USER MOD reduce.3.24.130724 H: found=0, std=0, add=1061, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1063 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 36 SER OG : rot -58:sc= -0.102 USER MOD Set 1.2: A 47 THR OG1 : rot 87:sc= 0.847 USER MOD Set 1.3: A 80 TYR OH : rot 123:sc= 1.12 USER MOD Set 2.1: A 7 TYR OH : rot -164:sc= 0.667 USER MOD Set 2.2: A 103 HIS : no HE2:sc= -1.32 K(o=-0.66,f=-7.2!) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot -21:sc= 0.214 USER MOD Single : A 29 LYS NZ :NH3+ -109:sc= 0.674 (180deg=-3.74!) USER MOD Single : A 34 TYR OH : rot -91:sc= -0.0656 USER MOD Single : A 38 SER OG : rot -152:sc= -1.8! USER MOD Single : A 49 GLN : amide:sc= -2.77 K(o=-2.8,f=-9.3!) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 156:sc= -0.0123 (180deg=-0.36) USER MOD Single : A 58 HIS : no HD1:sc= -3.61 K(o=-3.6,f=-2.4!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ -147:sc= -1.77 (180deg=-6.01!) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 CYS SG : rot -30:sc= -5.35 USER MOD Single : A 69 THR OG1 : rot -135:sc= -0.672 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 MET CE :methyl -110:sc= -6.52! (180deg=-11.6!) USER MOD Single : A 93 GLN : amide:sc= -1.82! C(o=-1.8!,f=-3.2!) USER MOD Single : A 94 SER OG : rot -164:sc= 0.13 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 LYS NZ :NH3+ -138:sc= -1.88 (180deg=-4.51!) USER MOD Single : A 101 SER OG : rot -57:sc= 0.0756 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -0.031 K(o=-0.031,f=-1.4) USER MOD Single : A 108 SER OG : rot -8:sc= 0.963 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0.0304 USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 124 THR OG1 : rot 134:sc= 1.15 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0 USER MOD Single : A 130 THR OG1 : rot 180:sc= -1.56! USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 GLN : amide:sc= -0.151 X(o=-0.15,f=-0.15) USER MOD Single : A 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 21 N LEU A 4 -3.155 13.493 3.824 1.00 0.00 N ATOM 22 CA LEU A 4 -2.936 12.348 2.948 1.00 0.00 C ATOM 23 C LEU A 4 -4.162 12.096 2.075 1.00 0.00 C ATOM 24 O LEU A 4 -4.056 11.551 0.977 1.00 0.00 O ATOM 25 CB LEU A 4 -2.612 11.100 3.773 1.00 0.00 C ATOM 26 CG LEU A 4 -1.121 10.797 3.927 1.00 0.00 C ATOM 27 CD1 LEU A 4 -0.830 10.237 5.311 1.00 0.00 C ATOM 28 CD2 LEU A 4 -0.663 9.826 2.849 1.00 0.00 C ATOM 0 HA LEU A 4 -2.089 12.571 2.300 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -3.048 11.215 4.765 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -3.096 10.240 3.310 1.00 0.00 H new ATOM 0 HG LEU A 4 -0.565 11.728 3.811 1.00 0.00 H new ATOM 0 HD11 LEU A 4 0.236 10.027 5.402 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -1.122 10.966 6.067 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -1.395 9.316 5.457 1.00 0.00 H new ATOM 0 HD21 LEU A 4 0.400 9.621 2.972 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -1.225 8.896 2.935 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -0.836 10.265 1.866 1.00 0.00 H new ATOM 40 N ASP A 5 -5.327 12.502 2.572 1.00 0.00 N ATOM 41 CA ASP A 5 -6.574 12.327 1.839 1.00 0.00 C ATOM 42 C ASP A 5 -6.496 12.975 0.460 1.00 0.00 C ATOM 43 O ASP A 5 -7.114 12.498 -0.492 1.00 0.00 O ATOM 44 CB ASP A 5 -7.740 12.922 2.632 1.00 0.00 C ATOM 45 CG ASP A 5 -9.073 12.744 1.930 1.00 0.00 C ATOM 46 OD1 ASP A 5 -9.250 13.323 0.838 1.00 0.00 O ATOM 47 OD2 ASP A 5 -9.939 12.025 2.472 1.00 0.00 O ATOM 0 H ASP A 5 -5.432 12.955 3.480 1.00 0.00 H new ATOM 0 HA ASP A 5 -6.740 11.258 1.705 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -7.785 12.451 3.614 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -7.559 13.984 2.796 1.00 0.00 H new ATOM 52 N LYS A 6 -5.736 14.062 0.354 1.00 0.00 N ATOM 53 CA LYS A 6 -5.592 14.761 -0.922 1.00 0.00 C ATOM 54 C LYS A 6 -4.546 14.086 -1.814 1.00 0.00 C ATOM 55 O LYS A 6 -4.376 14.464 -2.973 1.00 0.00 O ATOM 56 CB LYS A 6 -5.230 16.237 -0.702 1.00 0.00 C ATOM 57 CG LYS A 6 -3.760 16.478 -0.388 1.00 0.00 C ATOM 58 CD LYS A 6 -3.551 17.808 0.319 1.00 0.00 C ATOM 59 CE LYS A 6 -3.345 17.621 1.813 1.00 0.00 C ATOM 60 NZ LYS A 6 -2.673 18.796 2.433 1.00 0.00 N ATOM 0 H LYS A 6 -5.215 14.475 1.127 1.00 0.00 H new ATOM 0 HA LYS A 6 -6.555 14.711 -1.431 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -5.497 16.802 -1.595 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -5.834 16.630 0.116 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -3.383 15.669 0.238 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -3.182 16.461 -1.312 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -2.686 18.315 -0.107 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -4.414 18.451 0.148 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -4.309 17.458 2.295 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -2.747 16.727 1.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -2.551 18.628 3.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -1.742 18.936 1.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -3.256 19.645 2.289 1.00 0.00 H new ATOM 74 N TYR A 7 -3.843 13.094 -1.270 1.00 0.00 N ATOM 75 CA TYR A 7 -2.815 12.385 -2.028 1.00 0.00 C ATOM 76 C TYR A 7 -3.404 11.212 -2.806 1.00 0.00 C ATOM 77 O TYR A 7 -3.226 11.112 -4.019 1.00 0.00 O ATOM 78 CB TYR A 7 -1.716 11.878 -1.091 1.00 0.00 C ATOM 79 CG TYR A 7 -0.674 12.922 -0.752 1.00 0.00 C ATOM 80 CD1 TYR A 7 -1.030 14.251 -0.562 1.00 0.00 C ATOM 81 CD2 TYR A 7 0.665 12.577 -0.619 1.00 0.00 C ATOM 82 CE1 TYR A 7 -0.082 15.207 -0.250 1.00 0.00 C ATOM 83 CE2 TYR A 7 1.620 13.526 -0.307 1.00 0.00 C ATOM 84 CZ TYR A 7 1.240 14.840 -0.124 1.00 0.00 C ATOM 85 OH TYR A 7 2.187 15.789 0.187 1.00 0.00 O ATOM 0 H TYR A 7 -3.966 12.765 -0.312 1.00 0.00 H new ATOM 0 HA TYR A 7 -2.388 13.091 -2.741 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -2.174 11.522 -0.168 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -1.223 11.023 -1.553 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -2.065 14.542 -0.660 1.00 0.00 H new ATOM 0 HD2 TYR A 7 0.965 11.549 -0.762 1.00 0.00 H new ATOM 0 HE1 TYR A 7 -0.376 16.236 -0.106 1.00 0.00 H new ATOM 0 HE2 TYR A 7 2.657 13.241 -0.207 1.00 0.00 H new ATOM 0 HH TYR A 7 3.080 15.436 -0.008 1.00 0.00 H new ATOM 135 N ILE A 11 -9.345 9.366 -1.662 1.00 0.00 N ATOM 136 CA ILE A 11 -10.023 9.742 -2.895 1.00 0.00 C ATOM 137 C ILE A 11 -11.380 9.055 -3.016 1.00 0.00 C ATOM 138 O ILE A 11 -11.463 7.893 -3.409 1.00 0.00 O ATOM 139 CB ILE A 11 -9.171 9.391 -4.135 1.00 0.00 C ATOM 140 CG1 ILE A 11 -7.937 10.295 -4.209 1.00 0.00 C ATOM 141 CG2 ILE A 11 -10.000 9.515 -5.407 1.00 0.00 C ATOM 142 CD1 ILE A 11 -7.076 10.048 -5.431 1.00 0.00 C ATOM 0 HA ILE A 11 -10.170 10.821 -2.854 1.00 0.00 H new ATOM 0 HB ILE A 11 -8.838 8.357 -4.042 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -8.259 11.336 -4.206 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -7.334 10.146 -3.314 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -9.383 9.264 -6.270 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -10.848 8.832 -5.357 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -10.363 10.538 -5.506 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -6.221 10.724 -5.416 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -6.723 9.017 -5.425 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -7.663 10.226 -6.332 1.00 0.00 H new ATOM 154 N GLU A 12 -12.439 9.792 -2.694 1.00 0.00 N ATOM 155 CA GLU A 12 -13.803 9.276 -2.779 1.00 0.00 C ATOM 156 C GLU A 12 -13.934 7.891 -2.140 1.00 0.00 C ATOM 157 O GLU A 12 -14.302 7.774 -0.971 1.00 0.00 O ATOM 158 CB GLU A 12 -14.256 9.228 -4.240 1.00 0.00 C ATOM 159 CG GLU A 12 -14.491 10.600 -4.851 1.00 0.00 C ATOM 160 CD GLU A 12 -15.477 11.431 -4.055 1.00 0.00 C ATOM 161 OE1 GLU A 12 -16.250 10.843 -3.268 1.00 0.00 O ATOM 162 OE2 GLU A 12 -15.479 12.669 -4.219 1.00 0.00 O ATOM 0 H GLU A 12 -12.378 10.757 -2.369 1.00 0.00 H new ATOM 0 HA GLU A 12 -14.447 9.955 -2.220 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -13.504 8.702 -4.828 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -15.176 8.647 -4.307 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -13.542 11.132 -4.916 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -14.860 10.482 -5.870 1.00 0.00 H new ATOM 169 N LYS A 13 -13.644 6.844 -2.913 1.00 0.00 N ATOM 170 CA LYS A 13 -13.750 5.473 -2.408 1.00 0.00 C ATOM 171 C LYS A 13 -12.674 4.572 -3.008 1.00 0.00 C ATOM 172 O LYS A 13 -12.021 4.931 -3.988 1.00 0.00 O ATOM 173 CB LYS A 13 -15.132 4.899 -2.722 1.00 0.00 C ATOM 174 CG LYS A 13 -16.282 5.791 -2.282 1.00 0.00 C ATOM 175 CD LYS A 13 -16.741 6.702 -3.409 1.00 0.00 C ATOM 176 CE LYS A 13 -17.166 8.064 -2.886 1.00 0.00 C ATOM 177 NZ LYS A 13 -18.579 8.063 -2.414 1.00 0.00 N ATOM 0 H LYS A 13 -13.336 6.916 -3.883 1.00 0.00 H new ATOM 0 HA LYS A 13 -13.605 5.507 -1.328 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -15.208 4.727 -3.796 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -15.231 3.928 -2.236 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -17.116 5.174 -1.949 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -15.971 6.394 -1.429 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -15.934 6.824 -4.131 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -17.574 6.238 -3.937 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -16.510 8.359 -2.067 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -17.047 8.808 -3.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -18.829 9.010 -2.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -19.208 7.807 -3.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -18.688 7.371 -1.645 1.00 0.00 H new ATOM 191 N LEU A 14 -12.501 3.395 -2.411 1.00 0.00 N ATOM 192 CA LEU A 14 -11.512 2.429 -2.879 1.00 0.00 C ATOM 193 C LEU A 14 -12.193 1.214 -3.507 1.00 0.00 C ATOM 194 O LEU A 14 -13.396 1.015 -3.345 1.00 0.00 O ATOM 195 CB LEU A 14 -10.612 1.990 -1.725 1.00 0.00 C ATOM 196 CG LEU A 14 -9.845 3.120 -1.036 1.00 0.00 C ATOM 197 CD1 LEU A 14 -8.935 2.562 0.047 1.00 0.00 C ATOM 198 CD2 LEU A 14 -9.042 3.917 -2.053 1.00 0.00 C ATOM 0 H LEU A 14 -13.036 3.087 -1.599 1.00 0.00 H new ATOM 0 HA LEU A 14 -10.900 2.911 -3.641 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -11.224 1.480 -0.981 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -9.894 1.261 -2.101 1.00 0.00 H new ATOM 0 HG LEU A 14 -10.565 3.791 -0.567 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -8.397 3.379 0.527 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -9.534 2.036 0.790 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -8.221 1.870 -0.399 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -8.503 4.717 -1.545 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -8.330 3.259 -2.551 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -9.717 4.348 -2.793 1.00 0.00 H new ATOM 210 N ARG A 15 -11.419 0.413 -4.235 1.00 0.00 N ATOM 211 CA ARG A 15 -11.952 -0.774 -4.901 1.00 0.00 C ATOM 212 C ARG A 15 -12.099 -1.959 -3.949 1.00 0.00 C ATOM 213 O ARG A 15 -12.529 -3.035 -4.363 1.00 0.00 O ATOM 214 CB ARG A 15 -11.050 -1.172 -6.070 1.00 0.00 C ATOM 215 CG ARG A 15 -11.295 -0.363 -7.334 1.00 0.00 C ATOM 216 CD ARG A 15 -11.152 -1.220 -8.580 1.00 0.00 C ATOM 217 NE ARG A 15 -12.375 -1.961 -8.879 1.00 0.00 N ATOM 218 CZ ARG A 15 -13.438 -1.428 -9.477 1.00 0.00 C ATOM 219 NH1 ARG A 15 -13.433 -0.151 -9.839 1.00 0.00 N ATOM 220 NH2 ARG A 15 -14.510 -2.173 -9.712 1.00 0.00 N ATOM 0 H ARG A 15 -10.421 0.564 -4.379 1.00 0.00 H new ATOM 0 HA ARG A 15 -12.946 -0.514 -5.265 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -10.009 -1.055 -5.770 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -11.201 -2.229 -6.291 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -12.295 0.070 -7.302 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -10.589 0.467 -7.379 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -10.896 -0.586 -9.429 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -10.328 -1.920 -8.445 1.00 0.00 H new ATOM 0 HE ARG A 15 -12.417 -2.945 -8.614 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -12.612 0.427 -9.659 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -14.250 0.252 -10.297 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -14.520 -3.154 -9.434 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -15.325 -1.764 -10.170 1.00 0.00 H new ATOM 234 N ARG A 16 -11.737 -1.760 -2.682 1.00 0.00 N ATOM 235 CA ARG A 16 -11.823 -2.817 -1.666 1.00 0.00 C ATOM 236 C ARG A 16 -11.574 -4.202 -2.272 1.00 0.00 C ATOM 237 O ARG A 16 -10.429 -4.620 -2.447 1.00 0.00 O ATOM 238 CB ARG A 16 -13.181 -2.765 -0.951 1.00 0.00 C ATOM 239 CG ARG A 16 -13.383 -3.889 0.055 1.00 0.00 C ATOM 240 CD ARG A 16 -14.671 -3.713 0.839 1.00 0.00 C ATOM 241 NE ARG A 16 -15.151 -4.975 1.398 1.00 0.00 N ATOM 242 CZ ARG A 16 -14.562 -5.610 2.409 1.00 0.00 C ATOM 243 NH1 ARG A 16 -13.474 -5.103 2.977 1.00 0.00 N ATOM 244 NH2 ARG A 16 -15.063 -6.754 2.853 1.00 0.00 N ATOM 0 H ARG A 16 -11.379 -0.872 -2.330 1.00 0.00 H new ATOM 0 HA ARG A 16 -11.038 -2.639 -0.931 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -13.276 -1.808 -0.438 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -13.976 -2.808 -1.695 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -13.402 -4.846 -0.467 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -12.538 -3.918 0.743 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -14.509 -2.998 1.646 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -15.436 -3.291 0.188 1.00 0.00 H new ATOM 0 HE ARG A 16 -15.986 -5.394 0.990 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -13.085 -4.223 2.639 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -13.027 -5.594 3.751 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -15.899 -7.147 2.420 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -14.613 -7.242 3.628 1.00 0.00 H new ATOM 258 N GLY A 17 -12.652 -4.897 -2.595 1.00 0.00 N ATOM 259 CA GLY A 17 -12.553 -6.217 -3.189 1.00 0.00 C ATOM 260 C GLY A 17 -13.586 -6.412 -4.278 1.00 0.00 C ATOM 261 O GLY A 17 -13.535 -5.746 -5.312 1.00 0.00 O ATOM 0 H GLY A 17 -13.607 -4.567 -2.455 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -11.555 -6.357 -3.603 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -12.687 -6.976 -2.418 1.00 0.00 H new ATOM 265 N ASP A 18 -14.536 -7.315 -4.048 1.00 0.00 N ATOM 266 CA ASP A 18 -15.589 -7.573 -5.015 1.00 0.00 C ATOM 267 C ASP A 18 -16.217 -6.261 -5.481 1.00 0.00 C ATOM 268 O ASP A 18 -16.690 -6.148 -6.612 1.00 0.00 O ATOM 269 CB ASP A 18 -16.661 -8.480 -4.408 1.00 0.00 C ATOM 270 CG ASP A 18 -17.247 -9.441 -5.423 1.00 0.00 C ATOM 271 OD1 ASP A 18 -16.538 -10.386 -5.825 1.00 0.00 O ATOM 272 OD2 ASP A 18 -18.417 -9.246 -5.818 1.00 0.00 O ATOM 0 H ASP A 18 -14.595 -7.878 -3.199 1.00 0.00 H new ATOM 0 HA ASP A 18 -15.149 -8.077 -5.876 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -16.229 -9.046 -3.583 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -17.459 -7.866 -3.990 1.00 0.00 H new ATOM 277 N GLY A 19 -16.204 -5.270 -4.593 1.00 0.00 N ATOM 278 CA GLY A 19 -16.758 -3.967 -4.907 1.00 0.00 C ATOM 279 C GLY A 19 -15.993 -2.851 -4.223 1.00 0.00 C ATOM 280 O GLY A 19 -14.901 -3.074 -3.701 1.00 0.00 O ATOM 0 H GLY A 19 -15.815 -5.350 -3.653 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -16.738 -3.814 -5.986 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -17.803 -3.933 -4.600 1.00 0.00 H new ATOM 284 N GLU A 20 -16.560 -1.650 -4.219 1.00 0.00 N ATOM 285 CA GLU A 20 -15.910 -0.506 -3.588 1.00 0.00 C ATOM 286 C GLU A 20 -16.444 -0.284 -2.179 1.00 0.00 C ATOM 287 O GLU A 20 -17.559 -0.697 -1.854 1.00 0.00 O ATOM 288 CB GLU A 20 -16.113 0.752 -4.439 1.00 0.00 C ATOM 289 CG GLU A 20 -17.510 1.347 -4.334 1.00 0.00 C ATOM 290 CD GLU A 20 -17.745 2.464 -5.331 1.00 0.00 C ATOM 291 OE1 GLU A 20 -17.067 3.508 -5.224 1.00 0.00 O ATOM 292 OE2 GLU A 20 -18.606 2.296 -6.219 1.00 0.00 O ATOM 0 H GLU A 20 -17.464 -1.443 -4.643 1.00 0.00 H new ATOM 0 HA GLU A 20 -14.843 -0.716 -3.516 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -15.384 1.505 -4.138 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -15.909 0.510 -5.482 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -18.248 0.561 -4.494 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -17.664 1.728 -3.324 1.00 0.00 H new ATOM 299 N VAL A 21 -15.639 0.359 -1.341 1.00 0.00 N ATOM 300 CA VAL A 21 -16.030 0.621 0.034 1.00 0.00 C ATOM 301 C VAL A 21 -15.606 2.023 0.475 1.00 0.00 C ATOM 302 O VAL A 21 -14.754 2.654 -0.151 1.00 0.00 O ATOM 303 CB VAL A 21 -15.446 -0.461 0.975 1.00 0.00 C ATOM 304 CG1 VAL A 21 -14.773 0.136 2.203 1.00 0.00 C ATOM 305 CG2 VAL A 21 -16.536 -1.440 1.376 1.00 0.00 C ATOM 0 H VAL A 21 -14.714 0.707 -1.592 1.00 0.00 H new ATOM 0 HA VAL A 21 -17.118 0.577 0.093 1.00 0.00 H new ATOM 0 HB VAL A 21 -14.670 -0.992 0.424 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -14.381 -0.666 2.829 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -13.955 0.785 1.890 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -15.500 0.717 2.770 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -16.118 -2.199 2.038 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -17.333 -0.906 1.894 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -16.940 -1.919 0.485 1.00 0.00 H new ATOM 315 N GLU A 22 -16.226 2.506 1.549 1.00 0.00 N ATOM 316 CA GLU A 22 -15.938 3.838 2.073 1.00 0.00 C ATOM 317 C GLU A 22 -14.518 3.943 2.623 1.00 0.00 C ATOM 318 O GLU A 22 -13.961 2.974 3.141 1.00 0.00 O ATOM 319 CB GLU A 22 -16.943 4.200 3.168 1.00 0.00 C ATOM 320 CG GLU A 22 -18.228 4.815 2.636 1.00 0.00 C ATOM 321 CD GLU A 22 -18.663 6.031 3.430 1.00 0.00 C ATOM 322 OE1 GLU A 22 -18.097 7.122 3.203 1.00 0.00 O ATOM 323 OE2 GLU A 22 -19.571 5.895 4.276 1.00 0.00 O ATOM 0 H GLU A 22 -16.933 1.993 2.075 1.00 0.00 H new ATOM 0 HA GLU A 22 -16.026 4.540 1.244 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -17.188 3.302 3.736 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -16.476 4.899 3.862 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -18.087 5.098 1.593 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -19.021 4.068 2.659 1.00 0.00 H new ATOM 330 N VAL A 23 -13.948 5.139 2.509 1.00 0.00 N ATOM 331 CA VAL A 23 -12.600 5.415 2.991 1.00 0.00 C ATOM 332 C VAL A 23 -12.575 5.562 4.513 1.00 0.00 C ATOM 333 O VAL A 23 -11.552 5.326 5.155 1.00 0.00 O ATOM 334 CB VAL A 23 -12.035 6.699 2.350 1.00 0.00 C ATOM 335 CG1 VAL A 23 -10.728 7.105 3.013 1.00 0.00 C ATOM 336 CG2 VAL A 23 -11.847 6.505 0.853 1.00 0.00 C ATOM 0 H VAL A 23 -14.407 5.943 2.080 1.00 0.00 H new ATOM 0 HA VAL A 23 -11.978 4.567 2.705 1.00 0.00 H new ATOM 0 HB VAL A 23 -12.752 7.505 2.504 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -10.349 8.013 2.544 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -10.900 7.289 4.074 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -9.997 6.305 2.897 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -11.448 7.420 0.415 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -11.151 5.685 0.677 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -12.807 6.271 0.393 1.00 0.00 H new ATOM 346 N LYS A 24 -13.707 5.970 5.077 1.00 0.00 N ATOM 347 CA LYS A 24 -13.827 6.175 6.519 1.00 0.00 C ATOM 348 C LYS A 24 -13.320 4.964 7.300 1.00 0.00 C ATOM 349 O LYS A 24 -12.878 5.095 8.441 1.00 0.00 O ATOM 350 CB LYS A 24 -15.283 6.464 6.892 1.00 0.00 C ATOM 351 CG LYS A 24 -15.602 7.946 6.999 1.00 0.00 C ATOM 352 CD LYS A 24 -15.409 8.655 5.668 1.00 0.00 C ATOM 353 CE LYS A 24 -14.774 10.024 5.853 1.00 0.00 C ATOM 354 NZ LYS A 24 -13.787 10.328 4.780 1.00 0.00 N ATOM 0 H LYS A 24 -14.561 6.167 4.555 1.00 0.00 H new ATOM 0 HA LYS A 24 -13.208 7.032 6.786 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -15.937 6.013 6.145 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -15.508 5.983 7.844 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -16.631 8.074 7.335 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -14.961 8.404 7.753 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -14.781 8.046 5.018 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -16.372 8.764 5.169 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -15.552 10.787 5.857 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -14.280 10.067 6.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.377 11.270 4.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -13.031 9.614 4.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -14.263 10.313 3.856 1.00 0.00 H new ATOM 368 N SER A 25 -13.379 3.789 6.682 1.00 0.00 N ATOM 369 CA SER A 25 -12.915 2.567 7.332 1.00 0.00 C ATOM 370 C SER A 25 -11.430 2.665 7.693 1.00 0.00 C ATOM 371 O SER A 25 -10.924 1.877 8.491 1.00 0.00 O ATOM 372 CB SER A 25 -13.152 1.360 6.421 1.00 0.00 C ATOM 373 OG SER A 25 -12.695 0.165 7.029 1.00 0.00 O ATOM 0 H SER A 25 -13.741 3.656 5.738 1.00 0.00 H new ATOM 0 HA SER A 25 -13.484 2.438 8.253 1.00 0.00 H new ATOM 0 HB2 SER A 25 -14.215 1.274 6.196 1.00 0.00 H new ATOM 0 HB3 SER A 25 -12.636 1.509 5.472 1.00 0.00 H new ATOM 0 HG SER A 25 -12.035 0.381 7.721 1.00 0.00 H new ATOM 379 N LEU A 26 -10.741 3.647 7.112 1.00 0.00 N ATOM 380 CA LEU A 26 -9.324 3.861 7.383 1.00 0.00 C ATOM 381 C LEU A 26 -9.126 5.231 8.025 1.00 0.00 C ATOM 382 O LEU A 26 -8.330 6.047 7.555 1.00 0.00 O ATOM 383 CB LEU A 26 -8.500 3.759 6.093 1.00 0.00 C ATOM 384 CG LEU A 26 -9.040 2.794 5.031 1.00 0.00 C ATOM 385 CD1 LEU A 26 -7.966 2.486 4.000 1.00 0.00 C ATOM 386 CD2 LEU A 26 -9.547 1.508 5.673 1.00 0.00 C ATOM 0 H LEU A 26 -11.145 4.308 6.449 1.00 0.00 H new ATOM 0 HA LEU A 26 -8.979 3.087 8.068 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -8.428 4.753 5.651 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -7.487 3.452 6.354 1.00 0.00 H new ATOM 0 HG LEU A 26 -9.878 3.276 4.528 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -8.365 1.800 3.253 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -7.653 3.410 3.514 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -7.109 2.027 4.493 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -9.925 0.840 4.899 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -8.730 1.021 6.206 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -10.349 1.742 6.373 1.00 0.00 H new ATOM 398 N ALA A 27 -9.872 5.475 9.095 1.00 0.00 N ATOM 399 CA ALA A 27 -9.820 6.725 9.811 1.00 0.00 C ATOM 400 C ALA A 27 -9.092 6.570 11.129 1.00 0.00 C ATOM 401 O ALA A 27 -9.679 6.259 12.164 1.00 0.00 O ATOM 402 CB ALA A 27 -11.213 7.234 10.045 1.00 0.00 C ATOM 0 H ALA A 27 -10.531 4.802 9.486 1.00 0.00 H new ATOM 0 HA ALA A 27 -9.269 7.445 9.206 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -11.169 8.179 10.586 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -11.710 7.388 9.087 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -11.773 6.506 10.632 1.00 0.00 H new ATOM 408 N GLY A 28 -7.812 6.802 11.057 1.00 0.00 N ATOM 409 CA GLY A 28 -6.951 6.712 12.223 1.00 0.00 C ATOM 410 C GLY A 28 -6.214 5.390 12.323 1.00 0.00 C ATOM 411 O GLY A 28 -6.308 4.691 13.331 1.00 0.00 O ATOM 0 H GLY A 28 -7.328 7.059 10.196 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -6.224 7.524 12.193 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -7.551 6.854 13.121 1.00 0.00 H new ATOM 415 N LYS A 29 -5.470 5.056 11.274 1.00 0.00 N ATOM 416 CA LYS A 29 -4.700 3.821 11.239 1.00 0.00 C ATOM 417 C LYS A 29 -3.467 3.986 10.354 1.00 0.00 C ATOM 418 O LYS A 29 -3.270 5.036 9.741 1.00 0.00 O ATOM 419 CB LYS A 29 -5.575 2.673 10.733 1.00 0.00 C ATOM 420 CG LYS A 29 -5.815 2.689 9.230 1.00 0.00 C ATOM 421 CD LYS A 29 -6.497 1.413 8.759 1.00 0.00 C ATOM 422 CE LYS A 29 -7.811 1.178 9.489 1.00 0.00 C ATOM 423 NZ LYS A 29 -8.734 0.305 8.711 1.00 0.00 N ATOM 0 H LYS A 29 -5.385 5.628 10.433 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.366 3.586 12.250 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -5.107 1.727 11.005 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -6.537 2.711 11.244 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.431 3.549 8.968 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -4.864 2.807 8.710 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.682 1.473 7.686 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -5.833 0.564 8.921 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -7.611 0.721 10.458 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -8.295 2.136 9.682 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -9.528 0.872 8.352 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -8.221 -0.117 7.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -9.098 -0.450 9.326 1.00 0.00 H new ATOM 437 N LEU A 30 -2.643 2.945 10.281 1.00 0.00 N ATOM 438 CA LEU A 30 -1.440 2.988 9.459 1.00 0.00 C ATOM 439 C LEU A 30 -1.709 2.351 8.102 1.00 0.00 C ATOM 440 O LEU A 30 -1.553 1.143 7.930 1.00 0.00 O ATOM 441 CB LEU A 30 -0.283 2.269 10.158 1.00 0.00 C ATOM 442 CG LEU A 30 1.080 2.431 9.483 1.00 0.00 C ATOM 443 CD1 LEU A 30 1.586 3.856 9.638 1.00 0.00 C ATOM 444 CD2 LEU A 30 2.082 1.444 10.061 1.00 0.00 C ATOM 0 H LEU A 30 -2.786 2.066 10.779 1.00 0.00 H new ATOM 0 HA LEU A 30 -1.160 4.031 9.312 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -0.211 2.638 11.181 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -0.518 1.206 10.218 1.00 0.00 H new ATOM 0 HG LEU A 30 0.964 2.221 8.420 1.00 0.00 H new ATOM 0 HD11 LEU A 30 2.557 3.952 9.152 1.00 0.00 H new ATOM 0 HD12 LEU A 30 0.879 4.545 9.177 1.00 0.00 H new ATOM 0 HD13 LEU A 30 1.686 4.094 10.697 1.00 0.00 H new ATOM 0 HD21 LEU A 30 3.046 1.574 9.569 1.00 0.00 H new ATOM 0 HD22 LEU A 30 2.194 1.623 11.130 1.00 0.00 H new ATOM 0 HD23 LEU A 30 1.726 0.427 9.899 1.00 0.00 H new ATOM 456 N VAL A 31 -2.126 3.169 7.143 1.00 0.00 N ATOM 457 CA VAL A 31 -2.429 2.675 5.807 1.00 0.00 C ATOM 458 C VAL A 31 -1.180 2.619 4.938 1.00 0.00 C ATOM 459 O VAL A 31 -0.496 3.625 4.749 1.00 0.00 O ATOM 460 CB VAL A 31 -3.493 3.540 5.102 1.00 0.00 C ATOM 461 CG1 VAL A 31 -4.035 2.821 3.877 1.00 0.00 C ATOM 462 CG2 VAL A 31 -4.623 3.892 6.060 1.00 0.00 C ATOM 0 H VAL A 31 -2.261 4.173 7.265 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.824 1.667 5.936 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.021 4.467 4.778 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.785 3.445 3.391 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.220 2.624 3.180 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -4.489 1.878 4.180 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.362 4.503 5.542 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -5.095 2.977 6.418 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -4.222 4.449 6.907 1.00 0.00 H new ATOM 472 N PHE A 32 -0.891 1.437 4.407 1.00 0.00 N ATOM 473 CA PHE A 32 0.274 1.248 3.551 1.00 0.00 C ATOM 474 C PHE A 32 -0.121 1.338 2.084 1.00 0.00 C ATOM 475 O PHE A 32 -1.296 1.214 1.737 1.00 0.00 O ATOM 476 CB PHE A 32 0.928 -0.106 3.829 1.00 0.00 C ATOM 477 CG PHE A 32 1.998 -0.054 4.881 1.00 0.00 C ATOM 478 CD1 PHE A 32 3.254 0.451 4.586 1.00 0.00 C ATOM 479 CD2 PHE A 32 1.747 -0.510 6.164 1.00 0.00 C ATOM 480 CE1 PHE A 32 4.241 0.499 5.553 1.00 0.00 C ATOM 481 CE2 PHE A 32 2.730 -0.464 7.135 1.00 0.00 C ATOM 482 CZ PHE A 32 3.978 0.041 6.830 1.00 0.00 C ATOM 0 H PHE A 32 -1.447 0.595 4.554 1.00 0.00 H new ATOM 0 HA PHE A 32 0.990 2.039 3.772 1.00 0.00 H new ATOM 0 HB2 PHE A 32 0.160 -0.814 4.139 1.00 0.00 H new ATOM 0 HB3 PHE A 32 1.359 -0.489 2.904 1.00 0.00 H new ATOM 0 HD1 PHE A 32 3.464 0.811 3.590 1.00 0.00 H new ATOM 0 HD2 PHE A 32 0.773 -0.906 6.409 1.00 0.00 H new ATOM 0 HE1 PHE A 32 5.217 0.894 5.311 1.00 0.00 H new ATOM 0 HE2 PHE A 32 2.522 -0.823 8.132 1.00 0.00 H new ATOM 0 HZ PHE A 32 4.747 0.078 7.587 1.00 0.00 H new ATOM 492 N PHE A 33 0.866 1.553 1.226 1.00 0.00 N ATOM 493 CA PHE A 33 0.622 1.658 -0.203 1.00 0.00 C ATOM 494 C PHE A 33 1.802 1.101 -0.994 1.00 0.00 C ATOM 495 O PHE A 33 2.865 1.717 -1.063 1.00 0.00 O ATOM 496 CB PHE A 33 0.359 3.120 -0.575 1.00 0.00 C ATOM 497 CG PHE A 33 -1.058 3.545 -0.316 1.00 0.00 C ATOM 498 CD1 PHE A 33 -1.482 3.833 0.973 1.00 0.00 C ATOM 499 CD2 PHE A 33 -1.970 3.645 -1.354 1.00 0.00 C ATOM 500 CE1 PHE A 33 -2.787 4.214 1.218 1.00 0.00 C ATOM 501 CE2 PHE A 33 -3.277 4.024 -1.113 1.00 0.00 C ATOM 502 CZ PHE A 33 -3.686 4.309 0.174 1.00 0.00 C ATOM 0 H PHE A 33 1.844 1.658 1.496 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.258 1.066 -0.457 1.00 0.00 H new ATOM 0 HB2 PHE A 33 1.034 3.761 -0.008 1.00 0.00 H new ATOM 0 HB3 PHE A 33 0.590 3.268 -1.630 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -0.784 3.759 1.794 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -1.656 3.424 -2.363 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -3.104 4.438 2.226 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -3.978 4.097 -1.931 1.00 0.00 H new ATOM 0 HZ PHE A 33 -4.707 4.606 0.364 1.00 0.00 H new ATOM 512 N TYR A 34 1.605 -0.079 -1.575 1.00 0.00 N ATOM 513 CA TYR A 34 2.652 -0.739 -2.348 1.00 0.00 C ATOM 514 C TYR A 34 2.497 -0.483 -3.843 1.00 0.00 C ATOM 515 O TYR A 34 1.419 -0.660 -4.411 1.00 0.00 O ATOM 516 CB TYR A 34 2.648 -2.245 -2.059 1.00 0.00 C ATOM 517 CG TYR A 34 1.605 -3.039 -2.817 1.00 0.00 C ATOM 518 CD1 TYR A 34 1.782 -3.360 -4.156 1.00 0.00 C ATOM 519 CD2 TYR A 34 0.449 -3.480 -2.183 1.00 0.00 C ATOM 520 CE1 TYR A 34 0.835 -4.096 -4.844 1.00 0.00 C ATOM 521 CE2 TYR A 34 -0.501 -4.215 -2.864 1.00 0.00 C ATOM 522 CZ TYR A 34 -0.304 -4.522 -4.194 1.00 0.00 C ATOM 523 OH TYR A 34 -1.246 -5.258 -4.879 1.00 0.00 O ATOM 0 H TYR A 34 0.729 -0.598 -1.525 1.00 0.00 H new ATOM 0 HA TYR A 34 3.610 -0.317 -2.042 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.633 -2.648 -2.296 1.00 0.00 H new ATOM 0 HB3 TYR A 34 2.491 -2.394 -0.991 1.00 0.00 H new ATOM 0 HD1 TYR A 34 2.673 -3.030 -4.668 1.00 0.00 H new ATOM 0 HD2 TYR A 34 0.291 -3.244 -1.141 1.00 0.00 H new ATOM 0 HE1 TYR A 34 0.987 -4.336 -5.886 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -1.395 -4.548 -2.357 1.00 0.00 H new ATOM 0 HH TYR A 34 -1.912 -4.654 -5.270 1.00 0.00 H new ATOM 533 N PHE A 35 3.591 -0.073 -4.475 1.00 0.00 N ATOM 534 CA PHE A 35 3.591 0.203 -5.912 1.00 0.00 C ATOM 535 C PHE A 35 4.209 -0.959 -6.687 1.00 0.00 C ATOM 536 O PHE A 35 5.341 -1.356 -6.417 1.00 0.00 O ATOM 537 CB PHE A 35 4.355 1.494 -6.208 1.00 0.00 C ATOM 538 CG PHE A 35 3.595 2.739 -5.850 1.00 0.00 C ATOM 539 CD1 PHE A 35 2.409 3.051 -6.494 1.00 0.00 C ATOM 540 CD2 PHE A 35 4.066 3.596 -4.869 1.00 0.00 C ATOM 541 CE1 PHE A 35 1.707 4.196 -6.167 1.00 0.00 C ATOM 542 CE2 PHE A 35 3.369 4.742 -4.537 1.00 0.00 C ATOM 543 CZ PHE A 35 2.186 5.042 -5.186 1.00 0.00 C ATOM 0 H PHE A 35 4.490 0.076 -4.018 1.00 0.00 H new ATOM 0 HA PHE A 35 2.556 0.323 -6.234 1.00 0.00 H new ATOM 0 HB2 PHE A 35 5.297 1.483 -5.659 1.00 0.00 H new ATOM 0 HB3 PHE A 35 4.605 1.523 -7.269 1.00 0.00 H new ATOM 0 HD1 PHE A 35 2.028 2.392 -7.260 1.00 0.00 H new ATOM 0 HD2 PHE A 35 4.989 3.366 -4.358 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.785 4.429 -6.678 1.00 0.00 H new ATOM 0 HE2 PHE A 35 3.748 5.403 -3.771 1.00 0.00 H new ATOM 0 HZ PHE A 35 1.638 5.936 -4.927 1.00 0.00 H new ATOM 553 N SER A 36 3.461 -1.505 -7.646 1.00 0.00 N ATOM 554 CA SER A 36 3.952 -2.622 -8.444 1.00 0.00 C ATOM 555 C SER A 36 2.967 -2.975 -9.554 1.00 0.00 C ATOM 556 O SER A 36 1.833 -2.498 -9.564 1.00 0.00 O ATOM 557 CB SER A 36 4.189 -3.840 -7.549 1.00 0.00 C ATOM 558 OG SER A 36 3.010 -4.191 -6.844 1.00 0.00 O ATOM 0 H SER A 36 2.520 -1.193 -7.886 1.00 0.00 H new ATOM 0 HA SER A 36 4.894 -2.324 -8.905 1.00 0.00 H new ATOM 0 HB2 SER A 36 4.518 -4.683 -8.156 1.00 0.00 H new ATOM 0 HB3 SER A 36 4.990 -3.625 -6.841 1.00 0.00 H new ATOM 0 HG SER A 36 2.713 -3.429 -6.304 1.00 0.00 H new ATOM 564 N ALA A 37 3.405 -3.820 -10.483 1.00 0.00 N ATOM 565 CA ALA A 37 2.558 -4.242 -11.590 1.00 0.00 C ATOM 566 C ALA A 37 2.488 -5.761 -11.666 1.00 0.00 C ATOM 567 O ALA A 37 3.362 -6.458 -11.148 1.00 0.00 O ATOM 568 CB ALA A 37 3.075 -3.669 -12.899 1.00 0.00 C ATOM 0 H ALA A 37 4.341 -4.225 -10.490 1.00 0.00 H new ATOM 0 HA ALA A 37 1.551 -3.862 -11.416 1.00 0.00 H new ATOM 0 HB1 ALA A 37 2.432 -3.993 -13.717 1.00 0.00 H new ATOM 0 HB2 ALA A 37 3.073 -2.580 -12.845 1.00 0.00 H new ATOM 0 HB3 ALA A 37 4.091 -4.022 -13.075 1.00 0.00 H new ATOM 574 N SER A 38 1.447 -6.273 -12.311 1.00 0.00 N ATOM 575 CA SER A 38 1.278 -7.713 -12.447 1.00 0.00 C ATOM 576 C SER A 38 2.283 -8.281 -13.442 1.00 0.00 C ATOM 577 O SER A 38 2.823 -9.369 -13.237 1.00 0.00 O ATOM 578 CB SER A 38 -0.148 -8.043 -12.890 1.00 0.00 C ATOM 579 OG SER A 38 -1.041 -6.995 -12.557 1.00 0.00 O ATOM 0 H SER A 38 0.711 -5.716 -12.746 1.00 0.00 H new ATOM 0 HA SER A 38 1.458 -8.171 -11.475 1.00 0.00 H new ATOM 0 HB2 SER A 38 -0.167 -8.213 -13.966 1.00 0.00 H new ATOM 0 HB3 SER A 38 -0.475 -8.968 -12.415 1.00 0.00 H new ATOM 0 HG SER A 38 -1.941 -7.361 -12.426 1.00 0.00 H new ATOM 585 N TRP A 39 2.538 -7.539 -14.515 1.00 0.00 N ATOM 586 CA TRP A 39 3.491 -7.978 -15.529 1.00 0.00 C ATOM 587 C TRP A 39 4.902 -7.994 -14.951 1.00 0.00 C ATOM 588 O TRP A 39 5.741 -8.800 -15.352 1.00 0.00 O ATOM 589 CB TRP A 39 3.429 -7.070 -16.762 1.00 0.00 C ATOM 590 CG TRP A 39 3.942 -5.684 -16.516 1.00 0.00 C ATOM 591 CD1 TRP A 39 3.283 -4.665 -15.896 1.00 0.00 C ATOM 592 CD2 TRP A 39 5.224 -5.165 -16.891 1.00 0.00 C ATOM 593 NE1 TRP A 39 4.074 -3.542 -15.860 1.00 0.00 N ATOM 594 CE2 TRP A 39 5.272 -3.825 -16.465 1.00 0.00 C ATOM 595 CE3 TRP A 39 6.336 -5.705 -17.544 1.00 0.00 C ATOM 596 CZ2 TRP A 39 6.387 -3.017 -16.671 1.00 0.00 C ATOM 597 CZ3 TRP A 39 7.442 -4.902 -17.748 1.00 0.00 C ATOM 598 CH2 TRP A 39 7.461 -3.571 -17.313 1.00 0.00 C ATOM 0 H TRP A 39 2.101 -6.637 -14.705 1.00 0.00 H new ATOM 0 HA TRP A 39 3.226 -8.989 -15.838 1.00 0.00 H new ATOM 0 HB2 TRP A 39 4.007 -7.524 -17.566 1.00 0.00 H new ATOM 0 HB3 TRP A 39 2.397 -7.010 -17.106 1.00 0.00 H new ATOM 0 HD1 TRP A 39 2.284 -4.731 -15.492 1.00 0.00 H new ATOM 0 HE1 TRP A 39 3.813 -2.645 -15.451 1.00 0.00 H new ATOM 0 HE3 TRP A 39 6.331 -6.731 -17.883 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 6.404 -1.990 -16.336 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 8.307 -5.308 -18.252 1.00 0.00 H new ATOM 0 HH2 TRP A 39 8.341 -2.970 -17.488 1.00 0.00 H new ATOM 609 N CYS A 40 5.146 -7.101 -13.996 1.00 0.00 N ATOM 610 CA CYS A 40 6.448 -7.009 -13.340 1.00 0.00 C ATOM 611 C CYS A 40 6.853 -8.375 -12.772 1.00 0.00 C ATOM 612 O CYS A 40 6.276 -8.841 -11.790 1.00 0.00 O ATOM 613 CB CYS A 40 6.391 -5.944 -12.234 1.00 0.00 C ATOM 614 SG CYS A 40 7.693 -6.071 -10.968 1.00 0.00 S ATOM 0 H CYS A 40 4.457 -6.429 -13.658 1.00 0.00 H new ATOM 0 HA CYS A 40 7.203 -6.713 -14.068 1.00 0.00 H new ATOM 0 HB2 CYS A 40 6.451 -4.959 -12.697 1.00 0.00 H new ATOM 0 HB3 CYS A 40 5.420 -6.006 -11.742 1.00 0.00 H new ATOM 619 N PRO A 41 7.844 -9.042 -13.397 1.00 0.00 N ATOM 620 CA PRO A 41 8.310 -10.365 -12.961 1.00 0.00 C ATOM 621 C PRO A 41 8.711 -10.411 -11.486 1.00 0.00 C ATOM 622 O PRO A 41 8.305 -11.318 -10.760 1.00 0.00 O ATOM 623 CB PRO A 41 9.523 -10.637 -13.855 1.00 0.00 C ATOM 624 CG PRO A 41 9.303 -9.795 -15.062 1.00 0.00 C ATOM 625 CD PRO A 41 8.578 -8.567 -14.586 1.00 0.00 C ATOM 0 HA PRO A 41 7.519 -11.109 -13.051 1.00 0.00 H new ATOM 0 HB2 PRO A 41 10.453 -10.371 -13.352 1.00 0.00 H new ATOM 0 HB3 PRO A 41 9.593 -11.693 -14.117 1.00 0.00 H new ATOM 0 HG2 PRO A 41 10.251 -9.531 -15.531 1.00 0.00 H new ATOM 0 HG3 PRO A 41 8.716 -10.330 -15.809 1.00 0.00 H new ATOM 0 HD2 PRO A 41 9.271 -7.763 -14.336 1.00 0.00 H new ATOM 0 HD3 PRO A 41 7.901 -8.179 -15.348 1.00 0.00 H new ATOM 633 N PRO A 42 9.523 -9.444 -11.015 1.00 0.00 N ATOM 634 CA PRO A 42 9.969 -9.412 -9.618 1.00 0.00 C ATOM 635 C PRO A 42 8.880 -8.956 -8.645 1.00 0.00 C ATOM 636 O PRO A 42 9.150 -8.745 -7.463 1.00 0.00 O ATOM 637 CB PRO A 42 11.122 -8.409 -9.641 1.00 0.00 C ATOM 638 CG PRO A 42 10.812 -7.496 -10.776 1.00 0.00 C ATOM 639 CD PRO A 42 10.077 -8.322 -11.800 1.00 0.00 C ATOM 0 HA PRO A 42 10.247 -10.405 -9.265 1.00 0.00 H new ATOM 0 HB2 PRO A 42 11.189 -7.862 -8.701 1.00 0.00 H new ATOM 0 HB3 PRO A 42 12.079 -8.910 -9.787 1.00 0.00 H new ATOM 0 HG2 PRO A 42 10.201 -6.657 -10.443 1.00 0.00 H new ATOM 0 HG3 PRO A 42 11.726 -7.078 -11.198 1.00 0.00 H new ATOM 0 HD2 PRO A 42 9.289 -7.747 -12.287 1.00 0.00 H new ATOM 0 HD3 PRO A 42 10.746 -8.675 -12.585 1.00 0.00 H new ATOM 647 N CYS A 43 7.652 -8.809 -9.139 1.00 0.00 N ATOM 648 CA CYS A 43 6.539 -8.383 -8.297 1.00 0.00 C ATOM 649 C CYS A 43 5.627 -9.558 -7.964 1.00 0.00 C ATOM 650 O CYS A 43 4.428 -9.383 -7.745 1.00 0.00 O ATOM 651 CB CYS A 43 5.740 -7.282 -8.992 1.00 0.00 C ATOM 652 SG CYS A 43 6.682 -5.742 -9.241 1.00 0.00 S ATOM 0 H CYS A 43 7.404 -8.978 -10.114 1.00 0.00 H new ATOM 0 HA CYS A 43 6.949 -7.992 -7.366 1.00 0.00 H new ATOM 0 HB2 CYS A 43 5.398 -7.649 -9.960 1.00 0.00 H new ATOM 0 HB3 CYS A 43 4.851 -7.062 -8.401 1.00 0.00 H new ATOM 657 N ARG A 44 6.202 -10.754 -7.928 1.00 0.00 N ATOM 658 CA ARG A 44 5.443 -11.961 -7.622 1.00 0.00 C ATOM 659 C ARG A 44 5.915 -12.595 -6.313 1.00 0.00 C ATOM 660 O ARG A 44 5.164 -13.317 -5.659 1.00 0.00 O ATOM 661 CB ARG A 44 5.571 -12.971 -8.764 1.00 0.00 C ATOM 662 CG ARG A 44 7.000 -13.424 -9.017 1.00 0.00 C ATOM 663 CD ARG A 44 7.288 -14.759 -8.349 1.00 0.00 C ATOM 664 NE ARG A 44 8.705 -14.916 -8.028 1.00 0.00 N ATOM 665 CZ ARG A 44 9.657 -15.090 -8.941 1.00 0.00 C ATOM 666 NH1 ARG A 44 9.348 -15.131 -10.232 1.00 0.00 N ATOM 667 NH2 ARG A 44 10.920 -15.225 -8.565 1.00 0.00 N ATOM 0 H ARG A 44 7.193 -10.914 -8.107 1.00 0.00 H new ATOM 0 HA ARG A 44 4.397 -11.678 -7.507 1.00 0.00 H new ATOM 0 HB2 ARG A 44 4.957 -13.843 -8.538 1.00 0.00 H new ATOM 0 HB3 ARG A 44 5.172 -12.528 -9.676 1.00 0.00 H new ATOM 0 HG2 ARG A 44 7.171 -13.509 -10.090 1.00 0.00 H new ATOM 0 HG3 ARG A 44 7.693 -12.671 -8.642 1.00 0.00 H new ATOM 0 HD2 ARG A 44 6.698 -14.842 -7.436 1.00 0.00 H new ATOM 0 HD3 ARG A 44 6.973 -15.569 -9.007 1.00 0.00 H new ATOM 0 HE ARG A 44 8.980 -14.891 -7.046 1.00 0.00 H new ATOM 0 HH11 ARG A 44 8.377 -15.029 -10.528 1.00 0.00 H new ATOM 0 HH12 ARG A 44 10.082 -15.265 -10.928 1.00 0.00 H new ATOM 0 HH21 ARG A 44 11.163 -15.196 -7.575 1.00 0.00 H new ATOM 0 HH22 ARG A 44 11.649 -15.358 -9.266 1.00 0.00 H new ATOM 681 N GLY A 45 7.164 -12.325 -5.941 1.00 0.00 N ATOM 682 CA GLY A 45 7.708 -12.884 -4.716 1.00 0.00 C ATOM 683 C GLY A 45 7.487 -11.994 -3.504 1.00 0.00 C ATOM 684 O GLY A 45 7.848 -12.363 -2.387 1.00 0.00 O ATOM 0 H GLY A 45 7.807 -11.731 -6.465 1.00 0.00 H new ATOM 0 HA2 GLY A 45 7.251 -13.856 -4.533 1.00 0.00 H new ATOM 0 HA3 GLY A 45 8.777 -13.054 -4.845 1.00 0.00 H new ATOM 688 N PHE A 46 6.896 -10.822 -3.719 1.00 0.00 N ATOM 689 CA PHE A 46 6.635 -9.890 -2.626 1.00 0.00 C ATOM 690 C PHE A 46 5.159 -9.488 -2.575 1.00 0.00 C ATOM 691 O PHE A 46 4.778 -8.592 -1.823 1.00 0.00 O ATOM 692 CB PHE A 46 7.509 -8.642 -2.776 1.00 0.00 C ATOM 693 CG PHE A 46 7.299 -7.629 -1.686 1.00 0.00 C ATOM 694 CD1 PHE A 46 7.620 -7.929 -0.372 1.00 0.00 C ATOM 695 CD2 PHE A 46 6.772 -6.381 -1.975 1.00 0.00 C ATOM 696 CE1 PHE A 46 7.421 -7.001 0.633 1.00 0.00 C ATOM 697 CE2 PHE A 46 6.572 -5.449 -0.975 1.00 0.00 C ATOM 698 CZ PHE A 46 6.897 -5.760 0.331 1.00 0.00 C ATOM 0 H PHE A 46 6.590 -10.496 -4.636 1.00 0.00 H new ATOM 0 HA PHE A 46 6.882 -10.395 -1.692 1.00 0.00 H new ATOM 0 HB2 PHE A 46 8.557 -8.941 -2.786 1.00 0.00 H new ATOM 0 HB3 PHE A 46 7.301 -8.176 -3.739 1.00 0.00 H new ATOM 0 HD1 PHE A 46 8.030 -8.898 -0.130 1.00 0.00 H new ATOM 0 HD2 PHE A 46 6.514 -6.134 -2.994 1.00 0.00 H new ATOM 0 HE1 PHE A 46 7.675 -7.247 1.654 1.00 0.00 H new ATOM 0 HE2 PHE A 46 6.162 -4.479 -1.214 1.00 0.00 H new ATOM 0 HZ PHE A 46 6.741 -5.033 1.115 1.00 0.00 H new ATOM 708 N THR A 47 4.331 -10.154 -3.375 1.00 0.00 N ATOM 709 CA THR A 47 2.905 -9.855 -3.409 1.00 0.00 C ATOM 710 C THR A 47 2.178 -10.478 -2.213 1.00 0.00 C ATOM 711 O THR A 47 1.386 -9.809 -1.549 1.00 0.00 O ATOM 712 CB THR A 47 2.289 -10.350 -4.720 1.00 0.00 C ATOM 713 OG1 THR A 47 2.909 -9.724 -5.829 1.00 0.00 O ATOM 714 CG2 THR A 47 0.802 -10.089 -4.822 1.00 0.00 C ATOM 0 H THR A 47 4.622 -10.901 -4.005 1.00 0.00 H new ATOM 0 HA THR A 47 2.788 -8.773 -3.348 1.00 0.00 H new ATOM 0 HB THR A 47 2.453 -11.428 -4.727 1.00 0.00 H new ATOM 0 HG1 THR A 47 3.708 -10.230 -6.086 1.00 0.00 H new ATOM 0 HG21 THR A 47 0.431 -10.465 -5.775 1.00 0.00 H new ATOM 0 HG22 THR A 47 0.287 -10.597 -4.007 1.00 0.00 H new ATOM 0 HG23 THR A 47 0.615 -9.017 -4.758 1.00 0.00 H new ATOM 722 N PRO A 48 2.431 -11.768 -1.920 1.00 0.00 N ATOM 723 CA PRO A 48 1.789 -12.466 -0.805 1.00 0.00 C ATOM 724 C PRO A 48 2.508 -12.255 0.527 1.00 0.00 C ATOM 725 O PRO A 48 2.220 -12.940 1.509 1.00 0.00 O ATOM 726 CB PRO A 48 1.899 -13.923 -1.233 1.00 0.00 C ATOM 727 CG PRO A 48 3.202 -13.984 -1.949 1.00 0.00 C ATOM 728 CD PRO A 48 3.354 -12.660 -2.655 1.00 0.00 C ATOM 0 HA PRO A 48 0.773 -12.112 -0.628 1.00 0.00 H new ATOM 0 HB2 PRO A 48 1.882 -14.595 -0.375 1.00 0.00 H new ATOM 0 HB3 PRO A 48 1.072 -14.213 -1.881 1.00 0.00 H new ATOM 0 HG2 PRO A 48 4.023 -14.150 -1.251 1.00 0.00 H new ATOM 0 HG3 PRO A 48 3.217 -14.809 -2.661 1.00 0.00 H new ATOM 0 HD2 PRO A 48 4.381 -12.298 -2.612 1.00 0.00 H new ATOM 0 HD3 PRO A 48 3.086 -12.734 -3.709 1.00 0.00 H new ATOM 736 N GLN A 49 3.441 -11.308 0.561 1.00 0.00 N ATOM 737 CA GLN A 49 4.188 -11.023 1.781 1.00 0.00 C ATOM 738 C GLN A 49 3.340 -10.206 2.745 1.00 0.00 C ATOM 739 O GLN A 49 3.382 -10.414 3.958 1.00 0.00 O ATOM 740 CB GLN A 49 5.494 -10.284 1.458 1.00 0.00 C ATOM 741 CG GLN A 49 6.677 -11.212 1.236 1.00 0.00 C ATOM 742 CD GLN A 49 6.395 -12.278 0.195 1.00 0.00 C ATOM 743 OE1 GLN A 49 5.684 -12.037 -0.781 1.00 0.00 O ATOM 744 NE2 GLN A 49 6.952 -13.465 0.398 1.00 0.00 N ATOM 0 H GLN A 49 3.697 -10.728 -0.238 1.00 0.00 H new ATOM 0 HA GLN A 49 4.440 -11.971 2.257 1.00 0.00 H new ATOM 0 HB2 GLN A 49 5.347 -9.676 0.565 1.00 0.00 H new ATOM 0 HB3 GLN A 49 5.727 -9.600 2.274 1.00 0.00 H new ATOM 0 HG2 GLN A 49 7.541 -10.625 0.925 1.00 0.00 H new ATOM 0 HG3 GLN A 49 6.940 -11.691 2.179 1.00 0.00 H new ATOM 0 HE21 GLN A 49 7.534 -13.621 1.221 1.00 0.00 H new ATOM 0 HE22 GLN A 49 6.798 -14.221 -0.269 1.00 0.00 H new ATOM 753 N LEU A 50 2.572 -9.271 2.197 1.00 0.00 N ATOM 754 CA LEU A 50 1.715 -8.416 2.998 1.00 0.00 C ATOM 755 C LEU A 50 0.558 -9.192 3.608 1.00 0.00 C ATOM 756 O LEU A 50 0.289 -9.094 4.804 1.00 0.00 O ATOM 757 CB LEU A 50 1.155 -7.312 2.116 1.00 0.00 C ATOM 758 CG LEU A 50 1.294 -5.904 2.671 1.00 0.00 C ATOM 759 CD1 LEU A 50 0.996 -5.871 4.165 1.00 0.00 C ATOM 760 CD2 LEU A 50 2.687 -5.375 2.385 1.00 0.00 C ATOM 0 H LEU A 50 2.528 -9.088 1.194 1.00 0.00 H new ATOM 0 HA LEU A 50 2.313 -8.002 3.810 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.654 -7.354 1.148 1.00 0.00 H new ATOM 0 HB3 LEU A 50 0.098 -7.512 1.938 1.00 0.00 H new ATOM 0 HG LEU A 50 0.565 -5.261 2.178 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.103 -4.851 4.535 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.023 -6.215 4.340 1.00 0.00 H new ATOM 0 HD13 LEU A 50 1.695 -6.523 4.690 1.00 0.00 H new ATOM 0 HD21 LEU A 50 2.782 -4.365 2.785 1.00 0.00 H new ATOM 0 HD22 LEU A 50 3.426 -6.023 2.856 1.00 0.00 H new ATOM 0 HD23 LEU A 50 2.855 -5.356 1.308 1.00 0.00 H new ATOM 772 N ILE A 51 -0.127 -9.953 2.770 1.00 0.00 N ATOM 773 CA ILE A 51 -1.271 -10.743 3.217 1.00 0.00 C ATOM 774 C ILE A 51 -0.906 -11.597 4.432 1.00 0.00 C ATOM 775 O ILE A 51 -1.715 -11.778 5.341 1.00 0.00 O ATOM 776 CB ILE A 51 -1.814 -11.651 2.086 1.00 0.00 C ATOM 777 CG1 ILE A 51 -2.541 -10.813 1.027 1.00 0.00 C ATOM 778 CG2 ILE A 51 -2.747 -12.716 2.649 1.00 0.00 C ATOM 779 CD1 ILE A 51 -3.598 -9.892 1.599 1.00 0.00 C ATOM 0 H ILE A 51 0.086 -10.043 1.777 1.00 0.00 H new ATOM 0 HA ILE A 51 -2.054 -10.039 3.499 1.00 0.00 H new ATOM 0 HB ILE A 51 -0.967 -12.150 1.615 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -1.809 -10.217 0.483 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -3.008 -11.482 0.304 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -3.116 -13.342 1.837 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -2.205 -13.333 3.365 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -3.588 -12.236 3.148 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -4.069 -9.332 0.791 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -4.352 -10.483 2.119 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -3.135 -9.197 2.300 1.00 0.00 H new ATOM 791 N GLU A 52 0.317 -12.114 4.441 1.00 0.00 N ATOM 792 CA GLU A 52 0.784 -12.942 5.548 1.00 0.00 C ATOM 793 C GLU A 52 0.970 -12.106 6.811 1.00 0.00 C ATOM 794 O GLU A 52 0.462 -12.452 7.877 1.00 0.00 O ATOM 795 CB GLU A 52 2.098 -13.633 5.179 1.00 0.00 C ATOM 796 CG GLU A 52 1.910 -15.007 4.554 1.00 0.00 C ATOM 797 CD GLU A 52 0.980 -14.980 3.358 1.00 0.00 C ATOM 798 OE1 GLU A 52 -0.169 -14.517 3.509 1.00 0.00 O ATOM 799 OE2 GLU A 52 1.402 -15.424 2.268 1.00 0.00 O ATOM 0 H GLU A 52 1.001 -11.976 3.698 1.00 0.00 H new ATOM 0 HA GLU A 52 0.028 -13.702 5.745 1.00 0.00 H new ATOM 0 HB2 GLU A 52 2.649 -12.999 4.484 1.00 0.00 H new ATOM 0 HB3 GLU A 52 2.711 -13.732 6.075 1.00 0.00 H new ATOM 0 HG2 GLU A 52 2.880 -15.398 4.247 1.00 0.00 H new ATOM 0 HG3 GLU A 52 1.513 -15.692 5.303 1.00 0.00 H new ATOM 806 N PHE A 53 1.698 -11.001 6.682 1.00 0.00 N ATOM 807 CA PHE A 53 1.946 -10.113 7.814 1.00 0.00 C ATOM 808 C PHE A 53 0.660 -9.417 8.248 1.00 0.00 C ATOM 809 O PHE A 53 0.498 -9.056 9.414 1.00 0.00 O ATOM 810 CB PHE A 53 3.008 -9.072 7.453 1.00 0.00 C ATOM 811 CG PHE A 53 3.328 -8.124 8.575 1.00 0.00 C ATOM 812 CD1 PHE A 53 4.150 -8.517 9.620 1.00 0.00 C ATOM 813 CD2 PHE A 53 2.807 -6.840 8.584 1.00 0.00 C ATOM 814 CE1 PHE A 53 4.446 -7.646 10.652 1.00 0.00 C ATOM 815 CE2 PHE A 53 3.098 -5.967 9.614 1.00 0.00 C ATOM 816 CZ PHE A 53 3.919 -6.370 10.649 1.00 0.00 C ATOM 0 H PHE A 53 2.126 -10.699 5.807 1.00 0.00 H new ATOM 0 HA PHE A 53 2.311 -10.717 8.645 1.00 0.00 H new ATOM 0 HB2 PHE A 53 3.921 -9.586 7.151 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.665 -8.499 6.591 1.00 0.00 H new ATOM 0 HD1 PHE A 53 4.564 -9.515 9.628 1.00 0.00 H new ATOM 0 HD2 PHE A 53 2.166 -6.518 7.776 1.00 0.00 H new ATOM 0 HE1 PHE A 53 5.089 -7.963 11.460 1.00 0.00 H new ATOM 0 HE2 PHE A 53 2.684 -4.970 9.610 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.148 -5.688 11.455 1.00 0.00 H new ATOM 826 N TYR A 54 -0.252 -9.228 7.298 1.00 0.00 N ATOM 827 CA TYR A 54 -1.523 -8.573 7.575 1.00 0.00 C ATOM 828 C TYR A 54 -2.523 -9.551 8.187 1.00 0.00 C ATOM 829 O TYR A 54 -3.074 -9.301 9.252 1.00 0.00 O ATOM 830 CB TYR A 54 -2.093 -7.967 6.287 1.00 0.00 C ATOM 831 CG TYR A 54 -3.548 -7.556 6.389 1.00 0.00 C ATOM 832 CD1 TYR A 54 -3.905 -6.296 6.852 1.00 0.00 C ATOM 833 CD2 TYR A 54 -4.562 -8.431 6.020 1.00 0.00 C ATOM 834 CE1 TYR A 54 -5.232 -5.919 6.945 1.00 0.00 C ATOM 835 CE2 TYR A 54 -5.891 -8.062 6.110 1.00 0.00 C ATOM 836 CZ TYR A 54 -6.220 -6.806 6.573 1.00 0.00 C ATOM 837 OH TYR A 54 -7.542 -6.435 6.664 1.00 0.00 O ATOM 0 H TYR A 54 -0.132 -9.521 6.328 1.00 0.00 H new ATOM 0 HA TYR A 54 -1.346 -7.776 8.297 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -1.498 -7.095 6.014 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -1.987 -8.691 5.479 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -3.133 -5.599 7.144 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -4.308 -9.416 5.657 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -5.493 -4.936 7.307 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -6.667 -8.754 5.819 1.00 0.00 H new ATOM 0 HH TYR A 54 -8.111 -7.174 6.362 1.00 0.00 H new ATOM 847 N ASP A 55 -2.756 -10.662 7.506 1.00 0.00 N ATOM 848 CA ASP A 55 -3.699 -11.663 7.991 1.00 0.00 C ATOM 849 C ASP A 55 -3.345 -12.137 9.400 1.00 0.00 C ATOM 850 O ASP A 55 -4.210 -12.600 10.143 1.00 0.00 O ATOM 851 CB ASP A 55 -3.736 -12.859 7.036 1.00 0.00 C ATOM 852 CG ASP A 55 -4.935 -13.755 7.277 1.00 0.00 C ATOM 853 OD1 ASP A 55 -5.945 -13.261 7.821 1.00 0.00 O ATOM 854 OD2 ASP A 55 -4.864 -14.950 6.921 1.00 0.00 O ATOM 0 H ASP A 55 -2.308 -10.895 6.619 1.00 0.00 H new ATOM 0 HA ASP A 55 -4.683 -11.196 8.031 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -3.756 -12.499 6.008 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -2.822 -13.441 7.152 1.00 0.00 H new ATOM 859 N LYS A 56 -2.066 -12.047 9.754 1.00 0.00 N ATOM 860 CA LYS A 56 -1.601 -12.500 11.057 1.00 0.00 C ATOM 861 C LYS A 56 -1.544 -11.383 12.106 1.00 0.00 C ATOM 862 O LYS A 56 -1.454 -11.669 13.300 1.00 0.00 O ATOM 863 CB LYS A 56 -0.221 -13.142 10.923 1.00 0.00 C ATOM 864 CG LYS A 56 -0.159 -14.232 9.867 1.00 0.00 C ATOM 865 CD LYS A 56 -0.654 -15.563 10.410 1.00 0.00 C ATOM 866 CE LYS A 56 -1.458 -16.325 9.369 1.00 0.00 C ATOM 867 NZ LYS A 56 -0.760 -16.377 8.056 1.00 0.00 N ATOM 0 H LYS A 56 -1.335 -11.664 9.155 1.00 0.00 H new ATOM 0 HA LYS A 56 -2.331 -13.229 11.408 1.00 0.00 H new ATOM 0 HB2 LYS A 56 0.508 -12.369 10.679 1.00 0.00 H new ATOM 0 HB3 LYS A 56 0.070 -13.563 11.885 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.763 -13.942 9.007 1.00 0.00 H new ATOM 0 HG3 LYS A 56 0.867 -14.341 9.514 1.00 0.00 H new ATOM 0 HD2 LYS A 56 0.196 -16.166 10.728 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -1.270 -15.391 11.293 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -1.641 -17.340 9.723 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -2.431 -15.851 9.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -1.097 -17.199 7.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -0.959 -15.507 7.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 0.265 -16.461 8.211 1.00 0.00 H new ATOM 881 N PHE A 57 -1.567 -10.120 11.680 1.00 0.00 N ATOM 882 CA PHE A 57 -1.482 -9.015 12.634 1.00 0.00 C ATOM 883 C PHE A 57 -2.464 -7.885 12.322 1.00 0.00 C ATOM 884 O PHE A 57 -2.461 -6.857 12.998 1.00 0.00 O ATOM 885 CB PHE A 57 -0.055 -8.464 12.667 1.00 0.00 C ATOM 886 CG PHE A 57 0.751 -8.952 13.837 1.00 0.00 C ATOM 887 CD1 PHE A 57 1.326 -10.212 13.820 1.00 0.00 C ATOM 888 CD2 PHE A 57 0.934 -8.150 14.952 1.00 0.00 C ATOM 889 CE1 PHE A 57 2.070 -10.664 14.893 1.00 0.00 C ATOM 890 CE2 PHE A 57 1.675 -8.597 16.029 1.00 0.00 C ATOM 891 CZ PHE A 57 2.244 -9.855 15.999 1.00 0.00 C ATOM 0 H PHE A 57 -1.642 -9.840 10.702 1.00 0.00 H new ATOM 0 HA PHE A 57 -1.754 -9.417 13.610 1.00 0.00 H new ATOM 0 HB2 PHE A 57 0.454 -8.742 11.744 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -0.095 -7.375 12.693 1.00 0.00 H new ATOM 0 HD1 PHE A 57 1.191 -10.849 12.958 1.00 0.00 H new ATOM 0 HD2 PHE A 57 0.493 -7.165 14.979 1.00 0.00 H new ATOM 0 HE1 PHE A 57 2.515 -11.648 14.867 1.00 0.00 H new ATOM 0 HE2 PHE A 57 1.809 -7.963 16.893 1.00 0.00 H new ATOM 0 HZ PHE A 57 2.824 -10.206 16.839 1.00 0.00 H new ATOM 901 N HIS A 58 -3.290 -8.058 11.297 1.00 0.00 N ATOM 902 CA HIS A 58 -4.243 -7.026 10.920 1.00 0.00 C ATOM 903 C HIS A 58 -5.170 -6.682 12.081 1.00 0.00 C ATOM 904 O HIS A 58 -5.637 -5.552 12.198 1.00 0.00 O ATOM 905 CB HIS A 58 -5.070 -7.457 9.708 1.00 0.00 C ATOM 906 CG HIS A 58 -5.925 -8.662 9.957 1.00 0.00 C ATOM 907 ND1 HIS A 58 -7.296 -8.655 9.812 1.00 0.00 N ATOM 908 CD2 HIS A 58 -5.598 -9.919 10.344 1.00 0.00 C ATOM 909 CE1 HIS A 58 -7.775 -9.852 10.099 1.00 0.00 C ATOM 910 NE2 HIS A 58 -6.766 -10.637 10.424 1.00 0.00 N ATOM 0 H HIS A 58 -3.318 -8.897 10.717 1.00 0.00 H new ATOM 0 HA HIS A 58 -3.670 -6.137 10.655 1.00 0.00 H new ATOM 0 HB2 HIS A 58 -5.708 -6.628 9.401 1.00 0.00 H new ATOM 0 HB3 HIS A 58 -4.397 -7.666 8.876 1.00 0.00 H new ATOM 0 HD2 HIS A 58 -4.604 -10.287 10.551 1.00 0.00 H new ATOM 0 HE1 HIS A 58 -8.816 -10.139 10.072 1.00 0.00 H new ATOM 0 HE2 HIS A 58 -6.841 -11.618 10.691 1.00 0.00 H new ATOM 919 N GLU A 59 -5.437 -7.663 12.933 1.00 0.00 N ATOM 920 CA GLU A 59 -6.313 -7.458 14.082 1.00 0.00 C ATOM 921 C GLU A 59 -5.566 -6.774 15.225 1.00 0.00 C ATOM 922 O GLU A 59 -6.162 -6.051 16.023 1.00 0.00 O ATOM 923 CB GLU A 59 -6.885 -8.793 14.558 1.00 0.00 C ATOM 924 CG GLU A 59 -7.516 -9.617 13.448 1.00 0.00 C ATOM 925 CD GLU A 59 -7.858 -11.026 13.890 1.00 0.00 C ATOM 926 OE1 GLU A 59 -7.191 -11.537 14.813 1.00 0.00 O ATOM 927 OE2 GLU A 59 -8.794 -11.619 13.313 1.00 0.00 O ATOM 0 H GLU A 59 -5.061 -8.608 12.852 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.132 -6.810 13.770 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -6.089 -9.375 15.023 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -7.633 -8.604 15.328 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.421 -9.119 13.101 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -6.832 -9.662 12.600 1.00 0.00 H new ATOM 934 N SER A 60 -4.264 -7.019 15.303 1.00 0.00 N ATOM 935 CA SER A 60 -3.437 -6.440 16.356 1.00 0.00 C ATOM 936 C SER A 60 -3.208 -4.945 16.139 1.00 0.00 C ATOM 937 O SER A 60 -3.796 -4.113 16.829 1.00 0.00 O ATOM 938 CB SER A 60 -2.092 -7.166 16.427 1.00 0.00 C ATOM 939 OG SER A 60 -2.155 -8.272 17.311 1.00 0.00 O ATOM 0 H SER A 60 -3.757 -7.615 14.649 1.00 0.00 H new ATOM 0 HA SER A 60 -3.970 -6.563 17.299 1.00 0.00 H new ATOM 0 HB2 SER A 60 -1.807 -7.508 15.432 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.319 -6.474 16.760 1.00 0.00 H new ATOM 0 HG SER A 60 -1.284 -8.720 17.337 1.00 0.00 H new ATOM 945 N LYS A 61 -2.334 -4.613 15.194 1.00 0.00 N ATOM 946 CA LYS A 61 -2.009 -3.218 14.907 1.00 0.00 C ATOM 947 C LYS A 61 -3.123 -2.512 14.133 1.00 0.00 C ATOM 948 O LYS A 61 -3.111 -1.288 14.005 1.00 0.00 O ATOM 949 CB LYS A 61 -0.697 -3.131 14.125 1.00 0.00 C ATOM 950 CG LYS A 61 -0.783 -3.692 12.713 1.00 0.00 C ATOM 951 CD LYS A 61 0.489 -3.423 11.920 1.00 0.00 C ATOM 952 CE LYS A 61 0.759 -1.905 11.782 1.00 0.00 C ATOM 953 NZ LYS A 61 1.968 -1.636 10.956 1.00 0.00 N ATOM 0 H LYS A 61 -1.838 -5.289 14.614 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.900 -2.709 15.865 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -0.385 -2.088 14.073 1.00 0.00 H new ATOM 0 HB3 LYS A 61 0.077 -3.668 14.672 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -0.963 -4.766 12.759 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -1.634 -3.248 12.197 1.00 0.00 H new ATOM 0 HD2 LYS A 61 1.335 -3.901 12.414 1.00 0.00 H new ATOM 0 HD3 LYS A 61 0.403 -3.870 10.930 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -0.106 -1.421 11.330 1.00 0.00 H new ATOM 0 HE3 LYS A 61 0.889 -1.467 12.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 2.443 -0.779 11.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 2.620 -2.444 11.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 1.687 -1.497 9.964 1.00 0.00 H new ATOM 967 N ASN A 62 -4.088 -3.275 13.621 1.00 0.00 N ATOM 968 CA ASN A 62 -5.195 -2.695 12.871 1.00 0.00 C ATOM 969 C ASN A 62 -4.691 -1.741 11.794 1.00 0.00 C ATOM 970 O ASN A 62 -4.691 -0.524 11.978 1.00 0.00 O ATOM 971 CB ASN A 62 -6.136 -1.965 13.824 1.00 0.00 C ATOM 972 CG ASN A 62 -7.566 -1.934 13.320 1.00 0.00 C ATOM 973 OD1 ASN A 62 -8.283 -2.932 13.396 1.00 0.00 O ATOM 974 ND2 ASN A 62 -7.987 -0.787 12.804 1.00 0.00 N ATOM 0 H ASN A 62 -4.124 -4.290 13.712 1.00 0.00 H new ATOM 0 HA ASN A 62 -5.736 -3.502 12.376 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -6.109 -2.451 14.799 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -5.783 -0.944 13.967 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -8.940 -0.706 12.450 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -7.358 0.015 12.761 1.00 0.00 H new ATOM 981 N PHE A 63 -4.257 -2.302 10.670 1.00 0.00 N ATOM 982 CA PHE A 63 -3.745 -1.498 9.565 1.00 0.00 C ATOM 983 C PHE A 63 -4.377 -1.918 8.242 1.00 0.00 C ATOM 984 O PHE A 63 -5.072 -2.930 8.170 1.00 0.00 O ATOM 985 CB PHE A 63 -2.218 -1.603 9.489 1.00 0.00 C ATOM 986 CG PHE A 63 -1.716 -2.910 8.941 1.00 0.00 C ATOM 987 CD1 PHE A 63 -1.926 -4.095 9.628 1.00 0.00 C ATOM 988 CD2 PHE A 63 -1.028 -2.950 7.739 1.00 0.00 C ATOM 989 CE1 PHE A 63 -1.461 -5.295 9.125 1.00 0.00 C ATOM 990 CE2 PHE A 63 -0.559 -4.147 7.231 1.00 0.00 C ATOM 991 CZ PHE A 63 -0.776 -5.320 7.926 1.00 0.00 C ATOM 0 H PHE A 63 -4.249 -3.308 10.500 1.00 0.00 H new ATOM 0 HA PHE A 63 -4.014 -0.458 9.751 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -1.840 -0.792 8.867 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -1.805 -1.458 10.487 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -2.459 -4.080 10.567 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -0.856 -2.035 7.192 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -1.633 -6.212 9.669 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -0.024 -4.165 6.293 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.410 -6.257 7.532 1.00 0.00 H new ATOM 1001 N GLU A 64 -4.137 -1.130 7.198 1.00 0.00 N ATOM 1002 CA GLU A 64 -4.691 -1.420 5.885 1.00 0.00 C ATOM 1003 C GLU A 64 -3.676 -1.134 4.780 1.00 0.00 C ATOM 1004 O GLU A 64 -3.146 -0.029 4.675 1.00 0.00 O ATOM 1005 CB GLU A 64 -5.954 -0.594 5.645 1.00 0.00 C ATOM 1006 CG GLU A 64 -7.168 -1.429 5.279 1.00 0.00 C ATOM 1007 CD GLU A 64 -7.861 -2.017 6.492 1.00 0.00 C ATOM 1008 OE1 GLU A 64 -7.313 -2.971 7.084 1.00 0.00 O ATOM 1009 OE2 GLU A 64 -8.952 -1.526 6.849 1.00 0.00 O ATOM 0 H GLU A 64 -3.563 -0.288 7.238 1.00 0.00 H new ATOM 0 HA GLU A 64 -4.941 -2.481 5.859 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -6.177 -0.018 6.543 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -5.763 0.123 4.846 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -7.875 -0.811 4.726 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -6.861 -2.236 4.614 1.00 0.00 H new ATOM 1016 N VAL A 65 -3.428 -2.134 3.949 1.00 0.00 N ATOM 1017 CA VAL A 65 -2.496 -2.004 2.835 1.00 0.00 C ATOM 1018 C VAL A 65 -3.260 -1.835 1.529 1.00 0.00 C ATOM 1019 O VAL A 65 -4.001 -2.720 1.128 1.00 0.00 O ATOM 1020 CB VAL A 65 -1.581 -3.240 2.726 1.00 0.00 C ATOM 1021 CG1 VAL A 65 -0.573 -3.081 1.592 1.00 0.00 C ATOM 1022 CG2 VAL A 65 -0.879 -3.498 4.050 1.00 0.00 C ATOM 0 H VAL A 65 -3.863 -3.054 4.025 1.00 0.00 H new ATOM 0 HA VAL A 65 -1.879 -1.125 3.021 1.00 0.00 H new ATOM 0 HB VAL A 65 -2.202 -4.105 2.493 1.00 0.00 H new ATOM 0 HG11 VAL A 65 0.058 -3.968 1.539 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -1.104 -2.957 0.648 1.00 0.00 H new ATOM 0 HG13 VAL A 65 0.048 -2.204 1.777 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.237 -4.374 3.957 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.274 -2.631 4.316 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -1.622 -3.674 4.828 1.00 0.00 H new ATOM 1032 N VAL A 66 -3.084 -0.699 0.872 1.00 0.00 N ATOM 1033 CA VAL A 66 -3.780 -0.440 -0.385 1.00 0.00 C ATOM 1034 C VAL A 66 -2.944 -0.928 -1.571 1.00 0.00 C ATOM 1035 O VAL A 66 -1.716 -0.866 -1.532 1.00 0.00 O ATOM 1036 CB VAL A 66 -4.071 1.068 -0.548 1.00 0.00 C ATOM 1037 CG1 VAL A 66 -4.794 1.359 -1.857 1.00 0.00 C ATOM 1038 CG2 VAL A 66 -4.872 1.585 0.638 1.00 0.00 C ATOM 0 H VAL A 66 -2.471 0.055 1.183 1.00 0.00 H new ATOM 0 HA VAL A 66 -4.725 -0.984 -0.363 1.00 0.00 H new ATOM 0 HB VAL A 66 -3.116 1.592 -0.578 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -4.983 2.429 -1.938 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -4.176 1.035 -2.694 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -5.742 0.821 -1.877 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.069 2.649 0.508 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -5.817 1.046 0.701 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -4.304 1.431 1.556 1.00 0.00 H new ATOM 1048 N PHE A 67 -3.605 -1.420 -2.621 1.00 0.00 N ATOM 1049 CA PHE A 67 -2.895 -1.918 -3.792 1.00 0.00 C ATOM 1050 C PHE A 67 -2.647 -0.805 -4.806 1.00 0.00 C ATOM 1051 O PHE A 67 -3.577 -0.296 -5.430 1.00 0.00 O ATOM 1052 CB PHE A 67 -3.672 -3.075 -4.431 1.00 0.00 C ATOM 1053 CG PHE A 67 -3.424 -3.268 -5.906 1.00 0.00 C ATOM 1054 CD1 PHE A 67 -2.144 -3.182 -6.429 1.00 0.00 C ATOM 1055 CD2 PHE A 67 -4.477 -3.545 -6.763 1.00 0.00 C ATOM 1056 CE1 PHE A 67 -1.919 -3.367 -7.780 1.00 0.00 C ATOM 1057 CE2 PHE A 67 -4.257 -3.731 -8.115 1.00 0.00 C ATOM 1058 CZ PHE A 67 -2.976 -3.643 -8.624 1.00 0.00 C ATOM 0 H PHE A 67 -4.621 -1.482 -2.681 1.00 0.00 H new ATOM 0 HA PHE A 67 -1.923 -2.288 -3.467 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -3.415 -3.997 -3.910 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -4.738 -2.908 -4.275 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -1.313 -2.968 -5.774 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -5.481 -3.616 -6.370 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -0.917 -3.296 -8.175 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -5.086 -3.945 -8.773 1.00 0.00 H new ATOM 0 HZ PHE A 67 -2.802 -3.790 -9.680 1.00 0.00 H new ATOM 1068 N CYS A 68 -1.378 -0.452 -4.974 1.00 0.00 N ATOM 1069 CA CYS A 68 -0.987 0.581 -5.924 1.00 0.00 C ATOM 1070 C CYS A 68 -0.393 -0.070 -7.164 1.00 0.00 C ATOM 1071 O CYS A 68 0.736 -0.560 -7.139 1.00 0.00 O ATOM 1072 CB CYS A 68 0.026 1.545 -5.300 1.00 0.00 C ATOM 1073 SG CYS A 68 -0.065 1.661 -3.499 1.00 0.00 S ATOM 0 H CYS A 68 -0.600 -0.868 -4.462 1.00 0.00 H new ATOM 0 HA CYS A 68 -1.872 1.154 -6.200 1.00 0.00 H new ATOM 0 HB2 CYS A 68 1.031 1.229 -5.581 1.00 0.00 H new ATOM 0 HB3 CYS A 68 -0.126 2.538 -5.724 1.00 0.00 H new ATOM 0 HG CYS A 68 -1.287 1.445 -3.111 1.00 0.00 H new ATOM 1079 N THR A 69 -1.166 -0.093 -8.239 1.00 0.00 N ATOM 1080 CA THR A 69 -0.720 -0.712 -9.480 1.00 0.00 C ATOM 1081 C THR A 69 0.265 0.173 -10.236 1.00 0.00 C ATOM 1082 O THR A 69 0.315 1.386 -10.045 1.00 0.00 O ATOM 1083 CB THR A 69 -1.919 -1.036 -10.375 1.00 0.00 C ATOM 1084 OG1 THR A 69 -1.551 -1.957 -11.386 1.00 0.00 O ATOM 1085 CG2 THR A 69 -2.504 0.180 -11.056 1.00 0.00 C ATOM 0 H THR A 69 -2.103 0.308 -8.278 1.00 0.00 H new ATOM 0 HA THR A 69 -0.204 -1.635 -9.214 1.00 0.00 H new ATOM 0 HB THR A 69 -2.673 -1.456 -9.709 1.00 0.00 H new ATOM 0 HG1 THR A 69 -1.918 -1.663 -12.246 1.00 0.00 H new ATOM 0 HG21 THR A 69 -3.350 -0.121 -11.674 1.00 0.00 H new ATOM 0 HG22 THR A 69 -2.841 0.892 -10.303 1.00 0.00 H new ATOM 0 HG23 THR A 69 -1.744 0.647 -11.683 1.00 0.00 H new ATOM 1093 N TRP A 70 1.032 -0.461 -11.108 1.00 0.00 N ATOM 1094 CA TRP A 70 2.019 0.227 -11.934 1.00 0.00 C ATOM 1095 C TRP A 70 2.086 -0.429 -13.311 1.00 0.00 C ATOM 1096 O TRP A 70 3.161 -0.598 -13.885 1.00 0.00 O ATOM 1097 CB TRP A 70 3.393 0.195 -11.260 1.00 0.00 C ATOM 1098 CG TRP A 70 3.851 1.540 -10.785 1.00 0.00 C ATOM 1099 CD1 TRP A 70 3.698 2.061 -9.533 1.00 0.00 C ATOM 1100 CD2 TRP A 70 4.535 2.535 -11.554 1.00 0.00 C ATOM 1101 NE1 TRP A 70 4.246 3.320 -9.477 1.00 0.00 N ATOM 1102 CE2 TRP A 70 4.766 3.633 -10.706 1.00 0.00 C ATOM 1103 CE3 TRP A 70 4.976 2.603 -12.880 1.00 0.00 C ATOM 1104 CZ2 TRP A 70 5.418 4.785 -11.139 1.00 0.00 C ATOM 1105 CZ3 TRP A 70 5.622 3.747 -13.308 1.00 0.00 C ATOM 1106 CH2 TRP A 70 5.838 4.824 -12.440 1.00 0.00 C ATOM 0 H TRP A 70 0.990 -1.468 -11.265 1.00 0.00 H new ATOM 0 HA TRP A 70 1.719 1.268 -12.052 1.00 0.00 H new ATOM 0 HB2 TRP A 70 3.359 -0.490 -10.413 1.00 0.00 H new ATOM 0 HB3 TRP A 70 4.125 -0.204 -11.962 1.00 0.00 H new ATOM 0 HD1 TRP A 70 3.217 1.558 -8.707 1.00 0.00 H new ATOM 0 HE1 TRP A 70 4.263 3.923 -8.655 1.00 0.00 H new ATOM 0 HE3 TRP A 70 4.815 1.777 -13.556 1.00 0.00 H new ATOM 0 HZ2 TRP A 70 5.586 5.617 -10.472 1.00 0.00 H new ATOM 0 HZ3 TRP A 70 5.966 3.811 -14.330 1.00 0.00 H new ATOM 0 HH2 TRP A 70 6.347 5.704 -12.805 1.00 0.00 H new ATOM 1117 N ASP A 71 0.919 -0.810 -13.823 1.00 0.00 N ATOM 1118 CA ASP A 71 0.814 -1.467 -15.121 1.00 0.00 C ATOM 1119 C ASP A 71 0.037 -0.609 -16.112 1.00 0.00 C ATOM 1120 O ASP A 71 -0.666 0.324 -15.726 1.00 0.00 O ATOM 1121 CB ASP A 71 0.120 -2.823 -14.964 1.00 0.00 C ATOM 1122 CG ASP A 71 0.194 -3.661 -16.224 1.00 0.00 C ATOM 1123 OD1 ASP A 71 1.076 -3.393 -17.065 1.00 0.00 O ATOM 1124 OD2 ASP A 71 -0.632 -4.588 -16.370 1.00 0.00 O ATOM 0 H ASP A 71 0.025 -0.673 -13.352 1.00 0.00 H new ATOM 0 HA ASP A 71 1.823 -1.612 -15.508 1.00 0.00 H new ATOM 0 HB2 ASP A 71 0.579 -3.370 -14.140 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -0.925 -2.664 -14.698 1.00 0.00 H new ATOM 1129 N GLU A 72 0.157 -0.946 -17.391 1.00 0.00 N ATOM 1130 CA GLU A 72 -0.543 -0.222 -18.445 1.00 0.00 C ATOM 1131 C GLU A 72 -1.798 -0.980 -18.876 1.00 0.00 C ATOM 1132 O GLU A 72 -2.721 -0.399 -19.445 1.00 0.00 O ATOM 1133 CB GLU A 72 0.378 -0.009 -19.647 1.00 0.00 C ATOM 1134 CG GLU A 72 1.135 1.309 -19.608 1.00 0.00 C ATOM 1135 CD GLU A 72 2.421 1.218 -18.809 1.00 0.00 C ATOM 1136 OE1 GLU A 72 2.376 1.446 -17.583 1.00 0.00 O ATOM 1137 OE2 GLU A 72 3.473 0.919 -19.412 1.00 0.00 O ATOM 0 H GLU A 72 0.734 -1.718 -17.724 1.00 0.00 H new ATOM 0 HA GLU A 72 -0.841 0.750 -18.052 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.095 -0.829 -19.695 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -0.215 -0.051 -20.561 1.00 0.00 H new ATOM 0 HG2 GLU A 72 1.365 1.622 -20.626 1.00 0.00 H new ATOM 0 HG3 GLU A 72 0.496 2.078 -19.175 1.00 0.00 H new ATOM 1144 N GLU A 73 -1.825 -2.283 -18.598 1.00 0.00 N ATOM 1145 CA GLU A 73 -2.964 -3.120 -18.954 1.00 0.00 C ATOM 1146 C GLU A 73 -3.980 -3.165 -17.815 1.00 0.00 C ATOM 1147 O GLU A 73 -3.615 -3.310 -16.650 1.00 0.00 O ATOM 1148 CB GLU A 73 -2.497 -4.537 -19.293 1.00 0.00 C ATOM 1149 CG GLU A 73 -3.483 -5.313 -20.151 1.00 0.00 C ATOM 1150 CD GLU A 73 -3.066 -5.375 -21.608 1.00 0.00 C ATOM 1151 OE1 GLU A 73 -1.889 -5.698 -21.875 1.00 0.00 O ATOM 1152 OE2 GLU A 73 -3.915 -5.100 -22.481 1.00 0.00 O ATOM 0 H GLU A 73 -1.069 -2.780 -18.127 1.00 0.00 H new ATOM 0 HA GLU A 73 -3.444 -2.685 -19.830 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -1.541 -4.481 -19.813 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -2.324 -5.085 -18.367 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -3.579 -6.326 -19.761 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -4.466 -4.849 -20.078 1.00 0.00 H new ATOM 1159 N GLU A 74 -5.254 -3.034 -18.165 1.00 0.00 N ATOM 1160 CA GLU A 74 -6.326 -3.054 -17.173 1.00 0.00 C ATOM 1161 C GLU A 74 -6.556 -4.465 -16.636 1.00 0.00 C ATOM 1162 O GLU A 74 -6.990 -4.643 -15.499 1.00 0.00 O ATOM 1163 CB GLU A 74 -7.630 -2.511 -17.773 1.00 0.00 C ATOM 1164 CG GLU A 74 -7.430 -1.441 -18.841 1.00 0.00 C ATOM 1165 CD GLU A 74 -6.353 -0.436 -18.478 1.00 0.00 C ATOM 1166 OE1 GLU A 74 -6.049 -0.300 -17.274 1.00 0.00 O ATOM 1167 OE2 GLU A 74 -5.814 0.214 -19.397 1.00 0.00 O ATOM 0 H GLU A 74 -5.571 -2.913 -19.127 1.00 0.00 H new ATOM 0 HA GLU A 74 -6.019 -2.414 -16.346 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -8.190 -3.340 -18.206 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -8.241 -2.098 -16.971 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -7.168 -1.921 -19.784 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -8.371 -0.915 -19.001 1.00 0.00 H new ATOM 1174 N ASP A 75 -6.271 -5.464 -17.464 1.00 0.00 N ATOM 1175 CA ASP A 75 -6.455 -6.857 -17.075 1.00 0.00 C ATOM 1176 C ASP A 75 -5.408 -7.295 -16.052 1.00 0.00 C ATOM 1177 O ASP A 75 -5.636 -8.225 -15.279 1.00 0.00 O ATOM 1178 CB ASP A 75 -6.390 -7.764 -18.304 1.00 0.00 C ATOM 1179 CG ASP A 75 -6.885 -9.168 -18.015 1.00 0.00 C ATOM 1180 OD1 ASP A 75 -8.106 -9.338 -17.817 1.00 0.00 O ATOM 1181 OD2 ASP A 75 -6.050 -10.097 -17.986 1.00 0.00 O ATOM 0 H ASP A 75 -5.911 -5.335 -18.410 1.00 0.00 H new ATOM 0 HA ASP A 75 -7.438 -6.944 -16.613 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -6.988 -7.329 -19.105 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -5.362 -7.811 -18.663 1.00 0.00 H new ATOM 1186 N GLY A 76 -4.260 -6.625 -16.055 1.00 0.00 N ATOM 1187 CA GLY A 76 -3.202 -6.970 -15.123 1.00 0.00 C ATOM 1188 C GLY A 76 -3.483 -6.492 -13.711 1.00 0.00 C ATOM 1189 O GLY A 76 -3.489 -7.287 -12.771 1.00 0.00 O ATOM 0 H GLY A 76 -4.044 -5.852 -16.684 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -3.069 -8.052 -15.116 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -2.264 -6.536 -15.469 1.00 0.00 H new ATOM 1193 N PHE A 77 -3.714 -5.192 -13.560 1.00 0.00 N ATOM 1194 CA PHE A 77 -3.993 -4.608 -12.252 1.00 0.00 C ATOM 1195 C PHE A 77 -5.179 -5.300 -11.580 1.00 0.00 C ATOM 1196 O PHE A 77 -5.177 -5.524 -10.369 1.00 0.00 O ATOM 1197 CB PHE A 77 -4.256 -3.101 -12.395 1.00 0.00 C ATOM 1198 CG PHE A 77 -5.713 -2.719 -12.365 1.00 0.00 C ATOM 1199 CD1 PHE A 77 -6.458 -2.693 -13.532 1.00 0.00 C ATOM 1200 CD2 PHE A 77 -6.331 -2.390 -11.170 1.00 0.00 C ATOM 1201 CE1 PHE A 77 -7.795 -2.344 -13.508 1.00 0.00 C ATOM 1202 CE2 PHE A 77 -7.668 -2.040 -11.139 1.00 0.00 C ATOM 1203 CZ PHE A 77 -8.401 -2.017 -12.310 1.00 0.00 C ATOM 0 H PHE A 77 -3.714 -4.521 -14.329 1.00 0.00 H new ATOM 0 HA PHE A 77 -3.120 -4.756 -11.617 1.00 0.00 H new ATOM 0 HB2 PHE A 77 -3.739 -2.576 -11.592 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -3.821 -2.756 -13.333 1.00 0.00 H new ATOM 0 HD1 PHE A 77 -5.989 -2.948 -14.471 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -5.762 -2.407 -10.252 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -8.366 -2.327 -14.425 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -8.139 -1.785 -10.201 1.00 0.00 H new ATOM 0 HZ PHE A 77 -9.446 -1.744 -12.289 1.00 0.00 H new ATOM 1213 N ALA A 78 -6.191 -5.625 -12.374 1.00 0.00 N ATOM 1214 CA ALA A 78 -7.390 -6.281 -11.863 1.00 0.00 C ATOM 1215 C ALA A 78 -7.120 -7.723 -11.484 1.00 0.00 C ATOM 1216 O ALA A 78 -7.377 -8.140 -10.355 1.00 0.00 O ATOM 1217 CB ALA A 78 -8.456 -6.260 -12.916 1.00 0.00 C ATOM 0 H ALA A 78 -6.206 -5.445 -13.378 1.00 0.00 H new ATOM 0 HA ALA A 78 -7.710 -5.740 -10.973 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -9.353 -6.750 -12.536 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.689 -5.228 -13.177 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -8.103 -6.787 -13.802 1.00 0.00 H new ATOM 1223 N GLY A 79 -6.565 -8.475 -12.429 1.00 0.00 N ATOM 1224 CA GLY A 79 -6.229 -9.854 -12.163 1.00 0.00 C ATOM 1225 C GLY A 79 -5.279 -9.936 -10.996 1.00 0.00 C ATOM 1226 O GLY A 79 -5.056 -11.003 -10.424 1.00 0.00 O ATOM 0 H GLY A 79 -6.344 -8.152 -13.371 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -7.134 -10.422 -11.947 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.774 -10.303 -13.046 1.00 0.00 H new ATOM 1230 N TYR A 80 -4.714 -8.782 -10.655 1.00 0.00 N ATOM 1231 CA TYR A 80 -3.767 -8.688 -9.549 1.00 0.00 C ATOM 1232 C TYR A 80 -4.488 -8.635 -8.204 1.00 0.00 C ATOM 1233 O TYR A 80 -4.239 -9.459 -7.325 1.00 0.00 O ATOM 1234 CB TYR A 80 -2.873 -7.457 -9.714 1.00 0.00 C ATOM 1235 CG TYR A 80 -1.651 -7.470 -8.823 1.00 0.00 C ATOM 1236 CD1 TYR A 80 -1.772 -7.385 -7.442 1.00 0.00 C ATOM 1237 CD2 TYR A 80 -0.375 -7.568 -9.365 1.00 0.00 C ATOM 1238 CE1 TYR A 80 -0.657 -7.396 -6.626 1.00 0.00 C ATOM 1239 CE2 TYR A 80 0.744 -7.581 -8.556 1.00 0.00 C ATOM 1240 CZ TYR A 80 0.599 -7.494 -7.188 1.00 0.00 C ATOM 1241 OH TYR A 80 1.712 -7.505 -6.378 1.00 0.00 O ATOM 0 H TYR A 80 -4.896 -7.898 -11.129 1.00 0.00 H new ATOM 0 HA TYR A 80 -3.146 -9.584 -9.566 1.00 0.00 H new ATOM 0 HB2 TYR A 80 -2.553 -7.388 -10.754 1.00 0.00 H new ATOM 0 HB3 TYR A 80 -3.458 -6.563 -9.500 1.00 0.00 H new ATOM 0 HD1 TYR A 80 -2.754 -7.309 -6.999 1.00 0.00 H new ATOM 0 HD2 TYR A 80 -0.257 -7.635 -10.436 1.00 0.00 H new ATOM 0 HE1 TYR A 80 -0.768 -7.328 -5.554 1.00 0.00 H new ATOM 0 HE2 TYR A 80 1.728 -7.659 -8.993 1.00 0.00 H new ATOM 0 HH TYR A 80 2.232 -8.318 -6.547 1.00 0.00 H new ATOM 1251 N PHE A 81 -5.376 -7.658 -8.045 1.00 0.00 N ATOM 1252 CA PHE A 81 -6.124 -7.498 -6.800 1.00 0.00 C ATOM 1253 C PHE A 81 -7.292 -8.483 -6.715 1.00 0.00 C ATOM 1254 O PHE A 81 -7.890 -8.655 -5.652 1.00 0.00 O ATOM 1255 CB PHE A 81 -6.625 -6.051 -6.668 1.00 0.00 C ATOM 1256 CG PHE A 81 -8.053 -5.844 -7.095 1.00 0.00 C ATOM 1257 CD1 PHE A 81 -8.426 -6.021 -8.417 1.00 0.00 C ATOM 1258 CD2 PHE A 81 -9.019 -5.471 -6.174 1.00 0.00 C ATOM 1259 CE1 PHE A 81 -9.736 -5.831 -8.813 1.00 0.00 C ATOM 1260 CE2 PHE A 81 -10.330 -5.281 -6.564 1.00 0.00 C ATOM 1261 CZ PHE A 81 -10.690 -5.460 -7.885 1.00 0.00 C ATOM 0 H PHE A 81 -5.596 -6.966 -8.761 1.00 0.00 H new ATOM 0 HA PHE A 81 -5.451 -7.718 -5.971 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -6.520 -5.737 -5.629 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -5.983 -5.402 -7.264 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -7.684 -6.311 -9.147 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -8.743 -5.327 -5.140 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -10.014 -5.972 -9.847 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -11.074 -4.992 -5.836 1.00 0.00 H new ATOM 0 HZ PHE A 81 -11.715 -5.310 -8.192 1.00 0.00 H new ATOM 1271 N ALA A 82 -7.618 -9.122 -7.836 1.00 0.00 N ATOM 1272 CA ALA A 82 -8.720 -10.081 -7.884 1.00 0.00 C ATOM 1273 C ALA A 82 -8.674 -11.059 -6.711 1.00 0.00 C ATOM 1274 O ALA A 82 -9.711 -11.528 -6.242 1.00 0.00 O ATOM 1275 CB ALA A 82 -8.697 -10.839 -9.203 1.00 0.00 C ATOM 0 H ALA A 82 -7.134 -8.993 -8.725 1.00 0.00 H new ATOM 0 HA ALA A 82 -9.651 -9.519 -7.807 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -9.522 -11.551 -9.228 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -8.800 -10.135 -10.029 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -7.753 -11.375 -9.298 1.00 0.00 H new ATOM 1281 N LYS A 83 -7.467 -11.368 -6.246 1.00 0.00 N ATOM 1282 CA LYS A 83 -7.294 -12.296 -5.136 1.00 0.00 C ATOM 1283 C LYS A 83 -6.764 -11.584 -3.894 1.00 0.00 C ATOM 1284 O LYS A 83 -6.012 -12.162 -3.111 1.00 0.00 O ATOM 1285 CB LYS A 83 -6.336 -13.417 -5.538 1.00 0.00 C ATOM 1286 CG LYS A 83 -6.692 -14.072 -6.864 1.00 0.00 C ATOM 1287 CD LYS A 83 -7.292 -15.455 -6.662 1.00 0.00 C ATOM 1288 CE LYS A 83 -6.272 -16.549 -6.934 1.00 0.00 C ATOM 1289 NZ LYS A 83 -6.624 -17.821 -6.244 1.00 0.00 N ATOM 0 H LYS A 83 -6.597 -10.990 -6.620 1.00 0.00 H new ATOM 0 HA LYS A 83 -8.270 -12.718 -4.895 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -5.325 -13.015 -5.600 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -6.330 -14.177 -4.756 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -7.400 -13.443 -7.403 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -5.799 -14.149 -7.484 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -7.662 -15.547 -5.641 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -8.149 -15.582 -7.324 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -6.206 -16.725 -8.008 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -5.287 -16.217 -6.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -5.904 -18.541 -6.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -6.662 -17.660 -5.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -7.552 -18.151 -6.577 1.00 0.00 H new ATOM 1303 N MET A 84 -7.160 -10.326 -3.719 1.00 0.00 N ATOM 1304 CA MET A 84 -6.719 -9.541 -2.570 1.00 0.00 C ATOM 1305 C MET A 84 -7.892 -8.785 -1.943 1.00 0.00 C ATOM 1306 O MET A 84 -8.697 -8.179 -2.652 1.00 0.00 O ATOM 1307 CB MET A 84 -5.633 -8.553 -2.993 1.00 0.00 C ATOM 1308 CG MET A 84 -4.664 -9.117 -4.021 1.00 0.00 C ATOM 1309 SD MET A 84 -3.659 -10.461 -3.363 1.00 0.00 S ATOM 1310 CE MET A 84 -2.046 -10.019 -3.999 1.00 0.00 C ATOM 0 H MET A 84 -7.783 -9.830 -4.356 1.00 0.00 H new ATOM 0 HA MET A 84 -6.312 -10.226 -1.827 1.00 0.00 H new ATOM 0 HB2 MET A 84 -6.105 -7.660 -3.403 1.00 0.00 H new ATOM 0 HB3 MET A 84 -5.073 -8.241 -2.111 1.00 0.00 H new ATOM 0 HG2 MET A 84 -5.224 -9.476 -4.884 1.00 0.00 H new ATOM 0 HG3 MET A 84 -4.011 -8.319 -4.375 1.00 0.00 H new ATOM 0 HE1 MET A 84 -1.751 -10.731 -4.770 1.00 0.00 H new ATOM 0 HE2 MET A 84 -2.085 -9.017 -4.426 1.00 0.00 H new ATOM 0 HE3 MET A 84 -1.317 -10.039 -3.189 1.00 0.00 H new ATOM 1320 N PRO A 85 -8.011 -8.815 -0.603 1.00 0.00 N ATOM 1321 CA PRO A 85 -9.096 -8.137 0.110 1.00 0.00 C ATOM 1322 C PRO A 85 -8.821 -6.651 0.344 1.00 0.00 C ATOM 1323 O PRO A 85 -9.744 -5.839 0.370 1.00 0.00 O ATOM 1324 CB PRO A 85 -9.137 -8.884 1.439 1.00 0.00 C ATOM 1325 CG PRO A 85 -7.722 -9.286 1.683 1.00 0.00 C ATOM 1326 CD PRO A 85 -7.105 -9.522 0.326 1.00 0.00 C ATOM 0 HA PRO A 85 -10.030 -8.157 -0.452 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -9.513 -8.248 2.241 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -9.793 -9.753 1.386 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -7.185 -8.507 2.223 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -7.674 -10.188 2.293 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -6.091 -9.126 0.274 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -7.045 -10.585 0.094 1.00 0.00 H new ATOM 1334 N TRP A 86 -7.548 -6.305 0.522 1.00 0.00 N ATOM 1335 CA TRP A 86 -7.154 -4.917 0.765 1.00 0.00 C ATOM 1336 C TRP A 86 -7.815 -3.965 -0.225 1.00 0.00 C ATOM 1337 O TRP A 86 -8.246 -4.386 -1.298 1.00 0.00 O ATOM 1338 CB TRP A 86 -5.636 -4.776 0.678 1.00 0.00 C ATOM 1339 CG TRP A 86 -5.036 -5.227 -0.615 1.00 0.00 C ATOM 1340 CD1 TRP A 86 -5.391 -4.826 -1.868 1.00 0.00 C ATOM 1341 CD2 TRP A 86 -3.950 -6.145 -0.777 1.00 0.00 C ATOM 1342 NE1 TRP A 86 -4.592 -5.438 -2.801 1.00 0.00 N ATOM 1343 CE2 TRP A 86 -3.701 -6.257 -2.157 1.00 0.00 C ATOM 1344 CE3 TRP A 86 -3.164 -6.884 0.112 1.00 0.00 C ATOM 1345 CZ2 TRP A 86 -2.700 -7.079 -2.668 1.00 0.00 C ATOM 1346 CZ3 TRP A 86 -2.171 -7.699 -0.397 1.00 0.00 C ATOM 1347 CH2 TRP A 86 -1.946 -7.790 -1.776 1.00 0.00 C ATOM 0 H TRP A 86 -6.771 -6.966 0.503 1.00 0.00 H new ATOM 0 HA TRP A 86 -7.489 -4.651 1.768 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -5.373 -3.731 0.839 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -5.185 -5.347 1.490 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -6.185 -4.129 -2.094 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -4.651 -5.305 -3.811 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -3.330 -6.819 1.177 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -2.525 -7.152 -3.731 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -1.558 -8.275 0.280 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -1.161 -8.435 -2.143 1.00 0.00 H new ATOM 1358 N LEU A 87 -7.904 -2.676 0.129 1.00 0.00 N ATOM 1359 CA LEU A 87 -8.522 -1.718 -0.756 1.00 0.00 C ATOM 1360 C LEU A 87 -7.526 -1.194 -1.779 1.00 0.00 C ATOM 1361 O LEU A 87 -6.441 -0.745 -1.427 1.00 0.00 O ATOM 1362 CB LEU A 87 -9.126 -0.558 0.033 1.00 0.00 C ATOM 1363 CG LEU A 87 -9.913 -0.961 1.281 1.00 0.00 C ATOM 1364 CD1 LEU A 87 -9.692 0.047 2.401 1.00 0.00 C ATOM 1365 CD2 LEU A 87 -11.394 -1.085 0.956 1.00 0.00 C ATOM 0 H LEU A 87 -7.559 -2.291 1.008 1.00 0.00 H new ATOM 0 HA LEU A 87 -9.323 -2.231 -1.289 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -8.322 0.115 0.331 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -9.786 0.005 -0.627 1.00 0.00 H new ATOM 0 HG LEU A 87 -9.552 -1.932 1.620 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -10.260 -0.256 3.281 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -8.632 0.088 2.650 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -10.026 1.032 2.075 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -11.941 -1.372 1.854 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -11.768 -0.127 0.594 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -11.535 -1.844 0.187 1.00 0.00 H new ATOM 1377 N ALA A 88 -7.906 -1.260 -3.047 1.00 0.00 N ATOM 1378 CA ALA A 88 -7.045 -0.798 -4.124 1.00 0.00 C ATOM 1379 C ALA A 88 -7.647 0.400 -4.843 1.00 0.00 C ATOM 1380 O ALA A 88 -8.859 0.609 -4.819 1.00 0.00 O ATOM 1381 CB ALA A 88 -6.798 -1.929 -5.103 1.00 0.00 C ATOM 0 H ALA A 88 -8.806 -1.629 -3.354 1.00 0.00 H new ATOM 0 HA ALA A 88 -6.097 -0.481 -3.690 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -6.152 -1.579 -5.908 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -6.316 -2.759 -4.586 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -7.748 -2.264 -5.519 1.00 0.00 H new ATOM 1387 N VAL A 89 -6.790 1.183 -5.487 1.00 0.00 N ATOM 1388 CA VAL A 89 -7.237 2.361 -6.222 1.00 0.00 C ATOM 1389 C VAL A 89 -7.890 1.966 -7.544 1.00 0.00 C ATOM 1390 O VAL A 89 -7.296 1.241 -8.343 1.00 0.00 O ATOM 1391 CB VAL A 89 -6.073 3.325 -6.515 1.00 0.00 C ATOM 1392 CG1 VAL A 89 -6.585 4.603 -7.167 1.00 0.00 C ATOM 1393 CG2 VAL A 89 -5.307 3.638 -5.241 1.00 0.00 C ATOM 0 H VAL A 89 -5.783 1.024 -5.516 1.00 0.00 H new ATOM 0 HA VAL A 89 -7.966 2.866 -5.588 1.00 0.00 H new ATOM 0 HB VAL A 89 -5.391 2.839 -7.212 1.00 0.00 H new ATOM 0 HG11 VAL A 89 -5.747 5.271 -7.366 1.00 0.00 H new ATOM 0 HG12 VAL A 89 -7.084 4.358 -8.104 1.00 0.00 H new ATOM 0 HG13 VAL A 89 -7.290 5.095 -6.498 1.00 0.00 H new ATOM 0 HG21 VAL A 89 -4.488 4.321 -5.467 1.00 0.00 H new ATOM 0 HG22 VAL A 89 -5.978 4.103 -4.518 1.00 0.00 H new ATOM 0 HG23 VAL A 89 -4.905 2.715 -4.822 1.00 0.00 H new ATOM 1403 N PRO A 90 -9.121 2.443 -7.801 1.00 0.00 N ATOM 1404 CA PRO A 90 -9.836 2.136 -9.041 1.00 0.00 C ATOM 1405 C PRO A 90 -9.243 2.874 -10.234 1.00 0.00 C ATOM 1406 O PRO A 90 -8.560 3.885 -10.073 1.00 0.00 O ATOM 1407 CB PRO A 90 -11.256 2.629 -8.762 1.00 0.00 C ATOM 1408 CG PRO A 90 -11.085 3.718 -7.761 1.00 0.00 C ATOM 1409 CD PRO A 90 -9.907 3.322 -6.912 1.00 0.00 C ATOM 0 HA PRO A 90 -9.783 1.078 -9.297 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -11.734 2.997 -9.670 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -11.885 1.828 -8.373 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -10.908 4.675 -8.252 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -11.982 3.833 -7.153 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -9.331 4.191 -6.595 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -10.221 2.801 -6.008 1.00 0.00 H new ATOM 1417 N PHE A 91 -9.508 2.366 -11.434 1.00 0.00 N ATOM 1418 CA PHE A 91 -8.999 2.987 -12.653 1.00 0.00 C ATOM 1419 C PHE A 91 -9.278 4.487 -12.651 1.00 0.00 C ATOM 1420 O PHE A 91 -8.479 5.282 -13.143 1.00 0.00 O ATOM 1421 CB PHE A 91 -9.642 2.341 -13.884 1.00 0.00 C ATOM 1422 CG PHE A 91 -8.765 2.338 -15.109 1.00 0.00 C ATOM 1423 CD1 PHE A 91 -7.641 3.148 -15.188 1.00 0.00 C ATOM 1424 CD2 PHE A 91 -9.073 1.524 -16.186 1.00 0.00 C ATOM 1425 CE1 PHE A 91 -6.842 3.141 -16.315 1.00 0.00 C ATOM 1426 CE2 PHE A 91 -8.278 1.514 -17.316 1.00 0.00 C ATOM 1427 CZ PHE A 91 -7.161 2.323 -17.381 1.00 0.00 C ATOM 0 H PHE A 91 -10.070 1.529 -11.588 1.00 0.00 H new ATOM 0 HA PHE A 91 -7.921 2.833 -12.690 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -9.912 1.313 -13.642 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -10.568 2.868 -14.115 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -7.388 3.792 -14.358 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -9.946 0.889 -16.142 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -5.969 3.775 -16.362 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -8.530 0.874 -18.148 1.00 0.00 H new ATOM 0 HZ PHE A 91 -6.538 2.316 -18.263 1.00 0.00 H new ATOM 1437 N ALA A 92 -10.423 4.861 -12.092 1.00 0.00 N ATOM 1438 CA ALA A 92 -10.826 6.260 -12.020 1.00 0.00 C ATOM 1439 C ALA A 92 -9.750 7.137 -11.378 1.00 0.00 C ATOM 1440 O ALA A 92 -9.556 8.282 -11.786 1.00 0.00 O ATOM 1441 CB ALA A 92 -12.134 6.389 -11.254 1.00 0.00 C ATOM 0 H ALA A 92 -11.092 4.211 -11.680 1.00 0.00 H new ATOM 0 HA ALA A 92 -10.967 6.613 -13.042 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -12.426 7.438 -11.206 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -12.911 5.819 -11.763 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -12.003 6.002 -10.243 1.00 0.00 H new ATOM 1447 N GLN A 93 -9.058 6.609 -10.368 1.00 0.00 N ATOM 1448 CA GLN A 93 -8.022 7.373 -9.684 1.00 0.00 C ATOM 1449 C GLN A 93 -6.644 6.749 -9.888 1.00 0.00 C ATOM 1450 O GLN A 93 -5.737 6.954 -9.081 1.00 0.00 O ATOM 1451 CB GLN A 93 -8.333 7.462 -8.189 1.00 0.00 C ATOM 1452 CG GLN A 93 -9.821 7.529 -7.876 1.00 0.00 C ATOM 1453 CD GLN A 93 -10.470 8.794 -8.404 1.00 0.00 C ATOM 1454 OE1 GLN A 93 -9.789 9.717 -8.851 1.00 0.00 O ATOM 1455 NE2 GLN A 93 -11.797 8.842 -8.355 1.00 0.00 N ATOM 0 H GLN A 93 -9.196 5.664 -10.010 1.00 0.00 H new ATOM 0 HA GLN A 93 -8.009 8.375 -10.113 1.00 0.00 H new ATOM 0 HB2 GLN A 93 -7.904 6.596 -7.686 1.00 0.00 H new ATOM 0 HB3 GLN A 93 -7.844 8.345 -7.777 1.00 0.00 H new ATOM 0 HG2 GLN A 93 -10.319 6.661 -8.308 1.00 0.00 H new ATOM 0 HG3 GLN A 93 -9.965 7.474 -6.797 1.00 0.00 H new ATOM 0 HE21 GLN A 93 -12.322 8.054 -7.976 1.00 0.00 H new ATOM 0 HE22 GLN A 93 -12.290 9.667 -8.696 1.00 0.00 H new ATOM 1464 N SER A 94 -6.488 5.991 -10.969 1.00 0.00 N ATOM 1465 CA SER A 94 -5.212 5.352 -11.265 1.00 0.00 C ATOM 1466 C SER A 94 -4.145 6.398 -11.562 1.00 0.00 C ATOM 1467 O SER A 94 -2.962 6.187 -11.294 1.00 0.00 O ATOM 1468 CB SER A 94 -5.351 4.394 -12.448 1.00 0.00 C ATOM 1469 OG SER A 94 -5.267 5.087 -13.682 1.00 0.00 O ATOM 0 H SER A 94 -7.224 5.805 -11.650 1.00 0.00 H new ATOM 0 HA SER A 94 -4.907 4.781 -10.388 1.00 0.00 H new ATOM 0 HB2 SER A 94 -4.569 3.636 -12.400 1.00 0.00 H new ATOM 0 HB3 SER A 94 -6.305 3.871 -12.386 1.00 0.00 H new ATOM 0 HG SER A 94 -5.606 4.515 -14.402 1.00 0.00 H new ATOM 1475 N GLU A 95 -4.572 7.534 -12.109 1.00 0.00 N ATOM 1476 CA GLU A 95 -3.651 8.619 -12.433 1.00 0.00 C ATOM 1477 C GLU A 95 -2.869 9.039 -11.194 1.00 0.00 C ATOM 1478 O GLU A 95 -1.698 9.409 -11.278 1.00 0.00 O ATOM 1479 CB GLU A 95 -4.417 9.814 -13.001 1.00 0.00 C ATOM 1480 CG GLU A 95 -3.518 10.876 -13.611 1.00 0.00 C ATOM 1481 CD GLU A 95 -4.126 12.264 -13.539 1.00 0.00 C ATOM 1482 OE1 GLU A 95 -4.624 12.638 -12.457 1.00 0.00 O ATOM 1483 OE2 GLU A 95 -4.102 12.977 -14.565 1.00 0.00 O ATOM 0 H GLU A 95 -5.548 7.726 -12.336 1.00 0.00 H new ATOM 0 HA GLU A 95 -2.948 8.263 -13.186 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -5.115 9.461 -13.760 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -5.012 10.265 -12.207 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -2.559 10.876 -13.094 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -3.319 10.624 -14.653 1.00 0.00 H new ATOM 1490 N ALA A 96 -3.527 8.966 -10.040 1.00 0.00 N ATOM 1491 CA ALA A 96 -2.901 9.323 -8.773 1.00 0.00 C ATOM 1492 C ALA A 96 -1.663 8.480 -8.528 1.00 0.00 C ATOM 1493 O ALA A 96 -0.662 8.958 -8.004 1.00 0.00 O ATOM 1494 CB ALA A 96 -3.875 9.120 -7.627 1.00 0.00 C ATOM 0 H ALA A 96 -4.497 8.662 -9.958 1.00 0.00 H new ATOM 0 HA ALA A 96 -2.614 10.373 -8.826 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -3.393 9.391 -6.688 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -4.752 9.749 -7.779 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -4.180 8.074 -7.590 1.00 0.00 H new ATOM 1500 N VAL A 97 -1.758 7.214 -8.898 1.00 0.00 N ATOM 1501 CA VAL A 97 -0.668 6.272 -8.714 1.00 0.00 C ATOM 1502 C VAL A 97 0.601 6.737 -9.413 1.00 0.00 C ATOM 1503 O VAL A 97 1.712 6.496 -8.942 1.00 0.00 O ATOM 1504 CB VAL A 97 -1.075 4.887 -9.226 1.00 0.00 C ATOM 1505 CG1 VAL A 97 0.097 3.921 -9.168 1.00 0.00 C ATOM 1506 CG2 VAL A 97 -2.252 4.384 -8.411 1.00 0.00 C ATOM 0 H VAL A 97 -2.589 6.812 -9.332 1.00 0.00 H new ATOM 0 HA VAL A 97 -0.457 6.214 -7.646 1.00 0.00 H new ATOM 0 HB VAL A 97 -1.375 4.959 -10.271 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -0.218 2.945 -9.537 1.00 0.00 H new ATOM 0 HG12 VAL A 97 0.910 4.298 -9.788 1.00 0.00 H new ATOM 0 HG13 VAL A 97 0.440 3.826 -8.138 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -2.548 3.398 -8.769 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.966 4.318 -7.361 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -3.089 5.074 -8.516 1.00 0.00 H new ATOM 1516 N GLN A 98 0.419 7.402 -10.537 1.00 0.00 N ATOM 1517 CA GLN A 98 1.540 7.909 -11.321 1.00 0.00 C ATOM 1518 C GLN A 98 2.214 9.093 -10.629 1.00 0.00 C ATOM 1519 O GLN A 98 3.441 9.167 -10.564 1.00 0.00 O ATOM 1520 CB GLN A 98 1.067 8.324 -12.717 1.00 0.00 C ATOM 1521 CG GLN A 98 0.350 7.215 -13.469 1.00 0.00 C ATOM 1522 CD GLN A 98 0.285 7.474 -14.963 1.00 0.00 C ATOM 1523 OE1 GLN A 98 0.845 6.722 -15.760 1.00 0.00 O ATOM 1524 NE2 GLN A 98 -0.403 8.543 -15.348 1.00 0.00 N ATOM 0 H GLN A 98 -0.498 7.607 -10.934 1.00 0.00 H new ATOM 0 HA GLN A 98 2.272 7.106 -11.411 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.399 9.181 -12.626 1.00 0.00 H new ATOM 0 HB3 GLN A 98 1.927 8.651 -13.301 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.861 6.269 -13.289 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -0.662 7.110 -13.077 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -0.851 9.139 -14.652 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -0.483 8.768 -16.340 1.00 0.00 H new ATOM 1533 N LYS A 99 1.407 10.016 -10.112 1.00 0.00 N ATOM 1534 CA LYS A 99 1.937 11.194 -9.425 1.00 0.00 C ATOM 1535 C LYS A 99 2.311 10.860 -7.983 1.00 0.00 C ATOM 1536 O LYS A 99 3.280 11.394 -7.444 1.00 0.00 O ATOM 1537 CB LYS A 99 0.914 12.345 -9.438 1.00 0.00 C ATOM 1538 CG LYS A 99 0.570 12.903 -10.822 1.00 0.00 C ATOM 1539 CD LYS A 99 -0.813 13.537 -10.831 1.00 0.00 C ATOM 1540 CE LYS A 99 -1.728 12.871 -11.846 1.00 0.00 C ATOM 1541 NZ LYS A 99 -1.049 12.667 -13.157 1.00 0.00 N ATOM 0 H LYS A 99 0.389 9.973 -10.154 1.00 0.00 H new ATOM 0 HA LYS A 99 2.833 11.511 -9.960 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -0.005 11.997 -8.967 1.00 0.00 H new ATOM 0 HB3 LYS A 99 1.300 13.158 -8.823 1.00 0.00 H new ATOM 0 HG2 LYS A 99 1.314 13.644 -11.114 1.00 0.00 H new ATOM 0 HG3 LYS A 99 0.611 12.102 -11.560 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -1.255 13.461 -9.837 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -0.725 14.599 -11.061 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -2.063 11.909 -11.457 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -2.618 13.484 -11.990 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -1.705 12.905 -13.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -0.211 13.280 -13.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -0.757 11.673 -13.246 1.00 0.00 H new ATOM 1555 N LEU A 100 1.538 9.974 -7.365 1.00 0.00 N ATOM 1556 CA LEU A 100 1.793 9.571 -5.977 1.00 0.00 C ATOM 1557 C LEU A 100 3.221 9.059 -5.812 1.00 0.00 C ATOM 1558 O LEU A 100 3.919 9.429 -4.868 1.00 0.00 O ATOM 1559 CB LEU A 100 0.811 8.480 -5.540 1.00 0.00 C ATOM 1560 CG LEU A 100 0.722 8.220 -4.039 1.00 0.00 C ATOM 1561 CD1 LEU A 100 0.519 9.524 -3.280 1.00 0.00 C ATOM 1562 CD2 LEU A 100 -0.412 7.242 -3.751 1.00 0.00 C ATOM 0 H LEU A 100 0.733 9.520 -7.796 1.00 0.00 H new ATOM 0 HA LEU A 100 1.655 10.451 -5.349 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -0.182 8.747 -5.902 1.00 0.00 H new ATOM 0 HB3 LEU A 100 1.090 7.549 -6.034 1.00 0.00 H new ATOM 0 HG LEU A 100 1.659 7.779 -3.700 1.00 0.00 H new ATOM 0 HD11 LEU A 100 0.458 9.317 -2.212 1.00 0.00 H new ATOM 0 HD12 LEU A 100 1.359 10.192 -3.473 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -0.405 9.998 -3.611 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.471 7.060 -2.678 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -1.354 7.664 -4.100 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.222 6.302 -4.269 1.00 0.00 H new ATOM 1574 N SER A 101 3.647 8.201 -6.736 1.00 0.00 N ATOM 1575 CA SER A 101 4.989 7.631 -6.693 1.00 0.00 C ATOM 1576 C SER A 101 6.052 8.725 -6.696 1.00 0.00 C ATOM 1577 O SER A 101 6.959 8.725 -5.865 1.00 0.00 O ATOM 1578 CB SER A 101 5.204 6.692 -7.881 1.00 0.00 C ATOM 1579 OG SER A 101 5.114 7.394 -9.109 1.00 0.00 O ATOM 0 H SER A 101 3.081 7.886 -7.524 1.00 0.00 H new ATOM 0 HA SER A 101 5.084 7.065 -5.767 1.00 0.00 H new ATOM 0 HB2 SER A 101 6.182 6.217 -7.801 1.00 0.00 H new ATOM 0 HB3 SER A 101 4.460 5.896 -7.858 1.00 0.00 H new ATOM 0 HG SER A 101 4.244 7.842 -9.167 1.00 0.00 H new ATOM 1585 N LYS A 102 5.933 9.656 -7.636 1.00 0.00 N ATOM 1586 CA LYS A 102 6.885 10.756 -7.747 1.00 0.00 C ATOM 1587 C LYS A 102 6.929 11.570 -6.457 1.00 0.00 C ATOM 1588 O LYS A 102 7.948 12.180 -6.131 1.00 0.00 O ATOM 1589 CB LYS A 102 6.513 11.662 -8.922 1.00 0.00 C ATOM 1590 CG LYS A 102 7.479 12.819 -9.127 1.00 0.00 C ATOM 1591 CD LYS A 102 8.153 12.751 -10.489 1.00 0.00 C ATOM 1592 CE LYS A 102 7.498 13.698 -11.483 1.00 0.00 C ATOM 1593 NZ LYS A 102 8.502 14.365 -12.358 1.00 0.00 N ATOM 0 H LYS A 102 5.187 9.671 -8.332 1.00 0.00 H new ATOM 0 HA LYS A 102 7.874 10.332 -7.922 1.00 0.00 H new ATOM 0 HB2 LYS A 102 6.476 11.065 -9.833 1.00 0.00 H new ATOM 0 HB3 LYS A 102 5.511 12.060 -8.760 1.00 0.00 H new ATOM 0 HG2 LYS A 102 6.942 13.763 -9.033 1.00 0.00 H new ATOM 0 HG3 LYS A 102 8.237 12.804 -8.344 1.00 0.00 H new ATOM 0 HD2 LYS A 102 9.209 13.002 -10.387 1.00 0.00 H new ATOM 0 HD3 LYS A 102 8.104 11.731 -10.870 1.00 0.00 H new ATOM 0 HE2 LYS A 102 6.790 13.144 -12.099 1.00 0.00 H new ATOM 0 HE3 LYS A 102 6.928 14.454 -10.943 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 8.016 15.002 -13.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 9.163 14.914 -11.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 9.029 13.645 -12.893 1.00 0.00 H new ATOM 1607 N HIS A 103 5.817 11.579 -5.731 1.00 0.00 N ATOM 1608 CA HIS A 103 5.726 12.323 -4.479 1.00 0.00 C ATOM 1609 C HIS A 103 6.425 11.583 -3.341 1.00 0.00 C ATOM 1610 O HIS A 103 6.866 12.200 -2.371 1.00 0.00 O ATOM 1611 CB HIS A 103 4.261 12.572 -4.116 1.00 0.00 C ATOM 1612 CG HIS A 103 4.068 13.706 -3.159 1.00 0.00 C ATOM 1613 ND1 HIS A 103 3.322 14.827 -3.460 1.00 0.00 N ATOM 1614 CD2 HIS A 103 4.529 13.891 -1.899 1.00 0.00 C ATOM 1615 CE1 HIS A 103 3.334 15.651 -2.428 1.00 0.00 C ATOM 1616 NE2 HIS A 103 4.058 15.107 -1.468 1.00 0.00 N ATOM 0 H HIS A 103 4.965 11.080 -5.987 1.00 0.00 H new ATOM 0 HA HIS A 103 6.229 13.279 -4.622 1.00 0.00 H new ATOM 0 HB2 HIS A 103 3.699 12.776 -5.027 1.00 0.00 H new ATOM 0 HB3 HIS A 103 3.843 11.664 -3.680 1.00 0.00 H new ATOM 0 HD1 HIS A 103 2.837 14.993 -4.342 1.00 0.00 H new ATOM 0 HD2 HIS A 103 5.151 13.209 -1.338 1.00 0.00 H new ATOM 0 HE1 HIS A 103 2.836 16.608 -2.378 1.00 0.00 H new ATOM 1625 N PHE A 104 6.523 10.261 -3.460 1.00 0.00 N ATOM 1626 CA PHE A 104 7.169 9.453 -2.431 1.00 0.00 C ATOM 1627 C PHE A 104 8.540 8.960 -2.889 1.00 0.00 C ATOM 1628 O PHE A 104 9.102 8.035 -2.305 1.00 0.00 O ATOM 1629 CB PHE A 104 6.283 8.262 -2.062 1.00 0.00 C ATOM 1630 CG PHE A 104 4.918 8.655 -1.566 1.00 0.00 C ATOM 1631 CD1 PHE A 104 4.747 9.786 -0.783 1.00 0.00 C ATOM 1632 CD2 PHE A 104 3.807 7.892 -1.885 1.00 0.00 C ATOM 1633 CE1 PHE A 104 3.494 10.148 -0.327 1.00 0.00 C ATOM 1634 CE2 PHE A 104 2.551 8.249 -1.432 1.00 0.00 C ATOM 1635 CZ PHE A 104 2.394 9.379 -0.652 1.00 0.00 C ATOM 0 H PHE A 104 6.165 9.730 -4.254 1.00 0.00 H new ATOM 0 HA PHE A 104 7.312 10.083 -1.553 1.00 0.00 H new ATOM 0 HB2 PHE A 104 6.171 7.619 -2.935 1.00 0.00 H new ATOM 0 HB3 PHE A 104 6.783 7.672 -1.294 1.00 0.00 H new ATOM 0 HD1 PHE A 104 5.604 10.392 -0.526 1.00 0.00 H new ATOM 0 HD2 PHE A 104 3.923 7.008 -2.495 1.00 0.00 H new ATOM 0 HE1 PHE A 104 3.375 11.031 0.283 1.00 0.00 H new ATOM 0 HE2 PHE A 104 1.693 7.645 -1.687 1.00 0.00 H new ATOM 0 HZ PHE A 104 1.413 9.660 -0.297 1.00 0.00 H new ATOM 1645 N ASN A 105 9.077 9.586 -3.934 1.00 0.00 N ATOM 1646 CA ASN A 105 10.385 9.212 -4.464 1.00 0.00 C ATOM 1647 C ASN A 105 10.487 7.703 -4.676 1.00 0.00 C ATOM 1648 O ASN A 105 11.097 6.995 -3.874 1.00 0.00 O ATOM 1649 CB ASN A 105 11.492 9.682 -3.521 1.00 0.00 C ATOM 1650 CG ASN A 105 12.799 9.939 -4.246 1.00 0.00 C ATOM 1651 OD1 ASN A 105 12.938 9.627 -5.429 1.00 0.00 O ATOM 1652 ND2 ASN A 105 13.766 10.512 -3.538 1.00 0.00 N ATOM 0 H ASN A 105 8.626 10.355 -4.430 1.00 0.00 H new ATOM 0 HA ASN A 105 10.505 9.700 -5.431 1.00 0.00 H new ATOM 0 HB2 ASN A 105 11.173 10.595 -3.018 1.00 0.00 H new ATOM 0 HB3 ASN A 105 11.650 8.930 -2.748 1.00 0.00 H new ATOM 0 HD21 ASN A 105 14.667 10.710 -3.972 1.00 0.00 H new ATOM 0 HD22 ASN A 105 13.607 10.754 -2.560 1.00 0.00 H new ATOM 1659 N VAL A 106 9.891 7.221 -5.761 1.00 0.00 N ATOM 1660 CA VAL A 106 9.924 5.796 -6.078 1.00 0.00 C ATOM 1661 C VAL A 106 10.896 5.516 -7.219 1.00 0.00 C ATOM 1662 O VAL A 106 10.568 5.709 -8.389 1.00 0.00 O ATOM 1663 CB VAL A 106 8.528 5.259 -6.460 1.00 0.00 C ATOM 1664 CG1 VAL A 106 8.566 3.746 -6.621 1.00 0.00 C ATOM 1665 CG2 VAL A 106 7.494 5.665 -5.421 1.00 0.00 C ATOM 0 H VAL A 106 9.381 7.793 -6.434 1.00 0.00 H new ATOM 0 HA VAL A 106 10.259 5.282 -5.177 1.00 0.00 H new ATOM 0 HB VAL A 106 8.239 5.698 -7.415 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.574 3.384 -6.890 1.00 0.00 H new ATOM 0 HG12 VAL A 106 9.274 3.481 -7.406 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.877 3.288 -5.682 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.517 5.277 -5.709 1.00 0.00 H new ATOM 0 HG22 VAL A 106 7.775 5.257 -4.450 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.448 6.752 -5.359 1.00 0.00 H new ATOM 1675 N GLU A 107 12.095 5.061 -6.868 1.00 0.00 N ATOM 1676 CA GLU A 107 13.117 4.755 -7.862 1.00 0.00 C ATOM 1677 C GLU A 107 12.616 3.716 -8.859 1.00 0.00 C ATOM 1678 O GLU A 107 12.709 3.910 -10.071 1.00 0.00 O ATOM 1679 CB GLU A 107 14.388 4.250 -7.177 1.00 0.00 C ATOM 1680 CG GLU A 107 15.526 3.963 -8.144 1.00 0.00 C ATOM 1681 CD GLU A 107 15.855 5.150 -9.027 1.00 0.00 C ATOM 1682 OE1 GLU A 107 16.557 6.067 -8.551 1.00 0.00 O ATOM 1683 OE2 GLU A 107 15.412 5.163 -10.195 1.00 0.00 O ATOM 0 H GLU A 107 12.382 4.896 -5.903 1.00 0.00 H new ATOM 0 HA GLU A 107 13.344 5.672 -8.406 1.00 0.00 H new ATOM 0 HB2 GLU A 107 14.718 4.992 -6.450 1.00 0.00 H new ATOM 0 HB3 GLU A 107 14.155 3.341 -6.622 1.00 0.00 H new ATOM 0 HG2 GLU A 107 16.414 3.678 -7.580 1.00 0.00 H new ATOM 0 HG3 GLU A 107 15.259 3.112 -8.771 1.00 0.00 H new ATOM 1690 N SER A 108 12.086 2.614 -8.341 1.00 0.00 N ATOM 1691 CA SER A 108 11.570 1.546 -9.187 1.00 0.00 C ATOM 1692 C SER A 108 10.719 0.570 -8.380 1.00 0.00 C ATOM 1693 O SER A 108 10.934 0.386 -7.182 1.00 0.00 O ATOM 1694 CB SER A 108 12.722 0.796 -9.860 1.00 0.00 C ATOM 1695 OG SER A 108 13.402 1.628 -10.784 1.00 0.00 O ATOM 0 H SER A 108 12.003 2.437 -7.340 1.00 0.00 H new ATOM 0 HA SER A 108 10.942 2.000 -9.953 1.00 0.00 H new ATOM 0 HB2 SER A 108 13.421 0.441 -9.102 1.00 0.00 H new ATOM 0 HB3 SER A 108 12.336 -0.084 -10.374 1.00 0.00 H new ATOM 0 HG SER A 108 12.906 2.466 -10.896 1.00 0.00 H new ATOM 1701 N ILE A 109 9.755 -0.052 -9.047 1.00 0.00 N ATOM 1702 CA ILE A 109 8.870 -1.012 -8.400 1.00 0.00 C ATOM 1703 C ILE A 109 9.494 -2.406 -8.384 1.00 0.00 C ATOM 1704 O ILE A 109 10.379 -2.703 -9.186 1.00 0.00 O ATOM 1705 CB ILE A 109 7.498 -1.078 -9.103 1.00 0.00 C ATOM 1706 CG1 ILE A 109 7.679 -1.210 -10.624 1.00 0.00 C ATOM 1707 CG2 ILE A 109 6.663 0.144 -8.746 1.00 0.00 C ATOM 1708 CD1 ILE A 109 7.581 0.100 -11.386 1.00 0.00 C ATOM 0 H ILE A 109 9.566 0.092 -10.039 1.00 0.00 H new ATOM 0 HA ILE A 109 8.724 -0.670 -7.375 1.00 0.00 H new ATOM 0 HB ILE A 109 6.964 -1.962 -8.755 1.00 0.00 H new ATOM 0 HG12 ILE A 109 8.651 -1.660 -10.824 1.00 0.00 H new ATOM 0 HG13 ILE A 109 6.925 -1.897 -11.009 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.698 0.085 -9.249 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.509 0.177 -7.667 1.00 0.00 H new ATOM 0 HG23 ILE A 109 7.184 1.047 -9.066 1.00 0.00 H new ATOM 0 HD11 ILE A 109 7.721 -0.087 -12.451 1.00 0.00 H new ATOM 0 HD12 ILE A 109 6.599 0.544 -11.221 1.00 0.00 H new ATOM 0 HD13 ILE A 109 8.353 0.785 -11.034 1.00 0.00 H new ATOM 1720 N PRO A 110 9.044 -3.285 -7.468 1.00 0.00 N ATOM 1721 CA PRO A 110 7.994 -2.973 -6.497 1.00 0.00 C ATOM 1722 C PRO A 110 8.529 -2.286 -5.246 1.00 0.00 C ATOM 1723 O PRO A 110 9.705 -2.420 -4.904 1.00 0.00 O ATOM 1724 CB PRO A 110 7.447 -4.353 -6.147 1.00 0.00 C ATOM 1725 CG PRO A 110 8.625 -5.262 -6.263 1.00 0.00 C ATOM 1726 CD PRO A 110 9.531 -4.668 -7.316 1.00 0.00 C ATOM 0 HA PRO A 110 7.256 -2.279 -6.899 1.00 0.00 H new ATOM 0 HB2 PRO A 110 7.029 -4.371 -5.140 1.00 0.00 H new ATOM 0 HB3 PRO A 110 6.649 -4.648 -6.828 1.00 0.00 H new ATOM 0 HG2 PRO A 110 9.144 -5.346 -5.308 1.00 0.00 H new ATOM 0 HG3 PRO A 110 8.312 -6.267 -6.545 1.00 0.00 H new ATOM 0 HD2 PRO A 110 10.575 -4.691 -7.003 1.00 0.00 H new ATOM 0 HD3 PRO A 110 9.467 -5.219 -8.254 1.00 0.00 H new ATOM 1734 N THR A 111 7.654 -1.556 -4.561 1.00 0.00 N ATOM 1735 CA THR A 111 8.029 -0.854 -3.340 1.00 0.00 C ATOM 1736 C THR A 111 6.902 -0.925 -2.312 1.00 0.00 C ATOM 1737 O THR A 111 5.843 -1.495 -2.577 1.00 0.00 O ATOM 1738 CB THR A 111 8.385 0.606 -3.647 1.00 0.00 C ATOM 1739 OG1 THR A 111 9.160 1.162 -2.600 1.00 0.00 O ATOM 1740 CG2 THR A 111 7.178 1.500 -3.847 1.00 0.00 C ATOM 0 H THR A 111 6.678 -1.436 -4.832 1.00 0.00 H new ATOM 0 HA THR A 111 8.908 -1.342 -2.920 1.00 0.00 H new ATOM 0 HB THR A 111 8.943 0.570 -4.583 1.00 0.00 H new ATOM 0 HG1 THR A 111 9.379 2.093 -2.814 1.00 0.00 H new ATOM 0 HG21 THR A 111 7.509 2.516 -4.060 1.00 0.00 H new ATOM 0 HG22 THR A 111 6.585 1.129 -4.683 1.00 0.00 H new ATOM 0 HG23 THR A 111 6.570 1.499 -2.942 1.00 0.00 H new ATOM 1748 N LEU A 112 7.131 -0.332 -1.147 1.00 0.00 N ATOM 1749 CA LEU A 112 6.120 -0.319 -0.084 1.00 0.00 C ATOM 1750 C LEU A 112 6.217 0.978 0.716 1.00 0.00 C ATOM 1751 O LEU A 112 7.273 1.300 1.260 1.00 0.00 O ATOM 1752 CB LEU A 112 6.275 -1.535 0.856 1.00 0.00 C ATOM 1753 CG LEU A 112 4.980 -2.085 1.468 1.00 0.00 C ATOM 1754 CD1 LEU A 112 4.072 -0.973 1.954 1.00 0.00 C ATOM 1755 CD2 LEU A 112 4.239 -2.949 0.474 1.00 0.00 C ATOM 0 H LEU A 112 8.001 0.145 -0.910 1.00 0.00 H new ATOM 0 HA LEU A 112 5.138 -0.380 -0.553 1.00 0.00 H new ATOM 0 HB2 LEU A 112 6.760 -2.338 0.301 1.00 0.00 H new ATOM 0 HB3 LEU A 112 6.947 -1.257 1.668 1.00 0.00 H new ATOM 0 HG LEU A 112 5.266 -2.692 2.327 1.00 0.00 H new ATOM 0 HD11 LEU A 112 3.166 -1.403 2.380 1.00 0.00 H new ATOM 0 HD12 LEU A 112 4.589 -0.388 2.715 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.808 -0.327 1.117 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.325 -3.327 0.931 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.987 -2.357 -0.406 1.00 0.00 H new ATOM 0 HD23 LEU A 112 4.870 -3.787 0.179 1.00 0.00 H new ATOM 1767 N ILE A 113 5.120 1.725 0.779 1.00 0.00 N ATOM 1768 CA ILE A 113 5.104 2.990 1.509 1.00 0.00 C ATOM 1769 C ILE A 113 4.017 3.006 2.579 1.00 0.00 C ATOM 1770 O ILE A 113 2.869 2.654 2.318 1.00 0.00 O ATOM 1771 CB ILE A 113 4.891 4.181 0.554 1.00 0.00 C ATOM 1772 CG1 ILE A 113 5.925 4.149 -0.573 1.00 0.00 C ATOM 1773 CG2 ILE A 113 4.968 5.498 1.315 1.00 0.00 C ATOM 1774 CD1 ILE A 113 5.772 5.278 -1.569 1.00 0.00 C ATOM 0 H ILE A 113 4.234 1.479 0.337 1.00 0.00 H new ATOM 0 HA ILE A 113 6.076 3.086 1.993 1.00 0.00 H new ATOM 0 HB ILE A 113 3.897 4.099 0.114 1.00 0.00 H new ATOM 0 HG12 ILE A 113 6.924 4.191 -0.139 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.846 3.198 -1.100 1.00 0.00 H new ATOM 0 HG21 ILE A 113 4.815 6.327 0.624 1.00 0.00 H new ATOM 0 HG22 ILE A 113 4.196 5.520 2.084 1.00 0.00 H new ATOM 0 HG23 ILE A 113 5.948 5.591 1.783 1.00 0.00 H new ATOM 0 HD11 ILE A 113 6.539 5.191 -2.339 1.00 0.00 H new ATOM 0 HD12 ILE A 113 4.786 5.225 -2.031 1.00 0.00 H new ATOM 0 HD13 ILE A 113 5.881 6.233 -1.056 1.00 0.00 H new ATOM 1786 N GLY A 114 4.388 3.425 3.785 1.00 0.00 N ATOM 1787 CA GLY A 114 3.433 3.489 4.878 1.00 0.00 C ATOM 1788 C GLY A 114 3.097 4.916 5.264 1.00 0.00 C ATOM 1789 O GLY A 114 3.994 5.732 5.482 1.00 0.00 O ATOM 0 H GLY A 114 5.334 3.722 4.026 1.00 0.00 H new ATOM 0 HA2 GLY A 114 2.520 2.968 4.591 1.00 0.00 H new ATOM 0 HA3 GLY A 114 3.839 2.967 5.744 1.00 0.00 H new ATOM 1793 N VAL A 115 1.806 5.221 5.348 1.00 0.00 N ATOM 1794 CA VAL A 115 1.361 6.555 5.708 1.00 0.00 C ATOM 1795 C VAL A 115 0.269 6.499 6.767 1.00 0.00 C ATOM 1796 O VAL A 115 -0.451 5.508 6.888 1.00 0.00 O ATOM 1797 CB VAL A 115 0.839 7.328 4.478 1.00 0.00 C ATOM 1798 CG1 VAL A 115 1.844 7.260 3.338 1.00 0.00 C ATOM 1799 CG2 VAL A 115 -0.516 6.793 4.032 1.00 0.00 C ATOM 0 H VAL A 115 1.051 4.558 5.171 1.00 0.00 H new ATOM 0 HA VAL A 115 2.226 7.081 6.111 1.00 0.00 H new ATOM 0 HB VAL A 115 0.712 8.372 4.764 1.00 0.00 H new ATOM 0 HG11 VAL A 115 1.459 7.810 2.480 1.00 0.00 H new ATOM 0 HG12 VAL A 115 2.788 7.701 3.658 1.00 0.00 H new ATOM 0 HG13 VAL A 115 2.007 6.219 3.058 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -0.861 7.355 3.164 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -0.422 5.739 3.769 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -1.235 6.902 4.844 1.00 0.00 H new ATOM 1809 N ASP A 116 0.152 7.577 7.522 1.00 0.00 N ATOM 1810 CA ASP A 116 -0.854 7.677 8.571 1.00 0.00 C ATOM 1811 C ASP A 116 -1.980 8.610 8.143 1.00 0.00 C ATOM 1812 O ASP A 116 -1.769 9.807 7.952 1.00 0.00 O ATOM 1813 CB ASP A 116 -0.223 8.180 9.869 1.00 0.00 C ATOM 1814 CG ASP A 116 0.333 7.052 10.716 1.00 0.00 C ATOM 1815 OD1 ASP A 116 -0.470 6.258 11.248 1.00 0.00 O ATOM 1816 OD2 ASP A 116 1.572 6.963 10.848 1.00 0.00 O ATOM 0 H ASP A 116 0.744 8.402 7.429 1.00 0.00 H new ATOM 0 HA ASP A 116 -1.269 6.684 8.744 1.00 0.00 H new ATOM 0 HB2 ASP A 116 0.577 8.882 9.633 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -0.969 8.729 10.444 1.00 0.00 H new ATOM 1821 N ALA A 117 -3.176 8.054 7.989 1.00 0.00 N ATOM 1822 CA ALA A 117 -4.335 8.835 7.575 1.00 0.00 C ATOM 1823 C ALA A 117 -4.609 9.980 8.546 1.00 0.00 C ATOM 1824 O ALA A 117 -4.947 11.089 8.132 1.00 0.00 O ATOM 1825 CB ALA A 117 -5.559 7.937 7.455 1.00 0.00 C ATOM 0 H ALA A 117 -3.368 7.064 8.145 1.00 0.00 H new ATOM 0 HA ALA A 117 -4.117 9.270 6.600 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -6.418 8.532 7.145 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -5.369 7.160 6.714 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -5.767 7.475 8.420 1.00 0.00 H new ATOM 1831 N ASP A 118 -4.463 9.705 9.837 1.00 0.00 N ATOM 1832 CA ASP A 118 -4.698 10.712 10.865 1.00 0.00 C ATOM 1833 C ASP A 118 -3.518 11.674 10.972 1.00 0.00 C ATOM 1834 O ASP A 118 -3.701 12.873 11.182 1.00 0.00 O ATOM 1835 CB ASP A 118 -4.952 10.040 12.217 1.00 0.00 C ATOM 1836 CG ASP A 118 -6.426 9.967 12.557 1.00 0.00 C ATOM 1837 OD1 ASP A 118 -7.252 9.941 11.620 1.00 0.00 O ATOM 1838 OD2 ASP A 118 -6.757 9.935 13.761 1.00 0.00 O ATOM 0 H ASP A 118 -4.183 8.793 10.197 1.00 0.00 H new ATOM 0 HA ASP A 118 -5.580 11.285 10.580 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -4.535 9.033 12.203 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -4.429 10.592 12.998 1.00 0.00 H new ATOM 1843 N SER A 119 -2.309 11.141 10.832 1.00 0.00 N ATOM 1844 CA SER A 119 -1.101 11.954 10.917 1.00 0.00 C ATOM 1845 C SER A 119 -1.110 13.058 9.863 1.00 0.00 C ATOM 1846 O SER A 119 -0.775 14.206 10.151 1.00 0.00 O ATOM 1847 CB SER A 119 0.141 11.079 10.744 1.00 0.00 C ATOM 1848 OG SER A 119 1.310 11.763 11.164 1.00 0.00 O ATOM 0 H SER A 119 -2.139 10.150 10.659 1.00 0.00 H new ATOM 0 HA SER A 119 -1.076 12.419 11.903 1.00 0.00 H new ATOM 0 HB2 SER A 119 0.026 10.161 11.321 1.00 0.00 H new ATOM 0 HB3 SER A 119 0.242 10.788 9.698 1.00 0.00 H new ATOM 0 HG SER A 119 2.090 11.182 11.045 1.00 0.00 H new ATOM 1854 N GLY A 120 -1.496 12.701 8.643 1.00 0.00 N ATOM 1855 CA GLY A 120 -1.543 13.674 7.567 1.00 0.00 C ATOM 1856 C GLY A 120 -0.459 13.448 6.530 1.00 0.00 C ATOM 1857 O GLY A 120 -0.745 13.336 5.338 1.00 0.00 O ATOM 0 H GLY A 120 -1.777 11.756 8.380 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -2.519 13.629 7.083 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -1.440 14.676 7.983 1.00 0.00 H new ATOM 1861 N ASP A 121 0.788 13.384 6.984 1.00 0.00 N ATOM 1862 CA ASP A 121 1.917 13.171 6.085 1.00 0.00 C ATOM 1863 C ASP A 121 2.445 11.745 6.201 1.00 0.00 C ATOM 1864 O ASP A 121 2.106 11.020 7.136 1.00 0.00 O ATOM 1865 CB ASP A 121 3.036 14.169 6.393 1.00 0.00 C ATOM 1866 CG ASP A 121 3.741 14.651 5.140 1.00 0.00 C ATOM 1867 OD1 ASP A 121 4.642 13.935 4.654 1.00 0.00 O ATOM 1868 OD2 ASP A 121 3.393 15.744 4.646 1.00 0.00 O ATOM 0 H ASP A 121 1.043 13.476 7.967 1.00 0.00 H new ATOM 0 HA ASP A 121 1.570 13.328 5.064 1.00 0.00 H new ATOM 0 HB2 ASP A 121 2.620 15.025 6.925 1.00 0.00 H new ATOM 0 HB3 ASP A 121 3.762 13.703 7.059 1.00 0.00 H new ATOM 1873 N VAL A 122 3.278 11.349 5.243 1.00 0.00 N ATOM 1874 CA VAL A 122 3.853 10.011 5.235 1.00 0.00 C ATOM 1875 C VAL A 122 4.804 9.812 6.410 1.00 0.00 C ATOM 1876 O VAL A 122 5.547 10.721 6.782 1.00 0.00 O ATOM 1877 CB VAL A 122 4.613 9.736 3.923 1.00 0.00 C ATOM 1878 CG1 VAL A 122 5.057 8.284 3.858 1.00 0.00 C ATOM 1879 CG2 VAL A 122 3.750 10.094 2.721 1.00 0.00 C ATOM 0 H VAL A 122 3.569 11.937 4.462 1.00 0.00 H new ATOM 0 HA VAL A 122 3.023 9.310 5.322 1.00 0.00 H new ATOM 0 HB VAL A 122 5.503 10.364 3.901 1.00 0.00 H new ATOM 0 HG11 VAL A 122 5.592 8.109 2.925 1.00 0.00 H new ATOM 0 HG12 VAL A 122 5.715 8.067 4.700 1.00 0.00 H new ATOM 0 HG13 VAL A 122 4.183 7.634 3.903 1.00 0.00 H new ATOM 0 HG21 VAL A 122 4.303 9.893 1.803 1.00 0.00 H new ATOM 0 HG22 VAL A 122 2.840 9.494 2.735 1.00 0.00 H new ATOM 0 HG23 VAL A 122 3.488 11.151 2.763 1.00 0.00 H new ATOM 1889 N VAL A 123 4.777 8.616 6.989 1.00 0.00 N ATOM 1890 CA VAL A 123 5.636 8.295 8.119 1.00 0.00 C ATOM 1891 C VAL A 123 6.808 7.422 7.686 1.00 0.00 C ATOM 1892 O VAL A 123 7.914 7.546 8.209 1.00 0.00 O ATOM 1893 CB VAL A 123 4.855 7.572 9.233 1.00 0.00 C ATOM 1894 CG1 VAL A 123 5.721 7.401 10.470 1.00 0.00 C ATOM 1895 CG2 VAL A 123 3.579 8.330 9.566 1.00 0.00 C ATOM 0 H VAL A 123 4.168 7.853 6.692 1.00 0.00 H new ATOM 0 HA VAL A 123 6.014 9.241 8.508 1.00 0.00 H new ATOM 0 HB VAL A 123 4.579 6.581 8.874 1.00 0.00 H new ATOM 0 HG11 VAL A 123 5.151 6.888 11.245 1.00 0.00 H new ATOM 0 HG12 VAL A 123 6.603 6.812 10.218 1.00 0.00 H new ATOM 0 HG13 VAL A 123 6.031 8.380 10.835 1.00 0.00 H new ATOM 0 HG21 VAL A 123 3.040 7.806 10.355 1.00 0.00 H new ATOM 0 HG22 VAL A 123 3.831 9.335 9.905 1.00 0.00 H new ATOM 0 HG23 VAL A 123 2.951 8.393 8.677 1.00 0.00 H new ATOM 1905 N THR A 124 6.558 6.539 6.725 1.00 0.00 N ATOM 1906 CA THR A 124 7.594 5.645 6.220 1.00 0.00 C ATOM 1907 C THR A 124 7.397 5.371 4.729 1.00 0.00 C ATOM 1908 O THR A 124 6.265 5.303 4.248 1.00 0.00 O ATOM 1909 CB THR A 124 7.594 4.328 7.007 1.00 0.00 C ATOM 1910 OG1 THR A 124 8.192 3.288 6.252 1.00 0.00 O ATOM 1911 CG2 THR A 124 6.210 3.863 7.414 1.00 0.00 C ATOM 0 H THR A 124 5.647 6.423 6.280 1.00 0.00 H new ATOM 0 HA THR A 124 8.559 6.134 6.354 1.00 0.00 H new ATOM 0 HB THR A 124 8.165 4.540 7.911 1.00 0.00 H new ATOM 0 HG1 THR A 124 8.822 2.794 6.817 1.00 0.00 H new ATOM 0 HG21 THR A 124 6.289 2.927 7.966 1.00 0.00 H new ATOM 0 HG22 THR A 124 5.743 4.619 8.046 1.00 0.00 H new ATOM 0 HG23 THR A 124 5.601 3.709 6.523 1.00 0.00 H new ATOM 1919 N THR A 125 8.502 5.217 4.002 1.00 0.00 N ATOM 1920 CA THR A 125 8.445 4.954 2.569 1.00 0.00 C ATOM 1921 C THR A 125 9.519 3.949 2.159 1.00 0.00 C ATOM 1922 O THR A 125 10.312 4.204 1.252 1.00 0.00 O ATOM 1923 CB THR A 125 8.618 6.255 1.783 1.00 0.00 C ATOM 1924 OG1 THR A 125 9.814 6.914 2.159 1.00 0.00 O ATOM 1925 CG2 THR A 125 7.477 7.230 1.978 1.00 0.00 C ATOM 0 H THR A 125 9.447 5.270 4.383 1.00 0.00 H new ATOM 0 HA THR A 125 7.468 4.528 2.340 1.00 0.00 H new ATOM 0 HB THR A 125 8.644 5.956 0.735 1.00 0.00 H new ATOM 0 HG1 THR A 125 9.907 7.743 1.644 1.00 0.00 H new ATOM 0 HG21 THR A 125 7.664 8.130 1.393 1.00 0.00 H new ATOM 0 HG22 THR A 125 6.545 6.770 1.649 1.00 0.00 H new ATOM 0 HG23 THR A 125 7.399 7.493 3.033 1.00 0.00 H new ATOM 1933 N ARG A 126 9.536 2.806 2.835 1.00 0.00 N ATOM 1934 CA ARG A 126 10.510 1.758 2.547 1.00 0.00 C ATOM 1935 C ARG A 126 10.226 0.518 3.387 1.00 0.00 C ATOM 1936 O ARG A 126 11.137 -0.083 3.957 1.00 0.00 O ATOM 1937 CB ARG A 126 11.934 2.259 2.811 1.00 0.00 C ATOM 1938 CG ARG A 126 12.051 3.193 4.006 1.00 0.00 C ATOM 1939 CD ARG A 126 12.098 2.424 5.316 1.00 0.00 C ATOM 1940 NE ARG A 126 13.388 1.769 5.521 1.00 0.00 N ATOM 1941 CZ ARG A 126 14.474 2.397 5.968 1.00 0.00 C ATOM 1942 NH1 ARG A 126 14.431 3.692 6.254 1.00 0.00 N ATOM 1943 NH2 ARG A 126 15.608 1.726 6.127 1.00 0.00 N ATOM 0 H ARG A 126 8.886 2.581 3.588 1.00 0.00 H new ATOM 0 HA ARG A 126 10.424 1.493 1.493 1.00 0.00 H new ATOM 0 HB2 ARG A 126 12.587 1.400 2.969 1.00 0.00 H new ATOM 0 HB3 ARG A 126 12.297 2.776 1.922 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.951 3.800 3.907 1.00 0.00 H new ATOM 0 HG3 ARG A 126 11.204 3.879 4.016 1.00 0.00 H new ATOM 0 HD2 ARG A 126 11.902 3.106 6.144 1.00 0.00 H new ATOM 0 HD3 ARG A 126 11.306 1.675 5.325 1.00 0.00 H new ATOM 0 HE ARG A 126 13.461 0.774 5.310 1.00 0.00 H new ATOM 0 HH11 ARG A 126 13.562 4.213 6.132 1.00 0.00 H new ATOM 0 HH12 ARG A 126 15.266 4.167 6.596 1.00 0.00 H new ATOM 0 HH21 ARG A 126 15.647 0.731 5.907 1.00 0.00 H new ATOM 0 HH22 ARG A 126 16.441 2.206 6.469 1.00 0.00 H new ATOM 1957 N ALA A 127 8.954 0.144 3.463 1.00 0.00 N ATOM 1958 CA ALA A 127 8.542 -1.019 4.238 1.00 0.00 C ATOM 1959 C ALA A 127 8.436 -2.266 3.366 1.00 0.00 C ATOM 1960 O ALA A 127 7.647 -3.166 3.652 1.00 0.00 O ATOM 1961 CB ALA A 127 7.214 -0.745 4.927 1.00 0.00 C ATOM 0 H ALA A 127 8.189 0.631 2.996 1.00 0.00 H new ATOM 0 HA ALA A 127 9.307 -1.205 4.992 1.00 0.00 H new ATOM 0 HB1 ALA A 127 6.916 -1.621 5.503 1.00 0.00 H new ATOM 0 HB2 ALA A 127 7.320 0.110 5.595 1.00 0.00 H new ATOM 0 HB3 ALA A 127 6.453 -0.528 4.177 1.00 0.00 H new ATOM 1967 N ARG A 128 9.233 -2.317 2.306 1.00 0.00 N ATOM 1968 CA ARG A 128 9.222 -3.460 1.402 1.00 0.00 C ATOM 1969 C ARG A 128 9.924 -4.661 2.031 1.00 0.00 C ATOM 1970 O ARG A 128 9.356 -5.749 2.122 1.00 0.00 O ATOM 1971 CB ARG A 128 9.899 -3.095 0.079 1.00 0.00 C ATOM 1972 CG ARG A 128 9.921 -4.232 -0.930 1.00 0.00 C ATOM 1973 CD ARG A 128 11.247 -4.293 -1.672 1.00 0.00 C ATOM 1974 NE ARG A 128 11.177 -5.152 -2.851 1.00 0.00 N ATOM 1975 CZ ARG A 128 12.101 -5.171 -3.810 1.00 0.00 C ATOM 1976 NH1 ARG A 128 13.164 -4.381 -3.732 1.00 0.00 N ATOM 1977 NH2 ARG A 128 11.961 -5.984 -4.848 1.00 0.00 N ATOM 0 H ARG A 128 9.893 -1.582 2.052 1.00 0.00 H new ATOM 0 HA ARG A 128 8.183 -3.730 1.210 1.00 0.00 H new ATOM 0 HB2 ARG A 128 9.382 -2.241 -0.360 1.00 0.00 H new ATOM 0 HB3 ARG A 128 10.923 -2.779 0.280 1.00 0.00 H new ATOM 0 HG2 ARG A 128 9.746 -5.178 -0.418 1.00 0.00 H new ATOM 0 HG3 ARG A 128 9.109 -4.101 -1.645 1.00 0.00 H new ATOM 0 HD2 ARG A 128 11.540 -3.287 -1.973 1.00 0.00 H new ATOM 0 HD3 ARG A 128 12.021 -4.663 -1.000 1.00 0.00 H new ATOM 0 HE ARG A 128 10.374 -5.774 -2.945 1.00 0.00 H new ATOM 0 HH11 ARG A 128 13.277 -3.755 -2.935 1.00 0.00 H new ATOM 0 HH12 ARG A 128 13.869 -4.400 -4.469 1.00 0.00 H new ATOM 0 HH21 ARG A 128 11.146 -6.594 -4.912 1.00 0.00 H new ATOM 0 HH22 ARG A 128 12.668 -5.999 -5.583 1.00 0.00 H new ATOM 1991 N ALA A 129 11.167 -4.456 2.453 1.00 0.00 N ATOM 1992 CA ALA A 129 11.961 -5.516 3.063 1.00 0.00 C ATOM 1993 C ALA A 129 11.673 -5.662 4.554 1.00 0.00 C ATOM 1994 O ALA A 129 11.702 -6.765 5.096 1.00 0.00 O ATOM 1995 CB ALA A 129 13.439 -5.233 2.851 1.00 0.00 C ATOM 0 H ALA A 129 11.649 -3.560 2.383 1.00 0.00 H new ATOM 0 HA ALA A 129 11.686 -6.454 2.581 1.00 0.00 H new ATOM 0 HB1 ALA A 129 14.031 -6.026 3.308 1.00 0.00 H new ATOM 0 HB2 ALA A 129 13.652 -5.191 1.783 1.00 0.00 H new ATOM 0 HB3 ALA A 129 13.696 -4.279 3.310 1.00 0.00 H new ATOM 2001 N THR A 130 11.433 -4.541 5.217 1.00 0.00 N ATOM 2002 CA THR A 130 11.179 -4.524 6.637 1.00 0.00 C ATOM 2003 C THR A 130 9.838 -5.139 6.999 1.00 0.00 C ATOM 2004 O THR A 130 9.751 -5.935 7.933 1.00 0.00 O ATOM 2005 CB THR A 130 11.267 -3.090 7.136 1.00 0.00 C ATOM 2006 OG1 THR A 130 10.225 -2.302 6.592 1.00 0.00 O ATOM 2007 CG2 THR A 130 12.583 -2.418 6.796 1.00 0.00 C ATOM 0 H THR A 130 11.410 -3.620 4.779 1.00 0.00 H new ATOM 0 HA THR A 130 11.936 -5.138 7.125 1.00 0.00 H new ATOM 0 HB THR A 130 11.182 -3.156 8.221 1.00 0.00 H new ATOM 0 HG1 THR A 130 10.300 -1.384 6.927 1.00 0.00 H new ATOM 0 HG21 THR A 130 12.581 -1.398 7.180 1.00 0.00 H new ATOM 0 HG22 THR A 130 13.403 -2.974 7.249 1.00 0.00 H new ATOM 0 HG23 THR A 130 12.712 -2.398 5.714 1.00 0.00 H new ATOM 2015 N LEU A 131 8.794 -4.784 6.271 1.00 0.00 N ATOM 2016 CA LEU A 131 7.474 -5.326 6.552 1.00 0.00 C ATOM 2017 C LEU A 131 7.523 -6.851 6.602 1.00 0.00 C ATOM 2018 O LEU A 131 6.831 -7.480 7.403 1.00 0.00 O ATOM 2019 CB LEU A 131 6.474 -4.871 5.486 1.00 0.00 C ATOM 2020 CG LEU A 131 5.108 -5.561 5.535 1.00 0.00 C ATOM 2021 CD1 LEU A 131 4.003 -4.591 5.148 1.00 0.00 C ATOM 2022 CD2 LEU A 131 5.093 -6.776 4.619 1.00 0.00 C ATOM 0 H LEU A 131 8.832 -4.130 5.489 1.00 0.00 H new ATOM 0 HA LEU A 131 7.149 -4.953 7.523 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.324 -3.796 5.587 1.00 0.00 H new ATOM 0 HB3 LEU A 131 6.913 -5.040 4.503 1.00 0.00 H new ATOM 0 HG LEU A 131 4.929 -5.895 6.557 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.040 -5.101 5.189 1.00 0.00 H new ATOM 0 HD12 LEU A 131 3.998 -3.750 5.841 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.177 -4.226 4.136 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.115 -7.255 4.666 1.00 0.00 H new ATOM 0 HD22 LEU A 131 5.295 -6.462 3.595 1.00 0.00 H new ATOM 0 HD23 LEU A 131 5.859 -7.483 4.939 1.00 0.00 H new ATOM 2034 N VAL A 132 8.344 -7.436 5.738 1.00 0.00 N ATOM 2035 CA VAL A 132 8.483 -8.885 5.678 1.00 0.00 C ATOM 2036 C VAL A 132 9.564 -9.403 6.627 1.00 0.00 C ATOM 2037 O VAL A 132 9.337 -10.347 7.383 1.00 0.00 O ATOM 2038 CB VAL A 132 8.768 -9.364 4.235 1.00 0.00 C ATOM 2039 CG1 VAL A 132 9.751 -8.450 3.519 1.00 0.00 C ATOM 2040 CG2 VAL A 132 9.270 -10.800 4.228 1.00 0.00 C ATOM 0 H VAL A 132 8.923 -6.929 5.069 1.00 0.00 H new ATOM 0 HA VAL A 132 7.529 -9.300 6.003 1.00 0.00 H new ATOM 0 HB VAL A 132 7.825 -9.324 3.690 1.00 0.00 H new ATOM 0 HG11 VAL A 132 9.924 -8.822 2.509 1.00 0.00 H new ATOM 0 HG12 VAL A 132 9.340 -7.442 3.469 1.00 0.00 H new ATOM 0 HG13 VAL A 132 10.694 -8.431 4.065 1.00 0.00 H new ATOM 0 HG21 VAL A 132 9.463 -11.113 3.202 1.00 0.00 H new ATOM 0 HG22 VAL A 132 10.191 -10.866 4.807 1.00 0.00 H new ATOM 0 HG23 VAL A 132 8.516 -11.451 4.670 1.00 0.00 H new ATOM 2050 N LYS A 133 10.743 -8.795 6.565 1.00 0.00 N ATOM 2051 CA LYS A 133 11.869 -9.210 7.402 1.00 0.00 C ATOM 2052 C LYS A 133 11.768 -8.681 8.837 1.00 0.00 C ATOM 2053 O LYS A 133 12.751 -8.698 9.576 1.00 0.00 O ATOM 2054 CB LYS A 133 13.190 -8.760 6.771 1.00 0.00 C ATOM 2055 CG LYS A 133 13.711 -9.719 5.713 1.00 0.00 C ATOM 2056 CD LYS A 133 14.446 -10.892 6.340 1.00 0.00 C ATOM 2057 CE LYS A 133 14.719 -11.986 5.319 1.00 0.00 C ATOM 2058 NZ LYS A 133 15.849 -12.863 5.734 1.00 0.00 N ATOM 0 H LYS A 133 10.947 -8.012 5.944 1.00 0.00 H new ATOM 0 HA LYS A 133 11.837 -10.298 7.458 1.00 0.00 H new ATOM 0 HB2 LYS A 133 13.053 -7.776 6.323 1.00 0.00 H new ATOM 0 HB3 LYS A 133 13.940 -8.652 7.554 1.00 0.00 H new ATOM 0 HG2 LYS A 133 12.879 -10.088 5.113 1.00 0.00 H new ATOM 0 HG3 LYS A 133 14.381 -9.188 5.037 1.00 0.00 H new ATOM 0 HD2 LYS A 133 15.388 -10.547 6.766 1.00 0.00 H new ATOM 0 HD3 LYS A 133 13.854 -11.298 7.161 1.00 0.00 H new ATOM 0 HE2 LYS A 133 13.821 -12.590 5.185 1.00 0.00 H new ATOM 0 HE3 LYS A 133 14.946 -11.533 4.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 16.003 -13.595 5.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 16.712 -12.292 5.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 15.622 -13.315 6.643 1.00 0.00 H new ATOM 2072 N ASP A 134 10.582 -8.225 9.238 1.00 0.00 N ATOM 2073 CA ASP A 134 10.378 -7.718 10.594 1.00 0.00 C ATOM 2074 C ASP A 134 9.412 -8.617 11.361 1.00 0.00 C ATOM 2075 O ASP A 134 8.225 -8.315 11.472 1.00 0.00 O ATOM 2076 CB ASP A 134 9.843 -6.285 10.561 1.00 0.00 C ATOM 2077 CG ASP A 134 9.681 -5.695 11.948 1.00 0.00 C ATOM 2078 OD1 ASP A 134 10.682 -5.191 12.500 1.00 0.00 O ATOM 2079 OD2 ASP A 134 8.553 -5.737 12.483 1.00 0.00 O ATOM 0 H ASP A 134 9.752 -8.196 8.646 1.00 0.00 H new ATOM 0 HA ASP A 134 11.341 -7.719 11.104 1.00 0.00 H new ATOM 0 HB2 ASP A 134 10.522 -5.660 9.981 1.00 0.00 H new ATOM 0 HB3 ASP A 134 8.881 -6.271 10.049 1.00 0.00 H new ATOM 2084 N PRO A 135 9.910 -9.749 11.890 1.00 0.00 N ATOM 2085 CA PRO A 135 9.092 -10.705 12.633 1.00 0.00 C ATOM 2086 C PRO A 135 8.955 -10.362 14.116 1.00 0.00 C ATOM 2087 O PRO A 135 8.545 -11.204 14.915 1.00 0.00 O ATOM 2088 CB PRO A 135 9.871 -12.004 12.461 1.00 0.00 C ATOM 2089 CG PRO A 135 11.298 -11.576 12.405 1.00 0.00 C ATOM 2090 CD PRO A 135 11.313 -10.198 11.788 1.00 0.00 C ATOM 0 HA PRO A 135 8.065 -10.733 12.268 1.00 0.00 H new ATOM 0 HB2 PRO A 135 9.693 -12.687 13.292 1.00 0.00 H new ATOM 0 HB3 PRO A 135 9.577 -12.526 11.551 1.00 0.00 H new ATOM 0 HG2 PRO A 135 11.736 -11.558 13.403 1.00 0.00 H new ATOM 0 HG3 PRO A 135 11.888 -12.273 11.810 1.00 0.00 H new ATOM 0 HD2 PRO A 135 11.987 -9.528 12.322 1.00 0.00 H new ATOM 0 HD3 PRO A 135 11.649 -10.228 10.751 1.00 0.00 H new ATOM 2098 N GLU A 136 9.295 -9.129 14.487 1.00 0.00 N ATOM 2099 CA GLU A 136 9.197 -8.705 15.874 1.00 0.00 C ATOM 2100 C GLU A 136 8.132 -7.628 16.035 1.00 0.00 C ATOM 2101 O GLU A 136 7.585 -7.440 17.121 1.00 0.00 O ATOM 2102 CB GLU A 136 10.549 -8.183 16.364 1.00 0.00 C ATOM 2103 CG GLU A 136 11.693 -9.157 16.137 1.00 0.00 C ATOM 2104 CD GLU A 136 13.039 -8.576 16.529 1.00 0.00 C ATOM 2105 OE1 GLU A 136 13.585 -7.766 15.751 1.00 0.00 O ATOM 2106 OE2 GLU A 136 13.546 -8.934 17.613 1.00 0.00 O ATOM 0 H GLU A 136 9.638 -8.413 13.847 1.00 0.00 H new ATOM 0 HA GLU A 136 8.910 -9.567 16.476 1.00 0.00 H new ATOM 0 HB2 GLU A 136 10.774 -7.246 15.855 1.00 0.00 H new ATOM 0 HB3 GLU A 136 10.479 -7.959 17.428 1.00 0.00 H new ATOM 0 HG2 GLU A 136 11.512 -10.065 16.712 1.00 0.00 H new ATOM 0 HG3 GLU A 136 11.718 -9.445 15.086 1.00 0.00 H new ATOM 2113 N GLY A 137 7.846 -6.914 14.947 1.00 0.00 N ATOM 2114 CA GLY A 137 6.852 -5.860 14.996 1.00 0.00 C ATOM 2115 C GLY A 137 7.149 -4.852 16.088 1.00 0.00 C ATOM 2116 O GLY A 137 6.250 -4.160 16.567 1.00 0.00 O ATOM 0 H GLY A 137 8.285 -7.048 14.036 1.00 0.00 H new ATOM 0 HA2 GLY A 137 6.815 -5.351 14.033 1.00 0.00 H new ATOM 0 HA3 GLY A 137 5.868 -6.297 15.164 1.00 0.00 H new ATOM 2120 N GLU A 138 8.415 -4.776 16.486 1.00 0.00 N ATOM 2121 CA GLU A 138 8.829 -3.849 17.537 1.00 0.00 C ATOM 2122 C GLU A 138 8.937 -2.419 17.007 1.00 0.00 C ATOM 2123 O GLU A 138 9.009 -1.467 17.785 1.00 0.00 O ATOM 2124 CB GLU A 138 10.154 -4.292 18.175 1.00 0.00 C ATOM 2125 CG GLU A 138 11.337 -4.345 17.218 1.00 0.00 C ATOM 2126 CD GLU A 138 12.631 -3.902 17.871 1.00 0.00 C ATOM 2127 OE1 GLU A 138 13.113 -4.613 18.777 1.00 0.00 O ATOM 2128 OE2 GLU A 138 13.163 -2.843 17.477 1.00 0.00 O ATOM 0 H GLU A 138 9.170 -5.342 16.099 1.00 0.00 H new ATOM 0 HA GLU A 138 8.059 -3.864 18.308 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.394 -3.610 18.990 1.00 0.00 H new ATOM 0 HB3 GLU A 138 10.017 -5.279 18.616 1.00 0.00 H new ATOM 0 HG2 GLU A 138 11.452 -5.362 16.844 1.00 0.00 H new ATOM 0 HG3 GLU A 138 11.132 -3.709 16.356 1.00 0.00 H new ATOM 2135 N GLN A 139 8.946 -2.269 15.684 1.00 0.00 N ATOM 2136 CA GLN A 139 9.041 -0.961 15.059 1.00 0.00 C ATOM 2137 C GLN A 139 8.076 -0.876 13.888 1.00 0.00 C ATOM 2138 O GLN A 139 8.350 -0.190 12.913 1.00 0.00 O ATOM 2139 CB GLN A 139 10.457 -0.724 14.536 1.00 0.00 C ATOM 2140 CG GLN A 139 11.534 -1.538 15.230 1.00 0.00 C ATOM 2141 CD GLN A 139 12.855 -0.801 15.323 1.00 0.00 C ATOM 2142 OE1 GLN A 139 13.782 -1.064 14.556 1.00 0.00 O ATOM 2143 NE2 GLN A 139 12.948 0.128 16.266 1.00 0.00 N ATOM 0 H GLN A 139 8.888 -3.045 15.025 1.00 0.00 H new ATOM 0 HA GLN A 139 8.793 -0.207 15.806 1.00 0.00 H new ATOM 0 HB2 GLN A 139 10.479 -0.951 13.470 1.00 0.00 H new ATOM 0 HB3 GLN A 139 10.696 0.334 14.641 1.00 0.00 H new ATOM 0 HG2 GLN A 139 11.197 -1.799 16.233 1.00 0.00 H new ATOM 0 HG3 GLN A 139 11.682 -2.473 14.690 1.00 0.00 H new ATOM 0 HE21 GLN A 139 12.155 0.313 16.880 1.00 0.00 H new ATOM 0 HE22 GLN A 139 13.813 0.657 16.377 1.00 0.00 H new ATOM 2152 N PHE A 140 6.969 -1.611 13.979 1.00 0.00 N ATOM 2153 CA PHE A 140 5.977 -1.665 12.905 1.00 0.00 C ATOM 2154 C PHE A 140 5.861 -0.385 12.084 1.00 0.00 C ATOM 2155 O PHE A 140 5.866 -0.461 10.856 1.00 0.00 O ATOM 2156 CB PHE A 140 4.623 -2.140 13.420 1.00 0.00 C ATOM 2157 CG PHE A 140 4.015 -1.276 14.486 1.00 0.00 C ATOM 2158 CD1 PHE A 140 4.542 -1.253 15.769 1.00 0.00 C ATOM 2159 CD2 PHE A 140 2.911 -0.488 14.205 1.00 0.00 C ATOM 2160 CE1 PHE A 140 3.977 -0.459 16.749 1.00 0.00 C ATOM 2161 CE2 PHE A 140 2.343 0.307 15.182 1.00 0.00 C ATOM 2162 CZ PHE A 140 2.877 0.323 16.456 1.00 0.00 C ATOM 0 H PHE A 140 6.735 -2.181 14.792 1.00 0.00 H new ATOM 0 HA PHE A 140 6.354 -2.408 12.202 1.00 0.00 H new ATOM 0 HB2 PHE A 140 3.931 -2.197 12.580 1.00 0.00 H new ATOM 0 HB3 PHE A 140 4.734 -3.151 13.811 1.00 0.00 H new ATOM 0 HD1 PHE A 140 5.402 -1.862 16.004 1.00 0.00 H new ATOM 0 HD2 PHE A 140 2.489 -0.495 13.211 1.00 0.00 H new ATOM 0 HE1 PHE A 140 4.396 -0.450 17.744 1.00 0.00 H new ATOM 0 HE2 PHE A 140 1.482 0.916 14.950 1.00 0.00 H new ATOM 0 HZ PHE A 140 2.436 0.945 17.221 1.00 0.00 H new ATOM 2172 N PRO A 141 5.797 0.814 12.686 1.00 0.00 N ATOM 2173 CA PRO A 141 5.736 2.038 11.887 1.00 0.00 C ATOM 2174 C PRO A 141 7.005 2.211 11.040 1.00 0.00 C ATOM 2175 O PRO A 141 7.171 3.225 10.364 1.00 0.00 O ATOM 2176 CB PRO A 141 5.629 3.153 12.930 1.00 0.00 C ATOM 2177 CG PRO A 141 6.173 2.556 14.183 1.00 0.00 C ATOM 2178 CD PRO A 141 5.813 1.099 14.134 1.00 0.00 C ATOM 0 HA PRO A 141 4.904 2.033 11.183 1.00 0.00 H new ATOM 0 HB2 PRO A 141 6.200 4.031 12.630 1.00 0.00 H new ATOM 0 HB3 PRO A 141 4.596 3.474 13.061 1.00 0.00 H new ATOM 0 HG2 PRO A 141 7.253 2.690 14.243 1.00 0.00 H new ATOM 0 HG3 PRO A 141 5.743 3.035 15.063 1.00 0.00 H new ATOM 0 HD2 PRO A 141 6.544 0.484 14.659 1.00 0.00 H new ATOM 0 HD3 PRO A 141 4.844 0.906 14.595 1.00 0.00 H new ATOM 2186 N TRP A 142 7.893 1.196 11.098 1.00 0.00 N ATOM 2187 CA TRP A 142 9.170 1.173 10.368 1.00 0.00 C ATOM 2188 C TRP A 142 9.480 2.499 9.680 1.00 0.00 C ATOM 2189 O TRP A 142 9.545 2.582 8.453 1.00 0.00 O ATOM 2190 CB TRP A 142 9.180 0.023 9.353 1.00 0.00 C ATOM 2191 CG TRP A 142 8.477 -1.208 9.850 1.00 0.00 C ATOM 2192 CD1 TRP A 142 8.734 -1.897 11.007 1.00 0.00 C ATOM 2193 CD2 TRP A 142 7.399 -1.894 9.206 1.00 0.00 C ATOM 2194 NE1 TRP A 142 7.859 -2.951 11.129 1.00 0.00 N ATOM 2195 CE2 TRP A 142 7.038 -2.975 10.031 1.00 0.00 C ATOM 2196 CE3 TRP A 142 6.699 -1.695 8.015 1.00 0.00 C ATOM 2197 CZ2 TRP A 142 6.008 -3.852 9.703 1.00 0.00 C ATOM 2198 CZ3 TRP A 142 5.677 -2.567 7.688 1.00 0.00 C ATOM 2199 CH2 TRP A 142 5.340 -3.635 8.530 1.00 0.00 C ATOM 0 H TRP A 142 7.737 0.360 11.662 1.00 0.00 H new ATOM 0 HA TRP A 142 9.957 1.012 11.105 1.00 0.00 H new ATOM 0 HB2 TRP A 142 8.706 0.357 8.430 1.00 0.00 H new ATOM 0 HB3 TRP A 142 10.212 -0.229 9.109 1.00 0.00 H new ATOM 0 HD1 TRP A 142 9.509 -1.649 11.717 1.00 0.00 H new ATOM 0 HE1 TRP A 142 7.826 -3.608 11.909 1.00 0.00 H new ATOM 0 HE3 TRP A 142 6.951 -0.874 7.360 1.00 0.00 H new ATOM 0 HZ2 TRP A 142 5.746 -4.675 10.352 1.00 0.00 H new ATOM 0 HZ3 TRP A 142 5.129 -2.423 6.768 1.00 0.00 H new ATOM 0 HH2 TRP A 142 4.537 -4.300 8.247 1.00 0.00 H new ATOM 2210 N LYS A 143 9.673 3.533 10.492 1.00 0.00 N ATOM 2211 CA LYS A 143 9.981 4.866 9.987 1.00 0.00 C ATOM 2212 C LYS A 143 11.402 5.273 10.377 1.00 0.00 C ATOM 2213 O LYS A 143 12.185 4.449 10.848 1.00 0.00 O ATOM 2214 CB LYS A 143 8.966 5.879 10.527 1.00 0.00 C ATOM 2215 CG LYS A 143 9.132 6.186 12.008 1.00 0.00 C ATOM 2216 CD LYS A 143 8.001 7.058 12.526 1.00 0.00 C ATOM 2217 CE LYS A 143 8.269 7.535 13.944 1.00 0.00 C ATOM 2218 NZ LYS A 143 7.304 8.587 14.369 1.00 0.00 N ATOM 0 H LYS A 143 9.621 3.472 11.509 1.00 0.00 H new ATOM 0 HA LYS A 143 9.917 4.851 8.899 1.00 0.00 H new ATOM 0 HB2 LYS A 143 9.056 6.806 9.961 1.00 0.00 H new ATOM 0 HB3 LYS A 143 7.960 5.497 10.355 1.00 0.00 H new ATOM 0 HG2 LYS A 143 9.162 5.254 12.573 1.00 0.00 H new ATOM 0 HG3 LYS A 143 10.085 6.689 12.172 1.00 0.00 H new ATOM 0 HD2 LYS A 143 7.874 7.919 11.869 1.00 0.00 H new ATOM 0 HD3 LYS A 143 7.067 6.497 12.500 1.00 0.00 H new ATOM 0 HE2 LYS A 143 8.209 6.689 14.629 1.00 0.00 H new ATOM 0 HE3 LYS A 143 9.284 7.926 14.009 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 7.521 8.885 15.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 7.379 9.405 13.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 6.337 8.206 14.331 1.00 0.00 H new