USER MOD reduce.3.24.130724 H: found=0, std=0, add=972, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 972 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 164 ASN : amide:sc= -0.479 K(o=-0.17,f=-3.7!) USER MOD Set 1.2: A 167 ASN : amide:sc= 0.309 K(o=-0.17,f=-2.3!) USER MOD Set 2.1: A 68 TYR OH : rot 39:sc= 0.345 USER MOD Set 2.2: A 157 HIS : no HD1:sc= 0.933 K(o=1.3,f=-5) USER MOD Set 3.1: A 134 MET CE :methyl -131:sc= -2.15 (180deg=-8.47!) USER MOD Set 3.2: A 176 CYS SG : rot 61:sc= 0.444 USER MOD Set 4.1: A 126 CYS SG : rot -150:sc= -1.35 USER MOD Set 4.2: A 147 MET CE :methyl 151:sc= -0.39 (180deg=0) USER MOD Set 5.1: A 85 SER OG : rot 180:sc= 0 USER MOD Set 5.2: A 89 ASN : amide:sc= -2.82! K(o=-2.8!,f=-1.3) USER MOD Set 6.1: A 28 ASN : amide:sc= -2.31 K(o=-2.3,f=-11!) USER MOD Set 6.2: A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl -117:sc= 0 (180deg=-0.754) USER MOD Single : A 22 GLN : amide:sc= -0.0958 X(o=-0.096,f=0.33) USER MOD Single : A 23 GLN : amide:sc= -0.516 K(o=-0.52,f=-1.2) USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 TYR OH : rot 30:sc= 0 USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 LYS NZ :NH3+ -158:sc= -0.28 (180deg=-0.981) USER MOD Single : A 67 GLN : amide:sc= 0.278 X(o=0.28,f=-0.15) USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl 159:sc= -1.54 (180deg=-3.13!) USER MOD Single : A 82 THR OG1 : rot 160:sc= 0 USER MOD Single : A 84 ASN : amide:sc= -1.1 K(o=-1.1,f=-0.31) USER MOD Single : A 91 MET CE :methyl 155:sc= -0.207 (180deg=-0.874) USER MOD Single : A 92 THR OG1 : rot 30:sc= 0.434 USER MOD Single : A 93 SER OG : rot -19:sc= 0.0369 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 SER OG : rot -149:sc= 0.166 USER MOD Single : A 103 ASN : amide:sc= -1.04 K(o=-1,f=-0.0067) USER MOD Single : A 104 MET CE :methyl -121:sc= -0.445 (180deg=-4.48!) USER MOD Single : A 105 ASN : amide:sc= -0.75 K(o=-0.75,f=-3.9!) USER MOD Single : A 110 THR OG1 : rot 57:sc= 0.784 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 ASN : amide:sc= -0.0311 K(o=-0.031,f=-0.74) USER MOD Single : A 132 SER OG : rot -115:sc= 0.152 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 141 HIS : no HD1:sc= -0.119 X(o=-0.12,f=-0.41) USER MOD Single : A 142 THR OG1 : rot 49:sc= 0.0915 USER MOD Single : A 149 THR OG1 : rot 180:sc= -0.098 USER MOD Single : A 151 ASN : amide:sc=-0.00737 X(o=-0.0074,f=-0.26) USER MOD Single : A 152 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 156 CYS SG : rot 180:sc= -1.2 USER MOD Single : A 161 CYS SG : rot 160:sc= -3.16! USER MOD Single : A 169 SER OG : rot -25:sc= 1.52 USER MOD Single : A 173 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 213 N LEU A 18 -3.621 8.154 -11.554 1.00 0.00 N ATOM 214 CA LEU A 18 -4.383 6.957 -11.217 1.00 0.00 C ATOM 215 C LEU A 18 -4.488 6.021 -12.417 1.00 0.00 C ATOM 216 O LEU A 18 -4.694 4.818 -12.262 1.00 0.00 O ATOM 217 CB LEU A 18 -5.782 7.340 -10.730 1.00 0.00 C ATOM 218 CG LEU A 18 -5.909 7.670 -9.243 1.00 0.00 C ATOM 219 CD1 LEU A 18 -7.284 8.243 -8.938 1.00 0.00 C ATOM 220 CD2 LEU A 18 -5.645 6.433 -8.397 1.00 0.00 C ATOM 0 HA LEU A 18 -3.857 6.434 -10.418 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -6.121 8.203 -11.303 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -6.462 6.519 -10.959 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.161 8.423 -8.993 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -7.355 8.472 -7.875 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -7.435 9.155 -9.516 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -8.049 7.514 -9.204 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -5.740 6.687 -7.341 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -6.368 5.658 -8.650 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -4.637 6.067 -8.593 1.00 0.00 H new ATOM 232 N SER A 19 -4.343 6.582 -13.613 1.00 0.00 N ATOM 233 CA SER A 19 -4.423 5.799 -14.840 1.00 0.00 C ATOM 234 C SER A 19 -3.190 4.915 -15.001 1.00 0.00 C ATOM 235 O SER A 19 -3.300 3.711 -15.236 1.00 0.00 O ATOM 236 CB SER A 19 -4.565 6.722 -16.051 1.00 0.00 C ATOM 237 OG SER A 19 -5.916 7.097 -16.252 1.00 0.00 O ATOM 0 H SER A 19 -4.169 7.577 -13.758 1.00 0.00 H new ATOM 0 HA SER A 19 -5.302 5.158 -14.776 1.00 0.00 H new ATOM 0 HB2 SER A 19 -3.955 7.614 -15.906 1.00 0.00 H new ATOM 0 HB3 SER A 19 -4.188 6.219 -16.941 1.00 0.00 H new ATOM 0 HG SER A 19 -5.979 7.688 -17.031 1.00 0.00 H new ATOM 243 N LYS A 20 -2.014 5.521 -14.873 1.00 0.00 N ATOM 244 CA LYS A 20 -0.759 4.791 -15.003 1.00 0.00 C ATOM 245 C LYS A 20 -0.632 3.728 -13.917 1.00 0.00 C ATOM 246 O LYS A 20 -0.042 2.671 -14.136 1.00 0.00 O ATOM 247 CB LYS A 20 0.426 5.757 -14.926 1.00 0.00 C ATOM 248 CG LYS A 20 0.478 6.555 -13.635 1.00 0.00 C ATOM 249 CD LYS A 20 1.884 7.052 -13.343 1.00 0.00 C ATOM 250 CE LYS A 20 2.187 8.340 -14.093 1.00 0.00 C ATOM 251 NZ LYS A 20 3.644 8.645 -14.108 1.00 0.00 N ATOM 0 H LYS A 20 -1.904 6.516 -14.679 1.00 0.00 H new ATOM 0 HA LYS A 20 -0.755 4.295 -15.974 1.00 0.00 H new ATOM 0 HB2 LYS A 20 1.352 5.192 -15.031 1.00 0.00 H new ATOM 0 HB3 LYS A 20 0.376 6.447 -15.768 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -0.202 7.404 -13.703 1.00 0.00 H new ATOM 0 HG3 LYS A 20 0.131 5.935 -12.808 1.00 0.00 H new ATOM 0 HD2 LYS A 20 1.997 7.218 -12.272 1.00 0.00 H new ATOM 0 HD3 LYS A 20 2.607 6.287 -13.625 1.00 0.00 H new ATOM 0 HE2 LYS A 20 1.823 8.258 -15.117 1.00 0.00 H new ATOM 0 HE3 LYS A 20 1.648 9.166 -13.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 3.808 9.530 -14.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 3.987 8.749 -13.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 4.156 7.869 -14.574 1.00 0.00 H new ATOM 265 N MET A 21 -1.192 4.015 -12.746 1.00 0.00 N ATOM 266 CA MET A 21 -1.143 3.082 -11.627 1.00 0.00 C ATOM 267 C MET A 21 -2.040 1.875 -11.886 1.00 0.00 C ATOM 268 O MET A 21 -1.757 0.770 -11.423 1.00 0.00 O ATOM 269 CB MET A 21 -1.570 3.779 -10.334 1.00 0.00 C ATOM 270 CG MET A 21 -0.741 5.011 -10.006 1.00 0.00 C ATOM 271 SD MET A 21 0.952 4.604 -9.537 1.00 0.00 S ATOM 272 CE MET A 21 0.725 4.135 -7.824 1.00 0.00 C ATOM 0 H MET A 21 -1.685 4.886 -12.548 1.00 0.00 H new ATOM 0 HA MET A 21 -0.115 2.734 -11.522 1.00 0.00 H new ATOM 0 HB2 MET A 21 -2.618 4.067 -10.415 1.00 0.00 H new ATOM 0 HB3 MET A 21 -1.497 3.071 -9.508 1.00 0.00 H new ATOM 0 HG2 MET A 21 -0.725 5.674 -10.871 1.00 0.00 H new ATOM 0 HG3 MET A 21 -1.217 5.559 -9.193 1.00 0.00 H new ATOM 0 HE1 MET A 21 1.274 4.824 -7.182 1.00 0.00 H new ATOM 0 HE2 MET A 21 -0.335 4.173 -7.574 1.00 0.00 H new ATOM 0 HE3 MET A 21 1.098 3.122 -7.672 1.00 0.00 H new ATOM 282 N GLN A 22 -3.120 2.094 -12.629 1.00 0.00 N ATOM 283 CA GLN A 22 -4.057 1.024 -12.949 1.00 0.00 C ATOM 284 C GLN A 22 -3.569 0.212 -14.144 1.00 0.00 C ATOM 285 O GLN A 22 -3.664 -1.015 -14.152 1.00 0.00 O ATOM 286 CB GLN A 22 -5.443 1.601 -13.241 1.00 0.00 C ATOM 287 CG GLN A 22 -6.223 1.974 -11.990 1.00 0.00 C ATOM 288 CD GLN A 22 -7.463 2.789 -12.297 1.00 0.00 C ATOM 289 OE1 GLN A 22 -7.381 3.870 -12.883 1.00 0.00 O ATOM 290 NE2 GLN A 22 -8.622 2.275 -11.903 1.00 0.00 N ATOM 0 H GLN A 22 -3.368 3.003 -13.021 1.00 0.00 H new ATOM 0 HA GLN A 22 -4.122 0.362 -12.085 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -5.334 2.486 -13.869 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -6.017 0.873 -13.814 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -6.512 1.065 -11.462 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -5.577 2.541 -11.319 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -8.644 1.376 -11.421 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -9.491 2.779 -12.083 1.00 0.00 H new ATOM 299 N GLN A 23 -3.047 0.905 -15.151 1.00 0.00 N ATOM 300 CA GLN A 23 -2.546 0.248 -16.352 1.00 0.00 C ATOM 301 C GLN A 23 -1.463 -0.768 -16.004 1.00 0.00 C ATOM 302 O GLN A 23 -1.619 -1.964 -16.249 1.00 0.00 O ATOM 303 CB GLN A 23 -1.994 1.283 -17.333 1.00 0.00 C ATOM 304 CG GLN A 23 -3.071 2.130 -17.993 1.00 0.00 C ATOM 305 CD GLN A 23 -4.249 1.306 -18.472 1.00 0.00 C ATOM 306 OE1 GLN A 23 -4.079 0.208 -19.004 1.00 0.00 O ATOM 307 NE2 GLN A 23 -5.454 1.832 -18.287 1.00 0.00 N ATOM 0 H GLN A 23 -2.960 1.921 -15.159 1.00 0.00 H new ATOM 0 HA GLN A 23 -3.377 -0.279 -16.821 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -1.301 1.938 -16.805 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -1.422 0.770 -18.106 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -3.422 2.881 -17.285 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -2.639 2.666 -18.839 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -5.549 2.745 -17.842 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -6.285 1.323 -18.590 1.00 0.00 H new ATOM 316 N ASN A 24 -0.365 -0.284 -15.432 1.00 0.00 N ATOM 317 CA ASN A 24 0.744 -1.150 -15.052 1.00 0.00 C ATOM 318 C ASN A 24 0.967 -1.117 -13.543 1.00 0.00 C ATOM 319 O ASN A 24 1.053 -2.159 -12.895 1.00 0.00 O ATOM 320 CB ASN A 24 2.023 -0.724 -15.777 1.00 0.00 C ATOM 321 CG ASN A 24 1.892 -0.823 -17.284 1.00 0.00 C ATOM 322 OD1 ASN A 24 1.829 -1.918 -17.843 1.00 0.00 O ATOM 323 ND2 ASN A 24 1.852 0.325 -17.951 1.00 0.00 N ATOM 0 H ASN A 24 -0.220 0.704 -15.222 1.00 0.00 H new ATOM 0 HA ASN A 24 0.492 -2.170 -15.342 1.00 0.00 H new ATOM 0 HB2 ASN A 24 2.269 0.302 -15.503 1.00 0.00 H new ATOM 0 HB3 ASN A 24 2.851 -1.350 -15.445 1.00 0.00 H new ATOM 0 HD21 ASN A 24 1.766 0.322 -18.967 1.00 0.00 H new ATOM 0 HD22 ASN A 24 1.907 1.210 -17.447 1.00 0.00 H new ATOM 330 N GLY A 25 1.060 0.089 -12.990 1.00 0.00 N ATOM 331 CA GLY A 25 1.272 0.235 -11.561 1.00 0.00 C ATOM 332 C GLY A 25 2.582 0.925 -11.237 1.00 0.00 C ATOM 333 O GLY A 25 3.143 1.633 -12.074 1.00 0.00 O ATOM 0 H GLY A 25 0.992 0.967 -13.505 1.00 0.00 H new ATOM 0 HA2 GLY A 25 0.449 0.805 -11.131 1.00 0.00 H new ATOM 0 HA3 GLY A 25 1.257 -0.749 -11.092 1.00 0.00 H new ATOM 337 N TYR A 26 3.071 0.720 -10.019 1.00 0.00 N ATOM 338 CA TYR A 26 4.321 1.331 -9.585 1.00 0.00 C ATOM 339 C TYR A 26 5.201 0.316 -8.862 1.00 0.00 C ATOM 340 O TYR A 26 4.961 -0.015 -7.702 1.00 0.00 O ATOM 341 CB TYR A 26 4.040 2.523 -8.668 1.00 0.00 C ATOM 342 CG TYR A 26 5.288 3.246 -8.214 1.00 0.00 C ATOM 343 CD1 TYR A 26 6.066 3.962 -9.116 1.00 0.00 C ATOM 344 CD2 TYR A 26 5.689 3.213 -6.884 1.00 0.00 C ATOM 345 CE1 TYR A 26 7.208 4.623 -8.706 1.00 0.00 C ATOM 346 CE2 TYR A 26 6.828 3.873 -6.465 1.00 0.00 C ATOM 347 CZ TYR A 26 7.584 4.576 -7.379 1.00 0.00 C ATOM 348 OH TYR A 26 8.720 5.234 -6.966 1.00 0.00 O ATOM 0 H TYR A 26 2.621 0.135 -9.315 1.00 0.00 H new ATOM 0 HA TYR A 26 4.852 1.680 -10.471 1.00 0.00 H new ATOM 0 HB2 TYR A 26 3.392 3.227 -9.190 1.00 0.00 H new ATOM 0 HB3 TYR A 26 3.493 2.175 -7.792 1.00 0.00 H new ATOM 0 HD1 TYR A 26 5.773 4.002 -10.155 1.00 0.00 H new ATOM 0 HD2 TYR A 26 5.100 2.662 -6.166 1.00 0.00 H new ATOM 0 HE1 TYR A 26 7.803 5.173 -9.420 1.00 0.00 H new ATOM 0 HE2 TYR A 26 7.125 3.839 -5.427 1.00 0.00 H new ATOM 0 HH TYR A 26 8.868 6.019 -7.533 1.00 0.00 H new ATOM 358 N GLU A 27 6.223 -0.173 -9.558 1.00 0.00 N ATOM 359 CA GLU A 27 7.139 -1.151 -8.983 1.00 0.00 C ATOM 360 C GLU A 27 8.304 -0.458 -8.282 1.00 0.00 C ATOM 361 O GLU A 27 9.178 0.118 -8.929 1.00 0.00 O ATOM 362 CB GLU A 27 7.669 -2.088 -10.071 1.00 0.00 C ATOM 363 CG GLU A 27 6.735 -3.245 -10.384 1.00 0.00 C ATOM 364 CD GLU A 27 7.362 -4.263 -11.317 1.00 0.00 C ATOM 365 OE1 GLU A 27 8.349 -4.911 -10.911 1.00 0.00 O ATOM 366 OE2 GLU A 27 6.865 -4.412 -12.453 1.00 0.00 O ATOM 0 H GLU A 27 6.437 0.092 -10.519 1.00 0.00 H new ATOM 0 HA GLU A 27 6.589 -1.736 -8.246 1.00 0.00 H new ATOM 0 HB2 GLU A 27 7.841 -1.514 -10.981 1.00 0.00 H new ATOM 0 HB3 GLU A 27 8.634 -2.486 -9.758 1.00 0.00 H new ATOM 0 HG2 GLU A 27 6.448 -3.737 -9.455 1.00 0.00 H new ATOM 0 HG3 GLU A 27 5.821 -2.858 -10.835 1.00 0.00 H new ATOM 373 N ASN A 28 8.309 -0.518 -6.954 1.00 0.00 N ATOM 374 CA ASN A 28 9.365 0.104 -6.165 1.00 0.00 C ATOM 375 C ASN A 28 10.740 -0.378 -6.618 1.00 0.00 C ATOM 376 O ASN A 28 11.037 -1.573 -6.618 1.00 0.00 O ATOM 377 CB ASN A 28 9.169 -0.205 -4.679 1.00 0.00 C ATOM 378 CG ASN A 28 10.107 0.593 -3.794 1.00 0.00 C ATOM 379 OD1 ASN A 28 11.102 1.145 -4.264 1.00 0.00 O ATOM 380 ND2 ASN A 28 9.794 0.656 -2.505 1.00 0.00 N ATOM 0 H ASN A 28 7.593 -0.991 -6.402 1.00 0.00 H new ATOM 0 HA ASN A 28 9.310 1.182 -6.317 1.00 0.00 H new ATOM 0 HB2 ASN A 28 8.138 0.011 -4.399 1.00 0.00 H new ATOM 0 HB3 ASN A 28 9.330 -1.269 -4.508 1.00 0.00 H new ATOM 0 HD21 ASN A 28 10.388 1.178 -1.861 1.00 0.00 H new ATOM 0 HD22 ASN A 28 8.959 0.183 -2.159 1.00 0.00 H new ATOM 387 N PRO A 29 11.599 0.573 -7.015 1.00 0.00 N ATOM 388 CA PRO A 29 12.956 0.269 -7.478 1.00 0.00 C ATOM 389 C PRO A 29 13.859 -0.213 -6.348 1.00 0.00 C ATOM 390 O PRO A 29 14.539 -1.232 -6.474 1.00 0.00 O ATOM 391 CB PRO A 29 13.453 1.611 -8.024 1.00 0.00 C ATOM 392 CG PRO A 29 12.659 2.636 -7.289 1.00 0.00 C ATOM 393 CD PRO A 29 11.311 2.017 -7.042 1.00 0.00 C ATOM 0 HA PRO A 29 12.966 -0.536 -8.213 1.00 0.00 H new ATOM 0 HB2 PRO A 29 14.521 1.738 -7.850 1.00 0.00 H new ATOM 0 HB3 PRO A 29 13.294 1.684 -9.100 1.00 0.00 H new ATOM 0 HG2 PRO A 29 13.143 2.905 -6.350 1.00 0.00 H new ATOM 0 HG3 PRO A 29 12.567 3.551 -7.874 1.00 0.00 H new ATOM 0 HD2 PRO A 29 10.878 2.358 -6.102 1.00 0.00 H new ATOM 0 HD3 PRO A 29 10.602 2.271 -7.830 1.00 0.00 H new ATOM 401 N THR A 30 13.862 0.525 -5.242 1.00 0.00 N ATOM 402 CA THR A 30 14.682 0.173 -4.090 1.00 0.00 C ATOM 403 C THR A 30 14.596 -1.319 -3.789 1.00 0.00 C ATOM 404 O THR A 30 15.611 -1.973 -3.549 1.00 0.00 O ATOM 405 CB THR A 30 14.260 0.963 -2.837 1.00 0.00 C ATOM 406 OG1 THR A 30 14.180 2.360 -3.142 1.00 0.00 O ATOM 407 CG2 THR A 30 15.246 0.742 -1.700 1.00 0.00 C ATOM 0 H THR A 30 13.305 1.371 -5.120 1.00 0.00 H new ATOM 0 HA THR A 30 15.710 0.431 -4.344 1.00 0.00 H new ATOM 0 HB THR A 30 13.280 0.604 -2.521 1.00 0.00 H new ATOM 0 HG1 THR A 30 13.909 2.855 -2.341 1.00 0.00 H new ATOM 0 HG21 THR A 30 14.927 1.310 -0.826 1.00 0.00 H new ATOM 0 HG22 THR A 30 15.282 -0.318 -1.450 1.00 0.00 H new ATOM 0 HG23 THR A 30 16.237 1.076 -2.008 1.00 0.00 H new ATOM 824 N VAL A 61 4.002 14.795 8.838 1.00 0.00 N ATOM 825 CA VAL A 61 3.216 13.567 8.831 1.00 0.00 C ATOM 826 C VAL A 61 1.872 13.780 8.142 1.00 0.00 C ATOM 827 O VAL A 61 1.246 14.829 8.292 1.00 0.00 O ATOM 828 CB VAL A 61 2.971 13.049 10.260 1.00 0.00 C ATOM 829 CG1 VAL A 61 2.452 14.166 11.152 1.00 0.00 C ATOM 830 CG2 VAL A 61 2.002 11.876 10.242 1.00 0.00 C ATOM 0 HA VAL A 61 3.792 12.825 8.278 1.00 0.00 H new ATOM 0 HB VAL A 61 3.920 12.701 10.669 1.00 0.00 H new ATOM 0 HG11 VAL A 61 2.285 13.781 12.158 1.00 0.00 H new ATOM 0 HG12 VAL A 61 3.185 14.972 11.189 1.00 0.00 H new ATOM 0 HG13 VAL A 61 1.514 14.547 10.749 1.00 0.00 H new ATOM 0 HG21 VAL A 61 1.840 11.522 11.260 1.00 0.00 H new ATOM 0 HG22 VAL A 61 1.052 12.195 9.813 1.00 0.00 H new ATOM 0 HG23 VAL A 61 2.419 11.069 9.639 1.00 0.00 H new ATOM 840 N GLN A 62 1.435 12.777 7.387 1.00 0.00 N ATOM 841 CA GLN A 62 0.166 12.854 6.675 1.00 0.00 C ATOM 842 C GLN A 62 -0.773 11.735 7.112 1.00 0.00 C ATOM 843 O GLN A 62 -0.425 10.556 7.043 1.00 0.00 O ATOM 844 CB GLN A 62 0.398 12.780 5.165 1.00 0.00 C ATOM 845 CG GLN A 62 0.858 14.095 4.555 1.00 0.00 C ATOM 846 CD GLN A 62 1.090 13.995 3.060 1.00 0.00 C ATOM 847 OE1 GLN A 62 0.221 14.346 2.261 1.00 0.00 O ATOM 848 NE2 GLN A 62 2.266 13.515 2.674 1.00 0.00 N ATOM 0 H GLN A 62 1.941 11.902 7.253 1.00 0.00 H new ATOM 0 HA GLN A 62 -0.299 13.809 6.918 1.00 0.00 H new ATOM 0 HB2 GLN A 62 1.143 12.012 4.957 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -0.526 12.467 4.679 1.00 0.00 H new ATOM 0 HG2 GLN A 62 0.111 14.864 4.752 1.00 0.00 H new ATOM 0 HG3 GLN A 62 1.780 14.414 5.041 1.00 0.00 H new ATOM 0 HE21 GLN A 62 2.957 13.236 3.371 1.00 0.00 H new ATOM 0 HE22 GLN A 62 2.479 13.425 1.681 1.00 0.00 H new ATOM 857 N LYS A 63 -1.965 12.111 7.562 1.00 0.00 N ATOM 858 CA LYS A 63 -2.956 11.139 8.011 1.00 0.00 C ATOM 859 C LYS A 63 -4.118 11.053 7.026 1.00 0.00 C ATOM 860 O LYS A 63 -4.852 12.022 6.831 1.00 0.00 O ATOM 861 CB LYS A 63 -3.477 11.515 9.400 1.00 0.00 C ATOM 862 CG LYS A 63 -2.518 11.166 10.524 1.00 0.00 C ATOM 863 CD LYS A 63 -1.532 12.292 10.786 1.00 0.00 C ATOM 864 CE LYS A 63 -2.066 13.272 11.819 1.00 0.00 C ATOM 865 NZ LYS A 63 -2.992 14.268 11.211 1.00 0.00 N ATOM 0 H LYS A 63 -2.269 13.083 7.626 1.00 0.00 H new ATOM 0 HA LYS A 63 -2.474 10.163 8.063 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -3.679 12.586 9.425 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -4.426 11.007 9.573 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -3.082 10.956 11.433 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -1.974 10.256 10.270 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -0.586 11.875 11.133 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -1.325 12.820 9.855 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -2.587 12.724 12.604 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -1.233 13.792 12.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -3.041 15.111 11.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -2.642 14.538 10.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -3.940 13.851 11.121 1.00 0.00 H new ATOM 879 N PHE A 64 -4.279 9.888 6.409 1.00 0.00 N ATOM 880 CA PHE A 64 -5.352 9.675 5.445 1.00 0.00 C ATOM 881 C PHE A 64 -6.438 8.776 6.028 1.00 0.00 C ATOM 882 O PHE A 64 -6.146 7.725 6.601 1.00 0.00 O ATOM 883 CB PHE A 64 -4.798 9.057 4.160 1.00 0.00 C ATOM 884 CG PHE A 64 -3.948 10.001 3.358 1.00 0.00 C ATOM 885 CD1 PHE A 64 -2.593 10.126 3.618 1.00 0.00 C ATOM 886 CD2 PHE A 64 -4.506 10.764 2.344 1.00 0.00 C ATOM 887 CE1 PHE A 64 -1.809 10.994 2.882 1.00 0.00 C ATOM 888 CE2 PHE A 64 -3.726 11.633 1.604 1.00 0.00 C ATOM 889 CZ PHE A 64 -2.376 11.749 1.874 1.00 0.00 C ATOM 0 H PHE A 64 -3.680 9.076 6.559 1.00 0.00 H new ATOM 0 HA PHE A 64 -5.794 10.644 5.213 1.00 0.00 H new ATOM 0 HB2 PHE A 64 -4.208 8.177 4.415 1.00 0.00 H new ATOM 0 HB3 PHE A 64 -5.629 8.716 3.543 1.00 0.00 H new ATOM 0 HD1 PHE A 64 -2.144 9.538 4.405 1.00 0.00 H new ATOM 0 HD2 PHE A 64 -5.561 10.679 2.130 1.00 0.00 H new ATOM 0 HE1 PHE A 64 -0.754 11.082 3.095 1.00 0.00 H new ATOM 0 HE2 PHE A 64 -4.172 12.221 0.815 1.00 0.00 H new ATOM 0 HZ PHE A 64 -1.765 12.429 1.298 1.00 0.00 H new ATOM 899 N ARG A 65 -7.690 9.196 5.880 1.00 0.00 N ATOM 900 CA ARG A 65 -8.819 8.430 6.393 1.00 0.00 C ATOM 901 C ARG A 65 -9.218 7.328 5.416 1.00 0.00 C ATOM 902 O ARG A 65 -9.967 7.565 4.468 1.00 0.00 O ATOM 903 CB ARG A 65 -10.011 9.352 6.654 1.00 0.00 C ATOM 904 CG ARG A 65 -11.111 8.706 7.481 1.00 0.00 C ATOM 905 CD ARG A 65 -12.243 9.681 7.761 1.00 0.00 C ATOM 906 NE ARG A 65 -11.833 10.752 8.666 1.00 0.00 N ATOM 907 CZ ARG A 65 -12.508 11.885 8.817 1.00 0.00 C ATOM 908 NH1 ARG A 65 -13.621 12.096 8.128 1.00 0.00 N ATOM 909 NH2 ARG A 65 -12.070 12.812 9.660 1.00 0.00 N ATOM 0 H ARG A 65 -7.948 10.063 5.409 1.00 0.00 H new ATOM 0 HA ARG A 65 -8.515 7.966 7.331 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -9.661 10.248 7.167 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -10.427 9.673 5.699 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -11.501 7.836 6.953 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -10.696 8.348 8.423 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -12.590 10.113 6.822 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -13.086 9.143 8.195 1.00 0.00 H new ATOM 0 HE ARG A 65 -10.981 10.622 9.212 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -13.961 11.386 7.479 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -14.137 12.968 8.247 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -11.214 12.654 10.192 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -12.589 13.682 9.776 1.00 0.00 H new ATOM 923 N VAL A 66 -8.711 6.122 5.653 1.00 0.00 N ATOM 924 CA VAL A 66 -9.015 4.983 4.794 1.00 0.00 C ATOM 925 C VAL A 66 -9.564 3.815 5.605 1.00 0.00 C ATOM 926 O VAL A 66 -9.411 3.767 6.825 1.00 0.00 O ATOM 927 CB VAL A 66 -7.768 4.515 4.021 1.00 0.00 C ATOM 928 CG1 VAL A 66 -7.276 5.611 3.087 1.00 0.00 C ATOM 929 CG2 VAL A 66 -6.670 4.093 4.985 1.00 0.00 C ATOM 0 H VAL A 66 -8.088 5.909 6.432 1.00 0.00 H new ATOM 0 HA VAL A 66 -9.771 5.315 4.083 1.00 0.00 H new ATOM 0 HB VAL A 66 -8.041 3.650 3.416 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -6.394 5.262 2.549 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -8.061 5.860 2.373 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -7.020 6.497 3.668 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -5.797 3.765 4.421 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -6.397 4.937 5.618 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -7.028 3.273 5.608 1.00 0.00 H new ATOM 939 N GLN A 67 -10.205 2.874 4.918 1.00 0.00 N ATOM 940 CA GLN A 67 -10.778 1.706 5.575 1.00 0.00 C ATOM 941 C GLN A 67 -9.894 0.479 5.372 1.00 0.00 C ATOM 942 O GLN A 67 -9.149 0.394 4.396 1.00 0.00 O ATOM 943 CB GLN A 67 -12.184 1.431 5.039 1.00 0.00 C ATOM 944 CG GLN A 67 -13.275 2.191 5.776 1.00 0.00 C ATOM 945 CD GLN A 67 -14.570 2.260 4.991 1.00 0.00 C ATOM 946 OE1 GLN A 67 -14.767 3.160 4.175 1.00 0.00 O ATOM 947 NE2 GLN A 67 -15.462 1.307 5.235 1.00 0.00 N ATOM 0 H GLN A 67 -10.340 2.898 3.907 1.00 0.00 H new ATOM 0 HA GLN A 67 -10.839 1.915 6.643 1.00 0.00 H new ATOM 0 HB2 GLN A 67 -12.219 1.695 3.982 1.00 0.00 H new ATOM 0 HB3 GLN A 67 -12.387 0.362 5.107 1.00 0.00 H new ATOM 0 HG2 GLN A 67 -13.462 1.711 6.736 1.00 0.00 H new ATOM 0 HG3 GLN A 67 -12.928 3.203 5.988 1.00 0.00 H new ATOM 0 HE21 GLN A 67 -15.257 0.580 5.920 1.00 0.00 H new ATOM 0 HE22 GLN A 67 -16.352 1.302 4.737 1.00 0.00 H new ATOM 956 N TYR A 68 -9.983 -0.468 6.299 1.00 0.00 N ATOM 957 CA TYR A 68 -9.190 -1.689 6.222 1.00 0.00 C ATOM 958 C TYR A 68 -10.010 -2.836 5.641 1.00 0.00 C ATOM 959 O TYR A 68 -11.129 -3.102 6.082 1.00 0.00 O ATOM 960 CB TYR A 68 -8.669 -2.071 7.609 1.00 0.00 C ATOM 961 CG TYR A 68 -7.358 -2.823 7.577 1.00 0.00 C ATOM 962 CD1 TYR A 68 -7.214 -3.976 6.815 1.00 0.00 C ATOM 963 CD2 TYR A 68 -6.263 -2.381 8.308 1.00 0.00 C ATOM 964 CE1 TYR A 68 -6.018 -4.667 6.783 1.00 0.00 C ATOM 965 CE2 TYR A 68 -5.062 -3.064 8.281 1.00 0.00 C ATOM 966 CZ TYR A 68 -4.945 -4.206 7.518 1.00 0.00 C ATOM 967 OH TYR A 68 -3.751 -4.890 7.489 1.00 0.00 O ATOM 0 H TYR A 68 -10.596 -0.414 7.112 1.00 0.00 H new ATOM 0 HA TYR A 68 -8.344 -1.501 5.561 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -8.545 -1.166 8.203 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -9.417 -2.683 8.113 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -8.052 -4.338 6.238 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -6.352 -1.488 8.908 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -5.924 -5.562 6.186 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -4.220 -2.705 8.854 1.00 0.00 H new ATOM 0 HH TYR A 68 -3.585 -5.220 6.581 1.00 0.00 H new ATOM 977 N LEU A 69 -9.446 -3.514 4.647 1.00 0.00 N ATOM 978 CA LEU A 69 -10.123 -4.634 4.004 1.00 0.00 C ATOM 979 C LEU A 69 -9.627 -5.964 4.562 1.00 0.00 C ATOM 980 O LEU A 69 -10.413 -6.879 4.805 1.00 0.00 O ATOM 981 CB LEU A 69 -9.901 -4.589 2.491 1.00 0.00 C ATOM 982 CG LEU A 69 -10.937 -3.806 1.684 1.00 0.00 C ATOM 983 CD1 LEU A 69 -10.612 -2.320 1.698 1.00 0.00 C ATOM 984 CD2 LEU A 69 -11.004 -4.325 0.255 1.00 0.00 C ATOM 0 H LEU A 69 -8.521 -3.307 4.269 1.00 0.00 H new ATOM 0 HA LEU A 69 -11.190 -4.549 4.212 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -8.919 -4.156 2.301 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -9.876 -5.612 2.117 1.00 0.00 H new ATOM 0 HG LEU A 69 -11.913 -3.949 2.147 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.360 -1.779 1.119 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -10.616 -1.956 2.726 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -9.627 -2.159 1.260 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -11.747 -3.756 -0.304 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.029 -4.213 -0.219 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -11.285 -5.378 0.263 1.00 0.00 H new ATOM 996 N GLY A 70 -8.317 -6.063 4.766 1.00 0.00 N ATOM 997 CA GLY A 70 -7.739 -7.284 5.297 1.00 0.00 C ATOM 998 C GLY A 70 -6.568 -7.777 4.472 1.00 0.00 C ATOM 999 O GLY A 70 -6.376 -7.347 3.334 1.00 0.00 O ATOM 0 H GLY A 70 -7.646 -5.320 4.573 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -7.410 -7.111 6.322 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -8.505 -8.059 5.334 1.00 0.00 H new ATOM 1003 N MET A 71 -5.780 -8.681 5.045 1.00 0.00 N ATOM 1004 CA MET A 71 -4.621 -9.233 4.354 1.00 0.00 C ATOM 1005 C MET A 71 -5.032 -10.373 3.428 1.00 0.00 C ATOM 1006 O MET A 71 -5.952 -11.132 3.732 1.00 0.00 O ATOM 1007 CB MET A 71 -3.586 -9.730 5.366 1.00 0.00 C ATOM 1008 CG MET A 71 -2.265 -10.138 4.734 1.00 0.00 C ATOM 1009 SD MET A 71 -1.393 -11.390 5.694 1.00 0.00 S ATOM 1010 CE MET A 71 -2.236 -12.876 5.158 1.00 0.00 C ATOM 0 H MET A 71 -5.923 -9.047 5.986 1.00 0.00 H new ATOM 0 HA MET A 71 -4.178 -8.441 3.751 1.00 0.00 H new ATOM 0 HB2 MET A 71 -3.401 -8.945 6.100 1.00 0.00 H new ATOM 0 HB3 MET A 71 -3.999 -10.581 5.907 1.00 0.00 H new ATOM 0 HG2 MET A 71 -2.450 -10.519 3.730 1.00 0.00 H new ATOM 0 HG3 MET A 71 -1.630 -9.258 4.629 1.00 0.00 H new ATOM 0 HE1 MET A 71 -1.808 -13.740 5.666 1.00 0.00 H new ATOM 0 HE2 MET A 71 -3.296 -12.801 5.401 1.00 0.00 H new ATOM 0 HE3 MET A 71 -2.118 -12.993 4.081 1.00 0.00 H new ATOM 1020 N LEU A 72 -4.345 -10.487 2.297 1.00 0.00 N ATOM 1021 CA LEU A 72 -4.639 -11.535 1.325 1.00 0.00 C ATOM 1022 C LEU A 72 -3.353 -12.146 0.777 1.00 0.00 C ATOM 1023 O LEU A 72 -2.459 -11.447 0.299 1.00 0.00 O ATOM 1024 CB LEU A 72 -5.478 -10.972 0.177 1.00 0.00 C ATOM 1025 CG LEU A 72 -6.459 -11.946 -0.477 1.00 0.00 C ATOM 1026 CD1 LEU A 72 -5.710 -13.012 -1.260 1.00 0.00 C ATOM 1027 CD2 LEU A 72 -7.357 -12.584 0.572 1.00 0.00 C ATOM 0 H LEU A 72 -3.580 -9.867 2.030 1.00 0.00 H new ATOM 0 HA LEU A 72 -5.205 -12.317 1.831 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -6.041 -10.116 0.550 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -4.802 -10.598 -0.591 1.00 0.00 H new ATOM 0 HG LEU A 72 -7.087 -11.388 -1.172 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -6.424 -13.696 -1.718 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -5.111 -12.539 -2.038 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.057 -13.567 -0.586 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -8.048 -13.274 0.088 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -6.746 -13.128 1.292 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -7.921 -11.808 1.089 1.00 0.00 H new ATOM 1039 N PRO A 73 -3.257 -13.482 0.846 1.00 0.00 N ATOM 1040 CA PRO A 73 -2.086 -14.217 0.359 1.00 0.00 C ATOM 1041 C PRO A 73 -1.974 -14.189 -1.161 1.00 0.00 C ATOM 1042 O PRO A 73 -2.915 -14.547 -1.870 1.00 0.00 O ATOM 1043 CB PRO A 73 -2.334 -15.645 0.851 1.00 0.00 C ATOM 1044 CG PRO A 73 -3.814 -15.746 0.992 1.00 0.00 C ATOM 1045 CD PRO A 73 -4.284 -14.378 1.403 1.00 0.00 C ATOM 0 HA PRO A 73 -1.154 -13.783 0.720 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -1.953 -16.380 0.142 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -1.832 -15.829 1.801 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -4.276 -16.052 0.053 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -4.085 -16.493 1.738 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -5.272 -14.155 1.001 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -4.353 -14.286 2.487 1.00 0.00 H new ATOM 1053 N VAL A 74 -0.817 -13.762 -1.657 1.00 0.00 N ATOM 1054 CA VAL A 74 -0.582 -13.689 -3.094 1.00 0.00 C ATOM 1055 C VAL A 74 0.398 -14.765 -3.547 1.00 0.00 C ATOM 1056 O VAL A 74 0.874 -15.565 -2.740 1.00 0.00 O ATOM 1057 CB VAL A 74 -0.036 -12.308 -3.504 1.00 0.00 C ATOM 1058 CG1 VAL A 74 -1.154 -11.277 -3.526 1.00 0.00 C ATOM 1059 CG2 VAL A 74 1.080 -11.877 -2.565 1.00 0.00 C ATOM 0 H VAL A 74 -0.028 -13.461 -1.085 1.00 0.00 H new ATOM 0 HA VAL A 74 -1.544 -13.851 -3.580 1.00 0.00 H new ATOM 0 HB VAL A 74 0.376 -12.383 -4.510 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -0.749 -10.308 -3.818 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.917 -11.582 -4.242 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -1.598 -11.201 -2.534 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.454 -10.899 -2.869 1.00 0.00 H new ATOM 0 HG22 VAL A 74 0.696 -11.818 -1.547 1.00 0.00 H new ATOM 0 HG23 VAL A 74 1.891 -12.604 -2.605 1.00 0.00 H new ATOM 1069 N ASP A 75 0.696 -14.780 -4.841 1.00 0.00 N ATOM 1070 CA ASP A 75 1.622 -15.758 -5.401 1.00 0.00 C ATOM 1071 C ASP A 75 2.867 -15.072 -5.956 1.00 0.00 C ATOM 1072 O ASP A 75 3.898 -15.711 -6.165 1.00 0.00 O ATOM 1073 CB ASP A 75 0.937 -16.567 -6.503 1.00 0.00 C ATOM 1074 CG ASP A 75 0.630 -15.731 -7.730 1.00 0.00 C ATOM 1075 OD1 ASP A 75 -0.220 -14.821 -7.631 1.00 0.00 O ATOM 1076 OD2 ASP A 75 1.241 -15.985 -8.789 1.00 0.00 O ATOM 0 H ASP A 75 0.310 -14.126 -5.522 1.00 0.00 H new ATOM 0 HA ASP A 75 1.927 -16.433 -4.601 1.00 0.00 H new ATOM 0 HB2 ASP A 75 1.577 -17.403 -6.787 1.00 0.00 H new ATOM 0 HB3 ASP A 75 0.011 -16.992 -6.116 1.00 0.00 H new ATOM 1081 N ARG A 76 2.763 -13.768 -6.192 1.00 0.00 N ATOM 1082 CA ARG A 76 3.879 -12.997 -6.724 1.00 0.00 C ATOM 1083 C ARG A 76 3.985 -11.643 -6.028 1.00 0.00 C ATOM 1084 O ARG A 76 2.987 -11.039 -5.635 1.00 0.00 O ATOM 1085 CB ARG A 76 3.715 -12.795 -8.232 1.00 0.00 C ATOM 1086 CG ARG A 76 3.935 -14.061 -9.043 1.00 0.00 C ATOM 1087 CD ARG A 76 5.395 -14.486 -9.026 1.00 0.00 C ATOM 1088 NE ARG A 76 5.657 -15.585 -9.951 1.00 0.00 N ATOM 1089 CZ ARG A 76 6.741 -16.351 -9.896 1.00 0.00 C ATOM 1090 NH1 ARG A 76 7.660 -16.138 -8.964 1.00 0.00 N ATOM 1091 NH2 ARG A 76 6.907 -17.331 -10.774 1.00 0.00 N ATOM 0 H ARG A 76 1.917 -13.224 -6.023 1.00 0.00 H new ATOM 0 HA ARG A 76 4.796 -13.556 -6.537 1.00 0.00 H new ATOM 0 HB2 ARG A 76 2.713 -12.415 -8.432 1.00 0.00 H new ATOM 0 HB3 ARG A 76 4.418 -12.032 -8.567 1.00 0.00 H new ATOM 0 HG2 ARG A 76 3.316 -14.864 -8.642 1.00 0.00 H new ATOM 0 HG3 ARG A 76 3.615 -13.896 -10.072 1.00 0.00 H new ATOM 0 HD2 ARG A 76 6.023 -13.635 -9.288 1.00 0.00 H new ATOM 0 HD3 ARG A 76 5.673 -14.788 -8.016 1.00 0.00 H new ATOM 0 HE ARG A 76 4.969 -15.775 -10.680 1.00 0.00 H new ATOM 0 HH11 ARG A 76 7.535 -15.385 -8.288 1.00 0.00 H new ATOM 0 HH12 ARG A 76 8.492 -16.727 -8.924 1.00 0.00 H new ATOM 0 HH21 ARG A 76 6.202 -17.497 -11.492 1.00 0.00 H new ATOM 0 HH22 ARG A 76 7.740 -17.919 -10.731 1.00 0.00 H new ATOM 1105 N PRO A 77 5.225 -11.155 -5.869 1.00 0.00 N ATOM 1106 CA PRO A 77 5.491 -9.868 -5.220 1.00 0.00 C ATOM 1107 C PRO A 77 5.027 -8.686 -6.064 1.00 0.00 C ATOM 1108 O PRO A 77 4.729 -7.613 -5.537 1.00 0.00 O ATOM 1109 CB PRO A 77 7.015 -9.854 -5.072 1.00 0.00 C ATOM 1110 CG PRO A 77 7.508 -10.754 -6.151 1.00 0.00 C ATOM 1111 CD PRO A 77 6.461 -11.821 -6.312 1.00 0.00 C ATOM 0 HA PRO A 77 4.956 -9.770 -4.275 1.00 0.00 H new ATOM 0 HB2 PRO A 77 7.414 -8.846 -5.184 1.00 0.00 H new ATOM 0 HB3 PRO A 77 7.321 -10.211 -4.088 1.00 0.00 H new ATOM 0 HG2 PRO A 77 7.652 -10.205 -7.082 1.00 0.00 H new ATOM 0 HG3 PRO A 77 8.471 -11.190 -5.886 1.00 0.00 H new ATOM 0 HD2 PRO A 77 6.387 -12.159 -7.346 1.00 0.00 H new ATOM 0 HD3 PRO A 77 6.685 -12.698 -5.705 1.00 0.00 H new ATOM 1119 N VAL A 78 4.969 -8.888 -7.376 1.00 0.00 N ATOM 1120 CA VAL A 78 4.540 -7.839 -8.293 1.00 0.00 C ATOM 1121 C VAL A 78 3.556 -8.379 -9.325 1.00 0.00 C ATOM 1122 O VAL A 78 3.403 -9.590 -9.477 1.00 0.00 O ATOM 1123 CB VAL A 78 5.739 -7.207 -9.025 1.00 0.00 C ATOM 1124 CG1 VAL A 78 6.752 -6.670 -8.025 1.00 0.00 C ATOM 1125 CG2 VAL A 78 6.385 -8.219 -9.959 1.00 0.00 C ATOM 0 H VAL A 78 5.214 -9.769 -7.828 1.00 0.00 H new ATOM 0 HA VAL A 78 4.048 -7.075 -7.691 1.00 0.00 H new ATOM 0 HB VAL A 78 5.378 -6.371 -9.625 1.00 0.00 H new ATOM 0 HG11 VAL A 78 7.592 -6.227 -8.560 1.00 0.00 H new ATOM 0 HG12 VAL A 78 6.280 -5.912 -7.400 1.00 0.00 H new ATOM 0 HG13 VAL A 78 7.111 -7.486 -7.397 1.00 0.00 H new ATOM 0 HG21 VAL A 78 7.230 -7.756 -10.468 1.00 0.00 H new ATOM 0 HG22 VAL A 78 6.734 -9.076 -9.382 1.00 0.00 H new ATOM 0 HG23 VAL A 78 5.655 -8.551 -10.697 1.00 0.00 H new ATOM 1135 N GLY A 79 2.891 -7.471 -10.033 1.00 0.00 N ATOM 1136 CA GLY A 79 1.930 -7.876 -11.042 1.00 0.00 C ATOM 1137 C GLY A 79 0.519 -7.429 -10.712 1.00 0.00 C ATOM 1138 O GLY A 79 -0.077 -7.900 -9.745 1.00 0.00 O ATOM 0 H GLY A 79 3.001 -6.463 -9.926 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.223 -7.461 -12.006 1.00 0.00 H new ATOM 0 HA3 GLY A 79 1.950 -8.961 -11.143 1.00 0.00 H new ATOM 1142 N MET A 80 -0.015 -6.517 -11.518 1.00 0.00 N ATOM 1143 CA MET A 80 -1.364 -6.007 -11.306 1.00 0.00 C ATOM 1144 C MET A 80 -2.346 -7.149 -11.065 1.00 0.00 C ATOM 1145 O MET A 80 -3.025 -7.191 -10.039 1.00 0.00 O ATOM 1146 CB MET A 80 -1.814 -5.177 -12.510 1.00 0.00 C ATOM 1147 CG MET A 80 -1.463 -3.702 -12.397 1.00 0.00 C ATOM 1148 SD MET A 80 -2.762 -2.738 -11.600 1.00 0.00 S ATOM 1149 CE MET A 80 -2.278 -2.874 -9.881 1.00 0.00 C ATOM 0 H MET A 80 0.466 -6.116 -12.323 1.00 0.00 H new ATOM 0 HA MET A 80 -1.350 -5.371 -10.421 1.00 0.00 H new ATOM 0 HB2 MET A 80 -1.356 -5.583 -13.412 1.00 0.00 H new ATOM 0 HB3 MET A 80 -2.893 -5.277 -12.627 1.00 0.00 H new ATOM 0 HG2 MET A 80 -0.538 -3.595 -11.831 1.00 0.00 H new ATOM 0 HG3 MET A 80 -1.276 -3.300 -13.393 1.00 0.00 H new ATOM 0 HE1 MET A 80 -2.728 -2.061 -9.311 1.00 0.00 H new ATOM 0 HE2 MET A 80 -2.618 -3.829 -9.482 1.00 0.00 H new ATOM 0 HE3 MET A 80 -1.192 -2.814 -9.803 1.00 0.00 H new ATOM 1159 N ASP A 81 -2.415 -8.073 -12.017 1.00 0.00 N ATOM 1160 CA ASP A 81 -3.314 -9.217 -11.908 1.00 0.00 C ATOM 1161 C ASP A 81 -3.343 -9.751 -10.479 1.00 0.00 C ATOM 1162 O ASP A 81 -4.402 -10.099 -9.955 1.00 0.00 O ATOM 1163 CB ASP A 81 -2.883 -10.324 -12.871 1.00 0.00 C ATOM 1164 CG ASP A 81 -3.478 -10.152 -14.255 1.00 0.00 C ATOM 1165 OD1 ASP A 81 -4.624 -10.600 -14.467 1.00 0.00 O ATOM 1166 OD2 ASP A 81 -2.798 -9.569 -15.125 1.00 0.00 O ATOM 0 H ASP A 81 -1.860 -8.053 -12.872 1.00 0.00 H new ATOM 0 HA ASP A 81 -4.318 -8.886 -12.173 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -1.796 -10.334 -12.945 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -3.184 -11.291 -12.467 1.00 0.00 H new ATOM 1171 N THR A 82 -2.172 -9.815 -9.853 1.00 0.00 N ATOM 1172 CA THR A 82 -2.062 -10.309 -8.486 1.00 0.00 C ATOM 1173 C THR A 82 -2.771 -9.380 -7.507 1.00 0.00 C ATOM 1174 O THR A 82 -3.414 -9.834 -6.559 1.00 0.00 O ATOM 1175 CB THR A 82 -0.589 -10.458 -8.059 1.00 0.00 C ATOM 1176 OG1 THR A 82 0.157 -11.108 -9.094 1.00 0.00 O ATOM 1177 CG2 THR A 82 -0.478 -11.256 -6.768 1.00 0.00 C ATOM 0 H THR A 82 -1.286 -9.531 -10.271 1.00 0.00 H new ATOM 0 HA THR A 82 -2.540 -11.288 -8.465 1.00 0.00 H new ATOM 0 HB THR A 82 -0.180 -9.462 -7.888 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.112 -10.920 -8.976 1.00 0.00 H new ATOM 0 HG21 THR A 82 0.571 -11.348 -6.486 1.00 0.00 H new ATOM 0 HG22 THR A 82 -1.023 -10.743 -5.975 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.902 -12.249 -6.916 1.00 0.00 H new ATOM 1185 N LEU A 83 -2.652 -8.078 -7.742 1.00 0.00 N ATOM 1186 CA LEU A 83 -3.284 -7.084 -6.881 1.00 0.00 C ATOM 1187 C LEU A 83 -4.801 -7.116 -7.034 1.00 0.00 C ATOM 1188 O LEU A 83 -5.530 -7.261 -6.054 1.00 0.00 O ATOM 1189 CB LEU A 83 -2.756 -5.687 -7.210 1.00 0.00 C ATOM 1190 CG LEU A 83 -2.738 -4.687 -6.053 1.00 0.00 C ATOM 1191 CD1 LEU A 83 -1.424 -4.775 -5.292 1.00 0.00 C ATOM 1192 CD2 LEU A 83 -2.965 -3.273 -6.567 1.00 0.00 C ATOM 0 H LEU A 83 -2.124 -7.686 -8.521 1.00 0.00 H new ATOM 0 HA LEU A 83 -3.037 -7.325 -5.847 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -1.741 -5.785 -7.595 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -3.363 -5.271 -8.014 1.00 0.00 H new ATOM 0 HG LEU A 83 -3.548 -4.938 -5.368 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -1.429 -4.056 -4.473 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -1.302 -5.781 -4.891 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -0.597 -4.550 -5.966 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -2.949 -2.575 -5.730 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -2.177 -3.012 -7.273 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -3.932 -3.218 -7.067 1.00 0.00 H new ATOM 1204 N ASN A 84 -5.269 -6.983 -8.271 1.00 0.00 N ATOM 1205 CA ASN A 84 -6.700 -6.998 -8.553 1.00 0.00 C ATOM 1206 C ASN A 84 -7.353 -8.253 -7.982 1.00 0.00 C ATOM 1207 O ASN A 84 -8.559 -8.281 -7.736 1.00 0.00 O ATOM 1208 CB ASN A 84 -6.944 -6.923 -10.061 1.00 0.00 C ATOM 1209 CG ASN A 84 -6.939 -5.497 -10.578 1.00 0.00 C ATOM 1210 OD1 ASN A 84 -7.948 -5.003 -11.079 1.00 0.00 O ATOM 1211 ND2 ASN A 84 -5.797 -4.829 -10.457 1.00 0.00 N ATOM 0 H ASN A 84 -4.678 -6.864 -9.094 1.00 0.00 H new ATOM 0 HA ASN A 84 -7.149 -6.127 -8.076 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -6.176 -7.497 -10.579 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -7.902 -7.388 -10.295 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -5.732 -3.866 -10.786 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -4.985 -5.279 -10.035 1.00 0.00 H new ATOM 1218 N SER A 85 -6.548 -9.290 -7.773 1.00 0.00 N ATOM 1219 CA SER A 85 -7.048 -10.549 -7.234 1.00 0.00 C ATOM 1220 C SER A 85 -7.329 -10.427 -5.740 1.00 0.00 C ATOM 1221 O SER A 85 -8.359 -10.892 -5.251 1.00 0.00 O ATOM 1222 CB SER A 85 -6.039 -11.672 -7.485 1.00 0.00 C ATOM 1223 OG SER A 85 -6.602 -12.939 -7.189 1.00 0.00 O ATOM 0 H SER A 85 -5.547 -9.283 -7.969 1.00 0.00 H new ATOM 0 HA SER A 85 -7.982 -10.788 -7.743 1.00 0.00 H new ATOM 0 HB2 SER A 85 -5.715 -11.648 -8.526 1.00 0.00 H new ATOM 0 HB3 SER A 85 -5.152 -11.512 -6.872 1.00 0.00 H new ATOM 0 HG SER A 85 -5.938 -13.640 -7.359 1.00 0.00 H new ATOM 1229 N ALA A 86 -6.406 -9.799 -5.020 1.00 0.00 N ATOM 1230 CA ALA A 86 -6.554 -9.613 -3.582 1.00 0.00 C ATOM 1231 C ALA A 86 -7.714 -8.675 -3.266 1.00 0.00 C ATOM 1232 O ALA A 86 -8.575 -8.992 -2.444 1.00 0.00 O ATOM 1233 CB ALA A 86 -5.262 -9.078 -2.983 1.00 0.00 C ATOM 0 H ALA A 86 -5.547 -9.410 -5.409 1.00 0.00 H new ATOM 0 HA ALA A 86 -6.774 -10.583 -3.136 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -5.387 -8.944 -1.909 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -4.454 -9.786 -3.169 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -5.017 -8.120 -3.442 1.00 0.00 H new ATOM 1239 N ILE A 87 -7.731 -7.520 -3.923 1.00 0.00 N ATOM 1240 CA ILE A 87 -8.786 -6.537 -3.712 1.00 0.00 C ATOM 1241 C ILE A 87 -10.165 -7.182 -3.803 1.00 0.00 C ATOM 1242 O ILE A 87 -10.993 -7.027 -2.906 1.00 0.00 O ATOM 1243 CB ILE A 87 -8.700 -5.390 -4.736 1.00 0.00 C ATOM 1244 CG1 ILE A 87 -7.399 -4.607 -4.548 1.00 0.00 C ATOM 1245 CG2 ILE A 87 -9.903 -4.469 -4.602 1.00 0.00 C ATOM 1246 CD1 ILE A 87 -6.986 -3.819 -5.772 1.00 0.00 C ATOM 0 H ILE A 87 -7.026 -7.242 -4.606 1.00 0.00 H new ATOM 0 HA ILE A 87 -8.643 -6.131 -2.711 1.00 0.00 H new ATOM 0 HB ILE A 87 -8.704 -5.817 -5.739 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -7.514 -3.923 -3.707 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.601 -5.302 -4.287 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -9.828 -3.663 -5.332 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -10.817 -5.036 -4.780 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -9.928 -4.047 -3.597 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -6.056 -3.289 -5.567 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -6.838 -4.500 -6.610 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -7.766 -3.100 -6.022 1.00 0.00 H new ATOM 1258 N GLU A 88 -10.402 -7.907 -4.891 1.00 0.00 N ATOM 1259 CA GLU A 88 -11.681 -8.577 -5.098 1.00 0.00 C ATOM 1260 C GLU A 88 -11.902 -9.664 -4.050 1.00 0.00 C ATOM 1261 O GLU A 88 -13.019 -9.868 -3.579 1.00 0.00 O ATOM 1262 CB GLU A 88 -11.742 -9.185 -6.501 1.00 0.00 C ATOM 1263 CG GLU A 88 -11.761 -8.150 -7.613 1.00 0.00 C ATOM 1264 CD GLU A 88 -12.394 -8.675 -8.888 1.00 0.00 C ATOM 1265 OE1 GLU A 88 -11.819 -9.599 -9.499 1.00 0.00 O ATOM 1266 OE2 GLU A 88 -13.464 -8.160 -9.273 1.00 0.00 O ATOM 0 H GLU A 88 -9.726 -8.046 -5.642 1.00 0.00 H new ATOM 0 HA GLU A 88 -12.472 -7.834 -4.997 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -10.883 -9.841 -6.641 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -12.634 -9.807 -6.580 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -12.308 -7.270 -7.276 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -10.741 -7.830 -7.824 1.00 0.00 H new ATOM 1273 N ASN A 89 -10.827 -10.359 -3.692 1.00 0.00 N ATOM 1274 CA ASN A 89 -10.903 -11.426 -2.701 1.00 0.00 C ATOM 1275 C ASN A 89 -11.512 -10.917 -1.398 1.00 0.00 C ATOM 1276 O ASN A 89 -12.416 -11.538 -0.838 1.00 0.00 O ATOM 1277 CB ASN A 89 -9.511 -12.004 -2.435 1.00 0.00 C ATOM 1278 CG ASN A 89 -9.157 -13.124 -3.394 1.00 0.00 C ATOM 1279 OD1 ASN A 89 -9.917 -14.077 -3.561 1.00 0.00 O ATOM 1280 ND2 ASN A 89 -7.996 -13.012 -4.030 1.00 0.00 N ATOM 0 H ASN A 89 -9.894 -10.203 -4.073 1.00 0.00 H new ATOM 0 HA ASN A 89 -11.545 -12.212 -3.099 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -8.769 -11.210 -2.518 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -9.465 -12.377 -1.412 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -7.703 -13.734 -4.688 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -7.397 -12.204 -3.860 1.00 0.00 H new ATOM 1287 N LEU A 90 -11.010 -9.783 -0.921 1.00 0.00 N ATOM 1288 CA LEU A 90 -11.505 -9.188 0.316 1.00 0.00 C ATOM 1289 C LEU A 90 -12.863 -8.529 0.098 1.00 0.00 C ATOM 1290 O LEU A 90 -13.789 -8.718 0.887 1.00 0.00 O ATOM 1291 CB LEU A 90 -10.505 -8.159 0.845 1.00 0.00 C ATOM 1292 CG LEU A 90 -9.395 -8.703 1.746 1.00 0.00 C ATOM 1293 CD1 LEU A 90 -9.981 -9.569 2.851 1.00 0.00 C ATOM 1294 CD2 LEU A 90 -8.383 -9.492 0.928 1.00 0.00 C ATOM 0 H LEU A 90 -10.261 -9.257 -1.372 1.00 0.00 H new ATOM 0 HA LEU A 90 -11.622 -9.984 1.052 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -10.042 -7.660 -0.007 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -11.055 -7.399 1.399 1.00 0.00 H new ATOM 0 HG LEU A 90 -8.881 -7.859 2.207 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -9.177 -9.947 3.482 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -10.667 -8.974 3.455 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -10.520 -10.407 2.409 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -7.601 -9.871 1.585 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -8.883 -10.328 0.439 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -7.940 -8.842 0.173 1.00 0.00 H new ATOM 1306 N MET A 91 -12.975 -7.757 -0.978 1.00 0.00 N ATOM 1307 CA MET A 91 -14.221 -7.073 -1.301 1.00 0.00 C ATOM 1308 C MET A 91 -15.394 -8.048 -1.294 1.00 0.00 C ATOM 1309 O MET A 91 -16.536 -7.661 -1.041 1.00 0.00 O ATOM 1310 CB MET A 91 -14.116 -6.394 -2.668 1.00 0.00 C ATOM 1311 CG MET A 91 -13.347 -5.083 -2.638 1.00 0.00 C ATOM 1312 SD MET A 91 -13.477 -4.166 -4.185 1.00 0.00 S ATOM 1313 CE MET A 91 -15.228 -3.790 -4.210 1.00 0.00 C ATOM 0 H MET A 91 -12.218 -7.590 -1.641 1.00 0.00 H new ATOM 0 HA MET A 91 -14.397 -6.314 -0.539 1.00 0.00 H new ATOM 0 HB2 MET A 91 -13.630 -7.075 -3.366 1.00 0.00 H new ATOM 0 HB3 MET A 91 -15.120 -6.208 -3.050 1.00 0.00 H new ATOM 0 HG2 MET A 91 -13.721 -4.465 -1.822 1.00 0.00 H new ATOM 0 HG3 MET A 91 -12.297 -5.287 -2.428 1.00 0.00 H new ATOM 0 HE1 MET A 91 -15.400 -2.898 -4.813 1.00 0.00 H new ATOM 0 HE2 MET A 91 -15.774 -4.630 -4.640 1.00 0.00 H new ATOM 0 HE3 MET A 91 -15.577 -3.613 -3.193 1.00 0.00 H new ATOM 1323 N THR A 92 -15.107 -9.316 -1.573 1.00 0.00 N ATOM 1324 CA THR A 92 -16.137 -10.345 -1.600 1.00 0.00 C ATOM 1325 C THR A 92 -16.411 -10.886 -0.202 1.00 0.00 C ATOM 1326 O THR A 92 -17.565 -11.065 0.190 1.00 0.00 O ATOM 1327 CB THR A 92 -15.740 -11.514 -2.521 1.00 0.00 C ATOM 1328 OG1 THR A 92 -14.350 -11.816 -2.358 1.00 0.00 O ATOM 1329 CG2 THR A 92 -16.022 -11.176 -3.978 1.00 0.00 C ATOM 0 H THR A 92 -14.168 -9.654 -1.784 1.00 0.00 H new ATOM 0 HA THR A 92 -17.041 -9.876 -1.989 1.00 0.00 H new ATOM 0 HB THR A 92 -16.336 -12.384 -2.244 1.00 0.00 H new ATOM 0 HG1 THR A 92 -14.074 -11.604 -1.442 1.00 0.00 H new ATOM 0 HG21 THR A 92 -15.733 -12.017 -4.609 1.00 0.00 H new ATOM 0 HG22 THR A 92 -17.086 -10.975 -4.106 1.00 0.00 H new ATOM 0 HG23 THR A 92 -15.449 -10.294 -4.264 1.00 0.00 H new ATOM 1337 N SER A 93 -15.344 -11.144 0.547 1.00 0.00 N ATOM 1338 CA SER A 93 -15.470 -11.668 1.903 1.00 0.00 C ATOM 1339 C SER A 93 -16.230 -10.690 2.794 1.00 0.00 C ATOM 1340 O SER A 93 -17.182 -11.067 3.478 1.00 0.00 O ATOM 1341 CB SER A 93 -14.087 -11.947 2.495 1.00 0.00 C ATOM 1342 OG SER A 93 -13.268 -10.792 2.444 1.00 0.00 O ATOM 0 H SER A 93 -14.383 -10.999 0.239 1.00 0.00 H new ATOM 0 HA SER A 93 -16.032 -12.601 1.856 1.00 0.00 H new ATOM 0 HB2 SER A 93 -14.190 -12.278 3.528 1.00 0.00 H new ATOM 0 HB3 SER A 93 -13.610 -12.759 1.946 1.00 0.00 H new ATOM 0 HG SER A 93 -13.626 -10.166 1.781 1.00 0.00 H new ATOM 1348 N SER A 94 -15.801 -9.432 2.782 1.00 0.00 N ATOM 1349 CA SER A 94 -16.437 -8.399 3.592 1.00 0.00 C ATOM 1350 C SER A 94 -17.059 -7.323 2.708 1.00 0.00 C ATOM 1351 O SER A 94 -16.713 -7.190 1.535 1.00 0.00 O ATOM 1352 CB SER A 94 -15.418 -7.768 4.543 1.00 0.00 C ATOM 1353 OG SER A 94 -15.039 -8.678 5.561 1.00 0.00 O ATOM 0 H SER A 94 -15.016 -9.103 2.220 1.00 0.00 H new ATOM 0 HA SER A 94 -17.229 -8.866 4.178 1.00 0.00 H new ATOM 0 HB2 SER A 94 -14.537 -7.457 3.982 1.00 0.00 H new ATOM 0 HB3 SER A 94 -15.843 -6.871 4.993 1.00 0.00 H new ATOM 0 HG SER A 94 -14.386 -8.252 6.154 1.00 0.00 H new ATOM 1359 N SER A 95 -17.982 -6.556 3.282 1.00 0.00 N ATOM 1360 CA SER A 95 -18.657 -5.493 2.546 1.00 0.00 C ATOM 1361 C SER A 95 -17.913 -4.170 2.700 1.00 0.00 C ATOM 1362 O SER A 95 -16.876 -4.099 3.360 1.00 0.00 O ATOM 1363 CB SER A 95 -20.098 -5.341 3.036 1.00 0.00 C ATOM 1364 OG SER A 95 -20.942 -4.872 1.999 1.00 0.00 O ATOM 0 H SER A 95 -18.279 -6.651 4.253 1.00 0.00 H new ATOM 0 HA SER A 95 -18.667 -5.764 1.490 1.00 0.00 H new ATOM 0 HB2 SER A 95 -20.464 -6.300 3.402 1.00 0.00 H new ATOM 0 HB3 SER A 95 -20.129 -4.647 3.876 1.00 0.00 H new ATOM 0 HG SER A 95 -21.858 -4.785 2.337 1.00 0.00 H new ATOM 1370 N LYS A 96 -18.451 -3.121 2.086 1.00 0.00 N ATOM 1371 CA LYS A 96 -17.842 -1.799 2.153 1.00 0.00 C ATOM 1372 C LYS A 96 -17.905 -1.243 3.572 1.00 0.00 C ATOM 1373 O LYS A 96 -17.010 -0.517 4.004 1.00 0.00 O ATOM 1374 CB LYS A 96 -18.544 -0.841 1.188 1.00 0.00 C ATOM 1375 CG LYS A 96 -18.017 0.582 1.252 1.00 0.00 C ATOM 1376 CD LYS A 96 -18.540 1.423 0.099 1.00 0.00 C ATOM 1377 CE LYS A 96 -17.654 2.632 -0.156 1.00 0.00 C ATOM 1378 NZ LYS A 96 -18.134 3.438 -1.312 1.00 0.00 N ATOM 0 H LYS A 96 -19.309 -3.162 1.536 1.00 0.00 H new ATOM 0 HA LYS A 96 -16.795 -1.894 1.864 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -18.431 -1.216 0.171 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -19.611 -0.834 1.408 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -18.310 1.037 2.198 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -16.927 0.569 1.229 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -18.593 0.813 -0.803 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -19.555 1.754 0.320 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -17.627 3.257 0.736 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -16.633 2.301 -0.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -17.503 4.253 -1.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -18.135 2.849 -2.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -19.099 3.776 -1.123 1.00 0.00 H new ATOM 1392 N GLU A 97 -18.968 -1.589 4.292 1.00 0.00 N ATOM 1393 CA GLU A 97 -19.145 -1.124 5.663 1.00 0.00 C ATOM 1394 C GLU A 97 -18.304 -1.951 6.631 1.00 0.00 C ATOM 1395 O GLU A 97 -17.655 -1.408 7.525 1.00 0.00 O ATOM 1396 CB GLU A 97 -20.621 -1.195 6.062 1.00 0.00 C ATOM 1397 CG GLU A 97 -21.178 -2.609 6.083 1.00 0.00 C ATOM 1398 CD GLU A 97 -22.693 -2.638 6.129 1.00 0.00 C ATOM 1399 OE1 GLU A 97 -23.273 -1.953 6.996 1.00 0.00 O ATOM 1400 OE2 GLU A 97 -23.298 -3.346 5.297 1.00 0.00 O ATOM 0 H GLU A 97 -19.718 -2.189 3.949 1.00 0.00 H new ATOM 0 HA GLU A 97 -18.812 -0.088 5.714 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -20.744 -0.750 7.050 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -21.206 -0.593 5.367 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -20.835 -3.144 5.198 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -20.782 -3.139 6.949 1.00 0.00 H new ATOM 1407 N ASP A 98 -18.323 -3.266 6.447 1.00 0.00 N ATOM 1408 CA ASP A 98 -17.562 -4.169 7.303 1.00 0.00 C ATOM 1409 C ASP A 98 -16.147 -3.645 7.524 1.00 0.00 C ATOM 1410 O ASP A 98 -15.567 -3.829 8.594 1.00 0.00 O ATOM 1411 CB ASP A 98 -17.511 -5.568 6.686 1.00 0.00 C ATOM 1412 CG ASP A 98 -18.825 -6.311 6.825 1.00 0.00 C ATOM 1413 OD1 ASP A 98 -19.684 -6.170 5.928 1.00 0.00 O ATOM 1414 OD2 ASP A 98 -18.995 -7.033 7.829 1.00 0.00 O ATOM 0 H ASP A 98 -18.857 -3.731 5.713 1.00 0.00 H new ATOM 0 HA ASP A 98 -18.064 -4.224 8.269 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -17.253 -5.487 5.630 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -16.719 -6.144 7.164 1.00 0.00 H new ATOM 1419 N TRP A 99 -15.597 -2.993 6.506 1.00 0.00 N ATOM 1420 CA TRP A 99 -14.249 -2.443 6.589 1.00 0.00 C ATOM 1421 C TRP A 99 -14.173 -1.345 7.644 1.00 0.00 C ATOM 1422 O TRP A 99 -14.757 -0.271 7.499 1.00 0.00 O ATOM 1423 CB TRP A 99 -13.816 -1.893 5.229 1.00 0.00 C ATOM 1424 CG TRP A 99 -14.118 -2.818 4.090 1.00 0.00 C ATOM 1425 CD1 TRP A 99 -14.195 -4.181 4.139 1.00 0.00 C ATOM 1426 CD2 TRP A 99 -14.383 -2.448 2.732 1.00 0.00 C ATOM 1427 NE1 TRP A 99 -14.491 -4.680 2.894 1.00 0.00 N ATOM 1428 CE2 TRP A 99 -14.612 -3.637 2.013 1.00 0.00 C ATOM 1429 CE3 TRP A 99 -14.450 -1.228 2.055 1.00 0.00 C ATOM 1430 CZ2 TRP A 99 -14.902 -3.640 0.652 1.00 0.00 C ATOM 1431 CZ3 TRP A 99 -14.738 -1.232 0.703 1.00 0.00 C ATOM 1432 CH2 TRP A 99 -14.962 -2.431 0.013 1.00 0.00 C ATOM 0 H TRP A 99 -16.064 -2.832 5.613 1.00 0.00 H new ATOM 0 HA TRP A 99 -13.572 -3.247 6.880 1.00 0.00 H new ATOM 0 HB2 TRP A 99 -14.315 -0.940 5.055 1.00 0.00 H new ATOM 0 HB3 TRP A 99 -12.745 -1.693 5.251 1.00 0.00 H new ATOM 0 HD1 TRP A 99 -14.045 -4.778 5.026 1.00 0.00 H new ATOM 0 HE1 TRP A 99 -14.603 -5.667 2.663 1.00 0.00 H new ATOM 0 HE3 TRP A 99 -14.280 -0.299 2.578 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 -15.074 -4.563 0.119 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 -14.791 -0.295 0.169 1.00 0.00 H new ATOM 0 HH2 TRP A 99 -15.186 -2.401 -1.043 1.00 0.00 H new ATOM 1443 N PRO A 100 -13.437 -1.617 8.731 1.00 0.00 N ATOM 1444 CA PRO A 100 -13.267 -0.663 9.831 1.00 0.00 C ATOM 1445 C PRO A 100 -12.413 0.536 9.433 1.00 0.00 C ATOM 1446 O PRO A 100 -11.401 0.388 8.748 1.00 0.00 O ATOM 1447 CB PRO A 100 -12.561 -1.487 10.910 1.00 0.00 C ATOM 1448 CG PRO A 100 -11.851 -2.562 10.162 1.00 0.00 C ATOM 1449 CD PRO A 100 -12.713 -2.876 8.971 1.00 0.00 C ATOM 0 HA PRO A 100 -14.218 -0.240 10.153 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -11.863 -0.875 11.482 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -13.275 -1.904 11.620 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -10.860 -2.232 9.850 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -11.711 -3.445 10.786 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -12.115 -3.166 8.107 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -13.397 -3.700 9.176 1.00 0.00 H new ATOM 1457 N SER A 101 -12.827 1.722 9.866 1.00 0.00 N ATOM 1458 CA SER A 101 -12.101 2.947 9.551 1.00 0.00 C ATOM 1459 C SER A 101 -10.738 2.961 10.235 1.00 0.00 C ATOM 1460 O SER A 101 -10.599 2.526 11.378 1.00 0.00 O ATOM 1461 CB SER A 101 -12.913 4.171 9.980 1.00 0.00 C ATOM 1462 OG SER A 101 -12.567 5.308 9.210 1.00 0.00 O ATOM 0 H SER A 101 -13.661 1.861 10.436 1.00 0.00 H new ATOM 0 HA SER A 101 -11.947 2.982 8.472 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.977 3.963 9.869 1.00 0.00 H new ATOM 0 HB3 SER A 101 -12.737 4.376 11.036 1.00 0.00 H new ATOM 0 HG SER A 101 -12.680 6.117 9.752 1.00 0.00 H new ATOM 1468 N VAL A 102 -9.732 3.465 9.526 1.00 0.00 N ATOM 1469 CA VAL A 102 -8.379 3.538 10.063 1.00 0.00 C ATOM 1470 C VAL A 102 -7.621 4.727 9.484 1.00 0.00 C ATOM 1471 O VAL A 102 -7.853 5.128 8.344 1.00 0.00 O ATOM 1472 CB VAL A 102 -7.589 2.248 9.772 1.00 0.00 C ATOM 1473 CG1 VAL A 102 -8.279 1.046 10.398 1.00 0.00 C ATOM 1474 CG2 VAL A 102 -7.420 2.055 8.272 1.00 0.00 C ATOM 0 H VAL A 102 -9.829 3.829 8.578 1.00 0.00 H new ATOM 0 HA VAL A 102 -8.473 3.662 11.142 1.00 0.00 H new ATOM 0 HB VAL A 102 -6.599 2.340 10.218 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -7.706 0.144 10.182 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -8.343 1.185 11.477 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -9.283 0.946 9.984 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -6.860 1.139 8.084 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -8.401 1.984 7.802 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -6.878 2.904 7.855 1.00 0.00 H new ATOM 1484 N ASN A 103 -6.713 5.286 10.277 1.00 0.00 N ATOM 1485 CA ASN A 103 -5.919 6.430 9.843 1.00 0.00 C ATOM 1486 C ASN A 103 -4.557 5.982 9.323 1.00 0.00 C ATOM 1487 O ASN A 103 -3.750 5.424 10.066 1.00 0.00 O ATOM 1488 CB ASN A 103 -5.737 7.418 10.996 1.00 0.00 C ATOM 1489 CG ASN A 103 -6.968 8.274 11.225 1.00 0.00 C ATOM 1490 OD1 ASN A 103 -7.003 9.445 10.846 1.00 0.00 O ATOM 1491 ND2 ASN A 103 -7.987 7.691 11.846 1.00 0.00 N ATOM 0 H ASN A 103 -6.509 4.966 11.224 1.00 0.00 H new ATOM 0 HA ASN A 103 -6.453 6.924 9.031 1.00 0.00 H new ATOM 0 HB2 ASN A 103 -5.505 6.868 11.908 1.00 0.00 H new ATOM 0 HB3 ASN A 103 -4.883 8.063 10.787 1.00 0.00 H new ATOM 0 HD21 ASN A 103 -8.842 8.216 12.026 1.00 0.00 H new ATOM 0 HD22 ASN A 103 -7.914 6.718 12.143 1.00 0.00 H new ATOM 1498 N MET A 104 -4.308 6.229 8.041 1.00 0.00 N ATOM 1499 CA MET A 104 -3.042 5.853 7.422 1.00 0.00 C ATOM 1500 C MET A 104 -2.007 6.961 7.583 1.00 0.00 C ATOM 1501 O MET A 104 -2.280 8.125 7.293 1.00 0.00 O ATOM 1502 CB MET A 104 -3.248 5.543 5.938 1.00 0.00 C ATOM 1503 CG MET A 104 -2.051 4.871 5.285 1.00 0.00 C ATOM 1504 SD MET A 104 -2.126 3.072 5.382 1.00 0.00 S ATOM 1505 CE MET A 104 -3.348 2.717 4.122 1.00 0.00 C ATOM 0 H MET A 104 -4.966 6.688 7.411 1.00 0.00 H new ATOM 0 HA MET A 104 -2.672 4.959 7.925 1.00 0.00 H new ATOM 0 HB2 MET A 104 -4.121 4.899 5.828 1.00 0.00 H new ATOM 0 HB3 MET A 104 -3.467 6.470 5.409 1.00 0.00 H new ATOM 0 HG2 MET A 104 -1.996 5.173 4.239 1.00 0.00 H new ATOM 0 HG3 MET A 104 -1.137 5.219 5.766 1.00 0.00 H new ATOM 0 HE1 MET A 104 -4.189 2.187 4.570 1.00 0.00 H new ATOM 0 HE2 MET A 104 -3.700 3.651 3.683 1.00 0.00 H new ATOM 0 HE3 MET A 104 -2.900 2.097 3.345 1.00 0.00 H new ATOM 1515 N ASN A 105 -0.818 6.591 8.048 1.00 0.00 N ATOM 1516 CA ASN A 105 0.258 7.555 8.249 1.00 0.00 C ATOM 1517 C ASN A 105 1.320 7.418 7.163 1.00 0.00 C ATOM 1518 O ASN A 105 1.670 6.309 6.757 1.00 0.00 O ATOM 1519 CB ASN A 105 0.893 7.361 9.628 1.00 0.00 C ATOM 1520 CG ASN A 105 -0.033 7.774 10.755 1.00 0.00 C ATOM 1521 OD1 ASN A 105 -1.225 7.999 10.542 1.00 0.00 O ATOM 1522 ND2 ASN A 105 0.512 7.876 11.961 1.00 0.00 N ATOM 0 H ASN A 105 -0.575 5.631 8.293 1.00 0.00 H new ATOM 0 HA ASN A 105 -0.168 8.556 8.191 1.00 0.00 H new ATOM 0 HB2 ASN A 105 1.169 6.314 9.754 1.00 0.00 H new ATOM 0 HB3 ASN A 105 1.813 7.942 9.686 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -0.062 8.151 12.758 1.00 0.00 H new ATOM 0 HD22 ASN A 105 1.505 7.680 12.090 1.00 0.00 H new ATOM 1529 N VAL A 106 1.832 8.553 6.697 1.00 0.00 N ATOM 1530 CA VAL A 106 2.856 8.561 5.659 1.00 0.00 C ATOM 1531 C VAL A 106 4.029 9.452 6.051 1.00 0.00 C ATOM 1532 O VAL A 106 4.557 10.199 5.227 1.00 0.00 O ATOM 1533 CB VAL A 106 2.287 9.043 4.312 1.00 0.00 C ATOM 1534 CG1 VAL A 106 3.333 8.920 3.215 1.00 0.00 C ATOM 1535 CG2 VAL A 106 1.032 8.260 3.954 1.00 0.00 C ATOM 0 H VAL A 106 1.554 9.479 7.022 1.00 0.00 H new ATOM 0 HA VAL A 106 3.204 7.534 5.551 1.00 0.00 H new ATOM 0 HB VAL A 106 2.017 10.095 4.407 1.00 0.00 H new ATOM 0 HG11 VAL A 106 2.912 9.265 2.271 1.00 0.00 H new ATOM 0 HG12 VAL A 106 4.201 9.529 3.470 1.00 0.00 H new ATOM 0 HG13 VAL A 106 3.637 7.878 3.117 1.00 0.00 H new ATOM 0 HG21 VAL A 106 0.643 8.613 2.999 1.00 0.00 H new ATOM 0 HG22 VAL A 106 1.274 7.200 3.877 1.00 0.00 H new ATOM 0 HG23 VAL A 106 0.279 8.405 4.729 1.00 0.00 H new ATOM 1545 N ALA A 107 4.432 9.369 7.315 1.00 0.00 N ATOM 1546 CA ALA A 107 5.545 10.166 7.816 1.00 0.00 C ATOM 1547 C ALA A 107 6.873 9.446 7.612 1.00 0.00 C ATOM 1548 O ALA A 107 6.930 8.216 7.619 1.00 0.00 O ATOM 1549 CB ALA A 107 5.339 10.492 9.288 1.00 0.00 C ATOM 0 H ALA A 107 4.004 8.758 8.011 1.00 0.00 H new ATOM 0 HA ALA A 107 5.577 11.097 7.250 1.00 0.00 H new ATOM 0 HB1 ALA A 107 6.177 11.087 9.650 1.00 0.00 H new ATOM 0 HB2 ALA A 107 4.414 11.056 9.410 1.00 0.00 H new ATOM 0 HB3 ALA A 107 5.278 9.566 9.861 1.00 0.00 H new ATOM 1555 N ASP A 108 7.938 10.218 7.429 1.00 0.00 N ATOM 1556 CA ASP A 108 9.266 9.653 7.224 1.00 0.00 C ATOM 1557 C ASP A 108 9.222 8.517 6.206 1.00 0.00 C ATOM 1558 O ASP A 108 9.832 7.468 6.405 1.00 0.00 O ATOM 1559 CB ASP A 108 9.839 9.145 8.548 1.00 0.00 C ATOM 1560 CG ASP A 108 11.355 9.140 8.559 1.00 0.00 C ATOM 1561 OD1 ASP A 108 11.952 8.415 7.736 1.00 0.00 O ATOM 1562 OD2 ASP A 108 11.944 9.861 9.392 1.00 0.00 O ATOM 0 H ASP A 108 7.907 11.237 7.418 1.00 0.00 H new ATOM 0 HA ASP A 108 9.912 10.441 6.836 1.00 0.00 H new ATOM 0 HB2 ASP A 108 9.475 9.771 9.362 1.00 0.00 H new ATOM 0 HB3 ASP A 108 9.474 8.135 8.735 1.00 0.00 H new ATOM 1567 N ALA A 109 8.494 8.735 5.115 1.00 0.00 N ATOM 1568 CA ALA A 109 8.371 7.731 4.066 1.00 0.00 C ATOM 1569 C ALA A 109 8.011 6.369 4.649 1.00 0.00 C ATOM 1570 O ALA A 109 8.449 5.332 4.150 1.00 0.00 O ATOM 1571 CB ALA A 109 9.663 7.641 3.267 1.00 0.00 C ATOM 0 H ALA A 109 7.981 9.598 4.935 1.00 0.00 H new ATOM 0 HA ALA A 109 7.565 8.036 3.399 1.00 0.00 H new ATOM 0 HB1 ALA A 109 9.557 6.887 2.487 1.00 0.00 H new ATOM 0 HB2 ALA A 109 9.877 8.608 2.811 1.00 0.00 H new ATOM 0 HB3 ALA A 109 10.482 7.364 3.930 1.00 0.00 H new ATOM 1577 N THR A 110 7.210 6.378 5.710 1.00 0.00 N ATOM 1578 CA THR A 110 6.792 5.143 6.363 1.00 0.00 C ATOM 1579 C THR A 110 5.273 5.016 6.379 1.00 0.00 C ATOM 1580 O THR A 110 4.562 5.986 6.642 1.00 0.00 O ATOM 1581 CB THR A 110 7.318 5.067 7.809 1.00 0.00 C ATOM 1582 OG1 THR A 110 8.731 5.299 7.829 1.00 0.00 O ATOM 1583 CG2 THR A 110 7.012 3.710 8.424 1.00 0.00 C ATOM 0 H THR A 110 6.838 7.227 6.136 1.00 0.00 H new ATOM 0 HA THR A 110 7.216 4.321 5.786 1.00 0.00 H new ATOM 0 HB THR A 110 6.816 5.836 8.397 1.00 0.00 H new ATOM 0 HG1 THR A 110 8.925 6.169 7.422 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.393 3.679 9.445 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.934 3.550 8.434 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.490 2.927 7.835 1.00 0.00 H new ATOM 1591 N VAL A 111 4.781 3.814 6.097 1.00 0.00 N ATOM 1592 CA VAL A 111 3.346 3.560 6.081 1.00 0.00 C ATOM 1593 C VAL A 111 2.899 2.852 7.355 1.00 0.00 C ATOM 1594 O VAL A 111 3.365 1.756 7.667 1.00 0.00 O ATOM 1595 CB VAL A 111 2.940 2.707 4.864 1.00 0.00 C ATOM 1596 CG1 VAL A 111 1.428 2.563 4.793 1.00 0.00 C ATOM 1597 CG2 VAL A 111 3.487 3.315 3.582 1.00 0.00 C ATOM 0 H VAL A 111 5.356 3.001 5.876 1.00 0.00 H new ATOM 0 HA VAL A 111 2.854 4.530 6.016 1.00 0.00 H new ATOM 0 HB VAL A 111 3.370 1.712 4.980 1.00 0.00 H new ATOM 0 HG11 VAL A 111 1.160 1.957 3.927 1.00 0.00 H new ATOM 0 HG12 VAL A 111 1.066 2.079 5.700 1.00 0.00 H new ATOM 0 HG13 VAL A 111 0.973 3.549 4.701 1.00 0.00 H new ATOM 0 HG21 VAL A 111 3.191 2.700 2.732 1.00 0.00 H new ATOM 0 HG22 VAL A 111 3.088 4.322 3.458 1.00 0.00 H new ATOM 0 HG23 VAL A 111 4.575 3.360 3.636 1.00 0.00 H new ATOM 1607 N THR A 112 1.990 3.487 8.090 1.00 0.00 N ATOM 1608 CA THR A 112 1.479 2.919 9.331 1.00 0.00 C ATOM 1609 C THR A 112 -0.041 3.007 9.392 1.00 0.00 C ATOM 1610 O THR A 112 -0.607 4.098 9.460 1.00 0.00 O ATOM 1611 CB THR A 112 2.073 3.632 10.561 1.00 0.00 C ATOM 1612 OG1 THR A 112 3.453 3.936 10.332 1.00 0.00 O ATOM 1613 CG2 THR A 112 1.940 2.766 11.805 1.00 0.00 C ATOM 0 H THR A 112 1.593 4.395 7.847 1.00 0.00 H new ATOM 0 HA THR A 112 1.780 1.871 9.346 1.00 0.00 H new ATOM 0 HB THR A 112 1.519 4.557 10.720 1.00 0.00 H new ATOM 0 HG1 THR A 112 3.823 4.391 11.118 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.366 3.290 12.660 1.00 0.00 H new ATOM 0 HG22 THR A 112 0.886 2.560 11.994 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.472 1.827 11.653 1.00 0.00 H new ATOM 1621 N VAL A 113 -0.698 1.852 9.368 1.00 0.00 N ATOM 1622 CA VAL A 113 -2.154 1.799 9.422 1.00 0.00 C ATOM 1623 C VAL A 113 -2.658 1.970 10.851 1.00 0.00 C ATOM 1624 O VAL A 113 -2.902 0.990 11.555 1.00 0.00 O ATOM 1625 CB VAL A 113 -2.689 0.470 8.857 1.00 0.00 C ATOM 1626 CG1 VAL A 113 -4.207 0.422 8.950 1.00 0.00 C ATOM 1627 CG2 VAL A 113 -2.228 0.279 7.419 1.00 0.00 C ATOM 0 H VAL A 113 -0.245 0.940 9.311 1.00 0.00 H new ATOM 0 HA VAL A 113 -2.523 2.621 8.809 1.00 0.00 H new ATOM 0 HB VAL A 113 -2.287 -0.347 9.455 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -4.567 -0.524 8.546 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -4.511 0.510 9.993 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -4.633 1.246 8.377 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -2.615 -0.665 7.035 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -2.600 1.100 6.806 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -1.139 0.265 7.385 1.00 0.00 H new ATOM 1637 N ILE A 114 -2.810 3.221 11.273 1.00 0.00 N ATOM 1638 CA ILE A 114 -3.286 3.520 12.618 1.00 0.00 C ATOM 1639 C ILE A 114 -4.795 3.322 12.724 1.00 0.00 C ATOM 1640 O ILE A 114 -5.532 3.570 11.770 1.00 0.00 O ATOM 1641 CB ILE A 114 -2.939 4.963 13.030 1.00 0.00 C ATOM 1642 CG1 ILE A 114 -1.478 5.273 12.700 1.00 0.00 C ATOM 1643 CG2 ILE A 114 -3.209 5.170 14.513 1.00 0.00 C ATOM 1644 CD1 ILE A 114 -0.492 4.584 13.618 1.00 0.00 C ATOM 0 H ILE A 114 -2.611 4.043 10.703 1.00 0.00 H new ATOM 0 HA ILE A 114 -2.783 2.827 13.292 1.00 0.00 H new ATOM 0 HB ILE A 114 -3.572 5.649 12.467 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -1.275 4.974 11.672 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -1.322 6.350 12.755 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -2.959 6.194 14.789 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -4.263 4.985 14.720 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -2.599 4.479 15.094 1.00 0.00 H new ATOM 0 HD11 ILE A 114 0.524 4.849 13.325 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -0.668 4.902 14.646 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -0.620 3.504 13.545 1.00 0.00 H new ATOM 1656 N SER A 115 -5.247 2.875 13.891 1.00 0.00 N ATOM 1657 CA SER A 115 -6.667 2.642 14.122 1.00 0.00 C ATOM 1658 C SER A 115 -7.392 3.951 14.417 1.00 0.00 C ATOM 1659 O SER A 115 -6.902 4.787 15.175 1.00 0.00 O ATOM 1660 CB SER A 115 -6.863 1.665 15.283 1.00 0.00 C ATOM 1661 OG SER A 115 -8.088 0.962 15.157 1.00 0.00 O ATOM 0 H SER A 115 -4.650 2.667 14.691 1.00 0.00 H new ATOM 0 HA SER A 115 -7.090 2.209 13.216 1.00 0.00 H new ATOM 0 HB2 SER A 115 -6.035 0.957 15.310 1.00 0.00 H new ATOM 0 HB3 SER A 115 -6.848 2.210 16.227 1.00 0.00 H new ATOM 0 HG SER A 115 -8.189 0.343 15.910 1.00 0.00 H new ATOM 1667 N GLU A 116 -8.563 4.122 13.810 1.00 0.00 N ATOM 1668 CA GLU A 116 -9.355 5.330 14.007 1.00 0.00 C ATOM 1669 C GLU A 116 -9.831 5.440 15.453 1.00 0.00 C ATOM 1670 O GLU A 116 -9.932 6.536 16.004 1.00 0.00 O ATOM 1671 CB GLU A 116 -10.558 5.338 13.061 1.00 0.00 C ATOM 1672 CG GLU A 116 -11.024 6.733 12.680 1.00 0.00 C ATOM 1673 CD GLU A 116 -12.504 6.784 12.354 1.00 0.00 C ATOM 1674 OE1 GLU A 116 -13.287 6.097 13.043 1.00 0.00 O ATOM 1675 OE2 GLU A 116 -12.880 7.511 11.411 1.00 0.00 O ATOM 0 H GLU A 116 -8.983 3.440 13.179 1.00 0.00 H new ATOM 0 HA GLU A 116 -8.721 6.189 13.785 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -10.300 4.790 12.155 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.383 4.804 13.532 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -10.812 7.419 13.500 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -10.454 7.080 11.818 1.00 0.00 H new ATOM 1682 N LYS A 117 -10.122 4.296 16.062 1.00 0.00 N ATOM 1683 CA LYS A 117 -10.586 4.260 17.444 1.00 0.00 C ATOM 1684 C LYS A 117 -9.468 4.656 18.403 1.00 0.00 C ATOM 1685 O LYS A 117 -9.704 5.343 19.396 1.00 0.00 O ATOM 1686 CB LYS A 117 -11.103 2.863 17.794 1.00 0.00 C ATOM 1687 CG LYS A 117 -12.336 2.456 17.006 1.00 0.00 C ATOM 1688 CD LYS A 117 -12.632 0.974 17.161 1.00 0.00 C ATOM 1689 CE LYS A 117 -14.116 0.682 16.999 1.00 0.00 C ATOM 1690 NZ LYS A 117 -14.473 -0.673 17.502 1.00 0.00 N ATOM 0 H LYS A 117 -10.045 3.380 15.620 1.00 0.00 H new ATOM 0 HA LYS A 117 -11.400 4.977 17.547 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -10.311 2.136 17.614 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -11.334 2.826 18.859 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -13.194 3.037 17.345 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -12.189 2.690 15.952 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -12.066 0.409 16.420 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -12.299 0.636 18.142 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -14.695 1.433 17.537 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -14.389 0.762 15.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -15.493 -0.833 17.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -13.940 -1.392 16.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -14.236 -0.742 18.512 1.00 0.00 H new ATOM 1704 N ASN A 118 -8.251 4.217 18.100 1.00 0.00 N ATOM 1705 CA ASN A 118 -7.097 4.526 18.936 1.00 0.00 C ATOM 1706 C ASN A 118 -5.916 4.986 18.085 1.00 0.00 C ATOM 1707 O ASN A 118 -5.450 4.258 17.209 1.00 0.00 O ATOM 1708 CB ASN A 118 -6.697 3.303 19.763 1.00 0.00 C ATOM 1709 CG ASN A 118 -7.782 2.885 20.737 1.00 0.00 C ATOM 1710 OD1 ASN A 118 -8.833 2.386 20.337 1.00 0.00 O ATOM 1711 ND2 ASN A 118 -7.529 3.088 22.025 1.00 0.00 N ATOM 0 H ASN A 118 -8.038 3.646 17.282 1.00 0.00 H new ATOM 0 HA ASN A 118 -7.375 5.337 19.610 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -6.473 2.472 19.094 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -5.783 3.523 20.314 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -8.220 2.827 22.728 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -6.643 3.505 22.311 1.00 0.00 H new ATOM 1718 N GLU A 119 -5.439 6.198 18.351 1.00 0.00 N ATOM 1719 CA GLU A 119 -4.313 6.754 17.609 1.00 0.00 C ATOM 1720 C GLU A 119 -3.032 5.980 17.904 1.00 0.00 C ATOM 1721 O GLU A 119 -2.239 5.706 17.003 1.00 0.00 O ATOM 1722 CB GLU A 119 -4.122 8.231 17.960 1.00 0.00 C ATOM 1723 CG GLU A 119 -3.419 9.029 16.875 1.00 0.00 C ATOM 1724 CD GLU A 119 -3.366 10.512 17.183 1.00 0.00 C ATOM 1725 OE1 GLU A 119 -2.600 10.904 18.088 1.00 0.00 O ATOM 1726 OE2 GLU A 119 -4.091 11.282 16.519 1.00 0.00 O ATOM 0 H GLU A 119 -5.814 6.813 19.073 1.00 0.00 H new ATOM 0 HA GLU A 119 -4.533 6.666 16.545 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -5.097 8.678 18.154 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -3.548 8.305 18.883 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -2.404 8.651 16.751 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -3.934 8.877 15.926 1.00 0.00 H new ATOM 1733 N GLU A 120 -2.836 5.631 19.172 1.00 0.00 N ATOM 1734 CA GLU A 120 -1.650 4.890 19.585 1.00 0.00 C ATOM 1735 C GLU A 120 -1.840 3.392 19.364 1.00 0.00 C ATOM 1736 O GLU A 120 -1.448 2.577 20.198 1.00 0.00 O ATOM 1737 CB GLU A 120 -1.339 5.164 21.058 1.00 0.00 C ATOM 1738 CG GLU A 120 -1.172 6.639 21.381 1.00 0.00 C ATOM 1739 CD GLU A 120 -1.230 6.920 22.870 1.00 0.00 C ATOM 1740 OE1 GLU A 120 -2.211 6.495 23.515 1.00 0.00 O ATOM 1741 OE2 GLU A 120 -0.296 7.566 23.390 1.00 0.00 O ATOM 0 H GLU A 120 -3.483 5.849 19.930 1.00 0.00 H new ATOM 0 HA GLU A 120 -0.812 5.226 18.975 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -2.141 4.755 21.672 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -0.426 4.635 21.332 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -0.218 6.988 20.986 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -1.953 7.208 20.877 1.00 0.00 H new ATOM 1748 N GLU A 121 -2.444 3.039 18.234 1.00 0.00 N ATOM 1749 CA GLU A 121 -2.688 1.639 17.904 1.00 0.00 C ATOM 1750 C GLU A 121 -2.284 1.343 16.462 1.00 0.00 C ATOM 1751 O GLU A 121 -3.101 1.434 15.546 1.00 0.00 O ATOM 1752 CB GLU A 121 -4.163 1.291 18.114 1.00 0.00 C ATOM 1753 CG GLU A 121 -4.421 -0.198 18.262 1.00 0.00 C ATOM 1754 CD GLU A 121 -5.655 -0.497 19.092 1.00 0.00 C ATOM 1755 OE1 GLU A 121 -5.572 -0.393 20.334 1.00 0.00 O ATOM 1756 OE2 GLU A 121 -6.701 -0.834 18.501 1.00 0.00 O ATOM 0 H GLU A 121 -2.773 3.702 17.532 1.00 0.00 H new ATOM 0 HA GLU A 121 -2.080 1.024 18.568 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -4.526 1.804 19.005 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -4.741 1.669 17.271 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -4.536 -0.643 17.274 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -3.554 -0.669 18.725 1.00 0.00 H new ATOM 1763 N VAL A 122 -1.018 0.987 16.269 1.00 0.00 N ATOM 1764 CA VAL A 122 -0.505 0.676 14.941 1.00 0.00 C ATOM 1765 C VAL A 122 -0.903 -0.732 14.514 1.00 0.00 C ATOM 1766 O VAL A 122 -0.293 -1.716 14.935 1.00 0.00 O ATOM 1767 CB VAL A 122 1.030 0.803 14.887 1.00 0.00 C ATOM 1768 CG1 VAL A 122 1.566 0.246 13.578 1.00 0.00 C ATOM 1769 CG2 VAL A 122 1.451 2.253 15.072 1.00 0.00 C ATOM 0 H VAL A 122 -0.329 0.907 17.016 1.00 0.00 H new ATOM 0 HA VAL A 122 -0.946 1.399 14.255 1.00 0.00 H new ATOM 0 HB VAL A 122 1.455 0.219 15.703 1.00 0.00 H new ATOM 0 HG11 VAL A 122 2.651 0.344 13.558 1.00 0.00 H new ATOM 0 HG12 VAL A 122 1.295 -0.806 13.492 1.00 0.00 H new ATOM 0 HG13 VAL A 122 1.136 0.800 12.744 1.00 0.00 H new ATOM 0 HG21 VAL A 122 2.538 2.324 15.031 1.00 0.00 H new ATOM 0 HG22 VAL A 122 1.017 2.862 14.279 1.00 0.00 H new ATOM 0 HG23 VAL A 122 1.100 2.613 16.039 1.00 0.00 H new ATOM 1779 N LEU A 123 -1.928 -0.822 13.674 1.00 0.00 N ATOM 1780 CA LEU A 123 -2.408 -2.111 13.188 1.00 0.00 C ATOM 1781 C LEU A 123 -1.377 -2.767 12.275 1.00 0.00 C ATOM 1782 O LEU A 123 -1.117 -3.966 12.375 1.00 0.00 O ATOM 1783 CB LEU A 123 -3.731 -1.935 12.440 1.00 0.00 C ATOM 1784 CG LEU A 123 -4.839 -1.205 13.199 1.00 0.00 C ATOM 1785 CD1 LEU A 123 -5.924 -0.738 12.240 1.00 0.00 C ATOM 1786 CD2 LEU A 123 -5.429 -2.104 14.276 1.00 0.00 C ATOM 0 H LEU A 123 -2.443 -0.018 13.315 1.00 0.00 H new ATOM 0 HA LEU A 123 -2.568 -2.760 14.049 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -3.533 -1.393 11.515 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -4.100 -2.921 12.158 1.00 0.00 H new ATOM 0 HG LEU A 123 -4.406 -0.329 13.682 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -6.704 -0.220 12.798 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -5.492 -0.059 11.505 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -6.354 -1.600 11.729 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -6.216 -1.568 14.806 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -5.847 -2.999 13.814 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -4.647 -2.390 14.980 1.00 0.00 H new ATOM 1798 N VAL A 124 -0.792 -1.972 11.384 1.00 0.00 N ATOM 1799 CA VAL A 124 0.213 -2.474 10.455 1.00 0.00 C ATOM 1800 C VAL A 124 1.302 -1.436 10.209 1.00 0.00 C ATOM 1801 O VAL A 124 1.045 -0.377 9.637 1.00 0.00 O ATOM 1802 CB VAL A 124 -0.417 -2.870 9.107 1.00 0.00 C ATOM 1803 CG1 VAL A 124 0.663 -3.113 8.063 1.00 0.00 C ATOM 1804 CG2 VAL A 124 -1.297 -4.100 9.271 1.00 0.00 C ATOM 0 H VAL A 124 -0.997 -0.978 11.286 1.00 0.00 H new ATOM 0 HA VAL A 124 0.655 -3.358 10.915 1.00 0.00 H new ATOM 0 HB VAL A 124 -1.043 -2.047 8.763 1.00 0.00 H new ATOM 0 HG11 VAL A 124 0.199 -3.392 7.117 1.00 0.00 H new ATOM 0 HG12 VAL A 124 1.248 -2.203 7.926 1.00 0.00 H new ATOM 0 HG13 VAL A 124 1.317 -3.918 8.397 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -1.734 -4.366 8.308 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -0.695 -4.931 9.638 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -2.093 -3.885 9.984 1.00 0.00 H new ATOM 1814 N GLU A 125 2.519 -1.747 10.646 1.00 0.00 N ATOM 1815 CA GLU A 125 3.647 -0.840 10.473 1.00 0.00 C ATOM 1816 C GLU A 125 4.541 -1.296 9.323 1.00 0.00 C ATOM 1817 O GLU A 125 5.368 -2.194 9.485 1.00 0.00 O ATOM 1818 CB GLU A 125 4.463 -0.753 11.764 1.00 0.00 C ATOM 1819 CG GLU A 125 5.593 0.261 11.703 1.00 0.00 C ATOM 1820 CD GLU A 125 6.479 0.222 12.934 1.00 0.00 C ATOM 1821 OE1 GLU A 125 5.969 0.491 14.041 1.00 0.00 O ATOM 1822 OE2 GLU A 125 7.682 -0.078 12.788 1.00 0.00 O ATOM 0 H GLU A 125 2.748 -2.620 11.122 1.00 0.00 H new ATOM 0 HA GLU A 125 3.252 0.148 10.234 1.00 0.00 H new ATOM 0 HB2 GLU A 125 3.798 -0.494 12.588 1.00 0.00 H new ATOM 0 HB3 GLU A 125 4.879 -1.735 11.988 1.00 0.00 H new ATOM 0 HG2 GLU A 125 6.199 0.071 10.817 1.00 0.00 H new ATOM 0 HG3 GLU A 125 5.173 1.261 11.593 1.00 0.00 H new ATOM 1829 N CYS A 126 4.368 -0.672 8.164 1.00 0.00 N ATOM 1830 CA CYS A 126 5.158 -1.014 6.986 1.00 0.00 C ATOM 1831 C CYS A 126 5.974 0.184 6.512 1.00 0.00 C ATOM 1832 O CYS A 126 5.619 1.333 6.775 1.00 0.00 O ATOM 1833 CB CYS A 126 4.246 -1.503 5.860 1.00 0.00 C ATOM 1834 SG CYS A 126 5.027 -2.690 4.741 1.00 0.00 S ATOM 0 H CYS A 126 3.688 0.073 8.014 1.00 0.00 H new ATOM 0 HA CYS A 126 5.846 -1.814 7.260 1.00 0.00 H new ATOM 0 HB2 CYS A 126 3.360 -1.962 6.298 1.00 0.00 H new ATOM 0 HB3 CYS A 126 3.907 -0.643 5.282 1.00 0.00 H new ATOM 0 HG CYS A 126 4.506 -2.576 3.555 1.00 0.00 H new ATOM 1840 N ARG A 127 7.070 -0.093 5.813 1.00 0.00 N ATOM 1841 CA ARG A 127 7.939 0.962 5.305 1.00 0.00 C ATOM 1842 C ARG A 127 8.040 0.898 3.784 1.00 0.00 C ATOM 1843 O ARG A 127 7.567 -0.052 3.160 1.00 0.00 O ATOM 1844 CB ARG A 127 9.333 0.847 5.925 1.00 0.00 C ATOM 1845 CG ARG A 127 9.419 1.399 7.338 1.00 0.00 C ATOM 1846 CD ARG A 127 10.616 0.833 8.086 1.00 0.00 C ATOM 1847 NE ARG A 127 11.076 1.730 9.143 1.00 0.00 N ATOM 1848 CZ ARG A 127 10.545 1.764 10.360 1.00 0.00 C ATOM 1849 NH1 ARG A 127 9.543 0.954 10.673 1.00 0.00 N ATOM 1850 NH2 ARG A 127 11.018 2.608 11.268 1.00 0.00 N ATOM 0 H ARG A 127 7.377 -1.039 5.586 1.00 0.00 H new ATOM 0 HA ARG A 127 7.504 1.922 5.583 1.00 0.00 H new ATOM 0 HB2 ARG A 127 9.631 -0.201 5.935 1.00 0.00 H new ATOM 0 HB3 ARG A 127 10.047 1.376 5.293 1.00 0.00 H new ATOM 0 HG2 ARG A 127 9.492 2.486 7.301 1.00 0.00 H new ATOM 0 HG3 ARG A 127 8.504 1.160 7.880 1.00 0.00 H new ATOM 0 HD2 ARG A 127 10.350 -0.131 8.519 1.00 0.00 H new ATOM 0 HD3 ARG A 127 11.430 0.653 7.384 1.00 0.00 H new ATOM 0 HE ARG A 127 11.847 2.365 8.935 1.00 0.00 H new ATOM 0 HH11 ARG A 127 9.178 0.302 9.978 1.00 0.00 H new ATOM 0 HH12 ARG A 127 9.137 0.982 11.608 1.00 0.00 H new ATOM 0 HH21 ARG A 127 11.790 3.231 11.032 1.00 0.00 H new ATOM 0 HH22 ARG A 127 10.610 2.633 12.202 1.00 0.00 H new ATOM 1864 N VAL A 128 8.659 1.915 3.194 1.00 0.00 N ATOM 1865 CA VAL A 128 8.823 1.974 1.746 1.00 0.00 C ATOM 1866 C VAL A 128 9.942 1.049 1.281 1.00 0.00 C ATOM 1867 O VAL A 128 9.863 0.456 0.205 1.00 0.00 O ATOM 1868 CB VAL A 128 9.127 3.408 1.274 1.00 0.00 C ATOM 1869 CG1 VAL A 128 7.918 4.308 1.482 1.00 0.00 C ATOM 1870 CG2 VAL A 128 10.344 3.961 2.000 1.00 0.00 C ATOM 0 H VAL A 128 9.055 2.710 3.696 1.00 0.00 H new ATOM 0 HA VAL A 128 7.880 1.647 1.307 1.00 0.00 H new ATOM 0 HB VAL A 128 9.349 3.380 0.207 1.00 0.00 H new ATOM 0 HG11 VAL A 128 8.153 5.317 1.142 1.00 0.00 H new ATOM 0 HG12 VAL A 128 7.074 3.921 0.912 1.00 0.00 H new ATOM 0 HG13 VAL A 128 7.660 4.332 2.541 1.00 0.00 H new ATOM 0 HG21 VAL A 128 10.544 4.975 1.654 1.00 0.00 H new ATOM 0 HG22 VAL A 128 10.152 3.975 3.073 1.00 0.00 H new ATOM 0 HG23 VAL A 128 11.209 3.330 1.794 1.00 0.00 H new ATOM 1880 N ARG A 129 10.982 0.931 2.099 1.00 0.00 N ATOM 1881 CA ARG A 129 12.118 0.078 1.772 1.00 0.00 C ATOM 1882 C ARG A 129 11.700 -1.389 1.720 1.00 0.00 C ATOM 1883 O ARG A 129 12.317 -2.197 1.025 1.00 0.00 O ATOM 1884 CB ARG A 129 13.236 0.265 2.799 1.00 0.00 C ATOM 1885 CG ARG A 129 12.739 0.698 4.168 1.00 0.00 C ATOM 1886 CD ARG A 129 12.663 2.213 4.279 1.00 0.00 C ATOM 1887 NE ARG A 129 13.864 2.778 4.889 1.00 0.00 N ATOM 1888 CZ ARG A 129 13.919 3.999 5.409 1.00 0.00 C ATOM 1889 NH1 ARG A 129 12.847 4.779 5.394 1.00 0.00 N ATOM 1890 NH2 ARG A 129 15.049 4.442 5.947 1.00 0.00 N ATOM 0 H ARG A 129 11.062 1.415 2.993 1.00 0.00 H new ATOM 0 HA ARG A 129 12.486 0.368 0.788 1.00 0.00 H new ATOM 0 HB2 ARG A 129 13.785 -0.671 2.901 1.00 0.00 H new ATOM 0 HB3 ARG A 129 13.940 1.008 2.426 1.00 0.00 H new ATOM 0 HG2 ARG A 129 11.754 0.269 4.351 1.00 0.00 H new ATOM 0 HG3 ARG A 129 13.405 0.308 4.938 1.00 0.00 H new ATOM 0 HD2 ARG A 129 12.524 2.643 3.287 1.00 0.00 H new ATOM 0 HD3 ARG A 129 11.791 2.490 4.871 1.00 0.00 H new ATOM 0 HE ARG A 129 14.706 2.204 4.917 1.00 0.00 H new ATOM 0 HH11 ARG A 129 11.977 4.442 4.982 1.00 0.00 H new ATOM 0 HH12 ARG A 129 12.893 5.716 5.794 1.00 0.00 H new ATOM 0 HH21 ARG A 129 15.876 3.845 5.961 1.00 0.00 H new ATOM 0 HH22 ARG A 129 15.091 5.380 6.346 1.00 0.00 H new ATOM 1904 N PHE A 130 10.649 -1.725 2.460 1.00 0.00 N ATOM 1905 CA PHE A 130 10.149 -3.095 2.500 1.00 0.00 C ATOM 1906 C PHE A 130 9.077 -3.313 1.437 1.00 0.00 C ATOM 1907 O PHE A 130 8.869 -4.434 0.970 1.00 0.00 O ATOM 1908 CB PHE A 130 9.583 -3.413 3.886 1.00 0.00 C ATOM 1909 CG PHE A 130 10.640 -3.697 4.914 1.00 0.00 C ATOM 1910 CD1 PHE A 130 11.668 -4.586 4.644 1.00 0.00 C ATOM 1911 CD2 PHE A 130 10.605 -3.075 6.152 1.00 0.00 C ATOM 1912 CE1 PHE A 130 12.642 -4.849 5.588 1.00 0.00 C ATOM 1913 CE2 PHE A 130 11.577 -3.334 7.100 1.00 0.00 C ATOM 1914 CZ PHE A 130 12.596 -4.223 6.819 1.00 0.00 C ATOM 0 H PHE A 130 10.127 -1.068 3.040 1.00 0.00 H new ATOM 0 HA PHE A 130 10.982 -3.767 2.293 1.00 0.00 H new ATOM 0 HB2 PHE A 130 8.976 -2.573 4.223 1.00 0.00 H new ATOM 0 HB3 PHE A 130 8.920 -4.275 3.810 1.00 0.00 H new ATOM 0 HD1 PHE A 130 11.708 -5.079 3.684 1.00 0.00 H new ATOM 0 HD2 PHE A 130 9.810 -2.380 6.378 1.00 0.00 H new ATOM 0 HE1 PHE A 130 13.438 -5.543 5.364 1.00 0.00 H new ATOM 0 HE2 PHE A 130 11.540 -2.841 8.060 1.00 0.00 H new ATOM 0 HZ PHE A 130 13.355 -4.428 7.559 1.00 0.00 H new ATOM 1924 N LEU A 131 8.398 -2.236 1.060 1.00 0.00 N ATOM 1925 CA LEU A 131 7.346 -2.308 0.053 1.00 0.00 C ATOM 1926 C LEU A 131 7.889 -2.851 -1.265 1.00 0.00 C ATOM 1927 O LEU A 131 8.972 -2.467 -1.707 1.00 0.00 O ATOM 1928 CB LEU A 131 6.728 -0.926 -0.169 1.00 0.00 C ATOM 1929 CG LEU A 131 5.259 -0.907 -0.593 1.00 0.00 C ATOM 1930 CD1 LEU A 131 4.584 0.371 -0.122 1.00 0.00 C ATOM 1931 CD2 LEU A 131 5.138 -1.051 -2.103 1.00 0.00 C ATOM 0 H LEU A 131 8.557 -1.302 1.437 1.00 0.00 H new ATOM 0 HA LEU A 131 6.577 -2.989 0.417 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.826 -0.354 0.754 1.00 0.00 H new ATOM 0 HB3 LEU A 131 7.312 -0.407 -0.930 1.00 0.00 H new ATOM 0 HG LEU A 131 4.755 -1.753 -0.126 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.539 0.367 -0.433 1.00 0.00 H new ATOM 0 HD12 LEU A 131 4.639 0.432 0.965 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.089 1.232 -0.560 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.086 -1.035 -2.387 1.00 0.00 H new ATOM 0 HD22 LEU A 131 5.657 -0.226 -2.590 1.00 0.00 H new ATOM 0 HD23 LEU A 131 5.584 -1.995 -2.415 1.00 0.00 H new ATOM 1943 N SER A 132 7.130 -3.746 -1.889 1.00 0.00 N ATOM 1944 CA SER A 132 7.536 -4.343 -3.155 1.00 0.00 C ATOM 1945 C SER A 132 6.764 -3.729 -4.319 1.00 0.00 C ATOM 1946 O SER A 132 7.325 -2.998 -5.135 1.00 0.00 O ATOM 1947 CB SER A 132 7.314 -5.857 -3.124 1.00 0.00 C ATOM 1948 OG SER A 132 7.435 -6.417 -4.420 1.00 0.00 O ATOM 0 H SER A 132 6.230 -4.074 -1.538 1.00 0.00 H new ATOM 0 HA SER A 132 8.597 -4.141 -3.299 1.00 0.00 H new ATOM 0 HB2 SER A 132 8.039 -6.320 -2.455 1.00 0.00 H new ATOM 0 HB3 SER A 132 6.325 -6.074 -2.721 1.00 0.00 H new ATOM 0 HG SER A 132 6.570 -6.784 -4.700 1.00 0.00 H new ATOM 1954 N PHE A 133 5.471 -4.030 -4.387 1.00 0.00 N ATOM 1955 CA PHE A 133 4.620 -3.509 -5.450 1.00 0.00 C ATOM 1956 C PHE A 133 3.396 -2.805 -4.872 1.00 0.00 C ATOM 1957 O PHE A 133 2.961 -3.107 -3.761 1.00 0.00 O ATOM 1958 CB PHE A 133 4.179 -4.641 -6.380 1.00 0.00 C ATOM 1959 CG PHE A 133 3.361 -4.172 -7.549 1.00 0.00 C ATOM 1960 CD1 PHE A 133 3.874 -3.246 -8.444 1.00 0.00 C ATOM 1961 CD2 PHE A 133 2.079 -4.656 -7.754 1.00 0.00 C ATOM 1962 CE1 PHE A 133 3.124 -2.812 -9.521 1.00 0.00 C ATOM 1963 CE2 PHE A 133 1.324 -4.226 -8.829 1.00 0.00 C ATOM 1964 CZ PHE A 133 1.847 -3.302 -9.713 1.00 0.00 C ATOM 0 H PHE A 133 4.990 -4.632 -3.719 1.00 0.00 H new ATOM 0 HA PHE A 133 5.199 -2.783 -6.021 1.00 0.00 H new ATOM 0 HB2 PHE A 133 5.062 -5.161 -6.750 1.00 0.00 H new ATOM 0 HB3 PHE A 133 3.599 -5.365 -5.808 1.00 0.00 H new ATOM 0 HD1 PHE A 133 4.872 -2.859 -8.298 1.00 0.00 H new ATOM 0 HD2 PHE A 133 1.665 -5.378 -7.066 1.00 0.00 H new ATOM 0 HE1 PHE A 133 3.536 -2.091 -10.211 1.00 0.00 H new ATOM 0 HE2 PHE A 133 0.326 -4.612 -8.978 1.00 0.00 H new ATOM 0 HZ PHE A 133 1.258 -2.963 -10.553 1.00 0.00 H new ATOM 1974 N MET A 134 2.847 -1.863 -5.633 1.00 0.00 N ATOM 1975 CA MET A 134 1.674 -1.116 -5.196 1.00 0.00 C ATOM 1976 C MET A 134 0.963 -0.478 -6.385 1.00 0.00 C ATOM 1977 O MET A 134 1.556 0.300 -7.131 1.00 0.00 O ATOM 1978 CB MET A 134 2.075 -0.038 -4.188 1.00 0.00 C ATOM 1979 CG MET A 134 2.811 1.136 -4.814 1.00 0.00 C ATOM 1980 SD MET A 134 3.420 2.308 -3.587 1.00 0.00 S ATOM 1981 CE MET A 134 5.183 2.001 -3.672 1.00 0.00 C ATOM 0 H MET A 134 3.196 -1.600 -6.555 1.00 0.00 H new ATOM 0 HA MET A 134 0.988 -1.814 -4.716 1.00 0.00 H new ATOM 0 HB2 MET A 134 1.180 0.330 -3.687 1.00 0.00 H new ATOM 0 HB3 MET A 134 2.708 -0.486 -3.422 1.00 0.00 H new ATOM 0 HG2 MET A 134 3.650 0.762 -5.402 1.00 0.00 H new ATOM 0 HG3 MET A 134 2.143 1.652 -5.504 1.00 0.00 H new ATOM 0 HE1 MET A 134 5.578 1.865 -2.665 1.00 0.00 H new ATOM 0 HE2 MET A 134 5.368 1.101 -4.258 1.00 0.00 H new ATOM 0 HE3 MET A 134 5.678 2.850 -4.144 1.00 0.00 H new ATOM 1991 N GLY A 135 -0.313 -0.813 -6.556 1.00 0.00 N ATOM 1992 CA GLY A 135 -1.083 -0.263 -7.656 1.00 0.00 C ATOM 1993 C GLY A 135 -2.559 -0.150 -7.331 1.00 0.00 C ATOM 1994 O GLY A 135 -3.003 -0.582 -6.267 1.00 0.00 O ATOM 0 H GLY A 135 -0.826 -1.455 -5.952 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -0.694 0.723 -7.911 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -0.955 -0.893 -8.536 1.00 0.00 H new ATOM 1998 N VAL A 136 -3.323 0.434 -8.249 1.00 0.00 N ATOM 1999 CA VAL A 136 -4.758 0.603 -8.055 1.00 0.00 C ATOM 2000 C VAL A 136 -5.547 -0.415 -8.870 1.00 0.00 C ATOM 2001 O VAL A 136 -5.329 -0.567 -10.071 1.00 0.00 O ATOM 2002 CB VAL A 136 -5.214 2.022 -8.445 1.00 0.00 C ATOM 2003 CG1 VAL A 136 -6.726 2.145 -8.339 1.00 0.00 C ATOM 2004 CG2 VAL A 136 -4.523 3.061 -7.576 1.00 0.00 C ATOM 0 H VAL A 136 -2.972 0.798 -9.135 1.00 0.00 H new ATOM 0 HA VAL A 136 -4.955 0.445 -6.995 1.00 0.00 H new ATOM 0 HB VAL A 136 -4.931 2.204 -9.482 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -7.029 3.154 -8.618 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -7.197 1.426 -9.009 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -7.036 1.943 -7.314 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -4.857 4.057 -7.865 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -4.772 2.884 -6.530 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -3.444 2.987 -7.709 1.00 0.00 H new ATOM 2014 N GLY A 137 -6.466 -1.111 -8.208 1.00 0.00 N ATOM 2015 CA GLY A 137 -7.275 -2.107 -8.887 1.00 0.00 C ATOM 2016 C GLY A 137 -8.157 -1.502 -9.962 1.00 0.00 C ATOM 2017 O GLY A 137 -7.906 -0.392 -10.430 1.00 0.00 O ATOM 0 H GLY A 137 -6.665 -1.003 -7.213 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -6.623 -2.856 -9.336 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -7.899 -2.623 -8.157 1.00 0.00 H new ATOM 2021 N LYS A 138 -9.193 -2.235 -10.355 1.00 0.00 N ATOM 2022 CA LYS A 138 -10.116 -1.766 -11.382 1.00 0.00 C ATOM 2023 C LYS A 138 -10.700 -0.407 -11.009 1.00 0.00 C ATOM 2024 O LYS A 138 -10.760 0.502 -11.838 1.00 0.00 O ATOM 2025 CB LYS A 138 -11.245 -2.779 -11.583 1.00 0.00 C ATOM 2026 CG LYS A 138 -12.000 -3.110 -10.307 1.00 0.00 C ATOM 2027 CD LYS A 138 -12.828 -4.375 -10.461 1.00 0.00 C ATOM 2028 CE LYS A 138 -14.145 -4.097 -11.169 1.00 0.00 C ATOM 2029 NZ LYS A 138 -14.970 -5.328 -11.309 1.00 0.00 N ATOM 0 H LYS A 138 -9.415 -3.156 -9.978 1.00 0.00 H new ATOM 0 HA LYS A 138 -9.560 -1.660 -12.314 1.00 0.00 H new ATOM 0 HB2 LYS A 138 -11.947 -2.387 -12.319 1.00 0.00 H new ATOM 0 HB3 LYS A 138 -10.828 -3.697 -11.997 1.00 0.00 H new ATOM 0 HG2 LYS A 138 -11.293 -3.234 -9.487 1.00 0.00 H new ATOM 0 HG3 LYS A 138 -12.652 -2.277 -10.042 1.00 0.00 H new ATOM 0 HD2 LYS A 138 -12.261 -5.116 -11.024 1.00 0.00 H new ATOM 0 HD3 LYS A 138 -13.025 -4.804 -9.478 1.00 0.00 H new ATOM 0 HE2 LYS A 138 -14.705 -3.346 -10.612 1.00 0.00 H new ATOM 0 HE3 LYS A 138 -13.946 -3.679 -12.156 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 -15.859 -5.096 -11.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 -14.446 -6.036 -11.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 -15.182 -5.713 -10.366 1.00 0.00 H new ATOM 2043 N ASP A 139 -11.126 -0.274 -9.758 1.00 0.00 N ATOM 2044 CA ASP A 139 -11.702 0.976 -9.275 1.00 0.00 C ATOM 2045 C ASP A 139 -10.619 1.893 -8.716 1.00 0.00 C ATOM 2046 O ASP A 139 -9.499 1.457 -8.446 1.00 0.00 O ATOM 2047 CB ASP A 139 -12.754 0.695 -8.200 1.00 0.00 C ATOM 2048 CG ASP A 139 -14.092 0.295 -8.791 1.00 0.00 C ATOM 2049 OD1 ASP A 139 -14.401 0.742 -9.915 1.00 0.00 O ATOM 2050 OD2 ASP A 139 -14.829 -0.465 -8.128 1.00 0.00 O ATOM 0 H ASP A 139 -11.083 -1.016 -9.060 1.00 0.00 H new ATOM 0 HA ASP A 139 -12.178 1.478 -10.117 1.00 0.00 H new ATOM 0 HB2 ASP A 139 -12.397 -0.100 -7.545 1.00 0.00 H new ATOM 0 HB3 ASP A 139 -12.884 1.583 -7.582 1.00 0.00 H new ATOM 2055 N VAL A 140 -10.959 3.167 -8.546 1.00 0.00 N ATOM 2056 CA VAL A 140 -10.016 4.147 -8.020 1.00 0.00 C ATOM 2057 C VAL A 140 -10.154 4.285 -6.508 1.00 0.00 C ATOM 2058 O VAL A 140 -9.597 5.203 -5.905 1.00 0.00 O ATOM 2059 CB VAL A 140 -10.218 5.527 -8.672 1.00 0.00 C ATOM 2060 CG1 VAL A 140 -9.874 5.474 -10.153 1.00 0.00 C ATOM 2061 CG2 VAL A 140 -11.646 6.009 -8.465 1.00 0.00 C ATOM 0 H VAL A 140 -11.881 3.545 -8.765 1.00 0.00 H new ATOM 0 HA VAL A 140 -9.016 3.785 -8.259 1.00 0.00 H new ATOM 0 HB VAL A 140 -9.545 6.238 -8.193 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -10.023 6.458 -10.597 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -8.833 5.175 -10.274 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -10.519 4.750 -10.651 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -11.772 6.986 -8.932 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -12.339 5.299 -8.917 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -11.852 6.088 -7.398 1.00 0.00 H new ATOM 2071 N HIS A 141 -10.899 3.368 -5.901 1.00 0.00 N ATOM 2072 CA HIS A 141 -11.110 3.387 -4.458 1.00 0.00 C ATOM 2073 C HIS A 141 -10.542 2.128 -3.809 1.00 0.00 C ATOM 2074 O HIS A 141 -10.908 1.775 -2.688 1.00 0.00 O ATOM 2075 CB HIS A 141 -12.601 3.510 -4.140 1.00 0.00 C ATOM 2076 CG HIS A 141 -13.330 4.454 -5.047 1.00 0.00 C ATOM 2077 ND1 HIS A 141 -14.154 4.030 -6.068 1.00 0.00 N ATOM 2078 CD2 HIS A 141 -13.357 5.807 -5.080 1.00 0.00 C ATOM 2079 CE1 HIS A 141 -14.655 5.082 -6.691 1.00 0.00 C ATOM 2080 NE2 HIS A 141 -14.187 6.172 -6.111 1.00 0.00 N ATOM 0 H HIS A 141 -11.367 2.602 -6.386 1.00 0.00 H new ATOM 0 HA HIS A 141 -10.587 4.252 -4.051 1.00 0.00 H new ATOM 0 HB2 HIS A 141 -13.061 2.524 -4.209 1.00 0.00 H new ATOM 0 HB3 HIS A 141 -12.718 3.846 -3.110 1.00 0.00 H new ATOM 0 HD2 HIS A 141 -12.825 6.475 -4.419 1.00 0.00 H new ATOM 0 HE1 HIS A 141 -15.332 5.055 -7.532 1.00 0.00 H new ATOM 0 HE2 HIS A 141 -14.406 7.130 -6.385 1.00 0.00 H new ATOM 2088 N THR A 142 -9.646 1.453 -4.522 1.00 0.00 N ATOM 2089 CA THR A 142 -9.029 0.233 -4.017 1.00 0.00 C ATOM 2090 C THR A 142 -7.514 0.276 -4.178 1.00 0.00 C ATOM 2091 O THR A 142 -6.992 0.121 -5.282 1.00 0.00 O ATOM 2092 CB THR A 142 -9.575 -1.013 -4.740 1.00 0.00 C ATOM 2093 OG1 THR A 142 -9.667 -0.763 -6.147 1.00 0.00 O ATOM 2094 CG2 THR A 142 -10.944 -1.396 -4.198 1.00 0.00 C ATOM 0 H THR A 142 -9.331 1.731 -5.452 1.00 0.00 H new ATOM 0 HA THR A 142 -9.278 0.168 -2.958 1.00 0.00 H new ATOM 0 HB THR A 142 -8.887 -1.839 -4.563 1.00 0.00 H new ATOM 0 HG1 THR A 142 -8.824 -0.380 -6.467 1.00 0.00 H new ATOM 0 HG21 THR A 142 -11.310 -2.278 -4.723 1.00 0.00 H new ATOM 0 HG22 THR A 142 -10.866 -1.614 -3.133 1.00 0.00 H new ATOM 0 HG23 THR A 142 -11.639 -0.570 -4.349 1.00 0.00 H new ATOM 2102 N PHE A 143 -6.812 0.487 -3.069 1.00 0.00 N ATOM 2103 CA PHE A 143 -5.355 0.551 -3.087 1.00 0.00 C ATOM 2104 C PHE A 143 -4.751 -0.579 -2.258 1.00 0.00 C ATOM 2105 O PHE A 143 -5.129 -0.788 -1.105 1.00 0.00 O ATOM 2106 CB PHE A 143 -4.876 1.902 -2.554 1.00 0.00 C ATOM 2107 CG PHE A 143 -3.386 1.984 -2.380 1.00 0.00 C ATOM 2108 CD1 PHE A 143 -2.558 2.190 -3.471 1.00 0.00 C ATOM 2109 CD2 PHE A 143 -2.814 1.855 -1.125 1.00 0.00 C ATOM 2110 CE1 PHE A 143 -1.187 2.265 -3.313 1.00 0.00 C ATOM 2111 CE2 PHE A 143 -1.444 1.929 -0.960 1.00 0.00 C ATOM 2112 CZ PHE A 143 -0.629 2.135 -2.056 1.00 0.00 C ATOM 0 H PHE A 143 -7.228 0.617 -2.147 1.00 0.00 H new ATOM 0 HA PHE A 143 -5.024 0.438 -4.119 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -5.198 2.688 -3.237 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -5.357 2.097 -1.595 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -2.988 2.293 -4.456 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -3.447 1.695 -0.265 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -0.552 2.425 -4.172 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -1.011 1.826 0.024 1.00 0.00 H new ATOM 0 HZ PHE A 143 0.442 2.194 -1.931 1.00 0.00 H new ATOM 2122 N ALA A 144 -3.811 -1.305 -2.853 1.00 0.00 N ATOM 2123 CA ALA A 144 -3.153 -2.412 -2.170 1.00 0.00 C ATOM 2124 C ALA A 144 -1.651 -2.402 -2.429 1.00 0.00 C ATOM 2125 O ALA A 144 -1.188 -1.869 -3.438 1.00 0.00 O ATOM 2126 CB ALA A 144 -3.758 -3.737 -2.610 1.00 0.00 C ATOM 0 H ALA A 144 -3.488 -1.146 -3.807 1.00 0.00 H new ATOM 0 HA ALA A 144 -3.311 -2.291 -1.098 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -3.257 -4.555 -2.092 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -4.821 -3.750 -2.367 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -3.630 -3.856 -3.686 1.00 0.00 H new ATOM 2132 N PHE A 145 -0.893 -2.993 -1.511 1.00 0.00 N ATOM 2133 CA PHE A 145 0.559 -3.050 -1.639 1.00 0.00 C ATOM 2134 C PHE A 145 1.112 -4.318 -0.996 1.00 0.00 C ATOM 2135 O PHE A 145 0.647 -4.743 0.062 1.00 0.00 O ATOM 2136 CB PHE A 145 1.198 -1.817 -0.995 1.00 0.00 C ATOM 2137 CG PHE A 145 0.998 -1.746 0.491 1.00 0.00 C ATOM 2138 CD1 PHE A 145 1.607 -2.665 1.331 1.00 0.00 C ATOM 2139 CD2 PHE A 145 0.200 -0.761 1.050 1.00 0.00 C ATOM 2140 CE1 PHE A 145 1.425 -2.602 2.699 1.00 0.00 C ATOM 2141 CE2 PHE A 145 0.015 -0.692 2.418 1.00 0.00 C ATOM 2142 CZ PHE A 145 0.627 -1.615 3.244 1.00 0.00 C ATOM 0 H PHE A 145 -1.260 -3.439 -0.670 1.00 0.00 H new ATOM 0 HA PHE A 145 0.805 -3.065 -2.701 1.00 0.00 H new ATOM 0 HB2 PHE A 145 2.267 -1.817 -1.210 1.00 0.00 H new ATOM 0 HB3 PHE A 145 0.781 -0.920 -1.453 1.00 0.00 H new ATOM 0 HD1 PHE A 145 2.231 -3.440 0.911 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -0.283 -0.038 0.409 1.00 0.00 H new ATOM 0 HE1 PHE A 145 1.906 -3.324 3.342 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -0.607 0.083 2.841 1.00 0.00 H new ATOM 0 HZ PHE A 145 0.482 -1.565 4.313 1.00 0.00 H new ATOM 2152 N ILE A 146 2.106 -4.917 -1.643 1.00 0.00 N ATOM 2153 CA ILE A 146 2.722 -6.136 -1.135 1.00 0.00 C ATOM 2154 C ILE A 146 4.013 -5.827 -0.383 1.00 0.00 C ATOM 2155 O ILE A 146 4.901 -5.154 -0.906 1.00 0.00 O ATOM 2156 CB ILE A 146 3.029 -7.129 -2.272 1.00 0.00 C ATOM 2157 CG1 ILE A 146 1.740 -7.795 -2.757 1.00 0.00 C ATOM 2158 CG2 ILE A 146 4.030 -8.175 -1.806 1.00 0.00 C ATOM 2159 CD1 ILE A 146 1.100 -7.090 -3.932 1.00 0.00 C ATOM 0 H ILE A 146 2.502 -4.578 -2.520 1.00 0.00 H new ATOM 0 HA ILE A 146 2.005 -6.590 -0.451 1.00 0.00 H new ATOM 0 HB ILE A 146 3.469 -6.581 -3.105 1.00 0.00 H new ATOM 0 HG12 ILE A 146 1.956 -8.826 -3.036 1.00 0.00 H new ATOM 0 HG13 ILE A 146 1.027 -7.831 -1.933 1.00 0.00 H new ATOM 0 HG21 ILE A 146 4.237 -8.869 -2.621 1.00 0.00 H new ATOM 0 HG22 ILE A 146 4.955 -7.684 -1.504 1.00 0.00 H new ATOM 0 HG23 ILE A 146 3.617 -8.722 -0.959 1.00 0.00 H new ATOM 0 HD11 ILE A 146 0.191 -7.617 -4.222 1.00 0.00 H new ATOM 0 HD12 ILE A 146 0.852 -6.067 -3.651 1.00 0.00 H new ATOM 0 HD13 ILE A 146 1.795 -7.077 -4.771 1.00 0.00 H new ATOM 2171 N MET A 147 4.110 -6.325 0.845 1.00 0.00 N ATOM 2172 CA MET A 147 5.294 -6.104 1.667 1.00 0.00 C ATOM 2173 C MET A 147 6.051 -7.409 1.892 1.00 0.00 C ATOM 2174 O MET A 147 5.499 -8.496 1.716 1.00 0.00 O ATOM 2175 CB MET A 147 4.899 -5.492 3.013 1.00 0.00 C ATOM 2176 CG MET A 147 4.144 -6.451 3.919 1.00 0.00 C ATOM 2177 SD MET A 147 3.125 -5.598 5.138 1.00 0.00 S ATOM 2178 CE MET A 147 4.288 -5.425 6.489 1.00 0.00 C ATOM 0 H MET A 147 3.384 -6.884 1.293 1.00 0.00 H new ATOM 0 HA MET A 147 5.949 -5.411 1.138 1.00 0.00 H new ATOM 0 HB2 MET A 147 5.799 -5.152 3.526 1.00 0.00 H new ATOM 0 HB3 MET A 147 4.282 -4.611 2.835 1.00 0.00 H new ATOM 0 HG2 MET A 147 3.511 -7.097 3.311 1.00 0.00 H new ATOM 0 HG3 MET A 147 4.857 -7.095 4.434 1.00 0.00 H new ATOM 0 HE1 MET A 147 4.043 -4.535 7.068 1.00 0.00 H new ATOM 0 HE2 MET A 147 4.232 -6.303 7.132 1.00 0.00 H new ATOM 0 HE3 MET A 147 5.298 -5.331 6.090 1.00 0.00 H new ATOM 2188 N ASP A 148 7.316 -7.295 2.280 1.00 0.00 N ATOM 2189 CA ASP A 148 8.148 -8.466 2.529 1.00 0.00 C ATOM 2190 C ASP A 148 8.312 -8.708 4.026 1.00 0.00 C ATOM 2191 O ASP A 148 9.050 -7.994 4.705 1.00 0.00 O ATOM 2192 CB ASP A 148 9.520 -8.291 1.875 1.00 0.00 C ATOM 2193 CG ASP A 148 10.566 -9.214 2.469 1.00 0.00 C ATOM 2194 OD1 ASP A 148 10.398 -10.447 2.365 1.00 0.00 O ATOM 2195 OD2 ASP A 148 11.553 -8.703 3.038 1.00 0.00 O ATOM 0 H ASP A 148 7.788 -6.403 2.429 1.00 0.00 H new ATOM 0 HA ASP A 148 7.653 -9.333 2.091 1.00 0.00 H new ATOM 0 HB2 ASP A 148 9.436 -8.482 0.805 1.00 0.00 H new ATOM 0 HB3 ASP A 148 9.845 -7.257 1.990 1.00 0.00 H new ATOM 2200 N THR A 149 7.617 -9.720 4.536 1.00 0.00 N ATOM 2201 CA THR A 149 7.683 -10.056 5.953 1.00 0.00 C ATOM 2202 C THR A 149 8.888 -10.940 6.253 1.00 0.00 C ATOM 2203 O THR A 149 9.602 -10.722 7.231 1.00 0.00 O ATOM 2204 CB THR A 149 6.404 -10.775 6.420 1.00 0.00 C ATOM 2205 OG1 THR A 149 6.300 -12.054 5.783 1.00 0.00 O ATOM 2206 CG2 THR A 149 5.169 -9.944 6.105 1.00 0.00 C ATOM 0 H THR A 149 7.002 -10.322 3.988 1.00 0.00 H new ATOM 0 HA THR A 149 7.781 -9.116 6.496 1.00 0.00 H new ATOM 0 HB THR A 149 6.465 -10.911 7.500 1.00 0.00 H new ATOM 0 HG1 THR A 149 5.485 -12.505 6.087 1.00 0.00 H new ATOM 0 HG21 THR A 149 4.278 -10.473 6.444 1.00 0.00 H new ATOM 0 HG22 THR A 149 5.237 -8.983 6.615 1.00 0.00 H new ATOM 0 HG23 THR A 149 5.106 -9.780 5.029 1.00 0.00 H new ATOM 2214 N GLY A 150 9.110 -11.939 5.405 1.00 0.00 N ATOM 2215 CA GLY A 150 10.230 -12.841 5.597 1.00 0.00 C ATOM 2216 C GLY A 150 9.923 -14.253 5.140 1.00 0.00 C ATOM 2217 O GLY A 150 8.760 -14.644 5.050 1.00 0.00 O ATOM 0 H GLY A 150 8.534 -12.140 4.588 1.00 0.00 H new ATOM 0 HA2 GLY A 150 11.094 -12.465 5.049 1.00 0.00 H new ATOM 0 HA3 GLY A 150 10.504 -12.855 6.652 1.00 0.00 H new ATOM 2221 N ASN A 151 10.968 -15.021 4.851 1.00 0.00 N ATOM 2222 CA ASN A 151 10.804 -16.398 4.399 1.00 0.00 C ATOM 2223 C ASN A 151 10.129 -16.445 3.032 1.00 0.00 C ATOM 2224 O ASN A 151 9.357 -17.358 2.742 1.00 0.00 O ATOM 2225 CB ASN A 151 9.982 -17.195 5.414 1.00 0.00 C ATOM 2226 CG ASN A 151 10.307 -18.676 5.386 1.00 0.00 C ATOM 2227 OD1 ASN A 151 11.472 -19.068 5.451 1.00 0.00 O ATOM 2228 ND2 ASN A 151 9.275 -19.506 5.287 1.00 0.00 N ATOM 0 H ASN A 151 11.938 -14.713 4.922 1.00 0.00 H new ATOM 0 HA ASN A 151 11.794 -16.846 4.311 1.00 0.00 H new ATOM 0 HB2 ASN A 151 10.167 -16.804 6.414 1.00 0.00 H new ATOM 0 HB3 ASN A 151 8.921 -17.055 5.208 1.00 0.00 H new ATOM 0 HD21 ASN A 151 9.431 -20.514 5.262 1.00 0.00 H new ATOM 0 HD22 ASN A 151 8.326 -19.136 5.236 1.00 0.00 H new ATOM 2235 N GLN A 152 10.426 -15.454 2.197 1.00 0.00 N ATOM 2236 CA GLN A 152 9.847 -15.383 0.860 1.00 0.00 C ATOM 2237 C GLN A 152 8.329 -15.257 0.931 1.00 0.00 C ATOM 2238 O GLN A 152 7.619 -15.677 0.016 1.00 0.00 O ATOM 2239 CB GLN A 152 10.231 -16.621 0.048 1.00 0.00 C ATOM 2240 CG GLN A 152 11.711 -16.690 -0.292 1.00 0.00 C ATOM 2241 CD GLN A 152 12.168 -18.096 -0.628 1.00 0.00 C ATOM 2242 OE1 GLN A 152 12.416 -18.420 -1.790 1.00 0.00 O ATOM 2243 NE2 GLN A 152 12.281 -18.942 0.390 1.00 0.00 N ATOM 0 H GLN A 152 11.063 -14.690 2.422 1.00 0.00 H new ATOM 0 HA GLN A 152 10.244 -14.496 0.366 1.00 0.00 H new ATOM 0 HB2 GLN A 152 9.953 -17.514 0.609 1.00 0.00 H new ATOM 0 HB3 GLN A 152 9.653 -16.633 -0.876 1.00 0.00 H new ATOM 0 HG2 GLN A 152 11.917 -16.034 -1.137 1.00 0.00 H new ATOM 0 HG3 GLN A 152 12.291 -16.315 0.551 1.00 0.00 H new ATOM 0 HE21 GLN A 152 12.065 -18.632 1.337 1.00 0.00 H new ATOM 0 HE22 GLN A 152 12.583 -19.902 0.224 1.00 0.00 H new ATOM 2252 N ARG A 153 7.838 -14.678 2.021 1.00 0.00 N ATOM 2253 CA ARG A 153 6.403 -14.499 2.211 1.00 0.00 C ATOM 2254 C ARG A 153 5.964 -13.110 1.757 1.00 0.00 C ATOM 2255 O ARG A 153 6.637 -12.115 2.027 1.00 0.00 O ATOM 2256 CB ARG A 153 6.032 -14.708 3.680 1.00 0.00 C ATOM 2257 CG ARG A 153 6.106 -16.159 4.127 1.00 0.00 C ATOM 2258 CD ARG A 153 5.105 -17.024 3.377 1.00 0.00 C ATOM 2259 NE ARG A 153 4.655 -18.159 4.178 1.00 0.00 N ATOM 2260 CZ ARG A 153 3.865 -18.043 5.239 1.00 0.00 C ATOM 2261 NH1 ARG A 153 3.440 -16.848 5.626 1.00 0.00 N ATOM 2262 NH2 ARG A 153 3.499 -19.124 5.917 1.00 0.00 N ATOM 0 H ARG A 153 8.412 -14.325 2.786 1.00 0.00 H new ATOM 0 HA ARG A 153 5.886 -15.241 1.603 1.00 0.00 H new ATOM 0 HB2 ARG A 153 6.698 -14.111 4.303 1.00 0.00 H new ATOM 0 HB3 ARG A 153 5.021 -14.336 3.847 1.00 0.00 H new ATOM 0 HG2 ARG A 153 7.114 -16.541 3.963 1.00 0.00 H new ATOM 0 HG3 ARG A 153 5.912 -16.221 5.198 1.00 0.00 H new ATOM 0 HD2 ARG A 153 4.245 -16.418 3.091 1.00 0.00 H new ATOM 0 HD3 ARG A 153 5.559 -17.388 2.455 1.00 0.00 H new ATOM 0 HE ARG A 153 4.965 -19.092 3.908 1.00 0.00 H new ATOM 0 HH11 ARG A 153 3.720 -16.015 5.108 1.00 0.00 H new ATOM 0 HH12 ARG A 153 2.833 -16.762 6.441 1.00 0.00 H new ATOM 0 HH21 ARG A 153 3.825 -20.045 5.623 1.00 0.00 H new ATOM 0 HH22 ARG A 153 2.892 -19.034 6.732 1.00 0.00 H new ATOM 2276 N PHE A 154 4.831 -13.051 1.064 1.00 0.00 N ATOM 2277 CA PHE A 154 4.303 -11.784 0.571 1.00 0.00 C ATOM 2278 C PHE A 154 2.876 -11.562 1.064 1.00 0.00 C ATOM 2279 O PHE A 154 1.970 -12.328 0.739 1.00 0.00 O ATOM 2280 CB PHE A 154 4.336 -11.755 -0.959 1.00 0.00 C ATOM 2281 CG PHE A 154 5.568 -12.384 -1.544 1.00 0.00 C ATOM 2282 CD1 PHE A 154 6.829 -11.988 -1.126 1.00 0.00 C ATOM 2283 CD2 PHE A 154 5.466 -13.372 -2.510 1.00 0.00 C ATOM 2284 CE1 PHE A 154 7.964 -12.565 -1.664 1.00 0.00 C ATOM 2285 CE2 PHE A 154 6.598 -13.953 -3.050 1.00 0.00 C ATOM 2286 CZ PHE A 154 7.849 -13.549 -2.626 1.00 0.00 C ATOM 0 H PHE A 154 4.262 -13.865 0.831 1.00 0.00 H new ATOM 0 HA PHE A 154 4.932 -10.981 0.957 1.00 0.00 H new ATOM 0 HB2 PHE A 154 3.457 -12.272 -1.343 1.00 0.00 H new ATOM 0 HB3 PHE A 154 4.271 -10.721 -1.296 1.00 0.00 H new ATOM 0 HD1 PHE A 154 6.926 -11.221 -0.372 1.00 0.00 H new ATOM 0 HD2 PHE A 154 4.490 -13.692 -2.845 1.00 0.00 H new ATOM 0 HE1 PHE A 154 8.941 -12.246 -1.332 1.00 0.00 H new ATOM 0 HE2 PHE A 154 6.504 -14.722 -3.803 1.00 0.00 H new ATOM 0 HZ PHE A 154 8.735 -14.002 -3.046 1.00 0.00 H new ATOM 2296 N GLU A 155 2.686 -10.507 1.850 1.00 0.00 N ATOM 2297 CA GLU A 155 1.370 -10.184 2.389 1.00 0.00 C ATOM 2298 C GLU A 155 0.765 -8.985 1.666 1.00 0.00 C ATOM 2299 O GLU A 155 1.316 -7.884 1.698 1.00 0.00 O ATOM 2300 CB GLU A 155 1.465 -9.894 3.889 1.00 0.00 C ATOM 2301 CG GLU A 155 1.991 -11.065 4.703 1.00 0.00 C ATOM 2302 CD GLU A 155 2.046 -10.764 6.188 1.00 0.00 C ATOM 2303 OE1 GLU A 155 1.526 -9.706 6.600 1.00 0.00 O ATOM 2304 OE2 GLU A 155 2.609 -11.588 6.939 1.00 0.00 O ATOM 0 H GLU A 155 3.426 -9.862 2.128 1.00 0.00 H new ATOM 0 HA GLU A 155 0.721 -11.046 2.233 1.00 0.00 H new ATOM 0 HB2 GLU A 155 2.116 -9.033 4.044 1.00 0.00 H new ATOM 0 HB3 GLU A 155 0.478 -9.618 4.260 1.00 0.00 H new ATOM 0 HG2 GLU A 155 1.355 -11.934 4.535 1.00 0.00 H new ATOM 0 HG3 GLU A 155 2.989 -11.328 4.352 1.00 0.00 H new ATOM 2311 N CYS A 156 -0.371 -9.206 1.013 1.00 0.00 N ATOM 2312 CA CYS A 156 -1.051 -8.145 0.280 1.00 0.00 C ATOM 2313 C CYS A 156 -2.158 -7.522 1.125 1.00 0.00 C ATOM 2314 O CYS A 156 -3.137 -8.185 1.471 1.00 0.00 O ATOM 2315 CB CYS A 156 -1.635 -8.690 -1.024 1.00 0.00 C ATOM 2316 SG CYS A 156 -1.763 -7.463 -2.346 1.00 0.00 S ATOM 0 H CYS A 156 -0.840 -10.111 0.977 1.00 0.00 H new ATOM 0 HA CYS A 156 -0.318 -7.372 0.047 1.00 0.00 H new ATOM 0 HB2 CYS A 156 -1.015 -9.517 -1.370 1.00 0.00 H new ATOM 0 HB3 CYS A 156 -2.626 -9.097 -0.823 1.00 0.00 H new ATOM 0 HG CYS A 156 -2.265 -8.020 -3.408 1.00 0.00 H new ATOM 2322 N HIS A 157 -1.994 -6.246 1.458 1.00 0.00 N ATOM 2323 CA HIS A 157 -2.979 -5.534 2.265 1.00 0.00 C ATOM 2324 C HIS A 157 -3.776 -4.554 1.409 1.00 0.00 C ATOM 2325 O HIS A 157 -3.205 -3.714 0.713 1.00 0.00 O ATOM 2326 CB HIS A 157 -2.290 -4.787 3.407 1.00 0.00 C ATOM 2327 CG HIS A 157 -1.668 -5.693 4.425 1.00 0.00 C ATOM 2328 ND1 HIS A 157 -2.343 -6.154 5.535 1.00 0.00 N ATOM 2329 CD2 HIS A 157 -0.425 -6.225 4.495 1.00 0.00 C ATOM 2330 CE1 HIS A 157 -1.542 -6.928 6.245 1.00 0.00 C ATOM 2331 NE2 HIS A 157 -0.372 -6.988 5.635 1.00 0.00 N ATOM 0 H HIS A 157 -1.189 -5.684 1.182 1.00 0.00 H new ATOM 0 HA HIS A 157 -3.668 -6.268 2.684 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -1.520 -4.137 2.992 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -3.018 -4.144 3.901 1.00 0.00 H new ATOM 0 HD2 HIS A 157 0.376 -6.077 3.786 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -1.800 -7.427 7.167 1.00 0.00 H new ATOM 0 HE2 HIS A 157 0.439 -7.515 5.958 1.00 0.00 H new ATOM 2339 N VAL A 158 -5.100 -4.667 1.465 1.00 0.00 N ATOM 2340 CA VAL A 158 -5.975 -3.792 0.696 1.00 0.00 C ATOM 2341 C VAL A 158 -6.601 -2.722 1.584 1.00 0.00 C ATOM 2342 O VAL A 158 -7.010 -2.998 2.712 1.00 0.00 O ATOM 2343 CB VAL A 158 -7.097 -4.588 0.002 1.00 0.00 C ATOM 2344 CG1 VAL A 158 -7.878 -3.693 -0.948 1.00 0.00 C ATOM 2345 CG2 VAL A 158 -6.521 -5.788 -0.734 1.00 0.00 C ATOM 0 H VAL A 158 -5.589 -5.357 2.036 1.00 0.00 H new ATOM 0 HA VAL A 158 -5.356 -3.314 -0.063 1.00 0.00 H new ATOM 0 HB VAL A 158 -7.785 -4.954 0.764 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -8.666 -4.273 -1.429 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -8.323 -2.870 -0.389 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -7.206 -3.294 -1.708 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -7.327 -6.339 -1.218 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -5.811 -5.446 -1.487 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -6.011 -6.440 -0.024 1.00 0.00 H new ATOM 2355 N PHE A 159 -6.673 -1.500 1.067 1.00 0.00 N ATOM 2356 CA PHE A 159 -7.249 -0.387 1.814 1.00 0.00 C ATOM 2357 C PHE A 159 -8.102 0.494 0.905 1.00 0.00 C ATOM 2358 O PHE A 159 -7.713 0.801 -0.221 1.00 0.00 O ATOM 2359 CB PHE A 159 -6.141 0.449 2.459 1.00 0.00 C ATOM 2360 CG PHE A 159 -5.150 -0.369 3.238 1.00 0.00 C ATOM 2361 CD1 PHE A 159 -4.118 -1.029 2.592 1.00 0.00 C ATOM 2362 CD2 PHE A 159 -5.252 -0.477 4.616 1.00 0.00 C ATOM 2363 CE1 PHE A 159 -3.204 -1.782 3.306 1.00 0.00 C ATOM 2364 CE2 PHE A 159 -4.341 -1.227 5.335 1.00 0.00 C ATOM 2365 CZ PHE A 159 -3.316 -1.881 4.679 1.00 0.00 C ATOM 0 H PHE A 159 -6.340 -1.255 0.135 1.00 0.00 H new ATOM 0 HA PHE A 159 -7.887 -0.798 2.596 1.00 0.00 H new ATOM 0 HB2 PHE A 159 -5.613 1.001 1.681 1.00 0.00 H new ATOM 0 HB3 PHE A 159 -6.593 1.187 3.122 1.00 0.00 H new ATOM 0 HD1 PHE A 159 -4.026 -0.955 1.518 1.00 0.00 H new ATOM 0 HD2 PHE A 159 -6.052 0.031 5.134 1.00 0.00 H new ATOM 0 HE1 PHE A 159 -2.404 -2.292 2.791 1.00 0.00 H new ATOM 0 HE2 PHE A 159 -4.430 -1.302 6.409 1.00 0.00 H new ATOM 0 HZ PHE A 159 -2.604 -2.469 5.239 1.00 0.00 H new ATOM 2375 N TRP A 160 -9.265 0.895 1.404 1.00 0.00 N ATOM 2376 CA TRP A 160 -10.175 1.739 0.638 1.00 0.00 C ATOM 2377 C TRP A 160 -9.849 3.215 0.842 1.00 0.00 C ATOM 2378 O TRP A 160 -9.783 3.694 1.974 1.00 0.00 O ATOM 2379 CB TRP A 160 -11.624 1.463 1.043 1.00 0.00 C ATOM 2380 CG TRP A 160 -12.626 2.002 0.068 1.00 0.00 C ATOM 2381 CD1 TRP A 160 -13.165 3.257 0.056 1.00 0.00 C ATOM 2382 CD2 TRP A 160 -13.210 1.301 -1.036 1.00 0.00 C ATOM 2383 NE1 TRP A 160 -14.049 3.378 -0.989 1.00 0.00 N ATOM 2384 CE2 TRP A 160 -14.094 2.193 -1.674 1.00 0.00 C ATOM 2385 CE3 TRP A 160 -13.071 0.009 -1.548 1.00 0.00 C ATOM 2386 CZ2 TRP A 160 -14.835 1.831 -2.796 1.00 0.00 C ATOM 2387 CZ3 TRP A 160 -13.807 -0.349 -2.661 1.00 0.00 C ATOM 2388 CH2 TRP A 160 -14.679 0.559 -3.276 1.00 0.00 C ATOM 0 H TRP A 160 -9.601 0.650 2.335 1.00 0.00 H new ATOM 0 HA TRP A 160 -10.050 1.501 -0.418 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -11.767 0.387 1.143 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -11.810 1.902 2.024 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -12.931 4.039 0.763 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -14.585 4.215 -1.218 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -12.400 -0.698 -1.082 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -15.509 2.529 -3.270 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -13.708 -1.346 -3.064 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -15.239 0.249 -4.146 1.00 0.00 H new ATOM 2399 N CYS A 161 -9.647 3.929 -0.259 1.00 0.00 N ATOM 2400 CA CYS A 161 -9.328 5.351 -0.201 1.00 0.00 C ATOM 2401 C CYS A 161 -10.497 6.193 -0.701 1.00 0.00 C ATOM 2402 O CYS A 161 -11.355 5.705 -1.437 1.00 0.00 O ATOM 2403 CB CYS A 161 -8.078 5.649 -1.030 1.00 0.00 C ATOM 2404 SG CYS A 161 -6.577 4.850 -0.416 1.00 0.00 S ATOM 0 H CYS A 161 -9.698 3.547 -1.203 1.00 0.00 H new ATOM 0 HA CYS A 161 -9.136 5.612 0.840 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -8.252 5.330 -2.058 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -7.919 6.727 -1.053 1.00 0.00 H new ATOM 0 HG CYS A 161 -5.694 4.796 -1.368 1.00 0.00 H new ATOM 2410 N GLU A 162 -10.526 7.458 -0.295 1.00 0.00 N ATOM 2411 CA GLU A 162 -11.593 8.366 -0.700 1.00 0.00 C ATOM 2412 C GLU A 162 -11.125 9.817 -0.637 1.00 0.00 C ATOM 2413 O GLU A 162 -10.279 10.188 0.177 1.00 0.00 O ATOM 2414 CB GLU A 162 -12.822 8.175 0.191 1.00 0.00 C ATOM 2415 CG GLU A 162 -13.520 6.841 -0.012 1.00 0.00 C ATOM 2416 CD GLU A 162 -14.757 6.692 0.852 1.00 0.00 C ATOM 2417 OE1 GLU A 162 -14.695 7.062 2.044 1.00 0.00 O ATOM 2418 OE2 GLU A 162 -15.786 6.206 0.338 1.00 0.00 O ATOM 0 H GLU A 162 -9.823 7.878 0.314 1.00 0.00 H new ATOM 0 HA GLU A 162 -11.862 8.133 -1.730 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -12.521 8.263 1.235 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -13.531 8.980 -0.005 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -13.799 6.737 -1.061 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -12.824 6.033 0.214 1.00 0.00 H new ATOM 2425 N PRO A 163 -11.688 10.658 -1.517 1.00 0.00 N ATOM 2426 CA PRO A 163 -12.696 10.228 -2.491 1.00 0.00 C ATOM 2427 C PRO A 163 -12.108 9.331 -3.575 1.00 0.00 C ATOM 2428 O PRO A 163 -12.814 8.896 -4.484 1.00 0.00 O ATOM 2429 CB PRO A 163 -13.191 11.544 -3.095 1.00 0.00 C ATOM 2430 CG PRO A 163 -12.057 12.494 -2.914 1.00 0.00 C ATOM 2431 CD PRO A 163 -11.384 12.095 -1.629 1.00 0.00 C ATOM 0 HA PRO A 163 -13.484 9.634 -2.027 1.00 0.00 H new ATOM 0 HB2 PRO A 163 -13.444 11.426 -4.149 1.00 0.00 H new ATOM 0 HB3 PRO A 163 -14.089 11.899 -2.589 1.00 0.00 H new ATOM 0 HG2 PRO A 163 -11.363 12.437 -3.752 1.00 0.00 H new ATOM 0 HG3 PRO A 163 -12.414 13.523 -2.865 1.00 0.00 H new ATOM 0 HD2 PRO A 163 -10.310 12.277 -1.664 1.00 0.00 H new ATOM 0 HD3 PRO A 163 -11.774 12.656 -0.780 1.00 0.00 H new ATOM 2439 N ASN A 164 -10.811 9.059 -3.473 1.00 0.00 N ATOM 2440 CA ASN A 164 -10.129 8.214 -4.446 1.00 0.00 C ATOM 2441 C ASN A 164 -8.748 7.808 -3.940 1.00 0.00 C ATOM 2442 O ASN A 164 -8.290 8.287 -2.903 1.00 0.00 O ATOM 2443 CB ASN A 164 -10.000 8.943 -5.784 1.00 0.00 C ATOM 2444 CG ASN A 164 -9.334 10.298 -5.643 1.00 0.00 C ATOM 2445 OD1 ASN A 164 -9.021 10.736 -4.536 1.00 0.00 O ATOM 2446 ND2 ASN A 164 -9.115 10.970 -6.767 1.00 0.00 N ATOM 0 H ASN A 164 -10.212 9.411 -2.727 1.00 0.00 H new ATOM 0 HA ASN A 164 -10.724 7.312 -4.588 1.00 0.00 H new ATOM 0 HB2 ASN A 164 -9.424 8.328 -6.475 1.00 0.00 H new ATOM 0 HB3 ASN A 164 -10.990 9.072 -6.221 1.00 0.00 H new ATOM 0 HD21 ASN A 164 -8.671 11.888 -6.734 1.00 0.00 H new ATOM 0 HD22 ASN A 164 -9.391 10.569 -7.663 1.00 0.00 H new ATOM 2453 N ALA A 165 -8.089 6.923 -4.680 1.00 0.00 N ATOM 2454 CA ALA A 165 -6.760 6.455 -4.309 1.00 0.00 C ATOM 2455 C ALA A 165 -5.677 7.232 -5.050 1.00 0.00 C ATOM 2456 O ALA A 165 -4.611 6.696 -5.351 1.00 0.00 O ATOM 2457 CB ALA A 165 -6.627 4.965 -4.588 1.00 0.00 C ATOM 0 H ALA A 165 -8.454 6.515 -5.541 1.00 0.00 H new ATOM 0 HA ALA A 165 -6.628 6.627 -3.241 1.00 0.00 H new ATOM 0 HB1 ALA A 165 -5.629 4.630 -4.306 1.00 0.00 H new ATOM 0 HB2 ALA A 165 -7.371 4.418 -4.008 1.00 0.00 H new ATOM 0 HB3 ALA A 165 -6.786 4.778 -5.650 1.00 0.00 H new ATOM 2463 N ALA A 166 -5.958 8.498 -5.342 1.00 0.00 N ATOM 2464 CA ALA A 166 -5.008 9.348 -6.047 1.00 0.00 C ATOM 2465 C ALA A 166 -4.038 10.012 -5.074 1.00 0.00 C ATOM 2466 O ALA A 166 -2.826 9.998 -5.284 1.00 0.00 O ATOM 2467 CB ALA A 166 -5.745 10.401 -6.861 1.00 0.00 C ATOM 0 H ALA A 166 -6.836 8.957 -5.101 1.00 0.00 H new ATOM 0 HA ALA A 166 -4.429 8.720 -6.724 1.00 0.00 H new ATOM 0 HB1 ALA A 166 -5.023 11.029 -7.383 1.00 0.00 H new ATOM 0 HB2 ALA A 166 -6.392 9.911 -7.589 1.00 0.00 H new ATOM 0 HB3 ALA A 166 -6.349 11.018 -6.196 1.00 0.00 H new ATOM 2473 N ASN A 167 -4.581 10.594 -4.009 1.00 0.00 N ATOM 2474 CA ASN A 167 -3.764 11.264 -3.005 1.00 0.00 C ATOM 2475 C ASN A 167 -2.933 10.255 -2.218 1.00 0.00 C ATOM 2476 O ASN A 167 -1.731 10.440 -2.026 1.00 0.00 O ATOM 2477 CB ASN A 167 -4.649 12.067 -2.050 1.00 0.00 C ATOM 2478 CG ASN A 167 -5.817 12.725 -2.760 1.00 0.00 C ATOM 2479 OD1 ASN A 167 -6.807 12.069 -3.089 1.00 0.00 O ATOM 2480 ND2 ASN A 167 -5.707 14.026 -2.999 1.00 0.00 N ATOM 0 H ASN A 167 -5.583 10.615 -3.820 1.00 0.00 H new ATOM 0 HA ASN A 167 -3.086 11.944 -3.520 1.00 0.00 H new ATOM 0 HB2 ASN A 167 -5.027 11.408 -1.268 1.00 0.00 H new ATOM 0 HB3 ASN A 167 -4.048 12.832 -1.559 1.00 0.00 H new ATOM 0 HD21 ASN A 167 -6.461 14.523 -3.473 1.00 0.00 H new ATOM 0 HD22 ASN A 167 -4.868 14.529 -2.708 1.00 0.00 H new ATOM 2487 N VAL A 168 -3.582 9.187 -1.765 1.00 0.00 N ATOM 2488 CA VAL A 168 -2.904 8.147 -1.001 1.00 0.00 C ATOM 2489 C VAL A 168 -1.740 7.557 -1.789 1.00 0.00 C ATOM 2490 O VAL A 168 -0.580 7.692 -1.399 1.00 0.00 O ATOM 2491 CB VAL A 168 -3.872 7.015 -0.610 1.00 0.00 C ATOM 2492 CG1 VAL A 168 -3.102 5.793 -0.135 1.00 0.00 C ATOM 2493 CG2 VAL A 168 -4.845 7.491 0.458 1.00 0.00 C ATOM 0 H VAL A 168 -4.577 9.020 -1.914 1.00 0.00 H new ATOM 0 HA VAL A 168 -2.524 8.618 -0.094 1.00 0.00 H new ATOM 0 HB VAL A 168 -4.446 6.732 -1.492 1.00 0.00 H new ATOM 0 HG11 VAL A 168 -3.803 5.004 0.137 1.00 0.00 H new ATOM 0 HG12 VAL A 168 -2.451 5.440 -0.934 1.00 0.00 H new ATOM 0 HG13 VAL A 168 -2.499 6.058 0.734 1.00 0.00 H new ATOM 0 HG21 VAL A 168 -5.522 6.678 0.722 1.00 0.00 H new ATOM 0 HG22 VAL A 168 -4.290 7.803 1.343 1.00 0.00 H new ATOM 0 HG23 VAL A 168 -5.422 8.333 0.076 1.00 0.00 H new ATOM 2503 N SER A 169 -2.058 6.901 -2.900 1.00 0.00 N ATOM 2504 CA SER A 169 -1.038 6.286 -3.743 1.00 0.00 C ATOM 2505 C SER A 169 0.151 7.223 -3.928 1.00 0.00 C ATOM 2506 O SER A 169 1.301 6.829 -3.735 1.00 0.00 O ATOM 2507 CB SER A 169 -1.628 5.916 -5.105 1.00 0.00 C ATOM 2508 OG SER A 169 -2.295 4.667 -5.050 1.00 0.00 O ATOM 0 H SER A 169 -3.013 6.781 -3.238 1.00 0.00 H new ATOM 0 HA SER A 169 -0.690 5.380 -3.248 1.00 0.00 H new ATOM 0 HB2 SER A 169 -2.325 6.690 -5.425 1.00 0.00 H new ATOM 0 HB3 SER A 169 -0.833 5.875 -5.850 1.00 0.00 H new ATOM 0 HG SER A 169 -1.921 4.128 -4.322 1.00 0.00 H new ATOM 2514 N GLU A 170 -0.135 8.465 -4.305 1.00 0.00 N ATOM 2515 CA GLU A 170 0.910 9.459 -4.517 1.00 0.00 C ATOM 2516 C GLU A 170 1.779 9.610 -3.272 1.00 0.00 C ATOM 2517 O GLU A 170 3.005 9.532 -3.344 1.00 0.00 O ATOM 2518 CB GLU A 170 0.294 10.809 -4.889 1.00 0.00 C ATOM 2519 CG GLU A 170 1.319 11.916 -5.074 1.00 0.00 C ATOM 2520 CD GLU A 170 0.809 13.043 -5.951 1.00 0.00 C ATOM 2521 OE1 GLU A 170 0.142 13.954 -5.416 1.00 0.00 O ATOM 2522 OE2 GLU A 170 1.075 13.014 -7.170 1.00 0.00 O ATOM 0 H GLU A 170 -1.082 8.807 -4.470 1.00 0.00 H new ATOM 0 HA GLU A 170 1.539 9.116 -5.339 1.00 0.00 H new ATOM 0 HB2 GLU A 170 -0.277 10.697 -5.811 1.00 0.00 H new ATOM 0 HB3 GLU A 170 -0.410 11.104 -4.111 1.00 0.00 H new ATOM 0 HG2 GLU A 170 1.596 12.316 -4.099 1.00 0.00 H new ATOM 0 HG3 GLU A 170 2.224 11.498 -5.515 1.00 0.00 H new ATOM 2529 N ALA A 171 1.133 9.827 -2.130 1.00 0.00 N ATOM 2530 CA ALA A 171 1.845 9.987 -0.869 1.00 0.00 C ATOM 2531 C ALA A 171 2.857 8.865 -0.663 1.00 0.00 C ATOM 2532 O ALA A 171 3.988 9.105 -0.239 1.00 0.00 O ATOM 2533 CB ALA A 171 0.861 10.033 0.291 1.00 0.00 C ATOM 0 H ALA A 171 0.118 9.896 -2.053 1.00 0.00 H new ATOM 0 HA ALA A 171 2.390 10.930 -0.906 1.00 0.00 H new ATOM 0 HB1 ALA A 171 1.407 10.153 1.227 1.00 0.00 H new ATOM 0 HB2 ALA A 171 0.180 10.874 0.158 1.00 0.00 H new ATOM 0 HB3 ALA A 171 0.290 9.105 0.321 1.00 0.00 H new ATOM 2539 N VAL A 172 2.443 7.639 -0.964 1.00 0.00 N ATOM 2540 CA VAL A 172 3.313 6.479 -0.812 1.00 0.00 C ATOM 2541 C VAL A 172 4.402 6.465 -1.880 1.00 0.00 C ATOM 2542 O VAL A 172 5.559 6.159 -1.595 1.00 0.00 O ATOM 2543 CB VAL A 172 2.515 5.164 -0.890 1.00 0.00 C ATOM 2544 CG1 VAL A 172 3.433 3.969 -0.683 1.00 0.00 C ATOM 2545 CG2 VAL A 172 1.387 5.164 0.130 1.00 0.00 C ATOM 0 H VAL A 172 1.510 7.423 -1.315 1.00 0.00 H new ATOM 0 HA VAL A 172 3.775 6.557 0.172 1.00 0.00 H new ATOM 0 HB VAL A 172 2.075 5.085 -1.884 1.00 0.00 H new ATOM 0 HG11 VAL A 172 2.851 3.049 -0.741 1.00 0.00 H new ATOM 0 HG12 VAL A 172 4.201 3.962 -1.456 1.00 0.00 H new ATOM 0 HG13 VAL A 172 3.905 4.038 0.297 1.00 0.00 H new ATOM 0 HG21 VAL A 172 0.834 4.227 0.061 1.00 0.00 H new ATOM 0 HG22 VAL A 172 1.803 5.267 1.132 1.00 0.00 H new ATOM 0 HG23 VAL A 172 0.715 5.998 -0.071 1.00 0.00 H new ATOM 2555 N GLN A 173 4.021 6.798 -3.109 1.00 0.00 N ATOM 2556 CA GLN A 173 4.965 6.824 -4.219 1.00 0.00 C ATOM 2557 C GLN A 173 6.091 7.818 -3.954 1.00 0.00 C ATOM 2558 O GLN A 173 7.262 7.443 -3.894 1.00 0.00 O ATOM 2559 CB GLN A 173 4.246 7.185 -5.520 1.00 0.00 C ATOM 2560 CG GLN A 173 5.013 6.787 -6.771 1.00 0.00 C ATOM 2561 CD GLN A 173 4.382 7.328 -8.039 1.00 0.00 C ATOM 2562 OE1 GLN A 173 4.475 8.520 -8.332 1.00 0.00 O ATOM 2563 NE2 GLN A 173 3.737 6.451 -8.800 1.00 0.00 N ATOM 0 H GLN A 173 3.066 7.053 -3.361 1.00 0.00 H new ATOM 0 HA GLN A 173 5.399 5.829 -4.316 1.00 0.00 H new ATOM 0 HB2 GLN A 173 3.270 6.700 -5.533 1.00 0.00 H new ATOM 0 HB3 GLN A 173 4.067 8.260 -5.540 1.00 0.00 H new ATOM 0 HG2 GLN A 173 6.038 7.151 -6.696 1.00 0.00 H new ATOM 0 HG3 GLN A 173 5.065 5.700 -6.831 1.00 0.00 H new ATOM 0 HE21 GLN A 173 3.685 5.472 -8.518 1.00 0.00 H new ATOM 0 HE22 GLN A 173 3.294 6.756 -9.666 1.00 0.00 H new ATOM 2572 N ALA A 174 5.729 9.086 -3.797 1.00 0.00 N ATOM 2573 CA ALA A 174 6.708 10.134 -3.536 1.00 0.00 C ATOM 2574 C ALA A 174 7.663 9.728 -2.419 1.00 0.00 C ATOM 2575 O ALA A 174 8.866 9.972 -2.498 1.00 0.00 O ATOM 2576 CB ALA A 174 6.006 11.438 -3.186 1.00 0.00 C ATOM 0 H ALA A 174 4.764 9.413 -3.846 1.00 0.00 H new ATOM 0 HA ALA A 174 7.294 10.283 -4.443 1.00 0.00 H new ATOM 0 HB1 ALA A 174 6.750 12.211 -2.994 1.00 0.00 H new ATOM 0 HB2 ALA A 174 5.371 11.744 -4.017 1.00 0.00 H new ATOM 0 HB3 ALA A 174 5.394 11.294 -2.296 1.00 0.00 H new ATOM 2582 N ALA A 175 7.117 9.107 -1.378 1.00 0.00 N ATOM 2583 CA ALA A 175 7.921 8.666 -0.245 1.00 0.00 C ATOM 2584 C ALA A 175 9.090 7.801 -0.704 1.00 0.00 C ATOM 2585 O ALA A 175 10.216 7.959 -0.230 1.00 0.00 O ATOM 2586 CB ALA A 175 7.058 7.905 0.750 1.00 0.00 C ATOM 0 H ALA A 175 6.122 8.898 -1.296 1.00 0.00 H new ATOM 0 HA ALA A 175 8.328 9.550 0.245 1.00 0.00 H new ATOM 0 HB1 ALA A 175 7.671 7.582 1.591 1.00 0.00 H new ATOM 0 HB2 ALA A 175 6.260 8.554 1.111 1.00 0.00 H new ATOM 0 HB3 ALA A 175 6.623 7.033 0.262 1.00 0.00 H new ATOM 2592 N CYS A 176 8.816 6.887 -1.629 1.00 0.00 N ATOM 2593 CA CYS A 176 9.845 5.995 -2.151 1.00 0.00 C ATOM 2594 C CYS A 176 11.000 6.791 -2.750 1.00 0.00 C ATOM 2595 O CYS A 176 12.093 6.261 -2.952 1.00 0.00 O ATOM 2596 CB CYS A 176 9.252 5.061 -3.207 1.00 0.00 C ATOM 2597 SG CYS A 176 7.906 4.018 -2.597 1.00 0.00 S ATOM 0 H CYS A 176 7.890 6.745 -2.033 1.00 0.00 H new ATOM 0 HA CYS A 176 10.228 5.398 -1.323 1.00 0.00 H new ATOM 0 HB2 CYS A 176 8.885 5.659 -4.041 1.00 0.00 H new ATOM 0 HB3 CYS A 176 10.044 4.422 -3.598 1.00 0.00 H new ATOM 0 HG CYS A 176 6.932 4.769 -2.176 1.00 0.00 H new