USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 759 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 12 HIS : no HD1:sc= -6.13! K(o=-8.7!,f=-5.1) USER MOD Set 1.2: A 134 LYS NZ :NH3+ -107:sc= -2.53 (180deg=-1.46!) USER MOD Set 2.1: A 21 LYS NZ :NH3+ 162:sc= 1.04 (180deg=-0.231) USER MOD Set 2.2: A 131 TYR OH : rot 60:sc= 0.944 USER MOD Single : A 6 SER OG : rot 180:sc= -0.0185 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 15:sc= 0.853 USER MOD Single : A 13 CYS SG : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= -0.426 USER MOD Single : A 22 SER OG : rot 42:sc= -3.38! USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 ASN : amide:sc= -4.78! C(o=-4.8!,f=-10!) USER MOD Single : A 40 SER OG : rot 62:sc= 0.0614 USER MOD Single : A 43 SER OG : rot 180:sc= 0.639 USER MOD Single : A 48 SER OG : rot -58:sc= 0.887 USER MOD Single : A 51 SER OG : rot 137:sc= 0.849 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0.25 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 HIS : no HE2:sc= -0.448 X(o=-0.45,f=-0.35) USER MOD Single : A 85 SER OG : rot 7:sc= 0.607! USER MOD Single : A 90 MET CE :methyl -156:sc= 0 (180deg=-0.861) USER MOD Single : A 91 ASN : amide:sc= -0.308! X(o=-0.31!,f=-0.54) USER MOD Single : A 92 TYR OH : rot 180:sc= -0.0578 USER MOD Single : A 107 HIS : no HD1:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 110 SER OG : rot -69:sc= 0.0445! USER MOD Single : A 112 SER OG : rot -53:sc= 0.59 USER MOD Single : A 114 SER OG : rot 180:sc= -0.0149 USER MOD Single : A 115 THR OG1 : rot -6:sc= 0.935 USER MOD Single : A 121 LYS NZ :NH3+ -162:sc= -0.0233 (180deg=-0.442) USER MOD Single : A 123 TYR OH : rot -165:sc= 0.00694 USER MOD Single : A 124 ASN : amide:sc= -4.56! K(o=-4.6!,f=0.043) USER MOD Single : A 126 ASN : amide:sc= -2.33 K(o=-2.3,f=-5.2!) USER MOD ----------------------------------------------------------------- ATOM 80 N SER A 6 -6.238 15.319 0.665 1.00 0.00 N ATOM 81 CA SER A 6 -5.421 14.602 1.689 1.00 0.00 C ATOM 82 C SER A 6 -6.292 14.328 2.921 1.00 0.00 C ATOM 83 O SER A 6 -7.094 15.152 3.314 1.00 0.00 O ATOM 84 CB SER A 6 -4.218 15.463 2.088 1.00 0.00 C ATOM 85 OG SER A 6 -3.285 15.487 1.017 1.00 0.00 O ATOM 0 HA SER A 6 -5.061 13.660 1.276 1.00 0.00 H new ATOM 0 HB2 SER A 6 -4.543 16.476 2.325 1.00 0.00 H new ATOM 0 HB3 SER A 6 -3.749 15.060 2.986 1.00 0.00 H new ATOM 0 HG SER A 6 -2.514 16.038 1.267 1.00 0.00 H new ATOM 91 N LYS A 7 -6.151 13.174 3.525 1.00 0.00 N ATOM 92 CA LYS A 7 -6.983 12.846 4.726 1.00 0.00 C ATOM 93 C LYS A 7 -6.075 12.396 5.870 1.00 0.00 C ATOM 94 O LYS A 7 -5.150 11.638 5.674 1.00 0.00 O ATOM 95 CB LYS A 7 -7.956 11.709 4.383 1.00 0.00 C ATOM 96 CG LYS A 7 -8.837 12.103 3.182 1.00 0.00 C ATOM 97 CD LYS A 7 -10.239 12.497 3.663 1.00 0.00 C ATOM 98 CE LYS A 7 -10.158 13.772 4.504 1.00 0.00 C ATOM 99 NZ LYS A 7 -11.511 14.389 4.599 1.00 0.00 N ATOM 0 H LYS A 7 -5.497 12.445 3.240 1.00 0.00 H new ATOM 0 HA LYS A 7 -7.543 13.732 5.027 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -7.398 10.802 4.151 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -8.584 11.486 5.246 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -8.382 12.935 2.644 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -8.905 11.270 2.482 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -10.896 12.656 2.808 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -10.672 11.689 4.252 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -9.781 13.540 5.500 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -9.457 14.474 4.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -11.458 15.256 5.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -11.853 14.623 3.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -12.168 13.719 5.047 1.00 0.00 H new ATOM 113 N ALA A 8 -6.329 12.855 7.066 1.00 0.00 N ATOM 114 CA ALA A 8 -5.470 12.450 8.215 1.00 0.00 C ATOM 115 C ALA A 8 -6.012 11.170 8.852 1.00 0.00 C ATOM 116 O ALA A 8 -7.204 10.980 8.981 1.00 0.00 O ATOM 117 CB ALA A 8 -5.445 13.564 9.262 1.00 0.00 C ATOM 0 H ALA A 8 -7.092 13.491 7.296 1.00 0.00 H new ATOM 0 HA ALA A 8 -4.459 12.270 7.850 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -4.816 13.262 10.099 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -5.044 14.474 8.816 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -6.458 13.751 9.618 1.00 0.00 H new ATOM 123 N TYR A 9 -5.132 10.297 9.253 1.00 0.00 N ATOM 124 CA TYR A 9 -5.565 9.025 9.893 1.00 0.00 C ATOM 125 C TYR A 9 -4.432 8.521 10.787 1.00 0.00 C ATOM 126 O TYR A 9 -3.277 8.811 10.557 1.00 0.00 O ATOM 127 CB TYR A 9 -5.872 7.985 8.812 1.00 0.00 C ATOM 128 CG TYR A 9 -6.719 6.883 9.402 1.00 0.00 C ATOM 129 CD1 TYR A 9 -6.109 5.776 10.004 1.00 0.00 C ATOM 130 CD2 TYR A 9 -8.117 6.969 9.349 1.00 0.00 C ATOM 131 CE1 TYR A 9 -6.895 4.756 10.553 1.00 0.00 C ATOM 132 CE2 TYR A 9 -8.901 5.950 9.898 1.00 0.00 C ATOM 133 CZ TYR A 9 -8.291 4.843 10.501 1.00 0.00 C ATOM 134 OH TYR A 9 -9.065 3.837 11.042 1.00 0.00 O ATOM 0 H TYR A 9 -4.122 10.411 9.164 1.00 0.00 H new ATOM 0 HA TYR A 9 -6.463 9.192 10.488 1.00 0.00 H new ATOM 0 HB2 TYR A 9 -6.395 8.454 7.979 1.00 0.00 H new ATOM 0 HB3 TYR A 9 -4.945 7.573 8.415 1.00 0.00 H new ATOM 0 HD1 TYR A 9 -5.032 5.709 10.045 1.00 0.00 H new ATOM 0 HD2 TYR A 9 -8.588 7.822 8.884 1.00 0.00 H new ATOM 0 HE1 TYR A 9 -6.424 3.902 11.017 1.00 0.00 H new ATOM 0 HE2 TYR A 9 -9.978 6.017 9.857 1.00 0.00 H new ATOM 0 HH TYR A 9 -10.013 4.054 10.923 1.00 0.00 H new ATOM 144 N GLY A 10 -4.744 7.775 11.808 1.00 0.00 N ATOM 145 CA GLY A 10 -3.668 7.273 12.705 1.00 0.00 C ATOM 146 C GLY A 10 -2.943 8.463 13.340 1.00 0.00 C ATOM 147 O GLY A 10 -3.129 8.762 14.502 1.00 0.00 O ATOM 0 H GLY A 10 -5.691 7.492 12.059 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -4.093 6.635 13.480 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -2.963 6.662 12.141 1.00 0.00 H new ATOM 151 N SER A 11 -2.123 9.150 12.586 1.00 0.00 N ATOM 152 CA SER A 11 -1.396 10.321 13.155 1.00 0.00 C ATOM 153 C SER A 11 -0.575 11.019 12.062 1.00 0.00 C ATOM 154 O SER A 11 0.445 11.618 12.336 1.00 0.00 O ATOM 155 CB SER A 11 -0.459 9.843 14.268 1.00 0.00 C ATOM 156 OG SER A 11 -1.206 9.659 15.464 1.00 0.00 O ATOM 0 H SER A 11 -1.927 8.951 11.605 1.00 0.00 H new ATOM 0 HA SER A 11 -2.121 11.028 13.559 1.00 0.00 H new ATOM 0 HB2 SER A 11 0.022 8.909 13.978 1.00 0.00 H new ATOM 0 HB3 SER A 11 0.334 10.573 14.430 1.00 0.00 H new ATOM 0 HG SER A 11 -2.163 9.651 15.254 1.00 0.00 H new ATOM 162 N HIS A 12 -1.006 10.959 10.828 1.00 0.00 N ATOM 163 CA HIS A 12 -0.242 11.626 9.739 1.00 0.00 C ATOM 164 C HIS A 12 -1.211 12.049 8.636 1.00 0.00 C ATOM 165 O HIS A 12 -2.274 11.483 8.482 1.00 0.00 O ATOM 166 CB HIS A 12 0.785 10.647 9.164 1.00 0.00 C ATOM 167 CG HIS A 12 1.703 10.173 10.257 1.00 0.00 C ATOM 168 ND1 HIS A 12 2.987 10.672 10.409 1.00 0.00 N ATOM 169 CD2 HIS A 12 1.541 9.244 11.254 1.00 0.00 C ATOM 170 CE1 HIS A 12 3.542 10.047 11.463 1.00 0.00 C ATOM 171 NE2 HIS A 12 2.704 9.166 12.016 1.00 0.00 N ATOM 0 H HIS A 12 -1.854 10.476 10.531 1.00 0.00 H new ATOM 0 HA HIS A 12 0.273 12.502 10.134 1.00 0.00 H new ATOM 0 HB2 HIS A 12 0.276 9.797 8.709 1.00 0.00 H new ATOM 0 HB3 HIS A 12 1.362 11.132 8.376 1.00 0.00 H new ATOM 0 HD2 HIS A 12 0.647 8.662 11.422 1.00 0.00 H new ATOM 0 HE1 HIS A 12 4.544 10.235 11.819 1.00 0.00 H new ATOM 0 HE2 HIS A 12 2.878 8.566 12.822 1.00 0.00 H new ATOM 179 N CYS A 13 -0.852 13.032 7.858 1.00 0.00 N ATOM 180 CA CYS A 13 -1.754 13.477 6.759 1.00 0.00 C ATOM 181 C CYS A 13 -1.487 12.606 5.528 1.00 0.00 C ATOM 182 O CYS A 13 -0.361 12.454 5.100 1.00 0.00 O ATOM 183 CB CYS A 13 -1.484 14.949 6.433 1.00 0.00 C ATOM 184 SG CYS A 13 -3.009 15.719 5.832 1.00 0.00 S ATOM 0 H CYS A 13 0.026 13.546 7.935 1.00 0.00 H new ATOM 0 HA CYS A 13 -2.796 13.375 7.063 1.00 0.00 H new ATOM 0 HB2 CYS A 13 -1.125 15.470 7.321 1.00 0.00 H new ATOM 0 HB3 CYS A 13 -0.701 15.029 5.679 1.00 0.00 H new ATOM 0 HG CYS A 13 -2.784 16.969 5.556 1.00 0.00 H new ATOM 189 N TYR A 14 -2.511 12.013 4.973 1.00 0.00 N ATOM 190 CA TYR A 14 -2.309 11.128 3.789 1.00 0.00 C ATOM 191 C TYR A 14 -2.624 11.883 2.499 1.00 0.00 C ATOM 192 O TYR A 14 -3.351 12.853 2.497 1.00 0.00 O ATOM 193 CB TYR A 14 -3.225 9.908 3.903 1.00 0.00 C ATOM 194 CG TYR A 14 -2.774 9.055 5.067 1.00 0.00 C ATOM 195 CD1 TYR A 14 -2.903 9.534 6.375 1.00 0.00 C ATOM 196 CD2 TYR A 14 -2.223 7.787 4.837 1.00 0.00 C ATOM 197 CE1 TYR A 14 -2.481 8.748 7.454 1.00 0.00 C ATOM 198 CE2 TYR A 14 -1.803 7.002 5.918 1.00 0.00 C ATOM 199 CZ TYR A 14 -1.932 7.482 7.225 1.00 0.00 C ATOM 200 OH TYR A 14 -1.517 6.708 8.289 1.00 0.00 O ATOM 0 H TYR A 14 -3.477 12.103 5.288 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.268 10.807 3.763 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -4.258 10.226 4.048 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -3.196 9.329 2.980 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -3.328 10.511 6.553 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -2.122 7.416 3.828 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -2.579 9.119 8.463 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -1.379 6.024 5.742 1.00 0.00 H new ATOM 0 HH TYR A 14 -1.161 5.858 7.956 1.00 0.00 H new ATOM 210 N ALA A 15 -2.079 11.436 1.400 1.00 0.00 N ATOM 211 CA ALA A 15 -2.340 12.117 0.101 1.00 0.00 C ATOM 212 C ALA A 15 -2.277 11.087 -1.029 1.00 0.00 C ATOM 213 O ALA A 15 -1.339 10.321 -1.135 1.00 0.00 O ATOM 214 CB ALA A 15 -1.283 13.199 -0.133 1.00 0.00 C ATOM 0 H ALA A 15 -1.462 10.625 1.347 1.00 0.00 H new ATOM 0 HA ALA A 15 -3.328 12.578 0.122 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -1.475 13.696 -1.084 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -1.326 13.930 0.674 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -0.294 12.742 -0.156 1.00 0.00 H new ATOM 220 N LEU A 16 -3.272 11.062 -1.870 1.00 0.00 N ATOM 221 CA LEU A 16 -3.286 10.083 -2.994 1.00 0.00 C ATOM 222 C LEU A 16 -2.678 10.734 -4.242 1.00 0.00 C ATOM 223 O LEU A 16 -3.032 11.836 -4.613 1.00 0.00 O ATOM 224 CB LEU A 16 -4.745 9.670 -3.262 1.00 0.00 C ATOM 225 CG LEU A 16 -4.896 9.062 -4.661 1.00 0.00 C ATOM 226 CD1 LEU A 16 -4.035 7.802 -4.780 1.00 0.00 C ATOM 227 CD2 LEU A 16 -6.364 8.693 -4.890 1.00 0.00 C ATOM 0 H LEU A 16 -4.082 11.681 -1.828 1.00 0.00 H new ATOM 0 HA LEU A 16 -2.698 9.201 -2.740 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.066 8.948 -2.511 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -5.396 10.539 -3.167 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.572 9.788 -5.407 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -4.148 7.377 -5.777 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -2.989 8.059 -4.612 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -4.354 7.072 -4.036 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -6.480 8.260 -5.883 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.678 7.968 -4.139 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -6.981 9.588 -4.811 1.00 0.00 H new ATOM 239 N PHE A 17 -1.775 10.051 -4.902 1.00 0.00 N ATOM 240 CA PHE A 17 -1.150 10.605 -6.129 1.00 0.00 C ATOM 241 C PHE A 17 -1.487 9.674 -7.288 1.00 0.00 C ATOM 242 O PHE A 17 -1.159 8.504 -7.276 1.00 0.00 O ATOM 243 CB PHE A 17 0.369 10.672 -5.946 1.00 0.00 C ATOM 244 CG PHE A 17 0.717 11.834 -5.048 1.00 0.00 C ATOM 245 CD1 PHE A 17 0.766 11.655 -3.660 1.00 0.00 C ATOM 246 CD2 PHE A 17 0.992 13.089 -5.602 1.00 0.00 C ATOM 247 CE1 PHE A 17 1.088 12.733 -2.826 1.00 0.00 C ATOM 248 CE2 PHE A 17 1.315 14.167 -4.768 1.00 0.00 C ATOM 249 CZ PHE A 17 1.363 13.988 -3.381 1.00 0.00 C ATOM 0 H PHE A 17 -1.445 9.124 -4.635 1.00 0.00 H new ATOM 0 HA PHE A 17 -1.524 11.610 -6.328 1.00 0.00 H new ATOM 0 HB2 PHE A 17 0.735 9.741 -5.513 1.00 0.00 H new ATOM 0 HB3 PHE A 17 0.858 10.787 -6.913 1.00 0.00 H new ATOM 0 HD1 PHE A 17 0.555 10.686 -3.233 1.00 0.00 H new ATOM 0 HD2 PHE A 17 0.955 13.227 -6.673 1.00 0.00 H new ATOM 0 HE1 PHE A 17 1.124 12.596 -1.755 1.00 0.00 H new ATOM 0 HE2 PHE A 17 1.527 15.136 -5.195 1.00 0.00 H new ATOM 0 HZ PHE A 17 1.613 14.819 -2.738 1.00 0.00 H new ATOM 259 N LEU A 18 -2.142 10.182 -8.288 1.00 0.00 N ATOM 260 CA LEU A 18 -2.503 9.325 -9.444 1.00 0.00 C ATOM 261 C LEU A 18 -1.248 9.090 -10.261 1.00 0.00 C ATOM 262 O LEU A 18 -1.296 8.647 -11.391 1.00 0.00 O ATOM 263 CB LEU A 18 -3.559 10.031 -10.301 1.00 0.00 C ATOM 264 CG LEU A 18 -4.628 10.648 -9.395 1.00 0.00 C ATOM 265 CD1 LEU A 18 -5.845 11.038 -10.235 1.00 0.00 C ATOM 266 CD2 LEU A 18 -5.049 9.633 -8.329 1.00 0.00 C ATOM 0 H LEU A 18 -2.443 11.154 -8.355 1.00 0.00 H new ATOM 0 HA LEU A 18 -2.914 8.375 -9.101 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.091 10.806 -10.908 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.017 9.321 -10.989 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.221 11.534 -8.909 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.606 11.477 -9.590 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -5.547 11.764 -10.992 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -6.250 10.151 -10.722 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -5.810 10.075 -7.686 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.455 8.744 -8.813 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.183 9.356 -7.728 1.00 0.00 H new ATOM 278 N SER A 19 -0.117 9.396 -9.693 1.00 0.00 N ATOM 279 CA SER A 19 1.156 9.198 -10.446 1.00 0.00 C ATOM 280 C SER A 19 1.725 7.798 -10.160 1.00 0.00 C ATOM 281 O SER A 19 1.995 7.459 -9.026 1.00 0.00 O ATOM 282 CB SER A 19 2.186 10.249 -10.035 1.00 0.00 C ATOM 283 OG SER A 19 1.600 11.146 -9.102 1.00 0.00 O ATOM 0 H SER A 19 -0.016 9.771 -8.750 1.00 0.00 H new ATOM 0 HA SER A 19 0.944 9.297 -11.511 1.00 0.00 H new ATOM 0 HB2 SER A 19 3.058 9.766 -9.593 1.00 0.00 H new ATOM 0 HB3 SER A 19 2.534 10.795 -10.912 1.00 0.00 H new ATOM 0 HG SER A 19 2.261 11.819 -8.836 1.00 0.00 H new ATOM 289 N PRO A 20 1.918 6.997 -11.178 1.00 0.00 N ATOM 290 CA PRO A 20 2.481 5.629 -10.994 1.00 0.00 C ATOM 291 C PRO A 20 3.937 5.668 -10.503 1.00 0.00 C ATOM 292 O PRO A 20 4.694 6.546 -10.870 1.00 0.00 O ATOM 293 CB PRO A 20 2.413 5.048 -12.409 1.00 0.00 C ATOM 294 CG PRO A 20 1.842 6.111 -13.359 1.00 0.00 C ATOM 295 CD PRO A 20 1.579 7.390 -12.571 1.00 0.00 C ATOM 0 HA PRO A 20 1.941 5.049 -10.245 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.406 4.743 -12.739 1.00 0.00 H new ATOM 0 HB3 PRO A 20 1.785 4.157 -12.420 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.543 6.306 -14.171 1.00 0.00 H new ATOM 0 HG3 PRO A 20 0.919 5.752 -13.814 1.00 0.00 H new ATOM 0 HD2 PRO A 20 2.200 8.215 -12.921 1.00 0.00 H new ATOM 0 HD3 PRO A 20 0.542 7.713 -12.659 1.00 0.00 H new ATOM 303 N LYS A 21 4.344 4.720 -9.698 1.00 0.00 N ATOM 304 CA LYS A 21 5.761 4.715 -9.211 1.00 0.00 C ATOM 305 C LYS A 21 6.121 3.322 -8.684 1.00 0.00 C ATOM 306 O LYS A 21 5.433 2.775 -7.852 1.00 0.00 O ATOM 307 CB LYS A 21 5.925 5.738 -8.076 1.00 0.00 C ATOM 308 CG LYS A 21 6.269 7.121 -8.648 1.00 0.00 C ATOM 309 CD LYS A 21 6.861 7.997 -7.543 1.00 0.00 C ATOM 310 CE LYS A 21 6.911 9.451 -8.017 1.00 0.00 C ATOM 311 NZ LYS A 21 5.538 10.032 -7.984 1.00 0.00 N ATOM 0 H LYS A 21 3.763 3.954 -9.358 1.00 0.00 H new ATOM 0 HA LYS A 21 6.421 4.977 -10.038 1.00 0.00 H new ATOM 0 HB2 LYS A 21 5.005 5.796 -7.495 1.00 0.00 H new ATOM 0 HB3 LYS A 21 6.712 5.413 -7.395 1.00 0.00 H new ATOM 0 HG2 LYS A 21 6.981 7.021 -9.468 1.00 0.00 H new ATOM 0 HG3 LYS A 21 5.374 7.590 -9.058 1.00 0.00 H new ATOM 0 HD2 LYS A 21 6.257 7.918 -6.639 1.00 0.00 H new ATOM 0 HD3 LYS A 21 7.863 7.652 -7.288 1.00 0.00 H new ATOM 0 HE2 LYS A 21 7.578 10.030 -7.378 1.00 0.00 H new ATOM 0 HE3 LYS A 21 7.315 9.501 -9.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 5.600 11.070 -8.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 5.001 9.700 -8.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 5.055 9.731 -7.114 1.00 0.00 H new ATOM 325 N SER A 22 7.206 2.753 -9.146 1.00 0.00 N ATOM 326 CA SER A 22 7.614 1.403 -8.651 1.00 0.00 C ATOM 327 C SER A 22 7.405 1.342 -7.137 1.00 0.00 C ATOM 328 O SER A 22 7.450 2.346 -6.462 1.00 0.00 O ATOM 329 CB SER A 22 9.090 1.170 -8.964 1.00 0.00 C ATOM 330 OG SER A 22 9.591 0.145 -8.117 1.00 0.00 O ATOM 0 H SER A 22 7.826 3.164 -9.844 1.00 0.00 H new ATOM 0 HA SER A 22 7.013 0.636 -9.140 1.00 0.00 H new ATOM 0 HB2 SER A 22 9.212 0.886 -10.009 1.00 0.00 H new ATOM 0 HB3 SER A 22 9.655 2.090 -8.815 1.00 0.00 H new ATOM 0 HG SER A 22 8.933 -0.578 -8.054 1.00 0.00 H new ATOM 336 N TRP A 23 7.180 0.179 -6.592 1.00 0.00 N ATOM 337 CA TRP A 23 6.979 0.094 -5.119 1.00 0.00 C ATOM 338 C TRP A 23 8.176 0.741 -4.432 1.00 0.00 C ATOM 339 O TRP A 23 8.102 1.186 -3.304 1.00 0.00 O ATOM 340 CB TRP A 23 6.880 -1.372 -4.692 1.00 0.00 C ATOM 341 CG TRP A 23 6.749 -1.446 -3.203 1.00 0.00 C ATOM 342 CD1 TRP A 23 5.590 -1.639 -2.534 1.00 0.00 C ATOM 343 CD2 TRP A 23 7.791 -1.331 -2.191 1.00 0.00 C ATOM 344 NE1 TRP A 23 5.854 -1.649 -1.176 1.00 0.00 N ATOM 345 CE2 TRP A 23 7.196 -1.463 -0.914 1.00 0.00 C ATOM 346 CE3 TRP A 23 9.183 -1.127 -2.257 1.00 0.00 C ATOM 347 CZ2 TRP A 23 7.953 -1.395 0.255 1.00 0.00 C ATOM 348 CZ3 TRP A 23 9.947 -1.058 -1.081 1.00 0.00 C ATOM 349 CH2 TRP A 23 9.333 -1.191 0.174 1.00 0.00 C ATOM 0 H TRP A 23 7.127 -0.706 -7.096 1.00 0.00 H new ATOM 0 HA TRP A 23 6.058 0.607 -4.840 1.00 0.00 H new ATOM 0 HB2 TRP A 23 6.021 -1.844 -5.168 1.00 0.00 H new ATOM 0 HB3 TRP A 23 7.765 -1.918 -5.018 1.00 0.00 H new ATOM 0 HD1 TRP A 23 4.617 -1.765 -2.986 1.00 0.00 H new ATOM 0 HE1 TRP A 23 5.143 -1.778 -0.456 1.00 0.00 H new ATOM 0 HE3 TRP A 23 9.665 -1.023 -3.218 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 7.475 -1.499 1.218 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 11.014 -0.902 -1.143 1.00 0.00 H new ATOM 0 HH2 TRP A 23 9.926 -1.136 1.075 1.00 0.00 H new ATOM 360 N THR A 24 9.282 0.796 -5.119 1.00 0.00 N ATOM 361 CA THR A 24 10.506 1.407 -4.531 1.00 0.00 C ATOM 362 C THR A 24 10.546 2.897 -4.875 1.00 0.00 C ATOM 363 O THR A 24 11.229 3.679 -4.243 1.00 0.00 O ATOM 364 CB THR A 24 11.737 0.709 -5.114 1.00 0.00 C ATOM 365 OG1 THR A 24 12.883 1.056 -4.352 1.00 0.00 O ATOM 366 CG2 THR A 24 11.941 1.135 -6.574 1.00 0.00 C ATOM 0 H THR A 24 9.391 0.441 -6.069 1.00 0.00 H new ATOM 0 HA THR A 24 10.497 1.290 -3.447 1.00 0.00 H new ATOM 0 HB THR A 24 11.587 -0.370 -5.077 1.00 0.00 H new ATOM 0 HG1 THR A 24 13.671 0.608 -4.724 1.00 0.00 H new ATOM 0 HG21 THR A 24 12.819 0.633 -6.980 1.00 0.00 H new ATOM 0 HG22 THR A 24 11.063 0.861 -7.159 1.00 0.00 H new ATOM 0 HG23 THR A 24 12.086 2.214 -6.621 1.00 0.00 H new ATOM 374 N ASP A 25 9.814 3.286 -5.877 1.00 0.00 N ATOM 375 CA ASP A 25 9.791 4.719 -6.287 1.00 0.00 C ATOM 376 C ASP A 25 8.723 5.446 -5.479 1.00 0.00 C ATOM 377 O ASP A 25 8.919 6.558 -5.032 1.00 0.00 O ATOM 378 CB ASP A 25 9.467 4.825 -7.778 1.00 0.00 C ATOM 379 CG ASP A 25 10.705 4.455 -8.598 1.00 0.00 C ATOM 380 OD1 ASP A 25 11.626 3.895 -8.025 1.00 0.00 O ATOM 381 OD2 ASP A 25 10.713 4.737 -9.785 1.00 0.00 O ATOM 0 H ASP A 25 9.225 2.669 -6.436 1.00 0.00 H new ATOM 0 HA ASP A 25 10.766 5.170 -6.103 1.00 0.00 H new ATOM 0 HB2 ASP A 25 8.640 4.161 -8.029 1.00 0.00 H new ATOM 0 HB3 ASP A 25 9.147 5.838 -8.020 1.00 0.00 H new ATOM 386 N ALA A 26 7.601 4.816 -5.260 1.00 0.00 N ATOM 387 CA ALA A 26 6.548 5.459 -4.455 1.00 0.00 C ATOM 388 C ALA A 26 7.042 5.445 -3.016 1.00 0.00 C ATOM 389 O ALA A 26 6.771 6.333 -2.238 1.00 0.00 O ATOM 390 CB ALA A 26 5.252 4.667 -4.600 1.00 0.00 C ATOM 0 H ALA A 26 7.377 3.884 -5.608 1.00 0.00 H new ATOM 0 HA ALA A 26 6.347 6.481 -4.777 1.00 0.00 H new ATOM 0 HB1 ALA A 26 4.469 5.139 -4.006 1.00 0.00 H new ATOM 0 HB2 ALA A 26 4.952 4.649 -5.648 1.00 0.00 H new ATOM 0 HB3 ALA A 26 5.408 3.647 -4.250 1.00 0.00 H new ATOM 396 N ASP A 27 7.801 4.438 -2.675 1.00 0.00 N ATOM 397 CA ASP A 27 8.367 4.352 -1.309 1.00 0.00 C ATOM 398 C ASP A 27 9.273 5.561 -1.075 1.00 0.00 C ATOM 399 O ASP A 27 9.260 6.165 -0.021 1.00 0.00 O ATOM 400 CB ASP A 27 9.179 3.066 -1.207 1.00 0.00 C ATOM 401 CG ASP A 27 9.920 3.026 0.132 1.00 0.00 C ATOM 402 OD1 ASP A 27 9.262 3.136 1.153 1.00 0.00 O ATOM 403 OD2 ASP A 27 11.132 2.890 0.112 1.00 0.00 O ATOM 0 H ASP A 27 8.052 3.667 -3.294 1.00 0.00 H new ATOM 0 HA ASP A 27 7.575 4.346 -0.560 1.00 0.00 H new ATOM 0 HB2 ASP A 27 8.521 2.202 -1.295 1.00 0.00 H new ATOM 0 HB3 ASP A 27 9.892 3.009 -2.030 1.00 0.00 H new ATOM 408 N LEU A 28 10.052 5.924 -2.058 1.00 0.00 N ATOM 409 CA LEU A 28 10.952 7.100 -1.901 1.00 0.00 C ATOM 410 C LEU A 28 10.113 8.380 -1.940 1.00 0.00 C ATOM 411 O LEU A 28 10.185 9.210 -1.056 1.00 0.00 O ATOM 412 CB LEU A 28 11.975 7.114 -3.045 1.00 0.00 C ATOM 413 CG LEU A 28 13.257 7.815 -2.590 1.00 0.00 C ATOM 414 CD1 LEU A 28 14.245 7.879 -3.756 1.00 0.00 C ATOM 415 CD2 LEU A 28 12.928 9.237 -2.122 1.00 0.00 C ATOM 0 H LEU A 28 10.103 5.456 -2.963 1.00 0.00 H new ATOM 0 HA LEU A 28 11.480 7.040 -0.949 1.00 0.00 H new ATOM 0 HB2 LEU A 28 12.199 6.094 -3.356 1.00 0.00 H new ATOM 0 HB3 LEU A 28 11.558 7.627 -3.911 1.00 0.00 H new ATOM 0 HG LEU A 28 13.701 7.256 -1.766 1.00 0.00 H new ATOM 0 HD11 LEU A 28 15.158 8.378 -3.432 1.00 0.00 H new ATOM 0 HD12 LEU A 28 14.482 6.868 -4.088 1.00 0.00 H new ATOM 0 HD13 LEU A 28 13.800 8.436 -4.580 1.00 0.00 H new ATOM 0 HD21 LEU A 28 13.842 9.734 -1.798 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.482 9.797 -2.944 1.00 0.00 H new ATOM 0 HD23 LEU A 28 12.225 9.193 -1.290 1.00 0.00 H new ATOM 427 N ALA A 29 9.307 8.542 -2.956 1.00 0.00 N ATOM 428 CA ALA A 29 8.460 9.763 -3.045 1.00 0.00 C ATOM 429 C ALA A 29 7.679 9.926 -1.742 1.00 0.00 C ATOM 430 O ALA A 29 7.726 10.958 -1.104 1.00 0.00 O ATOM 431 CB ALA A 29 7.484 9.627 -4.211 1.00 0.00 C ATOM 0 H ALA A 29 9.200 7.882 -3.726 1.00 0.00 H new ATOM 0 HA ALA A 29 9.092 10.636 -3.207 1.00 0.00 H new ATOM 0 HB1 ALA A 29 6.865 10.522 -4.274 1.00 0.00 H new ATOM 0 HB2 ALA A 29 8.041 9.505 -5.140 1.00 0.00 H new ATOM 0 HB3 ALA A 29 6.848 8.756 -4.053 1.00 0.00 H new ATOM 437 N CYS A 30 6.968 8.910 -1.333 1.00 0.00 N ATOM 438 CA CYS A 30 6.203 9.010 -0.063 1.00 0.00 C ATOM 439 C CYS A 30 7.181 9.371 1.055 1.00 0.00 C ATOM 440 O CYS A 30 6.830 10.021 2.018 1.00 0.00 O ATOM 441 CB CYS A 30 5.547 7.666 0.264 1.00 0.00 C ATOM 442 SG CYS A 30 4.288 7.245 -0.973 1.00 0.00 S ATOM 0 H CYS A 30 6.886 8.019 -1.823 1.00 0.00 H new ATOM 0 HA CYS A 30 5.426 9.769 -0.160 1.00 0.00 H new ATOM 0 HB2 CYS A 30 6.306 6.884 0.297 1.00 0.00 H new ATOM 0 HB3 CYS A 30 5.091 7.710 1.253 1.00 0.00 H new ATOM 447 N GLN A 31 8.413 8.952 0.928 1.00 0.00 N ATOM 448 CA GLN A 31 9.421 9.270 1.975 1.00 0.00 C ATOM 449 C GLN A 31 9.871 10.718 1.808 1.00 0.00 C ATOM 450 O GLN A 31 10.175 11.401 2.766 1.00 0.00 O ATOM 451 CB GLN A 31 10.627 8.337 1.834 1.00 0.00 C ATOM 452 CG GLN A 31 11.513 8.455 3.075 1.00 0.00 C ATOM 453 CD GLN A 31 12.601 7.382 3.030 1.00 0.00 C ATOM 454 OE1 GLN A 31 12.389 6.266 3.461 1.00 0.00 O ATOM 455 NE2 GLN A 31 13.769 7.673 2.521 1.00 0.00 N ATOM 0 H GLN A 31 8.762 8.403 0.143 1.00 0.00 H new ATOM 0 HA GLN A 31 8.979 9.132 2.962 1.00 0.00 H new ATOM 0 HB2 GLN A 31 10.291 7.307 1.711 1.00 0.00 H new ATOM 0 HB3 GLN A 31 11.197 8.595 0.942 1.00 0.00 H new ATOM 0 HG2 GLN A 31 11.966 9.445 3.118 1.00 0.00 H new ATOM 0 HG3 GLN A 31 10.911 8.340 3.977 1.00 0.00 H new ATOM 0 HE21 GLN A 31 13.948 8.609 2.159 1.00 0.00 H new ATOM 0 HE22 GLN A 31 14.501 6.964 2.486 1.00 0.00 H new ATOM 464 N LYS A 32 9.901 11.199 0.596 1.00 0.00 N ATOM 465 CA LYS A 32 10.315 12.606 0.368 1.00 0.00 C ATOM 466 C LYS A 32 9.520 13.504 1.316 1.00 0.00 C ATOM 467 O LYS A 32 9.852 14.650 1.541 1.00 0.00 O ATOM 468 CB LYS A 32 10.019 12.998 -1.084 1.00 0.00 C ATOM 469 CG LYS A 32 10.877 14.209 -1.479 1.00 0.00 C ATOM 470 CD LYS A 32 12.244 13.734 -1.991 1.00 0.00 C ATOM 471 CE LYS A 32 12.163 13.440 -3.491 1.00 0.00 C ATOM 472 NZ LYS A 32 13.367 12.670 -3.912 1.00 0.00 N ATOM 0 H LYS A 32 9.656 10.676 -0.245 1.00 0.00 H new ATOM 0 HA LYS A 32 11.383 12.719 0.555 1.00 0.00 H new ATOM 0 HB2 LYS A 32 10.230 12.159 -1.747 1.00 0.00 H new ATOM 0 HB3 LYS A 32 8.962 13.237 -1.198 1.00 0.00 H new ATOM 0 HG2 LYS A 32 10.371 14.788 -2.251 1.00 0.00 H new ATOM 0 HG3 LYS A 32 11.009 14.868 -0.621 1.00 0.00 H new ATOM 0 HD2 LYS A 32 12.999 14.497 -1.801 1.00 0.00 H new ATOM 0 HD3 LYS A 32 12.553 12.839 -1.452 1.00 0.00 H new ATOM 0 HE2 LYS A 32 11.259 12.872 -3.713 1.00 0.00 H new ATOM 0 HE3 LYS A 32 12.100 14.372 -4.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 13.312 12.470 -4.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 14.222 13.227 -3.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 13.408 11.774 -3.385 1.00 0.00 H new ATOM 486 N ARG A 33 8.464 12.973 1.871 1.00 0.00 N ATOM 487 CA ARG A 33 7.623 13.766 2.809 1.00 0.00 C ATOM 488 C ARG A 33 8.211 13.675 4.218 1.00 0.00 C ATOM 489 O ARG A 33 8.956 12.764 4.518 1.00 0.00 O ATOM 490 CB ARG A 33 6.200 13.196 2.791 1.00 0.00 C ATOM 491 CG ARG A 33 5.445 13.718 1.560 1.00 0.00 C ATOM 492 CD ARG A 33 4.835 15.092 1.861 1.00 0.00 C ATOM 493 NE ARG A 33 3.924 15.482 0.748 1.00 0.00 N ATOM 494 CZ ARG A 33 4.410 16.004 -0.342 1.00 0.00 C ATOM 495 NH1 ARG A 33 5.179 15.292 -1.121 1.00 0.00 N ATOM 496 NH2 ARG A 33 4.130 17.239 -0.657 1.00 0.00 N ATOM 0 H ARG A 33 8.147 12.017 1.713 1.00 0.00 H new ATOM 0 HA ARG A 33 7.600 14.813 2.506 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.235 12.107 2.772 1.00 0.00 H new ATOM 0 HB3 ARG A 33 5.672 13.482 3.701 1.00 0.00 H new ATOM 0 HG2 ARG A 33 6.124 13.791 0.711 1.00 0.00 H new ATOM 0 HG3 ARG A 33 4.660 13.016 1.280 1.00 0.00 H new ATOM 0 HD2 ARG A 33 4.285 15.060 2.802 1.00 0.00 H new ATOM 0 HD3 ARG A 33 5.624 15.835 1.978 1.00 0.00 H new ATOM 0 HE ARG A 33 2.918 15.340 0.840 1.00 0.00 H new ATOM 0 HH11 ARG A 33 5.399 14.327 -0.876 1.00 0.00 H new ATOM 0 HH12 ARG A 33 5.559 15.701 -1.974 1.00 0.00 H new ATOM 0 HH21 ARG A 33 3.530 17.797 -0.049 1.00 0.00 H new ATOM 0 HH22 ARG A 33 4.511 17.647 -1.511 1.00 0.00 H new ATOM 510 N PRO A 34 7.886 14.612 5.081 1.00 0.00 N ATOM 511 CA PRO A 34 8.415 14.597 6.470 1.00 0.00 C ATOM 512 C PRO A 34 8.306 13.213 7.114 1.00 0.00 C ATOM 513 O PRO A 34 7.424 12.941 7.904 1.00 0.00 O ATOM 514 CB PRO A 34 7.529 15.638 7.174 1.00 0.00 C ATOM 515 CG PRO A 34 6.545 16.216 6.142 1.00 0.00 C ATOM 516 CD PRO A 34 6.973 15.737 4.750 1.00 0.00 C ATOM 0 HA PRO A 34 9.479 14.827 6.529 1.00 0.00 H new ATOM 0 HB2 PRO A 34 6.986 15.178 7.999 1.00 0.00 H new ATOM 0 HB3 PRO A 34 8.142 16.432 7.600 1.00 0.00 H new ATOM 0 HG2 PRO A 34 5.529 15.888 6.361 1.00 0.00 H new ATOM 0 HG3 PRO A 34 6.545 17.305 6.186 1.00 0.00 H new ATOM 0 HD2 PRO A 34 6.123 15.411 4.151 1.00 0.00 H new ATOM 0 HD3 PRO A 34 7.478 16.521 4.186 1.00 0.00 H new ATOM 524 N SER A 35 9.206 12.337 6.767 1.00 0.00 N ATOM 525 CA SER A 35 9.185 10.964 7.334 1.00 0.00 C ATOM 526 C SER A 35 8.017 10.175 6.745 1.00 0.00 C ATOM 527 O SER A 35 7.670 9.115 7.226 1.00 0.00 O ATOM 528 CB SER A 35 9.052 11.035 8.857 1.00 0.00 C ATOM 529 OG SER A 35 9.693 9.908 9.437 1.00 0.00 O ATOM 0 H SER A 35 9.963 12.517 6.107 1.00 0.00 H new ATOM 0 HA SER A 35 10.117 10.459 7.080 1.00 0.00 H new ATOM 0 HB2 SER A 35 9.501 11.955 9.230 1.00 0.00 H new ATOM 0 HB3 SER A 35 8.000 11.056 9.141 1.00 0.00 H new ATOM 0 HG SER A 35 9.611 9.951 10.413 1.00 0.00 H new ATOM 535 N GLY A 36 7.405 10.678 5.709 1.00 0.00 N ATOM 536 CA GLY A 36 6.262 9.937 5.110 1.00 0.00 C ATOM 537 C GLY A 36 6.736 8.586 4.559 1.00 0.00 C ATOM 538 O GLY A 36 7.874 8.195 4.727 1.00 0.00 O ATOM 0 H GLY A 36 7.644 11.560 5.256 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.488 9.780 5.861 1.00 0.00 H new ATOM 0 HA3 GLY A 36 5.816 10.528 4.310 1.00 0.00 H new ATOM 542 N ASN A 37 5.855 7.869 3.912 1.00 0.00 N ATOM 543 CA ASN A 37 6.211 6.530 3.343 1.00 0.00 C ATOM 544 C ASN A 37 4.920 5.858 2.867 1.00 0.00 C ATOM 545 O ASN A 37 3.890 5.987 3.496 1.00 0.00 O ATOM 546 CB ASN A 37 6.886 5.662 4.420 1.00 0.00 C ATOM 547 CG ASN A 37 6.448 6.125 5.813 1.00 0.00 C ATOM 548 OD1 ASN A 37 5.369 6.659 5.976 1.00 0.00 O ATOM 549 ND2 ASN A 37 7.247 5.942 6.828 1.00 0.00 N ATOM 0 H ASN A 37 4.890 8.156 3.750 1.00 0.00 H new ATOM 0 HA ASN A 37 6.906 6.648 2.511 1.00 0.00 H new ATOM 0 HB2 ASN A 37 6.620 4.615 4.275 1.00 0.00 H new ATOM 0 HB3 ASN A 37 7.970 5.731 4.328 1.00 0.00 H new ATOM 0 HD21 ASN A 37 6.966 6.247 7.760 1.00 0.00 H new ATOM 0 HD22 ASN A 37 8.153 5.494 6.690 1.00 0.00 H new ATOM 556 N LEU A 38 4.963 5.159 1.755 1.00 0.00 N ATOM 557 CA LEU A 38 3.734 4.490 1.228 1.00 0.00 C ATOM 558 C LEU A 38 2.717 4.251 2.352 1.00 0.00 C ATOM 559 O LEU A 38 3.059 3.837 3.438 1.00 0.00 O ATOM 560 CB LEU A 38 4.132 3.164 0.591 1.00 0.00 C ATOM 561 CG LEU A 38 4.868 3.440 -0.721 1.00 0.00 C ATOM 562 CD1 LEU A 38 5.692 2.215 -1.127 1.00 0.00 C ATOM 563 CD2 LEU A 38 3.859 3.771 -1.823 1.00 0.00 C ATOM 0 H LEU A 38 5.801 5.024 1.190 1.00 0.00 H new ATOM 0 HA LEU A 38 3.265 5.135 0.485 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.771 2.598 1.269 1.00 0.00 H new ATOM 0 HB3 LEU A 38 3.247 2.556 0.405 1.00 0.00 H new ATOM 0 HG LEU A 38 5.537 4.289 -0.579 1.00 0.00 H new ATOM 0 HD11 LEU A 38 6.213 2.420 -2.062 1.00 0.00 H new ATOM 0 HD12 LEU A 38 6.421 1.992 -0.348 1.00 0.00 H new ATOM 0 HD13 LEU A 38 5.030 1.359 -1.261 1.00 0.00 H new ATOM 0 HD21 LEU A 38 4.389 3.967 -2.755 1.00 0.00 H new ATOM 0 HD22 LEU A 38 3.181 2.928 -1.961 1.00 0.00 H new ATOM 0 HD23 LEU A 38 3.287 4.654 -1.539 1.00 0.00 H new ATOM 575 N VAL A 39 1.473 4.534 2.093 1.00 0.00 N ATOM 576 CA VAL A 39 0.410 4.360 3.128 1.00 0.00 C ATOM 577 C VAL A 39 0.638 3.093 3.959 1.00 0.00 C ATOM 578 O VAL A 39 1.144 2.097 3.481 1.00 0.00 O ATOM 579 CB VAL A 39 -0.947 4.276 2.432 1.00 0.00 C ATOM 580 CG1 VAL A 39 -0.865 3.284 1.270 1.00 0.00 C ATOM 581 CG2 VAL A 39 -2.014 3.808 3.426 1.00 0.00 C ATOM 0 H VAL A 39 1.139 4.884 1.195 1.00 0.00 H new ATOM 0 HA VAL A 39 0.441 5.214 3.804 1.00 0.00 H new ATOM 0 HB VAL A 39 -1.216 5.262 2.053 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -1.834 3.224 0.774 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -0.112 3.620 0.557 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -0.591 2.300 1.650 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -2.979 3.750 2.923 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -1.746 2.824 3.811 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -2.077 4.516 4.252 1.00 0.00 H new ATOM 591 N SER A 40 0.249 3.136 5.208 1.00 0.00 N ATOM 592 CA SER A 40 0.409 1.954 6.108 1.00 0.00 C ATOM 593 C SER A 40 -0.962 1.296 6.323 1.00 0.00 C ATOM 594 O SER A 40 -1.967 1.767 5.830 1.00 0.00 O ATOM 595 CB SER A 40 0.964 2.421 7.457 1.00 0.00 C ATOM 596 OG SER A 40 0.477 3.725 7.737 1.00 0.00 O ATOM 0 H SER A 40 -0.178 3.951 5.648 1.00 0.00 H new ATOM 0 HA SER A 40 1.095 1.236 5.658 1.00 0.00 H new ATOM 0 HB2 SER A 40 0.664 1.731 8.246 1.00 0.00 H new ATOM 0 HB3 SER A 40 2.054 2.424 7.434 1.00 0.00 H new ATOM 0 HG SER A 40 -0.501 3.703 7.798 1.00 0.00 H new ATOM 602 N VAL A 41 -1.014 0.214 7.061 1.00 0.00 N ATOM 603 CA VAL A 41 -2.328 -0.459 7.305 1.00 0.00 C ATOM 604 C VAL A 41 -2.185 -1.430 8.487 1.00 0.00 C ATOM 605 O VAL A 41 -1.881 -2.593 8.310 1.00 0.00 O ATOM 606 CB VAL A 41 -2.780 -1.236 6.043 1.00 0.00 C ATOM 607 CG1 VAL A 41 -4.131 -0.703 5.561 1.00 0.00 C ATOM 608 CG2 VAL A 41 -1.758 -1.079 4.908 1.00 0.00 C ATOM 0 H VAL A 41 -0.209 -0.230 7.503 1.00 0.00 H new ATOM 0 HA VAL A 41 -3.079 0.297 7.535 1.00 0.00 H new ATOM 0 HB VAL A 41 -2.862 -2.290 6.308 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -4.444 -1.253 4.673 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.874 -0.831 6.348 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -4.039 0.356 5.318 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -2.098 -1.633 4.033 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -1.657 -0.024 4.652 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -0.792 -1.468 5.231 1.00 0.00 H new ATOM 618 N LEU A 42 -2.397 -0.962 9.693 1.00 0.00 N ATOM 619 CA LEU A 42 -2.271 -1.859 10.884 1.00 0.00 C ATOM 620 C LEU A 42 -3.631 -2.036 11.562 1.00 0.00 C ATOM 621 O LEU A 42 -3.716 -2.525 12.671 1.00 0.00 O ATOM 622 CB LEU A 42 -1.290 -1.252 11.890 1.00 0.00 C ATOM 623 CG LEU A 42 0.129 -1.310 11.322 1.00 0.00 C ATOM 624 CD1 LEU A 42 1.021 -0.328 12.087 1.00 0.00 C ATOM 625 CD2 LEU A 42 0.692 -2.730 11.470 1.00 0.00 C ATOM 0 H LEU A 42 -2.652 0.003 9.904 1.00 0.00 H new ATOM 0 HA LEU A 42 -1.905 -2.829 10.548 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -1.565 -0.219 12.104 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -1.338 -1.796 12.833 1.00 0.00 H new ATOM 0 HG LEU A 42 0.105 -1.041 10.266 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.033 -0.367 11.685 1.00 0.00 H new ATOM 0 HD12 LEU A 42 0.626 0.682 11.979 1.00 0.00 H new ATOM 0 HD13 LEU A 42 1.039 -0.600 13.142 1.00 0.00 H new ATOM 0 HD21 LEU A 42 1.703 -2.765 11.064 1.00 0.00 H new ATOM 0 HD22 LEU A 42 0.715 -3.004 12.525 1.00 0.00 H new ATOM 0 HD23 LEU A 42 0.058 -3.431 10.927 1.00 0.00 H new ATOM 637 N SER A 43 -4.695 -1.646 10.916 1.00 0.00 N ATOM 638 CA SER A 43 -6.040 -1.803 11.548 1.00 0.00 C ATOM 639 C SER A 43 -7.080 -2.135 10.477 1.00 0.00 C ATOM 640 O SER A 43 -6.982 -1.704 9.347 1.00 0.00 O ATOM 641 CB SER A 43 -6.428 -0.498 12.244 1.00 0.00 C ATOM 642 OG SER A 43 -6.821 0.456 11.267 1.00 0.00 O ATOM 0 H SER A 43 -4.695 -1.228 9.985 1.00 0.00 H new ATOM 0 HA SER A 43 -6.003 -2.612 12.277 1.00 0.00 H new ATOM 0 HB2 SER A 43 -7.244 -0.675 12.945 1.00 0.00 H new ATOM 0 HB3 SER A 43 -5.587 -0.117 12.823 1.00 0.00 H new ATOM 0 HG SER A 43 -7.072 1.293 11.710 1.00 0.00 H new ATOM 648 N GLY A 44 -8.079 -2.898 10.830 1.00 0.00 N ATOM 649 CA GLY A 44 -9.131 -3.254 9.836 1.00 0.00 C ATOM 650 C GLY A 44 -9.870 -1.984 9.417 1.00 0.00 C ATOM 651 O GLY A 44 -10.522 -1.940 8.393 1.00 0.00 O ATOM 0 H GLY A 44 -8.212 -3.290 11.762 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -8.681 -3.732 8.966 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -9.829 -3.971 10.268 1.00 0.00 H new ATOM 655 N ALA A 45 -9.766 -0.947 10.203 1.00 0.00 N ATOM 656 CA ALA A 45 -10.453 0.328 9.855 1.00 0.00 C ATOM 657 C ALA A 45 -9.579 1.119 8.884 1.00 0.00 C ATOM 658 O ALA A 45 -10.066 1.787 7.996 1.00 0.00 O ATOM 659 CB ALA A 45 -10.672 1.149 11.124 1.00 0.00 C ATOM 0 H ALA A 45 -9.234 -0.929 11.073 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.416 0.112 9.391 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -11.175 2.083 10.871 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -11.288 0.582 11.822 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -9.709 1.369 11.586 1.00 0.00 H new ATOM 665 N GLU A 46 -8.287 1.043 9.045 1.00 0.00 N ATOM 666 CA GLU A 46 -7.377 1.785 8.131 1.00 0.00 C ATOM 667 C GLU A 46 -7.431 1.142 6.746 1.00 0.00 C ATOM 668 O GLU A 46 -7.497 1.817 5.739 1.00 0.00 O ATOM 669 CB GLU A 46 -5.946 1.718 8.668 1.00 0.00 C ATOM 670 CG GLU A 46 -5.042 2.625 7.831 1.00 0.00 C ATOM 671 CD GLU A 46 -3.682 2.764 8.516 1.00 0.00 C ATOM 672 OE1 GLU A 46 -3.601 2.461 9.696 1.00 0.00 O ATOM 673 OE2 GLU A 46 -2.743 3.171 7.851 1.00 0.00 O ATOM 0 H GLU A 46 -7.822 0.498 9.771 1.00 0.00 H new ATOM 0 HA GLU A 46 -7.689 2.827 8.067 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.924 2.029 9.712 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -5.581 0.691 8.633 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.917 2.208 6.832 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -5.503 3.606 7.712 1.00 0.00 H new ATOM 680 N GLY A 47 -7.413 -0.160 6.688 1.00 0.00 N ATOM 681 CA GLY A 47 -7.469 -0.843 5.365 1.00 0.00 C ATOM 682 C GLY A 47 -8.752 -0.426 4.646 1.00 0.00 C ATOM 683 O GLY A 47 -8.803 -0.355 3.433 1.00 0.00 O ATOM 0 H GLY A 47 -7.362 -0.780 7.497 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -6.598 -0.577 4.766 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -7.446 -1.925 5.498 1.00 0.00 H new ATOM 687 N SER A 48 -9.788 -0.142 5.387 1.00 0.00 N ATOM 688 CA SER A 48 -11.068 0.281 4.756 1.00 0.00 C ATOM 689 C SER A 48 -11.019 1.788 4.496 1.00 0.00 C ATOM 690 O SER A 48 -11.612 2.288 3.563 1.00 0.00 O ATOM 691 CB SER A 48 -12.231 -0.038 5.697 1.00 0.00 C ATOM 692 OG SER A 48 -12.431 1.053 6.585 1.00 0.00 O ATOM 0 H SER A 48 -9.802 -0.185 6.406 1.00 0.00 H new ATOM 0 HA SER A 48 -11.210 -0.252 3.816 1.00 0.00 H new ATOM 0 HB2 SER A 48 -13.138 -0.225 5.122 1.00 0.00 H new ATOM 0 HB3 SER A 48 -12.019 -0.946 6.261 1.00 0.00 H new ATOM 0 HG SER A 48 -11.607 1.220 7.089 1.00 0.00 H new ATOM 698 N PHE A 49 -10.308 2.511 5.319 1.00 0.00 N ATOM 699 CA PHE A 49 -10.210 3.984 5.123 1.00 0.00 C ATOM 700 C PHE A 49 -9.374 4.269 3.875 1.00 0.00 C ATOM 701 O PHE A 49 -9.772 5.025 3.011 1.00 0.00 O ATOM 702 CB PHE A 49 -9.541 4.616 6.347 1.00 0.00 C ATOM 703 CG PHE A 49 -9.779 6.107 6.339 1.00 0.00 C ATOM 704 CD1 PHE A 49 -10.990 6.624 6.817 1.00 0.00 C ATOM 705 CD2 PHE A 49 -8.791 6.972 5.856 1.00 0.00 C ATOM 706 CE1 PHE A 49 -11.212 8.006 6.809 1.00 0.00 C ATOM 707 CE2 PHE A 49 -9.013 8.355 5.849 1.00 0.00 C ATOM 708 CZ PHE A 49 -10.224 8.872 6.325 1.00 0.00 C ATOM 0 H PHE A 49 -9.791 2.144 6.118 1.00 0.00 H new ATOM 0 HA PHE A 49 -11.207 4.407 4.999 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -9.943 4.178 7.261 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -8.471 4.408 6.338 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -11.752 5.957 7.192 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -7.857 6.573 5.488 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -12.146 8.405 7.176 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -8.250 9.023 5.476 1.00 0.00 H new ATOM 0 HZ PHE A 49 -10.396 9.938 6.319 1.00 0.00 H new ATOM 718 N VAL A 50 -8.222 3.665 3.770 1.00 0.00 N ATOM 719 CA VAL A 50 -7.369 3.898 2.573 1.00 0.00 C ATOM 720 C VAL A 50 -8.121 3.426 1.329 1.00 0.00 C ATOM 721 O VAL A 50 -8.048 4.032 0.278 1.00 0.00 O ATOM 722 CB VAL A 50 -6.060 3.118 2.709 1.00 0.00 C ATOM 723 CG1 VAL A 50 -5.125 3.480 1.552 1.00 0.00 C ATOM 724 CG2 VAL A 50 -5.389 3.479 4.035 1.00 0.00 C ATOM 0 H VAL A 50 -7.836 3.021 4.461 1.00 0.00 H new ATOM 0 HA VAL A 50 -7.141 4.960 2.487 1.00 0.00 H new ATOM 0 HB VAL A 50 -6.271 2.049 2.685 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -4.193 2.924 1.650 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -5.602 3.225 0.606 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -4.914 4.549 1.576 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -4.456 2.924 4.134 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -5.179 4.548 4.057 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -6.053 3.222 4.860 1.00 0.00 H new ATOM 734 N SER A 51 -8.849 2.348 1.443 1.00 0.00 N ATOM 735 CA SER A 51 -9.610 1.839 0.269 1.00 0.00 C ATOM 736 C SER A 51 -10.567 2.926 -0.222 1.00 0.00 C ATOM 737 O SER A 51 -10.724 3.139 -1.404 1.00 0.00 O ATOM 738 CB SER A 51 -10.410 0.603 0.681 1.00 0.00 C ATOM 739 OG SER A 51 -11.514 0.443 -0.201 1.00 0.00 O ATOM 0 H SER A 51 -8.949 1.800 2.297 1.00 0.00 H new ATOM 0 HA SER A 51 -8.918 1.574 -0.530 1.00 0.00 H new ATOM 0 HB2 SER A 51 -9.775 -0.282 0.651 1.00 0.00 H new ATOM 0 HB3 SER A 51 -10.762 0.709 1.707 1.00 0.00 H new ATOM 0 HG SER A 51 -11.603 -0.502 -0.446 1.00 0.00 H new ATOM 745 N SER A 52 -11.210 3.616 0.681 1.00 0.00 N ATOM 746 CA SER A 52 -12.158 4.689 0.269 1.00 0.00 C ATOM 747 C SER A 52 -11.376 5.880 -0.290 1.00 0.00 C ATOM 748 O SER A 52 -11.895 6.676 -1.048 1.00 0.00 O ATOM 749 CB SER A 52 -12.974 5.140 1.480 1.00 0.00 C ATOM 750 OG SER A 52 -13.859 4.096 1.866 1.00 0.00 O ATOM 0 H SER A 52 -11.119 3.482 1.688 1.00 0.00 H new ATOM 0 HA SER A 52 -12.828 4.303 -0.500 1.00 0.00 H new ATOM 0 HB2 SER A 52 -12.310 5.393 2.306 1.00 0.00 H new ATOM 0 HB3 SER A 52 -13.539 6.040 1.237 1.00 0.00 H new ATOM 0 HG SER A 52 -14.383 4.382 2.644 1.00 0.00 H new ATOM 756 N LEU A 53 -10.133 6.011 0.080 1.00 0.00 N ATOM 757 CA LEU A 53 -9.317 7.150 -0.423 1.00 0.00 C ATOM 758 C LEU A 53 -8.861 6.851 -1.853 1.00 0.00 C ATOM 759 O LEU A 53 -8.574 7.747 -2.621 1.00 0.00 O ATOM 760 CB LEU A 53 -8.096 7.325 0.497 1.00 0.00 C ATOM 761 CG LEU A 53 -6.962 8.072 -0.221 1.00 0.00 C ATOM 762 CD1 LEU A 53 -7.391 9.514 -0.507 1.00 0.00 C ATOM 763 CD2 LEU A 53 -5.724 8.089 0.678 1.00 0.00 C ATOM 0 H LEU A 53 -9.645 5.376 0.712 1.00 0.00 H new ATOM 0 HA LEU A 53 -9.906 8.067 -0.424 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -8.388 7.875 1.392 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -7.741 6.348 0.825 1.00 0.00 H new ATOM 0 HG LEU A 53 -6.736 7.567 -1.160 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -6.583 10.040 -1.016 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -8.278 9.511 -1.140 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.617 10.019 0.432 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -4.915 8.618 0.174 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -5.961 8.595 1.614 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -5.413 7.066 0.888 1.00 0.00 H new ATOM 775 N VAL A 54 -8.772 5.598 -2.208 1.00 0.00 N ATOM 776 CA VAL A 54 -8.313 5.238 -3.581 1.00 0.00 C ATOM 777 C VAL A 54 -9.387 4.427 -4.311 1.00 0.00 C ATOM 778 O VAL A 54 -9.118 3.781 -5.306 1.00 0.00 O ATOM 779 CB VAL A 54 -7.025 4.420 -3.470 1.00 0.00 C ATOM 780 CG1 VAL A 54 -6.007 5.199 -2.638 1.00 0.00 C ATOM 781 CG2 VAL A 54 -7.316 3.080 -2.784 1.00 0.00 C ATOM 0 H VAL A 54 -8.998 4.806 -1.606 1.00 0.00 H new ATOM 0 HA VAL A 54 -8.128 6.148 -4.152 1.00 0.00 H new ATOM 0 HB VAL A 54 -6.628 4.235 -4.468 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -5.086 4.621 -2.555 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -5.795 6.152 -3.122 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -6.413 5.380 -1.643 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -6.395 2.502 -2.708 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -7.714 3.261 -1.786 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -8.047 2.522 -3.370 1.00 0.00 H new ATOM 791 N LYS A 55 -10.603 4.451 -3.836 1.00 0.00 N ATOM 792 CA LYS A 55 -11.687 3.680 -4.514 1.00 0.00 C ATOM 793 C LYS A 55 -12.369 4.567 -5.559 1.00 0.00 C ATOM 794 O LYS A 55 -13.214 4.119 -6.308 1.00 0.00 O ATOM 795 CB LYS A 55 -12.717 3.223 -3.476 1.00 0.00 C ATOM 796 CG LYS A 55 -13.997 2.760 -4.182 1.00 0.00 C ATOM 797 CD LYS A 55 -14.820 1.883 -3.235 1.00 0.00 C ATOM 798 CE LYS A 55 -15.269 2.713 -2.030 1.00 0.00 C ATOM 799 NZ LYS A 55 -16.371 2.002 -1.322 1.00 0.00 N ATOM 0 H LYS A 55 -10.894 4.971 -3.008 1.00 0.00 H new ATOM 0 HA LYS A 55 -11.258 2.807 -5.006 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -12.307 2.410 -2.877 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -12.944 4.040 -2.791 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -14.584 3.624 -4.495 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -13.745 2.202 -5.084 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -15.688 1.481 -3.757 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -14.226 1.032 -2.902 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -14.431 2.873 -1.352 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -15.607 3.696 -2.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -16.677 2.565 -0.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -17.173 1.871 -1.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -16.033 1.074 -0.997 1.00 0.00 H new ATOM 896 N SER A 62 -6.920 0.215 -11.309 1.00 0.00 N ATOM 897 CA SER A 62 -7.647 -0.731 -10.412 1.00 0.00 C ATOM 898 C SER A 62 -6.770 -1.096 -9.215 1.00 0.00 C ATOM 899 O SER A 62 -7.262 -1.371 -8.141 1.00 0.00 O ATOM 900 CB SER A 62 -7.986 -2.001 -11.198 1.00 0.00 C ATOM 901 OG SER A 62 -9.220 -1.813 -11.880 1.00 0.00 O ATOM 0 HA SER A 62 -8.561 -0.258 -10.052 1.00 0.00 H new ATOM 0 HB2 SER A 62 -7.193 -2.224 -11.911 1.00 0.00 H new ATOM 0 HB3 SER A 62 -8.056 -2.853 -10.522 1.00 0.00 H new ATOM 0 HG SER A 62 -9.441 -2.623 -12.386 1.00 0.00 H new ATOM 907 N TYR A 63 -5.476 -1.113 -9.383 1.00 0.00 N ATOM 908 CA TYR A 63 -4.586 -1.485 -8.245 1.00 0.00 C ATOM 909 C TYR A 63 -3.810 -0.257 -7.753 1.00 0.00 C ATOM 910 O TYR A 63 -3.710 0.745 -8.434 1.00 0.00 O ATOM 911 CB TYR A 63 -3.608 -2.565 -8.704 1.00 0.00 C ATOM 912 CG TYR A 63 -4.333 -3.885 -8.836 1.00 0.00 C ATOM 913 CD1 TYR A 63 -5.352 -4.035 -9.785 1.00 0.00 C ATOM 914 CD2 TYR A 63 -3.982 -4.963 -8.012 1.00 0.00 C ATOM 915 CE1 TYR A 63 -6.019 -5.259 -9.909 1.00 0.00 C ATOM 916 CE2 TYR A 63 -4.650 -6.185 -8.138 1.00 0.00 C ATOM 917 CZ TYR A 63 -5.668 -6.334 -9.086 1.00 0.00 C ATOM 918 OH TYR A 63 -6.326 -7.542 -9.211 1.00 0.00 O ATOM 0 H TYR A 63 -4.997 -0.887 -10.255 1.00 0.00 H new ATOM 0 HA TYR A 63 -5.194 -1.864 -7.424 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -3.164 -2.285 -9.660 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -2.791 -2.658 -7.988 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -5.623 -3.206 -10.421 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -3.196 -4.850 -7.280 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -6.805 -5.374 -10.641 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -4.380 -7.015 -7.502 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.960 -8.182 -8.566 1.00 0.00 H new ATOM 928 N VAL A 64 -3.277 -0.329 -6.561 1.00 0.00 N ATOM 929 CA VAL A 64 -2.520 0.828 -5.992 1.00 0.00 C ATOM 930 C VAL A 64 -1.351 0.297 -5.148 1.00 0.00 C ATOM 931 O VAL A 64 -1.466 -0.703 -4.476 1.00 0.00 O ATOM 932 CB VAL A 64 -3.493 1.644 -5.127 1.00 0.00 C ATOM 933 CG1 VAL A 64 -2.764 2.754 -4.361 1.00 0.00 C ATOM 934 CG2 VAL A 64 -4.559 2.268 -6.033 1.00 0.00 C ATOM 0 H VAL A 64 -3.334 -1.145 -5.952 1.00 0.00 H new ATOM 0 HA VAL A 64 -2.112 1.461 -6.780 1.00 0.00 H new ATOM 0 HB VAL A 64 -3.952 0.976 -4.398 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -3.481 3.312 -3.759 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.010 2.312 -3.710 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -2.282 3.428 -5.069 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -5.255 2.850 -5.429 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -4.080 2.920 -6.763 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -5.102 1.479 -6.553 1.00 0.00 H new ATOM 944 N TRP A 65 -0.220 0.954 -5.186 1.00 0.00 N ATOM 945 CA TRP A 65 0.953 0.471 -4.393 1.00 0.00 C ATOM 946 C TRP A 65 0.802 0.891 -2.927 1.00 0.00 C ATOM 947 O TRP A 65 0.269 1.941 -2.630 1.00 0.00 O ATOM 948 CB TRP A 65 2.241 1.116 -4.934 1.00 0.00 C ATOM 949 CG TRP A 65 3.015 0.194 -5.830 1.00 0.00 C ATOM 950 CD1 TRP A 65 3.678 0.607 -6.932 1.00 0.00 C ATOM 951 CD2 TRP A 65 3.253 -1.250 -5.733 1.00 0.00 C ATOM 952 NE1 TRP A 65 4.299 -0.472 -7.522 1.00 0.00 N ATOM 953 CE2 TRP A 65 4.066 -1.638 -6.828 1.00 0.00 C ATOM 954 CE3 TRP A 65 2.856 -2.252 -4.826 1.00 0.00 C ATOM 955 CZ2 TRP A 65 4.462 -2.959 -7.016 1.00 0.00 C ATOM 956 CZ3 TRP A 65 3.256 -3.584 -5.018 1.00 0.00 C ATOM 957 CH2 TRP A 65 4.056 -3.935 -6.111 1.00 0.00 C ATOM 0 H TRP A 65 -0.057 1.802 -5.730 1.00 0.00 H new ATOM 0 HA TRP A 65 1.002 -0.615 -4.473 1.00 0.00 H new ATOM 0 HB2 TRP A 65 1.986 2.022 -5.484 1.00 0.00 H new ATOM 0 HB3 TRP A 65 2.871 1.418 -4.097 1.00 0.00 H new ATOM 0 HD1 TRP A 65 3.715 1.624 -7.294 1.00 0.00 H new ATOM 0 HE1 TRP A 65 4.863 -0.414 -8.370 1.00 0.00 H new ATOM 0 HE3 TRP A 65 2.240 -1.994 -3.977 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 5.081 -3.225 -7.860 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 2.944 -4.344 -4.317 1.00 0.00 H new ATOM 0 HH2 TRP A 65 4.358 -4.962 -6.252 1.00 0.00 H new ATOM 968 N ILE A 66 1.310 0.105 -2.009 1.00 0.00 N ATOM 969 CA ILE A 66 1.239 0.498 -0.570 1.00 0.00 C ATOM 970 C ILE A 66 2.595 0.208 0.079 1.00 0.00 C ATOM 971 O ILE A 66 3.496 -0.305 -0.553 1.00 0.00 O ATOM 972 CB ILE A 66 0.141 -0.283 0.158 1.00 0.00 C ATOM 973 CG1 ILE A 66 0.293 -1.778 -0.113 1.00 0.00 C ATOM 974 CG2 ILE A 66 -1.230 0.179 -0.336 1.00 0.00 C ATOM 975 CD1 ILE A 66 -0.872 -2.529 0.538 1.00 0.00 C ATOM 0 H ILE A 66 1.768 -0.787 -2.194 1.00 0.00 H new ATOM 0 HA ILE A 66 1.001 1.559 -0.499 1.00 0.00 H new ATOM 0 HB ILE A 66 0.229 -0.100 1.229 1.00 0.00 H new ATOM 0 HG12 ILE A 66 0.307 -1.965 -1.187 1.00 0.00 H new ATOM 0 HG13 ILE A 66 1.241 -2.137 0.286 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -2.010 -0.378 0.183 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -1.349 1.244 -0.135 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.309 0.001 -1.408 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -0.768 -3.597 0.347 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -0.865 -2.350 1.613 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -1.813 -2.175 0.117 1.00 0.00 H new ATOM 987 N GLY A 67 2.760 0.552 1.328 1.00 0.00 N ATOM 988 CA GLY A 67 4.062 0.321 2.002 1.00 0.00 C ATOM 989 C GLY A 67 4.128 -1.080 2.588 1.00 0.00 C ATOM 990 O GLY A 67 4.331 -1.249 3.766 1.00 0.00 O ATOM 0 H GLY A 67 2.043 0.985 1.910 1.00 0.00 H new ATOM 0 HA2 GLY A 67 4.875 0.460 1.289 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.202 1.058 2.793 1.00 0.00 H new ATOM 994 N LEU A 68 3.977 -2.085 1.776 1.00 0.00 N ATOM 995 CA LEU A 68 4.068 -3.483 2.293 1.00 0.00 C ATOM 996 C LEU A 68 5.024 -4.272 1.398 1.00 0.00 C ATOM 997 O LEU A 68 4.869 -4.300 0.192 1.00 0.00 O ATOM 998 CB LEU A 68 2.687 -4.146 2.274 1.00 0.00 C ATOM 999 CG LEU A 68 2.612 -5.307 3.293 1.00 0.00 C ATOM 1000 CD1 LEU A 68 3.946 -6.056 3.393 1.00 0.00 C ATOM 1001 CD2 LEU A 68 2.250 -4.761 4.673 1.00 0.00 C ATOM 0 H LEU A 68 3.794 -2.003 0.776 1.00 0.00 H new ATOM 0 HA LEU A 68 4.435 -3.469 3.319 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.921 -3.405 2.505 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.475 -4.522 1.273 1.00 0.00 H new ATOM 0 HG LEU A 68 1.847 -6.002 2.946 1.00 0.00 H new ATOM 0 HD11 LEU A 68 3.856 -6.865 4.118 1.00 0.00 H new ATOM 0 HD12 LEU A 68 4.205 -6.470 2.418 1.00 0.00 H new ATOM 0 HD13 LEU A 68 4.727 -5.367 3.714 1.00 0.00 H new ATOM 0 HD21 LEU A 68 2.198 -5.583 5.387 1.00 0.00 H new ATOM 0 HD22 LEU A 68 3.010 -4.049 4.993 1.00 0.00 H new ATOM 0 HD23 LEU A 68 1.283 -4.261 4.624 1.00 0.00 H new ATOM 1013 N HIS A 69 6.007 -4.920 1.971 1.00 0.00 N ATOM 1014 CA HIS A 69 6.958 -5.709 1.140 1.00 0.00 C ATOM 1015 C HIS A 69 7.160 -7.088 1.757 1.00 0.00 C ATOM 1016 O HIS A 69 6.556 -7.435 2.750 1.00 0.00 O ATOM 1017 CB HIS A 69 8.298 -4.977 1.026 1.00 0.00 C ATOM 1018 CG HIS A 69 9.061 -5.089 2.316 1.00 0.00 C ATOM 1019 ND1 HIS A 69 10.188 -5.884 2.446 1.00 0.00 N ATOM 1020 CD2 HIS A 69 8.873 -4.503 3.538 1.00 0.00 C ATOM 1021 CE1 HIS A 69 10.630 -5.753 3.708 1.00 0.00 C ATOM 1022 NE2 HIS A 69 9.864 -4.921 4.419 1.00 0.00 N ATOM 0 H HIS A 69 6.189 -4.935 2.974 1.00 0.00 H new ATOM 0 HA HIS A 69 6.542 -5.825 0.139 1.00 0.00 H new ATOM 0 HB2 HIS A 69 8.884 -5.401 0.210 1.00 0.00 H new ATOM 0 HB3 HIS A 69 8.128 -3.928 0.785 1.00 0.00 H new ATOM 0 HD1 HIS A 69 10.606 -6.463 1.717 1.00 0.00 H new ATOM 0 HD2 HIS A 69 8.074 -3.818 3.782 1.00 0.00 H new ATOM 0 HE1 HIS A 69 11.500 -6.259 4.100 1.00 0.00 H new ATOM 1180 N TRP A 82 6.226 -10.383 5.567 1.00 0.00 N ATOM 1181 CA TRP A 82 5.309 -9.250 5.245 1.00 0.00 C ATOM 1182 C TRP A 82 5.476 -8.126 6.272 1.00 0.00 C ATOM 1183 O TRP A 82 4.922 -8.179 7.351 1.00 0.00 O ATOM 1184 CB TRP A 82 3.859 -9.744 5.271 1.00 0.00 C ATOM 1185 CG TRP A 82 3.781 -11.129 4.709 1.00 0.00 C ATOM 1186 CD1 TRP A 82 4.654 -11.662 3.824 1.00 0.00 C ATOM 1187 CD2 TRP A 82 2.790 -12.162 4.977 1.00 0.00 C ATOM 1188 NE1 TRP A 82 4.263 -12.956 3.533 1.00 0.00 N ATOM 1189 CE2 TRP A 82 3.119 -13.310 4.219 1.00 0.00 C ATOM 1190 CE3 TRP A 82 1.648 -12.212 5.798 1.00 0.00 C ATOM 1191 CZ2 TRP A 82 2.342 -14.468 4.273 1.00 0.00 C ATOM 1192 CZ3 TRP A 82 0.865 -13.377 5.854 1.00 0.00 C ATOM 1193 CH2 TRP A 82 1.211 -14.503 5.094 1.00 0.00 C ATOM 0 HA TRP A 82 5.554 -8.868 4.254 1.00 0.00 H new ATOM 0 HB2 TRP A 82 3.481 -9.736 6.293 1.00 0.00 H new ATOM 0 HB3 TRP A 82 3.226 -9.071 4.692 1.00 0.00 H new ATOM 0 HD1 TRP A 82 5.516 -11.159 3.412 1.00 0.00 H new ATOM 0 HE1 TRP A 82 4.759 -13.573 2.890 1.00 0.00 H new ATOM 0 HE3 TRP A 82 1.372 -11.350 6.388 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 2.613 -15.332 3.684 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 -0.010 -13.405 6.487 1.00 0.00 H new ATOM 0 HH2 TRP A 82 0.605 -15.396 5.143 1.00 0.00 H new ATOM 1204 N GLU A 83 6.219 -7.095 5.945 1.00 0.00 N ATOM 1205 CA GLU A 83 6.392 -5.965 6.911 1.00 0.00 C ATOM 1206 C GLU A 83 6.058 -4.653 6.209 1.00 0.00 C ATOM 1207 O GLU A 83 6.338 -4.476 5.043 1.00 0.00 O ATOM 1208 CB GLU A 83 7.836 -5.917 7.412 1.00 0.00 C ATOM 1209 CG GLU A 83 7.930 -4.965 8.606 1.00 0.00 C ATOM 1210 CD GLU A 83 9.396 -4.610 8.862 1.00 0.00 C ATOM 1211 OE1 GLU A 83 10.166 -5.514 9.135 1.00 0.00 O ATOM 1212 OE2 GLU A 83 9.723 -3.437 8.782 1.00 0.00 O ATOM 0 H GLU A 83 6.710 -6.988 5.057 1.00 0.00 H new ATOM 0 HA GLU A 83 5.726 -6.114 7.761 1.00 0.00 H new ATOM 0 HB2 GLU A 83 8.165 -6.915 7.702 1.00 0.00 H new ATOM 0 HB3 GLU A 83 8.498 -5.583 6.614 1.00 0.00 H new ATOM 0 HG2 GLU A 83 7.355 -4.060 8.409 1.00 0.00 H new ATOM 0 HG3 GLU A 83 7.498 -5.431 9.491 1.00 0.00 H new ATOM 1219 N TRP A 84 5.458 -3.728 6.905 1.00 0.00 N ATOM 1220 CA TRP A 84 5.107 -2.439 6.267 1.00 0.00 C ATOM 1221 C TRP A 84 6.316 -1.515 6.283 1.00 0.00 C ATOM 1222 O TRP A 84 6.981 -1.360 7.289 1.00 0.00 O ATOM 1223 CB TRP A 84 3.953 -1.775 7.025 1.00 0.00 C ATOM 1224 CG TRP A 84 3.215 -2.801 7.819 1.00 0.00 C ATOM 1225 CD1 TRP A 84 3.684 -3.407 8.932 1.00 0.00 C ATOM 1226 CD2 TRP A 84 1.886 -3.345 7.586 1.00 0.00 C ATOM 1227 NE1 TRP A 84 2.734 -4.297 9.389 1.00 0.00 N ATOM 1228 CE2 TRP A 84 1.606 -4.295 8.594 1.00 0.00 C ATOM 1229 CE3 TRP A 84 0.910 -3.112 6.605 1.00 0.00 C ATOM 1230 CZ2 TRP A 84 0.397 -4.989 8.628 1.00 0.00 C ATOM 1231 CZ3 TRP A 84 -0.309 -3.809 6.635 1.00 0.00 C ATOM 1232 CH2 TRP A 84 -0.564 -4.747 7.645 1.00 0.00 C ATOM 0 H TRP A 84 5.198 -3.813 7.887 1.00 0.00 H new ATOM 0 HA TRP A 84 4.801 -2.626 5.238 1.00 0.00 H new ATOM 0 HB2 TRP A 84 4.338 -0.998 7.686 1.00 0.00 H new ATOM 0 HB3 TRP A 84 3.276 -1.289 6.323 1.00 0.00 H new ATOM 0 HD1 TRP A 84 4.645 -3.224 9.389 1.00 0.00 H new ATOM 0 HE1 TRP A 84 2.851 -4.885 10.214 1.00 0.00 H new ATOM 0 HE3 TRP A 84 1.097 -2.392 5.822 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 0.205 -5.709 9.410 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 -1.054 -3.621 5.876 1.00 0.00 H new ATOM 0 HH2 TRP A 84 -1.502 -5.281 7.663 1.00 0.00 H new ATOM 1243 N SER A 85 6.599 -0.886 5.184 1.00 0.00 N ATOM 1244 CA SER A 85 7.754 0.044 5.144 1.00 0.00 C ATOM 1245 C SER A 85 7.289 1.406 5.642 1.00 0.00 C ATOM 1246 O SER A 85 8.038 2.362 5.677 1.00 0.00 O ATOM 1247 CB SER A 85 8.278 0.162 3.713 1.00 0.00 C ATOM 1248 OG SER A 85 9.019 1.368 3.583 1.00 0.00 O ATOM 0 H SER A 85 6.080 -0.975 4.310 1.00 0.00 H new ATOM 0 HA SER A 85 8.559 -0.330 5.776 1.00 0.00 H new ATOM 0 HB2 SER A 85 8.909 -0.694 3.473 1.00 0.00 H new ATOM 0 HB3 SER A 85 7.447 0.154 3.007 1.00 0.00 H new ATOM 0 HG SER A 85 9.114 1.790 4.462 1.00 0.00 H new ATOM 1288 N VAL A 89 5.498 -3.322 12.198 1.00 0.00 N ATOM 1289 CA VAL A 89 5.512 -4.813 12.111 1.00 0.00 C ATOM 1290 C VAL A 89 4.133 -5.315 11.680 1.00 0.00 C ATOM 1291 O VAL A 89 3.154 -4.597 11.734 1.00 0.00 O ATOM 1292 CB VAL A 89 5.859 -5.395 13.482 1.00 0.00 C ATOM 1293 CG1 VAL A 89 5.968 -6.919 13.380 1.00 0.00 C ATOM 1294 CG2 VAL A 89 7.196 -4.820 13.955 1.00 0.00 C ATOM 0 HA VAL A 89 6.256 -5.128 11.379 1.00 0.00 H new ATOM 0 HB VAL A 89 5.077 -5.135 14.195 1.00 0.00 H new ATOM 0 HG11 VAL A 89 6.215 -7.332 14.358 1.00 0.00 H new ATOM 0 HG12 VAL A 89 5.017 -7.330 13.042 1.00 0.00 H new ATOM 0 HG13 VAL A 89 6.750 -7.181 12.667 1.00 0.00 H new ATOM 0 HG21 VAL A 89 7.445 -5.234 14.932 1.00 0.00 H new ATOM 0 HG22 VAL A 89 7.977 -5.081 13.241 1.00 0.00 H new ATOM 0 HG23 VAL A 89 7.120 -3.735 14.029 1.00 0.00 H new ATOM 1304 N MET A 90 4.053 -6.544 11.251 1.00 0.00 N ATOM 1305 CA MET A 90 2.742 -7.099 10.812 1.00 0.00 C ATOM 1306 C MET A 90 1.766 -7.133 11.990 1.00 0.00 C ATOM 1307 O MET A 90 1.623 -8.138 12.657 1.00 0.00 O ATOM 1308 CB MET A 90 2.949 -8.523 10.279 1.00 0.00 C ATOM 1309 CG MET A 90 1.789 -8.905 9.350 1.00 0.00 C ATOM 1310 SD MET A 90 1.403 -10.663 9.551 1.00 0.00 S ATOM 1311 CE MET A 90 3.064 -11.301 9.219 1.00 0.00 C ATOM 0 H MET A 90 4.840 -7.189 11.185 1.00 0.00 H new ATOM 0 HA MET A 90 2.329 -6.466 10.026 1.00 0.00 H new ATOM 0 HB2 MET A 90 3.894 -8.585 9.740 1.00 0.00 H new ATOM 0 HB3 MET A 90 3.009 -9.227 11.109 1.00 0.00 H new ATOM 0 HG2 MET A 90 0.911 -8.301 9.580 1.00 0.00 H new ATOM 0 HG3 MET A 90 2.056 -8.697 8.314 1.00 0.00 H new ATOM 0 HE1 MET A 90 2.995 -12.332 8.872 1.00 0.00 H new ATOM 0 HE2 MET A 90 3.541 -10.691 8.452 1.00 0.00 H new ATOM 0 HE3 MET A 90 3.657 -11.264 10.133 1.00 0.00 H new ATOM 1321 N ASN A 91 1.074 -6.049 12.242 1.00 0.00 N ATOM 1322 CA ASN A 91 0.092 -6.043 13.364 1.00 0.00 C ATOM 1323 C ASN A 91 -1.298 -6.254 12.773 1.00 0.00 C ATOM 1324 O ASN A 91 -2.275 -6.399 13.483 1.00 0.00 O ATOM 1325 CB ASN A 91 0.147 -4.701 14.103 1.00 0.00 C ATOM 1326 CG ASN A 91 -0.392 -4.876 15.525 1.00 0.00 C ATOM 1327 OD1 ASN A 91 -0.021 -4.145 16.421 1.00 0.00 O ATOM 1328 ND2 ASN A 91 -1.257 -5.821 15.769 1.00 0.00 N ATOM 0 H ASN A 91 1.147 -5.175 11.722 1.00 0.00 H new ATOM 0 HA ASN A 91 0.326 -6.835 14.075 1.00 0.00 H new ATOM 0 HB2 ASN A 91 1.173 -4.333 14.135 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -0.442 -3.956 13.569 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -1.622 -5.947 16.713 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -1.568 -6.435 15.016 1.00 0.00 H new ATOM 1335 N TYR A 92 -1.387 -6.283 11.469 1.00 0.00 N ATOM 1336 CA TYR A 92 -2.703 -6.496 10.808 1.00 0.00 C ATOM 1337 C TYR A 92 -2.519 -7.424 9.604 1.00 0.00 C ATOM 1338 O TYR A 92 -1.449 -7.508 9.035 1.00 0.00 O ATOM 1339 CB TYR A 92 -3.270 -5.155 10.342 1.00 0.00 C ATOM 1340 CG TYR A 92 -4.622 -5.365 9.699 1.00 0.00 C ATOM 1341 CD1 TYR A 92 -5.669 -5.941 10.432 1.00 0.00 C ATOM 1342 CD2 TYR A 92 -4.831 -4.982 8.368 1.00 0.00 C ATOM 1343 CE1 TYR A 92 -6.921 -6.134 9.835 1.00 0.00 C ATOM 1344 CE2 TYR A 92 -6.083 -5.175 7.770 1.00 0.00 C ATOM 1345 CZ TYR A 92 -7.126 -5.751 8.504 1.00 0.00 C ATOM 1346 OH TYR A 92 -8.360 -5.941 7.914 1.00 0.00 O ATOM 0 H TYR A 92 -0.599 -6.167 10.832 1.00 0.00 H new ATOM 0 HA TYR A 92 -3.397 -6.949 11.516 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -3.362 -4.475 11.189 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -2.588 -4.689 9.631 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -5.510 -6.236 11.459 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -4.026 -4.537 7.802 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -7.727 -6.578 10.400 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -6.243 -4.880 6.744 1.00 0.00 H new ATOM 0 HH TYR A 92 -8.333 -5.620 6.988 1.00 0.00 H new ATOM 1356 N PHE A 93 -3.553 -8.125 9.210 1.00 0.00 N ATOM 1357 CA PHE A 93 -3.430 -9.051 8.043 1.00 0.00 C ATOM 1358 C PHE A 93 -4.639 -8.880 7.118 1.00 0.00 C ATOM 1359 O PHE A 93 -5.739 -8.615 7.561 1.00 0.00 O ATOM 1360 CB PHE A 93 -3.376 -10.495 8.544 1.00 0.00 C ATOM 1361 CG PHE A 93 -4.457 -10.713 9.576 1.00 0.00 C ATOM 1362 CD1 PHE A 93 -4.242 -10.331 10.906 1.00 0.00 C ATOM 1363 CD2 PHE A 93 -5.673 -11.297 9.202 1.00 0.00 C ATOM 1364 CE1 PHE A 93 -5.244 -10.533 11.862 1.00 0.00 C ATOM 1365 CE2 PHE A 93 -6.675 -11.498 10.158 1.00 0.00 C ATOM 1366 CZ PHE A 93 -6.461 -11.118 11.488 1.00 0.00 C ATOM 0 H PHE A 93 -4.475 -8.096 9.645 1.00 0.00 H new ATOM 0 HA PHE A 93 -2.518 -8.819 7.493 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -3.510 -11.185 7.711 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -2.398 -10.704 8.977 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -3.303 -9.881 11.194 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -5.838 -11.592 8.176 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -5.079 -10.238 12.888 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -7.614 -11.947 9.869 1.00 0.00 H new ATOM 0 HZ PHE A 93 -7.234 -11.276 12.226 1.00 0.00 H new ATOM 1376 N ALA A 94 -4.447 -9.038 5.834 1.00 0.00 N ATOM 1377 CA ALA A 94 -5.588 -8.891 4.884 1.00 0.00 C ATOM 1378 C ALA A 94 -5.133 -9.268 3.468 1.00 0.00 C ATOM 1379 O ALA A 94 -5.681 -8.803 2.485 1.00 0.00 O ATOM 1380 CB ALA A 94 -6.088 -7.439 4.901 1.00 0.00 C ATOM 0 H ALA A 94 -3.550 -9.262 5.403 1.00 0.00 H new ATOM 0 HA ALA A 94 -6.399 -9.554 5.187 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -6.921 -7.333 4.207 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -6.418 -7.180 5.907 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -5.279 -6.772 4.602 1.00 0.00 H new ATOM 1386 N TRP A 95 -4.139 -10.104 3.353 1.00 0.00 N ATOM 1387 CA TRP A 95 -3.654 -10.509 2.001 1.00 0.00 C ATOM 1388 C TRP A 95 -4.790 -11.194 1.236 1.00 0.00 C ATOM 1389 O TRP A 95 -5.711 -11.729 1.822 1.00 0.00 O ATOM 1390 CB TRP A 95 -2.483 -11.487 2.151 1.00 0.00 C ATOM 1391 CG TRP A 95 -1.243 -10.734 2.511 1.00 0.00 C ATOM 1392 CD1 TRP A 95 -0.885 -10.381 3.767 1.00 0.00 C ATOM 1393 CD2 TRP A 95 -0.191 -10.242 1.631 1.00 0.00 C ATOM 1394 NE1 TRP A 95 0.319 -9.701 3.715 1.00 0.00 N ATOM 1395 CE2 TRP A 95 0.787 -9.590 2.420 1.00 0.00 C ATOM 1396 CE3 TRP A 95 0.008 -10.297 0.240 1.00 0.00 C ATOM 1397 CZ2 TRP A 95 1.921 -9.014 1.848 1.00 0.00 C ATOM 1398 CZ3 TRP A 95 1.148 -9.717 -0.339 1.00 0.00 C ATOM 1399 CH2 TRP A 95 2.103 -9.077 0.463 1.00 0.00 C ATOM 0 H TRP A 95 -3.640 -10.525 4.137 1.00 0.00 H new ATOM 0 HA TRP A 95 -3.325 -9.626 1.454 1.00 0.00 H new ATOM 0 HB2 TRP A 95 -2.709 -12.225 2.921 1.00 0.00 H new ATOM 0 HB3 TRP A 95 -2.331 -12.034 1.220 1.00 0.00 H new ATOM 0 HD1 TRP A 95 -1.447 -10.595 4.664 1.00 0.00 H new ATOM 0 HE1 TRP A 95 0.802 -9.328 4.532 1.00 0.00 H new ATOM 0 HE3 TRP A 95 -0.721 -10.789 -0.387 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 2.654 -8.522 2.471 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 1.290 -9.764 -1.409 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.978 -8.633 0.012 1.00 0.00 H new ATOM 1410 N GLU A 96 -4.731 -11.181 -0.068 1.00 0.00 N ATOM 1411 CA GLU A 96 -5.806 -11.830 -0.870 1.00 0.00 C ATOM 1412 C GLU A 96 -5.652 -13.351 -0.792 1.00 0.00 C ATOM 1413 O GLU A 96 -6.616 -14.075 -0.646 1.00 0.00 O ATOM 1414 CB GLU A 96 -5.695 -11.373 -2.330 1.00 0.00 C ATOM 1415 CG GLU A 96 -6.634 -12.205 -3.213 1.00 0.00 C ATOM 1416 CD GLU A 96 -8.040 -12.212 -2.608 1.00 0.00 C ATOM 1417 OE1 GLU A 96 -8.459 -11.176 -2.120 1.00 0.00 O ATOM 1418 OE2 GLU A 96 -8.672 -13.254 -2.644 1.00 0.00 O ATOM 0 H GLU A 96 -3.984 -10.749 -0.612 1.00 0.00 H new ATOM 0 HA GLU A 96 -6.781 -11.546 -0.475 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -5.949 -10.316 -2.409 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -4.667 -11.480 -2.676 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -6.663 -11.791 -4.221 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -6.259 -13.225 -3.299 1.00 0.00 H new ATOM 1564 N HIS A 107 7.696 -9.339 -4.280 1.00 0.00 N ATOM 1565 CA HIS A 107 8.135 -8.906 -2.922 1.00 0.00 C ATOM 1566 C HIS A 107 7.501 -7.554 -2.584 1.00 0.00 C ATOM 1567 O HIS A 107 8.056 -6.762 -1.846 1.00 0.00 O ATOM 1568 CB HIS A 107 9.663 -8.788 -2.888 1.00 0.00 C ATOM 1569 CG HIS A 107 10.269 -9.888 -3.716 1.00 0.00 C ATOM 1570 ND1 HIS A 107 10.061 -11.226 -3.433 1.00 0.00 N ATOM 1571 CD2 HIS A 107 11.079 -9.864 -4.823 1.00 0.00 C ATOM 1572 CE1 HIS A 107 10.733 -11.940 -4.351 1.00 0.00 C ATOM 1573 NE2 HIS A 107 11.371 -11.159 -5.221 1.00 0.00 N ATOM 0 HA HIS A 107 7.817 -9.644 -2.186 1.00 0.00 H new ATOM 0 HB2 HIS A 107 9.972 -7.816 -3.273 1.00 0.00 H new ATOM 0 HB3 HIS A 107 10.021 -8.852 -1.860 1.00 0.00 H new ATOM 0 HD2 HIS A 107 11.436 -8.969 -5.311 1.00 0.00 H new ATOM 0 HE1 HIS A 107 10.754 -13.019 -4.380 1.00 0.00 H new ATOM 0 HE2 HIS A 107 11.949 -11.451 -6.009 1.00 0.00 H new ATOM 1581 N CYS A 108 6.335 -7.288 -3.109 1.00 0.00 N ATOM 1582 CA CYS A 108 5.654 -5.992 -2.812 1.00 0.00 C ATOM 1583 C CYS A 108 4.138 -6.195 -2.891 1.00 0.00 C ATOM 1584 O CYS A 108 3.642 -6.885 -3.760 1.00 0.00 O ATOM 1585 CB CYS A 108 6.094 -4.936 -3.826 1.00 0.00 C ATOM 1586 SG CYS A 108 7.729 -4.314 -3.365 1.00 0.00 S ATOM 0 H CYS A 108 5.823 -7.913 -3.732 1.00 0.00 H new ATOM 0 HA CYS A 108 5.923 -5.653 -1.812 1.00 0.00 H new ATOM 0 HB2 CYS A 108 6.124 -5.366 -4.827 1.00 0.00 H new ATOM 0 HB3 CYS A 108 5.374 -4.118 -3.852 1.00 0.00 H new ATOM 1591 N ALA A 109 3.400 -5.612 -1.981 1.00 0.00 N ATOM 1592 CA ALA A 109 1.915 -5.790 -1.995 1.00 0.00 C ATOM 1593 C ALA A 109 1.221 -4.521 -2.506 1.00 0.00 C ATOM 1594 O ALA A 109 1.672 -3.405 -2.295 1.00 0.00 O ATOM 1595 CB ALA A 109 1.424 -6.113 -0.578 1.00 0.00 C ATOM 0 H ALA A 109 3.759 -5.022 -1.231 1.00 0.00 H new ATOM 0 HA ALA A 109 1.669 -6.613 -2.666 1.00 0.00 H new ATOM 0 HB1 ALA A 109 0.342 -6.243 -0.589 1.00 0.00 H new ATOM 0 HB2 ALA A 109 1.896 -7.032 -0.230 1.00 0.00 H new ATOM 0 HB3 ALA A 109 1.685 -5.294 0.093 1.00 0.00 H new ATOM 1601 N SER A 110 0.118 -4.703 -3.178 1.00 0.00 N ATOM 1602 CA SER A 110 -0.651 -3.552 -3.728 1.00 0.00 C ATOM 1603 C SER A 110 -2.142 -3.814 -3.503 1.00 0.00 C ATOM 1604 O SER A 110 -2.548 -4.923 -3.217 1.00 0.00 O ATOM 1605 CB SER A 110 -0.365 -3.422 -5.230 1.00 0.00 C ATOM 1606 OG SER A 110 0.778 -4.201 -5.557 1.00 0.00 O ATOM 0 H SER A 110 -0.290 -5.618 -3.372 1.00 0.00 H new ATOM 0 HA SER A 110 -0.359 -2.627 -3.230 1.00 0.00 H new ATOM 0 HB2 SER A 110 -1.226 -3.758 -5.807 1.00 0.00 H new ATOM 0 HB3 SER A 110 -0.195 -2.377 -5.491 1.00 0.00 H new ATOM 0 HG SER A 110 1.575 -3.796 -5.156 1.00 0.00 H new ATOM 1612 N LEU A 111 -2.964 -2.812 -3.628 1.00 0.00 N ATOM 1613 CA LEU A 111 -4.423 -3.018 -3.422 1.00 0.00 C ATOM 1614 C LEU A 111 -5.039 -3.501 -4.734 1.00 0.00 C ATOM 1615 O LEU A 111 -4.525 -3.240 -5.803 1.00 0.00 O ATOM 1616 CB LEU A 111 -5.076 -1.692 -3.014 1.00 0.00 C ATOM 1617 CG LEU A 111 -4.581 -1.261 -1.620 1.00 0.00 C ATOM 1618 CD1 LEU A 111 -4.227 0.228 -1.632 1.00 0.00 C ATOM 1619 CD2 LEU A 111 -5.683 -1.498 -0.585 1.00 0.00 C ATOM 0 H LEU A 111 -2.689 -1.859 -3.864 1.00 0.00 H new ATOM 0 HA LEU A 111 -4.586 -3.756 -2.637 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -4.838 -0.921 -3.747 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -6.161 -1.800 -3.005 1.00 0.00 H new ATOM 0 HG LEU A 111 -3.699 -1.847 -1.363 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -3.878 0.527 -0.644 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -3.441 0.409 -2.365 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -5.110 0.810 -1.896 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -5.329 -1.192 0.400 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.564 -0.914 -0.852 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -5.942 -2.557 -0.565 1.00 0.00 H new ATOM 1631 N SER A 112 -6.127 -4.217 -4.661 1.00 0.00 N ATOM 1632 CA SER A 112 -6.780 -4.735 -5.902 1.00 0.00 C ATOM 1633 C SER A 112 -8.235 -4.264 -5.948 1.00 0.00 C ATOM 1634 O SER A 112 -9.040 -4.629 -5.115 1.00 0.00 O ATOM 1635 CB SER A 112 -6.747 -6.264 -5.885 1.00 0.00 C ATOM 1636 OG SER A 112 -5.460 -6.700 -5.466 1.00 0.00 O ATOM 0 H SER A 112 -6.596 -4.468 -3.791 1.00 0.00 H new ATOM 0 HA SER A 112 -6.248 -4.362 -6.778 1.00 0.00 H new ATOM 0 HB2 SER A 112 -7.512 -6.649 -5.210 1.00 0.00 H new ATOM 0 HB3 SER A 112 -6.971 -6.655 -6.877 1.00 0.00 H new ATOM 0 HG SER A 112 -4.774 -6.277 -6.023 1.00 0.00 H new ATOM 1642 N ARG A 113 -8.582 -3.456 -6.914 1.00 0.00 N ATOM 1643 CA ARG A 113 -9.991 -2.971 -6.996 1.00 0.00 C ATOM 1644 C ARG A 113 -10.943 -4.170 -7.025 1.00 0.00 C ATOM 1645 O ARG A 113 -12.051 -4.106 -6.531 1.00 0.00 O ATOM 1646 CB ARG A 113 -10.180 -2.144 -8.270 1.00 0.00 C ATOM 1647 CG ARG A 113 -11.648 -1.719 -8.391 1.00 0.00 C ATOM 1648 CD ARG A 113 -11.808 -0.723 -9.543 1.00 0.00 C ATOM 1649 NE ARG A 113 -11.902 -1.468 -10.833 1.00 0.00 N ATOM 1650 CZ ARG A 113 -12.928 -1.290 -11.621 1.00 0.00 C ATOM 1651 NH1 ARG A 113 -14.104 -1.036 -11.117 1.00 0.00 N ATOM 1652 NH2 ARG A 113 -12.778 -1.366 -12.916 1.00 0.00 N ATOM 0 H ARG A 113 -7.957 -3.113 -7.644 1.00 0.00 H new ATOM 0 HA ARG A 113 -10.208 -2.351 -6.126 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -9.537 -1.264 -8.244 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -9.886 -2.728 -9.142 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -12.276 -2.593 -8.564 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -11.983 -1.266 -7.458 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -12.702 -0.118 -9.394 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -10.960 -0.038 -9.567 1.00 0.00 H new ATOM 0 HE ARG A 113 -11.163 -2.118 -11.100 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -14.223 -0.976 -10.106 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -14.904 -0.897 -11.734 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -11.859 -1.564 -13.312 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -13.580 -1.227 -13.531 1.00 0.00 H new ATOM 1666 N SER A 114 -10.522 -5.263 -7.602 1.00 0.00 N ATOM 1667 CA SER A 114 -11.406 -6.461 -7.664 1.00 0.00 C ATOM 1668 C SER A 114 -11.791 -6.892 -6.246 1.00 0.00 C ATOM 1669 O SER A 114 -12.709 -7.666 -6.052 1.00 0.00 O ATOM 1670 CB SER A 114 -10.667 -7.604 -8.361 1.00 0.00 C ATOM 1671 OG SER A 114 -11.318 -8.833 -8.067 1.00 0.00 O ATOM 0 H SER A 114 -9.605 -5.378 -8.033 1.00 0.00 H new ATOM 0 HA SER A 114 -12.308 -6.215 -8.224 1.00 0.00 H new ATOM 0 HB2 SER A 114 -10.649 -7.437 -9.438 1.00 0.00 H new ATOM 0 HB3 SER A 114 -9.630 -7.639 -8.027 1.00 0.00 H new ATOM 0 HG SER A 114 -10.847 -9.567 -8.514 1.00 0.00 H new ATOM 1677 N THR A 115 -11.095 -6.400 -5.255 1.00 0.00 N ATOM 1678 CA THR A 115 -11.413 -6.780 -3.845 1.00 0.00 C ATOM 1679 C THR A 115 -11.807 -5.528 -3.057 1.00 0.00 C ATOM 1680 O THR A 115 -11.621 -5.454 -1.860 1.00 0.00 O ATOM 1681 CB THR A 115 -10.181 -7.423 -3.203 1.00 0.00 C ATOM 1682 OG1 THR A 115 -9.098 -6.504 -3.239 1.00 0.00 O ATOM 1683 CG2 THR A 115 -9.805 -8.690 -3.973 1.00 0.00 C ATOM 0 H THR A 115 -10.317 -5.749 -5.361 1.00 0.00 H new ATOM 0 HA THR A 115 -12.240 -7.490 -3.835 1.00 0.00 H new ATOM 0 HB THR A 115 -10.403 -7.683 -2.168 1.00 0.00 H new ATOM 0 HG1 THR A 115 -9.360 -5.710 -3.750 1.00 0.00 H new ATOM 0 HG21 THR A 115 -8.928 -9.147 -3.515 1.00 0.00 H new ATOM 0 HG22 THR A 115 -10.637 -9.393 -3.945 1.00 0.00 H new ATOM 0 HG23 THR A 115 -9.582 -8.434 -5.009 1.00 0.00 H new ATOM 1691 N ALA A 116 -12.349 -4.546 -3.723 1.00 0.00 N ATOM 1692 CA ALA A 116 -12.755 -3.296 -3.017 1.00 0.00 C ATOM 1693 C ALA A 116 -11.529 -2.657 -2.360 1.00 0.00 C ATOM 1694 O ALA A 116 -11.637 -1.945 -1.383 1.00 0.00 O ATOM 1695 CB ALA A 116 -13.796 -3.632 -1.947 1.00 0.00 C ATOM 0 H ALA A 116 -12.529 -4.554 -4.727 1.00 0.00 H new ATOM 0 HA ALA A 116 -13.185 -2.596 -3.734 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -14.094 -2.720 -1.430 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -14.669 -4.084 -2.418 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -13.368 -4.332 -1.230 1.00 0.00 H new ATOM 1701 N PHE A 117 -10.366 -2.902 -2.897 1.00 0.00 N ATOM 1702 CA PHE A 117 -9.129 -2.310 -2.313 1.00 0.00 C ATOM 1703 C PHE A 117 -9.007 -2.724 -0.846 1.00 0.00 C ATOM 1704 O PHE A 117 -8.348 -2.072 -0.061 1.00 0.00 O ATOM 1705 CB PHE A 117 -9.192 -0.783 -2.402 1.00 0.00 C ATOM 1706 CG PHE A 117 -9.580 -0.366 -3.800 1.00 0.00 C ATOM 1707 CD1 PHE A 117 -8.593 -0.194 -4.778 1.00 0.00 C ATOM 1708 CD2 PHE A 117 -10.925 -0.145 -4.117 1.00 0.00 C ATOM 1709 CE1 PHE A 117 -8.951 0.200 -6.073 1.00 0.00 C ATOM 1710 CE2 PHE A 117 -11.284 0.247 -5.414 1.00 0.00 C ATOM 1711 CZ PHE A 117 -10.296 0.420 -6.391 1.00 0.00 C ATOM 0 H PHE A 117 -10.218 -3.489 -3.718 1.00 0.00 H new ATOM 0 HA PHE A 117 -8.264 -2.670 -2.870 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -9.916 -0.398 -1.684 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -8.225 -0.354 -2.140 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -7.555 -0.365 -4.533 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -11.686 -0.276 -3.362 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -8.189 0.334 -6.827 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -12.322 0.416 -5.660 1.00 0.00 H new ATOM 0 HZ PHE A 117 -10.572 0.723 -7.390 1.00 0.00 H new ATOM 1721 N LEU A 118 -9.637 -3.803 -0.469 1.00 0.00 N ATOM 1722 CA LEU A 118 -9.561 -4.259 0.948 1.00 0.00 C ATOM 1723 C LEU A 118 -8.521 -5.374 1.074 1.00 0.00 C ATOM 1724 O LEU A 118 -7.967 -5.600 2.132 1.00 0.00 O ATOM 1725 CB LEU A 118 -10.930 -4.788 1.382 1.00 0.00 C ATOM 1726 CG LEU A 118 -11.917 -3.624 1.538 1.00 0.00 C ATOM 1727 CD1 LEU A 118 -13.302 -4.178 1.877 1.00 0.00 C ATOM 1728 CD2 LEU A 118 -11.451 -2.686 2.661 1.00 0.00 C ATOM 0 H LEU A 118 -10.202 -4.390 -1.083 1.00 0.00 H new ATOM 0 HA LEU A 118 -9.272 -3.423 1.584 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -11.305 -5.497 0.645 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -10.839 -5.327 2.325 1.00 0.00 H new ATOM 0 HG LEU A 118 -11.962 -3.064 0.604 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -14.006 -3.354 1.989 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -13.637 -4.835 1.075 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -13.251 -4.740 2.809 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -12.158 -1.863 2.764 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -11.399 -3.239 3.599 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -10.465 -2.289 2.418 1.00 0.00 H new ATOM 1740 N ARG A 119 -8.249 -6.072 0.003 1.00 0.00 N ATOM 1741 CA ARG A 119 -7.242 -7.172 0.059 1.00 0.00 C ATOM 1742 C ARG A 119 -5.936 -6.700 -0.580 1.00 0.00 C ATOM 1743 O ARG A 119 -5.892 -5.681 -1.241 1.00 0.00 O ATOM 1744 CB ARG A 119 -7.774 -8.388 -0.704 1.00 0.00 C ATOM 1745 CG ARG A 119 -9.065 -8.882 -0.045 1.00 0.00 C ATOM 1746 CD ARG A 119 -8.763 -9.432 1.354 1.00 0.00 C ATOM 1747 NE ARG A 119 -9.789 -10.449 1.720 1.00 0.00 N ATOM 1748 CZ ARG A 119 -11.050 -10.116 1.763 1.00 0.00 C ATOM 1749 NH1 ARG A 119 -11.443 -9.146 2.544 1.00 0.00 N ATOM 1750 NH2 ARG A 119 -11.918 -10.752 1.026 1.00 0.00 N ATOM 0 H ARG A 119 -8.681 -5.927 -0.909 1.00 0.00 H new ATOM 0 HA ARG A 119 -7.059 -7.446 1.098 1.00 0.00 H new ATOM 0 HB2 ARG A 119 -7.963 -8.123 -1.744 1.00 0.00 H new ATOM 0 HB3 ARG A 119 -7.028 -9.183 -0.708 1.00 0.00 H new ATOM 0 HG2 ARG A 119 -9.783 -8.065 0.024 1.00 0.00 H new ATOM 0 HG3 ARG A 119 -9.522 -9.658 -0.659 1.00 0.00 H new ATOM 0 HD2 ARG A 119 -7.769 -9.879 1.374 1.00 0.00 H new ATOM 0 HD3 ARG A 119 -8.763 -8.622 2.083 1.00 0.00 H new ATOM 0 HE ARG A 119 -9.506 -11.405 1.937 1.00 0.00 H new ATOM 0 HH11 ARG A 119 -10.764 -8.649 3.120 1.00 0.00 H new ATOM 0 HH12 ARG A 119 -12.429 -8.886 2.578 1.00 0.00 H new ATOM 0 HH21 ARG A 119 -11.611 -11.510 0.416 1.00 0.00 H new ATOM 0 HH22 ARG A 119 -12.904 -10.492 1.060 1.00 0.00 H new ATOM 1764 N TRP A 120 -4.868 -7.430 -0.385 1.00 0.00 N ATOM 1765 CA TRP A 120 -3.557 -7.024 -0.976 1.00 0.00 C ATOM 1766 C TRP A 120 -3.067 -8.105 -1.943 1.00 0.00 C ATOM 1767 O TRP A 120 -3.100 -9.282 -1.640 1.00 0.00 O ATOM 1768 CB TRP A 120 -2.528 -6.853 0.143 1.00 0.00 C ATOM 1769 CG TRP A 120 -3.136 -6.084 1.271 1.00 0.00 C ATOM 1770 CD1 TRP A 120 -3.914 -4.987 1.140 1.00 0.00 C ATOM 1771 CD2 TRP A 120 -3.027 -6.341 2.698 1.00 0.00 C ATOM 1772 NE1 TRP A 120 -4.289 -4.553 2.400 1.00 0.00 N ATOM 1773 CE2 TRP A 120 -3.767 -5.358 3.393 1.00 0.00 C ATOM 1774 CE3 TRP A 120 -2.362 -7.327 3.449 1.00 0.00 C ATOM 1775 CZ2 TRP A 120 -3.845 -5.352 4.787 1.00 0.00 C ATOM 1776 CZ3 TRP A 120 -2.439 -7.325 4.849 1.00 0.00 C ATOM 1777 CH2 TRP A 120 -3.177 -6.339 5.517 1.00 0.00 C ATOM 0 H TRP A 120 -4.847 -8.292 0.160 1.00 0.00 H new ATOM 0 HA TRP A 120 -3.682 -6.084 -1.514 1.00 0.00 H new ATOM 0 HB2 TRP A 120 -2.192 -7.829 0.494 1.00 0.00 H new ATOM 0 HB3 TRP A 120 -1.649 -6.330 -0.234 1.00 0.00 H new ATOM 0 HD1 TRP A 120 -4.197 -4.525 0.206 1.00 0.00 H new ATOM 0 HE1 TRP A 120 -4.878 -3.739 2.573 1.00 0.00 H new ATOM 0 HE3 TRP A 120 -1.789 -8.090 2.944 1.00 0.00 H new ATOM 0 HZ2 TRP A 120 -4.417 -4.591 5.297 1.00 0.00 H new ATOM 0 HZ3 TRP A 120 -1.926 -8.088 5.416 1.00 0.00 H new ATOM 0 HH2 TRP A 120 -3.230 -6.342 6.596 1.00 0.00 H new ATOM 1788 N LYS A 121 -2.601 -7.711 -3.100 1.00 0.00 N ATOM 1789 CA LYS A 121 -2.093 -8.708 -4.090 1.00 0.00 C ATOM 1790 C LYS A 121 -0.601 -8.488 -4.304 1.00 0.00 C ATOM 1791 O LYS A 121 -0.115 -7.375 -4.275 1.00 0.00 O ATOM 1792 CB LYS A 121 -2.836 -8.540 -5.418 1.00 0.00 C ATOM 1793 CG LYS A 121 -2.541 -9.739 -6.325 1.00 0.00 C ATOM 1794 CD LYS A 121 -3.453 -9.689 -7.553 1.00 0.00 C ATOM 1795 CE LYS A 121 -3.347 -11.007 -8.322 1.00 0.00 C ATOM 1796 NZ LYS A 121 -1.924 -11.253 -8.689 1.00 0.00 N ATOM 0 H LYS A 121 -2.550 -6.738 -3.403 1.00 0.00 H new ATOM 0 HA LYS A 121 -2.262 -9.716 -3.712 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -3.908 -8.461 -5.239 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -2.525 -7.616 -5.906 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -1.496 -9.725 -6.635 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -2.700 -10.669 -5.779 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -4.485 -9.517 -7.246 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -3.169 -8.856 -8.197 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -3.724 -11.828 -7.712 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -3.964 -10.968 -9.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -1.879 -11.959 -9.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -1.491 -10.365 -9.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -1.408 -11.607 -7.859 1.00 0.00 H new ATOM 1810 N ASP A 122 0.133 -9.545 -4.506 1.00 0.00 N ATOM 1811 CA ASP A 122 1.597 -9.399 -4.706 1.00 0.00 C ATOM 1812 C ASP A 122 1.872 -8.799 -6.087 1.00 0.00 C ATOM 1813 O ASP A 122 1.136 -9.016 -7.028 1.00 0.00 O ATOM 1814 CB ASP A 122 2.267 -10.770 -4.600 1.00 0.00 C ATOM 1815 CG ASP A 122 1.546 -11.764 -5.513 1.00 0.00 C ATOM 1816 OD1 ASP A 122 1.643 -11.609 -6.719 1.00 0.00 O ATOM 1817 OD2 ASP A 122 0.906 -12.662 -4.989 1.00 0.00 O ATOM 0 H ASP A 122 -0.218 -10.502 -4.541 1.00 0.00 H new ATOM 0 HA ASP A 122 2.001 -8.738 -3.940 1.00 0.00 H new ATOM 0 HB2 ASP A 122 3.317 -10.696 -4.883 1.00 0.00 H new ATOM 0 HB3 ASP A 122 2.239 -11.121 -3.569 1.00 0.00 H new ATOM 1822 N TYR A 123 2.931 -8.042 -6.216 1.00 0.00 N ATOM 1823 CA TYR A 123 3.251 -7.429 -7.539 1.00 0.00 C ATOM 1824 C TYR A 123 4.761 -7.173 -7.633 1.00 0.00 C ATOM 1825 O TYR A 123 5.439 -7.020 -6.636 1.00 0.00 O ATOM 1826 CB TYR A 123 2.485 -6.105 -7.680 1.00 0.00 C ATOM 1827 CG TYR A 123 1.235 -6.324 -8.501 1.00 0.00 C ATOM 1828 CD1 TYR A 123 1.317 -6.381 -9.898 1.00 0.00 C ATOM 1829 CD2 TYR A 123 -0.003 -6.469 -7.865 1.00 0.00 C ATOM 1830 CE1 TYR A 123 0.160 -6.585 -10.658 1.00 0.00 C ATOM 1831 CE2 TYR A 123 -1.160 -6.673 -8.625 1.00 0.00 C ATOM 1832 CZ TYR A 123 -1.079 -6.731 -10.023 1.00 0.00 C ATOM 1833 OH TYR A 123 -2.220 -6.930 -10.772 1.00 0.00 O ATOM 0 H TYR A 123 3.586 -7.823 -5.465 1.00 0.00 H new ATOM 0 HA TYR A 123 2.955 -8.105 -8.341 1.00 0.00 H new ATOM 0 HB2 TYR A 123 2.222 -5.719 -6.695 1.00 0.00 H new ATOM 0 HB3 TYR A 123 3.118 -5.357 -8.157 1.00 0.00 H new ATOM 0 HD1 TYR A 123 2.273 -6.268 -10.388 1.00 0.00 H new ATOM 0 HD2 TYR A 123 -0.065 -6.423 -6.788 1.00 0.00 H new ATOM 0 HE1 TYR A 123 0.223 -6.630 -11.735 1.00 0.00 H new ATOM 0 HE2 TYR A 123 -2.115 -6.786 -8.134 1.00 0.00 H new ATOM 0 HH TYR A 123 -3.010 -6.771 -10.214 1.00 0.00 H new ATOM 1843 N ASN A 124 5.290 -7.125 -8.829 1.00 0.00 N ATOM 1844 CA ASN A 124 6.752 -6.879 -8.991 1.00 0.00 C ATOM 1845 C ASN A 124 7.119 -5.547 -8.336 1.00 0.00 C ATOM 1846 O ASN A 124 6.633 -4.504 -8.714 1.00 0.00 O ATOM 1847 CB ASN A 124 7.098 -6.829 -10.482 1.00 0.00 C ATOM 1848 CG ASN A 124 6.699 -8.149 -11.144 1.00 0.00 C ATOM 1849 OD1 ASN A 124 7.527 -8.830 -11.714 1.00 0.00 O ATOM 1850 ND2 ASN A 124 5.455 -8.540 -11.093 1.00 0.00 N ATOM 0 H ASN A 124 4.772 -7.246 -9.699 1.00 0.00 H new ATOM 0 HA ASN A 124 7.312 -7.684 -8.515 1.00 0.00 H new ATOM 0 HB2 ASN A 124 6.577 -5.999 -10.959 1.00 0.00 H new ATOM 0 HB3 ASN A 124 8.166 -6.653 -10.613 1.00 0.00 H new ATOM 0 HD21 ASN A 124 5.178 -9.418 -11.532 1.00 0.00 H new ATOM 0 HD22 ASN A 124 4.760 -7.968 -10.614 1.00 0.00 H new ATOM 1857 N CYS A 125 7.973 -5.581 -7.352 1.00 0.00 N ATOM 1858 CA CYS A 125 8.374 -4.326 -6.652 1.00 0.00 C ATOM 1859 C CYS A 125 8.777 -3.244 -7.659 1.00 0.00 C ATOM 1860 O CYS A 125 9.060 -2.124 -7.282 1.00 0.00 O ATOM 1861 CB CYS A 125 9.567 -4.618 -5.739 1.00 0.00 C ATOM 1862 SG CYS A 125 9.009 -5.562 -4.301 1.00 0.00 S ATOM 0 H CYS A 125 8.414 -6.430 -6.999 1.00 0.00 H new ATOM 0 HA CYS A 125 7.524 -3.968 -6.070 1.00 0.00 H new ATOM 0 HB2 CYS A 125 10.326 -5.179 -6.283 1.00 0.00 H new ATOM 0 HB3 CYS A 125 10.030 -3.685 -5.418 1.00 0.00 H new ATOM 1867 N ASN A 126 8.825 -3.556 -8.927 1.00 0.00 N ATOM 1868 CA ASN A 126 9.236 -2.524 -9.927 1.00 0.00 C ATOM 1869 C ASN A 126 8.015 -1.984 -10.679 1.00 0.00 C ATOM 1870 O ASN A 126 7.985 -0.834 -11.068 1.00 0.00 O ATOM 1871 CB ASN A 126 10.217 -3.141 -10.925 1.00 0.00 C ATOM 1872 CG ASN A 126 9.645 -4.456 -11.456 1.00 0.00 C ATOM 1873 OD1 ASN A 126 8.611 -4.468 -12.095 1.00 0.00 O ATOM 1874 ND2 ASN A 126 10.278 -5.572 -11.220 1.00 0.00 N ATOM 0 H ASN A 126 8.600 -4.473 -9.313 1.00 0.00 H new ATOM 0 HA ASN A 126 9.715 -1.699 -9.399 1.00 0.00 H new ATOM 0 HB2 ASN A 126 10.396 -2.451 -11.749 1.00 0.00 H new ATOM 0 HB3 ASN A 126 11.179 -3.319 -10.444 1.00 0.00 H new ATOM 0 HD21 ASN A 126 9.905 -6.454 -11.572 1.00 0.00 H new ATOM 0 HD22 ASN A 126 11.146 -5.563 -10.684 1.00 0.00 H new ATOM 1881 N VAL A 127 7.002 -2.784 -10.882 1.00 0.00 N ATOM 1882 CA VAL A 127 5.800 -2.266 -11.601 1.00 0.00 C ATOM 1883 C VAL A 127 5.331 -1.023 -10.853 1.00 0.00 C ATOM 1884 O VAL A 127 5.219 -1.038 -9.644 1.00 0.00 O ATOM 1885 CB VAL A 127 4.693 -3.330 -11.595 1.00 0.00 C ATOM 1886 CG1 VAL A 127 3.325 -2.666 -11.797 1.00 0.00 C ATOM 1887 CG2 VAL A 127 4.943 -4.331 -12.726 1.00 0.00 C ATOM 0 H VAL A 127 6.953 -3.759 -10.587 1.00 0.00 H new ATOM 0 HA VAL A 127 6.038 -2.027 -12.638 1.00 0.00 H new ATOM 0 HB VAL A 127 4.701 -3.848 -10.636 1.00 0.00 H new ATOM 0 HG11 VAL A 127 2.546 -3.428 -11.791 1.00 0.00 H new ATOM 0 HG12 VAL A 127 3.143 -1.955 -10.991 1.00 0.00 H new ATOM 0 HG13 VAL A 127 3.313 -2.142 -12.753 1.00 0.00 H new ATOM 0 HG21 VAL A 127 4.158 -5.087 -12.723 1.00 0.00 H new ATOM 0 HG22 VAL A 127 4.939 -3.808 -13.682 1.00 0.00 H new ATOM 0 HG23 VAL A 127 5.910 -4.812 -12.579 1.00 0.00 H new ATOM 1897 N ARG A 128 5.093 0.069 -11.531 1.00 0.00 N ATOM 1898 CA ARG A 128 4.684 1.281 -10.787 1.00 0.00 C ATOM 1899 C ARG A 128 3.184 1.333 -10.645 1.00 0.00 C ATOM 1900 O ARG A 128 2.472 0.813 -11.479 1.00 0.00 O ATOM 1901 CB ARG A 128 5.168 2.511 -11.565 1.00 0.00 C ATOM 1902 CG ARG A 128 5.244 2.179 -13.060 1.00 0.00 C ATOM 1903 CD ARG A 128 5.485 3.460 -13.871 1.00 0.00 C ATOM 1904 NE ARG A 128 4.294 3.736 -14.724 1.00 0.00 N ATOM 1905 CZ ARG A 128 4.072 3.015 -15.788 1.00 0.00 C ATOM 1906 NH1 ARG A 128 4.776 1.938 -16.005 1.00 0.00 N ATOM 1907 NH2 ARG A 128 3.146 3.370 -16.636 1.00 0.00 N ATOM 0 H ARG A 128 5.163 0.168 -12.544 1.00 0.00 H new ATOM 0 HA ARG A 128 5.123 1.262 -9.789 1.00 0.00 H new ATOM 0 HB2 ARG A 128 4.488 3.347 -11.402 1.00 0.00 H new ATOM 0 HB3 ARG A 128 6.147 2.821 -11.201 1.00 0.00 H new ATOM 0 HG2 ARG A 128 6.049 1.467 -13.242 1.00 0.00 H new ATOM 0 HG3 ARG A 128 4.318 1.703 -13.383 1.00 0.00 H new ATOM 0 HD2 ARG A 128 5.668 4.299 -13.200 1.00 0.00 H new ATOM 0 HD3 ARG A 128 6.374 3.349 -14.492 1.00 0.00 H new ATOM 0 HE ARG A 128 3.652 4.489 -14.475 1.00 0.00 H new ATOM 0 HH11 ARG A 128 5.500 1.660 -15.343 1.00 0.00 H new ATOM 0 HH12 ARG A 128 4.602 1.374 -16.837 1.00 0.00 H new ATOM 0 HH21 ARG A 128 2.595 4.212 -16.467 1.00 0.00 H new ATOM 0 HH22 ARG A 128 2.973 2.806 -17.468 1.00 0.00 H new ATOM 1921 N LEU A 129 2.665 1.955 -9.605 1.00 0.00 N ATOM 1922 CA LEU A 129 1.159 1.968 -9.525 1.00 0.00 C ATOM 1923 C LEU A 129 0.702 3.257 -8.891 1.00 0.00 C ATOM 1924 O LEU A 129 1.469 3.873 -8.177 1.00 0.00 O ATOM 1925 CB LEU A 129 0.696 0.797 -8.640 1.00 0.00 C ATOM 1926 CG LEU A 129 0.480 -0.471 -9.483 1.00 0.00 C ATOM 1927 CD1 LEU A 129 0.752 -1.710 -8.626 1.00 0.00 C ATOM 1928 CD2 LEU A 129 -0.964 -0.519 -9.987 1.00 0.00 C ATOM 0 H LEU A 129 3.174 2.424 -8.856 1.00 0.00 H new ATOM 0 HA LEU A 129 0.740 1.877 -10.527 1.00 0.00 H new ATOM 0 HB2 LEU A 129 1.440 0.603 -7.867 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.231 1.064 -8.131 1.00 0.00 H new ATOM 0 HG LEU A 129 1.163 -0.453 -10.333 1.00 0.00 H new ATOM 0 HD11 LEU A 129 0.598 -2.608 -9.225 1.00 0.00 H new ATOM 0 HD12 LEU A 129 1.781 -1.685 -8.267 1.00 0.00 H new ATOM 0 HD13 LEU A 129 0.071 -1.721 -7.775 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -1.111 -1.419 -10.584 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -1.646 -0.531 -9.137 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -1.165 0.360 -10.600 1.00 0.00 H new ATOM 1940 N PRO A 130 -0.526 3.665 -9.049 1.00 0.00 N ATOM 1941 CA PRO A 130 -0.961 4.879 -8.337 1.00 0.00 C ATOM 1942 C PRO A 130 -0.778 4.589 -6.846 1.00 0.00 C ATOM 1943 O PRO A 130 -0.997 3.472 -6.425 1.00 0.00 O ATOM 1944 CB PRO A 130 -2.437 5.002 -8.734 1.00 0.00 C ATOM 1945 CG PRO A 130 -2.789 3.836 -9.677 1.00 0.00 C ATOM 1946 CD PRO A 130 -1.530 2.983 -9.904 1.00 0.00 C ATOM 0 HA PRO A 130 -0.422 5.798 -8.566 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -3.071 4.977 -7.848 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -2.618 5.957 -9.228 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -3.584 3.228 -9.245 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -3.162 4.219 -10.627 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -1.682 1.946 -9.604 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -1.231 2.971 -10.952 1.00 0.00 H new ATOM 1954 N TYR A 131 -0.323 5.511 -6.045 1.00 0.00 N ATOM 1955 CA TYR A 131 -0.094 5.134 -4.613 1.00 0.00 C ATOM 1956 C TYR A 131 -0.551 6.199 -3.631 1.00 0.00 C ATOM 1957 O TYR A 131 -1.060 7.237 -4.001 1.00 0.00 O ATOM 1958 CB TYR A 131 1.409 4.954 -4.424 1.00 0.00 C ATOM 1959 CG TYR A 131 2.098 6.235 -4.832 1.00 0.00 C ATOM 1960 CD1 TYR A 131 2.175 7.308 -3.932 1.00 0.00 C ATOM 1961 CD2 TYR A 131 2.649 6.358 -6.113 1.00 0.00 C ATOM 1962 CE1 TYR A 131 2.803 8.499 -4.316 1.00 0.00 C ATOM 1963 CE2 TYR A 131 3.275 7.552 -6.494 1.00 0.00 C ATOM 1964 CZ TYR A 131 3.353 8.620 -5.597 1.00 0.00 C ATOM 1965 OH TYR A 131 3.970 9.796 -5.973 1.00 0.00 O ATOM 0 H TYR A 131 -0.105 6.474 -6.300 1.00 0.00 H new ATOM 0 HA TYR A 131 -0.669 4.230 -4.412 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.635 4.717 -3.384 1.00 0.00 H new ATOM 0 HB3 TYR A 131 1.770 4.121 -5.027 1.00 0.00 H new ATOM 0 HD1 TYR A 131 1.750 7.216 -2.943 1.00 0.00 H new ATOM 0 HD2 TYR A 131 2.592 5.533 -6.807 1.00 0.00 H new ATOM 0 HE1 TYR A 131 2.863 9.325 -3.623 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.698 7.647 -7.483 1.00 0.00 H new ATOM 0 HH TYR A 131 4.723 9.977 -5.373 1.00 0.00 H new ATOM 1975 N VAL A 132 -0.333 5.944 -2.357 1.00 0.00 N ATOM 1976 CA VAL A 132 -0.717 6.948 -1.319 1.00 0.00 C ATOM 1977 C VAL A 132 0.468 7.140 -0.375 1.00 0.00 C ATOM 1978 O VAL A 132 1.328 6.285 -0.280 1.00 0.00 O ATOM 1979 CB VAL A 132 -1.927 6.439 -0.532 1.00 0.00 C ATOM 1980 CG1 VAL A 132 -2.252 7.416 0.601 1.00 0.00 C ATOM 1981 CG2 VAL A 132 -3.136 6.330 -1.464 1.00 0.00 C ATOM 0 H VAL A 132 0.092 5.089 -1.998 1.00 0.00 H new ATOM 0 HA VAL A 132 -0.978 7.895 -1.791 1.00 0.00 H new ATOM 0 HB VAL A 132 -1.696 5.459 -0.115 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -3.114 7.051 1.160 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -1.394 7.497 1.269 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -2.479 8.396 0.182 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -3.997 5.967 -0.902 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -3.363 7.311 -1.882 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -2.911 5.634 -2.272 1.00 0.00 H new ATOM 1991 N CYS A 133 0.535 8.235 0.333 1.00 0.00 N ATOM 1992 CA CYS A 133 1.685 8.433 1.270 1.00 0.00 C ATOM 1993 C CYS A 133 1.208 9.091 2.565 1.00 0.00 C ATOM 1994 O CYS A 133 0.419 10.013 2.549 1.00 0.00 O ATOM 1995 CB CYS A 133 2.737 9.346 0.629 1.00 0.00 C ATOM 1996 SG CYS A 133 3.054 8.847 -1.081 1.00 0.00 S ATOM 0 H CYS A 133 -0.146 8.994 0.307 1.00 0.00 H new ATOM 0 HA CYS A 133 2.116 7.456 1.486 1.00 0.00 H new ATOM 0 HB2 CYS A 133 2.393 10.380 0.654 1.00 0.00 H new ATOM 0 HB3 CYS A 133 3.662 9.304 1.204 1.00 0.00 H new ATOM 2001 N LYS A 134 1.718 8.647 3.685 1.00 0.00 N ATOM 2002 CA LYS A 134 1.335 9.265 4.988 1.00 0.00 C ATOM 2003 C LYS A 134 2.474 10.195 5.405 1.00 0.00 C ATOM 2004 O LYS A 134 3.595 10.022 4.971 1.00 0.00 O ATOM 2005 CB LYS A 134 1.128 8.164 6.043 1.00 0.00 C ATOM 2006 CG LYS A 134 2.457 7.821 6.725 1.00 0.00 C ATOM 2007 CD LYS A 134 2.305 6.520 7.519 1.00 0.00 C ATOM 2008 CE LYS A 134 3.403 6.432 8.581 1.00 0.00 C ATOM 2009 NZ LYS A 134 3.308 7.607 9.493 1.00 0.00 N ATOM 0 H LYS A 134 2.386 7.879 3.752 1.00 0.00 H new ATOM 0 HA LYS A 134 0.404 9.824 4.897 1.00 0.00 H new ATOM 0 HB2 LYS A 134 0.405 8.496 6.788 1.00 0.00 H new ATOM 0 HB3 LYS A 134 0.713 7.273 5.572 1.00 0.00 H new ATOM 0 HG2 LYS A 134 3.244 7.714 5.978 1.00 0.00 H new ATOM 0 HG3 LYS A 134 2.757 8.632 7.389 1.00 0.00 H new ATOM 0 HD2 LYS A 134 1.324 6.484 7.993 1.00 0.00 H new ATOM 0 HD3 LYS A 134 2.366 5.664 6.847 1.00 0.00 H new ATOM 0 HE2 LYS A 134 3.300 5.508 9.150 1.00 0.00 H new ATOM 0 HE3 LYS A 134 4.383 6.406 8.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 4.090 8.264 9.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 2.401 8.092 9.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 3.367 7.286 10.480 1.00 0.00 H new ATOM 2023 N PHE A 135 2.213 11.186 6.217 1.00 0.00 N ATOM 2024 CA PHE A 135 3.318 12.115 6.616 1.00 0.00 C ATOM 2025 C PHE A 135 2.805 13.143 7.627 1.00 0.00 C ATOM 2026 O PHE A 135 1.772 13.750 7.437 1.00 0.00 O ATOM 2027 CB PHE A 135 3.835 12.854 5.381 1.00 0.00 C ATOM 2028 CG PHE A 135 2.703 13.597 4.707 1.00 0.00 C ATOM 2029 CD1 PHE A 135 1.904 12.947 3.758 1.00 0.00 C ATOM 2030 CD2 PHE A 135 2.458 14.938 5.027 1.00 0.00 C ATOM 2031 CE1 PHE A 135 0.860 13.638 3.129 1.00 0.00 C ATOM 2032 CE2 PHE A 135 1.415 15.628 4.398 1.00 0.00 C ATOM 2033 CZ PHE A 135 0.616 14.978 3.449 1.00 0.00 C ATOM 0 H PHE A 135 1.298 11.393 6.617 1.00 0.00 H new ATOM 0 HA PHE A 135 4.120 11.531 7.067 1.00 0.00 H new ATOM 0 HB2 PHE A 135 4.619 13.554 5.669 1.00 0.00 H new ATOM 0 HB3 PHE A 135 4.281 12.145 4.684 1.00 0.00 H new ATOM 0 HD1 PHE A 135 2.093 11.913 3.511 1.00 0.00 H new ATOM 0 HD2 PHE A 135 3.074 15.440 5.759 1.00 0.00 H new ATOM 0 HE1 PHE A 135 0.244 13.136 2.397 1.00 0.00 H new ATOM 0 HE2 PHE A 135 1.226 16.662 4.645 1.00 0.00 H new ATOM 0 HZ PHE A 135 -0.188 15.511 2.964 1.00 0.00 H new