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= -0.0503 USER MOD Set 1.2: A 72 THR OG1 : rot 160:sc= 0.279 USER MOD Set 2.1: A 32 LYS NZ :NH3+ -168:sc= 1.62 (180deg=1.36) USER MOD Set 2.2: A 71 TYR OH : rot 180:sc= 0.0202 USER MOD Single : A 6 THR OG1 : rot -24:sc= 0.162 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 15 GLN : amide:sc= 0.798 K(o=0.8,f=-0.81) USER MOD Single : A 16 LYS NZ :NH3+ 153:sc= 0.29 (180deg=-0.163) USER MOD Single : A 19 GLN : amide:sc= -1.71 K(o=-1.7,f=-4.3) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 ASN : amide:sc= -0.36 X(o=-0.36,f=-0.0011) USER MOD Single : A 29 TYR OH : rot 30:sc= 0 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 35 SER OG : rot 85:sc= 0.364 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -0.394 X(o=-0.39,f=-0.79) USER MOD Single : A 56 LYS NZ :NH3+ 165:sc= -0.0217 (180deg=-0.267) 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 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 81 THR OG1 : rot 71:sc= 1.21 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc=-0.00592 K(o=-0.0059,f=-1.4) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 82 N THR A 6 11.162 -5.814 -10.518 1.00 0.00 N ATOM 83 CA THR A 6 12.074 -6.384 -9.532 1.00 0.00 C ATOM 84 C THR A 6 12.350 -7.858 -9.820 1.00 0.00 C ATOM 85 O THR A 6 11.799 -8.442 -10.753 1.00 0.00 O ATOM 86 CB THR A 6 11.482 -6.224 -8.130 1.00 0.00 C ATOM 87 OG1 THR A 6 10.184 -6.773 -8.096 1.00 0.00 O ATOM 88 CG2 THR A 6 11.419 -4.748 -7.743 1.00 0.00 C ATOM 0 HA THR A 6 13.021 -5.848 -9.591 1.00 0.00 H new ATOM 0 HB THR A 6 12.121 -6.749 -7.420 1.00 0.00 H new ATOM 0 HG1 THR A 6 9.807 -6.777 -9.000 1.00 0.00 H new ATOM 0 HG21 THR A 6 10.996 -4.652 -6.743 1.00 0.00 H new ATOM 0 HG22 THR A 6 12.424 -4.326 -7.754 1.00 0.00 H new ATOM 0 HG23 THR A 6 10.792 -4.211 -8.456 1.00 0.00 H new ATOM 96 N ASP A 7 13.214 -8.471 -9.011 1.00 0.00 N ATOM 97 CA ASP A 7 13.592 -9.865 -9.171 1.00 0.00 C ATOM 98 C ASP A 7 12.397 -10.806 -8.999 1.00 0.00 C ATOM 99 O ASP A 7 12.467 -11.964 -9.398 1.00 0.00 O ATOM 100 CB ASP A 7 14.669 -10.198 -8.137 1.00 0.00 C ATOM 101 CG ASP A 7 14.182 -9.911 -6.717 1.00 0.00 C ATOM 102 OD1 ASP A 7 14.254 -8.728 -6.312 1.00 0.00 O ATOM 103 OD2 ASP A 7 13.739 -10.871 -6.044 1.00 0.00 O ATOM 0 H ASP A 7 13.670 -8.008 -8.225 1.00 0.00 H new ATOM 0 HA ASP A 7 13.971 -10.008 -10.183 1.00 0.00 H new ATOM 0 HB2 ASP A 7 14.947 -11.248 -8.223 1.00 0.00 H new ATOM 0 HB3 ASP A 7 15.566 -9.613 -8.341 1.00 0.00 H new ATOM 108 N GLN A 8 11.296 -10.331 -8.408 1.00 0.00 N ATOM 109 CA GLN A 8 10.143 -11.184 -8.157 1.00 0.00 C ATOM 110 C GLN A 8 9.500 -11.623 -9.469 1.00 0.00 C ATOM 111 O GLN A 8 9.177 -12.797 -9.640 1.00 0.00 O ATOM 112 CB GLN A 8 9.127 -10.425 -7.308 1.00 0.00 C ATOM 113 CG GLN A 8 9.745 -10.028 -5.965 1.00 0.00 C ATOM 114 CD GLN A 8 8.758 -9.286 -5.070 1.00 0.00 C ATOM 115 OE1 GLN A 8 7.642 -8.966 -5.474 1.00 0.00 O ATOM 116 NE2 GLN A 8 9.163 -9.003 -3.834 1.00 0.00 N ATOM 0 H GLN A 8 11.184 -9.366 -8.098 1.00 0.00 H new ATOM 0 HA GLN A 8 10.474 -12.075 -7.624 1.00 0.00 H new ATOM 0 HB2 GLN A 8 8.793 -9.534 -7.839 1.00 0.00 H new ATOM 0 HB3 GLN A 8 8.247 -11.046 -7.141 1.00 0.00 H new ATOM 0 HG2 GLN A 8 10.097 -10.923 -5.451 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.617 -9.398 -6.141 1.00 0.00 H new ATOM 0 HE21 GLN A 8 10.095 -9.281 -3.526 1.00 0.00 H new ATOM 0 HE22 GLN A 8 8.541 -8.508 -3.194 1.00 0.00 H new ATOM 125 N VAL A 9 9.318 -10.682 -10.397 1.00 0.00 N ATOM 126 CA VAL A 9 8.691 -10.976 -11.679 1.00 0.00 C ATOM 127 C VAL A 9 9.711 -11.527 -12.669 1.00 0.00 C ATOM 128 O VAL A 9 9.349 -12.249 -13.593 1.00 0.00 O ATOM 129 CB VAL A 9 8.003 -9.711 -12.208 1.00 0.00 C ATOM 130 CG1 VAL A 9 9.005 -8.580 -12.429 1.00 0.00 C ATOM 131 CG2 VAL A 9 7.262 -9.991 -13.518 1.00 0.00 C ATOM 0 H VAL A 9 9.598 -9.708 -10.281 1.00 0.00 H new ATOM 0 HA VAL A 9 7.934 -11.749 -11.546 1.00 0.00 H new ATOM 0 HB VAL A 9 7.284 -9.402 -11.449 1.00 0.00 H new ATOM 0 HG11 VAL A 9 8.483 -7.700 -12.804 1.00 0.00 H new ATOM 0 HG12 VAL A 9 9.494 -8.338 -11.485 1.00 0.00 H new ATOM 0 HG13 VAL A 9 9.754 -8.894 -13.156 1.00 0.00 H new ATOM 0 HG21 VAL A 9 6.784 -9.076 -13.869 1.00 0.00 H new ATOM 0 HG22 VAL A 9 7.970 -10.341 -14.269 1.00 0.00 H new ATOM 0 HG23 VAL A 9 6.503 -10.755 -13.351 1.00 0.00 H new ATOM 141 N LEU A 10 10.989 -11.189 -12.482 1.00 0.00 N ATOM 142 CA LEU A 10 12.028 -11.635 -13.391 1.00 0.00 C ATOM 143 C LEU A 10 12.413 -13.087 -13.107 1.00 0.00 C ATOM 144 O LEU A 10 12.816 -13.807 -14.019 1.00 0.00 O ATOM 145 CB LEU A 10 13.213 -10.675 -13.265 1.00 0.00 C ATOM 146 CG LEU A 10 14.276 -10.881 -14.349 1.00 0.00 C ATOM 147 CD1 LEU A 10 13.698 -10.654 -15.746 1.00 0.00 C ATOM 148 CD2 LEU A 10 15.394 -9.865 -14.132 1.00 0.00 C ATOM 0 H LEU A 10 11.321 -10.610 -11.710 1.00 0.00 H new ATOM 0 HA LEU A 10 11.671 -11.618 -14.421 1.00 0.00 H new ATOM 0 HB2 LEU A 10 12.848 -9.649 -13.314 1.00 0.00 H new ATOM 0 HB3 LEU A 10 13.673 -10.803 -12.285 1.00 0.00 H new ATOM 0 HG LEU A 10 14.642 -11.905 -14.280 1.00 0.00 H new ATOM 0 HD11 LEU A 10 14.478 -10.808 -16.492 1.00 0.00 H new ATOM 0 HD12 LEU A 10 12.884 -11.357 -15.922 1.00 0.00 H new ATOM 0 HD13 LEU A 10 13.320 -9.635 -15.822 1.00 0.00 H new ATOM 0 HD21 LEU A 10 16.160 -9.998 -14.896 1.00 0.00 H new ATOM 0 HD22 LEU A 10 14.987 -8.856 -14.198 1.00 0.00 H new ATOM 0 HD23 LEU A 10 15.835 -10.014 -13.146 1.00 0.00 H new ATOM 160 N VAL A 11 12.288 -13.532 -11.853 1.00 0.00 N ATOM 161 CA VAL A 11 12.595 -14.909 -11.494 1.00 0.00 C ATOM 162 C VAL A 11 11.489 -15.841 -11.972 1.00 0.00 C ATOM 163 O VAL A 11 11.781 -16.933 -12.455 1.00 0.00 O ATOM 164 CB VAL A 11 12.802 -15.015 -9.980 1.00 0.00 C ATOM 165 CG1 VAL A 11 12.797 -16.468 -9.509 1.00 0.00 C ATOM 166 CG2 VAL A 11 14.159 -14.415 -9.610 1.00 0.00 C ATOM 0 H VAL A 11 11.976 -12.954 -11.073 1.00 0.00 H new ATOM 0 HA VAL A 11 13.518 -15.214 -11.987 1.00 0.00 H new ATOM 0 HB VAL A 11 11.983 -14.479 -9.501 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.947 -16.501 -8.430 1.00 0.00 H new ATOM 0 HG12 VAL A 11 11.840 -16.928 -9.757 1.00 0.00 H new ATOM 0 HG13 VAL A 11 13.601 -17.014 -10.004 1.00 0.00 H new ATOM 0 HG21 VAL A 11 14.308 -14.489 -8.533 1.00 0.00 H new ATOM 0 HG22 VAL A 11 14.950 -14.960 -10.125 1.00 0.00 H new ATOM 0 HG23 VAL A 11 14.187 -13.367 -9.909 1.00 0.00 H new ATOM 176 N GLU A 12 10.221 -15.439 -11.853 1.00 0.00 N ATOM 177 CA GLU A 12 9.152 -16.306 -12.325 1.00 0.00 C ATOM 178 C GLU A 12 9.110 -16.333 -13.853 1.00 0.00 C ATOM 179 O GLU A 12 8.573 -17.270 -14.433 1.00 0.00 O ATOM 180 CB GLU A 12 7.802 -15.892 -11.738 1.00 0.00 C ATOM 181 CG GLU A 12 7.367 -14.522 -12.255 1.00 0.00 C ATOM 182 CD GLU A 12 5.934 -14.211 -11.833 1.00 0.00 C ATOM 183 OE1 GLU A 12 5.022 -14.716 -12.525 1.00 0.00 O ATOM 184 OE2 GLU A 12 5.760 -13.481 -10.834 1.00 0.00 O ATOM 0 H GLU A 12 9.921 -14.552 -11.449 1.00 0.00 H new ATOM 0 HA GLU A 12 9.361 -17.318 -11.978 1.00 0.00 H new ATOM 0 HB2 GLU A 12 7.048 -16.636 -11.995 1.00 0.00 H new ATOM 0 HB3 GLU A 12 7.868 -15.868 -10.650 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.038 -13.754 -11.871 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.444 -14.498 -13.342 1.00 0.00 H new ATOM 191 N ARG A 13 9.672 -15.314 -14.511 1.00 0.00 N ATOM 192 CA ARG A 13 9.736 -15.286 -15.965 1.00 0.00 C ATOM 193 C ARG A 13 10.754 -16.306 -16.471 1.00 0.00 C ATOM 194 O ARG A 13 10.575 -16.867 -17.549 1.00 0.00 O ATOM 195 CB ARG A 13 10.065 -13.865 -16.428 1.00 0.00 C ATOM 196 CG ARG A 13 10.133 -13.803 -17.953 1.00 0.00 C ATOM 197 CD ARG A 13 10.313 -12.363 -18.419 1.00 0.00 C ATOM 198 NE ARG A 13 10.523 -12.313 -19.868 1.00 0.00 N ATOM 199 CZ ARG A 13 10.467 -11.204 -20.606 1.00 0.00 C ATOM 200 NH1 ARG A 13 10.194 -10.024 -20.049 1.00 0.00 N ATOM 201 NH2 ARG A 13 10.688 -11.276 -21.914 1.00 0.00 N ATOM 0 H ARG A 13 10.087 -14.501 -14.055 1.00 0.00 H new ATOM 0 HA ARG A 13 8.770 -15.565 -16.386 1.00 0.00 H new ATOM 0 HB2 ARG A 13 9.307 -13.172 -16.063 1.00 0.00 H new ATOM 0 HB3 ARG A 13 11.017 -13.548 -16.002 1.00 0.00 H new ATOM 0 HG2 ARG A 13 10.961 -14.414 -18.312 1.00 0.00 H new ATOM 0 HG3 ARG A 13 9.221 -14.219 -18.381 1.00 0.00 H new ATOM 0 HD2 ARG A 13 9.434 -11.776 -18.153 1.00 0.00 H new ATOM 0 HD3 ARG A 13 11.163 -11.913 -17.907 1.00 0.00 H new ATOM 0 HE ARG A 13 10.727 -13.190 -20.347 1.00 0.00 H new ATOM 0 HH11 ARG A 13 10.025 -9.961 -19.045 1.00 0.00 H new ATOM 0 HH12 ARG A 13 10.155 -9.184 -20.627 1.00 0.00 H new ATOM 0 HH21 ARG A 13 10.899 -12.175 -22.347 1.00 0.00 H new ATOM 0 HH22 ARG A 13 10.647 -10.432 -22.485 1.00 0.00 H new ATOM 215 N VAL A 14 11.818 -16.561 -15.704 1.00 0.00 N ATOM 216 CA VAL A 14 12.786 -17.593 -16.059 1.00 0.00 C ATOM 217 C VAL A 14 12.191 -18.975 -15.815 1.00 0.00 C ATOM 218 O VAL A 14 12.562 -19.936 -16.486 1.00 0.00 O ATOM 219 CB VAL A 14 14.081 -17.388 -15.263 1.00 0.00 C ATOM 220 CG1 VAL A 14 15.102 -18.484 -15.572 1.00 0.00 C ATOM 221 CG2 VAL A 14 14.708 -16.051 -15.653 1.00 0.00 C ATOM 0 H VAL A 14 12.027 -16.067 -14.837 1.00 0.00 H new ATOM 0 HA VAL A 14 13.027 -17.518 -17.119 1.00 0.00 H new ATOM 0 HB VAL A 14 13.827 -17.415 -14.203 1.00 0.00 H new ATOM 0 HG11 VAL A 14 16.009 -18.311 -14.992 1.00 0.00 H new ATOM 0 HG12 VAL A 14 14.684 -19.456 -15.309 1.00 0.00 H new ATOM 0 HG13 VAL A 14 15.342 -18.468 -16.635 1.00 0.00 H new ATOM 0 HG21 VAL A 14 15.629 -15.903 -15.089 1.00 0.00 H new ATOM 0 HG22 VAL A 14 14.932 -16.052 -16.720 1.00 0.00 H new ATOM 0 HG23 VAL A 14 14.011 -15.243 -15.429 1.00 0.00 H new ATOM 231 N GLN A 15 11.257 -19.093 -14.863 1.00 0.00 N ATOM 232 CA GLN A 15 10.568 -20.350 -14.612 1.00 0.00 C ATOM 233 C GLN A 15 9.589 -20.669 -15.743 1.00 0.00 C ATOM 234 O GLN A 15 9.132 -21.807 -15.859 1.00 0.00 O ATOM 235 CB GLN A 15 9.852 -20.299 -13.260 1.00 0.00 C ATOM 236 CG GLN A 15 10.870 -20.270 -12.118 1.00 0.00 C ATOM 237 CD GLN A 15 10.194 -20.239 -10.750 1.00 0.00 C ATOM 238 OE1 GLN A 15 8.996 -20.004 -10.633 1.00 0.00 O ATOM 239 NE2 GLN A 15 10.967 -20.478 -9.694 1.00 0.00 N ATOM 0 H GLN A 15 10.966 -18.327 -14.256 1.00 0.00 H new ATOM 0 HA GLN A 15 11.306 -21.151 -14.579 1.00 0.00 H new ATOM 0 HB2 GLN A 15 9.216 -19.415 -13.211 1.00 0.00 H new ATOM 0 HB3 GLN A 15 9.201 -21.167 -13.153 1.00 0.00 H new ATOM 0 HG2 GLN A 15 11.514 -21.147 -12.184 1.00 0.00 H new ATOM 0 HG3 GLN A 15 11.511 -19.395 -12.226 1.00 0.00 H new ATOM 0 HE21 GLN A 15 11.960 -20.670 -9.822 1.00 0.00 H new ATOM 0 HE22 GLN A 15 10.566 -20.469 -8.756 1.00 0.00 H new ATOM 248 N LYS A 16 9.266 -19.677 -16.582 1.00 0.00 N ATOM 249 CA LYS A 16 8.451 -19.881 -17.775 1.00 0.00 C ATOM 250 C LYS A 16 9.309 -20.322 -18.959 1.00 0.00 C ATOM 251 O LYS A 16 8.801 -20.468 -20.069 1.00 0.00 O ATOM 252 CB LYS A 16 7.647 -18.621 -18.094 1.00 0.00 C ATOM 253 CG LYS A 16 6.615 -18.364 -16.995 1.00 0.00 C ATOM 254 CD LYS A 16 5.851 -17.077 -17.297 1.00 0.00 C ATOM 255 CE LYS A 16 4.891 -16.742 -16.153 1.00 0.00 C ATOM 256 NZ LYS A 16 5.622 -16.411 -14.914 1.00 0.00 N ATOM 0 H LYS A 16 9.565 -18.711 -16.448 1.00 0.00 H new ATOM 0 HA LYS A 16 7.743 -20.686 -17.577 1.00 0.00 H new ATOM 0 HB2 LYS A 16 8.317 -17.765 -18.182 1.00 0.00 H new ATOM 0 HB3 LYS A 16 7.146 -18.734 -19.055 1.00 0.00 H new ATOM 0 HG2 LYS A 16 5.922 -19.203 -16.930 1.00 0.00 H new ATOM 0 HG3 LYS A 16 7.111 -18.285 -16.028 1.00 0.00 H new ATOM 0 HD2 LYS A 16 6.553 -16.256 -17.442 1.00 0.00 H new ATOM 0 HD3 LYS A 16 5.293 -17.188 -18.227 1.00 0.00 H new ATOM 0 HE2 LYS A 16 4.260 -15.901 -16.440 1.00 0.00 H new ATOM 0 HE3 LYS A 16 4.230 -17.589 -15.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 5.043 -15.776 -14.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 5.822 -17.284 -14.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 6.517 -15.940 -15.155 1.00 0.00 H new ATOM 270 N GLY A 17 10.612 -20.528 -18.727 1.00 0.00 N ATOM 271 CA GLY A 17 11.538 -21.034 -19.731 1.00 0.00 C ATOM 272 C GLY A 17 12.247 -19.922 -20.497 1.00 0.00 C ATOM 273 O GLY A 17 12.947 -20.203 -21.471 1.00 0.00 O ATOM 0 H GLY A 17 11.051 -20.344 -17.825 1.00 0.00 H new ATOM 0 HA2 GLY A 17 12.282 -21.666 -19.246 1.00 0.00 H new ATOM 0 HA3 GLY A 17 10.994 -21.664 -20.435 1.00 0.00 H new ATOM 277 N ASP A 18 12.086 -18.662 -20.080 1.00 0.00 N ATOM 278 CA ASP A 18 12.725 -17.542 -20.756 1.00 0.00 C ATOM 279 C ASP A 18 14.186 -17.439 -20.325 1.00 0.00 C ATOM 280 O ASP A 18 14.475 -17.081 -19.184 1.00 0.00 O ATOM 281 CB ASP A 18 11.958 -16.260 -20.433 1.00 0.00 C ATOM 282 CG ASP A 18 12.364 -15.100 -21.339 1.00 0.00 C ATOM 283 OD1 ASP A 18 13.548 -15.063 -21.742 1.00 0.00 O ATOM 284 OD2 ASP A 18 11.483 -14.255 -21.617 1.00 0.00 O ATOM 0 H ASP A 18 11.517 -18.398 -19.276 1.00 0.00 H new ATOM 0 HA ASP A 18 12.707 -17.696 -21.835 1.00 0.00 H new ATOM 0 HB2 ASP A 18 10.888 -16.443 -20.537 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.135 -15.985 -19.393 1.00 0.00 H new ATOM 289 N GLN A 19 15.114 -17.750 -21.236 1.00 0.00 N ATOM 290 CA GLN A 19 16.535 -17.694 -20.929 1.00 0.00 C ATOM 291 C GLN A 19 17.048 -16.256 -21.007 1.00 0.00 C ATOM 292 O GLN A 19 18.006 -15.901 -20.326 1.00 0.00 O ATOM 293 CB GLN A 19 17.278 -18.637 -21.882 1.00 0.00 C ATOM 294 CG GLN A 19 18.685 -18.978 -21.381 1.00 0.00 C ATOM 295 CD GLN A 19 19.688 -17.847 -21.572 1.00 0.00 C ATOM 296 OE1 GLN A 19 19.573 -17.044 -22.495 1.00 0.00 O ATOM 297 NE2 GLN A 19 20.688 -17.774 -20.695 1.00 0.00 N ATOM 0 H GLN A 19 14.900 -18.042 -22.190 1.00 0.00 H new ATOM 0 HA GLN A 19 16.716 -18.026 -19.907 1.00 0.00 H new ATOM 0 HB2 GLN A 19 16.704 -19.556 -22.001 1.00 0.00 H new ATOM 0 HB3 GLN A 19 17.347 -18.175 -22.867 1.00 0.00 H new ATOM 0 HG2 GLN A 19 18.634 -19.233 -20.322 1.00 0.00 H new ATOM 0 HG3 GLN A 19 19.044 -19.864 -21.905 1.00 0.00 H new ATOM 0 HE21 GLN A 19 20.755 -18.456 -19.940 1.00 0.00 H new ATOM 0 HE22 GLN A 19 21.387 -17.036 -20.779 1.00 0.00 H new ATOM 306 N LYS A 20 16.414 -15.415 -21.832 1.00 0.00 N ATOM 307 CA LYS A 20 16.847 -14.035 -21.995 1.00 0.00 C ATOM 308 C LYS A 20 16.516 -13.238 -20.739 1.00 0.00 C ATOM 309 O LYS A 20 17.236 -12.304 -20.394 1.00 0.00 O ATOM 310 CB LYS A 20 16.161 -13.416 -23.217 1.00 0.00 C ATOM 311 CG LYS A 20 16.383 -14.188 -24.526 1.00 0.00 C ATOM 312 CD LYS A 20 17.758 -13.965 -25.168 1.00 0.00 C ATOM 313 CE LYS A 20 18.903 -14.583 -24.365 1.00 0.00 C ATOM 314 NZ LYS A 20 20.162 -14.564 -25.132 1.00 0.00 N ATOM 0 H LYS A 20 15.602 -15.671 -22.393 1.00 0.00 H new ATOM 0 HA LYS A 20 17.926 -14.011 -22.150 1.00 0.00 H new ATOM 0 HB2 LYS A 20 15.090 -13.352 -23.024 1.00 0.00 H new ATOM 0 HB3 LYS A 20 16.524 -12.396 -23.345 1.00 0.00 H new ATOM 0 HG2 LYS A 20 16.255 -15.253 -24.332 1.00 0.00 H new ATOM 0 HG3 LYS A 20 15.611 -13.899 -25.239 1.00 0.00 H new ATOM 0 HD2 LYS A 20 17.756 -14.389 -26.172 1.00 0.00 H new ATOM 0 HD3 LYS A 20 17.933 -12.894 -25.274 1.00 0.00 H new ATOM 0 HE2 LYS A 20 19.034 -14.035 -23.432 1.00 0.00 H new ATOM 0 HE3 LYS A 20 18.652 -15.610 -24.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 20.922 -14.989 -24.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 20.042 -15.108 -26.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 20.412 -13.582 -25.364 1.00 0.00 H new ATOM 328 N ALA A 21 15.435 -13.603 -20.047 1.00 0.00 N ATOM 329 CA ALA A 21 15.076 -12.963 -18.794 1.00 0.00 C ATOM 330 C ALA A 21 16.128 -13.277 -17.729 1.00 0.00 C ATOM 331 O ALA A 21 16.343 -12.482 -16.813 1.00 0.00 O ATOM 332 CB ALA A 21 13.705 -13.470 -18.355 1.00 0.00 C ATOM 0 H ALA A 21 14.795 -14.342 -20.340 1.00 0.00 H new ATOM 0 HA ALA A 21 15.035 -11.882 -18.928 1.00 0.00 H new ATOM 0 HB1 ALA A 21 13.426 -12.995 -17.414 1.00 0.00 H new ATOM 0 HB2 ALA A 21 12.966 -13.227 -19.118 1.00 0.00 H new ATOM 0 HB3 ALA A 21 13.743 -14.551 -18.219 1.00 0.00 H new ATOM 338 N PHE A 22 16.791 -14.433 -17.843 1.00 0.00 N ATOM 339 CA PHE A 22 17.837 -14.786 -16.907 1.00 0.00 C ATOM 340 C PHE A 22 19.094 -13.971 -17.195 1.00 0.00 C ATOM 341 O PHE A 22 19.851 -13.670 -16.280 1.00 0.00 O ATOM 342 CB PHE A 22 18.127 -16.283 -16.987 1.00 0.00 C ATOM 343 CG PHE A 22 19.077 -16.746 -15.909 1.00 0.00 C ATOM 344 CD1 PHE A 22 18.634 -16.833 -14.582 1.00 0.00 C ATOM 345 CD2 PHE A 22 20.402 -17.082 -16.229 1.00 0.00 C ATOM 346 CE1 PHE A 22 19.513 -17.244 -13.570 1.00 0.00 C ATOM 347 CE2 PHE A 22 21.283 -17.493 -15.216 1.00 0.00 C ATOM 348 CZ PHE A 22 20.838 -17.567 -13.887 1.00 0.00 C ATOM 0 H PHE A 22 16.617 -15.127 -18.570 1.00 0.00 H new ATOM 0 HA PHE A 22 17.505 -14.555 -15.895 1.00 0.00 H new ATOM 0 HB2 PHE A 22 17.191 -16.836 -16.904 1.00 0.00 H new ATOM 0 HB3 PHE A 22 18.550 -16.516 -17.964 1.00 0.00 H new ATOM 0 HD1 PHE A 22 17.612 -16.583 -14.338 1.00 0.00 H new ATOM 0 HD2 PHE A 22 20.743 -17.024 -17.252 1.00 0.00 H new ATOM 0 HE1 PHE A 22 19.169 -17.311 -12.548 1.00 0.00 H new ATOM 0 HE2 PHE A 22 22.303 -17.752 -15.459 1.00 0.00 H new ATOM 0 HZ PHE A 22 21.519 -17.874 -13.107 1.00 0.00 H new ATOM 358 N ASN A 23 19.329 -13.603 -18.459 1.00 0.00 N ATOM 359 CA ASN A 23 20.502 -12.826 -18.817 1.00 0.00 C ATOM 360 C ASN A 23 20.438 -11.440 -18.176 1.00 0.00 C ATOM 361 O ASN A 23 21.467 -10.887 -17.796 1.00 0.00 O ATOM 362 CB ASN A 23 20.589 -12.729 -20.339 1.00 0.00 C ATOM 363 CG ASN A 23 21.814 -11.949 -20.789 1.00 0.00 C ATOM 364 OD1 ASN A 23 22.864 -12.530 -21.052 1.00 0.00 O ATOM 365 ND2 ASN A 23 21.691 -10.629 -20.873 1.00 0.00 N ATOM 0 H ASN A 23 18.719 -13.834 -19.243 1.00 0.00 H new ATOM 0 HA ASN A 23 21.400 -13.319 -18.443 1.00 0.00 H new ATOM 0 HB2 ASN A 23 20.620 -13.732 -20.765 1.00 0.00 H new ATOM 0 HB3 ASN A 23 19.690 -12.247 -20.724 1.00 0.00 H new ATOM 0 HD21 ASN A 23 22.486 -10.060 -21.165 1.00 0.00 H new ATOM 0 HD22 ASN A 23 20.802 -10.184 -20.646 1.00 0.00 H new ATOM 372 N LEU A 24 19.235 -10.872 -18.050 1.00 0.00 N ATOM 373 CA LEU A 24 19.078 -9.591 -17.376 1.00 0.00 C ATOM 374 C LEU A 24 19.190 -9.772 -15.863 1.00 0.00 C ATOM 375 O LEU A 24 19.564 -8.837 -15.160 1.00 0.00 O ATOM 376 CB LEU A 24 17.728 -8.957 -17.735 1.00 0.00 C ATOM 377 CG LEU A 24 17.699 -8.202 -19.073 1.00 0.00 C ATOM 378 CD1 LEU A 24 18.732 -7.079 -19.104 1.00 0.00 C ATOM 379 CD2 LEU A 24 17.941 -9.130 -20.263 1.00 0.00 C ATOM 0 H LEU A 24 18.368 -11.277 -18.403 1.00 0.00 H new ATOM 0 HA LEU A 24 19.874 -8.925 -17.710 1.00 0.00 H new ATOM 0 HB2 LEU A 24 16.971 -9.741 -17.761 1.00 0.00 H new ATOM 0 HB3 LEU A 24 17.445 -8.267 -16.940 1.00 0.00 H new ATOM 0 HG LEU A 24 16.699 -7.777 -19.157 1.00 0.00 H new ATOM 0 HD11 LEU A 24 18.684 -6.566 -20.065 1.00 0.00 H new ATOM 0 HD12 LEU A 24 18.522 -6.370 -18.303 1.00 0.00 H new ATOM 0 HD13 LEU A 24 19.729 -7.498 -18.966 1.00 0.00 H new ATOM 0 HD21 LEU A 24 17.912 -8.552 -21.187 1.00 0.00 H new ATOM 0 HD22 LEU A 24 18.917 -9.604 -20.162 1.00 0.00 H new ATOM 0 HD23 LEU A 24 17.167 -9.897 -20.290 1.00 0.00 H new ATOM 391 N LEU A 25 18.873 -10.969 -15.358 1.00 0.00 N ATOM 392 CA LEU A 25 18.986 -11.269 -13.940 1.00 0.00 C ATOM 393 C LEU A 25 20.451 -11.494 -13.561 1.00 0.00 C ATOM 394 O LEU A 25 20.854 -11.201 -12.438 1.00 0.00 O ATOM 395 CB LEU A 25 18.128 -12.507 -13.662 1.00 0.00 C ATOM 396 CG LEU A 25 18.046 -12.885 -12.181 1.00 0.00 C ATOM 397 CD1 LEU A 25 17.369 -11.793 -11.359 1.00 0.00 C ATOM 398 CD2 LEU A 25 17.221 -14.161 -12.063 1.00 0.00 C ATOM 0 H LEU A 25 18.534 -11.748 -15.922 1.00 0.00 H new ATOM 0 HA LEU A 25 18.631 -10.436 -13.333 1.00 0.00 H new ATOM 0 HB2 LEU A 25 17.120 -12.330 -14.038 1.00 0.00 H new ATOM 0 HB3 LEU A 25 18.533 -13.351 -14.220 1.00 0.00 H new ATOM 0 HG LEU A 25 19.058 -13.021 -11.800 1.00 0.00 H new ATOM 0 HD11 LEU A 25 17.329 -12.097 -10.313 1.00 0.00 H new ATOM 0 HD12 LEU A 25 17.937 -10.867 -11.446 1.00 0.00 H new ATOM 0 HD13 LEU A 25 16.356 -11.634 -11.729 1.00 0.00 H new ATOM 0 HD21 LEU A 25 17.148 -14.451 -11.015 1.00 0.00 H new ATOM 0 HD22 LEU A 25 16.222 -13.986 -12.462 1.00 0.00 H new ATOM 0 HD23 LEU A 25 17.703 -14.959 -12.628 1.00 0.00 H new ATOM 410 N VAL A 26 21.253 -12.013 -14.497 1.00 0.00 N ATOM 411 CA VAL A 26 22.676 -12.222 -14.275 1.00 0.00 C ATOM 412 C VAL A 26 23.377 -10.877 -14.167 1.00 0.00 C ATOM 413 O VAL A 26 24.147 -10.669 -13.237 1.00 0.00 O ATOM 414 CB VAL A 26 23.275 -13.045 -15.424 1.00 0.00 C ATOM 415 CG1 VAL A 26 24.805 -13.039 -15.368 1.00 0.00 C ATOM 416 CG2 VAL A 26 22.811 -14.501 -15.344 1.00 0.00 C ATOM 0 H VAL A 26 20.930 -12.296 -15.422 1.00 0.00 H new ATOM 0 HA VAL A 26 22.818 -12.773 -13.345 1.00 0.00 H new ATOM 0 HB VAL A 26 22.935 -12.588 -16.354 1.00 0.00 H new ATOM 0 HG11 VAL A 26 25.202 -13.630 -16.194 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.168 -12.014 -15.448 1.00 0.00 H new ATOM 0 HG13 VAL A 26 25.136 -13.469 -14.423 1.00 0.00 H new ATOM 0 HG21 VAL A 26 23.247 -15.067 -16.167 1.00 0.00 H new ATOM 0 HG22 VAL A 26 23.132 -14.933 -14.396 1.00 0.00 H new ATOM 0 HG23 VAL A 26 21.724 -14.541 -15.412 1.00 0.00 H new ATOM 426 N VAL A 27 23.119 -9.962 -15.106 1.00 0.00 N ATOM 427 CA VAL A 27 23.772 -8.656 -15.117 1.00 0.00 C ATOM 428 C VAL A 27 23.308 -7.813 -13.932 1.00 0.00 C ATOM 429 O VAL A 27 24.020 -6.905 -13.504 1.00 0.00 O ATOM 430 CB VAL A 27 23.488 -7.955 -16.451 1.00 0.00 C ATOM 431 CG1 VAL A 27 24.082 -6.547 -16.491 1.00 0.00 C ATOM 432 CG2 VAL A 27 24.111 -8.759 -17.594 1.00 0.00 C ATOM 0 H VAL A 27 22.459 -10.106 -15.870 1.00 0.00 H new ATOM 0 HA VAL A 27 24.849 -8.788 -15.018 1.00 0.00 H new ATOM 0 HB VAL A 27 22.405 -7.887 -16.558 1.00 0.00 H new ATOM 0 HG11 VAL A 27 23.858 -6.085 -17.453 1.00 0.00 H new ATOM 0 HG12 VAL A 27 23.649 -5.947 -15.691 1.00 0.00 H new ATOM 0 HG13 VAL A 27 25.162 -6.604 -16.358 1.00 0.00 H new ATOM 0 HG21 VAL A 27 23.909 -8.260 -18.542 1.00 0.00 H new ATOM 0 HG22 VAL A 27 25.188 -8.830 -17.444 1.00 0.00 H new ATOM 0 HG23 VAL A 27 23.680 -9.760 -17.612 1.00 0.00 H new ATOM 442 N ARG A 28 22.119 -8.104 -13.391 1.00 0.00 N ATOM 443 CA ARG A 28 21.580 -7.373 -12.254 1.00 0.00 C ATOM 444 C ARG A 28 22.372 -7.674 -10.984 1.00 0.00 C ATOM 445 O ARG A 28 22.479 -6.814 -10.111 1.00 0.00 O ATOM 446 CB ARG A 28 20.105 -7.748 -12.101 1.00 0.00 C ATOM 447 CG ARG A 28 19.429 -6.948 -10.988 1.00 0.00 C ATOM 448 CD ARG A 28 17.927 -7.210 -10.984 1.00 0.00 C ATOM 449 NE ARG A 28 17.293 -6.693 -12.203 1.00 0.00 N ATOM 450 CZ ARG A 28 15.974 -6.594 -12.382 1.00 0.00 C ATOM 451 NH1 ARG A 28 15.121 -6.992 -11.443 1.00 0.00 N ATOM 452 NH2 ARG A 28 15.490 -6.091 -13.513 1.00 0.00 N ATOM 0 H ARG A 28 21.512 -8.849 -13.732 1.00 0.00 H new ATOM 0 HA ARG A 28 21.665 -6.300 -12.425 1.00 0.00 H new ATOM 0 HB2 ARG A 28 19.585 -7.571 -13.043 1.00 0.00 H new ATOM 0 HB3 ARG A 28 20.021 -8.813 -11.886 1.00 0.00 H new ATOM 0 HG2 ARG A 28 19.855 -7.223 -10.023 1.00 0.00 H new ATOM 0 HG3 ARG A 28 19.619 -5.884 -11.129 1.00 0.00 H new ATOM 0 HD2 ARG A 28 17.743 -8.281 -10.902 1.00 0.00 H new ATOM 0 HD3 ARG A 28 17.476 -6.741 -10.110 1.00 0.00 H new ATOM 0 HE ARG A 28 17.901 -6.389 -12.964 1.00 0.00 H new ATOM 0 HH11 ARG A 28 15.471 -7.381 -10.568 1.00 0.00 H new ATOM 0 HH12 ARG A 28 14.116 -6.908 -11.598 1.00 0.00 H new ATOM 0 HH21 ARG A 28 16.127 -5.780 -14.246 1.00 0.00 H new ATOM 0 HH22 ARG A 28 14.482 -6.016 -13.648 1.00 0.00 H new ATOM 466 N TYR A 29 22.925 -8.886 -10.874 1.00 0.00 N ATOM 467 CA TYR A 29 23.695 -9.292 -9.704 1.00 0.00 C ATOM 468 C TYR A 29 25.167 -9.544 -10.014 1.00 0.00 C ATOM 469 O TYR A 29 25.920 -9.889 -9.109 1.00 0.00 O ATOM 470 CB TYR A 29 23.041 -10.524 -9.082 1.00 0.00 C ATOM 471 CG TYR A 29 21.693 -10.224 -8.471 1.00 0.00 C ATOM 472 CD1 TYR A 29 21.620 -9.450 -7.301 1.00 0.00 C ATOM 473 CD2 TYR A 29 20.523 -10.710 -9.067 1.00 0.00 C ATOM 474 CE1 TYR A 29 20.375 -9.154 -6.729 1.00 0.00 C ATOM 475 CE2 TYR A 29 19.273 -10.414 -8.505 1.00 0.00 C ATOM 476 CZ TYR A 29 19.195 -9.639 -7.330 1.00 0.00 C ATOM 477 OH TYR A 29 17.979 -9.363 -6.777 1.00 0.00 O ATOM 0 H TYR A 29 22.850 -9.607 -11.592 1.00 0.00 H new ATOM 0 HA TYR A 29 23.684 -8.467 -8.992 1.00 0.00 H new ATOM 0 HB2 TYR A 29 22.926 -11.293 -9.846 1.00 0.00 H new ATOM 0 HB3 TYR A 29 23.700 -10.932 -8.315 1.00 0.00 H new ATOM 0 HD1 TYR A 29 22.525 -9.082 -6.841 1.00 0.00 H new ATOM 0 HD2 TYR A 29 20.583 -11.314 -9.961 1.00 0.00 H new ATOM 0 HE1 TYR A 29 20.320 -8.557 -5.831 1.00 0.00 H new ATOM 0 HE2 TYR A 29 18.370 -10.780 -8.972 1.00 0.00 H new ATOM 0 HH TYR A 29 18.018 -8.500 -6.314 1.00 0.00 H new ATOM 487 N GLN A 30 25.592 -9.384 -11.268 1.00 0.00 N ATOM 488 CA GLN A 30 26.945 -9.727 -11.683 1.00 0.00 C ATOM 489 C GLN A 30 28.003 -8.962 -10.888 1.00 0.00 C ATOM 490 O GLN A 30 29.033 -9.528 -10.530 1.00 0.00 O ATOM 491 CB GLN A 30 27.083 -9.444 -13.181 1.00 0.00 C ATOM 492 CG GLN A 30 28.508 -9.707 -13.659 1.00 0.00 C ATOM 493 CD GLN A 30 28.637 -9.491 -15.160 1.00 0.00 C ATOM 494 OE1 GLN A 30 29.144 -8.465 -15.606 1.00 0.00 O ATOM 495 NE2 GLN A 30 28.179 -10.455 -15.955 1.00 0.00 N ATOM 0 H GLN A 30 25.008 -9.015 -12.018 1.00 0.00 H new ATOM 0 HA GLN A 30 27.114 -10.785 -11.484 1.00 0.00 H new ATOM 0 HB2 GLN A 30 26.387 -10.071 -13.739 1.00 0.00 H new ATOM 0 HB3 GLN A 30 26.813 -8.408 -13.385 1.00 0.00 H new ATOM 0 HG2 GLN A 30 29.198 -9.046 -13.134 1.00 0.00 H new ATOM 0 HG3 GLN A 30 28.794 -10.729 -13.411 1.00 0.00 H new ATOM 0 HE21 GLN A 30 27.764 -11.295 -15.551 1.00 0.00 H new ATOM 0 HE22 GLN A 30 28.243 -10.354 -16.968 1.00 0.00 H new ATOM 504 N HIS A 31 27.764 -7.680 -10.603 1.00 0.00 N ATOM 505 CA HIS A 31 28.736 -6.876 -9.877 1.00 0.00 C ATOM 506 C HIS A 31 28.607 -7.094 -8.372 1.00 0.00 C ATOM 507 O HIS A 31 29.562 -6.866 -7.632 1.00 0.00 O ATOM 508 CB HIS A 31 28.539 -5.404 -10.237 1.00 0.00 C ATOM 509 CG HIS A 31 28.678 -5.154 -11.717 1.00 0.00 C ATOM 510 ND1 HIS A 31 29.881 -5.161 -12.428 1.00 0.00 N ATOM 511 CD2 HIS A 31 27.651 -4.883 -12.575 1.00 0.00 C ATOM 512 CE1 HIS A 31 29.542 -4.894 -13.703 1.00 0.00 C ATOM 513 NE2 HIS A 31 28.214 -4.722 -13.817 1.00 0.00 N ATOM 0 H HIS A 31 26.912 -7.184 -10.863 1.00 0.00 H new ATOM 0 HA HIS A 31 29.742 -7.182 -10.164 1.00 0.00 H new ATOM 0 HB2 HIS A 31 27.552 -5.080 -9.907 1.00 0.00 H new ATOM 0 HB3 HIS A 31 29.269 -4.800 -9.698 1.00 0.00 H new ATOM 0 HD2 HIS A 31 26.603 -4.810 -12.326 1.00 0.00 H new ATOM 0 HE1 HIS A 31 30.242 -4.827 -14.523 1.00 0.00 H new ATOM 0 HE2 HIS A 31 27.711 -4.509 -14.678 1.00 0.00 H new ATOM 521 N LYS A 32 27.430 -7.537 -7.916 1.00 0.00 N ATOM 522 CA LYS A 32 27.170 -7.714 -6.496 1.00 0.00 C ATOM 523 C LYS A 32 27.660 -9.076 -6.020 1.00 0.00 C ATOM 524 O LYS A 32 28.092 -9.219 -4.876 1.00 0.00 O ATOM 525 CB LYS A 32 25.668 -7.546 -6.247 1.00 0.00 C ATOM 526 CG LYS A 32 25.418 -7.139 -4.799 1.00 0.00 C ATOM 527 CD LYS A 32 23.912 -7.061 -4.527 1.00 0.00 C ATOM 528 CE LYS A 32 23.625 -6.453 -3.153 1.00 0.00 C ATOM 529 NZ LYS A 32 24.397 -7.119 -2.084 1.00 0.00 N ATOM 0 H LYS A 32 26.643 -7.779 -8.519 1.00 0.00 H new ATOM 0 HA LYS A 32 27.715 -6.962 -5.927 1.00 0.00 H new ATOM 0 HB2 LYS A 32 25.262 -6.791 -6.920 1.00 0.00 H new ATOM 0 HB3 LYS A 32 25.149 -8.479 -6.465 1.00 0.00 H new ATOM 0 HG2 LYS A 32 25.880 -7.860 -4.125 1.00 0.00 H new ATOM 0 HG3 LYS A 32 25.882 -6.173 -4.599 1.00 0.00 H new ATOM 0 HD2 LYS A 32 23.432 -6.461 -5.300 1.00 0.00 H new ATOM 0 HD3 LYS A 32 23.478 -8.059 -4.583 1.00 0.00 H new ATOM 0 HE2 LYS A 32 23.868 -5.391 -3.168 1.00 0.00 H new ATOM 0 HE3 LYS A 32 22.560 -6.533 -2.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 24.031 -6.824 -1.156 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 24.305 -8.150 -2.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 25.399 -6.852 -2.162 1.00 0.00 H new ATOM 543 N VAL A 33 27.597 -10.083 -6.894 1.00 0.00 N ATOM 544 CA VAL A 33 28.062 -11.421 -6.567 1.00 0.00 C ATOM 545 C VAL A 33 29.577 -11.490 -6.708 1.00 0.00 C ATOM 546 O VAL A 33 30.223 -12.279 -6.023 1.00 0.00 O ATOM 547 CB VAL A 33 27.347 -12.450 -7.452 1.00 0.00 C ATOM 548 CG1 VAL A 33 27.876 -12.428 -8.881 1.00 0.00 C ATOM 549 CG2 VAL A 33 27.527 -13.854 -6.880 1.00 0.00 C ATOM 0 H VAL A 33 27.225 -9.990 -7.839 1.00 0.00 H new ATOM 0 HA VAL A 33 27.820 -11.658 -5.531 1.00 0.00 H new ATOM 0 HB VAL A 33 26.290 -12.184 -7.468 1.00 0.00 H new ATOM 0 HG11 VAL A 33 27.345 -13.170 -9.477 1.00 0.00 H new ATOM 0 HG12 VAL A 33 27.721 -11.439 -9.311 1.00 0.00 H new ATOM 0 HG13 VAL A 33 28.941 -12.659 -8.878 1.00 0.00 H new ATOM 0 HG21 VAL A 33 27.015 -14.575 -7.517 1.00 0.00 H new ATOM 0 HG22 VAL A 33 28.589 -14.097 -6.838 1.00 0.00 H new ATOM 0 HG23 VAL A 33 27.106 -13.894 -5.875 1.00 0.00 H new ATOM 559 N ALA A 34 30.155 -10.667 -7.587 1.00 0.00 N ATOM 560 CA ALA A 34 31.596 -10.614 -7.751 1.00 0.00 C ATOM 561 C ALA A 34 32.244 -9.987 -6.520 1.00 0.00 C ATOM 562 O ALA A 34 33.397 -10.280 -6.215 1.00 0.00 O ATOM 563 CB ALA A 34 31.917 -9.815 -9.014 1.00 0.00 C ATOM 0 H ALA A 34 29.639 -10.030 -8.194 1.00 0.00 H new ATOM 0 HA ALA A 34 31.998 -11.622 -7.856 1.00 0.00 H new ATOM 0 HB1 ALA A 34 32.997 -9.767 -9.149 1.00 0.00 H new ATOM 0 HB2 ALA A 34 31.464 -10.302 -9.878 1.00 0.00 H new ATOM 0 HB3 ALA A 34 31.519 -8.805 -8.917 1.00 0.00 H new ATOM 569 N SER A 35 31.508 -9.124 -5.814 1.00 0.00 N ATOM 570 CA SER A 35 31.968 -8.527 -4.568 1.00 0.00 C ATOM 571 C SER A 35 31.830 -9.511 -3.409 1.00 0.00 C ATOM 572 O SER A 35 32.501 -9.359 -2.389 1.00 0.00 O ATOM 573 CB SER A 35 31.184 -7.247 -4.283 1.00 0.00 C ATOM 574 OG SER A 35 31.436 -6.299 -5.299 1.00 0.00 O ATOM 0 H SER A 35 30.575 -8.822 -6.095 1.00 0.00 H new ATOM 0 HA SER A 35 33.024 -8.278 -4.671 1.00 0.00 H new ATOM 0 HB2 SER A 35 30.117 -7.466 -4.233 1.00 0.00 H new ATOM 0 HB3 SER A 35 31.472 -6.841 -3.313 1.00 0.00 H new ATOM 0 HG SER A 35 30.830 -6.459 -6.053 1.00 0.00 H new ATOM 580 N LEU A 36 30.963 -10.520 -3.550 1.00 0.00 N ATOM 581 CA LEU A 36 30.794 -11.544 -2.530 1.00 0.00 C ATOM 582 C LEU A 36 31.831 -12.657 -2.667 1.00 0.00 C ATOM 583 O LEU A 36 32.399 -13.078 -1.662 1.00 0.00 O ATOM 584 CB LEU A 36 29.376 -12.116 -2.635 1.00 0.00 C ATOM 585 CG LEU A 36 29.156 -13.312 -1.707 1.00 0.00 C ATOM 586 CD1 LEU A 36 29.369 -12.945 -0.237 1.00 0.00 C ATOM 587 CD2 LEU A 36 27.724 -13.804 -1.878 1.00 0.00 C ATOM 0 H LEU A 36 30.367 -10.644 -4.369 1.00 0.00 H new ATOM 0 HA LEU A 36 30.942 -11.090 -1.550 1.00 0.00 H new ATOM 0 HB2 LEU A 36 28.654 -11.336 -2.394 1.00 0.00 H new ATOM 0 HB3 LEU A 36 29.185 -12.419 -3.664 1.00 0.00 H new ATOM 0 HG LEU A 36 29.880 -14.082 -1.974 1.00 0.00 H new ATOM 0 HD11 LEU A 36 29.202 -13.824 0.385 1.00 0.00 H new ATOM 0 HD12 LEU A 36 30.389 -12.588 -0.095 1.00 0.00 H new ATOM 0 HD13 LEU A 36 28.667 -12.161 0.048 1.00 0.00 H new ATOM 0 HD21 LEU A 36 27.552 -14.657 -1.222 1.00 0.00 H new ATOM 0 HD22 LEU A 36 27.031 -13.003 -1.621 1.00 0.00 H new ATOM 0 HD23 LEU A 36 27.564 -14.104 -2.914 1.00 0.00 H new ATOM 599 N VAL A 37 32.093 -13.148 -3.883 1.00 0.00 N ATOM 600 CA VAL A 37 33.023 -14.265 -4.039 1.00 0.00 C ATOM 601 C VAL A 37 34.472 -13.805 -3.967 1.00 0.00 C ATOM 602 O VAL A 37 35.353 -14.609 -3.673 1.00 0.00 O ATOM 603 CB VAL A 37 32.755 -15.056 -5.322 1.00 0.00 C ATOM 604 CG1 VAL A 37 31.291 -15.488 -5.410 1.00 0.00 C ATOM 605 CG2 VAL A 37 33.119 -14.271 -6.576 1.00 0.00 C ATOM 0 H VAL A 37 31.685 -12.799 -4.751 1.00 0.00 H new ATOM 0 HA VAL A 37 32.850 -14.939 -3.200 1.00 0.00 H new ATOM 0 HB VAL A 37 33.394 -15.937 -5.272 1.00 0.00 H new ATOM 0 HG11 VAL A 37 31.132 -16.048 -6.332 1.00 0.00 H new ATOM 0 HG12 VAL A 37 31.046 -16.119 -4.556 1.00 0.00 H new ATOM 0 HG13 VAL A 37 30.651 -14.606 -5.406 1.00 0.00 H new ATOM 0 HG21 VAL A 37 32.910 -14.877 -7.458 1.00 0.00 H new ATOM 0 HG22 VAL A 37 32.529 -13.355 -6.616 1.00 0.00 H new ATOM 0 HG23 VAL A 37 34.179 -14.019 -6.552 1.00 0.00 H new ATOM 615 N SER A 38 34.738 -12.522 -4.232 1.00 0.00 N ATOM 616 CA SER A 38 36.086 -11.983 -4.138 1.00 0.00 C ATOM 617 C SER A 38 36.622 -12.087 -2.711 1.00 0.00 C ATOM 618 O SER A 38 37.822 -11.948 -2.482 1.00 0.00 O ATOM 619 CB SER A 38 36.098 -10.535 -4.617 1.00 0.00 C ATOM 620 OG SER A 38 35.305 -9.738 -3.764 1.00 0.00 O ATOM 0 H SER A 38 34.032 -11.842 -4.513 1.00 0.00 H new ATOM 0 HA SER A 38 36.741 -12.573 -4.779 1.00 0.00 H new ATOM 0 HB2 SER A 38 37.120 -10.158 -4.634 1.00 0.00 H new ATOM 0 HB3 SER A 38 35.720 -10.478 -5.638 1.00 0.00 H new ATOM 0 HG SER A 38 35.319 -8.810 -4.077 1.00 0.00 H new ATOM 626 N ARG A 39 35.728 -12.328 -1.747 1.00 0.00 N ATOM 627 CA ARG A 39 36.083 -12.486 -0.344 1.00 0.00 C ATOM 628 C ARG A 39 36.647 -13.880 -0.068 1.00 0.00 C ATOM 629 O ARG A 39 37.159 -14.123 1.022 1.00 0.00 O ATOM 630 CB ARG A 39 34.842 -12.239 0.520 1.00 0.00 C ATOM 631 CG ARG A 39 34.159 -10.917 0.159 1.00 0.00 C ATOM 632 CD ARG A 39 32.916 -10.720 1.020 1.00 0.00 C ATOM 633 NE ARG A 39 32.164 -9.539 0.581 1.00 0.00 N ATOM 634 CZ ARG A 39 31.167 -8.980 1.275 1.00 0.00 C ATOM 635 NH1 ARG A 39 30.773 -9.491 2.438 1.00 0.00 N ATOM 636 NH2 ARG A 39 30.558 -7.898 0.803 1.00 0.00 N ATOM 0 H ARG A 39 34.728 -12.419 -1.927 1.00 0.00 H new ATOM 0 HA ARG A 39 36.857 -11.760 -0.096 1.00 0.00 H new ATOM 0 HB2 ARG A 39 34.138 -13.061 0.390 1.00 0.00 H new ATOM 0 HB3 ARG A 39 35.127 -12.227 1.572 1.00 0.00 H new ATOM 0 HG2 ARG A 39 34.851 -10.088 0.309 1.00 0.00 H new ATOM 0 HG3 ARG A 39 33.885 -10.916 -0.896 1.00 0.00 H new ATOM 0 HD2 ARG A 39 32.282 -11.604 0.960 1.00 0.00 H new ATOM 0 HD3 ARG A 39 33.205 -10.606 2.065 1.00 0.00 H new ATOM 0 HE ARG A 39 32.418 -9.117 -0.312 1.00 0.00 H new ATOM 0 HH11 ARG A 39 31.233 -10.321 2.812 1.00 0.00 H new ATOM 0 HH12 ARG A 39 30.011 -9.053 2.956 1.00 0.00 H new ATOM 0 HH21 ARG A 39 30.851 -7.495 -0.087 1.00 0.00 H new ATOM 0 HH22 ARG A 39 29.797 -7.470 1.331 1.00 0.00 H new ATOM 650 N TYR A 40 36.558 -14.789 -1.047 1.00 0.00 N ATOM 651 CA TYR A 40 37.010 -16.168 -0.882 1.00 0.00 C ATOM 652 C TYR A 40 37.985 -16.599 -1.981 1.00 0.00 C ATOM 653 O TYR A 40 38.680 -17.600 -1.816 1.00 0.00 O ATOM 654 CB TYR A 40 35.787 -17.083 -0.830 1.00 0.00 C ATOM 655 CG TYR A 40 34.752 -16.631 0.177 1.00 0.00 C ATOM 656 CD1 TYR A 40 34.955 -16.866 1.544 1.00 0.00 C ATOM 657 CD2 TYR A 40 33.596 -15.961 -0.259 1.00 0.00 C ATOM 658 CE1 TYR A 40 34.008 -16.424 2.482 1.00 0.00 C ATOM 659 CE2 TYR A 40 32.646 -15.518 0.670 1.00 0.00 C ATOM 660 CZ TYR A 40 32.854 -15.747 2.047 1.00 0.00 C ATOM 661 OH TYR A 40 31.935 -15.313 2.958 1.00 0.00 O ATOM 0 H TYR A 40 36.172 -14.587 -1.969 1.00 0.00 H new ATOM 0 HA TYR A 40 37.565 -16.243 0.053 1.00 0.00 H new ATOM 0 HB2 TYR A 40 35.330 -17.125 -1.819 1.00 0.00 H new ATOM 0 HB3 TYR A 40 36.108 -18.095 -0.584 1.00 0.00 H new ATOM 0 HD1 TYR A 40 35.841 -17.387 1.876 1.00 0.00 H new ATOM 0 HD2 TYR A 40 33.440 -15.787 -1.313 1.00 0.00 H new ATOM 0 HE1 TYR A 40 34.165 -16.603 3.535 1.00 0.00 H new ATOM 0 HE2 TYR A 40 31.758 -15.003 0.334 1.00 0.00 H new ATOM 0 HH TYR A 40 31.199 -14.864 2.492 1.00 0.00 H new ATOM 671 N VAL A 41 38.049 -15.862 -3.098 1.00 0.00 N ATOM 672 CA VAL A 41 39.000 -16.140 -4.172 1.00 0.00 C ATOM 673 C VAL A 41 39.657 -14.847 -4.650 1.00 0.00 C ATOM 674 O VAL A 41 39.063 -13.774 -4.538 1.00 0.00 O ATOM 675 CB VAL A 41 38.328 -16.851 -5.357 1.00 0.00 C ATOM 676 CG1 VAL A 41 38.060 -18.318 -5.040 1.00 0.00 C ATOM 677 CG2 VAL A 41 37.018 -16.189 -5.776 1.00 0.00 C ATOM 0 H VAL A 41 37.444 -15.061 -3.278 1.00 0.00 H new ATOM 0 HA VAL A 41 39.762 -16.806 -3.767 1.00 0.00 H new ATOM 0 HB VAL A 41 39.031 -16.773 -6.187 1.00 0.00 H new ATOM 0 HG11 VAL A 41 37.584 -18.794 -5.897 1.00 0.00 H new ATOM 0 HG12 VAL A 41 39.002 -18.821 -4.822 1.00 0.00 H new ATOM 0 HG13 VAL A 41 37.402 -18.389 -4.174 1.00 0.00 H new ATOM 0 HG21 VAL A 41 36.588 -16.733 -6.617 1.00 0.00 H new ATOM 0 HG22 VAL A 41 36.319 -16.203 -4.939 1.00 0.00 H new ATOM 0 HG23 VAL A 41 37.210 -15.158 -6.071 1.00 0.00 H new ATOM 687 N PRO A 42 40.883 -14.933 -5.190 1.00 0.00 N ATOM 688 CA PRO A 42 41.599 -13.790 -5.728 1.00 0.00 C ATOM 689 C PRO A 42 40.928 -13.323 -7.019 1.00 0.00 C ATOM 690 O PRO A 42 40.171 -14.075 -7.634 1.00 0.00 O ATOM 691 CB PRO A 42 43.021 -14.290 -5.977 1.00 0.00 C ATOM 692 CG PRO A 42 42.811 -15.773 -6.277 1.00 0.00 C ATOM 693 CD PRO A 42 41.670 -16.147 -5.334 1.00 0.00 C ATOM 0 HA PRO A 42 41.601 -12.934 -5.053 1.00 0.00 H new ATOM 0 HB2 PRO A 42 43.492 -13.771 -6.812 1.00 0.00 H new ATOM 0 HB3 PRO A 42 43.661 -14.140 -5.107 1.00 0.00 H new ATOM 0 HG2 PRO A 42 42.546 -15.942 -7.321 1.00 0.00 H new ATOM 0 HG3 PRO A 42 43.709 -16.358 -6.078 1.00 0.00 H new ATOM 0 HD2 PRO A 42 41.070 -16.959 -5.744 1.00 0.00 H new ATOM 0 HD3 PRO A 42 42.050 -16.487 -4.371 1.00 0.00 H new ATOM 701 N SER A 43 41.210 -12.085 -7.431 1.00 0.00 N ATOM 702 CA SER A 43 40.574 -11.461 -8.583 1.00 0.00 C ATOM 703 C SER A 43 40.800 -12.243 -9.877 1.00 0.00 C ATOM 704 O SER A 43 40.095 -12.014 -10.857 1.00 0.00 O ATOM 705 CB SER A 43 41.114 -10.043 -8.726 1.00 0.00 C ATOM 706 OG SER A 43 40.875 -9.318 -7.538 1.00 0.00 O ATOM 0 H SER A 43 41.893 -11.486 -6.967 1.00 0.00 H new ATOM 0 HA SER A 43 39.498 -11.450 -8.412 1.00 0.00 H new ATOM 0 HB2 SER A 43 42.183 -10.071 -8.937 1.00 0.00 H new ATOM 0 HB3 SER A 43 40.635 -9.545 -9.569 1.00 0.00 H new ATOM 0 HG SER A 43 41.225 -8.408 -7.634 1.00 0.00 H new ATOM 712 N GLY A 44 41.771 -13.160 -9.891 1.00 0.00 N ATOM 713 CA GLY A 44 42.060 -13.976 -11.060 1.00 0.00 C ATOM 714 C GLY A 44 41.073 -15.132 -11.224 1.00 0.00 C ATOM 715 O GLY A 44 41.018 -15.734 -12.294 1.00 0.00 O ATOM 0 H GLY A 44 42.374 -13.353 -9.091 1.00 0.00 H new ATOM 0 HA2 GLY A 44 42.033 -13.350 -11.952 1.00 0.00 H new ATOM 0 HA3 GLY A 44 43.071 -14.374 -10.980 1.00 0.00 H new ATOM 719 N ASP A 45 40.300 -15.447 -10.179 1.00 0.00 N ATOM 720 CA ASP A 45 39.330 -16.536 -10.216 1.00 0.00 C ATOM 721 C ASP A 45 37.901 -16.041 -9.994 1.00 0.00 C ATOM 722 O ASP A 45 36.964 -16.824 -10.118 1.00 0.00 O ATOM 723 CB ASP A 45 39.711 -17.595 -9.178 1.00 0.00 C ATOM 724 CG ASP A 45 41.060 -18.237 -9.495 1.00 0.00 C ATOM 725 OD1 ASP A 45 41.231 -18.705 -10.640 1.00 0.00 O ATOM 726 OD2 ASP A 45 41.915 -18.257 -8.582 1.00 0.00 O ATOM 0 H ASP A 45 40.332 -14.953 -9.287 1.00 0.00 H new ATOM 0 HA ASP A 45 39.355 -16.980 -11.211 1.00 0.00 H new ATOM 0 HB2 ASP A 45 39.749 -17.138 -8.189 1.00 0.00 H new ATOM 0 HB3 ASP A 45 38.940 -18.365 -9.144 1.00 0.00 H new ATOM 731 N VAL A 46 37.714 -14.758 -9.670 1.00 0.00 N ATOM 732 CA VAL A 46 36.381 -14.205 -9.443 1.00 0.00 C ATOM 733 C VAL A 46 35.455 -14.418 -10.644 1.00 0.00 C ATOM 734 O VAL A 46 34.351 -14.917 -10.446 1.00 0.00 O ATOM 735 CB VAL A 46 36.478 -12.718 -9.077 1.00 0.00 C ATOM 736 CG1 VAL A 46 35.101 -12.052 -9.053 1.00 0.00 C ATOM 737 CG2 VAL A 46 37.082 -12.566 -7.684 1.00 0.00 C ATOM 0 H VAL A 46 38.472 -14.084 -9.560 1.00 0.00 H new ATOM 0 HA VAL A 46 35.938 -14.744 -8.606 1.00 0.00 H new ATOM 0 HB VAL A 46 37.101 -12.242 -9.834 1.00 0.00 H new ATOM 0 HG11 VAL A 46 35.210 -11.000 -8.790 1.00 0.00 H new ATOM 0 HG12 VAL A 46 34.640 -12.134 -10.037 1.00 0.00 H new ATOM 0 HG13 VAL A 46 34.470 -12.547 -8.315 1.00 0.00 H new ATOM 0 HG21 VAL A 46 37.148 -11.508 -7.430 1.00 0.00 H new ATOM 0 HG22 VAL A 46 36.450 -13.075 -6.956 1.00 0.00 H new ATOM 0 HG23 VAL A 46 38.079 -13.006 -7.670 1.00 0.00 H new ATOM 747 N PRO A 47 35.841 -14.068 -11.880 1.00 0.00 N ATOM 748 CA PRO A 47 34.933 -14.154 -13.016 1.00 0.00 C ATOM 749 C PRO A 47 34.585 -15.601 -13.367 1.00 0.00 C ATOM 750 O PRO A 47 33.557 -15.843 -14.000 1.00 0.00 O ATOM 751 CB PRO A 47 35.662 -13.460 -14.166 1.00 0.00 C ATOM 752 CG PRO A 47 37.133 -13.665 -13.814 1.00 0.00 C ATOM 753 CD PRO A 47 37.131 -13.555 -12.294 1.00 0.00 C ATOM 0 HA PRO A 47 33.977 -13.680 -12.794 1.00 0.00 H new ATOM 0 HB2 PRO A 47 35.412 -13.905 -15.129 1.00 0.00 H new ATOM 0 HB3 PRO A 47 35.405 -12.402 -14.227 1.00 0.00 H new ATOM 0 HG2 PRO A 47 37.498 -14.636 -14.149 1.00 0.00 H new ATOM 0 HG3 PRO A 47 37.769 -12.909 -14.274 1.00 0.00 H new ATOM 0 HD2 PRO A 47 37.944 -14.133 -11.856 1.00 0.00 H new ATOM 0 HD3 PRO A 47 37.266 -12.522 -11.973 1.00 0.00 H new ATOM 761 N ASP A 48 35.419 -16.564 -12.965 1.00 0.00 N ATOM 762 CA ASP A 48 35.153 -17.969 -13.233 1.00 0.00 C ATOM 763 C ASP A 48 34.255 -18.564 -12.150 1.00 0.00 C ATOM 764 O ASP A 48 33.471 -19.473 -12.427 1.00 0.00 O ATOM 765 CB ASP A 48 36.476 -18.727 -13.311 1.00 0.00 C ATOM 766 CG ASP A 48 37.323 -18.243 -14.482 1.00 0.00 C ATOM 767 OD1 ASP A 48 37.023 -18.663 -15.621 1.00 0.00 O ATOM 768 OD2 ASP A 48 38.264 -17.456 -14.228 1.00 0.00 O ATOM 0 H ASP A 48 36.284 -16.390 -12.453 1.00 0.00 H new ATOM 0 HA ASP A 48 34.631 -18.059 -14.186 1.00 0.00 H new ATOM 0 HB2 ASP A 48 37.029 -18.595 -12.381 1.00 0.00 H new ATOM 0 HB3 ASP A 48 36.281 -19.794 -13.417 1.00 0.00 H new ATOM 773 N VAL A 49 34.357 -18.060 -10.916 1.00 0.00 N ATOM 774 CA VAL A 49 33.529 -18.525 -9.810 1.00 0.00 C ATOM 775 C VAL A 49 32.161 -17.847 -9.856 1.00 0.00 C ATOM 776 O VAL A 49 31.171 -18.437 -9.429 1.00 0.00 O ATOM 777 CB VAL A 49 34.265 -18.242 -8.495 1.00 0.00 C ATOM 778 CG1 VAL A 49 33.378 -18.518 -7.286 1.00 0.00 C ATOM 779 CG2 VAL A 49 35.487 -19.152 -8.390 1.00 0.00 C ATOM 0 H VAL A 49 35.014 -17.322 -10.661 1.00 0.00 H new ATOM 0 HA VAL A 49 33.356 -19.598 -9.888 1.00 0.00 H new ATOM 0 HB VAL A 49 34.551 -17.190 -8.499 1.00 0.00 H new ATOM 0 HG11 VAL A 49 33.933 -18.307 -6.372 1.00 0.00 H new ATOM 0 HG12 VAL A 49 32.495 -17.881 -7.330 1.00 0.00 H new ATOM 0 HG13 VAL A 49 33.072 -19.564 -7.291 1.00 0.00 H new ATOM 0 HG21 VAL A 49 36.011 -18.951 -7.455 1.00 0.00 H new ATOM 0 HG22 VAL A 49 35.168 -20.194 -8.411 1.00 0.00 H new ATOM 0 HG23 VAL A 49 36.156 -18.961 -9.229 1.00 0.00 H new ATOM 789 N VAL A 50 32.094 -16.617 -10.376 1.00 0.00 N ATOM 790 CA VAL A 50 30.824 -15.925 -10.537 1.00 0.00 C ATOM 791 C VAL A 50 30.021 -16.580 -11.650 1.00 0.00 C ATOM 792 O VAL A 50 28.801 -16.703 -11.546 1.00 0.00 O ATOM 793 CB VAL A 50 31.075 -14.453 -10.870 1.00 0.00 C ATOM 794 CG1 VAL A 50 29.792 -13.794 -11.381 1.00 0.00 C ATOM 795 CG2 VAL A 50 31.553 -13.705 -9.627 1.00 0.00 C ATOM 0 H VAL A 50 32.906 -16.086 -10.690 1.00 0.00 H new ATOM 0 HA VAL A 50 30.260 -15.987 -9.606 1.00 0.00 H new ATOM 0 HB VAL A 50 31.841 -14.407 -11.644 1.00 0.00 H new ATOM 0 HG11 VAL A 50 29.988 -12.747 -11.613 1.00 0.00 H new ATOM 0 HG12 VAL A 50 29.452 -14.308 -12.280 1.00 0.00 H new ATOM 0 HG13 VAL A 50 29.020 -13.857 -10.614 1.00 0.00 H new ATOM 0 HG21 VAL A 50 31.728 -12.659 -9.877 1.00 0.00 H new ATOM 0 HG22 VAL A 50 30.793 -13.770 -8.849 1.00 0.00 H new ATOM 0 HG23 VAL A 50 32.480 -14.152 -9.267 1.00 0.00 H new ATOM 805 N GLN A 51 30.693 -17.007 -12.725 1.00 0.00 N ATOM 806 CA GLN A 51 29.999 -17.593 -13.854 1.00 0.00 C ATOM 807 C GLN A 51 29.498 -18.989 -13.499 1.00 0.00 C ATOM 808 O GLN A 51 28.501 -19.450 -14.049 1.00 0.00 O ATOM 809 CB GLN A 51 30.942 -17.618 -15.057 1.00 0.00 C ATOM 810 CG GLN A 51 30.172 -17.803 -16.364 1.00 0.00 C ATOM 811 CD GLN A 51 29.184 -16.666 -16.602 1.00 0.00 C ATOM 812 OE1 GLN A 51 27.983 -16.891 -16.726 1.00 0.00 O ATOM 813 NE2 GLN A 51 29.673 -15.432 -16.661 1.00 0.00 N ATOM 0 H GLN A 51 31.706 -16.954 -12.828 1.00 0.00 H new ATOM 0 HA GLN A 51 29.126 -16.993 -14.110 1.00 0.00 H new ATOM 0 HB2 GLN A 51 31.510 -16.688 -15.096 1.00 0.00 H new ATOM 0 HB3 GLN A 51 31.663 -18.427 -14.940 1.00 0.00 H new ATOM 0 HG2 GLN A 51 30.874 -17.855 -17.196 1.00 0.00 H new ATOM 0 HG3 GLN A 51 29.636 -18.752 -16.340 1.00 0.00 H new ATOM 0 HE21 GLN A 51 30.675 -15.275 -16.555 1.00 0.00 H new ATOM 0 HE22 GLN A 51 29.046 -14.642 -16.813 1.00 0.00 H new ATOM 822 N GLU A 52 30.176 -19.672 -12.571 1.00 0.00 N ATOM 823 CA GLU A 52 29.733 -20.977 -12.106 1.00 0.00 C ATOM 824 C GLU A 52 28.584 -20.825 -11.107 1.00 0.00 C ATOM 825 O GLU A 52 27.799 -21.754 -10.921 1.00 0.00 O ATOM 826 CB GLU A 52 30.925 -21.721 -11.500 1.00 0.00 C ATOM 827 CG GLU A 52 30.559 -23.163 -11.147 1.00 0.00 C ATOM 828 CD GLU A 52 31.798 -23.955 -10.739 1.00 0.00 C ATOM 829 OE1 GLU A 52 32.441 -24.530 -11.646 1.00 0.00 O ATOM 830 OE2 GLU A 52 32.096 -23.983 -9.523 1.00 0.00 O ATOM 0 H GLU A 52 31.033 -19.337 -12.131 1.00 0.00 H new ATOM 0 HA GLU A 52 29.351 -21.562 -12.942 1.00 0.00 H new ATOM 0 HB2 GLU A 52 31.756 -21.717 -12.206 1.00 0.00 H new ATOM 0 HB3 GLU A 52 31.264 -21.200 -10.605 1.00 0.00 H new ATOM 0 HG2 GLU A 52 29.834 -23.170 -10.333 1.00 0.00 H new ATOM 0 HG3 GLU A 52 30.082 -23.641 -12.003 1.00 0.00 H new ATOM 837 N ALA A 53 28.478 -19.658 -10.464 1.00 0.00 N ATOM 838 CA ALA A 53 27.431 -19.403 -9.491 1.00 0.00 C ATOM 839 C ALA A 53 26.104 -19.062 -10.172 1.00 0.00 C ATOM 840 O ALA A 53 25.045 -19.322 -9.600 1.00 0.00 O ATOM 841 CB ALA A 53 27.878 -18.267 -8.569 1.00 0.00 C ATOM 0 H ALA A 53 29.114 -18.874 -10.607 1.00 0.00 H new ATOM 0 HA ALA A 53 27.264 -20.307 -8.905 1.00 0.00 H new ATOM 0 HB1 ALA A 53 27.099 -18.067 -7.834 1.00 0.00 H new ATOM 0 HB2 ALA A 53 28.796 -18.555 -8.056 1.00 0.00 H new ATOM 0 HB3 ALA A 53 28.059 -17.369 -9.160 1.00 0.00 H new ATOM 847 N PHE A 54 26.144 -18.488 -11.380 1.00 0.00 N ATOM 848 CA PHE A 54 24.918 -18.178 -12.104 1.00 0.00 C ATOM 849 C PHE A 54 24.418 -19.394 -12.877 1.00 0.00 C ATOM 850 O PHE A 54 23.210 -19.566 -13.016 1.00 0.00 O ATOM 851 CB PHE A 54 25.150 -17.000 -13.051 1.00 0.00 C ATOM 852 CG PHE A 54 25.152 -15.647 -12.370 1.00 0.00 C ATOM 853 CD1 PHE A 54 24.000 -15.197 -11.704 1.00 0.00 C ATOM 854 CD2 PHE A 54 26.298 -14.839 -12.408 1.00 0.00 C ATOM 855 CE1 PHE A 54 23.994 -13.940 -11.083 1.00 0.00 C ATOM 856 CE2 PHE A 54 26.287 -13.580 -11.794 1.00 0.00 C ATOM 857 CZ PHE A 54 25.137 -13.134 -11.129 1.00 0.00 C ATOM 0 H PHE A 54 27.003 -18.234 -11.867 1.00 0.00 H new ATOM 0 HA PHE A 54 24.152 -17.902 -11.379 1.00 0.00 H new ATOM 0 HB2 PHE A 54 26.104 -17.140 -13.560 1.00 0.00 H new ATOM 0 HB3 PHE A 54 24.376 -17.007 -13.818 1.00 0.00 H new ATOM 0 HD1 PHE A 54 23.118 -15.820 -11.670 1.00 0.00 H new ATOM 0 HD2 PHE A 54 27.188 -15.187 -12.910 1.00 0.00 H new ATOM 0 HE1 PHE A 54 23.109 -13.594 -10.570 1.00 0.00 H new ATOM 0 HE2 PHE A 54 27.165 -12.953 -11.833 1.00 0.00 H new ATOM 0 HZ PHE A 54 25.133 -12.166 -10.651 1.00 0.00 H new ATOM 867 N ILE A 55 25.314 -20.247 -13.384 1.00 0.00 N ATOM 868 CA ILE A 55 24.879 -21.446 -14.089 1.00 0.00 C ATOM 869 C ILE A 55 24.340 -22.465 -13.088 1.00 0.00 C ATOM 870 O ILE A 55 23.490 -23.279 -13.442 1.00 0.00 O ATOM 871 CB ILE A 55 26.035 -21.985 -14.944 1.00 0.00 C ATOM 872 CG1 ILE A 55 26.024 -21.352 -16.340 1.00 0.00 C ATOM 873 CG2 ILE A 55 25.928 -23.501 -15.130 1.00 0.00 C ATOM 874 CD1 ILE A 55 26.023 -19.824 -16.321 1.00 0.00 C ATOM 0 H ILE A 55 26.325 -20.129 -13.319 1.00 0.00 H new ATOM 0 HA ILE A 55 24.061 -21.217 -14.772 1.00 0.00 H new ATOM 0 HB ILE A 55 26.955 -21.734 -14.417 1.00 0.00 H new ATOM 0 HG12 ILE A 55 26.896 -21.699 -16.894 1.00 0.00 H new ATOM 0 HG13 ILE A 55 25.144 -21.701 -16.881 1.00 0.00 H new ATOM 0 HG21 ILE A 55 26.760 -23.852 -15.740 1.00 0.00 H new ATOM 0 HG22 ILE A 55 25.959 -23.990 -14.156 1.00 0.00 H new ATOM 0 HG23 ILE A 55 24.988 -23.741 -15.627 1.00 0.00 H new ATOM 0 HD11 ILE A 55 26.015 -19.447 -17.344 1.00 0.00 H new ATOM 0 HD12 ILE A 55 25.137 -19.467 -15.796 1.00 0.00 H new ATOM 0 HD13 ILE A 55 26.916 -19.466 -15.810 1.00 0.00 H new ATOM 886 N LYS A 56 24.818 -22.433 -11.838 1.00 0.00 N ATOM 887 CA LYS A 56 24.269 -23.277 -10.784 1.00 0.00 C ATOM 888 C LYS A 56 22.901 -22.750 -10.369 1.00 0.00 C ATOM 889 O LYS A 56 22.005 -23.527 -10.038 1.00 0.00 O ATOM 890 CB LYS A 56 25.240 -23.291 -9.601 1.00 0.00 C ATOM 891 CG LYS A 56 24.686 -24.071 -8.411 1.00 0.00 C ATOM 892 CD LYS A 56 24.487 -25.558 -8.721 1.00 0.00 C ATOM 893 CE LYS A 56 25.822 -26.291 -8.875 1.00 0.00 C ATOM 894 NZ LYS A 56 26.560 -26.330 -7.598 1.00 0.00 N ATOM 0 H LYS A 56 25.584 -21.830 -11.538 1.00 0.00 H new ATOM 0 HA LYS A 56 24.143 -24.298 -11.143 1.00 0.00 H new ATOM 0 HB2 LYS A 56 26.186 -23.733 -9.914 1.00 0.00 H new ATOM 0 HB3 LYS A 56 25.452 -22.267 -9.295 1.00 0.00 H new ATOM 0 HG2 LYS A 56 25.366 -23.968 -7.566 1.00 0.00 H new ATOM 0 HG3 LYS A 56 23.733 -23.636 -8.108 1.00 0.00 H new ATOM 0 HD2 LYS A 56 23.908 -26.021 -7.922 1.00 0.00 H new ATOM 0 HD3 LYS A 56 23.907 -25.664 -9.638 1.00 0.00 H new ATOM 0 HE2 LYS A 56 25.643 -27.307 -9.226 1.00 0.00 H new ATOM 0 HE3 LYS A 56 26.427 -25.794 -9.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 27.322 -27.035 -7.659 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 26.969 -25.394 -7.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 25.910 -26.589 -6.829 1.00 0.00 H new ATOM 908 N ALA A 57 22.728 -21.428 -10.386 1.00 0.00 N ATOM 909 CA ALA A 57 21.447 -20.833 -10.060 1.00 0.00 C ATOM 910 C ALA A 57 20.449 -21.122 -11.175 1.00 0.00 C ATOM 911 O ALA A 57 19.282 -21.374 -10.898 1.00 0.00 O ATOM 912 CB ALA A 57 21.630 -19.328 -9.865 1.00 0.00 C ATOM 0 H ALA A 57 23.460 -20.758 -10.622 1.00 0.00 H new ATOM 0 HA ALA A 57 21.058 -21.262 -9.136 1.00 0.00 H new ATOM 0 HB1 ALA A 57 20.670 -18.874 -9.619 1.00 0.00 H new ATOM 0 HB2 ALA A 57 22.334 -19.149 -9.053 1.00 0.00 H new ATOM 0 HB3 ALA A 57 22.016 -18.886 -10.784 1.00 0.00 H new ATOM 918 N TYR A 58 20.890 -21.097 -12.432 1.00 0.00 N ATOM 919 CA TYR A 58 20.006 -21.309 -13.566 1.00 0.00 C ATOM 920 C TYR A 58 19.368 -22.697 -13.533 1.00 0.00 C ATOM 921 O TYR A 58 18.196 -22.851 -13.872 1.00 0.00 O ATOM 922 CB TYR A 58 20.810 -21.152 -14.853 1.00 0.00 C ATOM 923 CG TYR A 58 19.978 -21.361 -16.093 1.00 0.00 C ATOM 924 CD1 TYR A 58 19.083 -20.365 -16.509 1.00 0.00 C ATOM 925 CD2 TYR A 58 20.092 -22.556 -16.821 1.00 0.00 C ATOM 926 CE1 TYR A 58 18.294 -20.554 -17.653 1.00 0.00 C ATOM 927 CE2 TYR A 58 19.311 -22.752 -17.969 1.00 0.00 C ATOM 928 CZ TYR A 58 18.411 -21.749 -18.391 1.00 0.00 C ATOM 929 OH TYR A 58 17.653 -21.935 -19.510 1.00 0.00 O ATOM 0 H TYR A 58 21.863 -20.930 -12.687 1.00 0.00 H new ATOM 0 HA TYR A 58 19.204 -20.572 -13.519 1.00 0.00 H new ATOM 0 HB2 TYR A 58 21.251 -20.156 -14.881 1.00 0.00 H new ATOM 0 HB3 TYR A 58 21.634 -21.865 -14.850 1.00 0.00 H new ATOM 0 HD1 TYR A 58 19.001 -19.447 -15.945 1.00 0.00 H new ATOM 0 HD2 TYR A 58 20.780 -23.323 -16.497 1.00 0.00 H new ATOM 0 HE1 TYR A 58 17.600 -19.788 -17.967 1.00 0.00 H new ATOM 0 HE2 TYR A 58 19.398 -23.670 -18.531 1.00 0.00 H new ATOM 0 HH TYR A 58 17.856 -22.810 -19.901 1.00 0.00 H new ATOM 939 N ARG A 59 20.140 -23.713 -13.128 1.00 0.00 N ATOM 940 CA ARG A 59 19.673 -25.093 -13.106 1.00 0.00 C ATOM 941 C ARG A 59 18.979 -25.459 -11.797 1.00 0.00 C ATOM 942 O ARG A 59 18.452 -26.564 -11.683 1.00 0.00 O ATOM 943 CB ARG A 59 20.837 -26.034 -13.410 1.00 0.00 C ATOM 944 CG ARG A 59 21.906 -25.975 -12.320 1.00 0.00 C ATOM 945 CD ARG A 59 23.130 -26.785 -12.741 1.00 0.00 C ATOM 946 NE ARG A 59 22.811 -28.211 -12.883 1.00 0.00 N ATOM 947 CZ ARG A 59 23.628 -29.110 -13.436 1.00 0.00 C ATOM 948 NH1 ARG A 59 24.821 -28.748 -13.907 1.00 0.00 N ATOM 949 NH2 ARG A 59 23.254 -30.385 -13.521 1.00 0.00 N ATOM 0 H ARG A 59 21.102 -23.596 -12.809 1.00 0.00 H new ATOM 0 HA ARG A 59 18.916 -25.203 -13.882 1.00 0.00 H new ATOM 0 HB2 ARG A 59 20.466 -27.055 -13.502 1.00 0.00 H new ATOM 0 HB3 ARG A 59 21.280 -25.768 -14.370 1.00 0.00 H new ATOM 0 HG2 ARG A 59 22.192 -24.939 -12.136 1.00 0.00 H new ATOM 0 HG3 ARG A 59 21.505 -26.367 -11.385 1.00 0.00 H new ATOM 0 HD2 ARG A 59 23.513 -26.401 -13.686 1.00 0.00 H new ATOM 0 HD3 ARG A 59 23.921 -26.660 -12.002 1.00 0.00 H new ATOM 0 HE ARG A 59 21.908 -28.535 -12.537 1.00 0.00 H new ATOM 0 HH11 ARG A 59 25.119 -27.774 -13.847 1.00 0.00 H new ATOM 0 HH12 ARG A 59 25.436 -29.445 -14.327 1.00 0.00 H new ATOM 0 HH21 ARG A 59 22.344 -30.674 -13.164 1.00 0.00 H new ATOM 0 HH22 ARG A 59 23.878 -31.072 -13.944 1.00 0.00 H new ATOM 963 N ALA A 60 18.973 -24.551 -10.817 1.00 0.00 N ATOM 964 CA ALA A 60 18.278 -24.780 -9.557 1.00 0.00 C ATOM 965 C ALA A 60 17.162 -23.760 -9.293 1.00 0.00 C ATOM 966 O ALA A 60 16.439 -23.877 -8.303 1.00 0.00 O ATOM 967 CB ALA A 60 19.295 -24.791 -8.422 1.00 0.00 C ATOM 0 H ALA A 60 19.445 -23.649 -10.877 1.00 0.00 H new ATOM 0 HA ALA A 60 17.782 -25.749 -9.619 1.00 0.00 H new ATOM 0 HB1 ALA A 60 18.782 -24.962 -7.476 1.00 0.00 H new ATOM 0 HB2 ALA A 60 20.020 -25.587 -8.591 1.00 0.00 H new ATOM 0 HB3 ALA A 60 19.811 -23.832 -8.387 1.00 0.00 H new ATOM 973 N LEU A 61 17.007 -22.754 -10.161 1.00 0.00 N ATOM 974 CA LEU A 61 16.023 -21.692 -9.976 1.00 0.00 C ATOM 975 C LEU A 61 14.608 -22.194 -10.264 1.00 0.00 C ATOM 976 O LEU A 61 13.635 -21.584 -9.822 1.00 0.00 O ATOM 977 CB LEU A 61 16.443 -20.498 -10.841 1.00 0.00 C ATOM 978 CG LEU A 61 15.479 -19.310 -10.814 1.00 0.00 C ATOM 979 CD1 LEU A 61 16.294 -18.043 -11.061 1.00 0.00 C ATOM 980 CD2 LEU A 61 14.434 -19.409 -11.928 1.00 0.00 C ATOM 0 H LEU A 61 17.563 -22.657 -11.011 1.00 0.00 H new ATOM 0 HA LEU A 61 15.996 -21.364 -8.937 1.00 0.00 H new ATOM 0 HB2 LEU A 61 17.425 -20.158 -10.512 1.00 0.00 H new ATOM 0 HB3 LEU A 61 16.551 -20.835 -11.872 1.00 0.00 H new ATOM 0 HG LEU A 61 14.968 -19.298 -9.851 1.00 0.00 H new ATOM 0 HD11 LEU A 61 15.633 -17.177 -11.048 1.00 0.00 H new ATOM 0 HD12 LEU A 61 17.047 -17.937 -10.280 1.00 0.00 H new ATOM 0 HD13 LEU A 61 16.785 -18.110 -12.032 1.00 0.00 H new ATOM 0 HD21 LEU A 61 13.766 -18.549 -11.878 1.00 0.00 H new ATOM 0 HD22 LEU A 61 14.935 -19.424 -12.896 1.00 0.00 H new ATOM 0 HD23 LEU A 61 13.856 -20.325 -11.804 1.00 0.00 H new ATOM 992 N ASP A 62 14.479 -23.302 -10.996 1.00 0.00 N ATOM 993 CA ASP A 62 13.188 -23.906 -11.272 1.00 0.00 C ATOM 994 C ASP A 62 12.649 -24.627 -10.034 1.00 0.00 C ATOM 995 O ASP A 62 11.521 -25.119 -10.041 1.00 0.00 O ATOM 996 CB ASP A 62 13.311 -24.859 -12.462 1.00 0.00 C ATOM 997 CG ASP A 62 14.268 -26.010 -12.169 1.00 0.00 C ATOM 998 OD1 ASP A 62 15.480 -25.731 -12.033 1.00 0.00 O ATOM 999 OD2 ASP A 62 13.783 -27.159 -12.087 1.00 0.00 O ATOM 0 H ASP A 62 15.268 -23.799 -11.410 1.00 0.00 H new ATOM 0 HA ASP A 62 12.474 -23.123 -11.527 1.00 0.00 H new ATOM 0 HB2 ASP A 62 12.328 -25.258 -12.711 1.00 0.00 H new ATOM 0 HB3 ASP A 62 13.662 -24.308 -13.334 1.00 0.00 H new ATOM 1004 N SER A 63 13.464 -24.686 -8.976 1.00 0.00 N ATOM 1005 CA SER A 63 13.098 -25.270 -7.694 1.00 0.00 C ATOM 1006 C SER A 63 13.064 -24.205 -6.598 1.00 0.00 C ATOM 1007 O SER A 63 12.883 -24.531 -5.426 1.00 0.00 O ATOM 1008 CB SER A 63 14.076 -26.388 -7.338 1.00 0.00 C ATOM 1009 OG SER A 63 14.049 -27.396 -8.331 1.00 0.00 O ATOM 0 H SER A 63 14.416 -24.320 -8.994 1.00 0.00 H new ATOM 0 HA SER A 63 12.096 -25.692 -7.774 1.00 0.00 H new ATOM 0 HB2 SER A 63 15.084 -25.984 -7.247 1.00 0.00 H new ATOM 0 HB3 SER A 63 13.815 -26.814 -6.369 1.00 0.00 H new ATOM 0 HG SER A 63 14.681 -28.106 -8.093 1.00 0.00 H new ATOM 1015 N PHE A 64 13.234 -22.932 -6.967 1.00 0.00 N ATOM 1016 CA PHE A 64 13.201 -21.830 -6.016 1.00 0.00 C ATOM 1017 C PHE A 64 11.789 -21.690 -5.449 1.00 0.00 C ATOM 1018 O PHE A 64 10.816 -21.657 -6.205 1.00 0.00 O ATOM 1019 CB PHE A 64 13.656 -20.552 -6.725 1.00 0.00 C ATOM 1020 CG PHE A 64 13.687 -19.329 -5.839 1.00 0.00 C ATOM 1021 CD1 PHE A 64 14.539 -19.285 -4.726 1.00 0.00 C ATOM 1022 CD2 PHE A 64 12.863 -18.234 -6.129 1.00 0.00 C ATOM 1023 CE1 PHE A 64 14.574 -18.144 -3.914 1.00 0.00 C ATOM 1024 CE2 PHE A 64 12.898 -17.092 -5.319 1.00 0.00 C ATOM 1025 CZ PHE A 64 13.756 -17.046 -4.212 1.00 0.00 C ATOM 0 H PHE A 64 13.398 -22.643 -7.931 1.00 0.00 H new ATOM 0 HA PHE A 64 13.877 -22.020 -5.182 1.00 0.00 H new ATOM 0 HB2 PHE A 64 14.652 -20.714 -7.137 1.00 0.00 H new ATOM 0 HB3 PHE A 64 12.990 -20.360 -7.567 1.00 0.00 H new ATOM 0 HD1 PHE A 64 15.169 -20.131 -4.495 1.00 0.00 H new ATOM 0 HD2 PHE A 64 12.199 -18.270 -6.980 1.00 0.00 H new ATOM 0 HE1 PHE A 64 15.232 -18.111 -3.058 1.00 0.00 H new ATOM 0 HE2 PHE A 64 12.264 -16.248 -5.547 1.00 0.00 H new ATOM 0 HZ PHE A 64 13.787 -16.165 -3.589 1.00 0.00 H new ATOM 1035 N ARG A 65 11.673 -21.614 -4.119 1.00 0.00 N ATOM 1036 CA ARG A 65 10.380 -21.586 -3.446 1.00 0.00 C ATOM 1037 C ARG A 65 9.963 -20.174 -3.052 1.00 0.00 C ATOM 1038 O ARG A 65 8.786 -19.943 -2.773 1.00 0.00 O ATOM 1039 CB ARG A 65 10.427 -22.495 -2.214 1.00 0.00 C ATOM 1040 CG ARG A 65 10.732 -23.945 -2.609 1.00 0.00 C ATOM 1041 CD ARG A 65 10.685 -24.850 -1.378 1.00 0.00 C ATOM 1042 NE ARG A 65 11.646 -24.418 -0.359 1.00 0.00 N ATOM 1043 CZ ARG A 65 12.835 -24.983 -0.135 1.00 0.00 C ATOM 1044 NH1 ARG A 65 13.253 -26.020 -0.855 1.00 0.00 N ATOM 1045 NH2 ARG A 65 13.614 -24.499 0.827 1.00 0.00 N ATOM 0 H ARG A 65 12.471 -21.571 -3.486 1.00 0.00 H new ATOM 0 HA ARG A 65 9.629 -21.952 -4.147 1.00 0.00 H new ATOM 0 HB2 ARG A 65 11.188 -22.136 -1.522 1.00 0.00 H new ATOM 0 HB3 ARG A 65 9.473 -22.451 -1.689 1.00 0.00 H new ATOM 0 HG2 ARG A 65 10.009 -24.288 -3.349 1.00 0.00 H new ATOM 0 HG3 ARG A 65 11.716 -24.003 -3.075 1.00 0.00 H new ATOM 0 HD2 ARG A 65 9.679 -24.843 -0.958 1.00 0.00 H new ATOM 0 HD3 ARG A 65 10.901 -25.877 -1.671 1.00 0.00 H new ATOM 0 HE ARG A 65 11.386 -23.623 0.225 1.00 0.00 H new ATOM 0 HH11 ARG A 65 12.662 -26.399 -1.595 1.00 0.00 H new ATOM 0 HH12 ARG A 65 14.165 -26.437 -0.667 1.00 0.00 H new ATOM 0 HH21 ARG A 65 13.301 -23.704 1.385 1.00 0.00 H new ATOM 0 HH22 ARG A 65 14.524 -24.922 1.007 1.00 0.00 H new ATOM 1059 N GLY A 66 10.901 -19.222 -3.024 1.00 0.00 N ATOM 1060 CA GLY A 66 10.577 -17.844 -2.682 1.00 0.00 C ATOM 1061 C GLY A 66 10.403 -17.674 -1.177 1.00 0.00 C ATOM 1062 O GLY A 66 9.742 -16.737 -0.731 1.00 0.00 O ATOM 0 H GLY A 66 11.886 -19.385 -3.234 1.00 0.00 H new ATOM 0 HA2 GLY A 66 11.368 -17.183 -3.036 1.00 0.00 H new ATOM 0 HA3 GLY A 66 9.661 -17.546 -3.192 1.00 0.00 H new ATOM 1066 N ASP A 67 10.993 -18.578 -0.392 1.00 0.00 N ATOM 1067 CA ASP A 67 10.948 -18.524 1.065 1.00 0.00 C ATOM 1068 C ASP A 67 11.714 -17.304 1.584 1.00 0.00 C ATOM 1069 O ASP A 67 11.633 -16.977 2.768 1.00 0.00 O ATOM 1070 CB ASP A 67 11.551 -19.814 1.626 1.00 0.00 C ATOM 1071 CG ASP A 67 10.650 -21.027 1.391 1.00 0.00 C ATOM 1072 OD1 ASP A 67 9.411 -20.865 1.463 1.00 0.00 O ATOM 1073 OD2 ASP A 67 11.217 -22.115 1.142 1.00 0.00 O ATOM 0 H ASP A 67 11.519 -19.373 -0.756 1.00 0.00 H new ATOM 0 HA ASP A 67 9.913 -18.431 1.393 1.00 0.00 H new ATOM 0 HB2 ASP A 67 12.522 -19.990 1.162 1.00 0.00 H new ATOM 0 HB3 ASP A 67 11.725 -19.696 2.695 1.00 0.00 H new ATOM 1078 N SER A 68 12.459 -16.636 0.699 1.00 0.00 N ATOM 1079 CA SER A 68 13.190 -15.414 0.999 1.00 0.00 C ATOM 1080 C SER A 68 13.418 -14.640 -0.296 1.00 0.00 C ATOM 1081 O SER A 68 13.118 -15.139 -1.381 1.00 0.00 O ATOM 1082 CB SER A 68 14.525 -15.778 1.652 1.00 0.00 C ATOM 1083 OG SER A 68 15.286 -14.619 1.908 1.00 0.00 O ATOM 0 H SER A 68 12.570 -16.942 -0.268 1.00 0.00 H new ATOM 0 HA SER A 68 12.621 -14.789 1.687 1.00 0.00 H new ATOM 0 HB2 SER A 68 14.346 -16.315 2.584 1.00 0.00 H new ATOM 0 HB3 SER A 68 15.084 -16.449 1.000 1.00 0.00 H new ATOM 0 HG SER A 68 15.461 -14.548 2.870 1.00 0.00 H new ATOM 1089 N ALA A 69 13.946 -13.418 -0.187 1.00 0.00 N ATOM 1090 CA ALA A 69 14.285 -12.611 -1.345 1.00 0.00 C ATOM 1091 C ALA A 69 15.285 -13.370 -2.222 1.00 0.00 C ATOM 1092 O ALA A 69 16.023 -14.226 -1.735 1.00 0.00 O ATOM 1093 CB ALA A 69 14.859 -11.273 -0.882 1.00 0.00 C ATOM 0 H ALA A 69 14.147 -12.968 0.706 1.00 0.00 H new ATOM 0 HA ALA A 69 13.392 -12.414 -1.938 1.00 0.00 H new ATOM 0 HB1 ALA A 69 15.114 -10.666 -1.751 1.00 0.00 H new ATOM 0 HB2 ALA A 69 14.118 -10.749 -0.278 1.00 0.00 H new ATOM 0 HB3 ALA A 69 15.755 -11.448 -0.286 1.00 0.00 H new ATOM 1099 N PHE A 70 15.322 -13.065 -3.522 1.00 0.00 N ATOM 1100 CA PHE A 70 16.141 -13.829 -4.445 1.00 0.00 C ATOM 1101 C PHE A 70 17.630 -13.697 -4.134 1.00 0.00 C ATOM 1102 O PHE A 70 18.378 -14.652 -4.340 1.00 0.00 O ATOM 1103 CB PHE A 70 15.854 -13.378 -5.875 1.00 0.00 C ATOM 1104 CG PHE A 70 16.667 -14.144 -6.896 1.00 0.00 C ATOM 1105 CD1 PHE A 70 16.428 -15.510 -7.099 1.00 0.00 C ATOM 1106 CD2 PHE A 70 17.664 -13.489 -7.631 1.00 0.00 C ATOM 1107 CE1 PHE A 70 17.194 -16.223 -8.033 1.00 0.00 C ATOM 1108 CE2 PHE A 70 18.427 -14.199 -8.567 1.00 0.00 C ATOM 1109 CZ PHE A 70 18.194 -15.567 -8.764 1.00 0.00 C ATOM 0 H PHE A 70 14.797 -12.301 -3.948 1.00 0.00 H new ATOM 0 HA PHE A 70 15.883 -14.882 -4.333 1.00 0.00 H new ATOM 0 HB2 PHE A 70 14.793 -13.508 -6.088 1.00 0.00 H new ATOM 0 HB3 PHE A 70 16.070 -12.314 -5.967 1.00 0.00 H new ATOM 0 HD1 PHE A 70 15.655 -16.013 -6.537 1.00 0.00 H new ATOM 0 HD2 PHE A 70 17.844 -12.436 -7.476 1.00 0.00 H new ATOM 0 HE1 PHE A 70 17.013 -17.276 -8.189 1.00 0.00 H new ATOM 0 HE2 PHE A 70 19.193 -13.693 -9.136 1.00 0.00 H new ATOM 0 HZ PHE A 70 18.786 -16.117 -9.481 1.00 0.00 H new ATOM 1119 N TYR A 71 18.085 -12.541 -3.635 1.00 0.00 N ATOM 1120 CA TYR A 71 19.501 -12.369 -3.351 1.00 0.00 C ATOM 1121 C TYR A 71 19.924 -13.205 -2.147 1.00 0.00 C ATOM 1122 O TYR A 71 21.103 -13.524 -2.011 1.00 0.00 O ATOM 1123 CB TYR A 71 19.828 -10.895 -3.100 1.00 0.00 C ATOM 1124 CG TYR A 71 21.315 -10.652 -2.947 1.00 0.00 C ATOM 1125 CD1 TYR A 71 22.145 -10.744 -4.073 1.00 0.00 C ATOM 1126 CD2 TYR A 71 21.870 -10.349 -1.691 1.00 0.00 C ATOM 1127 CE1 TYR A 71 23.526 -10.536 -3.955 1.00 0.00 C ATOM 1128 CE2 TYR A 71 23.248 -10.122 -1.568 1.00 0.00 C ATOM 1129 CZ TYR A 71 24.082 -10.224 -2.698 1.00 0.00 C ATOM 1130 OH TYR A 71 25.423 -10.015 -2.571 1.00 0.00 O ATOM 0 H TYR A 71 17.502 -11.731 -3.426 1.00 0.00 H new ATOM 0 HA TYR A 71 20.057 -12.711 -4.224 1.00 0.00 H new ATOM 0 HB2 TYR A 71 19.448 -10.295 -3.927 1.00 0.00 H new ATOM 0 HB3 TYR A 71 19.313 -10.560 -2.200 1.00 0.00 H new ATOM 0 HD1 TYR A 71 21.718 -10.977 -5.037 1.00 0.00 H new ATOM 0 HD2 TYR A 71 21.234 -10.291 -0.820 1.00 0.00 H new ATOM 0 HE1 TYR A 71 24.162 -10.615 -4.824 1.00 0.00 H new ATOM 0 HE2 TYR A 71 23.670 -9.869 -0.607 1.00 0.00 H new ATOM 0 HH TYR A 71 25.635 -9.810 -1.637 1.00 0.00 H new ATOM 1140 N THR A 72 18.986 -13.572 -1.272 1.00 0.00 N ATOM 1141 CA THR A 72 19.321 -14.372 -0.106 1.00 0.00 C ATOM 1142 C THR A 72 19.690 -15.784 -0.544 1.00 0.00 C ATOM 1143 O THR A 72 20.560 -16.419 0.050 1.00 0.00 O ATOM 1144 CB THR A 72 18.133 -14.407 0.858 1.00 0.00 C ATOM 1145 OG1 THR A 72 17.640 -13.103 1.073 1.00 0.00 O ATOM 1146 CG2 THR A 72 18.557 -14.995 2.201 1.00 0.00 C ATOM 0 H THR A 72 17.999 -13.328 -1.352 1.00 0.00 H new ATOM 0 HA THR A 72 20.174 -13.927 0.407 1.00 0.00 H new ATOM 0 HB THR A 72 17.355 -15.028 0.414 1.00 0.00 H new ATOM 0 HG1 THR A 72 16.721 -13.152 1.410 1.00 0.00 H new ATOM 0 HG21 THR A 72 17.702 -15.014 2.876 1.00 0.00 H new ATOM 0 HG22 THR A 72 18.925 -16.010 2.054 1.00 0.00 H new ATOM 0 HG23 THR A 72 19.348 -14.382 2.633 1.00 0.00 H new ATOM 1154 N TRP A 73 19.020 -16.273 -1.591 1.00 0.00 N ATOM 1155 CA TRP A 73 19.287 -17.583 -2.158 1.00 0.00 C ATOM 1156 C TRP A 73 20.473 -17.530 -3.120 1.00 0.00 C ATOM 1157 O TRP A 73 21.170 -18.526 -3.299 1.00 0.00 O ATOM 1158 CB TRP A 73 18.013 -18.050 -2.859 1.00 0.00 C ATOM 1159 CG TRP A 73 18.081 -19.400 -3.492 1.00 0.00 C ATOM 1160 CD1 TRP A 73 18.011 -20.579 -2.838 1.00 0.00 C ATOM 1161 CD2 TRP A 73 18.229 -19.734 -4.906 1.00 0.00 C ATOM 1162 NE1 TRP A 73 18.077 -21.616 -3.744 1.00 0.00 N ATOM 1163 CE2 TRP A 73 18.217 -21.152 -5.038 1.00 0.00 C ATOM 1164 CE3 TRP A 73 18.372 -18.981 -6.087 1.00 0.00 C ATOM 1165 CZ2 TRP A 73 18.338 -21.790 -6.276 1.00 0.00 C ATOM 1166 CZ3 TRP A 73 18.501 -19.612 -7.335 1.00 0.00 C ATOM 1167 CH2 TRP A 73 18.480 -21.010 -7.431 1.00 0.00 C ATOM 0 H TRP A 73 18.275 -15.763 -2.066 1.00 0.00 H new ATOM 0 HA TRP A 73 19.558 -18.291 -1.375 1.00 0.00 H new ATOM 0 HB2 TRP A 73 17.200 -18.050 -2.133 1.00 0.00 H new ATOM 0 HB3 TRP A 73 17.755 -17.321 -3.627 1.00 0.00 H new ATOM 0 HD1 TRP A 73 17.918 -20.692 -1.768 1.00 0.00 H new ATOM 0 HE1 TRP A 73 18.029 -22.603 -3.491 1.00 0.00 H new ATOM 0 HE3 TRP A 73 18.383 -17.902 -6.032 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 18.322 -22.868 -6.341 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 18.617 -19.015 -8.228 1.00 0.00 H new ATOM 0 HH2 TRP A 73 18.573 -21.486 -8.396 1.00 0.00 H new ATOM 1178 N LEU A 74 20.712 -16.370 -3.742 1.00 0.00 N ATOM 1179 CA LEU A 74 21.825 -16.192 -4.666 1.00 0.00 C ATOM 1180 C LEU A 74 23.127 -16.082 -3.875 1.00 0.00 C ATOM 1181 O LEU A 74 24.142 -16.665 -4.248 1.00 0.00 O ATOM 1182 CB LEU A 74 21.560 -14.932 -5.497 1.00 0.00 C ATOM 1183 CG LEU A 74 22.155 -14.980 -6.905 1.00 0.00 C ATOM 1184 CD1 LEU A 74 21.910 -13.633 -7.579 1.00 0.00 C ATOM 1185 CD2 LEU A 74 23.658 -15.257 -6.911 1.00 0.00 C ATOM 0 H LEU A 74 20.139 -15.535 -3.616 1.00 0.00 H new ATOM 0 HA LEU A 74 21.918 -17.044 -5.339 1.00 0.00 H new ATOM 0 HB2 LEU A 74 20.483 -14.779 -5.573 1.00 0.00 H new ATOM 0 HB3 LEU A 74 21.968 -14.069 -4.970 1.00 0.00 H new ATOM 0 HG LEU A 74 21.670 -15.799 -7.436 1.00 0.00 H new ATOM 0 HD11 LEU A 74 22.328 -13.648 -8.586 1.00 0.00 H new ATOM 0 HD12 LEU A 74 20.838 -13.443 -7.634 1.00 0.00 H new ATOM 0 HD13 LEU A 74 22.389 -12.844 -6.999 1.00 0.00 H new ATOM 0 HD21 LEU A 74 24.020 -15.279 -7.939 1.00 0.00 H new ATOM 0 HD22 LEU A 74 24.175 -14.471 -6.361 1.00 0.00 H new ATOM 0 HD23 LEU A 74 23.853 -16.219 -6.438 1.00 0.00 H new ATOM 1197 N TYR A 75 23.097 -15.330 -2.772 1.00 0.00 N ATOM 1198 CA TYR A 75 24.237 -15.166 -1.885 1.00 0.00 C ATOM 1199 C TYR A 75 24.637 -16.530 -1.333 1.00 0.00 C ATOM 1200 O TYR A 75 25.824 -16.833 -1.217 1.00 0.00 O ATOM 1201 CB TYR A 75 23.815 -14.214 -0.758 1.00 0.00 C ATOM 1202 CG TYR A 75 24.893 -13.787 0.214 1.00 0.00 C ATOM 1203 CD1 TYR A 75 25.571 -14.720 1.014 1.00 0.00 C ATOM 1204 CD2 TYR A 75 25.202 -12.424 0.323 1.00 0.00 C ATOM 1205 CE1 TYR A 75 26.561 -14.291 1.912 1.00 0.00 C ATOM 1206 CE2 TYR A 75 26.181 -11.983 1.221 1.00 0.00 C ATOM 1207 CZ TYR A 75 26.869 -12.919 2.021 1.00 0.00 C ATOM 1208 OH TYR A 75 27.826 -12.495 2.896 1.00 0.00 O ATOM 0 H TYR A 75 22.269 -14.815 -2.472 1.00 0.00 H new ATOM 0 HA TYR A 75 25.097 -14.749 -2.410 1.00 0.00 H new ATOM 0 HB2 TYR A 75 23.392 -13.318 -1.211 1.00 0.00 H new ATOM 0 HB3 TYR A 75 23.016 -14.692 -0.191 1.00 0.00 H new ATOM 0 HD1 TYR A 75 25.330 -15.770 0.939 1.00 0.00 H new ATOM 0 HD2 TYR A 75 24.679 -11.707 -0.292 1.00 0.00 H new ATOM 0 HE1 TYR A 75 27.087 -15.012 2.520 1.00 0.00 H new ATOM 0 HE2 TYR A 75 26.409 -10.930 1.301 1.00 0.00 H new ATOM 0 HH TYR A 75 27.911 -11.520 2.841 1.00 0.00 H new ATOM 1218 N ARG A 76 23.639 -17.353 -0.999 1.00 0.00 N ATOM 1219 CA ARG A 76 23.834 -18.666 -0.403 1.00 0.00 C ATOM 1220 C ARG A 76 24.544 -19.607 -1.373 1.00 0.00 C ATOM 1221 O ARG A 76 25.385 -20.405 -0.955 1.00 0.00 O ATOM 1222 CB ARG A 76 22.450 -19.203 -0.031 1.00 0.00 C ATOM 1223 CG ARG A 76 22.483 -20.593 0.602 1.00 0.00 C ATOM 1224 CD ARG A 76 23.211 -20.587 1.943 1.00 0.00 C ATOM 1225 NE ARG A 76 23.032 -21.873 2.625 1.00 0.00 N ATOM 1226 CZ ARG A 76 23.896 -22.889 2.574 1.00 0.00 C ATOM 1227 NH1 ARG A 76 25.020 -22.798 1.869 1.00 0.00 N ATOM 1228 NH2 ARG A 76 23.635 -24.012 3.236 1.00 0.00 N ATOM 0 H ARG A 76 22.657 -17.116 -1.140 1.00 0.00 H new ATOM 0 HA ARG A 76 24.466 -18.594 0.482 1.00 0.00 H new ATOM 0 HB2 ARG A 76 21.974 -18.509 0.662 1.00 0.00 H new ATOM 0 HB3 ARG A 76 21.829 -19.235 -0.926 1.00 0.00 H new ATOM 0 HG2 ARG A 76 21.464 -20.953 0.743 1.00 0.00 H new ATOM 0 HG3 ARG A 76 22.976 -21.290 -0.076 1.00 0.00 H new ATOM 0 HD2 ARG A 76 24.273 -20.395 1.787 1.00 0.00 H new ATOM 0 HD3 ARG A 76 22.829 -19.780 2.568 1.00 0.00 H new ATOM 0 HE ARG A 76 22.185 -22.000 3.179 1.00 0.00 H new ATOM 0 HH11 ARG A 76 25.233 -21.942 1.357 1.00 0.00 H new ATOM 0 HH12 ARG A 76 25.669 -23.584 1.841 1.00 0.00 H new ATOM 0 HH21 ARG A 76 22.777 -24.095 3.781 1.00 0.00 H new ATOM 0 HH22 ARG A 76 24.293 -24.790 3.199 1.00 0.00 H new ATOM 1242 N ILE A 77 24.217 -19.524 -2.664 1.00 0.00 N ATOM 1243 CA ILE A 77 24.847 -20.367 -3.669 1.00 0.00 C ATOM 1244 C ILE A 77 26.224 -19.819 -4.023 1.00 0.00 C ATOM 1245 O ILE A 77 27.142 -20.594 -4.274 1.00 0.00 O ATOM 1246 CB ILE A 77 23.943 -20.462 -4.906 1.00 0.00 C ATOM 1247 CG1 ILE A 77 22.690 -21.270 -4.550 1.00 0.00 C ATOM 1248 CG2 ILE A 77 24.687 -21.138 -6.065 1.00 0.00 C ATOM 1249 CD1 ILE A 77 21.718 -21.389 -5.724 1.00 0.00 C ATOM 0 H ILE A 77 23.518 -18.879 -3.034 1.00 0.00 H new ATOM 0 HA ILE A 77 24.982 -21.372 -3.271 1.00 0.00 H new ATOM 0 HB ILE A 77 23.659 -19.457 -5.219 1.00 0.00 H new ATOM 0 HG12 ILE A 77 22.985 -22.267 -4.224 1.00 0.00 H new ATOM 0 HG13 ILE A 77 22.183 -20.797 -3.709 1.00 0.00 H new ATOM 0 HG21 ILE A 77 24.031 -21.197 -6.933 1.00 0.00 H new ATOM 0 HG22 ILE A 77 25.573 -20.555 -6.318 1.00 0.00 H new ATOM 0 HG23 ILE A 77 24.987 -22.143 -5.768 1.00 0.00 H new ATOM 0 HD11 ILE A 77 20.848 -21.970 -5.419 1.00 0.00 H new ATOM 0 HD12 ILE A 77 21.399 -20.394 -6.034 1.00 0.00 H new ATOM 0 HD13 ILE A 77 22.213 -21.888 -6.557 1.00 0.00 H new ATOM 1261 N ALA A 78 26.382 -18.494 -4.045 1.00 0.00 N ATOM 1262 CA ALA A 78 27.635 -17.885 -4.451 1.00 0.00 C ATOM 1263 C ALA A 78 28.731 -18.100 -3.410 1.00 0.00 C ATOM 1264 O ALA A 78 29.890 -18.292 -3.774 1.00 0.00 O ATOM 1265 CB ALA A 78 27.395 -16.400 -4.698 1.00 0.00 C ATOM 0 H ALA A 78 25.654 -17.829 -3.785 1.00 0.00 H new ATOM 0 HA ALA A 78 27.983 -18.360 -5.369 1.00 0.00 H new ATOM 0 HB1 ALA A 78 28.328 -15.927 -5.004 1.00 0.00 H new ATOM 0 HB2 ALA A 78 26.651 -16.278 -5.485 1.00 0.00 H new ATOM 0 HB3 ALA A 78 27.035 -15.932 -3.782 1.00 0.00 H new ATOM 1271 N VAL A 79 28.387 -18.075 -2.118 1.00 0.00 N ATOM 1272 CA VAL A 79 29.377 -18.294 -1.073 1.00 0.00 C ATOM 1273 C VAL A 79 29.703 -19.778 -0.948 1.00 0.00 C ATOM 1274 O VAL A 79 30.807 -20.136 -0.539 1.00 0.00 O ATOM 1275 CB VAL A 79 28.881 -17.700 0.253 1.00 0.00 C ATOM 1276 CG1 VAL A 79 27.674 -18.449 0.812 1.00 0.00 C ATOM 1277 CG2 VAL A 79 29.988 -17.752 1.303 1.00 0.00 C ATOM 0 H VAL A 79 27.440 -17.907 -1.779 1.00 0.00 H new ATOM 0 HA VAL A 79 30.302 -17.783 -1.340 1.00 0.00 H new ATOM 0 HB VAL A 79 28.590 -16.672 0.038 1.00 0.00 H new ATOM 0 HG11 VAL A 79 27.363 -17.989 1.750 1.00 0.00 H new ATOM 0 HG12 VAL A 79 26.854 -18.403 0.096 1.00 0.00 H new ATOM 0 HG13 VAL A 79 27.942 -19.490 0.990 1.00 0.00 H new ATOM 0 HG21 VAL A 79 29.623 -17.328 2.238 1.00 0.00 H new ATOM 0 HG22 VAL A 79 30.286 -18.788 1.466 1.00 0.00 H new ATOM 0 HG23 VAL A 79 30.847 -17.178 0.955 1.00 0.00 H new ATOM 1287 N ASN A 80 28.751 -20.646 -1.299 1.00 0.00 N ATOM 1288 CA ASN A 80 28.979 -22.079 -1.249 1.00 0.00 C ATOM 1289 C ASN A 80 29.746 -22.539 -2.495 1.00 0.00 C ATOM 1290 O ASN A 80 30.482 -23.519 -2.440 1.00 0.00 O ATOM 1291 CB ASN A 80 27.625 -22.778 -1.103 1.00 0.00 C ATOM 1292 CG ASN A 80 27.744 -24.238 -0.677 1.00 0.00 C ATOM 1293 OD1 ASN A 80 28.837 -24.774 -0.521 1.00 0.00 O ATOM 1294 ND2 ASN A 80 26.605 -24.895 -0.483 1.00 0.00 N ATOM 0 H ASN A 80 27.821 -20.376 -1.619 1.00 0.00 H new ATOM 0 HA ASN A 80 29.597 -22.342 -0.391 1.00 0.00 H new ATOM 0 HB2 ASN A 80 27.023 -22.241 -0.370 1.00 0.00 H new ATOM 0 HB3 ASN A 80 27.092 -22.726 -2.053 1.00 0.00 H new ATOM 0 HD21 ASN A 80 26.623 -25.874 -0.196 1.00 0.00 H new ATOM 0 HD22 ASN A 80 25.713 -24.421 -0.621 1.00 0.00 H new ATOM 1301 N THR A 81 29.583 -21.839 -3.622 1.00 0.00 N ATOM 1302 CA THR A 81 30.282 -22.185 -4.853 1.00 0.00 C ATOM 1303 C THR A 81 31.739 -21.742 -4.777 1.00 0.00 C ATOM 1304 O THR A 81 32.622 -22.463 -5.238 1.00 0.00 O ATOM 1305 CB THR A 81 29.575 -21.535 -6.046 1.00 0.00 C ATOM 1306 OG1 THR A 81 28.286 -22.089 -6.188 1.00 0.00 O ATOM 1307 CG2 THR A 81 30.343 -21.770 -7.346 1.00 0.00 C ATOM 0 H THR A 81 28.970 -21.028 -3.702 1.00 0.00 H new ATOM 0 HA THR A 81 30.266 -23.267 -4.984 1.00 0.00 H new ATOM 0 HB THR A 81 29.520 -20.463 -5.856 1.00 0.00 H new ATOM 0 HG1 THR A 81 27.712 -21.773 -5.459 1.00 0.00 H new ATOM 0 HG21 THR A 81 29.814 -21.295 -8.172 1.00 0.00 H new ATOM 0 HG22 THR A 81 31.342 -21.342 -7.261 1.00 0.00 H new ATOM 0 HG23 THR A 81 30.422 -22.841 -7.533 1.00 0.00 H new ATOM 1315 N ALA A 82 32.004 -20.568 -4.198 1.00 0.00 N ATOM 1316 CA ALA A 82 33.361 -20.063 -4.078 1.00 0.00 C ATOM 1317 C ALA A 82 34.145 -20.846 -3.024 1.00 0.00 C ATOM 1318 O ALA A 82 35.361 -20.988 -3.140 1.00 0.00 O ATOM 1319 CB ALA A 82 33.298 -18.579 -3.726 1.00 0.00 C ATOM 0 H ALA A 82 31.290 -19.953 -3.806 1.00 0.00 H new ATOM 0 HA ALA A 82 33.885 -20.190 -5.026 1.00 0.00 H new ATOM 0 HB1 ALA A 82 34.310 -18.184 -3.632 1.00 0.00 H new ATOM 0 HB2 ALA A 82 32.770 -18.041 -4.513 1.00 0.00 H new ATOM 0 HB3 ALA A 82 32.770 -18.451 -2.781 1.00 0.00 H new ATOM 1325 N LYS A 83 33.458 -21.362 -1.999 1.00 0.00 N ATOM 1326 CA LYS A 83 34.118 -22.129 -0.953 1.00 0.00 C ATOM 1327 C LYS A 83 34.317 -23.581 -1.393 1.00 0.00 C ATOM 1328 O LYS A 83 35.273 -24.226 -0.970 1.00 0.00 O ATOM 1329 CB LYS A 83 33.292 -22.018 0.330 1.00 0.00 C ATOM 1330 CG LYS A 83 34.086 -22.544 1.525 1.00 0.00 C ATOM 1331 CD LYS A 83 33.274 -22.436 2.816 1.00 0.00 C ATOM 1332 CE LYS A 83 32.934 -20.977 3.132 1.00 0.00 C ATOM 1333 NZ LYS A 83 32.190 -20.862 4.403 1.00 0.00 N ATOM 0 H LYS A 83 32.450 -21.260 -1.877 1.00 0.00 H new ATOM 0 HA LYS A 83 35.112 -21.727 -0.760 1.00 0.00 H new ATOM 0 HB2 LYS A 83 33.013 -20.978 0.501 1.00 0.00 H new ATOM 0 HB3 LYS A 83 32.366 -22.584 0.224 1.00 0.00 H new ATOM 0 HG2 LYS A 83 34.363 -23.584 1.352 1.00 0.00 H new ATOM 0 HG3 LYS A 83 35.013 -21.980 1.626 1.00 0.00 H new ATOM 0 HD2 LYS A 83 32.355 -23.015 2.721 1.00 0.00 H new ATOM 0 HD3 LYS A 83 33.839 -22.868 3.642 1.00 0.00 H new ATOM 0 HE2 LYS A 83 33.852 -20.392 3.191 1.00 0.00 H new ATOM 0 HE3 LYS A 83 32.340 -20.556 2.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 31.974 -19.862 4.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 31.303 -21.401 4.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 32.768 -21.242 5.179 1.00 0.00 H new ATOM 1347 N ASN A 84 33.425 -24.101 -2.243 1.00 0.00 N ATOM 1348 CA ASN A 84 33.569 -25.454 -2.762 1.00 0.00 C ATOM 1349 C ASN A 84 34.707 -25.494 -3.787 1.00 0.00 C ATOM 1350 O ASN A 84 35.288 -26.546 -4.039 1.00 0.00 O ATOM 1351 CB ASN A 84 32.233 -25.906 -3.359 1.00 0.00 C ATOM 1352 CG ASN A 84 32.199 -27.395 -3.689 1.00 0.00 C ATOM 1353 OD1 ASN A 84 33.113 -28.145 -3.359 1.00 0.00 O ATOM 1354 ND2 ASN A 84 31.129 -27.832 -4.346 1.00 0.00 N ATOM 0 H ASN A 84 32.601 -23.604 -2.581 1.00 0.00 H new ATOM 0 HA ASN A 84 33.829 -26.147 -1.962 1.00 0.00 H new ATOM 0 HB2 ASN A 84 31.432 -25.677 -2.656 1.00 0.00 H new ATOM 0 HB3 ASN A 84 32.035 -25.334 -4.266 1.00 0.00 H new ATOM 0 HD21 ASN A 84 31.049 -28.819 -4.591 1.00 0.00 H new ATOM 0 HD22 ASN A 84 30.388 -27.180 -4.605 1.00 0.00 H new ATOM 1361 N TYR A 85 35.037 -24.345 -4.379 1.00 0.00 N ATOM 1362 CA TYR A 85 36.141 -24.246 -5.323 1.00 0.00 C ATOM 1363 C TYR A 85 37.479 -24.358 -4.593 1.00 0.00 C ATOM 1364 O TYR A 85 38.441 -24.909 -5.133 1.00 0.00 O ATOM 1365 CB TYR A 85 36.037 -22.907 -6.052 1.00 0.00 C ATOM 1366 CG TYR A 85 37.238 -22.564 -6.899 1.00 0.00 C ATOM 1367 CD1 TYR A 85 37.466 -23.245 -8.106 1.00 0.00 C ATOM 1368 CD2 TYR A 85 38.123 -21.563 -6.478 1.00 0.00 C ATOM 1369 CE1 TYR A 85 38.577 -22.920 -8.894 1.00 0.00 C ATOM 1370 CE2 TYR A 85 39.230 -21.220 -7.270 1.00 0.00 C ATOM 1371 CZ TYR A 85 39.461 -21.901 -8.484 1.00 0.00 C ATOM 1372 OH TYR A 85 40.537 -21.580 -9.258 1.00 0.00 O ATOM 0 H TYR A 85 34.548 -23.465 -4.216 1.00 0.00 H new ATOM 0 HA TYR A 85 36.086 -25.062 -6.044 1.00 0.00 H new ATOM 0 HB2 TYR A 85 35.151 -22.921 -6.687 1.00 0.00 H new ATOM 0 HB3 TYR A 85 35.889 -22.117 -5.316 1.00 0.00 H new ATOM 0 HD1 TYR A 85 36.785 -24.019 -8.426 1.00 0.00 H new ATOM 0 HD2 TYR A 85 37.953 -21.054 -5.541 1.00 0.00 H new ATOM 0 HE1 TYR A 85 38.757 -23.451 -9.817 1.00 0.00 H new ATOM 0 HE2 TYR A 85 39.903 -20.437 -6.951 1.00 0.00 H new ATOM 0 HH TYR A 85 41.043 -20.857 -8.832 1.00 0.00 H new ATOM 1382 N LEU A 86 37.552 -23.842 -3.363 1.00 0.00 N ATOM 1383 CA LEU A 86 38.784 -23.899 -2.586 1.00 0.00 C ATOM 1384 C LEU A 86 39.112 -25.329 -2.161 1.00 0.00 C ATOM 1385 O LEU A 86 40.280 -25.659 -1.974 1.00 0.00 O ATOM 1386 CB LEU A 86 38.656 -23.002 -1.351 1.00 0.00 C ATOM 1387 CG LEU A 86 38.494 -21.524 -1.713 1.00 0.00 C ATOM 1388 CD1 LEU A 86 38.316 -20.718 -0.434 1.00 0.00 C ATOM 1389 CD2 LEU A 86 39.719 -21.007 -2.464 1.00 0.00 C ATOM 0 H LEU A 86 36.774 -23.383 -2.889 1.00 0.00 H new ATOM 0 HA LEU A 86 39.599 -23.543 -3.216 1.00 0.00 H new ATOM 0 HB2 LEU A 86 37.799 -23.324 -0.760 1.00 0.00 H new ATOM 0 HB3 LEU A 86 39.539 -23.124 -0.724 1.00 0.00 H new ATOM 0 HG LEU A 86 37.622 -21.416 -2.358 1.00 0.00 H new ATOM 0 HD11 LEU A 86 38.200 -19.663 -0.682 1.00 0.00 H new ATOM 0 HD12 LEU A 86 37.429 -21.066 0.095 1.00 0.00 H new ATOM 0 HD13 LEU A 86 39.192 -20.847 0.202 1.00 0.00 H new ATOM 0 HD21 LEU A 86 39.578 -19.954 -2.709 1.00 0.00 H new ATOM 0 HD22 LEU A 86 40.604 -21.118 -1.837 1.00 0.00 H new ATOM 0 HD23 LEU A 86 39.851 -21.579 -3.382 1.00 0.00 H new ATOM 1401 N VAL A 87 38.097 -26.184 -2.005 1.00 0.00 N ATOM 1402 CA VAL A 87 38.319 -27.584 -1.648 1.00 0.00 C ATOM 1403 C VAL A 87 38.356 -28.478 -2.884 1.00 0.00 C ATOM 1404 O VAL A 87 38.809 -29.616 -2.804 1.00 0.00 O ATOM 1405 CB VAL A 87 37.276 -28.067 -0.638 1.00 0.00 C ATOM 1406 CG1 VAL A 87 37.416 -27.287 0.671 1.00 0.00 C ATOM 1407 CG2 VAL A 87 35.856 -27.902 -1.167 1.00 0.00 C ATOM 0 H VAL A 87 37.116 -25.930 -2.121 1.00 0.00 H new ATOM 0 HA VAL A 87 39.297 -27.652 -1.172 1.00 0.00 H new ATOM 0 HB VAL A 87 37.456 -29.128 -0.466 1.00 0.00 H new ATOM 0 HG11 VAL A 87 36.670 -27.637 1.385 1.00 0.00 H new ATOM 0 HG12 VAL A 87 38.413 -27.443 1.083 1.00 0.00 H new ATOM 0 HG13 VAL A 87 37.265 -26.225 0.479 1.00 0.00 H new ATOM 0 HG21 VAL A 87 35.146 -28.257 -0.420 1.00 0.00 H new ATOM 0 HG22 VAL A 87 35.666 -26.849 -1.377 1.00 0.00 H new ATOM 0 HG23 VAL A 87 35.739 -28.482 -2.083 1.00 0.00 H new