USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=18 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 -60:sc= 0.956 USER MOD Set 1.2: B 100 HIS : no HD1:sc= -0.552 K(o=0.4,f=0.98) USER MOD Set 2.1: B 46 THR OG1 : rot 180:sc= -0.102 USER MOD Set 2.2: B 49 GLN : amide:sc= -3.31! C(o=-3.4!,f=-12!) USER MOD Single : B 10 SER OG : rot 180:sc= 0 USER MOD Single : B 16 HIS : no HD1:sc= -0.473 X(o=-0.47,f=-0.0063) USER MOD Single : B 21 TYR OH : rot 180:sc= 0 USER MOD Single : B 24 ASN : amide:sc= -0.194 X(o=-0.19,f=-0.023) USER MOD Single : B 25 LYS NZ :NH3+ -166:sc= -0.0556 (180deg=-0.279) USER MOD Single : B 30 GLN : amide:sc= -2.18 K(o=-2.2,f=-2.9!) USER MOD Single : B 39 HIS : no HD1:sc= -1.46 K(o=-1.5,f=0.28) USER MOD Single : B 41 ASN : amide:sc= 0.0467 X(o=0.047,f=0) USER MOD Single : B 42 THR OG1 : rot -91:sc= 1.24 USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 HIS : no HD1:sc= -0.865 K(o=-0.87,f=-0.076) USER MOD Single : B 53 HIS : no HE2:sc= -0.52 K(o=-0.088,f=-4.1) USER MOD Single : B 56 GLN : amide:sc= -2.41 K(o=-2.4,f=-0.36) USER MOD Single : B 57 MET CE :methyl 157:sc= -0.658 (180deg=-1.67!) USER MOD Single : B 62 SER OG : rot 180:sc= -0.0453 USER MOD Single : B 64 LYS NZ :NH3+ -142:sc= -1.88! (180deg=-4.4!) USER MOD Single : B 77 THR OG1 : rot 180:sc= 0 USER MOD Single : B 80 GLN : amide:sc= -1.27! C(o=-1.3!,f=-4.3!) USER MOD Single : B 85 GLN : amide:sc= -0.596 K(o=-0.6,f=-3.3!) USER MOD Single : B 102 MET CE :methyl -155:sc= -2.49! (180deg=-3.76!) USER MOD Single : B 103 LYS NZ :NH3+ 172:sc= -0.0236 (180deg=-0.135) USER MOD Single : B 104 ASN : amide:sc= -1.78! K(o=-1.8!,f=-0.035) USER MOD Single : B 106 THR OG1 : rot 180:sc= 0 USER MOD Single : B 108 LYS NZ :NH3+ 164:sc= 0.509 (180deg=0.367) USER MOD Single : B 110 SER OG : rot 180:sc= -0.0103 USER MOD Single : B 117 LYS NZ :NH3+ -161:sc= 1.04 (180deg=0.756) USER MOD Single : B 131 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 126 N TRP B 9 -20.845 9.241 5.410 1.00 0.00 N ATOM 127 CA TRP B 9 -20.870 7.938 6.057 1.00 0.00 C ATOM 128 C TRP B 9 -21.166 8.048 7.545 1.00 0.00 C ATOM 129 O TRP B 9 -20.413 8.665 8.308 1.00 0.00 O ATOM 130 CB TRP B 9 -19.549 7.205 5.840 1.00 0.00 C ATOM 131 CG TRP B 9 -19.381 6.692 4.446 1.00 0.00 C ATOM 132 CD1 TRP B 9 -18.876 7.368 3.378 1.00 0.00 C ATOM 133 CD2 TRP B 9 -19.731 5.390 3.970 1.00 0.00 C ATOM 134 NE1 TRP B 9 -18.874 6.559 2.268 1.00 0.00 N ATOM 135 CE2 TRP B 9 -19.401 5.344 2.605 1.00 0.00 C ATOM 136 CE3 TRP B 9 -20.284 4.258 4.565 1.00 0.00 C ATOM 137 CZ2 TRP B 9 -19.612 4.214 1.826 1.00 0.00 C ATOM 138 CZ3 TRP B 9 -20.496 3.136 3.789 1.00 0.00 C ATOM 139 CH2 TRP B 9 -20.158 3.120 2.433 1.00 0.00 C ATOM 0 HA TRP B 9 -21.677 7.366 5.598 1.00 0.00 H new ATOM 0 HB2 TRP B 9 -18.725 7.879 6.074 1.00 0.00 H new ATOM 0 HB3 TRP B 9 -19.486 6.370 6.537 1.00 0.00 H new ATOM 0 HD1 TRP B 9 -18.528 8.390 3.400 1.00 0.00 H new ATOM 0 HE1 TRP B 9 -18.534 6.822 1.343 1.00 0.00 H new ATOM 0 HE3 TRP B 9 -20.542 4.258 5.614 1.00 0.00 H new ATOM 0 HZ2 TRP B 9 -19.353 4.201 0.777 1.00 0.00 H new ATOM 0 HZ3 TRP B 9 -20.931 2.255 4.238 1.00 0.00 H new ATOM 0 HH2 TRP B 9 -20.332 2.225 1.854 1.00 0.00 H new ATOM 150 N SER B 10 -22.272 7.444 7.944 1.00 0.00 N ATOM 151 CA SER B 10 -22.663 7.393 9.341 1.00 0.00 C ATOM 152 C SER B 10 -21.864 6.305 10.063 1.00 0.00 C ATOM 153 O SER B 10 -21.372 5.374 9.424 1.00 0.00 O ATOM 154 CB SER B 10 -24.163 7.108 9.446 1.00 0.00 C ATOM 155 OG SER B 10 -24.907 7.974 8.602 1.00 0.00 O ATOM 0 H SER B 10 -22.922 6.977 7.311 1.00 0.00 H new ATOM 0 HA SER B 10 -22.453 8.353 9.811 1.00 0.00 H new ATOM 0 HB2 SER B 10 -24.360 6.071 9.173 1.00 0.00 H new ATOM 0 HB3 SER B 10 -24.489 7.233 10.479 1.00 0.00 H new ATOM 0 HG SER B 10 -25.862 7.771 8.686 1.00 0.00 H new ATOM 161 N PRO B 11 -21.710 6.408 11.395 1.00 0.00 N ATOM 162 CA PRO B 11 -20.998 5.398 12.193 1.00 0.00 C ATOM 163 C PRO B 11 -21.495 3.975 11.923 1.00 0.00 C ATOM 164 O PRO B 11 -20.702 3.060 11.704 1.00 0.00 O ATOM 165 CB PRO B 11 -21.306 5.809 13.632 1.00 0.00 C ATOM 166 CG PRO B 11 -21.526 7.278 13.557 1.00 0.00 C ATOM 167 CD PRO B 11 -22.190 7.528 12.230 1.00 0.00 C ATOM 0 HA PRO B 11 -19.934 5.370 11.958 1.00 0.00 H new ATOM 0 HB2 PRO B 11 -22.188 5.294 14.012 1.00 0.00 H new ATOM 0 HB3 PRO B 11 -20.481 5.564 14.301 1.00 0.00 H new ATOM 0 HG2 PRO B 11 -22.154 7.621 14.379 1.00 0.00 H new ATOM 0 HG3 PRO B 11 -20.582 7.819 13.630 1.00 0.00 H new ATOM 0 HD2 PRO B 11 -23.277 7.528 12.317 1.00 0.00 H new ATOM 0 HD3 PRO B 11 -21.904 8.493 11.812 1.00 0.00 H new ATOM 175 N GLU B 12 -22.814 3.802 11.917 1.00 0.00 N ATOM 176 CA GLU B 12 -23.421 2.500 11.650 1.00 0.00 C ATOM 177 C GLU B 12 -23.169 2.077 10.205 1.00 0.00 C ATOM 178 O GLU B 12 -23.068 0.892 9.903 1.00 0.00 O ATOM 179 CB GLU B 12 -24.929 2.561 11.911 1.00 0.00 C ATOM 180 CG GLU B 12 -25.644 1.227 11.760 1.00 0.00 C ATOM 181 CD GLU B 12 -25.354 0.271 12.899 1.00 0.00 C ATOM 182 OE1 GLU B 12 -24.289 -0.376 12.888 1.00 0.00 O ATOM 183 OE2 GLU B 12 -26.198 0.164 13.815 1.00 0.00 O ATOM 0 H GLU B 12 -23.485 4.549 12.095 1.00 0.00 H new ATOM 0 HA GLU B 12 -22.967 1.766 12.316 1.00 0.00 H new ATOM 0 HB2 GLU B 12 -25.096 2.938 12.920 1.00 0.00 H new ATOM 0 HB3 GLU B 12 -25.376 3.280 11.224 1.00 0.00 H new ATOM 0 HG2 GLU B 12 -26.719 1.401 11.703 1.00 0.00 H new ATOM 0 HG3 GLU B 12 -25.345 0.765 10.819 1.00 0.00 H new ATOM 190 N GLU B 13 -23.041 3.057 9.324 1.00 0.00 N ATOM 191 CA GLU B 13 -22.908 2.798 7.897 1.00 0.00 C ATOM 192 C GLU B 13 -21.522 2.234 7.586 1.00 0.00 C ATOM 193 O GLU B 13 -21.390 1.310 6.785 1.00 0.00 O ATOM 194 CB GLU B 13 -23.171 4.089 7.119 1.00 0.00 C ATOM 195 CG GLU B 13 -23.436 3.892 5.637 1.00 0.00 C ATOM 196 CD GLU B 13 -24.063 5.120 5.017 1.00 0.00 C ATOM 197 OE1 GLU B 13 -23.399 6.177 4.984 1.00 0.00 O ATOM 198 OE2 GLU B 13 -25.232 5.039 4.575 1.00 0.00 O ATOM 0 H GLU B 13 -23.026 4.046 9.574 1.00 0.00 H new ATOM 0 HA GLU B 13 -23.643 2.053 7.591 1.00 0.00 H new ATOM 0 HB2 GLU B 13 -24.027 4.597 7.563 1.00 0.00 H new ATOM 0 HB3 GLU B 13 -22.312 4.750 7.236 1.00 0.00 H new ATOM 0 HG2 GLU B 13 -22.501 3.663 5.127 1.00 0.00 H new ATOM 0 HG3 GLU B 13 -24.095 3.035 5.495 1.00 0.00 H new ATOM 205 N GLU B 14 -20.491 2.775 8.238 1.00 0.00 N ATOM 206 CA GLU B 14 -19.137 2.244 8.083 1.00 0.00 C ATOM 207 C GLU B 14 -19.003 0.893 8.782 1.00 0.00 C ATOM 208 O GLU B 14 -18.254 0.022 8.335 1.00 0.00 O ATOM 209 CB GLU B 14 -18.081 3.219 8.618 1.00 0.00 C ATOM 210 CG GLU B 14 -17.937 4.481 7.781 1.00 0.00 C ATOM 211 CD GLU B 14 -16.720 5.301 8.163 1.00 0.00 C ATOM 212 OE1 GLU B 14 -15.628 5.050 7.607 1.00 0.00 O ATOM 213 OE2 GLU B 14 -16.848 6.207 9.013 1.00 0.00 O ATOM 0 H GLU B 14 -20.566 3.571 8.871 1.00 0.00 H new ATOM 0 HA GLU B 14 -18.962 2.111 7.015 1.00 0.00 H new ATOM 0 HB2 GLU B 14 -18.341 3.498 9.639 1.00 0.00 H new ATOM 0 HB3 GLU B 14 -17.118 2.710 8.662 1.00 0.00 H new ATOM 0 HG2 GLU B 14 -17.870 4.208 6.728 1.00 0.00 H new ATOM 0 HG3 GLU B 14 -18.832 5.092 7.895 1.00 0.00 H new ATOM 220 N ALA B 15 -19.736 0.717 9.872 1.00 0.00 N ATOM 221 CA ALA B 15 -19.760 -0.561 10.569 1.00 0.00 C ATOM 222 C ALA B 15 -20.458 -1.612 9.714 1.00 0.00 C ATOM 223 O ALA B 15 -19.981 -2.728 9.581 1.00 0.00 O ATOM 224 CB ALA B 15 -20.442 -0.420 11.917 1.00 0.00 C ATOM 0 H ALA B 15 -20.320 1.440 10.292 1.00 0.00 H new ATOM 0 HA ALA B 15 -18.734 -0.885 10.743 1.00 0.00 H new ATOM 0 HB1 ALA B 15 -20.450 -1.385 12.423 1.00 0.00 H new ATOM 0 HB2 ALA B 15 -19.900 0.304 12.525 1.00 0.00 H new ATOM 0 HB3 ALA B 15 -21.467 -0.077 11.772 1.00 0.00 H new ATOM 230 N HIS B 16 -21.588 -1.233 9.140 1.00 0.00 N ATOM 231 CA HIS B 16 -22.321 -2.061 8.185 1.00 0.00 C ATOM 232 C HIS B 16 -21.456 -2.358 6.964 1.00 0.00 C ATOM 233 O HIS B 16 -21.621 -3.388 6.304 1.00 0.00 O ATOM 234 CB HIS B 16 -23.611 -1.346 7.759 1.00 0.00 C ATOM 235 CG HIS B 16 -24.560 -2.180 6.941 1.00 0.00 C ATOM 236 ND1 HIS B 16 -25.674 -1.655 6.322 1.00 0.00 N ATOM 237 CD2 HIS B 16 -24.576 -3.508 6.662 1.00 0.00 C ATOM 238 CE1 HIS B 16 -26.331 -2.620 5.704 1.00 0.00 C ATOM 239 NE2 HIS B 16 -25.686 -3.753 5.892 1.00 0.00 N ATOM 0 H HIS B 16 -22.030 -0.332 9.323 1.00 0.00 H new ATOM 0 HA HIS B 16 -22.579 -3.006 8.664 1.00 0.00 H new ATOM 0 HB2 HIS B 16 -24.131 -1.003 8.654 1.00 0.00 H new ATOM 0 HB3 HIS B 16 -23.344 -0.458 7.185 1.00 0.00 H new ATOM 0 HD2 HIS B 16 -23.849 -4.238 6.986 1.00 0.00 H new ATOM 0 HE1 HIS B 16 -27.244 -2.500 5.139 1.00 0.00 H new ATOM 0 HE2 HIS B 16 -25.965 -4.663 5.526 1.00 0.00 H new ATOM 248 N LEU B 17 -20.526 -1.463 6.680 1.00 0.00 N ATOM 249 CA LEU B 17 -19.641 -1.617 5.546 1.00 0.00 C ATOM 250 C LEU B 17 -18.707 -2.794 5.788 1.00 0.00 C ATOM 251 O LEU B 17 -18.528 -3.652 4.925 1.00 0.00 O ATOM 252 CB LEU B 17 -18.848 -0.330 5.333 1.00 0.00 C ATOM 253 CG LEU B 17 -18.192 -0.181 3.967 1.00 0.00 C ATOM 254 CD1 LEU B 17 -19.237 -0.294 2.876 1.00 0.00 C ATOM 255 CD2 LEU B 17 -17.471 1.149 3.871 1.00 0.00 C ATOM 0 H LEU B 17 -20.366 -0.616 7.226 1.00 0.00 H new ATOM 0 HA LEU B 17 -20.225 -1.814 4.647 1.00 0.00 H new ATOM 0 HB2 LEU B 17 -19.515 0.517 5.490 1.00 0.00 H new ATOM 0 HB3 LEU B 17 -18.073 -0.271 6.097 1.00 0.00 H new ATOM 0 HG LEU B 17 -17.461 -0.980 3.838 1.00 0.00 H new ATOM 0 HD11 LEU B 17 -18.759 -0.186 1.902 1.00 0.00 H new ATOM 0 HD12 LEU B 17 -19.722 -1.268 2.936 1.00 0.00 H new ATOM 0 HD13 LEU B 17 -19.982 0.491 3.003 1.00 0.00 H new ATOM 0 HD21 LEU B 17 -17.007 1.241 2.889 1.00 0.00 H new ATOM 0 HD22 LEU B 17 -18.184 1.961 4.013 1.00 0.00 H new ATOM 0 HD23 LEU B 17 -16.702 1.203 4.642 1.00 0.00 H new ATOM 267 N ARG B 18 -18.140 -2.850 6.987 1.00 0.00 N ATOM 268 CA ARG B 18 -17.298 -3.965 7.362 1.00 0.00 C ATOM 269 C ARG B 18 -18.168 -5.156 7.725 1.00 0.00 C ATOM 270 O ARG B 18 -17.772 -6.295 7.532 1.00 0.00 O ATOM 271 CB ARG B 18 -16.373 -3.591 8.524 1.00 0.00 C ATOM 272 CG ARG B 18 -17.090 -3.247 9.817 1.00 0.00 C ATOM 273 CD ARG B 18 -16.120 -2.755 10.876 1.00 0.00 C ATOM 274 NE ARG B 18 -16.784 -2.468 12.146 1.00 0.00 N ATOM 275 CZ ARG B 18 -16.266 -1.683 13.093 1.00 0.00 C ATOM 276 NH1 ARG B 18 -15.110 -1.063 12.889 1.00 0.00 N ATOM 277 NH2 ARG B 18 -16.911 -1.508 14.239 1.00 0.00 N ATOM 0 H ARG B 18 -18.251 -2.138 7.709 1.00 0.00 H new ATOM 0 HA ARG B 18 -16.666 -4.230 6.515 1.00 0.00 H new ATOM 0 HB2 ARG B 18 -15.692 -4.422 8.711 1.00 0.00 H new ATOM 0 HB3 ARG B 18 -15.762 -2.739 8.225 1.00 0.00 H new ATOM 0 HG2 ARG B 18 -17.841 -2.480 9.625 1.00 0.00 H new ATOM 0 HG3 ARG B 18 -17.619 -4.126 10.186 1.00 0.00 H new ATOM 0 HD2 ARG B 18 -15.347 -3.507 11.035 1.00 0.00 H new ATOM 0 HD3 ARG B 18 -15.621 -1.855 10.518 1.00 0.00 H new ATOM 0 HE ARG B 18 -17.696 -2.892 12.318 1.00 0.00 H new ATOM 0 HH11 ARG B 18 -14.614 -1.186 12.006 1.00 0.00 H new ATOM 0 HH12 ARG B 18 -14.717 -0.464 13.615 1.00 0.00 H new ATOM 0 HH21 ARG B 18 -17.804 -1.974 14.398 1.00 0.00 H new ATOM 0 HH22 ARG B 18 -16.513 -0.908 14.961 1.00 0.00 H new ATOM 291 N GLU B 19 -19.367 -4.867 8.225 1.00 0.00 N ATOM 292 CA GLU B 19 -20.343 -5.889 8.572 1.00 0.00 C ATOM 293 C GLU B 19 -20.529 -6.856 7.406 1.00 0.00 C ATOM 294 O GLU B 19 -20.397 -8.075 7.546 1.00 0.00 O ATOM 295 CB GLU B 19 -21.681 -5.231 8.918 1.00 0.00 C ATOM 296 CG GLU B 19 -22.778 -6.201 9.328 1.00 0.00 C ATOM 297 CD GLU B 19 -22.417 -7.005 10.562 1.00 0.00 C ATOM 298 OE1 GLU B 19 -22.248 -8.235 10.449 1.00 0.00 O ATOM 299 OE2 GLU B 19 -22.285 -6.408 11.649 1.00 0.00 O ATOM 0 H GLU B 19 -19.687 -3.914 8.400 1.00 0.00 H new ATOM 0 HA GLU B 19 -19.981 -6.444 9.437 1.00 0.00 H new ATOM 0 HB2 GLU B 19 -21.522 -4.520 9.728 1.00 0.00 H new ATOM 0 HB3 GLU B 19 -22.024 -4.660 8.055 1.00 0.00 H new ATOM 0 HG2 GLU B 19 -23.697 -5.645 9.517 1.00 0.00 H new ATOM 0 HG3 GLU B 19 -22.982 -6.883 8.502 1.00 0.00 H new ATOM 306 N LEU B 20 -20.802 -6.280 6.247 1.00 0.00 N ATOM 307 CA LEU B 20 -21.031 -7.043 5.034 1.00 0.00 C ATOM 308 C LEU B 20 -19.738 -7.672 4.527 1.00 0.00 C ATOM 309 O LEU B 20 -19.749 -8.764 3.951 1.00 0.00 O ATOM 310 CB LEU B 20 -21.622 -6.121 3.970 1.00 0.00 C ATOM 311 CG LEU B 20 -22.989 -6.539 3.430 1.00 0.00 C ATOM 312 CD1 LEU B 20 -23.682 -5.350 2.792 1.00 0.00 C ATOM 313 CD2 LEU B 20 -22.837 -7.669 2.423 1.00 0.00 C ATOM 0 H LEU B 20 -20.871 -5.270 6.122 1.00 0.00 H new ATOM 0 HA LEU B 20 -21.729 -7.851 5.252 1.00 0.00 H new ATOM 0 HB2 LEU B 20 -21.706 -5.118 4.388 1.00 0.00 H new ATOM 0 HB3 LEU B 20 -20.923 -6.061 3.136 1.00 0.00 H new ATOM 0 HG LEU B 20 -23.600 -6.897 4.259 1.00 0.00 H new ATOM 0 HD11 LEU B 20 -24.655 -5.658 2.410 1.00 0.00 H new ATOM 0 HD12 LEU B 20 -23.816 -4.565 3.536 1.00 0.00 H new ATOM 0 HD13 LEU B 20 -23.073 -4.972 1.971 1.00 0.00 H new ATOM 0 HD21 LEU B 20 -23.819 -7.956 2.047 1.00 0.00 H new ATOM 0 HD22 LEU B 20 -22.214 -7.335 1.593 1.00 0.00 H new ATOM 0 HD23 LEU B 20 -22.369 -8.526 2.906 1.00 0.00 H new ATOM 325 N TYR B 21 -18.624 -6.984 4.759 1.00 0.00 N ATOM 326 CA TYR B 21 -17.332 -7.450 4.287 1.00 0.00 C ATOM 327 C TYR B 21 -16.901 -8.676 5.066 1.00 0.00 C ATOM 328 O TYR B 21 -16.555 -9.696 4.483 1.00 0.00 O ATOM 329 CB TYR B 21 -16.273 -6.350 4.412 1.00 0.00 C ATOM 330 CG TYR B 21 -14.877 -6.808 4.041 1.00 0.00 C ATOM 331 CD1 TYR B 21 -14.483 -6.897 2.714 1.00 0.00 C ATOM 332 CD2 TYR B 21 -13.960 -7.165 5.021 1.00 0.00 C ATOM 333 CE1 TYR B 21 -13.212 -7.325 2.374 1.00 0.00 C ATOM 334 CE2 TYR B 21 -12.690 -7.591 4.690 1.00 0.00 C ATOM 335 CZ TYR B 21 -12.321 -7.674 3.367 1.00 0.00 C ATOM 336 OH TYR B 21 -11.057 -8.109 3.038 1.00 0.00 O ATOM 0 H TYR B 21 -18.594 -6.102 5.271 1.00 0.00 H new ATOM 0 HA TYR B 21 -17.430 -7.713 3.234 1.00 0.00 H new ATOM 0 HB2 TYR B 21 -16.554 -5.513 3.773 1.00 0.00 H new ATOM 0 HB3 TYR B 21 -16.265 -5.980 5.437 1.00 0.00 H new ATOM 0 HD1 TYR B 21 -15.180 -6.628 1.934 1.00 0.00 H new ATOM 0 HD2 TYR B 21 -14.246 -7.108 6.061 1.00 0.00 H new ATOM 0 HE1 TYR B 21 -12.919 -7.385 1.336 1.00 0.00 H new ATOM 0 HE2 TYR B 21 -11.988 -7.858 5.466 1.00 0.00 H new ATOM 0 HH TYR B 21 -10.558 -8.312 3.856 1.00 0.00 H new ATOM 346 N LEU B 22 -16.950 -8.571 6.385 1.00 0.00 N ATOM 347 CA LEU B 22 -16.521 -9.646 7.266 1.00 0.00 C ATOM 348 C LEU B 22 -17.314 -10.920 6.988 1.00 0.00 C ATOM 349 O LEU B 22 -16.807 -12.031 7.146 1.00 0.00 O ATOM 350 CB LEU B 22 -16.692 -9.223 8.730 1.00 0.00 C ATOM 351 CG LEU B 22 -16.026 -7.894 9.102 1.00 0.00 C ATOM 352 CD1 LEU B 22 -16.304 -7.536 10.550 1.00 0.00 C ATOM 353 CD2 LEU B 22 -14.530 -7.933 8.843 1.00 0.00 C ATOM 0 H LEU B 22 -17.287 -7.741 6.873 1.00 0.00 H new ATOM 0 HA LEU B 22 -15.467 -9.851 7.076 1.00 0.00 H new ATOM 0 HB2 LEU B 22 -17.757 -9.152 8.950 1.00 0.00 H new ATOM 0 HB3 LEU B 22 -16.286 -10.007 9.369 1.00 0.00 H new ATOM 0 HG LEU B 22 -16.458 -7.121 8.466 1.00 0.00 H new ATOM 0 HD11 LEU B 22 -15.821 -6.589 10.790 1.00 0.00 H new ATOM 0 HD12 LEU B 22 -17.379 -7.443 10.702 1.00 0.00 H new ATOM 0 HD13 LEU B 22 -15.912 -8.318 11.200 1.00 0.00 H new ATOM 0 HD21 LEU B 22 -14.088 -6.975 9.117 1.00 0.00 H new ATOM 0 HD22 LEU B 22 -14.078 -8.725 9.440 1.00 0.00 H new ATOM 0 HD23 LEU B 22 -14.349 -8.127 7.786 1.00 0.00 H new ATOM 365 N ALA B 23 -18.553 -10.742 6.550 1.00 0.00 N ATOM 366 CA ALA B 23 -19.427 -11.864 6.246 1.00 0.00 C ATOM 367 C ALA B 23 -19.043 -12.557 4.939 1.00 0.00 C ATOM 368 O ALA B 23 -18.949 -13.782 4.886 1.00 0.00 O ATOM 369 CB ALA B 23 -20.872 -11.395 6.187 1.00 0.00 C ATOM 0 H ALA B 23 -18.976 -9.826 6.397 1.00 0.00 H new ATOM 0 HA ALA B 23 -19.312 -12.596 7.046 1.00 0.00 H new ATOM 0 HB1 ALA B 23 -21.520 -12.241 5.959 1.00 0.00 H new ATOM 0 HB2 ALA B 23 -21.156 -10.970 7.149 1.00 0.00 H new ATOM 0 HB3 ALA B 23 -20.977 -10.638 5.410 1.00 0.00 H new ATOM 375 N ASN B 24 -18.813 -11.782 3.883 1.00 0.00 N ATOM 376 CA ASN B 24 -18.606 -12.358 2.560 1.00 0.00 C ATOM 377 C ASN B 24 -17.152 -12.256 2.102 1.00 0.00 C ATOM 378 O ASN B 24 -16.860 -12.441 0.925 1.00 0.00 O ATOM 379 CB ASN B 24 -19.524 -11.672 1.541 1.00 0.00 C ATOM 380 CG ASN B 24 -20.995 -11.852 1.870 1.00 0.00 C ATOM 381 OD1 ASN B 24 -21.612 -12.844 1.487 1.00 0.00 O ATOM 382 ND2 ASN B 24 -21.568 -10.890 2.580 1.00 0.00 N ATOM 0 H ASN B 24 -18.766 -10.764 3.917 1.00 0.00 H new ATOM 0 HA ASN B 24 -18.852 -13.418 2.626 1.00 0.00 H new ATOM 0 HB2 ASN B 24 -19.291 -10.608 1.505 1.00 0.00 H new ATOM 0 HB3 ASN B 24 -19.325 -12.076 0.548 1.00 0.00 H new ATOM 0 HD21 ASN B 24 -22.555 -10.958 2.827 1.00 0.00 H new ATOM 0 HD22 ASN B 24 -21.022 -10.082 2.879 1.00 0.00 H new ATOM 389 N LYS B 25 -16.239 -11.989 3.030 1.00 0.00 N ATOM 390 CA LYS B 25 -14.823 -11.844 2.684 1.00 0.00 C ATOM 391 C LYS B 25 -14.178 -13.196 2.414 1.00 0.00 C ATOM 392 O LYS B 25 -13.137 -13.278 1.768 1.00 0.00 O ATOM 393 CB LYS B 25 -14.050 -11.128 3.798 1.00 0.00 C ATOM 394 CG LYS B 25 -14.072 -11.862 5.131 1.00 0.00 C ATOM 395 CD LYS B 25 -13.274 -11.129 6.203 1.00 0.00 C ATOM 396 CE LYS B 25 -11.783 -11.103 5.891 1.00 0.00 C ATOM 397 NZ LYS B 25 -11.206 -12.471 5.771 1.00 0.00 N ATOM 0 H LYS B 25 -16.448 -11.869 4.021 1.00 0.00 H new ATOM 0 HA LYS B 25 -14.778 -11.243 1.776 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -13.015 -10.997 3.483 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -14.469 -10.131 3.936 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -15.104 -11.978 5.463 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -13.665 -12.865 4.999 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -13.643 -10.107 6.294 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -13.434 -11.612 7.167 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -11.618 -10.559 4.961 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -11.259 -10.558 6.676 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -10.168 -12.413 5.796 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -11.539 -13.059 6.561 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -11.507 -12.897 4.871 1.00 0.00 H new ATOM 411 N ASP B 26 -14.795 -14.252 2.914 1.00 0.00 N ATOM 412 CA ASP B 26 -14.230 -15.588 2.789 1.00 0.00 C ATOM 413 C ASP B 26 -14.916 -16.361 1.673 1.00 0.00 C ATOM 414 O ASP B 26 -14.709 -17.565 1.511 1.00 0.00 O ATOM 415 CB ASP B 26 -14.342 -16.341 4.117 1.00 0.00 C ATOM 416 CG ASP B 26 -13.479 -15.725 5.206 1.00 0.00 C ATOM 417 OD1 ASP B 26 -14.006 -14.935 6.018 1.00 0.00 O ATOM 418 OD2 ASP B 26 -12.267 -16.021 5.250 1.00 0.00 O ATOM 0 H ASP B 26 -15.686 -14.213 3.410 1.00 0.00 H new ATOM 0 HA ASP B 26 -13.174 -15.493 2.535 1.00 0.00 H new ATOM 0 HB2 ASP B 26 -15.383 -16.347 4.442 1.00 0.00 H new ATOM 0 HB3 ASP B 26 -14.048 -17.380 3.968 1.00 0.00 H new ATOM 423 N VAL B 27 -15.725 -15.657 0.894 1.00 0.00 N ATOM 424 CA VAL B 27 -16.427 -16.267 -0.220 1.00 0.00 C ATOM 425 C VAL B 27 -15.609 -16.117 -1.489 1.00 0.00 C ATOM 426 O VAL B 27 -15.477 -15.023 -2.036 1.00 0.00 O ATOM 427 CB VAL B 27 -17.828 -15.650 -0.428 1.00 0.00 C ATOM 428 CG1 VAL B 27 -18.585 -16.379 -1.530 1.00 0.00 C ATOM 429 CG2 VAL B 27 -18.619 -15.677 0.867 1.00 0.00 C ATOM 0 H VAL B 27 -15.910 -14.661 1.015 1.00 0.00 H new ATOM 0 HA VAL B 27 -16.560 -17.323 0.014 1.00 0.00 H new ATOM 0 HB VAL B 27 -17.699 -14.612 -0.734 1.00 0.00 H new ATOM 0 HG11 VAL B 27 -19.568 -15.926 -1.657 1.00 0.00 H new ATOM 0 HG12 VAL B 27 -18.028 -16.305 -2.464 1.00 0.00 H new ATOM 0 HG13 VAL B 27 -18.701 -17.428 -1.259 1.00 0.00 H new ATOM 0 HG21 VAL B 27 -19.603 -15.238 0.701 1.00 0.00 H new ATOM 0 HG22 VAL B 27 -18.733 -16.708 1.202 1.00 0.00 H new ATOM 0 HG23 VAL B 27 -18.090 -15.104 1.629 1.00 0.00 H new ATOM 439 N GLU B 28 -15.045 -17.220 -1.942 1.00 0.00 N ATOM 440 CA GLU B 28 -14.211 -17.210 -3.125 1.00 0.00 C ATOM 441 C GLU B 28 -15.045 -17.530 -4.358 1.00 0.00 C ATOM 442 O GLU B 28 -16.045 -18.245 -4.278 1.00 0.00 O ATOM 443 CB GLU B 28 -13.056 -18.198 -2.968 1.00 0.00 C ATOM 444 CG GLU B 28 -12.097 -17.826 -1.841 1.00 0.00 C ATOM 445 CD GLU B 28 -10.972 -18.822 -1.664 1.00 0.00 C ATOM 446 OE1 GLU B 28 -11.079 -19.693 -0.779 1.00 0.00 O ATOM 447 OE2 GLU B 28 -9.972 -18.742 -2.411 1.00 0.00 O ATOM 0 H GLU B 28 -15.151 -18.136 -1.506 1.00 0.00 H new ATOM 0 HA GLU B 28 -13.787 -16.214 -3.252 1.00 0.00 H new ATOM 0 HB2 GLU B 28 -13.460 -19.193 -2.779 1.00 0.00 H new ATOM 0 HB3 GLU B 28 -12.502 -18.252 -3.905 1.00 0.00 H new ATOM 0 HG2 GLU B 28 -11.674 -16.842 -2.042 1.00 0.00 H new ATOM 0 HG3 GLU B 28 -12.655 -17.748 -0.908 1.00 0.00 H new ATOM 454 N GLY B 29 -14.632 -16.987 -5.490 1.00 0.00 N ATOM 455 CA GLY B 29 -15.432 -17.079 -6.695 1.00 0.00 C ATOM 456 C GLY B 29 -16.494 -16.004 -6.699 1.00 0.00 C ATOM 457 O GLY B 29 -17.515 -16.107 -7.381 1.00 0.00 O ATOM 0 H GLY B 29 -13.753 -16.481 -5.598 1.00 0.00 H new ATOM 0 HA2 GLY B 29 -14.794 -16.974 -7.573 1.00 0.00 H new ATOM 0 HA3 GLY B 29 -15.899 -18.062 -6.756 1.00 0.00 H new ATOM 461 N GLN B 30 -16.241 -14.972 -5.913 1.00 0.00 N ATOM 462 CA GLN B 30 -17.190 -13.902 -5.697 1.00 0.00 C ATOM 463 C GLN B 30 -16.461 -12.562 -5.594 1.00 0.00 C ATOM 464 O GLN B 30 -15.293 -12.509 -5.202 1.00 0.00 O ATOM 465 CB GLN B 30 -17.988 -14.209 -4.421 1.00 0.00 C ATOM 466 CG GLN B 30 -18.806 -13.050 -3.867 1.00 0.00 C ATOM 467 CD GLN B 30 -18.102 -12.346 -2.719 1.00 0.00 C ATOM 468 OE1 GLN B 30 -16.880 -12.343 -2.633 1.00 0.00 O ATOM 469 NE2 GLN B 30 -18.868 -11.728 -1.838 1.00 0.00 N ATOM 0 H GLN B 30 -15.364 -14.855 -5.405 1.00 0.00 H new ATOM 0 HA GLN B 30 -17.879 -13.831 -6.538 1.00 0.00 H new ATOM 0 HB2 GLN B 30 -18.661 -15.042 -4.625 1.00 0.00 H new ATOM 0 HB3 GLN B 30 -17.293 -14.543 -3.650 1.00 0.00 H new ATOM 0 HG2 GLN B 30 -19.003 -12.333 -4.664 1.00 0.00 H new ATOM 0 HG3 GLN B 30 -19.773 -13.421 -3.525 1.00 0.00 H new ATOM 0 HE21 GLN B 30 -19.883 -11.751 -1.940 1.00 0.00 H new ATOM 0 HE22 GLN B 30 -18.445 -11.228 -1.056 1.00 0.00 H new ATOM 478 N ASP B 31 -17.141 -11.495 -5.984 1.00 0.00 N ATOM 479 CA ASP B 31 -16.622 -10.147 -5.814 1.00 0.00 C ATOM 480 C ASP B 31 -17.044 -9.621 -4.456 1.00 0.00 C ATOM 481 O ASP B 31 -18.200 -9.234 -4.273 1.00 0.00 O ATOM 482 CB ASP B 31 -17.171 -9.217 -6.891 1.00 0.00 C ATOM 483 CG ASP B 31 -16.697 -9.557 -8.289 1.00 0.00 C ATOM 484 OD1 ASP B 31 -17.376 -10.353 -8.977 1.00 0.00 O ATOM 485 OD2 ASP B 31 -15.664 -9.006 -8.720 1.00 0.00 O ATOM 0 H ASP B 31 -18.060 -11.538 -6.424 1.00 0.00 H new ATOM 0 HA ASP B 31 -15.535 -10.180 -5.893 1.00 0.00 H new ATOM 0 HB2 ASP B 31 -18.260 -9.252 -6.868 1.00 0.00 H new ATOM 0 HB3 ASP B 31 -16.880 -8.193 -6.657 1.00 0.00 H new ATOM 490 N VAL B 32 -16.125 -9.620 -3.499 1.00 0.00 N ATOM 491 CA VAL B 32 -16.462 -9.215 -2.145 1.00 0.00 C ATOM 492 C VAL B 32 -17.003 -7.791 -2.125 1.00 0.00 C ATOM 493 O VAL B 32 -18.013 -7.521 -1.488 1.00 0.00 O ATOM 494 CB VAL B 32 -15.265 -9.335 -1.172 1.00 0.00 C ATOM 495 CG1 VAL B 32 -14.224 -8.260 -1.436 1.00 0.00 C ATOM 496 CG2 VAL B 32 -15.747 -9.276 0.269 1.00 0.00 C ATOM 0 H VAL B 32 -15.151 -9.892 -3.635 1.00 0.00 H new ATOM 0 HA VAL B 32 -17.235 -9.902 -1.801 1.00 0.00 H new ATOM 0 HB VAL B 32 -14.789 -10.301 -1.342 1.00 0.00 H new ATOM 0 HG11 VAL B 32 -13.397 -8.374 -0.735 1.00 0.00 H new ATOM 0 HG12 VAL B 32 -13.851 -8.357 -2.456 1.00 0.00 H new ATOM 0 HG13 VAL B 32 -14.676 -7.276 -1.307 1.00 0.00 H new ATOM 0 HG21 VAL B 32 -14.894 -9.362 0.942 1.00 0.00 H new ATOM 0 HG22 VAL B 32 -16.254 -8.327 0.445 1.00 0.00 H new ATOM 0 HG23 VAL B 32 -16.440 -10.097 0.455 1.00 0.00 H new ATOM 506 N VAL B 33 -16.355 -6.891 -2.864 1.00 0.00 N ATOM 507 CA VAL B 33 -16.747 -5.498 -2.859 1.00 0.00 C ATOM 508 C VAL B 33 -18.106 -5.325 -3.524 1.00 0.00 C ATOM 509 O VAL B 33 -18.912 -4.520 -3.078 1.00 0.00 O ATOM 510 CB VAL B 33 -15.679 -4.595 -3.519 1.00 0.00 C ATOM 511 CG1 VAL B 33 -15.508 -4.888 -5.000 1.00 0.00 C ATOM 512 CG2 VAL B 33 -15.998 -3.125 -3.286 1.00 0.00 C ATOM 0 H VAL B 33 -15.562 -7.108 -3.468 1.00 0.00 H new ATOM 0 HA VAL B 33 -16.830 -5.180 -1.820 1.00 0.00 H new ATOM 0 HB VAL B 33 -14.726 -4.824 -3.041 1.00 0.00 H new ATOM 0 HG11 VAL B 33 -14.747 -4.228 -5.416 1.00 0.00 H new ATOM 0 HG12 VAL B 33 -15.200 -5.925 -5.133 1.00 0.00 H new ATOM 0 HG13 VAL B 33 -16.454 -4.722 -5.515 1.00 0.00 H new ATOM 0 HG21 VAL B 33 -15.234 -2.508 -3.759 1.00 0.00 H new ATOM 0 HG22 VAL B 33 -16.971 -2.891 -3.717 1.00 0.00 H new ATOM 0 HG23 VAL B 33 -16.017 -2.922 -2.215 1.00 0.00 H new ATOM 522 N GLU B 34 -18.373 -6.122 -4.556 1.00 0.00 N ATOM 523 CA GLU B 34 -19.679 -6.118 -5.206 1.00 0.00 C ATOM 524 C GLU B 34 -20.758 -6.463 -4.192 1.00 0.00 C ATOM 525 O GLU B 34 -21.792 -5.797 -4.114 1.00 0.00 O ATOM 526 CB GLU B 34 -19.711 -7.129 -6.349 1.00 0.00 C ATOM 527 CG GLU B 34 -21.088 -7.325 -6.955 1.00 0.00 C ATOM 528 CD GLU B 34 -21.113 -8.428 -7.988 1.00 0.00 C ATOM 529 OE1 GLU B 34 -20.861 -9.595 -7.626 1.00 0.00 O ATOM 530 OE2 GLU B 34 -21.399 -8.137 -9.167 1.00 0.00 O ATOM 0 H GLU B 34 -17.703 -6.777 -4.959 1.00 0.00 H new ATOM 0 HA GLU B 34 -19.863 -5.123 -5.612 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -19.024 -6.803 -7.130 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -19.345 -8.088 -5.983 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -21.800 -7.557 -6.163 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -21.415 -6.393 -7.415 1.00 0.00 H new ATOM 537 N ALA B 35 -20.492 -7.503 -3.406 1.00 0.00 N ATOM 538 CA ALA B 35 -21.394 -7.914 -2.346 1.00 0.00 C ATOM 539 C ALA B 35 -21.648 -6.766 -1.381 1.00 0.00 C ATOM 540 O ALA B 35 -22.757 -6.591 -0.887 1.00 0.00 O ATOM 541 CB ALA B 35 -20.827 -9.112 -1.601 1.00 0.00 C ATOM 0 H ALA B 35 -19.652 -8.076 -3.488 1.00 0.00 H new ATOM 0 HA ALA B 35 -22.343 -8.201 -2.798 1.00 0.00 H new ATOM 0 HB1 ALA B 35 -21.516 -9.407 -0.809 1.00 0.00 H new ATOM 0 HB2 ALA B 35 -20.694 -9.942 -2.295 1.00 0.00 H new ATOM 0 HB3 ALA B 35 -19.864 -8.846 -1.164 1.00 0.00 H new ATOM 547 N ILE B 36 -20.622 -5.973 -1.128 1.00 0.00 N ATOM 548 CA ILE B 36 -20.760 -4.845 -0.227 1.00 0.00 C ATOM 549 C ILE B 36 -21.596 -3.756 -0.880 1.00 0.00 C ATOM 550 O ILE B 36 -22.703 -3.471 -0.427 1.00 0.00 O ATOM 551 CB ILE B 36 -19.400 -4.243 0.188 1.00 0.00 C ATOM 552 CG1 ILE B 36 -18.350 -5.334 0.415 1.00 0.00 C ATOM 553 CG2 ILE B 36 -19.570 -3.406 1.442 1.00 0.00 C ATOM 554 CD1 ILE B 36 -18.758 -6.395 1.410 1.00 0.00 C ATOM 0 H ILE B 36 -19.692 -6.088 -1.530 1.00 0.00 H new ATOM 0 HA ILE B 36 -21.249 -5.222 0.671 1.00 0.00 H new ATOM 0 HB ILE B 36 -19.046 -3.609 -0.625 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -18.129 -5.813 -0.539 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -17.427 -4.867 0.758 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -18.608 -2.984 1.731 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -20.277 -2.599 1.248 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -19.948 -4.033 2.250 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -17.957 -7.127 1.510 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -18.949 -5.932 2.378 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -19.663 -6.893 1.061 1.00 0.00 H new ATOM 566 N LEU B 37 -21.073 -3.203 -1.979 1.00 0.00 N ATOM 567 CA LEU B 37 -21.690 -2.052 -2.668 1.00 0.00 C ATOM 568 C LEU B 37 -23.186 -2.261 -2.899 1.00 0.00 C ATOM 569 O LEU B 37 -23.995 -1.350 -2.722 1.00 0.00 O ATOM 570 CB LEU B 37 -21.056 -1.823 -4.049 1.00 0.00 C ATOM 571 CG LEU B 37 -19.545 -2.025 -4.168 1.00 0.00 C ATOM 572 CD1 LEU B 37 -19.151 -2.182 -5.626 1.00 0.00 C ATOM 573 CD2 LEU B 37 -18.799 -0.868 -3.551 1.00 0.00 C ATOM 0 H LEU B 37 -20.214 -3.535 -2.419 1.00 0.00 H new ATOM 0 HA LEU B 37 -21.524 -1.194 -2.016 1.00 0.00 H new ATOM 0 HB2 LEU B 37 -21.543 -2.492 -4.759 1.00 0.00 H new ATOM 0 HB3 LEU B 37 -21.286 -0.804 -4.361 1.00 0.00 H new ATOM 0 HG LEU B 37 -19.278 -2.933 -3.628 1.00 0.00 H new ATOM 0 HD11 LEU B 37 -18.073 -2.325 -5.698 1.00 0.00 H new ATOM 0 HD12 LEU B 37 -19.661 -3.047 -6.050 1.00 0.00 H new ATOM 0 HD13 LEU B 37 -19.436 -1.287 -6.178 1.00 0.00 H new ATOM 0 HD21 LEU B 37 -17.726 -1.034 -3.648 1.00 0.00 H new ATOM 0 HD22 LEU B 37 -19.071 0.055 -4.063 1.00 0.00 H new ATOM 0 HD23 LEU B 37 -19.060 -0.788 -2.496 1.00 0.00 H new ATOM 585 N ALA B 38 -23.536 -3.472 -3.303 1.00 0.00 N ATOM 586 CA ALA B 38 -24.873 -3.768 -3.799 1.00 0.00 C ATOM 587 C ALA B 38 -25.857 -4.174 -2.702 1.00 0.00 C ATOM 588 O ALA B 38 -27.066 -4.013 -2.867 1.00 0.00 O ATOM 589 CB ALA B 38 -24.789 -4.856 -4.852 1.00 0.00 C ATOM 0 H ALA B 38 -22.906 -4.274 -3.297 1.00 0.00 H new ATOM 0 HA ALA B 38 -25.263 -2.846 -4.229 1.00 0.00 H new ATOM 0 HB1 ALA B 38 -25.789 -5.079 -5.225 1.00 0.00 H new ATOM 0 HB2 ALA B 38 -24.162 -4.517 -5.676 1.00 0.00 H new ATOM 0 HB3 ALA B 38 -24.356 -5.755 -4.413 1.00 0.00 H new ATOM 595 N HIS B 39 -25.365 -4.705 -1.589 1.00 0.00 N ATOM 596 CA HIS B 39 -26.269 -5.184 -0.547 1.00 0.00 C ATOM 597 C HIS B 39 -26.672 -4.060 0.399 1.00 0.00 C ATOM 598 O HIS B 39 -27.772 -4.078 0.948 1.00 0.00 O ATOM 599 CB HIS B 39 -25.669 -6.350 0.244 1.00 0.00 C ATOM 600 CG HIS B 39 -25.791 -7.681 -0.437 1.00 0.00 C ATOM 601 ND1 HIS B 39 -26.830 -8.551 -0.208 1.00 0.00 N ATOM 602 CD2 HIS B 39 -24.996 -8.285 -1.344 1.00 0.00 C ATOM 603 CE1 HIS B 39 -26.669 -9.632 -0.947 1.00 0.00 C ATOM 604 NE2 HIS B 39 -25.561 -9.497 -1.650 1.00 0.00 N ATOM 0 H HIS B 39 -24.371 -4.814 -1.386 1.00 0.00 H new ATOM 0 HA HIS B 39 -27.162 -5.548 -1.054 1.00 0.00 H new ATOM 0 HB2 HIS B 39 -24.615 -6.144 0.430 1.00 0.00 H new ATOM 0 HB3 HIS B 39 -26.159 -6.405 1.216 1.00 0.00 H new ATOM 0 HD2 HIS B 39 -24.080 -7.886 -1.755 1.00 0.00 H new ATOM 0 HE1 HIS B 39 -27.332 -10.484 -0.972 1.00 0.00 H new ATOM 0 HE2 HIS B 39 -25.187 -10.179 -2.310 1.00 0.00 H new ATOM 613 N LEU B 40 -25.801 -3.077 0.588 1.00 0.00 N ATOM 614 CA LEU B 40 -26.156 -1.929 1.409 1.00 0.00 C ATOM 615 C LEU B 40 -26.583 -0.749 0.544 1.00 0.00 C ATOM 616 O LEU B 40 -25.800 0.149 0.243 1.00 0.00 O ATOM 617 CB LEU B 40 -25.032 -1.539 2.391 1.00 0.00 C ATOM 618 CG LEU B 40 -23.584 -1.775 1.932 1.00 0.00 C ATOM 619 CD1 LEU B 40 -23.169 -0.808 0.834 1.00 0.00 C ATOM 620 CD2 LEU B 40 -22.641 -1.658 3.116 1.00 0.00 C ATOM 0 H LEU B 40 -24.861 -3.051 0.192 1.00 0.00 H new ATOM 0 HA LEU B 40 -27.010 -2.223 2.020 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -25.143 -0.481 2.628 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -25.187 -2.091 3.318 1.00 0.00 H new ATOM 0 HG LEU B 40 -23.528 -2.782 1.518 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -22.139 -1.011 0.540 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -23.824 -0.934 -0.028 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -23.246 0.215 1.202 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -21.617 -1.826 2.783 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -22.723 -0.661 3.549 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -22.906 -2.402 3.867 1.00 0.00 H new ATOM 632 N ASN B 41 -27.847 -0.745 0.156 1.00 0.00 N ATOM 633 CA ASN B 41 -28.370 0.294 -0.725 1.00 0.00 C ATOM 634 C ASN B 41 -28.710 1.547 0.072 1.00 0.00 C ATOM 635 O ASN B 41 -29.681 2.248 -0.214 1.00 0.00 O ATOM 636 CB ASN B 41 -29.601 -0.220 -1.475 1.00 0.00 C ATOM 637 CG ASN B 41 -29.277 -1.390 -2.382 1.00 0.00 C ATOM 638 OD1 ASN B 41 -28.916 -1.208 -3.544 1.00 0.00 O ATOM 639 ND2 ASN B 41 -29.413 -2.602 -1.862 1.00 0.00 N ATOM 0 H ASN B 41 -28.532 -1.447 0.435 1.00 0.00 H new ATOM 0 HA ASN B 41 -27.603 0.552 -1.455 1.00 0.00 H new ATOM 0 HB2 ASN B 41 -30.362 -0.521 -0.755 1.00 0.00 H new ATOM 0 HB3 ASN B 41 -30.026 0.590 -2.068 1.00 0.00 H new ATOM 0 HD21 ASN B 41 -29.216 -3.426 -2.430 1.00 0.00 H new ATOM 0 HD22 ASN B 41 -29.715 -2.711 -0.894 1.00 0.00 H new ATOM 646 N THR B 42 -27.866 1.842 1.048 1.00 0.00 N ATOM 647 CA THR B 42 -27.997 3.035 1.858 1.00 0.00 C ATOM 648 C THR B 42 -27.181 4.162 1.238 1.00 0.00 C ATOM 649 O THR B 42 -27.459 5.344 1.449 1.00 0.00 O ATOM 650 CB THR B 42 -27.539 2.774 3.318 1.00 0.00 C ATOM 651 OG1 THR B 42 -27.577 3.988 4.084 1.00 0.00 O ATOM 652 CG2 THR B 42 -26.135 2.174 3.363 1.00 0.00 C ATOM 0 H THR B 42 -27.069 1.256 1.299 1.00 0.00 H new ATOM 0 HA THR B 42 -29.048 3.323 1.888 1.00 0.00 H new ATOM 0 HB THR B 42 -28.231 2.055 3.756 1.00 0.00 H new ATOM 0 HG1 THR B 42 -26.705 4.432 4.037 1.00 0.00 H new ATOM 0 HG21 THR B 42 -25.845 2.004 4.400 1.00 0.00 H new ATOM 0 HG22 THR B 42 -26.127 1.227 2.824 1.00 0.00 H new ATOM 0 HG23 THR B 42 -25.430 2.863 2.898 1.00 0.00 H new ATOM 660 N VAL B 43 -26.192 3.783 0.439 1.00 0.00 N ATOM 661 CA VAL B 43 -25.335 4.748 -0.224 1.00 0.00 C ATOM 662 C VAL B 43 -25.375 4.583 -1.737 1.00 0.00 C ATOM 663 O VAL B 43 -24.978 3.545 -2.265 1.00 0.00 O ATOM 664 CB VAL B 43 -23.864 4.632 0.242 1.00 0.00 C ATOM 665 CG1 VAL B 43 -23.654 5.339 1.569 1.00 0.00 C ATOM 666 CG2 VAL B 43 -23.437 3.172 0.344 1.00 0.00 C ATOM 0 H VAL B 43 -25.966 2.809 0.236 1.00 0.00 H new ATOM 0 HA VAL B 43 -25.721 5.730 0.049 1.00 0.00 H new ATOM 0 HB VAL B 43 -23.241 5.120 -0.507 1.00 0.00 H new ATOM 0 HG11 VAL B 43 -22.612 5.241 1.872 1.00 0.00 H new ATOM 0 HG12 VAL B 43 -23.904 6.395 1.462 1.00 0.00 H new ATOM 0 HG13 VAL B 43 -24.296 4.889 2.326 1.00 0.00 H new ATOM 0 HG21 VAL B 43 -22.399 3.119 0.673 1.00 0.00 H new ATOM 0 HG22 VAL B 43 -24.073 2.656 1.063 1.00 0.00 H new ATOM 0 HG23 VAL B 43 -23.533 2.696 -0.632 1.00 0.00 H new ATOM 676 N PRO B 44 -25.885 5.589 -2.457 1.00 0.00 N ATOM 677 CA PRO B 44 -25.732 5.656 -3.905 1.00 0.00 C ATOM 678 C PRO B 44 -24.286 5.980 -4.250 1.00 0.00 C ATOM 679 O PRO B 44 -23.907 7.148 -4.366 1.00 0.00 O ATOM 680 CB PRO B 44 -26.666 6.796 -4.334 1.00 0.00 C ATOM 681 CG PRO B 44 -27.480 7.124 -3.126 1.00 0.00 C ATOM 682 CD PRO B 44 -26.657 6.719 -1.937 1.00 0.00 C ATOM 0 HA PRO B 44 -25.976 4.719 -4.407 1.00 0.00 H new ATOM 0 HB2 PRO B 44 -26.097 7.663 -4.671 1.00 0.00 H new ATOM 0 HB3 PRO B 44 -27.302 6.490 -5.164 1.00 0.00 H new ATOM 0 HG2 PRO B 44 -27.713 8.188 -3.092 1.00 0.00 H new ATOM 0 HG3 PRO B 44 -28.430 6.590 -3.141 1.00 0.00 H new ATOM 0 HD2 PRO B 44 -26.012 7.528 -1.595 1.00 0.00 H new ATOM 0 HD3 PRO B 44 -27.281 6.430 -1.091 1.00 0.00 H new ATOM 690 N ARG B 45 -23.470 4.946 -4.372 1.00 0.00 N ATOM 691 CA ARG B 45 -22.034 5.126 -4.491 1.00 0.00 C ATOM 692 C ARG B 45 -21.413 4.165 -5.481 1.00 0.00 C ATOM 693 O ARG B 45 -22.087 3.301 -6.046 1.00 0.00 O ATOM 694 CB ARG B 45 -21.368 4.962 -3.126 1.00 0.00 C ATOM 695 CG ARG B 45 -21.278 6.263 -2.357 1.00 0.00 C ATOM 696 CD ARG B 45 -20.659 6.077 -0.984 1.00 0.00 C ATOM 697 NE ARG B 45 -19.944 7.279 -0.564 1.00 0.00 N ATOM 698 CZ ARG B 45 -20.457 8.224 0.226 1.00 0.00 C ATOM 699 NH1 ARG B 45 -21.653 8.061 0.780 1.00 0.00 N ATOM 700 NH2 ARG B 45 -19.758 9.322 0.486 1.00 0.00 N ATOM 0 H ARG B 45 -23.778 3.974 -4.391 1.00 0.00 H new ATOM 0 HA ARG B 45 -21.868 6.136 -4.865 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -21.929 4.236 -2.538 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -20.366 4.556 -3.262 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -20.686 6.979 -2.926 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -22.276 6.689 -2.249 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -21.438 5.841 -0.259 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -19.974 5.230 -1.002 1.00 0.00 H new ATOM 0 HE ARG B 45 -18.988 7.405 -0.897 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -22.185 7.209 0.603 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -22.039 8.788 1.383 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -18.829 9.443 0.082 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -20.150 10.045 1.090 1.00 0.00 H new ATOM 714 N THR B 46 -20.121 4.336 -5.683 1.00 0.00 N ATOM 715 CA THR B 46 -19.372 3.527 -6.616 1.00 0.00 C ATOM 716 C THR B 46 -18.507 2.515 -5.873 1.00 0.00 C ATOM 717 O THR B 46 -18.605 2.382 -4.651 1.00 0.00 O ATOM 718 CB THR B 46 -18.489 4.421 -7.494 1.00 0.00 C ATOM 719 OG1 THR B 46 -17.597 5.168 -6.671 1.00 0.00 O ATOM 720 CG2 THR B 46 -19.345 5.375 -8.306 1.00 0.00 C ATOM 0 H THR B 46 -19.563 5.042 -5.202 1.00 0.00 H new ATOM 0 HA THR B 46 -20.076 2.986 -7.248 1.00 0.00 H new ATOM 0 HB THR B 46 -17.919 3.790 -8.176 1.00 0.00 H new ATOM 0 HG1 THR B 46 -17.032 5.738 -7.234 1.00 0.00 H new ATOM 0 HG21 THR B 46 -18.704 6.003 -8.924 1.00 0.00 H new ATOM 0 HG22 THR B 46 -20.019 4.805 -8.945 1.00 0.00 H new ATOM 0 HG23 THR B 46 -19.928 6.003 -7.633 1.00 0.00 H new ATOM 728 N ARG B 47 -17.654 1.816 -6.611 1.00 0.00 N ATOM 729 CA ARG B 47 -16.845 0.749 -6.035 1.00 0.00 C ATOM 730 C ARG B 47 -15.768 1.343 -5.132 1.00 0.00 C ATOM 731 O ARG B 47 -15.631 0.958 -3.971 1.00 0.00 O ATOM 732 CB ARG B 47 -16.177 -0.113 -7.128 1.00 0.00 C ATOM 733 CG ARG B 47 -16.834 -0.060 -8.509 1.00 0.00 C ATOM 734 CD ARG B 47 -18.307 -0.448 -8.485 1.00 0.00 C ATOM 735 NE ARG B 47 -18.940 -0.228 -9.784 1.00 0.00 N ATOM 736 CZ ARG B 47 -20.128 -0.722 -10.134 1.00 0.00 C ATOM 737 NH1 ARG B 47 -20.828 -1.458 -9.280 1.00 0.00 N ATOM 738 NH2 ARG B 47 -20.623 -0.468 -11.339 1.00 0.00 N ATOM 0 H ARG B 47 -17.504 1.968 -7.608 1.00 0.00 H new ATOM 0 HA ARG B 47 -17.509 0.109 -5.454 1.00 0.00 H new ATOM 0 HB2 ARG B 47 -15.138 0.201 -7.228 1.00 0.00 H new ATOM 0 HB3 ARG B 47 -16.166 -1.150 -6.791 1.00 0.00 H new ATOM 0 HG2 ARG B 47 -16.736 0.948 -8.913 1.00 0.00 H new ATOM 0 HG3 ARG B 47 -16.300 -0.727 -9.185 1.00 0.00 H new ATOM 0 HD2 ARG B 47 -18.404 -1.497 -8.205 1.00 0.00 H new ATOM 0 HD3 ARG B 47 -18.825 0.134 -7.723 1.00 0.00 H new ATOM 0 HE ARG B 47 -18.440 0.341 -10.468 1.00 0.00 H new ATOM 0 HH11 ARG B 47 -20.458 -1.649 -8.349 1.00 0.00 H new ATOM 0 HH12 ARG B 47 -21.736 -1.833 -9.555 1.00 0.00 H new ATOM 0 HH21 ARG B 47 -20.095 0.105 -11.997 1.00 0.00 H new ATOM 0 HH22 ARG B 47 -21.532 -0.846 -11.607 1.00 0.00 H new ATOM 752 N LYS B 48 -15.040 2.313 -5.680 1.00 0.00 N ATOM 753 CA LYS B 48 -13.891 2.930 -5.018 1.00 0.00 C ATOM 754 C LYS B 48 -14.242 3.465 -3.622 1.00 0.00 C ATOM 755 O LYS B 48 -13.429 3.388 -2.695 1.00 0.00 O ATOM 756 CB LYS B 48 -13.357 4.056 -5.913 1.00 0.00 C ATOM 757 CG LYS B 48 -12.215 4.855 -5.305 1.00 0.00 C ATOM 758 CD LYS B 48 -12.189 6.288 -5.821 1.00 0.00 C ATOM 759 CE LYS B 48 -13.362 7.088 -5.272 1.00 0.00 C ATOM 760 NZ LYS B 48 -13.370 8.492 -5.758 1.00 0.00 N ATOM 0 H LYS B 48 -15.232 2.697 -6.605 1.00 0.00 H new ATOM 0 HA LYS B 48 -13.124 2.170 -4.872 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -13.021 3.625 -6.856 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -14.176 4.736 -6.147 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -12.314 4.861 -4.219 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -11.268 4.368 -5.536 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -11.252 6.765 -5.532 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -12.224 6.286 -6.910 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -14.295 6.602 -5.559 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -13.322 7.084 -4.183 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -14.187 8.994 -5.356 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -12.493 8.967 -5.463 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -13.435 8.500 -6.796 1.00 0.00 H new ATOM 774 N GLN B 49 -15.453 3.994 -3.485 1.00 0.00 N ATOM 775 CA GLN B 49 -15.933 4.551 -2.219 1.00 0.00 C ATOM 776 C GLN B 49 -15.845 3.525 -1.090 1.00 0.00 C ATOM 777 O GLN B 49 -15.144 3.725 -0.088 1.00 0.00 O ATOM 778 CB GLN B 49 -17.389 5.010 -2.363 1.00 0.00 C ATOM 779 CG GLN B 49 -17.585 6.467 -2.773 1.00 0.00 C ATOM 780 CD GLN B 49 -17.097 6.801 -4.169 1.00 0.00 C ATOM 781 OE1 GLN B 49 -16.112 6.261 -4.653 1.00 0.00 O ATOM 782 NE2 GLN B 49 -17.814 7.683 -4.838 1.00 0.00 N ATOM 0 H GLN B 49 -16.131 4.050 -4.245 1.00 0.00 H new ATOM 0 HA GLN B 49 -15.296 5.400 -1.971 1.00 0.00 H new ATOM 0 HB2 GLN B 49 -17.880 4.375 -3.100 1.00 0.00 H new ATOM 0 HB3 GLN B 49 -17.898 4.847 -1.413 1.00 0.00 H new ATOM 0 HG2 GLN B 49 -18.645 6.710 -2.705 1.00 0.00 H new ATOM 0 HG3 GLN B 49 -17.065 7.105 -2.058 1.00 0.00 H new ATOM 0 HE21 GLN B 49 -18.630 8.113 -4.402 1.00 0.00 H new ATOM 0 HE22 GLN B 49 -17.553 7.935 -5.791 1.00 0.00 H new ATOM 791 N ILE B 50 -16.564 2.425 -1.267 1.00 0.00 N ATOM 792 CA ILE B 50 -16.627 1.376 -0.264 1.00 0.00 C ATOM 793 C ILE B 50 -15.244 0.779 -0.013 1.00 0.00 C ATOM 794 O ILE B 50 -14.855 0.562 1.139 1.00 0.00 O ATOM 795 CB ILE B 50 -17.626 0.266 -0.680 1.00 0.00 C ATOM 796 CG1 ILE B 50 -19.076 0.693 -0.386 1.00 0.00 C ATOM 797 CG2 ILE B 50 -17.303 -1.059 0.005 1.00 0.00 C ATOM 798 CD1 ILE B 50 -19.737 1.516 -1.479 1.00 0.00 C ATOM 0 H ILE B 50 -17.116 2.237 -2.104 1.00 0.00 H new ATOM 0 HA ILE B 50 -16.983 1.825 0.663 1.00 0.00 H new ATOM 0 HB ILE B 50 -17.525 0.118 -1.755 1.00 0.00 H new ATOM 0 HG12 ILE B 50 -19.674 -0.202 -0.213 1.00 0.00 H new ATOM 0 HG13 ILE B 50 -19.089 1.269 0.540 1.00 0.00 H new ATOM 0 HG21 ILE B 50 -18.022 -1.816 -0.309 1.00 0.00 H new ATOM 0 HG22 ILE B 50 -16.298 -1.377 -0.273 1.00 0.00 H new ATOM 0 HG23 ILE B 50 -17.358 -0.932 1.086 1.00 0.00 H new ATOM 0 HD11 ILE B 50 -20.754 1.768 -1.180 1.00 0.00 H new ATOM 0 HD12 ILE B 50 -19.168 2.432 -1.639 1.00 0.00 H new ATOM 0 HD13 ILE B 50 -19.763 0.939 -2.403 1.00 0.00 H new ATOM 810 N ILE B 51 -14.500 0.554 -1.093 1.00 0.00 N ATOM 811 CA ILE B 51 -13.152 -0.003 -1.004 1.00 0.00 C ATOM 812 C ILE B 51 -12.294 0.808 -0.040 1.00 0.00 C ATOM 813 O ILE B 51 -11.621 0.257 0.833 1.00 0.00 O ATOM 814 CB ILE B 51 -12.452 -0.007 -2.373 1.00 0.00 C ATOM 815 CG1 ILE B 51 -13.268 -0.813 -3.378 1.00 0.00 C ATOM 816 CG2 ILE B 51 -11.044 -0.574 -2.244 1.00 0.00 C ATOM 817 CD1 ILE B 51 -12.764 -0.695 -4.795 1.00 0.00 C ATOM 0 H ILE B 51 -14.810 0.750 -2.045 1.00 0.00 H new ATOM 0 HA ILE B 51 -13.260 -1.027 -0.646 1.00 0.00 H new ATOM 0 HB ILE B 51 -12.377 1.019 -2.734 1.00 0.00 H new ATOM 0 HG12 ILE B 51 -13.258 -1.862 -3.084 1.00 0.00 H new ATOM 0 HG13 ILE B 51 -14.306 -0.481 -3.341 1.00 0.00 H new ATOM 0 HG21 ILE B 51 -10.560 -0.571 -3.221 1.00 0.00 H new ATOM 0 HG22 ILE B 51 -10.467 0.039 -1.551 1.00 0.00 H new ATOM 0 HG23 ILE B 51 -11.096 -1.596 -1.868 1.00 0.00 H new ATOM 0 HD11 ILE B 51 -13.391 -1.294 -5.455 1.00 0.00 H new ATOM 0 HD12 ILE B 51 -12.800 0.348 -5.108 1.00 0.00 H new ATOM 0 HD13 ILE B 51 -11.736 -1.054 -4.847 1.00 0.00 H new ATOM 829 N HIS B 52 -12.348 2.128 -0.204 1.00 0.00 N ATOM 830 CA HIS B 52 -11.529 3.042 0.580 1.00 0.00 C ATOM 831 C HIS B 52 -11.710 2.837 2.074 1.00 0.00 C ATOM 832 O HIS B 52 -10.731 2.686 2.792 1.00 0.00 O ATOM 833 CB HIS B 52 -11.830 4.494 0.218 1.00 0.00 C ATOM 834 CG HIS B 52 -10.896 5.059 -0.808 1.00 0.00 C ATOM 835 ND1 HIS B 52 -9.994 6.062 -0.534 1.00 0.00 N ATOM 836 CD2 HIS B 52 -10.734 4.760 -2.117 1.00 0.00 C ATOM 837 CE1 HIS B 52 -9.320 6.358 -1.629 1.00 0.00 C ATOM 838 NE2 HIS B 52 -9.747 5.583 -2.607 1.00 0.00 N ATOM 0 H HIS B 52 -12.957 2.589 -0.880 1.00 0.00 H new ATOM 0 HA HIS B 52 -10.491 2.819 0.334 1.00 0.00 H new ATOM 0 HB2 HIS B 52 -12.852 4.563 -0.155 1.00 0.00 H new ATOM 0 HB3 HIS B 52 -11.778 5.104 1.120 1.00 0.00 H new ATOM 0 HD2 HIS B 52 -11.279 4.013 -2.675 1.00 0.00 H new ATOM 0 HE1 HIS B 52 -8.548 7.109 -1.711 1.00 0.00 H new ATOM 0 HE2 HIS B 52 -9.403 5.592 -3.567 1.00 0.00 H new ATOM 847 N HIS B 53 -12.950 2.829 2.545 1.00 0.00 N ATOM 848 CA HIS B 53 -13.201 2.711 3.987 1.00 0.00 C ATOM 849 C HIS B 53 -12.689 1.389 4.544 1.00 0.00 C ATOM 850 O HIS B 53 -12.195 1.332 5.667 1.00 0.00 O ATOM 851 CB HIS B 53 -14.685 2.851 4.306 1.00 0.00 C ATOM 852 CG HIS B 53 -15.225 4.206 4.020 1.00 0.00 C ATOM 853 ND1 HIS B 53 -15.071 5.272 4.876 1.00 0.00 N ATOM 854 CD2 HIS B 53 -15.888 4.677 2.945 1.00 0.00 C ATOM 855 CE1 HIS B 53 -15.605 6.345 4.335 1.00 0.00 C ATOM 856 NE2 HIS B 53 -16.109 6.011 3.161 1.00 0.00 N ATOM 0 H HIS B 53 -13.788 2.901 1.968 1.00 0.00 H new ATOM 0 HA HIS B 53 -12.655 3.525 4.463 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -15.244 2.116 3.728 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -14.846 2.618 5.359 1.00 0.00 H new ATOM 0 HD1 HIS B 53 -14.614 5.236 5.787 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -16.188 4.109 2.077 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -15.628 7.331 4.775 1.00 0.00 H new ATOM 865 N LEU B 54 -12.786 0.338 3.752 1.00 0.00 N ATOM 866 CA LEU B 54 -12.408 -0.995 4.204 1.00 0.00 C ATOM 867 C LEU B 54 -10.899 -1.098 4.394 1.00 0.00 C ATOM 868 O LEU B 54 -10.423 -1.555 5.438 1.00 0.00 O ATOM 869 CB LEU B 54 -12.899 -2.053 3.214 1.00 0.00 C ATOM 870 CG LEU B 54 -14.420 -2.243 3.160 1.00 0.00 C ATOM 871 CD1 LEU B 54 -14.789 -3.192 2.036 1.00 0.00 C ATOM 872 CD2 LEU B 54 -14.956 -2.769 4.488 1.00 0.00 C ATOM 0 H LEU B 54 -13.123 0.378 2.790 1.00 0.00 H new ATOM 0 HA LEU B 54 -12.883 -1.175 5.169 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -12.547 -1.786 2.218 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -12.439 -3.008 3.469 1.00 0.00 H new ATOM 0 HG LEU B 54 -14.876 -1.271 2.971 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -15.871 -3.319 2.008 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -14.447 -2.781 1.086 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -14.315 -4.159 2.205 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -16.037 -2.894 4.420 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -14.493 -3.730 4.712 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -14.722 -2.059 5.282 1.00 0.00 H new ATOM 884 N VAL B 55 -10.149 -0.645 3.400 1.00 0.00 N ATOM 885 CA VAL B 55 -8.695 -0.679 3.474 1.00 0.00 C ATOM 886 C VAL B 55 -8.183 0.367 4.461 1.00 0.00 C ATOM 887 O VAL B 55 -7.079 0.251 4.994 1.00 0.00 O ATOM 888 CB VAL B 55 -8.049 -0.466 2.087 1.00 0.00 C ATOM 889 CG1 VAL B 55 -8.553 -1.512 1.109 1.00 0.00 C ATOM 890 CG2 VAL B 55 -8.320 0.930 1.550 1.00 0.00 C ATOM 0 H VAL B 55 -10.521 -0.251 2.536 1.00 0.00 H new ATOM 0 HA VAL B 55 -8.408 -1.669 3.828 1.00 0.00 H new ATOM 0 HB VAL B 55 -6.970 -0.572 2.203 1.00 0.00 H new ATOM 0 HG11 VAL B 55 -8.091 -1.352 0.135 1.00 0.00 H new ATOM 0 HG12 VAL B 55 -8.295 -2.506 1.474 1.00 0.00 H new ATOM 0 HG13 VAL B 55 -9.636 -1.430 1.015 1.00 0.00 H new ATOM 0 HG21 VAL B 55 -7.850 1.042 0.573 1.00 0.00 H new ATOM 0 HG22 VAL B 55 -9.395 1.081 1.454 1.00 0.00 H new ATOM 0 HG23 VAL B 55 -7.910 1.670 2.237 1.00 0.00 H new ATOM 900 N GLN B 56 -9.008 1.376 4.713 1.00 0.00 N ATOM 901 CA GLN B 56 -8.679 2.421 5.670 1.00 0.00 C ATOM 902 C GLN B 56 -8.892 1.945 7.102 1.00 0.00 C ATOM 903 O GLN B 56 -8.208 2.396 8.023 1.00 0.00 O ATOM 904 CB GLN B 56 -9.515 3.670 5.396 1.00 0.00 C ATOM 905 CG GLN B 56 -8.872 4.629 4.407 1.00 0.00 C ATOM 906 CD GLN B 56 -9.747 5.824 4.099 1.00 0.00 C ATOM 907 OE1 GLN B 56 -9.684 6.848 4.773 1.00 0.00 O ATOM 908 NE2 GLN B 56 -10.580 5.696 3.079 1.00 0.00 N ATOM 0 H GLN B 56 -9.916 1.491 4.263 1.00 0.00 H new ATOM 0 HA GLN B 56 -7.624 2.667 5.552 1.00 0.00 H new ATOM 0 HB2 GLN B 56 -10.490 3.368 5.014 1.00 0.00 H new ATOM 0 HB3 GLN B 56 -9.689 4.194 6.336 1.00 0.00 H new ATOM 0 HG2 GLN B 56 -7.920 4.975 4.809 1.00 0.00 H new ATOM 0 HG3 GLN B 56 -8.652 4.097 3.482 1.00 0.00 H new ATOM 0 HE21 GLN B 56 -10.601 4.828 2.544 1.00 0.00 H new ATOM 0 HE22 GLN B 56 -11.201 6.465 2.828 1.00 0.00 H new ATOM 917 N MET B 57 -9.826 1.021 7.288 1.00 0.00 N ATOM 918 CA MET B 57 -10.108 0.496 8.618 1.00 0.00 C ATOM 919 C MET B 57 -9.145 -0.625 8.986 1.00 0.00 C ATOM 920 O MET B 57 -9.243 -1.207 10.066 1.00 0.00 O ATOM 921 CB MET B 57 -11.558 0.019 8.731 1.00 0.00 C ATOM 922 CG MET B 57 -12.546 1.154 8.938 1.00 0.00 C ATOM 923 SD MET B 57 -14.237 0.583 9.209 1.00 0.00 S ATOM 924 CE MET B 57 -14.702 0.069 7.558 1.00 0.00 C ATOM 0 H MET B 57 -10.397 0.623 6.542 1.00 0.00 H new ATOM 0 HA MET B 57 -9.964 1.312 9.326 1.00 0.00 H new ATOM 0 HB2 MET B 57 -11.826 -0.527 7.826 1.00 0.00 H new ATOM 0 HB3 MET B 57 -11.640 -0.682 9.562 1.00 0.00 H new ATOM 0 HG2 MET B 57 -12.230 1.751 9.793 1.00 0.00 H new ATOM 0 HG3 MET B 57 -12.525 1.809 8.067 1.00 0.00 H new ATOM 0 HE1 MET B 57 -15.514 -0.656 7.618 1.00 0.00 H new ATOM 0 HE2 MET B 57 -15.031 0.936 6.986 1.00 0.00 H new ATOM 0 HE3 MET B 57 -13.844 -0.387 7.064 1.00 0.00 H new ATOM 934 N GLY B 58 -8.219 -0.927 8.082 1.00 0.00 N ATOM 935 CA GLY B 58 -7.188 -1.912 8.367 1.00 0.00 C ATOM 936 C GLY B 58 -7.709 -3.330 8.320 1.00 0.00 C ATOM 937 O GLY B 58 -6.988 -4.279 8.632 1.00 0.00 O ATOM 0 H GLY B 58 -8.163 -0.507 7.154 1.00 0.00 H new ATOM 0 HA2 GLY B 58 -6.377 -1.803 7.646 1.00 0.00 H new ATOM 0 HA3 GLY B 58 -6.767 -1.716 9.353 1.00 0.00 H new ATOM 941 N LEU B 59 -8.965 -3.477 7.928 1.00 0.00 N ATOM 942 CA LEU B 59 -9.572 -4.794 7.809 1.00 0.00 C ATOM 943 C LEU B 59 -9.314 -5.351 6.415 1.00 0.00 C ATOM 944 O LEU B 59 -9.515 -6.534 6.149 1.00 0.00 O ATOM 945 CB LEU B 59 -11.074 -4.726 8.129 1.00 0.00 C ATOM 946 CG LEU B 59 -11.876 -3.701 7.330 1.00 0.00 C ATOM 947 CD1 LEU B 59 -12.260 -4.254 5.972 1.00 0.00 C ATOM 948 CD2 LEU B 59 -13.108 -3.275 8.105 1.00 0.00 C ATOM 0 H LEU B 59 -9.583 -2.702 7.687 1.00 0.00 H new ATOM 0 HA LEU B 59 -9.119 -5.471 8.534 1.00 0.00 H new ATOM 0 HB2 LEU B 59 -11.508 -5.711 7.959 1.00 0.00 H new ATOM 0 HB3 LEU B 59 -11.191 -4.505 9.190 1.00 0.00 H new ATOM 0 HG LEU B 59 -11.248 -2.824 7.169 1.00 0.00 H new ATOM 0 HD11 LEU B 59 -12.830 -3.505 5.422 1.00 0.00 H new ATOM 0 HD12 LEU B 59 -11.358 -4.506 5.413 1.00 0.00 H new ATOM 0 HD13 LEU B 59 -12.868 -5.149 6.102 1.00 0.00 H new ATOM 0 HD21 LEU B 59 -13.669 -2.544 7.523 1.00 0.00 H new ATOM 0 HD22 LEU B 59 -13.736 -4.145 8.298 1.00 0.00 H new ATOM 0 HD23 LEU B 59 -12.806 -2.829 9.052 1.00 0.00 H new ATOM 960 N ALA B 60 -8.871 -4.470 5.533 1.00 0.00 N ATOM 961 CA ALA B 60 -8.448 -4.854 4.197 1.00 0.00 C ATOM 962 C ALA B 60 -7.070 -4.271 3.911 1.00 0.00 C ATOM 963 O ALA B 60 -6.668 -3.292 4.543 1.00 0.00 O ATOM 964 CB ALA B 60 -9.456 -4.390 3.158 1.00 0.00 C ATOM 0 H ALA B 60 -8.795 -3.471 5.723 1.00 0.00 H new ATOM 0 HA ALA B 60 -8.391 -5.941 4.142 1.00 0.00 H new ATOM 0 HB1 ALA B 60 -9.119 -4.688 2.165 1.00 0.00 H new ATOM 0 HB2 ALA B 60 -10.425 -4.844 3.364 1.00 0.00 H new ATOM 0 HB3 ALA B 60 -9.547 -3.305 3.199 1.00 0.00 H new ATOM 970 N ASP B 61 -6.350 -4.868 2.969 1.00 0.00 N ATOM 971 CA ASP B 61 -4.975 -4.457 2.685 1.00 0.00 C ATOM 972 C ASP B 61 -4.914 -3.187 1.846 1.00 0.00 C ATOM 973 O ASP B 61 -4.461 -2.142 2.314 1.00 0.00 O ATOM 974 CB ASP B 61 -4.211 -5.568 1.958 1.00 0.00 C ATOM 975 CG ASP B 61 -3.897 -6.748 2.851 1.00 0.00 C ATOM 976 OD1 ASP B 61 -4.595 -7.777 2.743 1.00 0.00 O ATOM 977 OD2 ASP B 61 -2.946 -6.654 3.654 1.00 0.00 O ATOM 0 H ASP B 61 -6.691 -5.635 2.390 1.00 0.00 H new ATOM 0 HA ASP B 61 -4.509 -4.257 3.650 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -4.800 -5.910 1.107 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -3.281 -5.162 1.560 1.00 0.00 H new ATOM 982 N SER B 62 -5.369 -3.275 0.605 1.00 0.00 N ATOM 983 CA SER B 62 -5.207 -2.178 -0.338 1.00 0.00 C ATOM 984 C SER B 62 -6.348 -2.141 -1.341 1.00 0.00 C ATOM 985 O SER B 62 -7.080 -3.118 -1.498 1.00 0.00 O ATOM 986 CB SER B 62 -3.881 -2.330 -1.083 1.00 0.00 C ATOM 987 OG SER B 62 -2.790 -2.423 -0.179 1.00 0.00 O ATOM 0 H SER B 62 -5.851 -4.091 0.228 1.00 0.00 H new ATOM 0 HA SER B 62 -5.213 -1.245 0.225 1.00 0.00 H new ATOM 0 HB2 SER B 62 -3.914 -3.221 -1.710 1.00 0.00 H new ATOM 0 HB3 SER B 62 -3.735 -1.478 -1.747 1.00 0.00 H new ATOM 0 HG SER B 62 -1.955 -2.521 -0.683 1.00 0.00 H new ATOM 993 N VAL B 63 -6.473 -1.014 -2.026 1.00 0.00 N ATOM 994 CA VAL B 63 -7.520 -0.814 -3.015 1.00 0.00 C ATOM 995 C VAL B 63 -7.327 -1.741 -4.210 1.00 0.00 C ATOM 996 O VAL B 63 -8.297 -2.200 -4.812 1.00 0.00 O ATOM 997 CB VAL B 63 -7.552 0.659 -3.481 1.00 0.00 C ATOM 998 CG1 VAL B 63 -8.427 0.842 -4.715 1.00 0.00 C ATOM 999 CG2 VAL B 63 -8.035 1.544 -2.343 1.00 0.00 C ATOM 0 H VAL B 63 -5.852 -0.213 -1.912 1.00 0.00 H new ATOM 0 HA VAL B 63 -8.475 -1.054 -2.547 1.00 0.00 H new ATOM 0 HB VAL B 63 -6.540 0.951 -3.760 1.00 0.00 H new ATOM 0 HG11 VAL B 63 -8.423 1.891 -5.011 1.00 0.00 H new ATOM 0 HG12 VAL B 63 -8.037 0.233 -5.531 1.00 0.00 H new ATOM 0 HG13 VAL B 63 -9.447 0.533 -4.487 1.00 0.00 H new ATOM 0 HG21 VAL B 63 -8.057 2.582 -2.674 1.00 0.00 H new ATOM 0 HG22 VAL B 63 -9.037 1.237 -2.044 1.00 0.00 H new ATOM 0 HG23 VAL B 63 -7.358 1.448 -1.494 1.00 0.00 H new ATOM 1009 N LYS B 64 -6.065 -2.036 -4.515 1.00 0.00 N ATOM 1010 CA LYS B 64 -5.704 -2.886 -5.650 1.00 0.00 C ATOM 1011 C LYS B 64 -6.380 -4.253 -5.592 1.00 0.00 C ATOM 1012 O LYS B 64 -6.665 -4.858 -6.626 1.00 0.00 O ATOM 1013 CB LYS B 64 -4.193 -3.084 -5.694 1.00 0.00 C ATOM 1014 CG LYS B 64 -3.422 -1.862 -6.160 1.00 0.00 C ATOM 1015 CD LYS B 64 -1.915 -2.101 -6.139 1.00 0.00 C ATOM 1016 CE LYS B 64 -1.435 -3.018 -7.266 1.00 0.00 C ATOM 1017 NZ LYS B 64 -1.874 -4.433 -7.100 1.00 0.00 N ATOM 0 H LYS B 64 -5.264 -1.694 -3.984 1.00 0.00 H new ATOM 0 HA LYS B 64 -6.049 -2.376 -6.549 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -3.845 -3.363 -4.700 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -3.966 -3.919 -6.357 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -3.734 -1.599 -7.171 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -3.664 -1.013 -5.520 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -1.401 -1.143 -6.215 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -1.636 -2.538 -5.180 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -1.807 -2.638 -8.218 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -0.347 -2.985 -7.313 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -1.112 -5.071 -7.406 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 -2.096 -4.613 -6.100 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -2.721 -4.604 -7.678 1.00 0.00 H new ATOM 1031 N ASP B 65 -6.639 -4.725 -4.382 1.00 0.00 N ATOM 1032 CA ASP B 65 -7.207 -6.054 -4.183 1.00 0.00 C ATOM 1033 C ASP B 65 -8.684 -6.068 -4.569 1.00 0.00 C ATOM 1034 O ASP B 65 -9.264 -7.123 -4.828 1.00 0.00 O ATOM 1035 CB ASP B 65 -7.022 -6.486 -2.722 1.00 0.00 C ATOM 1036 CG ASP B 65 -7.354 -7.948 -2.489 1.00 0.00 C ATOM 1037 OD1 ASP B 65 -6.535 -8.818 -2.869 1.00 0.00 O ATOM 1038 OD2 ASP B 65 -8.417 -8.235 -1.903 1.00 0.00 O ATOM 0 H ASP B 65 -6.465 -4.208 -3.520 1.00 0.00 H new ATOM 0 HA ASP B 65 -6.684 -6.762 -4.826 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -5.990 -6.301 -2.422 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -7.655 -5.869 -2.084 1.00 0.00 H new ATOM 1043 N PHE B 66 -9.277 -4.883 -4.633 1.00 0.00 N ATOM 1044 CA PHE B 66 -10.686 -4.745 -4.978 1.00 0.00 C ATOM 1045 C PHE B 66 -10.830 -4.241 -6.411 1.00 0.00 C ATOM 1046 O PHE B 66 -11.581 -4.799 -7.211 1.00 0.00 O ATOM 1047 CB PHE B 66 -11.372 -3.724 -4.064 1.00 0.00 C ATOM 1048 CG PHE B 66 -11.288 -3.975 -2.582 1.00 0.00 C ATOM 1049 CD1 PHE B 66 -12.440 -4.002 -1.817 1.00 0.00 C ATOM 1050 CD2 PHE B 66 -10.067 -4.138 -1.951 1.00 0.00 C ATOM 1051 CE1 PHE B 66 -12.377 -4.182 -0.450 1.00 0.00 C ATOM 1052 CE2 PHE B 66 -9.997 -4.327 -0.586 1.00 0.00 C ATOM 1053 CZ PHE B 66 -11.154 -4.346 0.164 1.00 0.00 C ATOM 0 H PHE B 66 -8.801 -4.000 -4.450 1.00 0.00 H new ATOM 0 HA PHE B 66 -11.148 -5.726 -4.863 1.00 0.00 H new ATOM 0 HB2 PHE B 66 -10.942 -2.743 -4.267 1.00 0.00 H new ATOM 0 HB3 PHE B 66 -12.425 -3.674 -4.341 1.00 0.00 H new ATOM 0 HD1 PHE B 66 -13.401 -3.881 -2.295 1.00 0.00 H new ATOM 0 HD2 PHE B 66 -9.158 -4.117 -2.534 1.00 0.00 H new ATOM 0 HE1 PHE B 66 -13.284 -4.194 0.137 1.00 0.00 H new ATOM 0 HE2 PHE B 66 -9.039 -4.460 -0.106 1.00 0.00 H new ATOM 0 HZ PHE B 66 -11.102 -4.489 1.233 1.00 0.00 H new ATOM 1184 N VAL B 74 3.897 3.685 -2.584 1.00 0.00 N ATOM 1185 CA VAL B 74 4.441 4.284 -1.385 1.00 0.00 C ATOM 1186 C VAL B 74 4.562 5.791 -1.582 1.00 0.00 C ATOM 1187 O VAL B 74 4.851 6.243 -2.683 1.00 0.00 O ATOM 1188 CB VAL B 74 5.837 3.655 -1.090 1.00 0.00 C ATOM 1189 CG1 VAL B 74 6.421 3.031 -2.361 1.00 0.00 C ATOM 1190 CG2 VAL B 74 6.813 4.680 -0.528 1.00 0.00 C ATOM 0 HA VAL B 74 3.782 4.096 -0.538 1.00 0.00 H new ATOM 0 HB VAL B 74 5.690 2.880 -0.337 1.00 0.00 H new ATOM 0 HG11 VAL B 74 7.395 2.596 -2.138 1.00 0.00 H new ATOM 0 HG12 VAL B 74 5.751 2.252 -2.725 1.00 0.00 H new ATOM 0 HG13 VAL B 74 6.533 3.800 -3.126 1.00 0.00 H new ATOM 0 HG21 VAL B 74 7.773 4.201 -0.336 1.00 0.00 H new ATOM 0 HG22 VAL B 74 6.947 5.487 -1.248 1.00 0.00 H new ATOM 0 HG23 VAL B 74 6.418 5.086 0.403 1.00 0.00 H new ATOM 1200 N LEU B 75 4.316 6.560 -0.526 1.00 0.00 N ATOM 1201 CA LEU B 75 4.374 8.017 -0.608 1.00 0.00 C ATOM 1202 C LEU B 75 5.707 8.492 -1.194 1.00 0.00 C ATOM 1203 O LEU B 75 6.747 8.470 -0.528 1.00 0.00 O ATOM 1204 CB LEU B 75 4.128 8.663 0.767 1.00 0.00 C ATOM 1205 CG LEU B 75 5.044 8.194 1.906 1.00 0.00 C ATOM 1206 CD1 LEU B 75 5.554 9.388 2.696 1.00 0.00 C ATOM 1207 CD2 LEU B 75 4.306 7.234 2.831 1.00 0.00 C ATOM 0 H LEU B 75 4.074 6.199 0.397 1.00 0.00 H new ATOM 0 HA LEU B 75 3.578 8.335 -1.281 1.00 0.00 H new ATOM 0 HB2 LEU B 75 4.235 9.743 0.663 1.00 0.00 H new ATOM 0 HB3 LEU B 75 3.095 8.471 1.056 1.00 0.00 H new ATOM 0 HG LEU B 75 5.893 7.669 1.468 1.00 0.00 H new ATOM 0 HD11 LEU B 75 6.202 9.042 3.501 1.00 0.00 H new ATOM 0 HD12 LEU B 75 6.116 10.048 2.035 1.00 0.00 H new ATOM 0 HD13 LEU B 75 4.709 9.932 3.119 1.00 0.00 H new ATOM 0 HD21 LEU B 75 4.974 6.914 3.631 1.00 0.00 H new ATOM 0 HD22 LEU B 75 3.440 7.737 3.261 1.00 0.00 H new ATOM 0 HD23 LEU B 75 3.976 6.364 2.264 1.00 0.00 H new ATOM 1219 N TRP B 76 5.670 8.877 -2.462 1.00 0.00 N ATOM 1220 CA TRP B 76 6.842 9.398 -3.147 1.00 0.00 C ATOM 1221 C TRP B 76 6.915 10.907 -2.991 1.00 0.00 C ATOM 1222 O TRP B 76 6.053 11.646 -3.475 1.00 0.00 O ATOM 1223 CB TRP B 76 6.835 9.008 -4.631 1.00 0.00 C ATOM 1224 CG TRP B 76 7.431 7.657 -4.900 1.00 0.00 C ATOM 1225 CD1 TRP B 76 6.824 6.450 -4.732 1.00 0.00 C ATOM 1226 CD2 TRP B 76 8.752 7.372 -5.381 1.00 0.00 C ATOM 1227 NE1 TRP B 76 7.676 5.433 -5.083 1.00 0.00 N ATOM 1228 CE2 TRP B 76 8.864 5.973 -5.483 1.00 0.00 C ATOM 1229 CE3 TRP B 76 9.849 8.158 -5.737 1.00 0.00 C ATOM 1230 CZ2 TRP B 76 10.021 5.346 -5.927 1.00 0.00 C ATOM 1231 CZ3 TRP B 76 11.001 7.531 -6.178 1.00 0.00 C ATOM 1232 CH2 TRP B 76 11.079 6.138 -6.268 1.00 0.00 C ATOM 0 H TRP B 76 4.831 8.837 -3.041 1.00 0.00 H new ATOM 0 HA TRP B 76 7.727 8.956 -2.690 1.00 0.00 H new ATOM 0 HB2 TRP B 76 5.808 9.022 -4.997 1.00 0.00 H new ATOM 0 HB3 TRP B 76 7.386 9.758 -5.198 1.00 0.00 H new ATOM 0 HD1 TRP B 76 5.815 6.312 -4.373 1.00 0.00 H new ATOM 0 HE1 TRP B 76 7.457 4.437 -5.050 1.00 0.00 H new ATOM 0 HE3 TRP B 76 9.800 9.235 -5.670 1.00 0.00 H new ATOM 0 HZ2 TRP B 76 10.081 4.270 -6.000 1.00 0.00 H new ATOM 0 HZ3 TRP B 76 11.856 8.129 -6.458 1.00 0.00 H new ATOM 0 HH2 TRP B 76 11.994 5.680 -6.614 1.00 0.00 H new ATOM 1243 N THR B 77 7.928 11.350 -2.269 1.00 0.00 N ATOM 1244 CA THR B 77 8.168 12.763 -2.051 1.00 0.00 C ATOM 1245 C THR B 77 9.580 13.114 -2.494 1.00 0.00 C ATOM 1246 O THR B 77 10.344 12.222 -2.861 1.00 0.00 O ATOM 1247 CB THR B 77 7.986 13.124 -0.568 1.00 0.00 C ATOM 1248 OG1 THR B 77 8.742 12.216 0.247 1.00 0.00 O ATOM 1249 CG2 THR B 77 6.519 13.063 -0.168 1.00 0.00 C ATOM 0 H THR B 77 8.608 10.739 -1.817 1.00 0.00 H new ATOM 0 HA THR B 77 7.447 13.333 -2.637 1.00 0.00 H new ATOM 0 HB THR B 77 8.344 14.143 -0.417 1.00 0.00 H new ATOM 0 HG1 THR B 77 8.625 12.450 1.192 1.00 0.00 H new ATOM 0 HG21 THR B 77 6.418 13.323 0.886 1.00 0.00 H new ATOM 0 HG22 THR B 77 5.948 13.768 -0.772 1.00 0.00 H new ATOM 0 HG23 THR B 77 6.139 12.054 -0.331 1.00 0.00 H new ATOM 1257 N GLY B 78 9.926 14.396 -2.453 1.00 0.00 N ATOM 1258 CA GLY B 78 11.254 14.824 -2.859 1.00 0.00 C ATOM 1259 C GLY B 78 12.352 14.080 -2.125 1.00 0.00 C ATOM 1260 O GLY B 78 13.290 13.582 -2.743 1.00 0.00 O ATOM 0 H GLY B 78 9.310 15.149 -2.145 1.00 0.00 H new ATOM 0 HA2 GLY B 78 11.370 14.671 -3.932 1.00 0.00 H new ATOM 0 HA3 GLY B 78 11.359 15.893 -2.677 1.00 0.00 H new ATOM 1264 N ASP B 79 12.216 13.987 -0.806 1.00 0.00 N ATOM 1265 CA ASP B 79 13.172 13.259 0.022 1.00 0.00 C ATOM 1266 C ASP B 79 13.242 11.795 -0.398 1.00 0.00 C ATOM 1267 O ASP B 79 14.304 11.293 -0.753 1.00 0.00 O ATOM 1268 CB ASP B 79 12.775 13.340 1.499 1.00 0.00 C ATOM 1269 CG ASP B 79 12.681 14.760 2.018 1.00 0.00 C ATOM 1270 OD1 ASP B 79 13.692 15.285 2.531 1.00 0.00 O ATOM 1271 OD2 ASP B 79 11.587 15.358 1.934 1.00 0.00 O ATOM 0 H ASP B 79 11.448 14.410 -0.285 1.00 0.00 H new ATOM 0 HA ASP B 79 14.151 13.719 -0.115 1.00 0.00 H new ATOM 0 HB2 ASP B 79 11.813 12.846 1.637 1.00 0.00 H new ATOM 0 HB3 ASP B 79 13.504 12.791 2.095 1.00 0.00 H new ATOM 1276 N GLN B 80 12.091 11.128 -0.380 1.00 0.00 N ATOM 1277 CA GLN B 80 12.010 9.695 -0.667 1.00 0.00 C ATOM 1278 C GLN B 80 12.553 9.383 -2.065 1.00 0.00 C ATOM 1279 O GLN B 80 13.271 8.397 -2.260 1.00 0.00 O ATOM 1280 CB GLN B 80 10.553 9.227 -0.528 1.00 0.00 C ATOM 1281 CG GLN B 80 10.374 7.715 -0.487 1.00 0.00 C ATOM 1282 CD GLN B 80 9.970 7.126 -1.825 1.00 0.00 C ATOM 1283 OE1 GLN B 80 10.813 6.755 -2.634 1.00 0.00 O ATOM 1284 NE2 GLN B 80 8.674 7.014 -2.055 1.00 0.00 N ATOM 0 H GLN B 80 11.192 11.561 -0.168 1.00 0.00 H new ATOM 0 HA GLN B 80 12.627 9.155 0.051 1.00 0.00 H new ATOM 0 HB2 GLN B 80 10.133 9.654 0.383 1.00 0.00 H new ATOM 0 HB3 GLN B 80 9.976 9.626 -1.362 1.00 0.00 H new ATOM 0 HG2 GLN B 80 11.306 7.254 -0.161 1.00 0.00 H new ATOM 0 HG3 GLN B 80 9.617 7.465 0.256 1.00 0.00 H new ATOM 0 HE21 GLN B 80 8.003 7.334 -1.357 1.00 0.00 H new ATOM 0 HE22 GLN B 80 8.345 6.607 -2.930 1.00 0.00 H new ATOM 1293 N GLU B 81 12.225 10.244 -3.021 1.00 0.00 N ATOM 1294 CA GLU B 81 12.671 10.088 -4.399 1.00 0.00 C ATOM 1295 C GLU B 81 14.188 10.225 -4.485 1.00 0.00 C ATOM 1296 O GLU B 81 14.869 9.387 -5.078 1.00 0.00 O ATOM 1297 CB GLU B 81 11.988 11.139 -5.281 1.00 0.00 C ATOM 1298 CG GLU B 81 12.211 10.947 -6.774 1.00 0.00 C ATOM 1299 CD GLU B 81 11.369 11.889 -7.613 1.00 0.00 C ATOM 1300 OE1 GLU B 81 10.134 11.926 -7.414 1.00 0.00 O ATOM 1301 OE2 GLU B 81 11.929 12.585 -8.482 1.00 0.00 O ATOM 0 H GLU B 81 11.644 11.067 -2.863 1.00 0.00 H new ATOM 0 HA GLU B 81 12.398 9.094 -4.753 1.00 0.00 H new ATOM 0 HB2 GLU B 81 10.917 11.123 -5.081 1.00 0.00 H new ATOM 0 HB3 GLU B 81 12.351 12.126 -4.996 1.00 0.00 H new ATOM 0 HG2 GLU B 81 13.265 11.104 -7.004 1.00 0.00 H new ATOM 0 HG3 GLU B 81 11.976 9.917 -7.044 1.00 0.00 H new ATOM 1308 N LEU B 82 14.707 11.276 -3.867 1.00 0.00 N ATOM 1309 CA LEU B 82 16.136 11.557 -3.868 1.00 0.00 C ATOM 1310 C LEU B 82 16.913 10.450 -3.149 1.00 0.00 C ATOM 1311 O LEU B 82 17.962 10.011 -3.627 1.00 0.00 O ATOM 1312 CB LEU B 82 16.364 12.945 -3.234 1.00 0.00 C ATOM 1313 CG LEU B 82 17.815 13.423 -3.039 1.00 0.00 C ATOM 1314 CD1 LEU B 82 18.442 12.802 -1.800 1.00 0.00 C ATOM 1315 CD2 LEU B 82 18.653 13.131 -4.274 1.00 0.00 C ATOM 0 H LEU B 82 14.150 11.958 -3.351 1.00 0.00 H new ATOM 0 HA LEU B 82 16.514 11.576 -4.890 1.00 0.00 H new ATOM 0 HB2 LEU B 82 15.850 13.682 -3.851 1.00 0.00 H new ATOM 0 HB3 LEU B 82 15.877 12.950 -2.259 1.00 0.00 H new ATOM 0 HG LEU B 82 17.790 14.503 -2.892 1.00 0.00 H new ATOM 0 HD11 LEU B 82 19.466 13.160 -1.692 1.00 0.00 H new ATOM 0 HD12 LEU B 82 17.864 13.084 -0.920 1.00 0.00 H new ATOM 0 HD13 LEU B 82 18.446 11.717 -1.899 1.00 0.00 H new ATOM 0 HD21 LEU B 82 19.673 13.478 -4.112 1.00 0.00 H new ATOM 0 HD22 LEU B 82 18.660 12.058 -4.463 1.00 0.00 H new ATOM 0 HD23 LEU B 82 18.227 13.648 -5.134 1.00 0.00 H new ATOM 1327 N GLU B 83 16.393 9.987 -2.016 1.00 0.00 N ATOM 1328 CA GLU B 83 17.059 8.941 -1.244 1.00 0.00 C ATOM 1329 C GLU B 83 17.191 7.654 -2.056 1.00 0.00 C ATOM 1330 O GLU B 83 18.251 7.030 -2.076 1.00 0.00 O ATOM 1331 CB GLU B 83 16.316 8.662 0.062 1.00 0.00 C ATOM 1332 CG GLU B 83 16.312 9.835 1.030 1.00 0.00 C ATOM 1333 CD GLU B 83 15.826 9.448 2.413 1.00 0.00 C ATOM 1334 OE1 GLU B 83 16.386 9.958 3.408 1.00 0.00 O ATOM 1335 OE2 GLU B 83 14.906 8.614 2.519 1.00 0.00 O ATOM 0 H GLU B 83 15.516 10.317 -1.613 1.00 0.00 H new ATOM 0 HA GLU B 83 18.059 9.302 -1.004 1.00 0.00 H new ATOM 0 HB2 GLU B 83 15.286 8.390 -0.168 1.00 0.00 H new ATOM 0 HB3 GLU B 83 16.772 7.801 0.551 1.00 0.00 H new ATOM 0 HG2 GLU B 83 17.320 10.243 1.104 1.00 0.00 H new ATOM 0 HG3 GLU B 83 15.676 10.626 0.634 1.00 0.00 H new ATOM 1342 N LEU B 84 16.119 7.265 -2.739 1.00 0.00 N ATOM 1343 CA LEU B 84 16.144 6.049 -3.546 1.00 0.00 C ATOM 1344 C LEU B 84 16.987 6.257 -4.804 1.00 0.00 C ATOM 1345 O LEU B 84 17.699 5.350 -5.238 1.00 0.00 O ATOM 1346 CB LEU B 84 14.715 5.610 -3.902 1.00 0.00 C ATOM 1347 CG LEU B 84 14.596 4.350 -4.773 1.00 0.00 C ATOM 1348 CD1 LEU B 84 15.478 3.235 -4.238 1.00 0.00 C ATOM 1349 CD2 LEU B 84 13.151 3.878 -4.823 1.00 0.00 C ATOM 0 H LEU B 84 15.231 7.767 -2.751 1.00 0.00 H new ATOM 0 HA LEU B 84 16.605 5.253 -2.961 1.00 0.00 H new ATOM 0 HB2 LEU B 84 14.167 5.440 -2.975 1.00 0.00 H new ATOM 0 HB3 LEU B 84 14.221 6.433 -4.419 1.00 0.00 H new ATOM 0 HG LEU B 84 14.928 4.605 -5.780 1.00 0.00 H new ATOM 0 HD11 LEU B 84 15.376 2.354 -4.872 1.00 0.00 H new ATOM 0 HD12 LEU B 84 16.518 3.562 -4.237 1.00 0.00 H new ATOM 0 HD13 LEU B 84 15.174 2.987 -3.221 1.00 0.00 H new ATOM 0 HD21 LEU B 84 13.081 2.985 -5.444 1.00 0.00 H new ATOM 0 HD22 LEU B 84 12.809 3.647 -3.814 1.00 0.00 H new ATOM 0 HD23 LEU B 84 12.526 4.664 -5.247 1.00 0.00 H new ATOM 1361 N GLN B 85 16.914 7.462 -5.358 1.00 0.00 N ATOM 1362 CA GLN B 85 17.687 7.829 -6.543 1.00 0.00 C ATOM 1363 C GLN B 85 19.174 7.581 -6.301 1.00 0.00 C ATOM 1364 O GLN B 85 19.800 6.757 -6.971 1.00 0.00 O ATOM 1365 CB GLN B 85 17.453 9.314 -6.859 1.00 0.00 C ATOM 1366 CG GLN B 85 17.744 9.735 -8.297 1.00 0.00 C ATOM 1367 CD GLN B 85 19.183 9.524 -8.723 1.00 0.00 C ATOM 1368 OE1 GLN B 85 19.520 8.503 -9.314 1.00 0.00 O ATOM 1369 NE2 GLN B 85 20.043 10.478 -8.410 1.00 0.00 N ATOM 0 H GLN B 85 16.320 8.211 -5.001 1.00 0.00 H new ATOM 0 HA GLN B 85 17.364 7.218 -7.386 1.00 0.00 H new ATOM 0 HB2 GLN B 85 16.415 9.557 -6.631 1.00 0.00 H new ATOM 0 HB3 GLN B 85 18.074 9.911 -6.191 1.00 0.00 H new ATOM 0 HG2 GLN B 85 17.092 9.175 -8.967 1.00 0.00 H new ATOM 0 HG3 GLN B 85 17.492 10.789 -8.414 1.00 0.00 H new ATOM 0 HE21 GLN B 85 19.723 11.312 -7.918 1.00 0.00 H new ATOM 0 HE22 GLN B 85 21.027 10.380 -8.661 1.00 0.00 H new ATOM 1378 N ARG B 86 19.719 8.281 -5.313 1.00 0.00 N ATOM 1379 CA ARG B 86 21.148 8.226 -5.034 1.00 0.00 C ATOM 1380 C ARG B 86 21.596 6.815 -4.683 1.00 0.00 C ATOM 1381 O ARG B 86 22.640 6.360 -5.149 1.00 0.00 O ATOM 1382 CB ARG B 86 21.510 9.173 -3.896 1.00 0.00 C ATOM 1383 CG ARG B 86 21.211 10.627 -4.195 1.00 0.00 C ATOM 1384 CD ARG B 86 22.017 11.547 -3.295 1.00 0.00 C ATOM 1385 NE ARG B 86 23.454 11.433 -3.555 1.00 0.00 N ATOM 1386 CZ ARG B 86 24.404 11.717 -2.659 1.00 0.00 C ATOM 1387 NH1 ARG B 86 24.076 12.089 -1.428 1.00 0.00 N ATOM 1388 NH2 ARG B 86 25.686 11.618 -2.992 1.00 0.00 N ATOM 0 H ARG B 86 19.192 8.894 -4.691 1.00 0.00 H new ATOM 0 HA ARG B 86 21.666 8.536 -5.941 1.00 0.00 H new ATOM 0 HB2 ARG B 86 20.964 8.876 -3.000 1.00 0.00 H new ATOM 0 HB3 ARG B 86 22.572 9.068 -3.672 1.00 0.00 H new ATOM 0 HG2 ARG B 86 21.441 10.842 -5.239 1.00 0.00 H new ATOM 0 HG3 ARG B 86 20.147 10.819 -4.057 1.00 0.00 H new ATOM 0 HD2 ARG B 86 21.699 12.578 -3.450 1.00 0.00 H new ATOM 0 HD3 ARG B 86 21.815 11.305 -2.252 1.00 0.00 H new ATOM 0 HE ARG B 86 23.748 11.117 -4.479 1.00 0.00 H new ATOM 0 HH11 ARG B 86 23.094 12.159 -1.161 1.00 0.00 H new ATOM 0 HH12 ARG B 86 24.806 12.304 -0.749 1.00 0.00 H new ATOM 0 HH21 ARG B 86 25.947 11.325 -3.933 1.00 0.00 H new ATOM 0 HH22 ARG B 86 26.409 11.835 -2.306 1.00 0.00 H new ATOM 1402 N LEU B 87 20.804 6.131 -3.868 1.00 0.00 N ATOM 1403 CA LEU B 87 21.132 4.774 -3.443 1.00 0.00 C ATOM 1404 C LEU B 87 21.232 3.822 -4.626 1.00 0.00 C ATOM 1405 O LEU B 87 22.178 3.037 -4.721 1.00 0.00 O ATOM 1406 CB LEU B 87 20.096 4.254 -2.458 1.00 0.00 C ATOM 1407 CG LEU B 87 20.522 4.272 -0.994 1.00 0.00 C ATOM 1408 CD1 LEU B 87 20.673 5.693 -0.472 1.00 0.00 C ATOM 1409 CD2 LEU B 87 19.527 3.498 -0.164 1.00 0.00 C ATOM 0 H LEU B 87 19.929 6.492 -3.487 1.00 0.00 H new ATOM 0 HA LEU B 87 22.106 4.818 -2.955 1.00 0.00 H new ATOM 0 HB2 LEU B 87 19.189 4.849 -2.563 1.00 0.00 H new ATOM 0 HB3 LEU B 87 19.840 3.231 -2.732 1.00 0.00 H new ATOM 0 HG LEU B 87 21.499 3.795 -0.916 1.00 0.00 H new ATOM 0 HD11 LEU B 87 20.977 5.666 0.574 1.00 0.00 H new ATOM 0 HD12 LEU B 87 21.429 6.217 -1.057 1.00 0.00 H new ATOM 0 HD13 LEU B 87 19.721 6.216 -0.559 1.00 0.00 H new ATOM 0 HD21 LEU B 87 19.835 3.513 0.881 1.00 0.00 H new ATOM 0 HD22 LEU B 87 18.542 3.954 -0.259 1.00 0.00 H new ATOM 0 HD23 LEU B 87 19.485 2.467 -0.515 1.00 0.00 H new ATOM 1421 N PHE B 88 20.258 3.897 -5.525 1.00 0.00 N ATOM 1422 CA PHE B 88 20.243 3.064 -6.721 1.00 0.00 C ATOM 1423 C PHE B 88 21.526 3.251 -7.528 1.00 0.00 C ATOM 1424 O PHE B 88 22.048 2.297 -8.095 1.00 0.00 O ATOM 1425 CB PHE B 88 18.986 3.380 -7.554 1.00 0.00 C ATOM 1426 CG PHE B 88 19.098 3.086 -9.027 1.00 0.00 C ATOM 1427 CD1 PHE B 88 19.543 1.856 -9.487 1.00 0.00 C ATOM 1428 CD2 PHE B 88 18.757 4.057 -9.954 1.00 0.00 C ATOM 1429 CE1 PHE B 88 19.653 1.607 -10.839 1.00 0.00 C ATOM 1430 CE2 PHE B 88 18.860 3.810 -11.306 1.00 0.00 C ATOM 1431 CZ PHE B 88 19.308 2.584 -11.750 1.00 0.00 C ATOM 0 H PHE B 88 19.463 4.531 -5.447 1.00 0.00 H new ATOM 0 HA PHE B 88 20.203 2.014 -6.431 1.00 0.00 H new ATOM 0 HB2 PHE B 88 18.150 2.810 -7.149 1.00 0.00 H new ATOM 0 HB3 PHE B 88 18.743 4.435 -7.429 1.00 0.00 H new ATOM 0 HD1 PHE B 88 19.806 1.084 -8.779 1.00 0.00 H new ATOM 0 HD2 PHE B 88 18.406 5.020 -9.613 1.00 0.00 H new ATOM 0 HE1 PHE B 88 20.009 0.648 -11.184 1.00 0.00 H new ATOM 0 HE2 PHE B 88 18.590 4.576 -12.017 1.00 0.00 H new ATOM 0 HZ PHE B 88 19.389 2.389 -12.809 1.00 0.00 H new ATOM 1441 N GLU B 89 22.052 4.462 -7.553 1.00 0.00 N ATOM 1442 CA GLU B 89 23.280 4.727 -8.283 1.00 0.00 C ATOM 1443 C GLU B 89 24.514 4.232 -7.535 1.00 0.00 C ATOM 1444 O GLU B 89 25.417 3.651 -8.138 1.00 0.00 O ATOM 1445 CB GLU B 89 23.434 6.215 -8.567 1.00 0.00 C ATOM 1446 CG GLU B 89 22.396 6.769 -9.510 1.00 0.00 C ATOM 1447 CD GLU B 89 22.702 8.198 -9.904 1.00 0.00 C ATOM 1448 OE1 GLU B 89 22.726 9.079 -9.014 1.00 0.00 O ATOM 1449 OE2 GLU B 89 22.948 8.447 -11.102 1.00 0.00 O ATOM 0 H GLU B 89 21.652 5.273 -7.080 1.00 0.00 H new ATOM 0 HA GLU B 89 23.204 4.179 -9.222 1.00 0.00 H new ATOM 0 HB2 GLU B 89 23.383 6.762 -7.625 1.00 0.00 H new ATOM 0 HB3 GLU B 89 24.424 6.394 -8.987 1.00 0.00 H new ATOM 0 HG2 GLU B 89 22.348 6.147 -10.404 1.00 0.00 H new ATOM 0 HG3 GLU B 89 21.415 6.724 -9.038 1.00 0.00 H new ATOM 1456 N GLU B 90 24.557 4.447 -6.226 1.00 0.00 N ATOM 1457 CA GLU B 90 25.794 4.246 -5.490 1.00 0.00 C ATOM 1458 C GLU B 90 25.939 2.820 -4.965 1.00 0.00 C ATOM 1459 O GLU B 90 27.051 2.348 -4.756 1.00 0.00 O ATOM 1460 CB GLU B 90 25.904 5.265 -4.365 1.00 0.00 C ATOM 1461 CG GLU B 90 24.827 5.147 -3.309 1.00 0.00 C ATOM 1462 CD GLU B 90 25.049 6.108 -2.167 1.00 0.00 C ATOM 1463 OE1 GLU B 90 25.311 5.648 -1.040 1.00 0.00 O ATOM 1464 OE2 GLU B 90 25.005 7.334 -2.399 1.00 0.00 O ATOM 0 H GLU B 90 23.764 4.755 -5.663 1.00 0.00 H new ATOM 0 HA GLU B 90 26.619 4.398 -6.186 1.00 0.00 H new ATOM 0 HB2 GLU B 90 26.878 5.157 -3.887 1.00 0.00 H new ATOM 0 HB3 GLU B 90 25.868 6.267 -4.793 1.00 0.00 H new ATOM 0 HG2 GLU B 90 23.854 5.339 -3.761 1.00 0.00 H new ATOM 0 HG3 GLU B 90 24.805 4.127 -2.926 1.00 0.00 H new ATOM 1471 N PHE B 91 24.826 2.132 -4.761 1.00 0.00 N ATOM 1472 CA PHE B 91 24.865 0.733 -4.349 1.00 0.00 C ATOM 1473 C PHE B 91 24.744 -0.172 -5.570 1.00 0.00 C ATOM 1474 O PHE B 91 24.548 -1.382 -5.459 1.00 0.00 O ATOM 1475 CB PHE B 91 23.738 0.434 -3.355 1.00 0.00 C ATOM 1476 CG PHE B 91 23.963 1.028 -1.989 1.00 0.00 C ATOM 1477 CD1 PHE B 91 24.611 0.301 -1.004 1.00 0.00 C ATOM 1478 CD2 PHE B 91 23.528 2.308 -1.689 1.00 0.00 C ATOM 1479 CE1 PHE B 91 24.822 0.837 0.253 1.00 0.00 C ATOM 1480 CE2 PHE B 91 23.737 2.851 -0.433 1.00 0.00 C ATOM 1481 CZ PHE B 91 24.384 2.115 0.537 1.00 0.00 C ATOM 0 H PHE B 91 23.887 2.515 -4.873 1.00 0.00 H new ATOM 0 HA PHE B 91 25.818 0.540 -3.857 1.00 0.00 H new ATOM 0 HB2 PHE B 91 22.800 0.816 -3.757 1.00 0.00 H new ATOM 0 HB3 PHE B 91 23.628 -0.646 -3.258 1.00 0.00 H new ATOM 0 HD1 PHE B 91 24.956 -0.699 -1.221 1.00 0.00 H new ATOM 0 HD2 PHE B 91 23.020 2.889 -2.444 1.00 0.00 H new ATOM 0 HE1 PHE B 91 25.328 0.257 1.011 1.00 0.00 H new ATOM 0 HE2 PHE B 91 23.393 3.851 -0.213 1.00 0.00 H new ATOM 0 HZ PHE B 91 24.548 2.538 1.517 1.00 0.00 H new ATOM 1491 N ARG B 92 24.895 0.432 -6.737 1.00 0.00 N ATOM 1492 CA ARG B 92 24.677 -0.256 -8.000 1.00 0.00 C ATOM 1493 C ARG B 92 25.892 -1.090 -8.404 1.00 0.00 C ATOM 1494 O ARG B 92 25.818 -1.906 -9.322 1.00 0.00 O ATOM 1495 CB ARG B 92 24.346 0.764 -9.087 1.00 0.00 C ATOM 1496 CG ARG B 92 23.661 0.174 -10.304 1.00 0.00 C ATOM 1497 CD ARG B 92 23.272 1.261 -11.290 1.00 0.00 C ATOM 1498 NE ARG B 92 22.975 0.722 -12.615 1.00 0.00 N ATOM 1499 CZ ARG B 92 22.634 1.470 -13.662 1.00 0.00 C ATOM 1500 NH1 ARG B 92 22.478 2.784 -13.528 1.00 0.00 N ATOM 1501 NH2 ARG B 92 22.455 0.903 -14.847 1.00 0.00 N ATOM 0 H ARG B 92 25.171 1.409 -6.836 1.00 0.00 H new ATOM 0 HA ARG B 92 23.839 -0.941 -7.876 1.00 0.00 H new ATOM 0 HB2 ARG B 92 23.705 1.536 -8.662 1.00 0.00 H new ATOM 0 HB3 ARG B 92 25.267 1.253 -9.404 1.00 0.00 H new ATOM 0 HG2 ARG B 92 24.326 -0.541 -10.789 1.00 0.00 H new ATOM 0 HG3 ARG B 92 22.772 -0.376 -9.995 1.00 0.00 H new ATOM 0 HD2 ARG B 92 22.400 1.796 -10.913 1.00 0.00 H new ATOM 0 HD3 ARG B 92 24.082 1.986 -11.368 1.00 0.00 H new ATOM 0 HE ARG B 92 23.032 -0.288 -12.746 1.00 0.00 H new ATOM 0 HH11 ARG B 92 22.620 3.224 -12.619 1.00 0.00 H new ATOM 0 HH12 ARG B 92 22.217 3.351 -14.334 1.00 0.00 H new ATOM 0 HH21 ARG B 92 22.579 -0.104 -14.955 1.00 0.00 H new ATOM 0 HH22 ARG B 92 22.194 1.474 -15.651 1.00 0.00 H new ATOM 1515 N ASP B 93 27.012 -0.881 -7.722 1.00 0.00 N ATOM 1516 CA ASP B 93 28.238 -1.608 -8.038 1.00 0.00 C ATOM 1517 C ASP B 93 28.288 -2.943 -7.304 1.00 0.00 C ATOM 1518 O ASP B 93 29.288 -3.661 -7.367 1.00 0.00 O ATOM 1519 CB ASP B 93 29.478 -0.774 -7.701 1.00 0.00 C ATOM 1520 CG ASP B 93 29.674 -0.576 -6.211 1.00 0.00 C ATOM 1521 OD1 ASP B 93 30.657 -1.112 -5.654 1.00 0.00 O ATOM 1522 OD2 ASP B 93 28.861 0.137 -5.593 1.00 0.00 O ATOM 0 H ASP B 93 27.098 -0.219 -6.951 1.00 0.00 H new ATOM 0 HA ASP B 93 28.235 -1.803 -9.110 1.00 0.00 H new ATOM 0 HB2 ASP B 93 30.360 -1.261 -8.116 1.00 0.00 H new ATOM 0 HB3 ASP B 93 29.396 0.200 -8.183 1.00 0.00 H new ATOM 1527 N SER B 94 27.208 -3.279 -6.616 1.00 0.00 N ATOM 1528 CA SER B 94 27.110 -4.571 -5.957 1.00 0.00 C ATOM 1529 C SER B 94 26.180 -5.486 -6.746 1.00 0.00 C ATOM 1530 O SER B 94 25.526 -5.044 -7.691 1.00 0.00 O ATOM 1531 CB SER B 94 26.636 -4.419 -4.507 1.00 0.00 C ATOM 1532 OG SER B 94 25.394 -3.734 -4.419 1.00 0.00 O ATOM 0 H SER B 94 26.392 -2.679 -6.500 1.00 0.00 H new ATOM 0 HA SER B 94 28.102 -5.023 -5.928 1.00 0.00 H new ATOM 0 HB2 SER B 94 26.538 -5.405 -4.053 1.00 0.00 H new ATOM 0 HB3 SER B 94 27.389 -3.878 -3.935 1.00 0.00 H new ATOM 0 HG SER B 94 25.488 -2.836 -4.801 1.00 0.00 H new ATOM 1538 N ASP B 95 26.121 -6.753 -6.354 1.00 0.00 N ATOM 1539 CA ASP B 95 25.407 -7.766 -7.126 1.00 0.00 C ATOM 1540 C ASP B 95 23.901 -7.525 -7.161 1.00 0.00 C ATOM 1541 O ASP B 95 23.229 -7.917 -8.115 1.00 0.00 O ATOM 1542 CB ASP B 95 25.711 -9.163 -6.584 1.00 0.00 C ATOM 1543 CG ASP B 95 27.158 -9.554 -6.810 1.00 0.00 C ATOM 1544 OD1 ASP B 95 27.939 -9.566 -5.833 1.00 0.00 O ATOM 1545 OD2 ASP B 95 27.530 -9.823 -7.972 1.00 0.00 O ATOM 0 H ASP B 95 26.560 -7.105 -5.503 1.00 0.00 H new ATOM 0 HA ASP B 95 25.764 -7.692 -8.153 1.00 0.00 H new ATOM 0 HB2 ASP B 95 25.489 -9.195 -5.517 1.00 0.00 H new ATOM 0 HB3 ASP B 95 25.059 -9.890 -7.068 1.00 0.00 H new ATOM 1550 N ASP B 96 23.373 -6.877 -6.134 1.00 0.00 N ATOM 1551 CA ASP B 96 21.947 -6.581 -6.073 1.00 0.00 C ATOM 1552 C ASP B 96 21.710 -5.227 -5.409 1.00 0.00 C ATOM 1553 O ASP B 96 21.834 -5.087 -4.189 1.00 0.00 O ATOM 1554 CB ASP B 96 21.209 -7.700 -5.330 1.00 0.00 C ATOM 1555 CG ASP B 96 19.753 -7.380 -5.052 1.00 0.00 C ATOM 1556 OD1 ASP B 96 19.353 -7.425 -3.869 1.00 0.00 O ATOM 1557 OD2 ASP B 96 19.003 -7.084 -6.003 1.00 0.00 O ATOM 0 H ASP B 96 23.908 -6.546 -5.332 1.00 0.00 H new ATOM 0 HA ASP B 96 21.552 -6.528 -7.088 1.00 0.00 H new ATOM 0 HB2 ASP B 96 21.266 -8.616 -5.918 1.00 0.00 H new ATOM 0 HB3 ASP B 96 21.717 -7.896 -4.386 1.00 0.00 H new ATOM 1562 N VAL B 97 21.376 -4.229 -6.229 1.00 0.00 N ATOM 1563 CA VAL B 97 21.215 -2.852 -5.759 1.00 0.00 C ATOM 1564 C VAL B 97 20.094 -2.762 -4.743 1.00 0.00 C ATOM 1565 O VAL B 97 20.290 -2.302 -3.618 1.00 0.00 O ATOM 1566 CB VAL B 97 20.870 -1.876 -6.908 1.00 0.00 C ATOM 1567 CG1 VAL B 97 21.181 -0.439 -6.538 1.00 0.00 C ATOM 1568 CG2 VAL B 97 21.581 -2.239 -8.181 1.00 0.00 C ATOM 0 H VAL B 97 21.211 -4.350 -7.228 1.00 0.00 H new ATOM 0 HA VAL B 97 22.171 -2.571 -5.318 1.00 0.00 H new ATOM 0 HB VAL B 97 19.797 -1.966 -7.074 1.00 0.00 H new ATOM 0 HG11 VAL B 97 20.925 0.215 -7.371 1.00 0.00 H new ATOM 0 HG12 VAL B 97 20.599 -0.155 -5.661 1.00 0.00 H new ATOM 0 HG13 VAL B 97 22.244 -0.343 -6.315 1.00 0.00 H new ATOM 0 HG21 VAL B 97 21.312 -1.529 -8.963 1.00 0.00 H new ATOM 0 HG22 VAL B 97 22.658 -2.208 -8.018 1.00 0.00 H new ATOM 0 HG23 VAL B 97 21.289 -3.244 -8.487 1.00 0.00 H new ATOM 1578 N LEU B 98 18.926 -3.242 -5.150 1.00 0.00 N ATOM 1579 CA LEU B 98 17.704 -3.056 -4.385 1.00 0.00 C ATOM 1580 C LEU B 98 17.783 -3.738 -3.022 1.00 0.00 C ATOM 1581 O LEU B 98 17.124 -3.316 -2.074 1.00 0.00 O ATOM 1582 CB LEU B 98 16.492 -3.564 -5.169 1.00 0.00 C ATOM 1583 CG LEU B 98 16.287 -2.937 -6.555 1.00 0.00 C ATOM 1584 CD1 LEU B 98 16.939 -3.781 -7.636 1.00 0.00 C ATOM 1585 CD2 LEU B 98 14.807 -2.756 -6.846 1.00 0.00 C ATOM 0 H LEU B 98 18.801 -3.768 -6.015 1.00 0.00 H new ATOM 0 HA LEU B 98 17.586 -1.986 -4.213 1.00 0.00 H new ATOM 0 HB2 LEU B 98 16.586 -4.643 -5.289 1.00 0.00 H new ATOM 0 HB3 LEU B 98 15.596 -3.386 -4.574 1.00 0.00 H new ATOM 0 HG LEU B 98 16.764 -1.957 -6.554 1.00 0.00 H new ATOM 0 HD11 LEU B 98 16.779 -3.314 -8.608 1.00 0.00 H new ATOM 0 HD12 LEU B 98 18.009 -3.858 -7.442 1.00 0.00 H new ATOM 0 HD13 LEU B 98 16.498 -4.778 -7.635 1.00 0.00 H new ATOM 0 HD21 LEU B 98 14.682 -2.310 -7.833 1.00 0.00 H new ATOM 0 HD22 LEU B 98 14.310 -3.726 -6.820 1.00 0.00 H new ATOM 0 HD23 LEU B 98 14.366 -2.102 -6.094 1.00 0.00 H new ATOM 1597 N GLY B 99 18.605 -4.774 -2.919 1.00 0.00 N ATOM 1598 CA GLY B 99 18.789 -5.456 -1.651 1.00 0.00 C ATOM 1599 C GLY B 99 19.475 -4.575 -0.632 1.00 0.00 C ATOM 1600 O GLY B 99 19.035 -4.471 0.511 1.00 0.00 O ATOM 0 H GLY B 99 19.149 -5.156 -3.693 1.00 0.00 H new ATOM 0 HA2 GLY B 99 17.820 -5.772 -1.264 1.00 0.00 H new ATOM 0 HA3 GLY B 99 19.379 -6.359 -1.807 1.00 0.00 H new ATOM 1604 N HIS B 100 20.540 -3.914 -1.057 1.00 0.00 N ATOM 1605 CA HIS B 100 21.267 -3.008 -0.182 1.00 0.00 C ATOM 1606 C HIS B 100 20.464 -1.736 -0.001 1.00 0.00 C ATOM 1607 O HIS B 100 20.553 -1.072 1.029 1.00 0.00 O ATOM 1608 CB HIS B 100 22.650 -2.688 -0.748 1.00 0.00 C ATOM 1609 CG HIS B 100 23.585 -3.856 -0.739 1.00 0.00 C ATOM 1610 ND1 HIS B 100 24.541 -4.044 0.231 1.00 0.00 N ATOM 1611 CD2 HIS B 100 23.713 -4.898 -1.595 1.00 0.00 C ATOM 1612 CE1 HIS B 100 25.216 -5.147 -0.025 1.00 0.00 C ATOM 1613 NE2 HIS B 100 24.735 -5.686 -1.129 1.00 0.00 N ATOM 0 H HIS B 100 20.920 -3.988 -2.001 1.00 0.00 H new ATOM 0 HA HIS B 100 21.409 -3.491 0.785 1.00 0.00 H new ATOM 0 HB2 HIS B 100 22.541 -2.329 -1.771 1.00 0.00 H new ATOM 0 HB3 HIS B 100 23.091 -1.876 -0.170 1.00 0.00 H new ATOM 0 HD2 HIS B 100 23.120 -5.076 -2.480 1.00 0.00 H new ATOM 0 HE1 HIS B 100 26.026 -5.543 0.569 1.00 0.00 H new ATOM 0 HE2 HIS B 100 25.068 -6.546 -1.564 1.00 0.00 H new ATOM 1622 N ILE B 101 19.673 -1.415 -1.014 1.00 0.00 N ATOM 1623 CA ILE B 101 18.748 -0.301 -0.941 1.00 0.00 C ATOM 1624 C ILE B 101 17.793 -0.476 0.235 1.00 0.00 C ATOM 1625 O ILE B 101 17.723 0.377 1.111 1.00 0.00 O ATOM 1626 CB ILE B 101 17.939 -0.146 -2.252 1.00 0.00 C ATOM 1627 CG1 ILE B 101 18.823 0.435 -3.358 1.00 0.00 C ATOM 1628 CG2 ILE B 101 16.707 0.725 -2.035 1.00 0.00 C ATOM 1629 CD1 ILE B 101 18.098 0.650 -4.671 1.00 0.00 C ATOM 0 H ILE B 101 19.656 -1.917 -1.902 1.00 0.00 H new ATOM 0 HA ILE B 101 19.338 0.604 -0.795 1.00 0.00 H new ATOM 0 HB ILE B 101 17.600 -1.135 -2.562 1.00 0.00 H new ATOM 0 HG12 ILE B 101 19.233 1.387 -3.020 1.00 0.00 H new ATOM 0 HG13 ILE B 101 19.667 -0.234 -3.525 1.00 0.00 H new ATOM 0 HG21 ILE B 101 16.157 0.817 -2.972 1.00 0.00 H new ATOM 0 HG22 ILE B 101 16.066 0.267 -1.281 1.00 0.00 H new ATOM 0 HG23 ILE B 101 17.016 1.714 -1.697 1.00 0.00 H new ATOM 0 HD11 ILE B 101 18.790 1.064 -5.405 1.00 0.00 H new ATOM 0 HD12 ILE B 101 17.711 -0.303 -5.033 1.00 0.00 H new ATOM 0 HD13 ILE B 101 17.271 1.344 -4.521 1.00 0.00 H new ATOM 1641 N MET B 102 17.083 -1.602 0.258 1.00 0.00 N ATOM 1642 CA MET B 102 16.096 -1.870 1.302 1.00 0.00 C ATOM 1643 C MET B 102 16.728 -1.893 2.684 1.00 0.00 C ATOM 1644 O MET B 102 16.131 -1.431 3.656 1.00 0.00 O ATOM 1645 CB MET B 102 15.394 -3.200 1.048 1.00 0.00 C ATOM 1646 CG MET B 102 14.610 -3.235 -0.245 1.00 0.00 C ATOM 1647 SD MET B 102 13.895 -4.854 -0.566 1.00 0.00 S ATOM 1648 CE MET B 102 12.944 -4.487 -2.031 1.00 0.00 C ATOM 0 H MET B 102 17.173 -2.345 -0.435 1.00 0.00 H new ATOM 0 HA MET B 102 15.369 -1.059 1.269 1.00 0.00 H new ATOM 0 HB2 MET B 102 16.138 -3.997 1.034 1.00 0.00 H new ATOM 0 HB3 MET B 102 14.719 -3.409 1.878 1.00 0.00 H new ATOM 0 HG2 MET B 102 13.815 -2.490 -0.205 1.00 0.00 H new ATOM 0 HG3 MET B 102 15.264 -2.959 -1.072 1.00 0.00 H new ATOM 0 HE1 MET B 102 12.120 -5.195 -2.116 1.00 0.00 H new ATOM 0 HE2 MET B 102 12.547 -3.474 -1.963 1.00 0.00 H new ATOM 0 HE3 MET B 102 13.584 -4.568 -2.910 1.00 0.00 H new ATOM 1658 N LYS B 103 17.939 -2.420 2.764 1.00 0.00 N ATOM 1659 CA LYS B 103 18.629 -2.560 4.040 1.00 0.00 C ATOM 1660 C LYS B 103 19.204 -1.229 4.519 1.00 0.00 C ATOM 1661 O LYS B 103 19.526 -1.080 5.699 1.00 0.00 O ATOM 1662 CB LYS B 103 19.743 -3.605 3.931 1.00 0.00 C ATOM 1663 CG LYS B 103 19.295 -5.043 4.185 1.00 0.00 C ATOM 1664 CD LYS B 103 18.156 -5.474 3.272 1.00 0.00 C ATOM 1665 CE LYS B 103 17.831 -6.952 3.435 1.00 0.00 C ATOM 1666 NZ LYS B 103 17.542 -7.314 4.849 1.00 0.00 N ATOM 0 H LYS B 103 18.467 -2.759 1.960 1.00 0.00 H new ATOM 0 HA LYS B 103 17.896 -2.892 4.776 1.00 0.00 H new ATOM 0 HB2 LYS B 103 20.182 -3.546 2.935 1.00 0.00 H new ATOM 0 HB3 LYS B 103 20.530 -3.353 4.642 1.00 0.00 H new ATOM 0 HG2 LYS B 103 20.142 -5.714 4.043 1.00 0.00 H new ATOM 0 HG3 LYS B 103 18.980 -5.143 5.224 1.00 0.00 H new ATOM 0 HD2 LYS B 103 17.269 -4.880 3.492 1.00 0.00 H new ATOM 0 HD3 LYS B 103 18.425 -5.273 2.235 1.00 0.00 H new ATOM 0 HE2 LYS B 103 16.970 -7.203 2.815 1.00 0.00 H new ATOM 0 HE3 LYS B 103 18.669 -7.548 3.074 1.00 0.00 H new ATOM 0 HZ1 LYS B 103 17.196 -8.294 4.893 1.00 0.00 H new ATOM 0 HZ2 LYS B 103 18.411 -7.229 5.414 1.00 0.00 H new ATOM 0 HZ3 LYS B 103 16.817 -6.673 5.230 1.00 0.00 H new ATOM 1680 N ASN B 104 19.352 -0.274 3.608 1.00 0.00 N ATOM 1681 CA ASN B 104 19.897 1.031 3.971 1.00 0.00 C ATOM 1682 C ASN B 104 18.798 2.081 4.107 1.00 0.00 C ATOM 1683 O ASN B 104 18.940 3.037 4.868 1.00 0.00 O ATOM 1684 CB ASN B 104 20.922 1.496 2.928 1.00 0.00 C ATOM 1685 CG ASN B 104 21.656 2.762 3.347 1.00 0.00 C ATOM 1686 OD1 ASN B 104 22.712 2.699 3.975 1.00 0.00 O ATOM 1687 ND2 ASN B 104 21.108 3.916 3.000 1.00 0.00 N ATOM 0 H ASN B 104 19.106 -0.375 2.623 1.00 0.00 H new ATOM 0 HA ASN B 104 20.387 0.919 4.938 1.00 0.00 H new ATOM 0 HB2 ASN B 104 21.647 0.700 2.758 1.00 0.00 H new ATOM 0 HB3 ASN B 104 20.414 1.673 1.980 1.00 0.00 H new ATOM 0 HD21 ASN B 104 21.563 4.793 3.253 1.00 0.00 H new ATOM 0 HD22 ASN B 104 20.231 3.928 2.479 1.00 0.00 H new ATOM 1694 N ILE B 105 17.694 1.897 3.395 1.00 0.00 N ATOM 1695 CA ILE B 105 16.678 2.937 3.306 1.00 0.00 C ATOM 1696 C ILE B 105 15.630 2.803 4.407 1.00 0.00 C ATOM 1697 O ILE B 105 15.314 1.703 4.872 1.00 0.00 O ATOM 1698 CB ILE B 105 15.982 2.931 1.927 1.00 0.00 C ATOM 1699 CG1 ILE B 105 15.166 4.206 1.712 1.00 0.00 C ATOM 1700 CG2 ILE B 105 15.101 1.704 1.754 1.00 0.00 C ATOM 1701 CD1 ILE B 105 16.009 5.391 1.306 1.00 0.00 C ATOM 0 H ILE B 105 17.480 1.046 2.875 1.00 0.00 H new ATOM 0 HA ILE B 105 17.197 3.887 3.436 1.00 0.00 H new ATOM 0 HB ILE B 105 16.767 2.895 1.171 1.00 0.00 H new ATOM 0 HG12 ILE B 105 14.414 4.023 0.944 1.00 0.00 H new ATOM 0 HG13 ILE B 105 14.631 4.447 2.631 1.00 0.00 H new ATOM 0 HG21 ILE B 105 14.627 1.732 0.773 1.00 0.00 H new ATOM 0 HG22 ILE B 105 15.710 0.804 1.837 1.00 0.00 H new ATOM 0 HG23 ILE B 105 14.333 1.695 2.528 1.00 0.00 H new ATOM 0 HD11 ILE B 105 15.369 6.263 1.169 1.00 0.00 H new ATOM 0 HD12 ILE B 105 16.744 5.598 2.084 1.00 0.00 H new ATOM 0 HD13 ILE B 105 16.523 5.168 0.371 1.00 0.00 H new ATOM 1713 N THR B 106 15.099 3.942 4.809 1.00 0.00 N ATOM 1714 CA THR B 106 14.120 4.010 5.869 1.00 0.00 C ATOM 1715 C THR B 106 12.761 3.472 5.405 1.00 0.00 C ATOM 1716 O THR B 106 11.990 2.935 6.197 1.00 0.00 O ATOM 1717 CB THR B 106 13.998 5.469 6.361 1.00 0.00 C ATOM 1718 OG1 THR B 106 13.496 5.506 7.703 1.00 0.00 O ATOM 1719 CG2 THR B 106 13.091 6.301 5.459 1.00 0.00 C ATOM 0 H THR B 106 15.338 4.848 4.406 1.00 0.00 H new ATOM 0 HA THR B 106 14.451 3.381 6.695 1.00 0.00 H new ATOM 0 HB THR B 106 14.998 5.901 6.330 1.00 0.00 H new ATOM 0 HG1 THR B 106 13.426 6.437 8.001 1.00 0.00 H new ATOM 0 HG21 THR B 106 13.033 7.320 5.841 1.00 0.00 H new ATOM 0 HG22 THR B 106 13.498 6.315 4.448 1.00 0.00 H new ATOM 0 HG23 THR B 106 12.093 5.863 5.442 1.00 0.00 H new ATOM 1727 N ALA B 107 12.487 3.581 4.111 1.00 0.00 N ATOM 1728 CA ALA B 107 11.214 3.134 3.570 1.00 0.00 C ATOM 1729 C ALA B 107 11.293 1.684 3.125 1.00 0.00 C ATOM 1730 O ALA B 107 12.179 1.308 2.357 1.00 0.00 O ATOM 1731 CB ALA B 107 10.803 4.011 2.396 1.00 0.00 C ATOM 0 H ALA B 107 13.127 3.974 3.421 1.00 0.00 H new ATOM 0 HA ALA B 107 10.465 3.215 4.358 1.00 0.00 H new ATOM 0 HB1 ALA B 107 9.848 3.665 2.000 1.00 0.00 H new ATOM 0 HB2 ALA B 107 10.705 5.044 2.730 1.00 0.00 H new ATOM 0 HB3 ALA B 107 11.562 3.953 1.615 1.00 0.00 H new ATOM 1737 N LYS B 108 10.363 0.875 3.592 1.00 0.00 N ATOM 1738 CA LYS B 108 10.298 -0.511 3.174 1.00 0.00 C ATOM 1739 C LYS B 108 9.422 -0.631 1.940 1.00 0.00 C ATOM 1740 O LYS B 108 8.195 -0.573 2.009 1.00 0.00 O ATOM 1741 CB LYS B 108 9.780 -1.398 4.307 1.00 0.00 C ATOM 1742 CG LYS B 108 10.653 -1.390 5.561 1.00 0.00 C ATOM 1743 CD LYS B 108 11.998 -2.080 5.350 1.00 0.00 C ATOM 1744 CE LYS B 108 13.107 -1.108 4.951 1.00 0.00 C ATOM 1745 NZ LYS B 108 13.344 -0.068 5.989 1.00 0.00 N ATOM 0 H LYS B 108 9.643 1.153 4.260 1.00 0.00 H new ATOM 0 HA LYS B 108 11.302 -0.854 2.924 1.00 0.00 H new ATOM 0 HB2 LYS B 108 8.775 -1.074 4.576 1.00 0.00 H new ATOM 0 HB3 LYS B 108 9.697 -2.422 3.942 1.00 0.00 H new ATOM 0 HG2 LYS B 108 10.823 -0.360 5.873 1.00 0.00 H new ATOM 0 HG3 LYS B 108 10.119 -1.885 6.373 1.00 0.00 H new ATOM 0 HD2 LYS B 108 12.285 -2.594 6.267 1.00 0.00 H new ATOM 0 HD3 LYS B 108 11.893 -2.841 4.577 1.00 0.00 H new ATOM 0 HE2 LYS B 108 14.029 -1.663 4.778 1.00 0.00 H new ATOM 0 HE3 LYS B 108 12.844 -0.626 4.010 1.00 0.00 H new ATOM 0 HZ1 LYS B 108 14.260 0.393 5.815 1.00 0.00 H new ATOM 0 HZ2 LYS B 108 12.585 0.642 5.949 1.00 0.00 H new ATOM 0 HZ3 LYS B 108 13.353 -0.512 6.929 1.00 0.00 H new ATOM 1759 N ARG B 109 10.082 -0.766 0.806 1.00 0.00 N ATOM 1760 CA ARG B 109 9.410 -0.849 -0.476 1.00 0.00 C ATOM 1761 C ARG B 109 9.703 -2.193 -1.111 1.00 0.00 C ATOM 1762 O ARG B 109 10.792 -2.732 -0.944 1.00 0.00 O ATOM 1763 CB ARG B 109 9.893 0.272 -1.397 1.00 0.00 C ATOM 1764 CG ARG B 109 9.641 1.670 -0.857 1.00 0.00 C ATOM 1765 CD ARG B 109 10.432 2.712 -1.632 1.00 0.00 C ATOM 1766 NE ARG B 109 11.874 2.572 -1.400 1.00 0.00 N ATOM 1767 CZ ARG B 109 12.738 3.588 -1.375 1.00 0.00 C ATOM 1768 NH1 ARG B 109 12.328 4.829 -1.608 1.00 0.00 N ATOM 1769 NH2 ARG B 109 14.024 3.358 -1.135 1.00 0.00 N ATOM 0 H ARG B 109 11.099 -0.821 0.748 1.00 0.00 H new ATOM 0 HA ARG B 109 8.336 -0.742 -0.325 1.00 0.00 H new ATOM 0 HB2 ARG B 109 10.962 0.149 -1.572 1.00 0.00 H new ATOM 0 HB3 ARG B 109 9.398 0.173 -2.363 1.00 0.00 H new ATOM 0 HG2 ARG B 109 8.577 1.899 -0.917 1.00 0.00 H new ATOM 0 HG3 ARG B 109 9.917 1.710 0.197 1.00 0.00 H new ATOM 0 HD2 ARG B 109 10.222 2.612 -2.697 1.00 0.00 H new ATOM 0 HD3 ARG B 109 10.110 3.710 -1.336 1.00 0.00 H new ATOM 0 HE ARG B 109 12.241 1.633 -1.247 1.00 0.00 H new ATOM 0 HH11 ARG B 109 11.345 5.012 -1.808 1.00 0.00 H new ATOM 0 HH12 ARG B 109 12.996 5.599 -1.587 1.00 0.00 H new ATOM 0 HH21 ARG B 109 14.350 2.406 -0.970 1.00 0.00 H new ATOM 0 HH22 ARG B 109 14.686 4.134 -1.116 1.00 0.00 H new ATOM 1783 N SER B 110 8.739 -2.725 -1.831 1.00 0.00 N ATOM 1784 CA SER B 110 8.914 -4.002 -2.498 1.00 0.00 C ATOM 1785 C SER B 110 9.589 -3.793 -3.849 1.00 0.00 C ATOM 1786 O SER B 110 9.585 -2.679 -4.382 1.00 0.00 O ATOM 1787 CB SER B 110 7.560 -4.696 -2.673 1.00 0.00 C ATOM 1788 OG SER B 110 7.703 -5.969 -3.280 1.00 0.00 O ATOM 0 H SER B 110 7.825 -2.295 -1.971 1.00 0.00 H new ATOM 0 HA SER B 110 9.550 -4.641 -1.885 1.00 0.00 H new ATOM 0 HB2 SER B 110 7.079 -4.807 -1.701 1.00 0.00 H new ATOM 0 HB3 SER B 110 6.906 -4.072 -3.283 1.00 0.00 H new ATOM 0 HG SER B 110 6.822 -6.386 -3.376 1.00 0.00 H new ATOM 1794 N ARG B 111 10.164 -4.861 -4.394 1.00 0.00 N ATOM 1795 CA ARG B 111 10.839 -4.802 -5.688 1.00 0.00 C ATOM 1796 C ARG B 111 9.895 -4.275 -6.755 1.00 0.00 C ATOM 1797 O ARG B 111 10.278 -3.443 -7.576 1.00 0.00 O ATOM 1798 CB ARG B 111 11.355 -6.187 -6.090 1.00 0.00 C ATOM 1799 CG ARG B 111 12.422 -6.735 -5.156 1.00 0.00 C ATOM 1800 CD ARG B 111 13.716 -5.951 -5.273 1.00 0.00 C ATOM 1801 NE ARG B 111 14.684 -6.335 -4.248 1.00 0.00 N ATOM 1802 CZ ARG B 111 15.916 -6.767 -4.507 1.00 0.00 C ATOM 1803 NH1 ARG B 111 16.351 -6.856 -5.758 1.00 0.00 N ATOM 1804 NH2 ARG B 111 16.715 -7.112 -3.512 1.00 0.00 N ATOM 0 H ARG B 111 10.176 -5.783 -3.957 1.00 0.00 H new ATOM 0 HA ARG B 111 11.687 -4.123 -5.598 1.00 0.00 H new ATOM 0 HB2 ARG B 111 10.517 -6.883 -6.118 1.00 0.00 H new ATOM 0 HB3 ARG B 111 11.761 -6.135 -7.100 1.00 0.00 H new ATOM 0 HG2 ARG B 111 12.063 -6.696 -4.128 1.00 0.00 H new ATOM 0 HG3 ARG B 111 12.608 -7.784 -5.389 1.00 0.00 H new ATOM 0 HD2 ARG B 111 14.150 -6.113 -6.260 1.00 0.00 H new ATOM 0 HD3 ARG B 111 13.503 -4.885 -5.189 1.00 0.00 H new ATOM 0 HE ARG B 111 14.397 -6.268 -3.271 1.00 0.00 H new ATOM 0 HH11 ARG B 111 15.739 -6.592 -6.531 1.00 0.00 H new ATOM 0 HH12 ARG B 111 17.297 -7.188 -5.947 1.00 0.00 H new ATOM 0 HH21 ARG B 111 16.387 -7.047 -2.548 1.00 0.00 H new ATOM 0 HH22 ARG B 111 17.660 -7.443 -3.708 1.00 0.00 H new ATOM 1818 N ALA B 112 8.652 -4.743 -6.709 1.00 0.00 N ATOM 1819 CA ALA B 112 7.636 -4.339 -7.669 1.00 0.00 C ATOM 1820 C ALA B 112 7.416 -2.830 -7.645 1.00 0.00 C ATOM 1821 O ALA B 112 7.217 -2.211 -8.684 1.00 0.00 O ATOM 1822 CB ALA B 112 6.334 -5.070 -7.387 1.00 0.00 C ATOM 0 H ALA B 112 8.324 -5.409 -6.009 1.00 0.00 H new ATOM 0 HA ALA B 112 7.987 -4.606 -8.666 1.00 0.00 H new ATOM 0 HB1 ALA B 112 5.579 -4.761 -8.110 1.00 0.00 H new ATOM 0 HB2 ALA B 112 6.495 -6.145 -7.467 1.00 0.00 H new ATOM 0 HB3 ALA B 112 5.992 -4.829 -6.381 1.00 0.00 H new ATOM 1828 N ARG B 113 7.476 -2.237 -6.457 1.00 0.00 N ATOM 1829 CA ARG B 113 7.247 -0.804 -6.321 1.00 0.00 C ATOM 1830 C ARG B 113 8.442 -0.018 -6.838 1.00 0.00 C ATOM 1831 O ARG B 113 8.284 1.016 -7.483 1.00 0.00 O ATOM 1832 CB ARG B 113 7.001 -0.406 -4.865 1.00 0.00 C ATOM 1833 CG ARG B 113 5.890 -1.169 -4.168 1.00 0.00 C ATOM 1834 CD ARG B 113 5.504 -0.474 -2.874 1.00 0.00 C ATOM 1835 NE ARG B 113 4.801 -1.356 -1.940 1.00 0.00 N ATOM 1836 CZ ARG B 113 4.080 -0.919 -0.900 1.00 0.00 C ATOM 1837 NH1 ARG B 113 3.892 0.382 -0.712 1.00 0.00 N ATOM 1838 NH2 ARG B 113 3.532 -1.784 -0.060 1.00 0.00 N ATOM 0 H ARG B 113 7.679 -2.721 -5.583 1.00 0.00 H new ATOM 0 HA ARG B 113 6.360 -0.570 -6.910 1.00 0.00 H new ATOM 0 HB2 ARG B 113 7.925 -0.548 -4.305 1.00 0.00 H new ATOM 0 HB3 ARG B 113 6.767 0.658 -4.830 1.00 0.00 H new ATOM 0 HG2 ARG B 113 5.022 -1.240 -4.823 1.00 0.00 H new ATOM 0 HG3 ARG B 113 6.215 -2.188 -3.958 1.00 0.00 H new ATOM 0 HD2 ARG B 113 6.403 -0.087 -2.394 1.00 0.00 H new ATOM 0 HD3 ARG B 113 4.871 0.383 -3.103 1.00 0.00 H new ATOM 0 HE ARG B 113 4.864 -2.363 -2.091 1.00 0.00 H new ATOM 0 HH11 ARG B 113 4.298 1.055 -1.362 1.00 0.00 H new ATOM 0 HH12 ARG B 113 3.342 0.708 0.082 1.00 0.00 H new ATOM 0 HH21 ARG B 113 3.659 -2.786 -0.205 1.00 0.00 H new ATOM 0 HH22 ARG B 113 2.983 -1.448 0.732 1.00 0.00 H new ATOM 1852 N ILE B 114 9.637 -0.515 -6.546 1.00 0.00 N ATOM 1853 CA ILE B 114 10.854 0.212 -6.866 1.00 0.00 C ATOM 1854 C ILE B 114 11.156 0.170 -8.362 1.00 0.00 C ATOM 1855 O ILE B 114 11.369 1.210 -8.987 1.00 0.00 O ATOM 1856 CB ILE B 114 12.069 -0.335 -6.086 1.00 0.00 C ATOM 1857 CG1 ILE B 114 11.852 -0.163 -4.581 1.00 0.00 C ATOM 1858 CG2 ILE B 114 13.345 0.374 -6.522 1.00 0.00 C ATOM 1859 CD1 ILE B 114 12.952 -0.765 -3.733 1.00 0.00 C ATOM 0 H ILE B 114 9.787 -1.415 -6.090 1.00 0.00 H new ATOM 0 HA ILE B 114 10.681 1.246 -6.568 1.00 0.00 H new ATOM 0 HB ILE B 114 12.173 -1.398 -6.305 1.00 0.00 H new ATOM 0 HG12 ILE B 114 11.771 0.900 -4.354 1.00 0.00 H new ATOM 0 HG13 ILE B 114 10.902 -0.621 -4.306 1.00 0.00 H new ATOM 0 HG21 ILE B 114 14.192 -0.024 -5.962 1.00 0.00 H new ATOM 0 HG22 ILE B 114 13.506 0.211 -7.588 1.00 0.00 H new ATOM 0 HG23 ILE B 114 13.252 1.443 -6.328 1.00 0.00 H new ATOM 0 HD11 ILE B 114 12.728 -0.603 -2.679 1.00 0.00 H new ATOM 0 HD12 ILE B 114 13.019 -1.835 -3.930 1.00 0.00 H new ATOM 0 HD13 ILE B 114 13.902 -0.291 -3.979 1.00 0.00 H new ATOM 1871 N VAL B 115 11.166 -1.032 -8.937 1.00 0.00 N ATOM 1872 CA VAL B 115 11.518 -1.189 -10.344 1.00 0.00 C ATOM 1873 C VAL B 115 10.508 -0.466 -11.235 1.00 0.00 C ATOM 1874 O VAL B 115 10.875 0.127 -12.245 1.00 0.00 O ATOM 1875 CB VAL B 115 11.632 -2.677 -10.766 1.00 0.00 C ATOM 1876 CG1 VAL B 115 12.642 -3.407 -9.889 1.00 0.00 C ATOM 1877 CG2 VAL B 115 10.284 -3.382 -10.722 1.00 0.00 C ATOM 0 H VAL B 115 10.937 -1.901 -8.455 1.00 0.00 H new ATOM 0 HA VAL B 115 12.502 -0.739 -10.474 1.00 0.00 H new ATOM 0 HB VAL B 115 11.981 -2.697 -11.798 1.00 0.00 H new ATOM 0 HG11 VAL B 115 12.708 -4.449 -10.200 1.00 0.00 H new ATOM 0 HG12 VAL B 115 13.620 -2.936 -9.990 1.00 0.00 H new ATOM 0 HG13 VAL B 115 12.322 -3.359 -8.848 1.00 0.00 H new ATOM 0 HG21 VAL B 115 10.407 -4.422 -11.025 1.00 0.00 H new ATOM 0 HG22 VAL B 115 9.886 -3.344 -9.708 1.00 0.00 H new ATOM 0 HG23 VAL B 115 9.592 -2.886 -11.402 1.00 0.00 H new ATOM 1887 N ASP B 116 9.245 -0.497 -10.827 1.00 0.00 N ATOM 1888 CA ASP B 116 8.181 0.217 -11.527 1.00 0.00 C ATOM 1889 C ASP B 116 8.484 1.707 -11.584 1.00 0.00 C ATOM 1890 O ASP B 116 8.327 2.357 -12.619 1.00 0.00 O ATOM 1891 CB ASP B 116 6.856 -0.032 -10.800 1.00 0.00 C ATOM 1892 CG ASP B 116 5.714 0.863 -11.258 1.00 0.00 C ATOM 1893 OD1 ASP B 116 5.624 2.021 -10.779 1.00 0.00 O ATOM 1894 OD2 ASP B 116 4.871 0.394 -12.053 1.00 0.00 O ATOM 0 H ASP B 116 8.929 -1.014 -10.007 1.00 0.00 H new ATOM 0 HA ASP B 116 8.111 -0.149 -12.551 1.00 0.00 H new ATOM 0 HB2 ASP B 116 6.566 -1.073 -10.943 1.00 0.00 H new ATOM 0 HB3 ASP B 116 7.009 0.112 -9.730 1.00 0.00 H new ATOM 1899 N LYS B 117 8.966 2.235 -10.474 1.00 0.00 N ATOM 1900 CA LYS B 117 9.198 3.658 -10.360 1.00 0.00 C ATOM 1901 C LYS B 117 10.500 4.077 -11.032 1.00 0.00 C ATOM 1902 O LYS B 117 10.597 5.185 -11.542 1.00 0.00 O ATOM 1903 CB LYS B 117 9.152 4.079 -8.894 1.00 0.00 C ATOM 1904 CG LYS B 117 7.730 4.265 -8.392 1.00 0.00 C ATOM 1905 CD LYS B 117 7.174 5.619 -8.804 1.00 0.00 C ATOM 1906 CE LYS B 117 5.704 5.542 -9.193 1.00 0.00 C ATOM 1907 NZ LYS B 117 5.475 4.704 -10.407 1.00 0.00 N ATOM 0 H LYS B 117 9.204 1.698 -9.640 1.00 0.00 H new ATOM 0 HA LYS B 117 8.400 4.178 -10.890 1.00 0.00 H new ATOM 0 HB2 LYS B 117 9.654 3.326 -8.286 1.00 0.00 H new ATOM 0 HB3 LYS B 117 9.704 5.010 -8.768 1.00 0.00 H new ATOM 0 HG2 LYS B 117 7.095 3.472 -8.788 1.00 0.00 H new ATOM 0 HG3 LYS B 117 7.710 4.176 -7.306 1.00 0.00 H new ATOM 0 HD2 LYS B 117 7.294 6.325 -7.982 1.00 0.00 H new ATOM 0 HD3 LYS B 117 7.751 6.007 -9.644 1.00 0.00 H new ATOM 0 HE2 LYS B 117 5.132 5.132 -8.360 1.00 0.00 H new ATOM 0 HE3 LYS B 117 5.327 6.548 -9.374 1.00 0.00 H new ATOM 0 HZ1 LYS B 117 4.547 4.933 -10.817 1.00 0.00 H new ATOM 0 HZ2 LYS B 117 6.220 4.896 -11.107 1.00 0.00 H new ATOM 0 HZ3 LYS B 117 5.499 3.698 -10.144 1.00 0.00 H new ATOM 1921 N LEU B 118 11.493 3.197 -11.064 1.00 0.00 N ATOM 1922 CA LEU B 118 12.737 3.510 -11.768 1.00 0.00 C ATOM 1923 C LEU B 118 12.480 3.714 -13.253 1.00 0.00 C ATOM 1924 O LEU B 118 13.030 4.631 -13.869 1.00 0.00 O ATOM 1925 CB LEU B 118 13.784 2.415 -11.592 1.00 0.00 C ATOM 1926 CG LEU B 118 14.381 2.275 -10.193 1.00 0.00 C ATOM 1927 CD1 LEU B 118 15.747 1.633 -10.290 1.00 0.00 C ATOM 1928 CD2 LEU B 118 14.477 3.619 -9.489 1.00 0.00 C ATOM 0 H LEU B 118 11.467 2.278 -10.622 1.00 0.00 H new ATOM 0 HA LEU B 118 13.121 4.431 -11.329 1.00 0.00 H new ATOM 0 HB2 LEU B 118 13.334 1.462 -11.870 1.00 0.00 H new ATOM 0 HB3 LEU B 118 14.596 2.601 -12.295 1.00 0.00 H new ATOM 0 HG LEU B 118 13.721 1.642 -9.600 1.00 0.00 H new ATOM 0 HD11 LEU B 118 16.174 1.533 -9.292 1.00 0.00 H new ATOM 0 HD12 LEU B 118 15.654 0.647 -10.746 1.00 0.00 H new ATOM 0 HD13 LEU B 118 16.399 2.256 -10.902 1.00 0.00 H new ATOM 0 HD21 LEU B 118 14.906 3.480 -8.497 1.00 0.00 H new ATOM 0 HD22 LEU B 118 15.112 4.289 -10.069 1.00 0.00 H new ATOM 0 HD23 LEU B 118 13.481 4.053 -9.396 1.00 0.00 H new ATOM 1940 N LEU B 119 11.639 2.859 -13.822 1.00 0.00 N ATOM 1941 CA LEU B 119 11.274 2.958 -15.230 1.00 0.00 C ATOM 1942 C LEU B 119 10.429 4.196 -15.477 1.00 0.00 C ATOM 1943 O LEU B 119 10.419 4.749 -16.576 1.00 0.00 O ATOM 1944 CB LEU B 119 10.497 1.715 -15.677 1.00 0.00 C ATOM 1945 CG LEU B 119 11.341 0.487 -16.066 1.00 0.00 C ATOM 1946 CD1 LEU B 119 12.225 0.807 -17.260 1.00 0.00 C ATOM 1947 CD2 LEU B 119 12.186 -0.005 -14.897 1.00 0.00 C ATOM 0 H LEU B 119 11.195 2.086 -13.327 1.00 0.00 H new ATOM 0 HA LEU B 119 12.195 3.031 -15.809 1.00 0.00 H new ATOM 0 HB2 LEU B 119 9.822 1.425 -14.872 1.00 0.00 H new ATOM 0 HB3 LEU B 119 9.876 1.988 -16.530 1.00 0.00 H new ATOM 0 HG LEU B 119 10.654 -0.314 -16.339 1.00 0.00 H new ATOM 0 HD11 LEU B 119 12.815 -0.071 -17.522 1.00 0.00 H new ATOM 0 HD12 LEU B 119 11.602 1.092 -18.108 1.00 0.00 H new ATOM 0 HD13 LEU B 119 12.893 1.631 -17.008 1.00 0.00 H new ATOM 0 HD21 LEU B 119 12.768 -0.872 -15.208 1.00 0.00 H new ATOM 0 HD22 LEU B 119 12.861 0.789 -14.576 1.00 0.00 H new ATOM 0 HD23 LEU B 119 11.534 -0.284 -14.069 1.00 0.00 H new ATOM 1959 N ALA B 120 9.732 4.629 -14.441 1.00 0.00 N ATOM 1960 CA ALA B 120 8.842 5.770 -14.541 1.00 0.00 C ATOM 1961 C ALA B 120 9.606 7.080 -14.372 1.00 0.00 C ATOM 1962 O ALA B 120 9.407 8.025 -15.133 1.00 0.00 O ATOM 1963 CB ALA B 120 7.735 5.639 -13.513 1.00 0.00 C ATOM 0 H ALA B 120 9.767 4.203 -13.515 1.00 0.00 H new ATOM 0 HA ALA B 120 8.396 5.787 -15.536 1.00 0.00 H new ATOM 0 HB1 ALA B 120 7.066 6.496 -13.588 1.00 0.00 H new ATOM 0 HB2 ALA B 120 7.174 4.723 -13.698 1.00 0.00 H new ATOM 0 HB3 ALA B 120 8.169 5.603 -12.514 1.00 0.00 H new ATOM 1969 N LEU B 121 10.487 7.123 -13.376 1.00 0.00 N ATOM 1970 CA LEU B 121 11.349 8.278 -13.148 1.00 0.00 C ATOM 1971 C LEU B 121 12.309 8.469 -14.308 1.00 0.00 C ATOM 1972 O LEU B 121 12.791 9.573 -14.559 1.00 0.00 O ATOM 1973 CB LEU B 121 12.180 8.078 -11.879 1.00 0.00 C ATOM 1974 CG LEU B 121 11.553 8.527 -10.559 1.00 0.00 C ATOM 1975 CD1 LEU B 121 10.200 7.874 -10.314 1.00 0.00 C ATOM 1976 CD2 LEU B 121 12.512 8.213 -9.424 1.00 0.00 C ATOM 0 H LEU B 121 10.623 6.364 -12.709 1.00 0.00 H new ATOM 0 HA LEU B 121 10.707 9.153 -13.048 1.00 0.00 H new ATOM 0 HB2 LEU B 121 12.421 7.018 -11.796 1.00 0.00 H new ATOM 0 HB3 LEU B 121 13.123 8.611 -12.004 1.00 0.00 H new ATOM 0 HG LEU B 121 11.376 9.601 -10.611 1.00 0.00 H new ATOM 0 HD11 LEU B 121 9.794 8.223 -9.365 1.00 0.00 H new ATOM 0 HD12 LEU B 121 9.517 8.139 -11.121 1.00 0.00 H new ATOM 0 HD13 LEU B 121 10.319 6.791 -10.281 1.00 0.00 H new ATOM 0 HD21 LEU B 121 12.073 8.530 -8.478 1.00 0.00 H new ATOM 0 HD22 LEU B 121 12.702 7.140 -9.394 1.00 0.00 H new ATOM 0 HD23 LEU B 121 13.451 8.743 -9.584 1.00 0.00 H new ATOM 1988 N GLY B 122 12.583 7.381 -15.009 1.00 0.00 N ATOM 1989 CA GLY B 122 13.583 7.406 -16.048 1.00 0.00 C ATOM 1990 C GLY B 122 14.976 7.346 -15.470 1.00 0.00 C ATOM 1991 O GLY B 122 15.912 7.932 -16.015 1.00 0.00 O ATOM 0 H GLY B 122 12.127 6.478 -14.874 1.00 0.00 H new ATOM 0 HA2 GLY B 122 13.430 6.564 -16.723 1.00 0.00 H new ATOM 0 HA3 GLY B 122 13.472 8.314 -16.641 1.00 0.00 H new ATOM 1995 N LEU B 123 15.112 6.637 -14.356 1.00 0.00 N ATOM 1996 CA LEU B 123 16.408 6.450 -13.725 1.00 0.00 C ATOM 1997 C LEU B 123 17.131 5.308 -14.409 1.00 0.00 C ATOM 1998 O LEU B 123 18.346 5.153 -14.295 1.00 0.00 O ATOM 1999 CB LEU B 123 16.252 6.175 -12.227 1.00 0.00 C ATOM 2000 CG LEU B 123 15.727 7.349 -11.396 1.00 0.00 C ATOM 2001 CD1 LEU B 123 15.770 7.012 -9.915 1.00 0.00 C ATOM 2002 CD2 LEU B 123 16.525 8.615 -11.679 1.00 0.00 C ATOM 0 H LEU B 123 14.338 6.182 -13.872 1.00 0.00 H new ATOM 0 HA LEU B 123 16.994 7.363 -13.830 1.00 0.00 H new ATOM 0 HB2 LEU B 123 15.576 5.330 -12.098 1.00 0.00 H new ATOM 0 HB3 LEU B 123 17.220 5.873 -11.827 1.00 0.00 H new ATOM 0 HG LEU B 123 14.691 7.531 -11.681 1.00 0.00 H new ATOM 0 HD11 LEU B 123 15.394 7.857 -9.338 1.00 0.00 H new ATOM 0 HD12 LEU B 123 15.150 6.136 -9.723 1.00 0.00 H new ATOM 0 HD13 LEU B 123 16.798 6.800 -9.620 1.00 0.00 H new ATOM 0 HD21 LEU B 123 16.133 9.435 -11.077 1.00 0.00 H new ATOM 0 HD22 LEU B 123 17.572 8.449 -11.427 1.00 0.00 H new ATOM 0 HD23 LEU B 123 16.442 8.869 -12.736 1.00 0.00 H new ATOM 2014 N VAL B 124 16.360 4.510 -15.127 1.00 0.00 N ATOM 2015 CA VAL B 124 16.899 3.437 -15.914 1.00 0.00 C ATOM 2016 C VAL B 124 16.037 3.215 -17.138 1.00 0.00 C ATOM 2017 O VAL B 124 15.017 3.875 -17.334 1.00 0.00 O ATOM 2018 CB VAL B 124 16.980 2.137 -15.098 1.00 0.00 C ATOM 2019 CG1 VAL B 124 15.642 1.412 -15.053 1.00 0.00 C ATOM 2020 CG2 VAL B 124 18.109 1.251 -15.571 1.00 0.00 C ATOM 0 H VAL B 124 15.345 4.595 -15.175 1.00 0.00 H new ATOM 0 HA VAL B 124 17.908 3.714 -16.220 1.00 0.00 H new ATOM 0 HB VAL B 124 17.213 2.411 -14.069 1.00 0.00 H new ATOM 0 HG11 VAL B 124 15.743 0.499 -14.467 1.00 0.00 H new ATOM 0 HG12 VAL B 124 14.894 2.058 -14.593 1.00 0.00 H new ATOM 0 HG13 VAL B 124 15.330 1.160 -16.067 1.00 0.00 H new ATOM 0 HG21 VAL B 124 18.134 0.342 -14.970 1.00 0.00 H new ATOM 0 HG22 VAL B 124 17.953 0.990 -16.618 1.00 0.00 H new ATOM 0 HG23 VAL B 124 19.056 1.781 -15.467 1.00 0.00 H new ATOM 2030 N ALA B 125 16.455 2.268 -17.930 1.00 0.00 N ATOM 2031 CA ALA B 125 15.764 1.926 -19.163 1.00 0.00 C ATOM 2032 C ALA B 125 15.258 0.493 -19.116 1.00 0.00 C ATOM 2033 O ALA B 125 14.514 0.052 -19.994 1.00 0.00 O ATOM 2034 CB ALA B 125 16.687 2.123 -20.358 1.00 0.00 C ATOM 0 H ALA B 125 17.285 1.704 -17.747 1.00 0.00 H new ATOM 0 HA ALA B 125 14.905 2.589 -19.271 1.00 0.00 H new ATOM 0 HB1 ALA B 125 16.157 1.863 -21.274 1.00 0.00 H new ATOM 0 HB2 ALA B 125 17.004 3.165 -20.405 1.00 0.00 H new ATOM 0 HB3 ALA B 125 17.562 1.482 -20.251 1.00 0.00 H new ATOM 2040 N GLU B 126 15.648 -0.225 -18.069 1.00 0.00 N ATOM 2041 CA GLU B 126 15.446 -1.667 -18.008 1.00 0.00 C ATOM 2042 C GLU B 126 15.831 -2.189 -16.627 1.00 0.00 C ATOM 2043 O GLU B 126 16.736 -1.653 -15.994 1.00 0.00 O ATOM 2044 CB GLU B 126 16.299 -2.328 -19.094 1.00 0.00 C ATOM 2045 CG GLU B 126 17.741 -1.854 -19.055 1.00 0.00 C ATOM 2046 CD GLU B 126 18.478 -2.023 -20.371 1.00 0.00 C ATOM 2047 OE1 GLU B 126 19.304 -2.953 -20.488 1.00 0.00 O ATOM 2048 OE2 GLU B 126 18.243 -1.220 -21.294 1.00 0.00 O ATOM 0 H GLU B 126 16.107 0.170 -17.248 1.00 0.00 H new ATOM 0 HA GLU B 126 14.396 -1.906 -18.178 1.00 0.00 H new ATOM 0 HB2 GLU B 126 16.270 -3.410 -18.968 1.00 0.00 H new ATOM 0 HB3 GLU B 126 15.872 -2.109 -20.073 1.00 0.00 H new ATOM 0 HG2 GLU B 126 17.760 -0.802 -18.771 1.00 0.00 H new ATOM 0 HG3 GLU B 126 18.273 -2.403 -18.278 1.00 0.00 H new ATOM 2055 N ARG B 127 15.154 -3.235 -16.167 1.00 0.00 N ATOM 2056 CA ARG B 127 15.377 -3.753 -14.818 1.00 0.00 C ATOM 2057 C ARG B 127 16.740 -4.424 -14.692 1.00 0.00 C ATOM 2058 O ARG B 127 17.350 -4.406 -13.631 1.00 0.00 O ATOM 2059 CB ARG B 127 14.269 -4.731 -14.423 1.00 0.00 C ATOM 2060 CG ARG B 127 12.920 -4.063 -14.219 1.00 0.00 C ATOM 2061 CD ARG B 127 11.872 -5.043 -13.718 1.00 0.00 C ATOM 2062 NE ARG B 127 11.580 -6.099 -14.690 1.00 0.00 N ATOM 2063 CZ ARG B 127 10.448 -6.177 -15.390 1.00 0.00 C ATOM 2064 NH1 ARG B 127 9.504 -5.254 -15.240 1.00 0.00 N ATOM 2065 NH2 ARG B 127 10.251 -7.182 -16.234 1.00 0.00 N ATOM 0 H ARG B 127 14.449 -3.740 -16.704 1.00 0.00 H new ATOM 0 HA ARG B 127 15.357 -2.903 -14.136 1.00 0.00 H new ATOM 0 HB2 ARG B 127 14.175 -5.494 -15.196 1.00 0.00 H new ATOM 0 HB3 ARG B 127 14.556 -5.242 -13.504 1.00 0.00 H new ATOM 0 HG2 ARG B 127 13.024 -3.246 -13.505 1.00 0.00 H new ATOM 0 HG3 ARG B 127 12.586 -3.624 -15.159 1.00 0.00 H new ATOM 0 HD2 ARG B 127 12.217 -5.495 -12.788 1.00 0.00 H new ATOM 0 HD3 ARG B 127 10.954 -4.502 -13.488 1.00 0.00 H new ATOM 0 HE ARG B 127 12.286 -6.819 -14.841 1.00 0.00 H new ATOM 0 HH11 ARG B 127 9.644 -4.483 -14.588 1.00 0.00 H new ATOM 0 HH12 ARG B 127 8.639 -5.317 -15.777 1.00 0.00 H new ATOM 0 HH21 ARG B 127 10.967 -7.899 -16.349 1.00 0.00 H new ATOM 0 HH22 ARG B 127 9.383 -7.237 -16.767 1.00 0.00 H new ATOM 2079 N ARG B 128 17.221 -4.990 -15.781 1.00 0.00 N ATOM 2080 CA ARG B 128 18.502 -5.700 -15.790 1.00 0.00 C ATOM 2081 C ARG B 128 19.694 -4.775 -15.515 1.00 0.00 C ATOM 2082 O ARG B 128 20.824 -5.237 -15.385 1.00 0.00 O ATOM 2083 CB ARG B 128 18.688 -6.392 -17.133 1.00 0.00 C ATOM 2084 CG ARG B 128 18.634 -5.433 -18.306 1.00 0.00 C ATOM 2085 CD ARG B 128 18.515 -6.167 -19.623 1.00 0.00 C ATOM 2086 NE ARG B 128 18.112 -5.264 -20.695 1.00 0.00 N ATOM 2087 CZ ARG B 128 17.000 -5.402 -21.415 1.00 0.00 C ATOM 2088 NH1 ARG B 128 16.152 -6.392 -21.152 1.00 0.00 N ATOM 2089 NH2 ARG B 128 16.723 -4.528 -22.378 1.00 0.00 N ATOM 0 H ARG B 128 16.745 -4.976 -16.683 1.00 0.00 H new ATOM 0 HA ARG B 128 18.473 -6.433 -14.984 1.00 0.00 H new ATOM 0 HB2 ARG B 128 19.647 -6.911 -17.139 1.00 0.00 H new ATOM 0 HB3 ARG B 128 17.915 -7.150 -17.255 1.00 0.00 H new ATOM 0 HG2 ARG B 128 17.785 -4.759 -18.187 1.00 0.00 H new ATOM 0 HG3 ARG B 128 19.532 -4.816 -18.313 1.00 0.00 H new ATOM 0 HD2 ARG B 128 19.470 -6.629 -19.873 1.00 0.00 H new ATOM 0 HD3 ARG B 128 17.787 -6.972 -19.529 1.00 0.00 H new ATOM 0 HE ARG B 128 18.722 -4.475 -20.907 1.00 0.00 H new ATOM 0 HH11 ARG B 128 16.352 -7.048 -20.397 1.00 0.00 H new ATOM 0 HH12 ARG B 128 15.301 -6.495 -21.705 1.00 0.00 H new ATOM 0 HH21 ARG B 128 17.361 -3.754 -22.564 1.00 0.00 H new ATOM 0 HH22 ARG B 128 15.872 -4.631 -22.931 1.00 0.00 H new ATOM 2103 N GLU B 129 19.447 -3.477 -15.451 1.00 0.00 N ATOM 2104 CA GLU B 129 20.500 -2.516 -15.150 1.00 0.00 C ATOM 2105 C GLU B 129 20.606 -2.270 -13.652 1.00 0.00 C ATOM 2106 O GLU B 129 21.651 -1.858 -13.148 1.00 0.00 O ATOM 2107 CB GLU B 129 20.222 -1.215 -15.877 1.00 0.00 C ATOM 2108 CG GLU B 129 20.388 -1.327 -17.375 1.00 0.00 C ATOM 2109 CD GLU B 129 21.829 -1.237 -17.823 1.00 0.00 C ATOM 2110 OE1 GLU B 129 22.260 -0.141 -18.225 1.00 0.00 O ATOM 2111 OE2 GLU B 129 22.540 -2.263 -17.777 1.00 0.00 O ATOM 0 H GLU B 129 18.527 -3.063 -15.603 1.00 0.00 H new ATOM 0 HA GLU B 129 21.451 -2.926 -15.489 1.00 0.00 H new ATOM 0 HB2 GLU B 129 19.206 -0.890 -15.653 1.00 0.00 H new ATOM 0 HB3 GLU B 129 20.893 -0.444 -15.499 1.00 0.00 H new ATOM 0 HG2 GLU B 129 19.969 -2.275 -17.711 1.00 0.00 H new ATOM 0 HG3 GLU B 129 19.814 -0.536 -17.858 1.00 0.00 H new ATOM 2118 N LEU B 130 19.513 -2.522 -12.950 1.00 0.00 N ATOM 2119 CA LEU B 130 19.483 -2.396 -11.501 1.00 0.00 C ATOM 2120 C LEU B 130 19.720 -3.760 -10.865 1.00 0.00 C ATOM 2121 O LEU B 130 19.543 -3.948 -9.662 1.00 0.00 O ATOM 2122 CB LEU B 130 18.154 -1.791 -11.028 1.00 0.00 C ATOM 2123 CG LEU B 130 16.939 -2.093 -11.907 1.00 0.00 C ATOM 2124 CD1 LEU B 130 15.698 -2.258 -11.065 1.00 0.00 C ATOM 2125 CD2 LEU B 130 16.720 -0.984 -12.925 1.00 0.00 C ATOM 0 H LEU B 130 18.629 -2.817 -13.364 1.00 0.00 H new ATOM 0 HA LEU B 130 20.278 -1.719 -11.189 1.00 0.00 H new ATOM 0 HB2 LEU B 130 17.949 -2.152 -10.020 1.00 0.00 H new ATOM 0 HB3 LEU B 130 18.271 -0.709 -10.961 1.00 0.00 H new ATOM 0 HG LEU B 130 17.136 -3.026 -12.436 1.00 0.00 H new ATOM 0 HD11 LEU B 130 14.846 -2.472 -11.710 1.00 0.00 H new ATOM 0 HD12 LEU B 130 15.840 -3.082 -10.366 1.00 0.00 H new ATOM 0 HD13 LEU B 130 15.510 -1.339 -10.510 1.00 0.00 H new ATOM 0 HD21 LEU B 130 15.851 -1.220 -13.539 1.00 0.00 H new ATOM 0 HD22 LEU B 130 16.552 -0.041 -12.405 1.00 0.00 H new ATOM 0 HD23 LEU B 130 17.600 -0.895 -13.561 1.00 0.00 H new ATOM 2137 N TYR B 131 20.122 -4.707 -11.699 1.00 0.00 N ATOM 2138 CA TYR B 131 20.540 -6.021 -11.247 1.00 0.00 C ATOM 2139 C TYR B 131 21.863 -6.369 -11.903 1.00 0.00 C ATOM 2140 O TYR B 131 21.925 -6.552 -13.119 1.00 0.00 O ATOM 2141 CB TYR B 131 19.502 -7.093 -11.601 1.00 0.00 C ATOM 2142 CG TYR B 131 18.178 -6.944 -10.888 1.00 0.00 C ATOM 2143 CD1 TYR B 131 18.037 -7.321 -9.559 1.00 0.00 C ATOM 2144 CD2 TYR B 131 17.065 -6.440 -11.548 1.00 0.00 C ATOM 2145 CE1 TYR B 131 16.826 -7.198 -8.909 1.00 0.00 C ATOM 2146 CE2 TYR B 131 15.851 -6.312 -10.904 1.00 0.00 C ATOM 2147 CZ TYR B 131 15.737 -6.693 -9.585 1.00 0.00 C ATOM 2148 OH TYR B 131 14.528 -6.573 -8.940 1.00 0.00 O ATOM 0 H TYR B 131 20.167 -4.583 -12.710 1.00 0.00 H new ATOM 0 HA TYR B 131 20.643 -5.996 -10.162 1.00 0.00 H new ATOM 0 HB2 TYR B 131 19.326 -7.069 -12.676 1.00 0.00 H new ATOM 0 HB3 TYR B 131 19.917 -8.074 -11.368 1.00 0.00 H new ATOM 0 HD1 TYR B 131 18.889 -7.717 -9.026 1.00 0.00 H new ATOM 0 HD2 TYR B 131 17.151 -6.143 -12.583 1.00 0.00 H new ATOM 0 HE1 TYR B 131 16.732 -7.496 -7.875 1.00 0.00 H new ATOM 0 HE2 TYR B 131 14.996 -5.916 -11.431 1.00 0.00 H new ATOM 0 HH TYR B 131 13.864 -6.199 -9.556 1.00 0.00 H new