USER MOD reduce.3.24.130724 H: found=0, std=0, add=669, rem=0, adj=17 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= -0.0988 USER MOD Set 1.2: A 72 THR OG1 : rot 160:sc= 0.197 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : A 15 GLN : amide:sc= 0.864 K(o=0.86,f=-0.79) USER MOD Single : A 16 LYS NZ :NH3+ -171:sc=-0.00124 (180deg=-0.102) USER MOD Single : A 19 GLN : amide:sc= -1.71 K(o=-1.7,f=-4.4!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 ASN : amide:sc= -0.4 X(o=-0.4,f=-0.0027) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= -0.341 K(o=-0.34,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+ 170:sc= 0 (180deg=-0.109) USER MOD Single : A 35 SER OG : rot 86:sc= 0.362 USER MOD Single : A 38 SER OG : rot -19:sc= 0.0709 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 K(o=0,f=-0.61) USER MOD Single : A 56 LYS NZ :NH3+ -160:sc= -0.0949 (180deg=-0.509) 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= -0.0656 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.0042 K(o=-0.0042,f=-1.1) USER MOD Single : A 81 THR OG1 : rot 74:sc= 1.24 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc=-0.00456 K(o=-0.0046,f=-1.2) USER MOD Single : A 85 TYR OH : rot 30:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 82 N THR A 6 10.919 -6.270 -11.066 1.00 0.00 N ATOM 83 CA THR A 6 11.564 -6.647 -9.816 1.00 0.00 C ATOM 84 C THR A 6 12.123 -8.063 -9.927 1.00 0.00 C ATOM 85 O THR A 6 11.839 -8.778 -10.887 1.00 0.00 O ATOM 86 CB THR A 6 10.565 -6.557 -8.661 1.00 0.00 C ATOM 87 OG1 THR A 6 9.493 -7.446 -8.887 1.00 0.00 O ATOM 88 CG2 THR A 6 10.015 -5.136 -8.535 1.00 0.00 C ATOM 0 HA THR A 6 12.386 -5.960 -9.618 1.00 0.00 H new ATOM 0 HB THR A 6 11.082 -6.823 -7.739 1.00 0.00 H new ATOM 0 HG1 THR A 6 8.856 -7.386 -8.144 1.00 0.00 H new ATOM 0 HG21 THR A 6 9.306 -5.092 -7.708 1.00 0.00 H new ATOM 0 HG22 THR A 6 10.836 -4.444 -8.347 1.00 0.00 H new ATOM 0 HG23 THR A 6 9.511 -4.858 -9.460 1.00 0.00 H new ATOM 96 N ASP A 7 12.923 -8.484 -8.944 1.00 0.00 N ATOM 97 CA ASP A 7 13.478 -9.828 -8.934 1.00 0.00 C ATOM 98 C ASP A 7 12.386 -10.879 -8.756 1.00 0.00 C ATOM 99 O ASP A 7 12.622 -12.059 -9.000 1.00 0.00 O ATOM 100 CB ASP A 7 14.504 -9.938 -7.801 1.00 0.00 C ATOM 101 CG ASP A 7 13.875 -9.658 -6.436 1.00 0.00 C ATOM 102 OD1 ASP A 7 13.616 -8.467 -6.155 1.00 0.00 O ATOM 103 OD2 ASP A 7 13.660 -10.638 -5.687 1.00 0.00 O ATOM 0 H ASP A 7 13.197 -7.909 -8.147 1.00 0.00 H new ATOM 0 HA ASP A 7 13.961 -10.013 -9.893 1.00 0.00 H new ATOM 0 HB2 ASP A 7 14.941 -10.937 -7.802 1.00 0.00 H new ATOM 0 HB3 ASP A 7 15.317 -9.234 -7.978 1.00 0.00 H new ATOM 108 N GLN A 8 11.188 -10.473 -8.334 1.00 0.00 N ATOM 109 CA GLN A 8 10.097 -11.408 -8.110 1.00 0.00 C ATOM 110 C GLN A 8 9.456 -11.819 -9.433 1.00 0.00 C ATOM 111 O GLN A 8 9.175 -12.996 -9.649 1.00 0.00 O ATOM 112 CB GLN A 8 9.048 -10.754 -7.213 1.00 0.00 C ATOM 113 CG GLN A 8 9.649 -10.379 -5.857 1.00 0.00 C ATOM 114 CD GLN A 8 8.610 -9.771 -4.919 1.00 0.00 C ATOM 115 OE1 GLN A 8 7.442 -9.618 -5.272 1.00 0.00 O ATOM 116 NE2 GLN A 8 9.025 -9.417 -3.706 1.00 0.00 N ATOM 0 H GLN A 8 10.953 -9.499 -8.141 1.00 0.00 H new ATOM 0 HA GLN A 8 10.494 -12.301 -7.627 1.00 0.00 H new ATOM 0 HB2 GLN A 8 8.652 -9.862 -7.699 1.00 0.00 H new ATOM 0 HB3 GLN A 8 8.211 -11.436 -7.068 1.00 0.00 H new ATOM 0 HG2 GLN A 8 10.080 -11.266 -5.394 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.463 -9.669 -6.005 1.00 0.00 H new ATOM 0 HE21 GLN A 8 10.000 -9.555 -3.440 1.00 0.00 H new ATOM 0 HE22 GLN A 8 8.368 -9.007 -3.042 1.00 0.00 H new ATOM 125 N VAL A 9 9.231 -10.846 -10.323 1.00 0.00 N ATOM 126 CA VAL A 9 8.597 -11.100 -11.609 1.00 0.00 C ATOM 127 C VAL A 9 9.624 -11.582 -12.631 1.00 0.00 C ATOM 128 O VAL A 9 9.274 -12.260 -13.597 1.00 0.00 O ATOM 129 CB VAL A 9 7.873 -9.831 -12.077 1.00 0.00 C ATOM 130 CG1 VAL A 9 8.850 -8.672 -12.269 1.00 0.00 C ATOM 131 CG2 VAL A 9 7.120 -10.082 -13.384 1.00 0.00 C ATOM 0 H VAL A 9 9.483 -9.870 -10.168 1.00 0.00 H new ATOM 0 HA VAL A 9 7.859 -11.895 -11.503 1.00 0.00 H new ATOM 0 HB VAL A 9 7.159 -9.563 -11.298 1.00 0.00 H new ATOM 0 HG11 VAL A 9 8.305 -7.788 -12.601 1.00 0.00 H new ATOM 0 HG12 VAL A 9 9.350 -8.457 -11.324 1.00 0.00 H new ATOM 0 HG13 VAL A 9 9.593 -8.943 -13.019 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.615 -9.167 -13.695 1.00 0.00 H new ATOM 0 HG22 VAL A 9 7.825 -10.388 -14.157 1.00 0.00 H new ATOM 0 HG23 VAL A 9 6.382 -10.870 -13.233 1.00 0.00 H new ATOM 141 N LEU A 10 10.894 -11.237 -12.426 1.00 0.00 N ATOM 142 CA LEU A 10 11.951 -11.626 -13.341 1.00 0.00 C ATOM 143 C LEU A 10 12.362 -13.081 -13.105 1.00 0.00 C ATOM 144 O LEU A 10 12.799 -13.755 -14.035 1.00 0.00 O ATOM 145 CB LEU A 10 13.111 -10.645 -13.161 1.00 0.00 C ATOM 146 CG LEU A 10 14.225 -10.811 -14.197 1.00 0.00 C ATOM 147 CD1 LEU A 10 13.695 -10.612 -15.615 1.00 0.00 C ATOM 148 CD2 LEU A 10 15.296 -9.755 -13.934 1.00 0.00 C ATOM 0 H LEU A 10 11.211 -10.686 -11.628 1.00 0.00 H new ATOM 0 HA LEU A 10 11.609 -11.578 -14.375 1.00 0.00 H new ATOM 0 HB2 LEU A 10 12.726 -9.627 -13.215 1.00 0.00 H new ATOM 0 HB3 LEU A 10 13.532 -10.774 -12.164 1.00 0.00 H new ATOM 0 HG LEU A 10 14.630 -11.819 -14.111 1.00 0.00 H new ATOM 0 HD11 LEU A 10 14.510 -10.736 -16.329 1.00 0.00 H new ATOM 0 HD12 LEU A 10 12.918 -11.348 -15.820 1.00 0.00 H new ATOM 0 HD13 LEU A 10 13.279 -9.609 -15.710 1.00 0.00 H new ATOM 0 HD21 LEU A 10 16.098 -9.860 -14.665 1.00 0.00 H new ATOM 0 HD22 LEU A 10 14.856 -8.761 -14.019 1.00 0.00 H new ATOM 0 HD23 LEU A 10 15.700 -9.889 -12.930 1.00 0.00 H new ATOM 160 N VAL A 11 12.225 -13.571 -11.870 1.00 0.00 N ATOM 161 CA VAL A 11 12.563 -14.957 -11.550 1.00 0.00 C ATOM 162 C VAL A 11 11.474 -15.906 -12.032 1.00 0.00 C ATOM 163 O VAL A 11 11.786 -16.998 -12.503 1.00 0.00 O ATOM 164 CB VAL A 11 12.801 -15.090 -10.043 1.00 0.00 C ATOM 165 CG1 VAL A 11 12.802 -16.545 -9.580 1.00 0.00 C ATOM 166 CG2 VAL A 11 14.163 -14.484 -9.700 1.00 0.00 C ATOM 0 H VAL A 11 11.883 -13.028 -11.077 1.00 0.00 H new ATOM 0 HA VAL A 11 13.480 -15.233 -12.070 1.00 0.00 H new ATOM 0 HB VAL A 11 11.987 -14.570 -9.538 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.975 -16.584 -8.504 1.00 0.00 H new ATOM 0 HG12 VAL A 11 11.839 -17.001 -9.810 1.00 0.00 H new ATOM 0 HG13 VAL A 11 13.593 -17.090 -10.095 1.00 0.00 H new ATOM 0 HG21 VAL A 11 14.342 -14.574 -8.629 1.00 0.00 H new ATOM 0 HG22 VAL A 11 14.945 -15.014 -10.244 1.00 0.00 H new ATOM 0 HG23 VAL A 11 14.174 -13.431 -9.983 1.00 0.00 H new ATOM 176 N GLU A 12 10.198 -15.520 -11.927 1.00 0.00 N ATOM 177 CA GLU A 12 9.131 -16.392 -12.403 1.00 0.00 C ATOM 178 C GLU A 12 9.089 -16.390 -13.931 1.00 0.00 C ATOM 179 O GLU A 12 8.582 -17.335 -14.534 1.00 0.00 O ATOM 180 CB GLU A 12 7.785 -15.996 -11.795 1.00 0.00 C ATOM 181 CG GLU A 12 7.351 -14.603 -12.243 1.00 0.00 C ATOM 182 CD GLU A 12 5.985 -14.240 -11.662 1.00 0.00 C ATOM 183 OE1 GLU A 12 4.971 -14.591 -12.307 1.00 0.00 O ATOM 184 OE2 GLU A 12 5.957 -13.614 -10.578 1.00 0.00 O ATOM 0 H GLU A 12 9.889 -14.634 -11.528 1.00 0.00 H new ATOM 0 HA GLU A 12 9.340 -17.411 -12.076 1.00 0.00 H new ATOM 0 HB2 GLU A 12 7.027 -16.724 -12.084 1.00 0.00 H new ATOM 0 HB3 GLU A 12 7.855 -16.023 -10.708 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.091 -13.868 -11.926 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.309 -14.564 -13.331 1.00 0.00 H new ATOM 191 N ARG A 13 9.617 -15.339 -14.566 1.00 0.00 N ATOM 192 CA ARG A 13 9.699 -15.286 -16.018 1.00 0.00 C ATOM 193 C ARG A 13 10.751 -16.275 -16.524 1.00 0.00 C ATOM 194 O ARG A 13 10.602 -16.822 -17.616 1.00 0.00 O ATOM 195 CB ARG A 13 10.003 -13.849 -16.449 1.00 0.00 C ATOM 196 CG ARG A 13 10.104 -13.764 -17.972 1.00 0.00 C ATOM 197 CD ARG A 13 10.303 -12.315 -18.407 1.00 0.00 C ATOM 198 NE ARG A 13 10.565 -12.242 -19.847 1.00 0.00 N ATOM 199 CZ ARG A 13 10.555 -11.120 -20.569 1.00 0.00 C ATOM 200 NH1 ARG A 13 10.286 -9.943 -20.007 1.00 0.00 N ATOM 201 NH2 ARG A 13 10.818 -11.182 -21.870 1.00 0.00 N ATOM 0 H ARG A 13 9.992 -14.517 -14.092 1.00 0.00 H new ATOM 0 HA ARG A 13 8.747 -15.580 -16.460 1.00 0.00 H new ATOM 0 HB2 ARG A 13 9.219 -13.181 -16.092 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.937 -13.516 -15.996 1.00 0.00 H new ATOM 0 HG2 ARG A 13 10.936 -14.374 -18.323 1.00 0.00 H new ATOM 0 HG3 ARG A 13 9.199 -14.167 -18.427 1.00 0.00 H new ATOM 0 HD2 ARG A 13 9.416 -11.731 -18.163 1.00 0.00 H new ATOM 0 HD3 ARG A 13 11.135 -11.875 -17.857 1.00 0.00 H new ATOM 0 HE ARG A 13 10.770 -13.114 -20.334 1.00 0.00 H new ATOM 0 HH11 ARG A 13 10.083 -9.889 -19.009 1.00 0.00 H new ATOM 0 HH12 ARG A 13 10.283 -9.096 -20.575 1.00 0.00 H new ATOM 0 HH21 ARG A 13 11.025 -12.081 -22.306 1.00 0.00 H new ATOM 0 HH22 ARG A 13 10.813 -10.331 -22.432 1.00 0.00 H new ATOM 215 N VAL A 14 11.806 -16.516 -15.741 1.00 0.00 N ATOM 216 CA VAL A 14 12.805 -17.524 -16.094 1.00 0.00 C ATOM 217 C VAL A 14 12.235 -18.926 -15.888 1.00 0.00 C ATOM 218 O VAL A 14 12.640 -19.859 -16.581 1.00 0.00 O ATOM 219 CB VAL A 14 14.082 -17.302 -15.275 1.00 0.00 C ATOM 220 CG1 VAL A 14 15.113 -18.395 -15.549 1.00 0.00 C ATOM 221 CG2 VAL A 14 14.713 -15.965 -15.656 1.00 0.00 C ATOM 0 H VAL A 14 11.989 -16.029 -14.864 1.00 0.00 H new ATOM 0 HA VAL A 14 13.064 -17.427 -17.148 1.00 0.00 H new ATOM 0 HB VAL A 14 13.803 -17.319 -14.222 1.00 0.00 H new ATOM 0 HG11 VAL A 14 16.007 -18.209 -14.954 1.00 0.00 H new ATOM 0 HG12 VAL A 14 14.694 -19.365 -15.282 1.00 0.00 H new ATOM 0 HG13 VAL A 14 15.375 -18.391 -16.607 1.00 0.00 H new ATOM 0 HG21 VAL A 14 15.620 -15.811 -15.072 1.00 0.00 H new ATOM 0 HG22 VAL A 14 14.961 -15.969 -16.717 1.00 0.00 H new ATOM 0 HG23 VAL A 14 14.009 -15.159 -15.451 1.00 0.00 H new ATOM 231 N GLN A 15 11.293 -19.088 -14.949 1.00 0.00 N ATOM 232 CA GLN A 15 10.638 -20.371 -14.729 1.00 0.00 C ATOM 233 C GLN A 15 9.676 -20.697 -15.874 1.00 0.00 C ATOM 234 O GLN A 15 9.253 -21.843 -16.012 1.00 0.00 O ATOM 235 CB GLN A 15 9.912 -20.366 -13.382 1.00 0.00 C ATOM 236 CG GLN A 15 10.921 -20.349 -12.232 1.00 0.00 C ATOM 237 CD GLN A 15 10.240 -20.364 -10.865 1.00 0.00 C ATOM 238 OE1 GLN A 15 9.037 -20.139 -10.748 1.00 0.00 O ATOM 239 NE2 GLN A 15 11.009 -20.634 -9.813 1.00 0.00 N ATOM 0 H GLN A 15 10.972 -18.342 -14.332 1.00 0.00 H new ATOM 0 HA GLN A 15 11.398 -21.152 -14.707 1.00 0.00 H new ATOM 0 HB2 GLN A 15 9.261 -19.494 -13.316 1.00 0.00 H new ATOM 0 HB3 GLN A 15 9.275 -21.247 -13.302 1.00 0.00 H new ATOM 0 HG2 GLN A 15 11.580 -21.213 -12.317 1.00 0.00 H new ATOM 0 HG3 GLN A 15 11.547 -19.461 -12.314 1.00 0.00 H new ATOM 0 HE21 GLN A 15 12.004 -20.817 -9.942 1.00 0.00 H new ATOM 0 HE22 GLN A 15 10.603 -20.658 -8.878 1.00 0.00 H new ATOM 248 N LYS A 16 9.332 -19.699 -16.698 1.00 0.00 N ATOM 249 CA LYS A 16 8.543 -19.908 -17.910 1.00 0.00 C ATOM 250 C LYS A 16 9.433 -20.323 -19.084 1.00 0.00 C ATOM 251 O LYS A 16 8.951 -20.455 -20.210 1.00 0.00 O ATOM 252 CB LYS A 16 7.727 -18.658 -18.235 1.00 0.00 C ATOM 253 CG LYS A 16 6.665 -18.431 -17.160 1.00 0.00 C ATOM 254 CD LYS A 16 5.906 -17.138 -17.458 1.00 0.00 C ATOM 255 CE LYS A 16 4.911 -16.826 -16.339 1.00 0.00 C ATOM 256 NZ LYS A 16 3.865 -17.864 -16.231 1.00 0.00 N ATOM 0 H LYS A 16 9.595 -18.726 -16.540 1.00 0.00 H new ATOM 0 HA LYS A 16 7.846 -20.727 -17.732 1.00 0.00 H new ATOM 0 HB2 LYS A 16 8.384 -17.791 -18.297 1.00 0.00 H new ATOM 0 HB3 LYS A 16 7.252 -18.768 -19.210 1.00 0.00 H new ATOM 0 HG2 LYS A 16 5.974 -19.273 -17.133 1.00 0.00 H new ATOM 0 HG3 LYS A 16 7.134 -18.372 -16.178 1.00 0.00 H new ATOM 0 HD2 LYS A 16 6.611 -16.313 -17.566 1.00 0.00 H new ATOM 0 HD3 LYS A 16 5.377 -17.231 -18.406 1.00 0.00 H new ATOM 0 HE2 LYS A 16 5.443 -16.746 -15.391 1.00 0.00 H new ATOM 0 HE3 LYS A 16 4.445 -15.858 -16.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 3.127 -17.546 -15.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 3.443 -18.031 -17.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 4.287 -18.747 -15.879 1.00 0.00 H new ATOM 270 N GLY A 17 10.731 -20.529 -18.829 1.00 0.00 N ATOM 271 CA GLY A 17 11.677 -20.998 -19.831 1.00 0.00 C ATOM 272 C GLY A 17 12.375 -19.861 -20.575 1.00 0.00 C ATOM 273 O GLY A 17 13.083 -20.115 -21.548 1.00 0.00 O ATOM 0 H GLY A 17 11.150 -20.372 -17.913 1.00 0.00 H new ATOM 0 HA2 GLY A 17 12.428 -21.623 -19.348 1.00 0.00 H new ATOM 0 HA3 GLY A 17 11.153 -21.627 -20.550 1.00 0.00 H new ATOM 277 N ASP A 18 12.189 -18.611 -20.139 1.00 0.00 N ATOM 278 CA ASP A 18 12.812 -17.469 -20.790 1.00 0.00 C ATOM 279 C ASP A 18 14.267 -17.342 -20.341 1.00 0.00 C ATOM 280 O ASP A 18 14.538 -16.980 -19.196 1.00 0.00 O ATOM 281 CB ASP A 18 12.010 -16.206 -20.460 1.00 0.00 C ATOM 282 CG ASP A 18 12.409 -15.027 -21.346 1.00 0.00 C ATOM 283 OD1 ASP A 18 13.591 -14.979 -21.751 1.00 0.00 O ATOM 284 OD2 ASP A 18 11.523 -14.183 -21.611 1.00 0.00 O ATOM 0 H ASP A 18 11.609 -18.371 -19.335 1.00 0.00 H new ATOM 0 HA ASP A 18 12.811 -17.607 -21.871 1.00 0.00 H new ATOM 0 HB2 ASP A 18 10.946 -16.409 -20.584 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.164 -15.942 -19.414 1.00 0.00 H new ATOM 289 N GLN A 19 15.212 -17.638 -21.237 1.00 0.00 N ATOM 290 CA GLN A 19 16.625 -17.564 -20.906 1.00 0.00 C ATOM 291 C GLN A 19 17.120 -16.119 -20.977 1.00 0.00 C ATOM 292 O GLN A 19 18.081 -15.756 -20.299 1.00 0.00 O ATOM 293 CB GLN A 19 17.402 -18.495 -21.850 1.00 0.00 C ATOM 294 CG GLN A 19 18.810 -18.802 -21.326 1.00 0.00 C ATOM 295 CD GLN A 19 19.801 -17.660 -21.524 1.00 0.00 C ATOM 296 OE1 GLN A 19 19.681 -16.862 -22.449 1.00 0.00 O ATOM 297 NE2 GLN A 19 20.801 -17.576 -20.649 1.00 0.00 N ATOM 0 H GLN A 19 15.018 -17.930 -22.195 1.00 0.00 H new ATOM 0 HA GLN A 19 16.790 -17.897 -19.881 1.00 0.00 H new ATOM 0 HB2 GLN A 19 16.851 -19.427 -21.974 1.00 0.00 H new ATOM 0 HB3 GLN A 19 17.475 -18.034 -22.835 1.00 0.00 H new ATOM 0 HG2 GLN A 19 18.749 -19.038 -20.264 1.00 0.00 H new ATOM 0 HG3 GLN A 19 19.189 -19.692 -21.829 1.00 0.00 H new ATOM 0 HE21 GLN A 19 20.874 -18.254 -19.891 1.00 0.00 H new ATOM 0 HE22 GLN A 19 21.494 -16.833 -20.737 1.00 0.00 H new ATOM 306 N LYS A 20 16.471 -15.280 -21.789 1.00 0.00 N ATOM 307 CA LYS A 20 16.882 -13.891 -21.944 1.00 0.00 C ATOM 308 C LYS A 20 16.539 -13.108 -20.682 1.00 0.00 C ATOM 309 O LYS A 20 17.244 -12.161 -20.334 1.00 0.00 O ATOM 310 CB LYS A 20 16.190 -13.274 -23.163 1.00 0.00 C ATOM 311 CG LYS A 20 16.386 -14.048 -24.474 1.00 0.00 C ATOM 312 CD LYS A 20 17.759 -13.856 -25.123 1.00 0.00 C ATOM 313 CE LYS A 20 18.887 -14.514 -24.328 1.00 0.00 C ATOM 314 NZ LYS A 20 20.144 -14.535 -25.103 1.00 0.00 N ATOM 0 H LYS A 20 15.659 -15.543 -22.347 1.00 0.00 H new ATOM 0 HA LYS A 20 17.960 -13.850 -22.100 1.00 0.00 H new ATOM 0 HB2 LYS A 20 15.122 -13.199 -22.958 1.00 0.00 H new ATOM 0 HB3 LYS A 20 16.561 -12.258 -23.298 1.00 0.00 H new ATOM 0 HG2 LYS A 20 16.234 -15.110 -24.281 1.00 0.00 H new ATOM 0 HG3 LYS A 20 15.617 -13.740 -25.182 1.00 0.00 H new ATOM 0 HD2 LYS A 20 17.741 -14.271 -26.131 1.00 0.00 H new ATOM 0 HD3 LYS A 20 17.964 -12.790 -25.221 1.00 0.00 H new ATOM 0 HE2 LYS A 20 19.041 -13.973 -23.394 1.00 0.00 H new ATOM 0 HE3 LYS A 20 18.603 -15.532 -24.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 20.892 -14.987 -24.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 20.001 -15.072 -25.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 20.426 -13.561 -25.334 1.00 0.00 H new ATOM 328 N ALA A 21 15.464 -13.494 -19.987 1.00 0.00 N ATOM 329 CA ALA A 21 15.102 -12.864 -18.730 1.00 0.00 C ATOM 330 C ALA A 21 16.152 -13.177 -17.667 1.00 0.00 C ATOM 331 O ALA A 21 16.366 -12.386 -16.751 1.00 0.00 O ATOM 332 CB ALA A 21 13.728 -13.369 -18.301 1.00 0.00 C ATOM 0 H ALA A 21 14.834 -14.241 -20.281 1.00 0.00 H new ATOM 0 HA ALA A 21 15.061 -11.782 -18.855 1.00 0.00 H new ATOM 0 HB1 ALA A 21 13.447 -12.901 -17.357 1.00 0.00 H new ATOM 0 HB2 ALA A 21 12.993 -13.116 -19.065 1.00 0.00 H new ATOM 0 HB3 ALA A 21 13.761 -14.451 -18.174 1.00 0.00 H new ATOM 338 N PHE A 22 16.813 -14.332 -17.787 1.00 0.00 N ATOM 339 CA PHE A 22 17.865 -14.690 -16.857 1.00 0.00 C ATOM 340 C PHE A 22 19.124 -13.882 -17.150 1.00 0.00 C ATOM 341 O PHE A 22 19.888 -13.578 -16.243 1.00 0.00 O ATOM 342 CB PHE A 22 18.147 -16.189 -16.938 1.00 0.00 C ATOM 343 CG PHE A 22 19.114 -16.651 -15.872 1.00 0.00 C ATOM 344 CD1 PHE A 22 18.680 -16.784 -14.545 1.00 0.00 C ATOM 345 CD2 PHE A 22 20.448 -16.939 -16.201 1.00 0.00 C ATOM 346 CE1 PHE A 22 19.571 -17.191 -13.547 1.00 0.00 C ATOM 347 CE2 PHE A 22 21.342 -17.351 -15.200 1.00 0.00 C ATOM 348 CZ PHE A 22 20.904 -17.470 -13.873 1.00 0.00 C ATOM 0 H PHE A 22 16.634 -15.023 -18.515 1.00 0.00 H new ATOM 0 HA PHE A 22 17.540 -14.457 -15.843 1.00 0.00 H new ATOM 0 HB2 PHE A 22 17.211 -16.738 -16.838 1.00 0.00 H new ATOM 0 HB3 PHE A 22 18.553 -16.427 -17.921 1.00 0.00 H new ATOM 0 HD1 PHE A 22 17.652 -16.571 -14.292 1.00 0.00 H new ATOM 0 HD2 PHE A 22 20.786 -16.844 -17.222 1.00 0.00 H new ATOM 0 HE1 PHE A 22 19.232 -17.290 -12.526 1.00 0.00 H new ATOM 0 HE2 PHE A 22 22.368 -17.576 -15.452 1.00 0.00 H new ATOM 0 HZ PHE A 22 21.595 -17.777 -13.102 1.00 0.00 H new ATOM 358 N ASN A 23 19.353 -13.522 -18.418 1.00 0.00 N ATOM 359 CA ASN A 23 20.513 -12.727 -18.782 1.00 0.00 C ATOM 360 C ASN A 23 20.432 -11.344 -18.137 1.00 0.00 C ATOM 361 O ASN A 23 21.457 -10.796 -17.740 1.00 0.00 O ATOM 362 CB ASN A 23 20.593 -12.638 -20.306 1.00 0.00 C ATOM 363 CG ASN A 23 21.805 -11.831 -20.752 1.00 0.00 C ATOM 364 OD1 ASN A 23 22.861 -12.390 -21.025 1.00 0.00 O ATOM 365 ND2 ASN A 23 21.660 -10.512 -20.830 1.00 0.00 N ATOM 0 H ASN A 23 18.748 -13.771 -19.201 1.00 0.00 H new ATOM 0 HA ASN A 23 21.423 -13.200 -18.413 1.00 0.00 H new ATOM 0 HB2 ASN A 23 20.647 -13.641 -20.728 1.00 0.00 H new ATOM 0 HB3 ASN A 23 19.684 -12.177 -20.693 1.00 0.00 H new ATOM 0 HD21 ASN A 23 22.443 -9.929 -21.125 1.00 0.00 H new ATOM 0 HD22 ASN A 23 20.765 -10.082 -20.595 1.00 0.00 H new ATOM 372 N LEU A 24 19.228 -10.775 -18.026 1.00 0.00 N ATOM 373 CA LEU A 24 19.066 -9.495 -17.349 1.00 0.00 C ATOM 374 C LEU A 24 19.193 -9.683 -15.838 1.00 0.00 C ATOM 375 O LEU A 24 19.550 -8.741 -15.133 1.00 0.00 O ATOM 376 CB LEU A 24 17.706 -8.876 -17.700 1.00 0.00 C ATOM 377 CG LEU A 24 17.665 -8.096 -19.022 1.00 0.00 C ATOM 378 CD1 LEU A 24 18.685 -6.955 -19.030 1.00 0.00 C ATOM 379 CD2 LEU A 24 17.921 -8.992 -20.230 1.00 0.00 C ATOM 0 H LEU A 24 18.365 -11.177 -18.392 1.00 0.00 H new ATOM 0 HA LEU A 24 19.850 -8.817 -17.684 1.00 0.00 H new ATOM 0 HB2 LEU A 24 16.963 -9.672 -17.743 1.00 0.00 H new ATOM 0 HB3 LEU A 24 17.410 -8.207 -16.892 1.00 0.00 H new ATOM 0 HG LEU A 24 16.658 -7.687 -19.097 1.00 0.00 H new ATOM 0 HD11 LEU A 24 18.629 -6.424 -19.980 1.00 0.00 H new ATOM 0 HD12 LEU A 24 18.466 -6.265 -18.215 1.00 0.00 H new ATOM 0 HD13 LEU A 24 19.688 -7.362 -18.900 1.00 0.00 H new ATOM 0 HD21 LEU A 24 17.882 -8.395 -21.141 1.00 0.00 H new ATOM 0 HD22 LEU A 24 18.905 -9.452 -20.140 1.00 0.00 H new ATOM 0 HD23 LEU A 24 17.159 -9.770 -20.274 1.00 0.00 H new ATOM 391 N LEU A 25 18.905 -10.889 -15.338 1.00 0.00 N ATOM 392 CA LEU A 25 19.042 -11.198 -13.925 1.00 0.00 C ATOM 393 C LEU A 25 20.520 -11.368 -13.562 1.00 0.00 C ATOM 394 O LEU A 25 20.918 -11.083 -12.434 1.00 0.00 O ATOM 395 CB LEU A 25 18.226 -12.463 -13.650 1.00 0.00 C ATOM 396 CG LEU A 25 18.131 -12.830 -12.169 1.00 0.00 C ATOM 397 CD1 LEU A 25 17.430 -11.738 -11.363 1.00 0.00 C ATOM 398 CD2 LEU A 25 17.311 -14.115 -12.055 1.00 0.00 C ATOM 0 H LEU A 25 18.573 -11.670 -15.904 1.00 0.00 H new ATOM 0 HA LEU A 25 18.664 -10.387 -13.303 1.00 0.00 H new ATOM 0 HB2 LEU A 25 17.219 -12.327 -14.046 1.00 0.00 H new ATOM 0 HB3 LEU A 25 18.672 -13.296 -14.193 1.00 0.00 H new ATOM 0 HG LEU A 25 19.139 -12.953 -11.773 1.00 0.00 H new ATOM 0 HD11 LEU A 25 17.381 -12.034 -10.315 1.00 0.00 H new ATOM 0 HD12 LEU A 25 17.988 -10.806 -11.451 1.00 0.00 H new ATOM 0 HD13 LEU A 25 16.420 -11.594 -11.747 1.00 0.00 H new ATOM 0 HD21 LEU A 25 17.227 -14.401 -11.007 1.00 0.00 H new ATOM 0 HD22 LEU A 25 16.316 -13.949 -12.467 1.00 0.00 H new ATOM 0 HD23 LEU A 25 17.805 -14.912 -12.610 1.00 0.00 H new ATOM 410 N VAL A 26 21.338 -11.826 -14.516 1.00 0.00 N ATOM 411 CA VAL A 26 22.777 -11.940 -14.319 1.00 0.00 C ATOM 412 C VAL A 26 23.392 -10.547 -14.296 1.00 0.00 C ATOM 413 O VAL A 26 24.224 -10.259 -13.442 1.00 0.00 O ATOM 414 CB VAL A 26 23.403 -12.787 -15.436 1.00 0.00 C ATOM 415 CG1 VAL A 26 24.930 -12.744 -15.355 1.00 0.00 C ATOM 416 CG2 VAL A 26 22.958 -14.241 -15.324 1.00 0.00 C ATOM 0 H VAL A 26 21.019 -12.125 -15.438 1.00 0.00 H new ATOM 0 HA VAL A 26 22.975 -12.435 -13.368 1.00 0.00 H new ATOM 0 HB VAL A 26 23.071 -12.371 -16.387 1.00 0.00 H new ATOM 0 HG11 VAL A 26 25.354 -13.351 -16.155 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.271 -11.714 -15.461 1.00 0.00 H new ATOM 0 HG13 VAL A 26 25.254 -13.137 -14.391 1.00 0.00 H new ATOM 0 HG21 VAL A 26 23.413 -14.824 -16.125 1.00 0.00 H new ATOM 0 HG22 VAL A 26 23.270 -14.644 -14.360 1.00 0.00 H new ATOM 0 HG23 VAL A 26 21.873 -14.297 -15.406 1.00 0.00 H new ATOM 426 N VAL A 27 22.991 -9.673 -15.221 1.00 0.00 N ATOM 427 CA VAL A 27 23.525 -8.312 -15.289 1.00 0.00 C ATOM 428 C VAL A 27 23.139 -7.523 -14.039 1.00 0.00 C ATOM 429 O VAL A 27 23.810 -6.558 -13.682 1.00 0.00 O ATOM 430 CB VAL A 27 23.008 -7.634 -16.565 1.00 0.00 C ATOM 431 CG1 VAL A 27 23.365 -6.148 -16.610 1.00 0.00 C ATOM 432 CG2 VAL A 27 23.643 -8.298 -17.791 1.00 0.00 C ATOM 0 H VAL A 27 22.295 -9.885 -15.936 1.00 0.00 H new ATOM 0 HA VAL A 27 24.614 -8.344 -15.327 1.00 0.00 H new ATOM 0 HB VAL A 27 21.923 -7.741 -16.567 1.00 0.00 H new ATOM 0 HG11 VAL A 27 22.979 -5.709 -17.530 1.00 0.00 H new ATOM 0 HG12 VAL A 27 22.922 -5.641 -15.753 1.00 0.00 H new ATOM 0 HG13 VAL A 27 24.448 -6.033 -16.579 1.00 0.00 H new ATOM 0 HG21 VAL A 27 23.275 -7.816 -18.697 1.00 0.00 H new ATOM 0 HG22 VAL A 27 24.727 -8.196 -17.740 1.00 0.00 H new ATOM 0 HG23 VAL A 27 23.379 -9.355 -17.810 1.00 0.00 H new ATOM 442 N ARG A 28 22.057 -7.931 -13.369 1.00 0.00 N ATOM 443 CA ARG A 28 21.567 -7.252 -12.179 1.00 0.00 C ATOM 444 C ARG A 28 22.455 -7.520 -10.965 1.00 0.00 C ATOM 445 O ARG A 28 22.650 -6.633 -10.138 1.00 0.00 O ATOM 446 CB ARG A 28 20.149 -7.755 -11.914 1.00 0.00 C ATOM 447 CG ARG A 28 19.428 -6.915 -10.865 1.00 0.00 C ATOM 448 CD ARG A 28 18.054 -7.532 -10.619 1.00 0.00 C ATOM 449 NE ARG A 28 17.191 -6.631 -9.844 1.00 0.00 N ATOM 450 CZ ARG A 28 15.998 -6.186 -10.253 1.00 0.00 C ATOM 451 NH1 ARG A 28 15.492 -6.555 -11.426 1.00 0.00 N ATOM 452 NH2 ARG A 28 15.300 -5.360 -9.478 1.00 0.00 N ATOM 0 H ARG A 28 21.501 -8.741 -13.641 1.00 0.00 H new ATOM 0 HA ARG A 28 21.578 -6.175 -12.346 1.00 0.00 H new ATOM 0 HB2 ARG A 28 19.580 -7.740 -12.844 1.00 0.00 H new ATOM 0 HB3 ARG A 28 20.189 -8.792 -11.582 1.00 0.00 H new ATOM 0 HG2 ARG A 28 20.003 -6.888 -9.940 1.00 0.00 H new ATOM 0 HG3 ARG A 28 19.326 -5.885 -11.208 1.00 0.00 H new ATOM 0 HD2 ARG A 28 17.580 -7.760 -11.574 1.00 0.00 H new ATOM 0 HD3 ARG A 28 18.168 -8.476 -10.086 1.00 0.00 H new ATOM 0 HE ARG A 28 17.525 -6.323 -8.931 1.00 0.00 H new ATOM 0 HH11 ARG A 28 16.015 -7.188 -12.031 1.00 0.00 H new ATOM 0 HH12 ARG A 28 14.580 -6.205 -11.721 1.00 0.00 H new ATOM 0 HH21 ARG A 28 15.675 -5.068 -8.575 1.00 0.00 H new ATOM 0 HH22 ARG A 28 14.390 -5.018 -9.786 1.00 0.00 H new ATOM 466 N TYR A 29 22.988 -8.740 -10.857 1.00 0.00 N ATOM 467 CA TYR A 29 23.765 -9.145 -9.694 1.00 0.00 C ATOM 468 C TYR A 29 25.237 -9.432 -9.990 1.00 0.00 C ATOM 469 O TYR A 29 25.978 -9.757 -9.068 1.00 0.00 O ATOM 470 CB TYR A 29 23.094 -10.364 -9.068 1.00 0.00 C ATOM 471 CG TYR A 29 21.749 -10.040 -8.460 1.00 0.00 C ATOM 472 CD1 TYR A 29 21.680 -9.222 -7.325 1.00 0.00 C ATOM 473 CD2 TYR A 29 20.575 -10.553 -9.031 1.00 0.00 C ATOM 474 CE1 TYR A 29 20.438 -8.914 -6.753 1.00 0.00 C ATOM 475 CE2 TYR A 29 19.329 -10.249 -8.467 1.00 0.00 C ATOM 476 CZ TYR A 29 19.255 -9.425 -7.324 1.00 0.00 C ATOM 477 OH TYR A 29 18.045 -9.126 -6.771 1.00 0.00 O ATOM 0 H TYR A 29 22.892 -9.465 -11.568 1.00 0.00 H new ATOM 0 HA TYR A 29 23.777 -8.303 -9.002 1.00 0.00 H new ATOM 0 HB2 TYR A 29 22.969 -11.135 -9.828 1.00 0.00 H new ATOM 0 HB3 TYR A 29 23.746 -10.778 -8.299 1.00 0.00 H new ATOM 0 HD1 TYR A 29 22.586 -8.828 -6.889 1.00 0.00 H new ATOM 0 HD2 TYR A 29 20.632 -11.183 -9.906 1.00 0.00 H new ATOM 0 HE1 TYR A 29 20.388 -8.286 -5.876 1.00 0.00 H new ATOM 0 HE2 TYR A 29 18.426 -10.645 -8.907 1.00 0.00 H new ATOM 0 HH TYR A 29 17.333 -9.558 -7.288 1.00 0.00 H new ATOM 487 N GLN A 30 25.684 -9.326 -11.246 1.00 0.00 N ATOM 488 CA GLN A 30 27.049 -9.714 -11.599 1.00 0.00 C ATOM 489 C GLN A 30 28.105 -8.931 -10.820 1.00 0.00 C ATOM 490 O GLN A 30 29.181 -9.463 -10.555 1.00 0.00 O ATOM 491 CB GLN A 30 27.271 -9.572 -13.107 1.00 0.00 C ATOM 492 CG GLN A 30 27.049 -8.137 -13.595 1.00 0.00 C ATOM 493 CD GLN A 30 27.265 -8.009 -15.097 1.00 0.00 C ATOM 494 OE1 GLN A 30 27.697 -8.947 -15.763 1.00 0.00 O ATOM 495 NE2 GLN A 30 26.960 -6.839 -15.649 1.00 0.00 N ATOM 0 H GLN A 30 25.126 -8.978 -12.026 1.00 0.00 H new ATOM 0 HA GLN A 30 27.166 -10.761 -11.318 1.00 0.00 H new ATOM 0 HB2 GLN A 30 28.286 -9.884 -13.354 1.00 0.00 H new ATOM 0 HB3 GLN A 30 26.594 -10.242 -13.636 1.00 0.00 H new ATOM 0 HG2 GLN A 30 26.036 -7.821 -13.346 1.00 0.00 H new ATOM 0 HG3 GLN A 30 27.730 -7.466 -13.072 1.00 0.00 H new ATOM 0 HE21 GLN A 30 26.603 -6.079 -15.069 1.00 0.00 H new ATOM 0 HE22 GLN A 30 27.083 -6.701 -16.652 1.00 0.00 H new ATOM 504 N HIS A 31 27.820 -7.679 -10.446 1.00 0.00 N ATOM 505 CA HIS A 31 28.782 -6.873 -9.706 1.00 0.00 C ATOM 506 C HIS A 31 28.656 -7.112 -8.204 1.00 0.00 C ATOM 507 O HIS A 31 29.621 -6.925 -7.464 1.00 0.00 O ATOM 508 CB HIS A 31 28.562 -5.397 -10.042 1.00 0.00 C ATOM 509 CG HIS A 31 28.733 -5.089 -11.505 1.00 0.00 C ATOM 510 ND1 HIS A 31 27.753 -4.541 -12.334 1.00 0.00 N ATOM 511 CD2 HIS A 31 29.869 -5.301 -12.235 1.00 0.00 C ATOM 512 CE1 HIS A 31 28.329 -4.425 -13.542 1.00 0.00 C ATOM 513 NE2 HIS A 31 29.594 -4.879 -13.514 1.00 0.00 N ATOM 0 H HIS A 31 26.936 -7.209 -10.644 1.00 0.00 H new ATOM 0 HA HIS A 31 29.791 -7.163 -9.998 1.00 0.00 H new ATOM 0 HB2 HIS A 31 27.559 -5.106 -9.731 1.00 0.00 H new ATOM 0 HB3 HIS A 31 29.262 -4.792 -9.466 1.00 0.00 H new ATOM 0 HD2 HIS A 31 30.799 -5.718 -11.878 1.00 0.00 H new ATOM 0 HE1 HIS A 31 27.842 -4.022 -14.417 1.00 0.00 H new ATOM 0 HE2 HIS A 31 30.238 -4.906 -14.305 1.00 0.00 H new ATOM 521 N LYS A 32 27.471 -7.524 -7.747 1.00 0.00 N ATOM 522 CA LYS A 32 27.212 -7.736 -6.330 1.00 0.00 C ATOM 523 C LYS A 32 27.708 -9.112 -5.896 1.00 0.00 C ATOM 524 O LYS A 32 28.155 -9.282 -4.761 1.00 0.00 O ATOM 525 CB LYS A 32 25.708 -7.572 -6.095 1.00 0.00 C ATOM 526 CG LYS A 32 25.406 -7.340 -4.614 1.00 0.00 C ATOM 527 CD LYS A 32 23.893 -7.217 -4.425 1.00 0.00 C ATOM 528 CE LYS A 32 23.534 -7.015 -2.955 1.00 0.00 C ATOM 529 NZ LYS A 32 24.061 -5.740 -2.430 1.00 0.00 N ATOM 0 H LYS A 32 26.671 -7.718 -8.349 1.00 0.00 H new ATOM 0 HA LYS A 32 27.752 -7.005 -5.727 1.00 0.00 H new ATOM 0 HB2 LYS A 32 25.334 -6.733 -6.682 1.00 0.00 H new ATOM 0 HB3 LYS A 32 25.183 -8.462 -6.442 1.00 0.00 H new ATOM 0 HG2 LYS A 32 25.794 -8.166 -4.017 1.00 0.00 H new ATOM 0 HG3 LYS A 32 25.903 -6.435 -4.266 1.00 0.00 H new ATOM 0 HD2 LYS A 32 23.518 -6.379 -5.012 1.00 0.00 H new ATOM 0 HD3 LYS A 32 23.403 -8.115 -4.802 1.00 0.00 H new ATOM 0 HE2 LYS A 32 22.450 -7.035 -2.840 1.00 0.00 H new ATOM 0 HE3 LYS A 32 23.932 -7.842 -2.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 23.658 -5.559 -1.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 25.097 -5.796 -2.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 23.800 -4.965 -3.073 1.00 0.00 H new ATOM 543 N VAL A 33 27.629 -10.092 -6.796 1.00 0.00 N ATOM 544 CA VAL A 33 28.095 -11.441 -6.505 1.00 0.00 C ATOM 545 C VAL A 33 29.608 -11.531 -6.671 1.00 0.00 C ATOM 546 O VAL A 33 30.255 -12.325 -5.992 1.00 0.00 O ATOM 547 CB VAL A 33 27.364 -12.445 -7.398 1.00 0.00 C ATOM 548 CG1 VAL A 33 27.874 -12.397 -8.831 1.00 0.00 C ATOM 549 CG2 VAL A 33 27.544 -13.864 -6.864 1.00 0.00 C ATOM 0 H VAL A 33 27.245 -9.973 -7.734 1.00 0.00 H new ATOM 0 HA VAL A 33 27.869 -11.686 -5.467 1.00 0.00 H new ATOM 0 HB VAL A 33 26.309 -12.171 -7.389 1.00 0.00 H new ATOM 0 HG11 VAL A 33 27.331 -13.124 -9.435 1.00 0.00 H new ATOM 0 HG12 VAL A 33 27.719 -11.398 -9.239 1.00 0.00 H new ATOM 0 HG13 VAL A 33 28.938 -12.634 -8.847 1.00 0.00 H new ATOM 0 HG21 VAL A 33 27.018 -14.566 -7.511 1.00 0.00 H new ATOM 0 HG22 VAL A 33 28.605 -14.114 -6.845 1.00 0.00 H new ATOM 0 HG23 VAL A 33 27.138 -13.927 -5.854 1.00 0.00 H new ATOM 559 N ALA A 34 30.184 -10.721 -7.565 1.00 0.00 N ATOM 560 CA ALA A 34 31.625 -10.706 -7.755 1.00 0.00 C ATOM 561 C ALA A 34 32.314 -10.110 -6.530 1.00 0.00 C ATOM 562 O ALA A 34 33.459 -10.452 -6.247 1.00 0.00 O ATOM 563 CB ALA A 34 31.952 -9.905 -9.014 1.00 0.00 C ATOM 0 H ALA A 34 29.671 -10.073 -8.163 1.00 0.00 H new ATOM 0 HA ALA A 34 31.992 -11.725 -7.878 1.00 0.00 H new ATOM 0 HB1 ALA A 34 33.031 -9.888 -9.165 1.00 0.00 H new ATOM 0 HB2 ALA A 34 31.473 -10.370 -9.876 1.00 0.00 H new ATOM 0 HB3 ALA A 34 31.586 -8.885 -8.901 1.00 0.00 H new ATOM 569 N SER A 35 31.622 -9.228 -5.802 1.00 0.00 N ATOM 570 CA SER A 35 32.145 -8.657 -4.571 1.00 0.00 C ATOM 571 C SER A 35 32.011 -9.650 -3.419 1.00 0.00 C ATOM 572 O SER A 35 32.732 -9.541 -2.429 1.00 0.00 O ATOM 573 CB SER A 35 31.411 -7.356 -4.255 1.00 0.00 C ATOM 574 OG SER A 35 31.669 -6.410 -5.270 1.00 0.00 O ATOM 0 H SER A 35 30.691 -8.896 -6.053 1.00 0.00 H new ATOM 0 HA SER A 35 33.205 -8.439 -4.702 1.00 0.00 H new ATOM 0 HB2 SER A 35 30.339 -7.540 -4.179 1.00 0.00 H new ATOM 0 HB3 SER A 35 31.737 -6.968 -3.290 1.00 0.00 H new ATOM 0 HG SER A 35 31.033 -6.537 -6.005 1.00 0.00 H new ATOM 580 N LEU A 36 31.093 -10.617 -3.534 1.00 0.00 N ATOM 581 CA LEU A 36 30.918 -11.644 -2.519 1.00 0.00 C ATOM 582 C LEU A 36 31.943 -12.766 -2.674 1.00 0.00 C ATOM 583 O LEU A 36 32.538 -13.181 -1.682 1.00 0.00 O ATOM 584 CB LEU A 36 29.490 -12.195 -2.606 1.00 0.00 C ATOM 585 CG LEU A 36 29.273 -13.396 -1.672 1.00 0.00 C ATOM 586 CD1 LEU A 36 29.483 -13.011 -0.208 1.00 0.00 C ATOM 587 CD2 LEU A 36 27.850 -13.901 -1.855 1.00 0.00 C ATOM 0 H LEU A 36 30.459 -10.703 -4.329 1.00 0.00 H new ATOM 0 HA LEU A 36 31.079 -11.199 -1.537 1.00 0.00 H new ATOM 0 HB2 LEU A 36 28.782 -11.406 -2.351 1.00 0.00 H new ATOM 0 HB3 LEU A 36 29.279 -12.493 -3.633 1.00 0.00 H new ATOM 0 HG LEU A 36 29.998 -14.170 -1.926 1.00 0.00 H new ATOM 0 HD11 LEU A 36 29.322 -13.884 0.425 1.00 0.00 H new ATOM 0 HD12 LEU A 36 30.501 -12.646 -0.070 1.00 0.00 H new ATOM 0 HD13 LEU A 36 28.777 -12.228 0.067 1.00 0.00 H new ATOM 0 HD21 LEU A 36 27.679 -14.754 -1.199 1.00 0.00 H new ATOM 0 HD22 LEU A 36 27.147 -13.106 -1.607 1.00 0.00 H new ATOM 0 HD23 LEU A 36 27.702 -14.205 -2.891 1.00 0.00 H new ATOM 599 N VAL A 37 32.166 -13.263 -3.893 1.00 0.00 N ATOM 600 CA VAL A 37 33.085 -14.384 -4.070 1.00 0.00 C ATOM 601 C VAL A 37 34.536 -13.919 -4.017 1.00 0.00 C ATOM 602 O VAL A 37 35.427 -14.721 -3.751 1.00 0.00 O ATOM 603 CB VAL A 37 32.789 -15.163 -5.356 1.00 0.00 C ATOM 604 CG1 VAL A 37 31.324 -15.589 -5.413 1.00 0.00 C ATOM 605 CG2 VAL A 37 33.125 -14.366 -6.609 1.00 0.00 C ATOM 0 H VAL A 37 31.735 -12.917 -4.750 1.00 0.00 H new ATOM 0 HA VAL A 37 32.928 -15.071 -3.238 1.00 0.00 H new ATOM 0 HB VAL A 37 33.429 -16.045 -5.331 1.00 0.00 H new ATOM 0 HG11 VAL A 37 31.141 -16.140 -6.336 1.00 0.00 H new ATOM 0 HG12 VAL A 37 31.097 -16.226 -4.559 1.00 0.00 H new ATOM 0 HG13 VAL A 37 30.687 -14.705 -5.386 1.00 0.00 H new ATOM 0 HG21 VAL A 37 32.897 -14.963 -7.492 1.00 0.00 H new ATOM 0 HG22 VAL A 37 32.534 -13.450 -6.627 1.00 0.00 H new ATOM 0 HG23 VAL A 37 34.185 -14.113 -6.606 1.00 0.00 H new ATOM 615 N SER A 38 34.786 -12.628 -4.263 1.00 0.00 N ATOM 616 CA SER A 38 36.129 -12.064 -4.178 1.00 0.00 C ATOM 617 C SER A 38 36.675 -12.183 -2.753 1.00 0.00 C ATOM 618 O SER A 38 37.877 -12.043 -2.531 1.00 0.00 O ATOM 619 CB SER A 38 36.098 -10.607 -4.630 1.00 0.00 C ATOM 620 OG SER A 38 37.395 -10.044 -4.596 1.00 0.00 O ATOM 0 H SER A 38 34.067 -11.953 -4.524 1.00 0.00 H new ATOM 0 HA SER A 38 36.795 -12.623 -4.835 1.00 0.00 H new ATOM 0 HB2 SER A 38 35.695 -10.543 -5.641 1.00 0.00 H new ATOM 0 HB3 SER A 38 35.431 -10.035 -3.985 1.00 0.00 H new ATOM 0 HG SER A 38 37.973 -10.589 -4.023 1.00 0.00 H new ATOM 626 N ARG A 39 35.796 -12.446 -1.780 1.00 0.00 N ATOM 627 CA ARG A 39 36.176 -12.611 -0.384 1.00 0.00 C ATOM 628 C ARG A 39 36.757 -14.004 -0.134 1.00 0.00 C ATOM 629 O ARG A 39 37.284 -14.260 0.949 1.00 0.00 O ATOM 630 CB ARG A 39 34.953 -12.381 0.505 1.00 0.00 C ATOM 631 CG ARG A 39 34.272 -11.054 0.176 1.00 0.00 C ATOM 632 CD ARG A 39 33.043 -10.867 1.056 1.00 0.00 C ATOM 633 NE ARG A 39 32.298 -9.670 0.657 1.00 0.00 N ATOM 634 CZ ARG A 39 31.305 -9.132 1.371 1.00 0.00 C ATOM 635 NH1 ARG A 39 30.923 -9.674 2.525 1.00 0.00 N ATOM 636 NH2 ARG A 39 30.685 -8.042 0.928 1.00 0.00 N ATOM 0 H ARG A 39 34.795 -12.550 -1.946 1.00 0.00 H new ATOM 0 HA ARG A 39 36.946 -11.879 -0.142 1.00 0.00 H new ATOM 0 HB2 ARG A 39 34.245 -13.199 0.372 1.00 0.00 H new ATOM 0 HB3 ARG A 39 35.255 -12.388 1.552 1.00 0.00 H new ATOM 0 HG2 ARG A 39 34.969 -10.230 0.330 1.00 0.00 H new ATOM 0 HG3 ARG A 39 33.983 -11.035 -0.875 1.00 0.00 H new ATOM 0 HD2 ARG A 39 32.399 -11.744 0.982 1.00 0.00 H new ATOM 0 HD3 ARG A 39 33.346 -10.782 2.100 1.00 0.00 H new ATOM 0 HE ARG A 39 32.554 -9.219 -0.221 1.00 0.00 H new ATOM 0 HH11 ARG A 39 31.390 -10.511 2.875 1.00 0.00 H new ATOM 0 HH12 ARG A 39 30.163 -9.253 3.060 1.00 0.00 H new ATOM 0 HH21 ARG A 39 30.968 -7.618 0.044 1.00 0.00 H new ATOM 0 HH22 ARG A 39 29.927 -7.630 1.472 1.00 0.00 H new ATOM 650 N TYR A 40 36.668 -14.904 -1.121 1.00 0.00 N ATOM 651 CA TYR A 40 37.120 -16.281 -0.972 1.00 0.00 C ATOM 652 C TYR A 40 38.094 -16.697 -2.078 1.00 0.00 C ATOM 653 O TYR A 40 38.832 -17.661 -1.901 1.00 0.00 O ATOM 654 CB TYR A 40 35.892 -17.193 -0.935 1.00 0.00 C ATOM 655 CG TYR A 40 34.872 -16.781 0.101 1.00 0.00 C ATOM 656 CD1 TYR A 40 35.098 -17.061 1.456 1.00 0.00 C ATOM 657 CD2 TYR A 40 33.705 -16.112 -0.297 1.00 0.00 C ATOM 658 CE1 TYR A 40 34.163 -16.657 2.420 1.00 0.00 C ATOM 659 CE2 TYR A 40 32.763 -15.706 0.661 1.00 0.00 C ATOM 660 CZ TYR A 40 32.993 -15.973 2.027 1.00 0.00 C ATOM 661 OH TYR A 40 32.090 -15.571 2.967 1.00 0.00 O ATOM 0 H TYR A 40 36.281 -14.693 -2.041 1.00 0.00 H new ATOM 0 HA TYR A 40 37.676 -16.371 -0.039 1.00 0.00 H new ATOM 0 HB2 TYR A 40 35.421 -17.196 -1.918 1.00 0.00 H new ATOM 0 HB3 TYR A 40 36.213 -18.215 -0.732 1.00 0.00 H new ATOM 0 HD1 TYR A 40 35.992 -17.587 1.757 1.00 0.00 H new ATOM 0 HD2 TYR A 40 33.531 -15.909 -1.343 1.00 0.00 H new ATOM 0 HE1 TYR A 40 34.339 -16.870 3.464 1.00 0.00 H new ATOM 0 HE2 TYR A 40 31.865 -15.191 0.353 1.00 0.00 H new ATOM 0 HH TYR A 40 31.343 -15.114 2.528 1.00 0.00 H new ATOM 671 N VAL A 41 38.112 -15.986 -3.209 1.00 0.00 N ATOM 672 CA VAL A 41 39.039 -16.284 -4.298 1.00 0.00 C ATOM 673 C VAL A 41 39.708 -15.008 -4.804 1.00 0.00 C ATOM 674 O VAL A 41 39.141 -13.924 -4.683 1.00 0.00 O ATOM 675 CB VAL A 41 38.336 -17.001 -5.460 1.00 0.00 C ATOM 676 CG1 VAL A 41 38.037 -18.453 -5.107 1.00 0.00 C ATOM 677 CG2 VAL A 41 37.037 -16.320 -5.884 1.00 0.00 C ATOM 0 H VAL A 41 37.491 -15.197 -3.392 1.00 0.00 H new ATOM 0 HA VAL A 41 39.802 -16.952 -3.898 1.00 0.00 H new ATOM 0 HB VAL A 41 39.031 -16.954 -6.298 1.00 0.00 H new ATOM 0 HG11 VAL A 41 37.539 -18.937 -5.947 1.00 0.00 H new ATOM 0 HG12 VAL A 41 38.969 -18.974 -4.889 1.00 0.00 H new ATOM 0 HG13 VAL A 41 37.388 -18.489 -4.232 1.00 0.00 H new ATOM 0 HG21 VAL A 41 36.588 -16.874 -6.709 1.00 0.00 H new ATOM 0 HG22 VAL A 41 36.345 -16.299 -5.042 1.00 0.00 H new ATOM 0 HG23 VAL A 41 37.249 -15.300 -6.205 1.00 0.00 H new ATOM 687 N PRO A 42 40.916 -15.126 -5.375 1.00 0.00 N ATOM 688 CA PRO A 42 41.637 -14.007 -5.953 1.00 0.00 C ATOM 689 C PRO A 42 40.931 -13.533 -7.220 1.00 0.00 C ATOM 690 O PRO A 42 40.129 -14.267 -7.799 1.00 0.00 O ATOM 691 CB PRO A 42 43.039 -14.541 -6.255 1.00 0.00 C ATOM 692 CG PRO A 42 42.786 -16.026 -6.518 1.00 0.00 C ATOM 693 CD PRO A 42 41.677 -16.356 -5.520 1.00 0.00 C ATOM 0 HA PRO A 42 41.683 -13.147 -5.284 1.00 0.00 H new ATOM 0 HB2 PRO A 42 43.483 -14.047 -7.119 1.00 0.00 H new ATOM 0 HB3 PRO A 42 43.719 -14.389 -5.417 1.00 0.00 H new ATOM 0 HG2 PRO A 42 42.474 -16.208 -7.546 1.00 0.00 H new ATOM 0 HG3 PRO A 42 43.679 -16.626 -6.345 1.00 0.00 H new ATOM 0 HD2 PRO A 42 41.048 -17.168 -5.885 1.00 0.00 H new ATOM 0 HD3 PRO A 42 42.090 -16.678 -4.564 1.00 0.00 H new ATOM 701 N SER A 43 41.224 -12.307 -7.656 1.00 0.00 N ATOM 702 CA SER A 43 40.555 -11.695 -8.797 1.00 0.00 C ATOM 703 C SER A 43 40.723 -12.504 -10.084 1.00 0.00 C ATOM 704 O SER A 43 39.961 -12.319 -11.028 1.00 0.00 O ATOM 705 CB SER A 43 41.113 -10.287 -8.992 1.00 0.00 C ATOM 706 OG SER A 43 42.504 -10.340 -9.249 1.00 0.00 O ATOM 0 H SER A 43 41.933 -11.713 -7.226 1.00 0.00 H new ATOM 0 HA SER A 43 39.486 -11.664 -8.584 1.00 0.00 H new ATOM 0 HB2 SER A 43 40.602 -9.798 -9.821 1.00 0.00 H new ATOM 0 HB3 SER A 43 40.924 -9.687 -8.102 1.00 0.00 H new ATOM 0 HG SER A 43 42.848 -9.431 -9.374 1.00 0.00 H new ATOM 712 N GLY A 44 41.713 -13.401 -10.124 1.00 0.00 N ATOM 713 CA GLY A 44 41.959 -14.242 -11.282 1.00 0.00 C ATOM 714 C GLY A 44 40.958 -15.389 -11.396 1.00 0.00 C ATOM 715 O GLY A 44 40.862 -16.009 -12.454 1.00 0.00 O ATOM 0 H GLY A 44 42.361 -13.559 -9.352 1.00 0.00 H new ATOM 0 HA2 GLY A 44 41.913 -13.633 -12.185 1.00 0.00 H new ATOM 0 HA3 GLY A 44 42.968 -14.650 -11.223 1.00 0.00 H new ATOM 719 N ASP A 45 40.208 -15.679 -10.325 1.00 0.00 N ATOM 720 CA ASP A 45 39.231 -16.763 -10.313 1.00 0.00 C ATOM 721 C ASP A 45 37.813 -16.249 -10.060 1.00 0.00 C ATOM 722 O ASP A 45 36.863 -17.024 -10.134 1.00 0.00 O ATOM 723 CB ASP A 45 39.633 -17.805 -9.269 1.00 0.00 C ATOM 724 CG ASP A 45 40.966 -18.469 -9.608 1.00 0.00 C ATOM 725 OD1 ASP A 45 41.119 -18.903 -10.771 1.00 0.00 O ATOM 726 OD2 ASP A 45 41.823 -18.541 -8.697 1.00 0.00 O ATOM 0 H ASP A 45 40.265 -15.166 -9.445 1.00 0.00 H new ATOM 0 HA ASP A 45 39.225 -17.229 -11.298 1.00 0.00 H new ATOM 0 HB2 ASP A 45 39.703 -17.330 -8.291 1.00 0.00 H new ATOM 0 HB3 ASP A 45 38.856 -18.566 -9.199 1.00 0.00 H new ATOM 731 N VAL A 46 37.650 -14.954 -9.767 1.00 0.00 N ATOM 732 CA VAL A 46 36.329 -14.385 -9.529 1.00 0.00 C ATOM 733 C VAL A 46 35.396 -14.600 -10.722 1.00 0.00 C ATOM 734 O VAL A 46 34.286 -15.083 -10.516 1.00 0.00 O ATOM 735 CB VAL A 46 36.443 -12.895 -9.180 1.00 0.00 C ATOM 736 CG1 VAL A 46 35.074 -12.212 -9.173 1.00 0.00 C ATOM 737 CG2 VAL A 46 37.042 -12.737 -7.784 1.00 0.00 C ATOM 0 H VAL A 46 38.417 -14.286 -9.690 1.00 0.00 H new ATOM 0 HA VAL A 46 35.889 -14.907 -8.679 1.00 0.00 H new ATOM 0 HB VAL A 46 37.076 -12.433 -9.938 1.00 0.00 H new ATOM 0 HG11 VAL A 46 35.194 -11.158 -8.922 1.00 0.00 H new ATOM 0 HG12 VAL A 46 34.618 -12.300 -10.159 1.00 0.00 H new ATOM 0 HG13 VAL A 46 34.433 -12.690 -8.433 1.00 0.00 H new ATOM 0 HG21 VAL A 46 37.121 -11.678 -7.540 1.00 0.00 H new ATOM 0 HG22 VAL A 46 36.400 -13.230 -7.055 1.00 0.00 H new ATOM 0 HG23 VAL A 46 38.033 -13.190 -7.760 1.00 0.00 H new ATOM 747 N PRO A 47 35.779 -14.265 -11.965 1.00 0.00 N ATOM 748 CA PRO A 47 34.870 -14.370 -13.095 1.00 0.00 C ATOM 749 C PRO A 47 34.513 -15.823 -13.399 1.00 0.00 C ATOM 750 O PRO A 47 33.484 -16.084 -14.020 1.00 0.00 O ATOM 751 CB PRO A 47 35.605 -13.716 -14.264 1.00 0.00 C ATOM 752 CG PRO A 47 37.076 -13.912 -13.907 1.00 0.00 C ATOM 753 CD PRO A 47 37.070 -13.752 -12.391 1.00 0.00 C ATOM 0 HA PRO A 47 33.919 -13.878 -12.891 1.00 0.00 H new ATOM 0 HB2 PRO A 47 35.355 -14.191 -15.213 1.00 0.00 H new ATOM 0 HB3 PRO A 47 35.351 -12.660 -14.359 1.00 0.00 H new ATOM 0 HG2 PRO A 47 37.440 -14.894 -14.210 1.00 0.00 H new ATOM 0 HG3 PRO A 47 37.713 -13.172 -14.391 1.00 0.00 H new ATOM 0 HD2 PRO A 47 37.887 -14.309 -11.932 1.00 0.00 H new ATOM 0 HD3 PRO A 47 37.194 -12.708 -12.104 1.00 0.00 H new ATOM 761 N ASP A 48 35.348 -16.775 -12.975 1.00 0.00 N ATOM 762 CA ASP A 48 35.077 -18.186 -13.207 1.00 0.00 C ATOM 763 C ASP A 48 34.153 -18.743 -12.123 1.00 0.00 C ATOM 764 O ASP A 48 33.353 -19.638 -12.389 1.00 0.00 O ATOM 765 CB ASP A 48 36.400 -18.951 -13.249 1.00 0.00 C ATOM 766 CG ASP A 48 36.177 -20.423 -13.594 1.00 0.00 C ATOM 767 OD1 ASP A 48 35.834 -20.693 -14.767 1.00 0.00 O ATOM 768 OD2 ASP A 48 36.351 -21.264 -12.686 1.00 0.00 O ATOM 0 H ASP A 48 36.215 -16.589 -12.470 1.00 0.00 H new ATOM 0 HA ASP A 48 34.568 -18.305 -14.163 1.00 0.00 H new ATOM 0 HB2 ASP A 48 37.062 -18.498 -13.987 1.00 0.00 H new ATOM 0 HB3 ASP A 48 36.899 -18.873 -12.283 1.00 0.00 H new ATOM 773 N VAL A 49 34.254 -18.213 -10.902 1.00 0.00 N ATOM 774 CA VAL A 49 33.421 -18.649 -9.788 1.00 0.00 C ATOM 775 C VAL A 49 32.061 -17.956 -9.837 1.00 0.00 C ATOM 776 O VAL A 49 31.071 -18.512 -9.368 1.00 0.00 O ATOM 777 CB VAL A 49 34.159 -18.380 -8.473 1.00 0.00 C ATOM 778 CG1 VAL A 49 33.268 -18.652 -7.262 1.00 0.00 C ATOM 779 CG2 VAL A 49 35.373 -19.306 -8.371 1.00 0.00 C ATOM 0 H VAL A 49 34.914 -17.473 -10.662 1.00 0.00 H new ATOM 0 HA VAL A 49 33.233 -19.720 -9.860 1.00 0.00 H new ATOM 0 HB VAL A 49 34.456 -17.331 -8.474 1.00 0.00 H new ATOM 0 HG11 VAL A 49 33.826 -18.450 -6.347 1.00 0.00 H new ATOM 0 HG12 VAL A 49 32.391 -18.005 -7.303 1.00 0.00 H new ATOM 0 HG13 VAL A 49 32.950 -19.695 -7.271 1.00 0.00 H new ATOM 0 HG21 VAL A 49 35.899 -19.115 -7.435 1.00 0.00 H new ATOM 0 HG22 VAL A 49 35.042 -20.344 -8.396 1.00 0.00 H new ATOM 0 HG23 VAL A 49 36.044 -19.119 -9.209 1.00 0.00 H new ATOM 789 N VAL A 50 31.998 -16.747 -10.404 1.00 0.00 N ATOM 790 CA VAL A 50 30.730 -16.051 -10.576 1.00 0.00 C ATOM 791 C VAL A 50 29.934 -16.722 -11.694 1.00 0.00 C ATOM 792 O VAL A 50 28.710 -16.798 -11.616 1.00 0.00 O ATOM 793 CB VAL A 50 30.984 -14.575 -10.892 1.00 0.00 C ATOM 794 CG1 VAL A 50 29.696 -13.891 -11.349 1.00 0.00 C ATOM 795 CG2 VAL A 50 31.506 -13.845 -9.655 1.00 0.00 C ATOM 0 H VAL A 50 32.810 -16.236 -10.749 1.00 0.00 H new ATOM 0 HA VAL A 50 30.151 -16.104 -9.654 1.00 0.00 H new ATOM 0 HB VAL A 50 31.726 -14.532 -11.689 1.00 0.00 H new ATOM 0 HG11 VAL A 50 29.899 -12.843 -11.568 1.00 0.00 H new ATOM 0 HG12 VAL A 50 29.321 -14.384 -12.246 1.00 0.00 H new ATOM 0 HG13 VAL A 50 28.948 -13.958 -10.559 1.00 0.00 H new ATOM 0 HG21 VAL A 50 31.681 -12.797 -9.898 1.00 0.00 H new ATOM 0 HG22 VAL A 50 30.770 -13.914 -8.854 1.00 0.00 H new ATOM 0 HG23 VAL A 50 32.440 -14.303 -9.329 1.00 0.00 H new ATOM 805 N GLN A 51 30.619 -17.212 -12.733 1.00 0.00 N ATOM 806 CA GLN A 51 29.952 -17.908 -13.820 1.00 0.00 C ATOM 807 C GLN A 51 29.537 -19.308 -13.383 1.00 0.00 C ATOM 808 O GLN A 51 28.651 -19.906 -13.991 1.00 0.00 O ATOM 809 CB GLN A 51 30.871 -17.964 -15.038 1.00 0.00 C ATOM 810 CG GLN A 51 30.908 -16.589 -15.703 1.00 0.00 C ATOM 811 CD GLN A 51 31.953 -16.506 -16.811 1.00 0.00 C ATOM 812 OE1 GLN A 51 32.450 -17.517 -17.297 1.00 0.00 O ATOM 813 NE2 GLN A 51 32.296 -15.287 -17.222 1.00 0.00 N ATOM 0 H GLN A 51 31.631 -17.136 -12.837 1.00 0.00 H new ATOM 0 HA GLN A 51 29.048 -17.362 -14.092 1.00 0.00 H new ATOM 0 HB2 GLN A 51 31.875 -18.263 -14.737 1.00 0.00 H new ATOM 0 HB3 GLN A 51 30.513 -18.713 -15.744 1.00 0.00 H new ATOM 0 HG2 GLN A 51 29.925 -16.362 -16.117 1.00 0.00 H new ATOM 0 HG3 GLN A 51 31.120 -15.830 -14.950 1.00 0.00 H new ATOM 0 HE21 GLN A 51 31.865 -14.466 -16.798 1.00 0.00 H new ATOM 0 HE22 GLN A 51 32.990 -15.174 -17.961 1.00 0.00 H new ATOM 822 N GLU A 52 30.153 -19.848 -12.333 1.00 0.00 N ATOM 823 CA GLU A 52 29.726 -21.130 -11.799 1.00 0.00 C ATOM 824 C GLU A 52 28.575 -20.931 -10.815 1.00 0.00 C ATOM 825 O GLU A 52 27.826 -21.864 -10.539 1.00 0.00 O ATOM 826 CB GLU A 52 30.928 -21.831 -11.163 1.00 0.00 C ATOM 827 CG GLU A 52 30.588 -23.273 -10.782 1.00 0.00 C ATOM 828 CD GLU A 52 31.842 -24.039 -10.370 1.00 0.00 C ATOM 829 OE1 GLU A 52 32.342 -23.784 -9.253 1.00 0.00 O ATOM 830 OE2 GLU A 52 32.298 -24.879 -11.178 1.00 0.00 O ATOM 0 H GLU A 52 30.939 -19.421 -11.844 1.00 0.00 H new ATOM 0 HA GLU A 52 29.350 -21.769 -12.598 1.00 0.00 H new ATOM 0 HB2 GLU A 52 31.767 -21.824 -11.859 1.00 0.00 H new ATOM 0 HB3 GLU A 52 31.245 -21.283 -10.276 1.00 0.00 H new ATOM 0 HG2 GLU A 52 29.869 -23.277 -9.962 1.00 0.00 H new ATOM 0 HG3 GLU A 52 30.112 -23.773 -11.625 1.00 0.00 H new ATOM 837 N ALA A 53 28.424 -19.713 -10.280 1.00 0.00 N ATOM 838 CA ALA A 53 27.360 -19.409 -9.337 1.00 0.00 C ATOM 839 C ALA A 53 26.052 -19.080 -10.056 1.00 0.00 C ATOM 840 O ALA A 53 24.979 -19.424 -9.559 1.00 0.00 O ATOM 841 CB ALA A 53 27.804 -18.253 -8.440 1.00 0.00 C ATOM 0 H ALA A 53 29.034 -18.923 -10.491 1.00 0.00 H new ATOM 0 HA ALA A 53 27.168 -20.289 -8.723 1.00 0.00 H new ATOM 0 HB1 ALA A 53 27.011 -18.019 -7.730 1.00 0.00 H new ATOM 0 HB2 ALA A 53 28.705 -18.539 -7.897 1.00 0.00 H new ATOM 0 HB3 ALA A 53 28.013 -17.376 -9.053 1.00 0.00 H new ATOM 847 N PHE A 54 26.114 -18.421 -11.219 1.00 0.00 N ATOM 848 CA PHE A 54 24.909 -18.110 -11.978 1.00 0.00 C ATOM 849 C PHE A 54 24.438 -19.318 -12.784 1.00 0.00 C ATOM 850 O PHE A 54 23.242 -19.489 -12.990 1.00 0.00 O ATOM 851 CB PHE A 54 25.170 -16.937 -12.923 1.00 0.00 C ATOM 852 CG PHE A 54 25.160 -15.576 -12.265 1.00 0.00 C ATOM 853 CD1 PHE A 54 24.018 -15.125 -11.588 1.00 0.00 C ATOM 854 CD2 PHE A 54 26.293 -14.754 -12.349 1.00 0.00 C ATOM 855 CE1 PHE A 54 24.007 -13.854 -11.000 1.00 0.00 C ATOM 856 CE2 PHE A 54 26.279 -13.481 -11.763 1.00 0.00 C ATOM 857 CZ PHE A 54 25.136 -13.032 -11.088 1.00 0.00 C ATOM 0 H PHE A 54 26.981 -18.097 -11.648 1.00 0.00 H new ATOM 0 HA PHE A 54 24.127 -17.841 -11.268 1.00 0.00 H new ATOM 0 HB2 PHE A 54 26.137 -17.085 -13.404 1.00 0.00 H new ATOM 0 HB3 PHE A 54 24.417 -16.949 -13.711 1.00 0.00 H new ATOM 0 HD1 PHE A 54 23.146 -15.758 -11.520 1.00 0.00 H new ATOM 0 HD2 PHE A 54 27.176 -15.102 -12.865 1.00 0.00 H new ATOM 0 HE1 PHE A 54 23.127 -13.508 -10.478 1.00 0.00 H new ATOM 0 HE2 PHE A 54 27.150 -12.846 -11.832 1.00 0.00 H new ATOM 0 HZ PHE A 54 25.126 -12.051 -10.636 1.00 0.00 H new ATOM 867 N ILE A 55 25.358 -20.166 -13.250 1.00 0.00 N ATOM 868 CA ILE A 55 24.977 -21.321 -14.047 1.00 0.00 C ATOM 869 C ILE A 55 24.405 -22.405 -13.133 1.00 0.00 C ATOM 870 O ILE A 55 23.538 -23.171 -13.548 1.00 0.00 O ATOM 871 CB ILE A 55 26.195 -21.793 -14.852 1.00 0.00 C ATOM 872 CG1 ILE A 55 26.422 -20.941 -16.115 1.00 0.00 C ATOM 873 CG2 ILE A 55 26.025 -23.247 -15.297 1.00 0.00 C ATOM 874 CD1 ILE A 55 26.206 -19.439 -15.924 1.00 0.00 C ATOM 0 H ILE A 55 26.361 -20.071 -13.088 1.00 0.00 H new ATOM 0 HA ILE A 55 24.194 -21.066 -14.761 1.00 0.00 H new ATOM 0 HB ILE A 55 27.053 -21.692 -14.188 1.00 0.00 H new ATOM 0 HG12 ILE A 55 27.440 -21.105 -16.469 1.00 0.00 H new ATOM 0 HG13 ILE A 55 25.752 -21.293 -16.899 1.00 0.00 H new ATOM 0 HG21 ILE A 55 26.901 -23.558 -15.866 1.00 0.00 H new ATOM 0 HG22 ILE A 55 25.916 -23.885 -14.420 1.00 0.00 H new ATOM 0 HG23 ILE A 55 25.137 -23.335 -15.922 1.00 0.00 H new ATOM 0 HD11 ILE A 55 26.389 -18.922 -16.866 1.00 0.00 H new ATOM 0 HD12 ILE A 55 25.180 -19.257 -15.603 1.00 0.00 H new ATOM 0 HD13 ILE A 55 26.895 -19.066 -15.166 1.00 0.00 H new ATOM 886 N LYS A 56 24.880 -22.475 -11.885 1.00 0.00 N ATOM 887 CA LYS A 56 24.331 -23.399 -10.906 1.00 0.00 C ATOM 888 C LYS A 56 22.954 -22.915 -10.465 1.00 0.00 C ATOM 889 O LYS A 56 22.075 -23.721 -10.165 1.00 0.00 O ATOM 890 CB LYS A 56 25.290 -23.488 -9.719 1.00 0.00 C ATOM 891 CG LYS A 56 24.867 -24.531 -8.684 1.00 0.00 C ATOM 892 CD LYS A 56 24.843 -25.937 -9.291 1.00 0.00 C ATOM 893 CE LYS A 56 24.638 -26.999 -8.210 1.00 0.00 C ATOM 894 NZ LYS A 56 25.753 -27.002 -7.247 1.00 0.00 N ATOM 0 H LYS A 56 25.645 -21.898 -11.535 1.00 0.00 H new ATOM 0 HA LYS A 56 24.218 -24.392 -11.341 1.00 0.00 H new ATOM 0 HB2 LYS A 56 26.288 -23.730 -10.083 1.00 0.00 H new ATOM 0 HB3 LYS A 56 25.355 -22.512 -9.238 1.00 0.00 H new ATOM 0 HG2 LYS A 56 25.555 -24.509 -7.839 1.00 0.00 H new ATOM 0 HG3 LYS A 56 23.879 -24.283 -8.297 1.00 0.00 H new ATOM 0 HD2 LYS A 56 24.043 -26.005 -10.028 1.00 0.00 H new ATOM 0 HD3 LYS A 56 25.779 -26.125 -9.818 1.00 0.00 H new ATOM 0 HE2 LYS A 56 23.701 -26.811 -7.685 1.00 0.00 H new ATOM 0 HE3 LYS A 56 24.552 -27.982 -8.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 25.775 -27.912 -6.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 26.650 -26.865 -7.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 25.622 -26.231 -6.561 1.00 0.00 H new ATOM 908 N ALA A 57 22.768 -21.593 -10.430 1.00 0.00 N ATOM 909 CA ALA A 57 21.492 -21.007 -10.075 1.00 0.00 C ATOM 910 C ALA A 57 20.500 -21.146 -11.228 1.00 0.00 C ATOM 911 O ALA A 57 19.308 -21.304 -10.987 1.00 0.00 O ATOM 912 CB ALA A 57 21.703 -19.540 -9.715 1.00 0.00 C ATOM 0 H ALA A 57 23.496 -20.912 -10.646 1.00 0.00 H new ATOM 0 HA ALA A 57 21.076 -21.532 -9.215 1.00 0.00 H new ATOM 0 HB1 ALA A 57 20.747 -19.090 -9.446 1.00 0.00 H new ATOM 0 HB2 ALA A 57 22.388 -19.468 -8.871 1.00 0.00 H new ATOM 0 HB3 ALA A 57 22.124 -19.012 -10.571 1.00 0.00 H new ATOM 918 N TYR A 58 20.971 -21.094 -12.478 1.00 0.00 N ATOM 919 CA TYR A 58 20.083 -21.161 -13.631 1.00 0.00 C ATOM 920 C TYR A 58 19.331 -22.488 -13.673 1.00 0.00 C ATOM 921 O TYR A 58 18.145 -22.519 -14.011 1.00 0.00 O ATOM 922 CB TYR A 58 20.912 -21.006 -14.904 1.00 0.00 C ATOM 923 CG TYR A 58 20.096 -21.158 -16.170 1.00 0.00 C ATOM 924 CD1 TYR A 58 19.137 -20.195 -16.508 1.00 0.00 C ATOM 925 CD2 TYR A 58 20.299 -22.273 -16.998 1.00 0.00 C ATOM 926 CE1 TYR A 58 18.375 -20.337 -17.678 1.00 0.00 C ATOM 927 CE2 TYR A 58 19.543 -22.424 -18.170 1.00 0.00 C ATOM 928 CZ TYR A 58 18.578 -21.455 -18.515 1.00 0.00 C ATOM 929 OH TYR A 58 17.839 -21.597 -19.651 1.00 0.00 O ATOM 0 H TYR A 58 21.960 -21.006 -12.711 1.00 0.00 H new ATOM 0 HA TYR A 58 19.350 -20.358 -13.553 1.00 0.00 H new ATOM 0 HB2 TYR A 58 21.389 -20.026 -14.902 1.00 0.00 H new ATOM 0 HB3 TYR A 58 21.710 -21.748 -14.903 1.00 0.00 H new ATOM 0 HD1 TYR A 58 18.983 -19.340 -15.866 1.00 0.00 H new ATOM 0 HD2 TYR A 58 21.038 -23.015 -16.733 1.00 0.00 H new ATOM 0 HE1 TYR A 58 17.636 -19.593 -17.937 1.00 0.00 H new ATOM 0 HE2 TYR A 58 19.700 -23.282 -18.808 1.00 0.00 H new ATOM 0 HH TYR A 58 18.104 -22.420 -20.113 1.00 0.00 H new ATOM 939 N ARG A 59 20.013 -23.586 -13.333 1.00 0.00 N ATOM 940 CA ARG A 59 19.408 -24.913 -13.356 1.00 0.00 C ATOM 941 C ARG A 59 18.809 -25.319 -12.011 1.00 0.00 C ATOM 942 O ARG A 59 18.167 -26.365 -11.923 1.00 0.00 O ATOM 943 CB ARG A 59 20.413 -25.935 -13.885 1.00 0.00 C ATOM 944 CG ARG A 59 21.643 -26.085 -12.988 1.00 0.00 C ATOM 945 CD ARG A 59 22.662 -26.958 -13.714 1.00 0.00 C ATOM 946 NE ARG A 59 23.841 -27.231 -12.884 1.00 0.00 N ATOM 947 CZ ARG A 59 25.018 -27.620 -13.373 1.00 0.00 C ATOM 948 NH1 ARG A 59 25.191 -27.785 -14.683 1.00 0.00 N ATOM 949 NH2 ARG A 59 26.044 -27.847 -12.558 1.00 0.00 N ATOM 0 H ARG A 59 20.989 -23.577 -13.038 1.00 0.00 H new ATOM 0 HA ARG A 59 18.561 -24.882 -14.041 1.00 0.00 H new ATOM 0 HB2 ARG A 59 19.921 -26.903 -13.982 1.00 0.00 H new ATOM 0 HB3 ARG A 59 20.733 -25.638 -14.884 1.00 0.00 H new ATOM 0 HG2 ARG A 59 22.071 -25.108 -12.764 1.00 0.00 H new ATOM 0 HG3 ARG A 59 21.366 -26.537 -12.036 1.00 0.00 H new ATOM 0 HD2 ARG A 59 22.194 -27.900 -14.000 1.00 0.00 H new ATOM 0 HD3 ARG A 59 22.973 -26.464 -14.634 1.00 0.00 H new ATOM 0 HE ARG A 59 23.755 -27.116 -11.874 1.00 0.00 H new ATOM 0 HH11 ARG A 59 24.417 -27.613 -15.325 1.00 0.00 H new ATOM 0 HH12 ARG A 59 26.097 -28.083 -15.044 1.00 0.00 H new ATOM 0 HH21 ARG A 59 25.933 -27.724 -11.552 1.00 0.00 H new ATOM 0 HH22 ARG A 59 26.942 -28.145 -12.939 1.00 0.00 H new ATOM 963 N ALA A 60 19.008 -24.506 -10.967 1.00 0.00 N ATOM 964 CA ALA A 60 18.405 -24.758 -9.665 1.00 0.00 C ATOM 965 C ALA A 60 17.271 -23.773 -9.353 1.00 0.00 C ATOM 966 O ALA A 60 16.561 -23.944 -8.362 1.00 0.00 O ATOM 967 CB ALA A 60 19.495 -24.707 -8.593 1.00 0.00 C ATOM 0 H ALA A 60 19.585 -23.666 -11.005 1.00 0.00 H new ATOM 0 HA ALA A 60 17.952 -25.749 -9.677 1.00 0.00 H new ATOM 0 HB1 ALA A 60 19.052 -24.895 -7.615 1.00 0.00 H new ATOM 0 HB2 ALA A 60 20.247 -25.467 -8.803 1.00 0.00 H new ATOM 0 HB3 ALA A 60 19.963 -23.723 -8.597 1.00 0.00 H new ATOM 973 N LEU A 61 17.092 -22.742 -10.189 1.00 0.00 N ATOM 974 CA LEU A 61 16.075 -21.718 -9.987 1.00 0.00 C ATOM 975 C LEU A 61 14.683 -22.264 -10.291 1.00 0.00 C ATOM 976 O LEU A 61 13.683 -21.680 -9.876 1.00 0.00 O ATOM 977 CB LEU A 61 16.474 -20.503 -10.836 1.00 0.00 C ATOM 978 CG LEU A 61 15.476 -19.343 -10.837 1.00 0.00 C ATOM 979 CD1 LEU A 61 16.258 -18.056 -11.093 1.00 0.00 C ATOM 980 CD2 LEU A 61 14.449 -19.482 -11.960 1.00 0.00 C ATOM 0 H LEU A 61 17.655 -22.600 -11.027 1.00 0.00 H new ATOM 0 HA LEU A 61 16.022 -21.403 -8.945 1.00 0.00 H new ATOM 0 HB2 LEU A 61 17.435 -20.132 -10.479 1.00 0.00 H new ATOM 0 HB3 LEU A 61 16.622 -20.833 -11.864 1.00 0.00 H new ATOM 0 HG LEU A 61 14.954 -19.336 -9.880 1.00 0.00 H new ATOM 0 HD11 LEU A 61 15.572 -17.209 -11.100 1.00 0.00 H new ATOM 0 HD12 LEU A 61 16.998 -17.917 -10.305 1.00 0.00 H new ATOM 0 HD13 LEU A 61 16.762 -18.122 -12.057 1.00 0.00 H new ATOM 0 HD21 LEU A 61 13.758 -18.640 -11.928 1.00 0.00 H new ATOM 0 HD22 LEU A 61 14.961 -19.494 -12.922 1.00 0.00 H new ATOM 0 HD23 LEU A 61 13.894 -20.411 -11.833 1.00 0.00 H new ATOM 992 N ASP A 62 14.600 -23.385 -11.012 1.00 0.00 N ATOM 993 CA ASP A 62 13.331 -24.040 -11.288 1.00 0.00 C ATOM 994 C ASP A 62 12.760 -24.673 -10.014 1.00 0.00 C ATOM 995 O ASP A 62 11.621 -25.136 -10.005 1.00 0.00 O ATOM 996 CB ASP A 62 13.554 -25.090 -12.378 1.00 0.00 C ATOM 997 CG ASP A 62 12.245 -25.740 -12.827 1.00 0.00 C ATOM 998 OD1 ASP A 62 11.365 -24.991 -13.312 1.00 0.00 O ATOM 999 OD2 ASP A 62 12.133 -26.977 -12.683 1.00 0.00 O ATOM 0 H ASP A 62 15.409 -23.857 -11.416 1.00 0.00 H new ATOM 0 HA ASP A 62 12.602 -23.308 -11.636 1.00 0.00 H new ATOM 0 HB2 ASP A 62 14.040 -24.624 -13.235 1.00 0.00 H new ATOM 0 HB3 ASP A 62 14.231 -25.859 -12.007 1.00 0.00 H new ATOM 1004 N SER A 63 13.552 -24.690 -8.937 1.00 0.00 N ATOM 1005 CA SER A 63 13.149 -25.230 -7.646 1.00 0.00 C ATOM 1006 C SER A 63 13.078 -24.137 -6.580 1.00 0.00 C ATOM 1007 O SER A 63 12.810 -24.432 -5.416 1.00 0.00 O ATOM 1008 CB SER A 63 14.114 -26.335 -7.226 1.00 0.00 C ATOM 1009 OG SER A 63 14.115 -27.370 -8.186 1.00 0.00 O ATOM 0 H SER A 63 14.503 -24.322 -8.944 1.00 0.00 H new ATOM 0 HA SER A 63 12.148 -25.650 -7.746 1.00 0.00 H new ATOM 0 HB2 SER A 63 15.119 -25.928 -7.117 1.00 0.00 H new ATOM 0 HB3 SER A 63 13.824 -26.731 -6.253 1.00 0.00 H new ATOM 0 HG SER A 63 14.738 -28.073 -7.908 1.00 0.00 H new ATOM 1015 N PHE A 64 13.313 -22.876 -6.958 1.00 0.00 N ATOM 1016 CA PHE A 64 13.249 -21.763 -6.026 1.00 0.00 C ATOM 1017 C PHE A 64 11.794 -21.551 -5.609 1.00 0.00 C ATOM 1018 O PHE A 64 10.937 -21.292 -6.456 1.00 0.00 O ATOM 1019 CB PHE A 64 13.833 -20.517 -6.692 1.00 0.00 C ATOM 1020 CG PHE A 64 13.783 -19.281 -5.822 1.00 0.00 C ATOM 1021 CD1 PHE A 64 14.569 -19.208 -4.667 1.00 0.00 C ATOM 1022 CD2 PHE A 64 12.955 -18.208 -6.174 1.00 0.00 C ATOM 1023 CE1 PHE A 64 14.523 -18.058 -3.864 1.00 0.00 C ATOM 1024 CE2 PHE A 64 12.910 -17.058 -5.376 1.00 0.00 C ATOM 1025 CZ PHE A 64 13.698 -16.985 -4.220 1.00 0.00 C ATOM 0 H PHE A 64 13.551 -22.607 -7.913 1.00 0.00 H new ATOM 0 HA PHE A 64 13.835 -21.972 -5.131 1.00 0.00 H new ATOM 0 HB2 PHE A 64 14.869 -20.715 -6.967 1.00 0.00 H new ATOM 0 HB3 PHE A 64 13.290 -20.322 -7.616 1.00 0.00 H new ATOM 0 HD1 PHE A 64 15.209 -20.034 -4.394 1.00 0.00 H new ATOM 0 HD2 PHE A 64 12.348 -18.268 -7.065 1.00 0.00 H new ATOM 0 HE1 PHE A 64 15.125 -18.001 -2.969 1.00 0.00 H new ATOM 0 HE2 PHE A 64 12.271 -16.232 -5.650 1.00 0.00 H new ATOM 0 HZ PHE A 64 13.669 -16.099 -3.603 1.00 0.00 H new ATOM 1035 N ARG A 65 11.512 -21.666 -4.308 1.00 0.00 N ATOM 1036 CA ARG A 65 10.143 -21.607 -3.804 1.00 0.00 C ATOM 1037 C ARG A 65 9.776 -20.240 -3.224 1.00 0.00 C ATOM 1038 O ARG A 65 8.615 -20.016 -2.881 1.00 0.00 O ATOM 1039 CB ARG A 65 9.902 -22.772 -2.847 1.00 0.00 C ATOM 1040 CG ARG A 65 10.556 -22.573 -1.479 1.00 0.00 C ATOM 1041 CD ARG A 65 10.814 -23.927 -0.808 1.00 0.00 C ATOM 1042 NE ARG A 65 9.600 -24.750 -0.750 1.00 0.00 N ATOM 1043 CZ ARG A 65 8.664 -24.668 0.199 1.00 0.00 C ATOM 1044 NH1 ARG A 65 8.776 -23.802 1.203 1.00 0.00 N ATOM 1045 NH2 ARG A 65 7.597 -25.462 0.143 1.00 0.00 N ATOM 0 H ARG A 65 12.219 -21.801 -3.585 1.00 0.00 H new ATOM 0 HA ARG A 65 9.457 -21.722 -4.643 1.00 0.00 H new ATOM 0 HB2 ARG A 65 8.829 -22.908 -2.713 1.00 0.00 H new ATOM 0 HB3 ARG A 65 10.286 -23.688 -3.296 1.00 0.00 H new ATOM 0 HG2 ARG A 65 11.495 -22.032 -1.593 1.00 0.00 H new ATOM 0 HG3 ARG A 65 9.911 -21.963 -0.846 1.00 0.00 H new ATOM 0 HD2 ARG A 65 11.589 -24.462 -1.357 1.00 0.00 H new ATOM 0 HD3 ARG A 65 11.192 -23.766 0.202 1.00 0.00 H new ATOM 0 HE ARG A 65 9.461 -25.437 -1.491 1.00 0.00 H new ATOM 0 HH11 ARG A 65 9.587 -23.186 1.257 1.00 0.00 H new ATOM 0 HH12 ARG A 65 8.051 -23.754 1.918 1.00 0.00 H new ATOM 0 HH21 ARG A 65 7.497 -26.129 -0.622 1.00 0.00 H new ATOM 0 HH22 ARG A 65 6.879 -25.403 0.865 1.00 0.00 H new ATOM 1059 N GLY A 66 10.744 -19.323 -3.114 1.00 0.00 N ATOM 1060 CA GLY A 66 10.458 -17.941 -2.752 1.00 0.00 C ATOM 1061 C GLY A 66 10.265 -17.740 -1.252 1.00 0.00 C ATOM 1062 O GLY A 66 9.535 -16.834 -0.845 1.00 0.00 O ATOM 0 H GLY A 66 11.732 -19.519 -3.272 1.00 0.00 H new ATOM 0 HA2 GLY A 66 11.275 -17.306 -3.095 1.00 0.00 H new ATOM 0 HA3 GLY A 66 9.559 -17.614 -3.274 1.00 0.00 H new ATOM 1066 N ASP A 67 10.907 -18.567 -0.424 1.00 0.00 N ATOM 1067 CA ASP A 67 10.838 -18.432 1.026 1.00 0.00 C ATOM 1068 C ASP A 67 11.605 -17.193 1.503 1.00 0.00 C ATOM 1069 O ASP A 67 11.552 -16.845 2.681 1.00 0.00 O ATOM 1070 CB ASP A 67 11.388 -19.701 1.680 1.00 0.00 C ATOM 1071 CG ASP A 67 10.375 -20.843 1.687 1.00 0.00 C ATOM 1072 OD1 ASP A 67 9.158 -20.558 1.639 1.00 0.00 O ATOM 1073 OD2 ASP A 67 10.829 -22.007 1.742 1.00 0.00 O ATOM 0 H ASP A 67 11.486 -19.345 -0.741 1.00 0.00 H new ATOM 0 HA ASP A 67 9.797 -18.301 1.320 1.00 0.00 H new ATOM 0 HB2 ASP A 67 12.285 -20.019 1.149 1.00 0.00 H new ATOM 0 HB3 ASP A 67 11.686 -19.478 2.705 1.00 0.00 H new ATOM 1078 N SER A 68 12.320 -16.525 0.590 1.00 0.00 N ATOM 1079 CA SER A 68 13.047 -15.297 0.875 1.00 0.00 C ATOM 1080 C SER A 68 13.260 -14.526 -0.427 1.00 0.00 C ATOM 1081 O SER A 68 12.933 -15.022 -1.505 1.00 0.00 O ATOM 1082 CB SER A 68 14.388 -15.651 1.517 1.00 0.00 C ATOM 1083 OG SER A 68 15.127 -14.481 1.793 1.00 0.00 O ATOM 0 H SER A 68 12.407 -16.832 -0.379 1.00 0.00 H new ATOM 0 HA SER A 68 12.480 -14.671 1.564 1.00 0.00 H new ATOM 0 HB2 SER A 68 14.221 -16.209 2.438 1.00 0.00 H new ATOM 0 HB3 SER A 68 14.957 -16.299 0.851 1.00 0.00 H new ATOM 0 HG SER A 68 15.303 -14.425 2.755 1.00 0.00 H new ATOM 1089 N ALA A 69 13.809 -13.313 -0.334 1.00 0.00 N ATOM 1090 CA ALA A 69 14.160 -12.522 -1.501 1.00 0.00 C ATOM 1091 C ALA A 69 15.154 -13.298 -2.362 1.00 0.00 C ATOM 1092 O ALA A 69 15.883 -14.158 -1.860 1.00 0.00 O ATOM 1093 CB ALA A 69 14.753 -11.185 -1.057 1.00 0.00 C ATOM 0 H ALA A 69 14.020 -12.858 0.554 1.00 0.00 H new ATOM 0 HA ALA A 69 13.267 -12.323 -2.094 1.00 0.00 H new ATOM 0 HB1 ALA A 69 15.015 -10.594 -1.934 1.00 0.00 H new ATOM 0 HB2 ALA A 69 14.020 -10.642 -0.460 1.00 0.00 H new ATOM 0 HB3 ALA A 69 15.647 -11.364 -0.460 1.00 0.00 H new ATOM 1099 N PHE A 70 15.195 -13.006 -3.665 1.00 0.00 N ATOM 1100 CA PHE A 70 16.006 -13.794 -4.575 1.00 0.00 C ATOM 1101 C PHE A 70 17.495 -13.706 -4.252 1.00 0.00 C ATOM 1102 O PHE A 70 18.216 -14.684 -4.437 1.00 0.00 O ATOM 1103 CB PHE A 70 15.757 -13.333 -6.010 1.00 0.00 C ATOM 1104 CG PHE A 70 16.573 -14.124 -7.007 1.00 0.00 C ATOM 1105 CD1 PHE A 70 16.337 -15.498 -7.171 1.00 0.00 C ATOM 1106 CD2 PHE A 70 17.576 -13.490 -7.752 1.00 0.00 C ATOM 1107 CE1 PHE A 70 17.114 -16.238 -8.072 1.00 0.00 C ATOM 1108 CE2 PHE A 70 18.353 -14.231 -8.652 1.00 0.00 C ATOM 1109 CZ PHE A 70 18.128 -15.605 -8.809 1.00 0.00 C ATOM 0 H PHE A 70 14.682 -12.240 -4.101 1.00 0.00 H new ATOM 0 HA PHE A 70 15.712 -14.837 -4.459 1.00 0.00 H new ATOM 0 HB2 PHE A 70 14.698 -13.436 -6.245 1.00 0.00 H new ATOM 0 HB3 PHE A 70 16.002 -12.275 -6.099 1.00 0.00 H new ATOM 0 HD1 PHE A 70 15.557 -15.984 -6.603 1.00 0.00 H new ATOM 0 HD2 PHE A 70 17.750 -12.431 -7.633 1.00 0.00 H new ATOM 0 HE1 PHE A 70 16.933 -17.295 -8.200 1.00 0.00 H new ATOM 0 HE2 PHE A 70 19.127 -13.742 -9.226 1.00 0.00 H new ATOM 0 HZ PHE A 70 18.734 -16.177 -9.496 1.00 0.00 H new ATOM 1119 N TYR A 71 17.977 -12.556 -3.769 1.00 0.00 N ATOM 1120 CA TYR A 71 19.401 -12.415 -3.506 1.00 0.00 C ATOM 1121 C TYR A 71 19.813 -13.196 -2.263 1.00 0.00 C ATOM 1122 O TYR A 71 20.984 -13.537 -2.115 1.00 0.00 O ATOM 1123 CB TYR A 71 19.785 -10.945 -3.359 1.00 0.00 C ATOM 1124 CG TYR A 71 21.285 -10.765 -3.233 1.00 0.00 C ATOM 1125 CD1 TYR A 71 22.093 -10.846 -4.377 1.00 0.00 C ATOM 1126 CD2 TYR A 71 21.871 -10.534 -1.978 1.00 0.00 C ATOM 1127 CE1 TYR A 71 23.484 -10.700 -4.273 1.00 0.00 C ATOM 1128 CE2 TYR A 71 23.258 -10.375 -1.869 1.00 0.00 C ATOM 1129 CZ TYR A 71 24.072 -10.473 -3.013 1.00 0.00 C ATOM 1130 OH TYR A 71 25.421 -10.349 -2.895 1.00 0.00 O ATOM 0 H TYR A 71 17.414 -11.732 -3.559 1.00 0.00 H new ATOM 0 HA TYR A 71 19.936 -12.829 -4.361 1.00 0.00 H new ATOM 0 HB2 TYR A 71 19.423 -10.387 -4.222 1.00 0.00 H new ATOM 0 HB3 TYR A 71 19.294 -10.527 -2.480 1.00 0.00 H new ATOM 0 HD1 TYR A 71 21.642 -11.022 -5.342 1.00 0.00 H new ATOM 0 HD2 TYR A 71 21.251 -10.479 -1.095 1.00 0.00 H new ATOM 0 HE1 TYR A 71 24.103 -10.761 -5.156 1.00 0.00 H new ATOM 0 HE2 TYR A 71 23.704 -10.177 -0.905 1.00 0.00 H new ATOM 0 HH TYR A 71 25.654 -10.195 -1.956 1.00 0.00 H new ATOM 1140 N THR A 72 18.876 -13.494 -1.360 1.00 0.00 N ATOM 1141 CA THR A 72 19.207 -14.252 -0.165 1.00 0.00 C ATOM 1142 C THR A 72 19.586 -15.675 -0.559 1.00 0.00 C ATOM 1143 O THR A 72 20.461 -16.285 0.052 1.00 0.00 O ATOM 1144 CB THR A 72 18.011 -14.264 0.789 1.00 0.00 C ATOM 1145 OG1 THR A 72 17.526 -12.952 0.973 1.00 0.00 O ATOM 1146 CG2 THR A 72 18.410 -14.828 2.152 1.00 0.00 C ATOM 0 H THR A 72 17.896 -13.223 -1.437 1.00 0.00 H new ATOM 0 HA THR A 72 20.052 -13.786 0.342 1.00 0.00 H new ATOM 0 HB THR A 72 17.238 -14.893 0.348 1.00 0.00 H new ATOM 0 HG1 THR A 72 16.606 -12.987 1.309 1.00 0.00 H new ATOM 0 HG21 THR A 72 17.544 -14.827 2.814 1.00 0.00 H new ATOM 0 HG22 THR A 72 18.773 -15.849 2.031 1.00 0.00 H new ATOM 0 HG23 THR A 72 19.198 -14.211 2.584 1.00 0.00 H new ATOM 1154 N TRP A 73 18.921 -16.201 -1.592 1.00 0.00 N ATOM 1155 CA TRP A 73 19.189 -17.526 -2.126 1.00 0.00 C ATOM 1156 C TRP A 73 20.372 -17.500 -3.093 1.00 0.00 C ATOM 1157 O TRP A 73 21.061 -18.504 -3.253 1.00 0.00 O ATOM 1158 CB TRP A 73 17.911 -18.011 -2.805 1.00 0.00 C ATOM 1159 CG TRP A 73 17.986 -19.356 -3.449 1.00 0.00 C ATOM 1160 CD1 TRP A 73 17.906 -20.540 -2.806 1.00 0.00 C ATOM 1161 CD2 TRP A 73 18.153 -19.685 -4.863 1.00 0.00 C ATOM 1162 NE1 TRP A 73 17.978 -21.572 -3.720 1.00 0.00 N ATOM 1163 CE2 TRP A 73 18.133 -21.100 -5.005 1.00 0.00 C ATOM 1164 CE3 TRP A 73 18.319 -18.927 -6.038 1.00 0.00 C ATOM 1165 CZ2 TRP A 73 18.264 -21.731 -6.248 1.00 0.00 C ATOM 1166 CZ3 TRP A 73 18.461 -19.549 -7.288 1.00 0.00 C ATOM 1167 CH2 TRP A 73 18.434 -20.946 -7.396 1.00 0.00 C ATOM 0 H TRP A 73 18.174 -15.708 -2.082 1.00 0.00 H new ATOM 0 HA TRP A 73 19.467 -18.213 -1.327 1.00 0.00 H new ATOM 0 HB2 TRP A 73 17.112 -18.028 -2.063 1.00 0.00 H new ATOM 0 HB3 TRP A 73 17.626 -17.282 -3.563 1.00 0.00 H new ATOM 0 HD1 TRP A 73 17.801 -20.662 -1.738 1.00 0.00 H new ATOM 0 HE1 TRP A 73 17.923 -22.561 -3.475 1.00 0.00 H new ATOM 0 HE3 TRP A 73 18.337 -17.849 -5.976 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 18.234 -22.808 -6.321 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 18.592 -18.946 -8.174 1.00 0.00 H new ATOM 0 HH2 TRP A 73 18.544 -21.416 -8.362 1.00 0.00 H new ATOM 1178 N LEU A 74 20.617 -16.354 -3.739 1.00 0.00 N ATOM 1179 CA LEU A 74 21.723 -16.210 -4.673 1.00 0.00 C ATOM 1180 C LEU A 74 23.032 -16.101 -3.889 1.00 0.00 C ATOM 1181 O LEU A 74 24.043 -16.691 -4.260 1.00 0.00 O ATOM 1182 CB LEU A 74 21.471 -14.961 -5.528 1.00 0.00 C ATOM 1183 CG LEU A 74 22.065 -15.031 -6.936 1.00 0.00 C ATOM 1184 CD1 LEU A 74 21.803 -13.690 -7.616 1.00 0.00 C ATOM 1185 CD2 LEU A 74 23.568 -15.302 -6.943 1.00 0.00 C ATOM 0 H LEU A 74 20.055 -15.510 -3.626 1.00 0.00 H new ATOM 0 HA LEU A 74 21.799 -17.076 -5.331 1.00 0.00 H new ATOM 0 HB2 LEU A 74 20.396 -14.800 -5.608 1.00 0.00 H new ATOM 0 HB3 LEU A 74 21.886 -14.094 -5.014 1.00 0.00 H new ATOM 0 HG LEU A 74 21.593 -15.862 -7.459 1.00 0.00 H new ATOM 0 HD11 LEU A 74 22.215 -13.707 -8.625 1.00 0.00 H new ATOM 0 HD12 LEU A 74 20.729 -13.511 -7.666 1.00 0.00 H new ATOM 0 HD13 LEU A 74 22.277 -12.893 -7.043 1.00 0.00 H new ATOM 0 HD21 LEU A 74 23.926 -15.339 -7.972 1.00 0.00 H new ATOM 0 HD22 LEU A 74 24.084 -14.505 -6.408 1.00 0.00 H new ATOM 0 HD23 LEU A 74 23.768 -16.256 -6.454 1.00 0.00 H new ATOM 1197 N TYR A 75 23.006 -15.341 -2.794 1.00 0.00 N ATOM 1198 CA TYR A 75 24.149 -15.177 -1.912 1.00 0.00 C ATOM 1199 C TYR A 75 24.528 -16.530 -1.320 1.00 0.00 C ATOM 1200 O TYR A 75 25.709 -16.827 -1.156 1.00 0.00 O ATOM 1201 CB TYR A 75 23.740 -14.202 -0.803 1.00 0.00 C ATOM 1202 CG TYR A 75 24.836 -13.795 0.160 1.00 0.00 C ATOM 1203 CD1 TYR A 75 25.358 -14.714 1.085 1.00 0.00 C ATOM 1204 CD2 TYR A 75 25.317 -12.482 0.135 1.00 0.00 C ATOM 1205 CE1 TYR A 75 26.359 -14.312 1.983 1.00 0.00 C ATOM 1206 CE2 TYR A 75 26.305 -12.066 1.036 1.00 0.00 C ATOM 1207 CZ TYR A 75 26.837 -12.985 1.963 1.00 0.00 C ATOM 1208 OH TYR A 75 27.805 -12.595 2.841 1.00 0.00 O ATOM 0 H TYR A 75 22.181 -14.820 -2.497 1.00 0.00 H new ATOM 0 HA TYR A 75 25.011 -14.787 -2.453 1.00 0.00 H new ATOM 0 HB2 TYR A 75 23.339 -13.301 -1.268 1.00 0.00 H new ATOM 0 HB3 TYR A 75 22.930 -14.653 -0.231 1.00 0.00 H new ATOM 0 HD1 TYR A 75 24.990 -15.729 1.105 1.00 0.00 H new ATOM 0 HD2 TYR A 75 24.922 -11.782 -0.586 1.00 0.00 H new ATOM 0 HE1 TYR A 75 26.764 -15.020 2.691 1.00 0.00 H new ATOM 0 HE2 TYR A 75 26.658 -11.045 1.021 1.00 0.00 H new ATOM 0 HH TYR A 75 28.021 -11.651 2.692 1.00 0.00 H new ATOM 1218 N ARG A 76 23.517 -17.350 -1.006 1.00 0.00 N ATOM 1219 CA ARG A 76 23.696 -18.654 -0.393 1.00 0.00 C ATOM 1220 C ARG A 76 24.411 -19.608 -1.348 1.00 0.00 C ATOM 1221 O ARG A 76 25.256 -20.393 -0.918 1.00 0.00 O ATOM 1222 CB ARG A 76 22.305 -19.187 -0.030 1.00 0.00 C ATOM 1223 CG ARG A 76 22.334 -20.566 0.624 1.00 0.00 C ATOM 1224 CD ARG A 76 23.063 -20.544 1.967 1.00 0.00 C ATOM 1225 NE ARG A 76 22.881 -21.818 2.665 1.00 0.00 N ATOM 1226 CZ ARG A 76 23.747 -22.832 2.633 1.00 0.00 C ATOM 1227 NH1 ARG A 76 24.875 -22.748 1.932 1.00 0.00 N ATOM 1228 NH2 ARG A 76 23.485 -23.946 3.311 1.00 0.00 N ATOM 0 H ARG A 76 22.540 -17.114 -1.177 1.00 0.00 H new ATOM 0 HA ARG A 76 24.316 -18.572 0.500 1.00 0.00 H new ATOM 0 HB2 ARG A 76 21.820 -18.483 0.646 1.00 0.00 H new ATOM 0 HB3 ARG A 76 21.696 -19.234 -0.932 1.00 0.00 H new ATOM 0 HG2 ARG A 76 21.314 -20.920 0.771 1.00 0.00 H new ATOM 0 HG3 ARG A 76 22.824 -21.274 -0.044 1.00 0.00 H new ATOM 0 HD2 ARG A 76 24.125 -20.357 1.809 1.00 0.00 H new ATOM 0 HD3 ARG A 76 22.683 -19.728 2.581 1.00 0.00 H new ATOM 0 HE ARG A 76 22.031 -21.939 3.215 1.00 0.00 H new ATOM 0 HH11 ARG A 76 25.088 -21.899 1.409 1.00 0.00 H new ATOM 0 HH12 ARG A 76 25.527 -23.533 1.918 1.00 0.00 H new ATOM 0 HH21 ARG A 76 22.624 -24.023 3.853 1.00 0.00 H new ATOM 0 HH22 ARG A 76 24.145 -24.724 3.289 1.00 0.00 H new ATOM 1242 N ILE A 77 24.081 -19.543 -2.642 1.00 0.00 N ATOM 1243 CA ILE A 77 24.716 -20.398 -3.634 1.00 0.00 C ATOM 1244 C ILE A 77 26.103 -19.865 -3.978 1.00 0.00 C ATOM 1245 O ILE A 77 27.023 -20.648 -4.192 1.00 0.00 O ATOM 1246 CB ILE A 77 23.827 -20.487 -4.884 1.00 0.00 C ATOM 1247 CG1 ILE A 77 22.562 -21.282 -4.542 1.00 0.00 C ATOM 1248 CG2 ILE A 77 24.582 -21.164 -6.034 1.00 0.00 C ATOM 1249 CD1 ILE A 77 21.623 -21.418 -5.741 1.00 0.00 C ATOM 0 H ILE A 77 23.379 -18.907 -3.020 1.00 0.00 H new ATOM 0 HA ILE A 77 24.836 -21.401 -3.226 1.00 0.00 H new ATOM 0 HB ILE A 77 23.553 -19.481 -5.203 1.00 0.00 H new ATOM 0 HG12 ILE A 77 22.843 -22.274 -4.188 1.00 0.00 H new ATOM 0 HG13 ILE A 77 22.035 -20.790 -3.724 1.00 0.00 H new ATOM 0 HG21 ILE A 77 23.937 -21.218 -6.911 1.00 0.00 H new ATOM 0 HG22 ILE A 77 25.473 -20.585 -6.275 1.00 0.00 H new ATOM 0 HG23 ILE A 77 24.873 -22.171 -5.735 1.00 0.00 H new ATOM 0 HD11 ILE A 77 20.741 -21.989 -5.450 1.00 0.00 H new ATOM 0 HD12 ILE A 77 21.319 -20.427 -6.079 1.00 0.00 H new ATOM 0 HD13 ILE A 77 22.139 -21.935 -6.550 1.00 0.00 H new ATOM 1261 N ALA A 78 26.267 -18.541 -4.029 1.00 0.00 N ATOM 1262 CA ALA A 78 27.527 -17.944 -4.441 1.00 0.00 C ATOM 1263 C ALA A 78 28.623 -18.146 -3.393 1.00 0.00 C ATOM 1264 O ALA A 78 29.782 -18.349 -3.753 1.00 0.00 O ATOM 1265 CB ALA A 78 27.292 -16.459 -4.711 1.00 0.00 C ATOM 0 H ALA A 78 25.540 -17.867 -3.789 1.00 0.00 H new ATOM 0 HA ALA A 78 27.876 -18.436 -5.349 1.00 0.00 H new ATOM 0 HB1 ALA A 78 28.227 -15.993 -5.022 1.00 0.00 H new ATOM 0 HB2 ALA A 78 26.550 -16.346 -5.501 1.00 0.00 H new ATOM 0 HB3 ALA A 78 26.931 -15.977 -3.803 1.00 0.00 H new ATOM 1271 N VAL A 79 28.276 -18.097 -2.102 1.00 0.00 N ATOM 1272 CA VAL A 79 29.268 -18.299 -1.051 1.00 0.00 C ATOM 1273 C VAL A 79 29.577 -19.784 -0.893 1.00 0.00 C ATOM 1274 O VAL A 79 30.675 -20.147 -0.478 1.00 0.00 O ATOM 1275 CB VAL A 79 28.783 -17.668 0.259 1.00 0.00 C ATOM 1276 CG1 VAL A 79 27.591 -18.416 0.849 1.00 0.00 C ATOM 1277 CG2 VAL A 79 29.904 -17.672 1.294 1.00 0.00 C ATOM 0 H VAL A 79 27.329 -17.922 -1.767 1.00 0.00 H new ATOM 0 HA VAL A 79 30.198 -17.803 -1.330 1.00 0.00 H new ATOM 0 HB VAL A 79 28.479 -16.649 0.022 1.00 0.00 H new ATOM 0 HG11 VAL A 79 27.281 -17.934 1.776 1.00 0.00 H new ATOM 0 HG12 VAL A 79 26.764 -18.401 0.139 1.00 0.00 H new ATOM 0 HG13 VAL A 79 27.875 -19.448 1.054 1.00 0.00 H new ATOM 0 HG21 VAL A 79 29.546 -17.221 2.220 1.00 0.00 H new ATOM 0 HG22 VAL A 79 30.217 -18.698 1.487 1.00 0.00 H new ATOM 0 HG23 VAL A 79 30.751 -17.100 0.915 1.00 0.00 H new ATOM 1287 N ASN A 80 28.616 -20.650 -1.229 1.00 0.00 N ATOM 1288 CA ASN A 80 28.823 -22.085 -1.147 1.00 0.00 C ATOM 1289 C ASN A 80 29.558 -22.595 -2.393 1.00 0.00 C ATOM 1290 O ASN A 80 30.158 -23.663 -2.364 1.00 0.00 O ATOM 1291 CB ASN A 80 27.461 -22.757 -0.952 1.00 0.00 C ATOM 1292 CG ASN A 80 27.571 -24.196 -0.461 1.00 0.00 C ATOM 1293 OD1 ASN A 80 28.659 -24.712 -0.217 1.00 0.00 O ATOM 1294 ND2 ASN A 80 26.431 -24.864 -0.307 1.00 0.00 N ATOM 0 H ASN A 80 27.691 -20.375 -1.559 1.00 0.00 H new ATOM 0 HA ASN A 80 29.457 -22.334 -0.296 1.00 0.00 H new ATOM 0 HB2 ASN A 80 26.876 -22.179 -0.237 1.00 0.00 H new ATOM 0 HB3 ASN A 80 26.916 -22.742 -1.896 1.00 0.00 H new ATOM 0 HD21 ASN A 80 26.446 -25.830 0.021 1.00 0.00 H new ATOM 0 HD22 ASN A 80 25.542 -24.411 -0.517 1.00 0.00 H new ATOM 1301 N THR A 81 29.523 -21.836 -3.493 1.00 0.00 N ATOM 1302 CA THR A 81 30.233 -22.211 -4.708 1.00 0.00 C ATOM 1303 C THR A 81 31.696 -21.793 -4.617 1.00 0.00 C ATOM 1304 O THR A 81 32.575 -22.546 -5.032 1.00 0.00 O ATOM 1305 CB THR A 81 29.557 -21.560 -5.917 1.00 0.00 C ATOM 1306 OG1 THR A 81 28.252 -22.071 -6.061 1.00 0.00 O ATOM 1307 CG2 THR A 81 30.325 -21.856 -7.204 1.00 0.00 C ATOM 0 H THR A 81 29.008 -20.958 -3.561 1.00 0.00 H new ATOM 0 HA THR A 81 30.198 -23.294 -4.826 1.00 0.00 H new ATOM 0 HB THR A 81 29.537 -20.483 -5.747 1.00 0.00 H new ATOM 0 HG1 THR A 81 27.674 -21.692 -5.366 1.00 0.00 H new ATOM 0 HG21 THR A 81 29.821 -21.381 -8.046 1.00 0.00 H new ATOM 0 HG22 THR A 81 31.339 -21.465 -7.121 1.00 0.00 H new ATOM 0 HG23 THR A 81 30.363 -22.933 -7.365 1.00 0.00 H new ATOM 1315 N ALA A 82 31.971 -20.603 -4.076 1.00 0.00 N ATOM 1316 CA ALA A 82 33.335 -20.116 -3.959 1.00 0.00 C ATOM 1317 C ALA A 82 34.107 -20.864 -2.874 1.00 0.00 C ATOM 1318 O ALA A 82 35.324 -21.018 -2.977 1.00 0.00 O ATOM 1319 CB ALA A 82 33.295 -18.616 -3.664 1.00 0.00 C ATOM 0 H ALA A 82 31.263 -19.964 -3.714 1.00 0.00 H new ATOM 0 HA ALA A 82 33.859 -20.294 -4.898 1.00 0.00 H new ATOM 0 HB1 ALA A 82 34.312 -18.236 -3.573 1.00 0.00 H new ATOM 0 HB2 ALA A 82 32.785 -18.099 -4.477 1.00 0.00 H new ATOM 0 HB3 ALA A 82 32.759 -18.443 -2.731 1.00 0.00 H new ATOM 1325 N LYS A 83 33.413 -21.336 -1.832 1.00 0.00 N ATOM 1326 CA LYS A 83 34.063 -22.054 -0.744 1.00 0.00 C ATOM 1327 C LYS A 83 34.260 -23.525 -1.102 1.00 0.00 C ATOM 1328 O LYS A 83 35.214 -24.148 -0.641 1.00 0.00 O ATOM 1329 CB LYS A 83 33.229 -21.869 0.525 1.00 0.00 C ATOM 1330 CG LYS A 83 34.013 -22.333 1.753 1.00 0.00 C ATOM 1331 CD LYS A 83 33.198 -22.135 3.033 1.00 0.00 C ATOM 1332 CE LYS A 83 32.873 -20.655 3.251 1.00 0.00 C ATOM 1333 NZ LYS A 83 32.123 -20.457 4.505 1.00 0.00 N ATOM 0 H LYS A 83 32.404 -21.231 -1.725 1.00 0.00 H new ATOM 0 HA LYS A 83 35.060 -21.650 -0.568 1.00 0.00 H new ATOM 0 HB2 LYS A 83 32.954 -20.820 0.637 1.00 0.00 H new ATOM 0 HB3 LYS A 83 32.301 -22.435 0.443 1.00 0.00 H new ATOM 0 HG2 LYS A 83 34.276 -23.385 1.644 1.00 0.00 H new ATOM 0 HG3 LYS A 83 34.948 -21.777 1.823 1.00 0.00 H new ATOM 0 HD2 LYS A 83 32.274 -22.709 2.973 1.00 0.00 H new ATOM 0 HD3 LYS A 83 33.756 -22.518 3.887 1.00 0.00 H new ATOM 0 HE2 LYS A 83 33.797 -20.077 3.281 1.00 0.00 H new ATOM 0 HE3 LYS A 83 32.289 -20.280 2.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 31.915 -19.446 4.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 31.232 -20.991 4.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 32.693 -20.794 5.307 1.00 0.00 H new ATOM 1347 N ASN A 84 33.369 -24.090 -1.924 1.00 0.00 N ATOM 1348 CA ASN A 84 33.507 -25.463 -2.377 1.00 0.00 C ATOM 1349 C ASN A 84 34.620 -25.550 -3.424 1.00 0.00 C ATOM 1350 O ASN A 84 35.186 -26.616 -3.648 1.00 0.00 O ATOM 1351 CB ASN A 84 32.155 -25.944 -2.915 1.00 0.00 C ATOM 1352 CG ASN A 84 32.104 -27.447 -3.160 1.00 0.00 C ATOM 1353 OD1 ASN A 84 33.036 -28.181 -2.836 1.00 0.00 O ATOM 1354 ND2 ASN A 84 31.004 -27.923 -3.737 1.00 0.00 N ATOM 0 H ASN A 84 32.545 -23.609 -2.286 1.00 0.00 H new ATOM 0 HA ASN A 84 33.792 -26.118 -1.553 1.00 0.00 H new ATOM 0 HB2 ASN A 84 31.372 -25.672 -2.207 1.00 0.00 H new ATOM 0 HB3 ASN A 84 31.937 -25.423 -3.847 1.00 0.00 H new ATOM 0 HD21 ASN A 84 30.917 -28.922 -3.922 1.00 0.00 H new ATOM 0 HD22 ASN A 84 30.248 -27.289 -3.994 1.00 0.00 H new ATOM 1361 N TYR A 85 34.944 -24.425 -4.067 1.00 0.00 N ATOM 1362 CA TYR A 85 36.025 -24.358 -5.041 1.00 0.00 C ATOM 1363 C TYR A 85 37.385 -24.436 -4.346 1.00 0.00 C ATOM 1364 O TYR A 85 38.336 -24.987 -4.900 1.00 0.00 O ATOM 1365 CB TYR A 85 35.881 -23.051 -5.821 1.00 0.00 C ATOM 1366 CG TYR A 85 37.025 -22.736 -6.753 1.00 0.00 C ATOM 1367 CD1 TYR A 85 37.175 -23.453 -7.949 1.00 0.00 C ATOM 1368 CD2 TYR A 85 37.931 -21.725 -6.418 1.00 0.00 C ATOM 1369 CE1 TYR A 85 38.228 -23.143 -8.821 1.00 0.00 C ATOM 1370 CE2 TYR A 85 38.976 -21.395 -7.293 1.00 0.00 C ATOM 1371 CZ TYR A 85 39.125 -22.103 -8.502 1.00 0.00 C ATOM 1372 OH TYR A 85 40.134 -21.790 -9.360 1.00 0.00 O ATOM 0 H TYR A 85 34.462 -23.538 -3.924 1.00 0.00 H new ATOM 0 HA TYR A 85 35.966 -25.204 -5.725 1.00 0.00 H new ATOM 0 HB2 TYR A 85 34.959 -23.091 -6.402 1.00 0.00 H new ATOM 0 HB3 TYR A 85 35.774 -22.231 -5.111 1.00 0.00 H new ATOM 0 HD1 TYR A 85 36.481 -24.242 -8.198 1.00 0.00 H new ATOM 0 HD2 TYR A 85 37.826 -21.196 -5.482 1.00 0.00 H new ATOM 0 HE1 TYR A 85 38.352 -23.701 -9.737 1.00 0.00 H new ATOM 0 HE2 TYR A 85 39.664 -20.601 -7.041 1.00 0.00 H new ATOM 0 HH TYR A 85 39.855 -21.988 -10.279 1.00 0.00 H new ATOM 1382 N LEU A 86 37.487 -23.893 -3.131 1.00 0.00 N ATOM 1383 CA LEU A 86 38.739 -23.924 -2.388 1.00 0.00 C ATOM 1384 C LEU A 86 39.069 -25.335 -1.899 1.00 0.00 C ATOM 1385 O LEU A 86 40.243 -25.678 -1.768 1.00 0.00 O ATOM 1386 CB LEU A 86 38.649 -22.971 -1.194 1.00 0.00 C ATOM 1387 CG LEU A 86 38.504 -21.511 -1.627 1.00 0.00 C ATOM 1388 CD1 LEU A 86 38.326 -20.655 -0.378 1.00 0.00 C ATOM 1389 CD2 LEU A 86 39.736 -21.034 -2.393 1.00 0.00 C ATOM 0 H LEU A 86 36.719 -23.429 -2.646 1.00 0.00 H new ATOM 0 HA LEU A 86 39.538 -23.607 -3.058 1.00 0.00 H new ATOM 0 HB2 LEU A 86 37.798 -23.250 -0.573 1.00 0.00 H new ATOM 0 HB3 LEU A 86 39.542 -23.078 -0.578 1.00 0.00 H new ATOM 0 HG LEU A 86 37.641 -21.422 -2.287 1.00 0.00 H new ATOM 0 HD11 LEU A 86 38.221 -19.609 -0.666 1.00 0.00 H new ATOM 0 HD12 LEU A 86 37.433 -20.975 0.158 1.00 0.00 H new ATOM 0 HD13 LEU A 86 39.197 -20.768 0.268 1.00 0.00 H new ATOM 0 HD21 LEU A 86 39.601 -19.993 -2.687 1.00 0.00 H new ATOM 0 HD22 LEU A 86 40.616 -21.121 -1.756 1.00 0.00 H new ATOM 0 HD23 LEU A 86 39.871 -21.648 -3.284 1.00 0.00 H new ATOM 1401 N VAL A 87 38.047 -26.157 -1.628 1.00 0.00 N ATOM 1402 CA VAL A 87 38.277 -27.523 -1.169 1.00 0.00 C ATOM 1403 C VAL A 87 38.296 -28.512 -2.333 1.00 0.00 C ATOM 1404 O VAL A 87 38.765 -29.638 -2.173 1.00 0.00 O ATOM 1405 CB VAL A 87 37.239 -27.928 -0.117 1.00 0.00 C ATOM 1406 CG1 VAL A 87 37.386 -27.052 1.128 1.00 0.00 C ATOM 1407 CG2 VAL A 87 35.814 -27.805 -0.652 1.00 0.00 C ATOM 0 H VAL A 87 37.064 -25.899 -1.719 1.00 0.00 H new ATOM 0 HA VAL A 87 39.262 -27.552 -0.702 1.00 0.00 H new ATOM 0 HB VAL A 87 37.421 -28.972 0.137 1.00 0.00 H new ATOM 0 HG11 VAL A 87 36.644 -27.347 1.870 1.00 0.00 H new ATOM 0 HG12 VAL A 87 38.386 -27.177 1.545 1.00 0.00 H new ATOM 0 HG13 VAL A 87 37.233 -26.007 0.858 1.00 0.00 H new ATOM 0 HG21 VAL A 87 35.107 -28.101 0.123 1.00 0.00 H new ATOM 0 HG22 VAL A 87 35.622 -26.772 -0.942 1.00 0.00 H new ATOM 0 HG23 VAL A 87 35.694 -28.454 -1.519 1.00 0.00 H new