USER MOD reduce.3.24.130724 H: found=0, std=0, add=669, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 669 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 68 SER OG : rot 120:sc= -0.138 USER MOD Set 1.2: A 72 THR OG1 : rot 160:sc= 0.155 USER MOD Single : A 6 THR OG1 : rot -29:sc= 0.08 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 15 GLN : amide:sc= -0.0928 K(o=-0.093,f=-1.8!) USER MOD Single : A 16 LYS NZ :NH3+ 133:sc= 0.294 (180deg=-0.778) USER MOD Single : A 19 GLN : amide:sc= -1.73 K(o=-1.7,f=-3.9) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 ASN : amide:sc= -0.431 X(o=-0.43,f=-0.011) USER MOD Single : A 29 TYR OH : rot 180:sc= 0.112 USER MOD Single : A 30 GLN : amide:sc= -0.34 K(o=-0.34,f=-1.2) USER MOD Single : A 31 HIS : no HD1:sc= 0.444 K(o=0.44,f=-2.4!) USER MOD Single : A 32 LYS NZ :NH3+ 169:sc=-0.00263 (180deg=-0.142) USER MOD Single : A 35 SER OG : rot 84:sc= 0.217 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -0.428 X(o=-0.43,f=-0.68) USER MOD Single : A 56 LYS NZ :NH3+ -165:sc= -0.036 (180deg=-0.264) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= -0.0602 USER MOD Single : A 75 TYR OH : rot 30:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.0357 K(o=-0.036,f=-1.6!) USER MOD Single : A 81 THR OG1 : rot 91:sc= 1.29 USER MOD Single : A 83 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0378) USER MOD Single : A 84 ASN : amide:sc= -0.694 K(o=-0.69,f=-1.6) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 82 N THR A 6 11.101 -6.214 -11.388 1.00 0.00 N ATOM 83 CA THR A 6 12.009 -6.538 -10.294 1.00 0.00 C ATOM 84 C THR A 6 12.409 -8.010 -10.350 1.00 0.00 C ATOM 85 O THR A 6 11.920 -8.766 -11.190 1.00 0.00 O ATOM 86 CB THR A 6 11.342 -6.224 -8.955 1.00 0.00 C ATOM 87 OG1 THR A 6 10.166 -6.997 -8.817 1.00 0.00 O ATOM 88 CG2 THR A 6 10.977 -4.744 -8.866 1.00 0.00 C ATOM 0 HA THR A 6 12.909 -5.932 -10.395 1.00 0.00 H new ATOM 0 HB THR A 6 12.045 -6.465 -8.157 1.00 0.00 H new ATOM 0 HG1 THR A 6 9.789 -7.180 -9.703 1.00 0.00 H new ATOM 0 HG21 THR A 6 10.504 -4.543 -7.905 1.00 0.00 H new ATOM 0 HG22 THR A 6 11.880 -4.140 -8.959 1.00 0.00 H new ATOM 0 HG23 THR A 6 10.287 -4.491 -9.670 1.00 0.00 H new ATOM 96 N ASP A 7 13.306 -8.429 -9.454 1.00 0.00 N ATOM 97 CA ASP A 7 13.765 -9.809 -9.403 1.00 0.00 C ATOM 98 C ASP A 7 12.619 -10.775 -9.106 1.00 0.00 C ATOM 99 O ASP A 7 12.767 -11.978 -9.301 1.00 0.00 O ATOM 100 CB ASP A 7 14.861 -9.936 -8.346 1.00 0.00 C ATOM 101 CG ASP A 7 14.397 -9.421 -6.983 1.00 0.00 C ATOM 102 OD1 ASP A 7 14.505 -8.192 -6.772 1.00 0.00 O ATOM 103 OD2 ASP A 7 13.942 -10.252 -6.167 1.00 0.00 O ATOM 0 H ASP A 7 13.728 -7.823 -8.751 1.00 0.00 H new ATOM 0 HA ASP A 7 14.165 -10.077 -10.381 1.00 0.00 H new ATOM 0 HB2 ASP A 7 15.161 -10.980 -8.257 1.00 0.00 H new ATOM 0 HB3 ASP A 7 15.741 -9.377 -8.665 1.00 0.00 H new ATOM 108 N GLN A 8 11.470 -10.275 -8.643 1.00 0.00 N ATOM 109 CA GLN A 8 10.346 -11.132 -8.313 1.00 0.00 C ATOM 110 C GLN A 8 9.681 -11.652 -9.582 1.00 0.00 C ATOM 111 O GLN A 8 9.369 -12.837 -9.668 1.00 0.00 O ATOM 112 CB GLN A 8 9.341 -10.356 -7.459 1.00 0.00 C ATOM 113 CG GLN A 8 9.968 -9.948 -6.124 1.00 0.00 C ATOM 114 CD GLN A 8 8.983 -9.182 -5.243 1.00 0.00 C ATOM 115 OE1 GLN A 8 7.837 -8.948 -5.618 1.00 0.00 O ATOM 116 NE2 GLN A 8 9.431 -8.778 -4.054 1.00 0.00 N ATOM 0 H GLN A 8 11.301 -9.281 -8.491 1.00 0.00 H new ATOM 0 HA GLN A 8 10.707 -11.989 -7.744 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.008 -9.468 -7.997 1.00 0.00 H new ATOM 0 HB3 GLN A 8 8.458 -10.970 -7.280 1.00 0.00 H new ATOM 0 HG2 GLN A 8 10.310 -10.838 -5.597 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.846 -9.330 -6.309 1.00 0.00 H new ATOM 0 HE21 GLN A 8 10.388 -8.988 -3.771 1.00 0.00 H new ATOM 0 HE22 GLN A 8 8.816 -8.259 -3.427 1.00 0.00 H new ATOM 125 N VAL A 9 9.457 -10.781 -10.570 1.00 0.00 N ATOM 126 CA VAL A 9 8.825 -11.197 -11.814 1.00 0.00 C ATOM 127 C VAL A 9 9.854 -11.780 -12.771 1.00 0.00 C ATOM 128 O VAL A 9 9.504 -12.554 -13.656 1.00 0.00 O ATOM 129 CB VAL A 9 8.082 -10.034 -12.478 1.00 0.00 C ATOM 130 CG1 VAL A 9 7.162 -9.321 -11.488 1.00 0.00 C ATOM 131 CG2 VAL A 9 9.048 -9.013 -13.077 1.00 0.00 C ATOM 0 H VAL A 9 9.704 -9.792 -10.529 1.00 0.00 H new ATOM 0 HA VAL A 9 8.095 -11.969 -11.571 1.00 0.00 H new ATOM 0 HB VAL A 9 7.484 -10.470 -13.278 1.00 0.00 H new ATOM 0 HG11 VAL A 9 6.650 -8.501 -11.992 1.00 0.00 H new ATOM 0 HG12 VAL A 9 6.426 -10.026 -11.103 1.00 0.00 H new ATOM 0 HG13 VAL A 9 7.753 -8.926 -10.662 1.00 0.00 H new ATOM 0 HG21 VAL A 9 8.482 -8.204 -13.539 1.00 0.00 H new ATOM 0 HG22 VAL A 9 9.684 -8.608 -12.290 1.00 0.00 H new ATOM 0 HG23 VAL A 9 9.668 -9.498 -13.831 1.00 0.00 H new ATOM 141 N LEU A 10 11.127 -11.410 -12.595 1.00 0.00 N ATOM 142 CA LEU A 10 12.185 -11.851 -13.483 1.00 0.00 C ATOM 143 C LEU A 10 12.585 -13.290 -13.164 1.00 0.00 C ATOM 144 O LEU A 10 13.026 -14.013 -14.051 1.00 0.00 O ATOM 145 CB LEU A 10 13.357 -10.876 -13.355 1.00 0.00 C ATOM 146 CG LEU A 10 14.411 -11.042 -14.458 1.00 0.00 C ATOM 147 CD1 LEU A 10 13.816 -10.767 -15.838 1.00 0.00 C ATOM 148 CD2 LEU A 10 15.530 -10.034 -14.214 1.00 0.00 C ATOM 0 H LEU A 10 11.441 -10.802 -11.838 1.00 0.00 H new ATOM 0 HA LEU A 10 11.844 -11.850 -14.518 1.00 0.00 H new ATOM 0 HB2 LEU A 10 12.975 -9.855 -13.378 1.00 0.00 H new ATOM 0 HB3 LEU A 10 13.832 -11.016 -12.384 1.00 0.00 H new ATOM 0 HG LEU A 10 14.781 -12.067 -14.431 1.00 0.00 H new ATOM 0 HD11 LEU A 10 14.587 -10.893 -16.598 1.00 0.00 H new ATOM 0 HD12 LEU A 10 13.001 -11.465 -16.029 1.00 0.00 H new ATOM 0 HD13 LEU A 10 13.435 -9.746 -15.873 1.00 0.00 H new ATOM 0 HD21 LEU A 10 16.289 -10.138 -14.990 1.00 0.00 H new ATOM 0 HD22 LEU A 10 15.122 -9.024 -14.239 1.00 0.00 H new ATOM 0 HD23 LEU A 10 15.980 -10.219 -13.239 1.00 0.00 H new ATOM 160 N VAL A 11 12.429 -13.718 -11.908 1.00 0.00 N ATOM 161 CA VAL A 11 12.674 -15.106 -11.539 1.00 0.00 C ATOM 162 C VAL A 11 11.510 -15.970 -12.009 1.00 0.00 C ATOM 163 O VAL A 11 11.717 -17.094 -12.465 1.00 0.00 O ATOM 164 CB VAL A 11 12.864 -15.205 -10.023 1.00 0.00 C ATOM 165 CG1 VAL A 11 12.826 -16.655 -9.539 1.00 0.00 C ATOM 166 CG2 VAL A 11 14.218 -14.612 -9.641 1.00 0.00 C ATOM 0 H VAL A 11 12.135 -13.121 -11.135 1.00 0.00 H new ATOM 0 HA VAL A 11 13.583 -15.467 -12.021 1.00 0.00 H new ATOM 0 HB VAL A 11 12.047 -14.657 -9.554 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.965 -16.682 -8.458 1.00 0.00 H new ATOM 0 HG12 VAL A 11 11.863 -17.098 -9.792 1.00 0.00 H new ATOM 0 HG13 VAL A 11 13.624 -17.220 -10.021 1.00 0.00 H new ATOM 0 HG21 VAL A 11 14.354 -14.682 -8.562 1.00 0.00 H new ATOM 0 HG22 VAL A 11 15.012 -15.164 -10.144 1.00 0.00 H new ATOM 0 HG23 VAL A 11 14.256 -13.566 -9.944 1.00 0.00 H new ATOM 176 N GLU A 12 10.280 -15.454 -11.910 1.00 0.00 N ATOM 177 CA GLU A 12 9.106 -16.176 -12.383 1.00 0.00 C ATOM 178 C GLU A 12 9.151 -16.322 -13.903 1.00 0.00 C ATOM 179 O GLU A 12 8.618 -17.288 -14.446 1.00 0.00 O ATOM 180 CB GLU A 12 7.848 -15.413 -11.965 1.00 0.00 C ATOM 181 CG GLU A 12 7.572 -15.572 -10.467 1.00 0.00 C ATOM 182 CD GLU A 12 7.167 -17.001 -10.104 1.00 0.00 C ATOM 183 OE1 GLU A 12 6.633 -17.705 -10.996 1.00 0.00 O ATOM 184 OE2 GLU A 12 7.391 -17.386 -8.934 1.00 0.00 O ATOM 0 H GLU A 12 10.077 -14.540 -11.506 1.00 0.00 H new ATOM 0 HA GLU A 12 9.092 -17.173 -11.943 1.00 0.00 H new ATOM 0 HB2 GLU A 12 7.965 -14.356 -12.205 1.00 0.00 H new ATOM 0 HB3 GLU A 12 6.993 -15.777 -12.535 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.463 -15.294 -9.903 1.00 0.00 H new ATOM 0 HG3 GLU A 12 6.780 -14.885 -10.170 1.00 0.00 H new ATOM 191 N ARG A 13 9.788 -15.370 -14.587 1.00 0.00 N ATOM 192 CA ARG A 13 9.870 -15.378 -16.041 1.00 0.00 C ATOM 193 C ARG A 13 10.944 -16.350 -16.533 1.00 0.00 C ATOM 194 O ARG A 13 10.807 -16.911 -17.620 1.00 0.00 O ATOM 195 CB ARG A 13 10.122 -13.939 -16.499 1.00 0.00 C ATOM 196 CG ARG A 13 10.275 -13.856 -18.017 1.00 0.00 C ATOM 197 CD ARG A 13 10.427 -12.396 -18.444 1.00 0.00 C ATOM 198 NE ARG A 13 10.699 -12.306 -19.882 1.00 0.00 N ATOM 199 CZ ARG A 13 10.691 -11.176 -20.589 1.00 0.00 C ATOM 200 NH1 ARG A 13 10.408 -10.007 -20.017 1.00 0.00 N ATOM 201 NH2 ARG A 13 10.972 -11.223 -21.889 1.00 0.00 N ATOM 0 H ARG A 13 10.258 -14.578 -14.148 1.00 0.00 H new ATOM 0 HA ARG A 13 8.937 -15.735 -16.476 1.00 0.00 H new ATOM 0 HB2 ARG A 13 9.296 -13.304 -16.180 1.00 0.00 H new ATOM 0 HB3 ARG A 13 11.023 -13.555 -16.019 1.00 0.00 H new ATOM 0 HG2 ARG A 13 11.145 -14.430 -18.336 1.00 0.00 H new ATOM 0 HG3 ARG A 13 9.406 -14.298 -18.504 1.00 0.00 H new ATOM 0 HD2 ARG A 13 9.518 -11.845 -18.205 1.00 0.00 H new ATOM 0 HD3 ARG A 13 11.238 -11.930 -17.885 1.00 0.00 H new ATOM 0 HE ARG A 13 10.910 -13.172 -20.378 1.00 0.00 H new ATOM 0 HH11 ARG A 13 10.192 -9.966 -19.021 1.00 0.00 H new ATOM 0 HH12 ARG A 13 10.407 -9.153 -20.575 1.00 0.00 H new ATOM 0 HH21 ARG A 13 11.190 -12.116 -22.332 1.00 0.00 H new ATOM 0 HH22 ARG A 13 10.970 -10.366 -22.443 1.00 0.00 H new ATOM 215 N VAL A 14 12.004 -16.564 -15.753 1.00 0.00 N ATOM 216 CA VAL A 14 13.079 -17.470 -16.148 1.00 0.00 C ATOM 217 C VAL A 14 12.665 -18.929 -15.977 1.00 0.00 C ATOM 218 O VAL A 14 13.024 -19.763 -16.805 1.00 0.00 O ATOM 219 CB VAL A 14 14.340 -17.156 -15.340 1.00 0.00 C ATOM 220 CG1 VAL A 14 15.402 -18.242 -15.516 1.00 0.00 C ATOM 221 CG2 VAL A 14 14.926 -15.834 -15.830 1.00 0.00 C ATOM 0 H VAL A 14 12.140 -16.121 -14.844 1.00 0.00 H new ATOM 0 HA VAL A 14 13.292 -17.319 -17.206 1.00 0.00 H new ATOM 0 HB VAL A 14 14.062 -17.102 -14.287 1.00 0.00 H new ATOM 0 HG11 VAL A 14 16.284 -17.987 -14.928 1.00 0.00 H new ATOM 0 HG12 VAL A 14 15.004 -19.198 -15.177 1.00 0.00 H new ATOM 0 HG13 VAL A 14 15.676 -18.316 -16.568 1.00 0.00 H new ATOM 0 HG21 VAL A 14 15.825 -15.601 -15.260 1.00 0.00 H new ATOM 0 HG22 VAL A 14 15.178 -15.917 -16.887 1.00 0.00 H new ATOM 0 HG23 VAL A 14 14.194 -15.038 -15.693 1.00 0.00 H new ATOM 231 N GLN A 15 11.914 -19.255 -14.921 1.00 0.00 N ATOM 232 CA GLN A 15 11.489 -20.629 -14.702 1.00 0.00 C ATOM 233 C GLN A 15 10.348 -21.014 -15.644 1.00 0.00 C ATOM 234 O GLN A 15 10.052 -22.198 -15.808 1.00 0.00 O ATOM 235 CB GLN A 15 11.161 -20.850 -13.225 1.00 0.00 C ATOM 236 CG GLN A 15 9.941 -20.067 -12.748 1.00 0.00 C ATOM 237 CD GLN A 15 9.876 -20.068 -11.224 1.00 0.00 C ATOM 238 OE1 GLN A 15 10.006 -19.027 -10.591 1.00 0.00 O ATOM 239 NE2 GLN A 15 9.674 -21.234 -10.623 1.00 0.00 N ATOM 0 H GLN A 15 11.594 -18.591 -14.216 1.00 0.00 H new ATOM 0 HA GLN A 15 12.310 -21.302 -14.947 1.00 0.00 H new ATOM 0 HB2 GLN A 15 10.990 -21.913 -13.054 1.00 0.00 H new ATOM 0 HB3 GLN A 15 12.024 -20.565 -12.623 1.00 0.00 H new ATOM 0 HG2 GLN A 15 9.991 -19.042 -13.116 1.00 0.00 H new ATOM 0 HG3 GLN A 15 9.033 -20.509 -13.158 1.00 0.00 H new ATOM 0 HE21 GLN A 15 9.570 -22.083 -11.179 1.00 0.00 H new ATOM 0 HE22 GLN A 15 9.623 -21.281 -9.605 1.00 0.00 H new ATOM 248 N LYS A 16 9.711 -20.016 -16.271 1.00 0.00 N ATOM 249 CA LYS A 16 8.750 -20.244 -17.348 1.00 0.00 C ATOM 250 C LYS A 16 9.451 -20.522 -18.681 1.00 0.00 C ATOM 251 O LYS A 16 8.787 -20.685 -19.703 1.00 0.00 O ATOM 252 CB LYS A 16 7.780 -19.068 -17.437 1.00 0.00 C ATOM 253 CG LYS A 16 6.803 -19.137 -16.259 1.00 0.00 C ATOM 254 CD LYS A 16 5.902 -17.901 -16.252 1.00 0.00 C ATOM 255 CE LYS A 16 4.925 -17.962 -15.075 1.00 0.00 C ATOM 256 NZ LYS A 16 5.638 -17.969 -13.782 1.00 0.00 N ATOM 0 H LYS A 16 9.850 -19.031 -16.043 1.00 0.00 H new ATOM 0 HA LYS A 16 8.173 -21.139 -17.118 1.00 0.00 H new ATOM 0 HB2 LYS A 16 8.328 -18.126 -17.417 1.00 0.00 H new ATOM 0 HB3 LYS A 16 7.235 -19.100 -18.380 1.00 0.00 H new ATOM 0 HG2 LYS A 16 6.196 -20.039 -16.332 1.00 0.00 H new ATOM 0 HG3 LYS A 16 7.355 -19.200 -15.321 1.00 0.00 H new ATOM 0 HD2 LYS A 16 6.511 -16.999 -16.182 1.00 0.00 H new ATOM 0 HD3 LYS A 16 5.349 -17.840 -17.189 1.00 0.00 H new ATOM 0 HE2 LYS A 16 4.251 -17.107 -15.116 1.00 0.00 H new ATOM 0 HE3 LYS A 16 4.309 -18.858 -15.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 5.197 -17.282 -13.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 5.586 -18.919 -13.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 6.634 -17.711 -13.933 1.00 0.00 H new ATOM 270 N GLY A 17 10.790 -20.579 -18.681 1.00 0.00 N ATOM 271 CA GLY A 17 11.566 -21.015 -19.835 1.00 0.00 C ATOM 272 C GLY A 17 12.269 -19.893 -20.596 1.00 0.00 C ATOM 273 O GLY A 17 12.856 -20.159 -21.644 1.00 0.00 O ATOM 0 H GLY A 17 11.361 -20.322 -17.876 1.00 0.00 H new ATOM 0 HA2 GLY A 17 12.315 -21.733 -19.501 1.00 0.00 H new ATOM 0 HA3 GLY A 17 10.904 -21.542 -20.522 1.00 0.00 H new ATOM 277 N ASP A 18 12.224 -18.650 -20.104 1.00 0.00 N ATOM 278 CA ASP A 18 12.870 -17.539 -20.787 1.00 0.00 C ATOM 279 C ASP A 18 14.344 -17.452 -20.385 1.00 0.00 C ATOM 280 O ASP A 18 14.665 -17.100 -19.249 1.00 0.00 O ATOM 281 CB ASP A 18 12.123 -16.249 -20.462 1.00 0.00 C ATOM 282 CG ASP A 18 12.526 -15.101 -21.384 1.00 0.00 C ATOM 283 OD1 ASP A 18 13.698 -15.084 -21.814 1.00 0.00 O ATOM 284 OD2 ASP A 18 11.653 -14.245 -21.650 1.00 0.00 O ATOM 0 H ASP A 18 11.748 -18.395 -19.239 1.00 0.00 H new ATOM 0 HA ASP A 18 12.836 -17.698 -21.865 1.00 0.00 H new ATOM 0 HB2 ASP A 18 11.050 -16.421 -20.547 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.320 -15.968 -19.427 1.00 0.00 H new ATOM 289 N GLN A 19 15.253 -17.774 -21.308 1.00 0.00 N ATOM 290 CA GLN A 19 16.681 -17.730 -21.028 1.00 0.00 C ATOM 291 C GLN A 19 17.217 -16.301 -21.122 1.00 0.00 C ATOM 292 O GLN A 19 18.182 -15.954 -20.444 1.00 0.00 O ATOM 293 CB GLN A 19 17.403 -18.687 -21.984 1.00 0.00 C ATOM 294 CG GLN A 19 18.822 -19.026 -21.508 1.00 0.00 C ATOM 295 CD GLN A 19 19.829 -17.902 -21.728 1.00 0.00 C ATOM 296 OE1 GLN A 19 19.699 -17.100 -22.650 1.00 0.00 O ATOM 297 NE2 GLN A 19 20.844 -17.839 -20.874 1.00 0.00 N ATOM 0 H GLN A 19 15.020 -18.068 -22.256 1.00 0.00 H new ATOM 0 HA GLN A 19 16.867 -18.057 -20.005 1.00 0.00 H new ATOM 0 HB2 GLN A 19 16.825 -19.606 -22.079 1.00 0.00 H new ATOM 0 HB3 GLN A 19 17.453 -18.237 -22.976 1.00 0.00 H new ATOM 0 HG2 GLN A 19 18.790 -19.271 -20.446 1.00 0.00 H new ATOM 0 HG3 GLN A 19 19.167 -19.918 -22.030 1.00 0.00 H new ATOM 0 HE21 GLN A 19 20.920 -18.522 -20.120 1.00 0.00 H new ATOM 0 HE22 GLN A 19 21.548 -17.107 -20.972 1.00 0.00 H new ATOM 306 N LYS A 20 16.600 -15.459 -21.959 1.00 0.00 N ATOM 307 CA LYS A 20 17.054 -14.088 -22.133 1.00 0.00 C ATOM 308 C LYS A 20 16.732 -13.278 -20.884 1.00 0.00 C ATOM 309 O LYS A 20 17.461 -12.346 -20.546 1.00 0.00 O ATOM 310 CB LYS A 20 16.377 -13.467 -23.360 1.00 0.00 C ATOM 311 CG LYS A 20 16.615 -14.242 -24.661 1.00 0.00 C ATOM 312 CD LYS A 20 17.969 -13.962 -25.320 1.00 0.00 C ATOM 313 CE LYS A 20 19.159 -14.451 -24.493 1.00 0.00 C ATOM 314 NZ LYS A 20 20.419 -14.350 -25.255 1.00 0.00 N ATOM 0 H LYS A 20 15.787 -15.709 -22.522 1.00 0.00 H new ATOM 0 HA LYS A 20 18.133 -14.082 -22.289 1.00 0.00 H new ATOM 0 HB2 LYS A 20 15.304 -13.404 -23.178 1.00 0.00 H new ATOM 0 HB3 LYS A 20 16.740 -12.447 -23.485 1.00 0.00 H new ATOM 0 HG2 LYS A 20 16.538 -15.309 -24.454 1.00 0.00 H new ATOM 0 HG3 LYS A 20 15.822 -13.996 -25.367 1.00 0.00 H new ATOM 0 HD2 LYS A 20 17.995 -14.441 -26.299 1.00 0.00 H new ATOM 0 HD3 LYS A 20 18.068 -12.890 -25.488 1.00 0.00 H new ATOM 0 HE2 LYS A 20 19.236 -13.862 -23.579 1.00 0.00 H new ATOM 0 HE3 LYS A 20 18.995 -15.486 -24.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 21.208 -14.689 -24.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 20.352 -14.932 -26.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 20.586 -13.358 -25.520 1.00 0.00 H new ATOM 328 N ALA A 21 15.648 -13.626 -20.192 1.00 0.00 N ATOM 329 CA ALA A 21 15.299 -12.980 -18.941 1.00 0.00 C ATOM 330 C ALA A 21 16.349 -13.291 -17.874 1.00 0.00 C ATOM 331 O ALA A 21 16.545 -12.509 -16.945 1.00 0.00 O ATOM 332 CB ALA A 21 13.919 -13.467 -18.502 1.00 0.00 C ATOM 0 H ALA A 21 14.998 -14.356 -20.484 1.00 0.00 H new ATOM 0 HA ALA A 21 15.272 -11.899 -19.078 1.00 0.00 H new ATOM 0 HB1 ALA A 21 13.646 -12.988 -17.562 1.00 0.00 H new ATOM 0 HB2 ALA A 21 13.184 -13.213 -19.266 1.00 0.00 H new ATOM 0 HB3 ALA A 21 13.941 -14.548 -18.365 1.00 0.00 H new ATOM 338 N PHE A 22 17.028 -14.433 -18.003 1.00 0.00 N ATOM 339 CA PHE A 22 18.076 -14.792 -17.061 1.00 0.00 C ATOM 340 C PHE A 22 19.333 -13.977 -17.335 1.00 0.00 C ATOM 341 O PHE A 22 20.083 -13.674 -16.414 1.00 0.00 O ATOM 342 CB PHE A 22 18.371 -16.286 -17.142 1.00 0.00 C ATOM 343 CG PHE A 22 19.332 -16.743 -16.073 1.00 0.00 C ATOM 344 CD1 PHE A 22 18.919 -16.751 -14.734 1.00 0.00 C ATOM 345 CD2 PHE A 22 20.630 -17.150 -16.410 1.00 0.00 C ATOM 346 CE1 PHE A 22 19.807 -17.151 -13.725 1.00 0.00 C ATOM 347 CE2 PHE A 22 21.520 -17.547 -15.400 1.00 0.00 C ATOM 348 CZ PHE A 22 21.109 -17.540 -14.060 1.00 0.00 C ATOM 0 H PHE A 22 16.869 -15.115 -18.745 1.00 0.00 H new ATOM 0 HA PHE A 22 17.734 -14.565 -16.051 1.00 0.00 H new ATOM 0 HB2 PHE A 22 17.438 -16.843 -17.050 1.00 0.00 H new ATOM 0 HB3 PHE A 22 18.786 -16.519 -18.123 1.00 0.00 H new ATOM 0 HD1 PHE A 22 17.914 -16.448 -14.478 1.00 0.00 H new ATOM 0 HD2 PHE A 22 20.944 -17.158 -17.443 1.00 0.00 H new ATOM 0 HE1 PHE A 22 19.487 -17.159 -12.693 1.00 0.00 H new ATOM 0 HE2 PHE A 22 22.522 -17.858 -15.655 1.00 0.00 H new ATOM 0 HZ PHE A 22 21.799 -17.836 -13.284 1.00 0.00 H new ATOM 358 N ASN A 23 19.573 -13.610 -18.597 1.00 0.00 N ATOM 359 CA ASN A 23 20.727 -12.796 -18.939 1.00 0.00 C ATOM 360 C ASN A 23 20.626 -11.426 -18.273 1.00 0.00 C ATOM 361 O ASN A 23 21.639 -10.860 -17.867 1.00 0.00 O ATOM 362 CB ASN A 23 20.812 -12.675 -20.461 1.00 0.00 C ATOM 363 CG ASN A 23 22.022 -11.856 -20.892 1.00 0.00 C ATOM 364 OD1 ASN A 23 23.074 -12.407 -21.202 1.00 0.00 O ATOM 365 ND2 ASN A 23 21.884 -10.534 -20.919 1.00 0.00 N ATOM 0 H ASN A 23 18.984 -13.865 -19.389 1.00 0.00 H new ATOM 0 HA ASN A 23 21.639 -13.268 -18.572 1.00 0.00 H new ATOM 0 HB2 ASN A 23 20.869 -13.670 -20.903 1.00 0.00 H new ATOM 0 HB3 ASN A 23 19.903 -12.209 -20.841 1.00 0.00 H new ATOM 0 HD21 ASN A 23 22.667 -9.945 -21.204 1.00 0.00 H new ATOM 0 HD22 ASN A 23 20.995 -10.109 -20.655 1.00 0.00 H new ATOM 372 N LEU A 24 19.409 -10.885 -18.151 1.00 0.00 N ATOM 373 CA LEU A 24 19.214 -9.621 -17.456 1.00 0.00 C ATOM 374 C LEU A 24 19.342 -9.820 -15.947 1.00 0.00 C ATOM 375 O LEU A 24 19.690 -8.882 -15.232 1.00 0.00 O ATOM 376 CB LEU A 24 17.840 -9.029 -17.804 1.00 0.00 C ATOM 377 CG LEU A 24 17.790 -8.232 -19.116 1.00 0.00 C ATOM 378 CD1 LEU A 24 18.750 -7.044 -19.076 1.00 0.00 C ATOM 379 CD2 LEU A 24 18.125 -9.097 -20.328 1.00 0.00 C ATOM 0 H LEU A 24 18.556 -11.302 -18.523 1.00 0.00 H new ATOM 0 HA LEU A 24 19.985 -8.922 -17.780 1.00 0.00 H new ATOM 0 HB2 LEU A 24 17.115 -9.841 -17.862 1.00 0.00 H new ATOM 0 HB3 LEU A 24 17.525 -8.378 -16.989 1.00 0.00 H new ATOM 0 HG LEU A 24 16.766 -7.873 -19.216 1.00 0.00 H new ATOM 0 HD11 LEU A 24 18.693 -6.498 -20.018 1.00 0.00 H new ATOM 0 HD12 LEU A 24 18.475 -6.381 -18.256 1.00 0.00 H new ATOM 0 HD13 LEU A 24 19.768 -7.404 -18.926 1.00 0.00 H new ATOM 0 HD21 LEU A 24 18.077 -8.490 -21.232 1.00 0.00 H new ATOM 0 HD22 LEU A 24 19.130 -9.505 -20.217 1.00 0.00 H new ATOM 0 HD23 LEU A 24 17.408 -9.915 -20.401 1.00 0.00 H new ATOM 391 N LEU A 25 19.066 -11.032 -15.451 1.00 0.00 N ATOM 392 CA LEU A 25 19.214 -11.349 -14.040 1.00 0.00 C ATOM 393 C LEU A 25 20.693 -11.514 -13.687 1.00 0.00 C ATOM 394 O LEU A 25 21.092 -11.265 -12.550 1.00 0.00 O ATOM 395 CB LEU A 25 18.401 -12.619 -13.764 1.00 0.00 C ATOM 396 CG LEU A 25 18.337 -12.986 -12.280 1.00 0.00 C ATOM 397 CD1 LEU A 25 17.642 -11.900 -11.456 1.00 0.00 C ATOM 398 CD2 LEU A 25 17.524 -14.275 -12.146 1.00 0.00 C ATOM 0 H LEU A 25 18.736 -11.812 -16.020 1.00 0.00 H new ATOM 0 HA LEU A 25 18.838 -10.542 -13.411 1.00 0.00 H new ATOM 0 HB2 LEU A 25 17.388 -12.482 -14.141 1.00 0.00 H new ATOM 0 HB3 LEU A 25 18.838 -13.450 -14.318 1.00 0.00 H new ATOM 0 HG LEU A 25 19.355 -13.101 -11.909 1.00 0.00 H new ATOM 0 HD11 LEU A 25 17.617 -12.199 -10.408 1.00 0.00 H new ATOM 0 HD12 LEU A 25 18.190 -10.963 -11.553 1.00 0.00 H new ATOM 0 HD13 LEU A 25 16.623 -11.764 -11.819 1.00 0.00 H new ATOM 0 HD21 LEU A 25 17.463 -14.559 -11.095 1.00 0.00 H new ATOM 0 HD22 LEU A 25 16.519 -14.114 -12.537 1.00 0.00 H new ATOM 0 HD23 LEU A 25 18.009 -15.072 -12.710 1.00 0.00 H new ATOM 410 N VAL A 26 21.514 -11.926 -14.655 1.00 0.00 N ATOM 411 CA VAL A 26 22.955 -12.023 -14.460 1.00 0.00 C ATOM 412 C VAL A 26 23.554 -10.622 -14.410 1.00 0.00 C ATOM 413 O VAL A 26 24.371 -10.337 -13.543 1.00 0.00 O ATOM 414 CB VAL A 26 23.594 -12.847 -15.588 1.00 0.00 C ATOM 415 CG1 VAL A 26 25.121 -12.797 -15.515 1.00 0.00 C ATOM 416 CG2 VAL A 26 23.165 -14.309 -15.495 1.00 0.00 C ATOM 0 H VAL A 26 21.199 -12.199 -15.586 1.00 0.00 H new ATOM 0 HA VAL A 26 23.158 -12.530 -13.517 1.00 0.00 H new ATOM 0 HB VAL A 26 23.257 -12.413 -16.529 1.00 0.00 H new ATOM 0 HG11 VAL A 26 25.544 -13.390 -16.326 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.456 -11.764 -15.608 1.00 0.00 H new ATOM 0 HG13 VAL A 26 25.453 -13.202 -14.559 1.00 0.00 H new ATOM 0 HG21 VAL A 26 23.628 -14.876 -16.303 1.00 0.00 H new ATOM 0 HG22 VAL A 26 23.480 -14.720 -14.536 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.080 -14.376 -15.580 1.00 0.00 H new ATOM 426 N VAL A 27 23.156 -9.739 -15.332 1.00 0.00 N ATOM 427 CA VAL A 27 23.689 -8.379 -15.373 1.00 0.00 C ATOM 428 C VAL A 27 23.292 -7.605 -14.115 1.00 0.00 C ATOM 429 O VAL A 27 23.963 -6.646 -13.740 1.00 0.00 O ATOM 430 CB VAL A 27 23.186 -7.677 -16.641 1.00 0.00 C ATOM 431 CG1 VAL A 27 23.556 -6.196 -16.665 1.00 0.00 C ATOM 432 CG2 VAL A 27 23.813 -8.333 -17.873 1.00 0.00 C ATOM 0 H VAL A 27 22.468 -9.944 -16.057 1.00 0.00 H new ATOM 0 HA VAL A 27 24.778 -8.417 -15.401 1.00 0.00 H new ATOM 0 HB VAL A 27 22.100 -7.770 -16.647 1.00 0.00 H new ATOM 0 HG11 VAL A 27 23.179 -5.742 -17.581 1.00 0.00 H new ATOM 0 HG12 VAL A 27 23.113 -5.696 -15.803 1.00 0.00 H new ATOM 0 HG13 VAL A 27 24.640 -6.091 -16.628 1.00 0.00 H new ATOM 0 HG21 VAL A 27 23.455 -7.833 -18.773 1.00 0.00 H new ATOM 0 HG22 VAL A 27 24.898 -8.248 -17.818 1.00 0.00 H new ATOM 0 HG23 VAL A 27 23.533 -9.386 -17.907 1.00 0.00 H new ATOM 442 N ARG A 28 22.206 -8.020 -13.460 1.00 0.00 N ATOM 443 CA ARG A 28 21.709 -7.379 -12.252 1.00 0.00 C ATOM 444 C ARG A 28 22.599 -7.669 -11.046 1.00 0.00 C ATOM 445 O ARG A 28 22.798 -6.790 -10.210 1.00 0.00 O ATOM 446 CB ARG A 28 20.299 -7.913 -12.003 1.00 0.00 C ATOM 447 CG ARG A 28 19.636 -7.293 -10.775 1.00 0.00 C ATOM 448 CD ARG A 28 18.263 -7.945 -10.614 1.00 0.00 C ATOM 449 NE ARG A 28 17.539 -7.420 -9.453 1.00 0.00 N ATOM 450 CZ ARG A 28 16.800 -6.307 -9.457 1.00 0.00 C ATOM 451 NH1 ARG A 28 16.697 -5.557 -10.550 1.00 0.00 N ATOM 452 NH2 ARG A 28 16.157 -5.939 -8.355 1.00 0.00 N ATOM 0 H ARG A 28 21.646 -8.818 -13.760 1.00 0.00 H new ATOM 0 HA ARG A 28 21.707 -6.297 -12.387 1.00 0.00 H new ATOM 0 HB2 ARG A 28 19.682 -7.718 -12.880 1.00 0.00 H new ATOM 0 HB3 ARG A 28 20.343 -8.995 -11.879 1.00 0.00 H new ATOM 0 HG2 ARG A 28 20.245 -7.458 -9.886 1.00 0.00 H new ATOM 0 HG3 ARG A 28 19.536 -6.214 -10.897 1.00 0.00 H new ATOM 0 HD2 ARG A 28 17.674 -7.777 -11.515 1.00 0.00 H new ATOM 0 HD3 ARG A 28 18.384 -9.023 -10.509 1.00 0.00 H new ATOM 0 HE ARG A 28 17.604 -7.942 -8.579 1.00 0.00 H new ATOM 0 HH11 ARG A 28 17.186 -5.828 -11.403 1.00 0.00 H new ATOM 0 HH12 ARG A 28 16.128 -4.710 -10.536 1.00 0.00 H new ATOM 0 HH21 ARG A 28 16.228 -6.505 -7.510 1.00 0.00 H new ATOM 0 HH22 ARG A 28 15.592 -5.090 -8.354 1.00 0.00 H new ATOM 466 N TYR A 29 23.128 -8.891 -10.950 1.00 0.00 N ATOM 467 CA TYR A 29 23.912 -9.311 -9.794 1.00 0.00 C ATOM 468 C TYR A 29 25.380 -9.606 -10.091 1.00 0.00 C ATOM 469 O TYR A 29 26.120 -9.941 -9.167 1.00 0.00 O ATOM 470 CB TYR A 29 23.231 -10.525 -9.167 1.00 0.00 C ATOM 471 CG TYR A 29 21.893 -10.194 -8.552 1.00 0.00 C ATOM 472 CD1 TYR A 29 21.834 -9.373 -7.418 1.00 0.00 C ATOM 473 CD2 TYR A 29 20.713 -10.699 -9.114 1.00 0.00 C ATOM 474 CE1 TYR A 29 20.596 -9.050 -6.844 1.00 0.00 C ATOM 475 CE2 TYR A 29 19.472 -10.376 -8.552 1.00 0.00 C ATOM 476 CZ TYR A 29 19.408 -9.546 -7.416 1.00 0.00 C ATOM 477 OH TYR A 29 18.201 -9.223 -6.872 1.00 0.00 O ATOM 0 H TYR A 29 23.024 -9.609 -11.667 1.00 0.00 H new ATOM 0 HA TYR A 29 23.938 -8.470 -9.102 1.00 0.00 H new ATOM 0 HB2 TYR A 29 23.095 -11.293 -9.928 1.00 0.00 H new ATOM 0 HB3 TYR A 29 23.883 -10.946 -8.402 1.00 0.00 H new ATOM 0 HD1 TYR A 29 22.745 -8.988 -6.985 1.00 0.00 H new ATOM 0 HD2 TYR A 29 20.761 -11.339 -9.983 1.00 0.00 H new ATOM 0 HE1 TYR A 29 20.553 -8.423 -5.966 1.00 0.00 H new ATOM 0 HE2 TYR A 29 18.564 -10.763 -8.990 1.00 0.00 H new ATOM 0 HH TYR A 29 17.485 -9.647 -7.389 1.00 0.00 H new ATOM 487 N GLN A 30 25.830 -9.494 -11.345 1.00 0.00 N ATOM 488 CA GLN A 30 27.186 -9.907 -11.699 1.00 0.00 C ATOM 489 C GLN A 30 28.264 -9.162 -10.910 1.00 0.00 C ATOM 490 O GLN A 30 29.317 -9.730 -10.626 1.00 0.00 O ATOM 491 CB GLN A 30 27.416 -9.741 -13.206 1.00 0.00 C ATOM 492 CG GLN A 30 27.224 -8.294 -13.668 1.00 0.00 C ATOM 493 CD GLN A 30 27.437 -8.149 -15.172 1.00 0.00 C ATOM 494 OE1 GLN A 30 27.795 -9.099 -15.863 1.00 0.00 O ATOM 495 NE2 GLN A 30 27.215 -6.944 -15.691 1.00 0.00 N ATOM 0 H GLN A 30 25.281 -9.125 -12.121 1.00 0.00 H new ATOM 0 HA GLN A 30 27.274 -10.960 -11.430 1.00 0.00 H new ATOM 0 HB2 GLN A 30 28.425 -10.069 -13.455 1.00 0.00 H new ATOM 0 HB3 GLN A 30 26.727 -10.388 -13.750 1.00 0.00 H new ATOM 0 HG2 GLN A 30 26.220 -7.959 -13.409 1.00 0.00 H new ATOM 0 HG3 GLN A 30 27.922 -7.647 -13.137 1.00 0.00 H new ATOM 0 HE21 GLN A 30 26.918 -6.176 -15.089 1.00 0.00 H new ATOM 0 HE22 GLN A 30 27.341 -6.788 -16.691 1.00 0.00 H new ATOM 504 N HIS A 31 28.018 -7.901 -10.549 1.00 0.00 N ATOM 505 CA HIS A 31 28.995 -7.116 -9.809 1.00 0.00 C ATOM 506 C HIS A 31 28.855 -7.343 -8.309 1.00 0.00 C ATOM 507 O HIS A 31 29.826 -7.194 -7.567 1.00 0.00 O ATOM 508 CB HIS A 31 28.815 -5.639 -10.159 1.00 0.00 C ATOM 509 CG HIS A 31 27.472 -5.097 -9.747 1.00 0.00 C ATOM 510 ND1 HIS A 31 26.241 -5.504 -10.266 1.00 0.00 N ATOM 511 CD2 HIS A 31 27.265 -4.131 -8.801 1.00 0.00 C ATOM 512 CE1 HIS A 31 25.320 -4.769 -9.619 1.00 0.00 C ATOM 513 NE2 HIS A 31 25.905 -3.941 -8.735 1.00 0.00 N ATOM 0 H HIS A 31 27.151 -7.407 -10.759 1.00 0.00 H new ATOM 0 HA HIS A 31 29.999 -7.433 -10.091 1.00 0.00 H new ATOM 0 HB2 HIS A 31 29.600 -5.058 -9.674 1.00 0.00 H new ATOM 0 HB3 HIS A 31 28.939 -5.508 -11.234 1.00 0.00 H new ATOM 0 HD2 HIS A 31 28.019 -3.620 -8.222 1.00 0.00 H new ATOM 0 HE1 HIS A 31 24.255 -4.834 -9.786 1.00 0.00 H new ATOM 0 HE2 HIS A 31 25.422 -3.285 -8.121 1.00 0.00 H new ATOM 521 N LYS A 32 27.651 -7.704 -7.853 1.00 0.00 N ATOM 522 CA LYS A 32 27.377 -7.901 -6.440 1.00 0.00 C ATOM 523 C LYS A 32 27.837 -9.283 -5.992 1.00 0.00 C ATOM 524 O LYS A 32 28.271 -9.455 -4.856 1.00 0.00 O ATOM 525 CB LYS A 32 25.877 -7.699 -6.224 1.00 0.00 C ATOM 526 CG LYS A 32 25.555 -7.458 -4.752 1.00 0.00 C ATOM 527 CD LYS A 32 24.044 -7.292 -4.580 1.00 0.00 C ATOM 528 CE LYS A 32 23.683 -7.066 -3.108 1.00 0.00 C ATOM 529 NZ LYS A 32 24.254 -5.812 -2.586 1.00 0.00 N ATOM 0 H LYS A 32 26.846 -7.866 -8.458 1.00 0.00 H new ATOM 0 HA LYS A 32 27.929 -7.182 -5.835 1.00 0.00 H new ATOM 0 HB2 LYS A 32 25.533 -6.851 -6.817 1.00 0.00 H new ATOM 0 HB3 LYS A 32 25.335 -8.576 -6.578 1.00 0.00 H new ATOM 0 HG2 LYS A 32 25.910 -8.294 -4.150 1.00 0.00 H new ATOM 0 HG3 LYS A 32 26.072 -6.567 -4.397 1.00 0.00 H new ATOM 0 HD2 LYS A 32 23.696 -6.449 -5.177 1.00 0.00 H new ATOM 0 HD3 LYS A 32 23.532 -8.179 -4.952 1.00 0.00 H new ATOM 0 HE2 LYS A 32 22.599 -7.043 -3.000 1.00 0.00 H new ATOM 0 HE3 LYS A 32 24.045 -7.905 -2.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 23.839 -5.602 -1.656 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 25.285 -5.913 -2.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 24.042 -5.034 -3.243 1.00 0.00 H new ATOM 543 N VAL A 33 27.745 -10.271 -6.888 1.00 0.00 N ATOM 544 CA VAL A 33 28.181 -11.625 -6.590 1.00 0.00 C ATOM 545 C VAL A 33 29.696 -11.736 -6.723 1.00 0.00 C ATOM 546 O VAL A 33 30.319 -12.547 -6.041 1.00 0.00 O ATOM 547 CB VAL A 33 27.452 -12.615 -7.502 1.00 0.00 C ATOM 548 CG1 VAL A 33 27.993 -12.570 -8.926 1.00 0.00 C ATOM 549 CG2 VAL A 33 27.598 -14.033 -6.956 1.00 0.00 C ATOM 0 H VAL A 33 27.369 -10.150 -7.829 1.00 0.00 H new ATOM 0 HA VAL A 33 27.929 -11.871 -5.559 1.00 0.00 H new ATOM 0 HB VAL A 33 26.401 -12.328 -7.524 1.00 0.00 H new ATOM 0 HG11 VAL A 33 27.451 -13.286 -9.544 1.00 0.00 H new ATOM 0 HG12 VAL A 33 27.862 -11.567 -9.333 1.00 0.00 H new ATOM 0 HG13 VAL A 33 29.053 -12.824 -8.921 1.00 0.00 H new ATOM 0 HG21 VAL A 33 27.076 -14.731 -7.611 1.00 0.00 H new ATOM 0 HG22 VAL A 33 28.654 -14.298 -6.911 1.00 0.00 H new ATOM 0 HG23 VAL A 33 27.168 -14.084 -5.956 1.00 0.00 H new ATOM 559 N ALA A 34 30.305 -10.925 -7.596 1.00 0.00 N ATOM 560 CA ALA A 34 31.750 -10.928 -7.756 1.00 0.00 C ATOM 561 C ALA A 34 32.435 -10.364 -6.515 1.00 0.00 C ATOM 562 O ALA A 34 33.564 -10.741 -6.212 1.00 0.00 O ATOM 563 CB ALA A 34 32.108 -10.115 -8.997 1.00 0.00 C ATOM 0 H ALA A 34 29.815 -10.263 -8.197 1.00 0.00 H new ATOM 0 HA ALA A 34 32.101 -11.952 -7.881 1.00 0.00 H new ATOM 0 HB1 ALA A 34 33.190 -10.109 -9.129 1.00 0.00 H new ATOM 0 HB2 ALA A 34 31.638 -10.562 -9.873 1.00 0.00 H new ATOM 0 HB3 ALA A 34 31.752 -9.092 -8.877 1.00 0.00 H new ATOM 569 N SER A 35 31.758 -9.467 -5.793 1.00 0.00 N ATOM 570 CA SER A 35 32.283 -8.913 -4.555 1.00 0.00 C ATOM 571 C SER A 35 32.112 -9.903 -3.406 1.00 0.00 C ATOM 572 O SER A 35 32.827 -9.821 -2.410 1.00 0.00 O ATOM 573 CB SER A 35 31.572 -7.597 -4.243 1.00 0.00 C ATOM 574 OG SER A 35 31.853 -6.656 -5.257 1.00 0.00 O ATOM 0 H SER A 35 30.838 -9.111 -6.053 1.00 0.00 H new ATOM 0 HA SER A 35 33.349 -8.722 -4.675 1.00 0.00 H new ATOM 0 HB2 SER A 35 30.497 -7.761 -4.172 1.00 0.00 H new ATOM 0 HB3 SER A 35 31.900 -7.215 -3.277 1.00 0.00 H new ATOM 0 HG SER A 35 31.237 -6.790 -6.008 1.00 0.00 H new ATOM 580 N LEU A 36 31.167 -10.842 -3.539 1.00 0.00 N ATOM 581 CA LEU A 36 30.941 -11.864 -2.526 1.00 0.00 C ATOM 582 C LEU A 36 31.920 -13.026 -2.669 1.00 0.00 C ATOM 583 O LEU A 36 32.458 -13.487 -1.667 1.00 0.00 O ATOM 584 CB LEU A 36 29.493 -12.344 -2.641 1.00 0.00 C ATOM 585 CG LEU A 36 29.196 -13.545 -1.737 1.00 0.00 C ATOM 586 CD1 LEU A 36 29.445 -13.235 -0.262 1.00 0.00 C ATOM 587 CD2 LEU A 36 27.731 -13.924 -1.914 1.00 0.00 C ATOM 0 H LEU A 36 30.546 -10.910 -4.346 1.00 0.00 H new ATOM 0 HA LEU A 36 31.112 -11.437 -1.538 1.00 0.00 H new ATOM 0 HB2 LEU A 36 28.821 -11.525 -2.383 1.00 0.00 H new ATOM 0 HB3 LEU A 36 29.285 -12.613 -3.676 1.00 0.00 H new ATOM 0 HG LEU A 36 29.863 -14.359 -2.023 1.00 0.00 H new ATOM 0 HD11 LEU A 36 29.220 -14.117 0.338 1.00 0.00 H new ATOM 0 HD12 LEU A 36 30.489 -12.956 -0.120 1.00 0.00 H new ATOM 0 HD13 LEU A 36 28.803 -12.411 0.050 1.00 0.00 H new ATOM 0 HD21 LEU A 36 27.497 -14.778 -1.279 1.00 0.00 H new ATOM 0 HD22 LEU A 36 27.100 -13.080 -1.634 1.00 0.00 H new ATOM 0 HD23 LEU A 36 27.546 -14.185 -2.956 1.00 0.00 H new ATOM 599 N VAL A 37 32.169 -13.510 -3.889 1.00 0.00 N ATOM 600 CA VAL A 37 33.067 -14.647 -4.052 1.00 0.00 C ATOM 601 C VAL A 37 34.526 -14.215 -3.956 1.00 0.00 C ATOM 602 O VAL A 37 35.395 -15.042 -3.691 1.00 0.00 O ATOM 603 CB VAL A 37 32.793 -15.406 -5.354 1.00 0.00 C ATOM 604 CG1 VAL A 37 31.323 -15.809 -5.460 1.00 0.00 C ATOM 605 CG2 VAL A 37 33.180 -14.596 -6.586 1.00 0.00 C ATOM 0 H VAL A 37 31.772 -13.142 -4.754 1.00 0.00 H new ATOM 0 HA VAL A 37 32.870 -15.337 -3.231 1.00 0.00 H new ATOM 0 HB VAL A 37 33.414 -16.301 -5.322 1.00 0.00 H new ATOM 0 HG11 VAL A 37 31.159 -16.346 -6.394 1.00 0.00 H new ATOM 0 HG12 VAL A 37 31.061 -16.453 -4.621 1.00 0.00 H new ATOM 0 HG13 VAL A 37 30.699 -14.916 -5.441 1.00 0.00 H new ATOM 0 HG21 VAL A 37 32.967 -15.176 -7.484 1.00 0.00 H new ATOM 0 HG22 VAL A 37 32.606 -13.670 -6.608 1.00 0.00 H new ATOM 0 HG23 VAL A 37 34.244 -14.363 -6.548 1.00 0.00 H new ATOM 615 N SER A 38 34.806 -12.925 -4.161 1.00 0.00 N ATOM 616 CA SER A 38 36.158 -12.389 -4.028 1.00 0.00 C ATOM 617 C SER A 38 36.668 -12.570 -2.599 1.00 0.00 C ATOM 618 O SER A 38 37.866 -12.462 -2.341 1.00 0.00 O ATOM 619 CB SER A 38 36.159 -10.914 -4.429 1.00 0.00 C ATOM 620 OG SER A 38 37.460 -10.372 -4.335 1.00 0.00 O ATOM 0 H SER A 38 34.106 -12.230 -4.422 1.00 0.00 H new ATOM 0 HA SER A 38 36.831 -12.934 -4.690 1.00 0.00 H new ATOM 0 HB2 SER A 38 35.789 -10.809 -5.449 1.00 0.00 H new ATOM 0 HB3 SER A 38 35.480 -10.356 -3.784 1.00 0.00 H new ATOM 0 HG SER A 38 37.441 -9.428 -4.597 1.00 0.00 H new ATOM 626 N ARG A 39 35.757 -12.846 -1.658 1.00 0.00 N ATOM 627 CA ARG A 39 36.100 -13.068 -0.261 1.00 0.00 C ATOM 628 C ARG A 39 36.648 -14.478 -0.037 1.00 0.00 C ATOM 629 O ARG A 39 37.194 -14.755 1.030 1.00 0.00 O ATOM 630 CB ARG A 39 34.858 -12.855 0.607 1.00 0.00 C ATOM 631 CG ARG A 39 34.211 -11.492 0.352 1.00 0.00 C ATOM 632 CD ARG A 39 32.950 -11.362 1.201 1.00 0.00 C ATOM 633 NE ARG A 39 32.235 -10.116 0.905 1.00 0.00 N ATOM 634 CZ ARG A 39 31.018 -9.827 1.371 1.00 0.00 C ATOM 635 NH1 ARG A 39 30.376 -10.681 2.161 1.00 0.00 N ATOM 636 NH2 ARG A 39 30.439 -8.676 1.044 1.00 0.00 N ATOM 0 H ARG A 39 34.758 -12.920 -1.852 1.00 0.00 H new ATOM 0 HA ARG A 39 36.878 -12.357 0.017 1.00 0.00 H new ATOM 0 HB2 ARG A 39 34.134 -13.644 0.405 1.00 0.00 H new ATOM 0 HB3 ARG A 39 35.132 -12.936 1.659 1.00 0.00 H new ATOM 0 HG2 ARG A 39 34.911 -10.693 0.597 1.00 0.00 H new ATOM 0 HG3 ARG A 39 33.964 -11.387 -0.704 1.00 0.00 H new ATOM 0 HD2 ARG A 39 32.295 -12.213 1.015 1.00 0.00 H new ATOM 0 HD3 ARG A 39 33.216 -11.389 2.258 1.00 0.00 H new ATOM 0 HE ARG A 39 32.695 -9.429 0.307 1.00 0.00 H new ATOM 0 HH11 ARG A 39 30.813 -11.567 2.416 1.00 0.00 H new ATOM 0 HH12 ARG A 39 29.446 -10.451 2.512 1.00 0.00 H new ATOM 0 HH21 ARG A 39 30.925 -8.015 0.438 1.00 0.00 H new ATOM 0 HH22 ARG A 39 29.509 -8.454 1.399 1.00 0.00 H new ATOM 650 N TYR A 40 36.508 -15.370 -1.027 1.00 0.00 N ATOM 651 CA TYR A 40 36.904 -16.765 -0.874 1.00 0.00 C ATOM 652 C TYR A 40 37.850 -17.243 -1.978 1.00 0.00 C ATOM 653 O TYR A 40 38.451 -18.303 -1.840 1.00 0.00 O ATOM 654 CB TYR A 40 35.645 -17.632 -0.792 1.00 0.00 C ATOM 655 CG TYR A 40 34.617 -17.101 0.184 1.00 0.00 C ATOM 656 CD1 TYR A 40 34.810 -17.272 1.561 1.00 0.00 C ATOM 657 CD2 TYR A 40 33.479 -16.429 -0.287 1.00 0.00 C ATOM 658 CE1 TYR A 40 33.873 -16.764 2.473 1.00 0.00 C ATOM 659 CE2 TYR A 40 32.539 -15.914 0.619 1.00 0.00 C ATOM 660 CZ TYR A 40 32.737 -16.080 2.004 1.00 0.00 C ATOM 661 OH TYR A 40 31.830 -15.582 2.893 1.00 0.00 O ATOM 0 H TYR A 40 36.121 -15.143 -1.943 1.00 0.00 H new ATOM 0 HA TYR A 40 37.473 -16.858 0.051 1.00 0.00 H new ATOM 0 HB2 TYR A 40 35.194 -17.701 -1.782 1.00 0.00 H new ATOM 0 HB3 TYR A 40 35.927 -18.643 -0.498 1.00 0.00 H new ATOM 0 HD1 TYR A 40 35.683 -17.796 1.921 1.00 0.00 H new ATOM 0 HD2 TYR A 40 33.326 -16.308 -1.349 1.00 0.00 H new ATOM 0 HE1 TYR A 40 34.024 -16.898 3.534 1.00 0.00 H new ATOM 0 HE2 TYR A 40 31.666 -15.392 0.256 1.00 0.00 H new ATOM 0 HH TYR A 40 31.105 -15.137 2.406 1.00 0.00 H new ATOM 671 N VAL A 41 37.997 -16.486 -3.070 1.00 0.00 N ATOM 672 CA VAL A 41 38.941 -16.826 -4.135 1.00 0.00 C ATOM 673 C VAL A 41 39.709 -15.595 -4.605 1.00 0.00 C ATOM 674 O VAL A 41 39.214 -14.474 -4.472 1.00 0.00 O ATOM 675 CB VAL A 41 38.246 -17.476 -5.339 1.00 0.00 C ATOM 676 CG1 VAL A 41 37.951 -18.947 -5.068 1.00 0.00 C ATOM 677 CG2 VAL A 41 36.948 -16.770 -5.717 1.00 0.00 C ATOM 0 H VAL A 41 37.470 -15.629 -3.238 1.00 0.00 H new ATOM 0 HA VAL A 41 39.637 -17.547 -3.708 1.00 0.00 H new ATOM 0 HB VAL A 41 38.939 -17.384 -6.176 1.00 0.00 H new ATOM 0 HG11 VAL A 41 37.458 -19.385 -5.936 1.00 0.00 H new ATOM 0 HG12 VAL A 41 38.884 -19.476 -4.875 1.00 0.00 H new ATOM 0 HG13 VAL A 41 37.299 -19.033 -4.199 1.00 0.00 H new ATOM 0 HG21 VAL A 41 36.498 -17.271 -6.574 1.00 0.00 H new ATOM 0 HG22 VAL A 41 36.257 -16.802 -4.874 1.00 0.00 H new ATOM 0 HG23 VAL A 41 37.160 -15.732 -5.973 1.00 0.00 H new ATOM 687 N PRO A 42 40.917 -15.789 -5.158 1.00 0.00 N ATOM 688 CA PRO A 42 41.707 -14.727 -5.760 1.00 0.00 C ATOM 689 C PRO A 42 40.947 -14.060 -6.901 1.00 0.00 C ATOM 690 O PRO A 42 40.056 -14.671 -7.493 1.00 0.00 O ATOM 691 CB PRO A 42 42.974 -15.402 -6.294 1.00 0.00 C ATOM 692 CG PRO A 42 43.078 -16.687 -5.474 1.00 0.00 C ATOM 693 CD PRO A 42 41.620 -17.057 -5.235 1.00 0.00 C ATOM 0 HA PRO A 42 41.935 -13.947 -5.034 1.00 0.00 H new ATOM 0 HB2 PRO A 42 42.895 -15.614 -7.360 1.00 0.00 H new ATOM 0 HB3 PRO A 42 43.851 -14.769 -6.159 1.00 0.00 H new ATOM 0 HG2 PRO A 42 43.610 -17.470 -6.015 1.00 0.00 H new ATOM 0 HG3 PRO A 42 43.613 -16.527 -4.538 1.00 0.00 H new ATOM 0 HD2 PRO A 42 41.232 -17.675 -6.045 1.00 0.00 H new ATOM 0 HD3 PRO A 42 41.504 -17.629 -4.314 1.00 0.00 H new ATOM 701 N SER A 43 41.297 -12.811 -7.219 1.00 0.00 N ATOM 702 CA SER A 43 40.631 -12.060 -8.275 1.00 0.00 C ATOM 703 C SER A 43 40.801 -12.728 -9.638 1.00 0.00 C ATOM 704 O SER A 43 40.051 -12.432 -10.566 1.00 0.00 O ATOM 705 CB SER A 43 41.199 -10.643 -8.306 1.00 0.00 C ATOM 706 OG SER A 43 42.590 -10.683 -8.552 1.00 0.00 O ATOM 0 H SER A 43 42.046 -12.299 -6.753 1.00 0.00 H new ATOM 0 HA SER A 43 39.562 -12.032 -8.062 1.00 0.00 H new ATOM 0 HB2 SER A 43 40.701 -10.060 -9.081 1.00 0.00 H new ATOM 0 HB3 SER A 43 41.004 -10.144 -7.357 1.00 0.00 H new ATOM 0 HG SER A 43 42.945 -9.770 -8.572 1.00 0.00 H new ATOM 712 N GLY A 44 41.783 -13.630 -9.764 1.00 0.00 N ATOM 713 CA GLY A 44 42.014 -14.369 -10.993 1.00 0.00 C ATOM 714 C GLY A 44 41.030 -15.527 -11.163 1.00 0.00 C ATOM 715 O GLY A 44 40.934 -16.087 -12.253 1.00 0.00 O ATOM 0 H GLY A 44 42.434 -13.861 -9.013 1.00 0.00 H new ATOM 0 HA2 GLY A 44 41.927 -13.693 -11.844 1.00 0.00 H new ATOM 0 HA3 GLY A 44 43.033 -14.756 -10.996 1.00 0.00 H new ATOM 719 N ASP A 45 40.296 -15.889 -10.105 1.00 0.00 N ATOM 720 CA ASP A 45 39.332 -16.981 -10.155 1.00 0.00 C ATOM 721 C ASP A 45 37.905 -16.492 -9.904 1.00 0.00 C ATOM 722 O ASP A 45 36.962 -17.274 -9.996 1.00 0.00 O ATOM 723 CB ASP A 45 39.747 -18.062 -9.158 1.00 0.00 C ATOM 724 CG ASP A 45 41.131 -18.617 -9.498 1.00 0.00 C ATOM 725 OD1 ASP A 45 41.272 -19.186 -10.604 1.00 0.00 O ATOM 726 OD2 ASP A 45 42.038 -18.469 -8.649 1.00 0.00 O ATOM 0 H ASP A 45 40.357 -15.432 -9.195 1.00 0.00 H new ATOM 0 HA ASP A 45 39.332 -17.407 -11.158 1.00 0.00 H new ATOM 0 HB2 ASP A 45 39.755 -17.648 -8.150 1.00 0.00 H new ATOM 0 HB3 ASP A 45 39.015 -18.870 -9.166 1.00 0.00 H new ATOM 731 N VAL A 46 37.731 -15.202 -9.589 1.00 0.00 N ATOM 732 CA VAL A 46 36.407 -14.631 -9.370 1.00 0.00 C ATOM 733 C VAL A 46 35.502 -14.796 -10.593 1.00 0.00 C ATOM 734 O VAL A 46 34.387 -15.283 -10.430 1.00 0.00 O ATOM 735 CB VAL A 46 36.530 -13.153 -8.968 1.00 0.00 C ATOM 736 CG1 VAL A 46 35.176 -12.439 -9.014 1.00 0.00 C ATOM 737 CG2 VAL A 46 37.058 -13.043 -7.538 1.00 0.00 C ATOM 0 H VAL A 46 38.497 -14.537 -9.481 1.00 0.00 H new ATOM 0 HA VAL A 46 35.937 -15.180 -8.554 1.00 0.00 H new ATOM 0 HB VAL A 46 37.212 -12.686 -9.678 1.00 0.00 H new ATOM 0 HG11 VAL A 46 35.304 -11.396 -8.723 1.00 0.00 H new ATOM 0 HG12 VAL A 46 34.774 -12.487 -10.026 1.00 0.00 H new ATOM 0 HG13 VAL A 46 34.485 -12.925 -8.326 1.00 0.00 H new ATOM 0 HG21 VAL A 46 37.142 -11.992 -7.261 1.00 0.00 H new ATOM 0 HG22 VAL A 46 36.370 -13.544 -6.857 1.00 0.00 H new ATOM 0 HG23 VAL A 46 38.039 -13.514 -7.475 1.00 0.00 H new ATOM 747 N PRO A 47 35.916 -14.418 -11.815 1.00 0.00 N ATOM 748 CA PRO A 47 35.027 -14.458 -12.966 1.00 0.00 C ATOM 749 C PRO A 47 34.643 -15.887 -13.347 1.00 0.00 C ATOM 750 O PRO A 47 33.608 -16.096 -13.981 1.00 0.00 O ATOM 751 CB PRO A 47 35.800 -13.771 -14.093 1.00 0.00 C ATOM 752 CG PRO A 47 37.261 -14.009 -13.714 1.00 0.00 C ATOM 753 CD PRO A 47 37.228 -13.915 -12.192 1.00 0.00 C ATOM 0 HA PRO A 47 34.083 -13.957 -12.753 1.00 0.00 H new ATOM 0 HB2 PRO A 47 35.561 -14.202 -15.065 1.00 0.00 H new ATOM 0 HB3 PRO A 47 35.567 -12.708 -14.150 1.00 0.00 H new ATOM 0 HG2 PRO A 47 37.614 -14.983 -14.053 1.00 0.00 H new ATOM 0 HG3 PRO A 47 37.921 -13.260 -14.152 1.00 0.00 H new ATOM 0 HD2 PRO A 47 38.023 -14.509 -11.742 1.00 0.00 H new ATOM 0 HD3 PRO A 47 37.369 -12.888 -11.856 1.00 0.00 H new ATOM 761 N ASP A 48 35.458 -16.878 -12.968 1.00 0.00 N ATOM 762 CA ASP A 48 35.163 -18.271 -13.271 1.00 0.00 C ATOM 763 C ASP A 48 34.224 -18.867 -12.222 1.00 0.00 C ATOM 764 O ASP A 48 33.413 -19.738 -12.535 1.00 0.00 O ATOM 765 CB ASP A 48 36.478 -19.054 -13.344 1.00 0.00 C ATOM 766 CG ASP A 48 36.234 -20.500 -13.764 1.00 0.00 C ATOM 767 OD1 ASP A 48 35.878 -20.705 -14.947 1.00 0.00 O ATOM 768 OD2 ASP A 48 36.407 -21.394 -12.907 1.00 0.00 O ATOM 0 H ASP A 48 36.326 -16.735 -12.451 1.00 0.00 H new ATOM 0 HA ASP A 48 34.655 -18.335 -14.233 1.00 0.00 H new ATOM 0 HB2 ASP A 48 37.151 -18.574 -14.054 1.00 0.00 H new ATOM 0 HB3 ASP A 48 36.972 -19.033 -12.373 1.00 0.00 H new ATOM 773 N VAL A 49 34.333 -18.398 -10.975 1.00 0.00 N ATOM 774 CA VAL A 49 33.493 -18.875 -9.885 1.00 0.00 C ATOM 775 C VAL A 49 32.139 -18.170 -9.912 1.00 0.00 C ATOM 776 O VAL A 49 31.140 -18.744 -9.484 1.00 0.00 O ATOM 777 CB VAL A 49 34.236 -18.661 -8.561 1.00 0.00 C ATOM 778 CG1 VAL A 49 33.338 -18.915 -7.351 1.00 0.00 C ATOM 779 CG2 VAL A 49 35.419 -19.626 -8.479 1.00 0.00 C ATOM 0 H VAL A 49 35.004 -17.681 -10.699 1.00 0.00 H new ATOM 0 HA VAL A 49 33.293 -19.941 -9.997 1.00 0.00 H new ATOM 0 HB VAL A 49 34.567 -17.623 -8.541 1.00 0.00 H new ATOM 0 HG11 VAL A 49 33.906 -18.751 -6.435 1.00 0.00 H new ATOM 0 HG12 VAL A 49 32.489 -18.232 -7.378 1.00 0.00 H new ATOM 0 HG13 VAL A 49 32.977 -19.943 -7.375 1.00 0.00 H new ATOM 0 HG21 VAL A 49 35.948 -19.474 -7.538 1.00 0.00 H new ATOM 0 HG22 VAL A 49 35.056 -20.652 -8.530 1.00 0.00 H new ATOM 0 HG23 VAL A 49 36.098 -19.440 -9.311 1.00 0.00 H new ATOM 789 N VAL A 50 32.093 -16.932 -10.411 1.00 0.00 N ATOM 790 CA VAL A 50 30.834 -16.215 -10.568 1.00 0.00 C ATOM 791 C VAL A 50 30.018 -16.849 -11.689 1.00 0.00 C ATOM 792 O VAL A 50 28.799 -16.959 -11.581 1.00 0.00 O ATOM 793 CB VAL A 50 31.109 -14.746 -10.898 1.00 0.00 C ATOM 794 CG1 VAL A 50 29.842 -14.062 -11.405 1.00 0.00 C ATOM 795 CG2 VAL A 50 31.605 -14.008 -9.656 1.00 0.00 C ATOM 0 H VAL A 50 32.915 -16.409 -10.712 1.00 0.00 H new ATOM 0 HA VAL A 50 30.272 -16.272 -9.636 1.00 0.00 H new ATOM 0 HB VAL A 50 31.873 -14.714 -11.675 1.00 0.00 H new ATOM 0 HG11 VAL A 50 30.059 -13.019 -11.634 1.00 0.00 H new ATOM 0 HG12 VAL A 50 29.492 -14.566 -12.306 1.00 0.00 H new ATOM 0 HG13 VAL A 50 29.069 -14.112 -10.638 1.00 0.00 H new ATOM 0 HG21 VAL A 50 31.797 -12.964 -9.905 1.00 0.00 H new ATOM 0 HG22 VAL A 50 30.847 -14.061 -8.874 1.00 0.00 H new ATOM 0 HG23 VAL A 50 32.526 -14.471 -9.301 1.00 0.00 H new ATOM 805 N GLN A 51 30.684 -17.270 -12.765 1.00 0.00 N ATOM 806 CA GLN A 51 29.982 -17.847 -13.895 1.00 0.00 C ATOM 807 C GLN A 51 29.450 -19.234 -13.537 1.00 0.00 C ATOM 808 O GLN A 51 28.446 -19.674 -14.085 1.00 0.00 O ATOM 809 CB GLN A 51 30.927 -17.889 -15.097 1.00 0.00 C ATOM 810 CG GLN A 51 30.157 -18.059 -16.405 1.00 0.00 C ATOM 811 CD GLN A 51 29.194 -16.900 -16.638 1.00 0.00 C ATOM 812 OE1 GLN A 51 27.989 -17.098 -16.753 1.00 0.00 O ATOM 813 NE2 GLN A 51 29.718 -15.678 -16.707 1.00 0.00 N ATOM 0 H GLN A 51 31.697 -17.220 -12.871 1.00 0.00 H new ATOM 0 HA GLN A 51 29.120 -17.233 -14.155 1.00 0.00 H new ATOM 0 HB2 GLN A 51 31.512 -16.970 -15.134 1.00 0.00 H new ATOM 0 HB3 GLN A 51 31.632 -18.711 -14.979 1.00 0.00 H new ATOM 0 HG2 GLN A 51 30.859 -18.124 -17.236 1.00 0.00 H new ATOM 0 HG3 GLN A 51 29.602 -18.997 -16.383 1.00 0.00 H new ATOM 0 HE21 GLN A 51 30.725 -15.548 -16.607 1.00 0.00 H new ATOM 0 HE22 GLN A 51 29.113 -14.871 -16.860 1.00 0.00 H new ATOM 822 N GLU A 52 30.117 -19.928 -12.613 1.00 0.00 N ATOM 823 CA GLU A 52 29.649 -21.226 -12.152 1.00 0.00 C ATOM 824 C GLU A 52 28.504 -21.052 -11.154 1.00 0.00 C ATOM 825 O GLU A 52 27.681 -21.954 -10.989 1.00 0.00 O ATOM 826 CB GLU A 52 30.829 -21.981 -11.539 1.00 0.00 C ATOM 827 CG GLU A 52 30.437 -23.415 -11.180 1.00 0.00 C ATOM 828 CD GLU A 52 31.662 -24.227 -10.766 1.00 0.00 C ATOM 829 OE1 GLU A 52 32.056 -24.126 -9.584 1.00 0.00 O ATOM 830 OE2 GLU A 52 32.202 -24.946 -11.639 1.00 0.00 O ATOM 0 H GLU A 52 30.980 -19.610 -12.173 1.00 0.00 H new ATOM 0 HA GLU A 52 29.258 -21.807 -12.987 1.00 0.00 H new ATOM 0 HB2 GLU A 52 31.662 -21.993 -12.242 1.00 0.00 H new ATOM 0 HB3 GLU A 52 31.174 -21.460 -10.646 1.00 0.00 H new ATOM 0 HG2 GLU A 52 29.711 -23.405 -10.367 1.00 0.00 H new ATOM 0 HG3 GLU A 52 29.953 -23.889 -12.034 1.00 0.00 H new ATOM 837 N ALA A 53 28.440 -19.897 -10.485 1.00 0.00 N ATOM 838 CA ALA A 53 27.408 -19.633 -9.496 1.00 0.00 C ATOM 839 C ALA A 53 26.079 -19.280 -10.164 1.00 0.00 C ATOM 840 O ALA A 53 25.019 -19.575 -9.613 1.00 0.00 O ATOM 841 CB ALA A 53 27.877 -18.498 -8.583 1.00 0.00 C ATOM 0 H ALA A 53 29.099 -19.129 -10.617 1.00 0.00 H new ATOM 0 HA ALA A 53 27.241 -20.533 -8.904 1.00 0.00 H new ATOM 0 HB1 ALA A 53 27.110 -18.291 -7.836 1.00 0.00 H new ATOM 0 HB2 ALA A 53 28.800 -18.791 -8.083 1.00 0.00 H new ATOM 0 HB3 ALA A 53 28.055 -17.602 -9.178 1.00 0.00 H new ATOM 847 N PHE A 54 26.119 -18.657 -11.347 1.00 0.00 N ATOM 848 CA PHE A 54 24.898 -18.334 -12.069 1.00 0.00 C ATOM 849 C PHE A 54 24.373 -19.553 -12.820 1.00 0.00 C ATOM 850 O PHE A 54 23.162 -19.717 -12.937 1.00 0.00 O ATOM 851 CB PHE A 54 25.137 -17.169 -13.034 1.00 0.00 C ATOM 852 CG PHE A 54 25.179 -15.805 -12.377 1.00 0.00 C ATOM 853 CD1 PHE A 54 24.060 -15.329 -11.677 1.00 0.00 C ATOM 854 CD2 PHE A 54 26.327 -15.007 -12.477 1.00 0.00 C ATOM 855 CE1 PHE A 54 24.086 -14.057 -11.089 1.00 0.00 C ATOM 856 CE2 PHE A 54 26.351 -13.734 -11.892 1.00 0.00 C ATOM 857 CZ PHE A 54 25.230 -13.258 -11.199 1.00 0.00 C ATOM 0 H PHE A 54 26.979 -18.371 -11.816 1.00 0.00 H new ATOM 0 HA PHE A 54 24.143 -18.032 -11.343 1.00 0.00 H new ATOM 0 HB2 PHE A 54 26.079 -17.335 -13.557 1.00 0.00 H new ATOM 0 HB3 PHE A 54 24.349 -17.171 -13.787 1.00 0.00 H new ATOM 0 HD1 PHE A 54 23.177 -15.944 -11.591 1.00 0.00 H new ATOM 0 HD2 PHE A 54 27.194 -15.374 -13.006 1.00 0.00 H new ATOM 0 HE1 PHE A 54 23.223 -13.693 -10.551 1.00 0.00 H new ATOM 0 HE2 PHE A 54 27.235 -13.119 -11.975 1.00 0.00 H new ATOM 0 HZ PHE A 54 25.249 -12.276 -10.750 1.00 0.00 H new ATOM 867 N ILE A 55 25.254 -20.417 -13.332 1.00 0.00 N ATOM 868 CA ILE A 55 24.800 -21.609 -14.037 1.00 0.00 C ATOM 869 C ILE A 55 24.233 -22.631 -13.051 1.00 0.00 C ATOM 870 O ILE A 55 23.344 -23.400 -13.413 1.00 0.00 O ATOM 871 CB ILE A 55 25.953 -22.164 -14.885 1.00 0.00 C ATOM 872 CG1 ILE A 55 25.938 -21.554 -16.292 1.00 0.00 C ATOM 873 CG2 ILE A 55 25.840 -23.682 -15.045 1.00 0.00 C ATOM 874 CD1 ILE A 55 25.919 -20.023 -16.311 1.00 0.00 C ATOM 0 H ILE A 55 26.267 -20.313 -13.271 1.00 0.00 H new ATOM 0 HA ILE A 55 23.985 -21.359 -14.716 1.00 0.00 H new ATOM 0 HB ILE A 55 26.876 -21.907 -14.366 1.00 0.00 H new ATOM 0 HG12 ILE A 55 26.816 -21.902 -16.836 1.00 0.00 H new ATOM 0 HG13 ILE A 55 25.063 -21.924 -16.827 1.00 0.00 H new ATOM 0 HG21 ILE A 55 26.670 -24.047 -15.650 1.00 0.00 H new ATOM 0 HG22 ILE A 55 25.871 -24.155 -14.063 1.00 0.00 H new ATOM 0 HG23 ILE A 55 24.898 -23.927 -15.536 1.00 0.00 H new ATOM 0 HD11 ILE A 55 25.909 -19.672 -17.343 1.00 0.00 H new ATOM 0 HD12 ILE A 55 25.027 -19.664 -15.797 1.00 0.00 H new ATOM 0 HD13 ILE A 55 26.807 -19.642 -15.807 1.00 0.00 H new ATOM 886 N LYS A 56 24.727 -22.652 -11.808 1.00 0.00 N ATOM 887 CA LYS A 56 24.173 -23.537 -10.792 1.00 0.00 C ATOM 888 C LYS A 56 22.816 -23.005 -10.343 1.00 0.00 C ATOM 889 O LYS A 56 21.928 -23.781 -9.996 1.00 0.00 O ATOM 890 CB LYS A 56 25.152 -23.630 -9.620 1.00 0.00 C ATOM 891 CG LYS A 56 24.691 -24.620 -8.546 1.00 0.00 C ATOM 892 CD LYS A 56 24.515 -26.036 -9.102 1.00 0.00 C ATOM 893 CE LYS A 56 24.127 -27.021 -7.998 1.00 0.00 C ATOM 894 NZ LYS A 56 25.168 -27.129 -6.956 1.00 0.00 N ATOM 0 H LYS A 56 25.502 -22.070 -11.489 1.00 0.00 H new ATOM 0 HA LYS A 56 24.027 -24.538 -11.198 1.00 0.00 H new ATOM 0 HB2 LYS A 56 26.131 -23.933 -9.992 1.00 0.00 H new ATOM 0 HB3 LYS A 56 25.272 -22.643 -9.172 1.00 0.00 H new ATOM 0 HG2 LYS A 56 25.419 -24.638 -7.735 1.00 0.00 H new ATOM 0 HG3 LYS A 56 23.747 -24.279 -8.121 1.00 0.00 H new ATOM 0 HD2 LYS A 56 23.747 -26.033 -9.876 1.00 0.00 H new ATOM 0 HD3 LYS A 56 25.442 -26.362 -9.574 1.00 0.00 H new ATOM 0 HE2 LYS A 56 23.190 -26.702 -7.541 1.00 0.00 H new ATOM 0 HE3 LYS A 56 23.950 -28.003 -8.436 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 24.991 -27.973 -6.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 26.102 -27.208 -7.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 25.144 -26.282 -6.353 1.00 0.00 H new ATOM 908 N ALA A 57 22.654 -21.681 -10.352 1.00 0.00 N ATOM 909 CA ALA A 57 21.388 -21.067 -10.001 1.00 0.00 C ATOM 910 C ALA A 57 20.391 -21.246 -11.143 1.00 0.00 C ATOM 911 O ALA A 57 19.205 -21.416 -10.892 1.00 0.00 O ATOM 912 CB ALA A 57 21.619 -19.590 -9.697 1.00 0.00 C ATOM 0 H ALA A 57 23.389 -21.019 -10.600 1.00 0.00 H new ATOM 0 HA ALA A 57 20.972 -21.546 -9.115 1.00 0.00 H new ATOM 0 HB1 ALA A 57 20.672 -19.121 -9.432 1.00 0.00 H new ATOM 0 HB2 ALA A 57 22.317 -19.495 -8.865 1.00 0.00 H new ATOM 0 HB3 ALA A 57 22.034 -19.098 -10.577 1.00 0.00 H new ATOM 918 N TYR A 58 20.851 -21.209 -12.396 1.00 0.00 N ATOM 919 CA TYR A 58 19.969 -21.311 -13.549 1.00 0.00 C ATOM 920 C TYR A 58 19.221 -22.640 -13.565 1.00 0.00 C ATOM 921 O TYR A 58 18.049 -22.688 -13.937 1.00 0.00 O ATOM 922 CB TYR A 58 20.803 -21.185 -14.823 1.00 0.00 C ATOM 923 CG TYR A 58 19.987 -21.356 -16.083 1.00 0.00 C ATOM 924 CD1 TYR A 58 19.112 -20.346 -16.496 1.00 0.00 C ATOM 925 CD2 TYR A 58 20.109 -22.535 -16.834 1.00 0.00 C ATOM 926 CE1 TYR A 58 18.345 -20.510 -17.660 1.00 0.00 C ATOM 927 CE2 TYR A 58 19.349 -22.708 -18.002 1.00 0.00 C ATOM 928 CZ TYR A 58 18.461 -21.693 -18.418 1.00 0.00 C ATOM 929 OH TYR A 58 17.723 -21.859 -19.551 1.00 0.00 O ATOM 0 H TYR A 58 21.838 -21.108 -12.633 1.00 0.00 H new ATOM 0 HA TYR A 58 19.232 -20.510 -13.491 1.00 0.00 H new ATOM 0 HB2 TYR A 58 21.286 -20.208 -14.839 1.00 0.00 H new ATOM 0 HB3 TYR A 58 21.596 -21.932 -14.807 1.00 0.00 H new ATOM 0 HD1 TYR A 58 19.026 -19.438 -15.918 1.00 0.00 H new ATOM 0 HD2 TYR A 58 20.789 -23.311 -16.513 1.00 0.00 H new ATOM 0 HE1 TYR A 58 17.667 -19.731 -17.975 1.00 0.00 H new ATOM 0 HE2 TYR A 58 19.444 -23.615 -18.580 1.00 0.00 H new ATOM 0 HH TYR A 58 17.927 -22.731 -19.950 1.00 0.00 H new ATOM 939 N ARG A 59 19.892 -23.721 -13.158 1.00 0.00 N ATOM 940 CA ARG A 59 19.299 -25.054 -13.153 1.00 0.00 C ATOM 941 C ARG A 59 18.610 -25.387 -11.831 1.00 0.00 C ATOM 942 O ARG A 59 17.914 -26.398 -11.752 1.00 0.00 O ATOM 943 CB ARG A 59 20.359 -26.090 -13.528 1.00 0.00 C ATOM 944 CG ARG A 59 21.488 -26.146 -12.499 1.00 0.00 C ATOM 945 CD ARG A 59 22.615 -27.044 -13.009 1.00 0.00 C ATOM 946 NE ARG A 59 22.163 -28.431 -13.191 1.00 0.00 N ATOM 947 CZ ARG A 59 22.106 -29.337 -12.210 1.00 0.00 C ATOM 948 NH1 ARG A 59 22.463 -29.023 -10.967 1.00 0.00 N ATOM 949 NH2 ARG A 59 21.689 -30.573 -12.470 1.00 0.00 N ATOM 0 H ARG A 59 20.856 -23.694 -12.825 1.00 0.00 H new ATOM 0 HA ARG A 59 18.509 -25.076 -13.904 1.00 0.00 H new ATOM 0 HB2 ARG A 59 19.894 -27.072 -13.611 1.00 0.00 H new ATOM 0 HB3 ARG A 59 20.772 -25.849 -14.508 1.00 0.00 H new ATOM 0 HG2 ARG A 59 21.869 -25.142 -12.310 1.00 0.00 H new ATOM 0 HG3 ARG A 59 21.109 -26.527 -11.551 1.00 0.00 H new ATOM 0 HD2 ARG A 59 22.990 -26.656 -13.956 1.00 0.00 H new ATOM 0 HD3 ARG A 59 23.446 -27.021 -12.304 1.00 0.00 H new ATOM 0 HE ARG A 59 21.874 -28.720 -14.126 1.00 0.00 H new ATOM 0 HH11 ARG A 59 22.786 -28.080 -10.752 1.00 0.00 H new ATOM 0 HH12 ARG A 59 22.414 -29.726 -10.229 1.00 0.00 H new ATOM 0 HH21 ARG A 59 21.413 -30.829 -13.418 1.00 0.00 H new ATOM 0 HH22 ARG A 59 21.645 -31.265 -11.722 1.00 0.00 H new ATOM 963 N ALA A 60 18.794 -24.556 -10.800 1.00 0.00 N ATOM 964 CA ALA A 60 18.143 -24.760 -9.515 1.00 0.00 C ATOM 965 C ALA A 60 17.052 -23.720 -9.233 1.00 0.00 C ATOM 966 O ALA A 60 16.334 -23.830 -8.236 1.00 0.00 O ATOM 967 CB ALA A 60 19.209 -24.757 -8.419 1.00 0.00 C ATOM 0 H ALA A 60 19.394 -23.732 -10.838 1.00 0.00 H new ATOM 0 HA ALA A 60 17.634 -25.724 -9.536 1.00 0.00 H new ATOM 0 HB1 ALA A 60 18.735 -24.909 -7.450 1.00 0.00 H new ATOM 0 HB2 ALA A 60 19.923 -25.560 -8.604 1.00 0.00 H new ATOM 0 HB3 ALA A 60 19.731 -23.800 -8.421 1.00 0.00 H new ATOM 973 N LEU A 61 16.917 -22.709 -10.098 1.00 0.00 N ATOM 974 CA LEU A 61 15.966 -21.617 -9.909 1.00 0.00 C ATOM 975 C LEU A 61 14.534 -22.082 -10.169 1.00 0.00 C ATOM 976 O LEU A 61 13.587 -21.475 -9.669 1.00 0.00 O ATOM 977 CB LEU A 61 16.418 -20.450 -10.797 1.00 0.00 C ATOM 978 CG LEU A 61 15.478 -19.245 -10.825 1.00 0.00 C ATOM 979 CD1 LEU A 61 16.300 -18.011 -11.186 1.00 0.00 C ATOM 980 CD2 LEU A 61 14.403 -19.415 -11.897 1.00 0.00 C ATOM 0 H LEU A 61 17.469 -22.628 -10.952 1.00 0.00 H new ATOM 0 HA LEU A 61 15.956 -21.274 -8.875 1.00 0.00 H new ATOM 0 HB2 LEU A 61 17.399 -20.116 -10.458 1.00 0.00 H new ATOM 0 HB3 LEU A 61 16.541 -20.817 -11.816 1.00 0.00 H new ATOM 0 HG LEU A 61 15.001 -19.149 -9.850 1.00 0.00 H new ATOM 0 HD11 LEU A 61 15.650 -17.136 -11.212 1.00 0.00 H new ATOM 0 HD12 LEU A 61 17.080 -17.862 -10.439 1.00 0.00 H new ATOM 0 HD13 LEU A 61 16.758 -18.153 -12.165 1.00 0.00 H new ATOM 0 HD21 LEU A 61 13.747 -18.544 -11.896 1.00 0.00 H new ATOM 0 HD22 LEU A 61 14.876 -19.512 -12.874 1.00 0.00 H new ATOM 0 HD23 LEU A 61 13.818 -20.310 -11.687 1.00 0.00 H new ATOM 992 N ASP A 62 14.358 -23.159 -10.944 1.00 0.00 N ATOM 993 CA ASP A 62 13.037 -23.726 -11.199 1.00 0.00 C ATOM 994 C ASP A 62 12.474 -24.371 -9.929 1.00 0.00 C ATOM 995 O ASP A 62 11.302 -24.734 -9.882 1.00 0.00 O ATOM 996 CB ASP A 62 13.162 -24.747 -12.329 1.00 0.00 C ATOM 997 CG ASP A 62 11.813 -25.367 -12.684 1.00 0.00 C ATOM 998 OD1 ASP A 62 10.903 -24.600 -13.074 1.00 0.00 O ATOM 999 OD2 ASP A 62 11.701 -26.609 -12.560 1.00 0.00 O ATOM 0 H ASP A 62 15.121 -23.654 -11.406 1.00 0.00 H new ATOM 0 HA ASP A 62 12.343 -22.940 -11.495 1.00 0.00 H new ATOM 0 HB2 ASP A 62 13.583 -24.264 -13.211 1.00 0.00 H new ATOM 0 HB3 ASP A 62 13.857 -25.533 -12.034 1.00 0.00 H new ATOM 1004 N SER A 63 13.314 -24.508 -8.894 1.00 0.00 N ATOM 1005 CA SER A 63 12.929 -25.067 -7.604 1.00 0.00 C ATOM 1006 C SER A 63 12.888 -23.980 -6.528 1.00 0.00 C ATOM 1007 O SER A 63 12.709 -24.284 -5.351 1.00 0.00 O ATOM 1008 CB SER A 63 13.892 -26.190 -7.215 1.00 0.00 C ATOM 1009 OG SER A 63 13.863 -27.211 -8.192 1.00 0.00 O ATOM 0 H SER A 63 14.294 -24.227 -8.937 1.00 0.00 H new ATOM 0 HA SER A 63 11.925 -25.484 -7.688 1.00 0.00 H new ATOM 0 HB2 SER A 63 14.904 -25.796 -7.119 1.00 0.00 H new ATOM 0 HB3 SER A 63 13.615 -26.598 -6.243 1.00 0.00 H new ATOM 0 HG SER A 63 14.483 -27.926 -7.937 1.00 0.00 H new ATOM 1015 N PHE A 64 13.055 -22.712 -6.920 1.00 0.00 N ATOM 1016 CA PHE A 64 13.016 -21.600 -5.986 1.00 0.00 C ATOM 1017 C PHE A 64 11.596 -21.447 -5.441 1.00 0.00 C ATOM 1018 O PHE A 64 10.630 -21.450 -6.202 1.00 0.00 O ATOM 1019 CB PHE A 64 13.489 -20.331 -6.702 1.00 0.00 C ATOM 1020 CG PHE A 64 13.519 -19.100 -5.832 1.00 0.00 C ATOM 1021 CD1 PHE A 64 14.404 -19.024 -4.749 1.00 0.00 C ATOM 1022 CD2 PHE A 64 12.662 -18.025 -6.112 1.00 0.00 C ATOM 1023 CE1 PHE A 64 14.439 -17.873 -3.952 1.00 0.00 C ATOM 1024 CE2 PHE A 64 12.704 -16.870 -5.321 1.00 0.00 C ATOM 1025 CZ PHE A 64 13.594 -16.792 -4.239 1.00 0.00 C ATOM 0 H PHE A 64 13.219 -22.437 -7.888 1.00 0.00 H new ATOM 0 HA PHE A 64 13.681 -21.783 -5.142 1.00 0.00 H new ATOM 0 HB2 PHE A 64 14.489 -20.504 -7.100 1.00 0.00 H new ATOM 0 HB3 PHE A 64 12.835 -20.144 -7.554 1.00 0.00 H new ATOM 0 HD1 PHE A 64 15.060 -19.853 -4.528 1.00 0.00 H new ATOM 0 HD2 PHE A 64 11.969 -18.088 -6.938 1.00 0.00 H new ATOM 0 HE1 PHE A 64 15.119 -17.818 -3.114 1.00 0.00 H new ATOM 0 HE2 PHE A 64 12.051 -16.039 -5.544 1.00 0.00 H new ATOM 0 HZ PHE A 64 13.628 -15.901 -3.629 1.00 0.00 H new ATOM 1035 N ARG A 65 11.468 -21.317 -4.115 1.00 0.00 N ATOM 1036 CA ARG A 65 10.172 -21.260 -3.450 1.00 0.00 C ATOM 1037 C ARG A 65 9.752 -19.832 -3.114 1.00 0.00 C ATOM 1038 O ARG A 65 8.577 -19.591 -2.836 1.00 0.00 O ATOM 1039 CB ARG A 65 10.208 -22.113 -2.182 1.00 0.00 C ATOM 1040 CG ARG A 65 10.487 -23.581 -2.511 1.00 0.00 C ATOM 1041 CD ARG A 65 10.431 -24.430 -1.241 1.00 0.00 C ATOM 1042 NE ARG A 65 11.439 -24.000 -0.266 1.00 0.00 N ATOM 1043 CZ ARG A 65 12.665 -24.521 -0.165 1.00 0.00 C ATOM 1044 NH1 ARG A 65 13.061 -25.502 -0.971 1.00 0.00 N ATOM 1045 NH2 ARG A 65 13.507 -24.058 0.753 1.00 0.00 N ATOM 0 H ARG A 65 12.262 -21.249 -3.479 1.00 0.00 H new ATOM 0 HA ARG A 65 9.429 -21.655 -4.142 1.00 0.00 H new ATOM 0 HB2 ARG A 65 10.978 -21.736 -1.508 1.00 0.00 H new ATOM 0 HB3 ARG A 65 9.256 -22.030 -1.657 1.00 0.00 H new ATOM 0 HG2 ARG A 65 9.755 -23.945 -3.232 1.00 0.00 H new ATOM 0 HG3 ARG A 65 11.468 -23.676 -2.977 1.00 0.00 H new ATOM 0 HD2 ARG A 65 9.438 -24.358 -0.797 1.00 0.00 H new ATOM 0 HD3 ARG A 65 10.591 -25.478 -1.494 1.00 0.00 H new ATOM 0 HE ARG A 65 11.186 -23.252 0.379 1.00 0.00 H new ATOM 0 HH11 ARG A 65 12.425 -25.868 -1.680 1.00 0.00 H new ATOM 0 HH12 ARG A 65 14.001 -25.889 -0.880 1.00 0.00 H new ATOM 0 HH21 ARG A 65 13.217 -23.306 1.379 1.00 0.00 H new ATOM 0 HH22 ARG A 65 14.444 -24.454 0.832 1.00 0.00 H new ATOM 1059 N GLY A 66 10.690 -18.881 -3.137 1.00 0.00 N ATOM 1060 CA GLY A 66 10.374 -17.494 -2.834 1.00 0.00 C ATOM 1061 C GLY A 66 10.226 -17.276 -1.334 1.00 0.00 C ATOM 1062 O GLY A 66 9.580 -16.320 -0.910 1.00 0.00 O ATOM 0 H GLY A 66 11.670 -19.052 -3.362 1.00 0.00 H new ATOM 0 HA2 GLY A 66 11.160 -16.846 -3.222 1.00 0.00 H new ATOM 0 HA3 GLY A 66 9.450 -17.211 -3.338 1.00 0.00 H new ATOM 1066 N ASP A 67 10.820 -18.164 -0.525 1.00 0.00 N ATOM 1067 CA ASP A 67 10.765 -18.076 0.927 1.00 0.00 C ATOM 1068 C ASP A 67 11.562 -16.870 1.436 1.00 0.00 C ATOM 1069 O ASP A 67 11.492 -16.535 2.616 1.00 0.00 O ATOM 1070 CB ASP A 67 11.314 -19.379 1.519 1.00 0.00 C ATOM 1071 CG ASP A 67 10.353 -20.555 1.355 1.00 0.00 C ATOM 1072 OD1 ASP A 67 9.125 -20.323 1.399 1.00 0.00 O ATOM 1073 OD2 ASP A 67 10.868 -21.683 1.191 1.00 0.00 O ATOM 0 H ASP A 67 11.352 -18.964 -0.868 1.00 0.00 H new ATOM 0 HA ASP A 67 9.731 -17.936 1.242 1.00 0.00 H new ATOM 0 HB2 ASP A 67 12.262 -19.620 1.038 1.00 0.00 H new ATOM 0 HB3 ASP A 67 11.523 -19.232 2.579 1.00 0.00 H new ATOM 1078 N SER A 68 12.315 -16.221 0.542 1.00 0.00 N ATOM 1079 CA SER A 68 13.069 -15.012 0.837 1.00 0.00 C ATOM 1080 C SER A 68 13.326 -14.261 -0.467 1.00 0.00 C ATOM 1081 O SER A 68 13.009 -14.757 -1.547 1.00 0.00 O ATOM 1082 CB SER A 68 14.384 -15.395 1.523 1.00 0.00 C ATOM 1083 OG SER A 68 15.164 -14.248 1.780 1.00 0.00 O ATOM 0 H SER A 68 12.415 -16.533 -0.424 1.00 0.00 H new ATOM 0 HA SER A 68 12.508 -14.362 1.509 1.00 0.00 H new ATOM 0 HB2 SER A 68 14.174 -15.915 2.458 1.00 0.00 H new ATOM 0 HB3 SER A 68 14.942 -16.086 0.891 1.00 0.00 H new ATOM 0 HG SER A 68 15.321 -14.168 2.744 1.00 0.00 H new ATOM 1089 N ALA A 69 13.904 -13.062 -0.373 1.00 0.00 N ATOM 1090 CA ALA A 69 14.304 -12.296 -1.543 1.00 0.00 C ATOM 1091 C ALA A 69 15.296 -13.109 -2.378 1.00 0.00 C ATOM 1092 O ALA A 69 15.986 -13.989 -1.862 1.00 0.00 O ATOM 1093 CB ALA A 69 14.922 -10.971 -1.096 1.00 0.00 C ATOM 0 H ALA A 69 14.105 -12.601 0.514 1.00 0.00 H new ATOM 0 HA ALA A 69 13.432 -12.082 -2.161 1.00 0.00 H new ATOM 0 HB1 ALA A 69 15.222 -10.396 -1.972 1.00 0.00 H new ATOM 0 HB2 ALA A 69 14.189 -10.403 -0.523 1.00 0.00 H new ATOM 0 HB3 ALA A 69 15.795 -11.168 -0.475 1.00 0.00 H new ATOM 1099 N PHE A 70 15.374 -12.822 -3.678 1.00 0.00 N ATOM 1100 CA PHE A 70 16.177 -13.639 -4.575 1.00 0.00 C ATOM 1101 C PHE A 70 17.664 -13.591 -4.229 1.00 0.00 C ATOM 1102 O PHE A 70 18.362 -14.586 -4.411 1.00 0.00 O ATOM 1103 CB PHE A 70 15.967 -13.177 -6.016 1.00 0.00 C ATOM 1104 CG PHE A 70 16.757 -14.017 -6.996 1.00 0.00 C ATOM 1105 CD1 PHE A 70 16.427 -15.368 -7.186 1.00 0.00 C ATOM 1106 CD2 PHE A 70 17.824 -13.450 -7.704 1.00 0.00 C ATOM 1107 CE1 PHE A 70 17.168 -16.147 -8.081 1.00 0.00 C ATOM 1108 CE2 PHE A 70 18.560 -14.230 -8.606 1.00 0.00 C ATOM 1109 CZ PHE A 70 18.237 -15.580 -8.790 1.00 0.00 C ATOM 0 H PHE A 70 14.896 -12.039 -4.125 1.00 0.00 H new ATOM 0 HA PHE A 70 15.849 -14.672 -4.459 1.00 0.00 H new ATOM 0 HB2 PHE A 70 14.907 -13.230 -6.264 1.00 0.00 H new ATOM 0 HB3 PHE A 70 16.265 -12.133 -6.110 1.00 0.00 H new ATOM 0 HD1 PHE A 70 15.603 -15.805 -6.642 1.00 0.00 H new ATOM 0 HD2 PHE A 70 18.080 -12.411 -7.555 1.00 0.00 H new ATOM 0 HE1 PHE A 70 16.916 -17.187 -8.226 1.00 0.00 H new ATOM 0 HE2 PHE A 70 19.376 -13.790 -9.159 1.00 0.00 H new ATOM 0 HZ PHE A 70 18.811 -16.184 -9.477 1.00 0.00 H new ATOM 1119 N TYR A 71 18.166 -12.457 -3.730 1.00 0.00 N ATOM 1120 CA TYR A 71 19.590 -12.353 -3.450 1.00 0.00 C ATOM 1121 C TYR A 71 19.967 -13.134 -2.195 1.00 0.00 C ATOM 1122 O TYR A 71 21.125 -13.513 -2.037 1.00 0.00 O ATOM 1123 CB TYR A 71 20.011 -10.891 -3.309 1.00 0.00 C ATOM 1124 CG TYR A 71 21.511 -10.746 -3.179 1.00 0.00 C ATOM 1125 CD1 TYR A 71 22.320 -10.849 -4.322 1.00 0.00 C ATOM 1126 CD2 TYR A 71 22.096 -10.522 -1.924 1.00 0.00 C ATOM 1127 CE1 TYR A 71 23.712 -10.725 -4.216 1.00 0.00 C ATOM 1128 CE2 TYR A 71 23.486 -10.378 -1.812 1.00 0.00 C ATOM 1129 CZ TYR A 71 24.299 -10.494 -2.955 1.00 0.00 C ATOM 1130 OH TYR A 71 25.652 -10.388 -2.833 1.00 0.00 O ATOM 0 H TYR A 71 17.620 -11.622 -3.518 1.00 0.00 H new ATOM 0 HA TYR A 71 20.123 -12.790 -4.295 1.00 0.00 H new ATOM 0 HB2 TYR A 71 19.666 -10.329 -4.176 1.00 0.00 H new ATOM 0 HB3 TYR A 71 19.527 -10.457 -2.434 1.00 0.00 H new ATOM 0 HD1 TYR A 71 21.868 -11.025 -5.287 1.00 0.00 H new ATOM 0 HD2 TYR A 71 21.475 -10.460 -1.043 1.00 0.00 H new ATOM 0 HE1 TYR A 71 24.332 -10.806 -5.096 1.00 0.00 H new ATOM 0 HE2 TYR A 71 23.933 -10.178 -0.849 1.00 0.00 H new ATOM 0 HH TYR A 71 25.884 -10.228 -1.894 1.00 0.00 H new ATOM 1140 N THR A 72 19.014 -13.393 -1.296 1.00 0.00 N ATOM 1141 CA THR A 72 19.306 -14.148 -0.088 1.00 0.00 C ATOM 1142 C THR A 72 19.630 -15.590 -0.466 1.00 0.00 C ATOM 1143 O THR A 72 20.457 -16.243 0.170 1.00 0.00 O ATOM 1144 CB THR A 72 18.097 -14.105 0.845 1.00 0.00 C ATOM 1145 OG1 THR A 72 17.641 -12.777 0.986 1.00 0.00 O ATOM 1146 CG2 THR A 72 18.456 -14.636 2.231 1.00 0.00 C ATOM 0 H THR A 72 18.044 -13.092 -1.385 1.00 0.00 H new ATOM 0 HA THR A 72 20.162 -13.711 0.426 1.00 0.00 H new ATOM 0 HB THR A 72 17.319 -14.730 0.406 1.00 0.00 H new ATOM 0 HG1 THR A 72 16.712 -12.782 1.297 1.00 0.00 H new ATOM 0 HG21 THR A 72 17.578 -14.594 2.875 1.00 0.00 H new ATOM 0 HG22 THR A 72 18.797 -15.668 2.148 1.00 0.00 H new ATOM 0 HG23 THR A 72 19.250 -14.025 2.660 1.00 0.00 H new ATOM 1154 N TRP A 73 18.968 -16.079 -1.516 1.00 0.00 N ATOM 1155 CA TRP A 73 19.170 -17.422 -2.029 1.00 0.00 C ATOM 1156 C TRP A 73 20.393 -17.467 -2.941 1.00 0.00 C ATOM 1157 O TRP A 73 21.103 -18.471 -2.983 1.00 0.00 O ATOM 1158 CB TRP A 73 17.903 -17.822 -2.777 1.00 0.00 C ATOM 1159 CG TRP A 73 17.929 -19.174 -3.411 1.00 0.00 C ATOM 1160 CD1 TRP A 73 17.795 -20.348 -2.759 1.00 0.00 C ATOM 1161 CD2 TRP A 73 18.090 -19.522 -4.819 1.00 0.00 C ATOM 1162 NE1 TRP A 73 17.832 -21.388 -3.661 1.00 0.00 N ATOM 1163 CE2 TRP A 73 18.011 -20.937 -4.953 1.00 0.00 C ATOM 1164 CE3 TRP A 73 18.286 -18.778 -5.997 1.00 0.00 C ATOM 1165 CZ2 TRP A 73 18.112 -21.578 -6.193 1.00 0.00 C ATOM 1166 CZ3 TRP A 73 18.395 -19.413 -7.242 1.00 0.00 C ATOM 1167 CH2 TRP A 73 18.309 -20.807 -7.346 1.00 0.00 C ATOM 0 H TRP A 73 18.272 -15.544 -2.034 1.00 0.00 H new ATOM 0 HA TRP A 73 19.357 -18.123 -1.216 1.00 0.00 H new ATOM 0 HB2 TRP A 73 17.064 -17.782 -2.082 1.00 0.00 H new ATOM 0 HB3 TRP A 73 17.710 -17.080 -3.552 1.00 0.00 H new ATOM 0 HD1 TRP A 73 17.677 -20.456 -1.691 1.00 0.00 H new ATOM 0 HE1 TRP A 73 17.739 -22.371 -3.406 1.00 0.00 H new ATOM 0 HE3 TRP A 73 18.353 -17.702 -5.941 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 18.039 -22.653 -6.260 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 18.547 -18.820 -8.132 1.00 0.00 H new ATOM 0 HH2 TRP A 73 18.394 -21.285 -8.311 1.00 0.00 H new ATOM 1178 N LEU A 74 20.646 -16.377 -3.674 1.00 0.00 N ATOM 1179 CA LEU A 74 21.793 -16.285 -4.564 1.00 0.00 C ATOM 1180 C LEU A 74 23.074 -16.184 -3.734 1.00 0.00 C ATOM 1181 O LEU A 74 24.116 -16.713 -4.113 1.00 0.00 O ATOM 1182 CB LEU A 74 21.612 -15.043 -5.446 1.00 0.00 C ATOM 1183 CG LEU A 74 22.219 -15.187 -6.846 1.00 0.00 C ATOM 1184 CD1 LEU A 74 22.036 -13.855 -7.572 1.00 0.00 C ATOM 1185 CD2 LEU A 74 23.705 -15.530 -6.838 1.00 0.00 C ATOM 0 H LEU A 74 20.061 -15.542 -3.663 1.00 0.00 H new ATOM 0 HA LEU A 74 21.868 -17.170 -5.195 1.00 0.00 H new ATOM 0 HB2 LEU A 74 20.548 -14.828 -5.542 1.00 0.00 H new ATOM 0 HB3 LEU A 74 22.067 -14.186 -4.949 1.00 0.00 H new ATOM 0 HG LEU A 74 21.708 -16.013 -7.341 1.00 0.00 H new ATOM 0 HD11 LEU A 74 22.459 -13.926 -8.574 1.00 0.00 H new ATOM 0 HD12 LEU A 74 20.974 -13.622 -7.642 1.00 0.00 H new ATOM 0 HD13 LEU A 74 22.545 -13.066 -7.018 1.00 0.00 H new ATOM 0 HD21 LEU A 74 24.064 -15.616 -7.864 1.00 0.00 H new ATOM 0 HD22 LEU A 74 24.257 -14.743 -6.325 1.00 0.00 H new ATOM 0 HD23 LEU A 74 23.857 -16.477 -6.320 1.00 0.00 H new ATOM 1197 N TYR A 75 22.996 -15.504 -2.588 1.00 0.00 N ATOM 1198 CA TYR A 75 24.130 -15.323 -1.701 1.00 0.00 C ATOM 1199 C TYR A 75 24.579 -16.667 -1.147 1.00 0.00 C ATOM 1200 O TYR A 75 25.779 -16.912 -1.034 1.00 0.00 O ATOM 1201 CB TYR A 75 23.720 -14.375 -0.569 1.00 0.00 C ATOM 1202 CG TYR A 75 24.842 -13.950 0.356 1.00 0.00 C ATOM 1203 CD1 TYR A 75 25.415 -14.854 1.262 1.00 0.00 C ATOM 1204 CD2 TYR A 75 25.298 -12.627 0.308 1.00 0.00 C ATOM 1205 CE1 TYR A 75 26.447 -14.437 2.117 1.00 0.00 C ATOM 1206 CE2 TYR A 75 26.316 -12.193 1.164 1.00 0.00 C ATOM 1207 CZ TYR A 75 26.902 -13.102 2.070 1.00 0.00 C ATOM 1208 OH TYR A 75 27.898 -12.684 2.902 1.00 0.00 O ATOM 0 H TYR A 75 22.138 -15.065 -2.255 1.00 0.00 H new ATOM 0 HA TYR A 75 24.968 -14.890 -2.247 1.00 0.00 H new ATOM 0 HB2 TYR A 75 23.275 -13.482 -1.008 1.00 0.00 H new ATOM 0 HB3 TYR A 75 22.945 -14.859 0.025 1.00 0.00 H new ATOM 0 HD1 TYR A 75 25.061 -15.874 1.302 1.00 0.00 H new ATOM 0 HD2 TYR A 75 24.860 -11.935 -0.396 1.00 0.00 H new ATOM 0 HE1 TYR A 75 26.892 -15.136 2.809 1.00 0.00 H new ATOM 0 HE2 TYR A 75 26.652 -11.167 1.131 1.00 0.00 H new ATOM 0 HH TYR A 75 28.494 -13.436 3.102 1.00 0.00 H new ATOM 1218 N ARG A 76 23.624 -17.545 -0.806 1.00 0.00 N ATOM 1219 CA ARG A 76 23.944 -18.857 -0.261 1.00 0.00 C ATOM 1220 C ARG A 76 24.618 -19.733 -1.312 1.00 0.00 C ATOM 1221 O ARG A 76 25.514 -20.506 -0.982 1.00 0.00 O ATOM 1222 CB ARG A 76 22.662 -19.522 0.247 1.00 0.00 C ATOM 1223 CG ARG A 76 22.982 -20.815 1.002 1.00 0.00 C ATOM 1224 CD ARG A 76 23.549 -20.533 2.391 1.00 0.00 C ATOM 1225 NE ARG A 76 22.508 -19.993 3.275 1.00 0.00 N ATOM 1226 CZ ARG A 76 22.657 -18.955 4.099 1.00 0.00 C ATOM 1227 NH1 ARG A 76 23.824 -18.318 4.197 1.00 0.00 N ATOM 1228 NH2 ARG A 76 21.628 -18.549 4.834 1.00 0.00 N ATOM 0 H ARG A 76 22.625 -17.363 -0.901 1.00 0.00 H new ATOM 0 HA ARG A 76 24.641 -18.735 0.568 1.00 0.00 H new ATOM 0 HB2 ARG A 76 22.126 -18.836 0.903 1.00 0.00 H new ATOM 0 HB3 ARG A 76 22.003 -19.740 -0.593 1.00 0.00 H new ATOM 0 HG2 ARG A 76 22.077 -21.416 1.094 1.00 0.00 H new ATOM 0 HG3 ARG A 76 23.699 -21.403 0.429 1.00 0.00 H new ATOM 0 HD2 ARG A 76 23.955 -21.450 2.817 1.00 0.00 H new ATOM 0 HD3 ARG A 76 24.374 -19.824 2.316 1.00 0.00 H new ATOM 0 HE ARG A 76 21.596 -20.449 3.257 1.00 0.00 H new ATOM 0 HH11 ARG A 76 24.620 -18.623 3.637 1.00 0.00 H new ATOM 0 HH12 ARG A 76 23.921 -17.526 4.832 1.00 0.00 H new ATOM 0 HH21 ARG A 76 20.731 -19.030 4.766 1.00 0.00 H new ATOM 0 HH22 ARG A 76 21.734 -17.756 5.466 1.00 0.00 H new ATOM 1242 N ILE A 77 24.197 -19.621 -2.576 1.00 0.00 N ATOM 1243 CA ILE A 77 24.782 -20.418 -3.643 1.00 0.00 C ATOM 1244 C ILE A 77 26.163 -19.881 -4.003 1.00 0.00 C ATOM 1245 O ILE A 77 27.058 -20.660 -4.318 1.00 0.00 O ATOM 1246 CB ILE A 77 23.851 -20.409 -4.865 1.00 0.00 C ATOM 1247 CG1 ILE A 77 22.554 -21.148 -4.522 1.00 0.00 C ATOM 1248 CG2 ILE A 77 24.540 -21.078 -6.061 1.00 0.00 C ATOM 1249 CD1 ILE A 77 21.593 -21.207 -5.709 1.00 0.00 C ATOM 0 H ILE A 77 23.457 -18.988 -2.878 1.00 0.00 H new ATOM 0 HA ILE A 77 24.898 -21.447 -3.304 1.00 0.00 H new ATOM 0 HB ILE A 77 23.619 -19.378 -5.132 1.00 0.00 H new ATOM 0 HG12 ILE A 77 22.790 -22.161 -4.197 1.00 0.00 H new ATOM 0 HG13 ILE A 77 22.065 -20.650 -3.685 1.00 0.00 H new ATOM 0 HG21 ILE A 77 23.870 -21.065 -6.921 1.00 0.00 H new ATOM 0 HG22 ILE A 77 25.453 -20.536 -6.305 1.00 0.00 H new ATOM 0 HG23 ILE A 77 24.787 -22.109 -5.809 1.00 0.00 H new ATOM 0 HD11 ILE A 77 20.688 -21.740 -5.418 1.00 0.00 H new ATOM 0 HD12 ILE A 77 21.334 -20.194 -6.018 1.00 0.00 H new ATOM 0 HD13 ILE A 77 22.071 -21.729 -6.538 1.00 0.00 H new ATOM 1261 N ALA A 78 26.349 -18.561 -3.963 1.00 0.00 N ATOM 1262 CA ALA A 78 27.606 -17.960 -4.376 1.00 0.00 C ATOM 1263 C ALA A 78 28.728 -18.255 -3.382 1.00 0.00 C ATOM 1264 O ALA A 78 29.862 -18.495 -3.797 1.00 0.00 O ATOM 1265 CB ALA A 78 27.389 -16.460 -4.532 1.00 0.00 C ATOM 0 H ALA A 78 25.644 -17.894 -3.649 1.00 0.00 H new ATOM 0 HA ALA A 78 27.918 -18.392 -5.327 1.00 0.00 H new ATOM 0 HB1 ALA A 78 28.321 -15.988 -4.842 1.00 0.00 H new ATOM 0 HB2 ALA A 78 26.623 -16.280 -5.286 1.00 0.00 H new ATOM 0 HB3 ALA A 78 27.068 -16.038 -3.580 1.00 0.00 H new ATOM 1271 N VAL A 79 28.434 -18.244 -2.077 1.00 0.00 N ATOM 1272 CA VAL A 79 29.452 -18.542 -1.078 1.00 0.00 C ATOM 1273 C VAL A 79 29.777 -20.030 -1.091 1.00 0.00 C ATOM 1274 O VAL A 79 30.916 -20.415 -0.830 1.00 0.00 O ATOM 1275 CB VAL A 79 28.995 -18.072 0.309 1.00 0.00 C ATOM 1276 CG1 VAL A 79 27.707 -18.754 0.769 1.00 0.00 C ATOM 1277 CG2 VAL A 79 30.073 -18.391 1.339 1.00 0.00 C ATOM 0 H VAL A 79 27.511 -18.034 -1.697 1.00 0.00 H new ATOM 0 HA VAL A 79 30.365 -17.999 -1.323 1.00 0.00 H new ATOM 0 HB VAL A 79 28.814 -17.000 0.228 1.00 0.00 H new ATOM 0 HG11 VAL A 79 27.431 -18.383 1.756 1.00 0.00 H new ATOM 0 HG12 VAL A 79 26.907 -18.535 0.062 1.00 0.00 H new ATOM 0 HG13 VAL A 79 27.863 -19.832 0.817 1.00 0.00 H new ATOM 0 HG21 VAL A 79 29.746 -18.056 2.323 1.00 0.00 H new ATOM 0 HG22 VAL A 79 30.248 -19.467 1.361 1.00 0.00 H new ATOM 0 HG23 VAL A 79 30.997 -17.879 1.070 1.00 0.00 H new ATOM 1287 N ASN A 80 28.789 -20.872 -1.393 1.00 0.00 N ATOM 1288 CA ASN A 80 28.993 -22.311 -1.416 1.00 0.00 C ATOM 1289 C ASN A 80 29.603 -22.761 -2.741 1.00 0.00 C ATOM 1290 O ASN A 80 30.211 -23.827 -2.794 1.00 0.00 O ATOM 1291 CB ASN A 80 27.657 -22.998 -1.118 1.00 0.00 C ATOM 1292 CG ASN A 80 27.300 -22.914 0.362 1.00 0.00 C ATOM 1293 OD1 ASN A 80 28.115 -22.520 1.191 1.00 0.00 O ATOM 1294 ND2 ASN A 80 26.071 -23.286 0.707 1.00 0.00 N ATOM 0 H ASN A 80 27.840 -20.577 -1.625 1.00 0.00 H new ATOM 0 HA ASN A 80 29.710 -22.599 -0.647 1.00 0.00 H new ATOM 0 HB2 ASN A 80 26.868 -22.533 -1.710 1.00 0.00 H new ATOM 0 HB3 ASN A 80 27.709 -24.044 -1.421 1.00 0.00 H new ATOM 0 HD21 ASN A 80 25.782 -23.248 1.685 1.00 0.00 H new ATOM 0 HD22 ASN A 80 25.417 -23.609 -0.006 1.00 0.00 H new ATOM 1301 N THR A 81 29.463 -21.977 -3.815 1.00 0.00 N ATOM 1302 CA THR A 81 30.116 -22.306 -5.075 1.00 0.00 C ATOM 1303 C THR A 81 31.599 -21.975 -4.975 1.00 0.00 C ATOM 1304 O THR A 81 32.440 -22.717 -5.482 1.00 0.00 O ATOM 1305 CB THR A 81 29.461 -21.532 -6.225 1.00 0.00 C ATOM 1306 OG1 THR A 81 28.121 -21.943 -6.376 1.00 0.00 O ATOM 1307 CG2 THR A 81 30.189 -21.791 -7.542 1.00 0.00 C ATOM 0 H THR A 81 28.909 -21.121 -3.833 1.00 0.00 H new ATOM 0 HA THR A 81 30.005 -23.371 -5.278 1.00 0.00 H new ATOM 0 HB THR A 81 29.512 -20.470 -5.984 1.00 0.00 H new ATOM 0 HG1 THR A 81 27.540 -21.371 -5.832 1.00 0.00 H new ATOM 0 HG21 THR A 81 29.705 -21.231 -8.342 1.00 0.00 H new ATOM 0 HG22 THR A 81 31.227 -21.472 -7.453 1.00 0.00 H new ATOM 0 HG23 THR A 81 30.155 -22.856 -7.773 1.00 0.00 H new ATOM 1315 N ALA A 82 31.934 -20.860 -4.318 1.00 0.00 N ATOM 1316 CA ALA A 82 33.317 -20.458 -4.143 1.00 0.00 C ATOM 1317 C ALA A 82 34.000 -21.310 -3.071 1.00 0.00 C ATOM 1318 O ALA A 82 35.210 -21.512 -3.122 1.00 0.00 O ATOM 1319 CB ALA A 82 33.350 -18.972 -3.782 1.00 0.00 C ATOM 0 H ALA A 82 31.256 -20.223 -3.900 1.00 0.00 H new ATOM 0 HA ALA A 82 33.868 -20.614 -5.070 1.00 0.00 H new ATOM 0 HB1 ALA A 82 34.384 -18.653 -3.647 1.00 0.00 H new ATOM 0 HB2 ALA A 82 32.894 -18.392 -4.584 1.00 0.00 H new ATOM 0 HB3 ALA A 82 32.796 -18.810 -2.857 1.00 0.00 H new ATOM 1325 N LYS A 83 33.235 -21.822 -2.098 1.00 0.00 N ATOM 1326 CA LYS A 83 33.798 -22.659 -1.051 1.00 0.00 C ATOM 1327 C LYS A 83 33.960 -24.098 -1.533 1.00 0.00 C ATOM 1328 O LYS A 83 34.891 -24.786 -1.119 1.00 0.00 O ATOM 1329 CB LYS A 83 32.917 -22.567 0.196 1.00 0.00 C ATOM 1330 CG LYS A 83 33.619 -23.212 1.391 1.00 0.00 C ATOM 1331 CD LYS A 83 32.784 -23.061 2.666 1.00 0.00 C ATOM 1332 CE LYS A 83 31.394 -23.692 2.536 1.00 0.00 C ATOM 1333 NZ LYS A 83 31.475 -25.149 2.312 1.00 0.00 N ATOM 0 H LYS A 83 32.230 -21.667 -2.021 1.00 0.00 H new ATOM 0 HA LYS A 83 34.795 -22.302 -0.794 1.00 0.00 H new ATOM 0 HB2 LYS A 83 32.695 -21.523 0.416 1.00 0.00 H new ATOM 0 HB3 LYS A 83 31.964 -23.064 0.014 1.00 0.00 H new ATOM 0 HG2 LYS A 83 33.792 -24.269 1.188 1.00 0.00 H new ATOM 0 HG3 LYS A 83 34.596 -22.751 1.535 1.00 0.00 H new ATOM 0 HD2 LYS A 83 33.313 -23.523 3.499 1.00 0.00 H new ATOM 0 HD3 LYS A 83 32.678 -22.003 2.904 1.00 0.00 H new ATOM 0 HE2 LYS A 83 30.818 -23.494 3.440 1.00 0.00 H new ATOM 0 HE3 LYS A 83 30.858 -23.226 1.709 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 30.518 -25.557 2.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 31.913 -25.334 1.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 32.051 -25.584 3.061 1.00 0.00 H new ATOM 1347 N ASN A 84 33.070 -24.565 -2.414 1.00 0.00 N ATOM 1348 CA ASN A 84 33.208 -25.892 -3.003 1.00 0.00 C ATOM 1349 C ASN A 84 34.373 -25.893 -3.996 1.00 0.00 C ATOM 1350 O ASN A 84 34.919 -26.947 -4.313 1.00 0.00 O ATOM 1351 CB ASN A 84 31.902 -26.307 -3.688 1.00 0.00 C ATOM 1352 CG ASN A 84 30.787 -26.615 -2.696 1.00 0.00 C ATOM 1353 OD1 ASN A 84 30.982 -26.578 -1.483 1.00 0.00 O ATOM 1354 ND2 ASN A 84 29.599 -26.925 -3.209 1.00 0.00 N ATOM 0 H ASN A 84 32.252 -24.044 -2.731 1.00 0.00 H new ATOM 0 HA ASN A 84 33.419 -26.617 -2.217 1.00 0.00 H new ATOM 0 HB2 ASN A 84 31.578 -25.509 -4.356 1.00 0.00 H new ATOM 0 HB3 ASN A 84 32.085 -27.186 -4.307 1.00 0.00 H new ATOM 0 HD21 ASN A 84 28.817 -27.141 -2.591 1.00 0.00 H new ATOM 0 HD22 ASN A 84 29.470 -26.947 -4.221 1.00 0.00 H new ATOM 1361 N TYR A 85 34.761 -24.713 -4.489 1.00 0.00 N ATOM 1362 CA TYR A 85 35.911 -24.579 -5.365 1.00 0.00 C ATOM 1363 C TYR A 85 37.214 -24.712 -4.573 1.00 0.00 C ATOM 1364 O TYR A 85 38.230 -25.125 -5.124 1.00 0.00 O ATOM 1365 CB TYR A 85 35.832 -23.231 -6.083 1.00 0.00 C ATOM 1366 CG TYR A 85 37.043 -22.912 -6.925 1.00 0.00 C ATOM 1367 CD1 TYR A 85 37.136 -23.389 -8.240 1.00 0.00 C ATOM 1368 CD2 TYR A 85 38.077 -22.135 -6.381 1.00 0.00 C ATOM 1369 CE1 TYR A 85 38.272 -23.099 -9.011 1.00 0.00 C ATOM 1370 CE2 TYR A 85 39.217 -21.840 -7.145 1.00 0.00 C ATOM 1371 CZ TYR A 85 39.317 -22.325 -8.465 1.00 0.00 C ATOM 1372 OH TYR A 85 40.427 -22.050 -9.209 1.00 0.00 O ATOM 0 H TYR A 85 34.285 -23.833 -4.289 1.00 0.00 H new ATOM 0 HA TYR A 85 35.902 -25.378 -6.106 1.00 0.00 H new ATOM 0 HB2 TYR A 85 34.947 -23.221 -6.719 1.00 0.00 H new ATOM 0 HB3 TYR A 85 35.700 -22.443 -5.341 1.00 0.00 H new ATOM 0 HD1 TYR A 85 36.334 -23.979 -8.659 1.00 0.00 H new ATOM 0 HD2 TYR A 85 37.995 -21.762 -5.371 1.00 0.00 H new ATOM 0 HE1 TYR A 85 38.346 -23.469 -10.023 1.00 0.00 H new ATOM 0 HE2 TYR A 85 40.013 -21.245 -6.724 1.00 0.00 H new ATOM 0 HH TYR A 85 41.048 -21.505 -8.682 1.00 0.00 H new ATOM 1382 N LEU A 86 37.202 -24.370 -3.279 1.00 0.00 N ATOM 1383 CA LEU A 86 38.407 -24.486 -2.465 1.00 0.00 C ATOM 1384 C LEU A 86 38.687 -25.927 -2.048 1.00 0.00 C ATOM 1385 O LEU A 86 39.826 -26.247 -1.718 1.00 0.00 O ATOM 1386 CB LEU A 86 38.296 -23.592 -1.231 1.00 0.00 C ATOM 1387 CG LEU A 86 38.224 -22.107 -1.589 1.00 0.00 C ATOM 1388 CD1 LEU A 86 38.150 -21.299 -0.298 1.00 0.00 C ATOM 1389 CD2 LEU A 86 39.445 -21.661 -2.394 1.00 0.00 C ATOM 0 H LEU A 86 36.383 -24.017 -2.784 1.00 0.00 H new ATOM 0 HA LEU A 86 39.246 -24.158 -3.079 1.00 0.00 H new ATOM 0 HB2 LEU A 86 37.407 -23.869 -0.664 1.00 0.00 H new ATOM 0 HB3 LEU A 86 39.155 -23.765 -0.582 1.00 0.00 H new ATOM 0 HG LEU A 86 37.340 -21.941 -2.204 1.00 0.00 H new ATOM 0 HD11 LEU A 86 38.098 -20.237 -0.536 1.00 0.00 H new ATOM 0 HD12 LEU A 86 37.261 -21.589 0.262 1.00 0.00 H new ATOM 0 HD13 LEU A 86 39.038 -21.493 0.304 1.00 0.00 H new ATOM 0 HD21 LEU A 86 39.358 -20.600 -2.630 1.00 0.00 H new ATOM 0 HD22 LEU A 86 40.349 -21.829 -1.808 1.00 0.00 H new ATOM 0 HD23 LEU A 86 39.500 -22.235 -3.319 1.00 0.00 H new ATOM 1401 N VAL A 87 37.675 -26.802 -2.062 1.00 0.00 N ATOM 1402 CA VAL A 87 37.892 -28.209 -1.747 1.00 0.00 C ATOM 1403 C VAL A 87 38.072 -29.036 -3.016 1.00 0.00 C ATOM 1404 O VAL A 87 38.535 -30.170 -2.952 1.00 0.00 O ATOM 1405 CB VAL A 87 36.764 -28.766 -0.876 1.00 0.00 C ATOM 1406 CG1 VAL A 87 36.687 -27.996 0.444 1.00 0.00 C ATOM 1407 CG2 VAL A 87 35.417 -28.688 -1.586 1.00 0.00 C ATOM 0 H VAL A 87 36.710 -26.560 -2.286 1.00 0.00 H new ATOM 0 HA VAL A 87 38.815 -28.280 -1.172 1.00 0.00 H new ATOM 0 HB VAL A 87 36.988 -29.814 -0.679 1.00 0.00 H new ATOM 0 HG11 VAL A 87 35.881 -28.401 1.055 1.00 0.00 H new ATOM 0 HG12 VAL A 87 37.632 -28.094 0.978 1.00 0.00 H new ATOM 0 HG13 VAL A 87 36.493 -26.943 0.240 1.00 0.00 H new ATOM 0 HG21 VAL A 87 34.640 -29.092 -0.937 1.00 0.00 H new ATOM 0 HG22 VAL A 87 35.189 -27.648 -1.821 1.00 0.00 H new ATOM 0 HG23 VAL A 87 35.458 -29.268 -2.508 1.00 0.00 H new