USER MOD reduce.3.24.130724 H: found=0, std=0, add=669, rem=0, adj=15 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= -0.074 USER MOD Set 1.2: A 72 THR OG1 : rot 162:sc= 0.24 USER MOD Single : A 6 THR OG1 : rot -26:sc= 0.0992 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 15 GLN : amide:sc= 0.764 K(o=0.76,f=-0.83) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 GLN : amide:sc= -1.8 K(o=-1.8,f=-4.2) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 ASN : amide:sc= -0.408 X(o=-0.41,f=0) USER MOD Single : A 29 TYR OH : rot 30:sc= 0 USER MOD Single : A 30 GLN : amide:sc= -0.426 K(o=-0.43,f=-1.2) USER MOD Single : A 31 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot 81:sc= 0.248 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=-0.89) USER MOD Single : A 56 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0535) 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 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.0375 K(o=-0.038,f=-1.6!) USER MOD Single : A 81 THR OG1 : rot 77:sc= 1.27 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc= -0.951 K(o=-0.95,f=-2) USER MOD Single : A 85 TYR OH : rot 30:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 82 N THR A 6 11.051 -5.830 -10.914 1.00 0.00 N ATOM 83 CA THR A 6 11.839 -6.307 -9.785 1.00 0.00 C ATOM 84 C THR A 6 12.273 -7.747 -10.034 1.00 0.00 C ATOM 85 O THR A 6 11.839 -8.384 -10.994 1.00 0.00 O ATOM 86 CB THR A 6 11.020 -6.204 -8.495 1.00 0.00 C ATOM 87 OG1 THR A 6 9.861 -6.995 -8.611 1.00 0.00 O ATOM 88 CG2 THR A 6 10.612 -4.760 -8.219 1.00 0.00 C ATOM 0 HA THR A 6 12.729 -5.688 -9.677 1.00 0.00 H new ATOM 0 HB THR A 6 11.637 -6.557 -7.669 1.00 0.00 H new ATOM 0 HG1 THR A 6 9.619 -7.084 -9.556 1.00 0.00 H new ATOM 0 HG21 THR A 6 10.032 -4.716 -7.297 1.00 0.00 H new ATOM 0 HG22 THR A 6 11.505 -4.143 -8.116 1.00 0.00 H new ATOM 0 HG23 THR A 6 10.008 -4.388 -9.046 1.00 0.00 H new ATOM 96 N ASP A 7 13.133 -8.284 -9.166 1.00 0.00 N ATOM 97 CA ASP A 7 13.588 -9.662 -9.281 1.00 0.00 C ATOM 98 C ASP A 7 12.412 -10.633 -9.142 1.00 0.00 C ATOM 99 O ASP A 7 12.535 -11.801 -9.496 1.00 0.00 O ATOM 100 CB ASP A 7 14.639 -9.924 -8.207 1.00 0.00 C ATOM 101 CG ASP A 7 14.095 -9.647 -6.807 1.00 0.00 C ATOM 102 OD1 ASP A 7 14.087 -8.458 -6.418 1.00 0.00 O ATOM 103 OD2 ASP A 7 13.698 -10.623 -6.137 1.00 0.00 O ATOM 0 H ASP A 7 13.527 -7.778 -8.373 1.00 0.00 H new ATOM 0 HA ASP A 7 14.029 -9.821 -10.265 1.00 0.00 H new ATOM 0 HB2 ASP A 7 14.973 -10.960 -8.270 1.00 0.00 H new ATOM 0 HB3 ASP A 7 15.511 -9.296 -8.390 1.00 0.00 H new ATOM 108 N GLN A 8 11.271 -10.166 -8.630 1.00 0.00 N ATOM 109 CA GLN A 8 10.114 -11.019 -8.424 1.00 0.00 C ATOM 110 C GLN A 8 9.462 -11.384 -9.757 1.00 0.00 C ATOM 111 O GLN A 8 9.002 -12.513 -9.921 1.00 0.00 O ATOM 112 CB GLN A 8 9.132 -10.301 -7.498 1.00 0.00 C ATOM 113 CG GLN A 8 7.967 -11.219 -7.116 1.00 0.00 C ATOM 114 CD GLN A 8 6.982 -10.532 -6.176 1.00 0.00 C ATOM 115 OE1 GLN A 8 7.152 -9.371 -5.812 1.00 0.00 O ATOM 116 NE2 GLN A 8 5.936 -11.246 -5.772 1.00 0.00 N ATOM 0 H GLN A 8 11.130 -9.195 -8.351 1.00 0.00 H new ATOM 0 HA GLN A 8 10.425 -11.954 -7.957 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.650 -9.971 -6.598 1.00 0.00 H new ATOM 0 HB3 GLN A 8 8.749 -9.407 -7.991 1.00 0.00 H new ATOM 0 HG2 GLN A 8 7.445 -11.537 -8.019 1.00 0.00 H new ATOM 0 HG3 GLN A 8 8.356 -12.119 -6.639 1.00 0.00 H new ATOM 0 HE21 GLN A 8 5.821 -12.208 -6.091 1.00 0.00 H new ATOM 0 HE22 GLN A 8 5.248 -10.832 -5.143 1.00 0.00 H new ATOM 125 N VAL A 9 9.413 -10.450 -10.713 1.00 0.00 N ATOM 126 CA VAL A 9 8.811 -10.740 -12.008 1.00 0.00 C ATOM 127 C VAL A 9 9.825 -11.431 -12.911 1.00 0.00 C ATOM 128 O VAL A 9 9.452 -12.179 -13.807 1.00 0.00 O ATOM 129 CB VAL A 9 8.282 -9.466 -12.682 1.00 0.00 C ATOM 130 CG1 VAL A 9 7.603 -8.534 -11.684 1.00 0.00 C ATOM 131 CG2 VAL A 9 9.376 -8.677 -13.403 1.00 0.00 C ATOM 0 H VAL A 9 9.778 -9.503 -10.613 1.00 0.00 H new ATOM 0 HA VAL A 9 7.963 -11.405 -11.843 1.00 0.00 H new ATOM 0 HB VAL A 9 7.557 -9.817 -13.416 1.00 0.00 H new ATOM 0 HG11 VAL A 9 7.243 -7.645 -12.203 1.00 0.00 H new ATOM 0 HG12 VAL A 9 6.762 -9.049 -11.220 1.00 0.00 H new ATOM 0 HG13 VAL A 9 8.318 -8.241 -10.915 1.00 0.00 H new ATOM 0 HG21 VAL A 9 8.942 -7.788 -13.860 1.00 0.00 H new ATOM 0 HG22 VAL A 9 10.142 -8.380 -12.687 1.00 0.00 H new ATOM 0 HG23 VAL A 9 9.824 -9.300 -14.177 1.00 0.00 H new ATOM 141 N LEU A 10 11.110 -11.174 -12.663 1.00 0.00 N ATOM 142 CA LEU A 10 12.175 -11.685 -13.500 1.00 0.00 C ATOM 143 C LEU A 10 12.496 -13.139 -13.158 1.00 0.00 C ATOM 144 O LEU A 10 12.898 -13.901 -14.036 1.00 0.00 O ATOM 145 CB LEU A 10 13.378 -10.751 -13.340 1.00 0.00 C ATOM 146 CG LEU A 10 14.472 -10.980 -14.386 1.00 0.00 C ATOM 147 CD1 LEU A 10 13.929 -10.777 -15.798 1.00 0.00 C ATOM 148 CD2 LEU A 10 15.587 -9.964 -14.158 1.00 0.00 C ATOM 0 H LEU A 10 11.432 -10.608 -11.878 1.00 0.00 H new ATOM 0 HA LEU A 10 11.874 -11.698 -14.548 1.00 0.00 H new ATOM 0 HB2 LEU A 10 13.037 -9.718 -13.403 1.00 0.00 H new ATOM 0 HB3 LEU A 10 13.803 -10.886 -12.345 1.00 0.00 H new ATOM 0 HG LEU A 10 14.838 -12.002 -14.287 1.00 0.00 H new ATOM 0 HD11 LEU A 10 14.726 -10.946 -16.522 1.00 0.00 H new ATOM 0 HD12 LEU A 10 13.118 -11.482 -15.981 1.00 0.00 H new ATOM 0 HD13 LEU A 10 13.555 -9.758 -15.901 1.00 0.00 H new ATOM 0 HD21 LEU A 10 16.374 -10.116 -14.897 1.00 0.00 H new ATOM 0 HD22 LEU A 10 15.186 -8.955 -14.257 1.00 0.00 H new ATOM 0 HD23 LEU A 10 15.999 -10.094 -13.157 1.00 0.00 H new ATOM 160 N VAL A 11 12.325 -13.536 -11.892 1.00 0.00 N ATOM 161 CA VAL A 11 12.540 -14.920 -11.488 1.00 0.00 C ATOM 162 C VAL A 11 11.370 -15.786 -11.941 1.00 0.00 C ATOM 163 O VAL A 11 11.566 -16.936 -12.324 1.00 0.00 O ATOM 164 CB VAL A 11 12.737 -14.985 -9.969 1.00 0.00 C ATOM 165 CG1 VAL A 11 12.660 -16.418 -9.445 1.00 0.00 C ATOM 166 CG2 VAL A 11 14.116 -14.431 -9.613 1.00 0.00 C ATOM 0 H VAL A 11 12.039 -12.916 -11.135 1.00 0.00 H new ATOM 0 HA VAL A 11 13.440 -15.308 -11.965 1.00 0.00 H new ATOM 0 HB VAL A 11 11.940 -14.398 -9.512 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.805 -16.419 -8.365 1.00 0.00 H new ATOM 0 HG12 VAL A 11 11.683 -16.839 -9.680 1.00 0.00 H new ATOM 0 HG13 VAL A 11 13.437 -17.020 -9.916 1.00 0.00 H new ATOM 0 HG21 VAL A 11 14.259 -14.476 -8.533 1.00 0.00 H new ATOM 0 HG22 VAL A 11 14.885 -15.026 -10.106 1.00 0.00 H new ATOM 0 HG23 VAL A 11 14.189 -13.396 -9.946 1.00 0.00 H new ATOM 176 N GLU A 12 10.147 -15.245 -11.910 1.00 0.00 N ATOM 177 CA GLU A 12 8.985 -15.993 -12.369 1.00 0.00 C ATOM 178 C GLU A 12 8.999 -16.111 -13.890 1.00 0.00 C ATOM 179 O GLU A 12 8.440 -17.058 -14.443 1.00 0.00 O ATOM 180 CB GLU A 12 7.709 -15.290 -11.900 1.00 0.00 C ATOM 181 CG GLU A 12 7.566 -15.353 -10.375 1.00 0.00 C ATOM 182 CD GLU A 12 7.366 -16.782 -9.876 1.00 0.00 C ATOM 183 OE1 GLU A 12 6.313 -17.374 -10.207 1.00 0.00 O ATOM 184 OE2 GLU A 12 8.268 -17.277 -9.162 1.00 0.00 O ATOM 0 H GLU A 12 9.943 -14.303 -11.575 1.00 0.00 H new ATOM 0 HA GLU A 12 9.015 -16.998 -11.948 1.00 0.00 H new ATOM 0 HB2 GLU A 12 7.725 -14.249 -12.223 1.00 0.00 H new ATOM 0 HB3 GLU A 12 6.842 -15.756 -12.368 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.456 -14.928 -9.910 1.00 0.00 H new ATOM 0 HG3 GLU A 12 6.720 -14.739 -10.065 1.00 0.00 H new ATOM 191 N ARG A 13 9.636 -15.159 -14.580 1.00 0.00 N ATOM 192 CA ARG A 13 9.728 -15.192 -16.031 1.00 0.00 C ATOM 193 C ARG A 13 10.719 -16.261 -16.485 1.00 0.00 C ATOM 194 O ARG A 13 10.552 -16.830 -17.563 1.00 0.00 O ATOM 195 CB ARG A 13 10.099 -13.798 -16.542 1.00 0.00 C ATOM 196 CG ARG A 13 10.214 -13.792 -18.068 1.00 0.00 C ATOM 197 CD ARG A 13 10.462 -12.374 -18.584 1.00 0.00 C ATOM 198 NE ARG A 13 10.715 -12.387 -20.028 1.00 0.00 N ATOM 199 CZ ARG A 13 10.777 -11.303 -20.804 1.00 0.00 C ATOM 200 NH1 ARG A 13 10.591 -10.087 -20.301 1.00 0.00 N ATOM 201 NH2 ARG A 13 11.032 -11.447 -22.099 1.00 0.00 N ATOM 0 H ARG A 13 10.095 -14.356 -14.149 1.00 0.00 H new ATOM 0 HA ARG A 13 8.763 -15.464 -16.458 1.00 0.00 H new ATOM 0 HB2 ARG A 13 9.344 -13.077 -16.227 1.00 0.00 H new ATOM 0 HB3 ARG A 13 11.044 -13.483 -16.100 1.00 0.00 H new ATOM 0 HG2 ARG A 13 11.029 -14.446 -18.379 1.00 0.00 H new ATOM 0 HG3 ARG A 13 9.300 -14.190 -18.508 1.00 0.00 H new ATOM 0 HD2 ARG A 13 9.598 -11.746 -18.366 1.00 0.00 H new ATOM 0 HD3 ARG A 13 11.314 -11.936 -18.064 1.00 0.00 H new ATOM 0 HE ARG A 13 10.854 -13.294 -20.474 1.00 0.00 H new ATOM 0 HH11 ARG A 13 10.397 -9.971 -19.306 1.00 0.00 H new ATOM 0 HH12 ARG A 13 10.642 -9.270 -20.910 1.00 0.00 H new ATOM 0 HH21 ARG A 13 11.178 -12.378 -22.490 1.00 0.00 H new ATOM 0 HH22 ARG A 13 11.082 -10.627 -22.703 1.00 0.00 H new ATOM 215 N VAL A 14 11.744 -16.547 -15.679 1.00 0.00 N ATOM 216 CA VAL A 14 12.690 -17.610 -15.999 1.00 0.00 C ATOM 217 C VAL A 14 12.064 -18.977 -15.736 1.00 0.00 C ATOM 218 O VAL A 14 12.426 -19.956 -16.388 1.00 0.00 O ATOM 219 CB VAL A 14 13.984 -17.411 -15.208 1.00 0.00 C ATOM 220 CG1 VAL A 14 14.963 -18.565 -15.431 1.00 0.00 C ATOM 221 CG2 VAL A 14 14.670 -16.124 -15.666 1.00 0.00 C ATOM 0 H VAL A 14 11.937 -16.058 -14.805 1.00 0.00 H new ATOM 0 HA VAL A 14 12.938 -17.567 -17.059 1.00 0.00 H new ATOM 0 HB VAL A 14 13.718 -17.364 -14.152 1.00 0.00 H new ATOM 0 HG11 VAL A 14 15.870 -18.389 -14.853 1.00 0.00 H new ATOM 0 HG12 VAL A 14 14.503 -19.499 -15.109 1.00 0.00 H new ATOM 0 HG13 VAL A 14 15.214 -18.630 -16.490 1.00 0.00 H new ATOM 0 HG21 VAL A 14 15.592 -15.983 -15.102 1.00 0.00 H new ATOM 0 HG22 VAL A 14 14.902 -16.194 -16.729 1.00 0.00 H new ATOM 0 HG23 VAL A 14 14.006 -15.277 -15.494 1.00 0.00 H new ATOM 231 N GLN A 15 11.122 -19.068 -14.792 1.00 0.00 N ATOM 232 CA GLN A 15 10.413 -20.322 -14.551 1.00 0.00 C ATOM 233 C GLN A 15 9.433 -20.619 -15.684 1.00 0.00 C ATOM 234 O GLN A 15 8.973 -21.752 -15.816 1.00 0.00 O ATOM 235 CB GLN A 15 9.689 -20.278 -13.202 1.00 0.00 C ATOM 236 CG GLN A 15 10.696 -20.320 -12.050 1.00 0.00 C ATOM 237 CD GLN A 15 10.014 -20.449 -10.691 1.00 0.00 C ATOM 238 OE1 GLN A 15 8.794 -20.361 -10.583 1.00 0.00 O ATOM 239 NE2 GLN A 15 10.799 -20.660 -9.637 1.00 0.00 N ATOM 0 H GLN A 15 10.837 -18.296 -14.190 1.00 0.00 H new ATOM 0 HA GLN A 15 11.145 -21.129 -14.521 1.00 0.00 H new ATOM 0 HB2 GLN A 15 9.088 -19.371 -13.135 1.00 0.00 H new ATOM 0 HB3 GLN A 15 9.003 -21.121 -13.124 1.00 0.00 H new ATOM 0 HG2 GLN A 15 11.376 -21.160 -12.194 1.00 0.00 H new ATOM 0 HG3 GLN A 15 11.301 -19.414 -12.066 1.00 0.00 H new ATOM 0 HE21 GLN A 15 11.809 -20.728 -9.759 1.00 0.00 H new ATOM 0 HE22 GLN A 15 10.390 -20.753 -8.707 1.00 0.00 H new ATOM 248 N LYS A 16 9.114 -19.614 -16.510 1.00 0.00 N ATOM 249 CA LYS A 16 8.317 -19.811 -17.719 1.00 0.00 C ATOM 250 C LYS A 16 9.188 -20.267 -18.894 1.00 0.00 C ATOM 251 O LYS A 16 8.705 -20.371 -20.018 1.00 0.00 O ATOM 252 CB LYS A 16 7.511 -18.554 -18.048 1.00 0.00 C ATOM 253 CG LYS A 16 6.403 -18.405 -17.004 1.00 0.00 C ATOM 254 CD LYS A 16 5.433 -17.284 -17.372 1.00 0.00 C ATOM 255 CE LYS A 16 6.141 -15.931 -17.380 1.00 0.00 C ATOM 256 NZ LYS A 16 5.202 -14.841 -17.706 1.00 0.00 N ATOM 0 H LYS A 16 9.401 -18.647 -16.357 1.00 0.00 H new ATOM 0 HA LYS A 16 7.603 -20.613 -17.531 1.00 0.00 H new ATOM 0 HB2 LYS A 16 8.158 -17.677 -18.043 1.00 0.00 H new ATOM 0 HB3 LYS A 16 7.083 -18.629 -19.048 1.00 0.00 H new ATOM 0 HG2 LYS A 16 5.858 -19.344 -16.914 1.00 0.00 H new ATOM 0 HG3 LYS A 16 6.845 -18.199 -16.029 1.00 0.00 H new ATOM 0 HD2 LYS A 16 5.001 -17.479 -18.354 1.00 0.00 H new ATOM 0 HD3 LYS A 16 4.608 -17.263 -16.660 1.00 0.00 H new ATOM 0 HE2 LYS A 16 6.591 -15.747 -16.405 1.00 0.00 H new ATOM 0 HE3 LYS A 16 6.952 -15.946 -18.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 5.710 -13.933 -17.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 4.791 -15.006 -18.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 4.442 -14.814 -16.997 1.00 0.00 H new ATOM 270 N GLY A 17 10.474 -20.536 -18.636 1.00 0.00 N ATOM 271 CA GLY A 17 11.381 -21.093 -19.627 1.00 0.00 C ATOM 272 C GLY A 17 12.138 -20.029 -20.418 1.00 0.00 C ATOM 273 O GLY A 17 12.827 -20.362 -21.381 1.00 0.00 O ATOM 0 H GLY A 17 10.909 -20.370 -17.728 1.00 0.00 H new ATOM 0 HA2 GLY A 17 12.099 -21.744 -19.127 1.00 0.00 H new ATOM 0 HA3 GLY A 17 10.814 -21.716 -20.319 1.00 0.00 H new ATOM 277 N ASP A 18 12.024 -18.754 -20.035 1.00 0.00 N ATOM 278 CA ASP A 18 12.709 -17.683 -20.741 1.00 0.00 C ATOM 279 C ASP A 18 14.170 -17.615 -20.301 1.00 0.00 C ATOM 280 O ASP A 18 14.458 -17.248 -19.163 1.00 0.00 O ATOM 281 CB ASP A 18 11.981 -16.367 -20.468 1.00 0.00 C ATOM 282 CG ASP A 18 12.426 -15.256 -21.413 1.00 0.00 C ATOM 283 OD1 ASP A 18 13.622 -15.252 -21.780 1.00 0.00 O ATOM 284 OD2 ASP A 18 11.566 -14.417 -21.761 1.00 0.00 O ATOM 0 H ASP A 18 11.463 -18.445 -19.241 1.00 0.00 H new ATOM 0 HA ASP A 18 12.699 -17.873 -21.814 1.00 0.00 H new ATOM 0 HB2 ASP A 18 10.907 -16.520 -20.570 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.163 -16.060 -19.438 1.00 0.00 H new ATOM 289 N GLN A 19 15.100 -17.964 -21.196 1.00 0.00 N ATOM 290 CA GLN A 19 16.519 -17.941 -20.871 1.00 0.00 C ATOM 291 C GLN A 19 17.078 -16.521 -20.963 1.00 0.00 C ATOM 292 O GLN A 19 18.025 -16.177 -20.257 1.00 0.00 O ATOM 293 CB GLN A 19 17.255 -18.916 -21.797 1.00 0.00 C ATOM 294 CG GLN A 19 18.649 -19.276 -21.274 1.00 0.00 C ATOM 295 CD GLN A 19 19.680 -18.164 -21.454 1.00 0.00 C ATOM 296 OE1 GLN A 19 19.618 -17.383 -22.400 1.00 0.00 O ATOM 297 NE2 GLN A 19 20.642 -18.086 -20.536 1.00 0.00 N ATOM 0 H GLN A 19 14.890 -18.264 -22.148 1.00 0.00 H new ATOM 0 HA GLN A 19 16.669 -18.263 -19.840 1.00 0.00 H new ATOM 0 HB2 GLN A 19 16.664 -19.826 -21.906 1.00 0.00 H new ATOM 0 HB3 GLN A 19 17.345 -18.473 -22.789 1.00 0.00 H new ATOM 0 HG2 GLN A 19 18.577 -19.524 -20.215 1.00 0.00 H new ATOM 0 HG3 GLN A 19 19.000 -20.171 -21.788 1.00 0.00 H new ATOM 0 HE21 GLN A 19 20.664 -18.751 -19.763 1.00 0.00 H new ATOM 0 HE22 GLN A 19 21.356 -17.361 -20.606 1.00 0.00 H new ATOM 306 N LYS A 20 16.501 -15.686 -21.832 1.00 0.00 N ATOM 307 CA LYS A 20 16.973 -14.320 -22.015 1.00 0.00 C ATOM 308 C LYS A 20 16.648 -13.488 -20.781 1.00 0.00 C ATOM 309 O LYS A 20 17.384 -12.559 -20.455 1.00 0.00 O ATOM 310 CB LYS A 20 16.323 -13.703 -23.259 1.00 0.00 C ATOM 311 CG LYS A 20 16.532 -14.510 -24.546 1.00 0.00 C ATOM 312 CD LYS A 20 17.921 -14.342 -25.175 1.00 0.00 C ATOM 313 CE LYS A 20 19.036 -14.982 -24.345 1.00 0.00 C ATOM 314 NZ LYS A 20 20.304 -15.004 -25.094 1.00 0.00 N ATOM 0 H LYS A 20 15.705 -15.937 -22.418 1.00 0.00 H new ATOM 0 HA LYS A 20 18.054 -14.332 -22.155 1.00 0.00 H new ATOM 0 HB2 LYS A 20 15.253 -13.596 -23.081 1.00 0.00 H new ATOM 0 HB3 LYS A 20 16.723 -12.700 -23.404 1.00 0.00 H new ATOM 0 HG2 LYS A 20 16.369 -15.566 -24.330 1.00 0.00 H new ATOM 0 HG3 LYS A 20 15.777 -14.213 -25.274 1.00 0.00 H new ATOM 0 HD2 LYS A 20 17.918 -14.784 -26.171 1.00 0.00 H new ATOM 0 HD3 LYS A 20 18.132 -13.280 -25.298 1.00 0.00 H new ATOM 0 HE2 LYS A 20 19.168 -14.427 -23.416 1.00 0.00 H new ATOM 0 HE3 LYS A 20 18.753 -15.999 -24.071 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 21.044 -15.443 -24.510 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 20.181 -15.554 -25.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 20.583 -14.031 -25.333 1.00 0.00 H new ATOM 328 N ALA A 21 15.556 -13.819 -20.087 1.00 0.00 N ATOM 329 CA ALA A 21 15.199 -13.143 -18.853 1.00 0.00 C ATOM 330 C ALA A 21 16.236 -13.448 -17.773 1.00 0.00 C ATOM 331 O ALA A 21 16.473 -12.630 -16.887 1.00 0.00 O ATOM 332 CB ALA A 21 13.810 -13.603 -18.420 1.00 0.00 C ATOM 0 H ALA A 21 14.907 -14.554 -20.366 1.00 0.00 H new ATOM 0 HA ALA A 21 15.183 -12.064 -19.010 1.00 0.00 H new ATOM 0 HB1 ALA A 21 13.533 -13.100 -17.493 1.00 0.00 H new ATOM 0 HB2 ALA A 21 13.086 -13.356 -19.197 1.00 0.00 H new ATOM 0 HB3 ALA A 21 13.817 -14.681 -18.260 1.00 0.00 H new ATOM 338 N PHE A 22 16.860 -14.628 -17.839 1.00 0.00 N ATOM 339 CA PHE A 22 17.890 -14.976 -16.879 1.00 0.00 C ATOM 340 C PHE A 22 19.174 -14.210 -17.182 1.00 0.00 C ATOM 341 O PHE A 22 19.940 -13.909 -16.271 1.00 0.00 O ATOM 342 CB PHE A 22 18.136 -16.484 -16.899 1.00 0.00 C ATOM 343 CG PHE A 22 19.054 -16.928 -15.785 1.00 0.00 C ATOM 344 CD1 PHE A 22 18.571 -16.989 -14.470 1.00 0.00 C ATOM 345 CD2 PHE A 22 20.388 -17.268 -16.060 1.00 0.00 C ATOM 346 CE1 PHE A 22 19.421 -17.375 -13.427 1.00 0.00 C ATOM 347 CE2 PHE A 22 21.237 -17.655 -15.014 1.00 0.00 C ATOM 348 CZ PHE A 22 20.754 -17.704 -13.697 1.00 0.00 C ATOM 0 H PHE A 22 16.668 -15.344 -18.540 1.00 0.00 H new ATOM 0 HA PHE A 22 17.556 -14.696 -15.880 1.00 0.00 H new ATOM 0 HB2 PHE A 22 17.183 -17.007 -16.812 1.00 0.00 H new ATOM 0 HB3 PHE A 22 18.569 -16.767 -17.859 1.00 0.00 H new ATOM 0 HD1 PHE A 22 17.542 -16.738 -14.262 1.00 0.00 H new ATOM 0 HD2 PHE A 22 20.759 -17.232 -17.074 1.00 0.00 H new ATOM 0 HE1 PHE A 22 19.048 -17.419 -12.414 1.00 0.00 H new ATOM 0 HE2 PHE A 22 22.264 -17.916 -15.222 1.00 0.00 H new ATOM 0 HZ PHE A 22 21.412 -17.996 -12.892 1.00 0.00 H new ATOM 358 N ASN A 23 19.421 -13.885 -18.453 1.00 0.00 N ATOM 359 CA ASN A 23 20.608 -13.136 -18.826 1.00 0.00 C ATOM 360 C ASN A 23 20.571 -11.735 -18.224 1.00 0.00 C ATOM 361 O ASN A 23 21.610 -11.205 -17.837 1.00 0.00 O ATOM 362 CB ASN A 23 20.706 -13.091 -20.350 1.00 0.00 C ATOM 363 CG ASN A 23 21.951 -12.347 -20.809 1.00 0.00 C ATOM 364 OD1 ASN A 23 22.983 -12.957 -21.069 1.00 0.00 O ATOM 365 ND2 ASN A 23 21.865 -11.026 -20.913 1.00 0.00 N ATOM 0 H ASN A 23 18.813 -14.131 -19.234 1.00 0.00 H new ATOM 0 HA ASN A 23 21.496 -13.630 -18.431 1.00 0.00 H new ATOM 0 HB2 ASN A 23 20.722 -14.107 -20.744 1.00 0.00 H new ATOM 0 HB3 ASN A 23 19.820 -12.605 -20.758 1.00 0.00 H new ATOM 0 HD21 ASN A 23 22.674 -10.485 -21.218 1.00 0.00 H new ATOM 0 HD22 ASN A 23 20.990 -10.553 -20.688 1.00 0.00 H new ATOM 372 N LEU A 24 19.385 -11.126 -18.136 1.00 0.00 N ATOM 373 CA LEU A 24 19.253 -9.823 -17.500 1.00 0.00 C ATOM 374 C LEU A 24 19.347 -9.970 -15.981 1.00 0.00 C ATOM 375 O LEU A 24 19.717 -9.017 -15.298 1.00 0.00 O ATOM 376 CB LEU A 24 17.924 -9.161 -17.889 1.00 0.00 C ATOM 377 CG LEU A 24 17.926 -8.447 -19.247 1.00 0.00 C ATOM 378 CD1 LEU A 24 19.002 -7.361 -19.303 1.00 0.00 C ATOM 379 CD2 LEU A 24 18.143 -9.416 -20.407 1.00 0.00 C ATOM 0 H LEU A 24 18.513 -11.514 -18.495 1.00 0.00 H new ATOM 0 HA LEU A 24 20.066 -9.185 -17.846 1.00 0.00 H new ATOM 0 HB2 LEU A 24 17.145 -9.923 -17.898 1.00 0.00 H new ATOM 0 HB3 LEU A 24 17.655 -8.440 -17.117 1.00 0.00 H new ATOM 0 HG LEU A 24 16.941 -7.992 -19.351 1.00 0.00 H new ATOM 0 HD11 LEU A 24 18.977 -6.874 -20.278 1.00 0.00 H new ATOM 0 HD12 LEU A 24 18.814 -6.622 -18.524 1.00 0.00 H new ATOM 0 HD13 LEU A 24 19.982 -7.812 -19.147 1.00 0.00 H new ATOM 0 HD21 LEU A 24 18.137 -8.865 -21.347 1.00 0.00 H new ATOM 0 HD22 LEU A 24 19.103 -9.918 -20.287 1.00 0.00 H new ATOM 0 HD23 LEU A 24 17.344 -10.158 -20.416 1.00 0.00 H new ATOM 391 N LEU A 25 19.018 -11.153 -15.449 1.00 0.00 N ATOM 392 CA LEU A 25 19.132 -11.421 -14.024 1.00 0.00 C ATOM 393 C LEU A 25 20.601 -11.625 -13.648 1.00 0.00 C ATOM 394 O LEU A 25 21.004 -11.322 -12.527 1.00 0.00 O ATOM 395 CB LEU A 25 18.273 -12.648 -13.701 1.00 0.00 C ATOM 396 CG LEU A 25 18.196 -12.982 -12.211 1.00 0.00 C ATOM 397 CD1 LEU A 25 17.589 -11.837 -11.404 1.00 0.00 C ATOM 398 CD2 LEU A 25 17.304 -14.208 -12.051 1.00 0.00 C ATOM 0 H LEU A 25 18.669 -11.941 -15.995 1.00 0.00 H new ATOM 0 HA LEU A 25 18.771 -10.578 -13.436 1.00 0.00 H new ATOM 0 HB2 LEU A 25 17.264 -12.481 -14.077 1.00 0.00 H new ATOM 0 HB3 LEU A 25 18.674 -13.509 -14.235 1.00 0.00 H new ATOM 0 HG LEU A 25 19.206 -13.160 -11.842 1.00 0.00 H new ATOM 0 HD11 LEU A 25 17.552 -12.114 -10.350 1.00 0.00 H new ATOM 0 HD12 LEU A 25 18.202 -10.943 -11.523 1.00 0.00 H new ATOM 0 HD13 LEU A 25 16.579 -11.635 -11.762 1.00 0.00 H new ATOM 0 HD21 LEU A 25 17.231 -14.470 -10.995 1.00 0.00 H new ATOM 0 HD22 LEU A 25 16.310 -13.988 -12.440 1.00 0.00 H new ATOM 0 HD23 LEU A 25 17.733 -15.044 -12.603 1.00 0.00 H new ATOM 410 N VAL A 26 21.412 -12.134 -14.584 1.00 0.00 N ATOM 411 CA VAL A 26 22.845 -12.281 -14.372 1.00 0.00 C ATOM 412 C VAL A 26 23.495 -10.903 -14.366 1.00 0.00 C ATOM 413 O VAL A 26 24.319 -10.615 -13.502 1.00 0.00 O ATOM 414 CB VAL A 26 23.456 -13.158 -15.475 1.00 0.00 C ATOM 415 CG1 VAL A 26 24.984 -13.145 -15.398 1.00 0.00 C ATOM 416 CG2 VAL A 26 22.987 -14.602 -15.330 1.00 0.00 C ATOM 0 H VAL A 26 21.091 -12.451 -15.499 1.00 0.00 H new ATOM 0 HA VAL A 26 23.023 -12.766 -13.412 1.00 0.00 H new ATOM 0 HB VAL A 26 23.131 -12.751 -16.432 1.00 0.00 H new ATOM 0 HG11 VAL A 26 25.394 -13.773 -16.189 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.346 -12.124 -15.521 1.00 0.00 H new ATOM 0 HG13 VAL A 26 25.303 -13.528 -14.429 1.00 0.00 H new ATOM 0 HG21 VAL A 26 23.429 -15.209 -16.120 1.00 0.00 H new ATOM 0 HG22 VAL A 26 23.295 -14.989 -14.359 1.00 0.00 H new ATOM 0 HG23 VAL A 26 21.900 -14.641 -15.408 1.00 0.00 H new ATOM 426 N VAL A 27 23.128 -10.041 -15.321 1.00 0.00 N ATOM 427 CA VAL A 27 23.692 -8.698 -15.416 1.00 0.00 C ATOM 428 C VAL A 27 23.303 -7.866 -14.194 1.00 0.00 C ATOM 429 O VAL A 27 23.994 -6.905 -13.856 1.00 0.00 O ATOM 430 CB VAL A 27 23.207 -8.043 -16.718 1.00 0.00 C ATOM 431 CG1 VAL A 27 23.589 -6.562 -16.793 1.00 0.00 C ATOM 432 CG2 VAL A 27 23.848 -8.754 -17.912 1.00 0.00 C ATOM 0 H VAL A 27 22.438 -10.256 -16.041 1.00 0.00 H new ATOM 0 HA VAL A 27 24.780 -8.756 -15.435 1.00 0.00 H new ATOM 0 HB VAL A 27 22.120 -8.127 -16.738 1.00 0.00 H new ATOM 0 HG11 VAL A 27 23.226 -6.140 -17.730 1.00 0.00 H new ATOM 0 HG12 VAL A 27 23.140 -6.028 -15.956 1.00 0.00 H new ATOM 0 HG13 VAL A 27 24.674 -6.463 -16.746 1.00 0.00 H new ATOM 0 HG21 VAL A 27 23.506 -8.291 -18.838 1.00 0.00 H new ATOM 0 HG22 VAL A 27 24.933 -8.672 -17.845 1.00 0.00 H new ATOM 0 HG23 VAL A 27 23.563 -9.806 -17.905 1.00 0.00 H new ATOM 442 N ARG A 28 22.204 -8.228 -13.529 1.00 0.00 N ATOM 443 CA ARG A 28 21.709 -7.503 -12.368 1.00 0.00 C ATOM 444 C ARG A 28 22.575 -7.759 -11.136 1.00 0.00 C ATOM 445 O ARG A 28 22.774 -6.856 -10.328 1.00 0.00 O ATOM 446 CB ARG A 28 20.270 -7.956 -12.111 1.00 0.00 C ATOM 447 CG ARG A 28 19.544 -7.040 -11.123 1.00 0.00 C ATOM 448 CD ARG A 28 18.131 -7.582 -10.906 1.00 0.00 C ATOM 449 NE ARG A 28 17.282 -6.584 -10.244 1.00 0.00 N ATOM 450 CZ ARG A 28 16.107 -6.150 -10.711 1.00 0.00 C ATOM 451 NH1 ARG A 28 15.585 -6.635 -11.834 1.00 0.00 N ATOM 452 NH2 ARG A 28 15.440 -5.213 -10.039 1.00 0.00 N ATOM 0 H ARG A 28 21.634 -9.035 -13.785 1.00 0.00 H new ATOM 0 HA ARG A 28 21.746 -6.432 -12.565 1.00 0.00 H new ATOM 0 HB2 ARG A 28 19.723 -7.977 -13.054 1.00 0.00 H new ATOM 0 HB3 ARG A 28 20.275 -8.975 -11.723 1.00 0.00 H new ATOM 0 HG2 ARG A 28 20.084 -7.000 -10.177 1.00 0.00 H new ATOM 0 HG3 ARG A 28 19.504 -6.022 -11.510 1.00 0.00 H new ATOM 0 HD2 ARG A 28 17.693 -7.860 -11.865 1.00 0.00 H new ATOM 0 HD3 ARG A 28 18.174 -8.488 -10.301 1.00 0.00 H new ATOM 0 HE ARG A 28 17.613 -6.193 -9.362 1.00 0.00 H new ATOM 0 HH11 ARG A 28 16.083 -7.354 -12.359 1.00 0.00 H new ATOM 0 HH12 ARG A 28 14.687 -6.288 -12.170 1.00 0.00 H new ATOM 0 HH21 ARG A 28 15.826 -4.832 -9.175 1.00 0.00 H new ATOM 0 HH22 ARG A 28 14.543 -4.876 -10.388 1.00 0.00 H new ATOM 466 N TYR A 29 23.088 -8.986 -10.994 1.00 0.00 N ATOM 467 CA TYR A 29 23.854 -9.379 -9.817 1.00 0.00 C ATOM 468 C TYR A 29 25.323 -9.702 -10.090 1.00 0.00 C ATOM 469 O TYR A 29 26.048 -9.995 -9.145 1.00 0.00 O ATOM 470 CB TYR A 29 23.160 -10.569 -9.161 1.00 0.00 C ATOM 471 CG TYR A 29 21.819 -10.206 -8.560 1.00 0.00 C ATOM 472 CD1 TYR A 29 21.766 -9.413 -7.407 1.00 0.00 C ATOM 473 CD2 TYR A 29 20.636 -10.658 -9.160 1.00 0.00 C ATOM 474 CE1 TYR A 29 20.528 -9.072 -6.844 1.00 0.00 C ATOM 475 CE2 TYR A 29 19.395 -10.311 -8.610 1.00 0.00 C ATOM 476 CZ TYR A 29 19.336 -9.519 -7.445 1.00 0.00 C ATOM 477 OH TYR A 29 18.127 -9.189 -6.905 1.00 0.00 O ATOM 0 H TYR A 29 22.983 -9.726 -11.688 1.00 0.00 H new ATOM 0 HA TYR A 29 23.877 -8.516 -9.152 1.00 0.00 H new ATOM 0 HB2 TYR A 29 23.020 -11.356 -9.902 1.00 0.00 H new ATOM 0 HB3 TYR A 29 23.805 -10.976 -8.382 1.00 0.00 H new ATOM 0 HD1 TYR A 29 22.680 -9.063 -6.951 1.00 0.00 H new ATOM 0 HD2 TYR A 29 20.681 -11.274 -10.046 1.00 0.00 H new ATOM 0 HE1 TYR A 29 20.489 -8.467 -5.950 1.00 0.00 H new ATOM 0 HE2 TYR A 29 18.483 -10.650 -9.079 1.00 0.00 H new ATOM 0 HH TYR A 29 18.196 -8.322 -6.454 1.00 0.00 H new ATOM 487 N GLN A 30 25.785 -9.660 -11.345 1.00 0.00 N ATOM 488 CA GLN A 30 27.145 -10.090 -11.665 1.00 0.00 C ATOM 489 C GLN A 30 28.212 -9.296 -10.910 1.00 0.00 C ATOM 490 O GLN A 30 29.274 -9.839 -10.605 1.00 0.00 O ATOM 491 CB GLN A 30 27.382 -10.020 -13.178 1.00 0.00 C ATOM 492 CG GLN A 30 27.203 -8.603 -13.734 1.00 0.00 C ATOM 493 CD GLN A 30 27.423 -8.546 -15.239 1.00 0.00 C ATOM 494 OE1 GLN A 30 27.759 -9.543 -15.877 1.00 0.00 O ATOM 495 NE2 GLN A 30 27.236 -7.369 -15.829 1.00 0.00 N ATOM 0 H GLN A 30 25.242 -9.336 -12.145 1.00 0.00 H new ATOM 0 HA GLN A 30 27.239 -11.124 -11.335 1.00 0.00 H new ATOM 0 HB2 GLN A 30 28.390 -10.370 -13.401 1.00 0.00 H new ATOM 0 HB3 GLN A 30 26.691 -10.695 -13.683 1.00 0.00 H new ATOM 0 HG2 GLN A 30 26.200 -8.247 -13.501 1.00 0.00 H new ATOM 0 HG3 GLN A 30 27.903 -7.929 -13.240 1.00 0.00 H new ATOM 0 HE21 GLN A 30 26.957 -6.559 -15.275 1.00 0.00 H new ATOM 0 HE22 GLN A 30 27.371 -7.276 -16.836 1.00 0.00 H new ATOM 504 N HIS A 31 27.948 -8.024 -10.601 1.00 0.00 N ATOM 505 CA HIS A 31 28.916 -7.198 -9.889 1.00 0.00 C ATOM 506 C HIS A 31 28.794 -7.402 -8.382 1.00 0.00 C ATOM 507 O HIS A 31 29.776 -7.261 -7.654 1.00 0.00 O ATOM 508 CB HIS A 31 28.688 -5.735 -10.271 1.00 0.00 C ATOM 509 CG HIS A 31 29.656 -4.787 -9.611 1.00 0.00 C ATOM 510 ND1 HIS A 31 29.336 -3.879 -8.600 1.00 0.00 N ATOM 511 CD2 HIS A 31 30.982 -4.681 -9.908 1.00 0.00 C ATOM 512 CE1 HIS A 31 30.484 -3.242 -8.318 1.00 0.00 C ATOM 513 NE2 HIS A 31 31.487 -3.700 -9.087 1.00 0.00 N ATOM 0 H HIS A 31 27.076 -7.549 -10.833 1.00 0.00 H new ATOM 0 HA HIS A 31 29.928 -7.489 -10.172 1.00 0.00 H new ATOM 0 HB2 HIS A 31 28.771 -5.632 -11.353 1.00 0.00 H new ATOM 0 HB3 HIS A 31 27.671 -5.451 -10.001 1.00 0.00 H new ATOM 0 HD2 HIS A 31 31.528 -5.254 -10.643 1.00 0.00 H new ATOM 0 HE1 HIS A 31 30.588 -2.466 -7.574 1.00 0.00 H new ATOM 0 HE2 HIS A 31 32.454 -3.376 -9.065 1.00 0.00 H new ATOM 521 N LYS A 32 27.591 -7.737 -7.908 1.00 0.00 N ATOM 522 CA LYS A 32 27.316 -7.899 -6.489 1.00 0.00 C ATOM 523 C LYS A 32 27.774 -9.268 -6.002 1.00 0.00 C ATOM 524 O LYS A 32 28.214 -9.408 -4.861 1.00 0.00 O ATOM 525 CB LYS A 32 25.814 -7.702 -6.284 1.00 0.00 C ATOM 526 CG LYS A 32 25.477 -7.471 -4.816 1.00 0.00 C ATOM 527 CD LYS A 32 23.967 -7.276 -4.671 1.00 0.00 C ATOM 528 CE LYS A 32 23.622 -6.981 -3.212 1.00 0.00 C ATOM 529 NZ LYS A 32 22.167 -6.800 -3.041 1.00 0.00 N ATOM 0 H LYS A 32 26.781 -7.903 -8.505 1.00 0.00 H new ATOM 0 HA LYS A 32 27.868 -7.162 -5.905 1.00 0.00 H new ATOM 0 HB2 LYS A 32 25.473 -6.852 -6.875 1.00 0.00 H new ATOM 0 HB3 LYS A 32 25.278 -8.578 -6.648 1.00 0.00 H new ATOM 0 HG2 LYS A 32 25.805 -8.321 -4.217 1.00 0.00 H new ATOM 0 HG3 LYS A 32 26.006 -6.594 -4.443 1.00 0.00 H new ATOM 0 HD2 LYS A 32 23.634 -6.455 -5.306 1.00 0.00 H new ATOM 0 HD3 LYS A 32 23.442 -8.171 -5.005 1.00 0.00 H new ATOM 0 HE2 LYS A 32 23.968 -7.799 -2.580 1.00 0.00 H new ATOM 0 HE3 LYS A 32 24.145 -6.082 -2.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 21.957 -6.601 -2.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 21.845 -6.004 -3.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 21.673 -7.667 -3.332 1.00 0.00 H new ATOM 543 N VAL A 33 27.677 -10.281 -6.865 1.00 0.00 N ATOM 544 CA VAL A 33 28.119 -11.628 -6.525 1.00 0.00 C ATOM 545 C VAL A 33 29.636 -11.734 -6.653 1.00 0.00 C ATOM 546 O VAL A 33 30.259 -12.529 -5.953 1.00 0.00 O ATOM 547 CB VAL A 33 27.391 -12.648 -7.405 1.00 0.00 C ATOM 548 CG1 VAL A 33 27.919 -12.626 -8.835 1.00 0.00 C ATOM 549 CG2 VAL A 33 27.562 -14.052 -6.834 1.00 0.00 C ATOM 0 H VAL A 33 27.295 -10.190 -7.806 1.00 0.00 H new ATOM 0 HA VAL A 33 27.868 -11.847 -5.487 1.00 0.00 H new ATOM 0 HB VAL A 33 26.335 -12.377 -7.417 1.00 0.00 H new ATOM 0 HG11 VAL A 33 27.381 -13.362 -9.433 1.00 0.00 H new ATOM 0 HG12 VAL A 33 27.772 -11.634 -9.262 1.00 0.00 H new ATOM 0 HG13 VAL A 33 28.982 -12.867 -8.834 1.00 0.00 H new ATOM 0 HG21 VAL A 33 27.040 -14.769 -7.468 1.00 0.00 H new ATOM 0 HG22 VAL A 33 28.622 -14.304 -6.798 1.00 0.00 H new ATOM 0 HG23 VAL A 33 27.146 -14.088 -5.827 1.00 0.00 H new ATOM 559 N ALA A 34 30.240 -10.939 -7.541 1.00 0.00 N ATOM 560 CA ALA A 34 31.686 -10.924 -7.689 1.00 0.00 C ATOM 561 C ALA A 34 32.350 -10.329 -6.447 1.00 0.00 C ATOM 562 O ALA A 34 33.492 -10.663 -6.144 1.00 0.00 O ATOM 563 CB ALA A 34 32.047 -10.123 -8.941 1.00 0.00 C ATOM 0 H ALA A 34 29.745 -10.301 -8.164 1.00 0.00 H new ATOM 0 HA ALA A 34 32.053 -11.945 -7.797 1.00 0.00 H new ATOM 0 HB1 ALA A 34 33.130 -10.105 -9.062 1.00 0.00 H new ATOM 0 HB2 ALA A 34 31.592 -10.589 -9.815 1.00 0.00 H new ATOM 0 HB3 ALA A 34 31.676 -9.103 -8.840 1.00 0.00 H new ATOM 569 N SER A 35 31.634 -9.456 -5.730 1.00 0.00 N ATOM 570 CA SER A 35 32.113 -8.875 -4.484 1.00 0.00 C ATOM 571 C SER A 35 31.949 -9.856 -3.326 1.00 0.00 C ATOM 572 O SER A 35 32.634 -9.732 -2.313 1.00 0.00 O ATOM 573 CB SER A 35 31.365 -7.576 -4.197 1.00 0.00 C ATOM 574 OG SER A 35 31.609 -6.639 -5.223 1.00 0.00 O ATOM 0 H SER A 35 30.705 -9.136 -6.003 1.00 0.00 H new ATOM 0 HA SER A 35 33.176 -8.656 -4.588 1.00 0.00 H new ATOM 0 HB2 SER A 35 30.296 -7.772 -4.120 1.00 0.00 H new ATOM 0 HB3 SER A 35 31.684 -7.168 -3.238 1.00 0.00 H new ATOM 0 HG SER A 35 31.032 -6.836 -5.990 1.00 0.00 H new ATOM 580 N LEU A 36 31.042 -10.831 -3.470 1.00 0.00 N ATOM 581 CA LEU A 36 30.846 -11.860 -2.461 1.00 0.00 C ATOM 582 C LEU A 36 31.844 -13.007 -2.610 1.00 0.00 C ATOM 583 O LEU A 36 32.402 -13.459 -1.612 1.00 0.00 O ATOM 584 CB LEU A 36 29.409 -12.368 -2.560 1.00 0.00 C ATOM 585 CG LEU A 36 29.145 -13.566 -1.638 1.00 0.00 C ATOM 586 CD1 LEU A 36 29.397 -13.228 -0.170 1.00 0.00 C ATOM 587 CD2 LEU A 36 27.689 -13.984 -1.809 1.00 0.00 C ATOM 0 H LEU A 36 30.433 -10.922 -4.283 1.00 0.00 H new ATOM 0 HA LEU A 36 31.022 -11.428 -1.476 1.00 0.00 H new ATOM 0 HB2 LEU A 36 28.723 -11.560 -2.306 1.00 0.00 H new ATOM 0 HB3 LEU A 36 29.198 -12.653 -3.591 1.00 0.00 H new ATOM 0 HG LEU A 36 29.828 -14.370 -1.912 1.00 0.00 H new ATOM 0 HD11 LEU A 36 29.197 -14.106 0.445 1.00 0.00 H new ATOM 0 HD12 LEU A 36 30.435 -12.922 -0.040 1.00 0.00 H new ATOM 0 HD13 LEU A 36 28.739 -12.414 0.134 1.00 0.00 H new ATOM 0 HD21 LEU A 36 27.477 -14.836 -1.163 1.00 0.00 H new ATOM 0 HD22 LEU A 36 27.038 -13.153 -1.540 1.00 0.00 H new ATOM 0 HD23 LEU A 36 27.510 -14.263 -2.847 1.00 0.00 H new ATOM 599 N VAL A 37 32.089 -13.494 -3.832 1.00 0.00 N ATOM 600 CA VAL A 37 32.977 -14.639 -3.995 1.00 0.00 C ATOM 601 C VAL A 37 34.441 -14.231 -3.910 1.00 0.00 C ATOM 602 O VAL A 37 35.289 -15.070 -3.617 1.00 0.00 O ATOM 603 CB VAL A 37 32.690 -15.404 -5.291 1.00 0.00 C ATOM 604 CG1 VAL A 37 31.215 -15.790 -5.392 1.00 0.00 C ATOM 605 CG2 VAL A 37 33.089 -14.601 -6.523 1.00 0.00 C ATOM 0 H VAL A 37 31.695 -13.123 -4.697 1.00 0.00 H new ATOM 0 HA VAL A 37 32.775 -15.316 -3.165 1.00 0.00 H new ATOM 0 HB VAL A 37 33.295 -16.310 -5.257 1.00 0.00 H new ATOM 0 HG11 VAL A 37 31.043 -16.331 -6.322 1.00 0.00 H new ATOM 0 HG12 VAL A 37 30.946 -16.425 -4.548 1.00 0.00 H new ATOM 0 HG13 VAL A 37 30.601 -14.889 -5.378 1.00 0.00 H new ATOM 0 HG21 VAL A 37 32.869 -15.179 -7.421 1.00 0.00 H new ATOM 0 HG22 VAL A 37 32.528 -13.667 -6.546 1.00 0.00 H new ATOM 0 HG23 VAL A 37 34.156 -14.382 -6.485 1.00 0.00 H new ATOM 615 N SER A 38 34.754 -12.958 -4.160 1.00 0.00 N ATOM 616 CA SER A 38 36.122 -12.460 -4.061 1.00 0.00 C ATOM 617 C SER A 38 36.649 -12.601 -2.631 1.00 0.00 C ATOM 618 O SER A 38 37.851 -12.495 -2.399 1.00 0.00 O ATOM 619 CB SER A 38 36.182 -11.007 -4.523 1.00 0.00 C ATOM 620 OG SER A 38 35.405 -10.195 -3.670 1.00 0.00 O ATOM 0 H SER A 38 34.071 -12.251 -4.434 1.00 0.00 H new ATOM 0 HA SER A 38 36.761 -13.058 -4.711 1.00 0.00 H new ATOM 0 HB2 SER A 38 37.215 -10.660 -4.526 1.00 0.00 H new ATOM 0 HB3 SER A 38 35.816 -10.927 -5.547 1.00 0.00 H new ATOM 0 HG SER A 38 35.451 -9.264 -3.973 1.00 0.00 H new ATOM 626 N ARG A 39 35.748 -12.838 -1.673 1.00 0.00 N ATOM 627 CA ARG A 39 36.102 -13.027 -0.272 1.00 0.00 C ATOM 628 C ARG A 39 36.620 -14.440 -0.017 1.00 0.00 C ATOM 629 O ARG A 39 37.126 -14.716 1.071 1.00 0.00 O ATOM 630 CB ARG A 39 34.871 -12.750 0.595 1.00 0.00 C ATOM 631 CG ARG A 39 34.230 -11.406 0.242 1.00 0.00 C ATOM 632 CD ARG A 39 32.992 -11.179 1.103 1.00 0.00 C ATOM 633 NE ARG A 39 32.274 -9.976 0.665 1.00 0.00 N ATOM 634 CZ ARG A 39 31.281 -9.403 1.350 1.00 0.00 C ATOM 635 NH1 ARG A 39 30.870 -9.914 2.509 1.00 0.00 N ATOM 636 NH2 ARG A 39 30.692 -8.312 0.871 1.00 0.00 N ATOM 0 H ARG A 39 34.746 -12.904 -1.854 1.00 0.00 H new ATOM 0 HA ARG A 39 36.901 -12.332 -0.014 1.00 0.00 H new ATOM 0 HB2 ARG A 39 34.142 -13.549 0.460 1.00 0.00 H new ATOM 0 HB3 ARG A 39 35.157 -12.753 1.647 1.00 0.00 H new ATOM 0 HG2 ARG A 39 34.946 -10.599 0.399 1.00 0.00 H new ATOM 0 HG3 ARG A 39 33.958 -11.389 -0.813 1.00 0.00 H new ATOM 0 HD2 ARG A 39 32.334 -12.046 1.040 1.00 0.00 H new ATOM 0 HD3 ARG A 39 33.283 -11.076 2.148 1.00 0.00 H new ATOM 0 HE ARG A 39 32.551 -9.550 -0.219 1.00 0.00 H new ATOM 0 HH11 ARG A 39 31.315 -10.752 2.883 1.00 0.00 H new ATOM 0 HH12 ARG A 39 30.111 -9.467 3.023 1.00 0.00 H new ATOM 0 HH21 ARG A 39 30.999 -7.915 -0.017 1.00 0.00 H new ATOM 0 HH22 ARG A 39 29.933 -7.872 1.392 1.00 0.00 H new ATOM 650 N TYR A 40 36.503 -15.338 -1.003 1.00 0.00 N ATOM 651 CA TYR A 40 36.915 -16.727 -0.849 1.00 0.00 C ATOM 652 C TYR A 40 37.876 -17.178 -1.952 1.00 0.00 C ATOM 653 O TYR A 40 38.514 -18.219 -1.809 1.00 0.00 O ATOM 654 CB TYR A 40 35.662 -17.608 -0.796 1.00 0.00 C ATOM 655 CG TYR A 40 34.629 -17.106 0.192 1.00 0.00 C ATOM 656 CD1 TYR A 40 34.829 -17.284 1.568 1.00 0.00 C ATOM 657 CD2 TYR A 40 33.477 -16.441 -0.268 1.00 0.00 C ATOM 658 CE1 TYR A 40 33.887 -16.800 2.489 1.00 0.00 C ATOM 659 CE2 TYR A 40 32.538 -15.947 0.644 1.00 0.00 C ATOM 660 CZ TYR A 40 32.738 -16.122 2.029 1.00 0.00 C ATOM 661 OH TYR A 40 31.823 -15.641 2.917 1.00 0.00 O ATOM 0 H TYR A 40 36.121 -15.118 -1.923 1.00 0.00 H new ATOM 0 HA TYR A 40 37.471 -16.826 0.083 1.00 0.00 H new ATOM 0 HB2 TYR A 40 35.215 -17.655 -1.789 1.00 0.00 H new ATOM 0 HB3 TYR A 40 35.950 -18.624 -0.528 1.00 0.00 H new ATOM 0 HD1 TYR A 40 35.712 -17.796 1.921 1.00 0.00 H new ATOM 0 HD2 TYR A 40 33.317 -16.312 -1.328 1.00 0.00 H new ATOM 0 HE1 TYR A 40 34.041 -16.946 3.548 1.00 0.00 H new ATOM 0 HE2 TYR A 40 31.659 -15.431 0.287 1.00 0.00 H new ATOM 0 HH TYR A 40 31.095 -15.201 2.430 1.00 0.00 H new ATOM 671 N VAL A 41 37.991 -16.417 -3.047 1.00 0.00 N ATOM 672 CA VAL A 41 38.930 -16.717 -4.126 1.00 0.00 C ATOM 673 C VAL A 41 39.643 -15.445 -4.586 1.00 0.00 C ATOM 674 O VAL A 41 39.098 -14.349 -4.449 1.00 0.00 O ATOM 675 CB VAL A 41 38.232 -17.383 -5.321 1.00 0.00 C ATOM 676 CG1 VAL A 41 37.908 -18.844 -5.021 1.00 0.00 C ATOM 677 CG2 VAL A 41 36.944 -16.669 -5.727 1.00 0.00 C ATOM 0 H VAL A 41 37.435 -15.577 -3.207 1.00 0.00 H new ATOM 0 HA VAL A 41 39.664 -17.419 -3.730 1.00 0.00 H new ATOM 0 HB VAL A 41 38.936 -17.317 -6.151 1.00 0.00 H new ATOM 0 HG11 VAL A 41 37.414 -19.292 -5.883 1.00 0.00 H new ATOM 0 HG12 VAL A 41 38.830 -19.385 -4.809 1.00 0.00 H new ATOM 0 HG13 VAL A 41 37.248 -18.900 -4.156 1.00 0.00 H new ATOM 0 HG21 VAL A 41 36.495 -17.184 -6.576 1.00 0.00 H new ATOM 0 HG22 VAL A 41 36.246 -16.673 -4.890 1.00 0.00 H new ATOM 0 HG23 VAL A 41 37.171 -15.640 -6.005 1.00 0.00 H new ATOM 687 N PRO A 42 40.859 -15.576 -5.131 1.00 0.00 N ATOM 688 CA PRO A 42 41.617 -14.464 -5.672 1.00 0.00 C ATOM 689 C PRO A 42 40.952 -13.951 -6.944 1.00 0.00 C ATOM 690 O PRO A 42 40.143 -14.649 -7.556 1.00 0.00 O ATOM 691 CB PRO A 42 43.013 -15.024 -5.948 1.00 0.00 C ATOM 692 CG PRO A 42 42.733 -16.494 -6.245 1.00 0.00 C ATOM 693 CD PRO A 42 41.592 -16.819 -5.278 1.00 0.00 C ATOM 0 HA PRO A 42 41.666 -13.616 -4.989 1.00 0.00 H new ATOM 0 HB2 PRO A 42 43.490 -14.524 -6.791 1.00 0.00 H new ATOM 0 HB3 PRO A 42 43.674 -14.903 -5.090 1.00 0.00 H new ATOM 0 HG2 PRO A 42 42.441 -16.649 -7.284 1.00 0.00 H new ATOM 0 HG3 PRO A 42 43.608 -17.118 -6.064 1.00 0.00 H new ATOM 0 HD2 PRO A 42 40.953 -17.609 -5.672 1.00 0.00 H new ATOM 0 HD3 PRO A 42 41.975 -17.167 -4.319 1.00 0.00 H new ATOM 701 N SER A 43 41.292 -12.724 -7.347 1.00 0.00 N ATOM 702 CA SER A 43 40.663 -12.062 -8.484 1.00 0.00 C ATOM 703 C SER A 43 40.819 -12.864 -9.777 1.00 0.00 C ATOM 704 O SER A 43 40.042 -12.683 -10.713 1.00 0.00 O ATOM 705 CB SER A 43 41.282 -10.676 -8.634 1.00 0.00 C ATOM 706 OG SER A 43 40.585 -9.938 -9.618 1.00 0.00 O ATOM 0 H SER A 43 42.012 -12.164 -6.891 1.00 0.00 H new ATOM 0 HA SER A 43 39.592 -11.983 -8.297 1.00 0.00 H new ATOM 0 HB2 SER A 43 41.248 -10.149 -7.681 1.00 0.00 H new ATOM 0 HB3 SER A 43 42.332 -10.766 -8.911 1.00 0.00 H new ATOM 0 HG SER A 43 40.988 -9.049 -9.707 1.00 0.00 H new ATOM 712 N GLY A 44 41.812 -13.755 -9.837 1.00 0.00 N ATOM 713 CA GLY A 44 42.053 -14.568 -11.017 1.00 0.00 C ATOM 714 C GLY A 44 41.027 -15.689 -11.181 1.00 0.00 C ATOM 715 O GLY A 44 40.947 -16.283 -12.256 1.00 0.00 O ATOM 0 H GLY A 44 42.464 -13.928 -9.071 1.00 0.00 H new ATOM 0 HA2 GLY A 44 42.034 -13.932 -11.902 1.00 0.00 H new ATOM 0 HA3 GLY A 44 43.052 -15.001 -10.957 1.00 0.00 H new ATOM 719 N ASP A 45 40.244 -15.986 -10.137 1.00 0.00 N ATOM 720 CA ASP A 45 39.239 -17.040 -10.179 1.00 0.00 C ATOM 721 C ASP A 45 37.827 -16.499 -9.960 1.00 0.00 C ATOM 722 O ASP A 45 36.860 -17.250 -10.081 1.00 0.00 O ATOM 723 CB ASP A 45 39.580 -18.115 -9.148 1.00 0.00 C ATOM 724 CG ASP A 45 40.906 -18.803 -9.467 1.00 0.00 C ATOM 725 OD1 ASP A 45 41.090 -19.200 -10.637 1.00 0.00 O ATOM 726 OD2 ASP A 45 41.728 -18.930 -8.533 1.00 0.00 O ATOM 0 H ASP A 45 40.294 -15.499 -9.242 1.00 0.00 H new ATOM 0 HA ASP A 45 39.252 -17.480 -11.176 1.00 0.00 H new ATOM 0 HB2 ASP A 45 39.633 -17.665 -8.157 1.00 0.00 H new ATOM 0 HB3 ASP A 45 38.782 -18.857 -9.119 1.00 0.00 H new ATOM 731 N VAL A 46 37.686 -15.208 -9.639 1.00 0.00 N ATOM 732 CA VAL A 46 36.375 -14.617 -9.396 1.00 0.00 C ATOM 733 C VAL A 46 35.440 -14.785 -10.596 1.00 0.00 C ATOM 734 O VAL A 46 34.327 -15.265 -10.408 1.00 0.00 O ATOM 735 CB VAL A 46 36.520 -13.140 -9.009 1.00 0.00 C ATOM 736 CG1 VAL A 46 35.167 -12.430 -8.984 1.00 0.00 C ATOM 737 CG2 VAL A 46 37.116 -13.027 -7.607 1.00 0.00 C ATOM 0 H VAL A 46 38.465 -14.557 -9.543 1.00 0.00 H new ATOM 0 HA VAL A 46 35.919 -15.151 -8.563 1.00 0.00 H new ATOM 0 HB VAL A 46 37.165 -12.676 -9.755 1.00 0.00 H new ATOM 0 HG11 VAL A 46 35.309 -11.386 -8.706 1.00 0.00 H new ATOM 0 HG12 VAL A 46 34.710 -12.483 -9.972 1.00 0.00 H new ATOM 0 HG13 VAL A 46 34.516 -12.914 -8.256 1.00 0.00 H new ATOM 0 HG21 VAL A 46 37.216 -11.975 -7.338 1.00 0.00 H new ATOM 0 HG22 VAL A 46 36.460 -13.523 -6.892 1.00 0.00 H new ATOM 0 HG23 VAL A 46 38.097 -13.501 -7.589 1.00 0.00 H new ATOM 747 N PRO A 47 35.831 -14.417 -11.827 1.00 0.00 N ATOM 748 CA PRO A 47 34.917 -14.465 -12.958 1.00 0.00 C ATOM 749 C PRO A 47 34.532 -15.898 -13.319 1.00 0.00 C ATOM 750 O PRO A 47 33.493 -16.113 -13.938 1.00 0.00 O ATOM 751 CB PRO A 47 35.665 -13.781 -14.103 1.00 0.00 C ATOM 752 CG PRO A 47 37.131 -14.025 -13.758 1.00 0.00 C ATOM 753 CD PRO A 47 37.131 -13.918 -12.239 1.00 0.00 C ATOM 0 HA PRO A 47 33.975 -13.966 -12.732 1.00 0.00 H new ATOM 0 HB2 PRO A 47 35.402 -14.211 -15.069 1.00 0.00 H new ATOM 0 HB3 PRO A 47 35.435 -12.717 -14.155 1.00 0.00 H new ATOM 0 HG2 PRO A 47 37.471 -15.004 -14.096 1.00 0.00 H new ATOM 0 HG3 PRO A 47 37.785 -13.284 -14.218 1.00 0.00 H new ATOM 0 HD2 PRO A 47 37.937 -14.508 -11.802 1.00 0.00 H new ATOM 0 HD3 PRO A 47 37.279 -12.888 -11.916 1.00 0.00 H new ATOM 761 N ASP A 48 35.352 -16.882 -12.942 1.00 0.00 N ATOM 762 CA ASP A 48 35.058 -18.278 -13.235 1.00 0.00 C ATOM 763 C ASP A 48 34.135 -18.873 -12.171 1.00 0.00 C ATOM 764 O ASP A 48 33.316 -19.746 -12.467 1.00 0.00 O ATOM 765 CB ASP A 48 36.375 -19.046 -13.323 1.00 0.00 C ATOM 766 CG ASP A 48 36.142 -20.501 -13.722 1.00 0.00 C ATOM 767 OD1 ASP A 48 35.753 -20.720 -14.892 1.00 0.00 O ATOM 768 OD2 ASP A 48 36.355 -21.381 -12.860 1.00 0.00 O ATOM 0 H ASP A 48 36.224 -16.733 -12.433 1.00 0.00 H new ATOM 0 HA ASP A 48 34.535 -18.354 -14.188 1.00 0.00 H new ATOM 0 HB2 ASP A 48 37.030 -18.567 -14.051 1.00 0.00 H new ATOM 0 HB3 ASP A 48 36.886 -19.008 -12.361 1.00 0.00 H new ATOM 773 N VAL A 49 34.260 -18.402 -10.927 1.00 0.00 N ATOM 774 CA VAL A 49 33.428 -18.869 -9.825 1.00 0.00 C ATOM 775 C VAL A 49 32.071 -18.172 -9.856 1.00 0.00 C ATOM 776 O VAL A 49 31.073 -18.750 -9.426 1.00 0.00 O ATOM 777 CB VAL A 49 34.175 -18.627 -8.509 1.00 0.00 C ATOM 778 CG1 VAL A 49 33.279 -18.877 -7.298 1.00 0.00 C ATOM 779 CG2 VAL A 49 35.363 -19.584 -8.414 1.00 0.00 C ATOM 0 H VAL A 49 34.939 -17.689 -10.661 1.00 0.00 H new ATOM 0 HA VAL A 49 33.235 -19.938 -9.919 1.00 0.00 H new ATOM 0 HB VAL A 49 34.501 -17.587 -8.505 1.00 0.00 H new ATOM 0 HG11 VAL A 49 33.844 -18.695 -6.384 1.00 0.00 H new ATOM 0 HG12 VAL A 49 32.422 -18.205 -7.335 1.00 0.00 H new ATOM 0 HG13 VAL A 49 32.931 -19.910 -7.310 1.00 0.00 H new ATOM 0 HG21 VAL A 49 35.895 -19.412 -7.478 1.00 0.00 H new ATOM 0 HG22 VAL A 49 35.005 -20.613 -8.444 1.00 0.00 H new ATOM 0 HG23 VAL A 49 36.038 -19.410 -9.252 1.00 0.00 H new ATOM 789 N VAL A 50 32.019 -16.937 -10.367 1.00 0.00 N ATOM 790 CA VAL A 50 30.762 -16.221 -10.517 1.00 0.00 C ATOM 791 C VAL A 50 29.939 -16.854 -11.629 1.00 0.00 C ATOM 792 O VAL A 50 28.719 -16.957 -11.517 1.00 0.00 O ATOM 793 CB VAL A 50 31.035 -14.747 -10.839 1.00 0.00 C ATOM 794 CG1 VAL A 50 29.765 -14.061 -11.336 1.00 0.00 C ATOM 795 CG2 VAL A 50 31.545 -14.022 -9.598 1.00 0.00 C ATOM 0 H VAL A 50 32.838 -16.418 -10.682 1.00 0.00 H new ATOM 0 HA VAL A 50 30.203 -16.280 -9.583 1.00 0.00 H new ATOM 0 HB VAL A 50 31.792 -14.706 -11.622 1.00 0.00 H new ATOM 0 HG11 VAL A 50 29.979 -13.016 -11.559 1.00 0.00 H new ATOM 0 HG12 VAL A 50 29.412 -14.560 -12.239 1.00 0.00 H new ATOM 0 HG13 VAL A 50 28.996 -14.117 -10.566 1.00 0.00 H new ATOM 0 HG21 VAL A 50 31.735 -12.976 -9.840 1.00 0.00 H new ATOM 0 HG22 VAL A 50 30.796 -14.081 -8.808 1.00 0.00 H new ATOM 0 HG23 VAL A 50 32.469 -14.489 -9.258 1.00 0.00 H new ATOM 805 N GLN A 51 30.594 -17.283 -12.710 1.00 0.00 N ATOM 806 CA GLN A 51 29.881 -17.844 -13.844 1.00 0.00 C ATOM 807 C GLN A 51 29.348 -19.233 -13.499 1.00 0.00 C ATOM 808 O GLN A 51 28.337 -19.662 -14.048 1.00 0.00 O ATOM 809 CB GLN A 51 30.815 -17.871 -15.053 1.00 0.00 C ATOM 810 CG GLN A 51 30.028 -18.040 -16.352 1.00 0.00 C ATOM 811 CD GLN A 51 29.041 -16.895 -16.559 1.00 0.00 C ATOM 812 OE1 GLN A 51 27.837 -17.110 -16.656 1.00 0.00 O ATOM 813 NE2 GLN A 51 29.548 -15.666 -16.629 1.00 0.00 N ATOM 0 H GLN A 51 31.608 -17.251 -12.818 1.00 0.00 H new ATOM 0 HA GLN A 51 29.019 -17.225 -14.091 1.00 0.00 H new ATOM 0 HB2 GLN A 51 31.392 -16.947 -15.091 1.00 0.00 H new ATOM 0 HB3 GLN A 51 31.528 -18.688 -14.947 1.00 0.00 H new ATOM 0 HG2 GLN A 51 30.719 -18.084 -17.194 1.00 0.00 H new ATOM 0 HG3 GLN A 51 29.489 -18.987 -16.332 1.00 0.00 H new ATOM 0 HE21 GLN A 51 30.554 -15.524 -16.544 1.00 0.00 H new ATOM 0 HE22 GLN A 51 28.930 -14.866 -16.767 1.00 0.00 H new ATOM 822 N GLU A 52 30.016 -19.941 -12.584 1.00 0.00 N ATOM 823 CA GLU A 52 29.537 -21.239 -12.136 1.00 0.00 C ATOM 824 C GLU A 52 28.392 -21.069 -11.138 1.00 0.00 C ATOM 825 O GLU A 52 27.569 -21.968 -10.977 1.00 0.00 O ATOM 826 CB GLU A 52 30.710 -22.019 -11.536 1.00 0.00 C ATOM 827 CG GLU A 52 30.304 -23.459 -11.218 1.00 0.00 C ATOM 828 CD GLU A 52 31.516 -24.289 -10.798 1.00 0.00 C ATOM 829 OE1 GLU A 52 31.878 -24.225 -9.602 1.00 0.00 O ATOM 830 OE2 GLU A 52 32.071 -24.978 -11.681 1.00 0.00 O ATOM 0 H GLU A 52 30.884 -19.634 -12.145 1.00 0.00 H new ATOM 0 HA GLU A 52 29.141 -21.805 -12.979 1.00 0.00 H new ATOM 0 HB2 GLU A 52 31.547 -22.019 -12.234 1.00 0.00 H new ATOM 0 HB3 GLU A 52 31.053 -21.525 -10.627 1.00 0.00 H new ATOM 0 HG2 GLU A 52 29.561 -23.464 -10.420 1.00 0.00 H new ATOM 0 HG3 GLU A 52 29.835 -23.910 -12.093 1.00 0.00 H new ATOM 837 N ALA A 53 28.327 -19.917 -10.461 1.00 0.00 N ATOM 838 CA ALA A 53 27.291 -19.652 -9.479 1.00 0.00 C ATOM 839 C ALA A 53 25.961 -19.317 -10.157 1.00 0.00 C ATOM 840 O ALA A 53 24.902 -19.625 -9.613 1.00 0.00 O ATOM 841 CB ALA A 53 27.747 -18.506 -8.572 1.00 0.00 C ATOM 0 H ALA A 53 28.990 -19.152 -10.583 1.00 0.00 H new ATOM 0 HA ALA A 53 27.129 -20.547 -8.878 1.00 0.00 H new ATOM 0 HB1 ALA A 53 26.975 -18.299 -7.831 1.00 0.00 H new ATOM 0 HB2 ALA A 53 28.670 -18.788 -8.066 1.00 0.00 H new ATOM 0 HB3 ALA A 53 27.921 -17.613 -9.173 1.00 0.00 H new ATOM 847 N PHE A 54 25.996 -18.695 -11.344 1.00 0.00 N ATOM 848 CA PHE A 54 24.777 -18.370 -12.071 1.00 0.00 C ATOM 849 C PHE A 54 24.267 -19.578 -12.849 1.00 0.00 C ATOM 850 O PHE A 54 23.060 -19.733 -13.010 1.00 0.00 O ATOM 851 CB PHE A 54 25.021 -17.191 -13.016 1.00 0.00 C ATOM 852 CG PHE A 54 25.067 -15.844 -12.328 1.00 0.00 C ATOM 853 CD1 PHE A 54 23.936 -15.357 -11.655 1.00 0.00 C ATOM 854 CD2 PHE A 54 26.235 -15.069 -12.376 1.00 0.00 C ATOM 855 CE1 PHE A 54 23.968 -14.097 -11.043 1.00 0.00 C ATOM 856 CE2 PHE A 54 26.269 -13.812 -11.757 1.00 0.00 C ATOM 857 CZ PHE A 54 25.134 -13.325 -11.096 1.00 0.00 C ATOM 0 H PHE A 54 26.856 -18.411 -11.813 1.00 0.00 H new ATOM 0 HA PHE A 54 24.013 -18.087 -11.346 1.00 0.00 H new ATOM 0 HB2 PHE A 54 25.962 -17.350 -13.542 1.00 0.00 H new ATOM 0 HB3 PHE A 54 24.234 -17.175 -13.770 1.00 0.00 H new ATOM 0 HD1 PHE A 54 23.038 -15.955 -11.609 1.00 0.00 H new ATOM 0 HD2 PHE A 54 27.109 -15.441 -12.890 1.00 0.00 H new ATOM 0 HE1 PHE A 54 23.094 -13.722 -10.531 1.00 0.00 H new ATOM 0 HE2 PHE A 54 27.171 -13.219 -11.790 1.00 0.00 H new ATOM 0 HZ PHE A 54 25.159 -12.353 -10.627 1.00 0.00 H new ATOM 867 N ILE A 55 25.158 -20.447 -13.337 1.00 0.00 N ATOM 868 CA ILE A 55 24.728 -21.635 -14.057 1.00 0.00 C ATOM 869 C ILE A 55 24.146 -22.660 -13.085 1.00 0.00 C ATOM 870 O ILE A 55 23.259 -23.425 -13.462 1.00 0.00 O ATOM 871 CB ILE A 55 25.904 -22.184 -14.875 1.00 0.00 C ATOM 872 CG1 ILE A 55 25.899 -21.591 -16.290 1.00 0.00 C ATOM 873 CG2 ILE A 55 25.827 -23.705 -15.021 1.00 0.00 C ATOM 874 CD1 ILE A 55 25.862 -20.063 -16.318 1.00 0.00 C ATOM 0 H ILE A 55 26.169 -20.346 -13.245 1.00 0.00 H new ATOM 0 HA ILE A 55 23.930 -21.387 -14.757 1.00 0.00 H new ATOM 0 HB ILE A 55 26.812 -21.908 -14.339 1.00 0.00 H new ATOM 0 HG12 ILE A 55 26.787 -21.933 -16.821 1.00 0.00 H new ATOM 0 HG13 ILE A 55 25.035 -21.976 -16.832 1.00 0.00 H new ATOM 0 HG21 ILE A 55 26.676 -24.058 -15.606 1.00 0.00 H new ATOM 0 HG22 ILE A 55 25.849 -24.167 -14.034 1.00 0.00 H new ATOM 0 HG23 ILE A 55 24.900 -23.975 -15.527 1.00 0.00 H new ATOM 0 HD11 ILE A 55 25.861 -19.718 -17.352 1.00 0.00 H new ATOM 0 HD12 ILE A 55 24.960 -19.712 -15.817 1.00 0.00 H new ATOM 0 HD13 ILE A 55 26.739 -19.668 -15.805 1.00 0.00 H new ATOM 886 N LYS A 56 24.628 -22.686 -11.839 1.00 0.00 N ATOM 887 CA LYS A 56 24.064 -23.578 -10.835 1.00 0.00 C ATOM 888 C LYS A 56 22.702 -23.055 -10.391 1.00 0.00 C ATOM 889 O LYS A 56 21.814 -23.838 -10.058 1.00 0.00 O ATOM 890 CB LYS A 56 25.034 -23.686 -9.655 1.00 0.00 C ATOM 891 CG LYS A 56 24.600 -24.752 -8.644 1.00 0.00 C ATOM 892 CD LYS A 56 24.530 -26.142 -9.286 1.00 0.00 C ATOM 893 CE LYS A 56 24.256 -27.228 -8.244 1.00 0.00 C ATOM 894 NZ LYS A 56 22.940 -27.049 -7.607 1.00 0.00 N ATOM 0 H LYS A 56 25.399 -22.105 -11.509 1.00 0.00 H new ATOM 0 HA LYS A 56 23.920 -24.574 -11.254 1.00 0.00 H new ATOM 0 HB2 LYS A 56 26.030 -23.925 -10.027 1.00 0.00 H new ATOM 0 HB3 LYS A 56 25.104 -22.720 -9.155 1.00 0.00 H new ATOM 0 HG2 LYS A 56 25.302 -24.771 -7.810 1.00 0.00 H new ATOM 0 HG3 LYS A 56 23.625 -24.490 -8.234 1.00 0.00 H new ATOM 0 HD2 LYS A 56 23.745 -26.156 -10.042 1.00 0.00 H new ATOM 0 HD3 LYS A 56 25.469 -26.355 -9.797 1.00 0.00 H new ATOM 0 HE2 LYS A 56 24.301 -28.208 -8.719 1.00 0.00 H new ATOM 0 HE3 LYS A 56 25.035 -27.207 -7.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 22.744 -27.857 -6.982 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 22.941 -26.171 -7.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 22.204 -26.992 -8.340 1.00 0.00 H new ATOM 908 N ALA A 57 22.540 -21.732 -10.385 1.00 0.00 N ATOM 909 CA ALA A 57 21.272 -21.118 -10.040 1.00 0.00 C ATOM 910 C ALA A 57 20.286 -21.237 -11.199 1.00 0.00 C ATOM 911 O ALA A 57 19.084 -21.303 -10.969 1.00 0.00 O ATOM 912 CB ALA A 57 21.515 -19.655 -9.685 1.00 0.00 C ATOM 0 H ALA A 57 23.279 -21.068 -10.617 1.00 0.00 H new ATOM 0 HA ALA A 57 20.837 -21.632 -9.183 1.00 0.00 H new ATOM 0 HB1 ALA A 57 20.568 -19.182 -9.424 1.00 0.00 H new ATOM 0 HB2 ALA A 57 22.197 -19.595 -8.837 1.00 0.00 H new ATOM 0 HB3 ALA A 57 21.953 -19.141 -10.540 1.00 0.00 H new ATOM 918 N TYR A 58 20.772 -21.270 -12.441 1.00 0.00 N ATOM 919 CA TYR A 58 19.895 -21.338 -13.603 1.00 0.00 C ATOM 920 C TYR A 58 19.076 -22.626 -13.600 1.00 0.00 C ATOM 921 O TYR A 58 17.885 -22.605 -13.899 1.00 0.00 O ATOM 922 CB TYR A 58 20.731 -21.278 -14.879 1.00 0.00 C ATOM 923 CG TYR A 58 19.894 -21.458 -16.128 1.00 0.00 C ATOM 924 CD1 TYR A 58 18.919 -20.505 -16.464 1.00 0.00 C ATOM 925 CD2 TYR A 58 20.083 -22.587 -16.938 1.00 0.00 C ATOM 926 CE1 TYR A 58 18.126 -20.681 -17.608 1.00 0.00 C ATOM 927 CE2 TYR A 58 19.298 -22.767 -18.089 1.00 0.00 C ATOM 928 CZ TYR A 58 18.313 -21.816 -18.424 1.00 0.00 C ATOM 929 OH TYR A 58 17.539 -21.997 -19.531 1.00 0.00 O ATOM 0 H TYR A 58 21.767 -21.251 -12.664 1.00 0.00 H new ATOM 0 HA TYR A 58 19.210 -20.491 -13.562 1.00 0.00 H new ATOM 0 HB2 TYR A 58 21.248 -20.319 -14.927 1.00 0.00 H new ATOM 0 HB3 TYR A 58 21.498 -22.052 -14.844 1.00 0.00 H new ATOM 0 HD1 TYR A 58 18.779 -19.634 -15.840 1.00 0.00 H new ATOM 0 HD2 TYR A 58 20.833 -23.319 -16.677 1.00 0.00 H new ATOM 0 HE1 TYR A 58 17.374 -19.949 -17.863 1.00 0.00 H new ATOM 0 HE2 TYR A 58 19.449 -23.633 -18.716 1.00 0.00 H new ATOM 0 HH TYR A 58 17.800 -22.828 -19.980 1.00 0.00 H new ATOM 939 N ARG A 59 19.716 -23.750 -13.260 1.00 0.00 N ATOM 940 CA ARG A 59 19.051 -25.045 -13.257 1.00 0.00 C ATOM 941 C ARG A 59 18.452 -25.398 -11.897 1.00 0.00 C ATOM 942 O ARG A 59 17.755 -26.404 -11.784 1.00 0.00 O ATOM 943 CB ARG A 59 20.006 -26.119 -13.770 1.00 0.00 C ATOM 944 CG ARG A 59 21.229 -26.312 -12.870 1.00 0.00 C ATOM 945 CD ARG A 59 22.197 -27.262 -13.579 1.00 0.00 C ATOM 946 NE ARG A 59 23.372 -27.555 -12.750 1.00 0.00 N ATOM 947 CZ ARG A 59 24.640 -27.409 -13.150 1.00 0.00 C ATOM 948 NH1 ARG A 59 24.929 -26.943 -14.362 1.00 0.00 N ATOM 949 NH2 ARG A 59 25.633 -27.733 -12.328 1.00 0.00 N ATOM 0 H ARG A 59 20.697 -23.782 -12.983 1.00 0.00 H new ATOM 0 HA ARG A 59 18.201 -24.989 -13.937 1.00 0.00 H new ATOM 0 HB2 ARG A 59 19.470 -27.064 -13.853 1.00 0.00 H new ATOM 0 HB3 ARG A 59 20.339 -25.852 -14.773 1.00 0.00 H new ATOM 0 HG2 ARG A 59 21.711 -25.355 -12.673 1.00 0.00 H new ATOM 0 HG3 ARG A 59 20.931 -26.723 -11.906 1.00 0.00 H new ATOM 0 HD2 ARG A 59 21.682 -28.191 -13.823 1.00 0.00 H new ATOM 0 HD3 ARG A 59 22.518 -26.819 -14.522 1.00 0.00 H new ATOM 0 HE ARG A 59 23.210 -27.894 -11.802 1.00 0.00 H new ATOM 0 HH11 ARG A 59 24.178 -26.690 -15.004 1.00 0.00 H new ATOM 0 HH12 ARG A 59 25.902 -26.838 -14.650 1.00 0.00 H new ATOM 0 HH21 ARG A 59 25.427 -28.092 -11.396 1.00 0.00 H new ATOM 0 HH22 ARG A 59 26.601 -27.623 -12.630 1.00 0.00 H new ATOM 963 N ALA A 60 18.708 -24.583 -10.870 1.00 0.00 N ATOM 964 CA ALA A 60 18.126 -24.798 -9.550 1.00 0.00 C ATOM 965 C ALA A 60 17.046 -23.762 -9.211 1.00 0.00 C ATOM 966 O ALA A 60 16.369 -23.894 -8.193 1.00 0.00 O ATOM 967 CB ALA A 60 19.242 -24.795 -8.512 1.00 0.00 C ATOM 0 H ALA A 60 19.317 -23.767 -10.932 1.00 0.00 H new ATOM 0 HA ALA A 60 17.624 -25.766 -9.546 1.00 0.00 H new ATOM 0 HB1 ALA A 60 18.817 -24.955 -7.521 1.00 0.00 H new ATOM 0 HB2 ALA A 60 19.950 -25.593 -8.737 1.00 0.00 H new ATOM 0 HB3 ALA A 60 19.758 -23.835 -8.535 1.00 0.00 H new ATOM 973 N LEU A 61 16.875 -22.738 -10.055 1.00 0.00 N ATOM 974 CA LEU A 61 15.884 -21.691 -9.841 1.00 0.00 C ATOM 975 C LEU A 61 14.475 -22.230 -10.091 1.00 0.00 C ATOM 976 O LEU A 61 13.495 -21.640 -9.644 1.00 0.00 O ATOM 977 CB LEU A 61 16.260 -20.494 -10.722 1.00 0.00 C ATOM 978 CG LEU A 61 15.271 -19.322 -10.702 1.00 0.00 C ATOM 979 CD1 LEU A 61 16.052 -18.044 -11.009 1.00 0.00 C ATOM 980 CD2 LEU A 61 14.199 -19.464 -11.782 1.00 0.00 C ATOM 0 H LEU A 61 17.424 -22.617 -10.906 1.00 0.00 H new ATOM 0 HA LEU A 61 15.880 -21.351 -8.805 1.00 0.00 H new ATOM 0 HB2 LEU A 61 17.237 -20.127 -10.408 1.00 0.00 H new ATOM 0 HB3 LEU A 61 16.365 -20.841 -11.750 1.00 0.00 H new ATOM 0 HG LEU A 61 14.789 -19.299 -9.725 1.00 0.00 H new ATOM 0 HD11 LEU A 61 15.373 -17.192 -11.002 1.00 0.00 H new ATOM 0 HD12 LEU A 61 16.824 -17.899 -10.253 1.00 0.00 H new ATOM 0 HD13 LEU A 61 16.517 -18.129 -11.991 1.00 0.00 H new ATOM 0 HD21 LEU A 61 13.519 -18.614 -11.734 1.00 0.00 H new ATOM 0 HD22 LEU A 61 14.673 -19.494 -12.763 1.00 0.00 H new ATOM 0 HD23 LEU A 61 13.640 -20.386 -11.621 1.00 0.00 H new ATOM 992 N ASP A 62 14.365 -23.358 -10.800 1.00 0.00 N ATOM 993 CA ASP A 62 13.086 -24.019 -11.013 1.00 0.00 C ATOM 994 C ASP A 62 12.612 -24.696 -9.721 1.00 0.00 C ATOM 995 O ASP A 62 11.487 -25.189 -9.654 1.00 0.00 O ATOM 996 CB ASP A 62 13.239 -25.026 -12.154 1.00 0.00 C ATOM 997 CG ASP A 62 11.905 -25.667 -12.527 1.00 0.00 C ATOM 998 OD1 ASP A 62 10.982 -24.904 -12.893 1.00 0.00 O ATOM 999 OD2 ASP A 62 11.815 -26.913 -12.444 1.00 0.00 O ATOM 0 H ASP A 62 15.156 -23.831 -11.237 1.00 0.00 H new ATOM 0 HA ASP A 62 12.327 -23.287 -11.288 1.00 0.00 H new ATOM 0 HB2 ASP A 62 13.658 -24.525 -13.027 1.00 0.00 H new ATOM 0 HB3 ASP A 62 13.946 -25.802 -11.861 1.00 0.00 H new ATOM 1004 N SER A 63 13.474 -24.714 -8.700 1.00 0.00 N ATOM 1005 CA SER A 63 13.172 -25.275 -7.389 1.00 0.00 C ATOM 1006 C SER A 63 13.146 -24.178 -6.323 1.00 0.00 C ATOM 1007 O SER A 63 13.049 -24.473 -5.135 1.00 0.00 O ATOM 1008 CB SER A 63 14.189 -26.361 -7.040 1.00 0.00 C ATOM 1009 OG SER A 63 14.173 -27.379 -8.022 1.00 0.00 O ATOM 0 H SER A 63 14.417 -24.331 -8.767 1.00 0.00 H new ATOM 0 HA SER A 63 12.181 -25.728 -7.419 1.00 0.00 H new ATOM 0 HB2 SER A 63 15.187 -25.927 -6.972 1.00 0.00 H new ATOM 0 HB3 SER A 63 13.958 -26.785 -6.063 1.00 0.00 H new ATOM 0 HG SER A 63 14.829 -28.068 -7.789 1.00 0.00 H new ATOM 1015 N PHE A 64 13.232 -22.909 -6.740 1.00 0.00 N ATOM 1016 CA PHE A 64 13.174 -21.779 -5.827 1.00 0.00 C ATOM 1017 C PHE A 64 11.759 -21.670 -5.261 1.00 0.00 C ATOM 1018 O PHE A 64 10.783 -21.710 -6.012 1.00 0.00 O ATOM 1019 CB PHE A 64 13.583 -20.510 -6.578 1.00 0.00 C ATOM 1020 CG PHE A 64 13.555 -19.245 -5.747 1.00 0.00 C ATOM 1021 CD1 PHE A 64 14.363 -19.130 -4.609 1.00 0.00 C ATOM 1022 CD2 PHE A 64 12.720 -18.182 -6.121 1.00 0.00 C ATOM 1023 CE1 PHE A 64 14.343 -17.952 -3.848 1.00 0.00 C ATOM 1024 CE2 PHE A 64 12.702 -17.004 -5.362 1.00 0.00 C ATOM 1025 CZ PHE A 64 13.514 -16.888 -4.227 1.00 0.00 C ATOM 0 H PHE A 64 13.343 -22.645 -7.719 1.00 0.00 H new ATOM 0 HA PHE A 64 13.863 -21.916 -4.994 1.00 0.00 H new ATOM 0 HB2 PHE A 64 14.590 -20.647 -6.973 1.00 0.00 H new ATOM 0 HB3 PHE A 64 12.920 -20.381 -7.433 1.00 0.00 H new ATOM 0 HD1 PHE A 64 15.003 -19.950 -4.317 1.00 0.00 H new ATOM 0 HD2 PHE A 64 12.091 -18.271 -6.994 1.00 0.00 H new ATOM 0 HE1 PHE A 64 14.966 -17.865 -2.970 1.00 0.00 H new ATOM 0 HE2 PHE A 64 12.061 -16.185 -5.653 1.00 0.00 H new ATOM 0 HZ PHE A 64 13.501 -15.979 -3.644 1.00 0.00 H new ATOM 1035 N ARG A 65 11.645 -21.536 -3.937 1.00 0.00 N ATOM 1036 CA ARG A 65 10.357 -21.532 -3.254 1.00 0.00 C ATOM 1037 C ARG A 65 9.877 -20.124 -2.924 1.00 0.00 C ATOM 1038 O ARG A 65 8.705 -19.939 -2.597 1.00 0.00 O ATOM 1039 CB ARG A 65 10.445 -22.384 -1.988 1.00 0.00 C ATOM 1040 CG ARG A 65 10.838 -23.825 -2.316 1.00 0.00 C ATOM 1041 CD ARG A 65 10.814 -24.684 -1.052 1.00 0.00 C ATOM 1042 NE ARG A 65 11.759 -24.192 -0.046 1.00 0.00 N ATOM 1043 CZ ARG A 65 13.000 -24.655 0.131 1.00 0.00 C ATOM 1044 NH1 ARG A 65 13.490 -25.632 -0.629 1.00 0.00 N ATOM 1045 NH2 ARG A 65 13.768 -24.137 1.083 1.00 0.00 N ATOM 0 H ARG A 65 12.444 -21.428 -3.313 1.00 0.00 H new ATOM 0 HA ARG A 65 9.620 -21.961 -3.933 1.00 0.00 H new ATOM 0 HB2 ARG A 65 11.177 -21.951 -1.306 1.00 0.00 H new ATOM 0 HB3 ARG A 65 9.484 -22.375 -1.473 1.00 0.00 H new ATOM 0 HG2 ARG A 65 10.152 -24.236 -3.056 1.00 0.00 H new ATOM 0 HG3 ARG A 65 11.834 -23.845 -2.759 1.00 0.00 H new ATOM 0 HD2 ARG A 65 9.807 -24.689 -0.634 1.00 0.00 H new ATOM 0 HD3 ARG A 65 11.058 -25.715 -1.308 1.00 0.00 H new ATOM 0 HE ARG A 65 11.446 -23.439 0.566 1.00 0.00 H new ATOM 0 HH11 ARG A 65 12.915 -26.043 -1.365 1.00 0.00 H new ATOM 0 HH12 ARG A 65 14.440 -25.970 -0.476 1.00 0.00 H new ATOM 0 HH21 ARG A 65 13.410 -23.388 1.676 1.00 0.00 H new ATOM 0 HH22 ARG A 65 14.716 -24.488 1.221 1.00 0.00 H new ATOM 1059 N GLY A 66 10.762 -19.127 -3.005 1.00 0.00 N ATOM 1060 CA GLY A 66 10.387 -17.750 -2.723 1.00 0.00 C ATOM 1061 C GLY A 66 10.239 -17.505 -1.224 1.00 0.00 C ATOM 1062 O GLY A 66 9.570 -16.557 -0.814 1.00 0.00 O ATOM 0 H GLY A 66 11.741 -19.253 -3.264 1.00 0.00 H new ATOM 0 HA2 GLY A 66 11.141 -17.076 -3.130 1.00 0.00 H new ATOM 0 HA3 GLY A 66 9.448 -17.518 -3.225 1.00 0.00 H new ATOM 1066 N ASP A 67 10.859 -18.360 -0.402 1.00 0.00 N ATOM 1067 CA ASP A 67 10.796 -18.256 1.049 1.00 0.00 C ATOM 1068 C ASP A 67 11.544 -17.017 1.553 1.00 0.00 C ATOM 1069 O ASP A 67 11.433 -16.665 2.727 1.00 0.00 O ATOM 1070 CB ASP A 67 11.393 -19.527 1.661 1.00 0.00 C ATOM 1071 CG ASP A 67 10.489 -20.746 1.492 1.00 0.00 C ATOM 1072 OD1 ASP A 67 9.251 -20.566 1.521 1.00 0.00 O ATOM 1073 OD2 ASP A 67 11.050 -21.853 1.341 1.00 0.00 O ATOM 0 H ASP A 67 11.420 -19.145 -0.733 1.00 0.00 H new ATOM 0 HA ASP A 67 9.754 -18.151 1.352 1.00 0.00 H new ATOM 0 HB2 ASP A 67 12.358 -19.729 1.197 1.00 0.00 H new ATOM 0 HB3 ASP A 67 11.578 -19.362 2.722 1.00 0.00 H new ATOM 1078 N SER A 68 12.299 -16.356 0.670 1.00 0.00 N ATOM 1079 CA SER A 68 13.021 -15.130 0.968 1.00 0.00 C ATOM 1080 C SER A 68 13.291 -14.380 -0.335 1.00 0.00 C ATOM 1081 O SER A 68 13.005 -14.893 -1.419 1.00 0.00 O ATOM 1082 CB SER A 68 14.334 -15.475 1.675 1.00 0.00 C ATOM 1083 OG SER A 68 15.075 -14.306 1.942 1.00 0.00 O ATOM 0 H SER A 68 12.423 -16.671 -0.292 1.00 0.00 H new ATOM 0 HA SER A 68 12.428 -14.493 1.625 1.00 0.00 H new ATOM 0 HB2 SER A 68 14.125 -16.000 2.607 1.00 0.00 H new ATOM 0 HB3 SER A 68 14.922 -16.151 1.053 1.00 0.00 H new ATOM 0 HG SER A 68 15.214 -14.220 2.908 1.00 0.00 H new ATOM 1089 N ALA A 69 13.842 -13.167 -0.240 1.00 0.00 N ATOM 1090 CA ALA A 69 14.224 -12.381 -1.404 1.00 0.00 C ATOM 1091 C ALA A 69 15.234 -13.156 -2.250 1.00 0.00 C ATOM 1092 O ALA A 69 15.938 -14.034 -1.744 1.00 0.00 O ATOM 1093 CB ALA A 69 14.808 -11.042 -0.945 1.00 0.00 C ATOM 0 H ALA A 69 14.034 -12.706 0.650 1.00 0.00 H new ATOM 0 HA ALA A 69 13.345 -12.187 -2.019 1.00 0.00 H new ATOM 0 HB1 ALA A 69 15.095 -10.452 -1.816 1.00 0.00 H new ATOM 0 HB2 ALA A 69 14.060 -10.498 -0.368 1.00 0.00 H new ATOM 0 HB3 ALA A 69 15.685 -11.222 -0.324 1.00 0.00 H new ATOM 1099 N PHE A 70 15.314 -12.846 -3.547 1.00 0.00 N ATOM 1100 CA PHE A 70 16.129 -13.630 -4.461 1.00 0.00 C ATOM 1101 C PHE A 70 17.616 -13.558 -4.123 1.00 0.00 C ATOM 1102 O PHE A 70 18.328 -14.540 -4.324 1.00 0.00 O ATOM 1103 CB PHE A 70 15.895 -13.161 -5.895 1.00 0.00 C ATOM 1104 CG PHE A 70 16.677 -13.973 -6.901 1.00 0.00 C ATOM 1105 CD1 PHE A 70 16.368 -15.326 -7.100 1.00 0.00 C ATOM 1106 CD2 PHE A 70 17.717 -13.377 -7.627 1.00 0.00 C ATOM 1107 CE1 PHE A 70 17.107 -16.087 -8.014 1.00 0.00 C ATOM 1108 CE2 PHE A 70 18.454 -14.137 -8.546 1.00 0.00 C ATOM 1109 CZ PHE A 70 18.154 -15.494 -8.738 1.00 0.00 C ATOM 0 H PHE A 70 14.826 -12.062 -3.980 1.00 0.00 H new ATOM 0 HA PHE A 70 15.826 -14.672 -4.357 1.00 0.00 H new ATOM 0 HB2 PHE A 70 14.832 -13.226 -6.127 1.00 0.00 H new ATOM 0 HB3 PHE A 70 16.176 -12.111 -5.982 1.00 0.00 H new ATOM 0 HD1 PHE A 70 15.559 -15.782 -6.548 1.00 0.00 H new ATOM 0 HD2 PHE A 70 17.951 -12.333 -7.479 1.00 0.00 H new ATOM 0 HE1 PHE A 70 16.872 -17.131 -8.162 1.00 0.00 H new ATOM 0 HE2 PHE A 70 19.254 -13.677 -9.107 1.00 0.00 H new ATOM 0 HZ PHE A 70 18.727 -16.081 -9.441 1.00 0.00 H new ATOM 1119 N TYR A 71 18.104 -12.422 -3.614 1.00 0.00 N ATOM 1120 CA TYR A 71 19.525 -12.309 -3.317 1.00 0.00 C ATOM 1121 C TYR A 71 19.893 -13.135 -2.089 1.00 0.00 C ATOM 1122 O TYR A 71 21.042 -13.545 -1.947 1.00 0.00 O ATOM 1123 CB TYR A 71 19.924 -10.851 -3.102 1.00 0.00 C ATOM 1124 CG TYR A 71 21.422 -10.694 -2.939 1.00 0.00 C ATOM 1125 CD1 TYR A 71 22.246 -10.721 -4.073 1.00 0.00 C ATOM 1126 CD2 TYR A 71 21.990 -10.529 -1.665 1.00 0.00 C ATOM 1127 CE1 TYR A 71 23.636 -10.579 -3.942 1.00 0.00 C ATOM 1128 CE2 TYR A 71 23.374 -10.368 -1.527 1.00 0.00 C ATOM 1129 CZ TYR A 71 24.203 -10.404 -2.665 1.00 0.00 C ATOM 1130 OH TYR A 71 25.554 -10.268 -2.525 1.00 0.00 O ATOM 0 H TYR A 71 17.549 -11.592 -3.406 1.00 0.00 H new ATOM 0 HA TYR A 71 20.073 -12.697 -4.176 1.00 0.00 H new ATOM 0 HB2 TYR A 71 19.586 -10.253 -3.949 1.00 0.00 H new ATOM 0 HB3 TYR A 71 19.420 -10.463 -2.217 1.00 0.00 H new ATOM 0 HD1 TYR A 71 21.809 -10.852 -5.052 1.00 0.00 H new ATOM 0 HD2 TYR A 71 21.358 -10.526 -0.790 1.00 0.00 H new ATOM 0 HE1 TYR A 71 24.268 -10.604 -4.817 1.00 0.00 H new ATOM 0 HE2 TYR A 71 23.806 -10.216 -0.549 1.00 0.00 H new ATOM 0 HH TYR A 71 25.775 -10.155 -1.577 1.00 0.00 H new ATOM 1140 N THR A 72 18.936 -13.390 -1.193 1.00 0.00 N ATOM 1141 CA THR A 72 19.213 -14.177 -0.001 1.00 0.00 C ATOM 1142 C THR A 72 19.559 -15.601 -0.413 1.00 0.00 C ATOM 1143 O THR A 72 20.404 -16.253 0.197 1.00 0.00 O ATOM 1144 CB THR A 72 17.985 -14.176 0.914 1.00 0.00 C ATOM 1145 OG1 THR A 72 17.503 -12.861 1.085 1.00 0.00 O ATOM 1146 CG2 THR A 72 18.342 -14.751 2.283 1.00 0.00 C ATOM 0 H THR A 72 17.973 -13.064 -1.274 1.00 0.00 H new ATOM 0 HA THR A 72 20.054 -13.744 0.540 1.00 0.00 H new ATOM 0 HB THR A 72 17.215 -14.791 0.448 1.00 0.00 H new ATOM 0 HG1 THR A 72 16.579 -12.891 1.410 1.00 0.00 H new ATOM 0 HG21 THR A 72 17.459 -14.744 2.922 1.00 0.00 H new ATOM 0 HG22 THR A 72 18.697 -15.775 2.166 1.00 0.00 H new ATOM 0 HG23 THR A 72 19.125 -14.145 2.739 1.00 0.00 H new ATOM 1154 N TRP A 73 18.898 -16.082 -1.468 1.00 0.00 N ATOM 1155 CA TRP A 73 19.104 -17.421 -1.995 1.00 0.00 C ATOM 1156 C TRP A 73 20.327 -17.454 -2.906 1.00 0.00 C ATOM 1157 O TRP A 73 21.034 -18.459 -2.959 1.00 0.00 O ATOM 1158 CB TRP A 73 17.834 -17.811 -2.745 1.00 0.00 C ATOM 1159 CG TRP A 73 17.841 -19.168 -3.363 1.00 0.00 C ATOM 1160 CD1 TRP A 73 17.702 -20.331 -2.693 1.00 0.00 C ATOM 1161 CD2 TRP A 73 17.992 -19.525 -4.769 1.00 0.00 C ATOM 1162 NE1 TRP A 73 17.738 -21.382 -3.589 1.00 0.00 N ATOM 1163 CE2 TRP A 73 17.916 -20.939 -4.886 1.00 0.00 C ATOM 1164 CE3 TRP A 73 18.186 -18.795 -5.958 1.00 0.00 C ATOM 1165 CZ2 TRP A 73 18.025 -21.594 -6.122 1.00 0.00 C ATOM 1166 CZ3 TRP A 73 18.297 -19.441 -7.199 1.00 0.00 C ATOM 1167 CH2 TRP A 73 18.216 -20.839 -7.284 1.00 0.00 C ATOM 0 H TRP A 73 18.200 -15.544 -1.981 1.00 0.00 H new ATOM 0 HA TRP A 73 19.295 -18.133 -1.192 1.00 0.00 H new ATOM 0 HB2 TRP A 73 16.993 -17.750 -2.055 1.00 0.00 H new ATOM 0 HB3 TRP A 73 17.656 -17.075 -3.529 1.00 0.00 H new ATOM 0 HD1 TRP A 73 17.581 -20.425 -1.624 1.00 0.00 H new ATOM 0 HE1 TRP A 73 17.645 -22.363 -3.326 1.00 0.00 H new ATOM 0 HE3 TRP A 73 18.251 -17.718 -5.914 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 17.962 -22.671 -6.176 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 18.446 -18.857 -8.095 1.00 0.00 H new ATOM 0 HH2 TRP A 73 18.301 -21.330 -8.242 1.00 0.00 H new ATOM 1178 N LEU A 74 20.586 -16.358 -3.627 1.00 0.00 N ATOM 1179 CA LEU A 74 21.730 -16.258 -4.519 1.00 0.00 C ATOM 1180 C LEU A 74 23.015 -16.179 -3.696 1.00 0.00 C ATOM 1181 O LEU A 74 24.055 -16.692 -4.101 1.00 0.00 O ATOM 1182 CB LEU A 74 21.550 -15.004 -5.382 1.00 0.00 C ATOM 1183 CG LEU A 74 22.109 -15.147 -6.802 1.00 0.00 C ATOM 1184 CD1 LEU A 74 21.944 -13.802 -7.506 1.00 0.00 C ATOM 1185 CD2 LEU A 74 23.583 -15.543 -6.839 1.00 0.00 C ATOM 0 H LEU A 74 20.005 -15.520 -3.604 1.00 0.00 H new ATOM 0 HA LEU A 74 21.799 -17.134 -5.163 1.00 0.00 H new ATOM 0 HB2 LEU A 74 20.488 -14.764 -5.442 1.00 0.00 H new ATOM 0 HB3 LEU A 74 22.040 -14.163 -4.891 1.00 0.00 H new ATOM 0 HG LEU A 74 21.557 -15.947 -7.296 1.00 0.00 H new ATOM 0 HD11 LEU A 74 22.334 -13.873 -8.521 1.00 0.00 H new ATOM 0 HD12 LEU A 74 20.887 -13.537 -7.541 1.00 0.00 H new ATOM 0 HD13 LEU A 74 22.493 -13.035 -6.959 1.00 0.00 H new ATOM 0 HD21 LEU A 74 23.912 -15.626 -7.875 1.00 0.00 H new ATOM 0 HD22 LEU A 74 24.177 -14.784 -6.330 1.00 0.00 H new ATOM 0 HD23 LEU A 74 23.715 -16.502 -6.339 1.00 0.00 H new ATOM 1197 N TYR A 75 22.938 -15.538 -2.528 1.00 0.00 N ATOM 1198 CA TYR A 75 24.084 -15.372 -1.651 1.00 0.00 C ATOM 1199 C TYR A 75 24.552 -16.728 -1.142 1.00 0.00 C ATOM 1200 O TYR A 75 25.754 -16.981 -1.090 1.00 0.00 O ATOM 1201 CB TYR A 75 23.679 -14.448 -0.498 1.00 0.00 C ATOM 1202 CG TYR A 75 24.795 -14.071 0.453 1.00 0.00 C ATOM 1203 CD1 TYR A 75 25.361 -15.027 1.314 1.00 0.00 C ATOM 1204 CD2 TYR A 75 25.256 -12.747 0.478 1.00 0.00 C ATOM 1205 CE1 TYR A 75 26.392 -14.659 2.191 1.00 0.00 C ATOM 1206 CE2 TYR A 75 26.274 -12.366 1.362 1.00 0.00 C ATOM 1207 CZ TYR A 75 26.853 -13.326 2.218 1.00 0.00 C ATOM 1208 OH TYR A 75 27.850 -12.964 3.072 1.00 0.00 O ATOM 0 H TYR A 75 22.078 -15.122 -2.170 1.00 0.00 H new ATOM 0 HA TYR A 75 24.917 -14.923 -2.191 1.00 0.00 H new ATOM 0 HB2 TYR A 75 23.258 -13.534 -0.917 1.00 0.00 H new ATOM 0 HB3 TYR A 75 22.886 -14.932 0.072 1.00 0.00 H new ATOM 0 HD1 TYR A 75 25.002 -16.045 1.300 1.00 0.00 H new ATOM 0 HD2 TYR A 75 24.823 -12.016 -0.189 1.00 0.00 H new ATOM 0 HE1 TYR A 75 26.833 -15.396 2.846 1.00 0.00 H new ATOM 0 HE2 TYR A 75 26.614 -11.341 1.388 1.00 0.00 H new ATOM 0 HH TYR A 75 28.046 -12.010 2.960 1.00 0.00 H new ATOM 1218 N ARG A 76 23.611 -17.606 -0.766 1.00 0.00 N ATOM 1219 CA ARG A 76 23.952 -18.924 -0.236 1.00 0.00 C ATOM 1220 C ARG A 76 24.573 -19.811 -1.307 1.00 0.00 C ATOM 1221 O ARG A 76 25.444 -20.619 -0.995 1.00 0.00 O ATOM 1222 CB ARG A 76 22.698 -19.590 0.340 1.00 0.00 C ATOM 1223 CG ARG A 76 22.116 -18.792 1.509 1.00 0.00 C ATOM 1224 CD ARG A 76 22.989 -18.870 2.768 1.00 0.00 C ATOM 1225 NE ARG A 76 22.745 -17.737 3.673 1.00 0.00 N ATOM 1226 CZ ARG A 76 21.596 -17.478 4.308 1.00 0.00 C ATOM 1227 NH1 ARG A 76 20.547 -18.285 4.214 1.00 0.00 N ATOM 1228 NH2 ARG A 76 21.493 -16.380 5.055 1.00 0.00 N ATOM 0 H ARG A 76 22.609 -17.422 -0.821 1.00 0.00 H new ATOM 0 HA ARG A 76 24.690 -18.792 0.555 1.00 0.00 H new ATOM 0 HB2 ARG A 76 21.946 -19.688 -0.443 1.00 0.00 H new ATOM 0 HB3 ARG A 76 22.943 -20.598 0.674 1.00 0.00 H new ATOM 0 HG2 ARG A 76 22.004 -17.749 1.213 1.00 0.00 H new ATOM 0 HG3 ARG A 76 21.119 -19.166 1.739 1.00 0.00 H new ATOM 0 HD2 ARG A 76 22.788 -19.804 3.293 1.00 0.00 H new ATOM 0 HD3 ARG A 76 24.040 -18.886 2.481 1.00 0.00 H new ATOM 0 HE ARG A 76 23.519 -17.092 3.831 1.00 0.00 H new ATOM 0 HH11 ARG A 76 20.603 -19.130 3.646 1.00 0.00 H new ATOM 0 HH12 ARG A 76 19.685 -18.060 4.710 1.00 0.00 H new ATOM 0 HH21 ARG A 76 22.286 -15.744 5.139 1.00 0.00 H new ATOM 0 HH22 ARG A 76 20.621 -16.175 5.542 1.00 0.00 H new ATOM 1242 N ILE A 77 24.142 -19.671 -2.563 1.00 0.00 N ATOM 1243 CA ILE A 77 24.708 -20.465 -3.645 1.00 0.00 C ATOM 1244 C ILE A 77 26.092 -19.938 -4.009 1.00 0.00 C ATOM 1245 O ILE A 77 26.986 -20.720 -4.314 1.00 0.00 O ATOM 1246 CB ILE A 77 23.770 -20.429 -4.862 1.00 0.00 C ATOM 1247 CG1 ILE A 77 22.457 -21.137 -4.507 1.00 0.00 C ATOM 1248 CG2 ILE A 77 24.435 -21.117 -6.062 1.00 0.00 C ATOM 1249 CD1 ILE A 77 21.481 -21.171 -5.685 1.00 0.00 C ATOM 0 H ILE A 77 23.410 -19.021 -2.850 1.00 0.00 H new ATOM 0 HA ILE A 77 24.811 -21.500 -3.319 1.00 0.00 H new ATOM 0 HB ILE A 77 23.562 -19.393 -5.130 1.00 0.00 H new ATOM 0 HG12 ILE A 77 22.671 -22.156 -4.186 1.00 0.00 H new ATOM 0 HG13 ILE A 77 21.989 -20.629 -3.664 1.00 0.00 H new ATOM 0 HG21 ILE A 77 23.762 -21.086 -6.919 1.00 0.00 H new ATOM 0 HG22 ILE A 77 25.362 -20.600 -6.310 1.00 0.00 H new ATOM 0 HG23 ILE A 77 24.654 -22.155 -5.811 1.00 0.00 H new ATOM 0 HD11 ILE A 77 20.566 -21.682 -5.385 1.00 0.00 H new ATOM 0 HD12 ILE A 77 21.244 -20.152 -5.990 1.00 0.00 H new ATOM 0 HD13 ILE A 77 21.937 -21.703 -6.520 1.00 0.00 H new ATOM 1261 N ALA A 78 26.282 -18.618 -3.978 1.00 0.00 N ATOM 1262 CA ALA A 78 27.535 -18.019 -4.400 1.00 0.00 C ATOM 1263 C ALA A 78 28.672 -18.311 -3.424 1.00 0.00 C ATOM 1264 O ALA A 78 29.795 -18.568 -3.854 1.00 0.00 O ATOM 1265 CB ALA A 78 27.321 -16.519 -4.553 1.00 0.00 C ATOM 0 H ALA A 78 25.579 -17.949 -3.664 1.00 0.00 H new ATOM 0 HA ALA A 78 27.832 -18.457 -5.353 1.00 0.00 H new ATOM 0 HB1 ALA A 78 28.252 -16.049 -4.870 1.00 0.00 H new ATOM 0 HB2 ALA A 78 26.549 -16.336 -5.301 1.00 0.00 H new ATOM 0 HB3 ALA A 78 27.008 -16.097 -3.598 1.00 0.00 H new ATOM 1271 N VAL A 79 28.403 -18.279 -2.113 1.00 0.00 N ATOM 1272 CA VAL A 79 29.444 -18.576 -1.139 1.00 0.00 C ATOM 1273 C VAL A 79 29.768 -20.063 -1.154 1.00 0.00 C ATOM 1274 O VAL A 79 30.919 -20.448 -0.963 1.00 0.00 O ATOM 1275 CB VAL A 79 29.022 -18.109 0.261 1.00 0.00 C ATOM 1276 CG1 VAL A 79 27.737 -18.776 0.744 1.00 0.00 C ATOM 1277 CG2 VAL A 79 30.118 -18.452 1.265 1.00 0.00 C ATOM 0 H VAL A 79 27.491 -18.055 -1.714 1.00 0.00 H new ATOM 0 HA VAL A 79 30.348 -18.031 -1.410 1.00 0.00 H new ATOM 0 HB VAL A 79 28.854 -17.034 0.191 1.00 0.00 H new ATOM 0 HG11 VAL A 79 27.488 -18.407 1.739 1.00 0.00 H new ATOM 0 HG12 VAL A 79 26.925 -18.542 0.056 1.00 0.00 H new ATOM 0 HG13 VAL A 79 27.880 -19.856 0.782 1.00 0.00 H new ATOM 0 HG21 VAL A 79 29.818 -18.120 2.259 1.00 0.00 H new ATOM 0 HG22 VAL A 79 30.278 -19.530 1.275 1.00 0.00 H new ATOM 0 HG23 VAL A 79 31.043 -17.951 0.979 1.00 0.00 H new ATOM 1287 N ASN A 80 28.763 -20.907 -1.387 1.00 0.00 N ATOM 1288 CA ASN A 80 28.971 -22.344 -1.407 1.00 0.00 C ATOM 1289 C ASN A 80 29.596 -22.784 -2.727 1.00 0.00 C ATOM 1290 O ASN A 80 30.230 -23.833 -2.773 1.00 0.00 O ATOM 1291 CB ASN A 80 27.631 -23.032 -1.134 1.00 0.00 C ATOM 1292 CG ASN A 80 27.242 -22.942 0.339 1.00 0.00 C ATOM 1293 OD1 ASN A 80 28.041 -22.550 1.186 1.00 0.00 O ATOM 1294 ND2 ASN A 80 26.006 -23.307 0.657 1.00 0.00 N ATOM 0 H ASN A 80 27.801 -20.616 -1.563 1.00 0.00 H new ATOM 0 HA ASN A 80 29.675 -22.635 -0.628 1.00 0.00 H new ATOM 0 HB2 ASN A 80 26.854 -22.572 -1.745 1.00 0.00 H new ATOM 0 HB3 ASN A 80 27.692 -24.079 -1.431 1.00 0.00 H new ATOM 0 HD21 ASN A 80 25.696 -23.266 1.628 1.00 0.00 H new ATOM 0 HD22 ASN A 80 25.366 -23.628 -0.070 1.00 0.00 H new ATOM 1301 N THR A 81 29.443 -22.005 -3.802 1.00 0.00 N ATOM 1302 CA THR A 81 30.103 -22.316 -5.063 1.00 0.00 C ATOM 1303 C THR A 81 31.586 -21.978 -4.953 1.00 0.00 C ATOM 1304 O THR A 81 32.433 -22.709 -5.467 1.00 0.00 O ATOM 1305 CB THR A 81 29.450 -21.531 -6.204 1.00 0.00 C ATOM 1306 OG1 THR A 81 28.118 -21.959 -6.367 1.00 0.00 O ATOM 1307 CG2 THR A 81 30.193 -21.759 -7.520 1.00 0.00 C ATOM 0 H THR A 81 28.871 -21.161 -3.820 1.00 0.00 H new ATOM 0 HA THR A 81 29.999 -23.379 -5.279 1.00 0.00 H new ATOM 0 HB THR A 81 29.486 -20.472 -5.950 1.00 0.00 H new ATOM 0 HG1 THR A 81 27.561 -21.573 -5.659 1.00 0.00 H new ATOM 0 HG21 THR A 81 29.709 -21.190 -8.314 1.00 0.00 H new ATOM 0 HG22 THR A 81 31.227 -21.430 -7.416 1.00 0.00 H new ATOM 0 HG23 THR A 81 30.174 -22.820 -7.770 1.00 0.00 H new ATOM 1315 N ALA A 82 31.911 -20.872 -4.276 1.00 0.00 N ATOM 1316 CA ALA A 82 33.291 -20.454 -4.107 1.00 0.00 C ATOM 1317 C ALA A 82 34.007 -21.328 -3.078 1.00 0.00 C ATOM 1318 O ALA A 82 35.211 -21.551 -3.188 1.00 0.00 O ATOM 1319 CB ALA A 82 33.301 -18.981 -3.700 1.00 0.00 C ATOM 0 H ALA A 82 31.229 -20.254 -3.838 1.00 0.00 H new ATOM 0 HA ALA A 82 33.833 -20.573 -5.045 1.00 0.00 H new ATOM 0 HB1 ALA A 82 34.330 -18.647 -3.568 1.00 0.00 H new ATOM 0 HB2 ALA A 82 32.823 -18.385 -4.478 1.00 0.00 H new ATOM 0 HB3 ALA A 82 32.757 -18.859 -2.764 1.00 0.00 H new ATOM 1325 N LYS A 83 33.277 -21.837 -2.078 1.00 0.00 N ATOM 1326 CA LYS A 83 33.869 -22.711 -1.076 1.00 0.00 C ATOM 1327 C LYS A 83 33.967 -24.148 -1.582 1.00 0.00 C ATOM 1328 O LYS A 83 34.854 -24.885 -1.154 1.00 0.00 O ATOM 1329 CB LYS A 83 33.053 -22.644 0.214 1.00 0.00 C ATOM 1330 CG LYS A 83 33.329 -21.338 0.959 1.00 0.00 C ATOM 1331 CD LYS A 83 32.593 -21.362 2.297 1.00 0.00 C ATOM 1332 CE LYS A 83 32.851 -20.058 3.049 1.00 0.00 C ATOM 1333 NZ LYS A 83 32.156 -20.051 4.350 1.00 0.00 N ATOM 0 H LYS A 83 32.282 -21.656 -1.947 1.00 0.00 H new ATOM 0 HA LYS A 83 34.883 -22.367 -0.873 1.00 0.00 H new ATOM 0 HB2 LYS A 83 31.990 -22.719 -0.017 1.00 0.00 H new ATOM 0 HB3 LYS A 83 33.301 -23.492 0.852 1.00 0.00 H new ATOM 0 HG2 LYS A 83 34.400 -21.216 1.121 1.00 0.00 H new ATOM 0 HG3 LYS A 83 32.998 -20.488 0.363 1.00 0.00 H new ATOM 0 HD2 LYS A 83 31.523 -21.493 2.133 1.00 0.00 H new ATOM 0 HD3 LYS A 83 32.930 -22.210 2.893 1.00 0.00 H new ATOM 0 HE2 LYS A 83 33.922 -19.930 3.204 1.00 0.00 H new ATOM 0 HE3 LYS A 83 32.513 -19.214 2.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 32.347 -19.154 4.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 31.132 -20.150 4.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 32.498 -20.843 4.930 1.00 0.00 H new ATOM 1347 N ASN A 84 33.076 -24.557 -2.489 1.00 0.00 N ATOM 1348 CA ASN A 84 33.162 -25.886 -3.083 1.00 0.00 C ATOM 1349 C ASN A 84 34.319 -25.944 -4.082 1.00 0.00 C ATOM 1350 O ASN A 84 34.808 -27.025 -4.397 1.00 0.00 O ATOM 1351 CB ASN A 84 31.840 -26.260 -3.757 1.00 0.00 C ATOM 1352 CG ASN A 84 30.745 -26.590 -2.745 1.00 0.00 C ATOM 1353 OD1 ASN A 84 30.974 -26.618 -1.539 1.00 0.00 O ATOM 1354 ND2 ASN A 84 29.536 -26.839 -3.238 1.00 0.00 N ATOM 0 H ASN A 84 32.296 -23.991 -2.823 1.00 0.00 H new ATOM 0 HA ASN A 84 33.354 -26.611 -2.292 1.00 0.00 H new ATOM 0 HB2 ASN A 84 31.511 -25.435 -4.389 1.00 0.00 H new ATOM 0 HB3 ASN A 84 31.998 -27.118 -4.410 1.00 0.00 H new ATOM 0 HD21 ASN A 84 28.765 -27.062 -2.609 1.00 0.00 H new ATOM 0 HD22 ASN A 84 29.380 -26.807 -4.245 1.00 0.00 H new ATOM 1361 N TYR A 85 34.760 -24.785 -4.584 1.00 0.00 N ATOM 1362 CA TYR A 85 35.905 -24.704 -5.478 1.00 0.00 C ATOM 1363 C TYR A 85 37.216 -24.867 -4.708 1.00 0.00 C ATOM 1364 O TYR A 85 38.187 -25.400 -5.245 1.00 0.00 O ATOM 1365 CB TYR A 85 35.850 -23.355 -6.198 1.00 0.00 C ATOM 1366 CG TYR A 85 37.067 -23.050 -7.041 1.00 0.00 C ATOM 1367 CD1 TYR A 85 37.275 -23.723 -8.255 1.00 0.00 C ATOM 1368 CD2 TYR A 85 37.988 -22.090 -6.600 1.00 0.00 C ATOM 1369 CE1 TYR A 85 38.402 -23.427 -9.033 1.00 0.00 C ATOM 1370 CE2 TYR A 85 39.105 -21.771 -7.385 1.00 0.00 C ATOM 1371 CZ TYR A 85 39.315 -22.440 -8.608 1.00 0.00 C ATOM 1372 OH TYR A 85 40.401 -22.145 -9.378 1.00 0.00 O ATOM 0 H TYR A 85 34.330 -23.883 -4.379 1.00 0.00 H new ATOM 0 HA TYR A 85 35.866 -25.514 -6.207 1.00 0.00 H new ATOM 0 HB2 TYR A 85 34.966 -23.332 -6.835 1.00 0.00 H new ATOM 0 HB3 TYR A 85 35.729 -22.565 -5.457 1.00 0.00 H new ATOM 0 HD1 TYR A 85 36.568 -24.468 -8.589 1.00 0.00 H new ATOM 0 HD2 TYR A 85 37.837 -21.594 -5.652 1.00 0.00 H new ATOM 0 HE1 TYR A 85 38.572 -23.955 -9.959 1.00 0.00 H new ATOM 0 HE2 TYR A 85 39.802 -21.015 -7.054 1.00 0.00 H new ATOM 0 HH TYR A 85 40.185 -22.299 -10.321 1.00 0.00 H new ATOM 1382 N LEU A 86 37.257 -24.414 -3.448 1.00 0.00 N ATOM 1383 CA LEU A 86 38.465 -24.526 -2.641 1.00 0.00 C ATOM 1384 C LEU A 86 38.713 -25.971 -2.205 1.00 0.00 C ATOM 1385 O LEU A 86 39.862 -26.358 -1.997 1.00 0.00 O ATOM 1386 CB LEU A 86 38.339 -23.625 -1.409 1.00 0.00 C ATOM 1387 CG LEU A 86 38.288 -22.136 -1.762 1.00 0.00 C ATOM 1388 CD1 LEU A 86 38.040 -21.346 -0.481 1.00 0.00 C ATOM 1389 CD2 LEU A 86 39.598 -21.668 -2.396 1.00 0.00 C ATOM 0 H LEU A 86 36.470 -23.971 -2.974 1.00 0.00 H new ATOM 0 HA LEU A 86 39.313 -24.209 -3.248 1.00 0.00 H new ATOM 0 HB2 LEU A 86 37.437 -23.894 -0.859 1.00 0.00 H new ATOM 0 HB3 LEU A 86 39.184 -23.807 -0.744 1.00 0.00 H new ATOM 0 HG LEU A 86 37.487 -21.973 -2.483 1.00 0.00 H new ATOM 0 HD11 LEU A 86 38.000 -20.281 -0.712 1.00 0.00 H new ATOM 0 HD12 LEU A 86 37.093 -21.657 -0.039 1.00 0.00 H new ATOM 0 HD13 LEU A 86 38.849 -21.534 0.225 1.00 0.00 H new ATOM 0 HD21 LEU A 86 39.528 -20.607 -2.634 1.00 0.00 H new ATOM 0 HD22 LEU A 86 40.419 -21.830 -1.697 1.00 0.00 H new ATOM 0 HD23 LEU A 86 39.783 -22.234 -3.309 1.00 0.00 H new ATOM 1401 N VAL A 87 37.651 -26.771 -2.064 1.00 0.00 N ATOM 1402 CA VAL A 87 37.784 -28.171 -1.676 1.00 0.00 C ATOM 1403 C VAL A 87 37.887 -29.081 -2.894 1.00 0.00 C ATOM 1404 O VAL A 87 38.290 -30.234 -2.763 1.00 0.00 O ATOM 1405 CB VAL A 87 36.631 -28.600 -0.768 1.00 0.00 C ATOM 1406 CG1 VAL A 87 36.601 -27.751 0.506 1.00 0.00 C ATOM 1407 CG2 VAL A 87 35.290 -28.466 -1.481 1.00 0.00 C ATOM 0 H VAL A 87 36.689 -26.468 -2.214 1.00 0.00 H new ATOM 0 HA VAL A 87 38.712 -28.269 -1.113 1.00 0.00 H new ATOM 0 HB VAL A 87 36.795 -29.646 -0.508 1.00 0.00 H new ATOM 0 HG11 VAL A 87 35.773 -28.073 1.138 1.00 0.00 H new ATOM 0 HG12 VAL A 87 37.539 -27.873 1.047 1.00 0.00 H new ATOM 0 HG13 VAL A 87 36.469 -26.702 0.241 1.00 0.00 H new ATOM 0 HG21 VAL A 87 34.489 -28.778 -0.811 1.00 0.00 H new ATOM 0 HG22 VAL A 87 35.135 -27.427 -1.773 1.00 0.00 H new ATOM 0 HG23 VAL A 87 35.286 -29.097 -2.370 1.00 0.00 H new