18.118 9.539 15.661 1.00 0.00 C ATOM 336 CE2 PHE A 144 18.885 7.740 14.227 1.00 0.00 C ATOM 337 CZ PHE A 144 19.063 9.019 14.767 1.00 0.00 C ATOM 0 H PHE A 144 16.246 4.042 16.978 1.00 0.00 H new ATOM 0 HA PHE A 144 16.251 6.869 17.905 1.00 0.00 H new ATOM 0 HB2 PHE A 144 15.463 5.872 15.140 1.00 0.00 H new ATOM 0 HB3 PHE A 144 14.712 7.300 15.824 1.00 0.00 H new ATOM 0 HD1 PHE A 144 16.269 9.180 16.704 1.00 0.00 H new ATOM 0 HD2 PHE A 144 17.627 5.993 14.165 1.00 0.00 H new ATOM 0 HE1 PHE A 144 18.254 10.526 16.078 1.00 0.00 H new ATOM 0 HE2 PHE A 144 19.613 7.339 13.537 1.00 0.00 H new ATOM 0 HZ PHE A 144 19.928 9.605 14.495 1.00 0.00 H new ATOM 347 N ASN A 145 13.842 6.534 18.624 1.00 0.00 N ATOM 348 CA ASN A 145 12.519 6.183 19.213 1.00 0.00 C ATOM 349 C ASN A 145 11.403 6.777 18.352 1.00 0.00 C ATOM 350 O ASN A 145 11.538 7.849 17.795 1.00 0.00 O ATOM 351 CB ASN A 145 12.425 6.752 20.631 1.00 0.00 C ATOM 352 CG ASN A 145 13.561 6.185 21.485 1.00 0.00 C ATOM 353 OD1 ASN A 145 14.030 5.090 21.244 1.00 0.00 O ATOM 354 ND2 ASN A 145 14.027 6.890 22.479 1.00 0.00 N ATOM 0 H ASN A 145 14.204 7.451 18.886 1.00 0.00 H new ATOM 0 HA ASN A 145 12.414 5.099 19.248 1.00 0.00 H new ATOM 0 HB2 ASN A 145 12.485 7.840 20.602 1.00 0.00 H new ATOM 0 HB3 ASN A 145 11.462 6.498 21.073 1.00 0.00 H new ATOM 0 HD21 ASN A 145 14.785 6.522 23.054 1.00 0.00 H new ATOM 0 HD22 ASN A 145 13.633 7.809 22.681 1.00 0.00 H new ATOM 361 N GLY A 146 10.300 6.089 18.237 1.00 0.00 N ATOM 362 CA GLY A 146 9.177 6.614 17.411 1.00 0.00 C ATOM 363 C GLY A 146 7.884 5.890 17.793 1.00 0.00 C ATOM 364 O GLY A 146 7.868 5.051 18.672 1.00 0.00 O ATOM 0 H GLY A 146 10.128 5.186 18.679 1.00 0.00 H new ATOM 0 HA2 GLY A 146 9.066 7.687 17.568 1.00 0.00 H new ATOM 0 HA3 GLY A 146 9.390 6.467 16.352 1.00 0.00 H new ATOM 368 N VAL A 147 6.800 6.207 17.140 1.00 0.00 N ATOM 369 CA VAL A 147 5.511 5.534 17.469 1.00 0.00 C ATOM 370 C VAL A 147 4.911 4.935 16.196 1.00 0.00 C ATOM 371 O VAL A 147 5.066 5.466 15.114 1.00 0.00 O ATOM 372 CB VAL A 147 4.538 6.556 18.060 1.00 0.00 C ATOM 373 CG1 VAL A 147 3.259 5.843 18.507 1.00 0.00 C ATOM 374 CG2 VAL A 147 5.187 7.240 19.264 1.00 0.00 C ATOM 0 H VAL A 147 6.751 6.901 16.394 1.00 0.00 H new ATOM 0 HA VAL A 147 5.689 4.741 18.195 1.00 0.00 H new ATOM 0 HB VAL A 147 4.293 7.303 17.305 1.00 0.00 H new ATOM 0 HG11 VAL A 147 2.565 6.570 18.928 1.00 0.00 H new ATOM 0 HG12 VAL A 147 2.796 5.354 17.650 1.00 0.00 H new ATOM 0 HG13 VAL A 147 3.504 5.096 19.262 1.00 0.00 H new ATOM 0 HG21 VAL A 147 4.494 7.968 19.686 1.00 0.00 H new ATOM 0 HG22 VAL A 147 5.432 6.493 20.019 1.00 0.00 H new ATOM 0 HG23 VAL A 147 6.098 7.747 18.947 1.00 0.00 H new ATOM 384 N VAL A 148 4.224 3.832 16.315 1.00 0.00 N ATOM 385 CA VAL A 148 3.615 3.199 15.111 1.00 0.00 C ATOM 386 C VAL A 148 2.279 3.877 14.799 1.00 0.00 C ATOM 387 O VAL A 148 1.267 3.582 15.403 1.00 0.00 O ATOM 388 CB VAL A 148 3.381 1.712 15.381 1.00 0.00 C ATOM 389 CG1 VAL A 148 2.677 1.542 16.730 1.00 0.00 C ATOM 390 CG2 VAL A 148 2.506 1.123 14.271 1.00 0.00 C ATOM 0 H VAL A 148 4.058 3.342 17.194 1.00 0.00 H new ATOM 0 HA VAL A 148 4.288 3.313 14.261 1.00 0.00 H new ATOM 0 HB VAL A 148 4.339 1.192 15.403 1.00 0.00 H new ATOM 0 HG11 VAL A 148 2.510 0.482 16.922 1.00 0.00 H new ATOM 0 HG12 VAL A 148 3.300 1.961 17.521 1.00 0.00 H new ATOM 0 HG13 VAL A 148 1.719 2.062 16.709 1.00 0.00 H new ATOM 0 HG21 VAL A 148 2.339 0.063 14.463 1.00 0.00 H new ATOM 0 HG22 VAL A 148 1.548 1.643 14.248 1.00 0.00 H new ATOM 0 HG23 VAL A 148 3.007 1.243 13.310 1.00 0.00 H new ATOM 400 N GLU A 149 2.267 4.783 13.860 1.00 0.00 N ATOM 401 CA GLU A 149 0.995 5.476 13.512 1.00 0.00 C ATOM 402 C GLU A 149 0.022 4.471 12.893 1.00 0.00 C ATOM 403 O GLU A 149 -1.175 4.556 13.078 1.00 0.00 O ATOM 404 CB GLU A 149 1.281 6.594 12.507 1.00 0.00 C ATOM 405 CG GLU A 149 2.198 7.637 13.151 1.00 0.00 C ATOM 406 CD GLU A 149 2.387 8.812 12.191 1.00 0.00 C ATOM 407 OE1 GLU A 149 1.995 8.684 11.043 1.00 0.00 O ATOM 408 OE2 GLU A 149 2.921 9.822 12.620 1.00 0.00 O ATOM 0 H GLU A 149 3.082 5.073 13.320 1.00 0.00 H new ATOM 0 HA GLU A 149 0.554 5.902 14.413 1.00 0.00 H new ATOM 0 HB2 GLU A 149 1.751 6.183 11.614 1.00 0.00 H new ATOM 0 HB3 GLU A 149 0.348 7.060 12.190 1.00 0.00 H new ATOM 0 HG2 GLU A 149 1.767 7.986 14.089 1.00 0.00 H new ATOM 0 HG3 GLU A 149 3.163 7.190 13.390 1.00 0.00 H new ATOM 415 N GLU A 150 0.528 3.518 12.159 1.00 0.00 N ATOM 416 CA GLU A 150 -0.367 2.507 11.528 1.00 0.00 C ATOM 417 C GLU A 150 0.356 1.161 11.460 1.00 0.00 C ATOM 418 O GLU A 150 1.564 1.088 11.579 1.00 0.00 O ATOM 419 CB GLU A 150 -0.734 2.961 10.113 1.00 0.00 C ATOM 420 CG GLU A 150 -1.453 4.311 10.182 1.00 0.00 C ATOM 421 CD GLU A 150 -2.767 4.150 10.949 1.00 0.00 C ATOM 422 OE1 GLU A 150 -3.193 3.021 11.124 1.00 0.00 O ATOM 423 OE2 GLU A 150 -3.325 5.160 11.347 1.00 0.00 O ATOM 0 H GLU A 150 1.523 3.396 11.969 1.00 0.00 H new ATOM 0 HA GLU A 150 -1.275 2.404 12.122 1.00 0.00 H new ATOM 0 HB2 GLU A 150 0.165 3.046 9.502 1.00 0.00 H new ATOM 0 HB3 GLU A 150 -1.375 2.219 9.636 1.00 0.00 H new ATOM 0 HG2 GLU A 150 -0.819 5.048 10.676 1.00 0.00 H new ATOM 0 HG3 GLU A 150 -1.650 4.682 9.176 1.00 0.00 H new ATOM 430 N VAL A 151 -0.370 0.094 11.269 1.00 0.00 N ATOM 431 CA VAL A 151 0.278 -1.245 11.195 1.00 0.00 C ATOM 432 C VAL A 151 -0.197 -1.973 9.936 1.00 0.00 C ATOM 433 O VAL A 151 -1.323 -1.818 9.505 1.00 0.00 O ATOM 434 CB VAL A 151 -0.099 -2.064 12.431 1.00 0.00 C ATOM 435 CG1 VAL A 151 0.658 -3.394 12.411 1.00 0.00 C ATOM 436 CG2 VAL A 151 0.274 -1.284 13.693 1.00 0.00 C ATOM 0 H VAL A 151 -1.384 0.092 11.161 1.00 0.00 H new ATOM 0 HA VAL A 151 1.360 -1.123 11.157 1.00 0.00 H new ATOM 0 HB VAL A 151 -1.172 -2.256 12.427 1.00 0.00 H new ATOM 0 HG11 VAL A 151 0.390 -3.978 13.291 1.00 0.00 H new ATOM 0 HG12 VAL A 151 0.393 -3.950 11.512 1.00 0.00 H new ATOM 0 HG13 VAL A 151 1.731 -3.202 12.416 1.00 0.00 H new ATOM 0 HG21 VAL A 151 0.006 -1.867 14.574 1.00 0.00 H new ATOM 0 HG22 VAL A 151 1.347 -1.092 13.698 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -0.264 -0.336 13.707 1.00 0.00 H new ATOM 446 N ASP A 152 0.651 -2.768 9.342 1.00 0.00 N ATOM 447 CA ASP A 152 0.246 -3.505 8.113 1.00 0.00 C ATOM 448 C ASP A 152 0.540 -4.996 8.291 1.00 0.00 C ATOM 449 O ASP A 152 1.646 -5.450 8.078 1.00 0.00 O ATOM 450 CB ASP A 152 1.033 -2.970 6.914 1.00 0.00 C ATOM 451 CG ASP A 152 0.592 -1.536 6.613 1.00 0.00 C ATOM 452 OD1 ASP A 152 -0.425 -1.125 7.148 1.00 0.00 O ATOM 453 OD2 ASP A 152 1.278 -0.874 5.852 1.00 0.00 O ATOM 0 H ASP A 152 1.607 -2.938 9.655 1.00 0.00 H new ATOM 0 HA ASP A 152 -0.821 -3.363 7.940 1.00 0.00 H new ATOM 0 HB2 ASP A 152 2.102 -2.996 7.126 1.00 0.00 H new ATOM 0 HB3 ASP A 152 0.865 -3.604 6.043 1.00 0.00 H new ATOM 458 N TYR A 153 -0.444 -5.761 8.681 1.00 0.00 N ATOM 459 CA TYR A 153 -0.220 -7.221 8.874 1.00 0.00 C ATOM 460 C TYR A 153 0.081 -7.874 7.523 1.00 0.00 C ATOM 461 O TYR A 153 0.933 -8.733 7.414 1.00 0.00 O ATOM 462 CB TYR A 153 -1.475 -7.853 9.478 1.00 0.00 C ATOM 463 CG TYR A 153 -1.716 -7.279 10.853 1.00 0.00 C ATOM 464 CD1 TYR A 153 -0.990 -7.761 11.950 1.00 0.00 C ATOM 465 CD2 TYR A 153 -2.665 -6.266 11.033 1.00 0.00 C ATOM 466 CE1 TYR A 153 -1.213 -7.227 13.225 1.00 0.00 C ATOM 467 CE2 TYR A 153 -2.888 -5.733 12.308 1.00 0.00 C ATOM 468 CZ TYR A 153 -2.162 -6.214 13.405 1.00 0.00 C ATOM 469 OH TYR A 153 -2.382 -5.690 14.662 1.00 0.00 O ATOM 0 H TYR A 153 -1.392 -5.438 8.874 1.00 0.00 H new ATOM 0 HA TYR A 153 0.624 -7.374 9.547 1.00 0.00 H new ATOM 0 HB2 TYR A 153 -2.336 -7.662 8.837 1.00 0.00 H new ATOM 0 HB3 TYR A 153 -1.357 -8.935 9.540 1.00 0.00 H new ATOM 0 HD1 TYR A 153 -0.259 -8.544 11.812 1.00 0.00 H new ATOM 0 HD2 TYR A 153 -3.226 -5.895 10.188 1.00 0.00 H new ATOM 0 HE1 TYR A 153 -0.652 -7.597 14.070 1.00 0.00 H new ATOM 0 HE2 TYR A 153 -3.620 -4.951 12.446 1.00 0.00 H new ATOM 0 HH TYR A 153 -3.072 -4.996 14.611 1.00 0.00 H new ATOM 479 N GLU A 154 -0.610 -7.473 6.492 1.00 0.00 N ATOM 480 CA GLU A 154 -0.363 -8.071 5.150 1.00 0.00 C ATOM 481 C GLU A 154 1.073 -7.770 4.715 1.00 0.00 C ATOM 482 O GLU A 154 1.760 -8.619 4.182 1.00 0.00 O ATOM 483 CB GLU A 154 -1.339 -7.470 4.137 1.00 0.00 C ATOM 484 CG GLU A 154 -2.773 -7.819 4.542 1.00 0.00 C ATOM 485 CD GLU A 154 -3.748 -7.235 3.517 1.00 0.00 C ATOM 486 OE1 GLU A 154 -3.306 -6.470 2.676 1.00 0.00 O ATOM 487 OE2 GLU A 154 -4.921 -7.563 3.591 1.00 0.00 O ATOM 0 H GLU A 154 -1.335 -6.757 6.521 1.00 0.00 H new ATOM 0 HA GLU A 154 -0.509 -9.150 5.200 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -1.215 -6.388 4.094 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -1.127 -7.855 3.139 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -2.893 -8.901 4.599 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -2.989 -7.421 5.534 1.00 0.00 H new ATOM 494 N LYS A 155 1.532 -6.570 4.939 1.00 0.00 N ATOM 495 CA LYS A 155 2.924 -6.218 4.538 1.00 0.00 C ATOM 496 C LYS A 155 3.900 -6.661 5.632 1.00 0.00 C ATOM 497 O LYS A 155 5.093 -6.463 5.527 1.00 0.00 O ATOM 498 CB LYS A 155 3.030 -4.704 4.343 1.00 0.00 C ATOM 499 CG LYS A 155 2.099 -4.269 3.210 1.00 0.00 C ATOM 500 CD LYS A 155 2.291 -2.776 2.935 1.00 0.00 C ATOM 501 CE LYS A 155 1.218 -2.295 1.956 1.00 0.00 C ATOM 502 NZ LYS A 155 0.830 -0.897 2.295 1.00 0.00 N ATOM 0 H LYS A 155 1.004 -5.818 5.382 1.00 0.00 H new ATOM 0 HA LYS A 155 3.172 -6.724 3.605 1.00 0.00 H new ATOM 0 HB2 LYS A 155 2.763 -4.188 5.265 1.00 0.00 H new ATOM 0 HB3 LYS A 155 4.058 -4.428 4.109 1.00 0.00 H new ATOM 0 HG2 LYS A 155 2.311 -4.845 2.310 1.00 0.00 H new ATOM 0 HG3 LYS A 155 1.062 -4.469 3.480 1.00 0.00 H new ATOM 0 HD2 LYS A 155 2.228 -2.213 3.866 1.00 0.00 H new ATOM 0 HD3 LYS A 155 3.283 -2.596 2.521 1.00 0.00 H new ATOM 0 HE2 LYS A 155 1.595 -2.342 0.934 1.00 0.00 H new ATOM 0 HE3 LYS A 155 0.347 -2.948 2.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 0.101 -0.568 1.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 0.454 -0.866 3.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 1.664 -0.279 2.227 1.00 0.00 H new ATOM 516 N SER A 156 3.403 -7.259 6.681 1.00 0.00 N ATOM 517 CA SER A 156 4.305 -7.712 7.776 1.00 0.00 C ATOM 518 C SER A 156 5.300 -6.598 8.111 1.00 0.00 C ATOM 519 O SER A 156 6.499 -6.787 8.057 1.00 0.00 O ATOM 520 CB SER A 156 5.068 -8.960 7.325 1.00 0.00 C ATOM 521 OG SER A 156 5.674 -8.714 6.064 1.00 0.00 O ATOM 0 H SER A 156 2.412 -7.453 6.826 1.00 0.00 H new ATOM 0 HA SER A 156 3.713 -7.948 8.660 1.00 0.00 H new ATOM 0 HB2 SER A 156 5.828 -9.220 8.061 1.00 0.00 H new ATOM 0 HB3 SER A 156 4.388 -9.809 7.254 1.00 0.00 H new ATOM 0 HG SER A 156 5.915 -7.767 5.996 1.00 0.00 H new ATOM 527 N ARG A 157 4.812 -5.439 8.458 1.00 0.00 N ATOM 528 CA ARG A 157 5.730 -4.315 8.797 1.00 0.00 C ATOM 529 C ARG A 157 5.011 -3.328 9.716 1.00 0.00 C ATOM 530 O ARG A 157 3.804 -3.363 9.859 1.00 0.00 O ATOM 531 CB ARG A 157 6.157 -3.600 7.513 1.00 0.00 C ATOM 532 CG ARG A 157 7.255 -4.409 6.821 1.00 0.00 C ATOM 533 CD ARG A 157 7.853 -3.585 5.680 1.00 0.00 C ATOM 534 NE ARG A 157 8.518 -4.495 4.704 1.00 0.00 N ATOM 535 CZ ARG A 157 9.703 -4.203 4.242 1.00 0.00 C ATOM 536 NH1 ARG A 157 10.605 -3.693 5.036 1.00 0.00 N ATOM 537 NH2 ARG A 157 9.986 -4.420 2.987 1.00 0.00 N ATOM 0 H ARG A 157 3.817 -5.222 8.521 1.00 0.00 H new ATOM 0 HA ARG A 157 6.611 -4.707 9.305 1.00 0.00 H new ATOM 0 HB2 ARG A 157 5.302 -3.483 6.847 1.00 0.00 H new ATOM 0 HB3 ARG A 157 6.519 -2.599 7.745 1.00 0.00 H new ATOM 0 HG2 ARG A 157 8.032 -4.675 7.538 1.00 0.00 H new ATOM 0 HG3 ARG A 157 6.845 -5.342 6.434 1.00 0.00 H new ATOM 0 HD2 ARG A 157 7.071 -3.011 5.183 1.00 0.00 H new ATOM 0 HD3 ARG A 157 8.573 -2.868 6.074 1.00 0.00 H new ATOM 0 HE ARG A 157 8.047 -5.346 4.397 1.00 0.00 H new ATOM 0 HH11 ARG A 157 10.383 -3.523 6.017 1.00 0.00 H new ATOM 0 HH12 ARG A 157 11.531 -3.465 4.675 1.00 0.00 H new ATOM 0 HH21 ARG A 157 9.281 -4.818 2.367 1.00 0.00 H new ATOM 0 HH22 ARG A 157 10.912 -4.192 2.626 1.00 0.00 H new ATOM 551 N LEU A 158 5.741 -2.446 10.341 1.00 0.00 N ATOM 552 CA LEU A 158 5.097 -1.457 11.251 1.00 0.00 C ATOM 553 C LEU A 158 5.265 -0.050 10.675 1.00 0.00 C ATOM 554 O LEU A 158 6.320 0.313 10.196 1.00 0.00 O ATOM 555 CB LEU A 158 5.756 -1.522 12.632 1.00 0.00 C ATOM 556 CG LEU A 158 5.586 -2.925 13.209 1.00 0.00 C ATOM 557 CD1 LEU A 158 6.501 -3.889 12.456 1.00 0.00 C ATOM 558 CD2 LEU A 158 5.960 -2.918 14.693 1.00 0.00 C ATOM 0 H LEU A 158 6.755 -2.367 10.261 1.00 0.00 H new ATOM 0 HA LEU A 158 4.036 -1.690 11.344 1.00 0.00 H new ATOM 0 HB2 LEU A 158 6.815 -1.275 12.554 1.00 0.00 H new ATOM 0 HB3 LEU A 158 5.305 -0.786 13.297 1.00 0.00 H new ATOM 0 HG LEU A 158 4.549 -3.243 13.102 1.00 0.00 H new ATOM 0 HD11 LEU A 158 6.385 -4.894 12.863 1.00 0.00 H new ATOM 0 HD12 LEU A 158 6.235 -3.893 11.399 1.00 0.00 H new ATOM 0 HD13 LEU A 158 7.537 -3.570 12.568 1.00 0.00 H new ATOM 0 HD21 LEU A 158 5.838 -3.920 15.104 1.00 0.00 H new ATOM 0 HD22 LEU A 158 6.998 -2.604 14.805 1.00 0.00 H new ATOM 0 HD23 LEU A 158 5.311 -2.225 15.229 1.00 0.00 H new ATOM 570 N LYS A 159 4.233 0.748 10.720 1.00 0.00 N ATOM 571 CA LYS A 159 4.339 2.132 10.176 1.00 0.00 C ATOM 572 C LYS A 159 4.728 3.091 11.303 1.00 0.00 C ATOM 573 O LYS A 159 3.887 3.576 12.035 1.00 0.00 O ATOM 574 CB LYS A 159 2.994 2.555 9.585 1.00 0.00 C ATOM 575 CG LYS A 159 3.163 3.876 8.833 1.00 0.00 C ATOM 576 CD LYS A 159 1.795 4.381 8.373 1.00 0.00 C ATOM 577 CE LYS A 159 1.977 5.633 7.512 1.00 0.00 C ATOM 578 NZ LYS A 159 2.326 5.233 6.119 1.00 0.00 N ATOM 0 H LYS A 159 3.323 0.502 11.109 1.00 0.00 H new ATOM 0 HA LYS A 159 5.099 2.159 9.396 1.00 0.00 H new ATOM 0 HB2 LYS A 159 2.622 1.784 8.910 1.00 0.00 H new ATOM 0 HB3 LYS A 159 2.255 2.667 10.378 1.00 0.00 H new ATOM 0 HG2 LYS A 159 3.637 4.616 9.478 1.00 0.00 H new ATOM 0 HG3 LYS A 159 3.818 3.736 7.973 1.00 0.00 H new ATOM 0 HD2 LYS A 159 1.282 3.606 7.803 1.00 0.00 H new ATOM 0 HD3 LYS A 159 1.170 4.608 9.237 1.00 0.00 H new ATOM 0 HE2 LYS A 159 1.061 6.224 7.513 1.00 0.00 H new ATOM 0 HE3 LYS A 159 2.763 6.262 7.929 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 2.948 5.952 5.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 2.817 4.316 6.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 1.457 5.152 5.553 1.00 0.00 H new ATOM 592 N VAL A 160 5.994 3.367 11.450 1.00 0.00 N ATOM 593 CA VAL A 160 6.432 4.293 12.532 1.00 0.00 C ATOM 594 C VAL A 160 7.192 5.472 11.922 1.00 0.00 C ATOM 595 O VAL A 160 7.888 5.332 10.936 1.00 0.00 O ATOM 596 CB VAL A 160 7.349 3.545 13.503 1.00 0.00 C ATOM 597 CG1 VAL A 160 7.724 4.469 14.663 1.00 0.00 C ATOM 598 CG2 VAL A 160 6.622 2.314 14.046 1.00 0.00 C ATOM 0 H VAL A 160 6.744 2.992 10.869 1.00 0.00 H new ATOM 0 HA VAL A 160 5.557 4.663 13.067 1.00 0.00 H new ATOM 0 HB VAL A 160 8.253 3.231 12.981 1.00 0.00 H new ATOM 0 HG11 VAL A 160 8.377 3.937 15.355 1.00 0.00 H new ATOM 0 HG12 VAL A 160 8.242 5.346 14.276 1.00 0.00 H new ATOM 0 HG13 VAL A 160 6.820 4.783 15.185 1.00 0.00 H new ATOM 0 HG21 VAL A 160 7.275 1.781 14.737 1.00 0.00 H new ATOM 0 HG22 VAL A 160 5.718 2.626 14.568 1.00 0.00 H new ATOM 0 HG23 VAL A 160 6.354 1.656 13.220 1.00 0.00 H new ATOM 608 N SER A 161 7.065 6.634 12.504 1.00 0.00 N ATOM 609 CA SER A 161 7.782 7.821 11.960 1.00 0.00 C ATOM 610 C SER A 161 8.868 8.251 12.947 1.00 0.00 C ATOM 611 O SER A 161 8.682 8.207 14.147 1.00 0.00 O ATOM 612 CB SER A 161 6.790 8.969 11.760 1.00 0.00 C ATOM 613 OG SER A 161 7.449 10.060 11.133 1.00 0.00 O ATOM 0 H SER A 161 6.496 6.812 13.332 1.00 0.00 H new ATOM 0 HA SER A 161 8.238 7.566 11.003 1.00 0.00 H new ATOM 0 HB2 SER A 161 5.951 8.637 11.148 1.00 0.00 H new ATOM 0 HB3 SER A 161 6.380 9.281 12.721 1.00 0.00 H new ATOM 0 HG SER A 161 6.787 10.728 10.859 1.00 0.00 H new ATOM 619 N VAL A 162 10.004 8.664 12.455 1.00 0.00 N ATOM 620 CA VAL A 162 11.099 9.092 13.369 1.00 0.00 C ATOM 621 C VAL A 162 11.344 10.593 13.207 1.00 0.00 C ATOM 622 O VAL A 162 11.478 11.094 12.109 1.00 0.00 O ATOM 623 CB VAL A 162 12.380 8.328 13.025 1.00 0.00 C ATOM 624 CG1 VAL A 162 13.416 8.546 14.129 1.00 0.00 C ATOM 625 CG2 VAL A 162 12.067 6.835 12.906 1.00 0.00 C ATOM 0 H VAL A 162 10.221 8.723 11.460 1.00 0.00 H new ATOM 0 HA VAL A 162 10.813 8.879 14.399 1.00 0.00 H new ATOM 0 HB VAL A 162 12.777 8.692 12.078 1.00 0.00 H new ATOM 0 HG11 VAL A 162 14.328 8.002 13.884 1.00 0.00 H new ATOM 0 HG12 VAL A 162 13.639 9.610 14.214 1.00 0.00 H new ATOM 0 HG13 VAL A 162 13.020 8.182 15.077 1.00 0.00 H new ATOM 0 HG21 VAL A 162 12.979 6.290 12.661 1.00 0.00 H new ATOM 0 HG22 VAL A 162 11.670 6.470 13.853 1.00 0.00 H new ATOM 0 HG23 VAL A 162 11.329 6.680 12.119 1.00 0.00 H new ATOM 635 N SER A 163 11.405 11.314 14.293 1.00 0.00 N ATOM 636 CA SER A 163 11.643 12.781 14.198 1.00 0.00 C ATOM 637 C SER A 163 13.145 13.045 14.066 1.00 0.00 C ATOM 638 O SER A 163 13.816 13.357 15.029 1.00 0.00 O ATOM 639 CB SER A 163 11.113 13.467 15.458 1.00 0.00 C ATOM 640 OG SER A 163 11.284 14.873 15.340 1.00 0.00 O ATOM 0 H SER A 163 11.300 10.951 15.240 1.00 0.00 H new ATOM 0 HA SER A 163 11.125 13.178 13.325 1.00 0.00 H new ATOM 0 HB2 SER A 163 10.059 13.229 15.598 1.00 0.00 H new ATOM 0 HB3 SER A 163 11.643 13.098 16.336 1.00 0.00 H new ATOM 0 HG SER A 163 10.943 15.313 16.147 1.00 0.00 H new ATOM 646 N ILE A 164 13.677 12.922 12.880 1.00 0.00 N ATOM 647 CA ILE A 164 15.135 13.165 12.690 1.00 0.00 C ATOM 648 C ILE A 164 15.341 14.548 12.068 1.00 0.00 C ATOM 649 O ILE A 164 14.614 14.956 11.185 1.00 0.00 O ATOM 650 CB ILE A 164 15.713 12.095 11.762 1.00 0.00 C ATOM 651 CG1 ILE A 164 15.375 10.707 12.309 1.00 0.00 C ATOM 652 CG2 ILE A 164 17.232 12.257 11.682 1.00 0.00 C ATOM 653 CD1 ILE A 164 15.964 9.638 11.386 1.00 0.00 C ATOM 0 H ILE A 164 13.166 12.664 12.036 1.00 0.00 H new ATOM 0 HA ILE A 164 15.642 13.120 13.654 1.00 0.00 H new ATOM 0 HB ILE A 164 15.283 12.206 10.767 1.00 0.00 H new ATOM 0 HG12 ILE A 164 15.776 10.594 13.316 1.00 0.00 H new ATOM 0 HG13 ILE A 164 14.294 10.586 12.380 1.00 0.00 H new ATOM 0 HG21 ILE A 164 17.645 11.495 11.021 1.00 0.00 H new ATOM 0 HG22 ILE A 164 17.472 13.246 11.291 1.00 0.00 H new ATOM 0 HG23 ILE A 164 17.663 12.146 12.677 1.00 0.00 H new ATOM 0 HD11 ILE A 164 15.724 8.649 11.775 1.00 0.00 H new ATOM 0 HD12 ILE A 164 15.542 9.747 10.387 1.00 0.00 H new ATOM 0 HD13 ILE A 164 17.047 9.756 11.337 1.00 0.00 H new ATOM 665 N PHE A 165 16.326 15.272 12.523 1.00 0.00 N ATOM 666 CA PHE A 165 16.573 16.628 11.957 1.00 0.00 C ATOM 667 C PHE A 165 15.393 17.541 12.292 1.00 0.00 C ATOM 668 O PHE A 165 15.259 18.623 11.757 1.00 0.00 O ATOM 669 CB PHE A 165 16.726 16.527 10.437 1.00 0.00 C ATOM 670 CG PHE A 165 17.263 17.830 9.897 1.00 0.00 C ATOM 671 CD1 PHE A 165 18.642 18.074 9.902 1.00 0.00 C ATOM 672 CD2 PHE A 165 16.383 18.794 9.390 1.00 0.00 C ATOM 673 CE1 PHE A 165 19.141 19.282 9.401 1.00 0.00 C ATOM 674 CE2 PHE A 165 16.882 20.002 8.888 1.00 0.00 C ATOM 675 CZ PHE A 165 18.260 20.247 8.893 1.00 0.00 C ATOM 0 H PHE A 165 16.969 14.984 13.260 1.00 0.00 H new ATOM 0 HA PHE A 165 17.486 17.041 12.386 1.00 0.00 H new ATOM 0 HB2 PHE A 165 17.401 15.710 10.182 1.00 0.00 H new ATOM 0 HB3 PHE A 165 15.764 16.300 9.978 1.00 0.00 H new ATOM 0 HD1 PHE A 165 19.321 17.330 10.292 1.00 0.00 H new ATOM 0 HD2 PHE A 165 15.320 18.606 9.386 1.00 0.00 H new ATOM 0 HE1 PHE A 165 20.204 19.471 9.406 1.00 0.00 H new ATOM 0 HE2 PHE A 165 16.203 20.745 8.497 1.00 0.00 H new ATOM 0 HZ PHE A 165 18.644 21.179 8.506 1.00 0.00 H new ATOM 685 N GLY A 166 14.532 17.111 13.174 1.00 0.00 N ATOM 686 CA GLY A 166 13.359 17.952 13.544 1.00 0.00 C ATOM 687 C GLY A 166 12.268 17.797 12.483 1.00 0.00 C ATOM 688 O GLY A 166 11.304 18.536 12.456 1.00 0.00 O ATOM 0 H GLY A 166 14.591 16.213 13.654 1.00 0.00 H new ATOM 0 HA2 GLY A 166 12.977 17.654 14.520 1.00 0.00 H new ATOM 0 HA3 GLY A 166 13.658 18.997 13.624 1.00 0.00 H new ATOM 692 N ARG A 167 12.411 16.838 11.608 1.00 0.00 N ATOM 693 CA ARG A 167 11.382 16.636 10.550 1.00 0.00 C ATOM 694 C ARG A 167 10.791 15.230 10.676 1.00 0.00 C ATOM 695 O ARG A 167 11.497 14.268 10.905 1.00 0.00 O ATOM 696 CB ARG A 167 12.030 16.795 9.173 1.00 0.00 C ATOM 697 CG ARG A 167 12.466 18.249 8.979 1.00 0.00 C ATOM 698 CD ARG A 167 13.008 18.433 7.560 1.00 0.00 C ATOM 699 NE ARG A 167 11.884 18.352 6.586 1.00 0.00 N ATOM 700 CZ ARG A 167 11.864 17.403 5.689 1.00 0.00 C ATOM 701 NH1 ARG A 167 12.762 17.380 4.743 1.00 0.00 N ATOM 702 NH2 ARG A 167 10.947 16.475 5.741 1.00 0.00 N ATOM 0 H ARG A 167 13.196 16.187 11.581 1.00 0.00 H new ATOM 0 HA ARG A 167 10.590 17.375 10.667 1.00 0.00 H new ATOM 0 HB2 ARG A 167 12.890 16.131 9.085 1.00 0.00 H new ATOM 0 HB3 ARG A 167 11.325 16.508 8.392 1.00 0.00 H new ATOM 0 HG2 ARG A 167 11.623 18.919 9.147 1.00 0.00 H new ATOM 0 HG3 ARG A 167 13.232 18.511 9.709 1.00 0.00 H new ATOM 0 HD2 ARG A 167 13.510 19.396 7.473 1.00 0.00 H new ATOM 0 HD3 ARG A 167 13.750 17.666 7.340 1.00 0.00 H new ATOM 0 HE ARG A 167 11.130 19.038 6.620 1.00 0.00 H new ATOM 0 HH11 ARG A 167 13.480 18.103 4.704 1.00 0.00 H new ATOM 0 HH12 ARG A 167 12.746 16.639 4.043 1.00 0.00 H new ATOM 0 HH21 ARG A 167 10.246 16.491 6.482 1.00 0.00 H new ATOM 0 HH22 ARG A 167 10.931 15.734 5.040 1.00 0.00 H new ATOM 716 N ALA A 168 9.501 15.103 10.526 1.00 0.00 N ATOM 717 CA ALA A 168 8.868 13.758 10.638 1.00 0.00 C ATOM 718 C ALA A 168 9.245 12.915 9.417 1.00 0.00 C ATOM 719 O ALA A 168 9.249 13.391 8.299 1.00 0.00 O ATOM 720 CB ALA A 168 7.347 13.913 10.700 1.00 0.00 C ATOM 0 H ALA A 168 8.859 15.871 10.331 1.00 0.00 H new ATOM 0 HA ALA A 168 9.220 13.265 11.544 1.00 0.00 H new ATOM 0 HB1 ALA A 168 6.884 12.930 10.782 1.00 0.00 H new ATOM 0 HB2 ALA A 168 7.078 14.514 11.568 1.00 0.00 H new ATOM 0 HB3 ALA A 168 6.994 14.406 9.794 1.00 0.00 H new ATOM 726 N THR A 169 9.561 11.665 9.623 1.00 0.00 N ATOM 727 CA THR A 169 9.936 10.793 8.475 1.00 0.00 C ATOM 728 C THR A 169 9.186 9.465 8.578 1.00 0.00 C ATOM 729 O THR A 169 9.745 8.453 8.950 1.00 0.00 O ATOM 730 CB THR A 169 11.444 10.532 8.505 1.00 0.00 C ATOM 731 OG1 THR A 169 12.117 11.705 8.937 1.00 0.00 O ATOM 732 CG2 THR A 169 11.926 10.149 7.105 1.00 0.00 C ATOM 0 H THR A 169 9.575 11.211 10.536 1.00 0.00 H new ATOM 0 HA THR A 169 9.671 11.288 7.540 1.00 0.00 H new ATOM 0 HB THR A 169 11.658 9.716 9.195 1.00 0.00 H new ATOM 0 HG1 THR A 169 12.084 11.760 9.915 1.00 0.00 H new ATOM 0 HG21 THR A 169 13.000 9.964 7.128 1.00 0.00 H new ATOM 0 HG22 THR A 169 11.409 9.248 6.776 1.00 0.00 H new ATOM 0 HG23 THR A 169 11.713 10.963 6.412 1.00 0.00 H new ATOM 740 N PRO A 170 7.887 9.474 8.240 1.00 0.00 N ATOM 741 CA PRO A 170 7.047 8.271 8.293 1.00 0.00 C ATOM 742 C PRO A 170 7.623 7.136 7.441 1.00 0.00 C ATOM 743 O PRO A 170 7.530 7.148 6.230 1.00 0.00 O ATOM 744 CB PRO A 170 5.714 8.739 7.707 1.00 0.00 C ATOM 745 CG PRO A 170 6.072 9.895 6.836 1.00 0.00 C ATOM 746 CD PRO A 170 7.243 10.570 7.495 1.00 0.00 C ATOM 0 HA PRO A 170 6.968 7.873 9.304 1.00 0.00 H new ATOM 0 HB2 PRO A 170 5.232 7.946 7.135 1.00 0.00 H new ATOM 0 HB3 PRO A 170 5.018 9.034 8.492 1.00 0.00 H new ATOM 0 HG2 PRO A 170 6.331 9.560 5.831 1.00 0.00 H new ATOM 0 HG3 PRO A 170 5.232 10.582 6.737 1.00 0.00 H new ATOM 0 HD2 PRO A 170 7.919 11.010 6.762 1.00 0.00 H new ATOM 0 HD3 PRO A 170 6.924 11.374 8.158 1.00 0.00 H new ATOM 754 N VAL A 171 8.215 6.155 8.066 1.00 0.00 N ATOM 755 CA VAL A 171 8.794 5.021 7.294 1.00 0.00 C ATOM 756 C VAL A 171 8.293 3.699 7.879 1.00 0.00 C ATOM 757 O VAL A 171 7.923 3.621 9.034 1.00 0.00 O ATOM 758 CB VAL A 171 10.321 5.071 7.380 1.00 0.00 C ATOM 759 CG1 VAL A 171 10.814 6.437 6.899 1.00 0.00 C ATOM 760 CG2 VAL A 171 10.758 4.853 8.829 1.00 0.00 C ATOM 0 H VAL A 171 8.322 6.091 9.078 1.00 0.00 H new ATOM 0 HA VAL A 171 8.487 5.097 6.251 1.00 0.00 H new ATOM 0 HB VAL A 171 10.746 4.289 6.751 1.00 0.00 H new ATOM 0 HG11 VAL A 171 11.902 6.473 6.960 1.00 0.00 H new ATOM 0 HG12 VAL A 171 10.503 6.593 5.866 1.00 0.00 H new ATOM 0 HG13 VAL A 171 10.389 7.219 7.528 1.00 0.00 H new ATOM 0 HG21 VAL A 171 11.846 4.889 8.890 1.00 0.00 H new ATOM 0 HG22 VAL A 171 10.333 5.635 9.459 1.00 0.00 H new ATOM 0 HG23 VAL A 171 10.407 3.880 9.172 1.00 0.00 H new ATOM 770 N GLU A 172 8.276 2.659 7.092 1.00 0.00 N ATOM 771 CA GLU A 172 7.798 1.344 7.604 1.00 0.00 C ATOM 772 C GLU A 172 8.999 0.447 7.909 1.00 0.00 C ATOM 773 O GLU A 172 9.881 0.276 7.091 1.00 0.00 O ATOM 774 CB GLU A 172 6.917 0.675 6.548 1.00 0.00 C ATOM 775 CG GLU A 172 5.700 1.559 6.265 1.00 0.00 C ATOM 776 CD GLU A 172 4.777 0.855 5.269 1.00 0.00 C ATOM 777 OE1 GLU A 172 5.182 -0.167 4.738 1.00 0.00 O ATOM 778 OE2 GLU A 172 3.683 1.349 5.052 1.00 0.00 O ATOM 0 H GLU A 172 8.573 2.663 6.116 1.00 0.00 H new ATOM 0 HA GLU A 172 7.220 1.498 8.515 1.00 0.00 H new ATOM 0 HB2 GLU A 172 7.486 0.516 5.632 1.00 0.00 H new ATOM 0 HB3 GLU A 172 6.594 -0.306 6.897 1.00 0.00 H new ATOM 0 HG2 GLU A 172 5.163 1.764 7.191 1.00 0.00 H new ATOM 0 HG3 GLU A 172 6.021 2.520 5.863 1.00 0.00 H new ATOM 785 N LEU A 173 9.040 -0.128 9.079 1.00 0.00 N ATOM 786 CA LEU A 173 10.184 -1.014 9.435 1.00 0.00 C ATOM 787 C LEU A 173 9.658 -2.409 9.780 1.00 0.00 C ATOM 788 O LEU A 173 8.556 -2.564 10.267 1.00 0.00 O ATOM 789 CB LEU A 173 10.922 -0.434 10.643 1.00 0.00 C ATOM 790 CG LEU A 173 11.450 0.960 10.298 1.00 0.00 C ATOM 791 CD1 LEU A 173 12.172 0.913 8.950 1.00 0.00 C ATOM 792 CD2 LEU A 173 10.282 1.944 10.217 1.00 0.00 C ATOM 0 H LEU A 173 8.331 -0.023 9.804 1.00 0.00 H new ATOM 0 HA LEU A 173 10.869 -1.082 8.590 1.00 0.00 H new ATOM 0 HB2 LEU A 173 10.251 -0.378 11.500 1.00 0.00 H new ATOM 0 HB3 LEU A 173 11.747 -1.087 10.926 1.00 0.00 H new ATOM 0 HG LEU A 173 12.145 1.286 11.072 1.00 0.00 H new ATOM 0 HD11 LEU A 173 12.548 1.906 8.704 1.00 0.00 H new ATOM 0 HD12 LEU A 173 13.006 0.213 9.008 1.00 0.00 H new ATOM 0 HD13 LEU A 173 11.477 0.586 8.176 1.00 0.00 H new ATOM 0 HD21 LEU A 173 10.659 2.937 9.971 1.00 0.00 H new ATOM 0 HD22 LEU A 173 9.585 1.619 9.444 1.00 0.00 H new ATOM 0 HD23 LEU A 173 9.768 1.979 11.178 1.00 0.00 H new ATOM 804 N ASP A 174 10.438 -3.425 9.532 1.00 0.00 N ATOM 805 CA ASP A 174 9.982 -4.808 9.847 1.00 0.00 C ATOM 806 C ASP A 174 9.906 -4.988 11.365 1.00 0.00 C ATOM 807 O ASP A 174 10.542 -4.276 12.116 1.00 0.00 O ATOM 808 CB ASP A 174 10.973 -5.817 9.263 1.00 0.00 C ATOM 809 CG ASP A 174 10.947 -5.735 7.736 1.00 0.00 C ATOM 810 OD1 ASP A 174 10.064 -5.075 7.213 1.00 0.00 O ATOM 811 OD2 ASP A 174 11.810 -6.333 7.115 1.00 0.00 O ATOM 0 H ASP A 174 11.371 -3.357 9.125 1.00 0.00 H new ATOM 0 HA ASP A 174 8.996 -4.973 9.412 1.00 0.00 H new ATOM 0 HB2 ASP A 174 11.978 -5.610 9.631 1.00 0.00 H new ATOM 0 HB3 ASP A 174 10.715 -6.825 9.588 1.00 0.00 H new ATOM 816 N PHE A 175 9.134 -5.935 11.821 1.00 0.00 N ATOM 817 CA PHE A 175 9.020 -6.161 13.290 1.00 0.00 C ATOM 818 C PHE A 175 10.394 -6.530 13.854 1.00 0.00 C ATOM 819 O PHE A 175 10.780 -6.083 14.916 1.00 0.00 O ATOM 820 CB PHE A 175 8.033 -7.299 13.557 1.00 0.00 C ATOM 821 CG PHE A 175 6.664 -6.910 13.052 1.00 0.00 C ATOM 822 CD1 PHE A 175 5.790 -6.193 13.880 1.00 0.00 C ATOM 823 CD2 PHE A 175 6.267 -7.266 11.758 1.00 0.00 C ATOM 824 CE1 PHE A 175 4.521 -5.833 13.413 1.00 0.00 C ATOM 825 CE2 PHE A 175 4.996 -6.906 11.292 1.00 0.00 C ATOM 826 CZ PHE A 175 4.123 -6.190 12.119 1.00 0.00 C ATOM 0 H PHE A 175 8.577 -6.562 11.241 1.00 0.00 H new ATOM 0 HA PHE A 175 8.661 -5.252 13.773 1.00 0.00 H new ATOM 0 HB2 PHE A 175 8.369 -8.210 13.061 1.00 0.00 H new ATOM 0 HB3 PHE A 175 7.990 -7.514 14.625 1.00 0.00 H new ATOM 0 HD1 PHE A 175 6.096 -5.918 14.879 1.00 0.00 H new ATOM 0 HD2 PHE A 175 6.940 -7.818 11.119 1.00 0.00 H new ATOM 0 HE1 PHE A 175 3.848 -5.279 14.051 1.00 0.00 H new ATOM 0 HE2 PHE A 175 4.689 -7.181 10.294 1.00 0.00 H new ATOM 0 HZ PHE A 175 3.143 -5.913 11.759 1.00 0.00 H new ATOM 836 N SER A 176 11.137 -7.340 13.151 1.00 0.00 N ATOM 837 CA SER A 176 12.485 -7.732 13.646 1.00 0.00 C ATOM 838 C SER A 176 13.454 -6.563 13.455 1.00 0.00 C ATOM 839 O SER A 176 14.491 -6.494 14.083 1.00 0.00 O ATOM 840 CB SER A 176 12.988 -8.946 12.860 1.00 0.00 C ATOM 841 OG SER A 176 12.037 -9.997 12.957 1.00 0.00 O ATOM 0 H SER A 176 10.868 -7.747 12.255 1.00 0.00 H new ATOM 0 HA SER A 176 12.424 -7.987 14.704 1.00 0.00 H new ATOM 0 HB2 SER A 176 13.145 -8.677 11.815 1.00 0.00 H new ATOM 0 HB3 SER A 176 13.951 -9.274 13.252 1.00 0.00 H new ATOM 0 HG SER A 176 12.356 -10.775 12.453 1.00 0.00 H new ATOM 847 N GLN A 177 13.120 -5.642 12.592 1.00 0.00 N ATOM 848 CA GLN A 177 14.019 -4.476 12.361 1.00 0.00 C ATOM 849 C GLN A 177 13.776 -3.428 13.450 1.00 0.00 C ATOM 850 O GLN A 177 14.605 -2.575 13.701 1.00 0.00 O ATOM 851 CB GLN A 177 13.722 -3.867 10.988 1.00 0.00 C ATOM 852 CG GLN A 177 14.292 -4.773 9.896 1.00 0.00 C ATOM 853 CD GLN A 177 13.890 -4.232 8.523 1.00 0.00 C ATOM 854 OE1 GLN A 177 13.031 -3.379 8.420 1.00 0.00 O ATOM 855 NE2 GLN A 177 14.479 -4.696 7.454 1.00 0.00 N ATOM 0 H GLN A 177 12.264 -5.647 12.037 1.00 0.00 H new ATOM 0 HA GLN A 177 15.059 -4.802 12.394 1.00 0.00 H new ATOM 0 HB2 GLN A 177 12.646 -3.751 10.855 1.00 0.00 H new ATOM 0 HB3 GLN A 177 14.162 -2.872 10.917 1.00 0.00 H new ATOM 0 HG2 GLN A 177 15.378 -4.819 9.977 1.00 0.00 H new ATOM 0 HG3 GLN A 177 13.920 -5.790 10.021 1.00 0.00 H new ATOM 0 HE21 GLN A 177 15.200 -5.412 7.539 1.00 0.00 H new ATOM 0 HE22 GLN A 177 14.218 -4.342 6.534 1.00 0.00 H new ATOM 864 N VAL A 178 12.646 -3.490 14.100 1.00 0.00 N ATOM 865 CA VAL A 178 12.349 -2.502 15.175 1.00 0.00 C ATOM 866 C VAL A 178 12.016 -3.248 16.468 1.00 0.00 C ATOM 867 O VAL A 178 11.701 -4.422 16.454 1.00 0.00 O ATOM 868 CB VAL A 178 11.157 -1.638 14.760 1.00 0.00 C ATOM 869 CG1 VAL A 178 11.452 -0.973 13.414 1.00 0.00 C ATOM 870 CG2 VAL A 178 9.909 -2.515 14.633 1.00 0.00 C ATOM 0 H VAL A 178 11.916 -4.182 13.933 1.00 0.00 H new ATOM 0 HA VAL A 178 13.218 -1.864 15.336 1.00 0.00 H new ATOM 0 HB VAL A 178 10.986 -0.870 15.515 1.00 0.00 H new ATOM 0 HG11 VAL A 178 10.602 -0.357 13.118 1.00 0.00 H new ATOM 0 HG12 VAL A 178 12.340 -0.347 13.504 1.00 0.00 H new ATOM 0 HG13 VAL A 178 11.624 -1.740 12.659 1.00 0.00 H new ATOM 0 HG21 VAL A 178 9.060 -1.899 14.337 1.00 0.00 H new ATOM 0 HG22 VAL A 178 10.080 -3.284 13.879 1.00 0.00 H new ATOM 0 HG23 VAL A 178 9.698 -2.988 15.592 1.00 0.00 H new ATOM 880 N GLU A 179 12.083 -2.581 17.587 1.00 0.00 N ATOM 881 CA GLU A 179 11.771 -3.258 18.876 1.00 0.00 C ATOM 882 C GLU A 179 10.615 -2.536 19.571 1.00 0.00 C ATOM 883 O GLU A 179 10.398 -1.357 19.373 1.00 0.00 O ATOM 884 CB GLU A 179 13.006 -3.229 19.779 1.00 0.00 C ATOM 885 CG GLU A 179 14.221 -3.731 18.995 1.00 0.00 C ATOM 886 CD GLU A 179 15.417 -3.862 19.939 1.00 0.00 C ATOM 887 OE1 GLU A 179 15.357 -3.303 21.022 1.00 0.00 O ATOM 888 OE2 GLU A 179 16.374 -4.519 19.564 1.00 0.00 O ATOM 0 H GLU A 179 12.340 -1.597 17.664 1.00 0.00 H new ATOM 0 HA GLU A 179 11.486 -4.292 18.681 1.00 0.00 H new ATOM 0 HB2 GLU A 179 13.184 -2.215 20.137 1.00 0.00 H new ATOM 0 HB3 GLU A 179 12.843 -3.854 20.657 1.00 0.00 H new ATOM 0 HG2 GLU A 179 13.999 -4.694 18.536 1.00 0.00 H new ATOM 0 HG3 GLU A 179 14.456 -3.040 18.186 1.00 0.00 H new ATOM 895 N LYS A 180 9.870 -3.236 20.382 1.00 0.00 N ATOM 896 CA LYS A 180 8.729 -2.592 21.090 1.00 0.00 C ATOM 897 C LYS A 180 9.264 -1.700 22.213 1.00 0.00 C ATOM 898 O LYS A 180 10.146 -2.083 22.955 1.00 0.00 O ATOM 899 CB LYS A 180 7.824 -3.673 21.685 1.00 0.00 C ATOM 900 CG LYS A 180 6.508 -3.043 22.143 1.00 0.00 C ATOM 901 CD LYS A 180 5.582 -4.134 22.685 1.00 0.00 C ATOM 902 CE LYS A 180 4.182 -3.556 22.897 1.00 0.00 C ATOM 903 NZ LYS A 180 3.832 -3.621 24.344 1.00 0.00 N ATOM 0 H LYS A 180 10.003 -4.227 20.585 1.00 0.00 H new ATOM 0 HA LYS A 180 8.158 -1.987 20.386 1.00 0.00 H new ATOM 0 HB2 LYS A 180 7.630 -4.448 20.943 1.00 0.00 H new ATOM 0 HB3 LYS A 180 8.321 -4.155 22.527 1.00 0.00 H new ATOM 0 HG2 LYS A 180 6.699 -2.297 22.914 1.00 0.00 H new ATOM 0 HG3 LYS A 180 6.031 -2.526 21.310 1.00 0.00 H new ATOM 0 HD2 LYS A 180 5.540 -4.970 21.987 1.00 0.00 H new ATOM 0 HD3 LYS A 180 5.973 -4.523 23.625 1.00 0.00 H new ATOM 0 HE2 LYS A 180 4.147 -2.524 22.549 1.00 0.00 H new ATOM 0 HE3 LYS A 180 3.453 -4.115 22.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 180 3.042 -4.284 24.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 180 4.657 -3.949 24.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 180 3.553 -2.676 24.676 1.00 0.00 H new ATOM 917 N ALA A 181 8.736 -0.514 22.343 1.00 0.00 N ATOM 918 CA ALA A 181 9.215 0.400 23.418 1.00 0.00 C ATOM 919 C ALA A 181 9.162 -0.324 24.765 1.00 0.00 C ATOM 920 O ALA A 181 8.104 -0.537 25.324 1.00 0.00 O ATOM 921 CB ALA A 181 8.321 1.640 23.470 1.00 0.00 C ATOM 0 H ALA A 181 7.994 -0.139 21.752 1.00 0.00 H new ATOM 0 HA ALA A 181 10.241 0.701 23.208 1.00 0.00 H new ATOM 0 HB1 ALA A 181 8.671 2.308 24.256 1.00 0.00 H new ATOM 0 HB2 ALA A 181 8.359 2.157 22.511 1.00 0.00 H new ATOM 0 HB3 ALA A 181 7.294 1.340 23.680 1.00 0.00 H new TER 927 ALA A 181