USER MOD reduce.3.24.130724 H: found=0, std=0, add=972, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 972 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 21 MET CE :methyl 172:sc= -1.38 (180deg=0) USER MOD Set 1.2: A 169 SER OG : rot 66:sc= 0.179 USER MOD Set 1.3: A 173 GLN : amide:sc= -2.89! C(o=-4.1!,f=-5.5!) USER MOD Set 2.1: A 68 TYR OH : rot 47:sc= 0.87 USER MOD Set 2.2: A 157 HIS : no HD1:sc= -2.16! C(o=-1.3!,f=-7.5!) USER MOD Set 3.1: A 26 TYR OH : rot -106:sc= 0.268 USER MOD Set 3.2: A 134 MET CE :methyl -162:sc= -1.77 (180deg=-2.52!) USER MOD Set 3.3: A 176 CYS SG : rot 155:sc= 0.58 USER MOD Set 4.1: A 126 CYS SG : rot 114:sc= 1.21 USER MOD Set 4.2: A 147 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 85 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 89 ASN : amide:sc= -1.63 K(o=-1.6,f=-0.7) USER MOD Set 6.1: A 20 LYS NZ :NH3+ 146:sc= -1.28 (180deg=-2.8!) USER MOD Set 6.2: A 24 ASN : amide:sc= -3.16 K(o=-4.4,f=-9.5!) USER MOD Set 7.1: A 19 SER OG : rot 180:sc= 0 USER MOD Set 7.2: A 23 GLN : amide:sc= -0.0727 X(o=-0.073,f=0) USER MOD Single : A 22 GLN : amide:sc= 0.516 K(o=0.52,f=-0.41) USER MOD Single : A 28 ASN : amide:sc= -3.01! C(o=-3!,f=-9.6!) USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -160:sc= -0.017 (180deg=-0.212) USER MOD Single : A 67 GLN : amide:sc= -0.0896 X(o=-0.09,f=0) USER MOD Single : A 71 MET CE :methyl -141:sc= 0 (180deg=-0.0455) USER MOD Single : A 80 MET CE :methyl 163:sc= -3.94! (180deg=-4.78!) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 ASN : amide:sc= -0.209 X(o=-0.21,f=-0.0055) USER MOD Single : A 91 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot -6:sc= 0.818 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -0.178 X(o=-0.18,f=0) USER MOD Single : A 104 MET CE :methyl -113:sc= -1.09 (180deg=-2.8!) USER MOD Single : A 105 ASN : amide:sc= -0.86 K(o=-0.86,f=-4.7!) USER MOD Single : A 110 THR OG1 : rot 57:sc= 1.19 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 160:sc= -0.0299 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 ASN : amide:sc= -0.127 K(o=-0.13,f=-1.9) USER MOD Single : A 132 SER OG : rot 105:sc= 0.336 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 HIS : no HD1:sc= -1.28 X(o=-1.3,f=-0.88) USER MOD Single : A 142 THR OG1 : rot -54:sc= 0.59 USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD Single : A 151 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 152 GLN : amide:sc= -0.493 X(o=-0.49,f=-0.39) USER MOD Single : A 156 CYS SG : rot 170:sc= -0.381 USER MOD Single : A 161 CYS SG : rot 160:sc= -5.57! USER MOD Single : A 164 ASN : amide:sc= -0.715 K(o=-0.72,f=-3.8!) USER MOD Single : A 167 ASN : amide:sc= 0.0741 K(o=0.074,f=-0.93) USER MOD ----------------------------------------------------------------- ATOM 213 N LEU A 18 -3.897 8.237 -11.760 1.00 0.00 N ATOM 214 CA LEU A 18 -4.415 6.929 -11.373 1.00 0.00 C ATOM 215 C LEU A 18 -4.461 5.985 -12.570 1.00 0.00 C ATOM 216 O LEU A 18 -4.361 4.767 -12.417 1.00 0.00 O ATOM 217 CB LEU A 18 -5.813 7.071 -10.767 1.00 0.00 C ATOM 218 CG LEU A 18 -5.868 7.481 -9.295 1.00 0.00 C ATOM 219 CD1 LEU A 18 -7.279 7.899 -8.910 1.00 0.00 C ATOM 220 CD2 LEU A 18 -5.386 6.344 -8.406 1.00 0.00 C ATOM 0 HA LEU A 18 -3.743 6.506 -10.626 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -6.367 7.807 -11.349 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -6.334 6.120 -10.878 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.206 8.334 -9.151 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.299 8.187 -7.859 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -7.588 8.745 -9.524 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.962 7.065 -9.070 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -5.432 6.654 -7.362 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -6.022 5.472 -8.554 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.358 6.091 -8.664 1.00 0.00 H new ATOM 232 N SER A 19 -4.610 6.555 -13.761 1.00 0.00 N ATOM 233 CA SER A 19 -4.670 5.764 -14.985 1.00 0.00 C ATOM 234 C SER A 19 -3.397 4.942 -15.164 1.00 0.00 C ATOM 235 O SER A 19 -3.440 3.712 -15.216 1.00 0.00 O ATOM 236 CB SER A 19 -4.876 6.675 -16.197 1.00 0.00 C ATOM 237 OG SER A 19 -4.938 5.923 -17.396 1.00 0.00 O ATOM 0 H SER A 19 -4.691 7.562 -13.905 1.00 0.00 H new ATOM 0 HA SER A 19 -5.515 5.081 -14.905 1.00 0.00 H new ATOM 0 HB2 SER A 19 -5.796 7.246 -16.074 1.00 0.00 H new ATOM 0 HB3 SER A 19 -4.060 7.395 -16.257 1.00 0.00 H new ATOM 0 HG SER A 19 -5.072 6.528 -18.155 1.00 0.00 H new ATOM 243 N LYS A 20 -2.264 5.630 -15.256 1.00 0.00 N ATOM 244 CA LYS A 20 -0.978 4.966 -15.428 1.00 0.00 C ATOM 245 C LYS A 20 -0.751 3.927 -14.334 1.00 0.00 C ATOM 246 O LYS A 20 -0.092 2.912 -14.556 1.00 0.00 O ATOM 247 CB LYS A 20 0.156 5.994 -15.411 1.00 0.00 C ATOM 248 CG LYS A 20 0.350 6.664 -14.062 1.00 0.00 C ATOM 249 CD LYS A 20 1.800 7.062 -13.841 1.00 0.00 C ATOM 250 CE LYS A 20 2.638 5.881 -13.375 1.00 0.00 C ATOM 251 NZ LYS A 20 3.032 4.999 -14.508 1.00 0.00 N ATOM 0 H LYS A 20 -2.211 6.648 -15.214 1.00 0.00 H new ATOM 0 HA LYS A 20 -0.986 4.458 -16.392 1.00 0.00 H new ATOM 0 HB2 LYS A 20 1.085 5.502 -15.700 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -0.047 6.758 -16.161 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -0.285 7.548 -13.999 1.00 0.00 H new ATOM 0 HG3 LYS A 20 0.033 5.987 -13.269 1.00 0.00 H new ATOM 0 HD2 LYS A 20 2.214 7.460 -14.767 1.00 0.00 H new ATOM 0 HD3 LYS A 20 1.850 7.860 -13.100 1.00 0.00 H new ATOM 0 HE2 LYS A 20 3.533 6.247 -12.871 1.00 0.00 H new ATOM 0 HE3 LYS A 20 2.075 5.302 -12.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 3.976 4.602 -14.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 2.343 4.225 -14.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 3.052 5.553 -15.388 1.00 0.00 H new ATOM 265 N MET A 21 -1.304 4.187 -13.154 1.00 0.00 N ATOM 266 CA MET A 21 -1.164 3.272 -12.027 1.00 0.00 C ATOM 267 C MET A 21 -1.914 1.969 -12.288 1.00 0.00 C ATOM 268 O MET A 21 -1.412 0.885 -11.992 1.00 0.00 O ATOM 269 CB MET A 21 -1.684 3.925 -10.745 1.00 0.00 C ATOM 270 CG MET A 21 -0.800 5.051 -10.234 1.00 0.00 C ATOM 271 SD MET A 21 -0.882 5.241 -8.443 1.00 0.00 S ATOM 272 CE MET A 21 0.656 4.466 -7.950 1.00 0.00 C ATOM 0 H MET A 21 -1.853 5.023 -12.953 1.00 0.00 H new ATOM 0 HA MET A 21 -0.105 3.043 -11.906 1.00 0.00 H new ATOM 0 HB2 MET A 21 -2.686 4.314 -10.926 1.00 0.00 H new ATOM 0 HB3 MET A 21 -1.773 3.164 -9.970 1.00 0.00 H new ATOM 0 HG2 MET A 21 0.232 4.859 -10.528 1.00 0.00 H new ATOM 0 HG3 MET A 21 -1.098 5.986 -10.709 1.00 0.00 H new ATOM 0 HE1 MET A 21 0.820 4.628 -6.885 1.00 0.00 H new ATOM 0 HE2 MET A 21 0.605 3.396 -8.150 1.00 0.00 H new ATOM 0 HE3 MET A 21 1.480 4.902 -8.515 1.00 0.00 H new ATOM 282 N GLN A 22 -3.116 2.084 -12.843 1.00 0.00 N ATOM 283 CA GLN A 22 -3.934 0.915 -13.142 1.00 0.00 C ATOM 284 C GLN A 22 -3.378 0.155 -14.342 1.00 0.00 C ATOM 285 O GLN A 22 -3.570 -1.055 -14.465 1.00 0.00 O ATOM 286 CB GLN A 22 -5.380 1.333 -13.414 1.00 0.00 C ATOM 287 CG GLN A 22 -6.110 1.834 -12.178 1.00 0.00 C ATOM 288 CD GLN A 22 -7.383 2.584 -12.517 1.00 0.00 C ATOM 289 OE1 GLN A 22 -7.374 3.513 -13.326 1.00 0.00 O ATOM 290 NE2 GLN A 22 -8.488 2.185 -11.899 1.00 0.00 N ATOM 0 H GLN A 22 -3.545 2.975 -13.095 1.00 0.00 H new ATOM 0 HA GLN A 22 -3.911 0.256 -12.274 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -5.387 2.116 -14.172 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -5.924 0.484 -13.828 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -6.352 0.988 -11.535 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -5.448 2.487 -11.609 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -8.450 1.411 -11.236 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -9.375 2.653 -12.087 1.00 0.00 H new ATOM 299 N GLN A 23 -2.689 0.872 -15.224 1.00 0.00 N ATOM 300 CA GLN A 23 -2.107 0.265 -16.415 1.00 0.00 C ATOM 301 C GLN A 23 -0.925 -0.626 -16.049 1.00 0.00 C ATOM 302 O GLN A 23 -0.972 -1.842 -16.229 1.00 0.00 O ATOM 303 CB GLN A 23 -1.660 1.347 -17.399 1.00 0.00 C ATOM 304 CG GLN A 23 -2.808 1.987 -18.163 1.00 0.00 C ATOM 305 CD GLN A 23 -2.346 3.086 -19.099 1.00 0.00 C ATOM 306 OE1 GLN A 23 -1.931 2.822 -20.227 1.00 0.00 O ATOM 307 NE2 GLN A 23 -2.416 4.328 -18.634 1.00 0.00 N ATOM 0 H GLN A 23 -2.520 1.874 -15.136 1.00 0.00 H new ATOM 0 HA GLN A 23 -2.871 -0.352 -16.888 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -1.121 2.122 -16.854 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -0.959 0.912 -18.111 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -3.329 1.221 -18.738 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -3.527 2.397 -17.454 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -2.767 4.501 -17.692 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -2.119 5.109 -19.219 1.00 0.00 H new ATOM 316 N ASN A 24 0.135 -0.012 -15.533 1.00 0.00 N ATOM 317 CA ASN A 24 1.331 -0.749 -15.142 1.00 0.00 C ATOM 318 C ASN A 24 1.399 -0.912 -13.627 1.00 0.00 C ATOM 319 O ASN A 24 1.414 -2.029 -13.112 1.00 0.00 O ATOM 320 CB ASN A 24 2.585 -0.032 -15.646 1.00 0.00 C ATOM 321 CG ASN A 24 2.508 1.470 -15.456 1.00 0.00 C ATOM 322 OD1 ASN A 24 3.125 2.025 -14.547 1.00 0.00 O ATOM 323 ND2 ASN A 24 1.746 2.137 -16.316 1.00 0.00 N ATOM 0 H ASN A 24 0.190 0.994 -15.376 1.00 0.00 H new ATOM 0 HA ASN A 24 1.281 -1.740 -15.594 1.00 0.00 H new ATOM 0 HB2 ASN A 24 3.457 -0.418 -15.119 1.00 0.00 H new ATOM 0 HB3 ASN A 24 2.727 -0.255 -16.703 1.00 0.00 H new ATOM 0 HD21 ASN A 24 1.655 3.150 -16.238 1.00 0.00 H new ATOM 0 HD22 ASN A 24 1.252 1.636 -17.055 1.00 0.00 H new ATOM 330 N GLY A 25 1.438 0.212 -12.917 1.00 0.00 N ATOM 331 CA GLY A 25 1.503 0.172 -11.468 1.00 0.00 C ATOM 332 C GLY A 25 2.746 0.850 -10.925 1.00 0.00 C ATOM 333 O GLY A 25 3.261 1.792 -11.527 1.00 0.00 O ATOM 0 H GLY A 25 1.426 1.149 -13.320 1.00 0.00 H new ATOM 0 HA2 GLY A 25 0.618 0.656 -11.054 1.00 0.00 H new ATOM 0 HA3 GLY A 25 1.484 -0.866 -11.135 1.00 0.00 H new ATOM 337 N TYR A 26 3.227 0.372 -9.783 1.00 0.00 N ATOM 338 CA TYR A 26 4.414 0.941 -9.156 1.00 0.00 C ATOM 339 C TYR A 26 5.253 -0.146 -8.490 1.00 0.00 C ATOM 340 O TYR A 26 4.869 -0.696 -7.458 1.00 0.00 O ATOM 341 CB TYR A 26 4.015 1.996 -8.123 1.00 0.00 C ATOM 342 CG TYR A 26 5.138 2.941 -7.758 1.00 0.00 C ATOM 343 CD1 TYR A 26 6.309 2.468 -7.179 1.00 0.00 C ATOM 344 CD2 TYR A 26 5.028 4.306 -7.993 1.00 0.00 C ATOM 345 CE1 TYR A 26 7.337 3.327 -6.842 1.00 0.00 C ATOM 346 CE2 TYR A 26 6.051 5.172 -7.661 1.00 0.00 C ATOM 347 CZ TYR A 26 7.204 4.678 -7.086 1.00 0.00 C ATOM 348 OH TYR A 26 8.226 5.538 -6.754 1.00 0.00 O ATOM 0 H TYR A 26 2.813 -0.408 -9.273 1.00 0.00 H new ATOM 0 HA TYR A 26 5.014 1.412 -9.935 1.00 0.00 H new ATOM 0 HB2 TYR A 26 3.177 2.574 -8.512 1.00 0.00 H new ATOM 0 HB3 TYR A 26 3.665 1.495 -7.220 1.00 0.00 H new ATOM 0 HD1 TYR A 26 6.417 1.410 -6.989 1.00 0.00 H new ATOM 0 HD2 TYR A 26 4.127 4.696 -8.443 1.00 0.00 H new ATOM 0 HE1 TYR A 26 8.240 2.943 -6.390 1.00 0.00 H new ATOM 0 HE2 TYR A 26 5.949 6.230 -7.850 1.00 0.00 H new ATOM 0 HH TYR A 26 7.974 6.054 -5.960 1.00 0.00 H new ATOM 358 N GLU A 27 6.399 -0.450 -9.090 1.00 0.00 N ATOM 359 CA GLU A 27 7.293 -1.472 -8.556 1.00 0.00 C ATOM 360 C GLU A 27 8.503 -0.836 -7.878 1.00 0.00 C ATOM 361 O GLU A 27 9.245 -0.074 -8.496 1.00 0.00 O ATOM 362 CB GLU A 27 7.755 -2.411 -9.672 1.00 0.00 C ATOM 363 CG GLU A 27 6.620 -2.937 -10.534 1.00 0.00 C ATOM 364 CD GLU A 27 6.263 -1.996 -11.668 1.00 0.00 C ATOM 365 OE1 GLU A 27 6.589 -0.795 -11.568 1.00 0.00 O ATOM 366 OE2 GLU A 27 5.657 -2.461 -12.656 1.00 0.00 O ATOM 0 H GLU A 27 6.731 -0.004 -9.945 1.00 0.00 H new ATOM 0 HA GLU A 27 6.742 -2.047 -7.812 1.00 0.00 H new ATOM 0 HB2 GLU A 27 8.468 -1.884 -10.307 1.00 0.00 H new ATOM 0 HB3 GLU A 27 8.285 -3.255 -9.229 1.00 0.00 H new ATOM 0 HG2 GLU A 27 6.901 -3.906 -10.946 1.00 0.00 H new ATOM 0 HG3 GLU A 27 5.741 -3.099 -9.911 1.00 0.00 H new ATOM 373 N ASN A 28 8.693 -1.154 -6.602 1.00 0.00 N ATOM 374 CA ASN A 28 9.812 -0.613 -5.838 1.00 0.00 C ATOM 375 C ASN A 28 11.142 -1.111 -6.394 1.00 0.00 C ATOM 376 O ASN A 28 11.391 -2.313 -6.492 1.00 0.00 O ATOM 377 CB ASN A 28 9.685 -1.002 -4.364 1.00 0.00 C ATOM 378 CG ASN A 28 10.544 -0.136 -3.462 1.00 0.00 C ATOM 379 OD1 ASN A 28 11.601 0.347 -3.868 1.00 0.00 O ATOM 380 ND2 ASN A 28 10.092 0.064 -2.229 1.00 0.00 N ATOM 0 H ASN A 28 8.087 -1.783 -6.075 1.00 0.00 H new ATOM 0 HA ASN A 28 9.787 0.473 -5.924 1.00 0.00 H new ATOM 0 HB2 ASN A 28 8.642 -0.919 -4.058 1.00 0.00 H new ATOM 0 HB3 ASN A 28 9.971 -2.046 -4.241 1.00 0.00 H new ATOM 0 HD21 ASN A 28 10.627 0.638 -1.577 1.00 0.00 H new ATOM 0 HD22 ASN A 28 9.210 -0.356 -1.935 1.00 0.00 H new ATOM 387 N PRO A 29 12.018 -0.167 -6.768 1.00 0.00 N ATOM 388 CA PRO A 29 13.338 -0.486 -7.320 1.00 0.00 C ATOM 389 C PRO A 29 14.275 -1.081 -6.274 1.00 0.00 C ATOM 390 O PRO A 29 15.015 -2.025 -6.553 1.00 0.00 O ATOM 391 CB PRO A 29 13.861 0.872 -7.796 1.00 0.00 C ATOM 392 CG PRO A 29 13.146 1.870 -6.952 1.00 0.00 C ATOM 393 CD PRO A 29 11.788 1.285 -6.679 1.00 0.00 C ATOM 0 HA PRO A 29 13.280 -1.236 -8.109 1.00 0.00 H new ATOM 0 HB2 PRO A 29 14.941 0.947 -7.669 1.00 0.00 H new ATOM 0 HB3 PRO A 29 13.653 1.027 -8.855 1.00 0.00 H new ATOM 0 HG2 PRO A 29 13.686 2.053 -6.023 1.00 0.00 H new ATOM 0 HG3 PRO A 29 13.062 2.827 -7.466 1.00 0.00 H new ATOM 0 HD2 PRO A 29 11.416 1.573 -5.696 1.00 0.00 H new ATOM 0 HD3 PRO A 29 11.052 1.621 -7.409 1.00 0.00 H new ATOM 401 N THR A 30 14.239 -0.523 -5.068 1.00 0.00 N ATOM 402 CA THR A 30 15.086 -0.998 -3.981 1.00 0.00 C ATOM 403 C THR A 30 14.872 -2.486 -3.728 1.00 0.00 C ATOM 404 O THR A 30 15.819 -3.218 -3.439 1.00 0.00 O ATOM 405 CB THR A 30 14.814 -0.223 -2.678 1.00 0.00 C ATOM 406 OG1 THR A 30 15.085 1.170 -2.870 1.00 0.00 O ATOM 407 CG2 THR A 30 15.671 -0.759 -1.541 1.00 0.00 C ATOM 0 H THR A 30 13.632 0.258 -4.819 1.00 0.00 H new ATOM 0 HA THR A 30 16.118 -0.829 -4.287 1.00 0.00 H new ATOM 0 HB THR A 30 13.764 -0.355 -2.415 1.00 0.00 H new ATOM 0 HG1 THR A 30 14.908 1.656 -2.037 1.00 0.00 H new ATOM 0 HG21 THR A 30 15.462 -0.196 -0.631 1.00 0.00 H new ATOM 0 HG22 THR A 30 15.441 -1.812 -1.377 1.00 0.00 H new ATOM 0 HG23 THR A 30 16.725 -0.653 -1.799 1.00 0.00 H new ATOM 824 N VAL A 61 4.322 14.909 8.203 1.00 0.00 N ATOM 825 CA VAL A 61 3.509 13.699 8.229 1.00 0.00 C ATOM 826 C VAL A 61 2.125 13.955 7.642 1.00 0.00 C ATOM 827 O VAL A 61 1.534 15.012 7.859 1.00 0.00 O ATOM 828 CB VAL A 61 3.353 13.159 9.663 1.00 0.00 C ATOM 829 CG1 VAL A 61 2.692 14.197 10.557 1.00 0.00 C ATOM 830 CG2 VAL A 61 2.559 11.862 9.660 1.00 0.00 C ATOM 0 HA VAL A 61 4.027 12.956 7.623 1.00 0.00 H new ATOM 0 HB VAL A 61 4.345 12.950 10.063 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.591 13.797 11.566 1.00 0.00 H new ATOM 0 HG12 VAL A 61 3.305 15.098 10.584 1.00 0.00 H new ATOM 0 HG13 VAL A 61 1.706 14.442 10.163 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.458 11.495 10.681 1.00 0.00 H new ATOM 0 HG22 VAL A 61 1.569 12.042 9.240 1.00 0.00 H new ATOM 0 HG23 VAL A 61 3.079 11.118 9.056 1.00 0.00 H new ATOM 840 N GLN A 62 1.616 12.979 6.897 1.00 0.00 N ATOM 841 CA GLN A 62 0.301 13.099 6.277 1.00 0.00 C ATOM 842 C GLN A 62 -0.632 11.994 6.762 1.00 0.00 C ATOM 843 O GLN A 62 -0.257 10.822 6.800 1.00 0.00 O ATOM 844 CB GLN A 62 0.425 13.045 4.753 1.00 0.00 C ATOM 845 CG GLN A 62 0.969 14.326 4.142 1.00 0.00 C ATOM 846 CD GLN A 62 1.221 14.200 2.652 1.00 0.00 C ATOM 847 OE1 GLN A 62 0.415 14.645 1.835 1.00 0.00 O ATOM 848 NE2 GLN A 62 2.345 13.592 2.291 1.00 0.00 N ATOM 0 H GLN A 62 2.093 12.098 6.708 1.00 0.00 H new ATOM 0 HA GLN A 62 -0.123 14.061 6.566 1.00 0.00 H new ATOM 0 HB2 GLN A 62 1.077 12.216 4.479 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -0.555 12.835 4.324 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.263 15.137 4.320 1.00 0.00 H new ATOM 0 HG3 GLN A 62 1.899 14.597 4.642 1.00 0.00 H new ATOM 0 HE21 GLN A 62 2.985 13.238 3.002 1.00 0.00 H new ATOM 0 HE22 GLN A 62 2.569 13.479 1.302 1.00 0.00 H new ATOM 857 N LYS A 63 -1.849 12.376 7.134 1.00 0.00 N ATOM 858 CA LYS A 63 -2.837 11.418 7.617 1.00 0.00 C ATOM 859 C LYS A 63 -4.037 11.354 6.677 1.00 0.00 C ATOM 860 O LYS A 63 -4.669 12.372 6.392 1.00 0.00 O ATOM 861 CB LYS A 63 -3.299 11.798 9.026 1.00 0.00 C ATOM 862 CG LYS A 63 -2.310 11.416 10.114 1.00 0.00 C ATOM 863 CD LYS A 63 -1.252 12.489 10.306 1.00 0.00 C ATOM 864 CE LYS A 63 -0.640 12.424 11.698 1.00 0.00 C ATOM 865 NZ LYS A 63 -1.597 12.876 12.745 1.00 0.00 N ATOM 0 H LYS A 63 -2.175 13.342 7.110 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.369 10.434 7.648 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -3.472 12.874 9.065 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -4.254 11.314 9.229 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -2.843 11.257 11.052 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -1.830 10.472 9.856 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -0.469 12.368 9.557 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -1.696 13.472 10.148 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -0.326 11.402 11.910 1.00 0.00 H new ATOM 0 HE3 LYS A 63 0.255 13.046 11.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -1.073 13.142 13.603 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -2.130 13.698 12.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -2.258 12.104 12.968 1.00 0.00 H new ATOM 879 N PHE A 64 -4.346 10.153 6.200 1.00 0.00 N ATOM 880 CA PHE A 64 -5.470 9.957 5.293 1.00 0.00 C ATOM 881 C PHE A 64 -6.486 8.986 5.888 1.00 0.00 C ATOM 882 O PHE A 64 -6.128 7.902 6.348 1.00 0.00 O ATOM 883 CB PHE A 64 -4.978 9.434 3.942 1.00 0.00 C ATOM 884 CG PHE A 64 -4.045 10.377 3.238 1.00 0.00 C ATOM 885 CD1 PHE A 64 -4.539 11.354 2.387 1.00 0.00 C ATOM 886 CD2 PHE A 64 -2.676 10.289 3.426 1.00 0.00 C ATOM 887 CE1 PHE A 64 -3.683 12.222 1.737 1.00 0.00 C ATOM 888 CE2 PHE A 64 -1.815 11.155 2.779 1.00 0.00 C ATOM 889 CZ PHE A 64 -2.319 12.124 1.934 1.00 0.00 C ATOM 0 H PHE A 64 -3.833 9.301 6.427 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.958 10.921 5.146 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.472 8.480 4.093 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -5.838 9.241 3.301 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -5.604 11.437 2.231 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -2.276 9.534 4.087 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -4.080 12.977 1.075 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -0.749 11.074 2.934 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.649 12.803 1.428 1.00 0.00 H new ATOM 899 N ARG A 65 -7.754 9.383 5.874 1.00 0.00 N ATOM 900 CA ARG A 65 -8.822 8.549 6.413 1.00 0.00 C ATOM 901 C ARG A 65 -9.240 7.482 5.406 1.00 0.00 C ATOM 902 O ARG A 65 -9.904 7.778 4.412 1.00 0.00 O ATOM 903 CB ARG A 65 -10.028 9.410 6.791 1.00 0.00 C ATOM 904 CG ARG A 65 -11.003 8.716 7.729 1.00 0.00 C ATOM 905 CD ARG A 65 -11.937 9.711 8.398 1.00 0.00 C ATOM 906 NE ARG A 65 -13.153 9.930 7.620 1.00 0.00 N ATOM 907 CZ ARG A 65 -14.059 10.855 7.916 1.00 0.00 C ATOM 908 NH1 ARG A 65 -13.886 11.644 8.968 1.00 0.00 N ATOM 909 NH2 ARG A 65 -15.140 10.993 7.159 1.00 0.00 N ATOM 0 H ARG A 65 -8.067 10.277 5.495 1.00 0.00 H new ATOM 0 HA ARG A 65 -8.445 8.052 7.307 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -9.675 10.328 7.262 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -10.555 9.700 5.882 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -11.588 7.985 7.171 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -10.449 8.167 8.490 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -12.203 9.348 9.391 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -11.418 10.660 8.534 1.00 0.00 H new ATOM 0 HE ARG A 65 -13.316 9.340 6.804 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -13.056 11.541 9.552 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -14.583 12.354 9.193 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -15.276 10.388 6.349 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -15.835 11.704 7.387 1.00 0.00 H new ATOM 923 N VAL A 66 -8.847 6.240 5.669 1.00 0.00 N ATOM 924 CA VAL A 66 -9.181 5.129 4.786 1.00 0.00 C ATOM 925 C VAL A 66 -9.726 3.945 5.576 1.00 0.00 C ATOM 926 O VAL A 66 -9.661 3.923 6.805 1.00 0.00 O ATOM 927 CB VAL A 66 -7.956 4.670 3.973 1.00 0.00 C ATOM 928 CG1 VAL A 66 -7.320 5.850 3.254 1.00 0.00 C ATOM 929 CG2 VAL A 66 -6.946 3.979 4.877 1.00 0.00 C ATOM 0 H VAL A 66 -8.297 5.978 6.487 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.948 5.489 4.100 1.00 0.00 H new ATOM 0 HB VAL A 66 -8.288 3.953 3.222 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -6.456 5.507 2.685 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -8.047 6.298 2.576 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -7.001 6.593 3.985 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -6.087 3.661 4.286 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -6.617 4.672 5.652 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -7.409 3.108 5.341 1.00 0.00 H new ATOM 939 N GLN A 67 -10.262 2.961 4.862 1.00 0.00 N ATOM 940 CA GLN A 67 -10.819 1.772 5.497 1.00 0.00 C ATOM 941 C GLN A 67 -9.896 0.572 5.311 1.00 0.00 C ATOM 942 O GLN A 67 -9.050 0.560 4.416 1.00 0.00 O ATOM 943 CB GLN A 67 -12.202 1.460 4.921 1.00 0.00 C ATOM 944 CG GLN A 67 -13.324 2.253 5.570 1.00 0.00 C ATOM 945 CD GLN A 67 -14.530 2.406 4.665 1.00 0.00 C ATOM 946 OE1 GLN A 67 -14.633 3.371 3.906 1.00 0.00 O ATOM 947 NE2 GLN A 67 -15.452 1.453 4.740 1.00 0.00 N ATOM 0 H GLN A 67 -10.323 2.963 3.844 1.00 0.00 H new ATOM 0 HA GLN A 67 -10.914 1.972 6.564 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -12.195 1.665 3.851 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -12.404 0.396 5.040 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -13.627 1.758 6.492 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -12.954 3.240 5.845 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -15.326 0.671 5.383 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -16.286 1.503 4.155 1.00 0.00 H new ATOM 956 N TYR A 68 -10.063 -0.434 6.162 1.00 0.00 N ATOM 957 CA TYR A 68 -9.242 -1.637 6.093 1.00 0.00 C ATOM 958 C TYR A 68 -10.042 -2.811 5.537 1.00 0.00 C ATOM 959 O TYR A 68 -11.157 -3.086 5.984 1.00 0.00 O ATOM 960 CB TYR A 68 -8.697 -1.988 7.479 1.00 0.00 C ATOM 961 CG TYR A 68 -7.372 -2.714 7.442 1.00 0.00 C ATOM 962 CD1 TYR A 68 -7.218 -3.883 6.706 1.00 0.00 C ATOM 963 CD2 TYR A 68 -6.274 -2.233 8.144 1.00 0.00 C ATOM 964 CE1 TYR A 68 -6.009 -4.550 6.670 1.00 0.00 C ATOM 965 CE2 TYR A 68 -5.061 -2.893 8.113 1.00 0.00 C ATOM 966 CZ TYR A 68 -4.933 -4.051 7.374 1.00 0.00 C ATOM 967 OH TYR A 68 -3.727 -4.712 7.342 1.00 0.00 O ATOM 0 H TYR A 68 -10.759 -0.440 6.907 1.00 0.00 H new ATOM 0 HA TYR A 68 -8.407 -1.438 5.421 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -8.584 -1.072 8.058 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -9.427 -2.607 8.001 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -8.058 -4.277 6.153 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -6.370 -1.327 8.724 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -5.907 -5.458 6.094 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -4.217 -2.505 8.664 1.00 0.00 H new ATOM 0 HH TYR A 68 -3.507 -4.947 6.416 1.00 0.00 H new ATOM 977 N LEU A 69 -9.465 -3.501 4.560 1.00 0.00 N ATOM 978 CA LEU A 69 -10.123 -4.648 3.941 1.00 0.00 C ATOM 979 C LEU A 69 -9.590 -5.956 4.516 1.00 0.00 C ATOM 980 O LEU A 69 -10.347 -6.897 4.750 1.00 0.00 O ATOM 981 CB LEU A 69 -9.918 -4.621 2.426 1.00 0.00 C ATOM 982 CG LEU A 69 -10.979 -3.875 1.618 1.00 0.00 C ATOM 983 CD1 LEU A 69 -10.700 -2.380 1.623 1.00 0.00 C ATOM 984 CD2 LEU A 69 -11.034 -4.404 0.192 1.00 0.00 C ATOM 0 H LEU A 69 -8.543 -3.287 4.179 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.189 -4.586 4.158 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.948 -4.169 2.219 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.873 -5.649 2.067 1.00 0.00 H new ATOM 0 HG LEU A 69 -11.949 -4.045 2.085 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.466 -1.865 1.043 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -10.712 -2.011 2.649 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -9.722 -2.191 1.181 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -11.795 -3.861 -0.368 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.064 -4.265 -0.285 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.282 -5.465 0.207 1.00 0.00 H new ATOM 996 N GLY A 70 -8.280 -6.008 4.742 1.00 0.00 N ATOM 997 CA GLY A 70 -7.669 -7.205 5.289 1.00 0.00 C ATOM 998 C GLY A 70 -6.457 -7.652 4.495 1.00 0.00 C ATOM 999 O GLY A 70 -6.172 -7.109 3.428 1.00 0.00 O ATOM 0 H GLY A 70 -7.632 -5.243 4.556 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -7.375 -7.019 6.322 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.405 -8.009 5.307 1.00 0.00 H new ATOM 1003 N MET A 71 -5.742 -8.642 5.017 1.00 0.00 N ATOM 1004 CA MET A 71 -4.554 -9.161 4.349 1.00 0.00 C ATOM 1005 C MET A 71 -4.917 -10.301 3.402 1.00 0.00 C ATOM 1006 O MET A 71 -5.846 -11.066 3.663 1.00 0.00 O ATOM 1007 CB MET A 71 -3.533 -9.645 5.381 1.00 0.00 C ATOM 1008 CG MET A 71 -2.153 -9.898 4.797 1.00 0.00 C ATOM 1009 SD MET A 71 -1.214 -11.118 5.736 1.00 0.00 S ATOM 1010 CE MET A 71 -1.980 -12.637 5.177 1.00 0.00 C ATOM 0 H MET A 71 -5.964 -9.101 5.900 1.00 0.00 H new ATOM 0 HA MET A 71 -4.114 -8.353 3.765 1.00 0.00 H new ATOM 0 HB2 MET A 71 -3.452 -8.903 6.176 1.00 0.00 H new ATOM 0 HB3 MET A 71 -3.899 -10.564 5.839 1.00 0.00 H new ATOM 0 HG2 MET A 71 -2.256 -10.239 3.767 1.00 0.00 H new ATOM 0 HG3 MET A 71 -1.597 -8.961 4.769 1.00 0.00 H new ATOM 0 HE1 MET A 71 -2.077 -13.326 6.016 1.00 0.00 H new ATOM 0 HE2 MET A 71 -2.968 -12.418 4.771 1.00 0.00 H new ATOM 0 HE3 MET A 71 -1.362 -13.092 4.403 1.00 0.00 H new ATOM 1020 N LEU A 72 -4.179 -10.408 2.303 1.00 0.00 N ATOM 1021 CA LEU A 72 -4.424 -11.455 1.316 1.00 0.00 C ATOM 1022 C LEU A 72 -3.111 -11.993 0.757 1.00 0.00 C ATOM 1023 O LEU A 72 -2.279 -11.250 0.235 1.00 0.00 O ATOM 1024 CB LEU A 72 -5.294 -10.918 0.179 1.00 0.00 C ATOM 1025 CG LEU A 72 -6.230 -11.929 -0.485 1.00 0.00 C ATOM 1026 CD1 LEU A 72 -5.434 -12.943 -1.292 1.00 0.00 C ATOM 1027 CD2 LEU A 72 -7.085 -12.630 0.560 1.00 0.00 C ATOM 0 H LEU A 72 -3.406 -9.783 2.072 1.00 0.00 H new ATOM 0 HA LEU A 72 -4.949 -12.272 1.811 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -5.896 -10.096 0.566 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -4.640 -10.501 -0.587 1.00 0.00 H new ATOM 0 HG LEU A 72 -6.891 -11.392 -1.165 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -6.116 -13.654 -1.757 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -4.865 -12.427 -2.065 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -4.749 -13.476 -0.633 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -7.745 -13.346 0.070 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -6.440 -13.155 1.265 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -7.683 -11.892 1.095 1.00 0.00 H new ATOM 1039 N PRO A 73 -2.919 -13.316 0.865 1.00 0.00 N ATOM 1040 CA PRO A 73 -1.710 -13.984 0.373 1.00 0.00 C ATOM 1041 C PRO A 73 -1.636 -13.998 -1.150 1.00 0.00 C ATOM 1042 O PRO A 73 -2.631 -14.254 -1.828 1.00 0.00 O ATOM 1043 CB PRO A 73 -1.846 -15.409 0.915 1.00 0.00 C ATOM 1044 CG PRO A 73 -3.312 -15.607 1.096 1.00 0.00 C ATOM 1045 CD PRO A 73 -3.868 -14.262 1.475 1.00 0.00 C ATOM 0 HA PRO A 73 -0.802 -13.475 0.697 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -1.431 -16.138 0.220 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -1.311 -15.527 1.857 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -3.772 -15.975 0.179 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -3.513 -16.345 1.872 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -4.878 -14.122 1.090 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -3.919 -14.139 2.557 1.00 0.00 H new ATOM 1053 N VAL A 74 -0.449 -13.724 -1.683 1.00 0.00 N ATOM 1054 CA VAL A 74 -0.244 -13.707 -3.126 1.00 0.00 C ATOM 1055 C VAL A 74 0.818 -14.719 -3.542 1.00 0.00 C ATOM 1056 O VAL A 74 1.409 -15.395 -2.701 1.00 0.00 O ATOM 1057 CB VAL A 74 0.174 -12.308 -3.618 1.00 0.00 C ATOM 1058 CG1 VAL A 74 -0.954 -11.310 -3.410 1.00 0.00 C ATOM 1059 CG2 VAL A 74 1.440 -11.851 -2.908 1.00 0.00 C ATOM 0 H VAL A 74 0.385 -13.511 -1.136 1.00 0.00 H new ATOM 0 HA VAL A 74 -1.196 -13.975 -3.584 1.00 0.00 H new ATOM 0 HB VAL A 74 0.384 -12.364 -4.686 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -0.640 -10.328 -3.763 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.833 -11.633 -3.968 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.198 -11.253 -2.349 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.721 -10.861 -3.267 1.00 0.00 H new ATOM 0 HG22 VAL A 74 1.260 -11.810 -1.834 1.00 0.00 H new ATOM 0 HG23 VAL A 74 2.247 -12.555 -3.114 1.00 0.00 H new ATOM 1069 N ASP A 75 1.055 -14.816 -4.846 1.00 0.00 N ATOM 1070 CA ASP A 75 2.048 -15.744 -5.375 1.00 0.00 C ATOM 1071 C ASP A 75 3.279 -14.996 -5.877 1.00 0.00 C ATOM 1072 O ASP A 75 4.366 -15.565 -5.975 1.00 0.00 O ATOM 1073 CB ASP A 75 1.446 -16.578 -6.507 1.00 0.00 C ATOM 1074 CG ASP A 75 2.501 -17.319 -7.304 1.00 0.00 C ATOM 1075 OD1 ASP A 75 3.127 -18.243 -6.744 1.00 0.00 O ATOM 1076 OD2 ASP A 75 2.700 -16.975 -8.488 1.00 0.00 O ATOM 0 H ASP A 75 0.573 -14.264 -5.556 1.00 0.00 H new ATOM 0 HA ASP A 75 2.354 -16.409 -4.567 1.00 0.00 H new ATOM 0 HB2 ASP A 75 0.739 -17.295 -6.090 1.00 0.00 H new ATOM 0 HB3 ASP A 75 0.882 -15.926 -7.174 1.00 0.00 H new ATOM 1081 N ARG A 76 3.099 -13.718 -6.194 1.00 0.00 N ATOM 1082 CA ARG A 76 4.195 -12.892 -6.688 1.00 0.00 C ATOM 1083 C ARG A 76 4.205 -11.532 -5.996 1.00 0.00 C ATOM 1084 O ARG A 76 3.163 -10.980 -5.644 1.00 0.00 O ATOM 1085 CB ARG A 76 4.078 -12.706 -8.202 1.00 0.00 C ATOM 1086 CG ARG A 76 4.448 -13.946 -8.998 1.00 0.00 C ATOM 1087 CD ARG A 76 5.949 -14.194 -8.979 1.00 0.00 C ATOM 1088 NE ARG A 76 6.371 -15.078 -10.061 1.00 0.00 N ATOM 1089 CZ ARG A 76 7.518 -15.749 -10.057 1.00 0.00 C ATOM 1090 NH1 ARG A 76 8.351 -15.638 -9.032 1.00 0.00 N ATOM 1091 NH2 ARG A 76 7.832 -16.535 -11.079 1.00 0.00 N ATOM 0 H ARG A 76 2.205 -13.232 -6.118 1.00 0.00 H new ATOM 0 HA ARG A 76 5.132 -13.401 -6.463 1.00 0.00 H new ATOM 0 HB2 ARG A 76 3.055 -12.420 -8.446 1.00 0.00 H new ATOM 0 HB3 ARG A 76 4.722 -11.882 -8.509 1.00 0.00 H new ATOM 0 HG2 ARG A 76 3.930 -14.812 -8.586 1.00 0.00 H new ATOM 0 HG3 ARG A 76 4.110 -13.833 -10.028 1.00 0.00 H new ATOM 0 HD2 ARG A 76 6.475 -13.243 -9.062 1.00 0.00 H new ATOM 0 HD3 ARG A 76 6.232 -14.632 -8.022 1.00 0.00 H new ATOM 0 HE ARG A 76 5.752 -15.187 -10.864 1.00 0.00 H new ATOM 0 HH11 ARG A 76 8.112 -15.036 -8.244 1.00 0.00 H new ATOM 0 HH12 ARG A 76 9.231 -16.154 -9.032 1.00 0.00 H new ATOM 0 HH21 ARG A 76 7.193 -16.625 -11.869 1.00 0.00 H new ATOM 0 HH22 ARG A 76 8.713 -17.050 -11.075 1.00 0.00 H new ATOM 1105 N PRO A 77 5.410 -10.979 -5.797 1.00 0.00 N ATOM 1106 CA PRO A 77 5.586 -9.677 -5.146 1.00 0.00 C ATOM 1107 C PRO A 77 5.092 -8.524 -6.013 1.00 0.00 C ATOM 1108 O PRO A 77 4.721 -7.466 -5.505 1.00 0.00 O ATOM 1109 CB PRO A 77 7.100 -9.583 -4.944 1.00 0.00 C ATOM 1110 CG PRO A 77 7.679 -10.460 -5.999 1.00 0.00 C ATOM 1111 CD PRO A 77 6.695 -11.581 -6.191 1.00 0.00 C ATOM 0 HA PRO A 77 5.013 -9.603 -4.221 1.00 0.00 H new ATOM 0 HB2 PRO A 77 7.450 -8.556 -5.047 1.00 0.00 H new ATOM 0 HB3 PRO A 77 7.388 -9.919 -3.948 1.00 0.00 H new ATOM 0 HG2 PRO A 77 7.828 -9.908 -6.927 1.00 0.00 H new ATOM 0 HG3 PRO A 77 8.653 -10.843 -5.696 1.00 0.00 H new ATOM 0 HD2 PRO A 77 6.677 -11.927 -7.225 1.00 0.00 H new ATOM 0 HD3 PRO A 77 6.942 -12.443 -5.571 1.00 0.00 H new ATOM 1119 N VAL A 78 5.088 -8.736 -7.326 1.00 0.00 N ATOM 1120 CA VAL A 78 4.638 -7.715 -8.264 1.00 0.00 C ATOM 1121 C VAL A 78 3.691 -8.303 -9.304 1.00 0.00 C ATOM 1122 O VAL A 78 3.553 -9.521 -9.415 1.00 0.00 O ATOM 1123 CB VAL A 78 5.826 -7.052 -8.985 1.00 0.00 C ATOM 1124 CG1 VAL A 78 6.795 -6.452 -7.978 1.00 0.00 C ATOM 1125 CG2 VAL A 78 6.533 -8.057 -9.882 1.00 0.00 C ATOM 0 H VAL A 78 5.392 -9.606 -7.763 1.00 0.00 H new ATOM 0 HA VAL A 78 4.110 -6.961 -7.681 1.00 0.00 H new ATOM 0 HB VAL A 78 5.444 -6.246 -9.611 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.628 -5.988 -8.506 1.00 0.00 H new ATOM 0 HG12 VAL A 78 6.280 -5.700 -7.381 1.00 0.00 H new ATOM 0 HG13 VAL A 78 7.173 -7.238 -7.324 1.00 0.00 H new ATOM 0 HG21 VAL A 78 7.370 -7.571 -10.384 1.00 0.00 H new ATOM 0 HG22 VAL A 78 6.903 -8.886 -9.279 1.00 0.00 H new ATOM 0 HG23 VAL A 78 5.833 -8.435 -10.627 1.00 0.00 H new ATOM 1135 N GLY A 79 3.040 -7.429 -10.065 1.00 0.00 N ATOM 1136 CA GLY A 79 2.113 -7.881 -11.087 1.00 0.00 C ATOM 1137 C GLY A 79 0.697 -7.404 -10.837 1.00 0.00 C ATOM 1138 O GLY A 79 -0.004 -7.940 -9.980 1.00 0.00 O ATOM 0 H GLY A 79 3.138 -6.416 -9.992 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.447 -7.522 -12.061 1.00 0.00 H new ATOM 0 HA3 GLY A 79 2.124 -8.970 -11.127 1.00 0.00 H new ATOM 1142 N MET A 80 0.274 -6.391 -11.587 1.00 0.00 N ATOM 1143 CA MET A 80 -1.069 -5.841 -11.442 1.00 0.00 C ATOM 1144 C MET A 80 -2.096 -6.955 -11.265 1.00 0.00 C ATOM 1145 O MET A 80 -2.823 -6.989 -10.272 1.00 0.00 O ATOM 1146 CB MET A 80 -1.428 -4.988 -12.660 1.00 0.00 C ATOM 1147 CG MET A 80 -0.905 -3.564 -12.580 1.00 0.00 C ATOM 1148 SD MET A 80 -2.010 -2.467 -11.670 1.00 0.00 S ATOM 1149 CE MET A 80 -1.647 -2.945 -9.983 1.00 0.00 C ATOM 0 H MET A 80 0.842 -5.935 -12.301 1.00 0.00 H new ATOM 0 HA MET A 80 -1.084 -5.213 -10.551 1.00 0.00 H new ATOM 0 HB2 MET A 80 -1.029 -5.463 -13.556 1.00 0.00 H new ATOM 0 HB3 MET A 80 -2.512 -4.963 -12.769 1.00 0.00 H new ATOM 0 HG2 MET A 80 0.074 -3.567 -12.100 1.00 0.00 H new ATOM 0 HG3 MET A 80 -0.764 -3.176 -13.589 1.00 0.00 H new ATOM 0 HE1 MET A 80 -2.008 -2.175 -9.301 1.00 0.00 H new ATOM 0 HE2 MET A 80 -2.142 -3.890 -9.758 1.00 0.00 H new ATOM 0 HE3 MET A 80 -0.570 -3.061 -9.861 1.00 0.00 H new ATOM 1159 N ASP A 81 -2.150 -7.863 -12.233 1.00 0.00 N ATOM 1160 CA ASP A 81 -3.088 -8.978 -12.184 1.00 0.00 C ATOM 1161 C ASP A 81 -3.142 -9.581 -10.783 1.00 0.00 C ATOM 1162 O ASP A 81 -4.216 -9.900 -10.273 1.00 0.00 O ATOM 1163 CB ASP A 81 -2.691 -10.051 -13.199 1.00 0.00 C ATOM 1164 CG ASP A 81 -1.299 -10.596 -12.952 1.00 0.00 C ATOM 1165 OD1 ASP A 81 -0.408 -9.803 -12.583 1.00 0.00 O ATOM 1166 OD2 ASP A 81 -1.099 -11.817 -13.128 1.00 0.00 O ATOM 0 H ASP A 81 -1.555 -7.849 -13.061 1.00 0.00 H new ATOM 0 HA ASP A 81 -4.078 -8.599 -12.436 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -3.410 -10.869 -13.159 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -2.741 -9.632 -14.204 1.00 0.00 H new ATOM 1171 N THR A 82 -1.974 -9.737 -10.166 1.00 0.00 N ATOM 1172 CA THR A 82 -1.888 -10.303 -8.826 1.00 0.00 C ATOM 1173 C THR A 82 -2.606 -9.423 -7.809 1.00 0.00 C ATOM 1174 O THR A 82 -3.414 -9.906 -7.015 1.00 0.00 O ATOM 1175 CB THR A 82 -0.423 -10.486 -8.387 1.00 0.00 C ATOM 1176 OG1 THR A 82 0.311 -11.178 -9.403 1.00 0.00 O ATOM 1177 CG2 THR A 82 -0.343 -11.260 -7.079 1.00 0.00 C ATOM 0 H THR A 82 -1.075 -9.479 -10.574 1.00 0.00 H new ATOM 0 HA THR A 82 -2.373 -11.278 -8.863 1.00 0.00 H new ATOM 0 HB THR A 82 0.013 -9.499 -8.234 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.242 -11.288 -9.116 1.00 0.00 H new ATOM 0 HG21 THR A 82 0.701 -11.377 -6.789 1.00 0.00 H new ATOM 0 HG22 THR A 82 -0.877 -10.715 -6.301 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.796 -12.243 -7.210 1.00 0.00 H new ATOM 1185 N LEU A 83 -2.307 -8.129 -7.839 1.00 0.00 N ATOM 1186 CA LEU A 83 -2.925 -7.180 -6.919 1.00 0.00 C ATOM 1187 C LEU A 83 -4.445 -7.209 -7.047 1.00 0.00 C ATOM 1188 O LEU A 83 -5.156 -7.402 -6.062 1.00 0.00 O ATOM 1189 CB LEU A 83 -2.406 -5.767 -7.189 1.00 0.00 C ATOM 1190 CG LEU A 83 -2.353 -4.829 -5.983 1.00 0.00 C ATOM 1191 CD1 LEU A 83 -1.011 -4.942 -5.277 1.00 0.00 C ATOM 1192 CD2 LEU A 83 -2.613 -3.392 -6.412 1.00 0.00 C ATOM 0 H LEU A 83 -1.641 -7.713 -8.490 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.659 -7.470 -5.903 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -1.403 -5.844 -7.608 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -3.036 -5.310 -7.952 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.134 -5.125 -5.283 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -0.992 -4.267 -4.421 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -0.865 -5.966 -4.934 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -0.212 -4.674 -5.969 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -2.571 -2.739 -5.540 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -1.855 -3.085 -7.132 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -3.599 -3.322 -6.871 1.00 0.00 H new ATOM 1204 N ASN A 84 -4.935 -7.018 -8.267 1.00 0.00 N ATOM 1205 CA ASN A 84 -6.370 -7.024 -8.524 1.00 0.00 C ATOM 1206 C ASN A 84 -7.032 -8.242 -7.886 1.00 0.00 C ATOM 1207 O ASN A 84 -8.216 -8.214 -7.551 1.00 0.00 O ATOM 1208 CB ASN A 84 -6.640 -7.014 -10.030 1.00 0.00 C ATOM 1209 CG ASN A 84 -6.701 -5.608 -10.597 1.00 0.00 C ATOM 1210 OD1 ASN A 84 -7.767 -5.128 -10.981 1.00 0.00 O ATOM 1211 ND2 ASN A 84 -5.553 -4.942 -10.651 1.00 0.00 N ATOM 0 H ASN A 84 -4.359 -6.857 -9.093 1.00 0.00 H new ATOM 0 HA ASN A 84 -6.797 -6.125 -8.079 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -5.857 -7.575 -10.540 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -7.581 -7.525 -10.231 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -5.531 -3.992 -11.022 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -4.693 -5.380 -10.321 1.00 0.00 H new ATOM 1218 N SER A 85 -6.259 -9.311 -7.722 1.00 0.00 N ATOM 1219 CA SER A 85 -6.770 -10.540 -7.127 1.00 0.00 C ATOM 1220 C SER A 85 -7.103 -10.333 -5.653 1.00 0.00 C ATOM 1221 O SER A 85 -8.159 -10.751 -5.179 1.00 0.00 O ATOM 1222 CB SER A 85 -5.747 -11.668 -7.276 1.00 0.00 C ATOM 1223 OG SER A 85 -6.330 -12.927 -6.991 1.00 0.00 O ATOM 0 H SER A 85 -5.276 -9.351 -7.993 1.00 0.00 H new ATOM 0 HA SER A 85 -7.684 -10.816 -7.653 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.348 -11.670 -8.291 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.907 -11.492 -6.604 1.00 0.00 H new ATOM 0 HG SER A 85 -5.656 -13.631 -7.095 1.00 0.00 H new ATOM 1229 N ALA A 86 -6.195 -9.683 -4.933 1.00 0.00 N ATOM 1230 CA ALA A 86 -6.392 -9.417 -3.513 1.00 0.00 C ATOM 1231 C ALA A 86 -7.634 -8.563 -3.282 1.00 0.00 C ATOM 1232 O ALA A 86 -8.476 -8.889 -2.445 1.00 0.00 O ATOM 1233 CB ALA A 86 -5.164 -8.736 -2.928 1.00 0.00 C ATOM 0 H ALA A 86 -5.315 -9.331 -5.310 1.00 0.00 H new ATOM 0 HA ALA A 86 -6.540 -10.371 -3.007 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -5.325 -8.543 -1.867 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -4.296 -9.383 -3.051 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -4.990 -7.793 -3.446 1.00 0.00 H new ATOM 1239 N ILE A 87 -7.741 -7.469 -4.028 1.00 0.00 N ATOM 1240 CA ILE A 87 -8.880 -6.568 -3.904 1.00 0.00 C ATOM 1241 C ILE A 87 -10.196 -7.325 -4.042 1.00 0.00 C ATOM 1242 O ILE A 87 -11.066 -7.240 -3.175 1.00 0.00 O ATOM 1243 CB ILE A 87 -8.831 -5.449 -4.961 1.00 0.00 C ATOM 1244 CG1 ILE A 87 -7.568 -4.604 -4.783 1.00 0.00 C ATOM 1245 CG2 ILE A 87 -10.075 -4.578 -4.869 1.00 0.00 C ATOM 1246 CD1 ILE A 87 -7.143 -3.879 -6.041 1.00 0.00 C ATOM 0 H ILE A 87 -7.053 -7.185 -4.725 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.822 -6.121 -2.912 1.00 0.00 H new ATOM 0 HB ILE A 87 -8.803 -5.905 -5.950 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.738 -3.873 -3.992 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.753 -5.248 -4.452 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -10.025 -3.792 -5.622 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -10.961 -5.190 -5.041 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -10.131 -4.128 -3.878 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.241 -3.300 -5.840 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -6.941 -4.605 -6.829 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.940 -3.209 -6.362 1.00 0.00 H new ATOM 1258 N GLU A 88 -10.335 -8.067 -5.136 1.00 0.00 N ATOM 1259 CA GLU A 88 -11.545 -8.841 -5.386 1.00 0.00 C ATOM 1260 C GLU A 88 -11.736 -9.913 -4.317 1.00 0.00 C ATOM 1261 O GLU A 88 -12.863 -10.272 -3.978 1.00 0.00 O ATOM 1262 CB GLU A 88 -11.486 -9.490 -6.771 1.00 0.00 C ATOM 1263 CG GLU A 88 -11.533 -8.490 -7.914 1.00 0.00 C ATOM 1264 CD GLU A 88 -11.392 -9.150 -9.272 1.00 0.00 C ATOM 1265 OE1 GLU A 88 -12.381 -9.746 -9.747 1.00 0.00 O ATOM 1266 OE2 GLU A 88 -10.293 -9.071 -9.859 1.00 0.00 O ATOM 0 H GLU A 88 -9.625 -8.148 -5.863 1.00 0.00 H new ATOM 0 HA GLU A 88 -12.395 -8.160 -5.348 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -10.570 -10.076 -6.850 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -12.319 -10.185 -6.873 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -12.476 -7.944 -7.876 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -10.735 -7.758 -7.785 1.00 0.00 H new ATOM 1273 N ASN A 89 -10.626 -10.420 -3.791 1.00 0.00 N ATOM 1274 CA ASN A 89 -10.671 -11.452 -2.762 1.00 0.00 C ATOM 1275 C ASN A 89 -11.357 -10.934 -1.502 1.00 0.00 C ATOM 1276 O ASN A 89 -12.358 -11.494 -1.052 1.00 0.00 O ATOM 1277 CB ASN A 89 -9.256 -11.928 -2.426 1.00 0.00 C ATOM 1278 CG ASN A 89 -8.819 -13.096 -3.289 1.00 0.00 C ATOM 1279 OD1 ASN A 89 -9.503 -14.118 -3.363 1.00 0.00 O ATOM 1280 ND2 ASN A 89 -7.675 -12.951 -3.947 1.00 0.00 N ATOM 0 H ASN A 89 -9.685 -10.133 -4.060 1.00 0.00 H new ATOM 0 HA ASN A 89 -11.248 -12.292 -3.150 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -8.557 -11.102 -2.556 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -9.213 -12.219 -1.376 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -7.331 -13.704 -4.543 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -7.141 -12.087 -3.856 1.00 0.00 H new ATOM 1287 N LEU A 90 -10.814 -9.862 -0.937 1.00 0.00 N ATOM 1288 CA LEU A 90 -11.374 -9.267 0.272 1.00 0.00 C ATOM 1289 C LEU A 90 -12.746 -8.661 -0.005 1.00 0.00 C ATOM 1290 O LEU A 90 -13.715 -8.946 0.699 1.00 0.00 O ATOM 1291 CB LEU A 90 -10.432 -8.194 0.820 1.00 0.00 C ATOM 1292 CG LEU A 90 -9.284 -8.694 1.699 1.00 0.00 C ATOM 1293 CD1 LEU A 90 -9.824 -9.476 2.886 1.00 0.00 C ATOM 1294 CD2 LEU A 90 -8.324 -9.549 0.886 1.00 0.00 C ATOM 0 H LEU A 90 -9.986 -9.386 -1.296 1.00 0.00 H new ATOM 0 HA LEU A 90 -11.488 -10.056 1.016 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -10.007 -7.648 -0.022 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -11.022 -7.482 1.397 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.737 -7.830 2.077 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -8.994 -9.824 3.500 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -10.471 -8.832 3.482 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -10.395 -10.333 2.528 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.514 -9.896 1.527 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -8.857 -10.408 0.478 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -7.912 -8.957 0.069 1.00 0.00 H new ATOM 1306 N MET A 91 -12.822 -7.826 -1.036 1.00 0.00 N ATOM 1307 CA MET A 91 -14.077 -7.183 -1.408 1.00 0.00 C ATOM 1308 C MET A 91 -15.245 -8.156 -1.279 1.00 0.00 C ATOM 1309 O MET A 91 -16.310 -7.800 -0.774 1.00 0.00 O ATOM 1310 CB MET A 91 -13.997 -6.651 -2.840 1.00 0.00 C ATOM 1311 CG MET A 91 -13.341 -5.283 -2.944 1.00 0.00 C ATOM 1312 SD MET A 91 -13.420 -4.600 -4.611 1.00 0.00 S ATOM 1313 CE MET A 91 -15.077 -3.920 -4.620 1.00 0.00 C ATOM 0 H MET A 91 -12.030 -7.579 -1.629 1.00 0.00 H new ATOM 0 HA MET A 91 -14.245 -6.349 -0.727 1.00 0.00 H new ATOM 0 HB2 MET A 91 -13.439 -7.360 -3.452 1.00 0.00 H new ATOM 0 HB3 MET A 91 -15.003 -6.595 -3.255 1.00 0.00 H new ATOM 0 HG2 MET A 91 -13.828 -4.597 -2.251 1.00 0.00 H new ATOM 0 HG3 MET A 91 -12.298 -5.360 -2.636 1.00 0.00 H new ATOM 0 HE1 MET A 91 -15.277 -3.461 -5.588 1.00 0.00 H new ATOM 0 HE2 MET A 91 -15.798 -4.717 -4.441 1.00 0.00 H new ATOM 0 HE3 MET A 91 -15.166 -3.168 -3.836 1.00 0.00 H new ATOM 1323 N THR A 92 -15.039 -9.385 -1.741 1.00 0.00 N ATOM 1324 CA THR A 92 -16.075 -10.408 -1.678 1.00 0.00 C ATOM 1325 C THR A 92 -16.264 -10.914 -0.253 1.00 0.00 C ATOM 1326 O THR A 92 -17.384 -11.198 0.173 1.00 0.00 O ATOM 1327 CB THR A 92 -15.743 -11.601 -2.594 1.00 0.00 C ATOM 1328 OG1 THR A 92 -14.419 -12.075 -2.321 1.00 0.00 O ATOM 1329 CG2 THR A 92 -15.854 -11.207 -4.059 1.00 0.00 C ATOM 0 H THR A 92 -14.164 -9.696 -2.163 1.00 0.00 H new ATOM 0 HA THR A 92 -16.999 -9.942 -2.020 1.00 0.00 H new ATOM 0 HB THR A 92 -16.462 -12.395 -2.393 1.00 0.00 H new ATOM 0 HG1 THR A 92 -13.981 -11.472 -1.685 1.00 0.00 H new ATOM 0 HG21 THR A 92 -15.615 -12.066 -4.686 1.00 0.00 H new ATOM 0 HG22 THR A 92 -16.870 -10.875 -4.271 1.00 0.00 H new ATOM 0 HG23 THR A 92 -15.156 -10.397 -4.272 1.00 0.00 H new ATOM 1337 N SER A 93 -15.162 -11.024 0.482 1.00 0.00 N ATOM 1338 CA SER A 93 -15.206 -11.498 1.860 1.00 0.00 C ATOM 1339 C SER A 93 -15.983 -10.528 2.744 1.00 0.00 C ATOM 1340 O SER A 93 -16.892 -10.927 3.473 1.00 0.00 O ATOM 1341 CB SER A 93 -13.788 -11.678 2.406 1.00 0.00 C ATOM 1342 OG SER A 93 -13.750 -12.679 3.408 1.00 0.00 O ATOM 0 H SER A 93 -14.228 -10.791 0.146 1.00 0.00 H new ATOM 0 HA SER A 93 -15.717 -12.461 1.870 1.00 0.00 H new ATOM 0 HB2 SER A 93 -13.114 -11.947 1.593 1.00 0.00 H new ATOM 0 HB3 SER A 93 -13.431 -10.734 2.817 1.00 0.00 H new ATOM 0 HG SER A 93 -12.833 -12.776 3.739 1.00 0.00 H new ATOM 1348 N SER A 94 -15.619 -9.251 2.674 1.00 0.00 N ATOM 1349 CA SER A 94 -16.279 -8.223 3.471 1.00 0.00 C ATOM 1350 C SER A 94 -16.926 -7.173 2.573 1.00 0.00 C ATOM 1351 O SER A 94 -16.471 -6.930 1.455 1.00 0.00 O ATOM 1352 CB SER A 94 -15.276 -7.557 4.414 1.00 0.00 C ATOM 1353 OG SER A 94 -14.808 -8.471 5.390 1.00 0.00 O ATOM 0 H SER A 94 -14.871 -8.904 2.074 1.00 0.00 H new ATOM 0 HA SER A 94 -17.060 -8.701 4.063 1.00 0.00 H new ATOM 0 HB2 SER A 94 -14.434 -7.171 3.840 1.00 0.00 H new ATOM 0 HB3 SER A 94 -15.745 -6.704 4.905 1.00 0.00 H new ATOM 0 HG SER A 94 -14.167 -8.021 5.979 1.00 0.00 H new ATOM 1359 N SER A 95 -17.991 -6.553 3.071 1.00 0.00 N ATOM 1360 CA SER A 95 -18.704 -5.531 2.314 1.00 0.00 C ATOM 1361 C SER A 95 -17.994 -4.185 2.416 1.00 0.00 C ATOM 1362 O SER A 95 -17.021 -4.037 3.156 1.00 0.00 O ATOM 1363 CB SER A 95 -20.142 -5.402 2.820 1.00 0.00 C ATOM 1364 OG SER A 95 -20.983 -6.371 2.219 1.00 0.00 O ATOM 0 H SER A 95 -18.379 -6.741 3.995 1.00 0.00 H new ATOM 0 HA SER A 95 -18.721 -5.835 1.267 1.00 0.00 H new ATOM 0 HB2 SER A 95 -20.162 -5.521 3.903 1.00 0.00 H new ATOM 0 HB3 SER A 95 -20.519 -4.403 2.602 1.00 0.00 H new ATOM 0 HG SER A 95 -21.896 -6.269 2.560 1.00 0.00 H new ATOM 1370 N LYS A 96 -18.488 -3.204 1.668 1.00 0.00 N ATOM 1371 CA LYS A 96 -17.904 -1.868 1.673 1.00 0.00 C ATOM 1372 C LYS A 96 -18.009 -1.234 3.056 1.00 0.00 C ATOM 1373 O LYS A 96 -17.092 -0.547 3.505 1.00 0.00 O ATOM 1374 CB LYS A 96 -18.600 -0.981 0.639 1.00 0.00 C ATOM 1375 CG LYS A 96 -17.986 0.403 0.514 1.00 0.00 C ATOM 1376 CD LYS A 96 -18.406 1.085 -0.778 1.00 0.00 C ATOM 1377 CE LYS A 96 -17.745 2.446 -0.930 1.00 0.00 C ATOM 1378 NZ LYS A 96 -18.320 3.218 -2.067 1.00 0.00 N ATOM 0 H LYS A 96 -19.292 -3.310 1.050 1.00 0.00 H new ATOM 0 HA LYS A 96 -16.849 -1.958 1.413 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -18.565 -1.474 -0.333 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -19.651 -0.880 0.908 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -18.289 1.014 1.364 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -16.899 0.324 0.548 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -18.141 0.454 -1.626 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -19.490 1.202 -0.793 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -17.866 3.014 -0.007 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -16.674 2.314 -1.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -17.843 4.139 -2.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -18.182 2.688 -2.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -19.337 3.366 -1.907 1.00 0.00 H new ATOM 1392 N GLU A 97 -19.133 -1.470 3.727 1.00 0.00 N ATOM 1393 CA GLU A 97 -19.356 -0.921 5.059 1.00 0.00 C ATOM 1394 C GLU A 97 -18.674 -1.778 6.122 1.00 0.00 C ATOM 1395 O GLU A 97 -18.183 -1.265 7.127 1.00 0.00 O ATOM 1396 CB GLU A 97 -20.855 -0.825 5.351 1.00 0.00 C ATOM 1397 CG GLU A 97 -21.587 -2.150 5.219 1.00 0.00 C ATOM 1398 CD GLU A 97 -22.994 -2.097 5.781 1.00 0.00 C ATOM 1399 OE1 GLU A 97 -23.136 -1.977 7.016 1.00 0.00 O ATOM 1400 OE2 GLU A 97 -23.954 -2.175 4.986 1.00 0.00 O ATOM 0 H GLU A 97 -19.902 -2.037 3.370 1.00 0.00 H new ATOM 0 HA GLU A 97 -18.922 0.079 5.089 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -20.996 -0.441 6.361 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -21.304 -0.102 4.670 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -21.630 -2.434 4.168 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -21.022 -2.926 5.736 1.00 0.00 H new ATOM 1407 N ASP A 98 -18.649 -3.086 5.891 1.00 0.00 N ATOM 1408 CA ASP A 98 -18.027 -4.015 6.828 1.00 0.00 C ATOM 1409 C ASP A 98 -16.599 -3.587 7.151 1.00 0.00 C ATOM 1410 O ASP A 98 -16.095 -3.848 8.244 1.00 0.00 O ATOM 1411 CB ASP A 98 -18.030 -5.432 6.251 1.00 0.00 C ATOM 1412 CG ASP A 98 -19.309 -6.183 6.565 1.00 0.00 C ATOM 1413 OD1 ASP A 98 -19.817 -6.039 7.697 1.00 0.00 O ATOM 1414 OD2 ASP A 98 -19.800 -6.915 5.681 1.00 0.00 O ATOM 0 H ASP A 98 -19.052 -3.527 5.064 1.00 0.00 H new ATOM 0 HA ASP A 98 -18.607 -4.005 7.751 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -17.898 -5.381 5.170 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -17.180 -5.985 6.650 1.00 0.00 H new ATOM 1419 N TRP A 99 -15.953 -2.930 6.195 1.00 0.00 N ATOM 1420 CA TRP A 99 -14.583 -2.467 6.378 1.00 0.00 C ATOM 1421 C TRP A 99 -14.519 -1.349 7.413 1.00 0.00 C ATOM 1422 O TRP A 99 -15.152 -0.303 7.271 1.00 0.00 O ATOM 1423 CB TRP A 99 -14.005 -1.980 5.048 1.00 0.00 C ATOM 1424 CG TRP A 99 -14.288 -2.905 3.903 1.00 0.00 C ATOM 1425 CD1 TRP A 99 -14.393 -4.266 3.956 1.00 0.00 C ATOM 1426 CD2 TRP A 99 -14.500 -2.537 2.536 1.00 0.00 C ATOM 1427 NE1 TRP A 99 -14.657 -4.766 2.704 1.00 0.00 N ATOM 1428 CE2 TRP A 99 -14.728 -3.726 1.815 1.00 0.00 C ATOM 1429 CE3 TRP A 99 -14.521 -1.320 1.851 1.00 0.00 C ATOM 1430 CZ2 TRP A 99 -14.973 -3.730 0.445 1.00 0.00 C ATOM 1431 CZ3 TRP A 99 -14.763 -1.325 0.490 1.00 0.00 C ATOM 1432 CH2 TRP A 99 -14.988 -2.523 -0.201 1.00 0.00 C ATOM 0 H TRP A 99 -16.356 -2.706 5.285 1.00 0.00 H new ATOM 0 HA TRP A 99 -13.988 -3.306 6.740 1.00 0.00 H new ATOM 0 HB2 TRP A 99 -14.415 -0.996 4.821 1.00 0.00 H new ATOM 0 HB3 TRP A 99 -12.927 -1.860 5.151 1.00 0.00 H new ATOM 0 HD1 TRP A 99 -14.284 -4.861 4.851 1.00 0.00 H new ATOM 0 HE1 TRP A 99 -14.780 -5.752 2.474 1.00 0.00 H new ATOM 0 HE3 TRP A 99 -14.351 -0.391 2.375 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 -15.145 -4.652 -0.090 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 -14.779 -0.390 -0.050 1.00 0.00 H new ATOM 0 HH2 TRP A 99 -15.177 -2.494 -1.264 1.00 0.00 H new ATOM 1443 N PRO A 100 -13.738 -1.573 8.480 1.00 0.00 N ATOM 1444 CA PRO A 100 -13.573 -0.595 9.560 1.00 0.00 C ATOM 1445 C PRO A 100 -12.784 0.632 9.116 1.00 0.00 C ATOM 1446 O PRO A 100 -12.168 0.633 8.050 1.00 0.00 O ATOM 1447 CB PRO A 100 -12.799 -1.372 10.627 1.00 0.00 C ATOM 1448 CG PRO A 100 -12.068 -2.428 9.872 1.00 0.00 C ATOM 1449 CD PRO A 100 -12.955 -2.797 8.715 1.00 0.00 C ATOM 0 HA PRO A 100 -14.530 -0.206 9.907 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -12.110 -0.723 11.167 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -13.472 -1.808 11.366 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -11.103 -2.061 9.523 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -11.870 -3.294 10.504 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -12.374 -3.077 7.836 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -13.597 -3.644 8.955 1.00 0.00 H new ATOM 1457 N SER A 101 -12.805 1.674 9.940 1.00 0.00 N ATOM 1458 CA SER A 101 -12.093 2.908 9.630 1.00 0.00 C ATOM 1459 C SER A 101 -10.700 2.903 10.252 1.00 0.00 C ATOM 1460 O SER A 101 -10.504 2.401 11.359 1.00 0.00 O ATOM 1461 CB SER A 101 -12.884 4.118 10.132 1.00 0.00 C ATOM 1462 OG SER A 101 -12.642 5.257 9.324 1.00 0.00 O ATOM 0 H SER A 101 -13.307 1.689 10.828 1.00 0.00 H new ATOM 0 HA SER A 101 -11.988 2.975 8.547 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.949 3.886 10.130 1.00 0.00 H new ATOM 0 HB3 SER A 101 -12.607 4.335 11.164 1.00 0.00 H new ATOM 0 HG SER A 101 -13.160 6.016 9.665 1.00 0.00 H new ATOM 1468 N VAL A 102 -9.735 3.466 9.532 1.00 0.00 N ATOM 1469 CA VAL A 102 -8.360 3.528 10.013 1.00 0.00 C ATOM 1470 C VAL A 102 -7.617 4.711 9.402 1.00 0.00 C ATOM 1471 O VAL A 102 -7.870 5.094 8.260 1.00 0.00 O ATOM 1472 CB VAL A 102 -7.593 2.232 9.688 1.00 0.00 C ATOM 1473 CG1 VAL A 102 -8.247 1.040 10.370 1.00 0.00 C ATOM 1474 CG2 VAL A 102 -7.517 2.021 8.184 1.00 0.00 C ATOM 0 H VAL A 102 -9.880 3.886 8.614 1.00 0.00 H new ATOM 0 HA VAL A 102 -8.408 3.652 11.095 1.00 0.00 H new ATOM 0 HB VAL A 102 -6.576 2.326 10.070 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -7.692 0.133 10.129 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -8.244 1.192 11.449 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -9.275 0.940 10.021 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -6.972 1.101 7.973 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -8.525 1.948 7.776 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -7.000 2.863 7.724 1.00 0.00 H new ATOM 1484 N ASN A 103 -6.699 5.288 10.171 1.00 0.00 N ATOM 1485 CA ASN A 103 -5.919 6.428 9.706 1.00 0.00 C ATOM 1486 C ASN A 103 -4.551 5.982 9.200 1.00 0.00 C ATOM 1487 O ASN A 103 -3.808 5.302 9.908 1.00 0.00 O ATOM 1488 CB ASN A 103 -5.750 7.450 10.832 1.00 0.00 C ATOM 1489 CG ASN A 103 -6.867 8.476 10.855 1.00 0.00 C ATOM 1490 OD1 ASN A 103 -6.773 9.526 10.221 1.00 0.00 O ATOM 1491 ND2 ASN A 103 -7.932 8.174 11.589 1.00 0.00 N ATOM 0 H ASN A 103 -6.477 4.984 11.119 1.00 0.00 H new ATOM 0 HA ASN A 103 -6.458 6.892 8.880 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -5.719 6.930 11.789 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -4.794 7.960 10.715 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -8.715 8.825 11.643 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -7.967 7.291 12.098 1.00 0.00 H new ATOM 1498 N MET A 104 -4.225 6.369 7.972 1.00 0.00 N ATOM 1499 CA MET A 104 -2.945 6.010 7.372 1.00 0.00 C ATOM 1500 C MET A 104 -1.928 7.134 7.545 1.00 0.00 C ATOM 1501 O MET A 104 -2.204 8.288 7.220 1.00 0.00 O ATOM 1502 CB MET A 104 -3.125 5.695 5.886 1.00 0.00 C ATOM 1503 CG MET A 104 -1.889 5.091 5.239 1.00 0.00 C ATOM 1504 SD MET A 104 -2.181 4.563 3.540 1.00 0.00 S ATOM 1505 CE MET A 104 -3.378 3.255 3.792 1.00 0.00 C ATOM 0 H MET A 104 -4.829 6.931 7.372 1.00 0.00 H new ATOM 0 HA MET A 104 -2.570 5.123 7.882 1.00 0.00 H new ATOM 0 HB2 MET A 104 -3.961 5.005 5.768 1.00 0.00 H new ATOM 0 HB3 MET A 104 -3.391 6.611 5.358 1.00 0.00 H new ATOM 0 HG2 MET A 104 -1.082 5.823 5.254 1.00 0.00 H new ATOM 0 HG3 MET A 104 -1.556 4.237 5.829 1.00 0.00 H new ATOM 0 HE1 MET A 104 -2.933 2.297 3.522 1.00 0.00 H new ATOM 0 HE2 MET A 104 -3.678 3.233 4.840 1.00 0.00 H new ATOM 0 HE3 MET A 104 -4.253 3.437 3.168 1.00 0.00 H new ATOM 1515 N ASN A 105 -0.753 6.789 8.061 1.00 0.00 N ATOM 1516 CA ASN A 105 0.304 7.770 8.278 1.00 0.00 C ATOM 1517 C ASN A 105 1.409 7.619 7.237 1.00 0.00 C ATOM 1518 O ASN A 105 1.887 6.514 6.979 1.00 0.00 O ATOM 1519 CB ASN A 105 0.888 7.618 9.684 1.00 0.00 C ATOM 1520 CG ASN A 105 -0.126 7.927 10.768 1.00 0.00 C ATOM 1521 OD1 ASN A 105 -1.334 7.894 10.532 1.00 0.00 O ATOM 1522 ND2 ASN A 105 0.362 8.230 11.966 1.00 0.00 N ATOM 0 H ASN A 105 -0.509 5.838 8.337 1.00 0.00 H new ATOM 0 HA ASN A 105 -0.131 8.764 8.178 1.00 0.00 H new ATOM 0 HB2 ASN A 105 1.255 6.600 9.814 1.00 0.00 H new ATOM 0 HB3 ASN A 105 1.745 8.283 9.792 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -0.272 8.447 12.735 1.00 0.00 H new ATOM 0 HD22 ASN A 105 1.371 8.245 12.117 1.00 0.00 H new ATOM 1529 N VAL A 106 1.812 8.738 6.643 1.00 0.00 N ATOM 1530 CA VAL A 106 2.861 8.731 5.631 1.00 0.00 C ATOM 1531 C VAL A 106 4.053 9.574 6.070 1.00 0.00 C ATOM 1532 O VAL A 106 4.556 10.400 5.309 1.00 0.00 O ATOM 1533 CB VAL A 106 2.343 9.259 4.280 1.00 0.00 C ATOM 1534 CG1 VAL A 106 3.347 8.973 3.174 1.00 0.00 C ATOM 1535 CG2 VAL A 106 0.989 8.647 3.954 1.00 0.00 C ATOM 0 H VAL A 106 1.428 9.661 6.845 1.00 0.00 H new ATOM 0 HA VAL A 106 3.176 7.695 5.510 1.00 0.00 H new ATOM 0 HB VAL A 106 2.220 10.339 4.355 1.00 0.00 H new ATOM 0 HG11 VAL A 106 2.964 9.353 2.227 1.00 0.00 H new ATOM 0 HG12 VAL A 106 4.293 9.463 3.406 1.00 0.00 H new ATOM 0 HG13 VAL A 106 3.505 7.897 3.096 1.00 0.00 H new ATOM 0 HG21 VAL A 106 0.637 9.031 2.996 1.00 0.00 H new ATOM 0 HG22 VAL A 106 1.084 7.563 3.898 1.00 0.00 H new ATOM 0 HG23 VAL A 106 0.274 8.909 4.734 1.00 0.00 H new ATOM 1545 N ALA A 107 4.501 9.359 7.303 1.00 0.00 N ATOM 1546 CA ALA A 107 5.636 10.098 7.843 1.00 0.00 C ATOM 1547 C ALA A 107 6.942 9.347 7.606 1.00 0.00 C ATOM 1548 O ALA A 107 6.971 8.116 7.609 1.00 0.00 O ATOM 1549 CB ALA A 107 5.437 10.359 9.328 1.00 0.00 C ATOM 0 H ALA A 107 4.095 8.679 7.946 1.00 0.00 H new ATOM 0 HA ALA A 107 5.697 11.054 7.323 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.292 10.911 9.718 1.00 0.00 H new ATOM 0 HB2 ALA A 107 4.529 10.943 9.476 1.00 0.00 H new ATOM 0 HB3 ALA A 107 5.347 9.409 9.856 1.00 0.00 H new ATOM 1555 N ASP A 108 8.020 10.096 7.401 1.00 0.00 N ATOM 1556 CA ASP A 108 9.330 9.501 7.163 1.00 0.00 C ATOM 1557 C ASP A 108 9.237 8.372 6.141 1.00 0.00 C ATOM 1558 O ASP A 108 9.749 7.275 6.365 1.00 0.00 O ATOM 1559 CB ASP A 108 9.920 8.973 8.472 1.00 0.00 C ATOM 1560 CG ASP A 108 11.436 8.970 8.464 1.00 0.00 C ATOM 1561 OD1 ASP A 108 12.023 8.287 7.598 1.00 0.00 O ATOM 1562 OD2 ASP A 108 12.036 9.649 9.324 1.00 0.00 O ATOM 0 H ASP A 108 8.013 11.116 7.395 1.00 0.00 H new ATOM 0 HA ASP A 108 9.986 10.275 6.764 1.00 0.00 H new ATOM 0 HB2 ASP A 108 9.565 9.586 9.300 1.00 0.00 H new ATOM 0 HB3 ASP A 108 9.558 7.960 8.648 1.00 0.00 H new ATOM 1567 N ALA A 109 8.578 8.648 5.021 1.00 0.00 N ATOM 1568 CA ALA A 109 8.418 7.656 3.964 1.00 0.00 C ATOM 1569 C ALA A 109 8.052 6.293 4.542 1.00 0.00 C ATOM 1570 O ALA A 109 8.414 5.254 3.989 1.00 0.00 O ATOM 1571 CB ALA A 109 9.691 7.556 3.137 1.00 0.00 C ATOM 0 H ALA A 109 8.146 9.550 4.822 1.00 0.00 H new ATOM 0 HA ALA A 109 7.602 7.979 3.317 1.00 0.00 H new ATOM 0 HB1 ALA A 109 9.557 6.812 2.352 1.00 0.00 H new ATOM 0 HB2 ALA A 109 9.909 8.524 2.686 1.00 0.00 H new ATOM 0 HB3 ALA A 109 10.520 7.260 3.780 1.00 0.00 H new ATOM 1577 N THR A 110 7.331 6.303 5.659 1.00 0.00 N ATOM 1578 CA THR A 110 6.917 5.068 6.313 1.00 0.00 C ATOM 1579 C THR A 110 5.398 4.967 6.386 1.00 0.00 C ATOM 1580 O THR A 110 4.709 5.965 6.595 1.00 0.00 O ATOM 1581 CB THR A 110 7.496 4.965 7.737 1.00 0.00 C ATOM 1582 OG1 THR A 110 8.927 5.016 7.689 1.00 0.00 O ATOM 1583 CG2 THR A 110 7.053 3.675 8.409 1.00 0.00 C ATOM 0 H THR A 110 7.022 7.153 6.130 1.00 0.00 H new ATOM 0 HA THR A 110 7.304 4.246 5.711 1.00 0.00 H new ATOM 0 HB THR A 110 7.122 5.807 8.319 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.210 5.840 7.241 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.474 3.625 9.413 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.965 3.652 8.470 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.402 2.823 7.826 1.00 0.00 H new ATOM 1591 N VAL A 111 4.881 3.754 6.213 1.00 0.00 N ATOM 1592 CA VAL A 111 3.443 3.522 6.261 1.00 0.00 C ATOM 1593 C VAL A 111 3.038 2.852 7.569 1.00 0.00 C ATOM 1594 O VAL A 111 3.512 1.764 7.896 1.00 0.00 O ATOM 1595 CB VAL A 111 2.976 2.647 5.083 1.00 0.00 C ATOM 1596 CG1 VAL A 111 1.469 2.446 5.131 1.00 0.00 C ATOM 1597 CG2 VAL A 111 3.397 3.268 3.759 1.00 0.00 C ATOM 0 H VAL A 111 5.437 2.917 6.038 1.00 0.00 H new ATOM 0 HA VAL A 111 2.963 4.498 6.192 1.00 0.00 H new ATOM 0 HB VAL A 111 3.452 1.670 5.168 1.00 0.00 H new ATOM 0 HG11 VAL A 111 1.158 1.825 4.291 1.00 0.00 H new ATOM 0 HG12 VAL A 111 1.197 1.955 6.065 1.00 0.00 H new ATOM 0 HG13 VAL A 111 0.971 3.414 5.071 1.00 0.00 H new ATOM 0 HG21 VAL A 111 3.059 2.637 2.937 1.00 0.00 H new ATOM 0 HG22 VAL A 111 2.951 4.258 3.663 1.00 0.00 H new ATOM 0 HG23 VAL A 111 4.483 3.355 3.727 1.00 0.00 H new ATOM 1607 N THR A 112 2.156 3.510 8.317 1.00 0.00 N ATOM 1608 CA THR A 112 1.687 2.979 9.590 1.00 0.00 C ATOM 1609 C THR A 112 0.171 3.085 9.705 1.00 0.00 C ATOM 1610 O THR A 112 -0.371 4.166 9.935 1.00 0.00 O ATOM 1611 CB THR A 112 2.333 3.716 10.778 1.00 0.00 C ATOM 1612 OG1 THR A 112 3.749 3.808 10.587 1.00 0.00 O ATOM 1613 CG2 THR A 112 2.038 2.997 12.086 1.00 0.00 C ATOM 0 H THR A 112 1.753 4.412 8.062 1.00 0.00 H new ATOM 0 HA THR A 112 1.978 1.929 9.621 1.00 0.00 H new ATOM 0 HB THR A 112 1.908 4.719 10.829 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.152 4.279 11.346 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.504 3.536 12.911 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.960 2.955 12.243 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.438 1.984 12.042 1.00 0.00 H new ATOM 1621 N VAL A 113 -0.511 1.955 9.542 1.00 0.00 N ATOM 1622 CA VAL A 113 -1.966 1.920 9.629 1.00 0.00 C ATOM 1623 C VAL A 113 -2.436 2.157 11.060 1.00 0.00 C ATOM 1624 O VAL A 113 -2.500 1.227 11.865 1.00 0.00 O ATOM 1625 CB VAL A 113 -2.526 0.574 9.132 1.00 0.00 C ATOM 1626 CG1 VAL A 113 -4.043 0.558 9.230 1.00 0.00 C ATOM 1627 CG2 VAL A 113 -2.072 0.303 7.705 1.00 0.00 C ATOM 0 H VAL A 113 -0.079 1.052 9.349 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.341 2.719 8.989 1.00 0.00 H new ATOM 0 HB VAL A 113 -2.137 -0.220 9.770 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -4.420 -0.401 8.874 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -4.342 0.703 10.268 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -4.456 1.360 8.618 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -2.477 -0.652 7.370 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -2.431 1.099 7.052 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.983 0.268 7.670 1.00 0.00 H new ATOM 1637 N ILE A 114 -2.766 3.406 11.369 1.00 0.00 N ATOM 1638 CA ILE A 114 -3.233 3.765 12.703 1.00 0.00 C ATOM 1639 C ILE A 114 -4.728 3.505 12.850 1.00 0.00 C ATOM 1640 O ILE A 114 -5.490 3.644 11.893 1.00 0.00 O ATOM 1641 CB ILE A 114 -2.946 5.244 13.021 1.00 0.00 C ATOM 1642 CG1 ILE A 114 -1.463 5.555 12.811 1.00 0.00 C ATOM 1643 CG2 ILE A 114 -3.365 5.570 14.447 1.00 0.00 C ATOM 1644 CD1 ILE A 114 -0.557 4.888 13.822 1.00 0.00 C ATOM 0 H ILE A 114 -2.719 4.187 10.714 1.00 0.00 H new ATOM 0 HA ILE A 114 -2.687 3.138 13.408 1.00 0.00 H new ATOM 0 HB ILE A 114 -3.528 5.866 12.341 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -1.172 5.238 11.810 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -1.316 6.634 12.859 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -3.156 6.619 14.657 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -4.432 5.382 14.565 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -2.807 4.943 15.142 1.00 0.00 H new ATOM 0 HD11 ILE A 114 0.479 5.153 13.612 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -0.821 5.224 14.825 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -0.675 3.806 13.759 1.00 0.00 H new ATOM 1656 N SER A 115 -5.142 3.129 14.055 1.00 0.00 N ATOM 1657 CA SER A 115 -6.547 2.848 14.328 1.00 0.00 C ATOM 1658 C SER A 115 -7.343 4.143 14.465 1.00 0.00 C ATOM 1659 O SER A 115 -6.900 5.090 15.114 1.00 0.00 O ATOM 1660 CB SER A 115 -6.684 2.015 15.604 1.00 0.00 C ATOM 1661 OG SER A 115 -7.839 1.195 15.556 1.00 0.00 O ATOM 0 H SER A 115 -4.525 3.012 14.859 1.00 0.00 H new ATOM 0 HA SER A 115 -6.949 2.281 13.488 1.00 0.00 H new ATOM 0 HB2 SER A 115 -5.798 1.393 15.733 1.00 0.00 H new ATOM 0 HB3 SER A 115 -6.739 2.676 16.469 1.00 0.00 H new ATOM 0 HG SER A 115 -7.746 0.461 16.198 1.00 0.00 H new ATOM 1667 N GLU A 116 -8.520 4.174 13.848 1.00 0.00 N ATOM 1668 CA GLU A 116 -9.378 5.352 13.900 1.00 0.00 C ATOM 1669 C GLU A 116 -9.890 5.590 15.318 1.00 0.00 C ATOM 1670 O GLU A 116 -10.000 6.731 15.768 1.00 0.00 O ATOM 1671 CB GLU A 116 -10.558 5.194 12.940 1.00 0.00 C ATOM 1672 CG GLU A 116 -11.230 6.508 12.579 1.00 0.00 C ATOM 1673 CD GLU A 116 -12.122 7.032 13.688 1.00 0.00 C ATOM 1674 OE1 GLU A 116 -12.765 6.207 14.370 1.00 0.00 O ATOM 1675 OE2 GLU A 116 -12.177 8.265 13.873 1.00 0.00 O ATOM 0 H GLU A 116 -8.901 3.398 13.307 1.00 0.00 H new ATOM 0 HA GLU A 116 -8.785 6.215 13.596 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -10.210 4.711 12.027 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.296 4.530 13.391 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -10.466 7.251 12.350 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.823 6.372 11.675 1.00 0.00 H new ATOM 1682 N LYS A 117 -10.203 4.504 16.017 1.00 0.00 N ATOM 1683 CA LYS A 117 -10.703 4.592 17.384 1.00 0.00 C ATOM 1684 C LYS A 117 -9.616 5.089 18.331 1.00 0.00 C ATOM 1685 O LYS A 117 -9.890 5.835 19.270 1.00 0.00 O ATOM 1686 CB LYS A 117 -11.215 3.227 17.851 1.00 0.00 C ATOM 1687 CG LYS A 117 -10.152 2.142 17.836 1.00 0.00 C ATOM 1688 CD LYS A 117 -10.614 0.900 18.580 1.00 0.00 C ATOM 1689 CE LYS A 117 -9.837 -0.332 18.143 1.00 0.00 C ATOM 1690 NZ LYS A 117 -10.601 -1.586 18.391 1.00 0.00 N ATOM 0 H LYS A 117 -10.119 3.552 15.659 1.00 0.00 H new ATOM 0 HA LYS A 117 -11.526 5.306 17.397 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -11.610 3.323 18.862 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -12.044 2.921 17.213 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -9.911 1.882 16.805 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -9.237 2.521 18.291 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -10.489 1.049 19.652 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -11.678 0.743 18.402 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -9.600 -0.255 17.082 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -8.889 -0.372 18.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -10.038 -2.403 18.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -10.805 -1.673 19.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -11.495 -1.559 17.860 1.00 0.00 H new ATOM 1704 N ASN A 118 -8.380 4.673 18.076 1.00 0.00 N ATOM 1705 CA ASN A 118 -7.250 5.077 18.905 1.00 0.00 C ATOM 1706 C ASN A 118 -6.056 5.474 18.042 1.00 0.00 C ATOM 1707 O ASN A 118 -5.588 4.692 17.216 1.00 0.00 O ATOM 1708 CB ASN A 118 -6.854 3.943 19.853 1.00 0.00 C ATOM 1709 CG ASN A 118 -7.974 3.566 20.804 1.00 0.00 C ATOM 1710 OD1 ASN A 118 -8.909 4.339 21.017 1.00 0.00 O ATOM 1711 ND2 ASN A 118 -7.884 2.374 21.381 1.00 0.00 N ATOM 0 H ASN A 118 -8.135 4.056 17.302 1.00 0.00 H new ATOM 0 HA ASN A 118 -7.555 5.943 19.493 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -6.567 3.068 19.269 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -5.978 4.243 20.428 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -8.608 2.066 22.030 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -7.091 1.766 21.175 1.00 0.00 H new ATOM 1718 N GLU A 119 -5.568 6.695 18.242 1.00 0.00 N ATOM 1719 CA GLU A 119 -4.429 7.195 17.482 1.00 0.00 C ATOM 1720 C GLU A 119 -3.159 6.428 17.838 1.00 0.00 C ATOM 1721 O GLU A 119 -2.369 6.076 16.962 1.00 0.00 O ATOM 1722 CB GLU A 119 -4.228 8.689 17.746 1.00 0.00 C ATOM 1723 CG GLU A 119 -3.400 9.389 16.682 1.00 0.00 C ATOM 1724 CD GLU A 119 -4.233 9.838 15.497 1.00 0.00 C ATOM 1725 OE1 GLU A 119 -4.457 9.014 14.584 1.00 0.00 O ATOM 1726 OE2 GLU A 119 -4.659 11.011 15.481 1.00 0.00 O ATOM 0 H GLU A 119 -5.944 7.355 18.923 1.00 0.00 H new ATOM 0 HA GLU A 119 -4.637 7.046 16.423 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -5.203 9.172 17.812 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -3.743 8.816 18.714 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -2.906 10.255 17.123 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -2.616 8.716 16.336 1.00 0.00 H new ATOM 1733 N GLU A 120 -2.970 6.175 19.129 1.00 0.00 N ATOM 1734 CA GLU A 120 -1.795 5.451 19.601 1.00 0.00 C ATOM 1735 C GLU A 120 -1.986 3.945 19.449 1.00 0.00 C ATOM 1736 O GLU A 120 -1.624 3.172 20.335 1.00 0.00 O ATOM 1737 CB GLU A 120 -1.510 5.796 21.064 1.00 0.00 C ATOM 1738 CG GLU A 120 -2.589 5.320 22.022 1.00 0.00 C ATOM 1739 CD GLU A 120 -2.055 5.057 23.417 1.00 0.00 C ATOM 1740 OE1 GLU A 120 -1.409 4.008 23.617 1.00 0.00 O ATOM 1741 OE2 GLU A 120 -2.285 5.901 24.309 1.00 0.00 O ATOM 0 H GLU A 120 -3.615 6.460 19.866 1.00 0.00 H new ATOM 0 HA GLU A 120 -0.944 5.754 18.991 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -0.557 5.353 21.354 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -1.402 6.876 21.159 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -3.379 6.069 22.075 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -3.040 4.408 21.631 1.00 0.00 H new ATOM 1748 N GLU A 121 -2.557 3.538 18.320 1.00 0.00 N ATOM 1749 CA GLU A 121 -2.798 2.124 18.053 1.00 0.00 C ATOM 1750 C GLU A 121 -2.370 1.758 16.635 1.00 0.00 C ATOM 1751 O GLU A 121 -3.178 1.775 15.707 1.00 0.00 O ATOM 1752 CB GLU A 121 -4.277 1.789 18.254 1.00 0.00 C ATOM 1753 CG GLU A 121 -4.556 0.299 18.352 1.00 0.00 C ATOM 1754 CD GLU A 121 -5.838 -0.007 19.101 1.00 0.00 C ATOM 1755 OE1 GLU A 121 -6.199 0.778 20.003 1.00 0.00 O ATOM 1756 OE2 GLU A 121 -6.481 -1.030 18.786 1.00 0.00 O ATOM 0 H GLU A 121 -2.861 4.166 17.576 1.00 0.00 H new ATOM 0 HA GLU A 121 -2.203 1.541 18.756 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -4.631 2.277 19.162 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -4.851 2.204 17.425 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -4.617 -0.122 17.348 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -3.721 -0.191 18.853 1.00 0.00 H new ATOM 1763 N VAL A 122 -1.092 1.427 16.476 1.00 0.00 N ATOM 1764 CA VAL A 122 -0.555 1.056 15.172 1.00 0.00 C ATOM 1765 C VAL A 122 -1.051 -0.322 14.746 1.00 0.00 C ATOM 1766 O VAL A 122 -0.527 -1.346 15.186 1.00 0.00 O ATOM 1767 CB VAL A 122 0.985 1.056 15.179 1.00 0.00 C ATOM 1768 CG1 VAL A 122 1.524 0.416 13.908 1.00 0.00 C ATOM 1769 CG2 VAL A 122 1.517 2.472 15.340 1.00 0.00 C ATOM 0 H VAL A 122 -0.410 1.408 17.234 1.00 0.00 H new ATOM 0 HA VAL A 122 -0.907 1.802 14.460 1.00 0.00 H new ATOM 0 HB VAL A 122 1.328 0.465 16.029 1.00 0.00 H new ATOM 0 HG11 VAL A 122 2.614 0.425 13.930 1.00 0.00 H new ATOM 0 HG12 VAL A 122 1.171 -0.613 13.841 1.00 0.00 H new ATOM 0 HG13 VAL A 122 1.174 0.977 13.041 1.00 0.00 H new ATOM 0 HG21 VAL A 122 2.607 2.453 15.343 1.00 0.00 H new ATOM 0 HG22 VAL A 122 1.167 3.089 14.512 1.00 0.00 H new ATOM 0 HG23 VAL A 122 1.159 2.890 16.281 1.00 0.00 H new ATOM 1779 N LEU A 123 -2.063 -0.340 13.886 1.00 0.00 N ATOM 1780 CA LEU A 123 -2.630 -1.592 13.398 1.00 0.00 C ATOM 1781 C LEU A 123 -1.609 -2.367 12.572 1.00 0.00 C ATOM 1782 O LEU A 123 -1.446 -3.576 12.741 1.00 0.00 O ATOM 1783 CB LEU A 123 -3.879 -1.317 12.559 1.00 0.00 C ATOM 1784 CG LEU A 123 -4.988 -0.519 13.247 1.00 0.00 C ATOM 1785 CD1 LEU A 123 -5.819 0.234 12.220 1.00 0.00 C ATOM 1786 CD2 LEU A 123 -5.869 -1.439 14.079 1.00 0.00 C ATOM 0 H LEU A 123 -2.508 0.498 13.512 1.00 0.00 H new ATOM 0 HA LEU A 123 -2.906 -2.198 14.261 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -3.577 -0.780 11.660 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -4.293 -2.272 12.236 1.00 0.00 H new ATOM 0 HG LEU A 123 -4.526 0.209 13.914 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -6.603 0.796 12.728 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -5.179 0.922 11.668 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -6.272 -0.476 11.527 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.652 -0.854 14.561 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -6.323 -2.191 13.433 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -5.264 -1.932 14.840 1.00 0.00 H new ATOM 1798 N VAL A 124 -0.922 -1.663 11.678 1.00 0.00 N ATOM 1799 CA VAL A 124 0.087 -2.284 10.828 1.00 0.00 C ATOM 1800 C VAL A 124 1.244 -1.328 10.560 1.00 0.00 C ATOM 1801 O VAL A 124 1.034 -0.150 10.274 1.00 0.00 O ATOM 1802 CB VAL A 124 -0.514 -2.735 9.483 1.00 0.00 C ATOM 1803 CG1 VAL A 124 0.586 -3.163 8.523 1.00 0.00 C ATOM 1804 CG2 VAL A 124 -1.513 -3.862 9.698 1.00 0.00 C ATOM 0 H VAL A 124 -1.046 -0.662 11.524 1.00 0.00 H new ATOM 0 HA VAL A 124 0.458 -3.158 11.363 1.00 0.00 H new ATOM 0 HB VAL A 124 -1.042 -1.891 9.039 1.00 0.00 H new ATOM 0 HG11 VAL A 124 0.142 -3.478 7.579 1.00 0.00 H new ATOM 0 HG12 VAL A 124 1.260 -2.325 8.345 1.00 0.00 H new ATOM 0 HG13 VAL A 124 1.145 -3.993 8.956 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -1.928 -4.168 8.738 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -1.010 -4.710 10.163 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -2.317 -3.516 10.347 1.00 0.00 H new ATOM 1814 N GLU A 125 2.465 -1.845 10.654 1.00 0.00 N ATOM 1815 CA GLU A 125 3.656 -1.036 10.422 1.00 0.00 C ATOM 1816 C GLU A 125 4.451 -1.568 9.233 1.00 0.00 C ATOM 1817 O GLU A 125 5.047 -2.643 9.302 1.00 0.00 O ATOM 1818 CB GLU A 125 4.538 -1.017 11.672 1.00 0.00 C ATOM 1819 CG GLU A 125 5.686 -0.025 11.591 1.00 0.00 C ATOM 1820 CD GLU A 125 6.637 -0.136 12.767 1.00 0.00 C ATOM 1821 OE1 GLU A 125 7.551 -0.985 12.712 1.00 0.00 O ATOM 1822 OE2 GLU A 125 6.467 0.625 13.742 1.00 0.00 O ATOM 0 H GLU A 125 2.655 -2.819 10.889 1.00 0.00 H new ATOM 0 HA GLU A 125 3.335 -0.019 10.197 1.00 0.00 H new ATOM 0 HB2 GLU A 125 3.921 -0.776 12.538 1.00 0.00 H new ATOM 0 HB3 GLU A 125 4.943 -2.016 11.836 1.00 0.00 H new ATOM 0 HG2 GLU A 125 6.238 -0.189 10.665 1.00 0.00 H new ATOM 0 HG3 GLU A 125 5.284 0.987 11.548 1.00 0.00 H new ATOM 1829 N CYS A 126 4.455 -0.807 8.144 1.00 0.00 N ATOM 1830 CA CYS A 126 5.175 -1.201 6.938 1.00 0.00 C ATOM 1831 C CYS A 126 6.130 -0.099 6.491 1.00 0.00 C ATOM 1832 O CYS A 126 5.856 1.087 6.677 1.00 0.00 O ATOM 1833 CB CYS A 126 4.191 -1.527 5.814 1.00 0.00 C ATOM 1834 SG CYS A 126 4.861 -2.622 4.541 1.00 0.00 S ATOM 0 H CYS A 126 3.968 0.086 8.071 1.00 0.00 H new ATOM 0 HA CYS A 126 5.759 -2.092 7.168 1.00 0.00 H new ATOM 0 HB2 CYS A 126 3.303 -1.990 6.246 1.00 0.00 H new ATOM 0 HB3 CYS A 126 3.870 -0.597 5.346 1.00 0.00 H new ATOM 0 HG CYS A 126 4.232 -3.759 4.572 1.00 0.00 H new ATOM 1840 N ARG A 127 7.252 -0.499 5.901 1.00 0.00 N ATOM 1841 CA ARG A 127 8.249 0.455 5.430 1.00 0.00 C ATOM 1842 C ARG A 127 8.438 0.342 3.920 1.00 0.00 C ATOM 1843 O ARG A 127 8.410 -0.755 3.361 1.00 0.00 O ATOM 1844 CB ARG A 127 9.584 0.223 6.141 1.00 0.00 C ATOM 1845 CG ARG A 127 9.444 -0.023 7.634 1.00 0.00 C ATOM 1846 CD ARG A 127 8.726 1.127 8.323 1.00 0.00 C ATOM 1847 NE ARG A 127 9.133 1.269 9.719 1.00 0.00 N ATOM 1848 CZ ARG A 127 10.376 1.548 10.097 1.00 0.00 C ATOM 1849 NH1 ARG A 127 11.327 1.715 9.188 1.00 0.00 N ATOM 1850 NH2 ARG A 127 10.669 1.661 11.386 1.00 0.00 N ATOM 0 H ARG A 127 7.493 -1.477 5.738 1.00 0.00 H new ATOM 0 HA ARG A 127 7.892 1.459 5.660 1.00 0.00 H new ATOM 0 HB2 ARG A 127 10.085 -0.632 5.686 1.00 0.00 H new ATOM 0 HB3 ARG A 127 10.226 1.090 5.983 1.00 0.00 H new ATOM 0 HG2 ARG A 127 8.894 -0.949 7.801 1.00 0.00 H new ATOM 0 HG3 ARG A 127 10.431 -0.154 8.076 1.00 0.00 H new ATOM 0 HD2 ARG A 127 8.932 2.055 7.789 1.00 0.00 H new ATOM 0 HD3 ARG A 127 7.649 0.963 8.274 1.00 0.00 H new ATOM 0 HE ARG A 127 8.425 1.147 10.443 1.00 0.00 H new ATOM 0 HH11 ARG A 127 11.105 1.629 8.196 1.00 0.00 H new ATOM 0 HH12 ARG A 127 12.280 1.929 9.481 1.00 0.00 H new ATOM 0 HH21 ARG A 127 9.940 1.534 12.088 1.00 0.00 H new ATOM 0 HH22 ARG A 127 11.623 1.875 11.675 1.00 0.00 H new ATOM 1864 N VAL A 128 8.631 1.482 3.266 1.00 0.00 N ATOM 1865 CA VAL A 128 8.826 1.512 1.821 1.00 0.00 C ATOM 1866 C VAL A 128 9.912 0.532 1.393 1.00 0.00 C ATOM 1867 O VAL A 128 9.939 0.081 0.248 1.00 0.00 O ATOM 1868 CB VAL A 128 9.202 2.924 1.334 1.00 0.00 C ATOM 1869 CG1 VAL A 128 7.990 3.842 1.371 1.00 0.00 C ATOM 1870 CG2 VAL A 128 10.337 3.491 2.172 1.00 0.00 C ATOM 0 H VAL A 128 8.657 2.398 3.714 1.00 0.00 H new ATOM 0 HA VAL A 128 7.879 1.221 1.368 1.00 0.00 H new ATOM 0 HB VAL A 128 9.543 2.855 0.301 1.00 0.00 H new ATOM 0 HG11 VAL A 128 8.275 4.835 1.024 1.00 0.00 H new ATOM 0 HG12 VAL A 128 7.210 3.441 0.724 1.00 0.00 H new ATOM 0 HG13 VAL A 128 7.615 3.909 2.392 1.00 0.00 H new ATOM 0 HG21 VAL A 128 10.590 4.489 1.814 1.00 0.00 H new ATOM 0 HG22 VAL A 128 10.026 3.547 3.215 1.00 0.00 H new ATOM 0 HG23 VAL A 128 11.210 2.844 2.088 1.00 0.00 H new ATOM 1880 N ARG A 129 10.807 0.207 2.320 1.00 0.00 N ATOM 1881 CA ARG A 129 11.897 -0.720 2.039 1.00 0.00 C ATOM 1882 C ARG A 129 11.361 -2.120 1.758 1.00 0.00 C ATOM 1883 O ARG A 129 11.762 -2.767 0.790 1.00 0.00 O ATOM 1884 CB ARG A 129 12.875 -0.762 3.215 1.00 0.00 C ATOM 1885 CG ARG A 129 13.120 0.596 3.852 1.00 0.00 C ATOM 1886 CD ARG A 129 14.493 0.665 4.503 1.00 0.00 C ATOM 1887 NE ARG A 129 14.558 1.699 5.533 1.00 0.00 N ATOM 1888 CZ ARG A 129 14.793 2.980 5.274 1.00 0.00 C ATOM 1889 NH1 ARG A 129 14.984 3.384 4.026 1.00 0.00 N ATOM 1890 NH2 ARG A 129 14.838 3.861 6.266 1.00 0.00 N ATOM 0 H ARG A 129 10.799 0.572 3.272 1.00 0.00 H new ATOM 0 HA ARG A 129 12.422 -0.366 1.152 1.00 0.00 H new ATOM 0 HB2 ARG A 129 12.490 -1.445 3.972 1.00 0.00 H new ATOM 0 HB3 ARG A 129 13.826 -1.170 2.872 1.00 0.00 H new ATOM 0 HG2 ARG A 129 13.035 1.375 3.095 1.00 0.00 H new ATOM 0 HG3 ARG A 129 12.351 0.793 4.599 1.00 0.00 H new ATOM 0 HD2 ARG A 129 14.734 -0.302 4.944 1.00 0.00 H new ATOM 0 HD3 ARG A 129 15.246 0.864 3.741 1.00 0.00 H new ATOM 0 HE ARG A 129 14.415 1.422 6.504 1.00 0.00 H new ATOM 0 HH11 ARG A 129 14.951 2.710 3.261 1.00 0.00 H new ATOM 0 HH12 ARG A 129 15.164 4.369 3.831 1.00 0.00 H new ATOM 0 HH21 ARG A 129 14.692 3.554 7.228 1.00 0.00 H new ATOM 0 HH22 ARG A 129 15.019 4.845 6.067 1.00 0.00 H new ATOM 1904 N PHE A 130 10.453 -2.583 2.611 1.00 0.00 N ATOM 1905 CA PHE A 130 9.864 -3.908 2.456 1.00 0.00 C ATOM 1906 C PHE A 130 8.872 -3.929 1.296 1.00 0.00 C ATOM 1907 O PHE A 130 8.711 -4.947 0.621 1.00 0.00 O ATOM 1908 CB PHE A 130 9.163 -4.332 3.748 1.00 0.00 C ATOM 1909 CG PHE A 130 10.063 -4.316 4.951 1.00 0.00 C ATOM 1910 CD1 PHE A 130 10.985 -5.329 5.155 1.00 0.00 C ATOM 1911 CD2 PHE A 130 9.985 -3.288 5.877 1.00 0.00 C ATOM 1912 CE1 PHE A 130 11.815 -5.318 6.261 1.00 0.00 C ATOM 1913 CE2 PHE A 130 10.813 -3.271 6.984 1.00 0.00 C ATOM 1914 CZ PHE A 130 11.728 -4.288 7.177 1.00 0.00 C ATOM 0 H PHE A 130 10.109 -2.060 3.417 1.00 0.00 H new ATOM 0 HA PHE A 130 10.667 -4.612 2.238 1.00 0.00 H new ATOM 0 HB2 PHE A 130 8.317 -3.668 3.928 1.00 0.00 H new ATOM 0 HB3 PHE A 130 8.759 -5.336 3.620 1.00 0.00 H new ATOM 0 HD1 PHE A 130 11.057 -6.137 4.442 1.00 0.00 H new ATOM 0 HD2 PHE A 130 9.270 -2.492 5.732 1.00 0.00 H new ATOM 0 HE1 PHE A 130 12.530 -6.114 6.408 1.00 0.00 H new ATOM 0 HE2 PHE A 130 10.745 -2.463 7.698 1.00 0.00 H new ATOM 0 HZ PHE A 130 12.374 -4.278 8.042 1.00 0.00 H new ATOM 1924 N LEU A 131 8.210 -2.800 1.071 1.00 0.00 N ATOM 1925 CA LEU A 131 7.233 -2.687 -0.007 1.00 0.00 C ATOM 1926 C LEU A 131 7.816 -3.189 -1.324 1.00 0.00 C ATOM 1927 O LEU A 131 8.871 -2.731 -1.762 1.00 0.00 O ATOM 1928 CB LEU A 131 6.776 -1.235 -0.158 1.00 0.00 C ATOM 1929 CG LEU A 131 5.356 -1.030 -0.688 1.00 0.00 C ATOM 1930 CD1 LEU A 131 4.894 0.396 -0.436 1.00 0.00 C ATOM 1931 CD2 LEU A 131 5.288 -1.361 -2.172 1.00 0.00 C ATOM 0 H LEU A 131 8.332 -1.949 1.620 1.00 0.00 H new ATOM 0 HA LEU A 131 6.373 -3.307 0.248 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.853 -0.748 0.814 1.00 0.00 H new ATOM 0 HB3 LEU A 131 7.469 -0.725 -0.827 1.00 0.00 H new ATOM 0 HG LEU A 131 4.688 -1.706 -0.155 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.882 0.524 -0.820 1.00 0.00 H new ATOM 0 HD12 LEU A 131 4.904 0.598 0.635 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.564 1.090 -0.943 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.270 -1.210 -2.532 1.00 0.00 H new ATOM 0 HD22 LEU A 131 5.968 -0.710 -2.721 1.00 0.00 H new ATOM 0 HD23 LEU A 131 5.577 -2.401 -2.326 1.00 0.00 H new ATOM 1943 N SER A 132 7.120 -4.131 -1.953 1.00 0.00 N ATOM 1944 CA SER A 132 7.569 -4.696 -3.220 1.00 0.00 C ATOM 1945 C SER A 132 6.811 -4.076 -4.390 1.00 0.00 C ATOM 1946 O SER A 132 7.411 -3.505 -5.301 1.00 0.00 O ATOM 1947 CB SER A 132 7.379 -6.214 -3.222 1.00 0.00 C ATOM 1948 OG SER A 132 6.028 -6.559 -2.966 1.00 0.00 O ATOM 0 H SER A 132 6.243 -4.519 -1.606 1.00 0.00 H new ATOM 0 HA SER A 132 8.629 -4.470 -3.335 1.00 0.00 H new ATOM 0 HB2 SER A 132 7.685 -6.621 -4.186 1.00 0.00 H new ATOM 0 HB3 SER A 132 8.022 -6.665 -2.467 1.00 0.00 H new ATOM 0 HG SER A 132 5.602 -6.854 -3.798 1.00 0.00 H new ATOM 1954 N PHE A 133 5.487 -4.192 -4.358 1.00 0.00 N ATOM 1955 CA PHE A 133 4.646 -3.644 -5.416 1.00 0.00 C ATOM 1956 C PHE A 133 3.453 -2.896 -4.829 1.00 0.00 C ATOM 1957 O PHE A 133 3.011 -3.185 -3.717 1.00 0.00 O ATOM 1958 CB PHE A 133 4.157 -4.763 -6.338 1.00 0.00 C ATOM 1959 CG PHE A 133 3.427 -4.263 -7.552 1.00 0.00 C ATOM 1960 CD1 PHE A 133 3.962 -3.249 -8.330 1.00 0.00 C ATOM 1961 CD2 PHE A 133 2.205 -4.806 -7.914 1.00 0.00 C ATOM 1962 CE1 PHE A 133 3.293 -2.786 -9.447 1.00 0.00 C ATOM 1963 CE2 PHE A 133 1.532 -4.348 -9.031 1.00 0.00 C ATOM 1964 CZ PHE A 133 2.076 -3.336 -9.798 1.00 0.00 C ATOM 0 H PHE A 133 4.974 -4.660 -3.611 1.00 0.00 H new ATOM 0 HA PHE A 133 5.245 -2.941 -5.995 1.00 0.00 H new ATOM 0 HB2 PHE A 133 5.012 -5.359 -6.658 1.00 0.00 H new ATOM 0 HB3 PHE A 133 3.499 -5.425 -5.775 1.00 0.00 H new ATOM 0 HD1 PHE A 133 4.914 -2.815 -8.060 1.00 0.00 H new ATOM 0 HD2 PHE A 133 1.774 -5.596 -7.317 1.00 0.00 H new ATOM 0 HE1 PHE A 133 3.721 -1.995 -10.045 1.00 0.00 H new ATOM 0 HE2 PHE A 133 0.581 -4.781 -9.304 1.00 0.00 H new ATOM 0 HZ PHE A 133 1.551 -2.976 -10.670 1.00 0.00 H new ATOM 1974 N MET A 134 2.937 -1.931 -5.584 1.00 0.00 N ATOM 1975 CA MET A 134 1.795 -1.141 -5.139 1.00 0.00 C ATOM 1976 C MET A 134 1.124 -0.444 -6.318 1.00 0.00 C ATOM 1977 O MET A 134 1.786 0.208 -7.125 1.00 0.00 O ATOM 1978 CB MET A 134 2.237 -0.105 -4.104 1.00 0.00 C ATOM 1979 CG MET A 134 2.913 1.113 -4.712 1.00 0.00 C ATOM 1980 SD MET A 134 3.488 2.283 -3.467 1.00 0.00 S ATOM 1981 CE MET A 134 5.257 2.014 -3.540 1.00 0.00 C ATOM 0 H MET A 134 3.292 -1.678 -6.506 1.00 0.00 H new ATOM 0 HA MET A 134 1.073 -1.817 -4.681 1.00 0.00 H new ATOM 0 HB2 MET A 134 1.367 0.220 -3.533 1.00 0.00 H new ATOM 0 HB3 MET A 134 2.922 -0.577 -3.400 1.00 0.00 H new ATOM 0 HG2 MET A 134 3.759 0.789 -5.319 1.00 0.00 H new ATOM 0 HG3 MET A 134 2.214 1.615 -5.381 1.00 0.00 H new ATOM 0 HE1 MET A 134 5.723 2.409 -2.637 1.00 0.00 H new ATOM 0 HE2 MET A 134 5.460 0.946 -3.616 1.00 0.00 H new ATOM 0 HE3 MET A 134 5.667 2.524 -4.412 1.00 0.00 H new ATOM 1991 N GLY A 135 -0.195 -0.588 -6.413 1.00 0.00 N ATOM 1992 CA GLY A 135 -0.933 0.033 -7.497 1.00 0.00 C ATOM 1993 C GLY A 135 -2.424 0.080 -7.231 1.00 0.00 C ATOM 1994 O GLY A 135 -2.882 -0.300 -6.154 1.00 0.00 O ATOM 0 H GLY A 135 -0.765 -1.124 -5.758 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -0.562 1.046 -7.651 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -0.749 -0.517 -8.420 1.00 0.00 H new ATOM 1998 N VAL A 136 -3.185 0.551 -8.214 1.00 0.00 N ATOM 1999 CA VAL A 136 -4.633 0.647 -8.081 1.00 0.00 C ATOM 2000 C VAL A 136 -5.335 -0.409 -8.928 1.00 0.00 C ATOM 2001 O VAL A 136 -4.968 -0.641 -10.079 1.00 0.00 O ATOM 2002 CB VAL A 136 -5.143 2.041 -8.493 1.00 0.00 C ATOM 2003 CG1 VAL A 136 -6.650 2.135 -8.309 1.00 0.00 C ATOM 2004 CG2 VAL A 136 -4.432 3.125 -7.697 1.00 0.00 C ATOM 0 H VAL A 136 -2.822 0.872 -9.111 1.00 0.00 H new ATOM 0 HA VAL A 136 -4.866 0.478 -7.030 1.00 0.00 H new ATOM 0 HB VAL A 136 -4.920 2.192 -9.549 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.992 3.127 -8.605 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -7.140 1.383 -8.928 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -6.900 1.963 -7.262 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -4.805 4.103 -8.001 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -4.621 2.979 -6.634 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -3.360 3.071 -7.885 1.00 0.00 H new ATOM 2014 N GLY A 137 -6.347 -1.047 -8.348 1.00 0.00 N ATOM 2015 CA GLY A 137 -7.085 -2.072 -9.064 1.00 0.00 C ATOM 2016 C GLY A 137 -8.040 -1.490 -10.087 1.00 0.00 C ATOM 2017 O GLY A 137 -7.832 -0.383 -10.584 1.00 0.00 O ATOM 0 H GLY A 137 -6.669 -0.873 -7.396 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -6.383 -2.738 -9.565 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -7.645 -2.677 -8.351 1.00 0.00 H new ATOM 2021 N LYS A 138 -9.091 -2.239 -10.405 1.00 0.00 N ATOM 2022 CA LYS A 138 -10.083 -1.792 -11.376 1.00 0.00 C ATOM 2023 C LYS A 138 -10.740 -0.492 -10.925 1.00 0.00 C ATOM 2024 O LYS A 138 -10.978 0.407 -11.731 1.00 0.00 O ATOM 2025 CB LYS A 138 -11.150 -2.871 -11.579 1.00 0.00 C ATOM 2026 CG LYS A 138 -10.801 -3.874 -12.666 1.00 0.00 C ATOM 2027 CD LYS A 138 -11.205 -3.370 -14.041 1.00 0.00 C ATOM 2028 CE LYS A 138 -12.660 -3.693 -14.347 1.00 0.00 C ATOM 2029 NZ LYS A 138 -12.945 -3.636 -15.807 1.00 0.00 N ATOM 0 H LYS A 138 -9.278 -3.158 -10.004 1.00 0.00 H new ATOM 0 HA LYS A 138 -9.572 -1.611 -12.322 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -11.300 -3.403 -10.640 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -12.097 -2.392 -11.829 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -9.729 -4.071 -12.650 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -11.302 -4.821 -12.463 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -11.051 -2.292 -14.094 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -10.564 -3.821 -14.798 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -12.899 -4.687 -13.969 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -13.306 -2.989 -13.823 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -13.946 -3.862 -15.974 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -12.741 -2.680 -16.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -12.347 -4.326 -16.305 1.00 0.00 H new ATOM 2043 N ASP A 139 -11.030 -0.399 -9.631 1.00 0.00 N ATOM 2044 CA ASP A 139 -11.657 0.793 -9.072 1.00 0.00 C ATOM 2045 C ASP A 139 -10.605 1.778 -8.573 1.00 0.00 C ATOM 2046 O ASP A 139 -9.503 1.384 -8.191 1.00 0.00 O ATOM 2047 CB ASP A 139 -12.599 0.411 -7.929 1.00 0.00 C ATOM 2048 CG ASP A 139 -14.003 0.105 -8.413 1.00 0.00 C ATOM 2049 OD1 ASP A 139 -14.415 0.682 -9.441 1.00 0.00 O ATOM 2050 OD2 ASP A 139 -14.690 -0.712 -7.764 1.00 0.00 O ATOM 0 H ASP A 139 -10.841 -1.135 -8.950 1.00 0.00 H new ATOM 0 HA ASP A 139 -12.233 1.275 -9.862 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -12.200 -0.459 -7.408 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -12.637 1.225 -7.206 1.00 0.00 H new ATOM 2055 N VAL A 140 -10.952 3.061 -8.580 1.00 0.00 N ATOM 2056 CA VAL A 140 -10.037 4.102 -8.128 1.00 0.00 C ATOM 2057 C VAL A 140 -10.024 4.200 -6.607 1.00 0.00 C ATOM 2058 O VAL A 140 -9.182 4.884 -6.025 1.00 0.00 O ATOM 2059 CB VAL A 140 -10.414 5.475 -8.717 1.00 0.00 C ATOM 2060 CG1 VAL A 140 -10.234 5.476 -10.227 1.00 0.00 C ATOM 2061 CG2 VAL A 140 -11.842 5.840 -8.342 1.00 0.00 C ATOM 0 H VAL A 140 -11.860 3.404 -8.894 1.00 0.00 H new ATOM 0 HA VAL A 140 -9.043 3.824 -8.480 1.00 0.00 H new ATOM 0 HB VAL A 140 -9.748 6.228 -8.296 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -10.505 6.454 -10.625 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -9.193 5.261 -10.469 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -10.875 4.714 -10.670 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -12.092 6.813 -8.766 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -12.525 5.087 -8.734 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -11.934 5.883 -7.257 1.00 0.00 H new ATOM 2071 N HIS A 141 -10.964 3.512 -5.967 1.00 0.00 N ATOM 2072 CA HIS A 141 -11.060 3.520 -4.511 1.00 0.00 C ATOM 2073 C HIS A 141 -10.484 2.236 -3.921 1.00 0.00 C ATOM 2074 O HIS A 141 -10.772 1.882 -2.777 1.00 0.00 O ATOM 2075 CB HIS A 141 -12.517 3.686 -4.077 1.00 0.00 C ATOM 2076 CG HIS A 141 -13.310 4.587 -4.973 1.00 0.00 C ATOM 2077 ND1 HIS A 141 -13.855 4.169 -6.169 1.00 0.00 N ATOM 2078 CD2 HIS A 141 -13.652 5.890 -4.840 1.00 0.00 C ATOM 2079 CE1 HIS A 141 -14.495 5.177 -6.734 1.00 0.00 C ATOM 2080 NE2 HIS A 141 -14.387 6.233 -5.948 1.00 0.00 N ATOM 0 H HIS A 141 -11.670 2.942 -6.433 1.00 0.00 H new ATOM 0 HA HIS A 141 -10.478 4.363 -4.137 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -12.993 2.706 -4.048 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -12.542 4.083 -3.062 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -13.395 6.539 -4.016 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -15.018 5.143 -7.678 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -14.785 7.154 -6.134 1.00 0.00 H new ATOM 2088 N THR A 142 -9.670 1.542 -4.710 1.00 0.00 N ATOM 2089 CA THR A 142 -9.055 0.297 -4.267 1.00 0.00 C ATOM 2090 C THR A 142 -7.537 0.357 -4.394 1.00 0.00 C ATOM 2091 O THR A 142 -6.994 0.299 -5.497 1.00 0.00 O ATOM 2092 CB THR A 142 -9.579 -0.907 -5.073 1.00 0.00 C ATOM 2093 OG1 THR A 142 -9.416 -0.665 -6.475 1.00 0.00 O ATOM 2094 CG2 THR A 142 -11.045 -1.168 -4.766 1.00 0.00 C ATOM 0 H THR A 142 -9.421 1.821 -5.659 1.00 0.00 H new ATOM 0 HA THR A 142 -9.324 0.168 -3.219 1.00 0.00 H new ATOM 0 HB THR A 142 -9.003 -1.787 -4.786 1.00 0.00 H new ATOM 0 HG1 THR A 142 -9.845 0.184 -6.713 1.00 0.00 H new ATOM 0 HG21 THR A 142 -11.392 -2.023 -5.347 1.00 0.00 H new ATOM 0 HG22 THR A 142 -11.162 -1.380 -3.703 1.00 0.00 H new ATOM 0 HG23 THR A 142 -11.634 -0.289 -5.027 1.00 0.00 H new ATOM 2102 N PHE A 143 -6.857 0.474 -3.258 1.00 0.00 N ATOM 2103 CA PHE A 143 -5.401 0.543 -3.242 1.00 0.00 C ATOM 2104 C PHE A 143 -4.815 -0.538 -2.338 1.00 0.00 C ATOM 2105 O PHE A 143 -5.211 -0.676 -1.181 1.00 0.00 O ATOM 2106 CB PHE A 143 -4.939 1.923 -2.770 1.00 0.00 C ATOM 2107 CG PHE A 143 -3.478 1.982 -2.429 1.00 0.00 C ATOM 2108 CD1 PHE A 143 -2.526 2.125 -3.426 1.00 0.00 C ATOM 2109 CD2 PHE A 143 -3.056 1.896 -1.112 1.00 0.00 C ATOM 2110 CE1 PHE A 143 -1.180 2.178 -3.114 1.00 0.00 C ATOM 2111 CE2 PHE A 143 -1.712 1.950 -0.795 1.00 0.00 C ATOM 2112 CZ PHE A 143 -0.773 2.092 -1.797 1.00 0.00 C ATOM 0 H PHE A 143 -7.292 0.523 -2.336 1.00 0.00 H new ATOM 0 HA PHE A 143 -5.044 0.376 -4.258 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -5.152 2.655 -3.549 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -5.520 2.212 -1.894 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -2.839 2.196 -4.457 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -3.786 1.785 -0.324 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -0.447 2.287 -3.900 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -1.397 1.881 0.236 1.00 0.00 H new ATOM 0 HZ PHE A 143 0.278 2.136 -1.551 1.00 0.00 H new ATOM 2122 N ALA A 144 -3.870 -1.303 -2.876 1.00 0.00 N ATOM 2123 CA ALA A 144 -3.228 -2.370 -2.119 1.00 0.00 C ATOM 2124 C ALA A 144 -1.714 -2.331 -2.291 1.00 0.00 C ATOM 2125 O ALA A 144 -1.207 -1.873 -3.315 1.00 0.00 O ATOM 2126 CB ALA A 144 -3.776 -3.724 -2.548 1.00 0.00 C ATOM 0 H ALA A 144 -3.532 -1.203 -3.833 1.00 0.00 H new ATOM 0 HA ALA A 144 -3.451 -2.218 -1.063 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -3.288 -4.512 -1.975 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -4.850 -3.756 -2.367 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -3.583 -3.875 -3.610 1.00 0.00 H new ATOM 2132 N PHE A 145 -0.996 -2.814 -1.283 1.00 0.00 N ATOM 2133 CA PHE A 145 0.462 -2.833 -1.322 1.00 0.00 C ATOM 2134 C PHE A 145 1.004 -4.143 -0.758 1.00 0.00 C ATOM 2135 O PHE A 145 0.618 -4.569 0.331 1.00 0.00 O ATOM 2136 CB PHE A 145 1.030 -1.651 -0.534 1.00 0.00 C ATOM 2137 CG PHE A 145 0.707 -1.698 0.933 1.00 0.00 C ATOM 2138 CD1 PHE A 145 1.421 -2.523 1.786 1.00 0.00 C ATOM 2139 CD2 PHE A 145 -0.311 -0.917 1.457 1.00 0.00 C ATOM 2140 CE1 PHE A 145 1.127 -2.568 3.136 1.00 0.00 C ATOM 2141 CE2 PHE A 145 -0.609 -0.958 2.806 1.00 0.00 C ATOM 2142 CZ PHE A 145 0.110 -1.786 3.646 1.00 0.00 C ATOM 0 H PHE A 145 -1.400 -3.198 -0.429 1.00 0.00 H new ATOM 0 HA PHE A 145 0.774 -2.750 -2.363 1.00 0.00 H new ATOM 0 HB2 PHE A 145 2.113 -1.628 -0.659 1.00 0.00 H new ATOM 0 HB3 PHE A 145 0.641 -0.724 -0.954 1.00 0.00 H new ATOM 0 HD1 PHE A 145 2.216 -3.138 1.392 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -0.877 -0.269 0.804 1.00 0.00 H new ATOM 0 HE1 PHE A 145 1.692 -3.214 3.791 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -1.403 -0.343 3.203 1.00 0.00 H new ATOM 0 HZ PHE A 145 -0.123 -1.822 4.700 1.00 0.00 H new ATOM 2152 N ILE A 146 1.901 -4.776 -1.507 1.00 0.00 N ATOM 2153 CA ILE A 146 2.497 -6.036 -1.081 1.00 0.00 C ATOM 2154 C ILE A 146 3.842 -5.806 -0.400 1.00 0.00 C ATOM 2155 O ILE A 146 4.686 -5.065 -0.904 1.00 0.00 O ATOM 2156 CB ILE A 146 2.694 -6.995 -2.270 1.00 0.00 C ATOM 2157 CG1 ILE A 146 1.349 -7.304 -2.932 1.00 0.00 C ATOM 2158 CG2 ILE A 146 3.371 -8.278 -1.810 1.00 0.00 C ATOM 2159 CD1 ILE A 146 1.479 -7.856 -4.335 1.00 0.00 C ATOM 0 H ILE A 146 2.231 -4.437 -2.411 1.00 0.00 H new ATOM 0 HA ILE A 146 1.805 -6.488 -0.370 1.00 0.00 H new ATOM 0 HB ILE A 146 3.337 -6.511 -3.005 1.00 0.00 H new ATOM 0 HG12 ILE A 146 0.807 -8.022 -2.317 1.00 0.00 H new ATOM 0 HG13 ILE A 146 0.750 -6.394 -2.962 1.00 0.00 H new ATOM 0 HG21 ILE A 146 3.503 -8.945 -2.662 1.00 0.00 H new ATOM 0 HG22 ILE A 146 4.344 -8.042 -1.380 1.00 0.00 H new ATOM 0 HG23 ILE A 146 2.751 -8.767 -1.059 1.00 0.00 H new ATOM 0 HD11 ILE A 146 0.487 -8.052 -4.742 1.00 0.00 H new ATOM 0 HD12 ILE A 146 1.993 -7.130 -4.965 1.00 0.00 H new ATOM 0 HD13 ILE A 146 2.050 -8.784 -4.309 1.00 0.00 H new ATOM 2171 N MET A 147 4.035 -6.448 0.747 1.00 0.00 N ATOM 2172 CA MET A 147 5.280 -6.316 1.496 1.00 0.00 C ATOM 2173 C MET A 147 5.953 -7.673 1.676 1.00 0.00 C ATOM 2174 O MET A 147 5.375 -8.711 1.353 1.00 0.00 O ATOM 2175 CB MET A 147 5.013 -5.681 2.862 1.00 0.00 C ATOM 2176 CG MET A 147 4.206 -6.567 3.797 1.00 0.00 C ATOM 2177 SD MET A 147 3.208 -5.619 4.962 1.00 0.00 S ATOM 2178 CE MET A 147 4.274 -5.623 6.402 1.00 0.00 C ATOM 0 H MET A 147 3.346 -7.064 1.178 1.00 0.00 H new ATOM 0 HA MET A 147 5.950 -5.671 0.928 1.00 0.00 H new ATOM 0 HB2 MET A 147 5.966 -5.441 3.334 1.00 0.00 H new ATOM 0 HB3 MET A 147 4.482 -4.740 2.718 1.00 0.00 H new ATOM 0 HG2 MET A 147 3.555 -7.212 3.208 1.00 0.00 H new ATOM 0 HG3 MET A 147 4.884 -7.217 4.350 1.00 0.00 H new ATOM 0 HE1 MET A 147 3.794 -5.073 7.212 1.00 0.00 H new ATOM 0 HE2 MET A 147 4.455 -6.650 6.718 1.00 0.00 H new ATOM 0 HE3 MET A 147 5.223 -5.148 6.154 1.00 0.00 H new ATOM 2188 N ASP A 148 7.176 -7.657 2.193 1.00 0.00 N ATOM 2189 CA ASP A 148 7.928 -8.887 2.417 1.00 0.00 C ATOM 2190 C ASP A 148 8.161 -9.118 3.906 1.00 0.00 C ATOM 2191 O ASP A 148 8.910 -8.383 4.550 1.00 0.00 O ATOM 2192 CB ASP A 148 9.267 -8.832 1.680 1.00 0.00 C ATOM 2193 CG ASP A 148 10.154 -10.019 2.003 1.00 0.00 C ATOM 2194 OD1 ASP A 148 9.684 -11.167 1.861 1.00 0.00 O ATOM 2195 OD2 ASP A 148 11.318 -9.799 2.397 1.00 0.00 O ATOM 0 H ASP A 148 7.668 -6.806 2.465 1.00 0.00 H new ATOM 0 HA ASP A 148 7.342 -9.719 2.027 1.00 0.00 H new ATOM 0 HB2 ASP A 148 9.086 -8.799 0.606 1.00 0.00 H new ATOM 0 HB3 ASP A 148 9.787 -7.911 1.944 1.00 0.00 H new ATOM 2200 N THR A 149 7.513 -10.144 4.450 1.00 0.00 N ATOM 2201 CA THR A 149 7.648 -10.471 5.863 1.00 0.00 C ATOM 2202 C THR A 149 8.786 -11.459 6.093 1.00 0.00 C ATOM 2203 O THR A 149 9.108 -11.796 7.232 1.00 0.00 O ATOM 2204 CB THR A 149 6.345 -11.066 6.429 1.00 0.00 C ATOM 2205 OG1 THR A 149 6.198 -12.423 5.998 1.00 0.00 O ATOM 2206 CG2 THR A 149 5.140 -10.253 5.981 1.00 0.00 C ATOM 0 H THR A 149 6.889 -10.763 3.932 1.00 0.00 H new ATOM 0 HA THR A 149 7.869 -9.539 6.383 1.00 0.00 H new ATOM 0 HB THR A 149 6.400 -11.035 7.517 1.00 0.00 H new ATOM 0 HG1 THR A 149 5.368 -12.794 6.364 1.00 0.00 H new ATOM 0 HG21 THR A 149 4.231 -10.692 6.393 1.00 0.00 H new ATOM 0 HG22 THR A 149 5.241 -9.227 6.336 1.00 0.00 H new ATOM 0 HG23 THR A 149 5.083 -10.256 4.892 1.00 0.00 H new ATOM 2214 N GLY A 150 9.392 -11.921 5.004 1.00 0.00 N ATOM 2215 CA GLY A 150 10.489 -12.866 5.109 1.00 0.00 C ATOM 2216 C GLY A 150 10.076 -14.276 4.737 1.00 0.00 C ATOM 2217 O GLY A 150 8.888 -14.587 4.680 1.00 0.00 O ATOM 0 H GLY A 150 9.143 -11.658 4.050 1.00 0.00 H new ATOM 0 HA2 GLY A 150 11.304 -12.546 4.460 1.00 0.00 H new ATOM 0 HA3 GLY A 150 10.873 -12.860 6.129 1.00 0.00 H new ATOM 2221 N ASN A 151 11.061 -15.131 4.481 1.00 0.00 N ATOM 2222 CA ASN A 151 10.794 -16.516 4.110 1.00 0.00 C ATOM 2223 C ASN A 151 10.001 -16.587 2.808 1.00 0.00 C ATOM 2224 O ASN A 151 9.131 -17.442 2.647 1.00 0.00 O ATOM 2225 CB ASN A 151 10.027 -17.226 5.227 1.00 0.00 C ATOM 2226 CG ASN A 151 10.940 -17.713 6.336 1.00 0.00 C ATOM 2227 OD1 ASN A 151 11.167 -18.914 6.486 1.00 0.00 O ATOM 2228 ND2 ASN A 151 11.468 -16.780 7.120 1.00 0.00 N ATOM 0 H ASN A 151 12.051 -14.889 4.524 1.00 0.00 H new ATOM 0 HA ASN A 151 11.750 -17.017 3.960 1.00 0.00 H new ATOM 0 HB2 ASN A 151 9.285 -16.545 5.644 1.00 0.00 H new ATOM 0 HB3 ASN A 151 9.483 -18.073 4.809 1.00 0.00 H new ATOM 0 HD21 ASN A 151 12.090 -17.047 7.883 1.00 0.00 H new ATOM 0 HD22 ASN A 151 11.252 -15.796 6.959 1.00 0.00 H new ATOM 2235 N GLN A 152 10.309 -15.683 1.884 1.00 0.00 N ATOM 2236 CA GLN A 152 9.625 -15.643 0.597 1.00 0.00 C ATOM 2237 C GLN A 152 8.118 -15.504 0.785 1.00 0.00 C ATOM 2238 O GLN A 152 7.333 -16.073 0.028 1.00 0.00 O ATOM 2239 CB GLN A 152 9.936 -16.906 -0.208 1.00 0.00 C ATOM 2240 CG GLN A 152 11.406 -17.054 -0.566 1.00 0.00 C ATOM 2241 CD GLN A 152 12.218 -17.678 0.552 1.00 0.00 C ATOM 2242 OE1 GLN A 152 13.167 -17.076 1.056 1.00 0.00 O ATOM 2243 NE2 GLN A 152 11.850 -18.891 0.946 1.00 0.00 N ATOM 0 H GLN A 152 11.027 -14.969 2.002 1.00 0.00 H new ATOM 0 HA GLN A 152 9.986 -14.773 0.049 1.00 0.00 H new ATOM 0 HB2 GLN A 152 9.621 -17.778 0.365 1.00 0.00 H new ATOM 0 HB3 GLN A 152 9.347 -16.896 -1.125 1.00 0.00 H new ATOM 0 HG2 GLN A 152 11.498 -17.667 -1.463 1.00 0.00 H new ATOM 0 HG3 GLN A 152 11.818 -16.074 -0.806 1.00 0.00 H new ATOM 0 HE21 GLN A 152 11.057 -19.353 0.501 1.00 0.00 H new ATOM 0 HE22 GLN A 152 12.360 -19.361 1.694 1.00 0.00 H new ATOM 2252 N ARG A 153 7.722 -14.742 1.800 1.00 0.00 N ATOM 2253 CA ARG A 153 6.309 -14.529 2.089 1.00 0.00 C ATOM 2254 C ARG A 153 5.898 -13.096 1.767 1.00 0.00 C ATOM 2255 O ARG A 153 6.598 -12.145 2.116 1.00 0.00 O ATOM 2256 CB ARG A 153 6.015 -14.837 3.558 1.00 0.00 C ATOM 2257 CG ARG A 153 6.018 -16.323 3.882 1.00 0.00 C ATOM 2258 CD ARG A 153 4.644 -16.941 3.674 1.00 0.00 C ATOM 2259 NE ARG A 153 4.667 -18.392 3.833 1.00 0.00 N ATOM 2260 CZ ARG A 153 3.575 -19.148 3.844 1.00 0.00 C ATOM 2261 NH1 ARG A 153 2.379 -18.592 3.706 1.00 0.00 N ATOM 2262 NH2 ARG A 153 3.677 -20.462 3.994 1.00 0.00 N ATOM 0 H ARG A 153 8.360 -14.262 2.435 1.00 0.00 H new ATOM 0 HA ARG A 153 5.730 -15.205 1.460 1.00 0.00 H new ATOM 0 HB2 ARG A 153 6.757 -14.337 4.181 1.00 0.00 H new ATOM 0 HB3 ARG A 153 5.043 -14.419 3.821 1.00 0.00 H new ATOM 0 HG2 ARG A 153 6.747 -16.833 3.251 1.00 0.00 H new ATOM 0 HG3 ARG A 153 6.332 -16.471 4.915 1.00 0.00 H new ATOM 0 HD2 ARG A 153 3.941 -16.509 4.386 1.00 0.00 H new ATOM 0 HD3 ARG A 153 4.281 -16.691 2.677 1.00 0.00 H new ATOM 0 HE ARG A 153 5.572 -18.851 3.942 1.00 0.00 H new ATOM 0 HH11 ARG A 153 2.296 -17.582 3.591 1.00 0.00 H new ATOM 0 HH12 ARG A 153 1.542 -19.174 3.715 1.00 0.00 H new ATOM 0 HH21 ARG A 153 4.595 -20.893 4.101 1.00 0.00 H new ATOM 0 HH22 ARG A 153 2.837 -21.041 4.002 1.00 0.00 H new ATOM 2276 N PHE A 154 4.759 -12.948 1.098 1.00 0.00 N ATOM 2277 CA PHE A 154 4.256 -11.631 0.727 1.00 0.00 C ATOM 2278 C PHE A 154 2.806 -11.458 1.170 1.00 0.00 C ATOM 2279 O PHE A 154 1.955 -12.300 0.885 1.00 0.00 O ATOM 2280 CB PHE A 154 4.367 -11.426 -0.786 1.00 0.00 C ATOM 2281 CG PHE A 154 5.575 -12.081 -1.392 1.00 0.00 C ATOM 2282 CD1 PHE A 154 6.851 -11.662 -1.050 1.00 0.00 C ATOM 2283 CD2 PHE A 154 5.435 -13.115 -2.303 1.00 0.00 C ATOM 2284 CE1 PHE A 154 7.965 -12.262 -1.607 1.00 0.00 C ATOM 2285 CE2 PHE A 154 6.545 -13.719 -2.863 1.00 0.00 C ATOM 2286 CZ PHE A 154 7.811 -13.293 -2.514 1.00 0.00 C ATOM 0 H PHE A 154 4.167 -13.724 0.802 1.00 0.00 H new ATOM 0 HA PHE A 154 4.864 -10.882 1.234 1.00 0.00 H new ATOM 0 HB2 PHE A 154 3.471 -11.821 -1.265 1.00 0.00 H new ATOM 0 HB3 PHE A 154 4.398 -10.357 -0.999 1.00 0.00 H new ATOM 0 HD1 PHE A 154 6.977 -10.858 -0.340 1.00 0.00 H new ATOM 0 HD2 PHE A 154 4.447 -13.453 -2.579 1.00 0.00 H new ATOM 0 HE1 PHE A 154 8.954 -11.925 -1.334 1.00 0.00 H new ATOM 0 HE2 PHE A 154 6.422 -14.524 -3.573 1.00 0.00 H new ATOM 0 HZ PHE A 154 8.680 -13.765 -2.949 1.00 0.00 H new ATOM 2296 N GLU A 155 2.534 -10.360 1.868 1.00 0.00 N ATOM 2297 CA GLU A 155 1.187 -10.078 2.352 1.00 0.00 C ATOM 2298 C GLU A 155 0.588 -8.879 1.622 1.00 0.00 C ATOM 2299 O GLU A 155 1.107 -7.765 1.705 1.00 0.00 O ATOM 2300 CB GLU A 155 1.208 -9.814 3.859 1.00 0.00 C ATOM 2301 CG GLU A 155 1.658 -11.010 4.681 1.00 0.00 C ATOM 2302 CD GLU A 155 1.689 -10.717 6.168 1.00 0.00 C ATOM 2303 OE1 GLU A 155 1.094 -9.703 6.587 1.00 0.00 O ATOM 2304 OE2 GLU A 155 2.311 -11.504 6.914 1.00 0.00 O ATOM 0 H GLU A 155 3.227 -9.652 2.111 1.00 0.00 H new ATOM 0 HA GLU A 155 0.565 -10.951 2.152 1.00 0.00 H new ATOM 0 HB2 GLU A 155 1.872 -8.974 4.063 1.00 0.00 H new ATOM 0 HB3 GLU A 155 0.210 -9.517 4.181 1.00 0.00 H new ATOM 0 HG2 GLU A 155 0.987 -11.848 4.494 1.00 0.00 H new ATOM 0 HG3 GLU A 155 2.651 -11.318 4.354 1.00 0.00 H new ATOM 2311 N CYS A 156 -0.508 -9.116 0.909 1.00 0.00 N ATOM 2312 CA CYS A 156 -1.178 -8.057 0.163 1.00 0.00 C ATOM 2313 C CYS A 156 -2.304 -7.440 0.988 1.00 0.00 C ATOM 2314 O CYS A 156 -3.332 -8.075 1.227 1.00 0.00 O ATOM 2315 CB CYS A 156 -1.734 -8.604 -1.152 1.00 0.00 C ATOM 2316 SG CYS A 156 -2.207 -7.327 -2.342 1.00 0.00 S ATOM 0 H CYS A 156 -0.951 -10.032 0.832 1.00 0.00 H new ATOM 0 HA CYS A 156 -0.445 -7.281 -0.056 1.00 0.00 H new ATOM 0 HB2 CYS A 156 -0.986 -9.252 -1.609 1.00 0.00 H new ATOM 0 HB3 CYS A 156 -2.604 -9.224 -0.936 1.00 0.00 H new ATOM 0 HG CYS A 156 -2.461 -7.878 -3.492 1.00 0.00 H new ATOM 2322 N HIS A 157 -2.102 -6.200 1.421 1.00 0.00 N ATOM 2323 CA HIS A 157 -3.100 -5.498 2.220 1.00 0.00 C ATOM 2324 C HIS A 157 -3.869 -4.493 1.368 1.00 0.00 C ATOM 2325 O HIS A 157 -3.275 -3.660 0.684 1.00 0.00 O ATOM 2326 CB HIS A 157 -2.432 -4.782 3.395 1.00 0.00 C ATOM 2327 CG HIS A 157 -1.798 -5.714 4.382 1.00 0.00 C ATOM 2328 ND1 HIS A 157 -2.462 -6.206 5.486 1.00 0.00 N ATOM 2329 CD2 HIS A 157 -0.554 -6.244 4.425 1.00 0.00 C ATOM 2330 CE1 HIS A 157 -1.653 -6.997 6.166 1.00 0.00 C ATOM 2331 NE2 HIS A 157 -0.489 -7.038 5.544 1.00 0.00 N ATOM 0 H HIS A 157 -1.257 -5.661 1.232 1.00 0.00 H new ATOM 0 HA HIS A 157 -3.804 -6.235 2.606 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -1.672 -4.101 3.011 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -3.176 -4.173 3.909 1.00 0.00 H new ATOM 0 HD2 HIS A 157 0.240 -6.074 3.713 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -1.901 -7.522 7.077 1.00 0.00 H new ATOM 0 HE2 HIS A 157 0.326 -7.572 5.845 1.00 0.00 H new ATOM 2339 N VAL A 158 -5.195 -4.578 1.414 1.00 0.00 N ATOM 2340 CA VAL A 158 -6.046 -3.676 0.647 1.00 0.00 C ATOM 2341 C VAL A 158 -6.654 -2.601 1.540 1.00 0.00 C ATOM 2342 O VAL A 158 -6.963 -2.849 2.706 1.00 0.00 O ATOM 2343 CB VAL A 158 -7.180 -4.441 -0.062 1.00 0.00 C ATOM 2344 CG1 VAL A 158 -8.021 -3.492 -0.902 1.00 0.00 C ATOM 2345 CG2 VAL A 158 -6.611 -5.563 -0.918 1.00 0.00 C ATOM 0 H VAL A 158 -5.703 -5.262 1.974 1.00 0.00 H new ATOM 0 HA VAL A 158 -5.411 -3.204 -0.103 1.00 0.00 H new ATOM 0 HB VAL A 158 -7.825 -4.885 0.696 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -8.817 -4.050 -1.395 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -8.458 -2.728 -0.260 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -7.391 -3.017 -1.654 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -7.426 -6.093 -1.412 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -5.943 -5.144 -1.670 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -6.057 -6.257 -0.286 1.00 0.00 H new ATOM 2355 N PHE A 159 -6.824 -1.405 0.986 1.00 0.00 N ATOM 2356 CA PHE A 159 -7.395 -0.290 1.733 1.00 0.00 C ATOM 2357 C PHE A 159 -8.258 0.585 0.828 1.00 0.00 C ATOM 2358 O PHE A 159 -7.876 0.895 -0.300 1.00 0.00 O ATOM 2359 CB PHE A 159 -6.284 0.550 2.365 1.00 0.00 C ATOM 2360 CG PHE A 159 -5.368 -0.240 3.255 1.00 0.00 C ATOM 2361 CD1 PHE A 159 -4.376 -1.043 2.714 1.00 0.00 C ATOM 2362 CD2 PHE A 159 -5.498 -0.181 4.634 1.00 0.00 C ATOM 2363 CE1 PHE A 159 -3.531 -1.771 3.530 1.00 0.00 C ATOM 2364 CE2 PHE A 159 -4.655 -0.906 5.455 1.00 0.00 C ATOM 2365 CZ PHE A 159 -3.672 -1.703 4.902 1.00 0.00 C ATOM 0 H PHE A 159 -6.574 -1.183 0.022 1.00 0.00 H new ATOM 0 HA PHE A 159 -8.025 -0.699 2.523 1.00 0.00 H new ATOM 0 HB2 PHE A 159 -5.696 1.015 1.574 1.00 0.00 H new ATOM 0 HB3 PHE A 159 -6.734 1.356 2.944 1.00 0.00 H new ATOM 0 HD1 PHE A 159 -4.262 -1.100 1.642 1.00 0.00 H new ATOM 0 HD2 PHE A 159 -6.267 0.439 5.072 1.00 0.00 H new ATOM 0 HE1 PHE A 159 -2.762 -2.392 3.095 1.00 0.00 H new ATOM 0 HE2 PHE A 159 -4.765 -0.849 6.528 1.00 0.00 H new ATOM 0 HZ PHE A 159 -3.014 -2.272 5.542 1.00 0.00 H new ATOM 2375 N TRP A 160 -9.422 0.978 1.332 1.00 0.00 N ATOM 2376 CA TRP A 160 -10.340 1.817 0.570 1.00 0.00 C ATOM 2377 C TRP A 160 -10.106 3.293 0.872 1.00 0.00 C ATOM 2378 O TRP A 160 -10.194 3.723 2.023 1.00 0.00 O ATOM 2379 CB TRP A 160 -11.789 1.442 0.887 1.00 0.00 C ATOM 2380 CG TRP A 160 -12.773 1.983 -0.105 1.00 0.00 C ATOM 2381 CD1 TRP A 160 -13.329 3.231 -0.112 1.00 0.00 C ATOM 2382 CD2 TRP A 160 -13.319 1.292 -1.234 1.00 0.00 C ATOM 2383 NE1 TRP A 160 -14.187 3.357 -1.177 1.00 0.00 N ATOM 2384 CE2 TRP A 160 -14.199 2.182 -1.881 1.00 0.00 C ATOM 2385 CE3 TRP A 160 -13.149 0.010 -1.762 1.00 0.00 C ATOM 2386 CZ2 TRP A 160 -14.905 1.828 -3.027 1.00 0.00 C ATOM 2387 CZ3 TRP A 160 -13.851 -0.340 -2.900 1.00 0.00 C ATOM 2388 CH2 TRP A 160 -14.720 0.566 -3.523 1.00 0.00 C ATOM 0 H TRP A 160 -9.753 0.729 2.264 1.00 0.00 H new ATOM 0 HA TRP A 160 -10.152 1.648 -0.490 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -11.877 0.356 0.920 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -12.044 1.813 1.880 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -13.124 4.005 0.613 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -14.728 4.191 -1.407 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -12.481 -0.695 -1.290 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -15.575 2.525 -3.508 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -13.728 -1.329 -3.316 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -15.254 0.262 -4.411 1.00 0.00 H new ATOM 2399 N CYS A 161 -9.808 4.065 -0.168 1.00 0.00 N ATOM 2400 CA CYS A 161 -9.561 5.494 -0.013 1.00 0.00 C ATOM 2401 C CYS A 161 -10.670 6.312 -0.667 1.00 0.00 C ATOM 2402 O CYS A 161 -11.301 5.865 -1.624 1.00 0.00 O ATOM 2403 CB CYS A 161 -8.209 5.868 -0.623 1.00 0.00 C ATOM 2404 SG CYS A 161 -6.799 5.034 0.142 1.00 0.00 S ATOM 0 H CYS A 161 -9.732 3.725 -1.127 1.00 0.00 H new ATOM 0 HA CYS A 161 -9.547 5.721 1.053 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -8.224 5.631 -1.687 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -8.070 6.946 -0.538 1.00 0.00 H new ATOM 0 HG CYS A 161 -5.785 5.063 -0.671 1.00 0.00 H new ATOM 2410 N GLU A 162 -10.904 7.510 -0.141 1.00 0.00 N ATOM 2411 CA GLU A 162 -11.939 8.388 -0.673 1.00 0.00 C ATOM 2412 C GLU A 162 -11.482 9.844 -0.650 1.00 0.00 C ATOM 2413 O GLU A 162 -10.676 10.255 0.185 1.00 0.00 O ATOM 2414 CB GLU A 162 -13.231 8.235 0.132 1.00 0.00 C ATOM 2415 CG GLU A 162 -13.878 6.867 -0.009 1.00 0.00 C ATOM 2416 CD GLU A 162 -14.870 6.806 -1.154 1.00 0.00 C ATOM 2417 OE1 GLU A 162 -14.798 7.673 -2.049 1.00 0.00 O ATOM 2418 OE2 GLU A 162 -15.719 5.890 -1.154 1.00 0.00 O ATOM 0 H GLU A 162 -10.391 7.894 0.652 1.00 0.00 H new ATOM 0 HA GLU A 162 -12.127 8.101 -1.707 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -13.017 8.420 1.185 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -13.941 8.998 -0.188 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -13.103 6.117 -0.165 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -14.386 6.612 0.921 1.00 0.00 H new ATOM 2425 N PRO A 163 -12.009 10.644 -1.589 1.00 0.00 N ATOM 2426 CA PRO A 163 -12.969 10.166 -2.588 1.00 0.00 C ATOM 2427 C PRO A 163 -12.329 9.229 -3.606 1.00 0.00 C ATOM 2428 O PRO A 163 -12.995 8.738 -4.517 1.00 0.00 O ATOM 2429 CB PRO A 163 -13.443 11.452 -3.269 1.00 0.00 C ATOM 2430 CG PRO A 163 -12.323 12.417 -3.077 1.00 0.00 C ATOM 2431 CD PRO A 163 -11.707 12.076 -1.748 1.00 0.00 C ATOM 0 HA PRO A 163 -13.773 9.586 -2.135 1.00 0.00 H new ATOM 0 HB2 PRO A 163 -13.647 11.288 -4.327 1.00 0.00 H new ATOM 0 HB3 PRO A 163 -14.365 11.821 -2.820 1.00 0.00 H new ATOM 0 HG2 PRO A 163 -11.591 12.331 -3.880 1.00 0.00 H new ATOM 0 HG3 PRO A 163 -12.687 13.444 -3.087 1.00 0.00 H new ATOM 0 HD2 PRO A 163 -10.633 12.263 -1.743 1.00 0.00 H new ATOM 0 HD3 PRO A 163 -12.138 12.669 -0.941 1.00 0.00 H new ATOM 2439 N ASN A 164 -11.032 8.984 -3.445 1.00 0.00 N ATOM 2440 CA ASN A 164 -10.302 8.106 -4.351 1.00 0.00 C ATOM 2441 C ASN A 164 -8.922 7.773 -3.791 1.00 0.00 C ATOM 2442 O ASN A 164 -8.516 8.302 -2.757 1.00 0.00 O ATOM 2443 CB ASN A 164 -10.163 8.759 -5.727 1.00 0.00 C ATOM 2444 CG ASN A 164 -9.846 10.239 -5.635 1.00 0.00 C ATOM 2445 OD1 ASN A 164 -9.521 10.750 -4.563 1.00 0.00 O ATOM 2446 ND2 ASN A 164 -9.939 10.935 -6.762 1.00 0.00 N ATOM 0 H ASN A 164 -10.466 9.381 -2.695 1.00 0.00 H new ATOM 0 HA ASN A 164 -10.867 7.179 -4.452 1.00 0.00 H new ATOM 0 HB2 ASN A 164 -9.375 8.256 -6.287 1.00 0.00 H new ATOM 0 HB3 ASN A 164 -11.089 8.623 -6.286 1.00 0.00 H new ATOM 0 HD21 ASN A 164 -9.737 11.935 -6.762 1.00 0.00 H new ATOM 0 HD22 ASN A 164 -10.212 10.470 -7.628 1.00 0.00 H new ATOM 2453 N ALA A 165 -8.205 6.894 -4.484 1.00 0.00 N ATOM 2454 CA ALA A 165 -6.869 6.494 -4.058 1.00 0.00 C ATOM 2455 C ALA A 165 -5.796 7.276 -4.807 1.00 0.00 C ATOM 2456 O ALA A 165 -4.693 6.779 -5.028 1.00 0.00 O ATOM 2457 CB ALA A 165 -6.676 4.999 -4.264 1.00 0.00 C ATOM 0 H ALA A 165 -8.526 6.446 -5.342 1.00 0.00 H new ATOM 0 HA ALA A 165 -6.770 6.720 -2.996 1.00 0.00 H new ATOM 0 HB1 ALA A 165 -5.675 4.714 -3.942 1.00 0.00 H new ATOM 0 HB2 ALA A 165 -7.415 4.453 -3.678 1.00 0.00 H new ATOM 0 HB3 ALA A 165 -6.800 4.758 -5.320 1.00 0.00 H new ATOM 2463 N ALA A 166 -6.128 8.503 -5.197 1.00 0.00 N ATOM 2464 CA ALA A 166 -5.192 9.354 -5.920 1.00 0.00 C ATOM 2465 C ALA A 166 -4.191 10.002 -4.970 1.00 0.00 C ATOM 2466 O ALA A 166 -2.992 10.031 -5.242 1.00 0.00 O ATOM 2467 CB ALA A 166 -5.945 10.420 -6.703 1.00 0.00 C ATOM 0 H ALA A 166 -7.038 8.929 -5.024 1.00 0.00 H new ATOM 0 HA ALA A 166 -4.637 8.728 -6.619 1.00 0.00 H new ATOM 0 HB1 ALA A 166 -5.234 11.049 -7.238 1.00 0.00 H new ATOM 0 HB2 ALA A 166 -6.615 9.942 -7.417 1.00 0.00 H new ATOM 0 HB3 ALA A 166 -6.526 11.034 -6.015 1.00 0.00 H new ATOM 2473 N ASN A 167 -4.693 10.520 -3.853 1.00 0.00 N ATOM 2474 CA ASN A 167 -3.842 11.169 -2.862 1.00 0.00 C ATOM 2475 C ASN A 167 -2.949 10.149 -2.162 1.00 0.00 C ATOM 2476 O ASN A 167 -1.728 10.164 -2.320 1.00 0.00 O ATOM 2477 CB ASN A 167 -4.696 11.909 -1.831 1.00 0.00 C ATOM 2478 CG ASN A 167 -5.882 12.613 -2.462 1.00 0.00 C ATOM 2479 OD1 ASN A 167 -6.938 12.013 -2.666 1.00 0.00 O ATOM 2480 ND2 ASN A 167 -5.713 13.892 -2.775 1.00 0.00 N ATOM 0 H ASN A 167 -5.684 10.503 -3.612 1.00 0.00 H new ATOM 0 HA ASN A 167 -3.207 11.888 -3.380 1.00 0.00 H new ATOM 0 HB2 ASN A 167 -5.053 11.201 -1.083 1.00 0.00 H new ATOM 0 HB3 ASN A 167 -4.079 12.640 -1.309 1.00 0.00 H new ATOM 0 HD21 ASN A 167 -6.476 14.418 -3.202 1.00 0.00 H new ATOM 0 HD22 ASN A 167 -4.821 14.349 -2.588 1.00 0.00 H new ATOM 2487 N VAL A 168 -3.566 9.264 -1.386 1.00 0.00 N ATOM 2488 CA VAL A 168 -2.828 8.236 -0.662 1.00 0.00 C ATOM 2489 C VAL A 168 -1.687 7.681 -1.507 1.00 0.00 C ATOM 2490 O VAL A 168 -0.514 7.904 -1.207 1.00 0.00 O ATOM 2491 CB VAL A 168 -3.749 7.077 -0.238 1.00 0.00 C ATOM 2492 CG1 VAL A 168 -2.952 5.993 0.471 1.00 0.00 C ATOM 2493 CG2 VAL A 168 -4.875 7.588 0.648 1.00 0.00 C ATOM 0 H VAL A 168 -4.576 9.238 -1.242 1.00 0.00 H new ATOM 0 HA VAL A 168 -2.419 8.710 0.230 1.00 0.00 H new ATOM 0 HB VAL A 168 -4.192 6.642 -1.134 1.00 0.00 H new ATOM 0 HG11 VAL A 168 -3.620 5.183 0.763 1.00 0.00 H new ATOM 0 HG12 VAL A 168 -2.185 5.607 -0.201 1.00 0.00 H new ATOM 0 HG13 VAL A 168 -2.479 6.411 1.359 1.00 0.00 H new ATOM 0 HG21 VAL A 168 -5.516 6.756 0.938 1.00 0.00 H new ATOM 0 HG22 VAL A 168 -4.454 8.050 1.541 1.00 0.00 H new ATOM 0 HG23 VAL A 168 -5.463 8.325 0.101 1.00 0.00 H new ATOM 2503 N SER A 169 -2.039 6.957 -2.565 1.00 0.00 N ATOM 2504 CA SER A 169 -1.043 6.367 -3.452 1.00 0.00 C ATOM 2505 C SER A 169 0.045 7.379 -3.798 1.00 0.00 C ATOM 2506 O SER A 169 1.227 7.142 -3.552 1.00 0.00 O ATOM 2507 CB SER A 169 -1.709 5.859 -4.733 1.00 0.00 C ATOM 2508 OG SER A 169 -0.982 4.778 -5.291 1.00 0.00 O ATOM 0 H SER A 169 -3.005 6.765 -2.829 1.00 0.00 H new ATOM 0 HA SER A 169 -0.581 5.528 -2.932 1.00 0.00 H new ATOM 0 HB2 SER A 169 -2.729 5.542 -4.515 1.00 0.00 H new ATOM 0 HB3 SER A 169 -1.775 6.670 -5.458 1.00 0.00 H new ATOM 0 HG SER A 169 -1.019 4.010 -4.683 1.00 0.00 H new ATOM 2514 N GLU A 170 -0.365 8.507 -4.370 1.00 0.00 N ATOM 2515 CA GLU A 170 0.575 9.555 -4.750 1.00 0.00 C ATOM 2516 C GLU A 170 1.577 9.820 -3.630 1.00 0.00 C ATOM 2517 O GLU A 170 2.787 9.807 -3.850 1.00 0.00 O ATOM 2518 CB GLU A 170 -0.175 10.843 -5.094 1.00 0.00 C ATOM 2519 CG GLU A 170 0.738 12.035 -5.330 1.00 0.00 C ATOM 2520 CD GLU A 170 0.084 13.113 -6.171 1.00 0.00 C ATOM 2521 OE1 GLU A 170 0.025 12.949 -7.407 1.00 0.00 O ATOM 2522 OE2 GLU A 170 -0.370 14.123 -5.592 1.00 0.00 O ATOM 0 H GLU A 170 -1.341 8.718 -4.580 1.00 0.00 H new ATOM 0 HA GLU A 170 1.122 9.216 -5.630 1.00 0.00 H new ATOM 0 HB2 GLU A 170 -0.777 10.675 -5.987 1.00 0.00 H new ATOM 0 HB3 GLU A 170 -0.865 11.079 -4.284 1.00 0.00 H new ATOM 0 HG2 GLU A 170 1.033 12.458 -4.370 1.00 0.00 H new ATOM 0 HG3 GLU A 170 1.650 11.698 -5.823 1.00 0.00 H new ATOM 2529 N ALA A 171 1.062 10.061 -2.429 1.00 0.00 N ATOM 2530 CA ALA A 171 1.910 10.328 -1.274 1.00 0.00 C ATOM 2531 C ALA A 171 2.881 9.178 -1.028 1.00 0.00 C ATOM 2532 O ALA A 171 3.990 9.383 -0.534 1.00 0.00 O ATOM 2533 CB ALA A 171 1.057 10.574 -0.038 1.00 0.00 C ATOM 0 H ALA A 171 0.062 10.077 -2.231 1.00 0.00 H new ATOM 0 HA ALA A 171 2.494 11.224 -1.483 1.00 0.00 H new ATOM 0 HB1 ALA A 171 1.704 10.772 0.817 1.00 0.00 H new ATOM 0 HB2 ALA A 171 0.408 11.433 -0.209 1.00 0.00 H new ATOM 0 HB3 ALA A 171 0.447 9.693 0.165 1.00 0.00 H new ATOM 2539 N VAL A 172 2.458 7.967 -1.377 1.00 0.00 N ATOM 2540 CA VAL A 172 3.290 6.784 -1.194 1.00 0.00 C ATOM 2541 C VAL A 172 4.352 6.686 -2.284 1.00 0.00 C ATOM 2542 O VAL A 172 5.361 6.001 -2.121 1.00 0.00 O ATOM 2543 CB VAL A 172 2.445 5.497 -1.199 1.00 0.00 C ATOM 2544 CG1 VAL A 172 3.336 4.272 -1.054 1.00 0.00 C ATOM 2545 CG2 VAL A 172 1.401 5.541 -0.094 1.00 0.00 C ATOM 0 H VAL A 172 1.544 7.780 -1.788 1.00 0.00 H new ATOM 0 HA VAL A 172 3.777 6.886 -0.224 1.00 0.00 H new ATOM 0 HB VAL A 172 1.926 5.428 -2.155 1.00 0.00 H new ATOM 0 HG11 VAL A 172 2.721 3.372 -1.060 1.00 0.00 H new ATOM 0 HG12 VAL A 172 4.041 4.235 -1.884 1.00 0.00 H new ATOM 0 HG13 VAL A 172 3.885 4.331 -0.114 1.00 0.00 H new ATOM 0 HG21 VAL A 172 0.813 4.623 -0.112 1.00 0.00 H new ATOM 0 HG22 VAL A 172 1.897 5.635 0.872 1.00 0.00 H new ATOM 0 HG23 VAL A 172 0.743 6.397 -0.249 1.00 0.00 H new ATOM 2555 N GLN A 173 4.117 7.377 -3.395 1.00 0.00 N ATOM 2556 CA GLN A 173 5.054 7.367 -4.513 1.00 0.00 C ATOM 2557 C GLN A 173 6.434 7.842 -4.070 1.00 0.00 C ATOM 2558 O GLN A 173 7.422 7.121 -4.206 1.00 0.00 O ATOM 2559 CB GLN A 173 4.536 8.252 -5.647 1.00 0.00 C ATOM 2560 CG GLN A 173 3.130 7.898 -6.103 1.00 0.00 C ATOM 2561 CD GLN A 173 3.088 6.634 -6.938 1.00 0.00 C ATOM 2562 OE1 GLN A 173 3.116 6.688 -8.168 1.00 0.00 O ATOM 2563 NE2 GLN A 173 3.021 5.487 -6.274 1.00 0.00 N ATOM 0 H GLN A 173 3.287 7.950 -3.545 1.00 0.00 H new ATOM 0 HA GLN A 173 5.141 6.342 -4.873 1.00 0.00 H new ATOM 0 HB2 GLN A 173 4.552 9.292 -5.321 1.00 0.00 H new ATOM 0 HB3 GLN A 173 5.215 8.174 -6.496 1.00 0.00 H new ATOM 0 HG2 GLN A 173 2.490 7.773 -5.230 1.00 0.00 H new ATOM 0 HG3 GLN A 173 2.721 8.726 -6.683 1.00 0.00 H new ATOM 0 HE21 GLN A 173 3.000 5.489 -5.254 1.00 0.00 H new ATOM 0 HE22 GLN A 173 2.991 4.604 -6.783 1.00 0.00 H new ATOM 2572 N ALA A 174 6.494 9.059 -3.540 1.00 0.00 N ATOM 2573 CA ALA A 174 7.752 9.630 -3.076 1.00 0.00 C ATOM 2574 C ALA A 174 8.290 8.865 -1.872 1.00 0.00 C ATOM 2575 O ALA A 174 9.493 8.865 -1.611 1.00 0.00 O ATOM 2576 CB ALA A 174 7.570 11.100 -2.732 1.00 0.00 C ATOM 0 H ALA A 174 5.685 9.669 -3.421 1.00 0.00 H new ATOM 0 HA ALA A 174 8.480 9.545 -3.882 1.00 0.00 H new ATOM 0 HB1 ALA A 174 8.518 11.513 -2.387 1.00 0.00 H new ATOM 0 HB2 ALA A 174 7.239 11.643 -3.617 1.00 0.00 H new ATOM 0 HB3 ALA A 174 6.823 11.200 -1.945 1.00 0.00 H new ATOM 2582 N ALA A 175 7.392 8.215 -1.140 1.00 0.00 N ATOM 2583 CA ALA A 175 7.777 7.445 0.037 1.00 0.00 C ATOM 2584 C ALA A 175 8.885 6.451 -0.296 1.00 0.00 C ATOM 2585 O ALA A 175 9.784 6.217 0.512 1.00 0.00 O ATOM 2586 CB ALA A 175 6.569 6.719 0.611 1.00 0.00 C ATOM 0 H ALA A 175 6.392 8.206 -1.341 1.00 0.00 H new ATOM 0 HA ALA A 175 8.160 8.139 0.786 1.00 0.00 H new ATOM 0 HB1 ALA A 175 6.871 6.148 1.489 1.00 0.00 H new ATOM 0 HB2 ALA A 175 5.808 7.446 0.895 1.00 0.00 H new ATOM 0 HB3 ALA A 175 6.161 6.042 -0.139 1.00 0.00 H new ATOM 2592 N CYS A 176 8.813 5.870 -1.488 1.00 0.00 N ATOM 2593 CA CYS A 176 9.810 4.900 -1.927 1.00 0.00 C ATOM 2594 C CYS A 176 11.218 5.371 -1.577 1.00 0.00 C ATOM 2595 O CYS A 176 11.691 6.381 -2.096 1.00 0.00 O ATOM 2596 CB CYS A 176 9.696 4.667 -3.434 1.00 0.00 C ATOM 2597 SG CYS A 176 8.197 3.789 -3.935 1.00 0.00 S ATOM 0 H CYS A 176 8.075 6.053 -2.168 1.00 0.00 H new ATOM 0 HA CYS A 176 9.621 3.961 -1.407 1.00 0.00 H new ATOM 0 HB2 CYS A 176 9.727 5.630 -3.943 1.00 0.00 H new ATOM 0 HB3 CYS A 176 10.565 4.101 -3.770 1.00 0.00 H new ATOM 0 HG CYS A 176 7.905 4.095 -5.164 1.00 0.00 H new