USER MOD reduce.3.24.130724 H: found=0, std=0, add=787, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 789 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 80 ASN : amide:sc= -2.29 X(o=-3.1,f=-3.1!) USER MOD Set 1.2: A 96 MET CE :methyl 132:sc= -0.782 (180deg=-0.0055) USER MOD Set 2.1: A 78 HIS : no HD1:sc= -0.157 X(o=-0.13,f=-0.073) USER MOD Set 2.2: A 82 LYS NZ :NH3+ 155:sc= 0.025 (180deg=0) USER MOD Set 3.1: A 41 SER OG : rot 66:sc= 1.06 USER MOD Set 3.2: A 102 CYS SG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= -0.39 X(o=-0.39,f=-0.2) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= -1.44! C(o=-1.4!,f=-5.4!) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 TYR OH : rot 149:sc= 0.0092 USER MOD Single : A 56 LYS NZ :NH3+ -154:sc= -1.99! (180deg=-3.18!) USER MOD Single : A 57 MET CE :methyl 139:sc= -0.396 (180deg=-2.03!) USER MOD Single : A 60 MET CE :methyl -147:sc= -2.53! (180deg=-4.7!) USER MOD Single : A 61 HIS : no HD1:sc= -0.12 X(o=-0.12,f=-0.12) USER MOD Single : A 62 ASN : amide:sc= -0.0296 X(o=-0.03,f=0) USER MOD Single : A 63 TYR OH : rot 180:sc= -0.285 USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=-0.0033) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 71 GLN : amide:sc= -0.57 X(o=-0.57,f=-0.56) USER MOD Single : A 72 LYS NZ :NH3+ -178:sc= 0.304 (180deg=0.269) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= -0.314 K(o=-0.31,f=-1.4) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= -0.402 X(o=-0.4,f=-0.31) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ -105:sc= 1.26 (180deg=-0.252) USER MOD Single : A 101 GLN : amide:sc= -0.517 K(o=-0.52,f=-3.1!) USER MOD Single : A 116 GLN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 122 GLN : amide:sc= -0.893 K(o=-0.89,f=-2.4) USER MOD ----------------------------------------------------------------- ATOM 220 N GLN A 19 7.927 15.511 0.609 1.00 0.00 N ATOM 221 CA GLN A 19 8.897 14.508 1.032 1.00 0.00 C ATOM 222 C GLN A 19 8.401 13.102 0.711 1.00 0.00 C ATOM 223 O GLN A 19 9.140 12.280 0.168 1.00 0.00 O ATOM 224 CB GLN A 19 9.172 14.634 2.531 1.00 0.00 C ATOM 225 CG GLN A 19 10.141 15.753 2.879 1.00 0.00 C ATOM 226 CD GLN A 19 11.531 15.516 2.322 1.00 0.00 C ATOM 227 OE1 GLN A 19 12.106 16.385 1.667 1.00 0.00 O ATOM 228 NE2 GLN A 19 12.079 14.334 2.581 1.00 0.00 N ATOM 0 HA GLN A 19 9.823 14.681 0.484 1.00 0.00 H new ATOM 0 HB2 GLN A 19 8.230 14.805 3.052 1.00 0.00 H new ATOM 0 HB3 GLN A 19 9.573 13.690 2.899 1.00 0.00 H new ATOM 0 HG2 GLN A 19 9.755 16.696 2.492 1.00 0.00 H new ATOM 0 HG3 GLN A 19 10.200 15.853 3.963 1.00 0.00 H new ATOM 0 HE21 GLN A 19 11.566 13.643 3.128 1.00 0.00 H new ATOM 0 HE22 GLN A 19 13.013 14.117 2.233 1.00 0.00 H new ATOM 237 N LEU A 20 7.145 12.831 1.049 1.00 0.00 N ATOM 238 CA LEU A 20 6.549 11.523 0.797 1.00 0.00 C ATOM 239 C LEU A 20 6.459 11.245 -0.700 1.00 0.00 C ATOM 240 O LEU A 20 6.624 10.108 -1.141 1.00 0.00 O ATOM 241 CB LEU A 20 5.157 11.446 1.427 1.00 0.00 C ATOM 242 CG LEU A 20 4.296 10.254 1.006 1.00 0.00 C ATOM 243 CD1 LEU A 20 4.598 9.044 1.876 1.00 0.00 C ATOM 244 CD2 LEU A 20 2.819 10.611 1.081 1.00 0.00 C ATOM 0 H LEU A 20 6.519 13.500 1.498 1.00 0.00 H new ATOM 0 HA LEU A 20 7.189 10.766 1.250 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.271 11.422 2.511 1.00 0.00 H new ATOM 0 HB3 LEU A 20 4.618 12.362 1.184 1.00 0.00 H new ATOM 0 HG LEU A 20 4.537 10.003 -0.027 1.00 0.00 H new ATOM 0 HD11 LEU A 20 3.976 8.206 1.562 1.00 0.00 H new ATOM 0 HD12 LEU A 20 5.649 8.775 1.773 1.00 0.00 H new ATOM 0 HD13 LEU A 20 4.385 9.283 2.918 1.00 0.00 H new ATOM 0 HD21 LEU A 20 2.221 9.751 0.778 1.00 0.00 H new ATOM 0 HD22 LEU A 20 2.563 10.889 2.104 1.00 0.00 H new ATOM 0 HD23 LEU A 20 2.613 11.449 0.415 1.00 0.00 H new ATOM 256 N TYR A 21 6.199 12.292 -1.476 1.00 0.00 N ATOM 257 CA TYR A 21 6.087 12.160 -2.924 1.00 0.00 C ATOM 258 C TYR A 21 7.414 11.720 -3.535 1.00 0.00 C ATOM 259 O TYR A 21 7.471 11.308 -4.694 1.00 0.00 O ATOM 260 CB TYR A 21 5.642 13.485 -3.544 1.00 0.00 C ATOM 261 CG TYR A 21 4.173 13.783 -3.347 1.00 0.00 C ATOM 262 CD1 TYR A 21 3.581 13.661 -2.095 1.00 0.00 C ATOM 263 CD2 TYR A 21 3.376 14.185 -4.411 1.00 0.00 C ATOM 264 CE1 TYR A 21 2.239 13.931 -1.910 1.00 0.00 C ATOM 265 CE2 TYR A 21 2.033 14.459 -4.235 1.00 0.00 C ATOM 266 CZ TYR A 21 1.469 14.330 -2.983 1.00 0.00 C ATOM 267 OH TYR A 21 0.132 14.600 -2.804 1.00 0.00 O ATOM 0 H TYR A 21 6.062 13.241 -1.127 1.00 0.00 H new ATOM 0 HA TYR A 21 5.339 11.397 -3.137 1.00 0.00 H new ATOM 0 HB2 TYR A 21 6.230 14.295 -3.111 1.00 0.00 H new ATOM 0 HB3 TYR A 21 5.861 13.468 -4.612 1.00 0.00 H new ATOM 0 HD1 TYR A 21 4.181 13.350 -1.252 1.00 0.00 H new ATOM 0 HD2 TYR A 21 3.814 14.285 -5.393 1.00 0.00 H new ATOM 0 HE1 TYR A 21 1.795 13.830 -0.931 1.00 0.00 H new ATOM 0 HE2 TYR A 21 1.428 14.772 -5.073 1.00 0.00 H new ATOM 0 HH TYR A 21 -0.265 14.869 -3.659 1.00 0.00 H new ATOM 277 N LEU A 22 8.479 11.808 -2.746 1.00 0.00 N ATOM 278 CA LEU A 22 9.807 11.419 -3.208 1.00 0.00 C ATOM 279 C LEU A 22 10.083 9.952 -2.895 1.00 0.00 C ATOM 280 O LEU A 22 10.539 9.199 -3.756 1.00 0.00 O ATOM 281 CB LEU A 22 10.874 12.300 -2.556 1.00 0.00 C ATOM 282 CG LEU A 22 10.943 13.746 -3.050 1.00 0.00 C ATOM 283 CD1 LEU A 22 11.672 14.620 -2.041 1.00 0.00 C ATOM 284 CD2 LEU A 22 11.625 13.814 -4.408 1.00 0.00 C ATOM 0 H LEU A 22 8.449 12.145 -1.784 1.00 0.00 H new ATOM 0 HA LEU A 22 9.843 11.555 -4.289 1.00 0.00 H new ATOM 0 HB2 LEU A 22 10.699 12.312 -1.480 1.00 0.00 H new ATOM 0 HB3 LEU A 22 11.847 11.836 -2.715 1.00 0.00 H new ATOM 0 HG LEU A 22 9.926 14.122 -3.158 1.00 0.00 H new ATOM 0 HD11 LEU A 22 11.712 15.645 -2.409 1.00 0.00 H new ATOM 0 HD12 LEU A 22 11.142 14.596 -1.089 1.00 0.00 H new ATOM 0 HD13 LEU A 22 12.686 14.246 -1.901 1.00 0.00 H new ATOM 0 HD21 LEU A 22 11.665 14.850 -4.744 1.00 0.00 H new ATOM 0 HD22 LEU A 22 12.638 13.420 -4.327 1.00 0.00 H new ATOM 0 HD23 LEU A 22 11.061 13.221 -5.128 1.00 0.00 H new ATOM 296 N TRP A 23 9.802 9.552 -1.660 1.00 0.00 N ATOM 297 CA TRP A 23 10.019 8.174 -1.235 1.00 0.00 C ATOM 298 C TRP A 23 9.472 7.194 -2.267 1.00 0.00 C ATOM 299 O TRP A 23 10.154 6.248 -2.661 1.00 0.00 O ATOM 300 CB TRP A 23 9.357 7.928 0.122 1.00 0.00 C ATOM 301 CG TRP A 23 9.212 6.474 0.457 1.00 0.00 C ATOM 302 CD1 TRP A 23 10.220 5.586 0.704 1.00 0.00 C ATOM 303 CD2 TRP A 23 7.989 5.740 0.579 1.00 0.00 C ATOM 304 NE1 TRP A 23 9.697 4.344 0.973 1.00 0.00 N ATOM 305 CE2 TRP A 23 8.330 4.412 0.903 1.00 0.00 C ATOM 306 CE3 TRP A 23 6.639 6.076 0.449 1.00 0.00 C ATOM 307 CZ2 TRP A 23 7.370 3.423 1.097 1.00 0.00 C ATOM 308 CZ3 TRP A 23 5.687 5.093 0.641 1.00 0.00 C ATOM 309 CH2 TRP A 23 6.055 3.780 0.962 1.00 0.00 C ATOM 0 H TRP A 23 9.424 10.162 -0.936 1.00 0.00 H new ATOM 0 HA TRP A 23 11.093 8.013 -1.142 1.00 0.00 H new ATOM 0 HB2 TRP A 23 9.946 8.416 0.899 1.00 0.00 H new ATOM 0 HB3 TRP A 23 8.372 8.395 0.128 1.00 0.00 H new ATOM 0 HD1 TRP A 23 11.273 5.825 0.690 1.00 0.00 H new ATOM 0 HE1 TRP A 23 10.238 3.507 1.190 1.00 0.00 H new ATOM 0 HE3 TRP A 23 6.345 7.086 0.203 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 7.652 2.410 1.345 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 4.641 5.341 0.542 1.00 0.00 H new ATOM 0 HH2 TRP A 23 5.287 3.035 1.106 1.00 0.00 H new ATOM 320 N VAL A 24 8.238 7.426 -2.701 1.00 0.00 N ATOM 321 CA VAL A 24 7.600 6.563 -3.689 1.00 0.00 C ATOM 322 C VAL A 24 8.367 6.577 -5.007 1.00 0.00 C ATOM 323 O VAL A 24 8.618 5.529 -5.602 1.00 0.00 O ATOM 324 CB VAL A 24 6.144 6.990 -3.950 1.00 0.00 C ATOM 325 CG1 VAL A 24 5.515 6.116 -5.025 1.00 0.00 C ATOM 326 CG2 VAL A 24 5.333 6.934 -2.664 1.00 0.00 C ATOM 0 H VAL A 24 7.659 8.204 -2.384 1.00 0.00 H new ATOM 0 HA VAL A 24 7.606 5.553 -3.279 1.00 0.00 H new ATOM 0 HB VAL A 24 6.145 8.020 -4.307 1.00 0.00 H new ATOM 0 HG11 VAL A 24 4.486 6.433 -5.196 1.00 0.00 H new ATOM 0 HG12 VAL A 24 6.083 6.212 -5.951 1.00 0.00 H new ATOM 0 HG13 VAL A 24 5.525 5.076 -4.700 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.307 7.239 -2.868 1.00 0.00 H new ATOM 0 HG22 VAL A 24 5.339 5.916 -2.274 1.00 0.00 H new ATOM 0 HG23 VAL A 24 5.772 7.607 -1.927 1.00 0.00 H new ATOM 336 N ASP A 25 8.736 7.771 -5.457 1.00 0.00 N ATOM 337 CA ASP A 25 9.476 7.922 -6.705 1.00 0.00 C ATOM 338 C ASP A 25 10.475 6.783 -6.886 1.00 0.00 C ATOM 339 O ASP A 25 10.457 6.083 -7.897 1.00 0.00 O ATOM 340 CB ASP A 25 10.206 9.266 -6.730 1.00 0.00 C ATOM 341 CG ASP A 25 10.869 9.539 -8.066 1.00 0.00 C ATOM 342 OD1 ASP A 25 10.415 8.970 -9.081 1.00 0.00 O ATOM 343 OD2 ASP A 25 11.842 10.322 -8.097 1.00 0.00 O ATOM 0 H ASP A 25 8.535 8.648 -4.977 1.00 0.00 H new ATOM 0 HA ASP A 25 8.762 7.889 -7.528 1.00 0.00 H new ATOM 0 HB2 ASP A 25 9.498 10.065 -6.509 1.00 0.00 H new ATOM 0 HB3 ASP A 25 10.960 9.281 -5.943 1.00 0.00 H new ATOM 348 N ASN A 26 11.346 6.604 -5.898 1.00 0.00 N ATOM 349 CA ASN A 26 12.354 5.552 -5.948 1.00 0.00 C ATOM 350 C ASN A 26 11.761 4.257 -6.496 1.00 0.00 C ATOM 351 O ASN A 26 12.285 3.675 -7.445 1.00 0.00 O ATOM 352 CB ASN A 26 12.939 5.309 -4.556 1.00 0.00 C ATOM 353 CG ASN A 26 13.727 4.016 -4.477 1.00 0.00 C ATOM 354 OD1 ASN A 26 13.190 2.933 -4.710 1.00 0.00 O ATOM 355 ND2 ASN A 26 15.009 4.124 -4.146 1.00 0.00 N ATOM 0 H ASN A 26 11.374 7.174 -5.053 1.00 0.00 H new ATOM 0 HA ASN A 26 13.151 5.878 -6.617 1.00 0.00 H new ATOM 0 HB2 ASN A 26 13.587 6.143 -4.287 1.00 0.00 H new ATOM 0 HB3 ASN A 26 12.131 5.284 -3.825 1.00 0.00 H new ATOM 0 HD21 ASN A 26 15.590 3.288 -4.076 1.00 0.00 H new ATOM 0 HD22 ASN A 26 15.412 5.042 -3.961 1.00 0.00 H new ATOM 362 N ILE A 27 10.665 3.812 -5.890 1.00 0.00 N ATOM 363 CA ILE A 27 10.000 2.588 -6.318 1.00 0.00 C ATOM 364 C ILE A 27 9.376 2.755 -7.699 1.00 0.00 C ATOM 365 O ILE A 27 8.553 3.640 -7.933 1.00 0.00 O ATOM 366 CB ILE A 27 8.905 2.164 -5.320 1.00 0.00 C ATOM 367 CG1 ILE A 27 9.514 1.909 -3.940 1.00 0.00 C ATOM 368 CG2 ILE A 27 8.182 0.924 -5.823 1.00 0.00 C ATOM 369 CD1 ILE A 27 8.509 1.991 -2.812 1.00 0.00 C ATOM 0 H ILE A 27 10.219 4.281 -5.101 1.00 0.00 H new ATOM 0 HA ILE A 27 10.764 1.812 -6.359 1.00 0.00 H new ATOM 0 HB ILE A 27 8.180 2.973 -5.233 1.00 0.00 H new ATOM 0 HG12 ILE A 27 9.977 0.922 -3.933 1.00 0.00 H new ATOM 0 HG13 ILE A 27 10.308 2.635 -3.762 1.00 0.00 H new ATOM 0 HG21 ILE A 27 7.412 0.637 -5.107 1.00 0.00 H new ATOM 0 HG22 ILE A 27 7.720 1.138 -6.787 1.00 0.00 H new ATOM 0 HG23 ILE A 27 8.895 0.107 -5.936 1.00 0.00 H new ATOM 0 HD11 ILE A 27 9.010 1.800 -1.863 1.00 0.00 H new ATOM 0 HD12 ILE A 27 8.064 2.986 -2.793 1.00 0.00 H new ATOM 0 HD13 ILE A 27 7.728 1.247 -2.966 1.00 0.00 H new ATOM 577 N ASP A 39 -5.263 8.128 -7.657 1.00 0.00 N ATOM 578 CA ASP A 39 -4.665 6.808 -7.812 1.00 0.00 C ATOM 579 C ASP A 39 -4.478 6.132 -6.457 1.00 0.00 C ATOM 580 O ASP A 39 -4.698 4.929 -6.317 1.00 0.00 O ATOM 581 CB ASP A 39 -3.319 6.915 -8.532 1.00 0.00 C ATOM 582 CG ASP A 39 -3.474 7.257 -10.001 1.00 0.00 C ATOM 583 OD1 ASP A 39 -4.461 7.937 -10.352 1.00 0.00 O ATOM 584 OD2 ASP A 39 -2.607 6.845 -10.800 1.00 0.00 O ATOM 0 HA ASP A 39 -5.342 6.199 -8.411 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -2.710 7.678 -8.047 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -2.783 5.971 -8.436 1.00 0.00 H new ATOM 589 N PHE A 40 -4.072 6.914 -5.463 1.00 0.00 N ATOM 590 CA PHE A 40 -3.854 6.391 -4.119 1.00 0.00 C ATOM 591 C PHE A 40 -5.181 6.180 -3.396 1.00 0.00 C ATOM 592 O PHE A 40 -5.364 5.188 -2.690 1.00 0.00 O ATOM 593 CB PHE A 40 -2.968 7.346 -3.315 1.00 0.00 C ATOM 594 CG PHE A 40 -1.500 7.063 -3.456 1.00 0.00 C ATOM 595 CD1 PHE A 40 -0.790 7.542 -4.545 1.00 0.00 C ATOM 596 CD2 PHE A 40 -0.830 6.318 -2.499 1.00 0.00 C ATOM 597 CE1 PHE A 40 0.561 7.282 -4.676 1.00 0.00 C ATOM 598 CE2 PHE A 40 0.521 6.055 -2.625 1.00 0.00 C ATOM 599 CZ PHE A 40 1.218 6.539 -3.715 1.00 0.00 C ATOM 0 H PHE A 40 -3.887 7.912 -5.562 1.00 0.00 H new ATOM 0 HA PHE A 40 -3.352 5.428 -4.208 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -3.165 8.369 -3.636 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -3.242 7.284 -2.262 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -1.298 8.125 -5.299 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -1.370 5.938 -1.644 1.00 0.00 H new ATOM 0 HE1 PHE A 40 1.103 7.660 -5.530 1.00 0.00 H new ATOM 0 HE2 PHE A 40 1.031 5.472 -1.872 1.00 0.00 H new ATOM 0 HZ PHE A 40 2.274 6.337 -3.815 1.00 0.00 H new ATOM 609 N SER A 41 -6.103 7.119 -3.578 1.00 0.00 N ATOM 610 CA SER A 41 -7.412 7.039 -2.939 1.00 0.00 C ATOM 611 C SER A 41 -7.982 5.628 -3.045 1.00 0.00 C ATOM 612 O SER A 41 -8.735 5.184 -2.179 1.00 0.00 O ATOM 613 CB SER A 41 -8.376 8.040 -3.578 1.00 0.00 C ATOM 614 OG SER A 41 -9.703 7.828 -3.129 1.00 0.00 O ATOM 0 H SER A 41 -5.969 7.944 -4.162 1.00 0.00 H new ATOM 0 HA SER A 41 -7.290 7.285 -1.884 1.00 0.00 H new ATOM 0 HB2 SER A 41 -8.064 9.056 -3.335 1.00 0.00 H new ATOM 0 HB3 SER A 41 -8.337 7.946 -4.663 1.00 0.00 H new ATOM 0 HG SER A 41 -9.762 8.034 -2.173 1.00 0.00 H new ATOM 620 N ASP A 42 -7.617 4.928 -4.114 1.00 0.00 N ATOM 621 CA ASP A 42 -8.091 3.566 -4.334 1.00 0.00 C ATOM 622 C ASP A 42 -7.136 2.552 -3.712 1.00 0.00 C ATOM 623 O ASP A 42 -5.918 2.678 -3.827 1.00 0.00 O ATOM 624 CB ASP A 42 -8.241 3.292 -5.831 1.00 0.00 C ATOM 625 CG ASP A 42 -9.025 2.025 -6.111 1.00 0.00 C ATOM 626 OD1 ASP A 42 -9.200 1.217 -5.176 1.00 0.00 O ATOM 627 OD2 ASP A 42 -9.461 1.840 -7.267 1.00 0.00 O ATOM 0 H ASP A 42 -6.995 5.281 -4.841 1.00 0.00 H new ATOM 0 HA ASP A 42 -9.064 3.464 -3.854 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -8.741 4.137 -6.304 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -7.253 3.212 -6.284 1.00 0.00 H new ATOM 632 N GLY A 43 -7.700 1.545 -3.050 1.00 0.00 N ATOM 633 CA GLY A 43 -6.884 0.524 -2.418 1.00 0.00 C ATOM 634 C GLY A 43 -6.396 -0.519 -3.403 1.00 0.00 C ATOM 635 O GLY A 43 -6.436 -1.717 -3.121 1.00 0.00 O ATOM 0 H GLY A 43 -8.706 1.418 -2.940 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -6.026 0.995 -1.937 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -7.462 0.036 -1.633 1.00 0.00 H new ATOM 639 N VAL A 44 -5.933 -0.065 -4.564 1.00 0.00 N ATOM 640 CA VAL A 44 -5.435 -0.968 -5.595 1.00 0.00 C ATOM 641 C VAL A 44 -3.945 -0.755 -5.838 1.00 0.00 C ATOM 642 O VAL A 44 -3.193 -1.712 -6.028 1.00 0.00 O ATOM 643 CB VAL A 44 -6.193 -0.777 -6.922 1.00 0.00 C ATOM 644 CG1 VAL A 44 -5.626 -1.691 -7.997 1.00 0.00 C ATOM 645 CG2 VAL A 44 -7.681 -1.029 -6.726 1.00 0.00 C ATOM 0 H VAL A 44 -5.893 0.923 -4.814 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.600 -1.983 -5.234 1.00 0.00 H new ATOM 0 HB VAL A 44 -6.062 0.254 -7.250 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -6.174 -1.542 -8.927 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -4.573 -1.458 -8.155 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -5.724 -2.729 -7.680 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.202 -0.890 -7.673 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -7.834 -2.049 -6.374 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -8.075 -0.329 -5.989 1.00 0.00 H new ATOM 655 N LEU A 45 -3.524 0.505 -5.831 1.00 0.00 N ATOM 656 CA LEU A 45 -2.123 0.845 -6.050 1.00 0.00 C ATOM 657 C LEU A 45 -1.298 0.593 -4.792 1.00 0.00 C ATOM 658 O LEU A 45 -0.200 0.040 -4.857 1.00 0.00 O ATOM 659 CB LEU A 45 -1.993 2.308 -6.474 1.00 0.00 C ATOM 660 CG LEU A 45 -0.571 2.806 -6.740 1.00 0.00 C ATOM 661 CD1 LEU A 45 -0.194 2.589 -8.197 1.00 0.00 C ATOM 662 CD2 LEU A 45 -0.443 4.276 -6.368 1.00 0.00 C ATOM 0 H LEU A 45 -4.133 1.308 -5.676 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.741 0.207 -6.847 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -2.584 2.457 -7.378 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -2.436 2.931 -5.697 1.00 0.00 H new ATOM 0 HG LEU A 45 0.117 2.233 -6.118 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.821 2.949 -8.368 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.246 1.526 -8.432 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -0.886 3.136 -8.837 1.00 0.00 H new ATOM 0 HD21 LEU A 45 0.575 4.614 -6.564 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -1.141 4.864 -6.964 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -0.671 4.405 -5.310 1.00 0.00 H new ATOM 674 N VAL A 46 -1.835 1.000 -3.647 1.00 0.00 N ATOM 675 CA VAL A 46 -1.151 0.815 -2.372 1.00 0.00 C ATOM 676 C VAL A 46 -0.486 -0.555 -2.299 1.00 0.00 C ATOM 677 O VAL A 46 0.615 -0.694 -1.768 1.00 0.00 O ATOM 678 CB VAL A 46 -2.122 0.967 -1.187 1.00 0.00 C ATOM 679 CG1 VAL A 46 -1.399 0.730 0.130 1.00 0.00 C ATOM 680 CG2 VAL A 46 -2.775 2.341 -1.205 1.00 0.00 C ATOM 0 H VAL A 46 -2.742 1.460 -3.575 1.00 0.00 H new ATOM 0 HA VAL A 46 -0.387 1.590 -2.307 1.00 0.00 H new ATOM 0 HB VAL A 46 -2.906 0.216 -1.285 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -2.101 0.842 0.956 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -0.984 -0.278 0.141 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -0.593 1.456 0.238 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -3.458 2.430 -0.360 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -2.006 3.110 -1.133 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -3.329 2.468 -2.135 1.00 0.00 H new ATOM 690 N ALA A 47 -1.164 -1.564 -2.836 1.00 0.00 N ATOM 691 CA ALA A 47 -0.638 -2.924 -2.833 1.00 0.00 C ATOM 692 C ALA A 47 0.667 -3.009 -3.617 1.00 0.00 C ATOM 693 O ALA A 47 1.622 -3.650 -3.181 1.00 0.00 O ATOM 694 CB ALA A 47 -1.665 -3.888 -3.408 1.00 0.00 C ATOM 0 H ALA A 47 -2.078 -1.466 -3.278 1.00 0.00 H new ATOM 0 HA ALA A 47 -0.430 -3.205 -1.801 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -1.259 -4.900 -3.400 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -2.572 -3.856 -2.804 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -1.901 -3.600 -4.433 1.00 0.00 H new ATOM 700 N GLU A 48 0.699 -2.358 -4.776 1.00 0.00 N ATOM 701 CA GLU A 48 1.888 -2.363 -5.621 1.00 0.00 C ATOM 702 C GLU A 48 3.124 -1.956 -4.824 1.00 0.00 C ATOM 703 O GLU A 48 4.174 -2.591 -4.918 1.00 0.00 O ATOM 704 CB GLU A 48 1.700 -1.418 -6.810 1.00 0.00 C ATOM 705 CG GLU A 48 0.515 -1.776 -7.691 1.00 0.00 C ATOM 706 CD GLU A 48 0.438 -0.921 -8.941 1.00 0.00 C ATOM 707 OE1 GLU A 48 1.504 -0.512 -9.446 1.00 0.00 O ATOM 708 OE2 GLU A 48 -0.688 -0.661 -9.414 1.00 0.00 O ATOM 0 H GLU A 48 -0.083 -1.821 -5.151 1.00 0.00 H new ATOM 0 HA GLU A 48 2.034 -3.377 -5.992 1.00 0.00 H new ATOM 0 HB2 GLU A 48 1.572 -0.401 -6.438 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.607 -1.424 -7.415 1.00 0.00 H new ATOM 0 HG2 GLU A 48 0.584 -2.826 -7.977 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -0.406 -1.661 -7.119 1.00 0.00 H new ATOM 715 N VAL A 49 2.990 -0.891 -4.039 1.00 0.00 N ATOM 716 CA VAL A 49 4.095 -0.398 -3.225 1.00 0.00 C ATOM 717 C VAL A 49 4.667 -1.505 -2.347 1.00 0.00 C ATOM 718 O VAL A 49 5.858 -1.512 -2.036 1.00 0.00 O ATOM 719 CB VAL A 49 3.653 0.775 -2.331 1.00 0.00 C ATOM 720 CG1 VAL A 49 4.808 1.249 -1.462 1.00 0.00 C ATOM 721 CG2 VAL A 49 3.110 1.915 -3.178 1.00 0.00 C ATOM 0 H VAL A 49 2.128 -0.354 -3.950 1.00 0.00 H new ATOM 0 HA VAL A 49 4.865 -0.050 -3.913 1.00 0.00 H new ATOM 0 HB VAL A 49 2.855 0.428 -1.675 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.477 2.078 -0.837 1.00 0.00 H new ATOM 0 HG12 VAL A 49 5.146 0.430 -0.828 1.00 0.00 H new ATOM 0 HG13 VAL A 49 5.630 1.579 -2.097 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.802 2.735 -2.530 1.00 0.00 H new ATOM 0 HG22 VAL A 49 3.886 2.263 -3.860 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.252 1.565 -3.752 1.00 0.00 H new ATOM 731 N ILE A 50 3.810 -2.440 -1.950 1.00 0.00 N ATOM 732 CA ILE A 50 4.230 -3.554 -1.108 1.00 0.00 C ATOM 733 C ILE A 50 5.081 -4.546 -1.894 1.00 0.00 C ATOM 734 O ILE A 50 6.081 -5.059 -1.390 1.00 0.00 O ATOM 735 CB ILE A 50 3.020 -4.294 -0.509 1.00 0.00 C ATOM 736 CG1 ILE A 50 2.076 -3.304 0.176 1.00 0.00 C ATOM 737 CG2 ILE A 50 3.485 -5.358 0.474 1.00 0.00 C ATOM 738 CD1 ILE A 50 0.710 -3.880 0.474 1.00 0.00 C ATOM 0 H ILE A 50 2.821 -2.448 -2.198 1.00 0.00 H new ATOM 0 HA ILE A 50 4.824 -3.131 -0.298 1.00 0.00 H new ATOM 0 HB ILE A 50 2.476 -4.785 -1.316 1.00 0.00 H new ATOM 0 HG12 ILE A 50 2.530 -2.966 1.108 1.00 0.00 H new ATOM 0 HG13 ILE A 50 1.960 -2.426 -0.459 1.00 0.00 H new ATOM 0 HG21 ILE A 50 2.619 -5.873 0.890 1.00 0.00 H new ATOM 0 HG22 ILE A 50 4.121 -6.077 -0.042 1.00 0.00 H new ATOM 0 HG23 ILE A 50 4.048 -4.888 1.280 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.094 -3.123 0.959 1.00 0.00 H new ATOM 0 HD12 ILE A 50 0.236 -4.192 -0.457 1.00 0.00 H new ATOM 0 HD13 ILE A 50 0.814 -4.741 1.134 1.00 0.00 H new ATOM 750 N LYS A 51 4.680 -4.811 -3.132 1.00 0.00 N ATOM 751 CA LYS A 51 5.406 -5.739 -3.991 1.00 0.00 C ATOM 752 C LYS A 51 6.912 -5.541 -3.855 1.00 0.00 C ATOM 753 O LYS A 51 7.657 -6.496 -3.635 1.00 0.00 O ATOM 754 CB LYS A 51 4.986 -5.551 -5.450 1.00 0.00 C ATOM 755 CG LYS A 51 5.829 -6.345 -6.433 1.00 0.00 C ATOM 756 CD LYS A 51 5.353 -7.784 -6.541 1.00 0.00 C ATOM 757 CE LYS A 51 4.284 -7.938 -7.612 1.00 0.00 C ATOM 758 NZ LYS A 51 3.446 -9.149 -7.390 1.00 0.00 N ATOM 0 H LYS A 51 3.855 -4.396 -3.564 1.00 0.00 H new ATOM 0 HA LYS A 51 5.161 -6.753 -3.677 1.00 0.00 H new ATOM 0 HB2 LYS A 51 3.942 -5.845 -5.559 1.00 0.00 H new ATOM 0 HB3 LYS A 51 5.048 -4.493 -5.704 1.00 0.00 H new ATOM 0 HG2 LYS A 51 5.787 -5.872 -7.414 1.00 0.00 H new ATOM 0 HG3 LYS A 51 6.872 -6.329 -6.116 1.00 0.00 H new ATOM 0 HD2 LYS A 51 6.198 -8.432 -6.773 1.00 0.00 H new ATOM 0 HD3 LYS A 51 4.956 -8.110 -5.580 1.00 0.00 H new ATOM 0 HE2 LYS A 51 3.648 -7.053 -7.620 1.00 0.00 H new ATOM 0 HE3 LYS A 51 4.758 -7.999 -8.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 2.730 -9.218 -8.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 4.049 -9.996 -7.408 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 2.973 -9.080 -6.466 1.00 0.00 H new ATOM 772 N PHE A 52 7.355 -4.294 -3.985 1.00 0.00 N ATOM 773 CA PHE A 52 8.773 -3.971 -3.876 1.00 0.00 C ATOM 774 C PHE A 52 9.392 -4.649 -2.657 1.00 0.00 C ATOM 775 O PHE A 52 10.496 -5.191 -2.729 1.00 0.00 O ATOM 776 CB PHE A 52 8.966 -2.456 -3.784 1.00 0.00 C ATOM 777 CG PHE A 52 10.392 -2.048 -3.544 1.00 0.00 C ATOM 778 CD1 PHE A 52 10.897 -1.974 -2.256 1.00 0.00 C ATOM 779 CD2 PHE A 52 11.226 -1.738 -4.606 1.00 0.00 C ATOM 780 CE1 PHE A 52 12.208 -1.598 -2.032 1.00 0.00 C ATOM 781 CE2 PHE A 52 12.538 -1.361 -4.388 1.00 0.00 C ATOM 782 CZ PHE A 52 13.030 -1.292 -3.099 1.00 0.00 C ATOM 0 H PHE A 52 6.752 -3.491 -4.166 1.00 0.00 H new ATOM 0 HA PHE A 52 9.275 -4.341 -4.770 1.00 0.00 H new ATOM 0 HB2 PHE A 52 8.615 -1.996 -4.708 1.00 0.00 H new ATOM 0 HB3 PHE A 52 8.344 -2.067 -2.978 1.00 0.00 H new ATOM 0 HD1 PHE A 52 10.259 -2.213 -1.418 1.00 0.00 H new ATOM 0 HD2 PHE A 52 10.847 -1.791 -5.616 1.00 0.00 H new ATOM 0 HE1 PHE A 52 12.590 -1.543 -1.023 1.00 0.00 H new ATOM 0 HE2 PHE A 52 13.178 -1.121 -5.224 1.00 0.00 H new ATOM 0 HZ PHE A 52 14.055 -0.999 -2.926 1.00 0.00 H new ATOM 792 N TYR A 53 8.676 -4.613 -1.539 1.00 0.00 N ATOM 793 CA TYR A 53 9.156 -5.221 -0.304 1.00 0.00 C ATOM 794 C TYR A 53 8.811 -6.706 -0.257 1.00 0.00 C ATOM 795 O TYR A 53 9.695 -7.562 -0.283 1.00 0.00 O ATOM 796 CB TYR A 53 8.553 -4.508 0.907 1.00 0.00 C ATOM 797 CG TYR A 53 8.847 -3.025 0.945 1.00 0.00 C ATOM 798 CD1 TYR A 53 10.100 -2.555 1.318 1.00 0.00 C ATOM 799 CD2 TYR A 53 7.871 -2.095 0.610 1.00 0.00 C ATOM 800 CE1 TYR A 53 10.373 -1.201 1.355 1.00 0.00 C ATOM 801 CE2 TYR A 53 8.135 -0.739 0.642 1.00 0.00 C ATOM 802 CZ TYR A 53 9.388 -0.297 1.015 1.00 0.00 C ATOM 803 OH TYR A 53 9.654 1.052 1.050 1.00 0.00 O ATOM 0 H TYR A 53 7.761 -4.169 -1.463 1.00 0.00 H new ATOM 0 HA TYR A 53 10.241 -5.118 -0.276 1.00 0.00 H new ATOM 0 HB2 TYR A 53 7.473 -4.656 0.905 1.00 0.00 H new ATOM 0 HB3 TYR A 53 8.936 -4.969 1.817 1.00 0.00 H new ATOM 0 HD1 TYR A 53 10.874 -3.260 1.584 1.00 0.00 H new ATOM 0 HD2 TYR A 53 6.889 -2.438 0.320 1.00 0.00 H new ATOM 0 HE1 TYR A 53 11.352 -0.852 1.648 1.00 0.00 H new ATOM 0 HE2 TYR A 53 7.365 -0.029 0.377 1.00 0.00 H new ATOM 0 HH TYR A 53 9.118 1.509 0.368 1.00 0.00 H new ATOM 813 N PHE A 54 7.517 -7.005 -0.190 1.00 0.00 N ATOM 814 CA PHE A 54 7.053 -8.386 -0.139 1.00 0.00 C ATOM 815 C PHE A 54 6.053 -8.665 -1.257 1.00 0.00 C ATOM 816 O PHE A 54 5.004 -8.028 -1.359 1.00 0.00 O ATOM 817 CB PHE A 54 6.414 -8.682 1.219 1.00 0.00 C ATOM 818 CG PHE A 54 7.252 -8.243 2.385 1.00 0.00 C ATOM 819 CD1 PHE A 54 8.501 -8.800 2.606 1.00 0.00 C ATOM 820 CD2 PHE A 54 6.791 -7.274 3.261 1.00 0.00 C ATOM 821 CE1 PHE A 54 9.276 -8.398 3.678 1.00 0.00 C ATOM 822 CE2 PHE A 54 7.561 -6.867 4.334 1.00 0.00 C ATOM 823 CZ PHE A 54 8.804 -7.431 4.544 1.00 0.00 C ATOM 0 H PHE A 54 6.772 -6.309 -0.170 1.00 0.00 H new ATOM 0 HA PHE A 54 7.915 -9.038 -0.276 1.00 0.00 H new ATOM 0 HB2 PHE A 54 5.445 -8.186 1.271 1.00 0.00 H new ATOM 0 HB3 PHE A 54 6.228 -9.753 1.298 1.00 0.00 H new ATOM 0 HD1 PHE A 54 8.874 -9.558 1.933 1.00 0.00 H new ATOM 0 HD2 PHE A 54 5.819 -6.831 3.104 1.00 0.00 H new ATOM 0 HE1 PHE A 54 10.249 -8.839 3.838 1.00 0.00 H new ATOM 0 HE2 PHE A 54 7.191 -6.108 5.008 1.00 0.00 H new ATOM 0 HZ PHE A 54 9.406 -7.117 5.384 1.00 0.00 H new ATOM 833 N PRO A 55 6.383 -9.640 -2.117 1.00 0.00 N ATOM 834 CA PRO A 55 5.527 -10.026 -3.243 1.00 0.00 C ATOM 835 C PRO A 55 4.251 -10.725 -2.788 1.00 0.00 C ATOM 836 O PRO A 55 3.149 -10.357 -3.195 1.00 0.00 O ATOM 837 CB PRO A 55 6.408 -10.988 -4.044 1.00 0.00 C ATOM 838 CG PRO A 55 7.367 -11.543 -3.047 1.00 0.00 C ATOM 839 CD PRO A 55 7.617 -10.441 -2.055 1.00 0.00 C ATOM 0 HA PRO A 55 5.189 -9.161 -3.813 1.00 0.00 H new ATOM 0 HB2 PRO A 55 5.815 -11.778 -4.505 1.00 0.00 H new ATOM 0 HB3 PRO A 55 6.929 -10.470 -4.849 1.00 0.00 H new ATOM 0 HG2 PRO A 55 6.953 -12.424 -2.556 1.00 0.00 H new ATOM 0 HG3 PRO A 55 8.295 -11.853 -3.528 1.00 0.00 H new ATOM 0 HD2 PRO A 55 7.791 -10.834 -1.053 1.00 0.00 H new ATOM 0 HD3 PRO A 55 8.493 -9.851 -2.323 1.00 0.00 H new ATOM 847 N LYS A 56 4.406 -11.737 -1.940 1.00 0.00 N ATOM 848 CA LYS A 56 3.266 -12.488 -1.428 1.00 0.00 C ATOM 849 C LYS A 56 2.243 -11.555 -0.789 1.00 0.00 C ATOM 850 O LYS A 56 1.088 -11.504 -1.210 1.00 0.00 O ATOM 851 CB LYS A 56 3.732 -13.528 -0.406 1.00 0.00 C ATOM 852 CG LYS A 56 4.142 -14.851 -1.028 1.00 0.00 C ATOM 853 CD LYS A 56 5.403 -14.708 -1.864 1.00 0.00 C ATOM 854 CE LYS A 56 6.655 -14.837 -1.009 1.00 0.00 C ATOM 855 NZ LYS A 56 6.809 -13.690 -0.073 1.00 0.00 N ATOM 0 H LYS A 56 5.311 -12.056 -1.593 1.00 0.00 H new ATOM 0 HA LYS A 56 2.792 -12.998 -2.267 1.00 0.00 H new ATOM 0 HB2 LYS A 56 4.575 -13.123 0.154 1.00 0.00 H new ATOM 0 HB3 LYS A 56 2.930 -13.706 0.310 1.00 0.00 H new ATOM 0 HG2 LYS A 56 4.307 -15.588 -0.242 1.00 0.00 H new ATOM 0 HG3 LYS A 56 3.331 -15.227 -1.652 1.00 0.00 H new ATOM 0 HD2 LYS A 56 5.413 -15.470 -2.643 1.00 0.00 H new ATOM 0 HD3 LYS A 56 5.401 -13.740 -2.365 1.00 0.00 H new ATOM 0 HE2 LYS A 56 6.612 -15.766 -0.441 1.00 0.00 H new ATOM 0 HE3 LYS A 56 7.531 -14.899 -1.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 7.815 -13.563 0.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 6.445 -12.825 -0.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 6.275 -13.879 0.799 1.00 0.00 H new ATOM 869 N MET A 57 2.676 -10.817 0.228 1.00 0.00 N ATOM 870 CA MET A 57 1.797 -9.883 0.923 1.00 0.00 C ATOM 871 C MET A 57 0.821 -9.229 -0.050 1.00 0.00 C ATOM 872 O MET A 57 -0.357 -9.052 0.262 1.00 0.00 O ATOM 873 CB MET A 57 2.620 -8.810 1.637 1.00 0.00 C ATOM 874 CG MET A 57 3.232 -9.284 2.946 1.00 0.00 C ATOM 875 SD MET A 57 3.441 -7.948 4.139 1.00 0.00 S ATOM 876 CE MET A 57 1.754 -7.368 4.296 1.00 0.00 C ATOM 0 H MET A 57 3.629 -10.847 0.589 1.00 0.00 H new ATOM 0 HA MET A 57 1.225 -10.443 1.663 1.00 0.00 H new ATOM 0 HB2 MET A 57 3.417 -8.474 0.974 1.00 0.00 H new ATOM 0 HB3 MET A 57 1.984 -7.947 1.834 1.00 0.00 H new ATOM 0 HG2 MET A 57 2.598 -10.057 3.380 1.00 0.00 H new ATOM 0 HG3 MET A 57 4.201 -9.741 2.745 1.00 0.00 H new ATOM 0 HE1 MET A 57 1.541 -7.148 5.342 1.00 0.00 H new ATOM 0 HE2 MET A 57 1.623 -6.464 3.701 1.00 0.00 H new ATOM 0 HE3 MET A 57 1.070 -8.138 3.940 1.00 0.00 H new ATOM 886 N VAL A 58 1.319 -8.871 -1.229 1.00 0.00 N ATOM 887 CA VAL A 58 0.490 -8.237 -2.248 1.00 0.00 C ATOM 888 C VAL A 58 -0.749 -9.073 -2.547 1.00 0.00 C ATOM 889 O VAL A 58 -1.863 -8.703 -2.177 1.00 0.00 O ATOM 890 CB VAL A 58 1.277 -8.019 -3.555 1.00 0.00 C ATOM 891 CG1 VAL A 58 0.435 -7.250 -4.562 1.00 0.00 C ATOM 892 CG2 VAL A 58 2.584 -7.292 -3.274 1.00 0.00 C ATOM 0 H VAL A 58 2.292 -9.009 -1.502 1.00 0.00 H new ATOM 0 HA VAL A 58 0.184 -7.269 -1.851 1.00 0.00 H new ATOM 0 HB VAL A 58 1.514 -8.993 -3.984 1.00 0.00 H new ATOM 0 HG11 VAL A 58 1.006 -7.105 -5.479 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -0.471 -7.814 -4.784 1.00 0.00 H new ATOM 0 HG13 VAL A 58 0.166 -6.280 -4.145 1.00 0.00 H new ATOM 0 HG21 VAL A 58 3.127 -7.146 -4.208 1.00 0.00 H new ATOM 0 HG22 VAL A 58 2.372 -6.323 -2.823 1.00 0.00 H new ATOM 0 HG23 VAL A 58 3.191 -7.886 -2.590 1.00 0.00 H new ATOM 902 N GLU A 59 -0.547 -10.201 -3.220 1.00 0.00 N ATOM 903 CA GLU A 59 -1.650 -11.090 -3.569 1.00 0.00 C ATOM 904 C GLU A 59 -2.787 -10.313 -4.225 1.00 0.00 C ATOM 905 O GLU A 59 -3.945 -10.432 -3.826 1.00 0.00 O ATOM 906 CB GLU A 59 -2.164 -11.814 -2.323 1.00 0.00 C ATOM 907 CG GLU A 59 -2.791 -13.166 -2.621 1.00 0.00 C ATOM 908 CD GLU A 59 -1.765 -14.213 -3.005 1.00 0.00 C ATOM 909 OE1 GLU A 59 -0.613 -14.119 -2.531 1.00 0.00 O ATOM 910 OE2 GLU A 59 -2.113 -15.128 -3.781 1.00 0.00 O ATOM 0 H GLU A 59 0.369 -10.521 -3.534 1.00 0.00 H new ATOM 0 HA GLU A 59 -1.279 -11.827 -4.281 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -1.337 -11.952 -1.626 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -2.900 -11.183 -1.824 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -3.343 -13.507 -1.745 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -3.513 -13.057 -3.430 1.00 0.00 H new ATOM 917 N MET A 60 -2.448 -9.517 -5.234 1.00 0.00 N ATOM 918 CA MET A 60 -3.440 -8.720 -5.946 1.00 0.00 C ATOM 919 C MET A 60 -4.208 -9.577 -6.947 1.00 0.00 C ATOM 920 O MET A 60 -4.359 -9.205 -8.111 1.00 0.00 O ATOM 921 CB MET A 60 -2.766 -7.552 -6.668 1.00 0.00 C ATOM 922 CG MET A 60 -2.658 -6.295 -5.821 1.00 0.00 C ATOM 923 SD MET A 60 -2.673 -4.788 -6.811 1.00 0.00 S ATOM 924 CE MET A 60 -4.381 -4.754 -7.349 1.00 0.00 C ATOM 0 H MET A 60 -1.494 -9.407 -5.577 1.00 0.00 H new ATOM 0 HA MET A 60 -4.146 -8.326 -5.215 1.00 0.00 H new ATOM 0 HB2 MET A 60 -1.767 -7.857 -6.981 1.00 0.00 H new ATOM 0 HB3 MET A 60 -3.327 -7.323 -7.574 1.00 0.00 H new ATOM 0 HG2 MET A 60 -3.485 -6.267 -5.111 1.00 0.00 H new ATOM 0 HG3 MET A 60 -1.738 -6.333 -5.237 1.00 0.00 H new ATOM 0 HE1 MET A 60 -4.440 -4.314 -8.344 1.00 0.00 H new ATOM 0 HE2 MET A 60 -4.774 -5.770 -7.378 1.00 0.00 H new ATOM 0 HE3 MET A 60 -4.970 -4.157 -6.653 1.00 0.00 H new ATOM 934 N HIS A 61 -4.691 -10.727 -6.488 1.00 0.00 N ATOM 935 CA HIS A 61 -5.443 -11.637 -7.344 1.00 0.00 C ATOM 936 C HIS A 61 -6.930 -11.600 -7.002 1.00 0.00 C ATOM 937 O HIS A 61 -7.737 -12.291 -7.623 1.00 0.00 O ATOM 938 CB HIS A 61 -4.911 -13.064 -7.201 1.00 0.00 C ATOM 939 CG HIS A 61 -5.413 -13.999 -8.258 1.00 0.00 C ATOM 940 ND1 HIS A 61 -5.020 -13.924 -9.577 1.00 0.00 N ATOM 941 CD2 HIS A 61 -6.279 -15.036 -8.183 1.00 0.00 C ATOM 942 CE1 HIS A 61 -5.625 -14.873 -10.269 1.00 0.00 C ATOM 943 NE2 HIS A 61 -6.394 -15.562 -9.446 1.00 0.00 N ATOM 0 H HIS A 61 -4.575 -11.051 -5.528 1.00 0.00 H new ATOM 0 HA HIS A 61 -5.317 -11.312 -8.377 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -3.822 -13.042 -7.235 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -5.192 -13.451 -6.222 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -6.785 -15.385 -7.295 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -5.510 -15.054 -11.327 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -6.979 -16.356 -9.706 1.00 0.00 H new ATOM 952 N ASN A 62 -7.284 -10.790 -6.010 1.00 0.00 N ATOM 953 CA ASN A 62 -8.674 -10.664 -5.585 1.00 0.00 C ATOM 954 C ASN A 62 -9.180 -9.240 -5.796 1.00 0.00 C ATOM 955 O ASN A 62 -10.379 -9.015 -5.966 1.00 0.00 O ATOM 956 CB ASN A 62 -8.816 -11.055 -4.113 1.00 0.00 C ATOM 957 CG ASN A 62 -7.804 -12.103 -3.693 1.00 0.00 C ATOM 958 OD1 ASN A 62 -8.073 -13.303 -3.757 1.00 0.00 O ATOM 959 ND2 ASN A 62 -6.632 -11.654 -3.259 1.00 0.00 N ATOM 0 H ASN A 62 -6.628 -10.211 -5.485 1.00 0.00 H new ATOM 0 HA ASN A 62 -9.277 -11.339 -6.193 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -8.696 -10.168 -3.491 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -9.822 -11.434 -3.936 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -5.912 -12.312 -2.962 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -6.452 -10.651 -3.223 1.00 0.00 H new ATOM 966 N TYR A 63 -8.259 -8.283 -5.786 1.00 0.00 N ATOM 967 CA TYR A 63 -8.612 -6.881 -5.974 1.00 0.00 C ATOM 968 C TYR A 63 -8.777 -6.555 -7.455 1.00 0.00 C ATOM 969 O TYR A 63 -8.243 -7.251 -8.319 1.00 0.00 O ATOM 970 CB TYR A 63 -7.543 -5.977 -5.357 1.00 0.00 C ATOM 971 CG TYR A 63 -7.348 -6.195 -3.874 1.00 0.00 C ATOM 972 CD1 TYR A 63 -8.319 -5.802 -2.960 1.00 0.00 C ATOM 973 CD2 TYR A 63 -6.194 -6.795 -3.386 1.00 0.00 C ATOM 974 CE1 TYR A 63 -8.144 -5.998 -1.604 1.00 0.00 C ATOM 975 CE2 TYR A 63 -6.012 -6.997 -2.031 1.00 0.00 C ATOM 976 CZ TYR A 63 -6.990 -6.596 -1.144 1.00 0.00 C ATOM 977 OH TYR A 63 -6.813 -6.795 0.206 1.00 0.00 O ATOM 0 H TYR A 63 -7.262 -8.452 -5.650 1.00 0.00 H new ATOM 0 HA TYR A 63 -9.563 -6.702 -5.473 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -6.596 -6.148 -5.868 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -7.816 -4.936 -5.530 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -9.226 -5.336 -3.316 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -5.426 -7.109 -4.077 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -8.907 -5.684 -0.907 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -5.109 -7.466 -1.668 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.948 -7.229 0.362 1.00 0.00 H new ATOM 987 N VAL A 64 -9.520 -5.490 -7.741 1.00 0.00 N ATOM 988 CA VAL A 64 -9.755 -5.069 -9.117 1.00 0.00 C ATOM 989 C VAL A 64 -10.080 -3.581 -9.188 1.00 0.00 C ATOM 990 O VAL A 64 -10.836 -3.046 -8.377 1.00 0.00 O ATOM 991 CB VAL A 64 -10.906 -5.866 -9.759 1.00 0.00 C ATOM 992 CG1 VAL A 64 -11.176 -5.370 -11.171 1.00 0.00 C ATOM 993 CG2 VAL A 64 -10.587 -7.353 -9.760 1.00 0.00 C ATOM 0 H VAL A 64 -9.969 -4.903 -7.038 1.00 0.00 H new ATOM 0 HA VAL A 64 -8.836 -5.264 -9.669 1.00 0.00 H new ATOM 0 HB VAL A 64 -11.808 -5.711 -9.166 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -11.992 -5.945 -11.609 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -11.450 -4.316 -11.140 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -10.279 -5.494 -11.778 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -11.411 -7.901 -10.217 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -9.674 -7.529 -10.329 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -10.447 -7.696 -8.735 1.00 0.00 H new ATOM 1003 N PRO A 65 -9.497 -2.895 -10.182 1.00 0.00 N ATOM 1004 CA PRO A 65 -9.710 -1.459 -10.384 1.00 0.00 C ATOM 1005 C PRO A 65 -11.123 -1.145 -10.865 1.00 0.00 C ATOM 1006 O PRO A 65 -11.413 -1.216 -12.058 1.00 0.00 O ATOM 1007 CB PRO A 65 -8.686 -1.096 -11.462 1.00 0.00 C ATOM 1008 CG PRO A 65 -8.447 -2.368 -12.201 1.00 0.00 C ATOM 1009 CD PRO A 65 -8.584 -3.468 -11.186 1.00 0.00 C ATOM 0 HA PRO A 65 -9.592 -0.896 -9.458 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -9.067 -0.319 -12.124 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -7.765 -0.715 -11.021 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -9.168 -2.491 -13.009 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -7.456 -2.376 -12.654 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -8.993 -4.375 -11.630 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -7.621 -3.733 -10.749 1.00 0.00 H new ATOM 1017 N ALA A 66 -11.998 -0.796 -9.927 1.00 0.00 N ATOM 1018 CA ALA A 66 -13.380 -0.469 -10.256 1.00 0.00 C ATOM 1019 C ALA A 66 -13.598 1.040 -10.271 1.00 0.00 C ATOM 1020 O ALA A 66 -12.883 1.787 -9.604 1.00 0.00 O ATOM 1021 CB ALA A 66 -14.329 -1.131 -9.267 1.00 0.00 C ATOM 0 H ALA A 66 -11.774 -0.733 -8.934 1.00 0.00 H new ATOM 0 HA ALA A 66 -13.590 -0.851 -11.255 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -15.357 -0.878 -9.525 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -14.200 -2.213 -9.307 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -14.110 -0.777 -8.260 1.00 0.00 H new ATOM 1027 N ASN A 67 -14.589 1.483 -11.038 1.00 0.00 N ATOM 1028 CA ASN A 67 -14.900 2.904 -11.141 1.00 0.00 C ATOM 1029 C ASN A 67 -15.885 3.325 -10.055 1.00 0.00 C ATOM 1030 O ASN A 67 -15.822 4.444 -9.546 1.00 0.00 O ATOM 1031 CB ASN A 67 -15.478 3.222 -12.521 1.00 0.00 C ATOM 1032 CG ASN A 67 -15.395 4.698 -12.857 1.00 0.00 C ATOM 1033 OD1 ASN A 67 -14.305 5.250 -13.012 1.00 0.00 O ATOM 1034 ND2 ASN A 67 -16.549 5.345 -12.970 1.00 0.00 N ATOM 0 H ASN A 67 -15.190 0.878 -11.597 1.00 0.00 H new ATOM 0 HA ASN A 67 -13.975 3.464 -11.004 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -14.941 2.649 -13.277 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -16.519 2.902 -12.558 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -16.556 6.340 -13.194 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -17.428 4.847 -12.833 1.00 0.00 H new ATOM 1041 N SER A 68 -16.794 2.421 -9.705 1.00 0.00 N ATOM 1042 CA SER A 68 -17.795 2.700 -8.682 1.00 0.00 C ATOM 1043 C SER A 68 -17.135 2.942 -7.328 1.00 0.00 C ATOM 1044 O SER A 68 -15.910 2.910 -7.207 1.00 0.00 O ATOM 1045 CB SER A 68 -18.787 1.539 -8.579 1.00 0.00 C ATOM 1046 OG SER A 68 -19.696 1.547 -9.666 1.00 0.00 O ATOM 0 H SER A 68 -16.858 1.489 -10.115 1.00 0.00 H new ATOM 0 HA SER A 68 -18.333 3.603 -8.971 1.00 0.00 H new ATOM 0 HB2 SER A 68 -18.245 0.594 -8.561 1.00 0.00 H new ATOM 0 HB3 SER A 68 -19.337 1.609 -7.640 1.00 0.00 H new ATOM 0 HG SER A 68 -20.318 0.795 -9.578 1.00 0.00 H new ATOM 1052 N LEU A 69 -17.956 3.183 -6.312 1.00 0.00 N ATOM 1053 CA LEU A 69 -17.454 3.431 -4.965 1.00 0.00 C ATOM 1054 C LEU A 69 -17.590 2.185 -4.095 1.00 0.00 C ATOM 1055 O LEU A 69 -16.665 1.818 -3.372 1.00 0.00 O ATOM 1056 CB LEU A 69 -18.207 4.598 -4.325 1.00 0.00 C ATOM 1057 CG LEU A 69 -17.780 4.975 -2.906 1.00 0.00 C ATOM 1058 CD1 LEU A 69 -18.008 6.458 -2.656 1.00 0.00 C ATOM 1059 CD2 LEU A 69 -18.534 4.139 -1.882 1.00 0.00 C ATOM 0 H LEU A 69 -18.972 3.212 -6.395 1.00 0.00 H new ATOM 0 HA LEU A 69 -16.397 3.686 -5.040 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -18.089 5.474 -4.963 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -19.269 4.355 -4.311 1.00 0.00 H new ATOM 0 HG LEU A 69 -16.715 4.769 -2.801 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -17.698 6.708 -1.641 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -17.423 7.041 -3.368 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -19.066 6.689 -2.780 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -18.217 4.421 -0.878 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -19.605 4.314 -1.987 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -18.321 3.083 -2.047 1.00 0.00 H new ATOM 1071 N GLN A 70 -18.749 1.539 -4.174 1.00 0.00 N ATOM 1072 CA GLN A 70 -19.005 0.333 -3.395 1.00 0.00 C ATOM 1073 C GLN A 70 -17.799 -0.600 -3.424 1.00 0.00 C ATOM 1074 O GLN A 70 -17.419 -1.170 -2.402 1.00 0.00 O ATOM 1075 CB GLN A 70 -20.240 -0.393 -3.931 1.00 0.00 C ATOM 1076 CG GLN A 70 -21.550 0.153 -3.387 1.00 0.00 C ATOM 1077 CD GLN A 70 -21.940 -0.475 -2.064 1.00 0.00 C ATOM 1078 OE1 GLN A 70 -21.092 -0.718 -1.205 1.00 0.00 O ATOM 1079 NE2 GLN A 70 -23.230 -0.741 -1.891 1.00 0.00 N ATOM 0 H GLN A 70 -19.525 1.830 -4.769 1.00 0.00 H new ATOM 0 HA GLN A 70 -19.187 0.630 -2.362 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -20.250 -0.321 -5.019 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -20.166 -1.452 -3.682 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -21.465 1.232 -3.261 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -22.342 -0.022 -4.115 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -23.899 -0.523 -2.629 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -23.551 -1.163 -1.020 1.00 0.00 H new ATOM 1088 N GLN A 71 -17.202 -0.751 -4.602 1.00 0.00 N ATOM 1089 CA GLN A 71 -16.040 -1.616 -4.764 1.00 0.00 C ATOM 1090 C GLN A 71 -14.828 -1.042 -4.038 1.00 0.00 C ATOM 1091 O GLN A 71 -14.096 -1.765 -3.362 1.00 0.00 O ATOM 1092 CB GLN A 71 -15.719 -1.803 -6.248 1.00 0.00 C ATOM 1093 CG GLN A 71 -16.606 -2.826 -6.938 1.00 0.00 C ATOM 1094 CD GLN A 71 -16.815 -4.075 -6.104 1.00 0.00 C ATOM 1095 OE1 GLN A 71 -17.858 -4.246 -5.473 1.00 0.00 O ATOM 1096 NE2 GLN A 71 -15.821 -4.956 -6.097 1.00 0.00 N ATOM 0 H GLN A 71 -17.504 -0.286 -5.458 1.00 0.00 H new ATOM 0 HA GLN A 71 -16.277 -2.586 -4.326 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -15.821 -0.844 -6.757 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -14.678 -2.109 -6.350 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -17.573 -2.374 -7.157 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -16.160 -3.102 -7.893 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -14.974 -4.773 -6.635 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -15.905 -5.815 -5.554 1.00 0.00 H new ATOM 1105 N LYS A 72 -14.622 0.263 -4.182 1.00 0.00 N ATOM 1106 CA LYS A 72 -13.500 0.936 -3.539 1.00 0.00 C ATOM 1107 C LYS A 72 -13.332 0.461 -2.099 1.00 0.00 C ATOM 1108 O LYS A 72 -12.318 -0.143 -1.748 1.00 0.00 O ATOM 1109 CB LYS A 72 -13.705 2.452 -3.566 1.00 0.00 C ATOM 1110 CG LYS A 72 -13.828 3.024 -4.968 1.00 0.00 C ATOM 1111 CD LYS A 72 -12.464 3.299 -5.580 1.00 0.00 C ATOM 1112 CE LYS A 72 -12.587 3.801 -7.011 1.00 0.00 C ATOM 1113 NZ LYS A 72 -11.297 4.345 -7.520 1.00 0.00 N ATOM 0 H LYS A 72 -15.218 0.876 -4.739 1.00 0.00 H new ATOM 0 HA LYS A 72 -12.595 0.687 -4.093 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -14.604 2.699 -3.002 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -12.868 2.932 -3.059 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -14.377 2.326 -5.600 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -14.406 3.947 -4.936 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -11.936 4.038 -4.978 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -11.866 2.388 -5.563 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -12.917 2.986 -7.655 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -13.352 4.575 -7.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -11.430 4.708 -8.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -10.977 5.117 -6.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -10.582 3.590 -7.529 1.00 0.00 H new ATOM 1127 N LEU A 73 -14.333 0.737 -1.270 1.00 0.00 N ATOM 1128 CA LEU A 73 -14.297 0.336 0.132 1.00 0.00 C ATOM 1129 C LEU A 73 -14.163 -1.178 0.262 1.00 0.00 C ATOM 1130 O LEU A 73 -13.357 -1.674 1.050 1.00 0.00 O ATOM 1131 CB LEU A 73 -15.561 0.811 0.851 1.00 0.00 C ATOM 1132 CG LEU A 73 -15.585 2.283 1.265 1.00 0.00 C ATOM 1133 CD1 LEU A 73 -17.001 2.717 1.610 1.00 0.00 C ATOM 1134 CD2 LEU A 73 -14.650 2.521 2.441 1.00 0.00 C ATOM 0 H LEU A 73 -15.179 1.237 -1.544 1.00 0.00 H new ATOM 0 HA LEU A 73 -13.426 0.800 0.595 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -16.416 0.623 0.202 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -15.698 0.201 1.744 1.00 0.00 H new ATOM 0 HG LEU A 73 -15.238 2.883 0.424 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -16.999 3.767 1.902 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -17.644 2.584 0.740 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -17.376 2.112 2.435 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -14.680 3.574 2.722 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.966 1.910 3.287 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -13.633 2.250 2.158 1.00 0.00 H new ATOM 1146 N SER A 74 -14.956 -1.907 -0.516 1.00 0.00 N ATOM 1147 CA SER A 74 -14.927 -3.364 -0.487 1.00 0.00 C ATOM 1148 C SER A 74 -13.492 -3.878 -0.414 1.00 0.00 C ATOM 1149 O SER A 74 -13.159 -4.704 0.434 1.00 0.00 O ATOM 1150 CB SER A 74 -15.622 -3.935 -1.724 1.00 0.00 C ATOM 1151 OG SER A 74 -15.599 -5.351 -1.715 1.00 0.00 O ATOM 0 H SER A 74 -15.627 -1.512 -1.175 1.00 0.00 H new ATOM 0 HA SER A 74 -15.459 -3.695 0.405 1.00 0.00 H new ATOM 0 HB2 SER A 74 -16.654 -3.585 -1.759 1.00 0.00 H new ATOM 0 HB3 SER A 74 -15.130 -3.566 -2.624 1.00 0.00 H new ATOM 0 HG SER A 74 -16.051 -5.691 -2.516 1.00 0.00 H new ATOM 1157 N ASN A 75 -12.646 -3.381 -1.312 1.00 0.00 N ATOM 1158 CA ASN A 75 -11.247 -3.789 -1.351 1.00 0.00 C ATOM 1159 C ASN A 75 -10.527 -3.387 -0.067 1.00 0.00 C ATOM 1160 O ASN A 75 -10.036 -4.238 0.674 1.00 0.00 O ATOM 1161 CB ASN A 75 -10.546 -3.165 -2.559 1.00 0.00 C ATOM 1162 CG ASN A 75 -11.066 -3.711 -3.875 1.00 0.00 C ATOM 1163 OD1 ASN A 75 -11.432 -4.883 -3.972 1.00 0.00 O ATOM 1164 ND2 ASN A 75 -11.100 -2.862 -4.896 1.00 0.00 N ATOM 0 H ASN A 75 -12.906 -2.696 -2.021 1.00 0.00 H new ATOM 0 HA ASN A 75 -11.213 -4.875 -1.441 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -10.684 -2.084 -2.537 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -9.474 -3.351 -2.490 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -11.439 -3.172 -5.806 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -10.787 -1.900 -4.770 1.00 0.00 H new ATOM 1171 N TRP A 76 -10.469 -2.085 0.188 1.00 0.00 N ATOM 1172 CA TRP A 76 -9.809 -1.569 1.383 1.00 0.00 C ATOM 1173 C TRP A 76 -10.060 -2.481 2.579 1.00 0.00 C ATOM 1174 O TRP A 76 -9.122 -2.932 3.235 1.00 0.00 O ATOM 1175 CB TRP A 76 -10.301 -0.155 1.692 1.00 0.00 C ATOM 1176 CG TRP A 76 -9.501 0.914 1.011 1.00 0.00 C ATOM 1177 CD1 TRP A 76 -9.833 1.585 -0.132 1.00 0.00 C ATOM 1178 CD2 TRP A 76 -8.234 1.434 1.429 1.00 0.00 C ATOM 1179 NE1 TRP A 76 -8.850 2.490 -0.449 1.00 0.00 N ATOM 1180 CE2 TRP A 76 -7.858 2.418 0.494 1.00 0.00 C ATOM 1181 CE3 TRP A 76 -7.382 1.167 2.504 1.00 0.00 C ATOM 1182 CZ2 TRP A 76 -6.667 3.131 0.602 1.00 0.00 C ATOM 1183 CZ3 TRP A 76 -6.201 1.875 2.610 1.00 0.00 C ATOM 1184 CH2 TRP A 76 -5.852 2.848 1.664 1.00 0.00 C ATOM 0 H TRP A 76 -10.870 -1.367 -0.416 1.00 0.00 H new ATOM 0 HA TRP A 76 -8.736 -1.538 1.191 1.00 0.00 H new ATOM 0 HB2 TRP A 76 -11.344 -0.067 1.389 1.00 0.00 H new ATOM 0 HB3 TRP A 76 -10.267 0.007 2.769 1.00 0.00 H new ATOM 0 HD1 TRP A 76 -10.736 1.427 -0.703 1.00 0.00 H new ATOM 0 HE1 TRP A 76 -8.857 3.114 -1.255 1.00 0.00 H new ATOM 0 HE3 TRP A 76 -7.643 0.420 3.239 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 -6.396 3.881 -0.127 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 -5.535 1.675 3.436 1.00 0.00 H new ATOM 0 HH2 TRP A 76 -4.922 3.385 1.775 1.00 0.00 H new ATOM 1195 N GLY A 77 -11.332 -2.748 2.858 1.00 0.00 N ATOM 1196 CA GLY A 77 -11.682 -3.605 3.975 1.00 0.00 C ATOM 1197 C GLY A 77 -10.904 -4.906 3.975 1.00 0.00 C ATOM 1198 O GLY A 77 -10.496 -5.394 5.029 1.00 0.00 O ATOM 0 H GLY A 77 -12.126 -2.386 2.330 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -11.496 -3.074 4.908 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -12.749 -3.824 3.940 1.00 0.00 H new ATOM 1202 N HIS A 78 -10.699 -5.470 2.789 1.00 0.00 N ATOM 1203 CA HIS A 78 -9.965 -6.724 2.656 1.00 0.00 C ATOM 1204 C HIS A 78 -8.471 -6.504 2.871 1.00 0.00 C ATOM 1205 O HIS A 78 -7.773 -7.374 3.394 1.00 0.00 O ATOM 1206 CB HIS A 78 -10.209 -7.338 1.278 1.00 0.00 C ATOM 1207 CG HIS A 78 -10.124 -8.834 1.265 1.00 0.00 C ATOM 1208 ND1 HIS A 78 -9.849 -9.562 0.127 1.00 0.00 N ATOM 1209 CD2 HIS A 78 -10.277 -9.738 2.260 1.00 0.00 C ATOM 1210 CE1 HIS A 78 -9.839 -10.850 0.422 1.00 0.00 C ATOM 1211 NE2 HIS A 78 -10.095 -10.983 1.711 1.00 0.00 N ATOM 0 H HIS A 78 -11.030 -5.079 1.907 1.00 0.00 H new ATOM 0 HA HIS A 78 -10.327 -7.411 3.421 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -11.194 -7.035 0.924 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -9.480 -6.935 0.575 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -10.501 -9.521 3.294 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -9.653 -11.656 -0.272 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -10.149 -11.867 2.216 1.00 0.00 H new ATOM 1220 N LEU A 79 -7.985 -5.336 2.464 1.00 0.00 N ATOM 1221 CA LEU A 79 -6.573 -5.002 2.611 1.00 0.00 C ATOM 1222 C LEU A 79 -6.229 -4.718 4.070 1.00 0.00 C ATOM 1223 O LEU A 79 -5.058 -4.641 4.438 1.00 0.00 O ATOM 1224 CB LEU A 79 -6.223 -3.789 1.747 1.00 0.00 C ATOM 1225 CG LEU A 79 -4.733 -3.542 1.509 1.00 0.00 C ATOM 1226 CD1 LEU A 79 -4.230 -4.385 0.348 1.00 0.00 C ATOM 1227 CD2 LEU A 79 -4.472 -2.065 1.250 1.00 0.00 C ATOM 0 H LEU A 79 -8.548 -4.605 2.030 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.986 -5.858 2.279 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -6.711 -3.905 0.779 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -6.648 -2.901 2.214 1.00 0.00 H new ATOM 0 HG LEU A 79 -4.188 -3.835 2.406 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -3.168 -4.195 0.194 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -4.381 -5.441 0.573 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -4.780 -4.124 -0.556 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -3.406 -1.908 1.083 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -5.029 -1.746 0.369 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -4.794 -1.482 2.113 1.00 0.00 H new ATOM 1239 N ASN A 80 -7.259 -4.564 4.896 1.00 0.00 N ATOM 1240 CA ASN A 80 -7.067 -4.290 6.315 1.00 0.00 C ATOM 1241 C ASN A 80 -6.586 -5.538 7.050 1.00 0.00 C ATOM 1242 O ASN A 80 -5.755 -5.456 7.954 1.00 0.00 O ATOM 1243 CB ASN A 80 -8.370 -3.787 6.940 1.00 0.00 C ATOM 1244 CG ASN A 80 -8.195 -3.379 8.390 1.00 0.00 C ATOM 1245 OD1 ASN A 80 -7.170 -3.664 9.008 1.00 0.00 O ATOM 1246 ND2 ASN A 80 -9.200 -2.706 8.940 1.00 0.00 N ATOM 0 H ASN A 80 -8.235 -4.624 4.607 1.00 0.00 H new ATOM 0 HA ASN A 80 -6.304 -3.517 6.410 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -8.740 -2.936 6.368 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -9.127 -4.568 6.874 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -9.140 -2.404 9.912 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -10.032 -2.491 8.390 1.00 0.00 H new ATOM 1253 N ARG A 81 -7.113 -6.691 6.654 1.00 0.00 N ATOM 1254 CA ARG A 81 -6.739 -7.956 7.274 1.00 0.00 C ATOM 1255 C ARG A 81 -5.782 -8.739 6.379 1.00 0.00 C ATOM 1256 O ARG A 81 -5.405 -9.868 6.692 1.00 0.00 O ATOM 1257 CB ARG A 81 -7.984 -8.795 7.565 1.00 0.00 C ATOM 1258 CG ARG A 81 -8.894 -8.190 8.621 1.00 0.00 C ATOM 1259 CD ARG A 81 -9.751 -9.251 9.293 1.00 0.00 C ATOM 1260 NE ARG A 81 -10.978 -8.691 9.852 1.00 0.00 N ATOM 1261 CZ ARG A 81 -12.071 -8.455 9.134 1.00 0.00 C ATOM 1262 NH1 ARG A 81 -12.089 -8.729 7.837 1.00 0.00 N ATOM 1263 NH2 ARG A 81 -13.149 -7.943 9.715 1.00 0.00 N ATOM 0 H ARG A 81 -7.801 -6.776 5.906 1.00 0.00 H new ATOM 0 HA ARG A 81 -6.232 -7.735 8.213 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -8.549 -8.924 6.642 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -7.674 -9.788 7.890 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -8.292 -7.678 9.372 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -9.537 -7.439 8.162 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -10.003 -10.025 8.569 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -9.178 -9.731 10.086 1.00 0.00 H new ATOM 0 HE ARG A 81 -10.997 -8.469 10.847 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -11.262 -9.122 7.387 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -12.930 -8.547 7.289 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -13.138 -7.731 10.713 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -13.988 -7.762 9.164 1.00 0.00 H new ATOM 1277 N LYS A 82 -5.393 -8.131 5.264 1.00 0.00 N ATOM 1278 CA LYS A 82 -4.481 -8.769 4.322 1.00 0.00 C ATOM 1279 C LYS A 82 -3.125 -8.069 4.320 1.00 0.00 C ATOM 1280 O LYS A 82 -2.112 -8.659 3.944 1.00 0.00 O ATOM 1281 CB LYS A 82 -5.076 -8.754 2.913 1.00 0.00 C ATOM 1282 CG LYS A 82 -6.081 -9.866 2.666 1.00 0.00 C ATOM 1283 CD LYS A 82 -5.393 -11.211 2.494 1.00 0.00 C ATOM 1284 CE LYS A 82 -6.263 -12.350 3.002 1.00 0.00 C ATOM 1285 NZ LYS A 82 -7.157 -12.883 1.936 1.00 0.00 N ATOM 0 H LYS A 82 -5.695 -7.196 4.990 1.00 0.00 H new ATOM 0 HA LYS A 82 -4.337 -9.802 4.637 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -5.561 -7.793 2.743 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -4.268 -8.837 2.186 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -6.780 -9.918 3.501 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -6.665 -9.638 1.774 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -5.161 -11.370 1.441 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -4.445 -11.208 3.032 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -5.628 -13.152 3.378 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -6.866 -12.001 3.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -7.407 -13.869 2.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -8.023 -12.309 1.890 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -6.666 -12.844 1.020 1.00 0.00 H new ATOM 1299 N VAL A 83 -3.113 -6.809 4.744 1.00 0.00 N ATOM 1300 CA VAL A 83 -1.882 -6.031 4.793 1.00 0.00 C ATOM 1301 C VAL A 83 -1.671 -5.422 6.175 1.00 0.00 C ATOM 1302 O VAL A 83 -0.808 -5.864 6.935 1.00 0.00 O ATOM 1303 CB VAL A 83 -1.888 -4.903 3.743 1.00 0.00 C ATOM 1304 CG1 VAL A 83 -0.710 -3.966 3.959 1.00 0.00 C ATOM 1305 CG2 VAL A 83 -1.867 -5.485 2.338 1.00 0.00 C ATOM 0 H VAL A 83 -3.943 -6.306 5.058 1.00 0.00 H new ATOM 0 HA VAL A 83 -1.065 -6.718 4.573 1.00 0.00 H new ATOM 0 HB VAL A 83 -2.805 -4.326 3.859 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -0.731 -3.176 3.208 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -0.774 -3.524 4.953 1.00 0.00 H new ATOM 0 HG13 VAL A 83 0.221 -4.526 3.871 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -1.872 -4.675 1.609 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -0.968 -6.087 2.207 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -2.747 -6.111 2.190 1.00 0.00 H new ATOM 1315 N LEU A 84 -2.464 -4.406 6.495 1.00 0.00 N ATOM 1316 CA LEU A 84 -2.366 -3.736 7.787 1.00 0.00 C ATOM 1317 C LEU A 84 -2.156 -4.746 8.910 1.00 0.00 C ATOM 1318 O LEU A 84 -1.105 -4.770 9.550 1.00 0.00 O ATOM 1319 CB LEU A 84 -3.628 -2.913 8.054 1.00 0.00 C ATOM 1320 CG LEU A 84 -4.072 -1.980 6.928 1.00 0.00 C ATOM 1321 CD1 LEU A 84 -5.348 -1.248 7.313 1.00 0.00 C ATOM 1322 CD2 LEU A 84 -2.968 -0.988 6.591 1.00 0.00 C ATOM 0 H LEU A 84 -3.182 -4.028 5.878 1.00 0.00 H new ATOM 0 HA LEU A 84 -1.504 -3.069 7.758 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -4.446 -3.600 8.273 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.465 -2.315 8.951 1.00 0.00 H new ATOM 0 HG LEU A 84 -4.276 -2.582 6.043 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.649 -0.588 6.499 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -6.140 -1.973 7.504 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -5.172 -0.658 8.212 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -3.302 -0.332 5.787 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -2.733 -0.392 7.473 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -2.078 -1.529 6.271 1.00 0.00 H new ATOM 1334 N LYS A 85 -3.163 -5.582 9.143 1.00 0.00 N ATOM 1335 CA LYS A 85 -3.089 -6.598 10.186 1.00 0.00 C ATOM 1336 C LYS A 85 -1.724 -7.278 10.187 1.00 0.00 C ATOM 1337 O LYS A 85 -1.060 -7.358 11.221 1.00 0.00 O ATOM 1338 CB LYS A 85 -4.191 -7.642 9.988 1.00 0.00 C ATOM 1339 CG LYS A 85 -4.266 -8.665 11.108 1.00 0.00 C ATOM 1340 CD LYS A 85 -3.351 -9.849 10.844 1.00 0.00 C ATOM 1341 CE LYS A 85 -3.476 -10.904 11.933 1.00 0.00 C ATOM 1342 NZ LYS A 85 -2.355 -11.883 11.887 1.00 0.00 N ATOM 0 H LYS A 85 -4.040 -5.575 8.623 1.00 0.00 H new ATOM 0 HA LYS A 85 -3.231 -6.107 11.149 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -5.152 -7.133 9.907 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -4.024 -8.160 9.044 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -3.990 -8.194 12.051 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -5.293 -9.014 11.215 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -3.596 -10.291 9.878 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -2.318 -9.506 10.785 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -3.495 -10.419 12.909 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -4.424 -11.431 11.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -2.476 -12.585 12.644 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -2.352 -12.365 10.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -1.452 -11.384 12.019 1.00 0.00 H new ATOM 1356 N ARG A 86 -1.310 -7.766 9.022 1.00 0.00 N ATOM 1357 CA ARG A 86 -0.024 -8.439 8.889 1.00 0.00 C ATOM 1358 C ARG A 86 1.118 -7.518 9.310 1.00 0.00 C ATOM 1359 O ARG A 86 2.119 -7.967 9.869 1.00 0.00 O ATOM 1360 CB ARG A 86 0.187 -8.903 7.447 1.00 0.00 C ATOM 1361 CG ARG A 86 -0.594 -10.158 7.091 1.00 0.00 C ATOM 1362 CD ARG A 86 0.154 -11.416 7.505 1.00 0.00 C ATOM 1363 NE ARG A 86 -0.337 -12.600 6.805 1.00 0.00 N ATOM 1364 CZ ARG A 86 0.167 -13.816 6.977 1.00 0.00 C ATOM 1365 NH1 ARG A 86 1.172 -14.009 7.821 1.00 0.00 N ATOM 1366 NH2 ARG A 86 -0.333 -14.844 6.303 1.00 0.00 N ATOM 0 H ARG A 86 -1.847 -7.708 8.157 1.00 0.00 H new ATOM 0 HA ARG A 86 -0.028 -9.309 9.546 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -0.103 -8.100 6.770 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.249 -9.088 7.285 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -1.567 -10.134 7.582 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -0.779 -10.180 6.017 1.00 0.00 H new ATOM 0 HD2 ARG A 86 1.217 -11.289 7.301 1.00 0.00 H new ATOM 0 HD3 ARG A 86 0.051 -11.562 8.580 1.00 0.00 H new ATOM 0 HE ARG A 86 -1.109 -12.486 6.148 1.00 0.00 H new ATOM 0 HH11 ARG A 86 1.560 -13.222 8.340 1.00 0.00 H new ATOM 0 HH12 ARG A 86 1.557 -14.945 7.951 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -1.105 -14.700 5.652 1.00 0.00 H new ATOM 0 HH22 ARG A 86 0.055 -15.778 6.436 1.00 0.00 H new ATOM 1380 N LEU A 87 0.961 -6.227 9.037 1.00 0.00 N ATOM 1381 CA LEU A 87 1.978 -5.242 9.386 1.00 0.00 C ATOM 1382 C LEU A 87 1.704 -4.640 10.761 1.00 0.00 C ATOM 1383 O LEU A 87 2.093 -3.507 11.042 1.00 0.00 O ATOM 1384 CB LEU A 87 2.028 -4.135 8.332 1.00 0.00 C ATOM 1385 CG LEU A 87 2.641 -4.517 6.985 1.00 0.00 C ATOM 1386 CD1 LEU A 87 2.091 -3.632 5.877 1.00 0.00 C ATOM 1387 CD2 LEU A 87 4.158 -4.421 7.043 1.00 0.00 C ATOM 0 H LEU A 87 0.139 -5.838 8.575 1.00 0.00 H new ATOM 0 HA LEU A 87 2.943 -5.748 9.417 1.00 0.00 H new ATOM 0 HB2 LEU A 87 1.012 -3.780 8.158 1.00 0.00 H new ATOM 0 HB3 LEU A 87 2.593 -3.297 8.741 1.00 0.00 H new ATOM 0 HG LEU A 87 2.370 -5.550 6.765 1.00 0.00 H new ATOM 0 HD11 LEU A 87 2.539 -3.919 4.926 1.00 0.00 H new ATOM 0 HD12 LEU A 87 1.009 -3.751 5.819 1.00 0.00 H new ATOM 0 HD13 LEU A 87 2.330 -2.590 6.091 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.577 -4.697 6.075 1.00 0.00 H new ATOM 0 HD22 LEU A 87 4.449 -3.399 7.287 1.00 0.00 H new ATOM 0 HD23 LEU A 87 4.536 -5.098 7.809 1.00 0.00 H new ATOM 1399 N ASN A 88 1.032 -5.407 11.614 1.00 0.00 N ATOM 1400 CA ASN A 88 0.707 -4.949 12.960 1.00 0.00 C ATOM 1401 C ASN A 88 0.049 -3.573 12.922 1.00 0.00 C ATOM 1402 O ASN A 88 0.147 -2.800 13.876 1.00 0.00 O ATOM 1403 CB ASN A 88 1.969 -4.900 13.823 1.00 0.00 C ATOM 1404 CG ASN A 88 1.654 -4.781 15.302 1.00 0.00 C ATOM 1405 OD1 ASN A 88 2.076 -3.832 15.963 1.00 0.00 O ATOM 1406 ND2 ASN A 88 0.909 -5.746 15.827 1.00 0.00 N ATOM 0 H ASN A 88 0.702 -6.348 11.397 1.00 0.00 H new ATOM 0 HA ASN A 88 0.003 -5.657 13.398 1.00 0.00 H new ATOM 0 HB2 ASN A 88 2.559 -5.801 13.651 1.00 0.00 H new ATOM 0 HB3 ASN A 88 2.583 -4.054 13.516 1.00 0.00 H new ATOM 0 HD21 ASN A 88 0.664 -5.720 16.817 1.00 0.00 H new ATOM 0 HD22 ASN A 88 0.581 -6.514 15.241 1.00 0.00 H new ATOM 1413 N PHE A 89 -0.622 -3.274 11.815 1.00 0.00 N ATOM 1414 CA PHE A 89 -1.296 -1.991 11.653 1.00 0.00 C ATOM 1415 C PHE A 89 -2.809 -2.153 11.773 1.00 0.00 C ATOM 1416 O PHE A 89 -3.328 -3.268 11.756 1.00 0.00 O ATOM 1417 CB PHE A 89 -0.943 -1.373 10.298 1.00 0.00 C ATOM 1418 CG PHE A 89 -1.038 0.126 10.280 1.00 0.00 C ATOM 1419 CD1 PHE A 89 0.047 0.906 10.645 1.00 0.00 C ATOM 1420 CD2 PHE A 89 -2.213 0.754 9.898 1.00 0.00 C ATOM 1421 CE1 PHE A 89 -0.037 2.286 10.629 1.00 0.00 C ATOM 1422 CE2 PHE A 89 -2.302 2.133 9.880 1.00 0.00 C ATOM 1423 CZ PHE A 89 -1.214 2.900 10.247 1.00 0.00 C ATOM 0 H PHE A 89 -0.714 -3.902 11.017 1.00 0.00 H new ATOM 0 HA PHE A 89 -0.955 -1.326 12.447 1.00 0.00 H new ATOM 0 HB2 PHE A 89 0.070 -1.668 10.026 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.609 -1.780 9.537 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.969 0.431 10.946 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -3.068 0.160 9.611 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.816 2.883 10.915 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.223 2.611 9.579 1.00 0.00 H new ATOM 0 HZ PHE A 89 -1.283 3.978 10.235 1.00 0.00 H new ATOM 1433 N SER A 90 -3.510 -1.030 11.894 1.00 0.00 N ATOM 1434 CA SER A 90 -4.962 -1.046 12.022 1.00 0.00 C ATOM 1435 C SER A 90 -5.564 0.272 11.542 1.00 0.00 C ATOM 1436 O SER A 90 -4.947 1.330 11.663 1.00 0.00 O ATOM 1437 CB SER A 90 -5.365 -1.305 13.475 1.00 0.00 C ATOM 1438 OG SER A 90 -4.806 -0.332 14.340 1.00 0.00 O ATOM 0 H SER A 90 -3.096 -0.098 11.906 1.00 0.00 H new ATOM 0 HA SER A 90 -5.348 -1.851 11.397 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.451 -1.292 13.562 1.00 0.00 H new ATOM 0 HB3 SER A 90 -5.032 -2.298 13.776 1.00 0.00 H new ATOM 0 HG SER A 90 -5.080 -0.518 15.262 1.00 0.00 H new ATOM 1444 N VAL A 91 -6.775 0.198 10.998 1.00 0.00 N ATOM 1445 CA VAL A 91 -7.462 1.384 10.501 1.00 0.00 C ATOM 1446 C VAL A 91 -8.963 1.297 10.755 1.00 0.00 C ATOM 1447 O VAL A 91 -9.608 0.288 10.470 1.00 0.00 O ATOM 1448 CB VAL A 91 -7.219 1.583 8.993 1.00 0.00 C ATOM 1449 CG1 VAL A 91 -8.283 2.491 8.396 1.00 0.00 C ATOM 1450 CG2 VAL A 91 -5.827 2.146 8.748 1.00 0.00 C ATOM 0 H VAL A 91 -7.300 -0.670 10.891 1.00 0.00 H new ATOM 0 HA VAL A 91 -7.053 2.237 11.043 1.00 0.00 H new ATOM 0 HB VAL A 91 -7.286 0.613 8.500 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -8.095 2.620 7.330 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -9.266 2.043 8.539 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -8.252 3.462 8.890 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.672 2.280 7.677 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -5.729 3.107 9.252 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -5.081 1.454 9.139 1.00 0.00 H new ATOM 1460 N PRO A 92 -9.534 2.378 11.305 1.00 0.00 N ATOM 1461 CA PRO A 92 -10.966 2.449 11.610 1.00 0.00 C ATOM 1462 C PRO A 92 -11.824 2.516 10.351 1.00 0.00 C ATOM 1463 O PRO A 92 -11.344 2.891 9.281 1.00 0.00 O ATOM 1464 CB PRO A 92 -11.094 3.746 12.413 1.00 0.00 C ATOM 1465 CG PRO A 92 -9.940 4.579 11.974 1.00 0.00 C ATOM 1466 CD PRO A 92 -8.825 3.616 11.672 1.00 0.00 C ATOM 0 HA PRO A 92 -11.313 1.565 12.144 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -12.042 4.245 12.211 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -11.058 3.553 13.485 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -10.196 5.168 11.093 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -9.648 5.282 12.754 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -8.194 3.974 10.859 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -8.177 3.467 12.536 1.00 0.00 H new ATOM 1474 N ASP A 93 -13.093 2.149 10.485 1.00 0.00 N ATOM 1475 CA ASP A 93 -14.019 2.169 9.358 1.00 0.00 C ATOM 1476 C ASP A 93 -14.397 3.600 8.991 1.00 0.00 C ATOM 1477 O ASP A 93 -14.975 3.848 7.932 1.00 0.00 O ATOM 1478 CB ASP A 93 -15.276 1.364 9.689 1.00 0.00 C ATOM 1479 CG ASP A 93 -15.047 -0.132 9.601 1.00 0.00 C ATOM 1480 OD1 ASP A 93 -14.320 -0.672 10.461 1.00 0.00 O ATOM 1481 OD2 ASP A 93 -15.593 -0.762 8.671 1.00 0.00 O ATOM 0 H ASP A 93 -13.505 1.834 11.363 1.00 0.00 H new ATOM 0 HA ASP A 93 -13.521 1.714 8.502 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -15.612 1.618 10.694 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -16.076 1.647 9.004 1.00 0.00 H new ATOM 1486 N ASP A 94 -14.069 4.538 9.873 1.00 0.00 N ATOM 1487 CA ASP A 94 -14.375 5.945 9.641 1.00 0.00 C ATOM 1488 C ASP A 94 -13.316 6.593 8.755 1.00 0.00 C ATOM 1489 O ASP A 94 -13.611 7.508 7.986 1.00 0.00 O ATOM 1490 CB ASP A 94 -14.471 6.693 10.972 1.00 0.00 C ATOM 1491 CG ASP A 94 -15.408 6.015 11.952 1.00 0.00 C ATOM 1492 OD1 ASP A 94 -16.630 6.265 11.875 1.00 0.00 O ATOM 1493 OD2 ASP A 94 -14.921 5.233 12.794 1.00 0.00 O ATOM 0 H ASP A 94 -13.592 4.350 10.755 1.00 0.00 H new ATOM 0 HA ASP A 94 -15.336 6.003 9.129 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -13.478 6.768 11.416 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -14.816 7.711 10.789 1.00 0.00 H new ATOM 1498 N VAL A 95 -12.082 6.112 8.868 1.00 0.00 N ATOM 1499 CA VAL A 95 -10.979 6.644 8.077 1.00 0.00 C ATOM 1500 C VAL A 95 -11.017 6.106 6.650 1.00 0.00 C ATOM 1501 O VAL A 95 -10.503 6.735 5.726 1.00 0.00 O ATOM 1502 CB VAL A 95 -9.617 6.298 8.708 1.00 0.00 C ATOM 1503 CG1 VAL A 95 -8.498 6.477 7.694 1.00 0.00 C ATOM 1504 CG2 VAL A 95 -9.371 7.151 9.943 1.00 0.00 C ATOM 0 H VAL A 95 -11.821 5.355 9.500 1.00 0.00 H new ATOM 0 HA VAL A 95 -11.097 7.727 8.058 1.00 0.00 H new ATOM 0 HB VAL A 95 -9.633 5.252 9.014 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.544 6.228 8.158 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -8.670 5.819 6.842 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -8.477 7.512 7.354 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -8.405 6.894 10.376 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -9.375 8.205 9.664 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -10.157 6.967 10.675 1.00 0.00 H new ATOM 1514 N MET A 96 -11.629 4.939 6.480 1.00 0.00 N ATOM 1515 CA MET A 96 -11.735 4.318 5.165 1.00 0.00 C ATOM 1516 C MET A 96 -12.798 5.012 4.319 1.00 0.00 C ATOM 1517 O MET A 96 -12.548 5.381 3.172 1.00 0.00 O ATOM 1518 CB MET A 96 -12.070 2.831 5.305 1.00 0.00 C ATOM 1519 CG MET A 96 -10.987 2.028 6.008 1.00 0.00 C ATOM 1520 SD MET A 96 -10.981 0.293 5.518 1.00 0.00 S ATOM 1521 CE MET A 96 -10.576 -0.496 7.074 1.00 0.00 C ATOM 0 H MET A 96 -12.059 4.405 7.235 1.00 0.00 H new ATOM 0 HA MET A 96 -10.773 4.422 4.664 1.00 0.00 H new ATOM 0 HB2 MET A 96 -13.004 2.728 5.857 1.00 0.00 H new ATOM 0 HB3 MET A 96 -12.238 2.410 4.314 1.00 0.00 H new ATOM 0 HG2 MET A 96 -10.014 2.467 5.788 1.00 0.00 H new ATOM 0 HG3 MET A 96 -11.131 2.097 7.086 1.00 0.00 H new ATOM 0 HE1 MET A 96 -11.264 -1.322 7.253 1.00 0.00 H new ATOM 0 HE2 MET A 96 -9.555 -0.876 7.034 1.00 0.00 H new ATOM 0 HE3 MET A 96 -10.661 0.230 7.883 1.00 0.00 H new ATOM 1531 N ARG A 97 -13.983 5.188 4.894 1.00 0.00 N ATOM 1532 CA ARG A 97 -15.084 5.837 4.192 1.00 0.00 C ATOM 1533 C ARG A 97 -14.642 7.174 3.606 1.00 0.00 C ATOM 1534 O ARG A 97 -15.179 7.631 2.596 1.00 0.00 O ATOM 1535 CB ARG A 97 -16.267 6.049 5.139 1.00 0.00 C ATOM 1536 CG ARG A 97 -17.119 4.806 5.338 1.00 0.00 C ATOM 1537 CD ARG A 97 -18.548 5.164 5.712 1.00 0.00 C ATOM 1538 NE ARG A 97 -18.625 5.821 7.014 1.00 0.00 N ATOM 1539 CZ ARG A 97 -19.746 6.325 7.518 1.00 0.00 C ATOM 1540 NH1 ARG A 97 -20.879 6.246 6.833 1.00 0.00 N ATOM 1541 NH2 ARG A 97 -19.736 6.908 8.710 1.00 0.00 N ATOM 0 H ARG A 97 -14.205 4.890 5.844 1.00 0.00 H new ATOM 0 HA ARG A 97 -15.394 5.186 3.374 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -15.891 6.380 6.107 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -16.894 6.850 4.749 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -17.119 4.213 4.423 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -16.682 4.185 6.120 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -18.969 5.820 4.950 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -19.156 4.260 5.726 1.00 0.00 H new ATOM 0 HE ARG A 97 -17.771 5.897 7.567 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -20.891 5.797 5.917 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -21.738 6.634 7.222 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -18.867 6.970 9.240 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -20.597 7.295 9.096 1.00 0.00 H new ATOM 1555 N LYS A 98 -13.659 7.799 4.246 1.00 0.00 N ATOM 1556 CA LYS A 98 -13.143 9.084 3.790 1.00 0.00 C ATOM 1557 C LYS A 98 -12.193 8.900 2.610 1.00 0.00 C ATOM 1558 O LYS A 98 -12.405 9.467 1.538 1.00 0.00 O ATOM 1559 CB LYS A 98 -12.422 9.802 4.932 1.00 0.00 C ATOM 1560 CG LYS A 98 -13.339 10.202 6.075 1.00 0.00 C ATOM 1561 CD LYS A 98 -12.585 10.290 7.391 1.00 0.00 C ATOM 1562 CE LYS A 98 -13.464 10.849 8.500 1.00 0.00 C ATOM 1563 NZ LYS A 98 -14.449 9.844 8.986 1.00 0.00 N ATOM 0 H LYS A 98 -13.203 7.436 5.083 1.00 0.00 H new ATOM 0 HA LYS A 98 -13.987 9.692 3.464 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -11.636 9.154 5.318 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -11.935 10.694 4.539 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -13.799 11.165 5.853 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -14.147 9.476 6.166 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -12.227 9.300 7.673 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -11.707 10.924 7.267 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -12.838 11.175 9.330 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -13.993 11.729 8.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -15.394 10.078 8.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -14.173 8.898 8.653 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -14.469 9.852 10.026 1.00 0.00 H new ATOM 1577 N ILE A 99 -11.149 8.105 2.816 1.00 0.00 N ATOM 1578 CA ILE A 99 -10.169 7.846 1.768 1.00 0.00 C ATOM 1579 C ILE A 99 -10.852 7.537 0.441 1.00 0.00 C ATOM 1580 O ILE A 99 -10.611 8.206 -0.564 1.00 0.00 O ATOM 1581 CB ILE A 99 -9.243 6.673 2.142 1.00 0.00 C ATOM 1582 CG1 ILE A 99 -8.435 7.012 3.396 1.00 0.00 C ATOM 1583 CG2 ILE A 99 -8.316 6.341 0.982 1.00 0.00 C ATOM 1584 CD1 ILE A 99 -7.771 5.810 4.030 1.00 0.00 C ATOM 0 H ILE A 99 -10.960 7.629 3.698 1.00 0.00 H new ATOM 0 HA ILE A 99 -9.571 8.751 1.663 1.00 0.00 H new ATOM 0 HB ILE A 99 -9.857 5.798 2.354 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -7.671 7.745 3.139 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -9.094 7.481 4.127 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -7.668 5.510 1.261 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -8.909 6.062 0.111 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -7.707 7.212 0.742 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -7.216 6.125 4.914 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -8.531 5.084 4.319 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -7.087 5.353 3.315 1.00 0.00 H new ATOM 1596 N ALA A 100 -11.708 6.520 0.445 1.00 0.00 N ATOM 1597 CA ALA A 100 -12.430 6.124 -0.758 1.00 0.00 C ATOM 1598 C ALA A 100 -13.310 7.260 -1.269 1.00 0.00 C ATOM 1599 O ALA A 100 -13.741 7.252 -2.421 1.00 0.00 O ATOM 1600 CB ALA A 100 -13.269 4.884 -0.486 1.00 0.00 C ATOM 0 H ALA A 100 -11.918 5.955 1.268 1.00 0.00 H new ATOM 0 HA ALA A 100 -11.698 5.891 -1.531 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -13.803 4.600 -1.393 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -12.619 4.066 -0.176 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -13.987 5.097 0.306 1.00 0.00 H new ATOM 1606 N GLN A 101 -13.573 8.233 -0.403 1.00 0.00 N ATOM 1607 CA GLN A 101 -14.404 9.375 -0.767 1.00 0.00 C ATOM 1608 C GLN A 101 -13.544 10.580 -1.130 1.00 0.00 C ATOM 1609 O GLN A 101 -13.900 11.721 -0.834 1.00 0.00 O ATOM 1610 CB GLN A 101 -15.347 9.734 0.383 1.00 0.00 C ATOM 1611 CG GLN A 101 -16.542 8.802 0.504 1.00 0.00 C ATOM 1612 CD GLN A 101 -17.632 9.118 -0.500 1.00 0.00 C ATOM 1613 OE1 GLN A 101 -17.371 9.693 -1.557 1.00 0.00 O ATOM 1614 NE2 GLN A 101 -18.864 8.742 -0.175 1.00 0.00 N ATOM 0 H GLN A 101 -13.223 8.254 0.555 1.00 0.00 H new ATOM 0 HA GLN A 101 -14.996 9.098 -1.639 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -14.788 9.718 1.319 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -15.705 10.754 0.243 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -16.211 7.773 0.364 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -16.951 8.871 1.512 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -19.035 8.268 0.712 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -19.639 8.927 -0.812 1.00 0.00 H new ATOM 1623 N CYS A 102 -12.410 10.320 -1.773 1.00 0.00 N ATOM 1624 CA CYS A 102 -11.498 11.384 -2.176 1.00 0.00 C ATOM 1625 C CYS A 102 -11.382 12.443 -1.084 1.00 0.00 C ATOM 1626 O CYS A 102 -11.429 13.641 -1.361 1.00 0.00 O ATOM 1627 CB CYS A 102 -11.975 12.027 -3.479 1.00 0.00 C ATOM 1628 SG CYS A 102 -11.553 11.085 -4.964 1.00 0.00 S ATOM 0 H CYS A 102 -12.101 9.381 -2.026 1.00 0.00 H new ATOM 0 HA CYS A 102 -10.514 10.944 -2.336 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -13.057 12.151 -3.436 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -11.543 13.024 -3.559 1.00 0.00 H new ATOM 0 HG CYS A 102 -12.000 11.707 -6.014 1.00 0.00 H new ATOM 1634 N ALA A 103 -11.232 11.993 0.157 1.00 0.00 N ATOM 1635 CA ALA A 103 -11.110 12.901 1.290 1.00 0.00 C ATOM 1636 C ALA A 103 -9.798 13.676 1.233 1.00 0.00 C ATOM 1637 O ALA A 103 -8.801 13.217 0.674 1.00 0.00 O ATOM 1638 CB ALA A 103 -11.214 12.131 2.598 1.00 0.00 C ATOM 0 H ALA A 103 -11.192 11.004 0.403 1.00 0.00 H new ATOM 0 HA ALA A 103 -11.929 13.619 1.238 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -11.121 12.822 3.436 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -12.180 11.628 2.648 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.416 11.390 2.649 1.00 0.00 H new ATOM 1644 N PRO A 104 -9.794 14.880 1.824 1.00 0.00 N ATOM 1645 CA PRO A 104 -8.610 15.744 1.853 1.00 0.00 C ATOM 1646 C PRO A 104 -7.511 15.191 2.754 1.00 0.00 C ATOM 1647 O PRO A 104 -7.702 15.034 3.959 1.00 0.00 O ATOM 1648 CB PRO A 104 -9.148 17.063 2.415 1.00 0.00 C ATOM 1649 CG PRO A 104 -10.344 16.675 3.213 1.00 0.00 C ATOM 1650 CD PRO A 104 -10.946 15.491 2.509 1.00 0.00 C ATOM 0 HA PRO A 104 -8.150 15.839 0.869 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -8.403 17.562 3.035 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -9.413 17.755 1.616 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -10.065 16.420 4.235 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -11.057 17.497 3.272 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -11.409 14.798 3.212 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -11.719 15.794 1.803 1.00 0.00 H new ATOM 1658 N GLY A 105 -6.358 14.896 2.160 1.00 0.00 N ATOM 1659 CA GLY A 105 -5.245 14.363 2.924 1.00 0.00 C ATOM 1660 C GLY A 105 -5.698 13.461 4.055 1.00 0.00 C ATOM 1661 O GLY A 105 -5.780 13.891 5.206 1.00 0.00 O ATOM 0 H GLY A 105 -6.175 15.017 1.164 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -4.586 13.804 2.259 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -4.661 15.187 3.333 1.00 0.00 H new ATOM 1665 N VAL A 106 -5.993 12.207 3.728 1.00 0.00 N ATOM 1666 CA VAL A 106 -6.440 11.242 4.726 1.00 0.00 C ATOM 1667 C VAL A 106 -5.637 9.949 4.638 1.00 0.00 C ATOM 1668 O VAL A 106 -5.152 9.437 5.647 1.00 0.00 O ATOM 1669 CB VAL A 106 -7.936 10.917 4.560 1.00 0.00 C ATOM 1670 CG1 VAL A 106 -8.294 9.648 5.319 1.00 0.00 C ATOM 1671 CG2 VAL A 106 -8.790 12.086 5.028 1.00 0.00 C ATOM 0 H VAL A 106 -5.931 11.835 2.780 1.00 0.00 H new ATOM 0 HA VAL A 106 -6.281 11.699 5.703 1.00 0.00 H new ATOM 0 HB VAL A 106 -8.138 10.749 3.502 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -9.355 9.434 5.190 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -7.706 8.815 4.933 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -8.077 9.784 6.379 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -9.844 11.839 4.904 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -8.586 12.287 6.080 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -8.552 12.970 4.436 1.00 0.00 H new ATOM 1681 N VAL A 107 -5.499 9.426 3.424 1.00 0.00 N ATOM 1682 CA VAL A 107 -4.753 8.193 3.203 1.00 0.00 C ATOM 1683 C VAL A 107 -3.254 8.423 3.355 1.00 0.00 C ATOM 1684 O VAL A 107 -2.494 7.486 3.600 1.00 0.00 O ATOM 1685 CB VAL A 107 -5.033 7.610 1.805 1.00 0.00 C ATOM 1686 CG1 VAL A 107 -4.527 8.551 0.723 1.00 0.00 C ATOM 1687 CG2 VAL A 107 -4.400 6.234 1.665 1.00 0.00 C ATOM 0 H VAL A 107 -5.894 9.837 2.578 1.00 0.00 H new ATOM 0 HA VAL A 107 -5.087 7.482 3.958 1.00 0.00 H new ATOM 0 HB VAL A 107 -6.111 7.503 1.685 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -4.734 8.122 -0.258 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -5.032 9.513 0.812 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -3.452 8.693 0.838 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -4.608 5.837 0.671 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.322 6.313 1.806 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -4.816 5.564 2.417 1.00 0.00 H new ATOM 1697 N GLU A 108 -2.835 9.676 3.207 1.00 0.00 N ATOM 1698 CA GLU A 108 -1.425 10.029 3.328 1.00 0.00 C ATOM 1699 C GLU A 108 -0.915 9.755 4.740 1.00 0.00 C ATOM 1700 O GLU A 108 0.169 9.200 4.924 1.00 0.00 O ATOM 1701 CB GLU A 108 -1.213 11.502 2.974 1.00 0.00 C ATOM 1702 CG GLU A 108 0.200 11.821 2.516 1.00 0.00 C ATOM 1703 CD GLU A 108 1.143 12.081 3.675 1.00 0.00 C ATOM 1704 OE1 GLU A 108 0.849 11.614 4.795 1.00 0.00 O ATOM 1705 OE2 GLU A 108 2.175 12.753 3.462 1.00 0.00 O ATOM 0 H GLU A 108 -3.451 10.463 3.003 1.00 0.00 H new ATOM 0 HA GLU A 108 -0.861 9.410 2.630 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -1.913 11.782 2.187 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -1.451 12.114 3.844 1.00 0.00 H new ATOM 0 HG2 GLU A 108 0.581 10.991 1.921 1.00 0.00 H new ATOM 0 HG3 GLU A 108 0.179 12.696 1.866 1.00 0.00 H new ATOM 1712 N LEU A 109 -1.703 10.149 5.734 1.00 0.00 N ATOM 1713 CA LEU A 109 -1.332 9.948 7.130 1.00 0.00 C ATOM 1714 C LEU A 109 -1.079 8.472 7.419 1.00 0.00 C ATOM 1715 O LEU A 109 -0.392 8.125 8.380 1.00 0.00 O ATOM 1716 CB LEU A 109 -2.431 10.478 8.052 1.00 0.00 C ATOM 1717 CG LEU A 109 -2.725 11.976 7.953 1.00 0.00 C ATOM 1718 CD1 LEU A 109 -4.024 12.313 8.668 1.00 0.00 C ATOM 1719 CD2 LEU A 109 -1.572 12.786 8.527 1.00 0.00 C ATOM 0 H LEU A 109 -2.603 10.610 5.599 1.00 0.00 H new ATOM 0 HA LEU A 109 -0.411 10.500 7.318 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -3.350 9.933 7.839 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.156 10.249 9.082 1.00 0.00 H new ATOM 0 HG LEU A 109 -2.835 12.236 6.900 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -4.217 13.383 8.587 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -4.845 11.761 8.211 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -3.943 12.037 9.719 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -1.799 13.849 8.448 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -1.429 12.523 9.575 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -0.661 12.567 7.970 1.00 0.00 H new ATOM 1731 N VAL A 110 -1.637 7.606 6.579 1.00 0.00 N ATOM 1732 CA VAL A 110 -1.470 6.166 6.742 1.00 0.00 C ATOM 1733 C VAL A 110 -0.273 5.659 5.946 1.00 0.00 C ATOM 1734 O VAL A 110 0.268 4.589 6.230 1.00 0.00 O ATOM 1735 CB VAL A 110 -2.730 5.401 6.296 1.00 0.00 C ATOM 1736 CG1 VAL A 110 -2.624 3.931 6.675 1.00 0.00 C ATOM 1737 CG2 VAL A 110 -3.976 6.028 6.903 1.00 0.00 C ATOM 0 H VAL A 110 -2.209 7.876 5.779 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.301 5.985 7.803 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.810 5.467 5.211 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -3.523 3.406 6.352 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -1.753 3.492 6.189 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -2.520 3.841 7.756 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -4.857 5.475 6.577 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -3.908 5.994 7.990 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -4.057 7.065 6.577 1.00 0.00 H new ATOM 1747 N LEU A 111 0.139 6.434 4.948 1.00 0.00 N ATOM 1748 CA LEU A 111 1.274 6.064 4.110 1.00 0.00 C ATOM 1749 C LEU A 111 2.590 6.273 4.852 1.00 0.00 C ATOM 1750 O LEU A 111 3.461 5.403 4.850 1.00 0.00 O ATOM 1751 CB LEU A 111 1.268 6.883 2.818 1.00 0.00 C ATOM 1752 CG LEU A 111 0.132 6.583 1.839 1.00 0.00 C ATOM 1753 CD1 LEU A 111 0.194 7.524 0.646 1.00 0.00 C ATOM 1754 CD2 LEU A 111 0.191 5.133 1.381 1.00 0.00 C ATOM 0 H LEU A 111 -0.296 7.322 4.700 1.00 0.00 H new ATOM 0 HA LEU A 111 1.182 5.006 3.863 1.00 0.00 H new ATOM 0 HB2 LEU A 111 1.224 7.940 3.081 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.216 6.721 2.304 1.00 0.00 H new ATOM 0 HG LEU A 111 -0.816 6.742 2.353 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.622 7.296 -0.040 1.00 0.00 H new ATOM 0 HD12 LEU A 111 0.102 8.554 0.990 1.00 0.00 H new ATOM 0 HD13 LEU A 111 1.147 7.397 0.132 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -0.625 4.938 0.685 1.00 0.00 H new ATOM 0 HD22 LEU A 111 1.144 4.947 0.885 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.097 4.475 2.245 1.00 0.00 H new ATOM 1766 N ILE A 112 2.727 7.432 5.488 1.00 0.00 N ATOM 1767 CA ILE A 112 3.935 7.754 6.237 1.00 0.00 C ATOM 1768 C ILE A 112 4.383 6.573 7.092 1.00 0.00 C ATOM 1769 O ILE A 112 5.500 6.071 6.963 1.00 0.00 O ATOM 1770 CB ILE A 112 3.724 8.979 7.146 1.00 0.00 C ATOM 1771 CG1 ILE A 112 4.086 10.264 6.398 1.00 0.00 C ATOM 1772 CG2 ILE A 112 4.553 8.847 8.415 1.00 0.00 C ATOM 1773 CD1 ILE A 112 3.397 11.495 6.944 1.00 0.00 C ATOM 0 H ILE A 112 2.016 8.163 5.499 1.00 0.00 H new ATOM 0 HA ILE A 112 4.708 7.984 5.504 1.00 0.00 H new ATOM 0 HB ILE A 112 2.672 9.028 7.427 1.00 0.00 H new ATOM 0 HG12 ILE A 112 5.165 10.411 6.445 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.826 10.148 5.346 1.00 0.00 H new ATOM 0 HG21 ILE A 112 4.393 9.721 9.047 1.00 0.00 H new ATOM 0 HG22 ILE A 112 4.252 7.949 8.954 1.00 0.00 H new ATOM 0 HG23 ILE A 112 5.609 8.777 8.154 1.00 0.00 H new ATOM 0 HD11 ILE A 112 3.700 12.368 6.366 1.00 0.00 H new ATOM 0 HD12 ILE A 112 2.317 11.369 6.872 1.00 0.00 H new ATOM 0 HD13 ILE A 112 3.677 11.636 7.988 1.00 0.00 H new ATOM 1785 N PRO A 113 3.492 6.116 7.984 1.00 0.00 N ATOM 1786 CA PRO A 113 3.772 4.987 8.875 1.00 0.00 C ATOM 1787 C PRO A 113 3.848 3.661 8.126 1.00 0.00 C ATOM 1788 O PRO A 113 4.534 2.732 8.554 1.00 0.00 O ATOM 1789 CB PRO A 113 2.581 4.990 9.837 1.00 0.00 C ATOM 1790 CG PRO A 113 1.481 5.646 9.076 1.00 0.00 C ATOM 1791 CD PRO A 113 2.142 6.667 8.191 1.00 0.00 C ATOM 0 HA PRO A 113 4.738 5.089 9.370 1.00 0.00 H new ATOM 0 HB2 PRO A 113 2.308 3.977 10.133 1.00 0.00 H new ATOM 0 HB3 PRO A 113 2.812 5.538 10.751 1.00 0.00 H new ATOM 0 HG2 PRO A 113 0.927 4.917 8.485 1.00 0.00 H new ATOM 0 HG3 PRO A 113 0.767 6.118 9.751 1.00 0.00 H new ATOM 0 HD2 PRO A 113 1.608 6.787 7.248 1.00 0.00 H new ATOM 0 HD3 PRO A 113 2.177 7.648 8.665 1.00 0.00 H new ATOM 1799 N LEU A 114 3.139 3.579 7.005 1.00 0.00 N ATOM 1800 CA LEU A 114 3.126 2.367 6.194 1.00 0.00 C ATOM 1801 C LEU A 114 4.546 1.924 5.854 1.00 0.00 C ATOM 1802 O LEU A 114 4.897 0.755 6.015 1.00 0.00 O ATOM 1803 CB LEU A 114 2.330 2.597 4.909 1.00 0.00 C ATOM 1804 CG LEU A 114 2.113 1.369 4.024 1.00 0.00 C ATOM 1805 CD1 LEU A 114 0.853 0.627 4.440 1.00 0.00 C ATOM 1806 CD2 LEU A 114 2.037 1.774 2.559 1.00 0.00 C ATOM 0 H LEU A 114 2.565 4.338 6.637 1.00 0.00 H new ATOM 0 HA LEU A 114 2.647 1.577 6.773 1.00 0.00 H new ATOM 0 HB2 LEU A 114 1.355 3.003 5.177 1.00 0.00 H new ATOM 0 HB3 LEU A 114 2.841 3.358 4.320 1.00 0.00 H new ATOM 0 HG LEU A 114 2.963 0.699 4.151 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.715 -0.244 3.799 1.00 0.00 H new ATOM 0 HD12 LEU A 114 0.947 0.303 5.477 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -0.008 1.289 4.343 1.00 0.00 H new ATOM 0 HD21 LEU A 114 1.882 0.887 1.944 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.206 2.465 2.415 1.00 0.00 H new ATOM 0 HD23 LEU A 114 2.968 2.260 2.267 1.00 0.00 H new ATOM 1818 N ARG A 115 5.358 2.866 5.386 1.00 0.00 N ATOM 1819 CA ARG A 115 6.740 2.573 5.024 1.00 0.00 C ATOM 1820 C ARG A 115 7.557 2.202 6.258 1.00 0.00 C ATOM 1821 O ARG A 115 8.376 1.284 6.217 1.00 0.00 O ATOM 1822 CB ARG A 115 7.372 3.777 4.324 1.00 0.00 C ATOM 1823 CG ARG A 115 8.038 4.756 5.277 1.00 0.00 C ATOM 1824 CD ARG A 115 8.323 6.087 4.600 1.00 0.00 C ATOM 1825 NE ARG A 115 8.987 7.027 5.499 1.00 0.00 N ATOM 1826 CZ ARG A 115 9.243 8.291 5.181 1.00 0.00 C ATOM 1827 NH1 ARG A 115 8.894 8.764 3.992 1.00 0.00 N ATOM 1828 NH2 ARG A 115 9.851 9.086 6.053 1.00 0.00 N ATOM 0 H ARG A 115 5.083 3.839 5.249 1.00 0.00 H new ATOM 0 HA ARG A 115 6.739 1.724 4.341 1.00 0.00 H new ATOM 0 HB2 ARG A 115 8.111 3.422 3.606 1.00 0.00 H new ATOM 0 HB3 ARG A 115 6.603 4.301 3.757 1.00 0.00 H new ATOM 0 HG2 ARG A 115 7.395 4.917 6.142 1.00 0.00 H new ATOM 0 HG3 ARG A 115 8.970 4.328 5.647 1.00 0.00 H new ATOM 0 HD2 ARG A 115 8.948 5.921 3.723 1.00 0.00 H new ATOM 0 HD3 ARG A 115 7.388 6.522 4.247 1.00 0.00 H new ATOM 0 HE ARG A 115 9.270 6.695 6.421 1.00 0.00 H new ATOM 0 HH11 ARG A 115 8.427 8.157 3.318 1.00 0.00 H new ATOM 0 HH12 ARG A 115 9.092 9.735 3.751 1.00 0.00 H new ATOM 0 HH21 ARG A 115 10.122 8.726 6.968 1.00 0.00 H new ATOM 0 HH22 ARG A 115 10.047 10.056 5.808 1.00 0.00 H new ATOM 1842 N GLN A 116 7.328 2.921 7.352 1.00 0.00 N ATOM 1843 CA GLN A 116 8.045 2.667 8.596 1.00 0.00 C ATOM 1844 C GLN A 116 7.963 1.194 8.981 1.00 0.00 C ATOM 1845 O GLN A 116 8.899 0.640 9.559 1.00 0.00 O ATOM 1846 CB GLN A 116 7.476 3.533 9.722 1.00 0.00 C ATOM 1847 CG GLN A 116 8.041 4.944 9.749 1.00 0.00 C ATOM 1848 CD GLN A 116 9.285 5.059 10.607 1.00 0.00 C ATOM 1849 OE1 GLN A 116 10.297 4.407 10.345 1.00 0.00 O ATOM 1850 NE2 GLN A 116 9.218 5.890 11.640 1.00 0.00 N ATOM 0 H GLN A 116 6.652 3.683 7.402 1.00 0.00 H new ATOM 0 HA GLN A 116 9.093 2.925 8.442 1.00 0.00 H new ATOM 0 HB2 GLN A 116 6.392 3.586 9.616 1.00 0.00 H new ATOM 0 HB3 GLN A 116 7.679 3.051 10.678 1.00 0.00 H new ATOM 0 HG2 GLN A 116 8.276 5.256 8.732 1.00 0.00 H new ATOM 0 HG3 GLN A 116 7.281 5.628 10.125 1.00 0.00 H new ATOM 0 HE21 GLN A 116 8.360 6.411 11.821 1.00 0.00 H new ATOM 0 HE22 GLN A 116 10.025 6.008 12.253 1.00 0.00 H new ATOM 1859 N ARG A 117 6.839 0.564 8.656 1.00 0.00 N ATOM 1860 CA ARG A 117 6.635 -0.845 8.969 1.00 0.00 C ATOM 1861 C ARG A 117 7.280 -1.736 7.912 1.00 0.00 C ATOM 1862 O ARG A 117 8.121 -2.580 8.224 1.00 0.00 O ATOM 1863 CB ARG A 117 5.140 -1.156 9.070 1.00 0.00 C ATOM 1864 CG ARG A 117 4.481 -0.582 10.313 1.00 0.00 C ATOM 1865 CD ARG A 117 4.875 -1.358 11.561 1.00 0.00 C ATOM 1866 NE ARG A 117 4.480 -2.761 11.480 1.00 0.00 N ATOM 1867 CZ ARG A 117 4.786 -3.666 12.404 1.00 0.00 C ATOM 1868 NH1 ARG A 117 5.489 -3.315 13.472 1.00 0.00 N ATOM 1869 NH2 ARG A 117 4.390 -4.924 12.260 1.00 0.00 N ATOM 0 H ARG A 117 6.056 1.007 8.176 1.00 0.00 H new ATOM 0 HA ARG A 117 7.108 -1.050 9.930 1.00 0.00 H new ATOM 0 HB2 ARG A 117 4.635 -0.763 8.187 1.00 0.00 H new ATOM 0 HB3 ARG A 117 5.001 -2.237 9.062 1.00 0.00 H new ATOM 0 HG2 ARG A 117 4.767 0.464 10.428 1.00 0.00 H new ATOM 0 HG3 ARG A 117 3.398 -0.605 10.196 1.00 0.00 H new ATOM 0 HD2 ARG A 117 5.954 -1.293 11.703 1.00 0.00 H new ATOM 0 HD3 ARG A 117 4.410 -0.900 12.434 1.00 0.00 H new ATOM 0 HE ARG A 117 3.939 -3.063 10.670 1.00 0.00 H new ATOM 0 HH11 ARG A 117 5.796 -2.349 13.586 1.00 0.00 H new ATOM 0 HH12 ARG A 117 5.723 -4.011 14.180 1.00 0.00 H new ATOM 0 HH21 ARG A 117 3.850 -5.198 11.439 1.00 0.00 H new ATOM 0 HH22 ARG A 117 4.626 -5.617 12.970 1.00 0.00 H new ATOM 1883 N LEU A 118 6.881 -1.543 6.659 1.00 0.00 N ATOM 1884 CA LEU A 118 7.420 -2.329 5.555 1.00 0.00 C ATOM 1885 C LEU A 118 8.926 -2.515 5.703 1.00 0.00 C ATOM 1886 O LEU A 118 9.459 -3.589 5.426 1.00 0.00 O ATOM 1887 CB LEU A 118 7.107 -1.651 4.220 1.00 0.00 C ATOM 1888 CG LEU A 118 5.678 -1.817 3.701 1.00 0.00 C ATOM 1889 CD1 LEU A 118 5.421 -0.876 2.534 1.00 0.00 C ATOM 1890 CD2 LEU A 118 5.424 -3.260 3.291 1.00 0.00 C ATOM 0 H LEU A 118 6.186 -0.849 6.383 1.00 0.00 H new ATOM 0 HA LEU A 118 6.948 -3.311 5.576 1.00 0.00 H new ATOM 0 HB2 LEU A 118 7.315 -0.586 4.319 1.00 0.00 H new ATOM 0 HB3 LEU A 118 7.793 -2.041 3.468 1.00 0.00 H new ATOM 0 HG LEU A 118 4.988 -1.562 4.505 1.00 0.00 H new ATOM 0 HD11 LEU A 118 4.399 -1.008 2.178 1.00 0.00 H new ATOM 0 HD12 LEU A 118 5.561 0.155 2.860 1.00 0.00 H new ATOM 0 HD13 LEU A 118 6.118 -1.099 1.726 1.00 0.00 H new ATOM 0 HD21 LEU A 118 4.402 -3.360 2.924 1.00 0.00 H new ATOM 0 HD22 LEU A 118 6.122 -3.542 2.503 1.00 0.00 H new ATOM 0 HD23 LEU A 118 5.566 -3.913 4.152 1.00 0.00 H new ATOM 1902 N GLU A 119 9.607 -1.462 6.144 1.00 0.00 N ATOM 1903 CA GLU A 119 11.052 -1.510 6.330 1.00 0.00 C ATOM 1904 C GLU A 119 11.411 -2.253 7.614 1.00 0.00 C ATOM 1905 O GLU A 119 12.444 -2.916 7.691 1.00 0.00 O ATOM 1906 CB GLU A 119 11.632 -0.095 6.368 1.00 0.00 C ATOM 1907 CG GLU A 119 11.548 0.633 5.036 1.00 0.00 C ATOM 1908 CD GLU A 119 12.504 1.807 4.952 1.00 0.00 C ATOM 1909 OE1 GLU A 119 13.578 1.746 5.586 1.00 0.00 O ATOM 1910 OE2 GLU A 119 12.178 2.788 4.251 1.00 0.00 O ATOM 0 H GLU A 119 9.181 -0.566 6.379 1.00 0.00 H new ATOM 0 HA GLU A 119 11.483 -2.049 5.486 1.00 0.00 H new ATOM 0 HB2 GLU A 119 11.103 0.485 7.124 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.675 -0.147 6.679 1.00 0.00 H new ATOM 0 HG2 GLU A 119 11.766 -0.067 4.229 1.00 0.00 H new ATOM 0 HG3 GLU A 119 10.529 0.988 4.884 1.00 0.00 H new ATOM 1917 N GLU A 120 10.549 -2.134 8.619 1.00 0.00 N ATOM 1918 CA GLU A 120 10.775 -2.793 9.901 1.00 0.00 C ATOM 1919 C GLU A 120 10.789 -4.310 9.737 1.00 0.00 C ATOM 1920 O GLU A 120 11.382 -5.026 10.544 1.00 0.00 O ATOM 1921 CB GLU A 120 9.696 -2.387 10.906 1.00 0.00 C ATOM 1922 CG GLU A 120 10.147 -2.479 12.354 1.00 0.00 C ATOM 1923 CD GLU A 120 11.049 -1.329 12.758 1.00 0.00 C ATOM 1924 OE1 GLU A 120 12.125 -1.175 12.142 1.00 0.00 O ATOM 1925 OE2 GLU A 120 10.680 -0.584 13.689 1.00 0.00 O ATOM 0 H GLU A 120 9.689 -1.588 8.571 1.00 0.00 H new ATOM 0 HA GLU A 120 11.748 -2.476 10.277 1.00 0.00 H new ATOM 0 HB2 GLU A 120 9.382 -1.364 10.696 1.00 0.00 H new ATOM 0 HB3 GLU A 120 8.822 -3.023 10.765 1.00 0.00 H new ATOM 0 HG2 GLU A 120 9.271 -2.494 13.003 1.00 0.00 H new ATOM 0 HG3 GLU A 120 10.674 -3.421 12.507 1.00 0.00 H new ATOM 1932 N ARG A 121 10.132 -4.793 8.688 1.00 0.00 N ATOM 1933 CA ARG A 121 10.067 -6.224 8.419 1.00 0.00 C ATOM 1934 C ARG A 121 11.011 -6.608 7.284 1.00 0.00 C ATOM 1935 O ARG A 121 11.485 -7.741 7.215 1.00 0.00 O ATOM 1936 CB ARG A 121 8.635 -6.634 8.068 1.00 0.00 C ATOM 1937 CG ARG A 121 7.710 -6.710 9.271 1.00 0.00 C ATOM 1938 CD ARG A 121 6.334 -7.229 8.884 1.00 0.00 C ATOM 1939 NE ARG A 121 5.671 -7.902 9.997 1.00 0.00 N ATOM 1940 CZ ARG A 121 5.962 -9.138 10.387 1.00 0.00 C ATOM 1941 NH1 ARG A 121 6.901 -9.831 9.758 1.00 0.00 N ATOM 1942 NH2 ARG A 121 5.314 -9.683 11.409 1.00 0.00 N ATOM 0 H ARG A 121 9.637 -4.214 8.010 1.00 0.00 H new ATOM 0 HA ARG A 121 10.378 -6.752 9.320 1.00 0.00 H new ATOM 0 HB2 ARG A 121 8.227 -5.921 7.352 1.00 0.00 H new ATOM 0 HB3 ARG A 121 8.655 -7.606 7.574 1.00 0.00 H new ATOM 0 HG2 ARG A 121 8.147 -7.363 10.027 1.00 0.00 H new ATOM 0 HG3 ARG A 121 7.614 -5.722 9.721 1.00 0.00 H new ATOM 0 HD2 ARG A 121 5.716 -6.399 8.542 1.00 0.00 H new ATOM 0 HD3 ARG A 121 6.429 -7.921 8.047 1.00 0.00 H new ATOM 0 HE ARG A 121 4.945 -7.395 10.503 1.00 0.00 H new ATOM 0 HH11 ARG A 121 7.402 -9.415 8.973 1.00 0.00 H new ATOM 0 HH12 ARG A 121 7.123 -10.780 10.059 1.00 0.00 H new ATOM 0 HH21 ARG A 121 4.592 -9.153 11.896 1.00 0.00 H new ATOM 0 HH22 ARG A 121 5.538 -10.632 11.707 1.00 0.00 H new ATOM 1956 N GLN A 122 11.278 -5.655 6.396 1.00 0.00 N ATOM 1957 CA GLN A 122 12.164 -5.895 5.263 1.00 0.00 C ATOM 1958 C GLN A 122 13.516 -6.422 5.731 1.00 0.00 C ATOM 1959 O GLN A 122 13.913 -7.535 5.386 1.00 0.00 O ATOM 1960 CB GLN A 122 12.355 -4.608 4.458 1.00 0.00 C ATOM 1961 CG GLN A 122 13.239 -4.783 3.233 1.00 0.00 C ATOM 1962 CD GLN A 122 13.582 -3.464 2.568 1.00 0.00 C ATOM 1963 OE1 GLN A 122 12.765 -2.543 2.532 1.00 0.00 O ATOM 1964 NE2 GLN A 122 14.795 -3.367 2.036 1.00 0.00 N ATOM 0 H GLN A 122 10.894 -4.711 6.439 1.00 0.00 H new ATOM 0 HA GLN A 122 11.702 -6.649 4.626 1.00 0.00 H new ATOM 0 HB2 GLN A 122 11.379 -4.238 4.142 1.00 0.00 H new ATOM 0 HB3 GLN A 122 12.790 -3.846 5.104 1.00 0.00 H new ATOM 0 HG2 GLN A 122 14.160 -5.290 3.523 1.00 0.00 H new ATOM 0 HG3 GLN A 122 12.734 -5.428 2.514 1.00 0.00 H new ATOM 0 HE21 GLN A 122 15.440 -4.156 2.089 1.00 0.00 H new ATOM 0 HE22 GLN A 122 15.082 -2.504 1.574 1.00 0.00 H new