USER MOD reduce.3.24.130724 H: found=0, std=0, add=669, rem=0, adj=16 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= -0.309 USER MOD Set 1.2: A 72 THR OG1 : rot 160:sc= 0.00683 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 15 GLN : amide:sc= 1 K(o=1,f=-0.74) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 GLN : amide:sc= -1.65 K(o=-1.6,f=-4.2!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 ASN : amide:sc= -0.404 X(o=-0.4,f=0) USER MOD Single : A 29 TYR OH : rot 30:sc= 0 USER MOD Single : A 30 GLN : amide:sc= -0.353 K(o=-0.35,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+ 173:sc= 0 (180deg=-0.0696) USER MOD Single : A 35 SER OG : rot 82:sc= 0.601 USER MOD Single : A 38 SER OG : rot -28:sc= 0.00981 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= 1.09 K(o=1.1,f=0) USER MOD Single : A 56 LYS NZ :NH3+ -135:sc= -0.066 (180deg=-0.519) 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= -0.0871 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.0236 K(o=-0.024,f=-1.4!) USER MOD Single : A 81 THR OG1 : rot 95:sc= 1.28 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc= -0.0276 K(o=-0.028,f=-0.8) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 82 N THR A 6 11.032 -6.520 -11.430 1.00 0.00 N ATOM 83 CA THR A 6 11.729 -6.767 -10.175 1.00 0.00 C ATOM 84 C THR A 6 12.202 -8.217 -10.116 1.00 0.00 C ATOM 85 O THR A 6 11.800 -9.039 -10.939 1.00 0.00 O ATOM 86 CB THR A 6 10.807 -6.458 -8.990 1.00 0.00 C ATOM 87 OG1 THR A 6 9.681 -7.303 -9.032 1.00 0.00 O ATOM 88 CG2 THR A 6 10.341 -5.004 -9.029 1.00 0.00 C ATOM 0 HA THR A 6 12.599 -6.113 -10.119 1.00 0.00 H new ATOM 0 HB THR A 6 11.366 -6.625 -8.069 1.00 0.00 H new ATOM 0 HG1 THR A 6 9.094 -7.104 -8.273 1.00 0.00 H new ATOM 0 HG21 THR A 6 9.688 -4.808 -8.178 1.00 0.00 H new ATOM 0 HG22 THR A 6 11.207 -4.343 -8.982 1.00 0.00 H new ATOM 0 HG23 THR A 6 9.795 -4.821 -9.955 1.00 0.00 H new ATOM 96 N ASP A 7 13.060 -8.544 -9.147 1.00 0.00 N ATOM 97 CA ASP A 7 13.593 -9.892 -9.024 1.00 0.00 C ATOM 98 C ASP A 7 12.488 -10.914 -8.754 1.00 0.00 C ATOM 99 O ASP A 7 12.699 -12.110 -8.935 1.00 0.00 O ATOM 100 CB ASP A 7 14.633 -9.923 -7.904 1.00 0.00 C ATOM 101 CG ASP A 7 14.032 -9.535 -6.552 1.00 0.00 C ATOM 102 OD1 ASP A 7 13.795 -8.322 -6.351 1.00 0.00 O ATOM 103 OD2 ASP A 7 13.812 -10.455 -5.733 1.00 0.00 O ATOM 0 H ASP A 7 13.397 -7.891 -8.440 1.00 0.00 H new ATOM 0 HA ASP A 7 14.062 -10.165 -9.970 1.00 0.00 H new ATOM 0 HB2 ASP A 7 15.063 -10.922 -7.836 1.00 0.00 H new ATOM 0 HB3 ASP A 7 15.448 -9.241 -8.147 1.00 0.00 H new ATOM 108 N GLN A 8 11.308 -10.460 -8.322 1.00 0.00 N ATOM 109 CA GLN A 8 10.212 -11.365 -8.020 1.00 0.00 C ATOM 110 C GLN A 8 9.570 -11.880 -9.299 1.00 0.00 C ATOM 111 O GLN A 8 9.340 -13.079 -9.427 1.00 0.00 O ATOM 112 CB GLN A 8 9.182 -10.651 -7.145 1.00 0.00 C ATOM 113 CG GLN A 8 9.810 -10.223 -5.818 1.00 0.00 C ATOM 114 CD GLN A 8 8.793 -9.558 -4.893 1.00 0.00 C ATOM 115 OE1 GLN A 8 7.624 -9.397 -5.234 1.00 0.00 O ATOM 116 NE2 GLN A 8 9.234 -9.166 -3.703 1.00 0.00 N ATOM 0 H GLN A 8 11.094 -9.473 -8.176 1.00 0.00 H new ATOM 0 HA GLN A 8 10.603 -12.224 -7.475 1.00 0.00 H new ATOM 0 HB2 GLN A 8 8.794 -9.777 -7.669 1.00 0.00 H new ATOM 0 HB3 GLN A 8 8.336 -11.312 -6.957 1.00 0.00 H new ATOM 0 HG2 GLN A 8 10.237 -11.094 -5.321 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.631 -9.532 -6.011 1.00 0.00 H new ATOM 0 HE21 GLN A 8 10.210 -9.313 -3.447 1.00 0.00 H new ATOM 0 HE22 GLN A 8 8.596 -8.718 -3.045 1.00 0.00 H new ATOM 125 N VAL A 9 9.278 -10.987 -10.249 1.00 0.00 N ATOM 126 CA VAL A 9 8.651 -11.373 -11.505 1.00 0.00 C ATOM 127 C VAL A 9 9.692 -11.876 -12.498 1.00 0.00 C ATOM 128 O VAL A 9 9.381 -12.694 -13.360 1.00 0.00 O ATOM 129 CB VAL A 9 7.866 -10.183 -12.075 1.00 0.00 C ATOM 130 CG1 VAL A 9 8.770 -8.966 -12.251 1.00 0.00 C ATOM 131 CG2 VAL A 9 7.244 -10.531 -13.428 1.00 0.00 C ATOM 0 H VAL A 9 9.469 -9.988 -10.166 1.00 0.00 H new ATOM 0 HA VAL A 9 7.956 -12.192 -11.320 1.00 0.00 H new ATOM 0 HB VAL A 9 7.075 -9.950 -11.362 1.00 0.00 H new ATOM 0 HG11 VAL A 9 8.190 -8.137 -12.656 1.00 0.00 H new ATOM 0 HG12 VAL A 9 9.187 -8.680 -11.285 1.00 0.00 H new ATOM 0 HG13 VAL A 9 9.580 -9.211 -12.937 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.694 -9.670 -13.808 1.00 0.00 H new ATOM 0 HG22 VAL A 9 8.032 -10.798 -14.133 1.00 0.00 H new ATOM 0 HG23 VAL A 9 6.562 -11.373 -13.309 1.00 0.00 H new ATOM 141 N LEU A 10 10.931 -11.392 -12.385 1.00 0.00 N ATOM 142 CA LEU A 10 11.989 -11.788 -13.300 1.00 0.00 C ATOM 143 C LEU A 10 12.383 -13.243 -13.042 1.00 0.00 C ATOM 144 O LEU A 10 12.836 -13.927 -13.955 1.00 0.00 O ATOM 145 CB LEU A 10 13.167 -10.824 -13.124 1.00 0.00 C ATOM 146 CG LEU A 10 14.258 -10.997 -14.183 1.00 0.00 C ATOM 147 CD1 LEU A 10 13.697 -10.776 -15.587 1.00 0.00 C ATOM 148 CD2 LEU A 10 15.338 -9.946 -13.941 1.00 0.00 C ATOM 0 H LEU A 10 11.220 -10.727 -11.668 1.00 0.00 H new ATOM 0 HA LEU A 10 11.651 -11.731 -14.335 1.00 0.00 H new ATOM 0 HB2 LEU A 10 12.797 -9.799 -13.159 1.00 0.00 H new ATOM 0 HB3 LEU A 10 13.603 -10.972 -12.136 1.00 0.00 H new ATOM 0 HG LEU A 10 14.656 -12.009 -14.110 1.00 0.00 H new ATOM 0 HD11 LEU A 10 14.492 -10.905 -16.321 1.00 0.00 H new ATOM 0 HD12 LEU A 10 12.905 -11.499 -15.780 1.00 0.00 H new ATOM 0 HD13 LEU A 10 13.293 -9.766 -15.663 1.00 0.00 H new ATOM 0 HD21 LEU A 10 16.125 -10.054 -14.687 1.00 0.00 H new ATOM 0 HD22 LEU A 10 14.900 -8.951 -14.017 1.00 0.00 H new ATOM 0 HD23 LEU A 10 15.761 -10.081 -12.946 1.00 0.00 H new ATOM 160 N VAL A 11 12.211 -13.723 -11.808 1.00 0.00 N ATOM 161 CA VAL A 11 12.466 -15.121 -11.493 1.00 0.00 C ATOM 162 C VAL A 11 11.305 -15.994 -11.962 1.00 0.00 C ATOM 163 O VAL A 11 11.531 -17.108 -12.425 1.00 0.00 O ATOM 164 CB VAL A 11 12.709 -15.268 -9.985 1.00 0.00 C ATOM 165 CG1 VAL A 11 12.676 -16.727 -9.541 1.00 0.00 C ATOM 166 CG2 VAL A 11 14.083 -14.697 -9.639 1.00 0.00 C ATOM 0 H VAL A 11 11.897 -13.162 -11.016 1.00 0.00 H new ATOM 0 HA VAL A 11 13.359 -15.457 -12.020 1.00 0.00 H new ATOM 0 HB VAL A 11 11.913 -14.729 -9.470 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.853 -16.785 -8.467 1.00 0.00 H new ATOM 0 HG12 VAL A 11 11.701 -17.156 -9.772 1.00 0.00 H new ATOM 0 HG13 VAL A 11 13.451 -17.285 -10.066 1.00 0.00 H new ATOM 0 HG21 VAL A 11 14.260 -14.799 -8.568 1.00 0.00 H new ATOM 0 HG22 VAL A 11 14.852 -15.241 -10.188 1.00 0.00 H new ATOM 0 HG23 VAL A 11 14.119 -13.643 -9.914 1.00 0.00 H new ATOM 176 N GLU A 12 10.061 -15.513 -11.859 1.00 0.00 N ATOM 177 CA GLU A 12 8.922 -16.274 -12.367 1.00 0.00 C ATOM 178 C GLU A 12 8.988 -16.366 -13.887 1.00 0.00 C ATOM 179 O GLU A 12 8.478 -17.317 -14.481 1.00 0.00 O ATOM 180 CB GLU A 12 7.609 -15.599 -11.964 1.00 0.00 C ATOM 181 CG GLU A 12 7.433 -15.598 -10.448 1.00 0.00 C ATOM 182 CD GLU A 12 6.058 -15.059 -10.058 1.00 0.00 C ATOM 183 OE1 GLU A 12 5.836 -13.842 -10.241 1.00 0.00 O ATOM 184 OE2 GLU A 12 5.234 -15.874 -9.577 1.00 0.00 O ATOM 0 H GLU A 12 9.823 -14.616 -11.436 1.00 0.00 H new ATOM 0 HA GLU A 12 8.961 -17.275 -11.938 1.00 0.00 H new ATOM 0 HB2 GLU A 12 7.595 -14.574 -12.335 1.00 0.00 H new ATOM 0 HB3 GLU A 12 6.772 -16.119 -12.430 1.00 0.00 H new ATOM 0 HG2 GLU A 12 7.553 -16.611 -10.064 1.00 0.00 H new ATOM 0 HG3 GLU A 12 8.211 -14.988 -9.988 1.00 0.00 H new ATOM 191 N ARG A 13 9.618 -15.373 -14.521 1.00 0.00 N ATOM 192 CA ARG A 13 9.753 -15.316 -15.964 1.00 0.00 C ATOM 193 C ARG A 13 10.790 -16.326 -16.450 1.00 0.00 C ATOM 194 O ARG A 13 10.657 -16.859 -17.548 1.00 0.00 O ATOM 195 CB ARG A 13 10.107 -13.880 -16.345 1.00 0.00 C ATOM 196 CG ARG A 13 10.197 -13.711 -17.856 1.00 0.00 C ATOM 197 CD ARG A 13 10.344 -12.225 -18.173 1.00 0.00 C ATOM 198 NE ARG A 13 9.074 -11.513 -17.988 1.00 0.00 N ATOM 199 CZ ARG A 13 8.187 -11.283 -18.960 1.00 0.00 C ATOM 200 NH1 ARG A 13 8.408 -11.710 -20.203 1.00 0.00 N ATOM 201 NH2 ARG A 13 7.068 -10.615 -18.690 1.00 0.00 N ATOM 0 H ARG A 13 10.048 -14.585 -14.037 1.00 0.00 H new ATOM 0 HA ARG A 13 8.818 -15.590 -16.452 1.00 0.00 H new ATOM 0 HB2 ARG A 13 9.354 -13.200 -15.946 1.00 0.00 H new ATOM 0 HB3 ARG A 13 11.058 -13.605 -15.890 1.00 0.00 H new ATOM 0 HG2 ARG A 13 11.048 -14.267 -18.249 1.00 0.00 H new ATOM 0 HG3 ARG A 13 9.305 -14.113 -18.335 1.00 0.00 H new ATOM 0 HD2 ARG A 13 11.106 -11.787 -17.529 1.00 0.00 H new ATOM 0 HD3 ARG A 13 10.686 -12.102 -19.201 1.00 0.00 H new ATOM 0 HE ARG A 13 8.854 -11.170 -17.053 1.00 0.00 H new ATOM 0 HH11 ARG A 13 9.264 -12.220 -20.423 1.00 0.00 H new ATOM 0 HH12 ARG A 13 7.721 -11.527 -20.935 1.00 0.00 H new ATOM 0 HH21 ARG A 13 6.890 -10.280 -17.743 1.00 0.00 H new ATOM 0 HH22 ARG A 13 6.389 -10.438 -19.430 1.00 0.00 H new ATOM 215 N VAL A 14 11.818 -16.599 -15.642 1.00 0.00 N ATOM 216 CA VAL A 14 12.799 -17.626 -15.975 1.00 0.00 C ATOM 217 C VAL A 14 12.210 -19.015 -15.724 1.00 0.00 C ATOM 218 O VAL A 14 12.590 -19.974 -16.396 1.00 0.00 O ATOM 219 CB VAL A 14 14.087 -17.402 -15.174 1.00 0.00 C ATOM 220 CG1 VAL A 14 15.098 -18.513 -15.452 1.00 0.00 C ATOM 221 CG2 VAL A 14 14.722 -16.078 -15.593 1.00 0.00 C ATOM 0 H VAL A 14 11.989 -16.123 -14.756 1.00 0.00 H new ATOM 0 HA VAL A 14 13.051 -17.559 -17.033 1.00 0.00 H new ATOM 0 HB VAL A 14 13.830 -17.395 -14.115 1.00 0.00 H new ATOM 0 HG11 VAL A 14 16.004 -18.334 -14.873 1.00 0.00 H new ATOM 0 HG12 VAL A 14 14.670 -19.474 -15.167 1.00 0.00 H new ATOM 0 HG13 VAL A 14 15.342 -18.525 -16.514 1.00 0.00 H new ATOM 0 HG21 VAL A 14 15.638 -15.918 -15.024 1.00 0.00 H new ATOM 0 HG22 VAL A 14 14.956 -16.107 -16.657 1.00 0.00 H new ATOM 0 HG23 VAL A 14 14.026 -15.262 -15.397 1.00 0.00 H new ATOM 231 N GLN A 15 11.279 -19.142 -14.769 1.00 0.00 N ATOM 232 CA GLN A 15 10.577 -20.402 -14.547 1.00 0.00 C ATOM 233 C GLN A 15 9.608 -20.680 -15.699 1.00 0.00 C ATOM 234 O GLN A 15 9.135 -21.806 -15.851 1.00 0.00 O ATOM 235 CB GLN A 15 9.841 -20.364 -13.206 1.00 0.00 C ATOM 236 CG GLN A 15 10.838 -20.419 -12.049 1.00 0.00 C ATOM 237 CD GLN A 15 10.147 -20.476 -10.692 1.00 0.00 C ATOM 238 OE1 GLN A 15 8.947 -20.238 -10.575 1.00 0.00 O ATOM 239 NE2 GLN A 15 10.905 -20.794 -9.646 1.00 0.00 N ATOM 0 H GLN A 15 10.999 -18.387 -14.143 1.00 0.00 H new ATOM 0 HA GLN A 15 11.304 -21.214 -14.515 1.00 0.00 H new ATOM 0 HB2 GLN A 15 9.244 -19.454 -13.137 1.00 0.00 H new ATOM 0 HB3 GLN A 15 9.150 -21.204 -13.139 1.00 0.00 H new ATOM 0 HG2 GLN A 15 11.478 -21.294 -12.165 1.00 0.00 H new ATOM 0 HG3 GLN A 15 11.485 -19.543 -12.088 1.00 0.00 H new ATOM 0 HE21 GLN A 15 11.898 -20.986 -9.776 1.00 0.00 H new ATOM 0 HE22 GLN A 15 10.493 -20.846 -8.714 1.00 0.00 H new ATOM 248 N LYS A 16 9.313 -19.658 -16.513 1.00 0.00 N ATOM 249 CA LYS A 16 8.497 -19.802 -17.712 1.00 0.00 C ATOM 250 C LYS A 16 9.340 -20.310 -18.886 1.00 0.00 C ATOM 251 O LYS A 16 8.824 -20.505 -19.985 1.00 0.00 O ATOM 252 CB LYS A 16 7.810 -18.471 -18.008 1.00 0.00 C ATOM 253 CG LYS A 16 6.602 -18.690 -18.926 1.00 0.00 C ATOM 254 CD LYS A 16 5.794 -17.403 -19.095 1.00 0.00 C ATOM 255 CE LYS A 16 6.627 -16.318 -19.776 1.00 0.00 C ATOM 256 NZ LYS A 16 5.835 -15.089 -19.972 1.00 0.00 N ATOM 0 H LYS A 16 9.639 -18.705 -16.352 1.00 0.00 H new ATOM 0 HA LYS A 16 7.722 -20.552 -17.551 1.00 0.00 H new ATOM 0 HB2 LYS A 16 7.488 -18.005 -17.077 1.00 0.00 H new ATOM 0 HB3 LYS A 16 8.515 -17.787 -18.480 1.00 0.00 H new ATOM 0 HG2 LYS A 16 6.942 -19.040 -19.901 1.00 0.00 H new ATOM 0 HG3 LYS A 16 5.964 -19.471 -18.512 1.00 0.00 H new ATOM 0 HD2 LYS A 16 4.901 -17.605 -19.686 1.00 0.00 H new ATOM 0 HD3 LYS A 16 5.458 -17.050 -18.120 1.00 0.00 H new ATOM 0 HE2 LYS A 16 7.506 -16.096 -19.171 1.00 0.00 H new ATOM 0 HE3 LYS A 16 6.986 -16.681 -20.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 6.423 -14.367 -20.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 5.010 -15.299 -20.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 5.513 -14.732 -19.049 1.00 0.00 H new ATOM 270 N GLY A 17 10.640 -20.524 -18.658 1.00 0.00 N ATOM 271 CA GLY A 17 11.556 -21.039 -19.666 1.00 0.00 C ATOM 272 C GLY A 17 12.274 -19.930 -20.433 1.00 0.00 C ATOM 273 O GLY A 17 12.983 -20.218 -21.396 1.00 0.00 O ATOM 0 H GLY A 17 11.084 -20.341 -17.758 1.00 0.00 H new ATOM 0 HA2 GLY A 17 12.295 -21.680 -19.185 1.00 0.00 H new ATOM 0 HA3 GLY A 17 11.003 -21.662 -20.369 1.00 0.00 H new ATOM 277 N ASP A 18 12.102 -18.670 -20.024 1.00 0.00 N ATOM 278 CA ASP A 18 12.751 -17.551 -20.687 1.00 0.00 C ATOM 279 C ASP A 18 14.215 -17.469 -20.247 1.00 0.00 C ATOM 280 O ASP A 18 14.498 -17.125 -19.100 1.00 0.00 O ATOM 281 CB ASP A 18 11.997 -16.263 -20.355 1.00 0.00 C ATOM 282 CG ASP A 18 12.421 -15.093 -21.238 1.00 0.00 C ATOM 283 OD1 ASP A 18 13.591 -15.089 -21.674 1.00 0.00 O ATOM 284 OD2 ASP A 18 11.566 -14.211 -21.471 1.00 0.00 O ATOM 0 H ASP A 18 11.515 -18.405 -19.233 1.00 0.00 H new ATOM 0 HA ASP A 18 12.732 -17.693 -21.768 1.00 0.00 H new ATOM 0 HB2 ASP A 18 10.927 -16.432 -20.471 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.167 -16.005 -19.310 1.00 0.00 H new ATOM 289 N GLN A 19 15.147 -17.784 -21.153 1.00 0.00 N ATOM 290 CA GLN A 19 16.566 -17.746 -20.833 1.00 0.00 C ATOM 291 C GLN A 19 17.099 -16.312 -20.901 1.00 0.00 C ATOM 292 O GLN A 19 18.054 -15.972 -20.205 1.00 0.00 O ATOM 293 CB GLN A 19 17.311 -18.700 -21.777 1.00 0.00 C ATOM 294 CG GLN A 19 18.710 -19.055 -21.261 1.00 0.00 C ATOM 295 CD GLN A 19 19.734 -17.938 -21.431 1.00 0.00 C ATOM 296 OE1 GLN A 19 19.641 -17.123 -22.345 1.00 0.00 O ATOM 297 NE2 GLN A 19 20.725 -17.891 -20.546 1.00 0.00 N ATOM 0 H GLN A 19 14.938 -18.067 -22.110 1.00 0.00 H new ATOM 0 HA GLN A 19 16.731 -18.082 -19.809 1.00 0.00 H new ATOM 0 HB2 GLN A 19 16.729 -19.613 -21.900 1.00 0.00 H new ATOM 0 HB3 GLN A 19 17.395 -18.241 -22.762 1.00 0.00 H new ATOM 0 HG2 GLN A 19 18.642 -19.314 -20.204 1.00 0.00 H new ATOM 0 HG3 GLN A 19 19.065 -19.943 -21.785 1.00 0.00 H new ATOM 0 HE21 GLN A 19 20.774 -18.583 -19.798 1.00 0.00 H new ATOM 0 HE22 GLN A 19 21.436 -17.163 -20.615 1.00 0.00 H new ATOM 306 N LYS A 20 16.487 -15.466 -21.737 1.00 0.00 N ATOM 307 CA LYS A 20 16.937 -14.088 -21.898 1.00 0.00 C ATOM 308 C LYS A 20 16.601 -13.287 -20.649 1.00 0.00 C ATOM 309 O LYS A 20 17.323 -12.357 -20.300 1.00 0.00 O ATOM 310 CB LYS A 20 16.272 -13.460 -23.129 1.00 0.00 C ATOM 311 CG LYS A 20 16.470 -14.255 -24.425 1.00 0.00 C ATOM 312 CD LYS A 20 17.851 -14.090 -25.073 1.00 0.00 C ATOM 313 CE LYS A 20 18.974 -14.728 -24.253 1.00 0.00 C ATOM 314 NZ LYS A 20 20.235 -14.771 -25.019 1.00 0.00 N ATOM 0 H LYS A 20 15.681 -15.715 -22.310 1.00 0.00 H new ATOM 0 HA LYS A 20 18.017 -14.078 -22.042 1.00 0.00 H new ATOM 0 HB2 LYS A 20 15.204 -13.358 -22.938 1.00 0.00 H new ATOM 0 HB3 LYS A 20 16.668 -12.454 -23.269 1.00 0.00 H new ATOM 0 HG2 LYS A 20 16.306 -15.312 -24.216 1.00 0.00 H new ATOM 0 HG3 LYS A 20 15.708 -13.950 -25.142 1.00 0.00 H new ATOM 0 HD2 LYS A 20 17.836 -14.536 -26.067 1.00 0.00 H new ATOM 0 HD3 LYS A 20 18.061 -13.028 -25.203 1.00 0.00 H new ATOM 0 HE2 LYS A 20 19.123 -14.162 -23.333 1.00 0.00 H new ATOM 0 HE3 LYS A 20 18.687 -15.739 -23.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 20.979 -15.208 -24.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 20.097 -15.331 -25.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 20.519 -13.804 -25.274 1.00 0.00 H new ATOM 328 N ALA A 21 15.514 -13.642 -19.961 1.00 0.00 N ATOM 329 CA ALA A 21 15.147 -12.984 -18.715 1.00 0.00 C ATOM 330 C ALA A 21 16.184 -13.303 -17.638 1.00 0.00 C ATOM 331 O ALA A 21 16.407 -12.503 -16.731 1.00 0.00 O ATOM 332 CB ALA A 21 13.761 -13.462 -18.290 1.00 0.00 C ATOM 0 H ALA A 21 14.875 -14.383 -20.250 1.00 0.00 H new ATOM 0 HA ALA A 21 15.122 -11.903 -18.856 1.00 0.00 H new ATOM 0 HB1 ALA A 21 13.478 -12.974 -17.357 1.00 0.00 H new ATOM 0 HB2 ALA A 21 13.036 -13.212 -19.065 1.00 0.00 H new ATOM 0 HB3 ALA A 21 13.778 -14.542 -18.144 1.00 0.00 H new ATOM 338 N PHE A 22 16.823 -14.473 -17.735 1.00 0.00 N ATOM 339 CA PHE A 22 17.861 -14.834 -16.784 1.00 0.00 C ATOM 340 C PHE A 22 19.133 -14.041 -17.066 1.00 0.00 C ATOM 341 O PHE A 22 19.889 -13.744 -16.146 1.00 0.00 O ATOM 342 CB PHE A 22 18.136 -16.336 -16.854 1.00 0.00 C ATOM 343 CG PHE A 22 19.077 -16.808 -15.770 1.00 0.00 C ATOM 344 CD1 PHE A 22 18.626 -16.897 -14.446 1.00 0.00 C ATOM 345 CD2 PHE A 22 20.402 -17.148 -16.085 1.00 0.00 C ATOM 346 CE1 PHE A 22 19.499 -17.312 -13.432 1.00 0.00 C ATOM 347 CE2 PHE A 22 21.276 -17.563 -15.069 1.00 0.00 C ATOM 348 CZ PHE A 22 20.827 -17.641 -13.743 1.00 0.00 C ATOM 0 H PHE A 22 16.639 -15.173 -18.454 1.00 0.00 H new ATOM 0 HA PHE A 22 17.520 -14.590 -15.778 1.00 0.00 H new ATOM 0 HB2 PHE A 22 17.194 -16.878 -16.773 1.00 0.00 H new ATOM 0 HB3 PHE A 22 18.560 -16.579 -17.828 1.00 0.00 H new ATOM 0 HD1 PHE A 22 17.603 -16.645 -14.207 1.00 0.00 H new ATOM 0 HD2 PHE A 22 20.748 -17.090 -17.107 1.00 0.00 H new ATOM 0 HE1 PHE A 22 19.150 -17.379 -12.412 1.00 0.00 H new ATOM 0 HE2 PHE A 22 22.297 -17.823 -15.309 1.00 0.00 H new ATOM 0 HZ PHE A 22 21.503 -17.954 -12.961 1.00 0.00 H new ATOM 358 N ASN A 23 19.379 -13.685 -18.328 1.00 0.00 N ATOM 359 CA ASN A 23 20.554 -12.907 -18.685 1.00 0.00 C ATOM 360 C ASN A 23 20.483 -11.516 -18.055 1.00 0.00 C ATOM 361 O ASN A 23 21.510 -10.979 -17.643 1.00 0.00 O ATOM 362 CB ASN A 23 20.651 -12.828 -20.208 1.00 0.00 C ATOM 363 CG ASN A 23 21.876 -12.041 -20.649 1.00 0.00 C ATOM 364 OD1 ASN A 23 22.931 -12.618 -20.899 1.00 0.00 O ATOM 365 ND2 ASN A 23 21.744 -10.723 -20.748 1.00 0.00 N ATOM 0 H ASN A 23 18.777 -13.926 -19.116 1.00 0.00 H new ATOM 0 HA ASN A 23 21.452 -13.391 -18.300 1.00 0.00 H new ATOM 0 HB2 ASN A 23 20.695 -13.835 -20.623 1.00 0.00 H new ATOM 0 HB3 ASN A 23 19.752 -12.358 -20.607 1.00 0.00 H new ATOM 0 HD21 ASN A 23 22.537 -10.152 -21.041 1.00 0.00 H new ATOM 0 HD22 ASN A 23 20.850 -10.282 -20.531 1.00 0.00 H new ATOM 372 N LEU A 24 19.285 -10.930 -17.973 1.00 0.00 N ATOM 373 CA LEU A 24 19.123 -9.637 -17.320 1.00 0.00 C ATOM 374 C LEU A 24 19.266 -9.796 -15.807 1.00 0.00 C ATOM 375 O LEU A 24 19.654 -8.850 -15.125 1.00 0.00 O ATOM 376 CB LEU A 24 17.753 -9.038 -17.670 1.00 0.00 C ATOM 377 CG LEU A 24 17.710 -8.270 -18.999 1.00 0.00 C ATOM 378 CD1 LEU A 24 18.692 -7.100 -18.998 1.00 0.00 C ATOM 379 CD2 LEU A 24 18.013 -9.168 -20.196 1.00 0.00 C ATOM 0 H LEU A 24 18.424 -11.329 -18.348 1.00 0.00 H new ATOM 0 HA LEU A 24 19.899 -8.959 -17.675 1.00 0.00 H new ATOM 0 HB2 LEU A 24 17.018 -9.842 -17.707 1.00 0.00 H new ATOM 0 HB3 LEU A 24 17.450 -8.366 -16.867 1.00 0.00 H new ATOM 0 HG LEU A 24 16.692 -7.893 -19.095 1.00 0.00 H new ATOM 0 HD11 LEU A 24 18.636 -6.578 -19.953 1.00 0.00 H new ATOM 0 HD12 LEU A 24 18.437 -6.412 -18.192 1.00 0.00 H new ATOM 0 HD13 LEU A 24 19.704 -7.475 -18.848 1.00 0.00 H new ATOM 0 HD21 LEU A 24 17.971 -8.579 -21.112 1.00 0.00 H new ATOM 0 HD22 LEU A 24 19.009 -9.597 -20.086 1.00 0.00 H new ATOM 0 HD23 LEU A 24 17.276 -9.970 -20.245 1.00 0.00 H new ATOM 391 N LEU A 25 18.959 -10.985 -15.280 1.00 0.00 N ATOM 392 CA LEU A 25 19.093 -11.273 -13.860 1.00 0.00 C ATOM 393 C LEU A 25 20.567 -11.479 -13.503 1.00 0.00 C ATOM 394 O LEU A 25 20.975 -11.199 -12.376 1.00 0.00 O ATOM 395 CB LEU A 25 18.246 -12.514 -13.569 1.00 0.00 C ATOM 396 CG LEU A 25 18.148 -12.877 -12.085 1.00 0.00 C ATOM 397 CD1 LEU A 25 17.461 -11.775 -11.280 1.00 0.00 C ATOM 398 CD2 LEU A 25 17.317 -14.149 -11.967 1.00 0.00 C ATOM 0 H LEU A 25 18.611 -11.770 -15.830 1.00 0.00 H new ATOM 0 HA LEU A 25 18.741 -10.443 -13.247 1.00 0.00 H new ATOM 0 HB2 LEU A 25 17.241 -12.353 -13.959 1.00 0.00 H new ATOM 0 HB3 LEU A 25 18.666 -13.361 -14.111 1.00 0.00 H new ATOM 0 HG LEU A 25 19.155 -13.011 -11.690 1.00 0.00 H new ATOM 0 HD11 LEU A 25 17.410 -12.068 -10.231 1.00 0.00 H new ATOM 0 HD12 LEU A 25 18.030 -10.850 -11.370 1.00 0.00 H new ATOM 0 HD13 LEU A 25 16.452 -11.620 -11.663 1.00 0.00 H new ATOM 0 HD21 LEU A 25 17.231 -14.431 -10.918 1.00 0.00 H new ATOM 0 HD22 LEU A 25 16.323 -13.974 -12.378 1.00 0.00 H new ATOM 0 HD23 LEU A 25 17.802 -14.953 -12.520 1.00 0.00 H new ATOM 410 N VAL A 26 21.371 -11.966 -14.457 1.00 0.00 N ATOM 411 CA VAL A 26 22.808 -12.123 -14.265 1.00 0.00 C ATOM 412 C VAL A 26 23.477 -10.754 -14.274 1.00 0.00 C ATOM 413 O VAL A 26 24.310 -10.473 -13.415 1.00 0.00 O ATOM 414 CB VAL A 26 23.396 -13.005 -15.372 1.00 0.00 C ATOM 415 CG1 VAL A 26 24.925 -12.995 -15.326 1.00 0.00 C ATOM 416 CG2 VAL A 26 22.925 -14.448 -15.210 1.00 0.00 C ATOM 0 H VAL A 26 21.041 -12.259 -15.376 1.00 0.00 H new ATOM 0 HA VAL A 26 22.990 -12.604 -13.304 1.00 0.00 H new ATOM 0 HB VAL A 26 23.055 -12.602 -16.325 1.00 0.00 H new ATOM 0 HG11 VAL A 26 25.317 -13.628 -16.122 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.286 -11.976 -15.462 1.00 0.00 H new ATOM 0 HG13 VAL A 26 25.262 -13.374 -14.361 1.00 0.00 H new ATOM 0 HG21 VAL A 26 23.351 -15.061 -16.004 1.00 0.00 H new ATOM 0 HG22 VAL A 26 23.250 -14.830 -14.242 1.00 0.00 H new ATOM 0 HG23 VAL A 26 21.837 -14.484 -15.268 1.00 0.00 H new ATOM 426 N VAL A 27 23.118 -9.897 -15.233 1.00 0.00 N ATOM 427 CA VAL A 27 23.696 -8.560 -15.341 1.00 0.00 C ATOM 428 C VAL A 27 23.325 -7.721 -14.120 1.00 0.00 C ATOM 429 O VAL A 27 24.024 -6.765 -13.784 1.00 0.00 O ATOM 430 CB VAL A 27 23.216 -7.905 -16.643 1.00 0.00 C ATOM 431 CG1 VAL A 27 23.629 -6.435 -16.732 1.00 0.00 C ATOM 432 CG2 VAL A 27 23.827 -8.633 -17.841 1.00 0.00 C ATOM 0 H VAL A 27 22.424 -10.110 -15.950 1.00 0.00 H new ATOM 0 HA VAL A 27 24.783 -8.630 -15.370 1.00 0.00 H new ATOM 0 HB VAL A 27 22.128 -7.969 -16.651 1.00 0.00 H new ATOM 0 HG11 VAL A 27 23.268 -6.012 -17.669 1.00 0.00 H new ATOM 0 HG12 VAL A 27 23.198 -5.885 -15.896 1.00 0.00 H new ATOM 0 HG13 VAL A 27 24.716 -6.359 -16.694 1.00 0.00 H new ATOM 0 HG21 VAL A 27 23.484 -8.166 -18.764 1.00 0.00 H new ATOM 0 HG22 VAL A 27 24.914 -8.575 -17.786 1.00 0.00 H new ATOM 0 HG23 VAL A 27 23.519 -9.678 -17.827 1.00 0.00 H new ATOM 442 N ARG A 28 22.227 -8.075 -13.447 1.00 0.00 N ATOM 443 CA ARG A 28 21.746 -7.348 -12.285 1.00 0.00 C ATOM 444 C ARG A 28 22.582 -7.643 -11.039 1.00 0.00 C ATOM 445 O ARG A 28 22.752 -6.762 -10.198 1.00 0.00 O ATOM 446 CB ARG A 28 20.280 -7.726 -12.067 1.00 0.00 C ATOM 447 CG ARG A 28 19.644 -6.902 -10.946 1.00 0.00 C ATOM 448 CD ARG A 28 18.144 -7.186 -10.873 1.00 0.00 C ATOM 449 NE ARG A 28 17.455 -6.697 -12.075 1.00 0.00 N ATOM 450 CZ ARG A 28 16.145 -6.819 -12.289 1.00 0.00 C ATOM 451 NH1 ARG A 28 15.355 -7.417 -11.402 1.00 0.00 N ATOM 452 NH2 ARG A 28 15.606 -6.340 -13.404 1.00 0.00 N ATOM 0 H ARG A 28 21.650 -8.877 -13.699 1.00 0.00 H new ATOM 0 HA ARG A 28 21.838 -6.277 -12.464 1.00 0.00 H new ATOM 0 HB2 ARG A 28 19.723 -7.573 -12.992 1.00 0.00 H new ATOM 0 HB3 ARG A 28 20.210 -8.786 -11.824 1.00 0.00 H new ATOM 0 HG2 ARG A 28 20.115 -7.145 -9.993 1.00 0.00 H new ATOM 0 HG3 ARG A 28 19.813 -5.840 -11.124 1.00 0.00 H new ATOM 0 HD2 ARG A 28 17.978 -8.258 -10.766 1.00 0.00 H new ATOM 0 HD3 ARG A 28 17.723 -6.708 -9.989 1.00 0.00 H new ATOM 0 HE ARG A 28 18.015 -6.235 -12.791 1.00 0.00 H new ATOM 0 HH11 ARG A 28 15.749 -7.792 -10.539 1.00 0.00 H new ATOM 0 HH12 ARG A 28 14.355 -7.500 -11.584 1.00 0.00 H new ATOM 0 HH21 ARG A 28 16.194 -5.878 -14.097 1.00 0.00 H new ATOM 0 HH22 ARG A 28 14.603 -6.434 -13.567 1.00 0.00 H new ATOM 466 N TYR A 29 23.101 -8.869 -10.913 1.00 0.00 N ATOM 467 CA TYR A 29 23.849 -9.271 -9.727 1.00 0.00 C ATOM 468 C TYR A 29 25.320 -9.574 -9.994 1.00 0.00 C ATOM 469 O TYR A 29 26.043 -9.883 -9.050 1.00 0.00 O ATOM 470 CB TYR A 29 23.153 -10.467 -9.086 1.00 0.00 C ATOM 471 CG TYR A 29 21.813 -10.114 -8.483 1.00 0.00 C ATOM 472 CD1 TYR A 29 21.755 -9.253 -7.379 1.00 0.00 C ATOM 473 CD2 TYR A 29 20.636 -10.645 -9.030 1.00 0.00 C ATOM 474 CE1 TYR A 29 20.516 -8.921 -6.810 1.00 0.00 C ATOM 475 CE2 TYR A 29 19.393 -10.306 -8.471 1.00 0.00 C ATOM 476 CZ TYR A 29 19.329 -9.446 -7.356 1.00 0.00 C ATOM 477 OH TYR A 29 18.123 -9.121 -6.808 1.00 0.00 O ATOM 0 H TYR A 29 23.014 -9.598 -11.621 1.00 0.00 H new ATOM 0 HA TYR A 29 23.855 -8.421 -9.045 1.00 0.00 H new ATOM 0 HB2 TYR A 29 23.014 -11.245 -9.836 1.00 0.00 H new ATOM 0 HB3 TYR A 29 23.796 -10.883 -8.311 1.00 0.00 H new ATOM 0 HD1 TYR A 29 22.665 -8.844 -6.965 1.00 0.00 H new ATOM 0 HD2 TYR A 29 20.685 -11.312 -9.878 1.00 0.00 H new ATOM 0 HE1 TYR A 29 20.473 -8.264 -5.954 1.00 0.00 H new ATOM 0 HE2 TYR A 29 18.484 -10.705 -8.896 1.00 0.00 H new ATOM 0 HH TYR A 29 18.173 -8.225 -6.414 1.00 0.00 H new ATOM 487 N GLN A 30 25.789 -9.501 -11.244 1.00 0.00 N ATOM 488 CA GLN A 30 27.150 -9.924 -11.562 1.00 0.00 C ATOM 489 C GLN A 30 28.211 -9.124 -10.800 1.00 0.00 C ATOM 490 O GLN A 30 29.284 -9.656 -10.519 1.00 0.00 O ATOM 491 CB GLN A 30 27.393 -9.850 -13.075 1.00 0.00 C ATOM 492 CG GLN A 30 27.213 -8.433 -13.622 1.00 0.00 C ATOM 493 CD GLN A 30 27.439 -8.371 -15.127 1.00 0.00 C ATOM 494 OE1 GLN A 30 27.812 -9.360 -15.754 1.00 0.00 O ATOM 495 NE2 GLN A 30 27.214 -7.206 -15.726 1.00 0.00 N ATOM 0 H GLN A 30 25.252 -9.157 -12.040 1.00 0.00 H new ATOM 0 HA GLN A 30 27.247 -10.959 -11.236 1.00 0.00 H new ATOM 0 HB2 GLN A 30 28.402 -10.197 -13.296 1.00 0.00 H new ATOM 0 HB3 GLN A 30 26.705 -10.524 -13.585 1.00 0.00 H new ATOM 0 HG2 GLN A 30 26.208 -8.080 -13.391 1.00 0.00 H new ATOM 0 HG3 GLN A 30 27.910 -7.760 -13.122 1.00 0.00 H new ATOM 0 HE21 GLN A 30 26.905 -6.403 -15.179 1.00 0.00 H new ATOM 0 HE22 GLN A 30 27.350 -7.115 -16.733 1.00 0.00 H new ATOM 504 N HIS A 31 27.937 -7.863 -10.462 1.00 0.00 N ATOM 505 CA HIS A 31 28.899 -7.047 -9.737 1.00 0.00 C ATOM 506 C HIS A 31 28.782 -7.277 -8.232 1.00 0.00 C ATOM 507 O HIS A 31 29.761 -7.134 -7.502 1.00 0.00 O ATOM 508 CB HIS A 31 28.666 -5.577 -10.094 1.00 0.00 C ATOM 509 CG HIS A 31 29.634 -4.645 -9.420 1.00 0.00 C ATOM 510 ND1 HIS A 31 29.323 -3.755 -8.391 1.00 0.00 N ATOM 511 CD2 HIS A 31 30.963 -4.542 -9.719 1.00 0.00 C ATOM 512 CE1 HIS A 31 30.478 -3.137 -8.093 1.00 0.00 C ATOM 513 NE2 HIS A 31 31.477 -3.588 -8.875 1.00 0.00 N ATOM 0 H HIS A 31 27.060 -7.391 -10.680 1.00 0.00 H new ATOM 0 HA HIS A 31 29.911 -7.330 -10.026 1.00 0.00 H new ATOM 0 HB2 HIS A 31 28.746 -5.455 -11.174 1.00 0.00 H new ATOM 0 HB3 HIS A 31 27.650 -5.299 -9.816 1.00 0.00 H new ATOM 0 HD2 HIS A 31 31.502 -5.100 -10.470 1.00 0.00 H new ATOM 0 HE1 HIS A 31 30.590 -2.381 -7.330 1.00 0.00 H new ATOM 0 HE2 HIS A 31 32.447 -3.275 -8.846 1.00 0.00 H new ATOM 521 N LYS A 32 27.582 -7.637 -7.765 1.00 0.00 N ATOM 522 CA LYS A 32 27.326 -7.836 -6.348 1.00 0.00 C ATOM 523 C LYS A 32 27.814 -9.211 -5.900 1.00 0.00 C ATOM 524 O LYS A 32 28.308 -9.358 -4.783 1.00 0.00 O ATOM 525 CB LYS A 32 25.826 -7.666 -6.112 1.00 0.00 C ATOM 526 CG LYS A 32 25.521 -7.364 -4.646 1.00 0.00 C ATOM 527 CD LYS A 32 24.008 -7.242 -4.474 1.00 0.00 C ATOM 528 CE LYS A 32 23.632 -6.981 -3.016 1.00 0.00 C ATOM 529 NZ LYS A 32 24.122 -5.667 -2.546 1.00 0.00 N ATOM 0 H LYS A 32 26.769 -7.796 -8.361 1.00 0.00 H new ATOM 0 HA LYS A 32 27.872 -7.102 -5.756 1.00 0.00 H new ATOM 0 HB2 LYS A 32 25.447 -6.858 -6.738 1.00 0.00 H new ATOM 0 HB3 LYS A 32 25.304 -8.574 -6.414 1.00 0.00 H new ATOM 0 HG2 LYS A 32 25.911 -8.157 -4.008 1.00 0.00 H new ATOM 0 HG3 LYS A 32 26.011 -6.440 -4.341 1.00 0.00 H new ATOM 0 HD2 LYS A 32 23.633 -6.431 -5.099 1.00 0.00 H new ATOM 0 HD3 LYS A 32 23.526 -8.157 -4.817 1.00 0.00 H new ATOM 0 HE2 LYS A 32 22.548 -7.024 -2.907 1.00 0.00 H new ATOM 0 HE3 LYS A 32 24.047 -7.769 -2.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 23.747 -5.477 -1.595 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 25.161 -5.676 -2.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 23.803 -4.923 -3.199 1.00 0.00 H new ATOM 543 N VAL A 33 27.679 -10.218 -6.768 1.00 0.00 N ATOM 544 CA VAL A 33 28.124 -11.568 -6.456 1.00 0.00 C ATOM 545 C VAL A 33 29.638 -11.673 -6.613 1.00 0.00 C ATOM 546 O VAL A 33 30.275 -12.463 -5.920 1.00 0.00 O ATOM 547 CB VAL A 33 27.388 -12.577 -7.346 1.00 0.00 C ATOM 548 CG1 VAL A 33 27.909 -12.536 -8.776 1.00 0.00 C ATOM 549 CG2 VAL A 33 27.566 -13.990 -6.792 1.00 0.00 C ATOM 0 H VAL A 33 27.263 -10.117 -7.694 1.00 0.00 H new ATOM 0 HA VAL A 33 27.885 -11.800 -5.418 1.00 0.00 H new ATOM 0 HB VAL A 33 26.332 -12.307 -7.350 1.00 0.00 H new ATOM 0 HG11 VAL A 33 27.367 -13.263 -9.382 1.00 0.00 H new ATOM 0 HG12 VAL A 33 27.762 -11.538 -9.188 1.00 0.00 H new ATOM 0 HG13 VAL A 33 28.972 -12.778 -8.783 1.00 0.00 H new ATOM 0 HG21 VAL A 33 27.040 -14.700 -7.430 1.00 0.00 H new ATOM 0 HG22 VAL A 33 28.627 -14.240 -6.768 1.00 0.00 H new ATOM 0 HG23 VAL A 33 27.159 -14.039 -5.782 1.00 0.00 H new ATOM 559 N ALA A 34 30.225 -10.882 -7.516 1.00 0.00 N ATOM 560 CA ALA A 34 31.670 -10.882 -7.695 1.00 0.00 C ATOM 561 C ALA A 34 32.354 -10.281 -6.468 1.00 0.00 C ATOM 562 O ALA A 34 33.496 -10.624 -6.170 1.00 0.00 O ATOM 563 CB ALA A 34 32.016 -10.093 -8.956 1.00 0.00 C ATOM 0 H ALA A 34 29.722 -10.240 -8.128 1.00 0.00 H new ATOM 0 HA ALA A 34 32.028 -11.905 -7.808 1.00 0.00 H new ATOM 0 HB1 ALA A 34 33.097 -10.088 -9.097 1.00 0.00 H new ATOM 0 HB2 ALA A 34 31.539 -10.559 -9.819 1.00 0.00 H new ATOM 0 HB3 ALA A 34 31.659 -9.068 -8.853 1.00 0.00 H new ATOM 569 N SER A 35 31.662 -9.391 -5.754 1.00 0.00 N ATOM 570 CA SER A 35 32.189 -8.798 -4.532 1.00 0.00 C ATOM 571 C SER A 35 32.055 -9.771 -3.364 1.00 0.00 C ATOM 572 O SER A 35 32.779 -9.651 -2.376 1.00 0.00 O ATOM 573 CB SER A 35 31.446 -7.496 -4.227 1.00 0.00 C ATOM 574 OG SER A 35 31.621 -6.572 -5.281 1.00 0.00 O ATOM 0 H SER A 35 30.729 -9.066 -6.007 1.00 0.00 H new ATOM 0 HA SER A 35 33.247 -8.579 -4.675 1.00 0.00 H new ATOM 0 HB2 SER A 35 30.385 -7.700 -4.086 1.00 0.00 H new ATOM 0 HB3 SER A 35 31.815 -7.069 -3.295 1.00 0.00 H new ATOM 0 HG SER A 35 30.984 -6.770 -5.999 1.00 0.00 H new ATOM 580 N LEU A 36 31.134 -10.734 -3.471 1.00 0.00 N ATOM 581 CA LEU A 36 30.928 -11.738 -2.440 1.00 0.00 C ATOM 582 C LEU A 36 31.904 -12.906 -2.589 1.00 0.00 C ATOM 583 O LEU A 36 32.486 -13.337 -1.595 1.00 0.00 O ATOM 584 CB LEU A 36 29.482 -12.226 -2.517 1.00 0.00 C ATOM 585 CG LEU A 36 29.206 -13.419 -1.594 1.00 0.00 C ATOM 586 CD1 LEU A 36 29.470 -13.088 -0.124 1.00 0.00 C ATOM 587 CD2 LEU A 36 27.742 -13.816 -1.747 1.00 0.00 C ATOM 0 H LEU A 36 30.515 -10.833 -4.276 1.00 0.00 H new ATOM 0 HA LEU A 36 31.118 -11.291 -1.464 1.00 0.00 H new ATOM 0 HB2 LEU A 36 28.813 -11.407 -2.254 1.00 0.00 H new ATOM 0 HB3 LEU A 36 29.253 -12.507 -3.545 1.00 0.00 H new ATOM 0 HG LEU A 36 29.877 -14.229 -1.880 1.00 0.00 H new ATOM 0 HD11 LEU A 36 29.260 -13.964 0.490 1.00 0.00 H new ATOM 0 HD12 LEU A 36 30.513 -12.798 0.002 1.00 0.00 H new ATOM 0 HD13 LEU A 36 28.825 -12.266 0.185 1.00 0.00 H new ATOM 0 HD21 LEU A 36 27.525 -14.664 -1.098 1.00 0.00 H new ATOM 0 HD22 LEU A 36 27.106 -12.975 -1.470 1.00 0.00 H new ATOM 0 HD23 LEU A 36 27.546 -14.093 -2.783 1.00 0.00 H new ATOM 599 N VAL A 37 32.102 -13.426 -3.804 1.00 0.00 N ATOM 600 CA VAL A 37 32.994 -14.571 -3.968 1.00 0.00 C ATOM 601 C VAL A 37 34.453 -14.137 -3.893 1.00 0.00 C ATOM 602 O VAL A 37 35.325 -14.957 -3.626 1.00 0.00 O ATOM 603 CB VAL A 37 32.704 -15.341 -5.261 1.00 0.00 C ATOM 604 CG1 VAL A 37 31.231 -15.730 -5.352 1.00 0.00 C ATOM 605 CG2 VAL A 37 33.094 -14.552 -6.504 1.00 0.00 C ATOM 0 H VAL A 37 31.670 -13.084 -4.662 1.00 0.00 H new ATOM 0 HA VAL A 37 32.803 -15.256 -3.142 1.00 0.00 H new ATOM 0 HB VAL A 37 33.316 -16.242 -5.223 1.00 0.00 H new ATOM 0 HG11 VAL A 37 31.055 -16.275 -6.280 1.00 0.00 H new ATOM 0 HG12 VAL A 37 30.969 -16.363 -4.504 1.00 0.00 H new ATOM 0 HG13 VAL A 37 30.616 -14.830 -5.337 1.00 0.00 H new ATOM 0 HG21 VAL A 37 32.869 -15.140 -7.394 1.00 0.00 H new ATOM 0 HG22 VAL A 37 32.531 -13.619 -6.534 1.00 0.00 H new ATOM 0 HG23 VAL A 37 34.161 -14.332 -6.475 1.00 0.00 H new ATOM 615 N SER A 38 34.735 -12.849 -4.126 1.00 0.00 N ATOM 616 CA SER A 38 36.089 -12.323 -4.004 1.00 0.00 C ATOM 617 C SER A 38 36.608 -12.487 -2.573 1.00 0.00 C ATOM 618 O SER A 38 37.808 -12.379 -2.329 1.00 0.00 O ATOM 619 CB SER A 38 36.099 -10.852 -4.426 1.00 0.00 C ATOM 620 OG SER A 38 37.408 -10.325 -4.370 1.00 0.00 O ATOM 0 H SER A 38 34.039 -12.156 -4.400 1.00 0.00 H new ATOM 0 HA SER A 38 36.754 -12.885 -4.660 1.00 0.00 H new ATOM 0 HB2 SER A 38 35.706 -10.756 -5.438 1.00 0.00 H new ATOM 0 HB3 SER A 38 35.442 -10.277 -3.774 1.00 0.00 H new ATOM 0 HG SER A 38 37.926 -10.807 -3.692 1.00 0.00 H new ATOM 626 N ARG A 39 35.706 -12.745 -1.621 1.00 0.00 N ATOM 627 CA ARG A 39 36.065 -12.950 -0.225 1.00 0.00 C ATOM 628 C ARG A 39 36.597 -14.363 0.018 1.00 0.00 C ATOM 629 O ARG A 39 37.097 -14.645 1.106 1.00 0.00 O ATOM 630 CB ARG A 39 34.841 -12.686 0.660 1.00 0.00 C ATOM 631 CG ARG A 39 34.254 -11.298 0.402 1.00 0.00 C ATOM 632 CD ARG A 39 33.037 -11.051 1.296 1.00 0.00 C ATOM 633 NE ARG A 39 33.403 -11.057 2.718 1.00 0.00 N ATOM 634 CZ ARG A 39 33.909 -10.007 3.372 1.00 0.00 C ATOM 635 NH1 ARG A 39 34.105 -8.847 2.749 1.00 0.00 N ATOM 636 NH2 ARG A 39 34.223 -10.110 4.659 1.00 0.00 N ATOM 0 H ARG A 39 34.705 -12.817 -1.803 1.00 0.00 H new ATOM 0 HA ARG A 39 36.862 -12.251 0.030 1.00 0.00 H new ATOM 0 HB2 ARG A 39 34.082 -13.445 0.469 1.00 0.00 H new ATOM 0 HB3 ARG A 39 35.123 -12.774 1.709 1.00 0.00 H new ATOM 0 HG2 ARG A 39 35.011 -10.537 0.591 1.00 0.00 H new ATOM 0 HG3 ARG A 39 33.966 -11.208 -0.645 1.00 0.00 H new ATOM 0 HD2 ARG A 39 32.585 -10.093 1.040 1.00 0.00 H new ATOM 0 HD3 ARG A 39 32.286 -11.818 1.109 1.00 0.00 H new ATOM 0 HE ARG A 39 33.262 -11.921 3.242 1.00 0.00 H new ATOM 0 HH11 ARG A 39 33.868 -8.752 1.761 1.00 0.00 H new ATOM 0 HH12 ARG A 39 34.492 -8.053 3.259 1.00 0.00 H new ATOM 0 HH21 ARG A 39 34.078 -10.992 5.150 1.00 0.00 H new ATOM 0 HH22 ARG A 39 34.609 -9.307 5.156 1.00 0.00 H new ATOM 650 N TYR A 40 36.492 -15.250 -0.979 1.00 0.00 N ATOM 651 CA TYR A 40 36.913 -16.636 -0.835 1.00 0.00 C ATOM 652 C TYR A 40 37.886 -17.075 -1.935 1.00 0.00 C ATOM 653 O TYR A 40 38.508 -18.126 -1.801 1.00 0.00 O ATOM 654 CB TYR A 40 35.672 -17.533 -0.782 1.00 0.00 C ATOM 655 CG TYR A 40 34.640 -17.058 0.217 1.00 0.00 C ATOM 656 CD1 TYR A 40 34.831 -17.299 1.586 1.00 0.00 C ATOM 657 CD2 TYR A 40 33.497 -16.369 -0.222 1.00 0.00 C ATOM 658 CE1 TYR A 40 33.891 -16.839 2.520 1.00 0.00 C ATOM 659 CE2 TYR A 40 32.553 -15.908 0.707 1.00 0.00 C ATOM 660 CZ TYR A 40 32.749 -16.139 2.083 1.00 0.00 C ATOM 661 OH TYR A 40 31.839 -15.689 2.992 1.00 0.00 O ATOM 0 H TYR A 40 36.115 -15.023 -1.899 1.00 0.00 H new ATOM 0 HA TYR A 40 37.467 -16.732 0.099 1.00 0.00 H new ATOM 0 HB2 TYR A 40 35.218 -17.575 -1.772 1.00 0.00 H new ATOM 0 HB3 TYR A 40 35.975 -18.548 -0.527 1.00 0.00 H new ATOM 0 HD1 TYR A 40 35.704 -17.840 1.921 1.00 0.00 H new ATOM 0 HD2 TYR A 40 33.345 -16.194 -1.277 1.00 0.00 H new ATOM 0 HE1 TYR A 40 34.043 -17.021 3.574 1.00 0.00 H new ATOM 0 HE2 TYR A 40 31.676 -15.376 0.368 1.00 0.00 H new ATOM 0 HH TYR A 40 31.112 -15.226 2.525 1.00 0.00 H new ATOM 671 N VAL A 41 38.030 -16.295 -3.014 1.00 0.00 N ATOM 672 CA VAL A 41 38.981 -16.609 -4.077 1.00 0.00 C ATOM 673 C VAL A 41 39.715 -15.355 -4.552 1.00 0.00 C ATOM 674 O VAL A 41 39.190 -14.249 -4.419 1.00 0.00 O ATOM 675 CB VAL A 41 38.296 -17.272 -5.280 1.00 0.00 C ATOM 676 CG1 VAL A 41 37.981 -18.738 -4.994 1.00 0.00 C ATOM 677 CG2 VAL A 41 37.007 -16.564 -5.693 1.00 0.00 C ATOM 0 H VAL A 41 37.496 -15.440 -3.170 1.00 0.00 H new ATOM 0 HA VAL A 41 39.698 -17.310 -3.651 1.00 0.00 H new ATOM 0 HB VAL A 41 39.006 -17.196 -6.104 1.00 0.00 H new ATOM 0 HG11 VAL A 41 37.496 -19.182 -5.863 1.00 0.00 H new ATOM 0 HG12 VAL A 41 38.906 -19.274 -4.781 1.00 0.00 H new ATOM 0 HG13 VAL A 41 37.316 -18.806 -4.133 1.00 0.00 H new ATOM 0 HG21 VAL A 41 36.568 -17.078 -6.548 1.00 0.00 H new ATOM 0 HG22 VAL A 41 36.303 -16.576 -4.861 1.00 0.00 H new ATOM 0 HG23 VAL A 41 37.230 -15.532 -5.965 1.00 0.00 H new ATOM 687 N PRO A 42 40.925 -15.516 -5.111 1.00 0.00 N ATOM 688 CA PRO A 42 41.679 -14.434 -5.729 1.00 0.00 C ATOM 689 C PRO A 42 40.892 -13.802 -6.872 1.00 0.00 C ATOM 690 O PRO A 42 40.015 -14.441 -7.448 1.00 0.00 O ATOM 691 CB PRO A 42 42.960 -15.078 -6.265 1.00 0.00 C ATOM 692 CG PRO A 42 43.107 -16.350 -5.438 1.00 0.00 C ATOM 693 CD PRO A 42 41.661 -16.763 -5.185 1.00 0.00 C ATOM 0 HA PRO A 42 41.888 -13.639 -5.013 1.00 0.00 H new ATOM 0 HB2 PRO A 42 42.880 -15.301 -7.329 1.00 0.00 H new ATOM 0 HB3 PRO A 42 43.820 -14.420 -6.141 1.00 0.00 H new ATOM 0 HG2 PRO A 42 43.658 -17.120 -5.977 1.00 0.00 H new ATOM 0 HG3 PRO A 42 43.643 -16.166 -4.507 1.00 0.00 H new ATOM 0 HD2 PRO A 42 41.285 -17.397 -5.988 1.00 0.00 H new ATOM 0 HD3 PRO A 42 41.569 -17.332 -4.260 1.00 0.00 H new ATOM 701 N SER A 43 41.204 -12.546 -7.206 1.00 0.00 N ATOM 702 CA SER A 43 40.506 -11.834 -8.269 1.00 0.00 C ATOM 703 C SER A 43 40.697 -12.519 -9.620 1.00 0.00 C ATOM 704 O SER A 43 39.939 -12.267 -10.556 1.00 0.00 O ATOM 705 CB SER A 43 41.028 -10.398 -8.330 1.00 0.00 C ATOM 706 OG SER A 43 42.416 -10.397 -8.584 1.00 0.00 O ATOM 0 H SER A 43 41.939 -12.004 -6.751 1.00 0.00 H new ATOM 0 HA SER A 43 39.439 -11.836 -8.048 1.00 0.00 H new ATOM 0 HB2 SER A 43 40.507 -9.846 -9.112 1.00 0.00 H new ATOM 0 HB3 SER A 43 40.822 -9.888 -7.389 1.00 0.00 H new ATOM 0 HG SER A 43 42.741 -9.473 -8.623 1.00 0.00 H new ATOM 712 N GLY A 44 41.708 -13.388 -9.725 1.00 0.00 N ATOM 713 CA GLY A 44 41.979 -14.141 -10.939 1.00 0.00 C ATOM 714 C GLY A 44 41.031 -15.330 -11.104 1.00 0.00 C ATOM 715 O GLY A 44 40.975 -15.916 -12.186 1.00 0.00 O ATOM 0 H GLY A 44 42.359 -13.584 -8.965 1.00 0.00 H new ATOM 0 HA2 GLY A 44 41.886 -13.482 -11.802 1.00 0.00 H new ATOM 0 HA3 GLY A 44 43.008 -14.499 -10.921 1.00 0.00 H new ATOM 719 N ASP A 45 40.284 -15.691 -10.053 1.00 0.00 N ATOM 720 CA ASP A 45 39.348 -16.808 -10.095 1.00 0.00 C ATOM 721 C ASP A 45 37.905 -16.361 -9.847 1.00 0.00 C ATOM 722 O ASP A 45 36.986 -17.174 -9.932 1.00 0.00 O ATOM 723 CB ASP A 45 39.784 -17.871 -9.086 1.00 0.00 C ATOM 724 CG ASP A 45 41.180 -18.399 -9.408 1.00 0.00 C ATOM 725 OD1 ASP A 45 41.350 -18.948 -10.521 1.00 0.00 O ATOM 726 OD2 ASP A 45 42.070 -18.256 -8.540 1.00 0.00 O ATOM 0 H ASP A 45 40.316 -15.213 -9.152 1.00 0.00 H new ATOM 0 HA ASP A 45 39.366 -17.236 -11.097 1.00 0.00 H new ATOM 0 HB2 ASP A 45 39.775 -17.448 -8.082 1.00 0.00 H new ATOM 0 HB3 ASP A 45 39.071 -18.695 -9.091 1.00 0.00 H new ATOM 731 N VAL A 46 37.686 -15.074 -9.544 1.00 0.00 N ATOM 732 CA VAL A 46 36.344 -14.546 -9.320 1.00 0.00 C ATOM 733 C VAL A 46 35.436 -14.751 -10.533 1.00 0.00 C ATOM 734 O VAL A 46 34.331 -15.251 -10.353 1.00 0.00 O ATOM 735 CB VAL A 46 36.419 -13.063 -8.935 1.00 0.00 C ATOM 736 CG1 VAL A 46 35.041 -12.404 -8.970 1.00 0.00 C ATOM 737 CG2 VAL A 46 36.952 -12.921 -7.515 1.00 0.00 C ATOM 0 H VAL A 46 38.428 -14.381 -9.449 1.00 0.00 H new ATOM 0 HA VAL A 46 35.900 -15.104 -8.496 1.00 0.00 H new ATOM 0 HB VAL A 46 37.077 -12.579 -9.656 1.00 0.00 H new ATOM 0 HG11 VAL A 46 35.133 -11.354 -8.692 1.00 0.00 H new ATOM 0 HG12 VAL A 46 34.628 -12.478 -9.976 1.00 0.00 H new ATOM 0 HG13 VAL A 46 34.378 -12.909 -8.267 1.00 0.00 H new ATOM 0 HG21 VAL A 46 37.002 -11.865 -7.249 1.00 0.00 H new ATOM 0 HG22 VAL A 46 36.287 -13.438 -6.823 1.00 0.00 H new ATOM 0 HG23 VAL A 46 37.949 -13.358 -7.455 1.00 0.00 H new ATOM 747 N PRO A 47 35.837 -14.388 -11.761 1.00 0.00 N ATOM 748 CA PRO A 47 34.940 -14.468 -12.904 1.00 0.00 C ATOM 749 C PRO A 47 34.574 -15.913 -13.246 1.00 0.00 C ATOM 750 O PRO A 47 33.545 -16.148 -13.876 1.00 0.00 O ATOM 751 CB PRO A 47 35.696 -13.797 -14.052 1.00 0.00 C ATOM 752 CG PRO A 47 37.161 -13.997 -13.679 1.00 0.00 C ATOM 753 CD PRO A 47 37.130 -13.860 -12.160 1.00 0.00 C ATOM 0 HA PRO A 47 33.989 -13.976 -12.698 1.00 0.00 H new ATOM 0 HB2 PRO A 47 35.460 -14.257 -15.011 1.00 0.00 H new ATOM 0 HB3 PRO A 47 35.444 -12.740 -14.135 1.00 0.00 H new ATOM 0 HG2 PRO A 47 37.531 -14.973 -13.992 1.00 0.00 H new ATOM 0 HG3 PRO A 47 37.805 -13.249 -14.142 1.00 0.00 H new ATOM 0 HD2 PRO A 47 37.944 -14.418 -11.697 1.00 0.00 H new ATOM 0 HD3 PRO A 47 37.243 -12.820 -11.855 1.00 0.00 H new ATOM 761 N ASP A 48 35.395 -16.882 -12.840 1.00 0.00 N ATOM 762 CA ASP A 48 35.100 -18.287 -13.096 1.00 0.00 C ATOM 763 C ASP A 48 34.168 -18.849 -12.025 1.00 0.00 C ATOM 764 O ASP A 48 33.355 -19.729 -12.308 1.00 0.00 O ATOM 765 CB ASP A 48 36.410 -19.076 -13.141 1.00 0.00 C ATOM 766 CG ASP A 48 37.288 -18.622 -14.301 1.00 0.00 C ATOM 767 OD1 ASP A 48 36.997 -19.044 -15.441 1.00 0.00 O ATOM 768 OD2 ASP A 48 38.242 -17.853 -14.038 1.00 0.00 O ATOM 0 H ASP A 48 36.266 -16.718 -12.335 1.00 0.00 H new ATOM 0 HA ASP A 48 34.592 -18.377 -14.056 1.00 0.00 H new ATOM 0 HB2 ASP A 48 36.948 -18.946 -12.202 1.00 0.00 H new ATOM 0 HB3 ASP A 48 36.194 -20.140 -13.240 1.00 0.00 H new ATOM 773 N VAL A 49 34.278 -18.345 -10.793 1.00 0.00 N ATOM 774 CA VAL A 49 33.438 -18.790 -9.690 1.00 0.00 C ATOM 775 C VAL A 49 32.079 -18.100 -9.751 1.00 0.00 C ATOM 776 O VAL A 49 31.082 -18.653 -9.290 1.00 0.00 O ATOM 777 CB VAL A 49 34.169 -18.519 -8.370 1.00 0.00 C ATOM 778 CG1 VAL A 49 33.270 -18.764 -7.158 1.00 0.00 C ATOM 779 CG2 VAL A 49 35.369 -19.459 -8.253 1.00 0.00 C ATOM 0 H VAL A 49 34.950 -17.621 -10.538 1.00 0.00 H new ATOM 0 HA VAL A 49 33.251 -19.861 -9.763 1.00 0.00 H new ATOM 0 HB VAL A 49 34.477 -17.473 -8.379 1.00 0.00 H new ATOM 0 HG11 VAL A 49 33.828 -18.560 -6.244 1.00 0.00 H new ATOM 0 HG12 VAL A 49 32.403 -18.105 -7.209 1.00 0.00 H new ATOM 0 HG13 VAL A 49 32.937 -19.802 -7.156 1.00 0.00 H new ATOM 0 HG21 VAL A 49 35.891 -19.268 -7.315 1.00 0.00 H new ATOM 0 HG22 VAL A 49 35.025 -20.493 -8.273 1.00 0.00 H new ATOM 0 HG23 VAL A 49 36.049 -19.287 -9.088 1.00 0.00 H new ATOM 789 N VAL A 50 32.020 -16.891 -10.320 1.00 0.00 N ATOM 790 CA VAL A 50 30.757 -16.192 -10.508 1.00 0.00 C ATOM 791 C VAL A 50 29.960 -16.861 -11.623 1.00 0.00 C ATOM 792 O VAL A 50 28.735 -16.934 -11.541 1.00 0.00 O ATOM 793 CB VAL A 50 31.024 -14.719 -10.829 1.00 0.00 C ATOM 794 CG1 VAL A 50 29.752 -14.026 -11.316 1.00 0.00 C ATOM 795 CG2 VAL A 50 31.524 -13.994 -9.584 1.00 0.00 C ATOM 0 H VAL A 50 32.837 -16.381 -10.657 1.00 0.00 H new ATOM 0 HA VAL A 50 30.170 -16.241 -9.591 1.00 0.00 H new ATOM 0 HB VAL A 50 31.778 -14.682 -11.615 1.00 0.00 H new ATOM 0 HG11 VAL A 50 29.969 -12.981 -11.537 1.00 0.00 H new ATOM 0 HG12 VAL A 50 29.391 -14.520 -12.218 1.00 0.00 H new ATOM 0 HG13 VAL A 50 28.988 -14.082 -10.541 1.00 0.00 H new ATOM 0 HG21 VAL A 50 31.711 -12.947 -9.823 1.00 0.00 H new ATOM 0 HG22 VAL A 50 30.771 -14.058 -8.799 1.00 0.00 H new ATOM 0 HG23 VAL A 50 32.448 -14.458 -9.239 1.00 0.00 H new ATOM 805 N GLN A 51 30.639 -17.356 -12.663 1.00 0.00 N ATOM 806 CA GLN A 51 29.965 -18.071 -13.734 1.00 0.00 C ATOM 807 C GLN A 51 29.524 -19.450 -13.258 1.00 0.00 C ATOM 808 O GLN A 51 28.619 -20.039 -13.841 1.00 0.00 O ATOM 809 CB GLN A 51 30.893 -18.194 -14.944 1.00 0.00 C ATOM 810 CG GLN A 51 30.853 -16.891 -15.743 1.00 0.00 C ATOM 811 CD GLN A 51 31.836 -16.924 -16.904 1.00 0.00 C ATOM 812 OE1 GLN A 51 31.460 -17.186 -18.042 1.00 0.00 O ATOM 813 NE2 GLN A 51 33.106 -16.651 -16.624 1.00 0.00 N ATOM 0 H GLN A 51 31.649 -17.272 -12.779 1.00 0.00 H new ATOM 0 HA GLN A 51 29.077 -17.510 -14.027 1.00 0.00 H new ATOM 0 HB2 GLN A 51 31.911 -18.403 -14.616 1.00 0.00 H new ATOM 0 HB3 GLN A 51 30.583 -19.029 -15.572 1.00 0.00 H new ATOM 0 HG2 GLN A 51 29.845 -16.725 -16.122 1.00 0.00 H new ATOM 0 HG3 GLN A 51 31.089 -16.053 -15.088 1.00 0.00 H new ATOM 0 HE21 GLN A 51 33.382 -16.437 -15.666 1.00 0.00 H new ATOM 0 HE22 GLN A 51 33.804 -16.655 -17.367 1.00 0.00 H new ATOM 822 N GLU A 52 30.143 -19.984 -12.204 1.00 0.00 N ATOM 823 CA GLU A 52 29.695 -21.250 -11.653 1.00 0.00 C ATOM 824 C GLU A 52 28.530 -21.023 -10.685 1.00 0.00 C ATOM 825 O GLU A 52 27.766 -21.947 -10.411 1.00 0.00 O ATOM 826 CB GLU A 52 30.881 -21.949 -10.984 1.00 0.00 C ATOM 827 CG GLU A 52 30.534 -23.396 -10.641 1.00 0.00 C ATOM 828 CD GLU A 52 31.756 -24.140 -10.105 1.00 0.00 C ATOM 829 OE1 GLU A 52 32.724 -24.292 -10.882 1.00 0.00 O ATOM 830 OE2 GLU A 52 31.713 -24.553 -8.925 1.00 0.00 O ATOM 0 H GLU A 52 30.941 -19.564 -11.727 1.00 0.00 H new ATOM 0 HA GLU A 52 29.324 -21.899 -12.446 1.00 0.00 H new ATOM 0 HB2 GLU A 52 31.745 -21.925 -11.648 1.00 0.00 H new ATOM 0 HB3 GLU A 52 31.161 -21.413 -10.077 1.00 0.00 H new ATOM 0 HG2 GLU A 52 29.737 -23.416 -9.898 1.00 0.00 H new ATOM 0 HG3 GLU A 52 30.155 -23.903 -11.529 1.00 0.00 H new ATOM 837 N ALA A 53 28.386 -19.799 -10.168 1.00 0.00 N ATOM 838 CA ALA A 53 27.321 -19.477 -9.234 1.00 0.00 C ATOM 839 C ALA A 53 26.013 -19.160 -9.962 1.00 0.00 C ATOM 840 O ALA A 53 24.941 -19.479 -9.450 1.00 0.00 O ATOM 841 CB ALA A 53 27.765 -18.297 -8.367 1.00 0.00 C ATOM 0 H ALA A 53 29.001 -19.016 -10.387 1.00 0.00 H new ATOM 0 HA ALA A 53 27.128 -20.344 -8.602 1.00 0.00 H new ATOM 0 HB1 ALA A 53 26.973 -18.046 -7.661 1.00 0.00 H new ATOM 0 HB2 ALA A 53 28.667 -18.568 -7.819 1.00 0.00 H new ATOM 0 HB3 ALA A 53 27.971 -17.436 -9.003 1.00 0.00 H new ATOM 847 N PHE A 54 26.085 -18.545 -11.148 1.00 0.00 N ATOM 848 CA PHE A 54 24.886 -18.241 -11.915 1.00 0.00 C ATOM 849 C PHE A 54 24.413 -19.463 -12.695 1.00 0.00 C ATOM 850 O PHE A 54 23.215 -19.629 -12.904 1.00 0.00 O ATOM 851 CB PHE A 54 25.146 -17.077 -12.872 1.00 0.00 C ATOM 852 CG PHE A 54 25.167 -15.714 -12.216 1.00 0.00 C ATOM 853 CD1 PHE A 54 24.031 -15.241 -11.542 1.00 0.00 C ATOM 854 CD2 PHE A 54 26.315 -14.915 -12.294 1.00 0.00 C ATOM 855 CE1 PHE A 54 24.044 -13.965 -10.961 1.00 0.00 C ATOM 856 CE2 PHE A 54 26.324 -13.641 -11.717 1.00 0.00 C ATOM 857 CZ PHE A 54 25.189 -13.168 -11.049 1.00 0.00 C ATOM 0 H PHE A 54 26.957 -18.253 -11.589 1.00 0.00 H new ATOM 0 HA PHE A 54 24.101 -17.955 -11.214 1.00 0.00 H new ATOM 0 HB2 PHE A 54 26.101 -17.240 -13.370 1.00 0.00 H new ATOM 0 HB3 PHE A 54 24.378 -17.081 -13.646 1.00 0.00 H new ATOM 0 HD1 PHE A 54 23.148 -15.859 -11.471 1.00 0.00 H new ATOM 0 HD2 PHE A 54 27.195 -15.283 -12.801 1.00 0.00 H new ATOM 0 HE1 PHE A 54 23.169 -13.598 -10.445 1.00 0.00 H new ATOM 0 HE2 PHE A 54 27.207 -13.023 -11.787 1.00 0.00 H new ATOM 0 HZ PHE A 54 25.198 -12.185 -10.601 1.00 0.00 H new ATOM 867 N ILE A 55 25.336 -20.325 -13.133 1.00 0.00 N ATOM 868 CA ILE A 55 24.956 -21.511 -13.888 1.00 0.00 C ATOM 869 C ILE A 55 24.366 -22.557 -12.944 1.00 0.00 C ATOM 870 O ILE A 55 23.508 -23.340 -13.351 1.00 0.00 O ATOM 871 CB ILE A 55 26.173 -22.019 -14.669 1.00 0.00 C ATOM 872 CG1 ILE A 55 26.380 -21.239 -15.981 1.00 0.00 C ATOM 873 CG2 ILE A 55 26.024 -23.496 -15.033 1.00 0.00 C ATOM 874 CD1 ILE A 55 26.188 -19.726 -15.866 1.00 0.00 C ATOM 0 H ILE A 55 26.339 -20.221 -12.978 1.00 0.00 H new ATOM 0 HA ILE A 55 24.179 -21.277 -14.616 1.00 0.00 H new ATOM 0 HB ILE A 55 27.030 -21.873 -14.012 1.00 0.00 H new ATOM 0 HG12 ILE A 55 27.387 -21.436 -16.349 1.00 0.00 H new ATOM 0 HG13 ILE A 55 25.686 -21.623 -16.729 1.00 0.00 H new ATOM 0 HG21 ILE A 55 26.904 -23.825 -15.586 1.00 0.00 H new ATOM 0 HG22 ILE A 55 25.926 -24.087 -14.122 1.00 0.00 H new ATOM 0 HG23 ILE A 55 25.136 -23.631 -15.650 1.00 0.00 H new ATOM 0 HD11 ILE A 55 26.354 -19.263 -16.839 1.00 0.00 H new ATOM 0 HD12 ILE A 55 25.173 -19.512 -15.531 1.00 0.00 H new ATOM 0 HD13 ILE A 55 26.900 -19.323 -15.146 1.00 0.00 H new ATOM 886 N LYS A 56 24.809 -22.579 -11.682 1.00 0.00 N ATOM 887 CA LYS A 56 24.225 -23.467 -10.688 1.00 0.00 C ATOM 888 C LYS A 56 22.852 -22.952 -10.286 1.00 0.00 C ATOM 889 O LYS A 56 21.964 -23.737 -9.963 1.00 0.00 O ATOM 890 CB LYS A 56 25.159 -23.551 -9.479 1.00 0.00 C ATOM 891 CG LYS A 56 24.698 -24.596 -8.457 1.00 0.00 C ATOM 892 CD LYS A 56 24.698 -26.001 -9.063 1.00 0.00 C ATOM 893 CE LYS A 56 24.392 -27.053 -7.997 1.00 0.00 C ATOM 894 NZ LYS A 56 25.401 -27.037 -6.922 1.00 0.00 N ATOM 0 H LYS A 56 25.567 -21.992 -11.332 1.00 0.00 H new ATOM 0 HA LYS A 56 24.103 -24.467 -11.104 1.00 0.00 H new ATOM 0 HB2 LYS A 56 26.166 -23.797 -9.817 1.00 0.00 H new ATOM 0 HB3 LYS A 56 25.214 -22.575 -8.997 1.00 0.00 H new ATOM 0 HG2 LYS A 56 25.355 -24.572 -7.587 1.00 0.00 H new ATOM 0 HG3 LYS A 56 23.696 -24.348 -8.107 1.00 0.00 H new ATOM 0 HD2 LYS A 56 23.956 -26.058 -9.860 1.00 0.00 H new ATOM 0 HD3 LYS A 56 25.668 -26.207 -9.515 1.00 0.00 H new ATOM 0 HE2 LYS A 56 23.404 -26.869 -7.574 1.00 0.00 H new ATOM 0 HE3 LYS A 56 24.363 -28.041 -8.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 25.683 -28.012 -6.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 26.234 -26.499 -7.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 24.998 -26.588 -6.075 1.00 0.00 H new ATOM 908 N ALA A 57 22.674 -21.629 -10.309 1.00 0.00 N ATOM 909 CA ALA A 57 21.401 -21.021 -9.984 1.00 0.00 C ATOM 910 C ALA A 57 20.413 -21.192 -11.134 1.00 0.00 C ATOM 911 O ALA A 57 19.215 -21.301 -10.890 1.00 0.00 O ATOM 912 CB ALA A 57 21.624 -19.541 -9.680 1.00 0.00 C ATOM 0 H ALA A 57 23.407 -20.962 -10.552 1.00 0.00 H new ATOM 0 HA ALA A 57 20.976 -21.512 -9.108 1.00 0.00 H new ATOM 0 HB1 ALA A 57 20.671 -19.073 -9.434 1.00 0.00 H new ATOM 0 HB2 ALA A 57 22.306 -19.442 -8.836 1.00 0.00 H new ATOM 0 HB3 ALA A 57 22.054 -19.051 -10.553 1.00 0.00 H new ATOM 918 N TYR A 58 20.887 -21.220 -12.382 1.00 0.00 N ATOM 919 CA TYR A 58 20.004 -21.340 -13.532 1.00 0.00 C ATOM 920 C TYR A 58 19.260 -22.671 -13.526 1.00 0.00 C ATOM 921 O TYR A 58 18.075 -22.724 -13.855 1.00 0.00 O ATOM 922 CB TYR A 58 20.829 -21.221 -14.809 1.00 0.00 C ATOM 923 CG TYR A 58 20.007 -21.405 -16.064 1.00 0.00 C ATOM 924 CD1 TYR A 58 19.055 -20.441 -16.427 1.00 0.00 C ATOM 925 CD2 TYR A 58 20.193 -22.547 -16.856 1.00 0.00 C ATOM 926 CE1 TYR A 58 18.277 -20.614 -17.580 1.00 0.00 C ATOM 927 CE2 TYR A 58 19.424 -22.725 -18.013 1.00 0.00 C ATOM 928 CZ TYR A 58 18.461 -21.762 -18.379 1.00 0.00 C ATOM 929 OH TYR A 58 17.712 -21.947 -19.502 1.00 0.00 O ATOM 0 H TYR A 58 21.878 -21.161 -12.616 1.00 0.00 H new ATOM 0 HA TYR A 58 19.264 -20.541 -13.484 1.00 0.00 H new ATOM 0 HB2 TYR A 58 21.308 -20.242 -14.835 1.00 0.00 H new ATOM 0 HB3 TYR A 58 21.625 -21.965 -14.791 1.00 0.00 H new ATOM 0 HD1 TYR A 58 18.921 -19.561 -15.815 1.00 0.00 H new ATOM 0 HD2 TYR A 58 20.927 -23.287 -16.575 1.00 0.00 H new ATOM 0 HE1 TYR A 58 17.541 -19.873 -17.855 1.00 0.00 H new ATOM 0 HE2 TYR A 58 19.569 -23.602 -18.626 1.00 0.00 H new ATOM 0 HH TYR A 58 17.970 -22.789 -19.932 1.00 0.00 H new ATOM 939 N ARG A 59 19.953 -23.747 -13.146 1.00 0.00 N ATOM 940 CA ARG A 59 19.359 -25.080 -13.099 1.00 0.00 C ATOM 941 C ARG A 59 18.772 -25.424 -11.731 1.00 0.00 C ATOM 942 O ARG A 59 18.152 -26.477 -11.584 1.00 0.00 O ATOM 943 CB ARG A 59 20.372 -26.121 -13.577 1.00 0.00 C ATOM 944 CG ARG A 59 21.635 -26.147 -12.713 1.00 0.00 C ATOM 945 CD ARG A 59 22.687 -27.009 -13.411 1.00 0.00 C ATOM 946 NE ARG A 59 23.997 -26.903 -12.755 1.00 0.00 N ATOM 947 CZ ARG A 59 24.871 -27.910 -12.638 1.00 0.00 C ATOM 948 NH1 ARG A 59 24.585 -29.126 -13.096 1.00 0.00 N ATOM 949 NH2 ARG A 59 26.046 -27.699 -12.054 1.00 0.00 N ATOM 0 H ARG A 59 20.933 -23.717 -12.865 1.00 0.00 H new ATOM 0 HA ARG A 59 18.509 -25.089 -13.782 1.00 0.00 H new ATOM 0 HB2 ARG A 59 19.908 -27.107 -13.566 1.00 0.00 H new ATOM 0 HB3 ARG A 59 20.646 -25.909 -14.610 1.00 0.00 H new ATOM 0 HG2 ARG A 59 22.013 -25.135 -12.565 1.00 0.00 H new ATOM 0 HG3 ARG A 59 21.410 -26.551 -11.726 1.00 0.00 H new ATOM 0 HD2 ARG A 59 22.363 -28.050 -13.411 1.00 0.00 H new ATOM 0 HD3 ARG A 59 22.776 -26.702 -14.453 1.00 0.00 H new ATOM 0 HE ARG A 59 24.259 -25.999 -12.361 1.00 0.00 H new ATOM 0 HH11 ARG A 59 23.687 -29.303 -13.546 1.00 0.00 H new ATOM 0 HH12 ARG A 59 25.264 -29.881 -12.998 1.00 0.00 H new ATOM 0 HH21 ARG A 59 26.279 -26.772 -11.697 1.00 0.00 H new ATOM 0 HH22 ARG A 59 26.715 -28.464 -11.963 1.00 0.00 H new ATOM 963 N ALA A 60 18.958 -24.556 -10.734 1.00 0.00 N ATOM 964 CA ALA A 60 18.370 -24.753 -9.414 1.00 0.00 C ATOM 965 C ALA A 60 17.239 -23.756 -9.130 1.00 0.00 C ATOM 966 O ALA A 60 16.585 -23.844 -8.094 1.00 0.00 O ATOM 967 CB ALA A 60 19.470 -24.658 -8.360 1.00 0.00 C ATOM 0 H ALA A 60 19.515 -23.706 -10.820 1.00 0.00 H new ATOM 0 HA ALA A 60 17.918 -25.744 -9.380 1.00 0.00 H new ATOM 0 HB1 ALA A 60 19.039 -24.804 -7.370 1.00 0.00 H new ATOM 0 HB2 ALA A 60 20.220 -25.427 -8.546 1.00 0.00 H new ATOM 0 HB3 ALA A 60 19.938 -23.675 -8.410 1.00 0.00 H new ATOM 973 N LEU A 61 17.000 -22.808 -10.040 1.00 0.00 N ATOM 974 CA LEU A 61 15.978 -21.783 -9.866 1.00 0.00 C ATOM 975 C LEU A 61 14.591 -22.334 -10.178 1.00 0.00 C ATOM 976 O LEU A 61 13.586 -21.740 -9.788 1.00 0.00 O ATOM 977 CB LEU A 61 16.378 -20.581 -10.731 1.00 0.00 C ATOM 978 CG LEU A 61 15.358 -19.443 -10.800 1.00 0.00 C ATOM 979 CD1 LEU A 61 16.122 -18.152 -11.086 1.00 0.00 C ATOM 980 CD2 LEU A 61 14.366 -19.640 -11.946 1.00 0.00 C ATOM 0 H LEU A 61 17.513 -22.733 -10.918 1.00 0.00 H new ATOM 0 HA LEU A 61 15.917 -21.455 -8.828 1.00 0.00 H new ATOM 0 HB2 LEU A 61 17.317 -20.180 -10.350 1.00 0.00 H new ATOM 0 HB3 LEU A 61 16.570 -20.934 -11.744 1.00 0.00 H new ATOM 0 HG LEU A 61 14.811 -19.414 -9.858 1.00 0.00 H new ATOM 0 HD11 LEU A 61 15.421 -17.319 -11.141 1.00 0.00 H new ATOM 0 HD12 LEU A 61 16.840 -17.969 -10.287 1.00 0.00 H new ATOM 0 HD13 LEU A 61 16.651 -18.245 -12.035 1.00 0.00 H new ATOM 0 HD21 LEU A 61 13.658 -18.811 -11.961 1.00 0.00 H new ATOM 0 HD22 LEU A 61 14.906 -19.674 -12.892 1.00 0.00 H new ATOM 0 HD23 LEU A 61 13.826 -20.576 -11.803 1.00 0.00 H new ATOM 992 N ASP A 62 14.517 -23.471 -10.877 1.00 0.00 N ATOM 993 CA ASP A 62 13.246 -24.091 -11.222 1.00 0.00 C ATOM 994 C ASP A 62 12.563 -24.683 -9.984 1.00 0.00 C ATOM 995 O ASP A 62 11.394 -25.058 -10.044 1.00 0.00 O ATOM 996 CB ASP A 62 13.497 -25.151 -12.292 1.00 0.00 C ATOM 997 CG ASP A 62 12.195 -25.762 -12.800 1.00 0.00 C ATOM 998 OD1 ASP A 62 11.389 -25.001 -13.382 1.00 0.00 O ATOM 999 OD2 ASP A 62 12.011 -26.985 -12.607 1.00 0.00 O ATOM 0 H ASP A 62 15.334 -23.980 -11.215 1.00 0.00 H new ATOM 0 HA ASP A 62 12.565 -23.338 -11.618 1.00 0.00 H new ATOM 0 HB2 ASP A 62 14.039 -24.705 -13.126 1.00 0.00 H new ATOM 0 HB3 ASP A 62 14.132 -25.937 -11.883 1.00 0.00 H new ATOM 1004 N SER A 63 13.286 -24.767 -8.863 1.00 0.00 N ATOM 1005 CA SER A 63 12.754 -25.256 -7.600 1.00 0.00 C ATOM 1006 C SER A 63 12.735 -24.153 -6.542 1.00 0.00 C ATOM 1007 O SER A 63 12.464 -24.422 -5.373 1.00 0.00 O ATOM 1008 CB SER A 63 13.555 -26.472 -7.137 1.00 0.00 C ATOM 1009 OG SER A 63 14.910 -26.120 -6.955 1.00 0.00 O ATOM 0 H SER A 63 14.267 -24.493 -8.813 1.00 0.00 H new ATOM 0 HA SER A 63 11.719 -25.565 -7.750 1.00 0.00 H new ATOM 0 HB2 SER A 63 13.142 -26.855 -6.204 1.00 0.00 H new ATOM 0 HB3 SER A 63 13.475 -27.272 -7.873 1.00 0.00 H new ATOM 0 HG SER A 63 15.415 -26.905 -6.657 1.00 0.00 H new ATOM 1015 N PHE A 64 13.021 -22.904 -6.933 1.00 0.00 N ATOM 1016 CA PHE A 64 12.981 -21.774 -6.019 1.00 0.00 C ATOM 1017 C PHE A 64 11.536 -21.524 -5.589 1.00 0.00 C ATOM 1018 O PHE A 64 10.645 -21.448 -6.435 1.00 0.00 O ATOM 1019 CB PHE A 64 13.581 -20.548 -6.708 1.00 0.00 C ATOM 1020 CG PHE A 64 13.572 -19.295 -5.866 1.00 0.00 C ATOM 1021 CD1 PHE A 64 14.431 -19.184 -4.764 1.00 0.00 C ATOM 1022 CD2 PHE A 64 12.711 -18.237 -6.194 1.00 0.00 C ATOM 1023 CE1 PHE A 64 14.429 -18.015 -3.989 1.00 0.00 C ATOM 1024 CE2 PHE A 64 12.716 -17.065 -5.425 1.00 0.00 C ATOM 1025 CZ PHE A 64 13.573 -16.956 -4.325 1.00 0.00 C ATOM 0 H PHE A 64 13.284 -22.658 -7.887 1.00 0.00 H new ATOM 0 HA PHE A 64 13.569 -21.985 -5.126 1.00 0.00 H new ATOM 0 HB2 PHE A 64 14.609 -20.773 -6.993 1.00 0.00 H new ATOM 0 HB3 PHE A 64 13.029 -20.357 -7.629 1.00 0.00 H new ATOM 0 HD1 PHE A 64 15.094 -19.998 -4.512 1.00 0.00 H new ATOM 0 HD2 PHE A 64 12.044 -18.326 -7.039 1.00 0.00 H new ATOM 0 HE1 PHE A 64 15.085 -17.930 -3.135 1.00 0.00 H new ATOM 0 HE2 PHE A 64 12.059 -16.247 -5.682 1.00 0.00 H new ATOM 0 HZ PHE A 64 13.576 -16.053 -3.732 1.00 0.00 H new ATOM 1035 N ARG A 65 11.311 -21.401 -4.277 1.00 0.00 N ATOM 1036 CA ARG A 65 9.971 -21.283 -3.715 1.00 0.00 C ATOM 1037 C ARG A 65 9.585 -19.842 -3.391 1.00 0.00 C ATOM 1038 O ARG A 65 8.405 -19.561 -3.194 1.00 0.00 O ATOM 1039 CB ARG A 65 9.864 -22.156 -2.461 1.00 0.00 C ATOM 1040 CG ARG A 65 10.179 -23.619 -2.781 1.00 0.00 C ATOM 1041 CD ARG A 65 9.991 -24.484 -1.534 1.00 0.00 C ATOM 1042 NE ARG A 65 10.847 -24.023 -0.434 1.00 0.00 N ATOM 1043 CZ ARG A 65 12.018 -24.562 -0.089 1.00 0.00 C ATOM 1044 NH1 ARG A 65 12.506 -25.620 -0.735 1.00 0.00 N ATOM 1045 NH2 ARG A 65 12.708 -24.033 0.915 1.00 0.00 N ATOM 0 H ARG A 65 12.055 -21.381 -3.579 1.00 0.00 H new ATOM 0 HA ARG A 65 9.269 -21.628 -4.474 1.00 0.00 H new ATOM 0 HB2 ARG A 65 10.553 -21.790 -1.700 1.00 0.00 H new ATOM 0 HB3 ARG A 65 8.859 -22.079 -2.045 1.00 0.00 H new ATOM 0 HG2 ARG A 65 9.527 -23.973 -3.580 1.00 0.00 H new ATOM 0 HG3 ARG A 65 11.203 -23.707 -3.143 1.00 0.00 H new ATOM 0 HD2 ARG A 65 8.947 -24.455 -1.222 1.00 0.00 H new ATOM 0 HD3 ARG A 65 10.225 -25.522 -1.770 1.00 0.00 H new ATOM 0 HE ARG A 65 10.520 -23.225 0.111 1.00 0.00 H new ATOM 0 HH11 ARG A 65 11.983 -26.032 -1.508 1.00 0.00 H new ATOM 0 HH12 ARG A 65 13.403 -26.018 -0.457 1.00 0.00 H new ATOM 0 HH21 ARG A 65 12.342 -23.222 1.414 1.00 0.00 H new ATOM 0 HH22 ARG A 65 13.604 -24.437 1.187 1.00 0.00 H new ATOM 1059 N GLY A 66 10.557 -18.928 -3.330 1.00 0.00 N ATOM 1060 CA GLY A 66 10.273 -17.534 -3.017 1.00 0.00 C ATOM 1061 C GLY A 66 10.084 -17.330 -1.514 1.00 0.00 C ATOM 1062 O GLY A 66 9.435 -16.371 -1.102 1.00 0.00 O ATOM 0 H GLY A 66 11.543 -19.132 -3.493 1.00 0.00 H new ATOM 0 HA2 GLY A 66 11.090 -16.906 -3.372 1.00 0.00 H new ATOM 0 HA3 GLY A 66 9.374 -17.216 -3.545 1.00 0.00 H new ATOM 1066 N ASP A 67 10.649 -18.229 -0.702 1.00 0.00 N ATOM 1067 CA ASP A 67 10.568 -18.151 0.751 1.00 0.00 C ATOM 1068 C ASP A 67 11.355 -16.952 1.286 1.00 0.00 C ATOM 1069 O ASP A 67 11.259 -16.622 2.468 1.00 0.00 O ATOM 1070 CB ASP A 67 11.116 -19.454 1.340 1.00 0.00 C ATOM 1071 CG ASP A 67 10.160 -20.630 1.174 1.00 0.00 C ATOM 1072 OD1 ASP A 67 8.937 -20.388 1.076 1.00 0.00 O ATOM 1073 OD2 ASP A 67 10.668 -21.773 1.151 1.00 0.00 O ATOM 0 H ASP A 67 11.177 -19.033 -1.041 1.00 0.00 H new ATOM 0 HA ASP A 67 9.527 -18.015 1.046 1.00 0.00 H new ATOM 0 HB2 ASP A 67 12.065 -19.693 0.859 1.00 0.00 H new ATOM 0 HB3 ASP A 67 11.324 -19.308 2.400 1.00 0.00 H new ATOM 1078 N SER A 68 12.130 -16.299 0.415 1.00 0.00 N ATOM 1079 CA SER A 68 12.917 -15.124 0.747 1.00 0.00 C ATOM 1080 C SER A 68 13.200 -14.336 -0.530 1.00 0.00 C ATOM 1081 O SER A 68 12.893 -14.799 -1.630 1.00 0.00 O ATOM 1082 CB SER A 68 14.221 -15.570 1.402 1.00 0.00 C ATOM 1083 OG SER A 68 15.039 -14.465 1.710 1.00 0.00 O ATOM 0 H SER A 68 12.225 -16.585 -0.560 1.00 0.00 H new ATOM 0 HA SER A 68 12.373 -14.484 1.442 1.00 0.00 H new ATOM 0 HB2 SER A 68 14.002 -16.129 2.312 1.00 0.00 H new ATOM 0 HB3 SER A 68 14.754 -16.246 0.734 1.00 0.00 H new ATOM 0 HG SER A 68 15.204 -14.439 2.676 1.00 0.00 H new ATOM 1089 N ALA A 69 13.790 -13.146 -0.392 1.00 0.00 N ATOM 1090 CA ALA A 69 14.206 -12.346 -1.529 1.00 0.00 C ATOM 1091 C ALA A 69 15.202 -13.148 -2.368 1.00 0.00 C ATOM 1092 O ALA A 69 15.914 -14.008 -1.845 1.00 0.00 O ATOM 1093 CB ALA A 69 14.823 -11.033 -1.042 1.00 0.00 C ATOM 0 H ALA A 69 13.989 -12.718 0.512 1.00 0.00 H new ATOM 0 HA ALA A 69 13.344 -12.102 -2.150 1.00 0.00 H new ATOM 0 HB1 ALA A 69 15.133 -10.437 -1.900 1.00 0.00 H new ATOM 0 HB2 ALA A 69 14.086 -10.478 -0.462 1.00 0.00 H new ATOM 0 HB3 ALA A 69 15.690 -11.248 -0.417 1.00 0.00 H new ATOM 1099 N PHE A 70 15.260 -12.878 -3.674 1.00 0.00 N ATOM 1100 CA PHE A 70 16.065 -13.697 -4.563 1.00 0.00 C ATOM 1101 C PHE A 70 17.551 -13.641 -4.224 1.00 0.00 C ATOM 1102 O PHE A 70 18.250 -14.639 -4.398 1.00 0.00 O ATOM 1103 CB PHE A 70 15.836 -13.263 -6.007 1.00 0.00 C ATOM 1104 CG PHE A 70 16.640 -14.088 -6.982 1.00 0.00 C ATOM 1105 CD1 PHE A 70 16.355 -15.451 -7.147 1.00 0.00 C ATOM 1106 CD2 PHE A 70 17.680 -13.496 -7.714 1.00 0.00 C ATOM 1107 CE1 PHE A 70 17.122 -16.225 -8.030 1.00 0.00 C ATOM 1108 CE2 PHE A 70 18.446 -14.269 -8.599 1.00 0.00 C ATOM 1109 CZ PHE A 70 18.170 -15.637 -8.750 1.00 0.00 C ATOM 0 H PHE A 70 14.765 -12.110 -4.128 1.00 0.00 H new ATOM 0 HA PHE A 70 15.749 -14.732 -4.432 1.00 0.00 H new ATOM 0 HB2 PHE A 70 14.776 -13.349 -6.247 1.00 0.00 H new ATOM 0 HB3 PHE A 70 16.103 -12.212 -6.116 1.00 0.00 H new ATOM 0 HD1 PHE A 70 15.545 -15.904 -6.594 1.00 0.00 H new ATOM 0 HD2 PHE A 70 17.891 -12.443 -7.596 1.00 0.00 H new ATOM 0 HE1 PHE A 70 16.904 -17.275 -8.155 1.00 0.00 H new ATOM 0 HE2 PHE A 70 19.246 -13.813 -9.163 1.00 0.00 H new ATOM 0 HZ PHE A 70 18.766 -16.237 -9.422 1.00 0.00 H new ATOM 1119 N TYR A 71 18.057 -12.500 -3.742 1.00 0.00 N ATOM 1120 CA TYR A 71 19.483 -12.401 -3.467 1.00 0.00 C ATOM 1121 C TYR A 71 19.860 -13.152 -2.191 1.00 0.00 C ATOM 1122 O TYR A 71 21.026 -13.480 -1.998 1.00 0.00 O ATOM 1123 CB TYR A 71 19.930 -10.945 -3.386 1.00 0.00 C ATOM 1124 CG TYR A 71 21.440 -10.819 -3.409 1.00 0.00 C ATOM 1125 CD1 TYR A 71 22.120 -10.974 -4.625 1.00 0.00 C ATOM 1126 CD2 TYR A 71 22.161 -10.565 -2.232 1.00 0.00 C ATOM 1127 CE1 TYR A 71 23.518 -10.887 -4.674 1.00 0.00 C ATOM 1128 CE2 TYR A 71 23.558 -10.453 -2.276 1.00 0.00 C ATOM 1129 CZ TYR A 71 24.244 -10.635 -3.494 1.00 0.00 C ATOM 1130 OH TYR A 71 25.604 -10.564 -3.537 1.00 0.00 O ATOM 0 H TYR A 71 17.515 -11.660 -3.541 1.00 0.00 H new ATOM 0 HA TYR A 71 20.006 -12.871 -4.299 1.00 0.00 H new ATOM 0 HB2 TYR A 71 19.506 -10.387 -4.221 1.00 0.00 H new ATOM 0 HB3 TYR A 71 19.541 -10.496 -2.472 1.00 0.00 H new ATOM 0 HD1 TYR A 71 21.563 -11.162 -5.531 1.00 0.00 H new ATOM 0 HD2 TYR A 71 21.640 -10.456 -1.292 1.00 0.00 H new ATOM 0 HE1 TYR A 71 24.036 -11.013 -5.613 1.00 0.00 H new ATOM 0 HE2 TYR A 71 24.109 -10.227 -1.375 1.00 0.00 H new ATOM 0 HH TYR A 71 25.951 -10.383 -2.638 1.00 0.00 H new ATOM 1140 N THR A 72 18.892 -13.437 -1.316 1.00 0.00 N ATOM 1141 CA THR A 72 19.174 -14.172 -0.095 1.00 0.00 C ATOM 1142 C THR A 72 19.505 -15.617 -0.441 1.00 0.00 C ATOM 1143 O THR A 72 20.328 -16.253 0.215 1.00 0.00 O ATOM 1144 CB THR A 72 17.955 -14.108 0.827 1.00 0.00 C ATOM 1145 OG1 THR A 72 17.530 -12.771 0.978 1.00 0.00 O ATOM 1146 CG2 THR A 72 18.290 -14.676 2.202 1.00 0.00 C ATOM 0 H THR A 72 17.915 -13.169 -1.435 1.00 0.00 H new ATOM 0 HA THR A 72 20.028 -13.729 0.418 1.00 0.00 H new ATOM 0 HB THR A 72 17.160 -14.701 0.376 1.00 0.00 H new ATOM 0 HG1 THR A 72 16.597 -12.756 1.278 1.00 0.00 H new ATOM 0 HG21 THR A 72 17.410 -14.621 2.843 1.00 0.00 H new ATOM 0 HG22 THR A 72 18.601 -15.716 2.100 1.00 0.00 H new ATOM 0 HG23 THR A 72 19.099 -14.097 2.647 1.00 0.00 H new ATOM 1154 N TRP A 73 18.856 -16.133 -1.489 1.00 0.00 N ATOM 1155 CA TRP A 73 19.078 -17.479 -1.981 1.00 0.00 C ATOM 1156 C TRP A 73 20.306 -17.516 -2.885 1.00 0.00 C ATOM 1157 O TRP A 73 21.017 -18.519 -2.933 1.00 0.00 O ATOM 1158 CB TRP A 73 17.820 -17.908 -2.730 1.00 0.00 C ATOM 1159 CG TRP A 73 17.866 -19.254 -3.372 1.00 0.00 C ATOM 1160 CD1 TRP A 73 17.720 -20.434 -2.732 1.00 0.00 C ATOM 1161 CD2 TRP A 73 18.065 -19.589 -4.779 1.00 0.00 C ATOM 1162 NE1 TRP A 73 17.796 -21.469 -3.640 1.00 0.00 N ATOM 1163 CE2 TRP A 73 18.009 -21.004 -4.922 1.00 0.00 C ATOM 1164 CE3 TRP A 73 18.287 -18.839 -5.949 1.00 0.00 C ATOM 1165 CZ2 TRP A 73 18.151 -21.636 -6.162 1.00 0.00 C ATOM 1166 CZ3 TRP A 73 18.437 -19.464 -7.196 1.00 0.00 C ATOM 1167 CH2 TRP A 73 18.369 -20.858 -7.305 1.00 0.00 C ATOM 0 H TRP A 73 18.156 -15.615 -2.020 1.00 0.00 H new ATOM 0 HA TRP A 73 19.269 -18.168 -1.158 1.00 0.00 H new ATOM 0 HB2 TRP A 73 16.982 -17.889 -2.033 1.00 0.00 H new ATOM 0 HB3 TRP A 73 17.610 -17.167 -3.501 1.00 0.00 H new ATOM 0 HD1 TRP A 73 17.567 -20.550 -1.669 1.00 0.00 H new ATOM 0 HE1 TRP A 73 17.706 -22.455 -3.395 1.00 0.00 H new ATOM 0 HE3 TRP A 73 18.343 -17.762 -5.886 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 18.093 -22.712 -6.236 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 18.606 -18.865 -8.079 1.00 0.00 H new ATOM 0 HH2 TRP A 73 18.484 -21.332 -8.269 1.00 0.00 H new ATOM 1178 N LEU A 74 20.563 -16.419 -3.603 1.00 0.00 N ATOM 1179 CA LEU A 74 21.713 -16.310 -4.486 1.00 0.00 C ATOM 1180 C LEU A 74 22.986 -16.182 -3.650 1.00 0.00 C ATOM 1181 O LEU A 74 24.028 -16.724 -4.012 1.00 0.00 O ATOM 1182 CB LEU A 74 21.508 -15.082 -5.380 1.00 0.00 C ATOM 1183 CG LEU A 74 22.134 -15.203 -6.772 1.00 0.00 C ATOM 1184 CD1 LEU A 74 21.926 -13.877 -7.502 1.00 0.00 C ATOM 1185 CD2 LEU A 74 23.631 -15.505 -6.738 1.00 0.00 C ATOM 0 H LEU A 74 19.976 -15.585 -3.584 1.00 0.00 H new ATOM 0 HA LEU A 74 21.813 -17.197 -5.111 1.00 0.00 H new ATOM 0 HB2 LEU A 74 20.439 -14.902 -5.490 1.00 0.00 H new ATOM 0 HB3 LEU A 74 21.928 -14.209 -4.880 1.00 0.00 H new ATOM 0 HG LEU A 74 21.649 -16.038 -7.278 1.00 0.00 H new ATOM 0 HD11 LEU A 74 22.364 -13.938 -8.498 1.00 0.00 H new ATOM 0 HD12 LEU A 74 20.859 -13.672 -7.587 1.00 0.00 H new ATOM 0 HD13 LEU A 74 22.407 -13.074 -6.943 1.00 0.00 H new ATOM 0 HD21 LEU A 74 24.011 -15.578 -7.757 1.00 0.00 H new ATOM 0 HD22 LEU A 74 24.152 -14.704 -6.213 1.00 0.00 H new ATOM 0 HD23 LEU A 74 23.800 -16.449 -6.220 1.00 0.00 H new ATOM 1197 N TYR A 75 22.902 -15.467 -2.524 1.00 0.00 N ATOM 1198 CA TYR A 75 24.035 -15.267 -1.637 1.00 0.00 C ATOM 1199 C TYR A 75 24.492 -16.600 -1.060 1.00 0.00 C ATOM 1200 O TYR A 75 25.689 -16.849 -0.954 1.00 0.00 O ATOM 1201 CB TYR A 75 23.617 -14.313 -0.516 1.00 0.00 C ATOM 1202 CG TYR A 75 24.727 -13.886 0.418 1.00 0.00 C ATOM 1203 CD1 TYR A 75 25.287 -14.788 1.336 1.00 0.00 C ATOM 1204 CD2 TYR A 75 25.188 -12.562 0.372 1.00 0.00 C ATOM 1205 CE1 TYR A 75 26.315 -14.369 2.192 1.00 0.00 C ATOM 1206 CE2 TYR A 75 26.205 -12.130 1.232 1.00 0.00 C ATOM 1207 CZ TYR A 75 26.776 -13.037 2.147 1.00 0.00 C ATOM 1208 OH TYR A 75 27.767 -12.629 2.990 1.00 0.00 O ATOM 0 H TYR A 75 22.044 -15.014 -2.208 1.00 0.00 H new ATOM 0 HA TYR A 75 24.868 -14.836 -2.191 1.00 0.00 H new ATOM 0 HB2 TYR A 75 23.179 -13.421 -0.965 1.00 0.00 H new ATOM 0 HB3 TYR A 75 22.834 -14.791 0.072 1.00 0.00 H new ATOM 0 HD1 TYR A 75 24.926 -15.805 1.383 1.00 0.00 H new ATOM 0 HD2 TYR A 75 24.754 -11.869 -0.334 1.00 0.00 H new ATOM 0 HE1 TYR A 75 26.755 -15.068 2.888 1.00 0.00 H new ATOM 0 HE2 TYR A 75 26.550 -11.107 1.194 1.00 0.00 H new ATOM 0 HH TYR A 75 27.966 -11.683 2.827 1.00 0.00 H new ATOM 1218 N ARG A 76 23.542 -17.466 -0.685 1.00 0.00 N ATOM 1219 CA ARG A 76 23.866 -18.758 -0.096 1.00 0.00 C ATOM 1220 C ARG A 76 24.547 -19.657 -1.125 1.00 0.00 C ATOM 1221 O ARG A 76 25.449 -20.412 -0.775 1.00 0.00 O ATOM 1222 CB ARG A 76 22.584 -19.411 0.429 1.00 0.00 C ATOM 1223 CG ARG A 76 22.878 -20.727 1.159 1.00 0.00 C ATOM 1224 CD ARG A 76 23.650 -20.504 2.459 1.00 0.00 C ATOM 1225 NE ARG A 76 22.835 -19.754 3.425 1.00 0.00 N ATOM 1226 CZ ARG A 76 23.314 -18.860 4.292 1.00 0.00 C ATOM 1227 NH1 ARG A 76 24.615 -18.592 4.347 1.00 0.00 N ATOM 1228 NH2 ARG A 76 22.489 -18.225 5.116 1.00 0.00 N ATOM 0 H ARG A 76 22.542 -17.288 -0.782 1.00 0.00 H new ATOM 0 HA ARG A 76 24.558 -18.613 0.734 1.00 0.00 H new ATOM 0 HB2 ARG A 76 22.076 -18.724 1.106 1.00 0.00 H new ATOM 0 HB3 ARG A 76 21.904 -19.599 -0.402 1.00 0.00 H new ATOM 0 HG2 ARG A 76 21.940 -21.237 1.378 1.00 0.00 H new ATOM 0 HG3 ARG A 76 23.452 -21.383 0.505 1.00 0.00 H new ATOM 0 HD2 ARG A 76 23.937 -21.465 2.886 1.00 0.00 H new ATOM 0 HD3 ARG A 76 24.571 -19.959 2.252 1.00 0.00 H new ATOM 0 HE ARG A 76 21.830 -19.930 3.433 1.00 0.00 H new ATOM 0 HH11 ARG A 76 25.262 -19.072 3.721 1.00 0.00 H new ATOM 0 HH12 ARG A 76 24.967 -17.906 5.015 1.00 0.00 H new ATOM 0 HH21 ARG A 76 21.488 -18.420 5.087 1.00 0.00 H new ATOM 0 HH22 ARG A 76 22.856 -17.542 5.779 1.00 0.00 H new ATOM 1242 N ILE A 77 24.124 -19.577 -2.390 1.00 0.00 N ATOM 1243 CA ILE A 77 24.723 -20.384 -3.443 1.00 0.00 C ATOM 1244 C ILE A 77 26.097 -19.830 -3.804 1.00 0.00 C ATOM 1245 O ILE A 77 27.002 -20.599 -4.117 1.00 0.00 O ATOM 1246 CB ILE A 77 23.796 -20.411 -4.667 1.00 0.00 C ATOM 1247 CG1 ILE A 77 22.519 -21.189 -4.314 1.00 0.00 C ATOM 1248 CG2 ILE A 77 24.502 -21.073 -5.857 1.00 0.00 C ATOM 1249 CD1 ILE A 77 21.546 -21.271 -5.490 1.00 0.00 C ATOM 0 H ILE A 77 23.372 -18.963 -2.703 1.00 0.00 H new ATOM 0 HA ILE A 77 24.853 -21.407 -3.090 1.00 0.00 H new ATOM 0 HB ILE A 77 23.538 -19.389 -4.946 1.00 0.00 H new ATOM 0 HG12 ILE A 77 22.786 -22.197 -3.996 1.00 0.00 H new ATOM 0 HG13 ILE A 77 22.025 -20.708 -3.469 1.00 0.00 H new ATOM 0 HG21 ILE A 77 23.832 -21.085 -6.717 1.00 0.00 H new ATOM 0 HG22 ILE A 77 25.402 -20.510 -6.105 1.00 0.00 H new ATOM 0 HG23 ILE A 77 24.775 -22.095 -5.596 1.00 0.00 H new ATOM 0 HD11 ILE A 77 20.660 -21.830 -5.191 1.00 0.00 H new ATOM 0 HD12 ILE A 77 21.255 -20.265 -5.793 1.00 0.00 H new ATOM 0 HD13 ILE A 77 22.028 -21.776 -6.327 1.00 0.00 H new ATOM 1261 N ALA A 78 26.270 -18.509 -3.766 1.00 0.00 N ATOM 1262 CA ALA A 78 27.518 -17.889 -4.184 1.00 0.00 C ATOM 1263 C ALA A 78 28.661 -18.208 -3.224 1.00 0.00 C ATOM 1264 O ALA A 78 29.779 -18.455 -3.673 1.00 0.00 O ATOM 1265 CB ALA A 78 27.299 -16.385 -4.297 1.00 0.00 C ATOM 0 H ALA A 78 25.558 -17.851 -3.449 1.00 0.00 H new ATOM 0 HA ALA A 78 27.809 -18.294 -5.153 1.00 0.00 H new ATOM 0 HB1 ALA A 78 28.226 -15.905 -4.610 1.00 0.00 H new ATOM 0 HB2 ALA A 78 26.520 -16.185 -5.033 1.00 0.00 H new ATOM 0 HB3 ALA A 78 26.993 -15.988 -3.329 1.00 0.00 H new ATOM 1271 N VAL A 79 28.405 -18.207 -1.910 1.00 0.00 N ATOM 1272 CA VAL A 79 29.454 -18.532 -0.949 1.00 0.00 C ATOM 1273 C VAL A 79 29.740 -20.027 -0.965 1.00 0.00 C ATOM 1274 O VAL A 79 30.884 -20.441 -0.794 1.00 0.00 O ATOM 1275 CB VAL A 79 29.076 -18.048 0.456 1.00 0.00 C ATOM 1276 CG1 VAL A 79 27.749 -18.628 0.949 1.00 0.00 C ATOM 1277 CG2 VAL A 79 30.158 -18.460 1.452 1.00 0.00 C ATOM 0 H VAL A 79 27.498 -17.989 -1.498 1.00 0.00 H new ATOM 0 HA VAL A 79 30.366 -18.011 -1.239 1.00 0.00 H new ATOM 0 HB VAL A 79 28.978 -16.964 0.391 1.00 0.00 H new ATOM 0 HG11 VAL A 79 27.535 -18.249 1.948 1.00 0.00 H new ATOM 0 HG12 VAL A 79 26.949 -18.333 0.270 1.00 0.00 H new ATOM 0 HG13 VAL A 79 27.816 -19.715 0.980 1.00 0.00 H new ATOM 0 HG21 VAL A 79 29.885 -18.114 2.449 1.00 0.00 H new ATOM 0 HG22 VAL A 79 30.253 -19.546 1.458 1.00 0.00 H new ATOM 0 HG23 VAL A 79 31.109 -18.014 1.161 1.00 0.00 H new ATOM 1287 N ASN A 80 28.706 -20.845 -1.169 1.00 0.00 N ATOM 1288 CA ASN A 80 28.871 -22.287 -1.184 1.00 0.00 C ATOM 1289 C ASN A 80 29.446 -22.758 -2.518 1.00 0.00 C ATOM 1290 O ASN A 80 29.938 -23.878 -2.601 1.00 0.00 O ATOM 1291 CB ASN A 80 27.528 -22.942 -0.863 1.00 0.00 C ATOM 1292 CG ASN A 80 27.170 -22.806 0.613 1.00 0.00 C ATOM 1293 OD1 ASN A 80 27.988 -22.386 1.428 1.00 0.00 O ATOM 1294 ND2 ASN A 80 25.941 -23.159 0.974 1.00 0.00 N ATOM 0 H ASN A 80 27.749 -20.527 -1.325 1.00 0.00 H new ATOM 0 HA ASN A 80 29.590 -22.586 -0.421 1.00 0.00 H new ATOM 0 HB2 ASN A 80 26.746 -22.485 -1.470 1.00 0.00 H new ATOM 0 HB3 ASN A 80 27.565 -23.998 -1.132 1.00 0.00 H new ATOM 0 HD21 ASN A 80 25.655 -23.085 1.950 1.00 0.00 H new ATOM 0 HD22 ASN A 80 25.283 -23.504 0.275 1.00 0.00 H new ATOM 1301 N THR A 81 29.399 -21.926 -3.562 1.00 0.00 N ATOM 1302 CA THR A 81 30.037 -22.251 -4.833 1.00 0.00 C ATOM 1303 C THR A 81 31.517 -21.884 -4.777 1.00 0.00 C ATOM 1304 O THR A 81 32.349 -22.612 -5.312 1.00 0.00 O ATOM 1305 CB THR A 81 29.334 -21.509 -5.975 1.00 0.00 C ATOM 1306 OG1 THR A 81 28.018 -21.990 -6.115 1.00 0.00 O ATOM 1307 CG2 THR A 81 30.064 -21.725 -7.299 1.00 0.00 C ATOM 0 H THR A 81 28.925 -21.023 -3.548 1.00 0.00 H new ATOM 0 HA THR A 81 29.953 -23.322 -5.017 1.00 0.00 H new ATOM 0 HB THR A 81 29.332 -20.446 -5.732 1.00 0.00 H new ATOM 0 HG1 THR A 81 27.405 -21.418 -5.607 1.00 0.00 H new ATOM 0 HG21 THR A 81 29.545 -21.188 -8.093 1.00 0.00 H new ATOM 0 HG22 THR A 81 31.085 -21.352 -7.217 1.00 0.00 H new ATOM 0 HG23 THR A 81 30.084 -22.789 -7.534 1.00 0.00 H new ATOM 1315 N ALA A 82 31.852 -20.762 -4.130 1.00 0.00 N ATOM 1316 CA ALA A 82 33.236 -20.346 -4.006 1.00 0.00 C ATOM 1317 C ALA A 82 33.972 -21.228 -2.997 1.00 0.00 C ATOM 1318 O ALA A 82 35.172 -21.455 -3.140 1.00 0.00 O ATOM 1319 CB ALA A 82 33.268 -18.873 -3.595 1.00 0.00 C ATOM 0 H ALA A 82 31.180 -20.134 -3.689 1.00 0.00 H new ATOM 0 HA ALA A 82 33.748 -20.459 -4.962 1.00 0.00 H new ATOM 0 HB1 ALA A 82 34.303 -18.545 -3.497 1.00 0.00 H new ATOM 0 HB2 ALA A 82 32.767 -18.272 -4.354 1.00 0.00 H new ATOM 0 HB3 ALA A 82 32.757 -18.751 -2.640 1.00 0.00 H new ATOM 1325 N LYS A 83 33.267 -21.738 -1.980 1.00 0.00 N ATOM 1326 CA LYS A 83 33.872 -22.645 -1.016 1.00 0.00 C ATOM 1327 C LYS A 83 33.967 -24.059 -1.582 1.00 0.00 C ATOM 1328 O LYS A 83 34.841 -24.822 -1.177 1.00 0.00 O ATOM 1329 CB LYS A 83 33.064 -22.624 0.280 1.00 0.00 C ATOM 1330 CG LYS A 83 33.355 -21.349 1.071 1.00 0.00 C ATOM 1331 CD LYS A 83 32.635 -21.412 2.415 1.00 0.00 C ATOM 1332 CE LYS A 83 32.905 -20.135 3.208 1.00 0.00 C ATOM 1333 NZ LYS A 83 32.219 -20.163 4.514 1.00 0.00 N ATOM 0 H LYS A 83 32.282 -21.535 -1.810 1.00 0.00 H new ATOM 0 HA LYS A 83 34.888 -22.312 -0.803 1.00 0.00 H new ATOM 0 HB2 LYS A 83 32.000 -22.683 0.053 1.00 0.00 H new ATOM 0 HB3 LYS A 83 33.310 -23.498 0.883 1.00 0.00 H new ATOM 0 HG2 LYS A 83 34.429 -21.241 1.226 1.00 0.00 H new ATOM 0 HG3 LYS A 83 33.024 -20.476 0.509 1.00 0.00 H new ATOM 0 HD2 LYS A 83 31.563 -21.534 2.258 1.00 0.00 H new ATOM 0 HD3 LYS A 83 32.975 -22.280 2.980 1.00 0.00 H new ATOM 0 HE2 LYS A 83 33.978 -20.018 3.360 1.00 0.00 H new ATOM 0 HE3 LYS A 83 32.568 -19.270 2.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 32.420 -19.283 5.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 31.193 -20.251 4.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 32.559 -20.975 5.067 1.00 0.00 H new ATOM 1347 N ASN A 84 33.083 -24.423 -2.518 1.00 0.00 N ATOM 1348 CA ASN A 84 33.159 -25.725 -3.165 1.00 0.00 C ATOM 1349 C ASN A 84 34.322 -25.727 -4.161 1.00 0.00 C ATOM 1350 O ASN A 84 34.845 -26.780 -4.517 1.00 0.00 O ATOM 1351 CB ASN A 84 31.811 -26.042 -3.824 1.00 0.00 C ATOM 1352 CG ASN A 84 31.686 -27.489 -4.293 1.00 0.00 C ATOM 1353 OD1 ASN A 84 32.589 -28.300 -4.125 1.00 0.00 O ATOM 1354 ND2 ASN A 84 30.545 -27.821 -4.890 1.00 0.00 N ATOM 0 H ASN A 84 32.314 -23.834 -2.838 1.00 0.00 H new ATOM 0 HA ASN A 84 33.356 -26.511 -2.436 1.00 0.00 H new ATOM 0 HB2 ASN A 84 31.010 -25.828 -3.116 1.00 0.00 H new ATOM 0 HB3 ASN A 84 31.668 -25.379 -4.677 1.00 0.00 H new ATOM 0 HD21 ASN A 84 30.402 -28.774 -5.223 1.00 0.00 H new ATOM 0 HD22 ASN A 84 29.812 -27.122 -5.015 1.00 0.00 H new ATOM 1361 N TYR A 85 34.744 -24.541 -4.608 1.00 0.00 N ATOM 1362 CA TYR A 85 35.893 -24.405 -5.491 1.00 0.00 C ATOM 1363 C TYR A 85 37.197 -24.576 -4.709 1.00 0.00 C ATOM 1364 O TYR A 85 38.207 -24.983 -5.281 1.00 0.00 O ATOM 1365 CB TYR A 85 35.829 -23.038 -6.175 1.00 0.00 C ATOM 1366 CG TYR A 85 37.058 -22.704 -6.987 1.00 0.00 C ATOM 1367 CD1 TYR A 85 37.217 -23.224 -8.279 1.00 0.00 C ATOM 1368 CD2 TYR A 85 38.040 -21.866 -6.440 1.00 0.00 C ATOM 1369 CE1 TYR A 85 38.373 -22.924 -9.018 1.00 0.00 C ATOM 1370 CE2 TYR A 85 39.192 -21.551 -7.174 1.00 0.00 C ATOM 1371 CZ TYR A 85 39.366 -22.090 -8.465 1.00 0.00 C ATOM 1372 OH TYR A 85 40.491 -21.803 -9.180 1.00 0.00 O ATOM 0 H TYR A 85 34.298 -23.656 -4.367 1.00 0.00 H new ATOM 0 HA TYR A 85 35.869 -25.185 -6.251 1.00 0.00 H new ATOM 0 HB2 TYR A 85 34.956 -23.009 -6.827 1.00 0.00 H new ATOM 0 HB3 TYR A 85 35.686 -22.269 -5.416 1.00 0.00 H new ATOM 0 HD1 TYR A 85 36.451 -23.855 -8.706 1.00 0.00 H new ATOM 0 HD2 TYR A 85 37.908 -21.461 -5.448 1.00 0.00 H new ATOM 0 HE1 TYR A 85 38.501 -23.332 -10.010 1.00 0.00 H new ATOM 0 HE2 TYR A 85 39.942 -20.899 -6.753 1.00 0.00 H new ATOM 0 HH TYR A 85 41.072 -21.214 -8.654 1.00 0.00 H new ATOM 1382 N LEU A 86 37.198 -24.276 -3.407 1.00 0.00 N ATOM 1383 CA LEU A 86 38.402 -24.430 -2.597 1.00 0.00 C ATOM 1384 C LEU A 86 38.634 -25.881 -2.180 1.00 0.00 C ATOM 1385 O LEU A 86 39.753 -26.239 -1.822 1.00 0.00 O ATOM 1386 CB LEU A 86 38.309 -23.534 -1.362 1.00 0.00 C ATOM 1387 CG LEU A 86 38.246 -22.044 -1.710 1.00 0.00 C ATOM 1388 CD1 LEU A 86 38.189 -21.242 -0.414 1.00 0.00 C ATOM 1389 CD2 LEU A 86 39.464 -21.613 -2.526 1.00 0.00 C ATOM 0 H LEU A 86 36.385 -23.929 -2.898 1.00 0.00 H new ATOM 0 HA LEU A 86 39.254 -24.130 -3.207 1.00 0.00 H new ATOM 0 HB2 LEU A 86 37.423 -23.806 -0.788 1.00 0.00 H new ATOM 0 HB3 LEU A 86 39.172 -23.716 -0.721 1.00 0.00 H new ATOM 0 HG LEU A 86 37.357 -21.861 -2.313 1.00 0.00 H new ATOM 0 HD11 LEU A 86 38.144 -20.178 -0.646 1.00 0.00 H new ATOM 0 HD12 LEU A 86 37.302 -21.528 0.152 1.00 0.00 H new ATOM 0 HD13 LEU A 86 39.080 -21.446 0.180 1.00 0.00 H new ATOM 0 HD21 LEU A 86 39.390 -20.550 -2.757 1.00 0.00 H new ATOM 0 HD22 LEU A 86 40.371 -21.796 -1.950 1.00 0.00 H new ATOM 0 HD23 LEU A 86 39.501 -22.184 -3.454 1.00 0.00 H new ATOM 1401 N VAL A 87 37.593 -26.718 -2.222 1.00 0.00 N ATOM 1402 CA VAL A 87 37.734 -28.133 -1.896 1.00 0.00 C ATOM 1403 C VAL A 87 37.858 -28.978 -3.160 1.00 0.00 C ATOM 1404 O VAL A 87 38.258 -30.137 -3.088 1.00 0.00 O ATOM 1405 CB VAL A 87 36.574 -28.603 -1.013 1.00 0.00 C ATOM 1406 CG1 VAL A 87 36.546 -27.817 0.299 1.00 0.00 C ATOM 1407 CG2 VAL A 87 35.231 -28.433 -1.722 1.00 0.00 C ATOM 0 H VAL A 87 36.647 -26.437 -2.479 1.00 0.00 H new ATOM 0 HA VAL A 87 38.656 -28.263 -1.329 1.00 0.00 H new ATOM 0 HB VAL A 87 36.733 -29.661 -0.805 1.00 0.00 H new ATOM 0 HG11 VAL A 87 35.715 -28.164 0.914 1.00 0.00 H new ATOM 0 HG12 VAL A 87 37.483 -27.970 0.835 1.00 0.00 H new ATOM 0 HG13 VAL A 87 36.420 -26.756 0.085 1.00 0.00 H new ATOM 0 HG21 VAL A 87 34.429 -28.776 -1.069 1.00 0.00 H new ATOM 0 HG22 VAL A 87 35.078 -27.381 -1.964 1.00 0.00 H new ATOM 0 HG23 VAL A 87 35.227 -29.021 -2.640 1.00 0.00 H new