USER MOD reduce.3.24.130724 H: found=0, std=0, add=972, rem=0, adj=30 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 68 TYR OH : rot 35:sc= 0.956 USER MOD Set 1.2: A 157 HIS : no HD1:sc= -0.825 K(o=0.13,f=-7.5!) USER MOD Set 2.1: A 134 MET CE :methyl 165:sc= -3.67! (180deg=-4.1!) USER MOD Set 2.2: A 176 CYS SG : rot -100:sc= -1.08 USER MOD Set 3.1: A 126 CYS SG : rot 134:sc= 0.0676 USER MOD Set 3.2: A 147 MET CE :methyl 162:sc= -0.132 (180deg=0) USER MOD Set 4.1: A 93 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 94 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 85 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 89 ASN : amide:sc= -2.32! K(o=-2.3!,f=-1.8) USER MOD Set 6.1: A 21 MET CE :methyl -161:sc= -0.0213 (180deg=-0.292) USER MOD Set 6.2: A 173 GLN : amide:sc= -1.28 X(o=-1.3,f=-0.85) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ -122:sc= -1 (180deg=-3.2!) USER MOD Single : A 22 GLN : amide:sc= 0.571 K(o=0.57,f=-0.82) USER MOD Single : A 23 GLN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 24 ASN : amide:sc= -0.845 K(o=-0.85,f=-2.3!) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 ASN : amide:sc= -2.75! C(o=-2.8!,f=-9.5!) 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+ -173:sc= 0 (180deg=-0.0241) USER MOD Single : A 67 GLN : amide:sc= -0.1 X(o=-0.1,f=-0.0036) USER MOD Single : A 71 MET CE :methyl -154:sc= -0.394 (180deg=-1.32) USER MOD Single : A 80 MET CE :methyl 159:sc= -0.63 (180deg=-1.68!) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 1:sc= 1.09 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= -0.286 X(o=-0.29,f=0) USER MOD Single : A 104 MET CE :methyl -129:sc= -0.246 (180deg=-3.17!) USER MOD Single : A 105 ASN : amide:sc= -1.76 K(o=-1.8,f=-5.1!) USER MOD Single : A 110 THR OG1 : rot 59:sc= 0.262 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot -3:sc= -0.0712 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 SER OG : rot -45:sc= -0.391 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 HIS : no HD1:sc= -0.183 X(o=-0.18,f=-0.35) USER MOD Single : A 142 THR OG1 : rot -72:sc= 1.06 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= -0.136 X(o=-0.14,f=-0.017) USER MOD Single : A 156 CYS SG : rot 180:sc= -2.63 USER MOD Single : A 161 CYS SG : rot 180:sc= -0.0328 USER MOD Single : A 164 ASN : amide:sc= -0.731 K(o=-0.73,f=-2.7!) USER MOD Single : A 167 ASN : amide:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 169 SER OG : rot -100:sc= 1.05 USER MOD ----------------------------------------------------------------- ATOM 213 N LEU A 18 -3.683 8.212 -11.598 1.00 0.00 N ATOM 214 CA LEU A 18 -4.148 6.875 -11.247 1.00 0.00 C ATOM 215 C LEU A 18 -4.147 5.960 -12.467 1.00 0.00 C ATOM 216 O LEU A 18 -3.845 4.771 -12.364 1.00 0.00 O ATOM 217 CB LEU A 18 -5.554 6.944 -10.648 1.00 0.00 C ATOM 218 CG LEU A 18 -5.648 7.469 -9.215 1.00 0.00 C ATOM 219 CD1 LEU A 18 -7.091 7.793 -8.859 1.00 0.00 C ATOM 220 CD2 LEU A 18 -5.070 6.456 -8.237 1.00 0.00 C ATOM 0 HA LEU A 18 -3.464 6.462 -10.506 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -6.169 7.578 -11.287 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -5.989 5.945 -10.677 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.063 8.386 -9.145 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.139 8.165 -7.836 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -7.472 8.554 -9.540 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -7.698 6.892 -8.946 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -5.145 6.846 -7.222 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -5.627 5.522 -8.309 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.023 6.273 -8.479 1.00 0.00 H new ATOM 232 N SER A 19 -4.485 6.523 -13.623 1.00 0.00 N ATOM 233 CA SER A 19 -4.525 5.758 -14.863 1.00 0.00 C ATOM 234 C SER A 19 -3.288 4.874 -14.996 1.00 0.00 C ATOM 235 O SER A 19 -3.392 3.651 -15.099 1.00 0.00 O ATOM 236 CB SER A 19 -4.624 6.699 -16.065 1.00 0.00 C ATOM 237 OG SER A 19 -5.752 7.549 -15.956 1.00 0.00 O ATOM 0 H SER A 19 -4.735 7.506 -13.726 1.00 0.00 H new ATOM 0 HA SER A 19 -5.407 5.118 -14.838 1.00 0.00 H new ATOM 0 HB2 SER A 19 -3.717 7.300 -16.136 1.00 0.00 H new ATOM 0 HB3 SER A 19 -4.692 6.115 -16.983 1.00 0.00 H new ATOM 0 HG SER A 19 -5.792 8.142 -16.736 1.00 0.00 H new ATOM 243 N LYS A 20 -2.117 5.501 -14.993 1.00 0.00 N ATOM 244 CA LYS A 20 -0.859 4.774 -15.112 1.00 0.00 C ATOM 245 C LYS A 20 -0.756 3.687 -14.047 1.00 0.00 C ATOM 246 O LYS A 20 -0.303 2.576 -14.323 1.00 0.00 O ATOM 247 CB LYS A 20 0.324 5.737 -14.987 1.00 0.00 C ATOM 248 CG LYS A 20 0.788 5.949 -13.556 1.00 0.00 C ATOM 249 CD LYS A 20 1.847 7.036 -13.469 1.00 0.00 C ATOM 250 CE LYS A 20 1.253 8.414 -13.717 1.00 0.00 C ATOM 251 NZ LYS A 20 1.215 8.749 -15.167 1.00 0.00 N ATOM 0 H LYS A 20 -2.013 6.512 -14.909 1.00 0.00 H new ATOM 0 HA LYS A 20 -0.833 4.301 -16.094 1.00 0.00 H new ATOM 0 HB2 LYS A 20 1.157 5.354 -15.577 1.00 0.00 H new ATOM 0 HB3 LYS A 20 0.045 6.699 -15.416 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -0.064 6.219 -12.932 1.00 0.00 H new ATOM 0 HG3 LYS A 20 1.189 5.016 -13.161 1.00 0.00 H new ATOM 0 HD2 LYS A 20 2.315 7.012 -12.485 1.00 0.00 H new ATOM 0 HD3 LYS A 20 2.632 6.840 -14.200 1.00 0.00 H new ATOM 0 HE2 LYS A 20 0.243 8.453 -13.309 1.00 0.00 H new ATOM 0 HE3 LYS A 20 1.840 9.163 -13.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 1.751 9.624 -15.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 1.639 7.973 -15.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 0.228 8.884 -15.466 1.00 0.00 H new ATOM 265 N MET A 21 -1.182 4.013 -12.831 1.00 0.00 N ATOM 266 CA MET A 21 -1.140 3.062 -11.726 1.00 0.00 C ATOM 267 C MET A 21 -1.989 1.833 -12.035 1.00 0.00 C ATOM 268 O MET A 21 -1.598 0.706 -11.730 1.00 0.00 O ATOM 269 CB MET A 21 -1.630 3.724 -10.437 1.00 0.00 C ATOM 270 CG MET A 21 -0.830 4.955 -10.044 1.00 0.00 C ATOM 271 SD MET A 21 0.945 4.643 -9.990 1.00 0.00 S ATOM 272 CE MET A 21 1.151 4.153 -8.279 1.00 0.00 C ATOM 0 H MET A 21 -1.560 4.928 -12.586 1.00 0.00 H new ATOM 0 HA MET A 21 -0.106 2.743 -11.592 1.00 0.00 H new ATOM 0 HB2 MET A 21 -2.677 4.004 -10.557 1.00 0.00 H new ATOM 0 HB3 MET A 21 -1.586 2.998 -9.626 1.00 0.00 H new ATOM 0 HG2 MET A 21 -1.032 5.757 -10.754 1.00 0.00 H new ATOM 0 HG3 MET A 21 -1.163 5.303 -9.066 1.00 0.00 H new ATOM 0 HE1 MET A 21 2.199 4.253 -7.996 1.00 0.00 H new ATOM 0 HE2 MET A 21 0.540 4.792 -7.641 1.00 0.00 H new ATOM 0 HE3 MET A 21 0.839 3.116 -8.158 1.00 0.00 H new ATOM 282 N GLN A 22 -3.150 2.058 -12.640 1.00 0.00 N ATOM 283 CA GLN A 22 -4.054 0.968 -12.988 1.00 0.00 C ATOM 284 C GLN A 22 -3.584 0.254 -14.251 1.00 0.00 C ATOM 285 O GLN A 22 -3.944 -0.898 -14.494 1.00 0.00 O ATOM 286 CB GLN A 22 -5.475 1.498 -13.186 1.00 0.00 C ATOM 287 CG GLN A 22 -6.043 2.189 -11.958 1.00 0.00 C ATOM 288 CD GLN A 22 -7.270 3.022 -12.272 1.00 0.00 C ATOM 289 OE1 GLN A 22 -7.264 3.833 -13.198 1.00 0.00 O ATOM 290 NE2 GLN A 22 -8.333 2.826 -11.500 1.00 0.00 N ATOM 0 H GLN A 22 -3.487 2.985 -12.900 1.00 0.00 H new ATOM 0 HA GLN A 22 -4.053 0.252 -12.166 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -5.480 2.198 -14.021 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -6.128 0.670 -13.461 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -6.300 1.439 -11.210 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -5.277 2.828 -11.519 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -8.295 2.143 -10.743 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -9.188 3.358 -11.664 1.00 0.00 H new ATOM 299 N GLN A 23 -2.779 0.945 -15.051 1.00 0.00 N ATOM 300 CA GLN A 23 -2.262 0.377 -16.290 1.00 0.00 C ATOM 301 C GLN A 23 -1.050 -0.508 -16.018 1.00 0.00 C ATOM 302 O GLN A 23 -1.112 -1.727 -16.174 1.00 0.00 O ATOM 303 CB GLN A 23 -1.885 1.490 -17.269 1.00 0.00 C ATOM 304 CG GLN A 23 -3.086 2.193 -17.882 1.00 0.00 C ATOM 305 CD GLN A 23 -2.689 3.285 -18.856 1.00 0.00 C ATOM 306 OE1 GLN A 23 -1.540 3.354 -19.294 1.00 0.00 O ATOM 307 NE2 GLN A 23 -3.639 4.146 -19.200 1.00 0.00 N ATOM 0 H GLN A 23 -2.471 1.899 -14.863 1.00 0.00 H new ATOM 0 HA GLN A 23 -3.046 -0.237 -16.733 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -1.269 2.225 -16.751 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -1.274 1.069 -18.068 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -3.707 1.460 -18.397 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -3.695 2.624 -17.087 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -4.578 4.051 -18.813 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -3.430 4.902 -19.852 1.00 0.00 H new ATOM 316 N ASN A 24 0.052 0.114 -15.610 1.00 0.00 N ATOM 317 CA ASN A 24 1.279 -0.618 -15.317 1.00 0.00 C ATOM 318 C ASN A 24 1.489 -0.747 -13.812 1.00 0.00 C ATOM 319 O ASN A 24 1.445 -1.846 -13.261 1.00 0.00 O ATOM 320 CB ASN A 24 2.480 0.085 -15.952 1.00 0.00 C ATOM 321 CG ASN A 24 2.352 1.596 -15.916 1.00 0.00 C ATOM 322 OD1 ASN A 24 2.889 2.255 -15.026 1.00 0.00 O ATOM 323 ND2 ASN A 24 1.636 2.152 -16.887 1.00 0.00 N ATOM 0 H ASN A 24 0.120 1.123 -15.475 1.00 0.00 H new ATOM 0 HA ASN A 24 1.186 -1.618 -15.740 1.00 0.00 H new ATOM 0 HB2 ASN A 24 3.389 -0.212 -15.430 1.00 0.00 H new ATOM 0 HB3 ASN A 24 2.585 -0.243 -16.986 1.00 0.00 H new ATOM 0 HD21 ASN A 24 1.514 3.164 -16.915 1.00 0.00 H new ATOM 0 HD22 ASN A 24 1.209 1.567 -17.605 1.00 0.00 H new ATOM 330 N GLY A 25 1.716 0.384 -13.152 1.00 0.00 N ATOM 331 CA GLY A 25 1.929 0.376 -11.716 1.00 0.00 C ATOM 332 C GLY A 25 3.238 1.029 -11.320 1.00 0.00 C ATOM 333 O GLY A 25 3.871 1.708 -12.130 1.00 0.00 O ATOM 0 H GLY A 25 1.756 1.306 -13.586 1.00 0.00 H new ATOM 0 HA2 GLY A 25 1.105 0.895 -11.227 1.00 0.00 H new ATOM 0 HA3 GLY A 25 1.916 -0.653 -11.356 1.00 0.00 H new ATOM 337 N TYR A 26 3.644 0.827 -10.072 1.00 0.00 N ATOM 338 CA TYR A 26 4.885 1.405 -9.569 1.00 0.00 C ATOM 339 C TYR A 26 5.715 0.357 -8.833 1.00 0.00 C ATOM 340 O TYR A 26 5.329 -0.119 -7.766 1.00 0.00 O ATOM 341 CB TYR A 26 4.583 2.579 -8.636 1.00 0.00 C ATOM 342 CG TYR A 26 5.822 3.266 -8.107 1.00 0.00 C ATOM 343 CD1 TYR A 26 6.701 2.601 -7.261 1.00 0.00 C ATOM 344 CD2 TYR A 26 6.114 4.579 -8.454 1.00 0.00 C ATOM 345 CE1 TYR A 26 7.834 3.225 -6.775 1.00 0.00 C ATOM 346 CE2 TYR A 26 7.245 5.210 -7.973 1.00 0.00 C ATOM 347 CZ TYR A 26 8.101 4.529 -7.134 1.00 0.00 C ATOM 348 OH TYR A 26 9.229 5.154 -6.652 1.00 0.00 O ATOM 0 H TYR A 26 3.132 0.268 -9.390 1.00 0.00 H new ATOM 0 HA TYR A 26 5.461 1.765 -10.422 1.00 0.00 H new ATOM 0 HB2 TYR A 26 3.973 3.308 -9.169 1.00 0.00 H new ATOM 0 HB3 TYR A 26 3.989 2.221 -7.795 1.00 0.00 H new ATOM 0 HD1 TYR A 26 6.495 1.579 -6.979 1.00 0.00 H new ATOM 0 HD2 TYR A 26 5.446 5.116 -9.111 1.00 0.00 H new ATOM 0 HE1 TYR A 26 8.507 2.694 -6.118 1.00 0.00 H new ATOM 0 HE2 TYR A 26 7.457 6.231 -8.253 1.00 0.00 H new ATOM 0 HH TYR A 26 9.270 6.069 -7.001 1.00 0.00 H new ATOM 358 N GLU A 27 6.858 0.003 -9.413 1.00 0.00 N ATOM 359 CA GLU A 27 7.743 -0.988 -8.814 1.00 0.00 C ATOM 360 C GLU A 27 8.848 -0.313 -8.006 1.00 0.00 C ATOM 361 O GLU A 27 9.625 0.479 -8.538 1.00 0.00 O ATOM 362 CB GLU A 27 8.358 -1.876 -9.897 1.00 0.00 C ATOM 363 CG GLU A 27 7.480 -3.051 -10.292 1.00 0.00 C ATOM 364 CD GLU A 27 8.221 -4.081 -11.122 1.00 0.00 C ATOM 365 OE1 GLU A 27 9.437 -4.259 -10.898 1.00 0.00 O ATOM 366 OE2 GLU A 27 7.586 -4.708 -11.996 1.00 0.00 O ATOM 0 H GLU A 27 7.192 0.388 -10.297 1.00 0.00 H new ATOM 0 HA GLU A 27 7.150 -1.607 -8.140 1.00 0.00 H new ATOM 0 HB2 GLU A 27 8.559 -1.270 -10.781 1.00 0.00 H new ATOM 0 HB3 GLU A 27 9.318 -2.253 -9.544 1.00 0.00 H new ATOM 0 HG2 GLU A 27 7.091 -3.527 -9.392 1.00 0.00 H new ATOM 0 HG3 GLU A 27 6.622 -2.685 -10.856 1.00 0.00 H new ATOM 373 N ASN A 28 8.911 -0.632 -6.717 1.00 0.00 N ATOM 374 CA ASN A 28 9.919 -0.056 -5.835 1.00 0.00 C ATOM 375 C ASN A 28 11.325 -0.410 -6.312 1.00 0.00 C ATOM 376 O ASN A 28 11.686 -1.580 -6.444 1.00 0.00 O ATOM 377 CB ASN A 28 9.715 -0.550 -4.402 1.00 0.00 C ATOM 378 CG ASN A 28 10.533 0.238 -3.397 1.00 0.00 C ATOM 379 OD1 ASN A 28 11.557 0.828 -3.740 1.00 0.00 O ATOM 380 ND2 ASN A 28 10.083 0.250 -2.147 1.00 0.00 N ATOM 0 H ASN A 28 8.276 -1.286 -6.260 1.00 0.00 H new ATOM 0 HA ASN A 28 9.809 1.028 -5.857 1.00 0.00 H new ATOM 0 HB2 ASN A 28 8.659 -0.478 -4.143 1.00 0.00 H new ATOM 0 HB3 ASN A 28 9.987 -1.604 -4.342 1.00 0.00 H new ATOM 0 HD21 ASN A 28 10.592 0.763 -1.427 1.00 0.00 H new ATOM 0 HD22 ASN A 28 9.229 -0.254 -1.908 1.00 0.00 H new ATOM 387 N PRO A 29 12.138 0.624 -6.575 1.00 0.00 N ATOM 388 CA PRO A 29 13.517 0.447 -7.039 1.00 0.00 C ATOM 389 C PRO A 29 14.426 -0.118 -5.954 1.00 0.00 C ATOM 390 O PRO A 29 15.137 -1.100 -6.173 1.00 0.00 O ATOM 391 CB PRO A 29 13.950 1.867 -7.413 1.00 0.00 C ATOM 392 CG PRO A 29 13.091 2.756 -6.582 1.00 0.00 C ATOM 393 CD PRO A 29 11.774 2.044 -6.439 1.00 0.00 C ATOM 0 HA PRO A 29 13.582 -0.264 -7.862 1.00 0.00 H new ATOM 0 HB2 PRO A 29 15.007 2.027 -7.201 1.00 0.00 H new ATOM 0 HB3 PRO A 29 13.805 2.058 -8.476 1.00 0.00 H new ATOM 0 HG2 PRO A 29 13.545 2.937 -5.608 1.00 0.00 H new ATOM 0 HG3 PRO A 29 12.960 3.728 -7.058 1.00 0.00 H new ATOM 0 HD2 PRO A 29 11.309 2.249 -5.475 1.00 0.00 H new ATOM 0 HD3 PRO A 29 11.065 2.352 -7.207 1.00 0.00 H new ATOM 401 N THR A 30 14.400 0.507 -4.781 1.00 0.00 N ATOM 402 CA THR A 30 15.222 0.066 -3.661 1.00 0.00 C ATOM 403 C THR A 30 15.159 -1.448 -3.495 1.00 0.00 C ATOM 404 O THR A 30 16.168 -2.093 -3.205 1.00 0.00 O ATOM 405 CB THR A 30 14.783 0.734 -2.344 1.00 0.00 C ATOM 406 OG1 THR A 30 14.709 2.154 -2.516 1.00 0.00 O ATOM 407 CG2 THR A 30 15.753 0.404 -1.220 1.00 0.00 C ATOM 0 H THR A 30 13.818 1.321 -4.582 1.00 0.00 H new ATOM 0 HA THR A 30 16.247 0.362 -3.886 1.00 0.00 H new ATOM 0 HB THR A 30 13.799 0.349 -2.077 1.00 0.00 H new ATOM 0 HG1 THR A 30 14.428 2.571 -1.675 1.00 0.00 H new ATOM 0 HG21 THR A 30 15.422 0.887 -0.300 1.00 0.00 H new ATOM 0 HG22 THR A 30 15.785 -0.675 -1.072 1.00 0.00 H new ATOM 0 HG23 THR A 30 16.748 0.764 -1.481 1.00 0.00 H new ATOM 824 N VAL A 61 4.221 15.004 8.990 1.00 0.00 N ATOM 825 CA VAL A 61 3.461 13.766 8.863 1.00 0.00 C ATOM 826 C VAL A 61 2.089 14.024 8.252 1.00 0.00 C ATOM 827 O VAL A 61 1.460 15.046 8.526 1.00 0.00 O ATOM 828 CB VAL A 61 3.282 13.074 10.228 1.00 0.00 C ATOM 829 CG1 VAL A 61 2.812 14.072 11.275 1.00 0.00 C ATOM 830 CG2 VAL A 61 2.308 11.912 10.112 1.00 0.00 C ATOM 0 HA VAL A 61 4.031 13.111 8.204 1.00 0.00 H new ATOM 0 HB VAL A 61 4.247 12.679 10.545 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.691 13.565 12.232 1.00 0.00 H new ATOM 0 HG12 VAL A 61 3.550 14.868 11.376 1.00 0.00 H new ATOM 0 HG13 VAL A 61 1.858 14.499 10.968 1.00 0.00 H new ATOM 0 HG21 VAL A 61 2.193 11.435 11.085 1.00 0.00 H new ATOM 0 HG22 VAL A 61 1.340 12.281 9.773 1.00 0.00 H new ATOM 0 HG23 VAL A 61 2.691 11.186 9.395 1.00 0.00 H new ATOM 840 N GLN A 62 1.630 13.090 7.425 1.00 0.00 N ATOM 841 CA GLN A 62 0.331 13.218 6.775 1.00 0.00 C ATOM 842 C GLN A 62 -0.604 12.091 7.202 1.00 0.00 C ATOM 843 O GLN A 62 -0.206 10.927 7.260 1.00 0.00 O ATOM 844 CB GLN A 62 0.495 13.211 5.254 1.00 0.00 C ATOM 845 CG GLN A 62 1.118 14.484 4.704 1.00 0.00 C ATOM 846 CD GLN A 62 1.317 14.435 3.202 1.00 0.00 C ATOM 847 OE1 GLN A 62 0.653 15.151 2.452 1.00 0.00 O ATOM 848 NE2 GLN A 62 2.236 13.587 2.755 1.00 0.00 N ATOM 0 H GLN A 62 2.138 12.237 7.189 1.00 0.00 H new ATOM 0 HA GLN A 62 -0.109 14.167 7.082 1.00 0.00 H new ATOM 0 HB2 GLN A 62 1.113 12.360 4.967 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -0.481 13.065 4.792 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.482 15.333 4.955 1.00 0.00 H new ATOM 0 HG3 GLN A 62 2.080 14.652 5.189 1.00 0.00 H new ATOM 0 HE21 GLN A 62 2.763 13.013 3.413 1.00 0.00 H new ATOM 0 HE22 GLN A 62 2.415 13.510 1.754 1.00 0.00 H new ATOM 857 N LYS A 63 -1.850 12.444 7.501 1.00 0.00 N ATOM 858 CA LYS A 63 -2.843 11.463 7.923 1.00 0.00 C ATOM 859 C LYS A 63 -3.963 11.346 6.893 1.00 0.00 C ATOM 860 O LYS A 63 -4.583 12.342 6.520 1.00 0.00 O ATOM 861 CB LYS A 63 -3.425 11.849 9.284 1.00 0.00 C ATOM 862 CG LYS A 63 -2.536 11.470 10.456 1.00 0.00 C ATOM 863 CD LYS A 63 -1.547 12.576 10.786 1.00 0.00 C ATOM 864 CE LYS A 63 -0.764 12.264 12.051 1.00 0.00 C ATOM 865 NZ LYS A 63 -1.594 12.440 13.275 1.00 0.00 N ATOM 0 H LYS A 63 -2.196 13.403 7.459 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.349 10.495 8.008 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -3.598 12.925 9.304 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -4.395 11.367 9.404 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -3.153 11.260 11.329 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -1.994 10.554 10.221 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -0.857 12.709 9.953 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -2.081 13.518 10.910 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -0.395 11.239 12.006 1.00 0.00 H new ATOM 0 HE3 LYS A 63 0.109 12.914 12.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -0.995 12.334 14.119 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -2.022 13.388 13.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -2.345 11.721 13.291 1.00 0.00 H new ATOM 879 N PHE A 64 -4.217 10.123 6.439 1.00 0.00 N ATOM 880 CA PHE A 64 -5.263 9.876 5.453 1.00 0.00 C ATOM 881 C PHE A 64 -6.343 8.962 6.024 1.00 0.00 C ATOM 882 O PHE A 64 -6.046 7.903 6.577 1.00 0.00 O ATOM 883 CB PHE A 64 -4.666 9.253 4.190 1.00 0.00 C ATOM 884 CG PHE A 64 -3.611 10.103 3.543 1.00 0.00 C ATOM 885 CD1 PHE A 64 -2.340 10.189 4.089 1.00 0.00 C ATOM 886 CD2 PHE A 64 -3.890 10.818 2.389 1.00 0.00 C ATOM 887 CE1 PHE A 64 -1.367 10.971 3.496 1.00 0.00 C ATOM 888 CE2 PHE A 64 -2.920 11.601 1.791 1.00 0.00 C ATOM 889 CZ PHE A 64 -1.658 11.678 2.346 1.00 0.00 C ATOM 0 H PHE A 64 -3.713 9.288 6.738 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.719 10.832 5.196 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.236 8.283 4.441 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -5.465 9.071 3.472 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -2.107 9.638 4.988 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -4.876 10.763 1.952 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.380 11.029 3.931 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -3.149 12.152 0.891 1.00 0.00 H new ATOM 0 HZ PHE A 64 -0.899 12.290 1.881 1.00 0.00 H new ATOM 899 N ARG A 65 -7.597 9.379 5.885 1.00 0.00 N ATOM 900 CA ARG A 65 -8.722 8.600 6.388 1.00 0.00 C ATOM 901 C ARG A 65 -9.131 7.526 5.383 1.00 0.00 C ATOM 902 O ARG A 65 -9.730 7.824 4.350 1.00 0.00 O ATOM 903 CB ARG A 65 -9.911 9.514 6.686 1.00 0.00 C ATOM 904 CG ARG A 65 -10.992 8.854 7.527 1.00 0.00 C ATOM 905 CD ARG A 65 -12.362 9.449 7.241 1.00 0.00 C ATOM 906 NE ARG A 65 -12.495 10.799 7.781 1.00 0.00 N ATOM 907 CZ ARG A 65 -12.646 11.062 9.074 1.00 0.00 C ATOM 908 NH1 ARG A 65 -12.680 10.072 9.955 1.00 0.00 N ATOM 909 NH2 ARG A 65 -12.761 12.318 9.488 1.00 0.00 N ATOM 0 H ARG A 65 -7.860 10.252 5.428 1.00 0.00 H new ATOM 0 HA ARG A 65 -8.409 8.111 7.311 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -9.553 10.404 7.203 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -10.348 9.846 5.744 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -11.010 7.783 7.324 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -10.756 8.974 8.584 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -12.530 9.471 6.164 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -13.132 8.809 7.671 1.00 0.00 H new ATOM 0 HE ARG A 65 -12.471 11.583 7.129 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -12.590 9.106 9.640 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -12.796 10.276 10.948 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -12.733 13.082 8.813 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -12.877 12.519 10.481 1.00 0.00 H new ATOM 923 N VAL A 66 -8.804 6.276 5.695 1.00 0.00 N ATOM 924 CA VAL A 66 -9.138 5.158 4.820 1.00 0.00 C ATOM 925 C VAL A 66 -9.734 4.000 5.612 1.00 0.00 C ATOM 926 O VAL A 66 -9.759 4.025 6.842 1.00 0.00 O ATOM 927 CB VAL A 66 -7.900 4.657 4.053 1.00 0.00 C ATOM 928 CG1 VAL A 66 -7.313 5.770 3.199 1.00 0.00 C ATOM 929 CG2 VAL A 66 -6.859 4.111 5.019 1.00 0.00 C ATOM 0 H VAL A 66 -8.308 6.012 6.547 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.876 5.524 4.106 1.00 0.00 H new ATOM 0 HB VAL A 66 -8.209 3.848 3.391 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -6.439 5.397 2.665 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -8.059 6.110 2.481 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -7.019 6.603 3.838 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.991 3.762 4.459 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -6.553 4.898 5.708 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -7.285 3.281 5.583 1.00 0.00 H new ATOM 939 N GLN A 67 -10.213 2.987 4.898 1.00 0.00 N ATOM 940 CA GLN A 67 -10.810 1.819 5.535 1.00 0.00 C ATOM 941 C GLN A 67 -9.937 0.584 5.336 1.00 0.00 C ATOM 942 O GLN A 67 -9.176 0.499 4.371 1.00 0.00 O ATOM 943 CB GLN A 67 -12.210 1.565 4.974 1.00 0.00 C ATOM 944 CG GLN A 67 -13.304 2.336 5.694 1.00 0.00 C ATOM 945 CD GLN A 67 -14.558 2.490 4.857 1.00 0.00 C ATOM 946 OE1 GLN A 67 -14.731 3.487 4.155 1.00 0.00 O ATOM 947 NE2 GLN A 67 -15.442 1.501 4.926 1.00 0.00 N ATOM 0 H GLN A 67 -10.200 2.951 3.879 1.00 0.00 H new ATOM 0 HA GLN A 67 -10.886 2.019 6.604 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -12.223 1.834 3.918 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -12.429 0.499 5.035 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -13.553 1.823 6.623 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -12.929 3.323 5.965 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -15.258 0.693 5.521 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -16.305 1.549 4.384 1.00 0.00 H new ATOM 956 N TYR A 68 -10.052 -0.370 6.253 1.00 0.00 N ATOM 957 CA TYR A 68 -9.272 -1.599 6.179 1.00 0.00 C ATOM 958 C TYR A 68 -10.108 -2.743 5.612 1.00 0.00 C ATOM 959 O TYR A 68 -11.242 -2.968 6.037 1.00 0.00 O ATOM 960 CB TYR A 68 -8.743 -1.977 7.564 1.00 0.00 C ATOM 961 CG TYR A 68 -7.440 -2.742 7.526 1.00 0.00 C ATOM 962 CD1 TYR A 68 -7.322 -3.917 6.793 1.00 0.00 C ATOM 963 CD2 TYR A 68 -6.326 -2.292 8.225 1.00 0.00 C ATOM 964 CE1 TYR A 68 -6.134 -4.620 6.757 1.00 0.00 C ATOM 965 CE2 TYR A 68 -5.134 -2.987 8.193 1.00 0.00 C ATOM 966 CZ TYR A 68 -5.042 -4.151 7.458 1.00 0.00 C ATOM 967 OH TYR A 68 -3.856 -4.848 7.424 1.00 0.00 O ATOM 0 H TYR A 68 -10.678 -0.316 7.056 1.00 0.00 H new ATOM 0 HA TYR A 68 -8.429 -1.424 5.511 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -8.605 -1.069 8.151 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -9.493 -2.578 8.078 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -8.174 -4.287 6.242 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -6.394 -1.382 8.803 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -6.060 -5.532 6.183 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -4.278 -2.622 8.740 1.00 0.00 H new ATOM 0 HH TYR A 68 -3.738 -5.250 6.538 1.00 0.00 H new ATOM 977 N LEU A 69 -9.541 -3.462 4.651 1.00 0.00 N ATOM 978 CA LEU A 69 -10.232 -4.584 4.025 1.00 0.00 C ATOM 979 C LEU A 69 -9.709 -5.913 4.559 1.00 0.00 C ATOM 980 O LEU A 69 -10.484 -6.813 4.879 1.00 0.00 O ATOM 981 CB LEU A 69 -10.062 -4.530 2.505 1.00 0.00 C ATOM 982 CG LEU A 69 -11.117 -3.731 1.740 1.00 0.00 C ATOM 983 CD1 LEU A 69 -10.746 -2.257 1.700 1.00 0.00 C ATOM 984 CD2 LEU A 69 -11.282 -4.279 0.330 1.00 0.00 C ATOM 0 H LEU A 69 -8.604 -3.288 4.288 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.292 -4.507 4.269 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -9.083 -4.106 2.284 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -10.061 -5.551 2.123 1.00 0.00 H new ATOM 0 HG LEU A 69 -12.069 -3.831 2.262 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.509 -1.705 1.151 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -10.679 -1.871 2.717 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -9.783 -2.137 1.203 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -12.037 -3.698 -0.200 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.332 -4.210 -0.201 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.595 -5.322 0.379 1.00 0.00 H new ATOM 996 N GLY A 70 -8.388 -6.028 4.656 1.00 0.00 N ATOM 997 CA GLY A 70 -7.784 -7.249 5.155 1.00 0.00 C ATOM 998 C GLY A 70 -6.574 -7.671 4.344 1.00 0.00 C ATOM 999 O GLY A 70 -6.272 -7.074 3.311 1.00 0.00 O ATOM 0 H GLY A 70 -7.725 -5.297 4.398 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -7.489 -7.106 6.195 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.524 -8.049 5.141 1.00 0.00 H new ATOM 1003 N MET A 71 -5.879 -8.701 4.814 1.00 0.00 N ATOM 1004 CA MET A 71 -4.694 -9.201 4.125 1.00 0.00 C ATOM 1005 C MET A 71 -5.047 -10.380 3.223 1.00 0.00 C ATOM 1006 O MET A 71 -5.894 -11.206 3.566 1.00 0.00 O ATOM 1007 CB MET A 71 -3.628 -9.621 5.139 1.00 0.00 C ATOM 1008 CG MET A 71 -2.224 -9.671 4.558 1.00 0.00 C ATOM 1009 SD MET A 71 -1.973 -11.085 3.467 1.00 0.00 S ATOM 1010 CE MET A 71 -2.230 -12.442 4.607 1.00 0.00 C ATOM 0 H MET A 71 -6.115 -9.206 5.668 1.00 0.00 H new ATOM 0 HA MET A 71 -4.298 -8.397 3.504 1.00 0.00 H new ATOM 0 HB2 MET A 71 -3.641 -8.925 5.977 1.00 0.00 H new ATOM 0 HB3 MET A 71 -3.883 -10.603 5.537 1.00 0.00 H new ATOM 0 HG2 MET A 71 -2.031 -8.752 4.005 1.00 0.00 H new ATOM 0 HG3 MET A 71 -1.500 -9.712 5.371 1.00 0.00 H new ATOM 0 HE1 MET A 71 -1.687 -13.319 4.257 1.00 0.00 H new ATOM 0 HE2 MET A 71 -1.866 -12.161 5.595 1.00 0.00 H new ATOM 0 HE3 MET A 71 -3.294 -12.673 4.664 1.00 0.00 H new ATOM 1020 N LEU A 72 -4.394 -10.451 2.069 1.00 0.00 N ATOM 1021 CA LEU A 72 -4.639 -11.529 1.117 1.00 0.00 C ATOM 1022 C LEU A 72 -3.327 -12.151 0.649 1.00 0.00 C ATOM 1023 O LEU A 72 -2.396 -11.460 0.234 1.00 0.00 O ATOM 1024 CB LEU A 72 -5.425 -11.005 -0.086 1.00 0.00 C ATOM 1025 CG LEU A 72 -6.389 -11.994 -0.741 1.00 0.00 C ATOM 1026 CD1 LEU A 72 -5.621 -13.107 -1.437 1.00 0.00 C ATOM 1027 CD2 LEU A 72 -7.346 -12.571 0.293 1.00 0.00 C ATOM 0 H LEU A 72 -3.691 -9.775 1.769 1.00 0.00 H new ATOM 0 HA LEU A 72 -5.226 -12.298 1.620 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -5.993 -10.130 0.230 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -4.714 -10.668 -0.840 1.00 0.00 H new ATOM 0 HG LEU A 72 -6.973 -11.460 -1.490 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -6.324 -13.801 -1.897 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -4.977 -12.679 -2.206 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.011 -13.639 -0.707 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -8.025 -13.273 -0.191 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -6.778 -13.090 1.065 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -7.921 -11.764 0.746 1.00 0.00 H new ATOM 1039 N PRO A 73 -3.249 -13.489 0.715 1.00 0.00 N ATOM 1040 CA PRO A 73 -2.057 -14.234 0.300 1.00 0.00 C ATOM 1041 C PRO A 73 -1.848 -14.198 -1.210 1.00 0.00 C ATOM 1042 O PRO A 73 -2.781 -14.419 -1.982 1.00 0.00 O ATOM 1043 CB PRO A 73 -2.351 -15.662 0.765 1.00 0.00 C ATOM 1044 CG PRO A 73 -3.838 -15.747 0.810 1.00 0.00 C ATOM 1045 CD PRO A 73 -4.319 -14.376 1.199 1.00 0.00 C ATOM 0 HA PRO A 73 -1.145 -13.813 0.723 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -1.933 -16.396 0.077 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -1.913 -15.858 1.744 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -4.242 -16.042 -0.159 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -4.165 -16.495 1.533 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -5.277 -14.140 0.736 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -4.456 -14.289 2.277 1.00 0.00 H new ATOM 1053 N VAL A 74 -0.616 -13.918 -1.626 1.00 0.00 N ATOM 1054 CA VAL A 74 -0.284 -13.855 -3.044 1.00 0.00 C ATOM 1055 C VAL A 74 0.865 -14.798 -3.382 1.00 0.00 C ATOM 1056 O VAL A 74 1.651 -15.173 -2.511 1.00 0.00 O ATOM 1057 CB VAL A 74 0.098 -12.425 -3.468 1.00 0.00 C ATOM 1058 CG1 VAL A 74 -1.009 -11.447 -3.107 1.00 0.00 C ATOM 1059 CG2 VAL A 74 1.415 -12.013 -2.827 1.00 0.00 C ATOM 0 H VAL A 74 0.168 -13.731 -1.001 1.00 0.00 H new ATOM 0 HA VAL A 74 -1.175 -14.162 -3.591 1.00 0.00 H new ATOM 0 HB VAL A 74 0.226 -12.408 -4.550 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -0.721 -10.442 -3.414 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.928 -11.733 -3.618 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.172 -11.464 -2.029 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.670 -11.000 -3.138 1.00 0.00 H new ATOM 0 HG22 VAL A 74 1.318 -12.046 -1.742 1.00 0.00 H new ATOM 0 HG23 VAL A 74 2.203 -12.698 -3.142 1.00 0.00 H new ATOM 1069 N ASP A 75 0.959 -15.177 -4.652 1.00 0.00 N ATOM 1070 CA ASP A 75 2.014 -16.076 -5.106 1.00 0.00 C ATOM 1071 C ASP A 75 3.233 -15.288 -5.575 1.00 0.00 C ATOM 1072 O ASP A 75 4.362 -15.774 -5.505 1.00 0.00 O ATOM 1073 CB ASP A 75 1.501 -16.968 -6.237 1.00 0.00 C ATOM 1074 CG ASP A 75 2.527 -17.995 -6.675 1.00 0.00 C ATOM 1075 OD1 ASP A 75 3.189 -18.583 -5.796 1.00 0.00 O ATOM 1076 OD2 ASP A 75 2.669 -18.208 -7.898 1.00 0.00 O ATOM 0 H ASP A 75 0.317 -14.876 -5.385 1.00 0.00 H new ATOM 0 HA ASP A 75 2.311 -16.704 -4.266 1.00 0.00 H new ATOM 0 HB2 ASP A 75 0.596 -17.480 -5.910 1.00 0.00 H new ATOM 0 HB3 ASP A 75 1.226 -16.347 -7.089 1.00 0.00 H new ATOM 1081 N ARG A 76 2.997 -14.072 -6.055 1.00 0.00 N ATOM 1082 CA ARG A 76 4.075 -13.218 -6.538 1.00 0.00 C ATOM 1083 C ARG A 76 4.061 -11.868 -5.827 1.00 0.00 C ATOM 1084 O ARG A 76 3.006 -11.311 -5.522 1.00 0.00 O ATOM 1085 CB ARG A 76 3.954 -13.012 -8.049 1.00 0.00 C ATOM 1086 CG ARG A 76 4.428 -14.202 -8.866 1.00 0.00 C ATOM 1087 CD ARG A 76 5.940 -14.351 -8.807 1.00 0.00 C ATOM 1088 NE ARG A 76 6.606 -13.609 -9.874 1.00 0.00 N ATOM 1089 CZ ARG A 76 6.537 -13.947 -11.157 1.00 0.00 C ATOM 1090 NH1 ARG A 76 5.836 -15.009 -11.530 1.00 0.00 N ATOM 1091 NH2 ARG A 76 7.170 -13.221 -12.070 1.00 0.00 N ATOM 0 H ARG A 76 2.068 -13.656 -6.120 1.00 0.00 H new ATOM 0 HA ARG A 76 5.021 -13.714 -6.320 1.00 0.00 H new ATOM 0 HB2 ARG A 76 2.913 -12.804 -8.296 1.00 0.00 H new ATOM 0 HB3 ARG A 76 4.532 -12.133 -8.335 1.00 0.00 H new ATOM 0 HG2 ARG A 76 3.957 -15.112 -8.493 1.00 0.00 H new ATOM 0 HG3 ARG A 76 4.113 -14.082 -9.903 1.00 0.00 H new ATOM 0 HD2 ARG A 76 6.301 -13.999 -7.841 1.00 0.00 H new ATOM 0 HD3 ARG A 76 6.203 -15.406 -8.881 1.00 0.00 H new ATOM 0 HE ARG A 76 7.154 -12.787 -9.621 1.00 0.00 H new ATOM 0 HH11 ARG A 76 5.348 -15.569 -10.831 1.00 0.00 H new ATOM 0 HH12 ARG A 76 5.785 -15.266 -12.516 1.00 0.00 H new ATOM 0 HH21 ARG A 76 7.710 -12.403 -11.787 1.00 0.00 H new ATOM 0 HH22 ARG A 76 7.117 -13.481 -13.055 1.00 0.00 H new ATOM 1105 N PRO A 77 5.258 -11.329 -5.555 1.00 0.00 N ATOM 1106 CA PRO A 77 5.410 -10.038 -4.877 1.00 0.00 C ATOM 1107 C PRO A 77 4.972 -8.868 -5.752 1.00 0.00 C ATOM 1108 O PRO A 77 4.559 -7.824 -5.248 1.00 0.00 O ATOM 1109 CB PRO A 77 6.912 -9.961 -4.593 1.00 0.00 C ATOM 1110 CG PRO A 77 7.539 -10.828 -5.629 1.00 0.00 C ATOM 1111 CD PRO A 77 6.557 -11.937 -5.890 1.00 0.00 C ATOM 0 HA PRO A 77 4.790 -9.972 -3.983 1.00 0.00 H new ATOM 0 HB2 PRO A 77 7.276 -8.936 -4.662 1.00 0.00 H new ATOM 0 HB3 PRO A 77 7.143 -10.314 -3.588 1.00 0.00 H new ATOM 0 HG2 PRO A 77 7.742 -10.264 -6.539 1.00 0.00 H new ATOM 0 HG3 PRO A 77 8.493 -11.225 -5.281 1.00 0.00 H new ATOM 0 HD2 PRO A 77 6.590 -12.267 -6.928 1.00 0.00 H new ATOM 0 HD3 PRO A 77 6.763 -12.810 -5.271 1.00 0.00 H new ATOM 1119 N VAL A 78 5.066 -9.051 -7.065 1.00 0.00 N ATOM 1120 CA VAL A 78 4.678 -8.011 -8.011 1.00 0.00 C ATOM 1121 C VAL A 78 3.749 -8.564 -9.086 1.00 0.00 C ATOM 1122 O VAL A 78 3.554 -9.774 -9.190 1.00 0.00 O ATOM 1123 CB VAL A 78 5.910 -7.380 -8.687 1.00 0.00 C ATOM 1124 CG1 VAL A 78 6.891 -6.871 -7.643 1.00 0.00 C ATOM 1125 CG2 VAL A 78 6.579 -8.382 -9.616 1.00 0.00 C ATOM 0 H VAL A 78 5.407 -9.909 -7.498 1.00 0.00 H new ATOM 0 HA VAL A 78 4.153 -7.245 -7.441 1.00 0.00 H new ATOM 0 HB VAL A 78 5.579 -6.530 -9.284 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.754 -6.429 -8.140 1.00 0.00 H new ATOM 0 HG12 VAL A 78 6.404 -6.118 -7.023 1.00 0.00 H new ATOM 0 HG13 VAL A 78 7.219 -7.701 -7.016 1.00 0.00 H new ATOM 0 HG21 VAL A 78 7.447 -7.920 -10.085 1.00 0.00 H new ATOM 0 HG22 VAL A 78 6.897 -9.253 -9.043 1.00 0.00 H new ATOM 0 HG23 VAL A 78 5.873 -8.692 -10.386 1.00 0.00 H new ATOM 1135 N GLY A 79 3.177 -7.668 -9.885 1.00 0.00 N ATOM 1136 CA GLY A 79 2.275 -8.085 -10.942 1.00 0.00 C ATOM 1137 C GLY A 79 0.875 -7.534 -10.761 1.00 0.00 C ATOM 1138 O GLY A 79 0.214 -7.816 -9.762 1.00 0.00 O ATOM 0 H GLY A 79 3.323 -6.661 -9.819 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.670 -7.756 -11.903 1.00 0.00 H new ATOM 0 HA3 GLY A 79 2.233 -9.174 -10.971 1.00 0.00 H new ATOM 1142 N MET A 80 0.422 -6.743 -11.729 1.00 0.00 N ATOM 1143 CA MET A 80 -0.909 -6.150 -11.670 1.00 0.00 C ATOM 1144 C MET A 80 -1.968 -7.217 -11.415 1.00 0.00 C ATOM 1145 O MET A 80 -2.647 -7.198 -10.388 1.00 0.00 O ATOM 1146 CB MET A 80 -1.218 -5.410 -12.973 1.00 0.00 C ATOM 1147 CG MET A 80 -0.779 -3.954 -12.963 1.00 0.00 C ATOM 1148 SD MET A 80 -2.072 -2.843 -12.375 1.00 0.00 S ATOM 1149 CE MET A 80 -1.779 -2.888 -10.609 1.00 0.00 C ATOM 0 H MET A 80 0.957 -6.498 -12.563 1.00 0.00 H new ATOM 0 HA MET A 80 -0.927 -5.440 -10.843 1.00 0.00 H new ATOM 0 HB2 MET A 80 -0.726 -5.924 -13.799 1.00 0.00 H new ATOM 0 HB3 MET A 80 -2.290 -5.457 -13.162 1.00 0.00 H new ATOM 0 HG2 MET A 80 0.101 -3.848 -12.329 1.00 0.00 H new ATOM 0 HG3 MET A 80 -0.484 -3.661 -13.970 1.00 0.00 H new ATOM 0 HE1 MET A 80 -2.219 -2.006 -10.145 1.00 0.00 H new ATOM 0 HE2 MET A 80 -2.233 -3.785 -10.188 1.00 0.00 H new ATOM 0 HE3 MET A 80 -0.706 -2.901 -10.418 1.00 0.00 H new ATOM 1159 N ASP A 81 -2.105 -8.146 -12.355 1.00 0.00 N ATOM 1160 CA ASP A 81 -3.082 -9.222 -12.231 1.00 0.00 C ATOM 1161 C ASP A 81 -3.104 -9.775 -10.810 1.00 0.00 C ATOM 1162 O ASP A 81 -4.169 -10.028 -10.246 1.00 0.00 O ATOM 1163 CB ASP A 81 -2.767 -10.342 -13.223 1.00 0.00 C ATOM 1164 CG ASP A 81 -2.568 -9.827 -14.635 1.00 0.00 C ATOM 1165 OD1 ASP A 81 -3.547 -9.329 -15.228 1.00 0.00 O ATOM 1166 OD2 ASP A 81 -1.432 -9.922 -15.147 1.00 0.00 O ATOM 0 H ASP A 81 -1.552 -8.176 -13.211 1.00 0.00 H new ATOM 0 HA ASP A 81 -4.067 -8.813 -12.457 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -1.867 -10.866 -12.901 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -3.579 -11.069 -13.216 1.00 0.00 H new ATOM 1171 N THR A 82 -1.920 -9.962 -10.235 1.00 0.00 N ATOM 1172 CA THR A 82 -1.802 -10.488 -8.881 1.00 0.00 C ATOM 1173 C THR A 82 -2.493 -9.574 -7.875 1.00 0.00 C ATOM 1174 O THR A 82 -3.248 -10.036 -7.017 1.00 0.00 O ATOM 1175 CB THR A 82 -0.327 -10.661 -8.471 1.00 0.00 C ATOM 1176 OG1 THR A 82 0.354 -11.479 -9.429 1.00 0.00 O ATOM 1177 CG2 THR A 82 -0.220 -11.292 -7.091 1.00 0.00 C ATOM 0 H THR A 82 -1.029 -9.757 -10.687 1.00 0.00 H new ATOM 0 HA THR A 82 -2.289 -11.463 -8.877 1.00 0.00 H new ATOM 0 HB THR A 82 0.137 -9.675 -8.439 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.291 -11.583 -9.163 1.00 0.00 H new ATOM 0 HG21 THR A 82 0.830 -11.404 -6.823 1.00 0.00 H new ATOM 0 HG22 THR A 82 -0.715 -10.653 -6.359 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.699 -12.271 -7.101 1.00 0.00 H new ATOM 1185 N LEU A 83 -2.232 -8.276 -7.984 1.00 0.00 N ATOM 1186 CA LEU A 83 -2.830 -7.297 -7.084 1.00 0.00 C ATOM 1187 C LEU A 83 -4.350 -7.302 -7.206 1.00 0.00 C ATOM 1188 O LEU A 83 -5.060 -7.526 -6.227 1.00 0.00 O ATOM 1189 CB LEU A 83 -2.287 -5.899 -7.387 1.00 0.00 C ATOM 1190 CG LEU A 83 -2.329 -4.898 -6.231 1.00 0.00 C ATOM 1191 CD1 LEU A 83 -1.045 -4.965 -5.420 1.00 0.00 C ATOM 1192 CD2 LEU A 83 -2.558 -3.488 -6.756 1.00 0.00 C ATOM 0 H LEU A 83 -1.610 -7.877 -8.687 1.00 0.00 H new ATOM 0 HA LEU A 83 -2.566 -7.570 -6.062 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -1.254 -5.997 -7.720 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -2.853 -5.484 -8.221 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.161 -5.161 -5.577 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -1.093 -4.246 -4.602 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -0.923 -5.969 -5.014 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -0.196 -4.728 -6.062 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -2.585 -2.789 -5.920 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -1.747 -3.215 -7.431 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -3.506 -3.449 -7.293 1.00 0.00 H new ATOM 1204 N ASN A 84 -4.842 -7.055 -8.416 1.00 0.00 N ATOM 1205 CA ASN A 84 -6.279 -7.033 -8.666 1.00 0.00 C ATOM 1206 C ASN A 84 -6.959 -8.246 -8.040 1.00 0.00 C ATOM 1207 O ASN A 84 -8.157 -8.222 -7.757 1.00 0.00 O ATOM 1208 CB ASN A 84 -6.555 -6.999 -10.171 1.00 0.00 C ATOM 1209 CG ASN A 84 -6.567 -5.587 -10.725 1.00 0.00 C ATOM 1210 OD1 ASN A 84 -7.616 -4.947 -10.801 1.00 0.00 O ATOM 1211 ND2 ASN A 84 -5.397 -5.095 -11.116 1.00 0.00 N ATOM 0 H ASN A 84 -4.268 -6.867 -9.238 1.00 0.00 H new ATOM 0 HA ASN A 84 -6.689 -6.133 -8.208 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -5.796 -7.584 -10.690 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -7.515 -7.474 -10.372 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -5.343 -4.151 -11.498 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -4.553 -5.661 -11.035 1.00 0.00 H new ATOM 1218 N SER A 85 -6.186 -9.306 -7.827 1.00 0.00 N ATOM 1219 CA SER A 85 -6.715 -10.531 -7.237 1.00 0.00 C ATOM 1220 C SER A 85 -7.075 -10.316 -5.770 1.00 0.00 C ATOM 1221 O SER A 85 -8.097 -10.807 -5.293 1.00 0.00 O ATOM 1222 CB SER A 85 -5.694 -11.664 -7.363 1.00 0.00 C ATOM 1223 OG SER A 85 -6.279 -12.915 -7.044 1.00 0.00 O ATOM 0 H SER A 85 -5.192 -9.342 -8.054 1.00 0.00 H new ATOM 0 HA SER A 85 -7.620 -10.805 -7.779 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.300 -11.692 -8.379 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.851 -11.473 -6.699 1.00 0.00 H new ATOM 0 HG SER A 85 -5.607 -13.623 -7.133 1.00 0.00 H new ATOM 1229 N ALA A 86 -6.227 -9.579 -5.061 1.00 0.00 N ATOM 1230 CA ALA A 86 -6.455 -9.297 -3.650 1.00 0.00 C ATOM 1231 C ALA A 86 -7.675 -8.402 -3.459 1.00 0.00 C ATOM 1232 O ALA A 86 -8.596 -8.742 -2.716 1.00 0.00 O ATOM 1233 CB ALA A 86 -5.223 -8.651 -3.034 1.00 0.00 C ATOM 0 H ALA A 86 -5.375 -9.166 -5.441 1.00 0.00 H new ATOM 0 HA ALA A 86 -6.647 -10.243 -3.143 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -5.408 -8.446 -1.980 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -4.372 -9.326 -3.128 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -5.004 -7.717 -3.552 1.00 0.00 H new ATOM 1239 N ILE A 87 -7.674 -7.257 -4.134 1.00 0.00 N ATOM 1240 CA ILE A 87 -8.781 -6.314 -4.039 1.00 0.00 C ATOM 1241 C ILE A 87 -10.123 -7.023 -4.192 1.00 0.00 C ATOM 1242 O ILE A 87 -10.973 -6.960 -3.305 1.00 0.00 O ATOM 1243 CB ILE A 87 -8.673 -5.209 -5.106 1.00 0.00 C ATOM 1244 CG1 ILE A 87 -7.430 -4.352 -4.861 1.00 0.00 C ATOM 1245 CG2 ILE A 87 -9.926 -4.346 -5.105 1.00 0.00 C ATOM 1246 CD1 ILE A 87 -6.980 -3.576 -6.079 1.00 0.00 C ATOM 0 H ILE A 87 -6.919 -6.960 -4.752 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.723 -5.860 -3.050 1.00 0.00 H new ATOM 0 HB ILE A 87 -8.580 -5.679 -6.085 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.635 -3.653 -4.050 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.615 -4.995 -4.529 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -9.834 -3.570 -5.865 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -10.795 -4.966 -5.324 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -10.048 -3.883 -4.126 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.094 -2.991 -5.831 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -6.743 -4.270 -6.885 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.778 -2.907 -6.399 1.00 0.00 H new ATOM 1258 N GLU A 88 -10.303 -7.700 -5.322 1.00 0.00 N ATOM 1259 CA GLU A 88 -11.541 -8.422 -5.590 1.00 0.00 C ATOM 1260 C GLU A 88 -11.806 -9.467 -4.509 1.00 0.00 C ATOM 1261 O GLU A 88 -12.934 -9.621 -4.044 1.00 0.00 O ATOM 1262 CB GLU A 88 -11.477 -9.096 -6.962 1.00 0.00 C ATOM 1263 CG GLU A 88 -11.431 -8.114 -8.121 1.00 0.00 C ATOM 1264 CD GLU A 88 -11.725 -8.773 -9.455 1.00 0.00 C ATOM 1265 OE1 GLU A 88 -10.777 -9.280 -10.089 1.00 0.00 O ATOM 1266 OE2 GLU A 88 -12.905 -8.780 -9.864 1.00 0.00 O ATOM 0 H GLU A 88 -9.608 -7.763 -6.066 1.00 0.00 H new ATOM 0 HA GLU A 88 -12.360 -7.703 -5.584 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -10.595 -9.735 -7.003 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -12.346 -9.744 -7.080 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -12.154 -7.317 -7.946 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -10.446 -7.648 -8.159 1.00 0.00 H new ATOM 1273 N ASN A 89 -10.757 -10.182 -4.116 1.00 0.00 N ATOM 1274 CA ASN A 89 -10.875 -11.213 -3.092 1.00 0.00 C ATOM 1275 C ASN A 89 -11.591 -10.674 -1.857 1.00 0.00 C ATOM 1276 O ASN A 89 -12.656 -11.164 -1.479 1.00 0.00 O ATOM 1277 CB ASN A 89 -9.491 -11.738 -2.704 1.00 0.00 C ATOM 1278 CG ASN A 89 -9.072 -12.933 -3.537 1.00 0.00 C ATOM 1279 OD1 ASN A 89 -9.843 -13.873 -3.727 1.00 0.00 O ATOM 1280 ND2 ASN A 89 -7.843 -12.902 -4.040 1.00 0.00 N ATOM 0 H ASN A 89 -9.816 -10.066 -4.491 1.00 0.00 H new ATOM 0 HA ASN A 89 -11.464 -12.032 -3.504 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -8.757 -10.941 -2.822 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -9.493 -12.016 -1.650 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -7.505 -13.678 -4.609 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -7.237 -12.102 -3.857 1.00 0.00 H new ATOM 1287 N LEU A 90 -11.000 -9.661 -1.233 1.00 0.00 N ATOM 1288 CA LEU A 90 -11.581 -9.053 -0.041 1.00 0.00 C ATOM 1289 C LEU A 90 -12.942 -8.438 -0.351 1.00 0.00 C ATOM 1290 O LEU A 90 -13.933 -8.730 0.318 1.00 0.00 O ATOM 1291 CB LEU A 90 -10.642 -7.984 0.520 1.00 0.00 C ATOM 1292 CG LEU A 90 -9.479 -8.492 1.373 1.00 0.00 C ATOM 1293 CD1 LEU A 90 -9.997 -9.272 2.571 1.00 0.00 C ATOM 1294 CD2 LEU A 90 -8.542 -9.353 0.538 1.00 0.00 C ATOM 0 H LEU A 90 -10.119 -9.243 -1.533 1.00 0.00 H new ATOM 0 HA LEU A 90 -11.718 -9.836 0.705 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -10.233 -7.415 -0.314 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -11.231 -7.291 1.120 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.919 -7.632 1.740 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -9.155 -9.626 3.166 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -10.627 -8.625 3.182 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -10.581 -10.125 2.225 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.720 -9.706 1.161 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -9.090 -10.208 0.141 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -8.144 -8.763 -0.287 1.00 0.00 H new ATOM 1306 N MET A 91 -12.983 -7.588 -1.372 1.00 0.00 N ATOM 1307 CA MET A 91 -14.224 -6.935 -1.773 1.00 0.00 C ATOM 1308 C MET A 91 -15.398 -7.905 -1.696 1.00 0.00 C ATOM 1309 O MET A 91 -16.495 -7.537 -1.275 1.00 0.00 O ATOM 1310 CB MET A 91 -14.097 -6.381 -3.193 1.00 0.00 C ATOM 1311 CG MET A 91 -13.374 -5.046 -3.262 1.00 0.00 C ATOM 1312 SD MET A 91 -13.580 -4.227 -4.856 1.00 0.00 S ATOM 1313 CE MET A 91 -15.191 -3.473 -4.644 1.00 0.00 C ATOM 0 H MET A 91 -12.172 -7.335 -1.936 1.00 0.00 H new ATOM 0 HA MET A 91 -14.411 -6.111 -1.085 1.00 0.00 H new ATOM 0 HB2 MET A 91 -13.565 -7.105 -3.810 1.00 0.00 H new ATOM 0 HB3 MET A 91 -15.093 -6.268 -3.621 1.00 0.00 H new ATOM 0 HG2 MET A 91 -13.747 -4.394 -2.472 1.00 0.00 H new ATOM 0 HG3 MET A 91 -12.312 -5.202 -3.072 1.00 0.00 H new ATOM 0 HE1 MET A 91 -15.460 -2.928 -5.549 1.00 0.00 H new ATOM 0 HE2 MET A 91 -15.933 -4.248 -4.453 1.00 0.00 H new ATOM 0 HE3 MET A 91 -15.162 -2.783 -3.800 1.00 0.00 H new ATOM 1323 N THR A 92 -15.161 -9.148 -2.104 1.00 0.00 N ATOM 1324 CA THR A 92 -16.200 -10.171 -2.082 1.00 0.00 C ATOM 1325 C THR A 92 -16.339 -10.783 -0.694 1.00 0.00 C ATOM 1326 O THR A 92 -17.428 -11.195 -0.293 1.00 0.00 O ATOM 1327 CB THR A 92 -15.906 -11.291 -3.098 1.00 0.00 C ATOM 1328 OG1 THR A 92 -14.582 -11.799 -2.898 1.00 0.00 O ATOM 1329 CG2 THR A 92 -16.049 -10.780 -4.524 1.00 0.00 C ATOM 0 H THR A 92 -14.259 -9.471 -2.454 1.00 0.00 H new ATOM 0 HA THR A 92 -17.134 -9.680 -2.354 1.00 0.00 H new ATOM 0 HB THR A 92 -16.629 -12.092 -2.942 1.00 0.00 H new ATOM 0 HG1 THR A 92 -14.163 -11.333 -2.145 1.00 0.00 H new ATOM 0 HG21 THR A 92 -15.837 -11.589 -5.223 1.00 0.00 H new ATOM 0 HG22 THR A 92 -17.066 -10.422 -4.682 1.00 0.00 H new ATOM 0 HG23 THR A 92 -15.347 -9.963 -4.690 1.00 0.00 H new ATOM 1337 N SER A 93 -15.230 -10.840 0.037 1.00 0.00 N ATOM 1338 CA SER A 93 -15.229 -11.406 1.381 1.00 0.00 C ATOM 1339 C SER A 93 -16.112 -10.585 2.317 1.00 0.00 C ATOM 1340 O SER A 93 -17.010 -11.120 2.968 1.00 0.00 O ATOM 1341 CB SER A 93 -13.802 -11.466 1.931 1.00 0.00 C ATOM 1342 OG SER A 93 -13.798 -11.833 3.299 1.00 0.00 O ATOM 0 H SER A 93 -14.321 -10.501 -0.279 1.00 0.00 H new ATOM 0 HA SER A 93 -15.632 -12.417 1.323 1.00 0.00 H new ATOM 0 HB2 SER A 93 -13.218 -12.185 1.357 1.00 0.00 H new ATOM 0 HB3 SER A 93 -13.321 -10.495 1.810 1.00 0.00 H new ATOM 0 HG SER A 93 -12.875 -11.866 3.626 1.00 0.00 H new ATOM 1348 N SER A 94 -15.850 -9.284 2.378 1.00 0.00 N ATOM 1349 CA SER A 94 -16.618 -8.389 3.236 1.00 0.00 C ATOM 1350 C SER A 94 -17.258 -7.270 2.420 1.00 0.00 C ATOM 1351 O SER A 94 -16.879 -7.028 1.274 1.00 0.00 O ATOM 1352 CB SER A 94 -15.719 -7.794 4.322 1.00 0.00 C ATOM 1353 OG SER A 94 -15.254 -8.799 5.207 1.00 0.00 O ATOM 0 H SER A 94 -15.112 -8.826 1.844 1.00 0.00 H new ATOM 0 HA SER A 94 -17.411 -8.969 3.708 1.00 0.00 H new ATOM 0 HB2 SER A 94 -14.870 -7.291 3.860 1.00 0.00 H new ATOM 0 HB3 SER A 94 -16.271 -7.039 4.882 1.00 0.00 H new ATOM 0 HG SER A 94 -14.681 -8.393 5.890 1.00 0.00 H new ATOM 1359 N SER A 95 -18.230 -6.591 3.020 1.00 0.00 N ATOM 1360 CA SER A 95 -18.927 -5.500 2.349 1.00 0.00 C ATOM 1361 C SER A 95 -18.120 -4.207 2.433 1.00 0.00 C ATOM 1362 O SER A 95 -17.075 -4.154 3.081 1.00 0.00 O ATOM 1363 CB SER A 95 -20.310 -5.292 2.968 1.00 0.00 C ATOM 1364 OG SER A 95 -21.228 -4.793 2.010 1.00 0.00 O ATOM 0 H SER A 95 -18.553 -6.777 3.970 1.00 0.00 H new ATOM 0 HA SER A 95 -19.044 -5.768 1.299 1.00 0.00 H new ATOM 0 HB2 SER A 95 -20.677 -6.236 3.371 1.00 0.00 H new ATOM 0 HB3 SER A 95 -20.237 -4.596 3.803 1.00 0.00 H new ATOM 0 HG SER A 95 -22.105 -4.670 2.430 1.00 0.00 H new ATOM 1370 N LYS A 96 -18.613 -3.166 1.771 1.00 0.00 N ATOM 1371 CA LYS A 96 -17.942 -1.871 1.770 1.00 0.00 C ATOM 1372 C LYS A 96 -18.026 -1.214 3.144 1.00 0.00 C ATOM 1373 O LYS A 96 -17.130 -0.469 3.541 1.00 0.00 O ATOM 1374 CB LYS A 96 -18.561 -0.953 0.715 1.00 0.00 C ATOM 1375 CG LYS A 96 -17.955 0.440 0.689 1.00 0.00 C ATOM 1376 CD LYS A 96 -18.333 1.189 -0.577 1.00 0.00 C ATOM 1377 CE LYS A 96 -17.718 2.580 -0.607 1.00 0.00 C ATOM 1378 NZ LYS A 96 -18.451 3.530 0.274 1.00 0.00 N ATOM 0 H LYS A 96 -19.476 -3.194 1.228 1.00 0.00 H new ATOM 0 HA LYS A 96 -16.892 -2.034 1.528 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -18.442 -1.410 -0.267 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -19.632 -0.871 0.900 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -18.294 1.001 1.560 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -16.870 0.367 0.759 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -18.001 0.624 -1.448 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -19.418 1.268 -0.644 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -16.676 2.523 -0.292 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -17.722 2.957 -1.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -18.001 4.466 0.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -19.439 3.604 -0.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -18.426 3.184 1.254 1.00 0.00 H new ATOM 1392 N GLU A 97 -19.107 -1.495 3.865 1.00 0.00 N ATOM 1393 CA GLU A 97 -19.306 -0.931 5.194 1.00 0.00 C ATOM 1394 C GLU A 97 -18.525 -1.718 6.243 1.00 0.00 C ATOM 1395 O GLU A 97 -17.908 -1.139 7.137 1.00 0.00 O ATOM 1396 CB GLU A 97 -20.794 -0.922 5.552 1.00 0.00 C ATOM 1397 CG GLU A 97 -21.431 -2.301 5.537 1.00 0.00 C ATOM 1398 CD GLU A 97 -22.891 -2.273 5.945 1.00 0.00 C ATOM 1399 OE1 GLU A 97 -23.716 -1.754 5.164 1.00 0.00 O ATOM 1400 OE2 GLU A 97 -23.209 -2.772 7.045 1.00 0.00 O ATOM 0 H GLU A 97 -19.858 -2.110 3.551 1.00 0.00 H new ATOM 0 HA GLU A 97 -18.936 0.094 5.183 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -20.918 -0.484 6.542 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -21.324 -0.278 4.850 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -21.345 -2.726 4.537 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -20.882 -2.958 6.211 1.00 0.00 H new ATOM 1407 N ASP A 98 -18.556 -3.041 6.125 1.00 0.00 N ATOM 1408 CA ASP A 98 -17.851 -3.909 7.061 1.00 0.00 C ATOM 1409 C ASP A 98 -16.439 -3.393 7.323 1.00 0.00 C ATOM 1410 O ASP A 98 -15.929 -3.492 8.439 1.00 0.00 O ATOM 1411 CB ASP A 98 -17.792 -5.338 6.519 1.00 0.00 C ATOM 1412 CG ASP A 98 -19.102 -6.080 6.700 1.00 0.00 C ATOM 1413 OD1 ASP A 98 -20.151 -5.543 6.285 1.00 0.00 O ATOM 1414 OD2 ASP A 98 -19.078 -7.198 7.256 1.00 0.00 O ATOM 0 H ASP A 98 -19.062 -3.536 5.390 1.00 0.00 H new ATOM 0 HA ASP A 98 -18.400 -3.908 8.003 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -17.536 -5.312 5.460 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -16.996 -5.883 7.026 1.00 0.00 H new ATOM 1419 N TRP A 99 -15.815 -2.844 6.288 1.00 0.00 N ATOM 1420 CA TRP A 99 -14.461 -2.313 6.406 1.00 0.00 C ATOM 1421 C TRP A 99 -14.405 -1.191 7.436 1.00 0.00 C ATOM 1422 O TRP A 99 -14.999 -0.126 7.263 1.00 0.00 O ATOM 1423 CB TRP A 99 -13.971 -1.803 5.050 1.00 0.00 C ATOM 1424 CG TRP A 99 -14.285 -2.732 3.917 1.00 0.00 C ATOM 1425 CD1 TRP A 99 -14.386 -4.093 3.977 1.00 0.00 C ATOM 1426 CD2 TRP A 99 -14.536 -2.369 2.555 1.00 0.00 C ATOM 1427 NE1 TRP A 99 -14.685 -4.597 2.734 1.00 0.00 N ATOM 1428 CE2 TRP A 99 -14.783 -3.560 1.845 1.00 0.00 C ATOM 1429 CE3 TRP A 99 -14.578 -1.153 1.867 1.00 0.00 C ATOM 1430 CZ2 TRP A 99 -15.066 -3.569 0.482 1.00 0.00 C ATOM 1431 CZ3 TRP A 99 -14.860 -1.164 0.514 1.00 0.00 C ATOM 1432 CH2 TRP A 99 -15.101 -2.364 -0.167 1.00 0.00 C ATOM 0 H TRP A 99 -16.224 -2.754 5.358 1.00 0.00 H new ATOM 0 HA TRP A 99 -13.808 -3.120 6.740 1.00 0.00 H new ATOM 0 HB2 TRP A 99 -14.424 -0.832 4.850 1.00 0.00 H new ATOM 0 HB3 TRP A 99 -12.893 -1.649 5.096 1.00 0.00 H new ATOM 0 HD1 TRP A 99 -14.251 -4.686 4.870 1.00 0.00 H new ATOM 0 HE1 TRP A 99 -14.813 -5.584 2.510 1.00 0.00 H new ATOM 0 HE3 TRP A 99 -14.394 -0.222 2.383 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 -15.251 -4.493 -0.045 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 -14.895 -0.230 -0.028 1.00 0.00 H new ATOM 0 HH2 TRP A 99 -15.319 -2.338 -1.225 1.00 0.00 H new ATOM 1443 N PRO A 100 -13.674 -1.430 8.535 1.00 0.00 N ATOM 1444 CA PRO A 100 -13.522 -0.450 9.614 1.00 0.00 C ATOM 1445 C PRO A 100 -12.677 0.748 9.195 1.00 0.00 C ATOM 1446 O PRO A 100 -11.856 0.652 8.283 1.00 0.00 O ATOM 1447 CB PRO A 100 -12.816 -1.243 10.717 1.00 0.00 C ATOM 1448 CG PRO A 100 -12.088 -2.326 9.998 1.00 0.00 C ATOM 1449 CD PRO A 100 -12.939 -2.677 8.808 1.00 0.00 C ATOM 0 HA PRO A 100 -14.480 -0.029 9.919 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -12.130 -0.612 11.281 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -13.531 -1.653 11.430 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -11.099 -1.991 9.685 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -11.942 -3.193 10.643 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -12.332 -2.981 7.955 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -13.616 -3.503 9.027 1.00 0.00 H new ATOM 1457 N SER A 101 -12.884 1.876 9.867 1.00 0.00 N ATOM 1458 CA SER A 101 -12.143 3.094 9.561 1.00 0.00 C ATOM 1459 C SER A 101 -10.783 3.091 10.254 1.00 0.00 C ATOM 1460 O SER A 101 -10.653 2.633 11.389 1.00 0.00 O ATOM 1461 CB SER A 101 -12.944 4.325 9.991 1.00 0.00 C ATOM 1462 OG SER A 101 -13.861 4.713 8.983 1.00 0.00 O ATOM 0 H SER A 101 -13.558 1.972 10.626 1.00 0.00 H new ATOM 0 HA SER A 101 -11.983 3.131 8.484 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.483 4.108 10.914 1.00 0.00 H new ATOM 0 HB3 SER A 101 -12.264 5.149 10.205 1.00 0.00 H new ATOM 0 HG SER A 101 -14.362 5.500 9.282 1.00 0.00 H new ATOM 1468 N VAL A 102 -9.772 3.606 9.561 1.00 0.00 N ATOM 1469 CA VAL A 102 -8.422 3.665 10.108 1.00 0.00 C ATOM 1470 C VAL A 102 -7.642 4.836 9.521 1.00 0.00 C ATOM 1471 O VAL A 102 -7.818 5.192 8.357 1.00 0.00 O ATOM 1472 CB VAL A 102 -7.649 2.361 9.836 1.00 0.00 C ATOM 1473 CG1 VAL A 102 -8.328 1.185 10.521 1.00 0.00 C ATOM 1474 CG2 VAL A 102 -7.526 2.117 8.339 1.00 0.00 C ATOM 0 H VAL A 102 -9.863 3.988 8.620 1.00 0.00 H new ATOM 0 HA VAL A 102 -8.523 3.802 11.185 1.00 0.00 H new ATOM 0 HB VAL A 102 -6.645 2.462 10.249 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -7.768 0.272 10.318 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -8.360 1.359 11.597 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -9.344 1.079 10.140 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -6.977 1.192 8.165 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -8.521 2.037 7.900 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -6.992 2.948 7.878 1.00 0.00 H new ATOM 1484 N ASN A 103 -6.779 5.432 10.337 1.00 0.00 N ATOM 1485 CA ASN A 103 -5.971 6.565 9.900 1.00 0.00 C ATOM 1486 C ASN A 103 -4.605 6.099 9.402 1.00 0.00 C ATOM 1487 O ASN A 103 -3.863 5.436 10.126 1.00 0.00 O ATOM 1488 CB ASN A 103 -5.795 7.565 11.044 1.00 0.00 C ATOM 1489 CG ASN A 103 -7.021 8.436 11.243 1.00 0.00 C ATOM 1490 OD1 ASN A 103 -6.971 9.651 11.050 1.00 0.00 O ATOM 1491 ND2 ASN A 103 -8.129 7.817 11.633 1.00 0.00 N ATOM 0 H ASN A 103 -6.621 5.149 11.304 1.00 0.00 H new ATOM 0 HA ASN A 103 -6.491 7.054 9.076 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -5.583 7.024 11.966 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -4.932 8.198 10.840 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -8.985 8.351 11.785 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -8.124 6.808 11.781 1.00 0.00 H new ATOM 1498 N MET A 104 -4.281 6.453 8.163 1.00 0.00 N ATOM 1499 CA MET A 104 -3.004 6.073 7.570 1.00 0.00 C ATOM 1500 C MET A 104 -1.973 7.184 7.741 1.00 0.00 C ATOM 1501 O MET A 104 -2.258 8.353 7.486 1.00 0.00 O ATOM 1502 CB MET A 104 -3.183 5.752 6.085 1.00 0.00 C ATOM 1503 CG MET A 104 -2.018 4.981 5.485 1.00 0.00 C ATOM 1504 SD MET A 104 -2.227 3.195 5.614 1.00 0.00 S ATOM 1505 CE MET A 104 -3.412 2.897 4.303 1.00 0.00 C ATOM 0 H MET A 104 -4.884 7.002 7.550 1.00 0.00 H new ATOM 0 HA MET A 104 -2.642 5.184 8.086 1.00 0.00 H new ATOM 0 HB2 MET A 104 -4.097 5.173 5.955 1.00 0.00 H new ATOM 0 HB3 MET A 104 -3.314 6.683 5.534 1.00 0.00 H new ATOM 0 HG2 MET A 104 -1.908 5.255 4.436 1.00 0.00 H new ATOM 0 HG3 MET A 104 -1.096 5.272 5.989 1.00 0.00 H new ATOM 0 HE1 MET A 104 -4.246 2.312 4.692 1.00 0.00 H new ATOM 0 HE2 MET A 104 -3.782 3.849 3.924 1.00 0.00 H new ATOM 0 HE3 MET A 104 -2.930 2.348 3.495 1.00 0.00 H new ATOM 1515 N ASN A 105 -0.773 6.810 8.175 1.00 0.00 N ATOM 1516 CA ASN A 105 0.300 7.776 8.381 1.00 0.00 C ATOM 1517 C ASN A 105 1.384 7.619 7.319 1.00 0.00 C ATOM 1518 O ASN A 105 1.766 6.504 6.966 1.00 0.00 O ATOM 1519 CB ASN A 105 0.907 7.605 9.775 1.00 0.00 C ATOM 1520 CG ASN A 105 -0.047 8.024 10.877 1.00 0.00 C ATOM 1521 OD1 ASN A 105 -1.239 8.221 10.640 1.00 0.00 O ATOM 1522 ND2 ASN A 105 0.476 8.163 12.090 1.00 0.00 N ATOM 0 H ASN A 105 -0.520 5.846 8.391 1.00 0.00 H new ATOM 0 HA ASN A 105 -0.124 8.777 8.297 1.00 0.00 H new ATOM 0 HB2 ASN A 105 1.189 6.562 9.920 1.00 0.00 H new ATOM 0 HB3 ASN A 105 1.821 8.195 9.845 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -0.116 8.444 12.872 1.00 0.00 H new ATOM 0 HD22 ASN A 105 1.470 7.989 12.240 1.00 0.00 H new ATOM 1529 N VAL A 106 1.876 8.746 6.814 1.00 0.00 N ATOM 1530 CA VAL A 106 2.917 8.735 5.793 1.00 0.00 C ATOM 1531 C VAL A 106 4.103 9.599 6.208 1.00 0.00 C ATOM 1532 O VAL A 106 4.593 10.415 5.427 1.00 0.00 O ATOM 1533 CB VAL A 106 2.381 9.234 4.438 1.00 0.00 C ATOM 1534 CG1 VAL A 106 3.482 9.217 3.389 1.00 0.00 C ATOM 1535 CG2 VAL A 106 1.195 8.393 3.993 1.00 0.00 C ATOM 0 H VAL A 106 1.571 9.678 7.095 1.00 0.00 H new ATOM 0 HA VAL A 106 3.244 7.701 5.686 1.00 0.00 H new ATOM 0 HB VAL A 106 2.043 10.263 4.557 1.00 0.00 H new ATOM 0 HG11 VAL A 106 3.084 9.573 2.438 1.00 0.00 H new ATOM 0 HG12 VAL A 106 4.298 9.866 3.707 1.00 0.00 H new ATOM 0 HG13 VAL A 106 3.854 8.200 3.269 1.00 0.00 H new ATOM 0 HG21 VAL A 106 0.829 8.759 3.034 1.00 0.00 H new ATOM 0 HG22 VAL A 106 1.505 7.353 3.890 1.00 0.00 H new ATOM 0 HG23 VAL A 106 0.400 8.463 4.736 1.00 0.00 H new ATOM 1545 N ALA A 107 4.559 9.414 7.442 1.00 0.00 N ATOM 1546 CA ALA A 107 5.689 10.176 7.961 1.00 0.00 C ATOM 1547 C ALA A 107 7.002 9.432 7.736 1.00 0.00 C ATOM 1548 O ALA A 107 7.030 8.202 7.693 1.00 0.00 O ATOM 1549 CB ALA A 107 5.494 10.469 9.441 1.00 0.00 C ATOM 0 H ALA A 107 4.164 8.743 8.101 1.00 0.00 H new ATOM 0 HA ALA A 107 5.738 11.120 7.419 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.345 11.038 9.814 1.00 0.00 H new ATOM 0 HB2 ALA A 107 4.581 11.048 9.580 1.00 0.00 H new ATOM 0 HB3 ALA A 107 5.416 9.531 9.990 1.00 0.00 H new ATOM 1555 N ASP A 108 8.086 10.186 7.592 1.00 0.00 N ATOM 1556 CA ASP A 108 9.402 9.598 7.371 1.00 0.00 C ATOM 1557 C ASP A 108 9.332 8.482 6.333 1.00 0.00 C ATOM 1558 O ASP A 108 9.903 7.409 6.522 1.00 0.00 O ATOM 1559 CB ASP A 108 9.968 9.054 8.684 1.00 0.00 C ATOM 1560 CG ASP A 108 11.484 9.031 8.696 1.00 0.00 C ATOM 1561 OD1 ASP A 108 12.076 8.542 7.712 1.00 0.00 O ATOM 1562 OD2 ASP A 108 12.077 9.500 9.690 1.00 0.00 O ATOM 0 H ASP A 108 8.080 11.205 7.624 1.00 0.00 H new ATOM 0 HA ASP A 108 10.063 10.379 6.995 1.00 0.00 H new ATOM 0 HB2 ASP A 108 9.610 9.666 9.512 1.00 0.00 H new ATOM 0 HB3 ASP A 108 9.591 8.045 8.848 1.00 0.00 H new ATOM 1567 N ALA A 109 8.627 8.744 5.238 1.00 0.00 N ATOM 1568 CA ALA A 109 8.483 7.763 4.169 1.00 0.00 C ATOM 1569 C ALA A 109 8.125 6.390 4.729 1.00 0.00 C ATOM 1570 O ALA A 109 8.563 5.363 4.210 1.00 0.00 O ATOM 1571 CB ALA A 109 9.762 7.684 3.349 1.00 0.00 C ATOM 0 H ALA A 109 8.146 9.627 5.067 1.00 0.00 H new ATOM 0 HA ALA A 109 7.669 8.086 3.520 1.00 0.00 H new ATOM 0 HB1 ALA A 109 9.640 6.948 2.555 1.00 0.00 H new ATOM 0 HB2 ALA A 109 9.974 8.659 2.911 1.00 0.00 H new ATOM 0 HB3 ALA A 109 10.590 7.388 3.994 1.00 0.00 H new ATOM 1577 N THR A 110 7.328 6.379 5.793 1.00 0.00 N ATOM 1578 CA THR A 110 6.913 5.133 6.424 1.00 0.00 C ATOM 1579 C THR A 110 5.394 5.007 6.447 1.00 0.00 C ATOM 1580 O THR A 110 4.683 5.985 6.677 1.00 0.00 O ATOM 1581 CB THR A 110 7.447 5.028 7.865 1.00 0.00 C ATOM 1582 OG1 THR A 110 8.879 5.055 7.860 1.00 0.00 O ATOM 1583 CG2 THR A 110 6.961 3.750 8.531 1.00 0.00 C ATOM 0 H THR A 110 6.957 7.220 6.236 1.00 0.00 H new ATOM 0 HA THR A 110 7.333 4.322 5.828 1.00 0.00 H new ATOM 0 HB THR A 110 7.070 5.880 8.431 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.189 5.885 7.442 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.351 3.698 9.547 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.871 3.746 8.560 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.312 2.888 7.964 1.00 0.00 H new ATOM 1591 N VAL A 111 4.902 3.795 6.209 1.00 0.00 N ATOM 1592 CA VAL A 111 3.466 3.541 6.204 1.00 0.00 C ATOM 1593 C VAL A 111 3.021 2.878 7.503 1.00 0.00 C ATOM 1594 O VAL A 111 3.440 1.764 7.821 1.00 0.00 O ATOM 1595 CB VAL A 111 3.058 2.646 5.019 1.00 0.00 C ATOM 1596 CG1 VAL A 111 1.557 2.401 5.026 1.00 0.00 C ATOM 1597 CG2 VAL A 111 3.498 3.272 3.704 1.00 0.00 C ATOM 0 H VAL A 111 5.476 2.974 6.017 1.00 0.00 H new ATOM 0 HA VAL A 111 2.974 4.509 6.105 1.00 0.00 H new ATOM 0 HB VAL A 111 3.559 1.684 5.123 1.00 0.00 H new ATOM 0 HG11 VAL A 111 1.288 1.767 4.181 1.00 0.00 H new ATOM 0 HG12 VAL A 111 1.273 1.907 5.955 1.00 0.00 H new ATOM 0 HG13 VAL A 111 1.033 3.353 4.946 1.00 0.00 H new ATOM 0 HG21 VAL A 111 3.202 2.627 2.877 1.00 0.00 H new ATOM 0 HG22 VAL A 111 3.026 4.248 3.590 1.00 0.00 H new ATOM 0 HG23 VAL A 111 4.582 3.390 3.702 1.00 0.00 H new ATOM 1607 N THR A 112 2.168 3.570 8.253 1.00 0.00 N ATOM 1608 CA THR A 112 1.666 3.050 9.518 1.00 0.00 C ATOM 1609 C THR A 112 0.147 3.155 9.592 1.00 0.00 C ATOM 1610 O THR A 112 -0.405 4.251 9.693 1.00 0.00 O ATOM 1611 CB THR A 112 2.280 3.798 10.716 1.00 0.00 C ATOM 1612 OG1 THR A 112 3.691 3.956 10.525 1.00 0.00 O ATOM 1613 CG2 THR A 112 2.020 3.048 12.014 1.00 0.00 C ATOM 0 H THR A 112 1.811 4.493 8.005 1.00 0.00 H new ATOM 0 HA THR A 112 1.957 2.001 9.566 1.00 0.00 H new ATOM 0 HB THR A 112 1.811 4.780 10.782 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.073 4.434 11.290 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.463 3.596 12.846 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.945 2.956 12.172 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.465 2.055 11.956 1.00 0.00 H new ATOM 1621 N VAL A 113 -0.524 2.009 9.541 1.00 0.00 N ATOM 1622 CA VAL A 113 -1.980 1.972 9.604 1.00 0.00 C ATOM 1623 C VAL A 113 -2.476 2.239 11.021 1.00 0.00 C ATOM 1624 O VAL A 113 -2.638 1.313 11.817 1.00 0.00 O ATOM 1625 CB VAL A 113 -2.528 0.615 9.127 1.00 0.00 C ATOM 1626 CG1 VAL A 113 -4.040 0.563 9.288 1.00 0.00 C ATOM 1627 CG2 VAL A 113 -2.129 0.357 7.682 1.00 0.00 C ATOM 0 H VAL A 113 -0.082 1.094 9.456 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.345 2.756 8.941 1.00 0.00 H new ATOM 0 HB VAL A 113 -2.093 -0.170 9.746 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -4.409 -0.404 8.946 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -4.299 0.699 10.338 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -4.496 1.356 8.696 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -2.525 -0.607 7.362 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -2.534 1.145 7.047 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -1.042 0.348 7.601 1.00 0.00 H new ATOM 1637 N ILE A 114 -2.714 3.509 11.330 1.00 0.00 N ATOM 1638 CA ILE A 114 -3.193 3.897 12.650 1.00 0.00 C ATOM 1639 C ILE A 114 -4.689 3.639 12.790 1.00 0.00 C ATOM 1640 O ILE A 114 -5.418 3.596 11.799 1.00 0.00 O ATOM 1641 CB ILE A 114 -2.911 5.384 12.937 1.00 0.00 C ATOM 1642 CG1 ILE A 114 -1.431 5.698 12.708 1.00 0.00 C ATOM 1643 CG2 ILE A 114 -3.318 5.735 14.361 1.00 0.00 C ATOM 1644 CD1 ILE A 114 -0.507 4.997 13.679 1.00 0.00 C ATOM 0 H ILE A 114 -2.583 4.287 10.684 1.00 0.00 H new ATOM 0 HA ILE A 114 -2.652 3.287 13.373 1.00 0.00 H new ATOM 0 HB ILE A 114 -3.502 5.990 12.251 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -1.161 5.413 11.691 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -1.280 6.774 12.788 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -3.113 6.789 14.549 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -4.383 5.544 14.493 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -2.750 5.124 15.063 1.00 0.00 H new ATOM 0 HD11 ILE A 114 0.526 5.266 13.457 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -0.751 5.301 14.697 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -0.629 3.918 13.583 1.00 0.00 H new ATOM 1656 N SER A 115 -5.142 3.469 14.029 1.00 0.00 N ATOM 1657 CA SER A 115 -6.551 3.213 14.299 1.00 0.00 C ATOM 1658 C SER A 115 -7.362 4.503 14.223 1.00 0.00 C ATOM 1659 O SER A 115 -6.802 5.597 14.167 1.00 0.00 O ATOM 1660 CB SER A 115 -6.720 2.572 15.678 1.00 0.00 C ATOM 1661 OG SER A 115 -6.448 3.503 16.710 1.00 0.00 O ATOM 0 H SER A 115 -4.553 3.504 14.861 1.00 0.00 H new ATOM 0 HA SER A 115 -6.922 2.526 13.539 1.00 0.00 H new ATOM 0 HB2 SER A 115 -7.737 2.193 15.784 1.00 0.00 H new ATOM 0 HB3 SER A 115 -6.050 1.717 15.770 1.00 0.00 H new ATOM 0 HG SER A 115 -6.154 4.351 16.316 1.00 0.00 H new ATOM 1667 N GLU A 116 -8.684 4.365 14.223 1.00 0.00 N ATOM 1668 CA GLU A 116 -9.572 5.519 14.153 1.00 0.00 C ATOM 1669 C GLU A 116 -9.862 6.068 15.547 1.00 0.00 C ATOM 1670 O GLU A 116 -9.511 7.204 15.865 1.00 0.00 O ATOM 1671 CB GLU A 116 -10.882 5.142 13.459 1.00 0.00 C ATOM 1672 CG GLU A 116 -11.609 6.326 12.844 1.00 0.00 C ATOM 1673 CD GLU A 116 -13.105 6.100 12.735 1.00 0.00 C ATOM 1674 OE1 GLU A 116 -13.549 4.955 12.959 1.00 0.00 O ATOM 1675 OE2 GLU A 116 -13.830 7.068 12.424 1.00 0.00 O ATOM 0 H GLU A 116 -9.163 3.466 14.271 1.00 0.00 H new ATOM 0 HA GLU A 116 -9.072 6.294 13.573 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -10.672 4.410 12.679 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.540 4.658 14.181 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.423 7.215 13.447 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.202 6.522 11.852 1.00 0.00 H new ATOM 1682 N LYS A 117 -10.507 5.252 16.375 1.00 0.00 N ATOM 1683 CA LYS A 117 -10.845 5.653 17.735 1.00 0.00 C ATOM 1684 C LYS A 117 -9.608 6.143 18.481 1.00 0.00 C ATOM 1685 O LYS A 117 -9.652 7.156 19.178 1.00 0.00 O ATOM 1686 CB LYS A 117 -11.479 4.483 18.491 1.00 0.00 C ATOM 1687 CG LYS A 117 -12.952 4.283 18.177 1.00 0.00 C ATOM 1688 CD LYS A 117 -13.634 3.423 19.227 1.00 0.00 C ATOM 1689 CE LYS A 117 -13.952 4.223 20.481 1.00 0.00 C ATOM 1690 NZ LYS A 117 -15.193 5.032 20.324 1.00 0.00 N ATOM 0 H LYS A 117 -10.806 4.309 16.127 1.00 0.00 H new ATOM 0 HA LYS A 117 -11.562 6.472 17.678 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -10.937 3.569 18.249 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -11.364 4.648 19.562 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -13.448 5.252 18.121 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -13.056 3.815 17.198 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -14.554 3.007 18.817 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -12.990 2.582 19.484 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -14.066 3.544 21.326 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -13.116 4.882 20.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -15.375 5.562 21.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -15.076 5.698 19.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -15.996 4.401 20.128 1.00 0.00 H new ATOM 1704 N ASN A 118 -8.505 5.417 18.329 1.00 0.00 N ATOM 1705 CA ASN A 118 -7.255 5.778 18.988 1.00 0.00 C ATOM 1706 C ASN A 118 -6.226 6.267 17.973 1.00 0.00 C ATOM 1707 O ASN A 118 -6.381 6.061 16.770 1.00 0.00 O ATOM 1708 CB ASN A 118 -6.697 4.581 19.761 1.00 0.00 C ATOM 1709 CG ASN A 118 -7.652 4.088 20.831 1.00 0.00 C ATOM 1710 OD1 ASN A 118 -8.166 2.972 20.752 1.00 0.00 O ATOM 1711 ND2 ASN A 118 -7.894 4.919 21.837 1.00 0.00 N ATOM 0 H ASN A 118 -8.451 4.575 17.755 1.00 0.00 H new ATOM 0 HA ASN A 118 -7.463 6.588 19.687 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -6.485 3.769 19.065 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -5.750 4.860 20.223 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -8.529 4.642 22.586 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -7.445 5.835 21.861 1.00 0.00 H new ATOM 1718 N GLU A 119 -5.176 6.914 18.468 1.00 0.00 N ATOM 1719 CA GLU A 119 -4.122 7.432 17.604 1.00 0.00 C ATOM 1720 C GLU A 119 -2.827 6.646 17.793 1.00 0.00 C ATOM 1721 O GLU A 119 -2.127 6.343 16.828 1.00 0.00 O ATOM 1722 CB GLU A 119 -3.878 8.915 17.892 1.00 0.00 C ATOM 1723 CG GLU A 119 -3.104 9.629 16.796 1.00 0.00 C ATOM 1724 CD GLU A 119 -2.460 10.914 17.279 1.00 0.00 C ATOM 1725 OE1 GLU A 119 -1.344 10.846 17.835 1.00 0.00 O ATOM 1726 OE2 GLU A 119 -3.072 11.987 17.100 1.00 0.00 O ATOM 0 H GLU A 119 -5.033 7.092 19.462 1.00 0.00 H new ATOM 0 HA GLU A 119 -4.448 7.319 16.570 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -4.838 9.412 18.030 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -3.332 9.009 18.831 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -2.332 8.964 16.409 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -3.777 9.853 15.968 1.00 0.00 H new ATOM 1733 N GLU A 120 -2.517 6.320 19.044 1.00 0.00 N ATOM 1734 CA GLU A 120 -1.307 5.571 19.360 1.00 0.00 C ATOM 1735 C GLU A 120 -1.531 4.073 19.174 1.00 0.00 C ATOM 1736 O GLU A 120 -1.042 3.261 19.959 1.00 0.00 O ATOM 1737 CB GLU A 120 -0.863 5.857 20.796 1.00 0.00 C ATOM 1738 CG GLU A 120 -1.855 5.385 21.845 1.00 0.00 C ATOM 1739 CD GLU A 120 -1.210 5.162 23.199 1.00 0.00 C ATOM 1740 OE1 GLU A 120 -1.087 6.139 23.967 1.00 0.00 O ATOM 1741 OE2 GLU A 120 -0.828 4.009 23.491 1.00 0.00 O ATOM 0 H GLU A 120 -3.087 6.563 19.854 1.00 0.00 H new ATOM 0 HA GLU A 120 -0.523 5.892 18.675 1.00 0.00 H new ATOM 0 HB2 GLU A 120 0.098 5.374 20.973 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -0.707 6.929 20.912 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -2.652 6.122 21.943 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -2.318 4.457 21.510 1.00 0.00 H new ATOM 1748 N GLU A 121 -2.273 3.716 18.131 1.00 0.00 N ATOM 1749 CA GLU A 121 -2.562 2.316 17.843 1.00 0.00 C ATOM 1750 C GLU A 121 -2.057 1.929 16.456 1.00 0.00 C ATOM 1751 O GLU A 121 -2.792 2.009 15.471 1.00 0.00 O ATOM 1752 CB GLU A 121 -4.066 2.052 17.942 1.00 0.00 C ATOM 1753 CG GLU A 121 -4.409 0.630 18.354 1.00 0.00 C ATOM 1754 CD GLU A 121 -5.710 0.545 19.129 1.00 0.00 C ATOM 1755 OE1 GLU A 121 -5.839 1.253 20.150 1.00 0.00 O ATOM 1756 OE2 GLU A 121 -6.597 -0.229 18.716 1.00 0.00 O ATOM 0 H GLU A 121 -2.685 4.376 17.472 1.00 0.00 H new ATOM 0 HA GLU A 121 -2.043 1.706 18.582 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -4.501 2.745 18.662 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -4.528 2.263 16.977 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -4.479 0.005 17.464 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -3.600 0.227 18.964 1.00 0.00 H new ATOM 1763 N VAL A 122 -0.797 1.511 16.386 1.00 0.00 N ATOM 1764 CA VAL A 122 -0.193 1.112 15.121 1.00 0.00 C ATOM 1765 C VAL A 122 -0.661 -0.278 14.703 1.00 0.00 C ATOM 1766 O VAL A 122 -0.057 -1.286 15.072 1.00 0.00 O ATOM 1767 CB VAL A 122 1.345 1.119 15.206 1.00 0.00 C ATOM 1768 CG1 VAL A 122 1.954 0.601 13.912 1.00 0.00 C ATOM 1769 CG2 VAL A 122 1.853 2.518 15.522 1.00 0.00 C ATOM 0 H VAL A 122 -0.175 1.440 17.191 1.00 0.00 H new ATOM 0 HA VAL A 122 -0.512 1.840 14.375 1.00 0.00 H new ATOM 0 HB VAL A 122 1.651 0.454 16.014 1.00 0.00 H new ATOM 0 HG11 VAL A 122 3.041 0.613 13.991 1.00 0.00 H new ATOM 0 HG12 VAL A 122 1.615 -0.419 13.733 1.00 0.00 H new ATOM 0 HG13 VAL A 122 1.643 1.237 13.083 1.00 0.00 H new ATOM 0 HG21 VAL A 122 2.941 2.506 15.579 1.00 0.00 H new ATOM 0 HG22 VAL A 122 1.538 3.205 14.737 1.00 0.00 H new ATOM 0 HG23 VAL A 122 1.444 2.847 16.477 1.00 0.00 H new ATOM 1779 N LEU A 123 -1.741 -0.324 13.930 1.00 0.00 N ATOM 1780 CA LEU A 123 -2.291 -1.591 13.460 1.00 0.00 C ATOM 1781 C LEU A 123 -1.290 -2.323 12.572 1.00 0.00 C ATOM 1782 O LEU A 123 -1.025 -3.510 12.765 1.00 0.00 O ATOM 1783 CB LEU A 123 -3.591 -1.351 12.691 1.00 0.00 C ATOM 1784 CG LEU A 123 -4.686 -0.594 13.444 1.00 0.00 C ATOM 1785 CD1 LEU A 123 -5.579 0.161 12.471 1.00 0.00 C ATOM 1786 CD2 LEU A 123 -5.510 -1.553 14.292 1.00 0.00 C ATOM 0 H LEU A 123 -2.253 0.501 13.616 1.00 0.00 H new ATOM 0 HA LEU A 123 -2.500 -2.213 14.330 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -3.355 -0.799 11.781 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -3.991 -2.317 12.383 1.00 0.00 H new ATOM 0 HG LEU A 123 -4.211 0.130 14.106 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -6.352 0.694 13.025 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -4.980 0.875 11.907 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -6.046 -0.544 11.783 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.284 -0.997 14.821 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -5.975 -2.300 13.649 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -4.862 -2.049 15.014 1.00 0.00 H new ATOM 1798 N VAL A 124 -0.735 -1.608 11.599 1.00 0.00 N ATOM 1799 CA VAL A 124 0.240 -2.188 10.684 1.00 0.00 C ATOM 1800 C VAL A 124 1.410 -1.238 10.452 1.00 0.00 C ATOM 1801 O VAL A 124 1.228 -0.122 9.968 1.00 0.00 O ATOM 1802 CB VAL A 124 -0.402 -2.536 9.327 1.00 0.00 C ATOM 1803 CG1 VAL A 124 0.658 -2.991 8.336 1.00 0.00 C ATOM 1804 CG2 VAL A 124 -1.473 -3.601 9.502 1.00 0.00 C ATOM 0 H VAL A 124 -0.944 -0.625 11.424 1.00 0.00 H new ATOM 0 HA VAL A 124 0.606 -3.103 11.150 1.00 0.00 H new ATOM 0 HB VAL A 124 -0.876 -1.639 8.928 1.00 0.00 H new ATOM 0 HG11 VAL A 124 0.186 -3.232 7.384 1.00 0.00 H new ATOM 0 HG12 VAL A 124 1.385 -2.192 8.189 1.00 0.00 H new ATOM 0 HG13 VAL A 124 1.164 -3.875 8.725 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -1.916 -3.834 8.534 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -1.025 -4.501 9.923 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -2.247 -3.232 10.175 1.00 0.00 H new ATOM 1814 N GLU A 125 2.610 -1.691 10.800 1.00 0.00 N ATOM 1815 CA GLU A 125 3.810 -0.880 10.630 1.00 0.00 C ATOM 1816 C GLU A 125 4.657 -1.399 9.471 1.00 0.00 C ATOM 1817 O GLU A 125 5.228 -2.488 9.544 1.00 0.00 O ATOM 1818 CB GLU A 125 4.637 -0.876 11.918 1.00 0.00 C ATOM 1819 CG GLU A 125 5.681 0.227 11.967 1.00 0.00 C ATOM 1820 CD GLU A 125 6.631 0.079 13.139 1.00 0.00 C ATOM 1821 OE1 GLU A 125 6.985 -1.071 13.473 1.00 0.00 O ATOM 1822 OE2 GLU A 125 7.020 1.112 13.723 1.00 0.00 O ATOM 0 H GLU A 125 2.777 -2.614 11.201 1.00 0.00 H new ATOM 0 HA GLU A 125 3.499 0.140 10.403 1.00 0.00 H new ATOM 0 HB2 GLU A 125 3.966 -0.768 12.770 1.00 0.00 H new ATOM 0 HB3 GLU A 125 5.134 -1.840 12.024 1.00 0.00 H new ATOM 0 HG2 GLU A 125 6.252 0.223 11.039 1.00 0.00 H new ATOM 0 HG3 GLU A 125 5.181 1.193 12.029 1.00 0.00 H new ATOM 1829 N CYS A 126 4.734 -0.612 8.404 1.00 0.00 N ATOM 1830 CA CYS A 126 5.510 -0.991 7.228 1.00 0.00 C ATOM 1831 C CYS A 126 6.265 0.209 6.665 1.00 0.00 C ATOM 1832 O CYS A 126 5.790 1.342 6.735 1.00 0.00 O ATOM 1833 CB CYS A 126 4.594 -1.582 6.156 1.00 0.00 C ATOM 1834 SG CYS A 126 5.421 -2.727 5.028 1.00 0.00 S ATOM 0 H CYS A 126 4.269 0.293 8.329 1.00 0.00 H new ATOM 0 HA CYS A 126 6.237 -1.745 7.530 1.00 0.00 H new ATOM 0 HB2 CYS A 126 3.770 -2.102 6.644 1.00 0.00 H new ATOM 0 HB3 CYS A 126 4.159 -0.768 5.576 1.00 0.00 H new ATOM 0 HG CYS A 126 4.691 -3.792 4.878 1.00 0.00 H new ATOM 1840 N ARG A 127 7.444 -0.049 6.108 1.00 0.00 N ATOM 1841 CA ARG A 127 8.266 1.010 5.535 1.00 0.00 C ATOM 1842 C ARG A 127 8.409 0.831 4.027 1.00 0.00 C ATOM 1843 O ARG A 127 8.396 -0.290 3.520 1.00 0.00 O ATOM 1844 CB ARG A 127 9.648 1.022 6.191 1.00 0.00 C ATOM 1845 CG ARG A 127 9.702 1.822 7.483 1.00 0.00 C ATOM 1846 CD ARG A 127 8.885 1.160 8.582 1.00 0.00 C ATOM 1847 NE ARG A 127 9.187 1.716 9.898 1.00 0.00 N ATOM 1848 CZ ARG A 127 9.018 1.049 11.034 1.00 0.00 C ATOM 1849 NH1 ARG A 127 8.552 -0.193 11.015 1.00 0.00 N ATOM 1850 NH2 ARG A 127 9.315 1.623 12.193 1.00 0.00 N ATOM 0 H ARG A 127 7.851 -0.982 6.041 1.00 0.00 H new ATOM 0 HA ARG A 127 7.772 1.963 5.725 1.00 0.00 H new ATOM 0 HB2 ARG A 127 9.952 -0.004 6.396 1.00 0.00 H new ATOM 0 HB3 ARG A 127 10.371 1.435 5.488 1.00 0.00 H new ATOM 0 HG2 ARG A 127 10.738 1.922 7.808 1.00 0.00 H new ATOM 0 HG3 ARG A 127 9.326 2.829 7.305 1.00 0.00 H new ATOM 0 HD2 ARG A 127 7.823 1.286 8.370 1.00 0.00 H new ATOM 0 HD3 ARG A 127 9.084 0.088 8.587 1.00 0.00 H new ATOM 0 HE ARG A 127 9.548 2.669 9.948 1.00 0.00 H new ATOM 0 HH11 ARG A 127 8.323 -0.638 10.126 1.00 0.00 H new ATOM 0 HH12 ARG A 127 8.423 -0.703 11.889 1.00 0.00 H new ATOM 0 HH21 ARG A 127 9.674 2.578 12.212 1.00 0.00 H new ATOM 0 HH22 ARG A 127 9.185 1.110 13.065 1.00 0.00 H new ATOM 1864 N VAL A 128 8.545 1.945 3.315 1.00 0.00 N ATOM 1865 CA VAL A 128 8.691 1.913 1.864 1.00 0.00 C ATOM 1866 C VAL A 128 9.754 0.905 1.442 1.00 0.00 C ATOM 1867 O VAL A 128 9.720 0.382 0.328 1.00 0.00 O ATOM 1868 CB VAL A 128 9.063 3.299 1.306 1.00 0.00 C ATOM 1869 CG1 VAL A 128 7.856 4.224 1.325 1.00 0.00 C ATOM 1870 CG2 VAL A 128 10.217 3.899 2.096 1.00 0.00 C ATOM 0 H VAL A 128 8.557 2.881 3.719 1.00 0.00 H new ATOM 0 HA VAL A 128 7.726 1.613 1.455 1.00 0.00 H new ATOM 0 HB VAL A 128 9.384 3.181 0.271 1.00 0.00 H new ATOM 0 HG11 VAL A 128 8.138 5.199 0.927 1.00 0.00 H new ATOM 0 HG12 VAL A 128 7.062 3.798 0.712 1.00 0.00 H new ATOM 0 HG13 VAL A 128 7.502 4.339 2.349 1.00 0.00 H new ATOM 0 HG21 VAL A 128 10.467 4.878 1.688 1.00 0.00 H new ATOM 0 HG22 VAL A 128 9.926 4.005 3.141 1.00 0.00 H new ATOM 0 HG23 VAL A 128 11.086 3.244 2.025 1.00 0.00 H new ATOM 1880 N ARG A 129 10.697 0.637 2.339 1.00 0.00 N ATOM 1881 CA ARG A 129 11.772 -0.309 2.059 1.00 0.00 C ATOM 1882 C ARG A 129 11.220 -1.720 1.876 1.00 0.00 C ATOM 1883 O ARG A 129 11.583 -2.422 0.932 1.00 0.00 O ATOM 1884 CB ARG A 129 12.801 -0.294 3.190 1.00 0.00 C ATOM 1885 CG ARG A 129 13.155 1.103 3.673 1.00 0.00 C ATOM 1886 CD ARG A 129 14.539 1.141 4.301 1.00 0.00 C ATOM 1887 NE ARG A 129 14.739 2.338 5.114 1.00 0.00 N ATOM 1888 CZ ARG A 129 14.883 3.556 4.606 1.00 0.00 C ATOM 1889 NH1 ARG A 129 14.851 3.739 3.293 1.00 0.00 N ATOM 1890 NH2 ARG A 129 15.061 4.596 5.411 1.00 0.00 N ATOM 0 H ARG A 129 10.739 1.061 3.266 1.00 0.00 H new ATOM 0 HA ARG A 129 12.258 -0.005 1.132 1.00 0.00 H new ATOM 0 HB2 ARG A 129 12.414 -0.872 4.029 1.00 0.00 H new ATOM 0 HB3 ARG A 129 13.709 -0.793 2.851 1.00 0.00 H new ATOM 0 HG2 ARG A 129 13.115 1.800 2.836 1.00 0.00 H new ATOM 0 HG3 ARG A 129 12.415 1.436 4.401 1.00 0.00 H new ATOM 0 HD2 ARG A 129 14.681 0.255 4.920 1.00 0.00 H new ATOM 0 HD3 ARG A 129 15.294 1.106 3.516 1.00 0.00 H new ATOM 0 HE ARG A 129 14.770 2.232 6.128 1.00 0.00 H new ATOM 0 HH11 ARG A 129 14.715 2.943 2.670 1.00 0.00 H new ATOM 0 HH12 ARG A 129 14.962 4.676 2.906 1.00 0.00 H new ATOM 0 HH21 ARG A 129 15.087 4.460 6.422 1.00 0.00 H new ATOM 0 HH22 ARG A 129 15.172 5.531 5.019 1.00 0.00 H new ATOM 1904 N PHE A 130 10.342 -2.128 2.786 1.00 0.00 N ATOM 1905 CA PHE A 130 9.742 -3.456 2.727 1.00 0.00 C ATOM 1906 C PHE A 130 8.826 -3.585 1.513 1.00 0.00 C ATOM 1907 O PHE A 130 8.799 -4.622 0.849 1.00 0.00 O ATOM 1908 CB PHE A 130 8.954 -3.740 4.007 1.00 0.00 C ATOM 1909 CG PHE A 130 9.822 -3.905 5.222 1.00 0.00 C ATOM 1910 CD1 PHE A 130 10.353 -2.798 5.865 1.00 0.00 C ATOM 1911 CD2 PHE A 130 10.107 -5.166 5.720 1.00 0.00 C ATOM 1912 CE1 PHE A 130 11.153 -2.947 6.982 1.00 0.00 C ATOM 1913 CE2 PHE A 130 10.906 -5.321 6.838 1.00 0.00 C ATOM 1914 CZ PHE A 130 11.429 -4.209 7.470 1.00 0.00 C ATOM 0 H PHE A 130 10.030 -1.559 3.573 1.00 0.00 H new ATOM 0 HA PHE A 130 10.545 -4.187 2.634 1.00 0.00 H new ATOM 0 HB2 PHE A 130 8.252 -2.925 4.180 1.00 0.00 H new ATOM 0 HB3 PHE A 130 8.363 -4.645 3.867 1.00 0.00 H new ATOM 0 HD1 PHE A 130 10.139 -1.808 5.489 1.00 0.00 H new ATOM 0 HD2 PHE A 130 9.700 -6.038 5.229 1.00 0.00 H new ATOM 0 HE1 PHE A 130 11.562 -2.077 7.473 1.00 0.00 H new ATOM 0 HE2 PHE A 130 11.121 -6.309 7.217 1.00 0.00 H new ATOM 0 HZ PHE A 130 12.052 -4.327 8.344 1.00 0.00 H new ATOM 1924 N LEU A 131 8.077 -2.526 1.230 1.00 0.00 N ATOM 1925 CA LEU A 131 7.158 -2.519 0.097 1.00 0.00 C ATOM 1926 C LEU A 131 7.780 -3.213 -1.112 1.00 0.00 C ATOM 1927 O LEU A 131 8.952 -3.007 -1.423 1.00 0.00 O ATOM 1928 CB LEU A 131 6.775 -1.083 -0.266 1.00 0.00 C ATOM 1929 CG LEU A 131 5.380 -0.891 -0.863 1.00 0.00 C ATOM 1930 CD1 LEU A 131 5.034 0.587 -0.945 1.00 0.00 C ATOM 1931 CD2 LEU A 131 5.294 -1.539 -2.237 1.00 0.00 C ATOM 0 H LEU A 131 8.088 -1.660 1.769 1.00 0.00 H new ATOM 0 HA LEU A 131 6.260 -3.066 0.385 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.852 -0.470 0.632 1.00 0.00 H new ATOM 0 HB3 LEU A 131 7.508 -0.701 -0.976 1.00 0.00 H new ATOM 0 HG LEU A 131 4.655 -1.377 -0.209 1.00 0.00 H new ATOM 0 HD11 LEU A 131 4.038 0.704 -1.372 1.00 0.00 H new ATOM 0 HD12 LEU A 131 5.054 1.021 0.055 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.762 1.097 -1.576 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.295 -1.392 -2.646 1.00 0.00 H new ATOM 0 HD22 LEU A 131 6.029 -1.083 -2.901 1.00 0.00 H new ATOM 0 HD23 LEU A 131 5.497 -2.606 -2.149 1.00 0.00 H new ATOM 1943 N SER A 132 6.984 -4.034 -1.790 1.00 0.00 N ATOM 1944 CA SER A 132 7.456 -4.759 -2.963 1.00 0.00 C ATOM 1945 C SER A 132 6.817 -4.210 -4.235 1.00 0.00 C ATOM 1946 O SER A 132 7.509 -3.865 -5.193 1.00 0.00 O ATOM 1947 CB SER A 132 7.146 -6.251 -2.826 1.00 0.00 C ATOM 1948 OG SER A 132 5.754 -6.470 -2.674 1.00 0.00 O ATOM 0 H SER A 132 6.010 -4.213 -1.547 1.00 0.00 H new ATOM 0 HA SER A 132 8.535 -4.624 -3.032 1.00 0.00 H new ATOM 0 HB2 SER A 132 7.507 -6.783 -3.706 1.00 0.00 H new ATOM 0 HB3 SER A 132 7.678 -6.659 -1.966 1.00 0.00 H new ATOM 0 HG SER A 132 5.392 -5.833 -2.024 1.00 0.00 H new ATOM 1954 N PHE A 133 5.490 -4.131 -4.237 1.00 0.00 N ATOM 1955 CA PHE A 133 4.756 -3.625 -5.390 1.00 0.00 C ATOM 1956 C PHE A 133 3.485 -2.902 -4.951 1.00 0.00 C ATOM 1957 O PHE A 133 2.854 -3.279 -3.964 1.00 0.00 O ATOM 1958 CB PHE A 133 4.402 -4.772 -6.339 1.00 0.00 C ATOM 1959 CG PHE A 133 3.699 -4.321 -7.588 1.00 0.00 C ATOM 1960 CD1 PHE A 133 2.351 -4.002 -7.563 1.00 0.00 C ATOM 1961 CD2 PHE A 133 4.386 -4.216 -8.786 1.00 0.00 C ATOM 1962 CE1 PHE A 133 1.701 -3.588 -8.710 1.00 0.00 C ATOM 1963 CE2 PHE A 133 3.742 -3.802 -9.937 1.00 0.00 C ATOM 1964 CZ PHE A 133 2.398 -3.487 -9.899 1.00 0.00 C ATOM 0 H PHE A 133 4.901 -4.411 -3.452 1.00 0.00 H new ATOM 0 HA PHE A 133 5.395 -2.914 -5.913 1.00 0.00 H new ATOM 0 HB2 PHE A 133 5.315 -5.299 -6.616 1.00 0.00 H new ATOM 0 HB3 PHE A 133 3.769 -5.486 -5.813 1.00 0.00 H new ATOM 0 HD1 PHE A 133 1.802 -4.078 -6.636 1.00 0.00 H new ATOM 0 HD2 PHE A 133 5.437 -4.460 -8.821 1.00 0.00 H new ATOM 0 HE1 PHE A 133 0.650 -3.344 -8.677 1.00 0.00 H new ATOM 0 HE2 PHE A 133 4.289 -3.725 -10.865 1.00 0.00 H new ATOM 0 HZ PHE A 133 1.893 -3.162 -10.797 1.00 0.00 H new ATOM 1974 N MET A 134 3.118 -1.862 -5.692 1.00 0.00 N ATOM 1975 CA MET A 134 1.923 -1.087 -5.381 1.00 0.00 C ATOM 1976 C MET A 134 1.114 -0.804 -6.642 1.00 0.00 C ATOM 1977 O MET A 134 1.673 -0.498 -7.694 1.00 0.00 O ATOM 1978 CB MET A 134 2.306 0.230 -4.701 1.00 0.00 C ATOM 1979 CG MET A 134 3.470 0.943 -5.371 1.00 0.00 C ATOM 1980 SD MET A 134 5.060 0.181 -4.995 1.00 0.00 S ATOM 1981 CE MET A 134 5.819 1.458 -3.995 1.00 0.00 C ATOM 0 H MET A 134 3.631 -1.537 -6.512 1.00 0.00 H new ATOM 0 HA MET A 134 1.307 -1.674 -4.700 1.00 0.00 H new ATOM 0 HB2 MET A 134 1.440 0.892 -4.695 1.00 0.00 H new ATOM 0 HB3 MET A 134 2.563 0.031 -3.660 1.00 0.00 H new ATOM 0 HG2 MET A 134 3.318 0.944 -6.450 1.00 0.00 H new ATOM 0 HG3 MET A 134 3.486 1.985 -5.051 1.00 0.00 H new ATOM 0 HE1 MET A 134 6.679 1.045 -3.469 1.00 0.00 H new ATOM 0 HE2 MET A 134 6.145 2.277 -4.636 1.00 0.00 H new ATOM 0 HE3 MET A 134 5.095 1.831 -3.270 1.00 0.00 H new ATOM 1991 N GLY A 135 -0.207 -0.911 -6.529 1.00 0.00 N ATOM 1992 CA GLY A 135 -1.071 -0.664 -7.669 1.00 0.00 C ATOM 1993 C GLY A 135 -2.500 -0.367 -7.259 1.00 0.00 C ATOM 1994 O GLY A 135 -2.862 -0.513 -6.092 1.00 0.00 O ATOM 0 H GLY A 135 -0.694 -1.164 -5.669 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -0.679 0.175 -8.243 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -1.058 -1.533 -8.326 1.00 0.00 H new ATOM 1998 N VAL A 136 -3.315 0.053 -8.222 1.00 0.00 N ATOM 1999 CA VAL A 136 -4.712 0.372 -7.955 1.00 0.00 C ATOM 2000 C VAL A 136 -5.644 -0.492 -8.798 1.00 0.00 C ATOM 2001 O VAL A 136 -5.345 -0.804 -9.950 1.00 0.00 O ATOM 2002 CB VAL A 136 -5.012 1.857 -8.236 1.00 0.00 C ATOM 2003 CG1 VAL A 136 -6.491 2.150 -8.034 1.00 0.00 C ATOM 2004 CG2 VAL A 136 -4.157 2.749 -7.350 1.00 0.00 C ATOM 0 H VAL A 136 -3.031 0.180 -9.194 1.00 0.00 H new ATOM 0 HA VAL A 136 -4.887 0.167 -6.899 1.00 0.00 H new ATOM 0 HB VAL A 136 -4.763 2.071 -9.275 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -6.684 3.203 -8.237 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -7.080 1.535 -8.715 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -6.770 1.921 -7.005 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -4.382 3.794 -7.561 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -4.373 2.536 -6.303 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -3.103 2.557 -7.549 1.00 0.00 H new ATOM 2014 N GLY A 137 -6.776 -0.875 -8.215 1.00 0.00 N ATOM 2015 CA GLY A 137 -7.735 -1.699 -8.927 1.00 0.00 C ATOM 2016 C GLY A 137 -8.634 -0.887 -9.838 1.00 0.00 C ATOM 2017 O GLY A 137 -8.468 0.326 -9.966 1.00 0.00 O ATOM 0 H GLY A 137 -7.046 -0.629 -7.263 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -7.202 -2.444 -9.518 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -8.348 -2.242 -8.207 1.00 0.00 H new ATOM 2021 N LYS A 138 -9.588 -1.557 -10.476 1.00 0.00 N ATOM 2022 CA LYS A 138 -10.517 -0.891 -11.381 1.00 0.00 C ATOM 2023 C LYS A 138 -11.100 0.362 -10.736 1.00 0.00 C ATOM 2024 O LYS A 138 -11.254 1.394 -11.390 1.00 0.00 O ATOM 2025 CB LYS A 138 -11.645 -1.845 -11.779 1.00 0.00 C ATOM 2026 CG LYS A 138 -11.162 -3.090 -12.502 1.00 0.00 C ATOM 2027 CD LYS A 138 -12.217 -3.626 -13.456 1.00 0.00 C ATOM 2028 CE LYS A 138 -12.143 -2.939 -14.811 1.00 0.00 C ATOM 2029 NZ LYS A 138 -13.197 -3.432 -15.740 1.00 0.00 N ATOM 0 H LYS A 138 -9.738 -2.562 -10.383 1.00 0.00 H new ATOM 0 HA LYS A 138 -9.967 -0.596 -12.275 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -12.190 -2.144 -10.883 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -12.350 -1.314 -12.419 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -10.252 -2.860 -13.056 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -10.905 -3.859 -11.773 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -12.082 -4.700 -13.583 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -13.207 -3.478 -13.025 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -12.250 -1.862 -14.679 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -11.161 -3.110 -15.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -13.113 -2.940 -16.652 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -13.080 -4.455 -15.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -14.135 -3.246 -15.331 1.00 0.00 H new ATOM 2043 N ASP A 139 -11.422 0.266 -9.451 1.00 0.00 N ATOM 2044 CA ASP A 139 -11.986 1.393 -8.717 1.00 0.00 C ATOM 2045 C ASP A 139 -10.887 2.204 -8.039 1.00 0.00 C ATOM 2046 O ASP A 139 -10.049 1.657 -7.323 1.00 0.00 O ATOM 2047 CB ASP A 139 -12.990 0.898 -7.674 1.00 0.00 C ATOM 2048 CG ASP A 139 -14.206 0.248 -8.303 1.00 0.00 C ATOM 2049 OD1 ASP A 139 -14.532 0.594 -9.458 1.00 0.00 O ATOM 2050 OD2 ASP A 139 -14.833 -0.605 -7.641 1.00 0.00 O ATOM 0 H ASP A 139 -11.302 -0.581 -8.896 1.00 0.00 H new ATOM 0 HA ASP A 139 -12.501 2.038 -9.429 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -12.500 0.182 -7.014 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -13.309 1.736 -7.055 1.00 0.00 H new ATOM 2055 N VAL A 140 -10.896 3.513 -8.271 1.00 0.00 N ATOM 2056 CA VAL A 140 -9.901 4.401 -7.683 1.00 0.00 C ATOM 2057 C VAL A 140 -9.986 4.391 -6.161 1.00 0.00 C ATOM 2058 O VAL A 140 -9.092 4.888 -5.475 1.00 0.00 O ATOM 2059 CB VAL A 140 -10.070 5.847 -8.186 1.00 0.00 C ATOM 2060 CG1 VAL A 140 -9.872 5.915 -9.692 1.00 0.00 C ATOM 2061 CG2 VAL A 140 -11.437 6.389 -7.795 1.00 0.00 C ATOM 0 H VAL A 140 -11.582 3.982 -8.863 1.00 0.00 H new ATOM 0 HA VAL A 140 -8.924 4.029 -7.992 1.00 0.00 H new ATOM 0 HB VAL A 140 -9.309 6.469 -7.715 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -9.995 6.944 -10.029 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -8.870 5.568 -9.943 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -10.609 5.281 -10.185 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -11.540 7.412 -8.158 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -12.215 5.767 -8.237 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -11.536 6.377 -6.710 1.00 0.00 H new ATOM 2071 N HIS A 141 -11.067 3.821 -5.638 1.00 0.00 N ATOM 2072 CA HIS A 141 -11.269 3.745 -4.195 1.00 0.00 C ATOM 2073 C HIS A 141 -10.661 2.465 -3.628 1.00 0.00 C ATOM 2074 O HIS A 141 -10.964 2.066 -2.504 1.00 0.00 O ATOM 2075 CB HIS A 141 -12.760 3.804 -3.864 1.00 0.00 C ATOM 2076 CG HIS A 141 -13.530 4.750 -4.734 1.00 0.00 C ATOM 2077 ND1 HIS A 141 -14.183 4.355 -5.882 1.00 0.00 N ATOM 2078 CD2 HIS A 141 -13.749 6.081 -4.616 1.00 0.00 C ATOM 2079 CE1 HIS A 141 -14.770 5.402 -6.434 1.00 0.00 C ATOM 2080 NE2 HIS A 141 -14.523 6.462 -5.685 1.00 0.00 N ATOM 0 H HIS A 141 -11.816 3.405 -6.191 1.00 0.00 H new ATOM 0 HA HIS A 141 -10.768 4.598 -3.738 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -13.185 2.805 -3.962 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -12.881 4.101 -2.822 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -13.383 6.723 -3.828 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -15.353 5.393 -7.343 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -14.853 7.409 -5.870 1.00 0.00 H new ATOM 2088 N THR A 142 -9.800 1.826 -4.414 1.00 0.00 N ATOM 2089 CA THR A 142 -9.150 0.592 -3.992 1.00 0.00 C ATOM 2090 C THR A 142 -7.634 0.704 -4.099 1.00 0.00 C ATOM 2091 O THR A 142 -7.095 0.954 -5.177 1.00 0.00 O ATOM 2092 CB THR A 142 -9.626 -0.609 -4.832 1.00 0.00 C ATOM 2093 OG1 THR A 142 -9.313 -0.395 -6.213 1.00 0.00 O ATOM 2094 CG2 THR A 142 -11.124 -0.822 -4.672 1.00 0.00 C ATOM 0 H THR A 142 -9.537 2.143 -5.347 1.00 0.00 H new ATOM 0 HA THR A 142 -9.426 0.430 -2.950 1.00 0.00 H new ATOM 0 HB THR A 142 -9.109 -1.501 -4.477 1.00 0.00 H new ATOM 0 HG1 THR A 142 -9.901 0.299 -6.578 1.00 0.00 H new ATOM 0 HG21 THR A 142 -11.437 -1.675 -5.274 1.00 0.00 H new ATOM 0 HG22 THR A 142 -11.354 -1.014 -3.624 1.00 0.00 H new ATOM 0 HG23 THR A 142 -11.656 0.070 -5.003 1.00 0.00 H new ATOM 2102 N PHE A 143 -6.950 0.515 -2.975 1.00 0.00 N ATOM 2103 CA PHE A 143 -5.495 0.596 -2.943 1.00 0.00 C ATOM 2104 C PHE A 143 -4.902 -0.576 -2.166 1.00 0.00 C ATOM 2105 O PHE A 143 -5.300 -0.849 -1.034 1.00 0.00 O ATOM 2106 CB PHE A 143 -5.049 1.917 -2.313 1.00 0.00 C ATOM 2107 CG PHE A 143 -3.567 2.003 -2.085 1.00 0.00 C ATOM 2108 CD1 PHE A 143 -2.688 2.021 -3.156 1.00 0.00 C ATOM 2109 CD2 PHE A 143 -3.053 2.066 -0.800 1.00 0.00 C ATOM 2110 CE1 PHE A 143 -1.324 2.099 -2.949 1.00 0.00 C ATOM 2111 CE2 PHE A 143 -1.690 2.145 -0.587 1.00 0.00 C ATOM 2112 CZ PHE A 143 -0.824 2.162 -1.663 1.00 0.00 C ATOM 0 H PHE A 143 -7.381 0.305 -2.075 1.00 0.00 H new ATOM 0 HA PHE A 143 -5.132 0.550 -3.970 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -5.358 2.740 -2.958 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -5.563 2.048 -1.361 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -3.073 1.974 -4.164 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -3.725 2.053 0.045 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -0.649 2.111 -3.792 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -1.302 2.193 0.420 1.00 0.00 H new ATOM 0 HZ PHE A 143 0.242 2.224 -1.499 1.00 0.00 H new ATOM 2122 N ALA A 144 -3.949 -1.267 -2.784 1.00 0.00 N ATOM 2123 CA ALA A 144 -3.301 -2.408 -2.151 1.00 0.00 C ATOM 2124 C ALA A 144 -1.788 -2.351 -2.333 1.00 0.00 C ATOM 2125 O ALA A 144 -1.292 -1.836 -3.336 1.00 0.00 O ATOM 2126 CB ALA A 144 -3.853 -3.709 -2.715 1.00 0.00 C ATOM 0 H ALA A 144 -3.609 -1.056 -3.722 1.00 0.00 H new ATOM 0 HA ALA A 144 -3.514 -2.368 -1.083 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -3.360 -4.553 -2.233 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -4.926 -3.761 -2.528 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -3.670 -3.747 -3.789 1.00 0.00 H new ATOM 2132 N PHE A 145 -1.058 -2.882 -1.357 1.00 0.00 N ATOM 2133 CA PHE A 145 0.399 -2.889 -1.410 1.00 0.00 C ATOM 2134 C PHE A 145 0.960 -4.148 -0.755 1.00 0.00 C ATOM 2135 O PHE A 145 0.544 -4.529 0.340 1.00 0.00 O ATOM 2136 CB PHE A 145 0.962 -1.646 -0.717 1.00 0.00 C ATOM 2137 CG PHE A 145 0.821 -1.677 0.778 1.00 0.00 C ATOM 2138 CD1 PHE A 145 1.606 -2.525 1.543 1.00 0.00 C ATOM 2139 CD2 PHE A 145 -0.096 -0.860 1.418 1.00 0.00 C ATOM 2140 CE1 PHE A 145 1.480 -2.556 2.919 1.00 0.00 C ATOM 2141 CE2 PHE A 145 -0.227 -0.886 2.794 1.00 0.00 C ATOM 2142 CZ PHE A 145 0.561 -1.736 3.545 1.00 0.00 C ATOM 0 H PHE A 145 -1.452 -3.313 -0.520 1.00 0.00 H new ATOM 0 HA PHE A 145 0.700 -2.880 -2.458 1.00 0.00 H new ATOM 0 HB2 PHE A 145 2.017 -1.544 -0.972 1.00 0.00 H new ATOM 0 HB3 PHE A 145 0.454 -0.763 -1.104 1.00 0.00 H new ATOM 0 HD1 PHE A 145 2.325 -3.169 1.058 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -0.716 -0.195 0.835 1.00 0.00 H new ATOM 0 HE1 PHE A 145 2.099 -3.220 3.504 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -0.945 -0.242 3.281 1.00 0.00 H new ATOM 0 HZ PHE A 145 0.459 -1.760 4.620 1.00 0.00 H new ATOM 2152 N ILE A 146 1.907 -4.788 -1.432 1.00 0.00 N ATOM 2153 CA ILE A 146 2.526 -6.003 -0.917 1.00 0.00 C ATOM 2154 C ILE A 146 3.827 -5.690 -0.186 1.00 0.00 C ATOM 2155 O ILE A 146 4.643 -4.901 -0.661 1.00 0.00 O ATOM 2156 CB ILE A 146 2.814 -7.011 -2.045 1.00 0.00 C ATOM 2157 CG1 ILE A 146 1.519 -7.377 -2.774 1.00 0.00 C ATOM 2158 CG2 ILE A 146 3.483 -8.257 -1.485 1.00 0.00 C ATOM 2159 CD1 ILE A 146 1.747 -7.997 -4.135 1.00 0.00 C ATOM 0 H ILE A 146 2.263 -4.485 -2.339 1.00 0.00 H new ATOM 0 HA ILE A 146 1.816 -6.446 -0.218 1.00 0.00 H new ATOM 0 HB ILE A 146 3.494 -6.548 -2.760 1.00 0.00 H new ATOM 0 HG12 ILE A 146 0.949 -8.072 -2.158 1.00 0.00 H new ATOM 0 HG13 ILE A 146 0.910 -6.480 -2.889 1.00 0.00 H new ATOM 0 HG21 ILE A 146 3.680 -8.959 -2.295 1.00 0.00 H new ATOM 0 HG22 ILE A 146 4.423 -7.982 -1.007 1.00 0.00 H new ATOM 0 HG23 ILE A 146 2.826 -8.724 -0.751 1.00 0.00 H new ATOM 0 HD11 ILE A 146 0.786 -8.231 -4.594 1.00 0.00 H new ATOM 0 HD12 ILE A 146 2.290 -7.295 -4.768 1.00 0.00 H new ATOM 0 HD13 ILE A 146 2.329 -8.912 -4.025 1.00 0.00 H new ATOM 2171 N MET A 147 4.014 -6.315 0.972 1.00 0.00 N ATOM 2172 CA MET A 147 5.219 -6.105 1.767 1.00 0.00 C ATOM 2173 C MET A 147 5.918 -7.429 2.054 1.00 0.00 C ATOM 2174 O MET A 147 5.309 -8.495 1.969 1.00 0.00 O ATOM 2175 CB MET A 147 4.872 -5.403 3.081 1.00 0.00 C ATOM 2176 CG MET A 147 4.154 -6.298 4.078 1.00 0.00 C ATOM 2177 SD MET A 147 3.248 -5.363 5.325 1.00 0.00 S ATOM 2178 CE MET A 147 4.358 -5.501 6.724 1.00 0.00 C ATOM 0 H MET A 147 3.348 -6.970 1.381 1.00 0.00 H new ATOM 0 HA MET A 147 5.897 -5.473 1.194 1.00 0.00 H new ATOM 0 HB2 MET A 147 5.789 -5.028 3.536 1.00 0.00 H new ATOM 0 HB3 MET A 147 4.246 -4.537 2.866 1.00 0.00 H new ATOM 0 HG2 MET A 147 3.462 -6.948 3.543 1.00 0.00 H new ATOM 0 HG3 MET A 147 4.882 -6.943 4.571 1.00 0.00 H new ATOM 0 HE1 MET A 147 4.115 -4.733 7.458 1.00 0.00 H new ATOM 0 HE2 MET A 147 4.249 -6.485 7.179 1.00 0.00 H new ATOM 0 HE3 MET A 147 5.386 -5.369 6.387 1.00 0.00 H new ATOM 2188 N ASP A 148 7.201 -7.354 2.393 1.00 0.00 N ATOM 2189 CA ASP A 148 7.983 -8.548 2.694 1.00 0.00 C ATOM 2190 C ASP A 148 8.017 -8.811 4.196 1.00 0.00 C ATOM 2191 O ASP A 148 8.575 -8.026 4.963 1.00 0.00 O ATOM 2192 CB ASP A 148 9.407 -8.398 2.157 1.00 0.00 C ATOM 2193 CG ASP A 148 10.333 -9.488 2.660 1.00 0.00 C ATOM 2194 OD1 ASP A 148 10.588 -9.531 3.882 1.00 0.00 O ATOM 2195 OD2 ASP A 148 10.804 -10.297 1.833 1.00 0.00 O ATOM 0 H ASP A 148 7.721 -6.480 2.466 1.00 0.00 H new ATOM 0 HA ASP A 148 7.506 -9.398 2.206 1.00 0.00 H new ATOM 0 HB2 ASP A 148 9.385 -8.418 1.067 1.00 0.00 H new ATOM 0 HB3 ASP A 148 9.802 -7.425 2.450 1.00 0.00 H new ATOM 2200 N THR A 149 7.416 -9.922 4.611 1.00 0.00 N ATOM 2201 CA THR A 149 7.376 -10.289 6.021 1.00 0.00 C ATOM 2202 C THR A 149 8.534 -11.212 6.382 1.00 0.00 C ATOM 2203 O THR A 149 9.169 -11.049 7.424 1.00 0.00 O ATOM 2204 CB THR A 149 6.049 -10.982 6.383 1.00 0.00 C ATOM 2205 OG1 THR A 149 5.856 -12.134 5.555 1.00 0.00 O ATOM 2206 CG2 THR A 149 4.877 -10.028 6.216 1.00 0.00 C ATOM 0 H THR A 149 6.950 -10.583 3.990 1.00 0.00 H new ATOM 0 HA THR A 149 7.462 -9.364 6.591 1.00 0.00 H new ATOM 0 HB THR A 149 6.099 -11.291 7.427 1.00 0.00 H new ATOM 0 HG1 THR A 149 5.011 -12.570 5.793 1.00 0.00 H new ATOM 0 HG21 THR A 149 3.951 -10.540 6.477 1.00 0.00 H new ATOM 0 HG22 THR A 149 5.013 -9.167 6.870 1.00 0.00 H new ATOM 0 HG23 THR A 149 4.826 -9.692 5.180 1.00 0.00 H new ATOM 2214 N GLY A 150 8.805 -12.182 5.514 1.00 0.00 N ATOM 2215 CA GLY A 150 9.887 -13.117 5.761 1.00 0.00 C ATOM 2216 C GLY A 150 10.811 -13.262 4.567 1.00 0.00 C ATOM 2217 O GLY A 150 11.310 -12.271 4.037 1.00 0.00 O ATOM 0 H GLY A 150 8.295 -12.337 4.645 1.00 0.00 H new ATOM 0 HA2 GLY A 150 10.463 -12.782 6.624 1.00 0.00 H new ATOM 0 HA3 GLY A 150 9.470 -14.092 6.015 1.00 0.00 H new ATOM 2221 N ASN A 151 11.040 -14.501 4.146 1.00 0.00 N ATOM 2222 CA ASN A 151 11.912 -14.772 3.009 1.00 0.00 C ATOM 2223 C ASN A 151 11.113 -14.823 1.710 1.00 0.00 C ATOM 2224 O ASN A 151 11.310 -13.999 0.817 1.00 0.00 O ATOM 2225 CB ASN A 151 12.657 -16.093 3.214 1.00 0.00 C ATOM 2226 CG ASN A 151 13.679 -16.013 4.331 1.00 0.00 C ATOM 2227 OD1 ASN A 151 14.750 -15.430 4.166 1.00 0.00 O ATOM 2228 ND2 ASN A 151 13.352 -16.601 5.476 1.00 0.00 N ATOM 0 H ASN A 151 10.634 -15.333 4.575 1.00 0.00 H new ATOM 0 HA ASN A 151 12.637 -13.961 2.938 1.00 0.00 H new ATOM 0 HB2 ASN A 151 11.938 -16.881 3.439 1.00 0.00 H new ATOM 0 HB3 ASN A 151 13.157 -16.372 2.287 1.00 0.00 H new ATOM 0 HD21 ASN A 151 14.000 -16.580 6.263 1.00 0.00 H new ATOM 0 HD22 ASN A 151 12.453 -17.073 5.568 1.00 0.00 H new ATOM 2235 N GLN A 152 10.212 -15.794 1.613 1.00 0.00 N ATOM 2236 CA GLN A 152 9.383 -15.952 0.424 1.00 0.00 C ATOM 2237 C GLN A 152 7.913 -15.709 0.749 1.00 0.00 C ATOM 2238 O GLN A 152 7.025 -16.152 0.020 1.00 0.00 O ATOM 2239 CB GLN A 152 9.563 -17.351 -0.167 1.00 0.00 C ATOM 2240 CG GLN A 152 10.922 -17.568 -0.814 1.00 0.00 C ATOM 2241 CD GLN A 152 11.358 -19.020 -0.783 1.00 0.00 C ATOM 2242 OE1 GLN A 152 11.607 -19.628 -1.824 1.00 0.00 O ATOM 2243 NE2 GLN A 152 11.453 -19.583 0.416 1.00 0.00 N ATOM 0 H GLN A 152 10.037 -16.484 2.344 1.00 0.00 H new ATOM 0 HA GLN A 152 9.701 -15.212 -0.310 1.00 0.00 H new ATOM 0 HB2 GLN A 152 9.423 -18.090 0.622 1.00 0.00 H new ATOM 0 HB3 GLN A 152 8.784 -17.526 -0.909 1.00 0.00 H new ATOM 0 HG2 GLN A 152 10.887 -17.225 -1.848 1.00 0.00 H new ATOM 0 HG3 GLN A 152 11.666 -16.958 -0.301 1.00 0.00 H new ATOM 0 HE21 GLN A 152 11.237 -19.041 1.253 1.00 0.00 H new ATOM 0 HE22 GLN A 152 11.742 -20.557 0.500 1.00 0.00 H new ATOM 2252 N ARG A 153 7.663 -15.004 1.847 1.00 0.00 N ATOM 2253 CA ARG A 153 6.300 -14.704 2.269 1.00 0.00 C ATOM 2254 C ARG A 153 5.904 -13.287 1.862 1.00 0.00 C ATOM 2255 O ARG A 153 6.604 -12.323 2.172 1.00 0.00 O ATOM 2256 CB ARG A 153 6.165 -14.868 3.784 1.00 0.00 C ATOM 2257 CG ARG A 153 5.906 -16.300 4.221 1.00 0.00 C ATOM 2258 CD ARG A 153 4.458 -16.701 3.984 1.00 0.00 C ATOM 2259 NE ARG A 153 4.311 -18.143 3.810 1.00 0.00 N ATOM 2260 CZ ARG A 153 3.239 -18.713 3.270 1.00 0.00 C ATOM 2261 NH1 ARG A 153 2.226 -17.966 2.854 1.00 0.00 N ATOM 2262 NH2 ARG A 153 3.180 -20.033 3.144 1.00 0.00 N ATOM 0 H ARG A 153 8.387 -14.630 2.461 1.00 0.00 H new ATOM 0 HA ARG A 153 5.630 -15.406 1.773 1.00 0.00 H new ATOM 0 HB2 ARG A 153 7.077 -14.510 4.262 1.00 0.00 H new ATOM 0 HB3 ARG A 153 5.351 -14.236 4.138 1.00 0.00 H new ATOM 0 HG2 ARG A 153 6.566 -16.974 3.674 1.00 0.00 H new ATOM 0 HG3 ARG A 153 6.146 -16.408 5.279 1.00 0.00 H new ATOM 0 HD2 ARG A 153 3.849 -16.374 4.826 1.00 0.00 H new ATOM 0 HD3 ARG A 153 4.080 -16.189 3.099 1.00 0.00 H new ATOM 0 HE ARG A 153 5.073 -18.746 4.120 1.00 0.00 H new ATOM 0 HH11 ARG A 153 2.268 -16.951 2.948 1.00 0.00 H new ATOM 0 HH12 ARG A 153 1.404 -18.406 2.440 1.00 0.00 H new ATOM 0 HH21 ARG A 153 3.958 -20.611 3.462 1.00 0.00 H new ATOM 0 HH22 ARG A 153 2.357 -20.469 2.729 1.00 0.00 H new ATOM 2276 N PHE A 154 4.778 -13.170 1.166 1.00 0.00 N ATOM 2277 CA PHE A 154 4.290 -11.872 0.716 1.00 0.00 C ATOM 2278 C PHE A 154 2.858 -11.636 1.187 1.00 0.00 C ATOM 2279 O PHE A 154 1.968 -12.446 0.930 1.00 0.00 O ATOM 2280 CB PHE A 154 4.358 -11.779 -0.810 1.00 0.00 C ATOM 2281 CG PHE A 154 5.510 -12.537 -1.406 1.00 0.00 C ATOM 2282 CD1 PHE A 154 6.814 -12.240 -1.041 1.00 0.00 C ATOM 2283 CD2 PHE A 154 5.290 -13.545 -2.330 1.00 0.00 C ATOM 2284 CE1 PHE A 154 7.876 -12.935 -1.588 1.00 0.00 C ATOM 2285 CE2 PHE A 154 6.348 -14.244 -2.880 1.00 0.00 C ATOM 2286 CZ PHE A 154 7.643 -13.939 -2.508 1.00 0.00 C ATOM 0 H PHE A 154 4.187 -13.958 0.902 1.00 0.00 H new ATOM 0 HA PHE A 154 4.928 -11.102 1.149 1.00 0.00 H new ATOM 0 HB2 PHE A 154 3.427 -12.159 -1.231 1.00 0.00 H new ATOM 0 HB3 PHE A 154 4.435 -10.731 -1.099 1.00 0.00 H new ATOM 0 HD1 PHE A 154 7.002 -11.457 -0.321 1.00 0.00 H new ATOM 0 HD2 PHE A 154 4.280 -13.788 -2.624 1.00 0.00 H new ATOM 0 HE1 PHE A 154 8.887 -12.693 -1.296 1.00 0.00 H new ATOM 0 HE2 PHE A 154 6.163 -15.028 -3.600 1.00 0.00 H new ATOM 0 HZ PHE A 154 8.471 -14.484 -2.935 1.00 0.00 H new ATOM 2296 N GLU A 155 2.645 -10.522 1.880 1.00 0.00 N ATOM 2297 CA GLU A 155 1.322 -10.180 2.388 1.00 0.00 C ATOM 2298 C GLU A 155 0.767 -8.949 1.678 1.00 0.00 C ATOM 2299 O GLU A 155 1.349 -7.865 1.746 1.00 0.00 O ATOM 2300 CB GLU A 155 1.380 -9.929 3.897 1.00 0.00 C ATOM 2301 CG GLU A 155 1.249 -11.193 4.730 1.00 0.00 C ATOM 2302 CD GLU A 155 1.086 -10.903 6.209 1.00 0.00 C ATOM 2303 OE1 GLU A 155 1.395 -9.767 6.628 1.00 0.00 O ATOM 2304 OE2 GLU A 155 0.651 -11.810 6.948 1.00 0.00 O ATOM 0 H GLU A 155 3.371 -9.841 2.102 1.00 0.00 H new ATOM 0 HA GLU A 155 0.657 -11.021 2.192 1.00 0.00 H new ATOM 0 HB2 GLU A 155 2.324 -9.440 4.139 1.00 0.00 H new ATOM 0 HB3 GLU A 155 0.583 -9.238 4.173 1.00 0.00 H new ATOM 0 HG2 GLU A 155 0.391 -11.767 4.380 1.00 0.00 H new ATOM 0 HG3 GLU A 155 2.132 -11.815 4.581 1.00 0.00 H new ATOM 2311 N CYS A 156 -0.360 -9.124 0.997 1.00 0.00 N ATOM 2312 CA CYS A 156 -0.994 -8.028 0.273 1.00 0.00 C ATOM 2313 C CYS A 156 -2.179 -7.472 1.055 1.00 0.00 C ATOM 2314 O CYS A 156 -3.191 -8.151 1.234 1.00 0.00 O ATOM 2315 CB CYS A 156 -1.454 -8.500 -1.107 1.00 0.00 C ATOM 2316 SG CYS A 156 -1.580 -7.179 -2.335 1.00 0.00 S ATOM 0 H CYS A 156 -0.853 -10.014 0.931 1.00 0.00 H new ATOM 0 HA CYS A 156 -0.259 -7.233 0.151 1.00 0.00 H new ATOM 0 HB2 CYS A 156 -0.758 -9.255 -1.472 1.00 0.00 H new ATOM 0 HB3 CYS A 156 -2.426 -8.984 -1.008 1.00 0.00 H new ATOM 0 HG CYS A 156 -1.974 -7.677 -3.469 1.00 0.00 H new ATOM 2322 N HIS A 157 -2.047 -6.234 1.521 1.00 0.00 N ATOM 2323 CA HIS A 157 -3.107 -5.588 2.285 1.00 0.00 C ATOM 2324 C HIS A 157 -3.868 -4.587 1.420 1.00 0.00 C ATOM 2325 O HIS A 157 -3.267 -3.760 0.736 1.00 0.00 O ATOM 2326 CB HIS A 157 -2.524 -4.881 3.509 1.00 0.00 C ATOM 2327 CG HIS A 157 -1.927 -5.818 4.514 1.00 0.00 C ATOM 2328 ND1 HIS A 157 -2.617 -6.281 5.615 1.00 0.00 N ATOM 2329 CD2 HIS A 157 -0.698 -6.381 4.579 1.00 0.00 C ATOM 2330 CE1 HIS A 157 -1.837 -7.086 6.314 1.00 0.00 C ATOM 2331 NE2 HIS A 157 -0.667 -7.164 5.706 1.00 0.00 N ATOM 0 H HIS A 157 -1.216 -5.659 1.383 1.00 0.00 H new ATOM 0 HA HIS A 157 -3.803 -6.358 2.616 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -1.759 -4.177 3.182 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -3.309 -4.298 3.990 1.00 0.00 H new ATOM 0 HD2 HIS A 157 0.109 -6.240 3.875 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -2.110 -7.594 7.227 1.00 0.00 H new ATOM 0 HE2 HIS A 157 0.130 -7.716 6.022 1.00 0.00 H new ATOM 2339 N VAL A 158 -5.194 -4.670 1.456 1.00 0.00 N ATOM 2340 CA VAL A 158 -6.038 -3.772 0.676 1.00 0.00 C ATOM 2341 C VAL A 158 -6.662 -2.698 1.560 1.00 0.00 C ATOM 2342 O VAL A 158 -6.938 -2.931 2.737 1.00 0.00 O ATOM 2343 CB VAL A 158 -7.158 -4.542 -0.047 1.00 0.00 C ATOM 2344 CG1 VAL A 158 -7.958 -3.606 -0.941 1.00 0.00 C ATOM 2345 CG2 VAL A 158 -6.578 -5.695 -0.852 1.00 0.00 C ATOM 0 H VAL A 158 -5.707 -5.350 2.017 1.00 0.00 H new ATOM 0 HA VAL A 158 -5.396 -3.298 -0.066 1.00 0.00 H new ATOM 0 HB VAL A 158 -7.833 -4.956 0.702 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -8.745 -4.168 -1.444 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -8.405 -2.818 -0.335 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -7.298 -3.161 -1.685 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -7.384 -6.228 -1.356 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -5.880 -5.306 -1.594 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -6.054 -6.378 -0.184 1.00 0.00 H new ATOM 2355 N PHE A 159 -6.883 -1.521 0.985 1.00 0.00 N ATOM 2356 CA PHE A 159 -7.476 -0.410 1.721 1.00 0.00 C ATOM 2357 C PHE A 159 -8.357 0.438 0.809 1.00 0.00 C ATOM 2358 O PHE A 159 -8.008 0.698 -0.343 1.00 0.00 O ATOM 2359 CB PHE A 159 -6.380 0.459 2.343 1.00 0.00 C ATOM 2360 CG PHE A 159 -5.431 -0.308 3.219 1.00 0.00 C ATOM 2361 CD1 PHE A 159 -4.384 -1.026 2.665 1.00 0.00 C ATOM 2362 CD2 PHE A 159 -5.587 -0.310 4.595 1.00 0.00 C ATOM 2363 CE1 PHE A 159 -3.509 -1.733 3.468 1.00 0.00 C ATOM 2364 CE2 PHE A 159 -4.715 -1.015 5.404 1.00 0.00 C ATOM 2365 CZ PHE A 159 -3.675 -1.728 4.839 1.00 0.00 C ATOM 0 H PHE A 159 -6.661 -1.311 0.012 1.00 0.00 H new ATOM 0 HA PHE A 159 -8.098 -0.823 2.515 1.00 0.00 H new ATOM 0 HB2 PHE A 159 -5.815 0.943 1.546 1.00 0.00 H new ATOM 0 HB3 PHE A 159 -6.845 1.251 2.931 1.00 0.00 H new ATOM 0 HD1 PHE A 159 -4.250 -1.033 1.593 1.00 0.00 H new ATOM 0 HD2 PHE A 159 -6.399 0.245 5.041 1.00 0.00 H new ATOM 0 HE1 PHE A 159 -2.696 -2.289 3.024 1.00 0.00 H new ATOM 0 HE2 PHE A 159 -4.847 -1.008 6.476 1.00 0.00 H new ATOM 0 HZ PHE A 159 -2.993 -2.280 5.468 1.00 0.00 H new ATOM 2375 N TRP A 160 -9.500 0.866 1.332 1.00 0.00 N ATOM 2376 CA TRP A 160 -10.433 1.684 0.565 1.00 0.00 C ATOM 2377 C TRP A 160 -10.188 3.168 0.816 1.00 0.00 C ATOM 2378 O TRP A 160 -10.252 3.633 1.954 1.00 0.00 O ATOM 2379 CB TRP A 160 -11.875 1.324 0.925 1.00 0.00 C ATOM 2380 CG TRP A 160 -12.892 2.034 0.084 1.00 0.00 C ATOM 2381 CD1 TRP A 160 -13.439 3.262 0.322 1.00 0.00 C ATOM 2382 CD2 TRP A 160 -13.485 1.556 -1.128 1.00 0.00 C ATOM 2383 NE1 TRP A 160 -14.337 3.577 -0.669 1.00 0.00 N ATOM 2384 CE2 TRP A 160 -14.383 2.548 -1.572 1.00 0.00 C ATOM 2385 CE3 TRP A 160 -13.344 0.389 -1.884 1.00 0.00 C ATOM 2386 CZ2 TRP A 160 -15.134 2.405 -2.735 1.00 0.00 C ATOM 2387 CZ3 TRP A 160 -14.091 0.249 -3.038 1.00 0.00 C ATOM 2388 CH2 TRP A 160 -14.976 1.252 -3.455 1.00 0.00 C ATOM 0 H TRP A 160 -9.803 0.660 2.284 1.00 0.00 H new ATOM 0 HA TRP A 160 -10.270 1.482 -0.494 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -12.011 0.248 0.816 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -12.051 1.563 1.974 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -13.201 3.893 1.165 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -14.881 4.438 -0.723 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -12.663 -0.389 -1.572 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -15.817 3.177 -3.058 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -13.991 -0.649 -3.629 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -15.545 1.112 -4.362 1.00 0.00 H new ATOM 2399 N CYS A 161 -9.910 3.906 -0.253 1.00 0.00 N ATOM 2400 CA CYS A 161 -9.655 5.338 -0.148 1.00 0.00 C ATOM 2401 C CYS A 161 -10.810 6.141 -0.738 1.00 0.00 C ATOM 2402 O CYS A 161 -11.614 5.614 -1.507 1.00 0.00 O ATOM 2403 CB CYS A 161 -8.351 5.699 -0.860 1.00 0.00 C ATOM 2404 SG CYS A 161 -7.044 4.463 -0.678 1.00 0.00 S ATOM 0 H CYS A 161 -9.855 3.536 -1.202 1.00 0.00 H new ATOM 0 HA CYS A 161 -9.565 5.589 0.909 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -8.556 5.842 -1.921 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -7.991 6.653 -0.474 1.00 0.00 H new ATOM 0 HG CYS A 161 -5.982 4.857 -1.317 1.00 0.00 H new ATOM 2410 N GLU A 162 -10.885 7.416 -0.373 1.00 0.00 N ATOM 2411 CA GLU A 162 -11.944 8.290 -0.865 1.00 0.00 C ATOM 2412 C GLU A 162 -11.561 9.758 -0.696 1.00 0.00 C ATOM 2413 O GLU A 162 -10.793 10.126 0.193 1.00 0.00 O ATOM 2414 CB GLU A 162 -13.254 8.006 -0.128 1.00 0.00 C ATOM 2415 CG GLU A 162 -13.913 6.699 -0.539 1.00 0.00 C ATOM 2416 CD GLU A 162 -15.381 6.643 -0.166 1.00 0.00 C ATOM 2417 OE1 GLU A 162 -15.682 6.457 1.032 1.00 0.00 O ATOM 2418 OE2 GLU A 162 -16.230 6.785 -1.071 1.00 0.00 O ATOM 0 H GLU A 162 -10.226 7.867 0.261 1.00 0.00 H new ATOM 0 HA GLU A 162 -12.082 8.088 -1.927 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -13.060 7.984 0.944 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -13.949 8.826 -0.310 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -13.811 6.568 -1.616 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -13.390 5.868 -0.066 1.00 0.00 H new ATOM 2425 N PRO A 163 -12.108 10.616 -1.570 1.00 0.00 N ATOM 2426 CA PRO A 163 -13.023 10.188 -2.632 1.00 0.00 C ATOM 2427 C PRO A 163 -12.316 9.382 -3.717 1.00 0.00 C ATOM 2428 O PRO A 163 -12.940 8.940 -4.680 1.00 0.00 O ATOM 2429 CB PRO A 163 -13.546 11.509 -3.203 1.00 0.00 C ATOM 2430 CG PRO A 163 -12.480 12.503 -2.894 1.00 0.00 C ATOM 2431 CD PRO A 163 -11.875 12.070 -1.588 1.00 0.00 C ATOM 0 HA PRO A 163 -13.806 9.531 -2.255 1.00 0.00 H new ATOM 0 HB2 PRO A 163 -13.719 11.435 -4.277 1.00 0.00 H new ATOM 0 HB3 PRO A 163 -14.494 11.790 -2.745 1.00 0.00 H new ATOM 0 HG2 PRO A 163 -11.728 12.527 -3.683 1.00 0.00 H new ATOM 0 HG3 PRO A 163 -12.894 13.508 -2.818 1.00 0.00 H new ATOM 0 HD2 PRO A 163 -10.812 12.307 -1.539 1.00 0.00 H new ATOM 0 HD3 PRO A 163 -12.351 12.564 -0.741 1.00 0.00 H new ATOM 2439 N ASN A 164 -11.011 9.195 -3.552 1.00 0.00 N ATOM 2440 CA ASN A 164 -10.219 8.442 -4.518 1.00 0.00 C ATOM 2441 C ASN A 164 -8.853 8.083 -3.940 1.00 0.00 C ATOM 2442 O ASN A 164 -8.408 8.677 -2.958 1.00 0.00 O ATOM 2443 CB ASN A 164 -10.044 9.249 -5.806 1.00 0.00 C ATOM 2444 CG ASN A 164 -9.222 10.505 -5.594 1.00 0.00 C ATOM 2445 OD1 ASN A 164 -8.901 10.867 -4.461 1.00 0.00 O ATOM 2446 ND2 ASN A 164 -8.876 11.177 -6.686 1.00 0.00 N ATOM 0 H ASN A 164 -10.479 9.554 -2.759 1.00 0.00 H new ATOM 0 HA ASN A 164 -10.752 7.519 -4.745 1.00 0.00 H new ATOM 0 HB2 ASN A 164 -9.562 8.626 -6.559 1.00 0.00 H new ATOM 0 HB3 ASN A 164 -11.024 9.521 -6.197 1.00 0.00 H new ATOM 0 HD21 ASN A 164 -8.322 12.030 -6.606 1.00 0.00 H new ATOM 0 HD22 ASN A 164 -9.164 10.840 -7.605 1.00 0.00 H new ATOM 2453 N ALA A 165 -8.193 7.109 -4.558 1.00 0.00 N ATOM 2454 CA ALA A 165 -6.877 6.673 -4.107 1.00 0.00 C ATOM 2455 C ALA A 165 -5.770 7.426 -4.836 1.00 0.00 C ATOM 2456 O ALA A 165 -4.680 6.895 -5.048 1.00 0.00 O ATOM 2457 CB ALA A 165 -6.720 5.174 -4.309 1.00 0.00 C ATOM 0 H ALA A 165 -8.548 6.607 -5.372 1.00 0.00 H new ATOM 0 HA ALA A 165 -6.792 6.896 -3.043 1.00 0.00 H new ATOM 0 HB1 ALA A 165 -5.733 4.862 -3.968 1.00 0.00 H new ATOM 0 HB2 ALA A 165 -7.484 4.648 -3.737 1.00 0.00 H new ATOM 0 HB3 ALA A 165 -6.830 4.936 -5.367 1.00 0.00 H new ATOM 2463 N ALA A 166 -6.057 8.666 -5.220 1.00 0.00 N ATOM 2464 CA ALA A 166 -5.084 9.492 -5.925 1.00 0.00 C ATOM 2465 C ALA A 166 -4.069 10.090 -4.958 1.00 0.00 C ATOM 2466 O ALA A 166 -2.864 10.043 -5.200 1.00 0.00 O ATOM 2467 CB ALA A 166 -5.791 10.594 -6.700 1.00 0.00 C ATOM 0 H ALA A 166 -6.955 9.120 -5.055 1.00 0.00 H new ATOM 0 HA ALA A 166 -4.546 8.856 -6.628 1.00 0.00 H new ATOM 0 HB1 ALA A 166 -5.053 11.203 -7.222 1.00 0.00 H new ATOM 0 HB2 ALA A 166 -6.472 10.149 -7.425 1.00 0.00 H new ATOM 0 HB3 ALA A 166 -6.355 11.220 -6.009 1.00 0.00 H new ATOM 2473 N ASN A 167 -4.564 10.654 -3.861 1.00 0.00 N ATOM 2474 CA ASN A 167 -3.699 11.264 -2.857 1.00 0.00 C ATOM 2475 C ASN A 167 -2.844 10.209 -2.163 1.00 0.00 C ATOM 2476 O ASN A 167 -1.643 10.397 -1.967 1.00 0.00 O ATOM 2477 CB ASN A 167 -4.536 12.020 -1.823 1.00 0.00 C ATOM 2478 CG ASN A 167 -5.044 13.348 -2.350 1.00 0.00 C ATOM 2479 OD1 ASN A 167 -4.261 14.245 -2.662 1.00 0.00 O ATOM 2480 ND2 ASN A 167 -6.362 13.480 -2.450 1.00 0.00 N ATOM 0 H ASN A 167 -5.560 10.701 -3.645 1.00 0.00 H new ATOM 0 HA ASN A 167 -3.037 11.967 -3.363 1.00 0.00 H new ATOM 0 HB2 ASN A 167 -5.383 11.403 -1.524 1.00 0.00 H new ATOM 0 HB3 ASN A 167 -3.936 12.192 -0.930 1.00 0.00 H new ATOM 0 HD21 ASN A 167 -6.762 14.352 -2.797 1.00 0.00 H new ATOM 0 HD22 ASN A 167 -6.974 12.710 -2.180 1.00 0.00 H new ATOM 2487 N VAL A 168 -3.471 9.096 -1.793 1.00 0.00 N ATOM 2488 CA VAL A 168 -2.768 8.009 -1.122 1.00 0.00 C ATOM 2489 C VAL A 168 -1.764 7.344 -2.057 1.00 0.00 C ATOM 2490 O VAL A 168 -0.555 7.532 -1.921 1.00 0.00 O ATOM 2491 CB VAL A 168 -3.750 6.944 -0.599 1.00 0.00 C ATOM 2492 CG1 VAL A 168 -2.994 5.781 0.024 1.00 0.00 C ATOM 2493 CG2 VAL A 168 -4.718 7.558 0.401 1.00 0.00 C ATOM 0 H VAL A 168 -4.465 8.924 -1.947 1.00 0.00 H new ATOM 0 HA VAL A 168 -2.237 8.449 -0.278 1.00 0.00 H new ATOM 0 HB VAL A 168 -4.327 6.562 -1.441 1.00 0.00 H new ATOM 0 HG11 VAL A 168 -3.704 5.039 0.388 1.00 0.00 H new ATOM 0 HG12 VAL A 168 -2.345 5.326 -0.724 1.00 0.00 H new ATOM 0 HG13 VAL A 168 -2.390 6.143 0.856 1.00 0.00 H new ATOM 0 HG21 VAL A 168 -5.405 6.792 0.760 1.00 0.00 H new ATOM 0 HG22 VAL A 168 -4.160 7.969 1.242 1.00 0.00 H new ATOM 0 HG23 VAL A 168 -5.284 8.354 -0.082 1.00 0.00 H new ATOM 2503 N SER A 169 -2.274 6.567 -3.007 1.00 0.00 N ATOM 2504 CA SER A 169 -1.421 5.870 -3.963 1.00 0.00 C ATOM 2505 C SER A 169 -0.193 6.707 -4.307 1.00 0.00 C ATOM 2506 O SER A 169 0.892 6.172 -4.533 1.00 0.00 O ATOM 2507 CB SER A 169 -2.206 5.548 -5.237 1.00 0.00 C ATOM 2508 OG SER A 169 -2.272 6.675 -6.093 1.00 0.00 O ATOM 0 H SER A 169 -3.273 6.404 -3.135 1.00 0.00 H new ATOM 0 HA SER A 169 -1.087 4.939 -3.504 1.00 0.00 H new ATOM 0 HB2 SER A 169 -1.732 4.717 -5.760 1.00 0.00 H new ATOM 0 HB3 SER A 169 -3.214 5.226 -4.975 1.00 0.00 H new ATOM 0 HG SER A 169 -3.145 7.109 -5.995 1.00 0.00 H new ATOM 2514 N GLU A 170 -0.373 8.024 -4.344 1.00 0.00 N ATOM 2515 CA GLU A 170 0.720 8.935 -4.660 1.00 0.00 C ATOM 2516 C GLU A 170 1.630 9.133 -3.452 1.00 0.00 C ATOM 2517 O GLU A 170 2.846 8.964 -3.542 1.00 0.00 O ATOM 2518 CB GLU A 170 0.170 10.285 -5.125 1.00 0.00 C ATOM 2519 CG GLU A 170 1.248 11.318 -5.406 1.00 0.00 C ATOM 2520 CD GLU A 170 1.824 11.196 -6.803 1.00 0.00 C ATOM 2521 OE1 GLU A 170 1.051 11.324 -7.776 1.00 0.00 O ATOM 2522 OE2 GLU A 170 3.046 10.972 -6.925 1.00 0.00 O ATOM 0 H GLU A 170 -1.265 8.483 -4.159 1.00 0.00 H new ATOM 0 HA GLU A 170 1.306 8.493 -5.466 1.00 0.00 H new ATOM 0 HB2 GLU A 170 -0.422 10.135 -6.028 1.00 0.00 H new ATOM 0 HB3 GLU A 170 -0.505 10.675 -4.363 1.00 0.00 H new ATOM 0 HG2 GLU A 170 0.832 12.317 -5.275 1.00 0.00 H new ATOM 0 HG3 GLU A 170 2.050 11.209 -4.676 1.00 0.00 H new ATOM 2529 N ALA A 171 1.032 9.495 -2.321 1.00 0.00 N ATOM 2530 CA ALA A 171 1.788 9.715 -1.094 1.00 0.00 C ATOM 2531 C ALA A 171 2.613 8.485 -0.729 1.00 0.00 C ATOM 2532 O ALA A 171 3.502 8.551 0.120 1.00 0.00 O ATOM 2533 CB ALA A 171 0.849 10.080 0.046 1.00 0.00 C ATOM 0 H ALA A 171 0.027 9.642 -2.229 1.00 0.00 H new ATOM 0 HA ALA A 171 2.475 10.544 -1.264 1.00 0.00 H new ATOM 0 HB1 ALA A 171 1.427 10.241 0.956 1.00 0.00 H new ATOM 0 HB2 ALA A 171 0.307 10.992 -0.206 1.00 0.00 H new ATOM 0 HB3 ALA A 171 0.139 9.269 0.206 1.00 0.00 H new ATOM 2539 N VAL A 172 2.312 7.363 -1.375 1.00 0.00 N ATOM 2540 CA VAL A 172 3.026 6.118 -1.118 1.00 0.00 C ATOM 2541 C VAL A 172 4.267 6.006 -1.996 1.00 0.00 C ATOM 2542 O VAL A 172 5.393 6.021 -1.500 1.00 0.00 O ATOM 2543 CB VAL A 172 2.124 4.893 -1.363 1.00 0.00 C ATOM 2544 CG1 VAL A 172 2.883 3.606 -1.079 1.00 0.00 C ATOM 2545 CG2 VAL A 172 0.866 4.980 -0.513 1.00 0.00 C ATOM 0 H VAL A 172 1.579 7.291 -2.080 1.00 0.00 H new ATOM 0 HA VAL A 172 3.326 6.135 -0.070 1.00 0.00 H new ATOM 0 HB VAL A 172 1.826 4.886 -2.411 1.00 0.00 H new ATOM 0 HG11 VAL A 172 2.230 2.752 -1.257 1.00 0.00 H new ATOM 0 HG12 VAL A 172 3.751 3.543 -1.736 1.00 0.00 H new ATOM 0 HG13 VAL A 172 3.213 3.600 -0.040 1.00 0.00 H new ATOM 0 HG21 VAL A 172 0.240 4.107 -0.699 1.00 0.00 H new ATOM 0 HG22 VAL A 172 1.141 5.012 0.541 1.00 0.00 H new ATOM 0 HG23 VAL A 172 0.314 5.884 -0.772 1.00 0.00 H new ATOM 2555 N GLN A 173 4.053 5.893 -3.303 1.00 0.00 N ATOM 2556 CA GLN A 173 5.155 5.778 -4.250 1.00 0.00 C ATOM 2557 C GLN A 173 6.144 6.927 -4.078 1.00 0.00 C ATOM 2558 O GLN A 173 7.350 6.709 -3.966 1.00 0.00 O ATOM 2559 CB GLN A 173 4.623 5.758 -5.684 1.00 0.00 C ATOM 2560 CG GLN A 173 4.292 7.138 -6.229 1.00 0.00 C ATOM 2561 CD GLN A 173 3.698 7.087 -7.623 1.00 0.00 C ATOM 2562 OE1 GLN A 173 2.481 6.995 -7.788 1.00 0.00 O ATOM 2563 NE2 GLN A 173 4.555 7.147 -8.635 1.00 0.00 N ATOM 0 H GLN A 173 3.127 5.879 -3.730 1.00 0.00 H new ATOM 0 HA GLN A 173 5.676 4.842 -4.050 1.00 0.00 H new ATOM 0 HB2 GLN A 173 5.364 5.289 -6.331 1.00 0.00 H new ATOM 0 HB3 GLN A 173 3.728 5.137 -5.722 1.00 0.00 H new ATOM 0 HG2 GLN A 173 3.590 7.631 -5.557 1.00 0.00 H new ATOM 0 HG3 GLN A 173 5.197 7.745 -6.246 1.00 0.00 H new ATOM 0 HE21 GLN A 173 5.556 7.223 -8.452 1.00 0.00 H new ATOM 0 HE22 GLN A 173 4.213 7.117 -9.595 1.00 0.00 H new ATOM 2572 N ALA A 174 5.624 8.150 -4.057 1.00 0.00 N ATOM 2573 CA ALA A 174 6.460 9.332 -3.897 1.00 0.00 C ATOM 2574 C ALA A 174 7.428 9.167 -2.730 1.00 0.00 C ATOM 2575 O ALA A 174 8.593 9.553 -2.817 1.00 0.00 O ATOM 2576 CB ALA A 174 5.595 10.568 -3.696 1.00 0.00 C ATOM 0 H ALA A 174 4.627 8.347 -4.149 1.00 0.00 H new ATOM 0 HA ALA A 174 7.047 9.456 -4.807 1.00 0.00 H new ATOM 0 HB1 ALA A 174 6.233 11.444 -3.578 1.00 0.00 H new ATOM 0 HB2 ALA A 174 4.949 10.705 -4.563 1.00 0.00 H new ATOM 0 HB3 ALA A 174 4.983 10.442 -2.803 1.00 0.00 H new ATOM 2582 N ALA A 175 6.936 8.591 -1.637 1.00 0.00 N ATOM 2583 CA ALA A 175 7.758 8.373 -0.454 1.00 0.00 C ATOM 2584 C ALA A 175 8.947 7.471 -0.768 1.00 0.00 C ATOM 2585 O ALA A 175 10.052 7.689 -0.271 1.00 0.00 O ATOM 2586 CB ALA A 175 6.921 7.773 0.667 1.00 0.00 C ATOM 0 H ALA A 175 5.973 8.268 -1.547 1.00 0.00 H new ATOM 0 HA ALA A 175 8.144 9.339 -0.129 1.00 0.00 H new ATOM 0 HB1 ALA A 175 7.548 7.615 1.545 1.00 0.00 H new ATOM 0 HB2 ALA A 175 6.108 8.454 0.919 1.00 0.00 H new ATOM 0 HB3 ALA A 175 6.507 6.819 0.341 1.00 0.00 H new ATOM 2592 N CYS A 176 8.713 6.459 -1.596 1.00 0.00 N ATOM 2593 CA CYS A 176 9.765 5.523 -1.976 1.00 0.00 C ATOM 2594 C CYS A 176 11.035 6.267 -2.377 1.00 0.00 C ATOM 2595 O CYS A 176 12.049 5.651 -2.704 1.00 0.00 O ATOM 2596 CB CYS A 176 9.294 4.635 -3.129 1.00 0.00 C ATOM 2597 SG CYS A 176 7.891 3.572 -2.716 1.00 0.00 S ATOM 0 H CYS A 176 7.804 6.266 -2.017 1.00 0.00 H new ATOM 0 HA CYS A 176 9.990 4.896 -1.113 1.00 0.00 H new ATOM 0 HB2 CYS A 176 9.020 5.268 -3.973 1.00 0.00 H new ATOM 0 HB3 CYS A 176 10.126 4.011 -3.456 1.00 0.00 H new ATOM 0 HG CYS A 176 8.317 2.371 -2.460 1.00 0.00 H new