USER MOD reduce.3.24.130724 H: found=0, std=0, add=912, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 914 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 131 CYS SG : rot -150:sc= -0.204 USER MOD Set 1.2: B 135 MET CE :methyl 175:sc= -3.61! (180deg=-3.95) USER MOD Set 2.1: B 127 ASN : amide:sc= -0.386 K(o=-5.6,f=-2.3) USER MOD Set 2.2: B 130 ASN : amide:sc= -0.94 K(o=-5.6,f=-11!) USER MOD Set 2.3: B 158 ASN : amide:sc= -1.4 K(o=-5.6,f=-2.3) USER MOD Set 2.4: B 161 ASN : amide:sc= -2.92 K(o=-5.6,f=-11!) USER MOD Set 3.1: A 72 SER OG : rot 120:sc= -0.834! USER MOD Set 3.2: B 139 LYS NZ :NH3+ 178:sc= 0.617 (180deg=-0.258) USER MOD Set 4.1: A 31 CYS SG : rot -150:sc= -1.74 USER MOD Set 4.2: A 35 MET CE :methyl -129:sc= -1.02 (180deg=-0.336) USER MOD Set 5.1: A 27 ASN : amide:sc= -0.592 K(o=-4.6,f=-3.6) USER MOD Set 5.2: A 30 ASN : amide:sc= -1.4 K(o=-4.6,f=-8.9!) USER MOD Set 5.3: A 61 ASN : amide:sc= -2.65 K(o=-4.6,f=-8.9) USER MOD Single : A 17 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 22 LYS NZ :NH3+ -174:sc= -0.868! (180deg=-1.42!) USER MOD Single : A 23 MET CE :methyl 153:sc= -0.305 (180deg=-2.15!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 86:sc= 0.792 USER MOD Single : A 36 HIS : no HD1:sc= -0.0078 X(o=-0.0078,f=0) USER MOD Single : A 37 HIS : no HD1:sc= -0.219 X(o=-0.22,f=-0.007) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 ASN : amide:sc= -3.44! C(o=-3.4!,f=-7.8!) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 49 GLN : amide:sc= -0.0681 X(o=-0.068,f=-0.34) USER MOD Single : A 53 THR OG1 : rot 70:sc= 1.1 USER MOD Single : A 54 SER OG : rot 76:sc= 0.821 USER MOD Single : A 58 ASN : amide:sc= -0.828 K(o=-0.83,f=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 GLN : amide:sc= 0.203 X(o=0.2,f=0) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 HIS : no HE2:sc= 0.537 K(o=0.54,f=-2.1!) USER MOD Single : A 71 THR OG1 : rot 68:sc= 1.31 USER MOD Single : B 117 GLN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : B 122 LYS NZ :NH3+ -169:sc= 0.706 (180deg=0.0101) USER MOD Single : B 123 MET CE :methyl 151:sc= -0.689 (180deg=-2.68!) USER MOD Single : B 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 133 SER OG : rot 85:sc= 0.754 USER MOD Single : B 136 HIS : no HD1:sc= -0.0519 X(o=-0.052,f=0) USER MOD Single : B 137 HIS : no HD1:sc= -0.0331 X(o=-0.033,f=-0.016) USER MOD Single : B 140 ASN : amide:sc= -2.71! C(o=-2.7!,f=-7.5!) USER MOD Single : B 148 SER OG : rot 180:sc= 0 USER MOD Single : B 149 GLN : amide:sc= -0.476 K(o=-0.48,f=-1.6) USER MOD Single : B 153 THR OG1 : rot 78:sc= 1.17 USER MOD Single : B 154 SER OG : rot 82:sc= 1.05 USER MOD Single : B 163 LYS NZ :NH3+ -164:sc= -0.0433 (180deg=-0.303) USER MOD Single : B 164 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 166 TYR OH : rot 180:sc= 0 USER MOD Single : B 170 HIS : no HE2:sc= 1.09 K(o=1.1,f=-3.3!) USER MOD Single : B 171 THR OG1 : rot 62:sc= 1.27 USER MOD Single : B 172 SER OG : rot 180:sc= -0.961 USER MOD ----------------------------------------------------------------- ATOM 217 N GLY A 15 9.256 2.198 8.714 1.00 0.00 N ATOM 218 CA GLY A 15 8.002 2.643 8.089 1.00 0.00 C ATOM 219 C GLY A 15 7.483 1.710 7.000 1.00 0.00 C ATOM 220 O GLY A 15 6.480 1.013 7.207 1.00 0.00 O ATOM 0 HA2 GLY A 15 7.239 2.742 8.861 1.00 0.00 H new ATOM 0 HA3 GLY A 15 8.154 3.634 7.661 1.00 0.00 H new ATOM 224 N PRO A 16 8.162 1.643 5.854 1.00 0.00 N ATOM 225 CA PRO A 16 7.746 0.798 4.739 1.00 0.00 C ATOM 226 C PRO A 16 7.879 -0.725 5.055 1.00 0.00 C ATOM 227 O PRO A 16 7.043 -1.537 4.622 1.00 0.00 O ATOM 228 CB PRO A 16 8.684 1.259 3.605 1.00 0.00 C ATOM 229 CG PRO A 16 9.891 1.739 4.305 1.00 0.00 C ATOM 230 CD PRO A 16 9.386 2.408 5.538 1.00 0.00 C ATOM 0 HA PRO A 16 6.690 0.903 4.490 1.00 0.00 H new ATOM 0 HB2 PRO A 16 8.918 0.440 2.924 1.00 0.00 H new ATOM 0 HB3 PRO A 16 8.229 2.050 3.009 1.00 0.00 H new ATOM 0 HG2 PRO A 16 10.559 0.913 4.550 1.00 0.00 H new ATOM 0 HG3 PRO A 16 10.457 2.433 3.684 1.00 0.00 H new ATOM 0 HD2 PRO A 16 10.112 2.360 6.349 1.00 0.00 H new ATOM 0 HD3 PRO A 16 9.170 3.462 5.365 1.00 0.00 H new ATOM 238 N GLN A 17 8.887 -1.092 5.849 1.00 0.00 N ATOM 239 CA GLN A 17 9.111 -2.496 6.237 1.00 0.00 C ATOM 240 C GLN A 17 7.931 -3.016 7.066 1.00 0.00 C ATOM 241 O GLN A 17 7.309 -4.039 6.741 1.00 0.00 O ATOM 242 CB GLN A 17 10.406 -2.627 7.044 1.00 0.00 C ATOM 243 CG GLN A 17 10.637 -4.031 7.609 1.00 0.00 C ATOM 244 CD GLN A 17 11.864 -4.127 8.486 1.00 0.00 C ATOM 245 OE1 GLN A 17 12.266 -3.161 9.121 1.00 0.00 O ATOM 246 NE2 GLN A 17 12.445 -5.295 8.558 1.00 0.00 N ATOM 0 H GLN A 17 9.566 -0.438 6.239 1.00 0.00 H new ATOM 0 HA GLN A 17 9.197 -3.092 5.329 1.00 0.00 H new ATOM 0 HB2 GLN A 17 11.249 -2.357 6.408 1.00 0.00 H new ATOM 0 HB3 GLN A 17 10.385 -1.912 7.867 1.00 0.00 H new ATOM 0 HG2 GLN A 17 9.762 -4.332 8.186 1.00 0.00 H new ATOM 0 HG3 GLN A 17 10.733 -4.736 6.783 1.00 0.00 H new ATOM 0 HE21 GLN A 17 12.083 -6.079 8.015 1.00 0.00 H new ATOM 0 HE22 GLN A 17 13.260 -5.423 9.157 1.00 0.00 H new ATOM 255 N ASP A 18 7.614 -2.276 8.102 1.00 0.00 N ATOM 256 CA ASP A 18 6.511 -2.577 9.004 1.00 0.00 C ATOM 257 C ASP A 18 5.192 -2.507 8.274 1.00 0.00 C ATOM 258 O ASP A 18 4.222 -3.193 8.636 1.00 0.00 O ATOM 259 CB ASP A 18 6.532 -1.634 10.213 1.00 0.00 C ATOM 260 CG ASP A 18 5.320 -1.736 11.095 1.00 0.00 C ATOM 261 OD1 ASP A 18 5.156 -2.738 11.810 1.00 0.00 O ATOM 262 OD2 ASP A 18 4.522 -0.782 11.116 1.00 0.00 O ATOM 0 H ASP A 18 8.122 -1.428 8.353 1.00 0.00 H new ATOM 0 HA ASP A 18 6.632 -3.595 9.373 1.00 0.00 H new ATOM 0 HB2 ASP A 18 7.420 -1.845 10.809 1.00 0.00 H new ATOM 0 HB3 ASP A 18 6.623 -0.608 9.858 1.00 0.00 H new ATOM 267 N PHE A 19 5.154 -1.678 7.231 1.00 0.00 N ATOM 268 CA PHE A 19 3.955 -1.495 6.445 1.00 0.00 C ATOM 269 C PHE A 19 3.590 -2.809 5.781 1.00 0.00 C ATOM 270 O PHE A 19 2.427 -3.173 5.704 1.00 0.00 O ATOM 271 CB PHE A 19 4.169 -0.411 5.401 1.00 0.00 C ATOM 272 CG PHE A 19 2.908 0.222 4.949 1.00 0.00 C ATOM 273 CD1 PHE A 19 2.135 0.906 5.867 1.00 0.00 C ATOM 274 CD2 PHE A 19 2.495 0.170 3.626 1.00 0.00 C ATOM 275 CE1 PHE A 19 0.976 1.526 5.496 1.00 0.00 C ATOM 276 CE2 PHE A 19 1.322 0.793 3.252 1.00 0.00 C ATOM 277 CZ PHE A 19 0.567 1.472 4.194 1.00 0.00 C ATOM 0 H PHE A 19 5.950 -1.124 6.917 1.00 0.00 H new ATOM 0 HA PHE A 19 3.138 -1.182 7.095 1.00 0.00 H new ATOM 0 HB2 PHE A 19 4.826 0.356 5.812 1.00 0.00 H new ATOM 0 HB3 PHE A 19 4.681 -0.841 4.540 1.00 0.00 H new ATOM 0 HD1 PHE A 19 2.453 0.951 6.898 1.00 0.00 H new ATOM 0 HD2 PHE A 19 3.088 -0.355 2.892 1.00 0.00 H new ATOM 0 HE1 PHE A 19 0.386 2.056 6.229 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.992 0.751 2.224 1.00 0.00 H new ATOM 0 HZ PHE A 19 -0.349 1.961 3.898 1.00 0.00 H new ATOM 287 N LEU A 20 4.603 -3.521 5.341 1.00 0.00 N ATOM 288 CA LEU A 20 4.426 -4.831 4.756 1.00 0.00 C ATOM 289 C LEU A 20 4.047 -5.831 5.805 1.00 0.00 C ATOM 290 O LEU A 20 3.092 -6.555 5.656 1.00 0.00 O ATOM 291 CB LEU A 20 5.707 -5.302 4.113 1.00 0.00 C ATOM 292 CG LEU A 20 6.216 -4.479 2.972 1.00 0.00 C ATOM 293 CD1 LEU A 20 7.542 -5.028 2.502 1.00 0.00 C ATOM 294 CD2 LEU A 20 5.205 -4.475 1.847 1.00 0.00 C ATOM 0 H LEU A 20 5.573 -3.208 5.379 1.00 0.00 H new ATOM 0 HA LEU A 20 3.636 -4.750 4.010 1.00 0.00 H new ATOM 0 HB2 LEU A 20 6.481 -5.340 4.880 1.00 0.00 H new ATOM 0 HB3 LEU A 20 5.558 -6.322 3.759 1.00 0.00 H new ATOM 0 HG LEU A 20 6.363 -3.451 3.302 1.00 0.00 H new ATOM 0 HD11 LEU A 20 7.911 -4.427 1.671 1.00 0.00 H new ATOM 0 HD12 LEU A 20 8.261 -4.994 3.321 1.00 0.00 H new ATOM 0 HD13 LEU A 20 7.413 -6.060 2.174 1.00 0.00 H new ATOM 0 HD21 LEU A 20 5.583 -3.874 1.020 1.00 0.00 H new ATOM 0 HD22 LEU A 20 5.037 -5.496 1.506 1.00 0.00 H new ATOM 0 HD23 LEU A 20 4.266 -4.052 2.203 1.00 0.00 H new ATOM 306 N LEU A 21 4.788 -5.832 6.891 1.00 0.00 N ATOM 307 CA LEU A 21 4.635 -6.829 7.948 1.00 0.00 C ATOM 308 C LEU A 21 3.234 -6.843 8.578 1.00 0.00 C ATOM 309 O LEU A 21 2.833 -7.842 9.170 1.00 0.00 O ATOM 310 CB LEU A 21 5.691 -6.634 9.025 1.00 0.00 C ATOM 311 CG LEU A 21 7.145 -6.716 8.559 1.00 0.00 C ATOM 312 CD1 LEU A 21 8.092 -6.385 9.695 1.00 0.00 C ATOM 313 CD2 LEU A 21 7.451 -8.095 8.019 1.00 0.00 C ATOM 0 H LEU A 21 5.518 -5.143 7.074 1.00 0.00 H new ATOM 0 HA LEU A 21 4.772 -7.799 7.470 1.00 0.00 H new ATOM 0 HB2 LEU A 21 5.533 -5.660 9.489 1.00 0.00 H new ATOM 0 HB3 LEU A 21 5.535 -7.385 9.799 1.00 0.00 H new ATOM 0 HG LEU A 21 7.286 -5.985 7.763 1.00 0.00 H new ATOM 0 HD11 LEU A 21 9.121 -6.449 9.341 1.00 0.00 H new ATOM 0 HD12 LEU A 21 7.893 -5.374 10.051 1.00 0.00 H new ATOM 0 HD13 LEU A 21 7.944 -7.093 10.510 1.00 0.00 H new ATOM 0 HD21 LEU A 21 8.490 -8.135 7.692 1.00 0.00 H new ATOM 0 HD22 LEU A 21 7.288 -8.836 8.801 1.00 0.00 H new ATOM 0 HD23 LEU A 21 6.796 -8.309 7.174 1.00 0.00 H new ATOM 325 N LYS A 22 2.484 -5.768 8.418 1.00 0.00 N ATOM 326 CA LYS A 22 1.150 -5.695 8.989 1.00 0.00 C ATOM 327 C LYS A 22 0.096 -6.121 7.982 1.00 0.00 C ATOM 328 O LYS A 22 -1.097 -6.200 8.300 1.00 0.00 O ATOM 329 CB LYS A 22 0.850 -4.302 9.475 1.00 0.00 C ATOM 330 CG LYS A 22 0.828 -3.266 8.388 1.00 0.00 C ATOM 331 CD LYS A 22 0.400 -1.924 8.911 1.00 0.00 C ATOM 332 CE LYS A 22 1.539 -1.133 9.601 1.00 0.00 C ATOM 333 NZ LYS A 22 2.095 -1.785 10.817 1.00 0.00 N ATOM 0 H LYS A 22 2.773 -4.938 7.901 1.00 0.00 H new ATOM 0 HA LYS A 22 1.121 -6.381 9.835 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -0.116 -4.305 9.979 1.00 0.00 H new ATOM 0 HB3 LYS A 22 1.596 -4.019 10.217 1.00 0.00 H new ATOM 0 HG2 LYS A 22 1.819 -3.184 7.943 1.00 0.00 H new ATOM 0 HG3 LYS A 22 0.148 -3.582 7.597 1.00 0.00 H new ATOM 0 HD2 LYS A 22 0.006 -1.331 8.086 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -0.415 -2.064 9.621 1.00 0.00 H new ATOM 0 HE2 LYS A 22 2.346 -0.983 8.884 1.00 0.00 H new ATOM 0 HE3 LYS A 22 1.166 -0.146 9.872 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 2.777 -1.146 11.272 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 1.323 -1.997 11.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 2.574 -2.669 10.549 1.00 0.00 H new ATOM 347 N MET A 23 0.529 -6.395 6.776 1.00 0.00 N ATOM 348 CA MET A 23 -0.374 -6.804 5.734 1.00 0.00 C ATOM 349 C MET A 23 -0.643 -8.300 5.893 1.00 0.00 C ATOM 350 O MET A 23 0.258 -9.052 6.315 1.00 0.00 O ATOM 351 CB MET A 23 0.229 -6.560 4.342 1.00 0.00 C ATOM 352 CG MET A 23 0.636 -5.126 4.026 1.00 0.00 C ATOM 353 SD MET A 23 1.267 -4.987 2.340 1.00 0.00 S ATOM 354 CE MET A 23 1.609 -3.242 2.201 1.00 0.00 C ATOM 0 H MET A 23 1.507 -6.341 6.493 1.00 0.00 H new ATOM 0 HA MET A 23 -1.292 -6.222 5.818 1.00 0.00 H new ATOM 0 HB2 MET A 23 1.107 -7.197 4.233 1.00 0.00 H new ATOM 0 HB3 MET A 23 -0.495 -6.883 3.594 1.00 0.00 H new ATOM 0 HG2 MET A 23 -0.221 -4.465 4.153 1.00 0.00 H new ATOM 0 HG3 MET A 23 1.399 -4.797 4.732 1.00 0.00 H new ATOM 0 HE1 MET A 23 2.401 -3.084 1.469 1.00 0.00 H new ATOM 0 HE2 MET A 23 0.708 -2.719 1.879 1.00 0.00 H new ATOM 0 HE3 MET A 23 1.927 -2.855 3.169 1.00 0.00 H new ATOM 364 N PRO A 24 -1.866 -8.759 5.629 1.00 0.00 N ATOM 365 CA PRO A 24 -2.176 -10.182 5.680 1.00 0.00 C ATOM 366 C PRO A 24 -1.474 -10.925 4.542 1.00 0.00 C ATOM 367 O PRO A 24 -1.658 -10.595 3.374 1.00 0.00 O ATOM 368 CB PRO A 24 -3.702 -10.238 5.505 1.00 0.00 C ATOM 369 CG PRO A 24 -4.067 -8.952 4.848 1.00 0.00 C ATOM 370 CD PRO A 24 -3.041 -7.941 5.276 1.00 0.00 C ATOM 0 HA PRO A 24 -1.843 -10.653 6.605 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -3.997 -11.090 4.893 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -4.205 -10.346 6.466 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -4.075 -9.060 3.763 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -5.068 -8.637 5.144 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -2.813 -7.239 4.474 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -3.389 -7.353 6.125 1.00 0.00 H new ATOM 378 N GLY A 25 -0.662 -11.900 4.882 1.00 0.00 N ATOM 379 CA GLY A 25 0.045 -12.634 3.874 1.00 0.00 C ATOM 380 C GLY A 25 1.540 -12.367 3.924 1.00 0.00 C ATOM 381 O GLY A 25 2.306 -12.928 3.153 1.00 0.00 O ATOM 0 H GLY A 25 -0.480 -12.196 5.841 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -0.138 -13.700 4.006 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -0.340 -12.363 2.891 1.00 0.00 H new ATOM 385 N VAL A 26 1.958 -11.529 4.835 1.00 0.00 N ATOM 386 CA VAL A 26 3.349 -11.149 4.912 1.00 0.00 C ATOM 387 C VAL A 26 4.029 -11.684 6.171 1.00 0.00 C ATOM 388 O VAL A 26 3.459 -11.671 7.267 1.00 0.00 O ATOM 389 CB VAL A 26 3.522 -9.600 4.819 1.00 0.00 C ATOM 390 CG1 VAL A 26 4.982 -9.176 4.995 1.00 0.00 C ATOM 391 CG2 VAL A 26 2.991 -9.088 3.488 1.00 0.00 C ATOM 0 H VAL A 26 1.357 -11.095 5.536 1.00 0.00 H new ATOM 0 HA VAL A 26 3.841 -11.606 4.053 1.00 0.00 H new ATOM 0 HB VAL A 26 2.947 -9.160 5.634 1.00 0.00 H new ATOM 0 HG11 VAL A 26 5.057 -8.091 4.923 1.00 0.00 H new ATOM 0 HG12 VAL A 26 5.340 -9.501 5.972 1.00 0.00 H new ATOM 0 HG13 VAL A 26 5.590 -9.634 4.215 1.00 0.00 H new ATOM 0 HG21 VAL A 26 3.118 -8.007 3.437 1.00 0.00 H new ATOM 0 HG22 VAL A 26 3.541 -9.557 2.672 1.00 0.00 H new ATOM 0 HG23 VAL A 26 1.933 -9.333 3.400 1.00 0.00 H new ATOM 401 N ASN A 27 5.244 -12.144 5.988 1.00 0.00 N ATOM 402 CA ASN A 27 6.114 -12.607 7.050 1.00 0.00 C ATOM 403 C ASN A 27 7.403 -11.889 6.857 1.00 0.00 C ATOM 404 O ASN A 27 7.698 -11.478 5.742 1.00 0.00 O ATOM 405 CB ASN A 27 6.412 -14.115 6.977 1.00 0.00 C ATOM 406 CG ASN A 27 5.213 -14.996 7.159 1.00 0.00 C ATOM 407 OD1 ASN A 27 4.839 -15.345 8.279 1.00 0.00 O ATOM 408 ND2 ASN A 27 4.639 -15.411 6.087 1.00 0.00 N ATOM 0 H ASN A 27 5.672 -12.210 5.064 1.00 0.00 H new ATOM 0 HA ASN A 27 5.630 -12.420 8.009 1.00 0.00 H new ATOM 0 HB2 ASN A 27 6.866 -14.336 6.011 1.00 0.00 H new ATOM 0 HB3 ASN A 27 7.149 -14.364 7.740 1.00 0.00 H new ATOM 0 HD21 ASN A 27 3.847 -16.050 6.148 1.00 0.00 H new ATOM 0 HD22 ASN A 27 4.976 -15.101 5.175 1.00 0.00 H new ATOM 415 N ALA A 28 8.194 -11.768 7.882 1.00 0.00 N ATOM 416 CA ALA A 28 9.461 -11.057 7.788 1.00 0.00 C ATOM 417 C ALA A 28 10.409 -11.691 6.766 1.00 0.00 C ATOM 418 O ALA A 28 11.248 -11.001 6.174 1.00 0.00 O ATOM 419 CB ALA A 28 10.112 -10.941 9.149 1.00 0.00 C ATOM 0 H ALA A 28 7.993 -12.152 8.806 1.00 0.00 H new ATOM 0 HA ALA A 28 9.243 -10.052 7.427 1.00 0.00 H new ATOM 0 HB1 ALA A 28 11.057 -10.406 9.056 1.00 0.00 H new ATOM 0 HB2 ALA A 28 9.452 -10.395 9.823 1.00 0.00 H new ATOM 0 HB3 ALA A 28 10.297 -11.938 9.550 1.00 0.00 H new ATOM 425 N LYS A 29 10.222 -12.979 6.498 1.00 0.00 N ATOM 426 CA LYS A 29 11.082 -13.673 5.570 1.00 0.00 C ATOM 427 C LYS A 29 10.731 -13.287 4.133 1.00 0.00 C ATOM 428 O LYS A 29 11.609 -13.000 3.304 1.00 0.00 O ATOM 429 CB LYS A 29 11.009 -15.204 5.776 1.00 0.00 C ATOM 430 CG LYS A 29 9.640 -15.837 5.490 1.00 0.00 C ATOM 431 CD LYS A 29 9.619 -17.346 5.758 1.00 0.00 C ATOM 432 CE LYS A 29 10.699 -18.111 4.986 1.00 0.00 C ATOM 433 NZ LYS A 29 10.566 -17.990 3.517 1.00 0.00 N ATOM 0 H LYS A 29 9.486 -13.552 6.911 1.00 0.00 H new ATOM 0 HA LYS A 29 12.111 -13.370 5.763 1.00 0.00 H new ATOM 0 HB2 LYS A 29 11.752 -15.677 5.133 1.00 0.00 H new ATOM 0 HB3 LYS A 29 11.288 -15.430 6.805 1.00 0.00 H new ATOM 0 HG2 LYS A 29 8.884 -15.352 6.107 1.00 0.00 H new ATOM 0 HG3 LYS A 29 9.369 -15.653 4.450 1.00 0.00 H new ATOM 0 HD2 LYS A 29 9.752 -17.521 6.826 1.00 0.00 H new ATOM 0 HD3 LYS A 29 8.640 -17.743 5.490 1.00 0.00 H new ATOM 0 HE2 LYS A 29 11.680 -17.743 5.286 1.00 0.00 H new ATOM 0 HE3 LYS A 29 10.656 -19.165 5.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 11.325 -18.529 3.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 9.643 -18.366 3.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 10.636 -16.989 3.243 1.00 0.00 H new ATOM 447 N ASN A 30 9.461 -13.204 3.849 1.00 0.00 N ATOM 448 CA ASN A 30 9.051 -12.909 2.505 1.00 0.00 C ATOM 449 C ASN A 30 9.028 -11.428 2.267 1.00 0.00 C ATOM 450 O ASN A 30 9.057 -10.987 1.158 1.00 0.00 O ATOM 451 CB ASN A 30 7.733 -13.595 2.118 1.00 0.00 C ATOM 452 CG ASN A 30 6.490 -13.193 2.919 1.00 0.00 C ATOM 453 OD1 ASN A 30 6.348 -12.083 3.386 1.00 0.00 O ATOM 454 ND2 ASN A 30 5.601 -14.118 3.097 1.00 0.00 N ATOM 0 H ASN A 30 8.703 -13.334 4.518 1.00 0.00 H new ATOM 0 HA ASN A 30 9.799 -13.335 1.837 1.00 0.00 H new ATOM 0 HB2 ASN A 30 7.540 -13.392 1.065 1.00 0.00 H new ATOM 0 HB3 ASN A 30 7.868 -14.672 2.216 1.00 0.00 H new ATOM 0 HD21 ASN A 30 4.760 -13.920 3.639 1.00 0.00 H new ATOM 0 HD22 ASN A 30 5.742 -15.045 2.695 1.00 0.00 H new ATOM 461 N CYS A 31 9.003 -10.692 3.343 1.00 0.00 N ATOM 462 CA CYS A 31 9.071 -9.255 3.339 1.00 0.00 C ATOM 463 C CYS A 31 10.440 -8.805 2.830 1.00 0.00 C ATOM 464 O CYS A 31 10.523 -7.976 1.949 1.00 0.00 O ATOM 465 CB CYS A 31 8.813 -8.740 4.760 1.00 0.00 C ATOM 466 SG CYS A 31 8.851 -6.955 4.982 1.00 0.00 S ATOM 0 H CYS A 31 8.932 -11.089 4.280 1.00 0.00 H new ATOM 0 HA CYS A 31 8.312 -8.844 2.673 1.00 0.00 H new ATOM 0 HB2 CYS A 31 7.838 -9.104 5.084 1.00 0.00 H new ATOM 0 HB3 CYS A 31 9.555 -9.183 5.424 1.00 0.00 H new ATOM 0 HG CYS A 31 9.248 -6.676 6.188 1.00 0.00 H new ATOM 472 N ARG A 32 11.514 -9.391 3.363 1.00 0.00 N ATOM 473 CA ARG A 32 12.873 -9.052 2.911 1.00 0.00 C ATOM 474 C ARG A 32 13.055 -9.452 1.444 1.00 0.00 C ATOM 475 O ARG A 32 13.609 -8.688 0.618 1.00 0.00 O ATOM 476 CB ARG A 32 13.938 -9.702 3.821 1.00 0.00 C ATOM 477 CG ARG A 32 13.878 -11.215 3.885 1.00 0.00 C ATOM 478 CD ARG A 32 14.949 -11.883 3.032 1.00 0.00 C ATOM 479 NE ARG A 32 14.752 -13.336 2.977 1.00 0.00 N ATOM 480 CZ ARG A 32 15.703 -14.244 2.709 1.00 0.00 C ATOM 481 NH1 ARG A 32 16.956 -13.856 2.454 1.00 0.00 N ATOM 482 NH2 ARG A 32 15.385 -15.540 2.672 1.00 0.00 N ATOM 0 H ARG A 32 11.475 -10.095 4.100 1.00 0.00 H new ATOM 0 HA ARG A 32 13.009 -7.973 2.984 1.00 0.00 H new ATOM 0 HB2 ARG A 32 14.926 -9.406 3.470 1.00 0.00 H new ATOM 0 HB3 ARG A 32 13.826 -9.304 4.830 1.00 0.00 H new ATOM 0 HG2 ARG A 32 13.992 -11.535 4.921 1.00 0.00 H new ATOM 0 HG3 ARG A 32 12.895 -11.550 3.554 1.00 0.00 H new ATOM 0 HD2 ARG A 32 14.924 -11.471 2.023 1.00 0.00 H new ATOM 0 HD3 ARG A 32 15.935 -11.662 3.442 1.00 0.00 H new ATOM 0 HE ARG A 32 13.811 -13.686 3.158 1.00 0.00 H new ATOM 0 HH11 ARG A 32 17.194 -12.864 2.462 1.00 0.00 H new ATOM 0 HH12 ARG A 32 17.674 -14.552 2.251 1.00 0.00 H new ATOM 0 HH21 ARG A 32 14.424 -15.835 2.847 1.00 0.00 H new ATOM 0 HH22 ARG A 32 16.103 -16.236 2.469 1.00 0.00 H new ATOM 496 N SER A 33 12.551 -10.622 1.115 1.00 0.00 N ATOM 497 CA SER A 33 12.569 -11.106 -0.238 1.00 0.00 C ATOM 498 C SER A 33 11.752 -10.155 -1.149 1.00 0.00 C ATOM 499 O SER A 33 12.122 -9.864 -2.306 1.00 0.00 O ATOM 500 CB SER A 33 11.979 -12.499 -0.225 1.00 0.00 C ATOM 501 OG SER A 33 12.715 -13.338 0.657 1.00 0.00 O ATOM 0 H SER A 33 12.118 -11.261 1.782 1.00 0.00 H new ATOM 0 HA SER A 33 13.584 -11.138 -0.634 1.00 0.00 H new ATOM 0 HB2 SER A 33 10.936 -12.457 0.088 1.00 0.00 H new ATOM 0 HB3 SER A 33 11.993 -12.917 -1.232 1.00 0.00 H new ATOM 0 HG SER A 33 12.364 -13.244 1.567 1.00 0.00 H new ATOM 507 N LEU A 34 10.692 -9.622 -0.587 1.00 0.00 N ATOM 508 CA LEU A 34 9.809 -8.715 -1.279 1.00 0.00 C ATOM 509 C LEU A 34 10.532 -7.415 -1.532 1.00 0.00 C ATOM 510 O LEU A 34 10.367 -6.828 -2.546 1.00 0.00 O ATOM 511 CB LEU A 34 8.582 -8.415 -0.447 1.00 0.00 C ATOM 512 CG LEU A 34 7.413 -7.797 -1.192 1.00 0.00 C ATOM 513 CD1 LEU A 34 6.607 -8.846 -1.936 1.00 0.00 C ATOM 514 CD2 LEU A 34 6.561 -6.994 -0.269 1.00 0.00 C ATOM 0 H LEU A 34 10.416 -9.809 0.377 1.00 0.00 H new ATOM 0 HA LEU A 34 9.505 -9.183 -2.215 1.00 0.00 H new ATOM 0 HB2 LEU A 34 8.244 -9.342 0.015 1.00 0.00 H new ATOM 0 HB3 LEU A 34 8.870 -7.742 0.361 1.00 0.00 H new ATOM 0 HG LEU A 34 7.816 -7.118 -1.944 1.00 0.00 H new ATOM 0 HD11 LEU A 34 5.779 -8.366 -2.457 1.00 0.00 H new ATOM 0 HD12 LEU A 34 7.247 -9.351 -2.659 1.00 0.00 H new ATOM 0 HD13 LEU A 34 6.216 -9.575 -1.226 1.00 0.00 H new ATOM 0 HD21 LEU A 34 5.730 -6.561 -0.825 1.00 0.00 H new ATOM 0 HD22 LEU A 34 6.173 -7.638 0.521 1.00 0.00 H new ATOM 0 HD23 LEU A 34 7.156 -6.196 0.174 1.00 0.00 H new ATOM 526 N MET A 35 11.379 -7.012 -0.595 1.00 0.00 N ATOM 527 CA MET A 35 12.159 -5.766 -0.712 1.00 0.00 C ATOM 528 C MET A 35 13.062 -5.832 -1.890 1.00 0.00 C ATOM 529 O MET A 35 13.415 -4.823 -2.497 1.00 0.00 O ATOM 530 CB MET A 35 13.000 -5.557 0.512 1.00 0.00 C ATOM 531 CG MET A 35 12.183 -5.485 1.730 1.00 0.00 C ATOM 532 SD MET A 35 13.136 -5.476 3.209 1.00 0.00 S ATOM 533 CE MET A 35 11.772 -5.494 4.318 1.00 0.00 C ATOM 0 H MET A 35 11.552 -7.529 0.267 1.00 0.00 H new ATOM 0 HA MET A 35 11.456 -4.941 -0.825 1.00 0.00 H new ATOM 0 HB2 MET A 35 13.717 -6.372 0.603 1.00 0.00 H new ATOM 0 HB3 MET A 35 13.575 -4.637 0.405 1.00 0.00 H new ATOM 0 HG2 MET A 35 11.571 -4.584 1.695 1.00 0.00 H new ATOM 0 HG3 MET A 35 11.500 -6.334 1.751 1.00 0.00 H new ATOM 0 HE1 MET A 35 11.888 -4.695 5.050 1.00 0.00 H new ATOM 0 HE2 MET A 35 10.848 -5.344 3.760 1.00 0.00 H new ATOM 0 HE3 MET A 35 11.733 -6.455 4.832 1.00 0.00 H new ATOM 543 N HIS A 36 13.475 -7.026 -2.185 1.00 0.00 N ATOM 544 CA HIS A 36 14.312 -7.251 -3.322 1.00 0.00 C ATOM 545 C HIS A 36 13.546 -7.430 -4.614 1.00 0.00 C ATOM 546 O HIS A 36 14.110 -7.259 -5.680 1.00 0.00 O ATOM 547 CB HIS A 36 15.306 -8.375 -3.084 1.00 0.00 C ATOM 548 CG HIS A 36 16.457 -7.937 -2.250 1.00 0.00 C ATOM 549 ND1 HIS A 36 17.762 -8.105 -2.627 1.00 0.00 N ATOM 550 CD2 HIS A 36 16.489 -7.279 -1.068 1.00 0.00 C ATOM 551 CE1 HIS A 36 18.548 -7.566 -1.727 1.00 0.00 C ATOM 552 NE2 HIS A 36 17.804 -7.059 -0.771 1.00 0.00 N ATOM 0 H HIS A 36 13.244 -7.864 -1.651 1.00 0.00 H new ATOM 0 HA HIS A 36 14.885 -6.333 -3.450 1.00 0.00 H new ATOM 0 HB2 HIS A 36 14.801 -9.208 -2.595 1.00 0.00 H new ATOM 0 HB3 HIS A 36 15.673 -8.743 -4.042 1.00 0.00 H new ATOM 0 HD2 HIS A 36 15.637 -6.984 -0.473 1.00 0.00 H new ATOM 0 HE1 HIS A 36 19.627 -7.543 -1.765 1.00 0.00 H new ATOM 0 HE2 HIS A 36 18.152 -6.579 0.059 1.00 0.00 H new ATOM 561 N HIS A 37 12.283 -7.776 -4.543 1.00 0.00 N ATOM 562 CA HIS A 37 11.504 -7.939 -5.781 1.00 0.00 C ATOM 563 C HIS A 37 10.547 -6.780 -6.033 1.00 0.00 C ATOM 564 O HIS A 37 10.044 -6.598 -7.151 1.00 0.00 O ATOM 565 CB HIS A 37 10.749 -9.270 -5.808 1.00 0.00 C ATOM 566 CG HIS A 37 11.609 -10.474 -6.063 1.00 0.00 C ATOM 567 ND1 HIS A 37 11.681 -11.099 -7.289 1.00 0.00 N ATOM 568 CD2 HIS A 37 12.412 -11.183 -5.244 1.00 0.00 C ATOM 569 CE1 HIS A 37 12.487 -12.132 -7.208 1.00 0.00 C ATOM 570 NE2 HIS A 37 12.941 -12.205 -5.985 1.00 0.00 N ATOM 0 H HIS A 37 11.771 -7.949 -3.678 1.00 0.00 H new ATOM 0 HA HIS A 37 12.233 -7.941 -6.591 1.00 0.00 H new ATOM 0 HB2 HIS A 37 10.237 -9.401 -4.855 1.00 0.00 H new ATOM 0 HB3 HIS A 37 9.980 -9.220 -6.578 1.00 0.00 H new ATOM 0 HD2 HIS A 37 12.602 -10.982 -4.200 1.00 0.00 H new ATOM 0 HE1 HIS A 37 12.733 -12.807 -8.015 1.00 0.00 H new ATOM 0 HE2 HIS A 37 13.588 -12.913 -5.637 1.00 0.00 H new ATOM 579 N VAL A 38 10.318 -6.006 -5.022 1.00 0.00 N ATOM 580 CA VAL A 38 9.372 -4.921 -5.055 1.00 0.00 C ATOM 581 C VAL A 38 10.040 -3.652 -4.551 1.00 0.00 C ATOM 582 O VAL A 38 10.825 -3.688 -3.600 1.00 0.00 O ATOM 583 CB VAL A 38 8.132 -5.230 -4.147 1.00 0.00 C ATOM 584 CG1 VAL A 38 7.133 -4.109 -4.169 1.00 0.00 C ATOM 585 CG2 VAL A 38 7.455 -6.518 -4.558 1.00 0.00 C ATOM 0 H VAL A 38 10.792 -6.108 -4.125 1.00 0.00 H new ATOM 0 HA VAL A 38 9.035 -4.793 -6.084 1.00 0.00 H new ATOM 0 HB VAL A 38 8.510 -5.338 -3.130 1.00 0.00 H new ATOM 0 HG11 VAL A 38 6.289 -4.361 -3.528 1.00 0.00 H new ATOM 0 HG12 VAL A 38 7.604 -3.195 -3.806 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.781 -3.956 -5.189 1.00 0.00 H new ATOM 0 HG21 VAL A 38 6.599 -6.703 -3.908 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.116 -6.437 -5.591 1.00 0.00 H new ATOM 0 HG23 VAL A 38 8.161 -7.344 -4.472 1.00 0.00 H new ATOM 595 N LYS A 39 9.759 -2.555 -5.206 1.00 0.00 N ATOM 596 CA LYS A 39 10.266 -1.271 -4.791 1.00 0.00 C ATOM 597 C LYS A 39 9.564 -0.834 -3.502 1.00 0.00 C ATOM 598 O LYS A 39 10.166 -0.823 -2.436 1.00 0.00 O ATOM 599 CB LYS A 39 10.046 -0.264 -5.905 1.00 0.00 C ATOM 600 CG LYS A 39 10.593 1.113 -5.645 1.00 0.00 C ATOM 601 CD LYS A 39 10.472 1.982 -6.875 1.00 0.00 C ATOM 602 CE LYS A 39 9.035 2.319 -7.214 1.00 0.00 C ATOM 603 NZ LYS A 39 8.963 3.104 -8.464 1.00 0.00 N ATOM 0 H LYS A 39 9.173 -2.526 -6.041 1.00 0.00 H new ATOM 0 HA LYS A 39 11.335 -1.336 -4.589 1.00 0.00 H new ATOM 0 HB2 LYS A 39 10.500 -0.651 -6.817 1.00 0.00 H new ATOM 0 HB3 LYS A 39 8.975 -0.182 -6.092 1.00 0.00 H new ATOM 0 HG2 LYS A 39 10.054 1.572 -4.816 1.00 0.00 H new ATOM 0 HG3 LYS A 39 11.639 1.043 -5.346 1.00 0.00 H new ATOM 0 HD2 LYS A 39 11.030 2.905 -6.719 1.00 0.00 H new ATOM 0 HD3 LYS A 39 10.931 1.472 -7.722 1.00 0.00 H new ATOM 0 HE2 LYS A 39 8.457 1.401 -7.321 1.00 0.00 H new ATOM 0 HE3 LYS A 39 8.587 2.885 -6.397 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 7.970 3.325 -8.679 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 9.497 3.989 -8.349 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 9.371 2.552 -9.245 1.00 0.00 H new ATOM 617 N ASN A 40 8.294 -0.509 -3.607 1.00 0.00 N ATOM 618 CA ASN A 40 7.487 -0.148 -2.484 1.00 0.00 C ATOM 619 C ASN A 40 6.030 -0.456 -2.875 1.00 0.00 C ATOM 620 O ASN A 40 5.826 -1.151 -3.883 1.00 0.00 O ATOM 621 CB ASN A 40 7.738 1.345 -2.078 1.00 0.00 C ATOM 622 CG ASN A 40 6.969 1.775 -0.811 1.00 0.00 C ATOM 623 OD1 ASN A 40 5.880 2.264 -0.890 1.00 0.00 O ATOM 624 ND2 ASN A 40 7.513 1.551 0.340 1.00 0.00 N ATOM 0 H ASN A 40 7.793 -0.491 -4.495 1.00 0.00 H new ATOM 0 HA ASN A 40 7.740 -0.720 -1.591 1.00 0.00 H new ATOM 0 HB2 ASN A 40 8.805 1.494 -1.914 1.00 0.00 H new ATOM 0 HB3 ASN A 40 7.449 1.992 -2.906 1.00 0.00 H new ATOM 0 HD21 ASN A 40 7.013 1.792 1.196 1.00 0.00 H new ATOM 0 HD22 ASN A 40 8.442 1.133 0.392 1.00 0.00 H new ATOM 631 N ILE A 41 5.069 0.060 -2.119 1.00 0.00 N ATOM 632 CA ILE A 41 3.625 -0.127 -2.261 1.00 0.00 C ATOM 633 C ILE A 41 3.192 -0.161 -3.723 1.00 0.00 C ATOM 634 O ILE A 41 2.457 -1.062 -4.129 1.00 0.00 O ATOM 635 CB ILE A 41 2.914 1.069 -1.601 1.00 0.00 C ATOM 636 CG1 ILE A 41 3.195 1.122 -0.100 1.00 0.00 C ATOM 637 CG2 ILE A 41 1.403 1.053 -1.863 1.00 0.00 C ATOM 638 CD1 ILE A 41 2.650 2.359 0.570 1.00 0.00 C ATOM 0 H ILE A 41 5.293 0.667 -1.330 1.00 0.00 H new ATOM 0 HA ILE A 41 3.365 -1.077 -1.795 1.00 0.00 H new ATOM 0 HB ILE A 41 3.321 1.970 -2.060 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.762 0.241 0.374 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.272 1.075 0.062 1.00 0.00 H new ATOM 0 HG21 ILE A 41 0.941 1.914 -1.380 1.00 0.00 H new ATOM 0 HG22 ILE A 41 1.219 1.098 -2.936 1.00 0.00 H new ATOM 0 HG23 ILE A 41 0.973 0.136 -1.459 1.00 0.00 H new ATOM 0 HD11 ILE A 41 2.886 2.330 1.634 1.00 0.00 H new ATOM 0 HD12 ILE A 41 3.101 3.244 0.122 1.00 0.00 H new ATOM 0 HD13 ILE A 41 1.569 2.397 0.439 1.00 0.00 H new ATOM 650 N ALA A 42 3.673 0.826 -4.506 1.00 0.00 N ATOM 651 CA ALA A 42 3.316 0.925 -5.930 1.00 0.00 C ATOM 652 C ALA A 42 3.553 -0.375 -6.694 1.00 0.00 C ATOM 653 O ALA A 42 2.636 -0.911 -7.297 1.00 0.00 O ATOM 654 CB ALA A 42 4.049 2.070 -6.579 1.00 0.00 C ATOM 0 H ALA A 42 4.303 1.558 -4.178 1.00 0.00 H new ATOM 0 HA ALA A 42 2.244 1.118 -5.974 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.773 2.129 -7.632 1.00 0.00 H new ATOM 0 HB2 ALA A 42 3.781 3.002 -6.081 1.00 0.00 H new ATOM 0 HB3 ALA A 42 5.124 1.909 -6.494 1.00 0.00 H new ATOM 660 N GLU A 43 4.751 -0.908 -6.595 1.00 0.00 N ATOM 661 CA GLU A 43 5.114 -2.113 -7.324 1.00 0.00 C ATOM 662 C GLU A 43 4.456 -3.323 -6.702 1.00 0.00 C ATOM 663 O GLU A 43 4.131 -4.264 -7.392 1.00 0.00 O ATOM 664 CB GLU A 43 6.626 -2.283 -7.367 1.00 0.00 C ATOM 665 CG GLU A 43 7.395 -1.076 -7.906 1.00 0.00 C ATOM 666 CD GLU A 43 6.904 -0.583 -9.239 1.00 0.00 C ATOM 667 OE1 GLU A 43 7.426 -1.033 -10.274 1.00 0.00 O ATOM 668 OE2 GLU A 43 6.039 0.301 -9.267 1.00 0.00 O ATOM 0 H GLU A 43 5.498 -0.526 -6.014 1.00 0.00 H new ATOM 0 HA GLU A 43 4.757 -2.016 -8.349 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.981 -2.501 -6.360 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.862 -3.150 -7.983 1.00 0.00 H new ATOM 0 HG2 GLU A 43 7.328 -0.263 -7.183 1.00 0.00 H new ATOM 0 HG3 GLU A 43 8.449 -1.339 -7.993 1.00 0.00 H new ATOM 675 N LEU A 44 4.258 -3.283 -5.396 1.00 0.00 N ATOM 676 CA LEU A 44 3.584 -4.358 -4.682 1.00 0.00 C ATOM 677 C LEU A 44 2.175 -4.532 -5.209 1.00 0.00 C ATOM 678 O LEU A 44 1.737 -5.639 -5.506 1.00 0.00 O ATOM 679 CB LEU A 44 3.547 -4.063 -3.174 1.00 0.00 C ATOM 680 CG LEU A 44 2.806 -5.080 -2.305 1.00 0.00 C ATOM 681 CD1 LEU A 44 3.372 -6.474 -2.506 1.00 0.00 C ATOM 682 CD2 LEU A 44 2.896 -4.681 -0.855 1.00 0.00 C ATOM 0 H LEU A 44 4.557 -2.510 -4.802 1.00 0.00 H new ATOM 0 HA LEU A 44 4.141 -5.281 -4.844 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.573 -3.988 -2.814 1.00 0.00 H new ATOM 0 HB3 LEU A 44 3.086 -3.086 -3.027 1.00 0.00 H new ATOM 0 HG LEU A 44 1.758 -5.093 -2.604 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.830 -7.181 -1.878 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.266 -6.762 -3.552 1.00 0.00 H new ATOM 0 HD13 LEU A 44 4.427 -6.481 -2.233 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.366 -5.411 -0.243 1.00 0.00 H new ATOM 0 HD22 LEU A 44 3.942 -4.645 -0.552 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.445 -3.698 -0.720 1.00 0.00 H new ATOM 694 N ALA A 45 1.495 -3.426 -5.369 1.00 0.00 N ATOM 695 CA ALA A 45 0.150 -3.433 -5.831 1.00 0.00 C ATOM 696 C ALA A 45 0.077 -3.562 -7.339 1.00 0.00 C ATOM 697 O ALA A 45 -0.990 -3.813 -7.905 1.00 0.00 O ATOM 698 CB ALA A 45 -0.558 -2.200 -5.352 1.00 0.00 C ATOM 0 H ALA A 45 1.869 -2.496 -5.179 1.00 0.00 H new ATOM 0 HA ALA A 45 -0.352 -4.307 -5.417 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -1.588 -2.210 -5.709 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -0.552 -2.177 -4.262 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -0.050 -1.316 -5.737 1.00 0.00 H new ATOM 704 N ALA A 46 1.209 -3.375 -7.985 1.00 0.00 N ATOM 705 CA ALA A 46 1.300 -3.504 -9.420 1.00 0.00 C ATOM 706 C ALA A 46 1.516 -4.949 -9.800 1.00 0.00 C ATOM 707 O ALA A 46 1.185 -5.374 -10.925 1.00 0.00 O ATOM 708 CB ALA A 46 2.419 -2.641 -9.979 1.00 0.00 C ATOM 0 H ALA A 46 2.088 -3.130 -7.530 1.00 0.00 H new ATOM 0 HA ALA A 46 0.360 -3.159 -9.851 1.00 0.00 H new ATOM 0 HB1 ALA A 46 2.463 -2.759 -11.062 1.00 0.00 H new ATOM 0 HB2 ALA A 46 2.229 -1.596 -9.735 1.00 0.00 H new ATOM 0 HB3 ALA A 46 3.369 -2.948 -9.541 1.00 0.00 H new ATOM 714 N LEU A 47 2.068 -5.713 -8.884 1.00 0.00 N ATOM 715 CA LEU A 47 2.314 -7.093 -9.138 1.00 0.00 C ATOM 716 C LEU A 47 1.025 -7.933 -9.114 1.00 0.00 C ATOM 717 O LEU A 47 -0.043 -7.476 -8.673 1.00 0.00 O ATOM 718 CB LEU A 47 3.356 -7.680 -8.189 1.00 0.00 C ATOM 719 CG LEU A 47 4.762 -7.093 -8.290 1.00 0.00 C ATOM 720 CD1 LEU A 47 5.699 -7.814 -7.354 1.00 0.00 C ATOM 721 CD2 LEU A 47 5.288 -7.149 -9.716 1.00 0.00 C ATOM 0 H LEU A 47 2.351 -5.391 -7.959 1.00 0.00 H new ATOM 0 HA LEU A 47 2.720 -7.140 -10.148 1.00 0.00 H new ATOM 0 HB2 LEU A 47 3.002 -7.548 -7.167 1.00 0.00 H new ATOM 0 HB3 LEU A 47 3.418 -8.753 -8.369 1.00 0.00 H new ATOM 0 HG LEU A 47 4.708 -6.044 -7.998 1.00 0.00 H new ATOM 0 HD11 LEU A 47 6.698 -7.385 -7.437 1.00 0.00 H new ATOM 0 HD12 LEU A 47 5.342 -7.708 -6.329 1.00 0.00 H new ATOM 0 HD13 LEU A 47 5.735 -8.871 -7.618 1.00 0.00 H new ATOM 0 HD21 LEU A 47 6.291 -6.723 -9.751 1.00 0.00 H new ATOM 0 HD22 LEU A 47 5.322 -8.186 -10.051 1.00 0.00 H new ATOM 0 HD23 LEU A 47 4.628 -6.578 -10.370 1.00 0.00 H new ATOM 733 N SER A 48 1.125 -9.134 -9.612 1.00 0.00 N ATOM 734 CA SER A 48 0.019 -10.055 -9.630 1.00 0.00 C ATOM 735 C SER A 48 0.209 -11.084 -8.510 1.00 0.00 C ATOM 736 O SER A 48 1.314 -11.211 -7.961 1.00 0.00 O ATOM 737 CB SER A 48 -0.022 -10.750 -10.994 1.00 0.00 C ATOM 738 OG SER A 48 -0.014 -9.792 -12.050 1.00 0.00 O ATOM 0 H SER A 48 1.983 -9.506 -10.020 1.00 0.00 H new ATOM 0 HA SER A 48 -0.921 -9.528 -9.470 1.00 0.00 H new ATOM 0 HB2 SER A 48 0.835 -11.416 -11.094 1.00 0.00 H new ATOM 0 HB3 SER A 48 -0.916 -11.369 -11.065 1.00 0.00 H new ATOM 0 HG SER A 48 -0.039 -10.256 -12.913 1.00 0.00 H new ATOM 744 N GLN A 49 -0.841 -11.838 -8.195 1.00 0.00 N ATOM 745 CA GLN A 49 -0.797 -12.855 -7.146 1.00 0.00 C ATOM 746 C GLN A 49 0.220 -13.929 -7.515 1.00 0.00 C ATOM 747 O GLN A 49 0.876 -14.513 -6.650 1.00 0.00 O ATOM 748 CB GLN A 49 -2.179 -13.485 -6.958 1.00 0.00 C ATOM 749 CG GLN A 49 -2.252 -14.483 -5.821 1.00 0.00 C ATOM 750 CD GLN A 49 -3.591 -15.189 -5.737 1.00 0.00 C ATOM 751 OE1 GLN A 49 -4.630 -14.631 -6.070 1.00 0.00 O ATOM 752 NE2 GLN A 49 -3.572 -16.424 -5.336 1.00 0.00 N ATOM 0 H GLN A 49 -1.746 -11.762 -8.659 1.00 0.00 H new ATOM 0 HA GLN A 49 -0.499 -12.384 -6.209 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -2.907 -12.693 -6.780 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -2.469 -13.982 -7.883 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -1.463 -15.225 -5.945 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -2.059 -13.968 -4.880 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -2.690 -16.859 -5.066 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -4.439 -16.959 -5.291 1.00 0.00 H new ATOM 761 N ASP A 50 0.361 -14.154 -8.811 1.00 0.00 N ATOM 762 CA ASP A 50 1.328 -15.098 -9.357 1.00 0.00 C ATOM 763 C ASP A 50 2.716 -14.699 -8.925 1.00 0.00 C ATOM 764 O ASP A 50 3.455 -15.499 -8.370 1.00 0.00 O ATOM 765 CB ASP A 50 1.262 -15.111 -10.892 1.00 0.00 C ATOM 766 CG ASP A 50 -0.057 -15.598 -11.427 1.00 0.00 C ATOM 767 OD1 ASP A 50 -1.058 -14.867 -11.324 1.00 0.00 O ATOM 768 OD2 ASP A 50 -0.125 -16.736 -11.954 1.00 0.00 O ATOM 0 H ASP A 50 -0.197 -13.683 -9.523 1.00 0.00 H new ATOM 0 HA ASP A 50 1.092 -16.095 -8.984 1.00 0.00 H new ATOM 0 HB2 ASP A 50 1.448 -14.104 -11.265 1.00 0.00 H new ATOM 0 HB3 ASP A 50 2.059 -15.746 -11.278 1.00 0.00 H new ATOM 773 N GLU A 51 3.011 -13.413 -9.077 1.00 0.00 N ATOM 774 CA GLU A 51 4.308 -12.858 -8.765 1.00 0.00 C ATOM 775 C GLU A 51 4.543 -12.902 -7.277 1.00 0.00 C ATOM 776 O GLU A 51 5.648 -13.156 -6.822 1.00 0.00 O ATOM 777 CB GLU A 51 4.400 -11.425 -9.272 1.00 0.00 C ATOM 778 CG GLU A 51 4.157 -11.297 -10.764 1.00 0.00 C ATOM 779 CD GLU A 51 5.138 -12.112 -11.570 1.00 0.00 C ATOM 780 OE1 GLU A 51 6.267 -11.651 -11.780 1.00 0.00 O ATOM 781 OE2 GLU A 51 4.787 -13.226 -12.010 1.00 0.00 O ATOM 0 H GLU A 51 2.344 -12.725 -9.425 1.00 0.00 H new ATOM 0 HA GLU A 51 5.076 -13.453 -9.259 1.00 0.00 H new ATOM 0 HB2 GLU A 51 3.673 -10.812 -8.739 1.00 0.00 H new ATOM 0 HB3 GLU A 51 5.387 -11.027 -9.037 1.00 0.00 H new ATOM 0 HG2 GLU A 51 3.142 -11.620 -10.995 1.00 0.00 H new ATOM 0 HG3 GLU A 51 4.232 -10.249 -11.055 1.00 0.00 H new ATOM 788 N LEU A 52 3.487 -12.694 -6.516 1.00 0.00 N ATOM 789 CA LEU A 52 3.586 -12.768 -5.078 1.00 0.00 C ATOM 790 C LEU A 52 3.905 -14.189 -4.653 1.00 0.00 C ATOM 791 O LEU A 52 4.671 -14.400 -3.746 1.00 0.00 O ATOM 792 CB LEU A 52 2.317 -12.270 -4.384 1.00 0.00 C ATOM 793 CG LEU A 52 1.909 -10.827 -4.662 1.00 0.00 C ATOM 794 CD1 LEU A 52 0.659 -10.467 -3.887 1.00 0.00 C ATOM 795 CD2 LEU A 52 3.044 -9.859 -4.351 1.00 0.00 C ATOM 0 H LEU A 52 2.556 -12.474 -6.870 1.00 0.00 H new ATOM 0 HA LEU A 52 4.397 -12.108 -4.769 1.00 0.00 H new ATOM 0 HB2 LEU A 52 1.492 -12.920 -4.676 1.00 0.00 H new ATOM 0 HB3 LEU A 52 2.449 -12.386 -3.308 1.00 0.00 H new ATOM 0 HG LEU A 52 1.688 -10.740 -5.726 1.00 0.00 H new ATOM 0 HD11 LEU A 52 0.384 -9.434 -4.099 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -0.156 -11.127 -4.184 1.00 0.00 H new ATOM 0 HD13 LEU A 52 0.847 -10.581 -2.819 1.00 0.00 H new ATOM 0 HD21 LEU A 52 2.720 -8.839 -4.560 1.00 0.00 H new ATOM 0 HD22 LEU A 52 3.317 -9.945 -3.299 1.00 0.00 H new ATOM 0 HD23 LEU A 52 3.908 -10.100 -4.971 1.00 0.00 H new ATOM 807 N THR A 53 3.359 -15.161 -5.355 1.00 0.00 N ATOM 808 CA THR A 53 3.630 -16.551 -5.040 1.00 0.00 C ATOM 809 C THR A 53 5.090 -16.875 -5.372 1.00 0.00 C ATOM 810 O THR A 53 5.732 -17.641 -4.680 1.00 0.00 O ATOM 811 CB THR A 53 2.694 -17.496 -5.814 1.00 0.00 C ATOM 812 OG1 THR A 53 1.347 -17.021 -5.688 1.00 0.00 O ATOM 813 CG2 THR A 53 2.759 -18.908 -5.237 1.00 0.00 C ATOM 0 H THR A 53 2.728 -15.017 -6.143 1.00 0.00 H new ATOM 0 HA THR A 53 3.450 -16.702 -3.975 1.00 0.00 H new ATOM 0 HB THR A 53 3.005 -17.518 -6.858 1.00 0.00 H new ATOM 0 HG1 THR A 53 1.244 -16.190 -6.197 1.00 0.00 H new ATOM 0 HG21 THR A 53 2.090 -19.561 -5.798 1.00 0.00 H new ATOM 0 HG22 THR A 53 3.779 -19.284 -5.310 1.00 0.00 H new ATOM 0 HG23 THR A 53 2.454 -18.888 -4.191 1.00 0.00 H new ATOM 821 N SER A 54 5.613 -16.226 -6.387 1.00 0.00 N ATOM 822 CA SER A 54 6.955 -16.406 -6.805 1.00 0.00 C ATOM 823 C SER A 54 7.948 -15.808 -5.773 1.00 0.00 C ATOM 824 O SER A 54 9.049 -16.342 -5.563 1.00 0.00 O ATOM 825 CB SER A 54 7.096 -15.738 -8.154 1.00 0.00 C ATOM 826 OG SER A 54 6.123 -16.238 -9.063 1.00 0.00 O ATOM 0 H SER A 54 5.095 -15.548 -6.946 1.00 0.00 H new ATOM 0 HA SER A 54 7.193 -17.467 -6.880 1.00 0.00 H new ATOM 0 HB2 SER A 54 6.981 -14.660 -8.046 1.00 0.00 H new ATOM 0 HB3 SER A 54 8.096 -15.913 -8.550 1.00 0.00 H new ATOM 0 HG SER A 54 5.248 -15.852 -8.850 1.00 0.00 H new ATOM 832 N ILE A 55 7.538 -14.724 -5.124 1.00 0.00 N ATOM 833 CA ILE A 55 8.355 -14.042 -4.120 1.00 0.00 C ATOM 834 C ILE A 55 8.207 -14.700 -2.756 1.00 0.00 C ATOM 835 O ILE A 55 9.184 -15.115 -2.143 1.00 0.00 O ATOM 836 CB ILE A 55 7.935 -12.555 -3.982 1.00 0.00 C ATOM 837 CG1 ILE A 55 8.086 -11.837 -5.328 1.00 0.00 C ATOM 838 CG2 ILE A 55 8.765 -11.856 -2.882 1.00 0.00 C ATOM 839 CD1 ILE A 55 7.418 -10.477 -5.388 1.00 0.00 C ATOM 0 H ILE A 55 6.628 -14.290 -5.278 1.00 0.00 H new ATOM 0 HA ILE A 55 9.390 -14.109 -4.454 1.00 0.00 H new ATOM 0 HB ILE A 55 6.887 -12.511 -3.687 1.00 0.00 H new ATOM 0 HG12 ILE A 55 9.147 -11.717 -5.546 1.00 0.00 H new ATOM 0 HG13 ILE A 55 7.669 -12.469 -6.112 1.00 0.00 H new ATOM 0 HG21 ILE A 55 8.456 -10.814 -2.800 1.00 0.00 H new ATOM 0 HG22 ILE A 55 8.602 -12.359 -1.929 1.00 0.00 H new ATOM 0 HG23 ILE A 55 9.823 -11.902 -3.140 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.573 -10.039 -6.374 1.00 0.00 H new ATOM 0 HD12 ILE A 55 6.349 -10.588 -5.204 1.00 0.00 H new ATOM 0 HD13 ILE A 55 7.851 -9.825 -4.629 1.00 0.00 H new ATOM 851 N LEU A 56 6.979 -14.796 -2.302 1.00 0.00 N ATOM 852 CA LEU A 56 6.684 -15.289 -0.975 1.00 0.00 C ATOM 853 C LEU A 56 6.887 -16.794 -0.932 1.00 0.00 C ATOM 854 O LEU A 56 7.322 -17.344 0.067 1.00 0.00 O ATOM 855 CB LEU A 56 5.238 -14.929 -0.573 1.00 0.00 C ATOM 856 CG LEU A 56 4.755 -13.490 -0.910 1.00 0.00 C ATOM 857 CD1 LEU A 56 3.386 -13.242 -0.352 1.00 0.00 C ATOM 858 CD2 LEU A 56 5.709 -12.422 -0.425 1.00 0.00 C ATOM 0 H LEU A 56 6.155 -14.534 -2.843 1.00 0.00 H new ATOM 0 HA LEU A 56 7.362 -14.818 -0.263 1.00 0.00 H new ATOM 0 HB2 LEU A 56 4.565 -15.636 -1.058 1.00 0.00 H new ATOM 0 HB3 LEU A 56 5.137 -15.078 0.502 1.00 0.00 H new ATOM 0 HG LEU A 56 4.721 -13.426 -1.998 1.00 0.00 H new ATOM 0 HD11 LEU A 56 3.070 -12.229 -0.601 1.00 0.00 H new ATOM 0 HD12 LEU A 56 2.683 -13.957 -0.780 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.408 -13.360 0.731 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.319 -11.439 -0.689 1.00 0.00 H new ATOM 0 HD22 LEU A 56 5.814 -12.492 0.658 1.00 0.00 H new ATOM 0 HD23 LEU A 56 6.683 -12.564 -0.894 1.00 0.00 H new ATOM 870 N GLY A 57 6.580 -17.443 -2.029 1.00 0.00 N ATOM 871 CA GLY A 57 6.772 -18.871 -2.145 1.00 0.00 C ATOM 872 C GLY A 57 5.588 -19.664 -1.661 1.00 0.00 C ATOM 873 O GLY A 57 5.616 -20.901 -1.663 1.00 0.00 O ATOM 0 H GLY A 57 6.192 -17.001 -2.862 1.00 0.00 H new ATOM 0 HA2 GLY A 57 6.969 -19.122 -3.187 1.00 0.00 H new ATOM 0 HA3 GLY A 57 7.654 -19.161 -1.575 1.00 0.00 H new ATOM 877 N ASN A 58 4.538 -18.974 -1.254 1.00 0.00 N ATOM 878 CA ASN A 58 3.342 -19.639 -0.755 1.00 0.00 C ATOM 879 C ASN A 58 2.151 -18.932 -1.321 1.00 0.00 C ATOM 880 O ASN A 58 2.066 -17.692 -1.224 1.00 0.00 O ATOM 881 CB ASN A 58 3.214 -19.580 0.793 1.00 0.00 C ATOM 882 CG ASN A 58 4.509 -19.320 1.526 1.00 0.00 C ATOM 883 OD1 ASN A 58 5.284 -20.230 1.829 1.00 0.00 O ATOM 884 ND2 ASN A 58 4.711 -18.080 1.866 1.00 0.00 N ATOM 0 H ASN A 58 4.486 -17.955 -1.258 1.00 0.00 H new ATOM 0 HA ASN A 58 3.404 -20.686 -1.053 1.00 0.00 H new ATOM 0 HB2 ASN A 58 2.501 -18.798 1.055 1.00 0.00 H new ATOM 0 HB3 ASN A 58 2.796 -20.523 1.145 1.00 0.00 H new ATOM 0 HD21 ASN A 58 5.539 -17.828 2.406 1.00 0.00 H new ATOM 0 HD22 ASN A 58 4.042 -17.361 1.592 1.00 0.00 H new ATOM 891 N ALA A 59 1.222 -19.688 -1.863 1.00 0.00 N ATOM 892 CA ALA A 59 0.007 -19.137 -2.440 1.00 0.00 C ATOM 893 C ALA A 59 -0.866 -18.559 -1.354 1.00 0.00 C ATOM 894 O ALA A 59 -1.630 -17.649 -1.591 1.00 0.00 O ATOM 895 CB ALA A 59 -0.762 -20.203 -3.186 1.00 0.00 C ATOM 0 H ALA A 59 1.284 -20.705 -1.918 1.00 0.00 H new ATOM 0 HA ALA A 59 0.289 -18.350 -3.139 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -1.668 -19.769 -3.610 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -0.142 -20.605 -3.988 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -1.031 -21.005 -2.499 1.00 0.00 H new ATOM 901 N ALA A 60 -0.704 -19.071 -0.146 1.00 0.00 N ATOM 902 CA ALA A 60 -1.478 -18.622 0.995 1.00 0.00 C ATOM 903 C ALA A 60 -1.166 -17.188 1.274 1.00 0.00 C ATOM 904 O ALA A 60 -2.031 -16.377 1.474 1.00 0.00 O ATOM 905 CB ALA A 60 -1.144 -19.436 2.220 1.00 0.00 C ATOM 0 H ALA A 60 -0.033 -19.808 0.070 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.536 -18.743 0.762 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -1.736 -19.082 3.064 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -1.370 -20.486 2.032 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -0.084 -19.329 2.450 1.00 0.00 H new ATOM 911 N ASN A 61 0.090 -16.885 1.240 1.00 0.00 N ATOM 912 CA ASN A 61 0.561 -15.557 1.529 1.00 0.00 C ATOM 913 C ASN A 61 0.226 -14.629 0.379 1.00 0.00 C ATOM 914 O ASN A 61 -0.239 -13.518 0.579 1.00 0.00 O ATOM 915 CB ASN A 61 2.067 -15.574 1.774 1.00 0.00 C ATOM 916 CG ASN A 61 2.519 -16.190 3.097 1.00 0.00 C ATOM 917 OD1 ASN A 61 3.562 -15.856 3.592 1.00 0.00 O ATOM 918 ND2 ASN A 61 1.759 -17.063 3.665 1.00 0.00 N ATOM 0 H ASN A 61 0.828 -17.551 1.010 1.00 0.00 H new ATOM 0 HA ASN A 61 0.067 -15.194 2.430 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.542 -16.120 0.959 1.00 0.00 H new ATOM 0 HB3 ASN A 61 2.435 -14.549 1.728 1.00 0.00 H new ATOM 0 HD21 ASN A 61 2.039 -17.484 4.551 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.878 -17.333 3.228 1.00 0.00 H new ATOM 925 N ALA A 62 0.398 -15.140 -0.824 1.00 0.00 N ATOM 926 CA ALA A 62 0.184 -14.383 -2.049 1.00 0.00 C ATOM 927 C ALA A 62 -1.280 -14.032 -2.237 1.00 0.00 C ATOM 928 O ALA A 62 -1.606 -12.933 -2.678 1.00 0.00 O ATOM 929 CB ALA A 62 0.680 -15.192 -3.228 1.00 0.00 C ATOM 0 H ALA A 62 0.694 -16.103 -0.984 1.00 0.00 H new ATOM 0 HA ALA A 62 0.741 -13.448 -1.979 1.00 0.00 H new ATOM 0 HB1 ALA A 62 0.522 -14.629 -4.148 1.00 0.00 H new ATOM 0 HB2 ALA A 62 1.744 -15.397 -3.107 1.00 0.00 H new ATOM 0 HB3 ALA A 62 0.132 -16.133 -3.280 1.00 0.00 H new ATOM 935 N LYS A 63 -2.162 -14.946 -1.864 1.00 0.00 N ATOM 936 CA LYS A 63 -3.565 -14.746 -2.048 1.00 0.00 C ATOM 937 C LYS A 63 -4.066 -13.760 -1.041 1.00 0.00 C ATOM 938 O LYS A 63 -4.807 -12.850 -1.390 1.00 0.00 O ATOM 939 CB LYS A 63 -4.329 -16.074 -1.962 1.00 0.00 C ATOM 940 CG LYS A 63 -5.834 -15.932 -2.121 1.00 0.00 C ATOM 941 CD LYS A 63 -6.539 -17.267 -2.017 1.00 0.00 C ATOM 942 CE LYS A 63 -8.041 -17.102 -2.171 1.00 0.00 C ATOM 943 NZ LYS A 63 -8.755 -18.386 -2.062 1.00 0.00 N ATOM 0 H LYS A 63 -1.914 -15.835 -1.430 1.00 0.00 H new ATOM 0 HA LYS A 63 -3.738 -14.343 -3.046 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -3.954 -16.748 -2.733 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -4.118 -16.541 -1.000 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -6.218 -15.258 -1.356 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -6.056 -15.478 -3.087 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -6.163 -17.942 -2.786 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -6.317 -17.726 -1.054 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -8.410 -16.417 -1.408 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -8.258 -16.648 -3.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -9.777 -18.226 -2.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -8.423 -19.032 -2.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -8.570 -18.808 -1.130 1.00 0.00 H new ATOM 957 N GLN A 64 -3.600 -13.906 0.198 1.00 0.00 N ATOM 958 CA GLN A 64 -3.993 -13.017 1.277 1.00 0.00 C ATOM 959 C GLN A 64 -3.602 -11.586 0.970 1.00 0.00 C ATOM 960 O GLN A 64 -4.403 -10.650 1.155 1.00 0.00 O ATOM 961 CB GLN A 64 -3.387 -13.465 2.605 1.00 0.00 C ATOM 962 CG GLN A 64 -3.914 -14.783 3.097 1.00 0.00 C ATOM 963 CD GLN A 64 -3.381 -15.138 4.460 1.00 0.00 C ATOM 964 OE1 GLN A 64 -3.968 -14.812 5.491 1.00 0.00 O ATOM 965 NE2 GLN A 64 -2.262 -15.795 4.472 1.00 0.00 N ATOM 0 H GLN A 64 -2.946 -14.638 0.475 1.00 0.00 H new ATOM 0 HA GLN A 64 -5.078 -13.063 1.366 1.00 0.00 H new ATOM 0 HB2 GLN A 64 -2.305 -13.535 2.495 1.00 0.00 H new ATOM 0 HB3 GLN A 64 -3.582 -12.702 3.359 1.00 0.00 H new ATOM 0 HG2 GLN A 64 -5.003 -14.746 3.133 1.00 0.00 H new ATOM 0 HG3 GLN A 64 -3.645 -15.567 2.389 1.00 0.00 H new ATOM 0 HE21 GLN A 64 -1.808 -16.046 3.594 1.00 0.00 H new ATOM 0 HE22 GLN A 64 -1.836 -16.061 5.360 1.00 0.00 H new ATOM 974 N LEU A 65 -2.408 -11.428 0.452 1.00 0.00 N ATOM 975 CA LEU A 65 -1.880 -10.137 0.137 1.00 0.00 C ATOM 976 C LEU A 65 -2.585 -9.528 -1.081 1.00 0.00 C ATOM 977 O LEU A 65 -3.094 -8.405 -1.006 1.00 0.00 O ATOM 978 CB LEU A 65 -0.363 -10.235 -0.051 1.00 0.00 C ATOM 979 CG LEU A 65 0.394 -8.927 -0.258 1.00 0.00 C ATOM 980 CD1 LEU A 65 0.066 -7.943 0.851 1.00 0.00 C ATOM 981 CD2 LEU A 65 1.888 -9.204 -0.278 1.00 0.00 C ATOM 0 H LEU A 65 -1.777 -12.201 0.239 1.00 0.00 H new ATOM 0 HA LEU A 65 -2.072 -9.458 0.968 1.00 0.00 H new ATOM 0 HB2 LEU A 65 0.055 -10.734 0.823 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -0.169 -10.879 -0.909 1.00 0.00 H new ATOM 0 HG LEU A 65 0.092 -8.490 -1.210 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.614 -7.015 0.688 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -1.004 -7.737 0.850 1.00 0.00 H new ATOM 0 HD13 LEU A 65 0.352 -8.370 1.812 1.00 0.00 H new ATOM 0 HD21 LEU A 65 2.429 -8.270 -0.426 1.00 0.00 H new ATOM 0 HD22 LEU A 65 2.188 -9.651 0.670 1.00 0.00 H new ATOM 0 HD23 LEU A 65 2.120 -9.890 -1.092 1.00 0.00 H new ATOM 993 N TYR A 66 -2.675 -10.293 -2.182 1.00 0.00 N ATOM 994 CA TYR A 66 -3.323 -9.817 -3.417 1.00 0.00 C ATOM 995 C TYR A 66 -4.776 -9.417 -3.152 1.00 0.00 C ATOM 996 O TYR A 66 -5.271 -8.384 -3.681 1.00 0.00 O ATOM 997 CB TYR A 66 -3.259 -10.912 -4.496 1.00 0.00 C ATOM 998 CG TYR A 66 -3.873 -10.548 -5.838 1.00 0.00 C ATOM 999 CD1 TYR A 66 -3.148 -9.840 -6.785 1.00 0.00 C ATOM 1000 CD2 TYR A 66 -5.166 -10.940 -6.165 1.00 0.00 C ATOM 1001 CE1 TYR A 66 -3.695 -9.532 -8.015 1.00 0.00 C ATOM 1002 CE2 TYR A 66 -5.719 -10.631 -7.388 1.00 0.00 C ATOM 1003 CZ TYR A 66 -4.980 -9.929 -8.310 1.00 0.00 C ATOM 1004 OH TYR A 66 -5.524 -9.623 -9.538 1.00 0.00 O ATOM 0 H TYR A 66 -2.308 -11.243 -2.243 1.00 0.00 H new ATOM 0 HA TYR A 66 -2.789 -8.935 -3.771 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -2.214 -11.180 -4.655 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -3.762 -11.801 -4.116 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -2.140 -9.525 -6.557 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -5.748 -11.498 -5.446 1.00 0.00 H new ATOM 0 HE1 TYR A 66 -3.117 -8.982 -8.743 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -6.728 -10.939 -7.621 1.00 0.00 H new ATOM 0 HH TYR A 66 -6.437 -9.975 -9.588 1.00 0.00 H new ATOM 1014 N ASP A 67 -5.442 -10.226 -2.340 1.00 0.00 N ATOM 1015 CA ASP A 67 -6.825 -9.998 -1.939 1.00 0.00 C ATOM 1016 C ASP A 67 -6.963 -8.692 -1.215 1.00 0.00 C ATOM 1017 O ASP A 67 -7.825 -7.896 -1.550 1.00 0.00 O ATOM 1018 CB ASP A 67 -7.336 -11.147 -1.059 1.00 0.00 C ATOM 1019 CG ASP A 67 -8.695 -10.879 -0.454 1.00 0.00 C ATOM 1020 OD1 ASP A 67 -9.709 -10.898 -1.190 1.00 0.00 O ATOM 1021 OD2 ASP A 67 -8.764 -10.629 0.774 1.00 0.00 O ATOM 0 H ASP A 67 -5.033 -11.069 -1.936 1.00 0.00 H new ATOM 0 HA ASP A 67 -7.432 -9.958 -2.844 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -7.385 -12.058 -1.656 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -6.619 -11.328 -0.258 1.00 0.00 H new ATOM 1026 N PHE A 68 -6.076 -8.446 -0.265 1.00 0.00 N ATOM 1027 CA PHE A 68 -6.122 -7.230 0.525 1.00 0.00 C ATOM 1028 C PHE A 68 -5.952 -6.008 -0.381 1.00 0.00 C ATOM 1029 O PHE A 68 -6.762 -5.105 -0.344 1.00 0.00 O ATOM 1030 CB PHE A 68 -5.051 -7.271 1.618 1.00 0.00 C ATOM 1031 CG PHE A 68 -5.110 -6.129 2.599 1.00 0.00 C ATOM 1032 CD1 PHE A 68 -6.189 -5.997 3.459 1.00 0.00 C ATOM 1033 CD2 PHE A 68 -4.092 -5.195 2.666 1.00 0.00 C ATOM 1034 CE1 PHE A 68 -6.250 -4.960 4.366 1.00 0.00 C ATOM 1035 CE2 PHE A 68 -4.147 -4.155 3.576 1.00 0.00 C ATOM 1036 CZ PHE A 68 -5.228 -4.037 4.423 1.00 0.00 C ATOM 0 H PHE A 68 -5.312 -9.077 -0.022 1.00 0.00 H new ATOM 0 HA PHE A 68 -7.094 -7.153 1.012 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -5.146 -8.208 2.166 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -4.069 -7.276 1.146 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -6.993 -6.717 3.418 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -3.245 -5.279 2.001 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -7.097 -4.871 5.030 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -3.343 -3.435 3.623 1.00 0.00 H new ATOM 0 HZ PHE A 68 -5.274 -3.222 5.130 1.00 0.00 H new ATOM 1046 N ILE A 69 -4.938 -6.073 -1.247 1.00 0.00 N ATOM 1047 CA ILE A 69 -4.590 -5.022 -2.242 1.00 0.00 C ATOM 1048 C ILE A 69 -5.791 -4.635 -3.148 1.00 0.00 C ATOM 1049 O ILE A 69 -5.875 -3.478 -3.676 1.00 0.00 O ATOM 1050 CB ILE A 69 -3.405 -5.511 -3.134 1.00 0.00 C ATOM 1051 CG1 ILE A 69 -2.154 -5.740 -2.289 1.00 0.00 C ATOM 1052 CG2 ILE A 69 -3.104 -4.539 -4.272 1.00 0.00 C ATOM 1053 CD1 ILE A 69 -1.019 -6.365 -3.062 1.00 0.00 C ATOM 0 H ILE A 69 -4.310 -6.876 -1.287 1.00 0.00 H new ATOM 0 HA ILE A 69 -4.303 -4.133 -1.681 1.00 0.00 H new ATOM 0 HB ILE A 69 -3.710 -6.457 -3.582 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -1.823 -4.787 -1.877 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -2.406 -6.382 -1.445 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -2.273 -4.920 -4.866 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -3.985 -4.436 -4.905 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -2.838 -3.566 -3.859 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -0.161 -6.500 -2.403 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -1.334 -7.333 -3.452 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -0.741 -5.714 -3.890 1.00 0.00 H new ATOM 1065 N HIS A 70 -6.657 -5.611 -3.395 1.00 0.00 N ATOM 1066 CA HIS A 70 -7.816 -5.411 -4.277 1.00 0.00 C ATOM 1067 C HIS A 70 -9.185 -5.385 -3.565 1.00 0.00 C ATOM 1068 O HIS A 70 -10.207 -5.307 -4.227 1.00 0.00 O ATOM 1069 CB HIS A 70 -7.821 -6.441 -5.404 1.00 0.00 C ATOM 1070 CG HIS A 70 -6.688 -6.266 -6.359 1.00 0.00 C ATOM 1071 ND1 HIS A 70 -5.440 -6.799 -6.147 1.00 0.00 N ATOM 1072 CD2 HIS A 70 -6.608 -5.573 -7.519 1.00 0.00 C ATOM 1073 CE1 HIS A 70 -4.641 -6.435 -7.133 1.00 0.00 C ATOM 1074 NE2 HIS A 70 -5.324 -5.696 -7.973 1.00 0.00 N ATOM 0 H HIS A 70 -6.585 -6.549 -3.001 1.00 0.00 H new ATOM 0 HA HIS A 70 -7.687 -4.409 -4.685 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -7.775 -7.442 -4.974 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -8.762 -6.371 -5.949 1.00 0.00 H new ATOM 0 HD1 HIS A 70 -5.173 -7.383 -5.354 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -7.408 -5.026 -7.996 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -3.599 -6.702 -7.231 1.00 0.00 H new ATOM 1083 N THR A 71 -9.213 -5.410 -2.263 1.00 0.00 N ATOM 1084 CA THR A 71 -10.480 -5.352 -1.548 1.00 0.00 C ATOM 1085 C THR A 71 -10.764 -3.909 -1.174 1.00 0.00 C ATOM 1086 O THR A 71 -10.104 -3.375 -0.311 1.00 0.00 O ATOM 1087 CB THR A 71 -10.442 -6.226 -0.262 1.00 0.00 C ATOM 1088 OG1 THR A 71 -10.271 -7.604 -0.613 1.00 0.00 O ATOM 1089 CG2 THR A 71 -11.710 -6.072 0.571 1.00 0.00 C ATOM 0 H THR A 71 -8.386 -5.470 -1.668 1.00 0.00 H new ATOM 0 HA THR A 71 -11.266 -5.740 -2.195 1.00 0.00 H new ATOM 0 HB THR A 71 -9.600 -5.884 0.339 1.00 0.00 H new ATOM 0 HG1 THR A 71 -9.379 -7.736 -0.997 1.00 0.00 H new ATOM 0 HG21 THR A 71 -11.640 -6.700 1.459 1.00 0.00 H new ATOM 0 HG22 THR A 71 -11.824 -5.030 0.871 1.00 0.00 H new ATOM 0 HG23 THR A 71 -12.573 -6.376 -0.021 1.00 0.00 H new ATOM 1097 N SER A 72 -11.737 -3.282 -1.827 1.00 0.00 N ATOM 1098 CA SER A 72 -12.022 -1.870 -1.580 1.00 0.00 C ATOM 1099 C SER A 72 -12.329 -1.651 -0.105 1.00 0.00 C ATOM 1100 O SER A 72 -12.994 -2.498 0.536 1.00 0.00 O ATOM 1101 CB SER A 72 -13.199 -1.407 -2.413 1.00 0.00 C ATOM 1102 OG SER A 72 -13.079 -1.871 -3.741 1.00 0.00 O ATOM 0 H SER A 72 -12.337 -3.722 -2.525 1.00 0.00 H new ATOM 0 HA SER A 72 -11.142 -1.290 -1.860 1.00 0.00 H new ATOM 0 HB2 SER A 72 -14.128 -1.774 -1.976 1.00 0.00 H new ATOM 0 HB3 SER A 72 -13.251 -0.318 -2.405 1.00 0.00 H new ATOM 0 HG SER A 72 -13.848 -2.437 -3.961 1.00 0.00 H new ATOM 1108 N PHE A 73 -11.879 -0.521 0.429 1.00 0.00 N ATOM 1109 CA PHE A 73 -12.005 -0.225 1.847 1.00 0.00 C ATOM 1110 C PHE A 73 -13.491 -0.181 2.246 1.00 0.00 C ATOM 1111 O PHE A 73 -13.855 -0.443 3.391 1.00 0.00 O ATOM 1112 CB PHE A 73 -11.355 1.123 2.176 1.00 0.00 C ATOM 1113 CG PHE A 73 -10.129 1.504 1.352 1.00 0.00 C ATOM 1114 CD1 PHE A 73 -8.853 1.091 1.698 1.00 0.00 C ATOM 1115 CD2 PHE A 73 -10.276 2.303 0.227 1.00 0.00 C ATOM 1116 CE1 PHE A 73 -7.762 1.458 0.942 1.00 0.00 C ATOM 1117 CE2 PHE A 73 -9.188 2.677 -0.526 1.00 0.00 C ATOM 1118 CZ PHE A 73 -7.932 2.251 -0.173 1.00 0.00 C ATOM 0 H PHE A 73 -11.418 0.213 -0.109 1.00 0.00 H new ATOM 0 HA PHE A 73 -11.498 -1.011 2.406 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -12.106 1.904 2.052 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -11.071 1.118 3.228 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -8.712 0.473 2.572 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -11.262 2.637 -0.062 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -6.774 1.125 1.222 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -9.322 3.305 -1.394 1.00 0.00 H new ATOM 0 HZ PHE A 73 -7.077 2.537 -0.768 1.00 0.00 H new ATOM 1516 N GLY B 115 -9.464 -2.914 8.582 1.00 0.00 N ATOM 1517 CA GLY B 115 -8.359 -3.485 7.857 1.00 0.00 C ATOM 1518 C GLY B 115 -7.876 -2.535 6.771 1.00 0.00 C ATOM 1519 O GLY B 115 -6.824 -1.920 6.908 1.00 0.00 O ATOM 0 HA2 GLY B 115 -7.542 -3.704 8.544 1.00 0.00 H new ATOM 0 HA3 GLY B 115 -8.662 -4.432 7.410 1.00 0.00 H new ATOM 1523 N PRO B 116 -8.646 -2.372 5.703 1.00 0.00 N ATOM 1524 CA PRO B 116 -8.296 -1.472 4.605 1.00 0.00 C ATOM 1525 C PRO B 116 -8.431 0.058 4.964 1.00 0.00 C ATOM 1526 O PRO B 116 -7.550 0.864 4.608 1.00 0.00 O ATOM 1527 CB PRO B 116 -9.287 -1.902 3.508 1.00 0.00 C ATOM 1528 CG PRO B 116 -10.463 -2.397 4.254 1.00 0.00 C ATOM 1529 CD PRO B 116 -9.906 -3.106 5.435 1.00 0.00 C ATOM 0 HA PRO B 116 -7.248 -1.553 4.317 1.00 0.00 H new ATOM 0 HB2 PRO B 116 -9.550 -1.066 2.859 1.00 0.00 H new ATOM 0 HB3 PRO B 116 -8.864 -2.679 2.871 1.00 0.00 H new ATOM 0 HG2 PRO B 116 -11.111 -1.575 4.558 1.00 0.00 H new ATOM 0 HG3 PRO B 116 -11.065 -3.067 3.640 1.00 0.00 H new ATOM 0 HD2 PRO B 116 -10.585 -3.066 6.287 1.00 0.00 H new ATOM 0 HD3 PRO B 116 -9.722 -4.159 5.223 1.00 0.00 H new ATOM 1537 N GLN B 117 -9.496 0.448 5.694 1.00 0.00 N ATOM 1538 CA GLN B 117 -9.729 1.879 6.002 1.00 0.00 C ATOM 1539 C GLN B 117 -8.622 2.439 6.885 1.00 0.00 C ATOM 1540 O GLN B 117 -8.022 3.474 6.582 1.00 0.00 O ATOM 1541 CB GLN B 117 -11.065 2.102 6.711 1.00 0.00 C ATOM 1542 CG GLN B 117 -11.353 3.580 6.972 1.00 0.00 C ATOM 1543 CD GLN B 117 -12.523 3.823 7.883 1.00 0.00 C ATOM 1544 OE1 GLN B 117 -12.803 3.041 8.779 1.00 0.00 O ATOM 1545 NE2 GLN B 117 -13.231 4.903 7.650 1.00 0.00 N ATOM 0 H GLN B 117 -10.195 -0.189 6.075 1.00 0.00 H new ATOM 0 HA GLN B 117 -9.741 2.397 5.043 1.00 0.00 H new ATOM 0 HB2 GLN B 117 -11.868 1.681 6.106 1.00 0.00 H new ATOM 0 HB3 GLN B 117 -11.064 1.563 7.659 1.00 0.00 H new ATOM 0 HG2 GLN B 117 -10.466 4.041 7.406 1.00 0.00 H new ATOM 0 HG3 GLN B 117 -11.538 4.077 6.020 1.00 0.00 H new ATOM 0 HE21 GLN B 117 -12.966 5.533 6.893 1.00 0.00 H new ATOM 0 HE22 GLN B 117 -14.046 5.113 8.226 1.00 0.00 H new ATOM 1554 N ASP B 118 -8.336 1.733 7.966 1.00 0.00 N ATOM 1555 CA ASP B 118 -7.314 2.156 8.915 1.00 0.00 C ATOM 1556 C ASP B 118 -5.949 2.087 8.268 1.00 0.00 C ATOM 1557 O ASP B 118 -5.011 2.792 8.666 1.00 0.00 O ATOM 1558 CB ASP B 118 -7.374 1.354 10.213 1.00 0.00 C ATOM 1559 CG ASP B 118 -6.359 1.781 11.236 1.00 0.00 C ATOM 1560 OD1 ASP B 118 -6.612 2.745 11.974 1.00 0.00 O ATOM 1561 OD2 ASP B 118 -5.287 1.153 11.339 1.00 0.00 O ATOM 0 H ASP B 118 -8.799 0.858 8.211 1.00 0.00 H new ATOM 0 HA ASP B 118 -7.509 3.192 9.191 1.00 0.00 H new ATOM 0 HB2 ASP B 118 -8.371 1.449 10.642 1.00 0.00 H new ATOM 0 HB3 ASP B 118 -7.225 0.299 9.985 1.00 0.00 H new ATOM 1566 N PHE B 119 -5.822 1.196 7.286 1.00 0.00 N ATOM 1567 CA PHE B 119 -4.590 1.049 6.534 1.00 0.00 C ATOM 1568 C PHE B 119 -4.244 2.383 5.877 1.00 0.00 C ATOM 1569 O PHE B 119 -3.097 2.785 5.862 1.00 0.00 O ATOM 1570 CB PHE B 119 -4.735 -0.048 5.484 1.00 0.00 C ATOM 1571 CG PHE B 119 -3.442 -0.563 4.961 1.00 0.00 C ATOM 1572 CD1 PHE B 119 -2.576 -1.222 5.822 1.00 0.00 C ATOM 1573 CD2 PHE B 119 -3.079 -0.407 3.624 1.00 0.00 C ATOM 1574 CE1 PHE B 119 -1.382 -1.718 5.376 1.00 0.00 C ATOM 1575 CE2 PHE B 119 -1.874 -0.910 3.183 1.00 0.00 C ATOM 1576 CZ PHE B 119 -1.031 -1.566 4.062 1.00 0.00 C ATOM 0 H PHE B 119 -6.567 0.563 6.996 1.00 0.00 H new ATOM 0 HA PHE B 119 -3.784 0.761 7.209 1.00 0.00 H new ATOM 0 HB2 PHE B 119 -5.296 -0.877 5.915 1.00 0.00 H new ATOM 0 HB3 PHE B 119 -5.324 0.337 4.651 1.00 0.00 H new ATOM 0 HD1 PHE B 119 -2.849 -1.345 6.860 1.00 0.00 H new ATOM 0 HD2 PHE B 119 -3.738 0.105 2.938 1.00 0.00 H new ATOM 0 HE1 PHE B 119 -0.718 -2.228 6.059 1.00 0.00 H new ATOM 0 HE2 PHE B 119 -1.587 -0.792 2.149 1.00 0.00 H new ATOM 0 HZ PHE B 119 -0.090 -1.961 3.709 1.00 0.00 H new ATOM 1586 N LEU B 120 -5.265 3.069 5.378 1.00 0.00 N ATOM 1587 CA LEU B 120 -5.108 4.411 4.820 1.00 0.00 C ATOM 1588 C LEU B 120 -4.721 5.406 5.902 1.00 0.00 C ATOM 1589 O LEU B 120 -3.747 6.111 5.781 1.00 0.00 O ATOM 1590 CB LEU B 120 -6.413 4.893 4.180 1.00 0.00 C ATOM 1591 CG LEU B 120 -6.909 4.135 2.967 1.00 0.00 C ATOM 1592 CD1 LEU B 120 -8.274 4.664 2.534 1.00 0.00 C ATOM 1593 CD2 LEU B 120 -5.910 4.267 1.836 1.00 0.00 C ATOM 0 H LEU B 120 -6.221 2.715 5.348 1.00 0.00 H new ATOM 0 HA LEU B 120 -4.322 4.354 4.067 1.00 0.00 H new ATOM 0 HB2 LEU B 120 -7.194 4.862 4.940 1.00 0.00 H new ATOM 0 HB3 LEU B 120 -6.285 5.938 3.897 1.00 0.00 H new ATOM 0 HG LEU B 120 -7.014 3.081 3.225 1.00 0.00 H new ATOM 0 HD11 LEU B 120 -8.619 4.110 1.661 1.00 0.00 H new ATOM 0 HD12 LEU B 120 -8.988 4.539 3.348 1.00 0.00 H new ATOM 0 HD13 LEU B 120 -8.192 5.722 2.283 1.00 0.00 H new ATOM 0 HD21 LEU B 120 -6.272 3.720 0.965 1.00 0.00 H new ATOM 0 HD22 LEU B 120 -5.789 5.319 1.579 1.00 0.00 H new ATOM 0 HD23 LEU B 120 -4.950 3.857 2.149 1.00 0.00 H new ATOM 1605 N LEU B 121 -5.478 5.418 6.974 1.00 0.00 N ATOM 1606 CA LEU B 121 -5.332 6.407 8.057 1.00 0.00 C ATOM 1607 C LEU B 121 -3.968 6.412 8.741 1.00 0.00 C ATOM 1608 O LEU B 121 -3.595 7.401 9.387 1.00 0.00 O ATOM 1609 CB LEU B 121 -6.422 6.212 9.075 1.00 0.00 C ATOM 1610 CG LEU B 121 -7.831 6.437 8.563 1.00 0.00 C ATOM 1611 CD1 LEU B 121 -8.830 5.952 9.569 1.00 0.00 C ATOM 1612 CD2 LEU B 121 -8.053 7.909 8.303 1.00 0.00 C ATOM 0 H LEU B 121 -6.224 4.742 7.136 1.00 0.00 H new ATOM 0 HA LEU B 121 -5.418 7.383 7.579 1.00 0.00 H new ATOM 0 HB2 LEU B 121 -6.353 5.198 9.468 1.00 0.00 H new ATOM 0 HB3 LEU B 121 -6.243 6.890 9.910 1.00 0.00 H new ATOM 0 HG LEU B 121 -7.959 5.880 7.635 1.00 0.00 H new ATOM 0 HD11 LEU B 121 -9.838 6.119 9.190 1.00 0.00 H new ATOM 0 HD12 LEU B 121 -8.681 4.887 9.746 1.00 0.00 H new ATOM 0 HD13 LEU B 121 -8.699 6.497 10.504 1.00 0.00 H new ATOM 0 HD21 LEU B 121 -9.067 8.065 7.935 1.00 0.00 H new ATOM 0 HD22 LEU B 121 -7.913 8.467 9.229 1.00 0.00 H new ATOM 0 HD23 LEU B 121 -7.339 8.258 7.557 1.00 0.00 H new ATOM 1624 N LYS B 122 -3.235 5.344 8.608 1.00 0.00 N ATOM 1625 CA LYS B 122 -1.922 5.267 9.222 1.00 0.00 C ATOM 1626 C LYS B 122 -0.839 5.696 8.253 1.00 0.00 C ATOM 1627 O LYS B 122 0.334 5.767 8.614 1.00 0.00 O ATOM 1628 CB LYS B 122 -1.627 3.875 9.712 1.00 0.00 C ATOM 1629 CG LYS B 122 -1.559 2.854 8.615 1.00 0.00 C ATOM 1630 CD LYS B 122 -1.024 1.560 9.129 1.00 0.00 C ATOM 1631 CE LYS B 122 -1.932 0.937 10.185 1.00 0.00 C ATOM 1632 NZ LYS B 122 -3.298 0.716 9.692 1.00 0.00 N ATOM 0 H LYS B 122 -3.514 4.514 8.085 1.00 0.00 H new ATOM 0 HA LYS B 122 -1.929 5.947 10.074 1.00 0.00 H new ATOM 0 HB2 LYS B 122 -0.679 3.882 10.250 1.00 0.00 H new ATOM 0 HB3 LYS B 122 -2.396 3.579 10.425 1.00 0.00 H new ATOM 0 HG2 LYS B 122 -2.552 2.700 8.193 1.00 0.00 H new ATOM 0 HG3 LYS B 122 -0.924 3.221 7.809 1.00 0.00 H new ATOM 0 HD2 LYS B 122 -0.904 0.863 8.299 1.00 0.00 H new ATOM 0 HD3 LYS B 122 -0.034 1.722 9.554 1.00 0.00 H new ATOM 0 HE2 LYS B 122 -1.508 -0.013 10.509 1.00 0.00 H new ATOM 0 HE3 LYS B 122 -1.965 1.586 11.060 1.00 0.00 H new ATOM 0 HZ1 LYS B 122 -3.919 0.469 10.489 1.00 0.00 H new ATOM 0 HZ2 LYS B 122 -3.647 1.583 9.237 1.00 0.00 H new ATOM 0 HZ3 LYS B 122 -3.296 -0.061 9.001 1.00 0.00 H new ATOM 1646 N MET B 123 -1.225 5.979 7.027 1.00 0.00 N ATOM 1647 CA MET B 123 -0.266 6.360 6.020 1.00 0.00 C ATOM 1648 C MET B 123 0.094 7.828 6.202 1.00 0.00 C ATOM 1649 O MET B 123 -0.796 8.655 6.472 1.00 0.00 O ATOM 1650 CB MET B 123 -0.828 6.169 4.613 1.00 0.00 C ATOM 1651 CG MET B 123 -1.286 4.767 4.276 1.00 0.00 C ATOM 1652 SD MET B 123 -1.880 4.663 2.576 1.00 0.00 S ATOM 1653 CE MET B 123 -2.301 2.935 2.440 1.00 0.00 C ATOM 0 H MET B 123 -2.193 5.952 6.707 1.00 0.00 H new ATOM 0 HA MET B 123 0.613 5.726 6.134 1.00 0.00 H new ATOM 0 HB2 MET B 123 -1.670 6.848 4.483 1.00 0.00 H new ATOM 0 HB3 MET B 123 -0.065 6.465 3.893 1.00 0.00 H new ATOM 0 HG2 MET B 123 -0.461 4.069 4.419 1.00 0.00 H new ATOM 0 HG3 MET B 123 -2.080 4.467 4.960 1.00 0.00 H new ATOM 0 HE1 MET B 123 -3.107 2.813 1.717 1.00 0.00 H new ATOM 0 HE2 MET B 123 -1.428 2.373 2.109 1.00 0.00 H new ATOM 0 HE3 MET B 123 -2.626 2.562 3.411 1.00 0.00 H new ATOM 1663 N PRO B 124 1.378 8.188 6.092 1.00 0.00 N ATOM 1664 CA PRO B 124 1.813 9.581 6.207 1.00 0.00 C ATOM 1665 C PRO B 124 1.196 10.443 5.100 1.00 0.00 C ATOM 1666 O PRO B 124 1.410 10.195 3.923 1.00 0.00 O ATOM 1667 CB PRO B 124 3.344 9.509 6.056 1.00 0.00 C ATOM 1668 CG PRO B 124 3.610 8.193 5.408 1.00 0.00 C ATOM 1669 CD PRO B 124 2.510 7.273 5.851 1.00 0.00 C ATOM 0 HA PRO B 124 1.505 10.037 7.148 1.00 0.00 H new ATOM 0 HB2 PRO B 124 3.719 10.331 5.447 1.00 0.00 H new ATOM 0 HB3 PRO B 124 3.839 9.579 7.025 1.00 0.00 H new ATOM 0 HG2 PRO B 124 3.622 8.290 4.322 1.00 0.00 H new ATOM 0 HG3 PRO B 124 4.584 7.804 5.704 1.00 0.00 H new ATOM 0 HD2 PRO B 124 2.273 6.532 5.087 1.00 0.00 H new ATOM 0 HD3 PRO B 124 2.783 6.725 6.753 1.00 0.00 H new ATOM 1677 N GLY B 125 0.401 11.417 5.491 1.00 0.00 N ATOM 1678 CA GLY B 125 -0.255 12.263 4.529 1.00 0.00 C ATOM 1679 C GLY B 125 -1.763 12.127 4.640 1.00 0.00 C ATOM 1680 O GLY B 125 -2.523 12.990 4.220 1.00 0.00 O ATOM 0 H GLY B 125 0.197 11.638 6.466 1.00 0.00 H new ATOM 0 HA2 GLY B 125 0.035 13.301 4.692 1.00 0.00 H new ATOM 0 HA3 GLY B 125 0.067 11.996 3.522 1.00 0.00 H new ATOM 1684 N VAL B 126 -2.189 11.052 5.236 1.00 0.00 N ATOM 1685 CA VAL B 126 -3.596 10.749 5.339 1.00 0.00 C ATOM 1686 C VAL B 126 -4.202 11.206 6.668 1.00 0.00 C ATOM 1687 O VAL B 126 -3.625 11.012 7.746 1.00 0.00 O ATOM 1688 CB VAL B 126 -3.863 9.234 5.117 1.00 0.00 C ATOM 1689 CG1 VAL B 126 -5.345 8.892 5.263 1.00 0.00 C ATOM 1690 CG2 VAL B 126 -3.358 8.811 3.747 1.00 0.00 C ATOM 0 H VAL B 126 -1.576 10.359 5.665 1.00 0.00 H new ATOM 0 HA VAL B 126 -4.089 11.313 4.547 1.00 0.00 H new ATOM 0 HB VAL B 126 -3.322 8.685 5.887 1.00 0.00 H new ATOM 0 HG11 VAL B 126 -5.490 7.824 5.100 1.00 0.00 H new ATOM 0 HG12 VAL B 126 -5.682 9.155 6.266 1.00 0.00 H new ATOM 0 HG13 VAL B 126 -5.922 9.452 4.527 1.00 0.00 H new ATOM 0 HG21 VAL B 126 -3.550 7.748 3.601 1.00 0.00 H new ATOM 0 HG22 VAL B 126 -3.875 9.382 2.976 1.00 0.00 H new ATOM 0 HG23 VAL B 126 -2.286 8.999 3.680 1.00 0.00 H new ATOM 1700 N ASN B 127 -5.357 11.805 6.558 1.00 0.00 N ATOM 1701 CA ASN B 127 -6.182 12.252 7.677 1.00 0.00 C ATOM 1702 C ASN B 127 -7.554 11.713 7.404 1.00 0.00 C ATOM 1703 O ASN B 127 -7.858 11.427 6.256 1.00 0.00 O ATOM 1704 CB ASN B 127 -6.288 13.791 7.757 1.00 0.00 C ATOM 1705 CG ASN B 127 -4.989 14.509 8.001 1.00 0.00 C ATOM 1706 OD1 ASN B 127 -4.584 14.741 9.146 1.00 0.00 O ATOM 1707 ND2 ASN B 127 -4.376 14.936 6.949 1.00 0.00 N ATOM 0 H ASN B 127 -5.778 12.009 5.652 1.00 0.00 H new ATOM 0 HA ASN B 127 -5.744 11.907 8.614 1.00 0.00 H new ATOM 0 HB2 ASN B 127 -6.719 14.159 6.826 1.00 0.00 H new ATOM 0 HB3 ASN B 127 -6.984 14.051 8.555 1.00 0.00 H new ATOM 0 HD21 ASN B 127 -3.523 15.488 7.044 1.00 0.00 H new ATOM 0 HD22 ASN B 127 -4.744 14.722 6.022 1.00 0.00 H new ATOM 1714 N ALA B 128 -8.394 11.614 8.403 1.00 0.00 N ATOM 1715 CA ALA B 128 -9.745 11.070 8.239 1.00 0.00 C ATOM 1716 C ALA B 128 -10.568 11.836 7.190 1.00 0.00 C ATOM 1717 O ALA B 128 -11.392 11.246 6.482 1.00 0.00 O ATOM 1718 CB ALA B 128 -10.467 11.030 9.574 1.00 0.00 C ATOM 0 H ALA B 128 -8.175 11.904 9.356 1.00 0.00 H new ATOM 0 HA ALA B 128 -9.638 10.052 7.866 1.00 0.00 H new ATOM 0 HB1 ALA B 128 -11.469 10.623 9.434 1.00 0.00 H new ATOM 0 HB2 ALA B 128 -9.913 10.399 10.269 1.00 0.00 H new ATOM 0 HB3 ALA B 128 -10.539 12.039 9.979 1.00 0.00 H new ATOM 1724 N LYS B 129 -10.268 13.114 7.029 1.00 0.00 N ATOM 1725 CA LYS B 129 -10.996 13.973 6.103 1.00 0.00 C ATOM 1726 C LYS B 129 -10.651 13.604 4.652 1.00 0.00 C ATOM 1727 O LYS B 129 -11.530 13.394 3.767 1.00 0.00 O ATOM 1728 CB LYS B 129 -10.643 15.452 6.399 1.00 0.00 C ATOM 1729 CG LYS B 129 -9.139 15.781 6.296 1.00 0.00 C ATOM 1730 CD LYS B 129 -8.811 17.205 6.704 1.00 0.00 C ATOM 1731 CE LYS B 129 -9.428 18.235 5.777 1.00 0.00 C ATOM 1732 NZ LYS B 129 -9.126 19.612 6.220 1.00 0.00 N ATOM 0 H LYS B 129 -9.517 13.586 7.533 1.00 0.00 H new ATOM 0 HA LYS B 129 -12.069 13.832 6.236 1.00 0.00 H new ATOM 0 HB2 LYS B 129 -11.190 16.089 5.705 1.00 0.00 H new ATOM 0 HB3 LYS B 129 -10.989 15.702 7.402 1.00 0.00 H new ATOM 0 HG2 LYS B 129 -8.578 15.091 6.926 1.00 0.00 H new ATOM 0 HG3 LYS B 129 -8.807 15.618 5.271 1.00 0.00 H new ATOM 0 HD2 LYS B 129 -9.165 17.378 7.720 1.00 0.00 H new ATOM 0 HD3 LYS B 129 -7.729 17.335 6.717 1.00 0.00 H new ATOM 0 HE2 LYS B 129 -9.052 18.087 4.765 1.00 0.00 H new ATOM 0 HE3 LYS B 129 -10.508 18.092 5.740 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 -9.563 20.291 5.564 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 -9.507 19.760 7.176 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 -8.096 19.755 6.231 1.00 0.00 H new ATOM 1746 N ASN B 130 -9.395 13.410 4.425 1.00 0.00 N ATOM 1747 CA ASN B 130 -8.949 13.177 3.105 1.00 0.00 C ATOM 1748 C ASN B 130 -9.057 11.723 2.774 1.00 0.00 C ATOM 1749 O ASN B 130 -9.127 11.359 1.635 1.00 0.00 O ATOM 1750 CB ASN B 130 -7.545 13.766 2.842 1.00 0.00 C ATOM 1751 CG ASN B 130 -6.370 13.140 3.610 1.00 0.00 C ATOM 1752 OD1 ASN B 130 -6.366 11.982 3.954 1.00 0.00 O ATOM 1753 ND2 ASN B 130 -5.358 13.926 3.871 1.00 0.00 N ATOM 0 H ASN B 130 -8.666 13.409 5.138 1.00 0.00 H new ATOM 0 HA ASN B 130 -9.605 13.714 2.421 1.00 0.00 H new ATOM 0 HB2 ASN B 130 -7.336 13.681 1.776 1.00 0.00 H new ATOM 0 HB3 ASN B 130 -7.575 14.830 3.077 1.00 0.00 H new ATOM 0 HD21 ASN B 130 -4.547 13.564 4.373 1.00 0.00 H new ATOM 0 HD22 ASN B 130 -5.379 14.901 3.573 1.00 0.00 H new ATOM 1760 N CYS B 131 -9.145 10.921 3.805 1.00 0.00 N ATOM 1761 CA CYS B 131 -9.291 9.498 3.702 1.00 0.00 C ATOM 1762 C CYS B 131 -10.682 9.149 3.224 1.00 0.00 C ATOM 1763 O CYS B 131 -10.841 8.246 2.461 1.00 0.00 O ATOM 1764 CB CYS B 131 -9.026 8.851 5.052 1.00 0.00 C ATOM 1765 SG CYS B 131 -9.124 7.055 5.083 1.00 0.00 S ATOM 0 H CYS B 131 -9.116 11.255 4.768 1.00 0.00 H new ATOM 0 HA CYS B 131 -8.568 9.121 2.979 1.00 0.00 H new ATOM 0 HB2 CYS B 131 -8.033 9.149 5.390 1.00 0.00 H new ATOM 0 HB3 CYS B 131 -9.741 9.249 5.773 1.00 0.00 H new ATOM 0 HG CYS B 131 -9.510 6.662 6.260 1.00 0.00 H new ATOM 1771 N ARG B 132 -11.692 9.881 3.678 1.00 0.00 N ATOM 1772 CA ARG B 132 -13.061 9.624 3.223 1.00 0.00 C ATOM 1773 C ARG B 132 -13.213 10.063 1.770 1.00 0.00 C ATOM 1774 O ARG B 132 -13.825 9.370 0.931 1.00 0.00 O ATOM 1775 CB ARG B 132 -14.082 10.314 4.139 1.00 0.00 C ATOM 1776 CG ARG B 132 -13.985 11.830 4.209 1.00 0.00 C ATOM 1777 CD ARG B 132 -15.071 12.511 3.376 1.00 0.00 C ATOM 1778 NE ARG B 132 -16.426 12.114 3.797 1.00 0.00 N ATOM 1779 CZ ARG B 132 -17.547 12.804 3.550 1.00 0.00 C ATOM 1780 NH1 ARG B 132 -17.501 13.958 2.889 1.00 0.00 N ATOM 1781 NH2 ARG B 132 -18.715 12.332 3.965 1.00 0.00 N ATOM 0 H ARG B 132 -11.598 10.644 4.348 1.00 0.00 H new ATOM 0 HA ARG B 132 -13.260 8.554 3.276 1.00 0.00 H new ATOM 0 HB2 ARG B 132 -15.084 10.047 3.802 1.00 0.00 H new ATOM 0 HB3 ARG B 132 -13.968 9.914 5.146 1.00 0.00 H new ATOM 0 HG2 ARG B 132 -14.069 12.151 5.247 1.00 0.00 H new ATOM 0 HG3 ARG B 132 -13.004 12.148 3.855 1.00 0.00 H new ATOM 0 HD2 ARG B 132 -14.968 13.593 3.462 1.00 0.00 H new ATOM 0 HD3 ARG B 132 -14.931 12.260 2.325 1.00 0.00 H new ATOM 0 HE ARG B 132 -16.518 11.243 4.319 1.00 0.00 H new ATOM 0 HH11 ARG B 132 -16.606 14.325 2.565 1.00 0.00 H new ATOM 0 HH12 ARG B 132 -18.361 14.476 2.706 1.00 0.00 H new ATOM 0 HH21 ARG B 132 -18.757 11.447 4.470 1.00 0.00 H new ATOM 0 HH22 ARG B 132 -19.571 12.854 3.779 1.00 0.00 H new ATOM 1795 N SER B 133 -12.617 11.187 1.471 1.00 0.00 N ATOM 1796 CA SER B 133 -12.597 11.701 0.128 1.00 0.00 C ATOM 1797 C SER B 133 -11.824 10.703 -0.796 1.00 0.00 C ATOM 1798 O SER B 133 -12.247 10.368 -1.934 1.00 0.00 O ATOM 1799 CB SER B 133 -11.924 13.068 0.185 1.00 0.00 C ATOM 1800 OG SER B 133 -12.600 13.931 1.124 1.00 0.00 O ATOM 0 H SER B 133 -12.132 11.772 2.152 1.00 0.00 H new ATOM 0 HA SER B 133 -13.600 11.808 -0.286 1.00 0.00 H new ATOM 0 HB2 SER B 133 -10.880 12.953 0.476 1.00 0.00 H new ATOM 0 HB3 SER B 133 -11.931 13.524 -0.805 1.00 0.00 H new ATOM 0 HG SER B 133 -12.256 13.766 2.026 1.00 0.00 H new ATOM 1806 N LEU B 134 -10.758 10.167 -0.248 1.00 0.00 N ATOM 1807 CA LEU B 134 -9.893 9.218 -0.926 1.00 0.00 C ATOM 1808 C LEU B 134 -10.629 7.922 -1.109 1.00 0.00 C ATOM 1809 O LEU B 134 -10.490 7.268 -2.104 1.00 0.00 O ATOM 1810 CB LEU B 134 -8.698 8.917 -0.062 1.00 0.00 C ATOM 1811 CG LEU B 134 -7.525 8.252 -0.752 1.00 0.00 C ATOM 1812 CD1 LEU B 134 -6.714 9.247 -1.558 1.00 0.00 C ATOM 1813 CD2 LEU B 134 -6.682 7.513 0.240 1.00 0.00 C ATOM 0 H LEU B 134 -10.458 10.381 0.703 1.00 0.00 H new ATOM 0 HA LEU B 134 -9.589 9.644 -1.882 1.00 0.00 H new ATOM 0 HB2 LEU B 134 -8.351 9.851 0.380 1.00 0.00 H new ATOM 0 HB3 LEU B 134 -9.021 8.276 0.759 1.00 0.00 H new ATOM 0 HG LEU B 134 -7.917 7.524 -1.462 1.00 0.00 H new ATOM 0 HD11 LEU B 134 -5.881 8.733 -2.038 1.00 0.00 H new ATOM 0 HD12 LEU B 134 -7.348 9.701 -2.319 1.00 0.00 H new ATOM 0 HD13 LEU B 134 -6.329 10.023 -0.897 1.00 0.00 H new ATOM 0 HD21 LEU B 134 -5.844 7.042 -0.274 1.00 0.00 H new ATOM 0 HD22 LEU B 134 -6.303 8.211 0.987 1.00 0.00 H new ATOM 0 HD23 LEU B 134 -7.284 6.748 0.730 1.00 0.00 H new ATOM 1825 N MET B 135 -11.432 7.604 -0.129 1.00 0.00 N ATOM 1826 CA MET B 135 -12.204 6.394 -0.050 1.00 0.00 C ATOM 1827 C MET B 135 -13.136 6.300 -1.228 1.00 0.00 C ATOM 1828 O MET B 135 -13.450 5.228 -1.707 1.00 0.00 O ATOM 1829 CB MET B 135 -13.013 6.435 1.223 1.00 0.00 C ATOM 1830 CG MET B 135 -13.458 5.111 1.708 1.00 0.00 C ATOM 1831 SD MET B 135 -12.130 4.153 2.377 1.00 0.00 S ATOM 1832 CE MET B 135 -11.646 5.139 3.772 1.00 0.00 C ATOM 0 H MET B 135 -11.572 8.214 0.677 1.00 0.00 H new ATOM 0 HA MET B 135 -11.541 5.529 -0.056 1.00 0.00 H new ATOM 0 HB2 MET B 135 -12.418 6.912 2.002 1.00 0.00 H new ATOM 0 HB3 MET B 135 -13.890 7.063 1.062 1.00 0.00 H new ATOM 0 HG2 MET B 135 -14.225 5.246 2.471 1.00 0.00 H new ATOM 0 HG3 MET B 135 -13.919 4.563 0.886 1.00 0.00 H new ATOM 0 HE1 MET B 135 -10.878 4.614 4.340 1.00 0.00 H new ATOM 0 HE2 MET B 135 -11.251 6.093 3.424 1.00 0.00 H new ATOM 0 HE3 MET B 135 -12.512 5.316 4.410 1.00 0.00 H new ATOM 1842 N HIS B 136 -13.604 7.442 -1.670 1.00 0.00 N ATOM 1843 CA HIS B 136 -14.448 7.483 -2.846 1.00 0.00 C ATOM 1844 C HIS B 136 -13.642 7.598 -4.134 1.00 0.00 C ATOM 1845 O HIS B 136 -14.137 7.288 -5.202 1.00 0.00 O ATOM 1846 CB HIS B 136 -15.513 8.574 -2.749 1.00 0.00 C ATOM 1847 CG HIS B 136 -16.601 8.244 -1.772 1.00 0.00 C ATOM 1848 ND1 HIS B 136 -17.938 8.247 -2.094 1.00 0.00 N ATOM 1849 CD2 HIS B 136 -16.535 7.887 -0.468 1.00 0.00 C ATOM 1850 CE1 HIS B 136 -18.641 7.909 -1.038 1.00 0.00 C ATOM 1851 NE2 HIS B 136 -17.815 7.687 -0.039 1.00 0.00 N ATOM 0 H HIS B 136 -13.419 8.348 -1.241 1.00 0.00 H new ATOM 0 HA HIS B 136 -14.969 6.526 -2.884 1.00 0.00 H new ATOM 0 HB2 HIS B 136 -15.040 9.511 -2.455 1.00 0.00 H new ATOM 0 HB3 HIS B 136 -15.952 8.734 -3.734 1.00 0.00 H new ATOM 0 HD2 HIS B 136 -15.637 7.780 0.123 1.00 0.00 H new ATOM 0 HE1 HIS B 136 -19.717 7.827 -0.997 1.00 0.00 H new ATOM 0 HE2 HIS B 136 -18.087 7.410 0.904 1.00 0.00 H new ATOM 1860 N HIS B 137 -12.401 8.041 -4.038 1.00 0.00 N ATOM 1861 CA HIS B 137 -11.554 8.157 -5.237 1.00 0.00 C ATOM 1862 C HIS B 137 -10.728 6.905 -5.520 1.00 0.00 C ATOM 1863 O HIS B 137 -10.281 6.688 -6.655 1.00 0.00 O ATOM 1864 CB HIS B 137 -10.633 9.369 -5.163 1.00 0.00 C ATOM 1865 CG HIS B 137 -11.256 10.648 -5.619 1.00 0.00 C ATOM 1866 ND1 HIS B 137 -10.967 11.219 -6.835 1.00 0.00 N ATOM 1867 CD2 HIS B 137 -12.130 11.483 -5.014 1.00 0.00 C ATOM 1868 CE1 HIS B 137 -11.628 12.340 -6.962 1.00 0.00 C ATOM 1869 NE2 HIS B 137 -12.343 12.527 -5.872 1.00 0.00 N ATOM 0 H HIS B 137 -11.954 8.324 -3.166 1.00 0.00 H new ATOM 0 HA HIS B 137 -12.251 8.284 -6.065 1.00 0.00 H new ATOM 0 HB2 HIS B 137 -10.295 9.491 -4.134 1.00 0.00 H new ATOM 0 HB3 HIS B 137 -9.748 9.174 -5.768 1.00 0.00 H new ATOM 0 HD2 HIS B 137 -12.575 11.351 -4.039 1.00 0.00 H new ATOM 0 HE1 HIS B 137 -11.593 13.000 -7.816 1.00 0.00 H new ATOM 0 HE2 HIS B 137 -12.957 13.322 -5.696 1.00 0.00 H new ATOM 1878 N VAL B 138 -10.535 6.098 -4.520 1.00 0.00 N ATOM 1879 CA VAL B 138 -9.666 4.945 -4.615 1.00 0.00 C ATOM 1880 C VAL B 138 -10.427 3.661 -4.279 1.00 0.00 C ATOM 1881 O VAL B 138 -11.335 3.668 -3.450 1.00 0.00 O ATOM 1882 CB VAL B 138 -8.457 5.094 -3.629 1.00 0.00 C ATOM 1883 CG1 VAL B 138 -7.507 3.939 -3.735 1.00 0.00 C ATOM 1884 CG2 VAL B 138 -7.705 6.388 -3.869 1.00 0.00 C ATOM 0 H VAL B 138 -10.975 6.215 -3.607 1.00 0.00 H new ATOM 0 HA VAL B 138 -9.300 4.886 -5.640 1.00 0.00 H new ATOM 0 HB VAL B 138 -8.877 5.108 -2.623 1.00 0.00 H new ATOM 0 HG11 VAL B 138 -6.683 4.080 -3.036 1.00 0.00 H new ATOM 0 HG12 VAL B 138 -8.031 3.014 -3.496 1.00 0.00 H new ATOM 0 HG13 VAL B 138 -7.115 3.882 -4.751 1.00 0.00 H new ATOM 0 HG21 VAL B 138 -6.873 6.460 -3.169 1.00 0.00 H new ATOM 0 HG22 VAL B 138 -7.323 6.403 -4.890 1.00 0.00 H new ATOM 0 HG23 VAL B 138 -8.378 7.233 -3.721 1.00 0.00 H new ATOM 1894 N LYS B 139 -10.090 2.589 -4.974 1.00 0.00 N ATOM 1895 CA LYS B 139 -10.616 1.275 -4.671 1.00 0.00 C ATOM 1896 C LYS B 139 -9.924 0.728 -3.423 1.00 0.00 C ATOM 1897 O LYS B 139 -10.537 0.571 -2.377 1.00 0.00 O ATOM 1898 CB LYS B 139 -10.387 0.331 -5.847 1.00 0.00 C ATOM 1899 CG LYS B 139 -10.836 -1.077 -5.588 1.00 0.00 C ATOM 1900 CD LYS B 139 -10.622 -1.986 -6.771 1.00 0.00 C ATOM 1901 CE LYS B 139 -11.031 -3.400 -6.415 1.00 0.00 C ATOM 1902 NZ LYS B 139 -12.473 -3.502 -6.064 1.00 0.00 N ATOM 0 H LYS B 139 -9.444 2.608 -5.763 1.00 0.00 H new ATOM 0 HA LYS B 139 -11.688 1.352 -4.489 1.00 0.00 H new ATOM 0 HB2 LYS B 139 -10.915 0.717 -6.719 1.00 0.00 H new ATOM 0 HB3 LYS B 139 -9.326 0.324 -6.095 1.00 0.00 H new ATOM 0 HG2 LYS B 139 -10.295 -1.474 -4.729 1.00 0.00 H new ATOM 0 HG3 LYS B 139 -11.894 -1.073 -5.325 1.00 0.00 H new ATOM 0 HD2 LYS B 139 -11.204 -1.633 -7.622 1.00 0.00 H new ATOM 0 HD3 LYS B 139 -9.574 -1.966 -7.071 1.00 0.00 H new ATOM 0 HE2 LYS B 139 -10.817 -4.060 -7.256 1.00 0.00 H new ATOM 0 HE3 LYS B 139 -10.430 -3.749 -5.575 1.00 0.00 H new ATOM 0 HZ1 LYS B 139 -12.712 -4.494 -5.861 1.00 0.00 H new ATOM 0 HZ2 LYS B 139 -12.668 -2.920 -5.224 1.00 0.00 H new ATOM 0 HZ3 LYS B 139 -13.049 -3.163 -6.861 1.00 0.00 H new ATOM 1916 N ASN B 140 -8.644 0.439 -3.555 1.00 0.00 N ATOM 1917 CA ASN B 140 -7.828 -0.014 -2.475 1.00 0.00 C ATOM 1918 C ASN B 140 -6.383 0.328 -2.864 1.00 0.00 C ATOM 1919 O ASN B 140 -6.194 1.074 -3.840 1.00 0.00 O ATOM 1920 CB ASN B 140 -8.049 -1.538 -2.200 1.00 0.00 C ATOM 1921 CG ASN B 140 -7.326 -2.028 -0.930 1.00 0.00 C ATOM 1922 OD1 ASN B 140 -6.216 -2.466 -0.990 1.00 0.00 O ATOM 1923 ND2 ASN B 140 -7.931 -1.910 0.206 1.00 0.00 N ATOM 0 H ASN B 140 -8.143 0.518 -4.440 1.00 0.00 H new ATOM 0 HA ASN B 140 -8.085 0.475 -1.535 1.00 0.00 H new ATOM 0 HB2 ASN B 140 -9.117 -1.734 -2.103 1.00 0.00 H new ATOM 0 HB3 ASN B 140 -7.697 -2.112 -3.057 1.00 0.00 H new ATOM 0 HD21 ASN B 140 -7.461 -2.192 1.066 1.00 0.00 H new ATOM 0 HD22 ASN B 140 -8.879 -1.534 0.243 1.00 0.00 H new ATOM 1930 N ILE B 141 -5.415 -0.222 -2.151 1.00 0.00 N ATOM 1931 CA ILE B 141 -3.976 -0.005 -2.291 1.00 0.00 C ATOM 1932 C ILE B 141 -3.548 0.115 -3.759 1.00 0.00 C ATOM 1933 O ILE B 141 -2.809 1.032 -4.114 1.00 0.00 O ATOM 1934 CB ILE B 141 -3.252 -1.217 -1.687 1.00 0.00 C ATOM 1935 CG1 ILE B 141 -3.531 -1.326 -0.188 1.00 0.00 C ATOM 1936 CG2 ILE B 141 -1.741 -1.169 -1.952 1.00 0.00 C ATOM 1937 CD1 ILE B 141 -3.006 -2.596 0.431 1.00 0.00 C ATOM 0 H ILE B 141 -5.625 -0.882 -1.402 1.00 0.00 H new ATOM 0 HA ILE B 141 -3.723 0.926 -1.784 1.00 0.00 H new ATOM 0 HB ILE B 141 -3.644 -2.107 -2.179 1.00 0.00 H new ATOM 0 HG12 ILE B 141 -3.083 -0.472 0.320 1.00 0.00 H new ATOM 0 HG13 ILE B 141 -4.607 -1.268 -0.022 1.00 0.00 H new ATOM 0 HG21 ILE B 141 -1.266 -2.044 -1.508 1.00 0.00 H new ATOM 0 HG22 ILE B 141 -1.560 -1.164 -3.027 1.00 0.00 H new ATOM 0 HG23 ILE B 141 -1.322 -0.265 -1.509 1.00 0.00 H new ATOM 0 HD11 ILE B 141 -3.240 -2.605 1.496 1.00 0.00 H new ATOM 0 HD12 ILE B 141 -3.473 -3.455 -0.051 1.00 0.00 H new ATOM 0 HD13 ILE B 141 -1.926 -2.647 0.296 1.00 0.00 H new ATOM 1949 N ALA B 142 -4.038 -0.817 -4.602 1.00 0.00 N ATOM 1950 CA ALA B 142 -3.692 -0.816 -6.039 1.00 0.00 C ATOM 1951 C ALA B 142 -3.932 0.537 -6.717 1.00 0.00 C ATOM 1952 O ALA B 142 -3.018 1.110 -7.300 1.00 0.00 O ATOM 1953 CB ALA B 142 -4.434 -1.912 -6.769 1.00 0.00 C ATOM 0 H ALA B 142 -4.665 -1.570 -4.319 1.00 0.00 H new ATOM 0 HA ALA B 142 -2.620 -1.007 -6.096 1.00 0.00 H new ATOM 0 HB1 ALA B 142 -4.164 -1.893 -7.825 1.00 0.00 H new ATOM 0 HB2 ALA B 142 -4.166 -2.879 -6.343 1.00 0.00 H new ATOM 0 HB3 ALA B 142 -5.508 -1.756 -6.666 1.00 0.00 H new ATOM 1959 N GLU B 143 -5.123 1.064 -6.575 1.00 0.00 N ATOM 1960 CA GLU B 143 -5.493 2.318 -7.219 1.00 0.00 C ATOM 1961 C GLU B 143 -4.846 3.471 -6.515 1.00 0.00 C ATOM 1962 O GLU B 143 -4.520 4.456 -7.130 1.00 0.00 O ATOM 1963 CB GLU B 143 -6.992 2.493 -7.217 1.00 0.00 C ATOM 1964 CG GLU B 143 -7.761 1.309 -7.772 1.00 0.00 C ATOM 1965 CD GLU B 143 -7.342 0.907 -9.149 1.00 0.00 C ATOM 1966 OE1 GLU B 143 -7.813 1.507 -10.123 1.00 0.00 O ATOM 1967 OE2 GLU B 143 -6.569 -0.035 -9.283 1.00 0.00 O ATOM 0 H GLU B 143 -5.866 0.645 -6.015 1.00 0.00 H new ATOM 0 HA GLU B 143 -5.145 2.289 -8.252 1.00 0.00 H new ATOM 0 HB2 GLU B 143 -7.323 2.679 -6.195 1.00 0.00 H new ATOM 0 HB3 GLU B 143 -7.243 3.379 -7.800 1.00 0.00 H new ATOM 0 HG2 GLU B 143 -7.634 0.459 -7.101 1.00 0.00 H new ATOM 0 HG3 GLU B 143 -8.824 1.551 -7.782 1.00 0.00 H new ATOM 1974 N LEU B 144 -4.666 3.327 -5.222 1.00 0.00 N ATOM 1975 CA LEU B 144 -4.018 4.335 -4.404 1.00 0.00 C ATOM 1976 C LEU B 144 -2.623 4.594 -4.912 1.00 0.00 C ATOM 1977 O LEU B 144 -2.243 5.723 -5.176 1.00 0.00 O ATOM 1978 CB LEU B 144 -3.942 3.846 -2.964 1.00 0.00 C ATOM 1979 CG LEU B 144 -3.290 4.779 -1.967 1.00 0.00 C ATOM 1980 CD1 LEU B 144 -4.014 6.109 -1.923 1.00 0.00 C ATOM 1981 CD2 LEU B 144 -3.290 4.138 -0.617 1.00 0.00 C ATOM 0 H LEU B 144 -4.966 2.503 -4.702 1.00 0.00 H new ATOM 0 HA LEU B 144 -4.596 5.258 -4.453 1.00 0.00 H new ATOM 0 HB2 LEU B 144 -4.955 3.635 -2.622 1.00 0.00 H new ATOM 0 HB3 LEU B 144 -3.399 2.901 -2.953 1.00 0.00 H new ATOM 0 HG LEU B 144 -2.262 4.969 -2.276 1.00 0.00 H new ATOM 0 HD11 LEU B 144 -3.528 6.764 -1.200 1.00 0.00 H new ATOM 0 HD12 LEU B 144 -3.984 6.572 -2.909 1.00 0.00 H new ATOM 0 HD13 LEU B 144 -5.051 5.949 -1.628 1.00 0.00 H new ATOM 0 HD21 LEU B 144 -2.821 4.808 0.104 1.00 0.00 H new ATOM 0 HD22 LEU B 144 -4.316 3.936 -0.310 1.00 0.00 H new ATOM 0 HD23 LEU B 144 -2.733 3.202 -0.659 1.00 0.00 H new ATOM 1993 N ALA B 145 -1.893 3.525 -5.099 1.00 0.00 N ATOM 1994 CA ALA B 145 -0.546 3.600 -5.549 1.00 0.00 C ATOM 1995 C ALA B 145 -0.476 3.856 -7.039 1.00 0.00 C ATOM 1996 O ALA B 145 0.580 4.186 -7.573 1.00 0.00 O ATOM 1997 CB ALA B 145 0.184 2.342 -5.179 1.00 0.00 C ATOM 0 H ALA B 145 -2.228 2.575 -4.939 1.00 0.00 H new ATOM 0 HA ALA B 145 -0.062 4.443 -5.057 1.00 0.00 H new ATOM 0 HB1 ALA B 145 1.215 2.404 -5.526 1.00 0.00 H new ATOM 0 HB2 ALA B 145 0.172 2.220 -4.096 1.00 0.00 H new ATOM 0 HB3 ALA B 145 -0.305 1.487 -5.646 1.00 0.00 H new ATOM 2003 N ALA B 146 -1.599 3.689 -7.705 1.00 0.00 N ATOM 2004 CA ALA B 146 -1.679 3.937 -9.120 1.00 0.00 C ATOM 2005 C ALA B 146 -1.992 5.395 -9.398 1.00 0.00 C ATOM 2006 O ALA B 146 -1.807 5.870 -10.519 1.00 0.00 O ATOM 2007 CB ALA B 146 -2.721 3.046 -9.766 1.00 0.00 C ATOM 0 H ALA B 146 -2.473 3.380 -7.280 1.00 0.00 H new ATOM 0 HA ALA B 146 -0.707 3.704 -9.554 1.00 0.00 H new ATOM 0 HB1 ALA B 146 -2.763 3.252 -10.836 1.00 0.00 H new ATOM 0 HB2 ALA B 146 -2.455 2.001 -9.608 1.00 0.00 H new ATOM 0 HB3 ALA B 146 -3.696 3.244 -9.320 1.00 0.00 H new ATOM 2013 N LEU B 147 -2.517 6.097 -8.410 1.00 0.00 N ATOM 2014 CA LEU B 147 -2.821 7.498 -8.586 1.00 0.00 C ATOM 2015 C LEU B 147 -1.559 8.381 -8.528 1.00 0.00 C ATOM 2016 O LEU B 147 -0.562 8.031 -7.891 1.00 0.00 O ATOM 2017 CB LEU B 147 -3.849 7.994 -7.569 1.00 0.00 C ATOM 2018 CG LEU B 147 -5.242 7.376 -7.653 1.00 0.00 C ATOM 2019 CD1 LEU B 147 -6.129 7.958 -6.579 1.00 0.00 C ATOM 2020 CD2 LEU B 147 -5.866 7.607 -9.020 1.00 0.00 C ATOM 0 H LEU B 147 -2.738 5.721 -7.488 1.00 0.00 H new ATOM 0 HA LEU B 147 -3.252 7.586 -9.583 1.00 0.00 H new ATOM 0 HB2 LEU B 147 -3.455 7.813 -6.569 1.00 0.00 H new ATOM 0 HB3 LEU B 147 -3.947 9.074 -7.682 1.00 0.00 H new ATOM 0 HG LEU B 147 -5.145 6.301 -7.502 1.00 0.00 H new ATOM 0 HD11 LEU B 147 -7.121 7.512 -6.645 1.00 0.00 H new ATOM 0 HD12 LEU B 147 -5.701 7.746 -5.599 1.00 0.00 H new ATOM 0 HD13 LEU B 147 -6.206 9.037 -6.716 1.00 0.00 H new ATOM 0 HD21 LEU B 147 -6.858 7.155 -9.048 1.00 0.00 H new ATOM 0 HD22 LEU B 147 -5.950 8.678 -9.205 1.00 0.00 H new ATOM 0 HD23 LEU B 147 -5.239 7.154 -9.788 1.00 0.00 H new ATOM 2032 N SER B 148 -1.618 9.515 -9.197 1.00 0.00 N ATOM 2033 CA SER B 148 -0.526 10.470 -9.215 1.00 0.00 C ATOM 2034 C SER B 148 -0.603 11.396 -7.970 1.00 0.00 C ATOM 2035 O SER B 148 -1.633 11.436 -7.278 1.00 0.00 O ATOM 2036 CB SER B 148 -0.635 11.308 -10.489 1.00 0.00 C ATOM 2037 OG SER B 148 -0.781 10.484 -11.635 1.00 0.00 O ATOM 0 H SER B 148 -2.428 9.802 -9.746 1.00 0.00 H new ATOM 0 HA SER B 148 0.426 9.940 -9.194 1.00 0.00 H new ATOM 0 HB2 SER B 148 -1.488 11.982 -10.412 1.00 0.00 H new ATOM 0 HB3 SER B 148 0.254 11.929 -10.596 1.00 0.00 H new ATOM 0 HG SER B 148 -0.850 11.046 -12.435 1.00 0.00 H new ATOM 2043 N GLN B 149 0.459 12.176 -7.713 1.00 0.00 N ATOM 2044 CA GLN B 149 0.485 13.093 -6.576 1.00 0.00 C ATOM 2045 C GLN B 149 -0.501 14.216 -6.838 1.00 0.00 C ATOM 2046 O GLN B 149 -1.111 14.769 -5.920 1.00 0.00 O ATOM 2047 CB GLN B 149 1.888 13.682 -6.384 1.00 0.00 C ATOM 2048 CG GLN B 149 2.066 14.396 -5.057 1.00 0.00 C ATOM 2049 CD GLN B 149 3.422 15.023 -4.890 1.00 0.00 C ATOM 2050 OE1 GLN B 149 4.367 14.367 -4.463 1.00 0.00 O ATOM 2051 NE2 GLN B 149 3.521 16.289 -5.131 1.00 0.00 N ATOM 0 H GLN B 149 1.307 12.186 -8.280 1.00 0.00 H new ATOM 0 HA GLN B 149 0.214 12.549 -5.671 1.00 0.00 H new ATOM 0 HB2 GLN B 149 2.623 12.881 -6.459 1.00 0.00 H new ATOM 0 HB3 GLN B 149 2.095 14.381 -7.195 1.00 0.00 H new ATOM 0 HG2 GLN B 149 1.303 15.169 -4.964 1.00 0.00 H new ATOM 0 HG3 GLN B 149 1.900 13.686 -4.247 1.00 0.00 H new ATOM 0 HE21 GLN B 149 2.716 16.805 -5.486 1.00 0.00 H new ATOM 0 HE22 GLN B 149 4.404 16.772 -4.967 1.00 0.00 H new ATOM 2060 N ASP B 150 -0.677 14.513 -8.114 1.00 0.00 N ATOM 2061 CA ASP B 150 -1.595 15.544 -8.588 1.00 0.00 C ATOM 2062 C ASP B 150 -2.996 15.176 -8.181 1.00 0.00 C ATOM 2063 O ASP B 150 -3.760 16.012 -7.684 1.00 0.00 O ATOM 2064 CB ASP B 150 -1.512 15.662 -10.112 1.00 0.00 C ATOM 2065 CG ASP B 150 -0.113 15.936 -10.586 1.00 0.00 C ATOM 2066 OD1 ASP B 150 0.323 17.100 -10.559 1.00 0.00 O ATOM 2067 OD2 ASP B 150 0.603 14.980 -10.934 1.00 0.00 O ATOM 0 H ASP B 150 -0.179 14.038 -8.866 1.00 0.00 H new ATOM 0 HA ASP B 150 -1.323 16.504 -8.148 1.00 0.00 H new ATOM 0 HB2 ASP B 150 -1.873 14.739 -10.566 1.00 0.00 H new ATOM 0 HB3 ASP B 150 -2.171 16.462 -10.449 1.00 0.00 H new ATOM 2072 N GLU B 151 -3.301 13.898 -8.336 1.00 0.00 N ATOM 2073 CA GLU B 151 -4.577 13.339 -7.950 1.00 0.00 C ATOM 2074 C GLU B 151 -4.767 13.498 -6.464 1.00 0.00 C ATOM 2075 O GLU B 151 -5.777 14.021 -6.018 1.00 0.00 O ATOM 2076 CB GLU B 151 -4.649 11.861 -8.323 1.00 0.00 C ATOM 2077 CG GLU B 151 -4.531 11.596 -9.808 1.00 0.00 C ATOM 2078 CD GLU B 151 -5.640 12.249 -10.585 1.00 0.00 C ATOM 2079 OE1 GLU B 151 -6.779 11.753 -10.542 1.00 0.00 O ATOM 2080 OE2 GLU B 151 -5.401 13.286 -11.227 1.00 0.00 O ATOM 0 H GLU B 151 -2.659 13.215 -8.739 1.00 0.00 H new ATOM 0 HA GLU B 151 -5.368 13.870 -8.480 1.00 0.00 H new ATOM 0 HB2 GLU B 151 -3.853 11.326 -7.804 1.00 0.00 H new ATOM 0 HB3 GLU B 151 -5.594 11.452 -7.965 1.00 0.00 H new ATOM 0 HG2 GLU B 151 -3.570 11.965 -10.167 1.00 0.00 H new ATOM 0 HG3 GLU B 151 -4.547 10.521 -9.987 1.00 0.00 H new ATOM 2087 N LEU B 152 -3.760 13.098 -5.704 1.00 0.00 N ATOM 2088 CA LEU B 152 -3.809 13.178 -4.252 1.00 0.00 C ATOM 2089 C LEU B 152 -4.007 14.611 -3.781 1.00 0.00 C ATOM 2090 O LEU B 152 -4.795 14.861 -2.893 1.00 0.00 O ATOM 2091 CB LEU B 152 -2.555 12.580 -3.610 1.00 0.00 C ATOM 2092 CG LEU B 152 -2.237 11.121 -3.938 1.00 0.00 C ATOM 2093 CD1 LEU B 152 -0.973 10.681 -3.225 1.00 0.00 C ATOM 2094 CD2 LEU B 152 -3.405 10.205 -3.588 1.00 0.00 C ATOM 0 H LEU B 152 -2.891 12.711 -6.073 1.00 0.00 H new ATOM 0 HA LEU B 152 -4.668 12.588 -3.932 1.00 0.00 H new ATOM 0 HB2 LEU B 152 -1.700 13.188 -3.906 1.00 0.00 H new ATOM 0 HB3 LEU B 152 -2.652 12.671 -2.528 1.00 0.00 H new ATOM 0 HG LEU B 152 -2.072 11.046 -5.013 1.00 0.00 H new ATOM 0 HD11 LEU B 152 -0.761 9.640 -3.469 1.00 0.00 H new ATOM 0 HD12 LEU B 152 -0.139 11.306 -3.544 1.00 0.00 H new ATOM 0 HD13 LEU B 152 -1.109 10.780 -2.148 1.00 0.00 H new ATOM 0 HD21 LEU B 152 -3.146 9.175 -3.834 1.00 0.00 H new ATOM 0 HD22 LEU B 152 -3.620 10.281 -2.522 1.00 0.00 H new ATOM 0 HD23 LEU B 152 -4.285 10.504 -4.158 1.00 0.00 H new ATOM 2106 N THR B 153 -3.329 15.550 -4.410 1.00 0.00 N ATOM 2107 CA THR B 153 -3.447 16.954 -4.033 1.00 0.00 C ATOM 2108 C THR B 153 -4.887 17.426 -4.246 1.00 0.00 C ATOM 2109 O THR B 153 -5.417 18.201 -3.471 1.00 0.00 O ATOM 2110 CB THR B 153 -2.512 17.839 -4.877 1.00 0.00 C ATOM 2111 OG1 THR B 153 -1.196 17.262 -4.916 1.00 0.00 O ATOM 2112 CG2 THR B 153 -2.399 19.231 -4.275 1.00 0.00 C ATOM 0 H THR B 153 -2.690 15.372 -5.185 1.00 0.00 H new ATOM 0 HA THR B 153 -3.167 17.042 -2.983 1.00 0.00 H new ATOM 0 HB THR B 153 -2.931 17.906 -5.881 1.00 0.00 H new ATOM 0 HG1 THR B 153 -1.182 16.522 -5.558 1.00 0.00 H new ATOM 0 HG21 THR B 153 -1.734 19.839 -4.887 1.00 0.00 H new ATOM 0 HG22 THR B 153 -3.385 19.694 -4.241 1.00 0.00 H new ATOM 0 HG23 THR B 153 -1.997 19.159 -3.264 1.00 0.00 H new ATOM 2120 N SER B 154 -5.503 16.928 -5.280 1.00 0.00 N ATOM 2121 CA SER B 154 -6.832 17.267 -5.622 1.00 0.00 C ATOM 2122 C SER B 154 -7.857 16.602 -4.674 1.00 0.00 C ATOM 2123 O SER B 154 -8.905 17.179 -4.366 1.00 0.00 O ATOM 2124 CB SER B 154 -7.027 16.881 -7.059 1.00 0.00 C ATOM 2125 OG SER B 154 -6.080 17.579 -7.880 1.00 0.00 O ATOM 0 H SER B 154 -5.073 16.258 -5.918 1.00 0.00 H new ATOM 0 HA SER B 154 -7.002 18.337 -5.504 1.00 0.00 H new ATOM 0 HB2 SER B 154 -6.901 15.805 -7.177 1.00 0.00 H new ATOM 0 HB3 SER B 154 -8.042 17.120 -7.375 1.00 0.00 H new ATOM 0 HG SER B 154 -5.220 17.109 -7.859 1.00 0.00 H new ATOM 2131 N ILE B 155 -7.544 15.399 -4.221 1.00 0.00 N ATOM 2132 CA ILE B 155 -8.402 14.664 -3.303 1.00 0.00 C ATOM 2133 C ILE B 155 -8.261 15.209 -1.891 1.00 0.00 C ATOM 2134 O ILE B 155 -9.242 15.588 -1.258 1.00 0.00 O ATOM 2135 CB ILE B 155 -8.023 13.158 -3.264 1.00 0.00 C ATOM 2136 CG1 ILE B 155 -8.146 12.523 -4.650 1.00 0.00 C ATOM 2137 CG2 ILE B 155 -8.899 12.411 -2.253 1.00 0.00 C ATOM 2138 CD1 ILE B 155 -7.582 11.117 -4.728 1.00 0.00 C ATOM 0 H ILE B 155 -6.690 14.904 -4.478 1.00 0.00 H new ATOM 0 HA ILE B 155 -9.425 14.781 -3.660 1.00 0.00 H new ATOM 0 HB ILE B 155 -6.982 13.081 -2.949 1.00 0.00 H new ATOM 0 HG12 ILE B 155 -9.197 12.500 -4.937 1.00 0.00 H new ATOM 0 HG13 ILE B 155 -7.631 13.153 -5.376 1.00 0.00 H new ATOM 0 HG21 ILE B 155 -8.620 11.357 -2.238 1.00 0.00 H new ATOM 0 HG22 ILE B 155 -8.755 12.838 -1.261 1.00 0.00 H new ATOM 0 HG23 ILE B 155 -9.946 12.505 -2.540 1.00 0.00 H new ATOM 0 HD11 ILE B 155 -7.704 10.731 -5.740 1.00 0.00 H new ATOM 0 HD12 ILE B 155 -6.523 11.135 -4.472 1.00 0.00 H new ATOM 0 HD13 ILE B 155 -8.113 10.473 -4.028 1.00 0.00 H new ATOM 2150 N LEU B 156 -7.035 15.246 -1.419 1.00 0.00 N ATOM 2151 CA LEU B 156 -6.746 15.606 -0.043 1.00 0.00 C ATOM 2152 C LEU B 156 -6.871 17.109 0.131 1.00 0.00 C ATOM 2153 O LEU B 156 -7.217 17.604 1.201 1.00 0.00 O ATOM 2154 CB LEU B 156 -5.322 15.147 0.353 1.00 0.00 C ATOM 2155 CG LEU B 156 -4.845 13.754 -0.151 1.00 0.00 C ATOM 2156 CD1 LEU B 156 -3.515 13.408 0.442 1.00 0.00 C ATOM 2157 CD2 LEU B 156 -5.831 12.642 0.125 1.00 0.00 C ATOM 0 H LEU B 156 -6.208 15.028 -1.975 1.00 0.00 H new ATOM 0 HA LEU B 156 -7.464 15.105 0.606 1.00 0.00 H new ATOM 0 HB2 LEU B 156 -4.616 15.894 -0.009 1.00 0.00 H new ATOM 0 HB3 LEU B 156 -5.259 15.150 1.441 1.00 0.00 H new ATOM 0 HG LEU B 156 -4.761 13.840 -1.234 1.00 0.00 H new ATOM 0 HD11 LEU B 156 -3.198 12.431 0.078 1.00 0.00 H new ATOM 0 HD12 LEU B 156 -2.781 14.159 0.152 1.00 0.00 H new ATOM 0 HD13 LEU B 156 -3.597 13.382 1.529 1.00 0.00 H new ATOM 0 HD21 LEU B 156 -5.433 11.700 -0.253 1.00 0.00 H new ATOM 0 HD22 LEU B 156 -5.996 12.561 1.199 1.00 0.00 H new ATOM 0 HD23 LEU B 156 -6.776 12.862 -0.372 1.00 0.00 H new ATOM 2169 N GLY B 157 -6.552 17.815 -0.924 1.00 0.00 N ATOM 2170 CA GLY B 157 -6.667 19.250 -0.964 1.00 0.00 C ATOM 2171 C GLY B 157 -5.447 19.956 -0.445 1.00 0.00 C ATOM 2172 O GLY B 157 -5.425 21.179 -0.365 1.00 0.00 O ATOM 0 H GLY B 157 -6.201 17.404 -1.789 1.00 0.00 H new ATOM 0 HA2 GLY B 157 -6.852 19.565 -1.991 1.00 0.00 H new ATOM 0 HA3 GLY B 157 -7.533 19.555 -0.377 1.00 0.00 H new ATOM 2176 N ASN B 158 -4.421 19.202 -0.103 1.00 0.00 N ATOM 2177 CA ASN B 158 -3.179 19.793 0.377 1.00 0.00 C ATOM 2178 C ASN B 158 -2.045 19.030 -0.230 1.00 0.00 C ATOM 2179 O ASN B 158 -2.028 17.783 -0.166 1.00 0.00 O ATOM 2180 CB ASN B 158 -3.027 19.728 1.916 1.00 0.00 C ATOM 2181 CG ASN B 158 -4.304 19.466 2.660 1.00 0.00 C ATOM 2182 OD1 ASN B 158 -5.053 20.369 3.004 1.00 0.00 O ATOM 2183 ND2 ASN B 158 -4.526 18.227 2.964 1.00 0.00 N ATOM 0 H ASN B 158 -4.418 18.183 -0.147 1.00 0.00 H new ATOM 0 HA ASN B 158 -3.183 20.845 0.093 1.00 0.00 H new ATOM 0 HB2 ASN B 158 -2.310 18.945 2.164 1.00 0.00 H new ATOM 0 HB3 ASN B 158 -2.605 20.670 2.266 1.00 0.00 H new ATOM 0 HD21 ASN B 158 -5.350 17.976 3.510 1.00 0.00 H new ATOM 0 HD22 ASN B 158 -3.877 17.503 2.658 1.00 0.00 H new ATOM 2190 N ALA B 159 -1.097 19.739 -0.789 1.00 0.00 N ATOM 2191 CA ALA B 159 0.055 19.132 -1.432 1.00 0.00 C ATOM 2192 C ALA B 159 0.961 18.470 -0.412 1.00 0.00 C ATOM 2193 O ALA B 159 1.651 17.520 -0.724 1.00 0.00 O ATOM 2194 CB ALA B 159 0.821 20.158 -2.250 1.00 0.00 C ATOM 0 H ALA B 159 -1.097 20.759 -0.814 1.00 0.00 H new ATOM 0 HA ALA B 159 -0.308 18.360 -2.111 1.00 0.00 H new ATOM 0 HB1 ALA B 159 1.679 19.680 -2.722 1.00 0.00 H new ATOM 0 HB2 ALA B 159 0.168 20.572 -3.019 1.00 0.00 H new ATOM 0 HB3 ALA B 159 1.166 20.960 -1.597 1.00 0.00 H new ATOM 2200 N ALA B 160 0.899 18.942 0.829 1.00 0.00 N ATOM 2201 CA ALA B 160 1.715 18.398 1.909 1.00 0.00 C ATOM 2202 C ALA B 160 1.338 16.961 2.142 1.00 0.00 C ATOM 2203 O ALA B 160 2.179 16.082 2.237 1.00 0.00 O ATOM 2204 CB ALA B 160 1.476 19.177 3.185 1.00 0.00 C ATOM 0 H ALA B 160 0.287 19.707 1.113 1.00 0.00 H new ATOM 0 HA ALA B 160 2.766 18.472 1.629 1.00 0.00 H new ATOM 0 HB1 ALA B 160 2.090 18.763 3.985 1.00 0.00 H new ATOM 0 HB2 ALA B 160 1.742 20.222 3.028 1.00 0.00 H new ATOM 0 HB3 ALA B 160 0.424 19.108 3.462 1.00 0.00 H new ATOM 2210 N ASN B 161 0.050 16.739 2.175 1.00 0.00 N ATOM 2211 CA ASN B 161 -0.516 15.427 2.419 1.00 0.00 C ATOM 2212 C ASN B 161 -0.258 14.531 1.222 1.00 0.00 C ATOM 2213 O ASN B 161 0.107 13.368 1.363 1.00 0.00 O ATOM 2214 CB ASN B 161 -2.024 15.544 2.645 1.00 0.00 C ATOM 2215 CG ASN B 161 -2.465 16.174 3.967 1.00 0.00 C ATOM 2216 OD1 ASN B 161 -3.567 15.934 4.419 1.00 0.00 O ATOM 2217 ND2 ASN B 161 -1.637 16.944 4.589 1.00 0.00 N ATOM 0 H ASN B 161 -0.648 17.469 2.032 1.00 0.00 H new ATOM 0 HA ASN B 161 -0.050 14.998 3.306 1.00 0.00 H new ATOM 0 HB2 ASN B 161 -2.448 16.130 1.829 1.00 0.00 H new ATOM 0 HB3 ASN B 161 -2.458 14.546 2.580 1.00 0.00 H new ATOM 0 HD21 ASN B 161 -1.903 17.365 5.479 1.00 0.00 H new ATOM 0 HD22 ASN B 161 -0.717 17.131 4.190 1.00 0.00 H new ATOM 2224 N ALA B 162 -0.418 15.112 0.040 1.00 0.00 N ATOM 2225 CA ALA B 162 -0.248 14.405 -1.219 1.00 0.00 C ATOM 2226 C ALA B 162 1.180 13.930 -1.383 1.00 0.00 C ATOM 2227 O ALA B 162 1.422 12.776 -1.729 1.00 0.00 O ATOM 2228 CB ALA B 162 -0.619 15.323 -2.371 1.00 0.00 C ATOM 0 H ALA B 162 -0.671 16.094 -0.071 1.00 0.00 H new ATOM 0 HA ALA B 162 -0.902 13.533 -1.218 1.00 0.00 H new ATOM 0 HB1 ALA B 162 -0.491 14.793 -3.315 1.00 0.00 H new ATOM 0 HB2 ALA B 162 -1.658 15.635 -2.268 1.00 0.00 H new ATOM 0 HB3 ALA B 162 0.026 16.201 -2.359 1.00 0.00 H new ATOM 2234 N LYS B 163 2.113 14.806 -1.087 1.00 0.00 N ATOM 2235 CA LYS B 163 3.502 14.529 -1.271 1.00 0.00 C ATOM 2236 C LYS B 163 3.992 13.521 -0.258 1.00 0.00 C ATOM 2237 O LYS B 163 4.758 12.636 -0.601 1.00 0.00 O ATOM 2238 CB LYS B 163 4.312 15.830 -1.250 1.00 0.00 C ATOM 2239 CG LYS B 163 5.811 15.656 -1.370 1.00 0.00 C ATOM 2240 CD LYS B 163 6.493 17.000 -1.465 1.00 0.00 C ATOM 2241 CE LYS B 163 7.996 16.860 -1.478 1.00 0.00 C ATOM 2242 NZ LYS B 163 8.507 16.291 -0.216 1.00 0.00 N ATOM 0 H LYS B 163 1.919 15.734 -0.710 1.00 0.00 H new ATOM 0 HA LYS B 163 3.646 14.076 -2.252 1.00 0.00 H new ATOM 0 HB2 LYS B 163 3.969 16.466 -2.066 1.00 0.00 H new ATOM 0 HB3 LYS B 163 4.097 16.359 -0.322 1.00 0.00 H new ATOM 0 HG2 LYS B 163 6.190 15.109 -0.506 1.00 0.00 H new ATOM 0 HG3 LYS B 163 6.044 15.060 -2.252 1.00 0.00 H new ATOM 0 HD2 LYS B 163 6.167 17.511 -2.371 1.00 0.00 H new ATOM 0 HD3 LYS B 163 6.192 17.622 -0.622 1.00 0.00 H new ATOM 0 HE2 LYS B 163 8.294 16.223 -2.310 1.00 0.00 H new ATOM 0 HE3 LYS B 163 8.450 17.837 -1.646 1.00 0.00 H new ATOM 0 HZ1 LYS B 163 9.531 16.458 -0.150 1.00 0.00 H new ATOM 0 HZ2 LYS B 163 8.029 16.745 0.588 1.00 0.00 H new ATOM 0 HZ3 LYS B 163 8.321 15.268 -0.196 1.00 0.00 H new ATOM 2256 N GLN B 164 3.504 13.618 0.976 1.00 0.00 N ATOM 2257 CA GLN B 164 3.893 12.667 2.009 1.00 0.00 C ATOM 2258 C GLN B 164 3.463 11.252 1.675 1.00 0.00 C ATOM 2259 O GLN B 164 4.226 10.283 1.883 1.00 0.00 O ATOM 2260 CB GLN B 164 3.406 13.083 3.398 1.00 0.00 C ATOM 2261 CG GLN B 164 4.116 14.312 3.922 1.00 0.00 C ATOM 2262 CD GLN B 164 4.097 14.400 5.429 1.00 0.00 C ATOM 2263 OE1 GLN B 164 4.987 13.885 6.105 1.00 0.00 O ATOM 2264 NE2 GLN B 164 3.101 15.028 5.970 1.00 0.00 N ATOM 0 H GLN B 164 2.847 14.336 1.281 1.00 0.00 H new ATOM 0 HA GLN B 164 4.983 12.678 2.036 1.00 0.00 H new ATOM 0 HB2 GLN B 164 2.334 13.276 3.360 1.00 0.00 H new ATOM 0 HB3 GLN B 164 3.556 12.257 4.094 1.00 0.00 H new ATOM 0 HG2 GLN B 164 5.150 14.304 3.576 1.00 0.00 H new ATOM 0 HG3 GLN B 164 3.647 15.203 3.505 1.00 0.00 H new ATOM 0 HE21 GLN B 164 2.380 15.444 5.381 1.00 0.00 H new ATOM 0 HE22 GLN B 164 3.038 15.107 6.985 1.00 0.00 H new ATOM 2273 N LEU B 165 2.284 11.135 1.114 1.00 0.00 N ATOM 2274 CA LEU B 165 1.748 9.857 0.756 1.00 0.00 C ATOM 2275 C LEU B 165 2.422 9.311 -0.504 1.00 0.00 C ATOM 2276 O LEU B 165 2.912 8.179 -0.510 1.00 0.00 O ATOM 2277 CB LEU B 165 0.232 9.956 0.581 1.00 0.00 C ATOM 2278 CG LEU B 165 -0.495 8.666 0.208 1.00 0.00 C ATOM 2279 CD1 LEU B 165 -0.208 7.576 1.226 1.00 0.00 C ATOM 2280 CD2 LEU B 165 -1.988 8.921 0.113 1.00 0.00 C ATOM 0 H LEU B 165 1.676 11.924 0.896 1.00 0.00 H new ATOM 0 HA LEU B 165 1.955 9.153 1.562 1.00 0.00 H new ATOM 0 HB2 LEU B 165 -0.195 10.332 1.511 1.00 0.00 H new ATOM 0 HB3 LEU B 165 0.025 10.699 -0.189 1.00 0.00 H new ATOM 0 HG LEU B 165 -0.132 8.330 -0.763 1.00 0.00 H new ATOM 0 HD11 LEU B 165 -0.735 6.665 0.942 1.00 0.00 H new ATOM 0 HD12 LEU B 165 0.864 7.380 1.257 1.00 0.00 H new ATOM 0 HD13 LEU B 165 -0.546 7.899 2.210 1.00 0.00 H new ATOM 0 HD21 LEU B 165 -2.499 7.996 -0.153 1.00 0.00 H new ATOM 0 HD22 LEU B 165 -2.358 9.276 1.075 1.00 0.00 H new ATOM 0 HD23 LEU B 165 -2.181 9.675 -0.651 1.00 0.00 H new ATOM 2292 N TYR B 166 2.495 10.140 -1.541 1.00 0.00 N ATOM 2293 CA TYR B 166 3.079 9.751 -2.827 1.00 0.00 C ATOM 2294 C TYR B 166 4.534 9.315 -2.655 1.00 0.00 C ATOM 2295 O TYR B 166 4.981 8.308 -3.260 1.00 0.00 O ATOM 2296 CB TYR B 166 2.984 10.927 -3.811 1.00 0.00 C ATOM 2297 CG TYR B 166 3.450 10.636 -5.225 1.00 0.00 C ATOM 2298 CD1 TYR B 166 2.603 10.027 -6.139 1.00 0.00 C ATOM 2299 CD2 TYR B 166 4.724 10.998 -5.654 1.00 0.00 C ATOM 2300 CE1 TYR B 166 3.005 9.787 -7.436 1.00 0.00 C ATOM 2301 CE2 TYR B 166 5.136 10.755 -6.952 1.00 0.00 C ATOM 2302 CZ TYR B 166 4.272 10.149 -7.838 1.00 0.00 C ATOM 2303 OH TYR B 166 4.671 9.909 -9.130 1.00 0.00 O ATOM 0 H TYR B 166 2.152 11.100 -1.517 1.00 0.00 H new ATOM 0 HA TYR B 166 2.521 8.904 -3.225 1.00 0.00 H new ATOM 0 HB2 TYR B 166 1.947 11.262 -3.851 1.00 0.00 H new ATOM 0 HB3 TYR B 166 3.572 11.756 -3.417 1.00 0.00 H new ATOM 0 HD1 TYR B 166 1.610 9.735 -5.829 1.00 0.00 H new ATOM 0 HD2 TYR B 166 5.402 11.476 -4.962 1.00 0.00 H new ATOM 0 HE1 TYR B 166 2.329 9.317 -8.134 1.00 0.00 H new ATOM 0 HE2 TYR B 166 6.129 11.039 -7.269 1.00 0.00 H new ATOM 0 HH TYR B 166 5.591 10.225 -9.252 1.00 0.00 H new ATOM 2313 N ASP B 167 5.253 10.054 -1.827 1.00 0.00 N ATOM 2314 CA ASP B 167 6.649 9.778 -1.533 1.00 0.00 C ATOM 2315 C ASP B 167 6.791 8.455 -0.823 1.00 0.00 C ATOM 2316 O ASP B 167 7.635 7.662 -1.190 1.00 0.00 O ATOM 2317 CB ASP B 167 7.267 10.919 -0.714 1.00 0.00 C ATOM 2318 CG ASP B 167 8.719 10.712 -0.335 1.00 0.00 C ATOM 2319 OD1 ASP B 167 9.543 10.373 -1.207 1.00 0.00 O ATOM 2320 OD2 ASP B 167 9.081 10.984 0.834 1.00 0.00 O ATOM 0 H ASP B 167 4.882 10.868 -1.337 1.00 0.00 H new ATOM 0 HA ASP B 167 7.194 9.712 -2.475 1.00 0.00 H new ATOM 0 HB2 ASP B 167 7.183 11.844 -1.284 1.00 0.00 H new ATOM 0 HB3 ASP B 167 6.683 11.052 0.197 1.00 0.00 H new ATOM 2325 N PHE B 168 5.906 8.188 0.139 1.00 0.00 N ATOM 2326 CA PHE B 168 5.932 6.930 0.889 1.00 0.00 C ATOM 2327 C PHE B 168 5.725 5.754 -0.066 1.00 0.00 C ATOM 2328 O PHE B 168 6.514 4.827 -0.082 1.00 0.00 O ATOM 2329 CB PHE B 168 4.851 6.943 1.985 1.00 0.00 C ATOM 2330 CG PHE B 168 4.873 5.751 2.909 1.00 0.00 C ATOM 2331 CD1 PHE B 168 5.922 5.568 3.797 1.00 0.00 C ATOM 2332 CD2 PHE B 168 3.839 4.834 2.908 1.00 0.00 C ATOM 2333 CE1 PHE B 168 5.941 4.492 4.661 1.00 0.00 C ATOM 2334 CE2 PHE B 168 3.854 3.753 3.770 1.00 0.00 C ATOM 2335 CZ PHE B 168 4.905 3.583 4.646 1.00 0.00 C ATOM 0 H PHE B 168 5.161 8.827 0.418 1.00 0.00 H new ATOM 0 HA PHE B 168 6.903 6.819 1.371 1.00 0.00 H new ATOM 0 HB2 PHE B 168 4.968 7.849 2.580 1.00 0.00 H new ATOM 0 HB3 PHE B 168 3.872 6.998 1.509 1.00 0.00 H new ATOM 0 HD1 PHE B 168 6.736 6.278 3.813 1.00 0.00 H new ATOM 0 HD2 PHE B 168 3.011 4.963 2.227 1.00 0.00 H new ATOM 0 HE1 PHE B 168 6.765 4.363 5.347 1.00 0.00 H new ATOM 0 HE2 PHE B 168 3.042 3.041 3.757 1.00 0.00 H new ATOM 0 HZ PHE B 168 4.917 2.739 5.319 1.00 0.00 H new ATOM 2345 N ILE B 169 4.688 5.871 -0.909 1.00 0.00 N ATOM 2346 CA ILE B 169 4.308 4.881 -1.954 1.00 0.00 C ATOM 2347 C ILE B 169 5.493 4.543 -2.894 1.00 0.00 C ATOM 2348 O ILE B 169 5.572 3.416 -3.491 1.00 0.00 O ATOM 2349 CB ILE B 169 3.114 5.432 -2.800 1.00 0.00 C ATOM 2350 CG1 ILE B 169 1.872 5.617 -1.929 1.00 0.00 C ATOM 2351 CG2 ILE B 169 2.796 4.537 -3.989 1.00 0.00 C ATOM 2352 CD1 ILE B 169 0.726 6.291 -2.651 1.00 0.00 C ATOM 0 H ILE B 169 4.065 6.679 -0.890 1.00 0.00 H new ATOM 0 HA ILE B 169 4.014 3.964 -1.443 1.00 0.00 H new ATOM 0 HB ILE B 169 3.420 6.403 -3.191 1.00 0.00 H new ATOM 0 HG12 ILE B 169 1.542 4.643 -1.569 1.00 0.00 H new ATOM 0 HG13 ILE B 169 2.137 6.208 -1.052 1.00 0.00 H new ATOM 0 HG21 ILE B 169 1.960 4.958 -4.548 1.00 0.00 H new ATOM 0 HG22 ILE B 169 3.669 4.470 -4.638 1.00 0.00 H new ATOM 0 HG23 ILE B 169 2.530 3.541 -3.634 1.00 0.00 H new ATOM 0 HD11 ILE B 169 -0.122 6.390 -1.974 1.00 0.00 H new ATOM 0 HD12 ILE B 169 1.039 7.279 -2.988 1.00 0.00 H new ATOM 0 HD13 ILE B 169 0.435 5.690 -3.512 1.00 0.00 H new ATOM 2364 N HIS B 170 6.350 5.532 -3.082 1.00 0.00 N ATOM 2365 CA HIS B 170 7.508 5.414 -3.965 1.00 0.00 C ATOM 2366 C HIS B 170 8.875 5.406 -3.216 1.00 0.00 C ATOM 2367 O HIS B 170 9.914 5.662 -3.825 1.00 0.00 O ATOM 2368 CB HIS B 170 7.464 6.528 -5.016 1.00 0.00 C ATOM 2369 CG HIS B 170 6.295 6.410 -5.957 1.00 0.00 C ATOM 2370 ND1 HIS B 170 5.073 6.999 -5.720 1.00 0.00 N ATOM 2371 CD2 HIS B 170 6.158 5.742 -7.122 1.00 0.00 C ATOM 2372 CE1 HIS B 170 4.245 6.690 -6.703 1.00 0.00 C ATOM 2373 NE2 HIS B 170 4.883 5.935 -7.554 1.00 0.00 N ATOM 0 H HIS B 170 6.266 6.442 -2.629 1.00 0.00 H new ATOM 0 HA HIS B 170 7.440 4.440 -4.449 1.00 0.00 H new ATOM 0 HB2 HIS B 170 7.420 7.493 -4.511 1.00 0.00 H new ATOM 0 HB3 HIS B 170 8.389 6.512 -5.592 1.00 0.00 H new ATOM 0 HD1 HIS B 170 4.843 7.581 -4.914 1.00 0.00 H new ATOM 0 HD2 HIS B 170 6.921 5.161 -7.619 1.00 0.00 H new ATOM 0 HE1 HIS B 170 3.216 7.008 -6.787 1.00 0.00 H new ATOM 2382 N THR B 171 8.879 5.089 -1.938 1.00 0.00 N ATOM 2383 CA THR B 171 10.129 4.978 -1.178 1.00 0.00 C ATOM 2384 C THR B 171 10.419 3.504 -0.865 1.00 0.00 C ATOM 2385 O THR B 171 9.757 2.919 -0.043 1.00 0.00 O ATOM 2386 CB THR B 171 10.071 5.814 0.138 1.00 0.00 C ATOM 2387 OG1 THR B 171 10.023 7.217 -0.172 1.00 0.00 O ATOM 2388 CG2 THR B 171 11.266 5.528 1.042 1.00 0.00 C ATOM 0 H THR B 171 8.036 4.902 -1.394 1.00 0.00 H new ATOM 0 HA THR B 171 10.937 5.381 -1.789 1.00 0.00 H new ATOM 0 HB THR B 171 9.167 5.524 0.674 1.00 0.00 H new ATOM 0 HG1 THR B 171 9.212 7.411 -0.686 1.00 0.00 H new ATOM 0 HG21 THR B 171 11.189 6.129 1.948 1.00 0.00 H new ATOM 0 HG22 THR B 171 11.276 4.471 1.308 1.00 0.00 H new ATOM 0 HG23 THR B 171 12.188 5.779 0.517 1.00 0.00 H new ATOM 2396 N SER B 172 11.416 2.926 -1.522 1.00 0.00 N ATOM 2397 CA SER B 172 11.717 1.498 -1.399 1.00 0.00 C ATOM 2398 C SER B 172 11.950 1.082 0.068 1.00 0.00 C ATOM 2399 O SER B 172 12.515 1.857 0.876 1.00 0.00 O ATOM 2400 CB SER B 172 12.937 1.122 -2.260 1.00 0.00 C ATOM 2401 OG SER B 172 12.838 1.677 -3.567 1.00 0.00 O ATOM 0 H SER B 172 12.039 3.428 -2.154 1.00 0.00 H new ATOM 0 HA SER B 172 10.846 0.953 -1.763 1.00 0.00 H new ATOM 0 HB2 SER B 172 13.848 1.479 -1.779 1.00 0.00 H new ATOM 0 HB3 SER B 172 13.016 0.037 -2.328 1.00 0.00 H new ATOM 0 HG SER B 172 13.627 1.424 -4.091 1.00 0.00 H new ATOM 2407 N PHE B 173 11.549 -0.147 0.392 1.00 0.00 N ATOM 2408 CA PHE B 173 11.636 -0.701 1.757 1.00 0.00 C ATOM 2409 C PHE B 173 13.092 -0.790 2.193 1.00 0.00 C ATOM 2410 O PHE B 173 13.400 -0.827 3.372 1.00 0.00 O ATOM 2411 CB PHE B 173 11.034 -2.109 1.794 1.00 0.00 C ATOM 2412 CG PHE B 173 9.684 -2.232 1.145 1.00 0.00 C ATOM 2413 CD1 PHE B 173 8.544 -1.742 1.752 1.00 0.00 C ATOM 2414 CD2 PHE B 173 9.570 -2.828 -0.095 1.00 0.00 C ATOM 2415 CE1 PHE B 173 7.319 -1.843 1.130 1.00 0.00 C ATOM 2416 CE2 PHE B 173 8.351 -2.930 -0.722 1.00 0.00 C ATOM 2417 CZ PHE B 173 7.224 -2.436 -0.111 1.00 0.00 C ATOM 0 H PHE B 173 11.150 -0.797 -0.286 1.00 0.00 H new ATOM 0 HA PHE B 173 11.085 -0.043 2.429 1.00 0.00 H new ATOM 0 HB2 PHE B 173 11.722 -2.797 1.303 1.00 0.00 H new ATOM 0 HB3 PHE B 173 10.953 -2.428 2.833 1.00 0.00 H new ATOM 0 HD1 PHE B 173 8.614 -1.275 2.723 1.00 0.00 H new ATOM 0 HD2 PHE B 173 10.452 -3.220 -0.580 1.00 0.00 H new ATOM 0 HE1 PHE B 173 6.434 -1.458 1.614 1.00 0.00 H new ATOM 0 HE2 PHE B 173 8.279 -3.398 -1.693 1.00 0.00 H new ATOM 0 HZ PHE B 173 6.265 -2.512 -0.602 1.00 0.00 H new