USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 962 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: B 94 SER OG : rot -67:sc= 1.22 USER MOD Set 1.2: B 100 HIS : no HD1:sc= -0.126 K(o=1.1,f=0.4) USER MOD Single : B 10 SER OG : rot 180:sc= 0 USER MOD Single : B 16 HIS : no HE2:sc= 0.0832 K(o=0.083,f=-5.9!) USER MOD Single : B 21 TYR OH : rot 180:sc= 0 USER MOD Single : B 24 ASN : amide:sc= -0.207 X(o=-0.21,f=-0.0041) USER MOD Single : B 25 LYS NZ :NH3+ -167:sc=-0.00518 (180deg=-0.147) USER MOD Single : B 30 GLN : amide:sc= -5.69! C(o=-5.7!,f=-6.6!) USER MOD Single : B 39 HIS : no HD1:sc= -0.842 K(o=-0.84,f=0.059) USER MOD Single : B 41 ASN : amide:sc= -0.183 X(o=-0.18,f=-0.023) USER MOD Single : B 42 THR OG1 : rot -158:sc= 0.867 USER MOD Single : B 46 THR OG1 : rot 180:sc= -0.0449 USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 GLN : amide:sc= -0.419 K(o=-0.42,f=-5!) USER MOD Single : B 52 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 53 HIS : no HE2:sc= -0.178 K(o=-0.18,f=-0.97) USER MOD Single : B 56 GLN : amide:sc= -0.378 X(o=-0.38,f=0) USER MOD Single : B 57 MET CE :methyl -162:sc= -0.261 (180deg=-0.928) USER MOD Single : B 62 SER OG : rot 91:sc= 1.2 USER MOD Single : B 64 LYS NZ :NH3+ 178:sc= 2.28 (180deg=2.28) USER MOD Single : B 77 THR OG1 : rot 180:sc= 0.458 USER MOD Single : B 80 GLN : amide:sc= -0.795 K(o=-0.79,f=-0.2) USER MOD Single : B 85 GLN : amide:sc= -0.382 K(o=-0.38,f=-3.2!) USER MOD Single : B 102 MET CE :methyl -117:sc= -3.24 (180deg=-3.78!) USER MOD Single : B 103 LYS NZ :NH3+ 166:sc= -0.0217 (180deg=-0.289) USER MOD Single : B 104 ASN : amide:sc= -1.42! K(o=-1.4!,f=-0.0043) USER MOD Single : B 106 THR OG1 : rot 180:sc= 0 USER MOD Single : B 108 LYS NZ :NH3+ -133:sc= 0.688 (180deg=0.0406) USER MOD Single : B 110 SER OG : rot 180:sc= -0.065 USER MOD Single : B 117 LYS NZ :NH3+ -158:sc= 1.25 (180deg=1.16) USER MOD Single : B 131 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 126 N TRP B 9 -20.975 9.132 5.927 1.00 0.00 N ATOM 127 CA TRP B 9 -21.064 7.882 6.665 1.00 0.00 C ATOM 128 C TRP B 9 -21.308 8.144 8.138 1.00 0.00 C ATOM 129 O TRP B 9 -21.157 9.268 8.621 1.00 0.00 O ATOM 130 CB TRP B 9 -19.791 7.047 6.508 1.00 0.00 C ATOM 131 CG TRP B 9 -19.575 6.523 5.129 1.00 0.00 C ATOM 132 CD1 TRP B 9 -18.916 7.151 4.118 1.00 0.00 C ATOM 133 CD2 TRP B 9 -20.016 5.261 4.602 1.00 0.00 C ATOM 134 NE1 TRP B 9 -18.916 6.366 2.996 1.00 0.00 N ATOM 135 CE2 TRP B 9 -19.580 5.197 3.268 1.00 0.00 C ATOM 136 CE3 TRP B 9 -20.733 4.177 5.126 1.00 0.00 C ATOM 137 CZ2 TRP B 9 -19.837 4.100 2.450 1.00 0.00 C ATOM 138 CZ3 TRP B 9 -20.986 3.087 4.309 1.00 0.00 C ATOM 139 CH2 TRP B 9 -20.537 3.060 2.985 1.00 0.00 C ATOM 0 HA TRP B 9 -21.903 7.324 6.250 1.00 0.00 H new ATOM 0 HB2 TRP B 9 -18.933 7.655 6.793 1.00 0.00 H new ATOM 0 HB3 TRP B 9 -19.832 6.208 7.202 1.00 0.00 H new ATOM 0 HD1 TRP B 9 -18.459 8.127 4.190 1.00 0.00 H new ATOM 0 HE1 TRP B 9 -18.491 6.611 2.102 1.00 0.00 H new ATOM 0 HE3 TRP B 9 -21.082 4.191 6.148 1.00 0.00 H new ATOM 0 HZ2 TRP B 9 -19.493 4.074 1.426 1.00 0.00 H new ATOM 0 HZ3 TRP B 9 -21.538 2.246 4.701 1.00 0.00 H new ATOM 0 HH2 TRP B 9 -20.750 2.196 2.373 1.00 0.00 H new ATOM 150 N SER B 10 -21.688 7.096 8.840 1.00 0.00 N ATOM 151 CA SER B 10 -21.873 7.144 10.272 1.00 0.00 C ATOM 152 C SER B 10 -21.305 5.864 10.872 1.00 0.00 C ATOM 153 O SER B 10 -21.263 4.841 10.187 1.00 0.00 O ATOM 154 CB SER B 10 -23.360 7.285 10.601 1.00 0.00 C ATOM 155 OG SER B 10 -24.118 6.276 9.953 1.00 0.00 O ATOM 0 H SER B 10 -21.878 6.182 8.428 1.00 0.00 H new ATOM 0 HA SER B 10 -21.354 8.005 10.693 1.00 0.00 H new ATOM 0 HB2 SER B 10 -23.506 7.220 11.679 1.00 0.00 H new ATOM 0 HB3 SER B 10 -23.714 8.268 10.290 1.00 0.00 H new ATOM 0 HG SER B 10 -25.066 6.383 10.178 1.00 0.00 H new ATOM 161 N PRO B 11 -20.832 5.906 12.129 1.00 0.00 N ATOM 162 CA PRO B 11 -20.281 4.734 12.826 1.00 0.00 C ATOM 163 C PRO B 11 -21.091 3.454 12.601 1.00 0.00 C ATOM 164 O PRO B 11 -20.522 2.382 12.373 1.00 0.00 O ATOM 165 CB PRO B 11 -20.344 5.157 14.290 1.00 0.00 C ATOM 166 CG PRO B 11 -20.143 6.633 14.258 1.00 0.00 C ATOM 167 CD PRO B 11 -20.762 7.118 12.970 1.00 0.00 C ATOM 0 HA PRO B 11 -19.283 4.482 12.468 1.00 0.00 H new ATOM 0 HB2 PRO B 11 -21.303 4.896 14.738 1.00 0.00 H new ATOM 0 HB3 PRO B 11 -19.572 4.663 14.880 1.00 0.00 H new ATOM 0 HG2 PRO B 11 -20.614 7.108 15.119 1.00 0.00 H new ATOM 0 HG3 PRO B 11 -19.082 6.882 14.297 1.00 0.00 H new ATOM 0 HD2 PRO B 11 -21.751 7.545 13.138 1.00 0.00 H new ATOM 0 HD3 PRO B 11 -20.155 7.894 12.503 1.00 0.00 H new ATOM 175 N GLU B 12 -22.415 3.575 12.653 1.00 0.00 N ATOM 176 CA GLU B 12 -23.297 2.429 12.461 1.00 0.00 C ATOM 177 C GLU B 12 -23.206 1.891 11.029 1.00 0.00 C ATOM 178 O GLU B 12 -23.153 0.681 10.812 1.00 0.00 O ATOM 179 CB GLU B 12 -24.750 2.801 12.787 1.00 0.00 C ATOM 180 CG GLU B 12 -25.291 3.951 11.952 1.00 0.00 C ATOM 181 CD GLU B 12 -26.780 4.145 12.119 1.00 0.00 C ATOM 182 OE1 GLU B 12 -27.193 4.859 13.058 1.00 0.00 O ATOM 183 OE2 GLU B 12 -27.547 3.585 11.308 1.00 0.00 O ATOM 0 H GLU B 12 -22.900 4.455 12.827 1.00 0.00 H new ATOM 0 HA GLU B 12 -22.970 1.645 13.144 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -25.382 1.926 12.636 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -24.819 3.066 13.842 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -24.776 4.870 12.231 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -25.069 3.767 10.901 1.00 0.00 H new ATOM 190 N GLU B 13 -23.162 2.795 10.057 1.00 0.00 N ATOM 191 CA GLU B 13 -23.156 2.407 8.654 1.00 0.00 C ATOM 192 C GLU B 13 -21.770 1.917 8.238 1.00 0.00 C ATOM 193 O GLU B 13 -21.642 1.043 7.386 1.00 0.00 O ATOM 194 CB GLU B 13 -23.590 3.581 7.775 1.00 0.00 C ATOM 195 CG GLU B 13 -23.964 3.180 6.354 1.00 0.00 C ATOM 196 CD GLU B 13 -25.194 2.299 6.304 1.00 0.00 C ATOM 197 OE1 GLU B 13 -26.317 2.825 6.469 1.00 0.00 O ATOM 198 OE2 GLU B 13 -25.051 1.080 6.087 1.00 0.00 O ATOM 0 H GLU B 13 -23.130 3.802 10.216 1.00 0.00 H new ATOM 0 HA GLU B 13 -23.865 1.590 8.520 1.00 0.00 H new ATOM 0 HB2 GLU B 13 -24.443 4.075 8.240 1.00 0.00 H new ATOM 0 HB3 GLU B 13 -22.782 4.311 7.736 1.00 0.00 H new ATOM 0 HG2 GLU B 13 -24.140 4.078 5.761 1.00 0.00 H new ATOM 0 HG3 GLU B 13 -23.126 2.655 5.896 1.00 0.00 H new ATOM 205 N GLU B 14 -20.735 2.476 8.852 1.00 0.00 N ATOM 206 CA GLU B 14 -19.366 2.041 8.588 1.00 0.00 C ATOM 207 C GLU B 14 -19.160 0.624 9.108 1.00 0.00 C ATOM 208 O GLU B 14 -18.475 -0.187 8.485 1.00 0.00 O ATOM 209 CB GLU B 14 -18.362 2.990 9.240 1.00 0.00 C ATOM 210 CG GLU B 14 -18.476 4.421 8.753 1.00 0.00 C ATOM 211 CD GLU B 14 -17.448 5.324 9.391 1.00 0.00 C ATOM 212 OE1 GLU B 14 -16.627 5.911 8.654 1.00 0.00 O ATOM 213 OE2 GLU B 14 -17.449 5.446 10.631 1.00 0.00 O ATOM 0 H GLU B 14 -20.815 3.230 9.535 1.00 0.00 H new ATOM 0 HA GLU B 14 -19.201 2.054 7.511 1.00 0.00 H new ATOM 0 HB2 GLU B 14 -18.505 2.970 10.320 1.00 0.00 H new ATOM 0 HB3 GLU B 14 -17.353 2.628 9.045 1.00 0.00 H new ATOM 0 HG2 GLU B 14 -18.356 4.445 7.670 1.00 0.00 H new ATOM 0 HG3 GLU B 14 -19.475 4.799 8.972 1.00 0.00 H new ATOM 220 N ALA B 15 -19.772 0.328 10.248 1.00 0.00 N ATOM 221 CA ALA B 15 -19.750 -1.019 10.794 1.00 0.00 C ATOM 222 C ALA B 15 -20.499 -1.970 9.868 1.00 0.00 C ATOM 223 O ALA B 15 -20.190 -3.152 9.795 1.00 0.00 O ATOM 224 CB ALA B 15 -20.358 -1.039 12.186 1.00 0.00 C ATOM 0 H ALA B 15 -20.289 1.004 10.811 1.00 0.00 H new ATOM 0 HA ALA B 15 -18.714 -1.350 10.870 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -20.333 -2.055 12.579 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -19.787 -0.382 12.842 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -21.391 -0.694 12.137 1.00 0.00 H new ATOM 230 N HIS B 16 -21.475 -1.426 9.155 1.00 0.00 N ATOM 231 CA HIS B 16 -22.265 -2.175 8.187 1.00 0.00 C ATOM 232 C HIS B 16 -21.479 -2.364 6.891 1.00 0.00 C ATOM 233 O HIS B 16 -21.669 -3.348 6.173 1.00 0.00 O ATOM 234 CB HIS B 16 -23.585 -1.449 7.908 1.00 0.00 C ATOM 235 CG HIS B 16 -24.494 -2.170 6.961 1.00 0.00 C ATOM 236 ND1 HIS B 16 -25.238 -1.521 6.007 1.00 0.00 N ATOM 237 CD2 HIS B 16 -24.790 -3.485 6.836 1.00 0.00 C ATOM 238 CE1 HIS B 16 -25.954 -2.402 5.337 1.00 0.00 C ATOM 239 NE2 HIS B 16 -25.702 -3.603 5.820 1.00 0.00 N ATOM 0 H HIS B 16 -21.743 -0.445 9.232 1.00 0.00 H new ATOM 0 HA HIS B 16 -22.487 -3.158 8.603 1.00 0.00 H new ATOM 0 HB2 HIS B 16 -24.109 -1.296 8.851 1.00 0.00 H new ATOM 0 HB3 HIS B 16 -23.365 -0.462 7.502 1.00 0.00 H new ATOM 0 HD1 HIS B 16 -25.237 -0.514 5.842 1.00 0.00 H new ATOM 0 HD2 HIS B 16 -24.383 -4.292 7.427 1.00 0.00 H new ATOM 0 HE1 HIS B 16 -26.633 -2.178 4.528 1.00 0.00 H new ATOM 248 N LEU B 17 -20.599 -1.414 6.597 1.00 0.00 N ATOM 249 CA LEU B 17 -19.731 -1.509 5.434 1.00 0.00 C ATOM 250 C LEU B 17 -18.813 -2.710 5.588 1.00 0.00 C ATOM 251 O LEU B 17 -18.682 -3.536 4.683 1.00 0.00 O ATOM 252 CB LEU B 17 -18.911 -0.225 5.278 1.00 0.00 C ATOM 253 CG LEU B 17 -18.079 -0.130 3.998 1.00 0.00 C ATOM 254 CD1 LEU B 17 -18.983 -0.122 2.776 1.00 0.00 C ATOM 255 CD2 LEU B 17 -17.203 1.111 4.024 1.00 0.00 C ATOM 0 H LEU B 17 -20.469 -0.568 7.151 1.00 0.00 H new ATOM 0 HA LEU B 17 -20.339 -1.636 4.538 1.00 0.00 H new ATOM 0 HB2 LEU B 17 -19.590 0.627 5.314 1.00 0.00 H new ATOM 0 HB3 LEU B 17 -18.242 -0.135 6.134 1.00 0.00 H new ATOM 0 HG LEU B 17 -17.432 -1.005 3.940 1.00 0.00 H new ATOM 0 HD11 LEU B 17 -18.375 -0.054 1.874 1.00 0.00 H new ATOM 0 HD12 LEU B 17 -19.568 -1.041 2.750 1.00 0.00 H new ATOM 0 HD13 LEU B 17 -19.655 0.735 2.826 1.00 0.00 H new ATOM 0 HD21 LEU B 17 -16.618 1.163 3.106 1.00 0.00 H new ATOM 0 HD22 LEU B 17 -17.831 1.998 4.104 1.00 0.00 H new ATOM 0 HD23 LEU B 17 -16.530 1.064 4.880 1.00 0.00 H new ATOM 267 N ARG B 18 -18.206 -2.824 6.760 1.00 0.00 N ATOM 268 CA ARG B 18 -17.360 -3.957 7.051 1.00 0.00 C ATOM 269 C ARG B 18 -18.217 -5.163 7.382 1.00 0.00 C ATOM 270 O ARG B 18 -17.792 -6.291 7.192 1.00 0.00 O ATOM 271 CB ARG B 18 -16.390 -3.646 8.194 1.00 0.00 C ATOM 272 CG ARG B 18 -17.054 -3.307 9.519 1.00 0.00 C ATOM 273 CD ARG B 18 -16.022 -2.884 10.551 1.00 0.00 C ATOM 274 NE ARG B 18 -16.621 -2.554 11.841 1.00 0.00 N ATOM 275 CZ ARG B 18 -16.381 -1.424 12.508 1.00 0.00 C ATOM 276 NH1 ARG B 18 -15.623 -0.476 11.969 1.00 0.00 N ATOM 277 NH2 ARG B 18 -16.907 -1.243 13.713 1.00 0.00 N ATOM 0 H ARG B 18 -18.287 -2.146 7.518 1.00 0.00 H new ATOM 0 HA ARG B 18 -16.761 -4.180 6.168 1.00 0.00 H new ATOM 0 HB2 ARG B 18 -15.736 -4.506 8.341 1.00 0.00 H new ATOM 0 HB3 ARG B 18 -15.756 -2.810 7.897 1.00 0.00 H new ATOM 0 HG2 ARG B 18 -17.778 -2.505 9.373 1.00 0.00 H new ATOM 0 HG3 ARG B 18 -17.607 -4.172 9.885 1.00 0.00 H new ATOM 0 HD2 ARG B 18 -15.298 -3.687 10.686 1.00 0.00 H new ATOM 0 HD3 ARG B 18 -15.473 -2.019 10.178 1.00 0.00 H new ATOM 0 HE ARG B 18 -17.262 -3.229 12.258 1.00 0.00 H new ATOM 0 HH11 ARG B 18 -15.221 -0.610 11.041 1.00 0.00 H new ATOM 0 HH12 ARG B 18 -15.442 0.386 12.483 1.00 0.00 H new ATOM 0 HH21 ARG B 18 -17.494 -1.967 14.127 1.00 0.00 H new ATOM 0 HH22 ARG B 18 -16.725 -0.380 14.225 1.00 0.00 H new ATOM 291 N GLU B 19 -19.434 -4.912 7.847 1.00 0.00 N ATOM 292 CA GLU B 19 -20.377 -5.977 8.157 1.00 0.00 C ATOM 293 C GLU B 19 -20.521 -6.910 6.960 1.00 0.00 C ATOM 294 O GLU B 19 -20.331 -8.122 7.059 1.00 0.00 O ATOM 295 CB GLU B 19 -21.742 -5.393 8.523 1.00 0.00 C ATOM 296 CG GLU B 19 -22.809 -6.432 8.814 1.00 0.00 C ATOM 297 CD GLU B 19 -22.459 -7.315 9.995 1.00 0.00 C ATOM 298 OE1 GLU B 19 -22.801 -6.950 11.140 1.00 0.00 O ATOM 299 OE2 GLU B 19 -21.838 -8.376 9.788 1.00 0.00 O ATOM 0 H GLU B 19 -19.792 -3.973 8.019 1.00 0.00 H new ATOM 0 HA GLU B 19 -19.996 -6.540 9.009 1.00 0.00 H new ATOM 0 HB2 GLU B 19 -21.627 -4.753 9.397 1.00 0.00 H new ATOM 0 HB3 GLU B 19 -22.083 -4.758 7.705 1.00 0.00 H new ATOM 0 HG2 GLU B 19 -23.756 -5.929 9.010 1.00 0.00 H new ATOM 0 HG3 GLU B 19 -22.955 -7.054 7.931 1.00 0.00 H new ATOM 306 N LEU B 20 -20.821 -6.312 5.819 1.00 0.00 N ATOM 307 CA LEU B 20 -21.017 -7.052 4.586 1.00 0.00 C ATOM 308 C LEU B 20 -19.689 -7.593 4.053 1.00 0.00 C ATOM 309 O LEU B 20 -19.649 -8.644 3.406 1.00 0.00 O ATOM 310 CB LEU B 20 -21.689 -6.139 3.561 1.00 0.00 C ATOM 311 CG LEU B 20 -23.008 -6.657 2.995 1.00 0.00 C ATOM 312 CD1 LEU B 20 -23.806 -5.517 2.390 1.00 0.00 C ATOM 313 CD2 LEU B 20 -22.746 -7.737 1.961 1.00 0.00 C ATOM 0 H LEU B 20 -20.935 -5.303 5.723 1.00 0.00 H new ATOM 0 HA LEU B 20 -21.659 -7.911 4.779 1.00 0.00 H new ATOM 0 HB2 LEU B 20 -21.867 -5.169 4.024 1.00 0.00 H new ATOM 0 HB3 LEU B 20 -20.997 -5.976 2.735 1.00 0.00 H new ATOM 0 HG LEU B 20 -23.593 -7.091 3.806 1.00 0.00 H new ATOM 0 HD11 LEU B 20 -24.744 -5.902 1.990 1.00 0.00 H new ATOM 0 HD12 LEU B 20 -24.017 -4.773 3.158 1.00 0.00 H new ATOM 0 HD13 LEU B 20 -23.231 -5.057 1.587 1.00 0.00 H new ATOM 0 HD21 LEU B 20 -23.695 -8.099 1.564 1.00 0.00 H new ATOM 0 HD22 LEU B 20 -22.146 -7.326 1.149 1.00 0.00 H new ATOM 0 HD23 LEU B 20 -22.208 -8.563 2.426 1.00 0.00 H new ATOM 325 N TYR B 21 -18.602 -6.885 4.355 1.00 0.00 N ATOM 326 CA TYR B 21 -17.273 -7.312 3.937 1.00 0.00 C ATOM 327 C TYR B 21 -16.893 -8.582 4.673 1.00 0.00 C ATOM 328 O TYR B 21 -16.560 -9.595 4.066 1.00 0.00 O ATOM 329 CB TYR B 21 -16.236 -6.224 4.231 1.00 0.00 C ATOM 330 CG TYR B 21 -14.821 -6.607 3.850 1.00 0.00 C ATOM 331 CD1 TYR B 21 -14.384 -6.529 2.532 1.00 0.00 C ATOM 332 CD2 TYR B 21 -13.918 -7.039 4.813 1.00 0.00 C ATOM 333 CE1 TYR B 21 -13.092 -6.871 2.188 1.00 0.00 C ATOM 334 CE2 TYR B 21 -12.626 -7.384 4.476 1.00 0.00 C ATOM 335 CZ TYR B 21 -12.219 -7.297 3.163 1.00 0.00 C ATOM 336 OH TYR B 21 -10.932 -7.637 2.827 1.00 0.00 O ATOM 0 H TYR B 21 -18.618 -6.015 4.887 1.00 0.00 H new ATOM 0 HA TYR B 21 -17.290 -7.497 2.863 1.00 0.00 H new ATOM 0 HB2 TYR B 21 -16.513 -5.317 3.695 1.00 0.00 H new ATOM 0 HB3 TYR B 21 -16.264 -5.987 5.294 1.00 0.00 H new ATOM 0 HD1 TYR B 21 -15.067 -6.195 1.765 1.00 0.00 H new ATOM 0 HD2 TYR B 21 -14.233 -7.106 5.844 1.00 0.00 H new ATOM 0 HE1 TYR B 21 -12.768 -6.805 1.160 1.00 0.00 H new ATOM 0 HE2 TYR B 21 -11.937 -7.720 5.237 1.00 0.00 H new ATOM 0 HH TYR B 21 -10.447 -7.915 3.632 1.00 0.00 H new ATOM 346 N LEU B 22 -16.973 -8.511 5.991 1.00 0.00 N ATOM 347 CA LEU B 22 -16.605 -9.616 6.860 1.00 0.00 C ATOM 348 C LEU B 22 -17.496 -10.830 6.603 1.00 0.00 C ATOM 349 O LEU B 22 -17.099 -11.965 6.853 1.00 0.00 O ATOM 350 CB LEU B 22 -16.710 -9.179 8.327 1.00 0.00 C ATOM 351 CG LEU B 22 -15.990 -7.866 8.665 1.00 0.00 C ATOM 352 CD1 LEU B 22 -16.262 -7.449 10.101 1.00 0.00 C ATOM 353 CD2 LEU B 22 -14.496 -7.973 8.421 1.00 0.00 C ATOM 0 H LEU B 22 -17.296 -7.682 6.490 1.00 0.00 H new ATOM 0 HA LEU B 22 -15.575 -9.901 6.644 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -17.764 -9.075 8.585 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -16.304 -9.971 8.956 1.00 0.00 H new ATOM 0 HG LEU B 22 -16.387 -7.098 8.001 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -15.740 -6.516 10.314 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -17.333 -7.306 10.242 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -15.908 -8.226 10.779 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -14.018 -7.026 8.671 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -14.081 -8.764 9.045 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -14.314 -8.206 7.372 1.00 0.00 H new ATOM 365 N ALA B 23 -18.690 -10.579 6.083 1.00 0.00 N ATOM 366 CA ALA B 23 -19.651 -11.639 5.821 1.00 0.00 C ATOM 367 C ALA B 23 -19.341 -12.401 4.532 1.00 0.00 C ATOM 368 O ALA B 23 -19.694 -13.570 4.405 1.00 0.00 O ATOM 369 CB ALA B 23 -21.057 -11.062 5.760 1.00 0.00 C ATOM 0 H ALA B 23 -19.016 -9.645 5.834 1.00 0.00 H new ATOM 0 HA ALA B 23 -19.580 -12.352 6.643 1.00 0.00 H new ATOM 0 HB1 ALA B 23 -21.770 -11.862 5.563 1.00 0.00 H new ATOM 0 HB2 ALA B 23 -21.297 -10.587 6.711 1.00 0.00 H new ATOM 0 HB3 ALA B 23 -21.112 -10.322 4.961 1.00 0.00 H new ATOM 375 N ASN B 24 -18.691 -11.745 3.570 1.00 0.00 N ATOM 376 CA ASN B 24 -18.445 -12.374 2.274 1.00 0.00 C ATOM 377 C ASN B 24 -16.963 -12.393 1.912 1.00 0.00 C ATOM 378 O ASN B 24 -16.605 -12.696 0.775 1.00 0.00 O ATOM 379 CB ASN B 24 -19.238 -11.660 1.174 1.00 0.00 C ATOM 380 CG ASN B 24 -20.737 -11.861 1.310 1.00 0.00 C ATOM 381 OD1 ASN B 24 -21.293 -12.828 0.788 1.00 0.00 O ATOM 382 ND2 ASN B 24 -21.405 -10.949 2.002 1.00 0.00 N ATOM 0 H ASN B 24 -18.331 -10.795 3.661 1.00 0.00 H new ATOM 0 HA ASN B 24 -18.779 -13.408 2.354 1.00 0.00 H new ATOM 0 HB2 ASN B 24 -19.014 -10.594 1.204 1.00 0.00 H new ATOM 0 HB3 ASN B 24 -18.913 -12.027 0.200 1.00 0.00 H new ATOM 0 HD21 ASN B 24 -22.415 -11.035 2.117 1.00 0.00 H new ATOM 0 HD22 ASN B 24 -20.909 -10.162 2.420 1.00 0.00 H new ATOM 389 N LYS B 25 -16.099 -12.090 2.873 1.00 0.00 N ATOM 390 CA LYS B 25 -14.660 -12.073 2.615 1.00 0.00 C ATOM 391 C LYS B 25 -14.093 -13.484 2.619 1.00 0.00 C ATOM 392 O LYS B 25 -12.976 -13.718 2.168 1.00 0.00 O ATOM 393 CB LYS B 25 -13.921 -11.214 3.647 1.00 0.00 C ATOM 394 CG LYS B 25 -14.069 -11.700 5.083 1.00 0.00 C ATOM 395 CD LYS B 25 -13.299 -10.818 6.058 1.00 0.00 C ATOM 396 CE LYS B 25 -11.793 -11.036 5.965 1.00 0.00 C ATOM 397 NZ LYS B 25 -11.392 -12.374 6.474 1.00 0.00 N ATOM 0 H LYS B 25 -16.363 -11.855 3.830 1.00 0.00 H new ATOM 0 HA LYS B 25 -14.510 -11.634 1.628 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -12.862 -11.189 3.391 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -14.289 -10.190 3.582 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -15.124 -11.710 5.357 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -13.710 -12.726 5.159 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -13.526 -9.771 5.856 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -13.632 -11.026 7.075 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -11.475 -10.932 4.928 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -11.279 -10.262 6.535 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -10.360 -12.402 6.600 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -11.858 -12.552 7.387 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -11.677 -13.105 5.791 1.00 0.00 H new ATOM 411 N ASP B 26 -14.874 -14.422 3.132 1.00 0.00 N ATOM 412 CA ASP B 26 -14.448 -15.813 3.200 1.00 0.00 C ATOM 413 C ASP B 26 -15.053 -16.614 2.054 1.00 0.00 C ATOM 414 O ASP B 26 -14.909 -17.836 1.983 1.00 0.00 O ATOM 415 CB ASP B 26 -14.833 -16.440 4.546 1.00 0.00 C ATOM 416 CG ASP B 26 -16.328 -16.619 4.717 1.00 0.00 C ATOM 417 OD1 ASP B 26 -16.800 -17.776 4.668 1.00 0.00 O ATOM 418 OD2 ASP B 26 -17.033 -15.613 4.915 1.00 0.00 O ATOM 0 H ASP B 26 -15.806 -14.246 3.507 1.00 0.00 H new ATOM 0 HA ASP B 26 -13.362 -15.837 3.109 1.00 0.00 H new ATOM 0 HB2 ASP B 26 -14.345 -17.410 4.640 1.00 0.00 H new ATOM 0 HB3 ASP B 26 -14.454 -15.813 5.353 1.00 0.00 H new ATOM 423 N VAL B 27 -15.719 -15.920 1.145 1.00 0.00 N ATOM 424 CA VAL B 27 -16.350 -16.564 0.009 1.00 0.00 C ATOM 425 C VAL B 27 -15.498 -16.358 -1.236 1.00 0.00 C ATOM 426 O VAL B 27 -15.425 -15.253 -1.778 1.00 0.00 O ATOM 427 CB VAL B 27 -17.772 -16.015 -0.237 1.00 0.00 C ATOM 428 CG1 VAL B 27 -18.456 -16.773 -1.364 1.00 0.00 C ATOM 429 CG2 VAL B 27 -18.603 -16.079 1.036 1.00 0.00 C ATOM 0 H VAL B 27 -15.836 -14.907 1.174 1.00 0.00 H new ATOM 0 HA VAL B 27 -16.434 -17.628 0.229 1.00 0.00 H new ATOM 0 HB VAL B 27 -17.685 -14.970 -0.534 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -19.456 -16.369 -1.520 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -17.875 -16.666 -2.280 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -18.528 -17.828 -1.102 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -19.601 -15.687 0.839 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -18.679 -17.114 1.369 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -18.125 -15.482 1.813 1.00 0.00 H new ATOM 439 N GLU B 28 -14.850 -17.424 -1.673 1.00 0.00 N ATOM 440 CA GLU B 28 -13.975 -17.367 -2.832 1.00 0.00 C ATOM 441 C GLU B 28 -14.792 -17.440 -4.116 1.00 0.00 C ATOM 442 O GLU B 28 -15.792 -18.160 -4.186 1.00 0.00 O ATOM 443 CB GLU B 28 -12.963 -18.511 -2.789 1.00 0.00 C ATOM 444 CG GLU B 28 -12.088 -18.514 -1.541 1.00 0.00 C ATOM 445 CD GLU B 28 -11.158 -17.319 -1.463 1.00 0.00 C ATOM 446 OE1 GLU B 28 -10.467 -17.029 -2.461 1.00 0.00 O ATOM 447 OE2 GLU B 28 -11.098 -16.677 -0.394 1.00 0.00 O ATOM 0 H GLU B 28 -14.914 -18.345 -1.240 1.00 0.00 H new ATOM 0 HA GLU B 28 -13.436 -16.420 -2.813 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -13.498 -19.459 -2.848 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -12.323 -18.451 -3.669 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -12.726 -18.528 -0.657 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -11.496 -19.429 -1.522 1.00 0.00 H new ATOM 454 N GLY B 29 -14.368 -16.693 -5.126 1.00 0.00 N ATOM 455 CA GLY B 29 -15.094 -16.662 -6.379 1.00 0.00 C ATOM 456 C GLY B 29 -16.284 -15.732 -6.317 1.00 0.00 C ATOM 457 O GLY B 29 -17.230 -15.867 -7.094 1.00 0.00 O ATOM 0 H GLY B 29 -13.533 -16.107 -5.100 1.00 0.00 H new ATOM 0 HA2 GLY B 29 -14.425 -16.343 -7.178 1.00 0.00 H new ATOM 0 HA3 GLY B 29 -15.432 -17.668 -6.628 1.00 0.00 H new ATOM 461 N GLN B 30 -16.245 -14.796 -5.381 1.00 0.00 N ATOM 462 CA GLN B 30 -17.302 -13.812 -5.239 1.00 0.00 C ATOM 463 C GLN B 30 -16.692 -12.454 -4.961 1.00 0.00 C ATOM 464 O GLN B 30 -15.806 -12.326 -4.114 1.00 0.00 O ATOM 465 CB GLN B 30 -18.264 -14.211 -4.110 1.00 0.00 C ATOM 466 CG GLN B 30 -19.579 -13.428 -4.091 1.00 0.00 C ATOM 467 CD GLN B 30 -19.532 -12.075 -3.399 1.00 0.00 C ATOM 468 OE1 GLN B 30 -20.264 -11.166 -3.788 1.00 0.00 O ATOM 469 NE2 GLN B 30 -18.701 -11.917 -2.378 1.00 0.00 N ATOM 0 H GLN B 30 -15.487 -14.699 -4.706 1.00 0.00 H new ATOM 0 HA GLN B 30 -17.873 -13.765 -6.167 1.00 0.00 H new ATOM 0 HB2 GLN B 30 -18.490 -15.274 -4.200 1.00 0.00 H new ATOM 0 HB3 GLN B 30 -17.759 -14.073 -3.154 1.00 0.00 H new ATOM 0 HG2 GLN B 30 -19.906 -13.278 -5.120 1.00 0.00 H new ATOM 0 HG3 GLN B 30 -20.337 -14.039 -3.602 1.00 0.00 H new ATOM 0 HE21 GLN B 30 -18.107 -12.691 -2.080 1.00 0.00 H new ATOM 0 HE22 GLN B 30 -18.656 -11.022 -1.891 1.00 0.00 H new ATOM 478 N ASP B 31 -17.147 -11.450 -5.686 1.00 0.00 N ATOM 479 CA ASP B 31 -16.668 -10.094 -5.486 1.00 0.00 C ATOM 480 C ASP B 31 -17.228 -9.526 -4.200 1.00 0.00 C ATOM 481 O ASP B 31 -18.341 -9.005 -4.184 1.00 0.00 O ATOM 482 CB ASP B 31 -17.086 -9.193 -6.642 1.00 0.00 C ATOM 483 CG ASP B 31 -16.401 -9.542 -7.944 1.00 0.00 C ATOM 484 OD1 ASP B 31 -15.364 -8.921 -8.260 1.00 0.00 O ATOM 485 OD2 ASP B 31 -16.895 -10.434 -8.663 1.00 0.00 O ATOM 0 H ASP B 31 -17.849 -11.547 -6.420 1.00 0.00 H new ATOM 0 HA ASP B 31 -15.580 -10.130 -5.434 1.00 0.00 H new ATOM 0 HB2 ASP B 31 -18.165 -9.262 -6.776 1.00 0.00 H new ATOM 0 HB3 ASP B 31 -16.862 -8.157 -6.387 1.00 0.00 H new ATOM 490 N VAL B 32 -16.461 -9.630 -3.122 1.00 0.00 N ATOM 491 CA VAL B 32 -16.876 -9.079 -1.839 1.00 0.00 C ATOM 492 C VAL B 32 -17.163 -7.589 -1.995 1.00 0.00 C ATOM 493 O VAL B 32 -18.030 -7.039 -1.327 1.00 0.00 O ATOM 494 CB VAL B 32 -15.797 -9.292 -0.759 1.00 0.00 C ATOM 495 CG1 VAL B 32 -14.604 -8.398 -1.027 1.00 0.00 C ATOM 496 CG2 VAL B 32 -16.359 -9.056 0.638 1.00 0.00 C ATOM 0 H VAL B 32 -15.551 -10.090 -3.111 1.00 0.00 H new ATOM 0 HA VAL B 32 -17.778 -9.600 -1.519 1.00 0.00 H new ATOM 0 HB VAL B 32 -15.467 -10.330 -0.805 1.00 0.00 H new ATOM 0 HG11 VAL B 32 -13.849 -8.558 -0.257 1.00 0.00 H new ATOM 0 HG12 VAL B 32 -14.183 -8.637 -2.004 1.00 0.00 H new ATOM 0 HG13 VAL B 32 -14.921 -7.355 -1.013 1.00 0.00 H new ATOM 0 HG21 VAL B 32 -15.574 -9.214 1.377 1.00 0.00 H new ATOM 0 HG22 VAL B 32 -16.728 -8.033 0.714 1.00 0.00 H new ATOM 0 HG23 VAL B 32 -17.177 -9.752 0.823 1.00 0.00 H new ATOM 506 N VAL B 33 -16.437 -6.969 -2.920 1.00 0.00 N ATOM 507 CA VAL B 33 -16.616 -5.568 -3.247 1.00 0.00 C ATOM 508 C VAL B 33 -18.065 -5.301 -3.603 1.00 0.00 C ATOM 509 O VAL B 33 -18.748 -4.512 -2.950 1.00 0.00 O ATOM 510 CB VAL B 33 -15.753 -5.170 -4.455 1.00 0.00 C ATOM 511 CG1 VAL B 33 -15.603 -3.661 -4.546 1.00 0.00 C ATOM 512 CG2 VAL B 33 -14.403 -5.870 -4.418 1.00 0.00 C ATOM 0 H VAL B 33 -15.707 -7.430 -3.463 1.00 0.00 H new ATOM 0 HA VAL B 33 -16.319 -4.985 -2.375 1.00 0.00 H new ATOM 0 HB VAL B 33 -16.265 -5.500 -5.359 1.00 0.00 H new ATOM 0 HG11 VAL B 33 -14.988 -3.408 -5.410 1.00 0.00 H new ATOM 0 HG12 VAL B 33 -16.586 -3.203 -4.654 1.00 0.00 H new ATOM 0 HG13 VAL B 33 -15.127 -3.287 -3.639 1.00 0.00 H new ATOM 0 HG21 VAL B 33 -13.814 -5.570 -5.284 1.00 0.00 H new ATOM 0 HG22 VAL B 33 -13.874 -5.593 -3.506 1.00 0.00 H new ATOM 0 HG23 VAL B 33 -14.552 -6.950 -4.437 1.00 0.00 H new ATOM 522 N GLU B 34 -18.532 -5.994 -4.632 1.00 0.00 N ATOM 523 CA GLU B 34 -19.887 -5.822 -5.105 1.00 0.00 C ATOM 524 C GLU B 34 -20.874 -6.435 -4.135 1.00 0.00 C ATOM 525 O GLU B 34 -22.000 -5.982 -4.041 1.00 0.00 O ATOM 526 CB GLU B 34 -20.058 -6.399 -6.507 1.00 0.00 C ATOM 527 CG GLU B 34 -19.274 -5.629 -7.557 1.00 0.00 C ATOM 528 CD GLU B 34 -19.613 -6.048 -8.967 1.00 0.00 C ATOM 529 OE1 GLU B 34 -20.389 -5.327 -9.632 1.00 0.00 O ATOM 530 OE2 GLU B 34 -19.110 -7.096 -9.417 1.00 0.00 O ATOM 0 H GLU B 34 -17.986 -6.681 -5.153 1.00 0.00 H new ATOM 0 HA GLU B 34 -20.092 -4.753 -5.163 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -19.735 -7.440 -6.509 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -21.115 -6.393 -6.772 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -19.472 -4.563 -7.442 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -18.207 -5.775 -7.386 1.00 0.00 H new ATOM 537 N ALA B 35 -20.449 -7.447 -3.393 1.00 0.00 N ATOM 538 CA ALA B 35 -21.284 -7.992 -2.333 1.00 0.00 C ATOM 539 C ALA B 35 -21.710 -6.872 -1.401 1.00 0.00 C ATOM 540 O ALA B 35 -22.881 -6.738 -1.054 1.00 0.00 O ATOM 541 CB ALA B 35 -20.546 -9.069 -1.553 1.00 0.00 C ATOM 0 H ALA B 35 -19.543 -7.903 -3.503 1.00 0.00 H new ATOM 0 HA ALA B 35 -22.165 -8.449 -2.784 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -21.194 -9.458 -0.768 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -20.266 -9.879 -2.227 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -19.648 -8.643 -1.105 1.00 0.00 H new ATOM 547 N ILE B 36 -20.757 -6.036 -1.040 1.00 0.00 N ATOM 548 CA ILE B 36 -21.020 -4.939 -0.140 1.00 0.00 C ATOM 549 C ILE B 36 -21.810 -3.845 -0.837 1.00 0.00 C ATOM 550 O ILE B 36 -22.975 -3.606 -0.513 1.00 0.00 O ATOM 551 CB ILE B 36 -19.713 -4.335 0.385 1.00 0.00 C ATOM 552 CG1 ILE B 36 -18.860 -5.419 1.027 1.00 0.00 C ATOM 553 CG2 ILE B 36 -20.004 -3.226 1.382 1.00 0.00 C ATOM 554 CD1 ILE B 36 -17.429 -5.006 1.217 1.00 0.00 C ATOM 0 H ILE B 36 -19.790 -6.099 -1.360 1.00 0.00 H new ATOM 0 HA ILE B 36 -21.599 -5.338 0.693 1.00 0.00 H new ATOM 0 HB ILE B 36 -19.162 -3.906 -0.452 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -19.287 -5.684 1.994 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -18.894 -6.315 0.407 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -19.065 -2.808 1.745 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -20.586 -2.443 0.896 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -20.570 -3.630 2.221 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -16.873 -5.822 1.679 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -16.987 -4.768 0.249 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -17.386 -4.128 1.861 1.00 0.00 H new ATOM 566 N LEU B 37 -21.189 -3.228 -1.834 1.00 0.00 N ATOM 567 CA LEU B 37 -21.740 -2.020 -2.448 1.00 0.00 C ATOM 568 C LEU B 37 -23.060 -2.265 -3.180 1.00 0.00 C ATOM 569 O LEU B 37 -23.824 -1.331 -3.417 1.00 0.00 O ATOM 570 CB LEU B 37 -20.700 -1.353 -3.366 1.00 0.00 C ATOM 571 CG LEU B 37 -19.981 -2.246 -4.384 1.00 0.00 C ATOM 572 CD1 LEU B 37 -20.902 -2.604 -5.540 1.00 0.00 C ATOM 573 CD2 LEU B 37 -18.740 -1.544 -4.900 1.00 0.00 C ATOM 0 H LEU B 37 -20.305 -3.541 -2.236 1.00 0.00 H new ATOM 0 HA LEU B 37 -21.975 -1.334 -1.634 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -21.198 -0.552 -3.913 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -19.944 -0.886 -2.735 1.00 0.00 H new ATOM 0 HG LEU B 37 -19.689 -3.170 -3.886 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -20.368 -3.238 -6.248 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -21.773 -3.138 -5.160 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -21.227 -1.693 -6.042 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -18.234 -2.184 -5.623 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -19.025 -0.608 -5.381 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -18.068 -1.335 -4.068 1.00 0.00 H new ATOM 585 N ALA B 38 -23.329 -3.510 -3.534 1.00 0.00 N ATOM 586 CA ALA B 38 -24.576 -3.852 -4.208 1.00 0.00 C ATOM 587 C ALA B 38 -25.683 -4.204 -3.218 1.00 0.00 C ATOM 588 O ALA B 38 -26.864 -4.036 -3.519 1.00 0.00 O ATOM 589 CB ALA B 38 -24.364 -4.999 -5.179 1.00 0.00 C ATOM 0 H ALA B 38 -22.705 -4.300 -3.368 1.00 0.00 H new ATOM 0 HA ALA B 38 -24.893 -2.968 -4.762 1.00 0.00 H new ATOM 0 HB1 ALA B 38 -25.307 -5.238 -5.671 1.00 0.00 H new ATOM 0 HB2 ALA B 38 -23.627 -4.710 -5.928 1.00 0.00 H new ATOM 0 HB3 ALA B 38 -24.006 -5.874 -4.636 1.00 0.00 H new ATOM 595 N HIS B 39 -25.311 -4.701 -2.040 1.00 0.00 N ATOM 596 CA HIS B 39 -26.315 -5.140 -1.072 1.00 0.00 C ATOM 597 C HIS B 39 -26.786 -4.002 -0.174 1.00 0.00 C ATOM 598 O HIS B 39 -27.926 -4.010 0.288 1.00 0.00 O ATOM 599 CB HIS B 39 -25.799 -6.292 -0.206 1.00 0.00 C ATOM 600 CG HIS B 39 -25.939 -7.647 -0.830 1.00 0.00 C ATOM 601 ND1 HIS B 39 -26.943 -8.528 -0.501 1.00 0.00 N ATOM 602 CD2 HIS B 39 -25.183 -8.277 -1.754 1.00 0.00 C ATOM 603 CE1 HIS B 39 -26.796 -9.638 -1.199 1.00 0.00 C ATOM 604 NE2 HIS B 39 -25.736 -9.513 -1.970 1.00 0.00 N ATOM 0 H HIS B 39 -24.343 -4.809 -1.736 1.00 0.00 H new ATOM 0 HA HIS B 39 -27.165 -5.490 -1.658 1.00 0.00 H new ATOM 0 HB2 HIS B 39 -24.747 -6.117 0.021 1.00 0.00 H new ATOM 0 HB3 HIS B 39 -26.335 -6.285 0.743 1.00 0.00 H new ATOM 0 HD2 HIS B 39 -24.302 -7.879 -2.236 1.00 0.00 H new ATOM 0 HE1 HIS B 39 -27.438 -10.505 -1.147 1.00 0.00 H new ATOM 0 HE2 HIS B 39 -25.385 -10.217 -2.619 1.00 0.00 H new ATOM 613 N LEU B 40 -25.932 -3.023 0.089 1.00 0.00 N ATOM 614 CA LEU B 40 -26.346 -1.912 0.928 1.00 0.00 C ATOM 615 C LEU B 40 -26.789 -0.708 0.099 1.00 0.00 C ATOM 616 O LEU B 40 -26.010 0.189 -0.199 1.00 0.00 O ATOM 617 CB LEU B 40 -25.276 -1.532 1.978 1.00 0.00 C ATOM 618 CG LEU B 40 -23.797 -1.690 1.591 1.00 0.00 C ATOM 619 CD1 LEU B 40 -23.340 -0.612 0.619 1.00 0.00 C ATOM 620 CD2 LEU B 40 -22.933 -1.663 2.844 1.00 0.00 C ATOM 0 H LEU B 40 -24.973 -2.975 -0.257 1.00 0.00 H new ATOM 0 HA LEU B 40 -27.217 -2.253 1.488 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -25.438 -0.491 2.259 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -25.454 -2.134 2.869 1.00 0.00 H new ATOM 0 HG LEU B 40 -23.688 -2.650 1.086 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -22.289 -0.765 0.374 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -23.936 -0.667 -0.292 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -23.467 0.369 1.077 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -21.885 -1.775 2.566 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -23.071 -0.713 3.361 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -23.223 -2.481 3.504 1.00 0.00 H new ATOM 632 N ASN B 41 -28.070 -0.690 -0.257 1.00 0.00 N ATOM 633 CA ASN B 41 -28.635 0.415 -1.028 1.00 0.00 C ATOM 634 C ASN B 41 -29.023 1.546 -0.075 1.00 0.00 C ATOM 635 O ASN B 41 -30.060 2.188 -0.218 1.00 0.00 O ATOM 636 CB ASN B 41 -29.855 -0.057 -1.835 1.00 0.00 C ATOM 637 CG ASN B 41 -30.195 0.869 -2.996 1.00 0.00 C ATOM 638 OD1 ASN B 41 -29.685 0.701 -4.104 1.00 0.00 O ATOM 639 ND2 ASN B 41 -31.058 1.847 -2.759 1.00 0.00 N ATOM 0 H ASN B 41 -28.736 -1.426 -0.025 1.00 0.00 H new ATOM 0 HA ASN B 41 -27.889 0.780 -1.734 1.00 0.00 H new ATOM 0 HB2 ASN B 41 -29.664 -1.059 -2.220 1.00 0.00 H new ATOM 0 HB3 ASN B 41 -30.717 -0.130 -1.171 1.00 0.00 H new ATOM 0 HD21 ASN B 41 -31.319 2.490 -3.507 1.00 0.00 H new ATOM 0 HD22 ASN B 41 -31.461 1.957 -1.829 1.00 0.00 H new ATOM 646 N THR B 42 -28.165 1.773 0.904 1.00 0.00 N ATOM 647 CA THR B 42 -28.345 2.842 1.870 1.00 0.00 C ATOM 648 C THR B 42 -27.515 4.049 1.447 1.00 0.00 C ATOM 649 O THR B 42 -27.688 5.160 1.952 1.00 0.00 O ATOM 650 CB THR B 42 -27.938 2.368 3.291 1.00 0.00 C ATOM 651 OG1 THR B 42 -28.004 3.445 4.237 1.00 0.00 O ATOM 652 CG2 THR B 42 -26.537 1.776 3.284 1.00 0.00 C ATOM 0 H THR B 42 -27.321 1.219 1.052 1.00 0.00 H new ATOM 0 HA THR B 42 -29.397 3.125 1.901 1.00 0.00 H new ATOM 0 HB THR B 42 -28.647 1.597 3.593 1.00 0.00 H new ATOM 0 HG1 THR B 42 -27.431 3.241 5.005 1.00 0.00 H new ATOM 0 HG21 THR B 42 -26.274 1.451 4.291 1.00 0.00 H new ATOM 0 HG22 THR B 42 -26.506 0.922 2.607 1.00 0.00 H new ATOM 0 HG23 THR B 42 -25.825 2.530 2.949 1.00 0.00 H new ATOM 660 N VAL B 43 -26.625 3.820 0.487 1.00 0.00 N ATOM 661 CA VAL B 43 -25.724 4.852 0.001 1.00 0.00 C ATOM 662 C VAL B 43 -25.481 4.713 -1.504 1.00 0.00 C ATOM 663 O VAL B 43 -24.880 3.739 -1.956 1.00 0.00 O ATOM 664 CB VAL B 43 -24.364 4.810 0.742 1.00 0.00 C ATOM 665 CG1 VAL B 43 -24.481 5.403 2.136 1.00 0.00 C ATOM 666 CG2 VAL B 43 -23.829 3.384 0.820 1.00 0.00 C ATOM 0 H VAL B 43 -26.510 2.917 0.027 1.00 0.00 H new ATOM 0 HA VAL B 43 -26.206 5.810 0.198 1.00 0.00 H new ATOM 0 HB VAL B 43 -23.659 5.414 0.170 1.00 0.00 H new ATOM 0 HG11 VAL B 43 -23.511 5.360 2.632 1.00 0.00 H new ATOM 0 HG12 VAL B 43 -24.806 6.441 2.064 1.00 0.00 H new ATOM 0 HG13 VAL B 43 -25.210 4.834 2.713 1.00 0.00 H new ATOM 0 HG21 VAL B 43 -22.874 3.382 1.345 1.00 0.00 H new ATOM 0 HG22 VAL B 43 -24.540 2.758 1.359 1.00 0.00 H new ATOM 0 HG23 VAL B 43 -23.690 2.992 -0.187 1.00 0.00 H new ATOM 676 N PRO B 44 -25.962 5.676 -2.304 1.00 0.00 N ATOM 677 CA PRO B 44 -25.665 5.723 -3.738 1.00 0.00 C ATOM 678 C PRO B 44 -24.208 6.110 -3.985 1.00 0.00 C ATOM 679 O PRO B 44 -23.859 7.293 -3.997 1.00 0.00 O ATOM 680 CB PRO B 44 -26.617 6.797 -4.265 1.00 0.00 C ATOM 681 CG PRO B 44 -26.892 7.675 -3.092 1.00 0.00 C ATOM 682 CD PRO B 44 -26.840 6.783 -1.882 1.00 0.00 C ATOM 0 HA PRO B 44 -25.799 4.760 -4.230 1.00 0.00 H new ATOM 0 HB2 PRO B 44 -26.165 7.359 -5.082 1.00 0.00 H new ATOM 0 HB3 PRO B 44 -27.535 6.355 -4.652 1.00 0.00 H new ATOM 0 HG2 PRO B 44 -26.152 8.473 -3.020 1.00 0.00 H new ATOM 0 HG3 PRO B 44 -27.868 8.152 -3.183 1.00 0.00 H new ATOM 0 HD2 PRO B 44 -26.437 7.306 -1.015 1.00 0.00 H new ATOM 0 HD3 PRO B 44 -27.832 6.425 -1.605 1.00 0.00 H new ATOM 690 N ARG B 45 -23.352 5.107 -4.150 1.00 0.00 N ATOM 691 CA ARG B 45 -21.915 5.340 -4.215 1.00 0.00 C ATOM 692 C ARG B 45 -21.262 4.587 -5.358 1.00 0.00 C ATOM 693 O ARG B 45 -21.918 3.837 -6.086 1.00 0.00 O ATOM 694 CB ARG B 45 -21.252 4.940 -2.902 1.00 0.00 C ATOM 695 CG ARG B 45 -21.695 5.787 -1.733 1.00 0.00 C ATOM 696 CD ARG B 45 -20.873 5.481 -0.503 1.00 0.00 C ATOM 697 NE ARG B 45 -21.465 6.045 0.705 1.00 0.00 N ATOM 698 CZ ARG B 45 -21.335 7.313 1.083 1.00 0.00 C ATOM 699 NH1 ARG B 45 -20.661 8.174 0.329 1.00 0.00 N ATOM 700 NH2 ARG B 45 -21.878 7.720 2.224 1.00 0.00 N ATOM 0 H ARG B 45 -23.627 4.129 -4.241 1.00 0.00 H new ATOM 0 HA ARG B 45 -21.775 6.406 -4.392 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -21.477 3.895 -2.692 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -20.170 5.017 -3.010 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -21.598 6.843 -1.986 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -22.749 5.604 -1.525 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -20.778 4.401 -0.390 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -19.866 5.878 -0.632 1.00 0.00 H new ATOM 0 HE ARG B 45 -22.015 5.425 1.299 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -20.239 7.864 -0.546 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -20.565 9.145 0.625 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -22.393 7.061 2.808 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -21.780 8.692 2.517 1.00 0.00 H new ATOM 714 N THR B 46 -19.961 4.794 -5.506 1.00 0.00 N ATOM 715 CA THR B 46 -19.209 4.171 -6.580 1.00 0.00 C ATOM 716 C THR B 46 -18.294 3.072 -6.023 1.00 0.00 C ATOM 717 O THR B 46 -18.096 2.987 -4.808 1.00 0.00 O ATOM 718 CB THR B 46 -18.392 5.229 -7.363 1.00 0.00 C ATOM 719 OG1 THR B 46 -17.757 4.637 -8.499 1.00 0.00 O ATOM 720 CG2 THR B 46 -17.336 5.893 -6.487 1.00 0.00 C ATOM 0 H THR B 46 -19.405 5.391 -4.893 1.00 0.00 H new ATOM 0 HA THR B 46 -19.912 3.711 -7.274 1.00 0.00 H new ATOM 0 HB THR B 46 -19.096 5.993 -7.693 1.00 0.00 H new ATOM 0 HG1 THR B 46 -17.247 5.321 -8.982 1.00 0.00 H new ATOM 0 HG21 THR B 46 -16.786 6.628 -7.074 1.00 0.00 H new ATOM 0 HG22 THR B 46 -17.820 6.390 -5.646 1.00 0.00 H new ATOM 0 HG23 THR B 46 -16.646 5.137 -6.113 1.00 0.00 H new ATOM 728 N ARG B 47 -17.755 2.233 -6.910 1.00 0.00 N ATOM 729 CA ARG B 47 -16.896 1.110 -6.509 1.00 0.00 C ATOM 730 C ARG B 47 -15.726 1.583 -5.657 1.00 0.00 C ATOM 731 O ARG B 47 -15.519 1.096 -4.544 1.00 0.00 O ATOM 732 CB ARG B 47 -16.355 0.366 -7.736 1.00 0.00 C ATOM 733 CG ARG B 47 -17.183 -0.840 -8.161 1.00 0.00 C ATOM 734 CD ARG B 47 -18.579 -0.449 -8.608 1.00 0.00 C ATOM 735 NE ARG B 47 -19.353 -1.612 -9.045 1.00 0.00 N ATOM 736 CZ ARG B 47 -20.598 -1.548 -9.510 1.00 0.00 C ATOM 737 NH1 ARG B 47 -21.207 -0.374 -9.624 1.00 0.00 N ATOM 738 NH2 ARG B 47 -21.229 -2.663 -9.874 1.00 0.00 N ATOM 0 H ARG B 47 -17.898 2.309 -7.917 1.00 0.00 H new ATOM 0 HA ARG B 47 -17.513 0.432 -5.919 1.00 0.00 H new ATOM 0 HB2 ARG B 47 -16.297 1.064 -8.572 1.00 0.00 H new ATOM 0 HB3 ARG B 47 -15.338 0.036 -7.525 1.00 0.00 H new ATOM 0 HG2 ARG B 47 -16.675 -1.359 -8.974 1.00 0.00 H new ATOM 0 HG3 ARG B 47 -17.253 -1.542 -7.330 1.00 0.00 H new ATOM 0 HD2 ARG B 47 -19.098 0.046 -7.788 1.00 0.00 H new ATOM 0 HD3 ARG B 47 -18.512 0.271 -9.424 1.00 0.00 H new ATOM 0 HE ARG B 47 -18.910 -2.529 -8.990 1.00 0.00 H new ATOM 0 HH11 ARG B 47 -20.720 0.481 -9.355 1.00 0.00 H new ATOM 0 HH12 ARG B 47 -22.161 -0.327 -9.981 1.00 0.00 H new ATOM 0 HH21 ARG B 47 -20.758 -3.564 -9.796 1.00 0.00 H new ATOM 0 HH22 ARG B 47 -22.183 -2.616 -10.231 1.00 0.00 H new ATOM 752 N LYS B 48 -14.979 2.539 -6.197 1.00 0.00 N ATOM 753 CA LYS B 48 -13.811 3.113 -5.531 1.00 0.00 C ATOM 754 C LYS B 48 -14.138 3.566 -4.106 1.00 0.00 C ATOM 755 O LYS B 48 -13.298 3.489 -3.204 1.00 0.00 O ATOM 756 CB LYS B 48 -13.317 4.312 -6.344 1.00 0.00 C ATOM 757 CG LYS B 48 -12.123 5.027 -5.736 1.00 0.00 C ATOM 758 CD LYS B 48 -12.063 6.479 -6.182 1.00 0.00 C ATOM 759 CE LYS B 48 -13.210 7.286 -5.584 1.00 0.00 C ATOM 760 NZ LYS B 48 -13.168 8.713 -5.996 1.00 0.00 N ATOM 0 H LYS B 48 -15.166 2.942 -7.115 1.00 0.00 H new ATOM 0 HA LYS B 48 -13.040 2.345 -5.469 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -13.052 3.973 -7.346 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -14.135 5.024 -6.454 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -12.184 4.981 -4.649 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -11.204 4.517 -6.026 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -11.111 6.916 -5.880 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -12.107 6.530 -7.270 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -14.159 6.848 -5.893 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -13.168 7.222 -4.497 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -13.966 9.222 -5.566 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -12.274 9.140 -5.679 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -13.234 8.777 -7.032 1.00 0.00 H new ATOM 774 N GLN B 49 -15.371 4.010 -3.914 1.00 0.00 N ATOM 775 CA GLN B 49 -15.791 4.622 -2.670 1.00 0.00 C ATOM 776 C GLN B 49 -15.844 3.590 -1.550 1.00 0.00 C ATOM 777 O GLN B 49 -15.200 3.765 -0.514 1.00 0.00 O ATOM 778 CB GLN B 49 -17.152 5.287 -2.873 1.00 0.00 C ATOM 779 CG GLN B 49 -17.388 6.467 -1.964 1.00 0.00 C ATOM 780 CD GLN B 49 -18.329 7.489 -2.566 1.00 0.00 C ATOM 781 OE1 GLN B 49 -19.214 7.149 -3.346 1.00 0.00 O ATOM 782 NE2 GLN B 49 -18.136 8.749 -2.212 1.00 0.00 N ATOM 0 H GLN B 49 -16.106 3.954 -4.619 1.00 0.00 H new ATOM 0 HA GLN B 49 -15.065 5.381 -2.377 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -17.236 5.614 -3.909 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -17.936 4.549 -2.707 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -17.798 6.115 -1.017 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -16.434 6.945 -1.740 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -17.388 8.987 -1.560 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -18.735 9.483 -2.591 1.00 0.00 H new ATOM 791 N ILE B 50 -16.589 2.508 -1.765 1.00 0.00 N ATOM 792 CA ILE B 50 -16.688 1.442 -0.769 1.00 0.00 C ATOM 793 C ILE B 50 -15.310 0.851 -0.483 1.00 0.00 C ATOM 794 O ILE B 50 -14.904 0.736 0.677 1.00 0.00 O ATOM 795 CB ILE B 50 -17.670 0.317 -1.207 1.00 0.00 C ATOM 796 CG1 ILE B 50 -19.123 0.717 -0.927 1.00 0.00 C ATOM 797 CG2 ILE B 50 -17.348 -1.008 -0.523 1.00 0.00 C ATOM 798 CD1 ILE B 50 -19.739 1.599 -1.991 1.00 0.00 C ATOM 0 H ILE B 50 -17.130 2.346 -2.614 1.00 0.00 H new ATOM 0 HA ILE B 50 -17.087 1.890 0.141 1.00 0.00 H new ATOM 0 HB ILE B 50 -17.545 0.181 -2.281 1.00 0.00 H new ATOM 0 HG12 ILE B 50 -19.724 -0.187 -0.827 1.00 0.00 H new ATOM 0 HG13 ILE B 50 -19.167 1.237 0.030 1.00 0.00 H new ATOM 0 HG21 ILE B 50 -18.055 -1.769 -0.854 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -16.335 -1.315 -0.784 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -17.424 -0.887 0.558 1.00 0.00 H new ATOM 0 HD11 ILE B 50 -20.767 1.836 -1.717 1.00 0.00 H new ATOM 0 HD12 ILE B 50 -19.164 2.521 -2.077 1.00 0.00 H new ATOM 0 HD13 ILE B 50 -19.730 1.076 -2.947 1.00 0.00 H new ATOM 810 N ILE B 51 -14.587 0.519 -1.550 1.00 0.00 N ATOM 811 CA ILE B 51 -13.260 -0.080 -1.435 1.00 0.00 C ATOM 812 C ILE B 51 -12.353 0.760 -0.543 1.00 0.00 C ATOM 813 O ILE B 51 -11.696 0.247 0.366 1.00 0.00 O ATOM 814 CB ILE B 51 -12.581 -0.207 -2.812 1.00 0.00 C ATOM 815 CG1 ILE B 51 -13.429 -1.051 -3.763 1.00 0.00 C ATOM 816 CG2 ILE B 51 -11.191 -0.804 -2.660 1.00 0.00 C ATOM 817 CD1 ILE B 51 -12.894 -1.085 -5.179 1.00 0.00 C ATOM 0 H ILE B 51 -14.901 0.656 -2.511 1.00 0.00 H new ATOM 0 HA ILE B 51 -13.403 -1.069 -0.999 1.00 0.00 H new ATOM 0 HB ILE B 51 -12.487 0.790 -3.242 1.00 0.00 H new ATOM 0 HG12 ILE B 51 -13.486 -2.070 -3.380 1.00 0.00 H new ATOM 0 HG13 ILE B 51 -14.446 -0.658 -3.776 1.00 0.00 H new ATOM 0 HG21 ILE B 51 -10.722 -0.888 -3.640 1.00 0.00 H new ATOM 0 HG22 ILE B 51 -10.586 -0.159 -2.023 1.00 0.00 H new ATOM 0 HG23 ILE B 51 -11.267 -1.793 -2.208 1.00 0.00 H new ATOM 0 HD11 ILE B 51 -13.545 -1.702 -5.799 1.00 0.00 H new ATOM 0 HD12 ILE B 51 -12.863 -0.072 -5.581 1.00 0.00 H new ATOM 0 HD13 ILE B 51 -11.888 -1.506 -5.178 1.00 0.00 H new ATOM 829 N HIS B 52 -12.339 2.059 -0.811 1.00 0.00 N ATOM 830 CA HIS B 52 -11.436 2.974 -0.136 1.00 0.00 C ATOM 831 C HIS B 52 -11.634 2.982 1.372 1.00 0.00 C ATOM 832 O HIS B 52 -10.660 2.964 2.115 1.00 0.00 O ATOM 833 CB HIS B 52 -11.590 4.390 -0.693 1.00 0.00 C ATOM 834 CG HIS B 52 -10.524 4.749 -1.678 1.00 0.00 C ATOM 835 ND1 HIS B 52 -9.746 5.879 -1.559 1.00 0.00 N ATOM 836 CD2 HIS B 52 -10.094 4.116 -2.798 1.00 0.00 C ATOM 837 CE1 HIS B 52 -8.882 5.924 -2.553 1.00 0.00 C ATOM 838 NE2 HIS B 52 -9.072 4.867 -3.320 1.00 0.00 N ATOM 0 H HIS B 52 -12.949 2.503 -1.497 1.00 0.00 H new ATOM 0 HA HIS B 52 -10.424 2.617 -0.329 1.00 0.00 H new ATOM 0 HB2 HIS B 52 -12.565 4.482 -1.171 1.00 0.00 H new ATOM 0 HB3 HIS B 52 -11.570 5.103 0.131 1.00 0.00 H new ATOM 0 HD2 HIS B 52 -10.483 3.194 -3.203 1.00 0.00 H new ATOM 0 HE1 HIS B 52 -8.143 6.695 -2.713 1.00 0.00 H new ATOM 0 HE2 HIS B 52 -8.544 4.645 -4.164 1.00 0.00 H new ATOM 847 N HIS B 53 -12.878 2.991 1.829 1.00 0.00 N ATOM 848 CA HIS B 53 -13.152 3.111 3.264 1.00 0.00 C ATOM 849 C HIS B 53 -12.814 1.819 3.990 1.00 0.00 C ATOM 850 O HIS B 53 -12.544 1.819 5.188 1.00 0.00 O ATOM 851 CB HIS B 53 -14.614 3.474 3.519 1.00 0.00 C ATOM 852 CG HIS B 53 -15.115 4.605 2.681 1.00 0.00 C ATOM 853 ND1 HIS B 53 -14.334 5.677 2.302 1.00 0.00 N ATOM 854 CD2 HIS B 53 -16.315 4.793 2.095 1.00 0.00 C ATOM 855 CE1 HIS B 53 -15.035 6.471 1.517 1.00 0.00 C ATOM 856 NE2 HIS B 53 -16.242 5.961 1.374 1.00 0.00 N ATOM 0 H HIS B 53 -13.708 2.918 1.240 1.00 0.00 H new ATOM 0 HA HIS B 53 -12.521 3.911 3.650 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -15.233 2.596 3.334 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -14.735 3.733 4.571 1.00 0.00 H new ATOM 0 HD1 HIS B 53 -13.366 5.831 2.585 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -17.175 4.145 2.177 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -14.680 7.386 1.067 1.00 0.00 H new ATOM 865 N LEU B 54 -12.808 0.727 3.250 1.00 0.00 N ATOM 866 CA LEU B 54 -12.539 -0.588 3.815 1.00 0.00 C ATOM 867 C LEU B 54 -11.050 -0.765 4.071 1.00 0.00 C ATOM 868 O LEU B 54 -10.636 -1.134 5.172 1.00 0.00 O ATOM 869 CB LEU B 54 -13.053 -1.673 2.870 1.00 0.00 C ATOM 870 CG LEU B 54 -14.574 -1.856 2.853 1.00 0.00 C ATOM 871 CD1 LEU B 54 -14.984 -2.666 1.640 1.00 0.00 C ATOM 872 CD2 LEU B 54 -15.056 -2.540 4.132 1.00 0.00 C ATOM 0 H LEU B 54 -12.988 0.722 2.246 1.00 0.00 H new ATOM 0 HA LEU B 54 -13.060 -0.675 4.769 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -12.720 -1.439 1.859 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -12.592 -2.621 3.146 1.00 0.00 H new ATOM 0 HG LEU B 54 -15.038 -0.871 2.799 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -16.067 -2.792 1.635 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -14.675 -2.145 0.734 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -14.505 -3.645 1.677 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -16.139 -2.658 4.095 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -14.587 -3.520 4.220 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -14.787 -1.930 4.994 1.00 0.00 H new ATOM 884 N VAL B 55 -10.245 -0.480 3.058 1.00 0.00 N ATOM 885 CA VAL B 55 -8.796 -0.594 3.187 1.00 0.00 C ATOM 886 C VAL B 55 -8.264 0.473 4.137 1.00 0.00 C ATOM 887 O VAL B 55 -7.243 0.287 4.794 1.00 0.00 O ATOM 888 CB VAL B 55 -8.093 -0.498 1.815 1.00 0.00 C ATOM 889 CG1 VAL B 55 -8.715 -1.485 0.843 1.00 0.00 C ATOM 890 CG2 VAL B 55 -8.140 0.914 1.248 1.00 0.00 C ATOM 0 H VAL B 55 -10.566 -0.169 2.141 1.00 0.00 H new ATOM 0 HA VAL B 55 -8.575 -1.578 3.601 1.00 0.00 H new ATOM 0 HB VAL B 55 -7.043 -0.751 1.961 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -8.213 -1.411 -0.122 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -8.605 -2.497 1.232 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -9.774 -1.257 0.720 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -7.634 0.936 0.283 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -9.178 1.220 1.120 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -7.641 1.598 1.934 1.00 0.00 H new ATOM 900 N GLN B 56 -8.994 1.577 4.224 1.00 0.00 N ATOM 901 CA GLN B 56 -8.661 2.659 5.136 1.00 0.00 C ATOM 902 C GLN B 56 -9.122 2.338 6.556 1.00 0.00 C ATOM 903 O GLN B 56 -8.675 2.961 7.520 1.00 0.00 O ATOM 904 CB GLN B 56 -9.284 3.971 4.651 1.00 0.00 C ATOM 905 CG GLN B 56 -8.488 4.654 3.545 1.00 0.00 C ATOM 906 CD GLN B 56 -9.132 5.939 3.065 1.00 0.00 C ATOM 907 OE1 GLN B 56 -8.845 7.028 3.566 1.00 0.00 O ATOM 908 NE2 GLN B 56 -10.013 5.818 2.088 1.00 0.00 N ATOM 0 H GLN B 56 -9.831 1.746 3.666 1.00 0.00 H new ATOM 0 HA GLN B 56 -7.577 2.772 5.152 1.00 0.00 H new ATOM 0 HB2 GLN B 56 -10.293 3.772 4.291 1.00 0.00 H new ATOM 0 HB3 GLN B 56 -9.376 4.654 5.496 1.00 0.00 H new ATOM 0 HG2 GLN B 56 -7.483 4.870 3.907 1.00 0.00 H new ATOM 0 HG3 GLN B 56 -8.383 3.969 2.703 1.00 0.00 H new ATOM 0 HE21 GLN B 56 -10.222 4.898 1.701 1.00 0.00 H new ATOM 0 HE22 GLN B 56 -10.484 6.645 1.721 1.00 0.00 H new ATOM 917 N MET B 57 -10.023 1.369 6.684 1.00 0.00 N ATOM 918 CA MET B 57 -10.542 0.987 7.992 1.00 0.00 C ATOM 919 C MET B 57 -9.646 -0.064 8.643 1.00 0.00 C ATOM 920 O MET B 57 -9.893 -0.503 9.767 1.00 0.00 O ATOM 921 CB MET B 57 -11.974 0.465 7.867 1.00 0.00 C ATOM 922 CG MET B 57 -12.801 0.632 9.134 1.00 0.00 C ATOM 923 SD MET B 57 -14.464 -0.056 8.986 1.00 0.00 S ATOM 924 CE MET B 57 -15.045 0.756 7.497 1.00 0.00 C ATOM 0 H MET B 57 -10.407 0.837 5.903 1.00 0.00 H new ATOM 0 HA MET B 57 -10.549 1.872 8.629 1.00 0.00 H new ATOM 0 HB2 MET B 57 -12.471 0.986 7.049 1.00 0.00 H new ATOM 0 HB3 MET B 57 -11.944 -0.591 7.600 1.00 0.00 H new ATOM 0 HG2 MET B 57 -12.286 0.148 9.964 1.00 0.00 H new ATOM 0 HG3 MET B 57 -12.873 1.692 9.378 1.00 0.00 H new ATOM 0 HE1 MET B 57 -16.132 0.693 7.449 1.00 0.00 H new ATOM 0 HE2 MET B 57 -14.743 1.803 7.512 1.00 0.00 H new ATOM 0 HE3 MET B 57 -14.614 0.266 6.624 1.00 0.00 H new ATOM 934 N GLY B 58 -8.618 -0.484 7.915 1.00 0.00 N ATOM 935 CA GLY B 58 -7.625 -1.390 8.471 1.00 0.00 C ATOM 936 C GLY B 58 -8.039 -2.839 8.363 1.00 0.00 C ATOM 937 O GLY B 58 -7.288 -3.739 8.738 1.00 0.00 O ATOM 0 H GLY B 58 -8.452 -0.213 6.946 1.00 0.00 H new ATOM 0 HA2 GLY B 58 -6.677 -1.247 7.953 1.00 0.00 H new ATOM 0 HA3 GLY B 58 -7.457 -1.141 9.519 1.00 0.00 H new ATOM 941 N LEU B 59 -9.231 -3.064 7.840 1.00 0.00 N ATOM 942 CA LEU B 59 -9.757 -4.410 7.691 1.00 0.00 C ATOM 943 C LEU B 59 -9.268 -5.035 6.390 1.00 0.00 C ATOM 944 O LEU B 59 -9.361 -6.246 6.193 1.00 0.00 O ATOM 945 CB LEU B 59 -11.285 -4.390 7.769 1.00 0.00 C ATOM 946 CG LEU B 59 -11.977 -3.400 6.838 1.00 0.00 C ATOM 947 CD1 LEU B 59 -12.256 -4.035 5.493 1.00 0.00 C ATOM 948 CD2 LEU B 59 -13.258 -2.895 7.467 1.00 0.00 C ATOM 0 H LEU B 59 -9.856 -2.329 7.510 1.00 0.00 H new ATOM 0 HA LEU B 59 -9.388 -5.029 8.509 1.00 0.00 H new ATOM 0 HB2 LEU B 59 -11.656 -5.391 7.547 1.00 0.00 H new ATOM 0 HB3 LEU B 59 -11.576 -4.162 8.794 1.00 0.00 H new ATOM 0 HG LEU B 59 -11.311 -2.552 6.680 1.00 0.00 H new ATOM 0 HD11 LEU B 59 -12.750 -3.311 4.844 1.00 0.00 H new ATOM 0 HD12 LEU B 59 -11.317 -4.349 5.037 1.00 0.00 H new ATOM 0 HD13 LEU B 59 -12.902 -4.902 5.627 1.00 0.00 H new ATOM 0 HD21 LEU B 59 -13.741 -2.189 6.792 1.00 0.00 H new ATOM 0 HD22 LEU B 59 -13.927 -3.735 7.654 1.00 0.00 H new ATOM 0 HD23 LEU B 59 -13.029 -2.397 8.409 1.00 0.00 H new ATOM 960 N ALA B 60 -8.752 -4.194 5.505 1.00 0.00 N ATOM 961 CA ALA B 60 -8.118 -4.667 4.281 1.00 0.00 C ATOM 962 C ALA B 60 -6.727 -4.069 4.151 1.00 0.00 C ATOM 963 O ALA B 60 -6.371 -3.150 4.892 1.00 0.00 O ATOM 964 CB ALA B 60 -8.959 -4.320 3.061 1.00 0.00 C ATOM 0 H ALA B 60 -8.760 -3.180 5.611 1.00 0.00 H new ATOM 0 HA ALA B 60 -8.035 -5.752 4.335 1.00 0.00 H new ATOM 0 HB1 ALA B 60 -8.463 -4.684 2.161 1.00 0.00 H new ATOM 0 HB2 ALA B 60 -9.939 -4.788 3.150 1.00 0.00 H new ATOM 0 HB3 ALA B 60 -9.078 -3.238 2.997 1.00 0.00 H new ATOM 970 N ASP B 61 -5.937 -4.604 3.230 1.00 0.00 N ATOM 971 CA ASP B 61 -4.604 -4.072 2.970 1.00 0.00 C ATOM 972 C ASP B 61 -4.683 -2.870 2.051 1.00 0.00 C ATOM 973 O ASP B 61 -4.371 -1.747 2.450 1.00 0.00 O ATOM 974 CB ASP B 61 -3.700 -5.127 2.326 1.00 0.00 C ATOM 975 CG ASP B 61 -2.323 -4.582 1.977 1.00 0.00 C ATOM 976 OD1 ASP B 61 -2.057 -4.355 0.773 1.00 0.00 O ATOM 977 OD2 ASP B 61 -1.506 -4.368 2.899 1.00 0.00 O ATOM 0 H ASP B 61 -6.194 -5.404 2.651 1.00 0.00 H new ATOM 0 HA ASP B 61 -4.179 -3.778 3.930 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -3.591 -5.971 3.007 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -4.177 -5.506 1.422 1.00 0.00 H new ATOM 982 N SER B 62 -5.105 -3.110 0.821 1.00 0.00 N ATOM 983 CA SER B 62 -5.108 -2.073 -0.187 1.00 0.00 C ATOM 984 C SER B 62 -6.241 -2.268 -1.181 1.00 0.00 C ATOM 985 O SER B 62 -6.911 -3.302 -1.186 1.00 0.00 O ATOM 986 CB SER B 62 -3.776 -2.076 -0.931 1.00 0.00 C ATOM 987 OG SER B 62 -2.681 -1.906 -0.045 1.00 0.00 O ATOM 0 H SER B 62 -5.449 -4.015 0.500 1.00 0.00 H new ATOM 0 HA SER B 62 -5.254 -1.117 0.315 1.00 0.00 H new ATOM 0 HB2 SER B 62 -3.664 -3.015 -1.473 1.00 0.00 H new ATOM 0 HB3 SER B 62 -3.771 -1.277 -1.673 1.00 0.00 H new ATOM 0 HG SER B 62 -2.358 -2.784 0.248 1.00 0.00 H new ATOM 993 N VAL B 63 -6.435 -1.264 -2.028 1.00 0.00 N ATOM 994 CA VAL B 63 -7.435 -1.314 -3.085 1.00 0.00 C ATOM 995 C VAL B 63 -7.149 -2.469 -4.038 1.00 0.00 C ATOM 996 O VAL B 63 -8.054 -3.011 -4.657 1.00 0.00 O ATOM 997 CB VAL B 63 -7.470 0.026 -3.860 1.00 0.00 C ATOM 998 CG1 VAL B 63 -8.368 -0.049 -5.087 1.00 0.00 C ATOM 999 CG2 VAL B 63 -7.930 1.143 -2.939 1.00 0.00 C ATOM 0 H VAL B 63 -5.904 -0.394 -2.001 1.00 0.00 H new ATOM 0 HA VAL B 63 -8.411 -1.477 -2.627 1.00 0.00 H new ATOM 0 HB VAL B 63 -6.459 0.234 -4.210 1.00 0.00 H new ATOM 0 HG11 VAL B 63 -8.363 0.912 -5.601 1.00 0.00 H new ATOM 0 HG12 VAL B 63 -7.999 -0.822 -5.761 1.00 0.00 H new ATOM 0 HG13 VAL B 63 -9.385 -0.291 -4.779 1.00 0.00 H new ATOM 0 HG21 VAL B 63 -7.952 2.083 -3.490 1.00 0.00 H new ATOM 0 HG22 VAL B 63 -8.929 0.918 -2.565 1.00 0.00 H new ATOM 0 HG23 VAL B 63 -7.239 1.231 -2.100 1.00 0.00 H new ATOM 1009 N LYS B 64 -5.881 -2.860 -4.103 1.00 0.00 N ATOM 1010 CA LYS B 64 -5.419 -3.945 -4.971 1.00 0.00 C ATOM 1011 C LYS B 64 -6.227 -5.222 -4.749 1.00 0.00 C ATOM 1012 O LYS B 64 -6.529 -5.959 -5.688 1.00 0.00 O ATOM 1013 CB LYS B 64 -3.938 -4.203 -4.681 1.00 0.00 C ATOM 1014 CG LYS B 64 -3.666 -5.170 -3.534 1.00 0.00 C ATOM 1015 CD LYS B 64 -2.196 -5.181 -3.144 1.00 0.00 C ATOM 1016 CE LYS B 64 -1.865 -6.353 -2.229 1.00 0.00 C ATOM 1017 NZ LYS B 64 -2.615 -6.306 -0.946 1.00 0.00 N ATOM 0 H LYS B 64 -5.137 -2.432 -3.552 1.00 0.00 H new ATOM 0 HA LYS B 64 -5.557 -3.649 -6.011 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -3.469 -4.593 -5.584 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -3.456 -3.252 -4.457 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -4.269 -4.889 -2.671 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -3.973 -6.175 -3.825 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -1.581 -5.236 -4.043 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -1.945 -4.246 -2.643 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -2.092 -7.287 -2.744 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -0.795 -6.355 -2.020 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -2.379 -7.143 -0.375 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 -2.355 -5.445 -0.423 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -3.636 -6.297 -1.141 1.00 0.00 H new ATOM 1031 N ASP B 65 -6.567 -5.458 -3.496 1.00 0.00 N ATOM 1032 CA ASP B 65 -7.305 -6.653 -3.094 1.00 0.00 C ATOM 1033 C ASP B 65 -8.718 -6.656 -3.666 1.00 0.00 C ATOM 1034 O ASP B 65 -9.332 -7.713 -3.829 1.00 0.00 O ATOM 1035 CB ASP B 65 -7.355 -6.751 -1.568 1.00 0.00 C ATOM 1036 CG ASP B 65 -5.993 -7.015 -0.959 1.00 0.00 C ATOM 1037 OD1 ASP B 65 -5.225 -6.049 -0.767 1.00 0.00 O ATOM 1038 OD2 ASP B 65 -5.680 -8.193 -0.670 1.00 0.00 O ATOM 0 H ASP B 65 -6.342 -4.830 -2.724 1.00 0.00 H new ATOM 0 HA ASP B 65 -6.781 -7.521 -3.494 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -7.758 -5.824 -1.161 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -8.039 -7.550 -1.281 1.00 0.00 H new ATOM 1043 N PHE B 66 -9.227 -5.471 -3.969 1.00 0.00 N ATOM 1044 CA PHE B 66 -10.557 -5.326 -4.552 1.00 0.00 C ATOM 1045 C PHE B 66 -10.441 -5.112 -6.053 1.00 0.00 C ATOM 1046 O PHE B 66 -11.114 -5.767 -6.851 1.00 0.00 O ATOM 1047 CB PHE B 66 -11.275 -4.114 -3.951 1.00 0.00 C ATOM 1048 CG PHE B 66 -11.509 -4.180 -2.469 1.00 0.00 C ATOM 1049 CD1 PHE B 66 -12.796 -4.145 -1.957 1.00 0.00 C ATOM 1050 CD2 PHE B 66 -10.444 -4.256 -1.587 1.00 0.00 C ATOM 1051 CE1 PHE B 66 -13.011 -4.186 -0.596 1.00 0.00 C ATOM 1052 CE2 PHE B 66 -10.653 -4.300 -0.227 1.00 0.00 C ATOM 1053 CZ PHE B 66 -11.937 -4.263 0.270 1.00 0.00 C ATOM 0 H PHE B 66 -8.737 -4.589 -3.820 1.00 0.00 H new ATOM 0 HA PHE B 66 -11.122 -6.233 -4.339 1.00 0.00 H new ATOM 0 HB2 PHE B 66 -10.691 -3.220 -4.171 1.00 0.00 H new ATOM 0 HB3 PHE B 66 -12.237 -3.997 -4.450 1.00 0.00 H new ATOM 0 HD1 PHE B 66 -13.638 -4.085 -2.630 1.00 0.00 H new ATOM 0 HD2 PHE B 66 -9.435 -4.281 -1.972 1.00 0.00 H new ATOM 0 HE1 PHE B 66 -14.018 -4.158 -0.207 1.00 0.00 H new ATOM 0 HE2 PHE B 66 -9.813 -4.363 0.448 1.00 0.00 H new ATOM 0 HZ PHE B 66 -12.104 -4.294 1.336 1.00 0.00 H new ATOM 1184 N VAL B 74 5.584 -0.878 -1.684 1.00 0.00 N ATOM 1185 CA VAL B 74 6.570 -0.509 -0.703 1.00 0.00 C ATOM 1186 C VAL B 74 7.630 0.333 -1.399 1.00 0.00 C ATOM 1187 O VAL B 74 7.902 0.099 -2.569 1.00 0.00 O ATOM 1188 CB VAL B 74 7.185 -1.768 -0.057 1.00 0.00 C ATOM 1189 CG1 VAL B 74 6.098 -2.600 0.601 1.00 0.00 C ATOM 1190 CG2 VAL B 74 7.932 -2.598 -1.086 1.00 0.00 C ATOM 0 HA VAL B 74 6.113 0.070 0.100 1.00 0.00 H new ATOM 0 HB VAL B 74 7.898 -1.449 0.703 1.00 0.00 H new ATOM 0 HG11 VAL B 74 6.542 -3.486 1.054 1.00 0.00 H new ATOM 0 HG12 VAL B 74 5.603 -2.008 1.371 1.00 0.00 H new ATOM 0 HG13 VAL B 74 5.368 -2.903 -0.149 1.00 0.00 H new ATOM 0 HG21 VAL B 74 8.356 -3.479 -0.604 1.00 0.00 H new ATOM 0 HG22 VAL B 74 7.244 -2.909 -1.872 1.00 0.00 H new ATOM 0 HG23 VAL B 74 8.734 -2.002 -1.522 1.00 0.00 H new ATOM 1200 N LEU B 75 8.191 1.311 -0.699 1.00 0.00 N ATOM 1201 CA LEU B 75 9.084 2.310 -1.307 1.00 0.00 C ATOM 1202 C LEU B 75 10.225 1.680 -2.120 1.00 0.00 C ATOM 1203 O LEU B 75 11.313 1.431 -1.606 1.00 0.00 O ATOM 1204 CB LEU B 75 9.656 3.219 -0.217 1.00 0.00 C ATOM 1205 CG LEU B 75 10.327 2.481 0.944 1.00 0.00 C ATOM 1206 CD1 LEU B 75 11.784 2.894 1.065 1.00 0.00 C ATOM 1207 CD2 LEU B 75 9.585 2.746 2.240 1.00 0.00 C ATOM 0 H LEU B 75 8.046 1.441 0.302 1.00 0.00 H new ATOM 0 HA LEU B 75 8.485 2.892 -2.008 1.00 0.00 H new ATOM 0 HB2 LEU B 75 10.383 3.893 -0.670 1.00 0.00 H new ATOM 0 HB3 LEU B 75 8.851 3.838 0.180 1.00 0.00 H new ATOM 0 HG LEU B 75 10.291 1.411 0.742 1.00 0.00 H new ATOM 0 HD11 LEU B 75 12.246 2.360 1.895 1.00 0.00 H new ATOM 0 HD12 LEU B 75 12.309 2.652 0.141 1.00 0.00 H new ATOM 0 HD13 LEU B 75 11.844 3.967 1.246 1.00 0.00 H new ATOM 0 HD21 LEU B 75 10.075 2.214 3.055 1.00 0.00 H new ATOM 0 HD22 LEU B 75 9.590 3.816 2.450 1.00 0.00 H new ATOM 0 HD23 LEU B 75 8.556 2.399 2.147 1.00 0.00 H new ATOM 1219 N TRP B 76 9.971 1.430 -3.396 1.00 0.00 N ATOM 1220 CA TRP B 76 10.956 0.789 -4.250 1.00 0.00 C ATOM 1221 C TRP B 76 11.914 1.807 -4.837 1.00 0.00 C ATOM 1222 O TRP B 76 11.549 2.608 -5.700 1.00 0.00 O ATOM 1223 CB TRP B 76 10.290 -0.015 -5.372 1.00 0.00 C ATOM 1224 CG TRP B 76 9.757 -1.345 -4.928 1.00 0.00 C ATOM 1225 CD1 TRP B 76 8.460 -1.759 -4.954 1.00 0.00 C ATOM 1226 CD2 TRP B 76 10.513 -2.437 -4.395 1.00 0.00 C ATOM 1227 NE1 TRP B 76 8.363 -3.042 -4.471 1.00 0.00 N ATOM 1228 CE2 TRP B 76 9.609 -3.478 -4.122 1.00 0.00 C ATOM 1229 CE3 TRP B 76 11.866 -2.634 -4.124 1.00 0.00 C ATOM 1230 CZ2 TRP B 76 10.013 -4.696 -3.591 1.00 0.00 C ATOM 1231 CZ3 TRP B 76 12.266 -3.845 -3.597 1.00 0.00 C ATOM 1232 CH2 TRP B 76 11.344 -4.861 -3.335 1.00 0.00 C ATOM 0 H TRP B 76 9.093 1.661 -3.861 1.00 0.00 H new ATOM 0 HA TRP B 76 11.521 0.098 -3.625 1.00 0.00 H new ATOM 0 HB2 TRP B 76 9.473 0.572 -5.791 1.00 0.00 H new ATOM 0 HB3 TRP B 76 11.013 -0.172 -6.172 1.00 0.00 H new ATOM 0 HD1 TRP B 76 7.628 -1.165 -5.303 1.00 0.00 H new ATOM 0 HE1 TRP B 76 7.501 -3.581 -4.387 1.00 0.00 H new ATOM 0 HE3 TRP B 76 12.587 -1.855 -4.322 1.00 0.00 H new ATOM 0 HZ2 TRP B 76 9.301 -5.483 -3.388 1.00 0.00 H new ATOM 0 HZ3 TRP B 76 13.312 -4.010 -3.383 1.00 0.00 H new ATOM 0 HH2 TRP B 76 11.691 -5.796 -2.921 1.00 0.00 H new ATOM 1243 N THR B 77 13.136 1.769 -4.350 1.00 0.00 N ATOM 1244 CA THR B 77 14.200 2.606 -4.855 1.00 0.00 C ATOM 1245 C THR B 77 15.263 1.734 -5.497 1.00 0.00 C ATOM 1246 O THR B 77 15.153 0.509 -5.469 1.00 0.00 O ATOM 1247 CB THR B 77 14.841 3.417 -3.715 1.00 0.00 C ATOM 1248 OG1 THR B 77 15.300 2.524 -2.686 1.00 0.00 O ATOM 1249 CG2 THR B 77 13.848 4.408 -3.126 1.00 0.00 C ATOM 0 H THR B 77 13.419 1.153 -3.588 1.00 0.00 H new ATOM 0 HA THR B 77 13.782 3.295 -5.588 1.00 0.00 H new ATOM 0 HB THR B 77 15.684 3.975 -4.122 1.00 0.00 H new ATOM 0 HG1 THR B 77 15.709 3.042 -1.962 1.00 0.00 H new ATOM 0 HG21 THR B 77 14.326 4.968 -2.322 1.00 0.00 H new ATOM 0 HG22 THR B 77 13.518 5.098 -3.903 1.00 0.00 H new ATOM 0 HG23 THR B 77 12.987 3.869 -2.730 1.00 0.00 H new ATOM 1257 N GLY B 78 16.288 2.353 -6.066 1.00 0.00 N ATOM 1258 CA GLY B 78 17.415 1.596 -6.573 1.00 0.00 C ATOM 1259 C GLY B 78 18.103 0.826 -5.466 1.00 0.00 C ATOM 1260 O GLY B 78 18.633 -0.264 -5.687 1.00 0.00 O ATOM 0 H GLY B 78 16.359 3.363 -6.186 1.00 0.00 H new ATOM 0 HA2 GLY B 78 17.074 0.904 -7.343 1.00 0.00 H new ATOM 0 HA3 GLY B 78 18.127 2.272 -7.045 1.00 0.00 H new ATOM 1264 N ASP B 79 18.071 1.394 -4.263 1.00 0.00 N ATOM 1265 CA ASP B 79 18.652 0.754 -3.092 1.00 0.00 C ATOM 1266 C ASP B 79 17.819 -0.451 -2.681 1.00 0.00 C ATOM 1267 O ASP B 79 18.337 -1.560 -2.563 1.00 0.00 O ATOM 1268 CB ASP B 79 18.735 1.729 -1.912 1.00 0.00 C ATOM 1269 CG ASP B 79 19.503 2.994 -2.233 1.00 0.00 C ATOM 1270 OD1 ASP B 79 18.863 4.060 -2.355 1.00 0.00 O ATOM 1271 OD2 ASP B 79 20.740 2.930 -2.366 1.00 0.00 O ATOM 0 H ASP B 79 17.645 2.302 -4.076 1.00 0.00 H new ATOM 0 HA ASP B 79 19.659 0.434 -3.358 1.00 0.00 H new ATOM 0 HB2 ASP B 79 17.726 1.995 -1.598 1.00 0.00 H new ATOM 0 HB3 ASP B 79 19.210 1.228 -1.068 1.00 0.00 H new ATOM 1276 N GLN B 80 16.520 -0.235 -2.479 1.00 0.00 N ATOM 1277 CA GLN B 80 15.642 -1.303 -2.015 1.00 0.00 C ATOM 1278 C GLN B 80 15.496 -2.394 -3.072 1.00 0.00 C ATOM 1279 O GLN B 80 15.351 -3.575 -2.742 1.00 0.00 O ATOM 1280 CB GLN B 80 14.266 -0.768 -1.611 1.00 0.00 C ATOM 1281 CG GLN B 80 13.368 -1.858 -1.051 1.00 0.00 C ATOM 1282 CD GLN B 80 12.103 -1.343 -0.404 1.00 0.00 C ATOM 1283 OE1 GLN B 80 12.078 -1.059 0.791 1.00 0.00 O ATOM 1284 NE2 GLN B 80 11.036 -1.256 -1.178 1.00 0.00 N ATOM 0 H GLN B 80 16.057 0.662 -2.628 1.00 0.00 H new ATOM 0 HA GLN B 80 16.107 -1.738 -1.130 1.00 0.00 H new ATOM 0 HB2 GLN B 80 14.388 0.018 -0.866 1.00 0.00 H new ATOM 0 HB3 GLN B 80 13.786 -0.314 -2.478 1.00 0.00 H new ATOM 0 HG2 GLN B 80 13.099 -2.542 -1.856 1.00 0.00 H new ATOM 0 HG3 GLN B 80 13.930 -2.435 -0.317 1.00 0.00 H new ATOM 0 HE21 GLN B 80 11.101 -1.502 -2.166 1.00 0.00 H new ATOM 0 HE22 GLN B 80 10.147 -0.943 -0.788 1.00 0.00 H new ATOM 1293 N GLU B 81 15.545 -1.999 -4.338 1.00 0.00 N ATOM 1294 CA GLU B 81 15.499 -2.953 -5.439 1.00 0.00 C ATOM 1295 C GLU B 81 16.680 -3.910 -5.330 1.00 0.00 C ATOM 1296 O GLU B 81 16.542 -5.119 -5.523 1.00 0.00 O ATOM 1297 CB GLU B 81 15.531 -2.211 -6.777 1.00 0.00 C ATOM 1298 CG GLU B 81 15.370 -3.110 -7.990 1.00 0.00 C ATOM 1299 CD GLU B 81 15.263 -2.320 -9.277 1.00 0.00 C ATOM 1300 OE1 GLU B 81 16.294 -2.123 -9.946 1.00 0.00 O ATOM 1301 OE2 GLU B 81 14.143 -1.886 -9.616 1.00 0.00 O ATOM 0 H GLU B 81 15.617 -1.024 -4.628 1.00 0.00 H new ATOM 0 HA GLU B 81 14.573 -3.525 -5.386 1.00 0.00 H new ATOM 0 HB2 GLU B 81 14.738 -1.464 -6.785 1.00 0.00 H new ATOM 0 HB3 GLU B 81 16.476 -1.674 -6.859 1.00 0.00 H new ATOM 0 HG2 GLU B 81 16.220 -3.789 -8.052 1.00 0.00 H new ATOM 0 HG3 GLU B 81 14.479 -3.725 -7.868 1.00 0.00 H new ATOM 1308 N LEU B 82 17.835 -3.353 -4.987 1.00 0.00 N ATOM 1309 CA LEU B 82 19.031 -4.144 -4.772 1.00 0.00 C ATOM 1310 C LEU B 82 18.877 -5.015 -3.530 1.00 0.00 C ATOM 1311 O LEU B 82 19.245 -6.189 -3.546 1.00 0.00 O ATOM 1312 CB LEU B 82 20.249 -3.239 -4.618 1.00 0.00 C ATOM 1313 CG LEU B 82 21.566 -3.977 -4.407 1.00 0.00 C ATOM 1314 CD1 LEU B 82 22.047 -4.614 -5.701 1.00 0.00 C ATOM 1315 CD2 LEU B 82 22.609 -3.041 -3.841 1.00 0.00 C ATOM 0 H LEU B 82 17.965 -2.350 -4.852 1.00 0.00 H new ATOM 0 HA LEU B 82 19.175 -4.787 -5.641 1.00 0.00 H new ATOM 0 HB2 LEU B 82 20.336 -2.615 -5.507 1.00 0.00 H new ATOM 0 HB3 LEU B 82 20.083 -2.570 -3.774 1.00 0.00 H new ATOM 0 HG LEU B 82 21.399 -4.778 -3.687 1.00 0.00 H new ATOM 0 HD11 LEU B 82 22.988 -5.134 -5.523 1.00 0.00 H new ATOM 0 HD12 LEU B 82 21.301 -5.325 -6.056 1.00 0.00 H new ATOM 0 HD13 LEU B 82 22.197 -3.840 -6.454 1.00 0.00 H new ATOM 0 HD21 LEU B 82 23.544 -3.583 -3.696 1.00 0.00 H new ATOM 0 HD22 LEU B 82 22.772 -2.216 -4.534 1.00 0.00 H new ATOM 0 HD23 LEU B 82 22.265 -2.649 -2.884 1.00 0.00 H new ATOM 1327 N GLU B 83 18.331 -4.430 -2.457 1.00 0.00 N ATOM 1328 CA GLU B 83 18.094 -5.166 -1.212 1.00 0.00 C ATOM 1329 C GLU B 83 17.331 -6.451 -1.491 1.00 0.00 C ATOM 1330 O GLU B 83 17.692 -7.522 -1.004 1.00 0.00 O ATOM 1331 CB GLU B 83 17.283 -4.338 -0.211 1.00 0.00 C ATOM 1332 CG GLU B 83 17.976 -3.091 0.305 1.00 0.00 C ATOM 1333 CD GLU B 83 17.168 -2.418 1.398 1.00 0.00 C ATOM 1334 OE1 GLU B 83 16.032 -1.976 1.119 1.00 0.00 O ATOM 1335 OE2 GLU B 83 17.656 -2.344 2.543 1.00 0.00 O ATOM 0 H GLU B 83 18.046 -3.451 -2.427 1.00 0.00 H new ATOM 0 HA GLU B 83 19.072 -5.388 -0.785 1.00 0.00 H new ATOM 0 HB2 GLU B 83 16.345 -4.045 -0.682 1.00 0.00 H new ATOM 0 HB3 GLU B 83 17.029 -4.971 0.639 1.00 0.00 H new ATOM 0 HG2 GLU B 83 18.962 -3.354 0.689 1.00 0.00 H new ATOM 0 HG3 GLU B 83 18.130 -2.392 -0.517 1.00 0.00 H new ATOM 1342 N LEU B 84 16.265 -6.329 -2.271 1.00 0.00 N ATOM 1343 CA LEU B 84 15.461 -7.480 -2.642 1.00 0.00 C ATOM 1344 C LEU B 84 16.302 -8.499 -3.391 1.00 0.00 C ATOM 1345 O LEU B 84 16.341 -9.668 -3.019 1.00 0.00 O ATOM 1346 CB LEU B 84 14.278 -7.056 -3.512 1.00 0.00 C ATOM 1347 CG LEU B 84 13.483 -8.216 -4.119 1.00 0.00 C ATOM 1348 CD1 LEU B 84 12.882 -9.085 -3.027 1.00 0.00 C ATOM 1349 CD2 LEU B 84 12.396 -7.699 -5.043 1.00 0.00 C ATOM 0 H LEU B 84 15.939 -5.443 -2.658 1.00 0.00 H new ATOM 0 HA LEU B 84 15.082 -7.933 -1.726 1.00 0.00 H new ATOM 0 HB2 LEU B 84 13.603 -6.446 -2.912 1.00 0.00 H new ATOM 0 HB3 LEU B 84 14.646 -6.424 -4.320 1.00 0.00 H new ATOM 0 HG LEU B 84 14.170 -8.826 -4.706 1.00 0.00 H new ATOM 0 HD11 LEU B 84 12.322 -9.903 -3.480 1.00 0.00 H new ATOM 0 HD12 LEU B 84 13.680 -9.492 -2.406 1.00 0.00 H new ATOM 0 HD13 LEU B 84 12.213 -8.484 -2.411 1.00 0.00 H new ATOM 0 HD21 LEU B 84 11.844 -8.540 -5.462 1.00 0.00 H new ATOM 0 HD22 LEU B 84 11.713 -7.062 -4.481 1.00 0.00 H new ATOM 0 HD23 LEU B 84 12.848 -7.123 -5.850 1.00 0.00 H new ATOM 1361 N GLN B 85 16.981 -8.033 -4.432 1.00 0.00 N ATOM 1362 CA GLN B 85 17.761 -8.904 -5.297 1.00 0.00 C ATOM 1363 C GLN B 85 18.807 -9.688 -4.512 1.00 0.00 C ATOM 1364 O GLN B 85 18.890 -10.908 -4.636 1.00 0.00 O ATOM 1365 CB GLN B 85 18.445 -8.092 -6.394 1.00 0.00 C ATOM 1366 CG GLN B 85 19.197 -8.958 -7.384 1.00 0.00 C ATOM 1367 CD GLN B 85 19.905 -8.154 -8.450 1.00 0.00 C ATOM 1368 OE1 GLN B 85 19.332 -7.834 -9.489 1.00 0.00 O ATOM 1369 NE2 GLN B 85 21.168 -7.845 -8.214 1.00 0.00 N ATOM 0 H GLN B 85 17.006 -7.048 -4.698 1.00 0.00 H new ATOM 0 HA GLN B 85 17.071 -9.616 -5.749 1.00 0.00 H new ATOM 0 HB2 GLN B 85 17.696 -7.506 -6.927 1.00 0.00 H new ATOM 0 HB3 GLN B 85 19.138 -7.385 -5.938 1.00 0.00 H new ATOM 0 HG2 GLN B 85 19.928 -9.564 -6.848 1.00 0.00 H new ATOM 0 HG3 GLN B 85 18.499 -9.647 -7.859 1.00 0.00 H new ATOM 0 HE21 GLN B 85 21.608 -8.129 -7.339 1.00 0.00 H new ATOM 0 HE22 GLN B 85 21.703 -7.322 -8.907 1.00 0.00 H new ATOM 1378 N ARG B 86 19.592 -8.986 -3.703 1.00 0.00 N ATOM 1379 CA ARG B 86 20.668 -9.618 -2.943 1.00 0.00 C ATOM 1380 C ARG B 86 20.145 -10.766 -2.083 1.00 0.00 C ATOM 1381 O ARG B 86 20.646 -11.887 -2.166 1.00 0.00 O ATOM 1382 CB ARG B 86 21.384 -8.593 -2.067 1.00 0.00 C ATOM 1383 CG ARG B 86 21.977 -7.440 -2.858 1.00 0.00 C ATOM 1384 CD ARG B 86 22.862 -6.562 -1.985 1.00 0.00 C ATOM 1385 NE ARG B 86 24.016 -7.291 -1.466 1.00 0.00 N ATOM 1386 CZ ARG B 86 24.780 -6.861 -0.461 1.00 0.00 C ATOM 1387 NH1 ARG B 86 24.513 -5.708 0.141 1.00 0.00 N ATOM 1388 NH2 ARG B 86 25.814 -7.585 -0.057 1.00 0.00 N ATOM 0 H ARG B 86 19.505 -7.980 -3.555 1.00 0.00 H new ATOM 0 HA ARG B 86 21.378 -10.028 -3.661 1.00 0.00 H new ATOM 0 HB2 ARG B 86 20.682 -8.198 -1.333 1.00 0.00 H new ATOM 0 HB3 ARG B 86 22.179 -9.091 -1.512 1.00 0.00 H new ATOM 0 HG2 ARG B 86 22.560 -7.831 -3.692 1.00 0.00 H new ATOM 0 HG3 ARG B 86 21.174 -6.839 -3.285 1.00 0.00 H new ATOM 0 HD2 ARG B 86 23.205 -5.705 -2.564 1.00 0.00 H new ATOM 0 HD3 ARG B 86 22.276 -6.171 -1.153 1.00 0.00 H new ATOM 0 HE ARG B 86 24.252 -8.184 -1.899 1.00 0.00 H new ATOM 0 HH11 ARG B 86 23.719 -5.145 -0.165 1.00 0.00 H new ATOM 0 HH12 ARG B 86 25.102 -5.385 0.909 1.00 0.00 H new ATOM 0 HH21 ARG B 86 26.026 -8.472 -0.515 1.00 0.00 H new ATOM 0 HH22 ARG B 86 26.398 -7.256 0.712 1.00 0.00 H new ATOM 1402 N LEU B 87 19.129 -10.492 -1.271 1.00 0.00 N ATOM 1403 CA LEU B 87 18.542 -11.521 -0.417 1.00 0.00 C ATOM 1404 C LEU B 87 17.909 -12.625 -1.254 1.00 0.00 C ATOM 1405 O LEU B 87 18.012 -13.808 -0.920 1.00 0.00 O ATOM 1406 CB LEU B 87 17.494 -10.926 0.523 1.00 0.00 C ATOM 1407 CG LEU B 87 18.039 -10.324 1.822 1.00 0.00 C ATOM 1408 CD1 LEU B 87 18.808 -9.040 1.560 1.00 0.00 C ATOM 1409 CD2 LEU B 87 16.905 -10.079 2.793 1.00 0.00 C ATOM 0 H LEU B 87 18.696 -9.572 -1.186 1.00 0.00 H new ATOM 0 HA LEU B 87 19.348 -11.946 0.181 1.00 0.00 H new ATOM 0 HB2 LEU B 87 16.947 -10.151 -0.015 1.00 0.00 H new ATOM 0 HB3 LEU B 87 16.775 -11.705 0.778 1.00 0.00 H new ATOM 0 HG LEU B 87 18.735 -11.038 2.262 1.00 0.00 H new ATOM 0 HD11 LEU B 87 19.180 -8.640 2.503 1.00 0.00 H new ATOM 0 HD12 LEU B 87 19.648 -9.248 0.897 1.00 0.00 H new ATOM 0 HD13 LEU B 87 18.148 -8.310 1.092 1.00 0.00 H new ATOM 0 HD21 LEU B 87 17.301 -9.651 3.714 1.00 0.00 H new ATOM 0 HD22 LEU B 87 16.189 -9.387 2.349 1.00 0.00 H new ATOM 0 HD23 LEU B 87 16.407 -11.022 3.016 1.00 0.00 H new ATOM 1421 N PHE B 88 17.261 -12.225 -2.340 1.00 0.00 N ATOM 1422 CA PHE B 88 16.671 -13.161 -3.280 1.00 0.00 C ATOM 1423 C PHE B 88 17.710 -14.166 -3.767 1.00 0.00 C ATOM 1424 O PHE B 88 17.466 -15.366 -3.754 1.00 0.00 O ATOM 1425 CB PHE B 88 16.059 -12.388 -4.454 1.00 0.00 C ATOM 1426 CG PHE B 88 15.895 -13.189 -5.710 1.00 0.00 C ATOM 1427 CD1 PHE B 88 14.843 -14.077 -5.860 1.00 0.00 C ATOM 1428 CD2 PHE B 88 16.800 -13.043 -6.748 1.00 0.00 C ATOM 1429 CE1 PHE B 88 14.698 -14.803 -7.028 1.00 0.00 C ATOM 1430 CE2 PHE B 88 16.662 -13.766 -7.913 1.00 0.00 C ATOM 1431 CZ PHE B 88 15.612 -14.646 -8.052 1.00 0.00 C ATOM 0 H PHE B 88 17.131 -11.245 -2.591 1.00 0.00 H new ATOM 0 HA PHE B 88 15.883 -13.722 -2.779 1.00 0.00 H new ATOM 0 HB2 PHE B 88 15.084 -12.007 -4.152 1.00 0.00 H new ATOM 0 HB3 PHE B 88 16.687 -11.523 -4.669 1.00 0.00 H new ATOM 0 HD1 PHE B 88 14.130 -14.204 -5.059 1.00 0.00 H new ATOM 0 HD2 PHE B 88 17.625 -12.354 -6.643 1.00 0.00 H new ATOM 0 HE1 PHE B 88 13.873 -15.491 -7.139 1.00 0.00 H new ATOM 0 HE2 PHE B 88 17.375 -13.643 -8.715 1.00 0.00 H new ATOM 0 HZ PHE B 88 15.503 -15.215 -8.964 1.00 0.00 H new ATOM 1441 N GLU B 89 18.870 -13.670 -4.176 1.00 0.00 N ATOM 1442 CA GLU B 89 19.952 -14.528 -4.646 1.00 0.00 C ATOM 1443 C GLU B 89 20.490 -15.395 -3.517 1.00 0.00 C ATOM 1444 O GLU B 89 20.795 -16.574 -3.706 1.00 0.00 O ATOM 1445 CB GLU B 89 21.102 -13.685 -5.183 1.00 0.00 C ATOM 1446 CG GLU B 89 20.728 -12.771 -6.331 1.00 0.00 C ATOM 1447 CD GLU B 89 21.896 -11.907 -6.769 1.00 0.00 C ATOM 1448 OE1 GLU B 89 22.954 -12.475 -7.126 1.00 0.00 O ATOM 1449 OE2 GLU B 89 21.772 -10.668 -6.757 1.00 0.00 O ATOM 0 H GLU B 89 19.087 -12.674 -4.192 1.00 0.00 H new ATOM 0 HA GLU B 89 19.546 -15.162 -5.435 1.00 0.00 H new ATOM 0 HB2 GLU B 89 21.503 -13.080 -4.370 1.00 0.00 H new ATOM 0 HB3 GLU B 89 21.901 -14.350 -5.510 1.00 0.00 H new ATOM 0 HG2 GLU B 89 20.383 -13.369 -7.174 1.00 0.00 H new ATOM 0 HG3 GLU B 89 19.897 -12.133 -6.031 1.00 0.00 H new ATOM 1456 N GLU B 90 20.595 -14.804 -2.339 1.00 0.00 N ATOM 1457 CA GLU B 90 21.272 -15.434 -1.224 1.00 0.00 C ATOM 1458 C GLU B 90 20.477 -16.600 -0.642 1.00 0.00 C ATOM 1459 O GLU B 90 21.056 -17.600 -0.215 1.00 0.00 O ATOM 1460 CB GLU B 90 21.550 -14.391 -0.153 1.00 0.00 C ATOM 1461 CG GLU B 90 22.773 -13.541 -0.443 1.00 0.00 C ATOM 1462 CD GLU B 90 23.983 -14.374 -0.807 1.00 0.00 C ATOM 1463 OE1 GLU B 90 24.377 -15.243 -0.004 1.00 0.00 O ATOM 1464 OE2 GLU B 90 24.546 -14.164 -1.897 1.00 0.00 O ATOM 0 H GLU B 90 20.215 -13.880 -2.132 1.00 0.00 H new ATOM 0 HA GLU B 90 22.210 -15.850 -1.592 1.00 0.00 H new ATOM 0 HB2 GLU B 90 20.680 -13.741 -0.054 1.00 0.00 H new ATOM 0 HB3 GLU B 90 21.684 -14.892 0.806 1.00 0.00 H new ATOM 0 HG2 GLU B 90 22.549 -12.854 -1.260 1.00 0.00 H new ATOM 0 HG3 GLU B 90 23.004 -12.932 0.431 1.00 0.00 H new ATOM 1471 N PHE B 91 19.159 -16.475 -0.629 1.00 0.00 N ATOM 1472 CA PHE B 91 18.308 -17.505 -0.046 1.00 0.00 C ATOM 1473 C PHE B 91 17.482 -18.205 -1.120 1.00 0.00 C ATOM 1474 O PHE B 91 16.494 -18.872 -0.822 1.00 0.00 O ATOM 1475 CB PHE B 91 17.382 -16.888 1.003 1.00 0.00 C ATOM 1476 CG PHE B 91 18.108 -16.187 2.118 1.00 0.00 C ATOM 1477 CD1 PHE B 91 18.747 -16.914 3.110 1.00 0.00 C ATOM 1478 CD2 PHE B 91 18.147 -14.804 2.174 1.00 0.00 C ATOM 1479 CE1 PHE B 91 19.414 -16.273 4.135 1.00 0.00 C ATOM 1480 CE2 PHE B 91 18.812 -14.158 3.197 1.00 0.00 C ATOM 1481 CZ PHE B 91 19.446 -14.892 4.180 1.00 0.00 C ATOM 0 H PHE B 91 18.656 -15.675 -1.013 1.00 0.00 H new ATOM 0 HA PHE B 91 18.950 -18.246 0.430 1.00 0.00 H new ATOM 0 HB2 PHE B 91 16.716 -16.178 0.513 1.00 0.00 H new ATOM 0 HB3 PHE B 91 16.755 -17.673 1.427 1.00 0.00 H new ATOM 0 HD1 PHE B 91 18.723 -17.993 3.081 1.00 0.00 H new ATOM 0 HD2 PHE B 91 17.652 -14.224 1.409 1.00 0.00 H new ATOM 0 HE1 PHE B 91 19.910 -16.850 4.901 1.00 0.00 H new ATOM 0 HE2 PHE B 91 18.836 -13.079 3.228 1.00 0.00 H new ATOM 0 HZ PHE B 91 19.965 -14.388 4.982 1.00 0.00 H new ATOM 1491 N ARG B 92 17.909 -18.062 -2.365 1.00 0.00 N ATOM 1492 CA ARG B 92 17.160 -18.572 -3.512 1.00 0.00 C ATOM 1493 C ARG B 92 17.158 -20.097 -3.550 1.00 0.00 C ATOM 1494 O ARG B 92 16.189 -20.723 -3.978 1.00 0.00 O ATOM 1495 CB ARG B 92 17.781 -18.040 -4.791 1.00 0.00 C ATOM 1496 CG ARG B 92 16.885 -18.153 -6.000 1.00 0.00 C ATOM 1497 CD ARG B 92 17.648 -17.777 -7.252 1.00 0.00 C ATOM 1498 NE ARG B 92 18.816 -18.633 -7.445 1.00 0.00 N ATOM 1499 CZ ARG B 92 19.899 -18.284 -8.139 1.00 0.00 C ATOM 1500 NH1 ARG B 92 19.922 -17.145 -8.823 1.00 0.00 N ATOM 1501 NH2 ARG B 92 20.951 -19.090 -8.166 1.00 0.00 N ATOM 0 H ARG B 92 18.780 -17.592 -2.612 1.00 0.00 H new ATOM 0 HA ARG B 92 16.128 -18.235 -3.419 1.00 0.00 H new ATOM 0 HB2 ARG B 92 18.048 -16.993 -4.645 1.00 0.00 H new ATOM 0 HB3 ARG B 92 18.707 -18.581 -4.986 1.00 0.00 H new ATOM 0 HG2 ARG B 92 16.507 -19.172 -6.088 1.00 0.00 H new ATOM 0 HG3 ARG B 92 16.020 -17.501 -5.883 1.00 0.00 H new ATOM 0 HD2 ARG B 92 16.990 -17.857 -8.118 1.00 0.00 H new ATOM 0 HD3 ARG B 92 17.965 -16.736 -7.187 1.00 0.00 H new ATOM 0 HE ARG B 92 18.802 -19.560 -7.020 1.00 0.00 H new ATOM 0 HH11 ARG B 92 19.107 -16.531 -8.819 1.00 0.00 H new ATOM 0 HH12 ARG B 92 20.754 -16.884 -9.352 1.00 0.00 H new ATOM 0 HH21 ARG B 92 20.930 -19.974 -7.657 1.00 0.00 H new ATOM 0 HH22 ARG B 92 21.782 -18.827 -8.696 1.00 0.00 H new ATOM 1515 N ASP B 93 18.255 -20.678 -3.097 1.00 0.00 N ATOM 1516 CA ASP B 93 18.447 -22.129 -3.115 1.00 0.00 C ATOM 1517 C ASP B 93 17.673 -22.830 -1.997 1.00 0.00 C ATOM 1518 O ASP B 93 17.956 -23.981 -1.665 1.00 0.00 O ATOM 1519 CB ASP B 93 19.935 -22.464 -2.988 1.00 0.00 C ATOM 1520 CG ASP B 93 20.523 -22.012 -1.665 1.00 0.00 C ATOM 1521 OD1 ASP B 93 20.856 -22.879 -0.831 1.00 0.00 O ATOM 1522 OD2 ASP B 93 20.652 -20.789 -1.454 1.00 0.00 O ATOM 0 H ASP B 93 19.042 -20.162 -2.705 1.00 0.00 H new ATOM 0 HA ASP B 93 18.061 -22.491 -4.068 1.00 0.00 H new ATOM 0 HB2 ASP B 93 20.072 -23.540 -3.094 1.00 0.00 H new ATOM 0 HB3 ASP B 93 20.481 -21.992 -3.805 1.00 0.00 H new ATOM 1527 N SER B 94 16.686 -22.155 -1.433 1.00 0.00 N ATOM 1528 CA SER B 94 15.848 -22.766 -0.419 1.00 0.00 C ATOM 1529 C SER B 94 14.492 -23.122 -1.019 1.00 0.00 C ATOM 1530 O SER B 94 14.244 -22.862 -2.197 1.00 0.00 O ATOM 1531 CB SER B 94 15.682 -21.834 0.786 1.00 0.00 C ATOM 1532 OG SER B 94 15.037 -20.624 0.427 1.00 0.00 O ATOM 0 H SER B 94 16.447 -21.189 -1.659 1.00 0.00 H new ATOM 0 HA SER B 94 16.329 -23.679 -0.068 1.00 0.00 H new ATOM 0 HB2 SER B 94 15.104 -22.339 1.560 1.00 0.00 H new ATOM 0 HB3 SER B 94 16.660 -21.612 1.212 1.00 0.00 H new ATOM 0 HG SER B 94 15.619 -20.108 -0.169 1.00 0.00 H new ATOM 1538 N ASP B 95 13.627 -23.730 -0.224 1.00 0.00 N ATOM 1539 CA ASP B 95 12.309 -24.127 -0.707 1.00 0.00 C ATOM 1540 C ASP B 95 11.411 -22.908 -0.854 1.00 0.00 C ATOM 1541 O ASP B 95 10.500 -22.884 -1.681 1.00 0.00 O ATOM 1542 CB ASP B 95 11.664 -25.139 0.245 1.00 0.00 C ATOM 1543 CG ASP B 95 12.437 -26.439 0.339 1.00 0.00 C ATOM 1544 OD1 ASP B 95 13.296 -26.563 1.240 1.00 0.00 O ATOM 1545 OD2 ASP B 95 12.189 -27.349 -0.480 1.00 0.00 O ATOM 0 H ASP B 95 13.809 -23.960 0.753 1.00 0.00 H new ATOM 0 HA ASP B 95 12.432 -24.598 -1.682 1.00 0.00 H new ATOM 0 HB2 ASP B 95 11.586 -24.697 1.238 1.00 0.00 H new ATOM 0 HB3 ASP B 95 10.649 -25.350 -0.091 1.00 0.00 H new ATOM 1550 N ASP B 96 11.689 -21.896 -0.053 1.00 0.00 N ATOM 1551 CA ASP B 96 10.927 -20.659 -0.079 1.00 0.00 C ATOM 1552 C ASP B 96 11.853 -19.477 0.160 1.00 0.00 C ATOM 1553 O ASP B 96 12.251 -19.204 1.295 1.00 0.00 O ATOM 1554 CB ASP B 96 9.828 -20.695 0.984 1.00 0.00 C ATOM 1555 CG ASP B 96 8.997 -19.432 1.018 1.00 0.00 C ATOM 1556 OD1 ASP B 96 9.416 -18.460 1.672 1.00 0.00 O ATOM 1557 OD2 ASP B 96 7.908 -19.414 0.412 1.00 0.00 O ATOM 0 H ASP B 96 12.445 -21.907 0.631 1.00 0.00 H new ATOM 0 HA ASP B 96 10.460 -20.549 -1.058 1.00 0.00 H new ATOM 0 HB2 ASP B 96 9.176 -21.548 0.795 1.00 0.00 H new ATOM 0 HB3 ASP B 96 10.282 -20.851 1.963 1.00 0.00 H new ATOM 1562 N VAL B 97 12.217 -18.789 -0.911 1.00 0.00 N ATOM 1563 CA VAL B 97 13.156 -17.679 -0.817 1.00 0.00 C ATOM 1564 C VAL B 97 12.495 -16.435 -0.218 1.00 0.00 C ATOM 1565 O VAL B 97 13.122 -15.701 0.547 1.00 0.00 O ATOM 1566 CB VAL B 97 13.785 -17.343 -2.197 1.00 0.00 C ATOM 1567 CG1 VAL B 97 12.730 -16.967 -3.224 1.00 0.00 C ATOM 1568 CG2 VAL B 97 14.816 -16.233 -2.077 1.00 0.00 C ATOM 0 H VAL B 97 11.878 -18.978 -1.854 1.00 0.00 H new ATOM 0 HA VAL B 97 13.956 -17.997 -0.148 1.00 0.00 H new ATOM 0 HB VAL B 97 14.285 -18.248 -2.543 1.00 0.00 H new ATOM 0 HG11 VAL B 97 13.212 -16.740 -4.175 1.00 0.00 H new ATOM 0 HG12 VAL B 97 12.039 -17.800 -3.358 1.00 0.00 H new ATOM 0 HG13 VAL B 97 12.181 -16.092 -2.877 1.00 0.00 H new ATOM 0 HG21 VAL B 97 15.238 -16.021 -3.059 1.00 0.00 H new ATOM 0 HG22 VAL B 97 14.339 -15.335 -1.685 1.00 0.00 H new ATOM 0 HG23 VAL B 97 15.611 -16.546 -1.400 1.00 0.00 H new ATOM 1578 N LEU B 98 11.214 -16.236 -0.517 1.00 0.00 N ATOM 1579 CA LEU B 98 10.522 -15.007 -0.141 1.00 0.00 C ATOM 1580 C LEU B 98 10.384 -14.853 1.367 1.00 0.00 C ATOM 1581 O LEU B 98 10.495 -13.743 1.887 1.00 0.00 O ATOM 1582 CB LEU B 98 9.143 -14.927 -0.787 1.00 0.00 C ATOM 1583 CG LEU B 98 9.134 -14.741 -2.302 1.00 0.00 C ATOM 1584 CD1 LEU B 98 9.236 -16.074 -3.022 1.00 0.00 C ATOM 1585 CD2 LEU B 98 7.881 -14.004 -2.723 1.00 0.00 C ATOM 0 H LEU B 98 10.635 -16.910 -1.018 1.00 0.00 H new ATOM 0 HA LEU B 98 11.141 -14.189 -0.509 1.00 0.00 H new ATOM 0 HB2 LEU B 98 8.596 -15.839 -0.548 1.00 0.00 H new ATOM 0 HB3 LEU B 98 8.597 -14.100 -0.334 1.00 0.00 H new ATOM 0 HG LEU B 98 10.006 -14.149 -2.579 1.00 0.00 H new ATOM 0 HD11 LEU B 98 9.227 -15.907 -4.099 1.00 0.00 H new ATOM 0 HD12 LEU B 98 10.164 -16.570 -2.739 1.00 0.00 H new ATOM 0 HD13 LEU B 98 8.390 -16.703 -2.745 1.00 0.00 H new ATOM 0 HD21 LEU B 98 7.881 -13.875 -3.805 1.00 0.00 H new ATOM 0 HD22 LEU B 98 7.004 -14.579 -2.426 1.00 0.00 H new ATOM 0 HD23 LEU B 98 7.854 -13.027 -2.241 1.00 0.00 H new ATOM 1597 N GLY B 99 10.135 -15.955 2.066 1.00 0.00 N ATOM 1598 CA GLY B 99 10.009 -15.904 3.510 1.00 0.00 C ATOM 1599 C GLY B 99 11.276 -15.409 4.168 1.00 0.00 C ATOM 1600 O GLY B 99 11.231 -14.699 5.166 1.00 0.00 O ATOM 0 H GLY B 99 10.018 -16.883 1.658 1.00 0.00 H new ATOM 0 HA2 GLY B 99 9.180 -15.249 3.779 1.00 0.00 H new ATOM 0 HA3 GLY B 99 9.767 -16.897 3.889 1.00 0.00 H new ATOM 1604 N HIS B 100 12.408 -15.763 3.580 1.00 0.00 N ATOM 1605 CA HIS B 100 13.699 -15.338 4.095 1.00 0.00 C ATOM 1606 C HIS B 100 13.937 -13.874 3.756 1.00 0.00 C ATOM 1607 O HIS B 100 14.669 -13.175 4.453 1.00 0.00 O ATOM 1608 CB HIS B 100 14.818 -16.205 3.514 1.00 0.00 C ATOM 1609 CG HIS B 100 14.692 -17.660 3.852 1.00 0.00 C ATOM 1610 ND1 HIS B 100 14.849 -18.667 2.924 1.00 0.00 N ATOM 1611 CD2 HIS B 100 14.436 -18.278 5.030 1.00 0.00 C ATOM 1612 CE1 HIS B 100 14.700 -19.834 3.518 1.00 0.00 C ATOM 1613 NE2 HIS B 100 14.451 -19.628 4.794 1.00 0.00 N ATOM 0 H HIS B 100 12.458 -16.345 2.744 1.00 0.00 H new ATOM 0 HA HIS B 100 13.700 -15.455 5.179 1.00 0.00 H new ATOM 0 HB2 HIS B 100 14.827 -16.093 2.430 1.00 0.00 H new ATOM 0 HB3 HIS B 100 15.777 -15.838 3.880 1.00 0.00 H new ATOM 0 HD2 HIS B 100 14.254 -17.796 5.979 1.00 0.00 H new ATOM 0 HE1 HIS B 100 14.770 -20.799 3.038 1.00 0.00 H new ATOM 0 HE2 HIS B 100 14.295 -20.354 5.493 1.00 0.00 H new ATOM 1622 N ILE B 101 13.298 -13.416 2.686 1.00 0.00 N ATOM 1623 CA ILE B 101 13.407 -12.031 2.258 1.00 0.00 C ATOM 1624 C ILE B 101 12.697 -11.105 3.238 1.00 0.00 C ATOM 1625 O ILE B 101 13.335 -10.295 3.910 1.00 0.00 O ATOM 1626 CB ILE B 101 12.808 -11.826 0.847 1.00 0.00 C ATOM 1627 CG1 ILE B 101 13.576 -12.659 -0.186 1.00 0.00 C ATOM 1628 CG2 ILE B 101 12.826 -10.348 0.467 1.00 0.00 C ATOM 1629 CD1 ILE B 101 13.031 -12.541 -1.595 1.00 0.00 C ATOM 0 H ILE B 101 12.695 -13.990 2.097 1.00 0.00 H new ATOM 0 HA ILE B 101 14.469 -11.788 2.229 1.00 0.00 H new ATOM 0 HB ILE B 101 11.771 -12.163 0.859 1.00 0.00 H new ATOM 0 HG12 ILE B 101 14.621 -12.350 -0.184 1.00 0.00 H new ATOM 0 HG13 ILE B 101 13.553 -13.706 0.116 1.00 0.00 H new ATOM 0 HG21 ILE B 101 12.401 -10.223 -0.529 1.00 0.00 H new ATOM 0 HG22 ILE B 101 12.237 -9.780 1.187 1.00 0.00 H new ATOM 0 HG23 ILE B 101 13.853 -9.984 0.471 1.00 0.00 H new ATOM 0 HD11 ILE B 101 13.626 -13.158 -2.268 1.00 0.00 H new ATOM 0 HD12 ILE B 101 11.995 -12.879 -1.614 1.00 0.00 H new ATOM 0 HD13 ILE B 101 13.080 -11.501 -1.918 1.00 0.00 H new ATOM 1641 N MET B 102 11.379 -11.258 3.338 1.00 0.00 N ATOM 1642 CA MET B 102 10.549 -10.360 4.143 1.00 0.00 C ATOM 1643 C MET B 102 10.893 -10.435 5.632 1.00 0.00 C ATOM 1644 O MET B 102 10.613 -9.499 6.384 1.00 0.00 O ATOM 1645 CB MET B 102 9.052 -10.644 3.923 1.00 0.00 C ATOM 1646 CG MET B 102 8.714 -12.120 3.794 1.00 0.00 C ATOM 1647 SD MET B 102 6.958 -12.488 3.995 1.00 0.00 S ATOM 1648 CE MET B 102 6.269 -11.633 2.587 1.00 0.00 C ATOM 0 H MET B 102 10.859 -11.999 2.869 1.00 0.00 H new ATOM 0 HA MET B 102 10.765 -9.346 3.807 1.00 0.00 H new ATOM 0 HB2 MET B 102 8.487 -10.224 4.755 1.00 0.00 H new ATOM 0 HB3 MET B 102 8.723 -10.127 3.022 1.00 0.00 H new ATOM 0 HG2 MET B 102 9.040 -12.473 2.816 1.00 0.00 H new ATOM 0 HG3 MET B 102 9.280 -12.679 4.539 1.00 0.00 H new ATOM 0 HE1 MET B 102 5.601 -10.844 2.932 1.00 0.00 H new ATOM 0 HE2 MET B 102 7.074 -11.195 1.997 1.00 0.00 H new ATOM 0 HE3 MET B 102 5.710 -12.338 1.971 1.00 0.00 H new ATOM 1658 N LYS B 103 11.510 -11.530 6.060 1.00 0.00 N ATOM 1659 CA LYS B 103 11.877 -11.687 7.463 1.00 0.00 C ATOM 1660 C LYS B 103 13.234 -11.059 7.777 1.00 0.00 C ATOM 1661 O LYS B 103 13.441 -10.547 8.877 1.00 0.00 O ATOM 1662 CB LYS B 103 11.886 -13.163 7.868 1.00 0.00 C ATOM 1663 CG LYS B 103 10.570 -13.646 8.465 1.00 0.00 C ATOM 1664 CD LYS B 103 9.409 -13.510 7.492 1.00 0.00 C ATOM 1665 CE LYS B 103 8.096 -13.944 8.125 1.00 0.00 C ATOM 1666 NZ LYS B 103 7.729 -13.085 9.282 1.00 0.00 N ATOM 0 H LYS B 103 11.765 -12.316 5.462 1.00 0.00 H new ATOM 0 HA LYS B 103 11.119 -11.161 8.043 1.00 0.00 H new ATOM 0 HB2 LYS B 103 12.121 -13.769 6.993 1.00 0.00 H new ATOM 0 HB3 LYS B 103 12.684 -13.326 8.592 1.00 0.00 H new ATOM 0 HG2 LYS B 103 10.671 -14.690 8.763 1.00 0.00 H new ATOM 0 HG3 LYS B 103 10.353 -13.076 9.368 1.00 0.00 H new ATOM 0 HD2 LYS B 103 9.330 -12.474 7.161 1.00 0.00 H new ATOM 0 HD3 LYS B 103 9.604 -14.114 6.605 1.00 0.00 H new ATOM 0 HE2 LYS B 103 7.303 -13.906 7.378 1.00 0.00 H new ATOM 0 HE3 LYS B 103 8.176 -14.980 8.453 1.00 0.00 H new ATOM 0 HZ1 LYS B 103 6.735 -13.252 9.537 1.00 0.00 H new ATOM 0 HZ2 LYS B 103 8.337 -13.316 10.093 1.00 0.00 H new ATOM 0 HZ3 LYS B 103 7.858 -12.085 9.027 1.00 0.00 H new ATOM 1680 N ASN B 104 14.157 -11.089 6.822 1.00 0.00 N ATOM 1681 CA ASN B 104 15.514 -10.599 7.074 1.00 0.00 C ATOM 1682 C ASN B 104 15.665 -9.131 6.677 1.00 0.00 C ATOM 1683 O ASN B 104 16.581 -8.446 7.134 1.00 0.00 O ATOM 1684 CB ASN B 104 16.549 -11.455 6.333 1.00 0.00 C ATOM 1685 CG ASN B 104 17.978 -11.131 6.740 1.00 0.00 C ATOM 1686 OD1 ASN B 104 18.495 -11.680 7.711 1.00 0.00 O ATOM 1687 ND2 ASN B 104 18.637 -10.251 5.997 1.00 0.00 N ATOM 0 H ASN B 104 13.998 -11.441 5.878 1.00 0.00 H new ATOM 0 HA ASN B 104 15.693 -10.679 8.146 1.00 0.00 H new ATOM 0 HB2 ASN B 104 16.350 -12.509 6.528 1.00 0.00 H new ATOM 0 HB3 ASN B 104 16.438 -11.303 5.259 1.00 0.00 H new ATOM 0 HD21 ASN B 104 19.602 -10.012 6.225 1.00 0.00 H new ATOM 0 HD22 ASN B 104 18.179 -9.813 5.198 1.00 0.00 H new ATOM 1694 N ILE B 105 14.768 -8.635 5.837 1.00 0.00 N ATOM 1695 CA ILE B 105 14.857 -7.251 5.397 1.00 0.00 C ATOM 1696 C ILE B 105 14.060 -6.340 6.315 1.00 0.00 C ATOM 1697 O ILE B 105 13.084 -6.760 6.941 1.00 0.00 O ATOM 1698 CB ILE B 105 14.390 -7.069 3.935 1.00 0.00 C ATOM 1699 CG1 ILE B 105 14.751 -5.676 3.416 1.00 0.00 C ATOM 1700 CG2 ILE B 105 12.891 -7.309 3.791 1.00 0.00 C ATOM 1701 CD1 ILE B 105 16.241 -5.419 3.335 1.00 0.00 C ATOM 0 H ILE B 105 13.983 -9.160 5.452 1.00 0.00 H new ATOM 0 HA ILE B 105 15.910 -6.974 5.444 1.00 0.00 H new ATOM 0 HB ILE B 105 14.912 -7.814 3.334 1.00 0.00 H new ATOM 0 HG12 ILE B 105 14.315 -5.544 2.426 1.00 0.00 H new ATOM 0 HG13 ILE B 105 14.298 -4.928 4.066 1.00 0.00 H new ATOM 0 HG21 ILE B 105 12.599 -7.172 2.750 1.00 0.00 H new ATOM 0 HG22 ILE B 105 12.654 -8.326 4.104 1.00 0.00 H new ATOM 0 HG23 ILE B 105 12.347 -6.601 4.416 1.00 0.00 H new ATOM 0 HD11 ILE B 105 16.416 -4.411 2.959 1.00 0.00 H new ATOM 0 HD12 ILE B 105 16.682 -5.518 4.327 1.00 0.00 H new ATOM 0 HD13 ILE B 105 16.699 -6.143 2.661 1.00 0.00 H new ATOM 1713 N THR B 106 14.497 -5.098 6.391 1.00 0.00 N ATOM 1714 CA THR B 106 13.922 -4.128 7.296 1.00 0.00 C ATOM 1715 C THR B 106 12.535 -3.679 6.832 1.00 0.00 C ATOM 1716 O THR B 106 11.669 -3.366 7.649 1.00 0.00 O ATOM 1717 CB THR B 106 14.870 -2.923 7.429 1.00 0.00 C ATOM 1718 OG1 THR B 106 14.498 -2.108 8.548 1.00 0.00 O ATOM 1719 CG2 THR B 106 14.878 -2.076 6.164 1.00 0.00 C ATOM 0 H THR B 106 15.263 -4.734 5.824 1.00 0.00 H new ATOM 0 HA THR B 106 13.798 -4.598 8.272 1.00 0.00 H new ATOM 0 HB THR B 106 15.874 -3.317 7.587 1.00 0.00 H new ATOM 0 HG1 THR B 106 15.113 -1.348 8.618 1.00 0.00 H new ATOM 0 HG21 THR B 106 15.558 -1.234 6.294 1.00 0.00 H new ATOM 0 HG22 THR B 106 15.209 -2.683 5.322 1.00 0.00 H new ATOM 0 HG23 THR B 106 13.872 -1.703 5.969 1.00 0.00 H new ATOM 1727 N ALA B 107 12.320 -3.667 5.521 1.00 0.00 N ATOM 1728 CA ALA B 107 11.034 -3.278 4.970 1.00 0.00 C ATOM 1729 C ALA B 107 10.120 -4.485 4.906 1.00 0.00 C ATOM 1730 O ALA B 107 10.490 -5.520 4.353 1.00 0.00 O ATOM 1731 CB ALA B 107 11.210 -2.676 3.584 1.00 0.00 C ATOM 0 H ALA B 107 13.020 -3.922 4.824 1.00 0.00 H new ATOM 0 HA ALA B 107 10.585 -2.524 5.617 1.00 0.00 H new ATOM 0 HB1 ALA B 107 10.237 -2.390 3.185 1.00 0.00 H new ATOM 0 HB2 ALA B 107 11.849 -1.795 3.648 1.00 0.00 H new ATOM 0 HB3 ALA B 107 11.671 -3.411 2.924 1.00 0.00 H new ATOM 1737 N LYS B 108 8.929 -4.364 5.462 1.00 0.00 N ATOM 1738 CA LYS B 108 7.987 -5.465 5.418 1.00 0.00 C ATOM 1739 C LYS B 108 7.271 -5.459 4.082 1.00 0.00 C ATOM 1740 O LYS B 108 6.349 -4.674 3.849 1.00 0.00 O ATOM 1741 CB LYS B 108 6.983 -5.379 6.571 1.00 0.00 C ATOM 1742 CG LYS B 108 7.614 -5.267 7.960 1.00 0.00 C ATOM 1743 CD LYS B 108 8.316 -6.550 8.412 1.00 0.00 C ATOM 1744 CE LYS B 108 9.767 -6.624 7.948 1.00 0.00 C ATOM 1745 NZ LYS B 108 10.532 -7.674 8.669 1.00 0.00 N ATOM 0 H LYS B 108 8.595 -3.528 5.942 1.00 0.00 H new ATOM 0 HA LYS B 108 8.533 -6.401 5.530 1.00 0.00 H new ATOM 0 HB2 LYS B 108 6.338 -4.516 6.409 1.00 0.00 H new ATOM 0 HB3 LYS B 108 6.345 -6.263 6.547 1.00 0.00 H new ATOM 0 HG2 LYS B 108 8.334 -4.448 7.959 1.00 0.00 H new ATOM 0 HG3 LYS B 108 6.840 -5.011 8.683 1.00 0.00 H new ATOM 0 HD2 LYS B 108 8.283 -6.613 9.500 1.00 0.00 H new ATOM 0 HD3 LYS B 108 7.772 -7.412 8.026 1.00 0.00 H new ATOM 0 HE2 LYS B 108 9.795 -6.827 6.877 1.00 0.00 H new ATOM 0 HE3 LYS B 108 10.246 -5.657 8.102 1.00 0.00 H new ATOM 0 HZ1 LYS B 108 11.442 -7.284 8.987 1.00 0.00 H new ATOM 0 HZ2 LYS B 108 9.986 -7.997 9.494 1.00 0.00 H new ATOM 0 HZ3 LYS B 108 10.704 -8.478 8.032 1.00 0.00 H new ATOM 1759 N ARG B 109 7.721 -6.330 3.199 1.00 0.00 N ATOM 1760 CA ARG B 109 7.155 -6.428 1.873 1.00 0.00 C ATOM 1761 C ARG B 109 6.411 -7.738 1.757 1.00 0.00 C ATOM 1762 O ARG B 109 6.931 -8.782 2.128 1.00 0.00 O ATOM 1763 CB ARG B 109 8.247 -6.358 0.813 1.00 0.00 C ATOM 1764 CG ARG B 109 9.303 -5.306 1.094 1.00 0.00 C ATOM 1765 CD ARG B 109 10.415 -5.355 0.061 1.00 0.00 C ATOM 1766 NE ARG B 109 11.595 -4.594 0.488 1.00 0.00 N ATOM 1767 CZ ARG B 109 12.856 -5.014 0.346 1.00 0.00 C ATOM 1768 NH1 ARG B 109 13.113 -6.194 -0.205 1.00 0.00 N ATOM 1769 NH2 ARG B 109 13.860 -4.249 0.761 1.00 0.00 N ATOM 0 H ARG B 109 8.483 -6.983 3.381 1.00 0.00 H new ATOM 0 HA ARG B 109 6.472 -5.593 1.712 1.00 0.00 H new ATOM 0 HB2 ARG B 109 8.729 -7.333 0.736 1.00 0.00 H new ATOM 0 HB3 ARG B 109 7.789 -6.151 -0.154 1.00 0.00 H new ATOM 0 HG2 ARG B 109 8.845 -4.317 1.092 1.00 0.00 H new ATOM 0 HG3 ARG B 109 9.720 -5.462 2.089 1.00 0.00 H new ATOM 0 HD2 ARG B 109 10.698 -6.392 -0.118 1.00 0.00 H new ATOM 0 HD3 ARG B 109 10.049 -4.956 -0.885 1.00 0.00 H new ATOM 0 HE ARG B 109 11.443 -3.684 0.922 1.00 0.00 H new ATOM 0 HH11 ARG B 109 12.346 -6.786 -0.523 1.00 0.00 H new ATOM 0 HH12 ARG B 109 14.078 -6.508 -0.310 1.00 0.00 H new ATOM 0 HH21 ARG B 109 13.668 -3.342 1.187 1.00 0.00 H new ATOM 0 HH22 ARG B 109 14.823 -4.568 0.653 1.00 0.00 H new ATOM 1783 N SER B 110 5.205 -7.674 1.245 1.00 0.00 N ATOM 1784 CA SER B 110 4.342 -8.847 1.187 1.00 0.00 C ATOM 1785 C SER B 110 4.624 -9.673 -0.071 1.00 0.00 C ATOM 1786 O SER B 110 5.292 -9.205 -0.995 1.00 0.00 O ATOM 1787 CB SER B 110 2.870 -8.413 1.243 1.00 0.00 C ATOM 1788 OG SER B 110 1.994 -9.526 1.283 1.00 0.00 O ATOM 0 H SER B 110 4.792 -6.825 0.860 1.00 0.00 H new ATOM 0 HA SER B 110 4.553 -9.480 2.049 1.00 0.00 H new ATOM 0 HB2 SER B 110 2.708 -7.791 2.123 1.00 0.00 H new ATOM 0 HB3 SER B 110 2.639 -7.800 0.372 1.00 0.00 H new ATOM 0 HG SER B 110 1.067 -9.211 1.320 1.00 0.00 H new ATOM 1794 N ARG B 111 4.092 -10.894 -0.098 1.00 0.00 N ATOM 1795 CA ARG B 111 4.382 -11.863 -1.153 1.00 0.00 C ATOM 1796 C ARG B 111 4.034 -11.339 -2.540 1.00 0.00 C ATOM 1797 O ARG B 111 4.882 -11.341 -3.431 1.00 0.00 O ATOM 1798 CB ARG B 111 3.633 -13.169 -0.884 1.00 0.00 C ATOM 1799 CG ARG B 111 4.194 -13.956 0.289 1.00 0.00 C ATOM 1800 CD ARG B 111 5.576 -14.496 -0.030 1.00 0.00 C ATOM 1801 NE ARG B 111 6.191 -15.165 1.112 1.00 0.00 N ATOM 1802 CZ ARG B 111 6.652 -16.416 1.084 1.00 0.00 C ATOM 1803 NH1 ARG B 111 6.557 -17.152 -0.021 1.00 0.00 N ATOM 1804 NH2 ARG B 111 7.208 -16.938 2.164 1.00 0.00 N ATOM 0 H ARG B 111 3.447 -11.239 0.612 1.00 0.00 H new ATOM 0 HA ARG B 111 5.457 -12.043 -1.138 1.00 0.00 H new ATOM 0 HB2 ARG B 111 2.584 -12.945 -0.693 1.00 0.00 H new ATOM 0 HB3 ARG B 111 3.668 -13.790 -1.779 1.00 0.00 H new ATOM 0 HG2 ARG B 111 4.244 -13.316 1.170 1.00 0.00 H new ATOM 0 HG3 ARG B 111 3.524 -14.781 0.532 1.00 0.00 H new ATOM 0 HD2 ARG B 111 5.506 -15.196 -0.863 1.00 0.00 H new ATOM 0 HD3 ARG B 111 6.217 -13.676 -0.355 1.00 0.00 H new ATOM 0 HE ARG B 111 6.273 -14.644 1.985 1.00 0.00 H new ATOM 0 HH11 ARG B 111 6.128 -16.760 -0.859 1.00 0.00 H new ATOM 0 HH12 ARG B 111 6.914 -18.108 -0.029 1.00 0.00 H new ATOM 0 HH21 ARG B 111 7.284 -16.384 3.017 1.00 0.00 H new ATOM 0 HH22 ARG B 111 7.561 -17.895 2.144 1.00 0.00 H new ATOM 1818 N ALA B 112 2.797 -10.883 -2.717 1.00 0.00 N ATOM 1819 CA ALA B 112 2.335 -10.395 -4.015 1.00 0.00 C ATOM 1820 C ALA B 112 3.189 -9.230 -4.506 1.00 0.00 C ATOM 1821 O ALA B 112 3.325 -9.004 -5.705 1.00 0.00 O ATOM 1822 CB ALA B 112 0.876 -9.975 -3.930 1.00 0.00 C ATOM 0 H ALA B 112 2.095 -10.841 -1.978 1.00 0.00 H new ATOM 0 HA ALA B 112 2.431 -11.210 -4.733 1.00 0.00 H new ATOM 0 HB1 ALA B 112 0.544 -9.613 -4.903 1.00 0.00 H new ATOM 0 HB2 ALA B 112 0.268 -10.830 -3.634 1.00 0.00 H new ATOM 0 HB3 ALA B 112 0.769 -9.180 -3.192 1.00 0.00 H new ATOM 1828 N ARG B 113 3.782 -8.513 -3.565 1.00 0.00 N ATOM 1829 CA ARG B 113 4.585 -7.344 -3.882 1.00 0.00 C ATOM 1830 C ARG B 113 6.028 -7.743 -4.204 1.00 0.00 C ATOM 1831 O ARG B 113 6.665 -7.144 -5.072 1.00 0.00 O ATOM 1832 CB ARG B 113 4.505 -6.353 -2.709 1.00 0.00 C ATOM 1833 CG ARG B 113 5.421 -5.138 -2.795 1.00 0.00 C ATOM 1834 CD ARG B 113 5.440 -4.491 -4.175 1.00 0.00 C ATOM 1835 NE ARG B 113 4.116 -4.333 -4.776 1.00 0.00 N ATOM 1836 CZ ARG B 113 3.869 -4.530 -6.078 1.00 0.00 C ATOM 1837 NH1 ARG B 113 4.829 -4.977 -6.884 1.00 0.00 N ATOM 1838 NH2 ARG B 113 2.665 -4.285 -6.571 1.00 0.00 N ATOM 0 H ARG B 113 3.721 -8.723 -2.569 1.00 0.00 H new ATOM 0 HA ARG B 113 4.194 -6.857 -4.775 1.00 0.00 H new ATOM 0 HB2 ARG B 113 3.476 -6.002 -2.626 1.00 0.00 H new ATOM 0 HB3 ARG B 113 4.734 -6.891 -1.789 1.00 0.00 H new ATOM 0 HG2 ARG B 113 5.102 -4.399 -2.060 1.00 0.00 H new ATOM 0 HG3 ARG B 113 6.435 -5.437 -2.528 1.00 0.00 H new ATOM 0 HD2 ARG B 113 5.913 -3.512 -4.099 1.00 0.00 H new ATOM 0 HD3 ARG B 113 6.060 -5.094 -4.839 1.00 0.00 H new ATOM 0 HE ARG B 113 3.341 -4.059 -4.173 1.00 0.00 H new ATOM 0 HH11 ARG B 113 5.758 -5.171 -6.511 1.00 0.00 H new ATOM 0 HH12 ARG B 113 4.635 -5.125 -7.874 1.00 0.00 H new ATOM 0 HH21 ARG B 113 1.923 -3.945 -5.959 1.00 0.00 H new ATOM 0 HH22 ARG B 113 2.480 -4.436 -7.563 1.00 0.00 H new ATOM 1852 N ILE B 114 6.532 -8.757 -3.515 1.00 0.00 N ATOM 1853 CA ILE B 114 7.873 -9.266 -3.779 1.00 0.00 C ATOM 1854 C ILE B 114 7.928 -10.039 -5.101 1.00 0.00 C ATOM 1855 O ILE B 114 8.822 -9.806 -5.920 1.00 0.00 O ATOM 1856 CB ILE B 114 8.367 -10.165 -2.624 1.00 0.00 C ATOM 1857 CG1 ILE B 114 8.495 -9.347 -1.334 1.00 0.00 C ATOM 1858 CG2 ILE B 114 9.699 -10.813 -2.977 1.00 0.00 C ATOM 1859 CD1 ILE B 114 8.869 -10.180 -0.116 1.00 0.00 C ATOM 0 H ILE B 114 6.034 -9.244 -2.770 1.00 0.00 H new ATOM 0 HA ILE B 114 8.533 -8.402 -3.856 1.00 0.00 H new ATOM 0 HB ILE B 114 7.635 -10.957 -2.466 1.00 0.00 H new ATOM 0 HG12 ILE B 114 9.248 -8.572 -1.479 1.00 0.00 H new ATOM 0 HG13 ILE B 114 7.550 -8.840 -1.140 1.00 0.00 H new ATOM 0 HG21 ILE B 114 10.028 -11.442 -2.150 1.00 0.00 H new ATOM 0 HG22 ILE B 114 9.581 -11.424 -3.872 1.00 0.00 H new ATOM 0 HG23 ILE B 114 10.443 -10.038 -3.162 1.00 0.00 H new ATOM 0 HD11 ILE B 114 8.941 -9.534 0.759 1.00 0.00 H new ATOM 0 HD12 ILE B 114 8.105 -10.938 0.055 1.00 0.00 H new ATOM 0 HD13 ILE B 114 9.829 -10.666 -0.288 1.00 0.00 H new ATOM 1871 N VAL B 115 6.969 -10.943 -5.320 1.00 0.00 N ATOM 1872 CA VAL B 115 6.951 -11.749 -6.542 1.00 0.00 C ATOM 1873 C VAL B 115 6.810 -10.865 -7.773 1.00 0.00 C ATOM 1874 O VAL B 115 7.467 -11.085 -8.786 1.00 0.00 O ATOM 1875 CB VAL B 115 5.819 -12.812 -6.553 1.00 0.00 C ATOM 1876 CG1 VAL B 115 6.002 -13.814 -5.430 1.00 0.00 C ATOM 1877 CG2 VAL B 115 4.443 -12.172 -6.461 1.00 0.00 C ATOM 0 H VAL B 115 6.203 -11.133 -4.674 1.00 0.00 H new ATOM 0 HA VAL B 115 7.905 -12.276 -6.564 1.00 0.00 H new ATOM 0 HB VAL B 115 5.884 -13.336 -7.506 1.00 0.00 H new ATOM 0 HG11 VAL B 115 5.196 -14.547 -5.461 1.00 0.00 H new ATOM 0 HG12 VAL B 115 6.959 -14.322 -5.548 1.00 0.00 H new ATOM 0 HG13 VAL B 115 5.983 -13.294 -4.472 1.00 0.00 H new ATOM 0 HG21 VAL B 115 3.679 -12.949 -6.472 1.00 0.00 H new ATOM 0 HG22 VAL B 115 4.368 -11.602 -5.535 1.00 0.00 H new ATOM 0 HG23 VAL B 115 4.294 -11.505 -7.310 1.00 0.00 H new ATOM 1887 N ASP B 116 5.964 -9.850 -7.665 1.00 0.00 N ATOM 1888 CA ASP B 116 5.704 -8.942 -8.771 1.00 0.00 C ATOM 1889 C ASP B 116 6.963 -8.168 -9.137 1.00 0.00 C ATOM 1890 O ASP B 116 7.233 -7.918 -10.312 1.00 0.00 O ATOM 1891 CB ASP B 116 4.584 -7.979 -8.383 1.00 0.00 C ATOM 1892 CG ASP B 116 4.166 -7.057 -9.508 1.00 0.00 C ATOM 1893 OD1 ASP B 116 3.280 -7.441 -10.298 1.00 0.00 O ATOM 1894 OD2 ASP B 116 4.694 -5.929 -9.585 1.00 0.00 O ATOM 0 H ASP B 116 5.443 -9.635 -6.815 1.00 0.00 H new ATOM 0 HA ASP B 116 5.398 -9.521 -9.642 1.00 0.00 H new ATOM 0 HB2 ASP B 116 3.718 -8.554 -8.054 1.00 0.00 H new ATOM 0 HB3 ASP B 116 4.909 -7.379 -7.533 1.00 0.00 H new ATOM 1899 N LYS B 117 7.750 -7.824 -8.126 1.00 0.00 N ATOM 1900 CA LYS B 117 8.955 -7.039 -8.337 1.00 0.00 C ATOM 1901 C LYS B 117 10.038 -7.869 -9.023 1.00 0.00 C ATOM 1902 O LYS B 117 10.763 -7.354 -9.869 1.00 0.00 O ATOM 1903 CB LYS B 117 9.466 -6.467 -7.013 1.00 0.00 C ATOM 1904 CG LYS B 117 10.699 -5.586 -7.156 1.00 0.00 C ATOM 1905 CD LYS B 117 10.447 -4.387 -8.061 1.00 0.00 C ATOM 1906 CE LYS B 117 11.710 -3.563 -8.244 1.00 0.00 C ATOM 1907 NZ LYS B 117 11.509 -2.418 -9.170 1.00 0.00 N ATOM 0 H LYS B 117 7.574 -8.077 -7.154 1.00 0.00 H new ATOM 0 HA LYS B 117 8.704 -6.207 -8.995 1.00 0.00 H new ATOM 0 HB2 LYS B 117 8.669 -5.887 -6.548 1.00 0.00 H new ATOM 0 HB3 LYS B 117 9.697 -7.291 -6.338 1.00 0.00 H new ATOM 0 HG2 LYS B 117 11.010 -5.237 -6.171 1.00 0.00 H new ATOM 0 HG3 LYS B 117 11.521 -6.177 -7.559 1.00 0.00 H new ATOM 0 HD2 LYS B 117 10.089 -4.730 -9.032 1.00 0.00 H new ATOM 0 HD3 LYS B 117 9.662 -3.764 -7.633 1.00 0.00 H new ATOM 0 HE2 LYS B 117 12.041 -3.190 -7.275 1.00 0.00 H new ATOM 0 HE3 LYS B 117 12.505 -4.202 -8.628 1.00 0.00 H new ATOM 0 HZ1 LYS B 117 12.427 -2.118 -9.555 1.00 0.00 H new ATOM 0 HZ2 LYS B 117 10.884 -2.707 -9.950 1.00 0.00 H new ATOM 0 HZ3 LYS B 117 11.075 -1.626 -8.654 1.00 0.00 H new ATOM 1921 N LEU B 118 10.153 -9.149 -8.664 1.00 0.00 N ATOM 1922 CA LEU B 118 11.101 -10.037 -9.341 1.00 0.00 C ATOM 1923 C LEU B 118 10.816 -10.078 -10.830 1.00 0.00 C ATOM 1924 O LEU B 118 11.724 -9.971 -11.657 1.00 0.00 O ATOM 1925 CB LEU B 118 11.015 -11.472 -8.834 1.00 0.00 C ATOM 1926 CG LEU B 118 11.264 -11.713 -7.350 1.00 0.00 C ATOM 1927 CD1 LEU B 118 11.493 -13.195 -7.137 1.00 0.00 C ATOM 1928 CD2 LEU B 118 12.455 -10.918 -6.848 1.00 0.00 C ATOM 0 H LEU B 118 9.611 -9.589 -7.920 1.00 0.00 H new ATOM 0 HA LEU B 118 12.092 -9.634 -9.133 1.00 0.00 H new ATOM 0 HB2 LEU B 118 10.023 -11.854 -9.074 1.00 0.00 H new ATOM 0 HB3 LEU B 118 11.732 -12.070 -9.396 1.00 0.00 H new ATOM 0 HG LEU B 118 10.394 -11.379 -6.784 1.00 0.00 H new ATOM 0 HD11 LEU B 118 11.673 -13.387 -6.079 1.00 0.00 H new ATOM 0 HD12 LEU B 118 10.613 -13.750 -7.462 1.00 0.00 H new ATOM 0 HD13 LEU B 118 12.358 -13.516 -7.717 1.00 0.00 H new ATOM 0 HD21 LEU B 118 12.602 -11.115 -5.786 1.00 0.00 H new ATOM 0 HD22 LEU B 118 13.348 -11.213 -7.399 1.00 0.00 H new ATOM 0 HD23 LEU B 118 12.271 -9.854 -6.998 1.00 0.00 H new ATOM 1940 N LEU B 119 9.544 -10.256 -11.154 1.00 0.00 N ATOM 1941 CA LEU B 119 9.094 -10.347 -12.534 1.00 0.00 C ATOM 1942 C LEU B 119 9.359 -9.050 -13.282 1.00 0.00 C ATOM 1943 O LEU B 119 9.652 -9.055 -14.475 1.00 0.00 O ATOM 1944 CB LEU B 119 7.599 -10.684 -12.573 1.00 0.00 C ATOM 1945 CG LEU B 119 7.249 -12.180 -12.501 1.00 0.00 C ATOM 1946 CD1 LEU B 119 7.752 -12.896 -13.741 1.00 0.00 C ATOM 1947 CD2 LEU B 119 7.822 -12.835 -11.247 1.00 0.00 C ATOM 0 H LEU B 119 8.795 -10.341 -10.467 1.00 0.00 H new ATOM 0 HA LEU B 119 9.655 -11.141 -13.027 1.00 0.00 H new ATOM 0 HB2 LEU B 119 7.109 -10.175 -11.743 1.00 0.00 H new ATOM 0 HB3 LEU B 119 7.177 -10.275 -13.491 1.00 0.00 H new ATOM 0 HG LEU B 119 6.163 -12.263 -12.452 1.00 0.00 H new ATOM 0 HD11 LEU B 119 7.498 -13.954 -13.678 1.00 0.00 H new ATOM 0 HD12 LEU B 119 7.285 -12.463 -14.626 1.00 0.00 H new ATOM 0 HD13 LEU B 119 8.834 -12.786 -13.811 1.00 0.00 H new ATOM 0 HD21 LEU B 119 7.553 -13.891 -11.233 1.00 0.00 H new ATOM 0 HD22 LEU B 119 8.908 -12.737 -11.249 1.00 0.00 H new ATOM 0 HD23 LEU B 119 7.415 -12.345 -10.362 1.00 0.00 H new ATOM 1959 N ALA B 120 9.278 -7.947 -12.561 1.00 0.00 N ATOM 1960 CA ALA B 120 9.449 -6.630 -13.150 1.00 0.00 C ATOM 1961 C ALA B 120 10.925 -6.258 -13.247 1.00 0.00 C ATOM 1962 O ALA B 120 11.318 -5.444 -14.081 1.00 0.00 O ATOM 1963 CB ALA B 120 8.682 -5.605 -12.331 1.00 0.00 C ATOM 0 H ALA B 120 9.093 -7.937 -11.558 1.00 0.00 H new ATOM 0 HA ALA B 120 9.051 -6.644 -14.165 1.00 0.00 H new ATOM 0 HB1 ALA B 120 8.810 -4.617 -12.773 1.00 0.00 H new ATOM 0 HB2 ALA B 120 7.623 -5.864 -12.323 1.00 0.00 H new ATOM 0 HB3 ALA B 120 9.062 -5.598 -11.309 1.00 0.00 H new ATOM 1969 N LEU B 121 11.737 -6.870 -12.395 1.00 0.00 N ATOM 1970 CA LEU B 121 13.159 -6.609 -12.362 1.00 0.00 C ATOM 1971 C LEU B 121 13.905 -7.602 -13.252 1.00 0.00 C ATOM 1972 O LEU B 121 15.080 -7.417 -13.567 1.00 0.00 O ATOM 1973 CB LEU B 121 13.633 -6.692 -10.911 1.00 0.00 C ATOM 1974 CG LEU B 121 15.135 -6.613 -10.695 1.00 0.00 C ATOM 1975 CD1 LEU B 121 15.700 -5.306 -11.236 1.00 0.00 C ATOM 1976 CD2 LEU B 121 15.450 -6.760 -9.219 1.00 0.00 C ATOM 0 H LEU B 121 11.424 -7.559 -11.711 1.00 0.00 H new ATOM 0 HA LEU B 121 13.368 -5.612 -12.750 1.00 0.00 H new ATOM 0 HB2 LEU B 121 13.162 -5.885 -10.349 1.00 0.00 H new ATOM 0 HB3 LEU B 121 13.274 -7.629 -10.485 1.00 0.00 H new ATOM 0 HG LEU B 121 15.607 -7.429 -11.243 1.00 0.00 H new ATOM 0 HD11 LEU B 121 16.777 -5.278 -11.067 1.00 0.00 H new ATOM 0 HD12 LEU B 121 15.498 -5.237 -12.305 1.00 0.00 H new ATOM 0 HD13 LEU B 121 15.230 -4.467 -10.723 1.00 0.00 H new ATOM 0 HD21 LEU B 121 16.528 -6.703 -9.070 1.00 0.00 H new ATOM 0 HD22 LEU B 121 14.963 -5.960 -8.662 1.00 0.00 H new ATOM 0 HD23 LEU B 121 15.085 -7.724 -8.863 1.00 0.00 H new ATOM 1988 N GLY B 122 13.210 -8.654 -13.662 1.00 0.00 N ATOM 1989 CA GLY B 122 13.807 -9.646 -14.532 1.00 0.00 C ATOM 1990 C GLY B 122 14.714 -10.599 -13.788 1.00 0.00 C ATOM 1991 O GLY B 122 15.737 -11.039 -14.311 1.00 0.00 O ATOM 0 H GLY B 122 12.240 -8.838 -13.406 1.00 0.00 H new ATOM 0 HA2 GLY B 122 13.018 -10.212 -15.027 1.00 0.00 H new ATOM 0 HA3 GLY B 122 14.377 -9.143 -15.314 1.00 0.00 H new ATOM 1995 N LEU B 123 14.344 -10.914 -12.556 1.00 0.00 N ATOM 1996 CA LEU B 123 15.100 -11.861 -11.756 1.00 0.00 C ATOM 1997 C LEU B 123 14.662 -13.279 -12.077 1.00 0.00 C ATOM 1998 O LEU B 123 15.419 -14.238 -11.903 1.00 0.00 O ATOM 1999 CB LEU B 123 14.926 -11.557 -10.268 1.00 0.00 C ATOM 2000 CG LEU B 123 15.623 -10.280 -9.791 1.00 0.00 C ATOM 2001 CD1 LEU B 123 15.477 -10.114 -8.289 1.00 0.00 C ATOM 2002 CD2 LEU B 123 17.095 -10.285 -10.184 1.00 0.00 C ATOM 0 H LEU B 123 13.524 -10.526 -12.090 1.00 0.00 H new ATOM 0 HA LEU B 123 16.159 -11.766 -11.998 1.00 0.00 H new ATOM 0 HB2 LEU B 123 13.861 -11.477 -10.049 1.00 0.00 H new ATOM 0 HB3 LEU B 123 15.307 -12.400 -9.692 1.00 0.00 H new ATOM 0 HG LEU B 123 15.141 -9.433 -10.279 1.00 0.00 H new ATOM 0 HD11 LEU B 123 15.980 -9.200 -7.973 1.00 0.00 H new ATOM 0 HD12 LEU B 123 14.420 -10.054 -8.031 1.00 0.00 H new ATOM 0 HD13 LEU B 123 15.926 -10.969 -7.783 1.00 0.00 H new ATOM 0 HD21 LEU B 123 17.568 -9.368 -9.834 1.00 0.00 H new ATOM 0 HD22 LEU B 123 17.590 -11.144 -9.731 1.00 0.00 H new ATOM 0 HD23 LEU B 123 17.182 -10.347 -11.269 1.00 0.00 H new ATOM 2014 N VAL B 124 13.441 -13.391 -12.571 1.00 0.00 N ATOM 2015 CA VAL B 124 12.848 -14.674 -12.921 1.00 0.00 C ATOM 2016 C VAL B 124 11.930 -14.518 -14.121 1.00 0.00 C ATOM 2017 O VAL B 124 11.812 -13.431 -14.690 1.00 0.00 O ATOM 2018 CB VAL B 124 12.038 -15.260 -11.751 1.00 0.00 C ATOM 2019 CG1 VAL B 124 12.959 -15.727 -10.637 1.00 0.00 C ATOM 2020 CG2 VAL B 124 11.040 -14.233 -11.241 1.00 0.00 C ATOM 0 H VAL B 124 12.829 -12.593 -12.742 1.00 0.00 H new ATOM 0 HA VAL B 124 13.665 -15.355 -13.159 1.00 0.00 H new ATOM 0 HB VAL B 124 11.486 -16.129 -12.109 1.00 0.00 H new ATOM 0 HG11 VAL B 124 12.364 -16.137 -9.821 1.00 0.00 H new ATOM 0 HG12 VAL B 124 13.631 -16.496 -11.019 1.00 0.00 H new ATOM 0 HG13 VAL B 124 13.544 -14.883 -10.271 1.00 0.00 H new ATOM 0 HG21 VAL B 124 10.472 -14.658 -10.413 1.00 0.00 H new ATOM 0 HG22 VAL B 124 11.573 -13.346 -10.898 1.00 0.00 H new ATOM 0 HG23 VAL B 124 10.358 -13.958 -12.046 1.00 0.00 H new ATOM 2030 N ALA B 125 11.273 -15.602 -14.488 1.00 0.00 N ATOM 2031 CA ALA B 125 10.350 -15.597 -15.612 1.00 0.00 C ATOM 2032 C ALA B 125 8.936 -15.891 -15.134 1.00 0.00 C ATOM 2033 O ALA B 125 7.976 -15.808 -15.900 1.00 0.00 O ATOM 2034 CB ALA B 125 10.783 -16.617 -16.655 1.00 0.00 C ATOM 0 H ALA B 125 11.361 -16.505 -14.021 1.00 0.00 H new ATOM 0 HA ALA B 125 10.362 -14.608 -16.070 1.00 0.00 H new ATOM 0 HB1 ALA B 125 10.083 -16.602 -17.491 1.00 0.00 H new ATOM 0 HB2 ALA B 125 11.782 -16.369 -17.014 1.00 0.00 H new ATOM 0 HB3 ALA B 125 10.795 -17.611 -16.209 1.00 0.00 H new ATOM 2040 N GLU B 126 8.824 -16.230 -13.852 1.00 0.00 N ATOM 2041 CA GLU B 126 7.562 -16.654 -13.265 1.00 0.00 C ATOM 2042 C GLU B 126 7.728 -16.862 -11.769 1.00 0.00 C ATOM 2043 O GLU B 126 8.846 -16.834 -11.261 1.00 0.00 O ATOM 2044 CB GLU B 126 7.116 -17.959 -13.910 1.00 0.00 C ATOM 2045 CG GLU B 126 8.162 -19.050 -13.803 1.00 0.00 C ATOM 2046 CD GLU B 126 7.879 -20.199 -14.740 1.00 0.00 C ATOM 2047 OE1 GLU B 126 8.579 -20.313 -15.764 1.00 0.00 O ATOM 2048 OE2 GLU B 126 6.937 -20.974 -14.474 1.00 0.00 O ATOM 0 H GLU B 126 9.604 -16.218 -13.195 1.00 0.00 H new ATOM 0 HA GLU B 126 6.811 -15.883 -13.438 1.00 0.00 H new ATOM 0 HB2 GLU B 126 6.194 -18.297 -13.437 1.00 0.00 H new ATOM 0 HB3 GLU B 126 6.888 -17.781 -14.961 1.00 0.00 H new ATOM 0 HG2 GLU B 126 9.144 -18.634 -14.026 1.00 0.00 H new ATOM 0 HG3 GLU B 126 8.198 -19.419 -12.778 1.00 0.00 H new ATOM 2055 N ARG B 127 6.623 -17.091 -11.072 1.00 0.00 N ATOM 2056 CA ARG B 127 6.665 -17.330 -9.634 1.00 0.00 C ATOM 2057 C ARG B 127 7.108 -18.756 -9.323 1.00 0.00 C ATOM 2058 O ARG B 127 7.556 -19.045 -8.221 1.00 0.00 O ATOM 2059 CB ARG B 127 5.317 -17.046 -8.965 1.00 0.00 C ATOM 2060 CG ARG B 127 4.941 -15.572 -8.926 1.00 0.00 C ATOM 2061 CD ARG B 127 4.373 -15.107 -10.251 1.00 0.00 C ATOM 2062 NE ARG B 127 3.920 -13.717 -10.204 1.00 0.00 N ATOM 2063 CZ ARG B 127 3.811 -12.929 -11.276 1.00 0.00 C ATOM 2064 NH1 ARG B 127 4.088 -13.400 -12.486 1.00 0.00 N ATOM 2065 NH2 ARG B 127 3.402 -11.675 -11.140 1.00 0.00 N ATOM 0 H ARG B 127 5.687 -17.116 -11.478 1.00 0.00 H new ATOM 0 HA ARG B 127 7.399 -16.636 -9.224 1.00 0.00 H new ATOM 0 HB2 ARG B 127 4.538 -17.595 -9.494 1.00 0.00 H new ATOM 0 HB3 ARG B 127 5.341 -17.431 -7.945 1.00 0.00 H new ATOM 0 HG2 ARG B 127 4.209 -15.403 -8.136 1.00 0.00 H new ATOM 0 HG3 ARG B 127 5.820 -14.978 -8.678 1.00 0.00 H new ATOM 0 HD2 ARG B 127 5.132 -15.213 -11.026 1.00 0.00 H new ATOM 0 HD3 ARG B 127 3.538 -15.749 -10.531 1.00 0.00 H new ATOM 0 HE ARG B 127 3.672 -13.325 -9.295 1.00 0.00 H new ATOM 0 HH11 ARG B 127 4.386 -14.369 -12.600 1.00 0.00 H new ATOM 0 HH12 ARG B 127 4.003 -12.793 -13.301 1.00 0.00 H new ATOM 0 HH21 ARG B 127 3.170 -11.312 -10.216 1.00 0.00 H new ATOM 0 HH22 ARG B 127 3.319 -11.074 -11.960 1.00 0.00 H new ATOM 2079 N ARG B 128 6.976 -19.643 -10.299 1.00 0.00 N ATOM 2080 CA ARG B 128 7.332 -21.051 -10.113 1.00 0.00 C ATOM 2081 C ARG B 128 8.800 -21.195 -9.730 1.00 0.00 C ATOM 2082 O ARG B 128 9.169 -22.043 -8.916 1.00 0.00 O ATOM 2083 CB ARG B 128 7.089 -21.828 -11.406 1.00 0.00 C ATOM 2084 CG ARG B 128 7.406 -23.311 -11.296 1.00 0.00 C ATOM 2085 CD ARG B 128 7.793 -23.907 -12.643 1.00 0.00 C ATOM 2086 NE ARG B 128 6.878 -23.509 -13.711 1.00 0.00 N ATOM 2087 CZ ARG B 128 6.298 -24.354 -14.559 1.00 0.00 C ATOM 2088 NH1 ARG B 128 6.562 -25.653 -14.502 1.00 0.00 N ATOM 2089 NH2 ARG B 128 5.470 -23.894 -15.485 1.00 0.00 N ATOM 0 H ARG B 128 6.625 -19.417 -11.230 1.00 0.00 H new ATOM 0 HA ARG B 128 6.709 -21.449 -9.312 1.00 0.00 H new ATOM 0 HB2 ARG B 128 6.046 -21.709 -11.701 1.00 0.00 H new ATOM 0 HB3 ARG B 128 7.696 -21.394 -12.200 1.00 0.00 H new ATOM 0 HG2 ARG B 128 8.220 -23.457 -10.586 1.00 0.00 H new ATOM 0 HG3 ARG B 128 6.539 -23.840 -10.900 1.00 0.00 H new ATOM 0 HD2 ARG B 128 8.805 -23.593 -12.899 1.00 0.00 H new ATOM 0 HD3 ARG B 128 7.807 -24.994 -12.566 1.00 0.00 H new ATOM 0 HE ARG B 128 6.670 -22.516 -13.813 1.00 0.00 H new ATOM 0 HH11 ARG B 128 7.214 -26.011 -13.804 1.00 0.00 H new ATOM 0 HH12 ARG B 128 6.113 -26.294 -15.156 1.00 0.00 H new ATOM 0 HH21 ARG B 128 5.279 -22.894 -15.547 1.00 0.00 H new ATOM 0 HH22 ARG B 128 5.024 -24.540 -16.136 1.00 0.00 H new ATOM 2103 N GLU B 129 9.621 -20.339 -10.310 1.00 0.00 N ATOM 2104 CA GLU B 129 11.061 -20.447 -10.190 1.00 0.00 C ATOM 2105 C GLU B 129 11.570 -19.920 -8.858 1.00 0.00 C ATOM 2106 O GLU B 129 12.749 -20.073 -8.540 1.00 0.00 O ATOM 2107 CB GLU B 129 11.715 -19.693 -11.338 1.00 0.00 C ATOM 2108 CG GLU B 129 11.374 -20.277 -12.695 1.00 0.00 C ATOM 2109 CD GLU B 129 11.659 -21.763 -12.766 1.00 0.00 C ATOM 2110 OE1 GLU B 129 10.772 -22.527 -13.209 1.00 0.00 O ATOM 2111 OE2 GLU B 129 12.763 -22.171 -12.353 1.00 0.00 O ATOM 0 H GLU B 129 9.308 -19.551 -10.877 1.00 0.00 H new ATOM 0 HA GLU B 129 11.325 -21.504 -10.235 1.00 0.00 H new ATOM 0 HB2 GLU B 129 11.401 -18.650 -11.307 1.00 0.00 H new ATOM 0 HB3 GLU B 129 12.797 -19.704 -11.204 1.00 0.00 H new ATOM 0 HG2 GLU B 129 10.320 -20.100 -12.910 1.00 0.00 H new ATOM 0 HG3 GLU B 129 11.948 -19.761 -13.465 1.00 0.00 H new ATOM 2118 N LEU B 130 10.685 -19.311 -8.084 1.00 0.00 N ATOM 2119 CA LEU B 130 11.082 -18.691 -6.823 1.00 0.00 C ATOM 2120 C LEU B 130 11.129 -19.739 -5.723 1.00 0.00 C ATOM 2121 O LEU B 130 11.601 -19.491 -4.615 1.00 0.00 O ATOM 2122 CB LEU B 130 10.100 -17.588 -6.412 1.00 0.00 C ATOM 2123 CG LEU B 130 9.349 -16.879 -7.545 1.00 0.00 C ATOM 2124 CD1 LEU B 130 8.548 -15.712 -7.001 1.00 0.00 C ATOM 2125 CD2 LEU B 130 10.281 -16.410 -8.645 1.00 0.00 C ATOM 0 H LEU B 130 9.692 -19.231 -8.302 1.00 0.00 H new ATOM 0 HA LEU B 130 12.068 -18.250 -6.966 1.00 0.00 H new ATOM 0 HB2 LEU B 130 9.364 -18.022 -5.735 1.00 0.00 H new ATOM 0 HB3 LEU B 130 10.650 -16.836 -5.845 1.00 0.00 H new ATOM 0 HG LEU B 130 8.668 -17.607 -7.985 1.00 0.00 H new ATOM 0 HD11 LEU B 130 8.021 -15.220 -7.818 1.00 0.00 H new ATOM 0 HD12 LEU B 130 7.825 -16.076 -6.270 1.00 0.00 H new ATOM 0 HD13 LEU B 130 9.221 -15.000 -6.523 1.00 0.00 H new ATOM 0 HD21 LEU B 130 9.703 -15.914 -9.425 1.00 0.00 H new ATOM 0 HD22 LEU B 130 11.008 -15.711 -8.232 1.00 0.00 H new ATOM 0 HD23 LEU B 130 10.803 -17.267 -9.070 1.00 0.00 H new ATOM 2137 N TYR B 131 10.620 -20.910 -6.045 1.00 0.00 N ATOM 2138 CA TYR B 131 10.491 -21.987 -5.092 1.00 0.00 C ATOM 2139 C TYR B 131 11.216 -23.211 -5.627 1.00 0.00 C ATOM 2140 O TYR B 131 11.047 -23.562 -6.796 1.00 0.00 O ATOM 2141 CB TYR B 131 9.009 -22.289 -4.851 1.00 0.00 C ATOM 2142 CG TYR B 131 8.194 -21.069 -4.456 1.00 0.00 C ATOM 2143 CD1 TYR B 131 8.023 -20.725 -3.121 1.00 0.00 C ATOM 2144 CD2 TYR B 131 7.597 -20.260 -5.421 1.00 0.00 C ATOM 2145 CE1 TYR B 131 7.283 -19.614 -2.760 1.00 0.00 C ATOM 2146 CE2 TYR B 131 6.858 -19.147 -5.066 1.00 0.00 C ATOM 2147 CZ TYR B 131 6.702 -18.831 -3.734 1.00 0.00 C ATOM 2148 OH TYR B 131 5.967 -17.723 -3.375 1.00 0.00 O ATOM 0 H TYR B 131 10.283 -21.140 -6.980 1.00 0.00 H new ATOM 0 HA TYR B 131 10.938 -21.701 -4.140 1.00 0.00 H new ATOM 0 HB2 TYR B 131 8.583 -22.722 -5.756 1.00 0.00 H new ATOM 0 HB3 TYR B 131 8.923 -23.042 -4.067 1.00 0.00 H new ATOM 0 HD1 TYR B 131 8.475 -21.335 -2.353 1.00 0.00 H new ATOM 0 HD2 TYR B 131 7.714 -20.507 -6.466 1.00 0.00 H new ATOM 0 HE1 TYR B 131 7.161 -19.361 -1.717 1.00 0.00 H new ATOM 0 HE2 TYR B 131 6.406 -18.529 -5.828 1.00 0.00 H new ATOM 0 HH TYR B 131 5.627 -17.281 -4.181 1.00 0.00 H new