USER MOD reduce.3.24.130724 H: found=0, std=0, add=787, rem=0, adj=12 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= -2.86 K(o=-2.9,f=-3.8!) USER MOD Set 1.2: A 96 MET CE :methyl -171:sc= 0 (180deg=-0.0713) USER MOD Single : A 19 GLN : amide:sc= -0.78 K(o=-0.78,f=-0.26) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= -2! K(o=-2!,f=-0.57) USER MOD Single : A 41 SER OG : rot 43:sc= 0.457 USER MOD Single : A 51 LYS NZ :NH3+ -148:sc= -0.796 (180deg=-1.02) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl -114:sc= -0.118 (180deg=-3.81!) USER MOD Single : A 60 MET CE :methyl 140:sc= -2.18 (180deg=-6.06!) USER MOD Single : A 61 HIS : no HD1:sc= -0.0028 X(o=-0.0028,f=-0.0028) USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -0.659 K(o=-0.66,f=-1.6!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 GLN : amide:sc= -0.483 X(o=-0.48,f=-0.48) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 0.336 K(o=0.34,f=-1.4!) USER MOD Single : A 78 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 ASN : amide:sc= -0.694 X(o=-0.69,f=-0.68) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 GLN : amide:sc= -0.724 K(o=-0.72,f=-0.012) USER MOD Single : A 102 CYS SG : rot -51:sc= -0.307 USER MOD Single : A 116 GLN : amide:sc= -0.0712 K(o=-0.071,f=-1.5!) USER MOD Single : A 122 GLN : amide:sc= -2.91! C(o=-2.9!,f=-3.4!) USER MOD ----------------------------------------------------------------- ATOM 220 N GLN A 19 8.122 15.251 0.681 1.00 0.00 N ATOM 221 CA GLN A 19 9.042 14.132 0.851 1.00 0.00 C ATOM 222 C GLN A 19 8.332 12.803 0.616 1.00 0.00 C ATOM 223 O GLN A 19 8.906 11.872 0.049 1.00 0.00 O ATOM 224 CB GLN A 19 9.653 14.157 2.253 1.00 0.00 C ATOM 225 CG GLN A 19 10.595 15.327 2.486 1.00 0.00 C ATOM 226 CD GLN A 19 11.836 15.260 1.618 1.00 0.00 C ATOM 227 OE1 GLN A 19 12.887 14.789 2.054 1.00 0.00 O ATOM 228 NE2 GLN A 19 11.721 15.731 0.382 1.00 0.00 N ATOM 0 HA GLN A 19 9.838 14.232 0.113 1.00 0.00 H new ATOM 0 HB2 GLN A 19 8.850 14.196 2.989 1.00 0.00 H new ATOM 0 HB3 GLN A 19 10.195 13.226 2.421 1.00 0.00 H new ATOM 0 HG2 GLN A 19 10.067 16.259 2.286 1.00 0.00 H new ATOM 0 HG3 GLN A 19 10.891 15.347 3.535 1.00 0.00 H new ATOM 0 HE21 GLN A 19 10.831 16.112 0.062 1.00 0.00 H new ATOM 0 HE22 GLN A 19 12.523 15.711 -0.248 1.00 0.00 H new ATOM 237 N LEU A 20 7.081 12.720 1.056 1.00 0.00 N ATOM 238 CA LEU A 20 6.292 11.504 0.894 1.00 0.00 C ATOM 239 C LEU A 20 5.777 11.376 -0.536 1.00 0.00 C ATOM 240 O LEU A 20 5.579 10.269 -1.039 1.00 0.00 O ATOM 241 CB LEU A 20 5.118 11.499 1.874 1.00 0.00 C ATOM 242 CG LEU A 20 3.947 10.583 1.515 1.00 0.00 C ATOM 243 CD1 LEU A 20 4.267 9.142 1.879 1.00 0.00 C ATOM 244 CD2 LEU A 20 2.677 11.043 2.215 1.00 0.00 C ATOM 0 H LEU A 20 6.591 13.480 1.528 1.00 0.00 H new ATOM 0 HA LEU A 20 6.937 10.651 1.106 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.492 11.209 2.856 1.00 0.00 H new ATOM 0 HB3 LEU A 20 4.742 12.518 1.964 1.00 0.00 H new ATOM 0 HG LEU A 20 3.784 10.637 0.439 1.00 0.00 H new ATOM 0 HD11 LEU A 20 3.423 8.504 1.617 1.00 0.00 H new ATOM 0 HD12 LEU A 20 5.152 8.816 1.332 1.00 0.00 H new ATOM 0 HD13 LEU A 20 4.456 9.071 2.950 1.00 0.00 H new ATOM 0 HD21 LEU A 20 1.854 10.380 1.948 1.00 0.00 H new ATOM 0 HD22 LEU A 20 2.827 11.019 3.294 1.00 0.00 H new ATOM 0 HD23 LEU A 20 2.439 12.060 1.905 1.00 0.00 H new ATOM 256 N TYR A 21 5.563 12.514 -1.186 1.00 0.00 N ATOM 257 CA TYR A 21 5.070 12.529 -2.559 1.00 0.00 C ATOM 258 C TYR A 21 6.159 12.092 -3.533 1.00 0.00 C ATOM 259 O TYR A 21 5.879 11.454 -4.550 1.00 0.00 O ATOM 260 CB TYR A 21 4.571 13.928 -2.928 1.00 0.00 C ATOM 261 CG TYR A 21 3.251 14.289 -2.286 1.00 0.00 C ATOM 262 CD1 TYR A 21 2.699 13.491 -1.291 1.00 0.00 C ATOM 263 CD2 TYR A 21 2.555 15.427 -2.674 1.00 0.00 C ATOM 264 CE1 TYR A 21 1.492 13.816 -0.702 1.00 0.00 C ATOM 265 CE2 TYR A 21 1.349 15.761 -2.090 1.00 0.00 C ATOM 266 CZ TYR A 21 0.821 14.952 -1.104 1.00 0.00 C ATOM 267 OH TYR A 21 -0.381 15.281 -0.521 1.00 0.00 O ATOM 0 H TYR A 21 5.723 13.438 -0.785 1.00 0.00 H new ATOM 0 HA TYR A 21 4.241 11.824 -2.629 1.00 0.00 H new ATOM 0 HB2 TYR A 21 5.321 14.662 -2.633 1.00 0.00 H new ATOM 0 HB3 TYR A 21 4.469 13.994 -4.011 1.00 0.00 H new ATOM 0 HD1 TYR A 21 3.222 12.602 -0.973 1.00 0.00 H new ATOM 0 HD2 TYR A 21 2.964 16.062 -3.446 1.00 0.00 H new ATOM 0 HE1 TYR A 21 1.076 13.184 0.069 1.00 0.00 H new ATOM 0 HE2 TYR A 21 0.822 16.650 -2.403 1.00 0.00 H new ATOM 0 HH TYR A 21 -0.721 16.110 -0.917 1.00 0.00 H new ATOM 277 N LEU A 22 7.401 12.438 -3.216 1.00 0.00 N ATOM 278 CA LEU A 22 8.535 12.080 -4.062 1.00 0.00 C ATOM 279 C LEU A 22 8.939 10.625 -3.846 1.00 0.00 C ATOM 280 O LEU A 22 9.206 9.897 -4.802 1.00 0.00 O ATOM 281 CB LEU A 22 9.723 13.000 -3.772 1.00 0.00 C ATOM 282 CG LEU A 22 9.441 14.501 -3.836 1.00 0.00 C ATOM 283 CD1 LEU A 22 10.460 15.271 -3.011 1.00 0.00 C ATOM 284 CD2 LEU A 22 9.446 14.984 -5.279 1.00 0.00 C ATOM 0 H LEU A 22 7.649 12.966 -2.379 1.00 0.00 H new ATOM 0 HA LEU A 22 8.233 12.203 -5.102 1.00 0.00 H new ATOM 0 HB2 LEU A 22 10.105 12.765 -2.779 1.00 0.00 H new ATOM 0 HB3 LEU A 22 10.517 12.769 -4.482 1.00 0.00 H new ATOM 0 HG LEU A 22 8.452 14.683 -3.416 1.00 0.00 H new ATOM 0 HD11 LEU A 22 10.243 16.338 -3.068 1.00 0.00 H new ATOM 0 HD12 LEU A 22 10.408 14.946 -1.972 1.00 0.00 H new ATOM 0 HD13 LEU A 22 11.461 15.082 -3.400 1.00 0.00 H new ATOM 0 HD21 LEU A 22 9.243 16.055 -5.305 1.00 0.00 H new ATOM 0 HD22 LEU A 22 10.421 14.788 -5.725 1.00 0.00 H new ATOM 0 HD23 LEU A 22 8.677 14.456 -5.842 1.00 0.00 H new ATOM 296 N TRP A 23 8.979 10.209 -2.586 1.00 0.00 N ATOM 297 CA TRP A 23 9.348 8.840 -2.245 1.00 0.00 C ATOM 298 C TRP A 23 8.617 7.841 -3.136 1.00 0.00 C ATOM 299 O TRP A 23 9.227 6.924 -3.686 1.00 0.00 O ATOM 300 CB TRP A 23 9.033 8.556 -0.775 1.00 0.00 C ATOM 301 CG TRP A 23 8.838 7.100 -0.480 1.00 0.00 C ATOM 302 CD1 TRP A 23 9.812 6.149 -0.364 1.00 0.00 C ATOM 303 CD2 TRP A 23 7.592 6.428 -0.266 1.00 0.00 C ATOM 304 NE1 TRP A 23 9.246 4.927 -0.090 1.00 0.00 N ATOM 305 CE2 TRP A 23 7.886 5.072 -0.024 1.00 0.00 C ATOM 306 CE3 TRP A 23 6.257 6.840 -0.252 1.00 0.00 C ATOM 307 CZ2 TRP A 23 6.893 4.128 0.226 1.00 0.00 C ATOM 308 CZ3 TRP A 23 5.272 5.902 -0.004 1.00 0.00 C ATOM 309 CH2 TRP A 23 5.594 4.560 0.233 1.00 0.00 C ATOM 0 H TRP A 23 8.761 10.800 -1.784 1.00 0.00 H new ATOM 0 HA TRP A 23 10.420 8.728 -2.408 1.00 0.00 H new ATOM 0 HB2 TRP A 23 9.845 8.939 -0.156 1.00 0.00 H new ATOM 0 HB3 TRP A 23 8.132 9.101 -0.492 1.00 0.00 H new ATOM 0 HD1 TRP A 23 10.871 6.331 -0.472 1.00 0.00 H new ATOM 0 HE1 TRP A 23 9.756 4.054 0.043 1.00 0.00 H new ATOM 0 HE3 TRP A 23 5.999 7.873 -0.432 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 7.139 3.092 0.408 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 4.237 6.210 0.007 1.00 0.00 H new ATOM 0 HH2 TRP A 23 4.802 3.852 0.425 1.00 0.00 H new ATOM 320 N VAL A 24 7.308 8.026 -3.275 1.00 0.00 N ATOM 321 CA VAL A 24 6.495 7.141 -4.101 1.00 0.00 C ATOM 322 C VAL A 24 7.025 7.082 -5.530 1.00 0.00 C ATOM 323 O VAL A 24 7.391 6.015 -6.024 1.00 0.00 O ATOM 324 CB VAL A 24 5.024 7.595 -4.130 1.00 0.00 C ATOM 325 CG1 VAL A 24 4.238 6.796 -5.159 1.00 0.00 C ATOM 326 CG2 VAL A 24 4.399 7.462 -2.749 1.00 0.00 C ATOM 0 H VAL A 24 6.788 8.780 -2.827 1.00 0.00 H new ATOM 0 HA VAL A 24 6.553 6.149 -3.653 1.00 0.00 H new ATOM 0 HB VAL A 24 4.992 8.645 -4.419 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.201 7.131 -5.165 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.674 6.947 -6.147 1.00 0.00 H new ATOM 0 HG13 VAL A 24 4.276 5.737 -4.904 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.359 7.787 -2.787 1.00 0.00 H new ATOM 0 HG22 VAL A 24 4.442 6.421 -2.429 1.00 0.00 H new ATOM 0 HG23 VAL A 24 4.947 8.083 -2.040 1.00 0.00 H new ATOM 336 N ASP A 25 7.064 8.235 -6.188 1.00 0.00 N ATOM 337 CA ASP A 25 7.551 8.316 -7.560 1.00 0.00 C ATOM 338 C ASP A 25 8.872 7.568 -7.713 1.00 0.00 C ATOM 339 O ASP A 25 9.056 6.801 -8.657 1.00 0.00 O ATOM 340 CB ASP A 25 7.728 9.777 -7.976 1.00 0.00 C ATOM 341 CG ASP A 25 8.061 9.924 -9.448 1.00 0.00 C ATOM 342 OD1 ASP A 25 7.346 9.328 -10.280 1.00 0.00 O ATOM 343 OD2 ASP A 25 9.037 10.634 -9.768 1.00 0.00 O ATOM 0 H ASP A 25 6.764 9.127 -5.794 1.00 0.00 H new ATOM 0 HA ASP A 25 6.811 7.848 -8.210 1.00 0.00 H new ATOM 0 HB2 ASP A 25 6.813 10.327 -7.757 1.00 0.00 H new ATOM 0 HB3 ASP A 25 8.522 10.228 -7.380 1.00 0.00 H new ATOM 348 N ASN A 26 9.788 7.797 -6.778 1.00 0.00 N ATOM 349 CA ASN A 26 11.093 7.146 -6.810 1.00 0.00 C ATOM 350 C ASN A 26 10.947 5.649 -7.066 1.00 0.00 C ATOM 351 O ASN A 26 11.619 5.090 -7.933 1.00 0.00 O ATOM 352 CB ASN A 26 11.835 7.380 -5.492 1.00 0.00 C ATOM 353 CG ASN A 26 13.212 6.745 -5.484 1.00 0.00 C ATOM 354 OD1 ASN A 26 14.228 7.440 -5.523 1.00 0.00 O ATOM 355 ND2 ASN A 26 13.252 5.419 -5.434 1.00 0.00 N ATOM 0 H ASN A 26 9.651 8.428 -5.989 1.00 0.00 H new ATOM 0 HA ASN A 26 11.670 7.582 -7.626 1.00 0.00 H new ATOM 0 HB2 ASN A 26 11.931 8.452 -5.317 1.00 0.00 H new ATOM 0 HB3 ASN A 26 11.246 6.974 -4.669 1.00 0.00 H new ATOM 0 HD21 ASN A 26 14.150 4.936 -5.427 1.00 0.00 H new ATOM 0 HD22 ASN A 26 12.384 4.883 -5.403 1.00 0.00 H new ATOM 362 N ILE A 27 10.066 5.007 -6.307 1.00 0.00 N ATOM 363 CA ILE A 27 9.831 3.576 -6.453 1.00 0.00 C ATOM 364 C ILE A 27 9.211 3.256 -7.809 1.00 0.00 C ATOM 365 O ILE A 27 8.246 3.887 -8.242 1.00 0.00 O ATOM 366 CB ILE A 27 8.911 3.040 -5.340 1.00 0.00 C ATOM 367 CG1 ILE A 27 9.542 3.279 -3.967 1.00 0.00 C ATOM 368 CG2 ILE A 27 8.632 1.559 -5.551 1.00 0.00 C ATOM 369 CD1 ILE A 27 8.553 3.193 -2.825 1.00 0.00 C ATOM 0 H ILE A 27 9.503 5.455 -5.584 1.00 0.00 H new ATOM 0 HA ILE A 27 10.802 3.087 -6.376 1.00 0.00 H new ATOM 0 HB ILE A 27 7.964 3.578 -5.382 1.00 0.00 H new ATOM 0 HG12 ILE A 27 10.334 2.547 -3.807 1.00 0.00 H new ATOM 0 HG13 ILE A 27 10.011 4.263 -3.958 1.00 0.00 H new ATOM 0 HG21 ILE A 27 7.981 1.195 -4.757 1.00 0.00 H new ATOM 0 HG22 ILE A 27 8.144 1.414 -6.515 1.00 0.00 H new ATOM 0 HG23 ILE A 27 9.571 1.006 -5.533 1.00 0.00 H new ATOM 0 HD11 ILE A 27 9.069 3.373 -1.882 1.00 0.00 H new ATOM 0 HD12 ILE A 27 7.774 3.943 -2.961 1.00 0.00 H new ATOM 0 HD13 ILE A 27 8.102 2.201 -2.808 1.00 0.00 H new ATOM 577 N ASP A 39 -5.057 8.350 -7.347 1.00 0.00 N ATOM 578 CA ASP A 39 -4.858 6.934 -7.630 1.00 0.00 C ATOM 579 C ASP A 39 -4.911 6.110 -6.347 1.00 0.00 C ATOM 580 O ASP A 39 -5.763 5.234 -6.194 1.00 0.00 O ATOM 581 CB ASP A 39 -3.518 6.716 -8.334 1.00 0.00 C ATOM 582 CG ASP A 39 -3.515 5.474 -9.203 1.00 0.00 C ATOM 583 OD1 ASP A 39 -3.864 4.390 -8.690 1.00 0.00 O ATOM 584 OD2 ASP A 39 -3.165 5.585 -10.396 1.00 0.00 O ATOM 0 HA ASP A 39 -5.663 6.604 -8.286 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -3.288 7.586 -8.949 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -2.728 6.635 -7.588 1.00 0.00 H new ATOM 589 N PHE A 40 -3.996 6.397 -5.427 1.00 0.00 N ATOM 590 CA PHE A 40 -3.938 5.682 -4.157 1.00 0.00 C ATOM 591 C PHE A 40 -5.340 5.420 -3.616 1.00 0.00 C ATOM 592 O PHE A 40 -5.638 4.326 -3.137 1.00 0.00 O ATOM 593 CB PHE A 40 -3.125 6.480 -3.135 1.00 0.00 C ATOM 594 CG PHE A 40 -1.654 6.180 -3.175 1.00 0.00 C ATOM 595 CD1 PHE A 40 -1.197 4.874 -3.115 1.00 0.00 C ATOM 596 CD2 PHE A 40 -0.727 7.206 -3.271 1.00 0.00 C ATOM 597 CE1 PHE A 40 0.156 4.595 -3.151 1.00 0.00 C ATOM 598 CE2 PHE A 40 0.627 6.934 -3.308 1.00 0.00 C ATOM 599 CZ PHE A 40 1.070 5.627 -3.247 1.00 0.00 C ATOM 0 H PHE A 40 -3.285 7.120 -5.537 1.00 0.00 H new ATOM 0 HA PHE A 40 -3.450 4.723 -4.330 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -3.276 7.545 -3.314 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -3.504 6.268 -2.135 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -1.907 4.064 -3.039 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -1.067 8.230 -3.317 1.00 0.00 H new ATOM 0 HE1 PHE A 40 0.499 3.572 -3.104 1.00 0.00 H new ATOM 0 HE2 PHE A 40 1.339 7.743 -3.385 1.00 0.00 H new ATOM 0 HZ PHE A 40 2.128 5.412 -3.274 1.00 0.00 H new ATOM 609 N SER A 41 -6.197 6.433 -3.695 1.00 0.00 N ATOM 610 CA SER A 41 -7.567 6.314 -3.210 1.00 0.00 C ATOM 611 C SER A 41 -8.164 4.963 -3.590 1.00 0.00 C ATOM 612 O SER A 41 -8.818 4.310 -2.777 1.00 0.00 O ATOM 613 CB SER A 41 -8.431 7.443 -3.776 1.00 0.00 C ATOM 614 OG SER A 41 -9.652 7.557 -3.065 1.00 0.00 O ATOM 0 H SER A 41 -5.967 7.345 -4.090 1.00 0.00 H new ATOM 0 HA SER A 41 -7.548 6.390 -2.123 1.00 0.00 H new ATOM 0 HB2 SER A 41 -7.885 8.385 -3.721 1.00 0.00 H new ATOM 0 HB3 SER A 41 -8.636 7.255 -4.830 1.00 0.00 H new ATOM 0 HG SER A 41 -9.479 7.482 -2.103 1.00 0.00 H new ATOM 620 N ASP A 42 -7.932 4.549 -4.831 1.00 0.00 N ATOM 621 CA ASP A 42 -8.445 3.275 -5.321 1.00 0.00 C ATOM 622 C ASP A 42 -8.131 2.150 -4.340 1.00 0.00 C ATOM 623 O ASP A 42 -9.018 1.400 -3.935 1.00 0.00 O ATOM 624 CB ASP A 42 -7.849 2.955 -6.693 1.00 0.00 C ATOM 625 CG ASP A 42 -6.538 2.200 -6.592 1.00 0.00 C ATOM 626 OD1 ASP A 42 -5.510 2.838 -6.283 1.00 0.00 O ATOM 627 OD2 ASP A 42 -6.540 0.973 -6.824 1.00 0.00 O ATOM 0 H ASP A 42 -7.392 5.077 -5.516 1.00 0.00 H new ATOM 0 HA ASP A 42 -9.528 3.359 -5.415 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -8.562 2.364 -7.267 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -7.689 3.883 -7.242 1.00 0.00 H new ATOM 632 N GLY A 43 -6.860 2.037 -3.964 1.00 0.00 N ATOM 633 CA GLY A 43 -6.451 1.000 -3.035 1.00 0.00 C ATOM 634 C GLY A 43 -5.526 -0.017 -3.673 1.00 0.00 C ATOM 635 O GLY A 43 -4.486 -0.360 -3.109 1.00 0.00 O ATOM 0 H GLY A 43 -6.107 2.645 -4.286 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -5.950 1.458 -2.182 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -7.335 0.492 -2.650 1.00 0.00 H new ATOM 639 N VAL A 44 -5.904 -0.502 -4.851 1.00 0.00 N ATOM 640 CA VAL A 44 -5.101 -1.487 -5.566 1.00 0.00 C ATOM 641 C VAL A 44 -3.682 -0.978 -5.793 1.00 0.00 C ATOM 642 O VAL A 44 -2.761 -1.761 -6.031 1.00 0.00 O ATOM 643 CB VAL A 44 -5.731 -1.845 -6.925 1.00 0.00 C ATOM 644 CG1 VAL A 44 -4.898 -2.899 -7.639 1.00 0.00 C ATOM 645 CG2 VAL A 44 -7.163 -2.321 -6.740 1.00 0.00 C ATOM 0 H VAL A 44 -6.762 -0.229 -5.331 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.068 -2.381 -4.943 1.00 0.00 H new ATOM 0 HB VAL A 44 -5.748 -0.949 -7.545 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -5.359 -3.139 -8.597 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -3.892 -2.515 -7.806 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -4.846 -3.799 -7.026 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -7.592 -2.569 -7.711 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -7.173 -3.205 -6.102 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -7.752 -1.531 -6.275 1.00 0.00 H new ATOM 655 N LEU A 45 -3.512 0.337 -5.718 1.00 0.00 N ATOM 656 CA LEU A 45 -2.204 0.952 -5.916 1.00 0.00 C ATOM 657 C LEU A 45 -1.304 0.718 -4.706 1.00 0.00 C ATOM 658 O LEU A 45 -0.088 0.588 -4.840 1.00 0.00 O ATOM 659 CB LEU A 45 -2.357 2.453 -6.168 1.00 0.00 C ATOM 660 CG LEU A 45 -1.275 3.102 -7.032 1.00 0.00 C ATOM 661 CD1 LEU A 45 0.027 3.223 -6.254 1.00 0.00 C ATOM 662 CD2 LEU A 45 -1.062 2.303 -8.310 1.00 0.00 C ATOM 0 H LEU A 45 -4.263 0.998 -5.522 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.740 0.489 -6.787 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -3.324 2.625 -6.641 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -2.379 2.963 -5.205 1.00 0.00 H new ATOM 0 HG LEU A 45 -1.607 4.104 -7.305 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.786 3.687 -6.884 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.134 3.837 -5.368 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.364 2.231 -5.951 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.289 2.780 -8.912 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -0.752 1.289 -8.058 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -1.993 2.268 -8.876 1.00 0.00 H new ATOM 674 N VAL A 46 -1.912 0.662 -3.525 1.00 0.00 N ATOM 675 CA VAL A 46 -1.166 0.440 -2.292 1.00 0.00 C ATOM 676 C VAL A 46 -0.536 -0.948 -2.274 1.00 0.00 C ATOM 677 O VAL A 46 0.612 -1.114 -1.861 1.00 0.00 O ATOM 678 CB VAL A 46 -2.069 0.597 -1.054 1.00 0.00 C ATOM 679 CG1 VAL A 46 -1.388 0.028 0.181 1.00 0.00 C ATOM 680 CG2 VAL A 46 -2.435 2.059 -0.845 1.00 0.00 C ATOM 0 H VAL A 46 -2.918 0.767 -3.396 1.00 0.00 H new ATOM 0 HA VAL A 46 -0.380 1.194 -2.257 1.00 0.00 H new ATOM 0 HB VAL A 46 -2.988 0.036 -1.223 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -2.042 0.148 1.045 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -1.181 -1.031 0.027 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -0.452 0.558 0.357 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -3.073 2.152 0.034 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -1.527 2.644 -0.698 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -2.967 2.430 -1.721 1.00 0.00 H new ATOM 690 N ALA A 47 -1.294 -1.943 -2.724 1.00 0.00 N ATOM 691 CA ALA A 47 -0.808 -3.316 -2.762 1.00 0.00 C ATOM 692 C ALA A 47 0.413 -3.442 -3.666 1.00 0.00 C ATOM 693 O ALA A 47 1.256 -4.317 -3.467 1.00 0.00 O ATOM 694 CB ALA A 47 -1.912 -4.254 -3.229 1.00 0.00 C ATOM 0 H ALA A 47 -2.247 -1.823 -3.067 1.00 0.00 H new ATOM 0 HA ALA A 47 -0.510 -3.597 -1.752 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -1.535 -5.276 -3.253 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -2.755 -4.194 -2.541 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -2.237 -3.964 -4.228 1.00 0.00 H new ATOM 700 N GLU A 48 0.502 -2.563 -4.660 1.00 0.00 N ATOM 701 CA GLU A 48 1.620 -2.579 -5.595 1.00 0.00 C ATOM 702 C GLU A 48 2.909 -2.133 -4.909 1.00 0.00 C ATOM 703 O GLU A 48 3.944 -2.789 -5.023 1.00 0.00 O ATOM 704 CB GLU A 48 1.326 -1.671 -6.791 1.00 0.00 C ATOM 705 CG GLU A 48 0.325 -2.260 -7.770 1.00 0.00 C ATOM 706 CD GLU A 48 0.301 -1.522 -9.095 1.00 0.00 C ATOM 707 OE1 GLU A 48 1.202 -1.764 -9.925 1.00 0.00 O ATOM 708 OE2 GLU A 48 -0.619 -0.703 -9.302 1.00 0.00 O ATOM 0 H GLU A 48 -0.187 -1.832 -4.838 1.00 0.00 H new ATOM 0 HA GLU A 48 1.751 -3.602 -5.948 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.947 -0.716 -6.427 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.258 -1.464 -7.317 1.00 0.00 H new ATOM 0 HG2 GLU A 48 0.568 -3.308 -7.946 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -0.670 -2.234 -7.326 1.00 0.00 H new ATOM 715 N VAL A 49 2.837 -1.013 -4.198 1.00 0.00 N ATOM 716 CA VAL A 49 3.996 -0.479 -3.493 1.00 0.00 C ATOM 717 C VAL A 49 4.681 -1.560 -2.664 1.00 0.00 C ATOM 718 O VAL A 49 5.909 -1.645 -2.631 1.00 0.00 O ATOM 719 CB VAL A 49 3.602 0.689 -2.568 1.00 0.00 C ATOM 720 CG1 VAL A 49 4.755 1.049 -1.643 1.00 0.00 C ATOM 721 CG2 VAL A 49 3.169 1.894 -3.389 1.00 0.00 C ATOM 0 H VAL A 49 1.988 -0.457 -4.095 1.00 0.00 H new ATOM 0 HA VAL A 49 4.688 -0.114 -4.252 1.00 0.00 H new ATOM 0 HB VAL A 49 2.759 0.376 -1.953 1.00 0.00 H new ATOM 0 HG11 VAL A 49 4.459 1.876 -0.997 1.00 0.00 H new ATOM 0 HG12 VAL A 49 5.014 0.185 -1.031 1.00 0.00 H new ATOM 0 HG13 VAL A 49 5.620 1.345 -2.237 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.894 2.710 -2.721 1.00 0.00 H new ATOM 0 HG22 VAL A 49 3.991 2.212 -4.030 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.311 1.625 -4.005 1.00 0.00 H new ATOM 731 N ILE A 50 3.880 -2.384 -1.998 1.00 0.00 N ATOM 732 CA ILE A 50 4.410 -3.461 -1.171 1.00 0.00 C ATOM 733 C ILE A 50 5.116 -4.511 -2.022 1.00 0.00 C ATOM 734 O ILE A 50 6.212 -4.962 -1.688 1.00 0.00 O ATOM 735 CB ILE A 50 3.297 -4.142 -0.353 1.00 0.00 C ATOM 736 CG1 ILE A 50 2.484 -3.097 0.414 1.00 0.00 C ATOM 737 CG2 ILE A 50 3.892 -5.164 0.603 1.00 0.00 C ATOM 738 CD1 ILE A 50 1.143 -3.606 0.893 1.00 0.00 C ATOM 0 H ILE A 50 2.862 -2.327 -2.015 1.00 0.00 H new ATOM 0 HA ILE A 50 5.128 -3.009 -0.486 1.00 0.00 H new ATOM 0 HB ILE A 50 2.629 -4.662 -1.040 1.00 0.00 H new ATOM 0 HG12 ILE A 50 3.063 -2.758 1.273 1.00 0.00 H new ATOM 0 HG13 ILE A 50 2.326 -2.229 -0.227 1.00 0.00 H new ATOM 0 HG21 ILE A 50 3.093 -5.637 1.174 1.00 0.00 H new ATOM 0 HG22 ILE A 50 4.430 -5.923 0.035 1.00 0.00 H new ATOM 0 HG23 ILE A 50 4.580 -4.666 1.286 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.622 -2.812 1.428 1.00 0.00 H new ATOM 0 HD12 ILE A 50 0.545 -3.919 0.037 1.00 0.00 H new ATOM 0 HD13 ILE A 50 1.293 -4.455 1.560 1.00 0.00 H new ATOM 750 N LYS A 51 4.481 -4.895 -3.124 1.00 0.00 N ATOM 751 CA LYS A 51 5.049 -5.890 -4.026 1.00 0.00 C ATOM 752 C LYS A 51 6.559 -5.716 -4.148 1.00 0.00 C ATOM 753 O LYS A 51 7.307 -6.694 -4.169 1.00 0.00 O ATOM 754 CB LYS A 51 4.399 -5.785 -5.408 1.00 0.00 C ATOM 755 CG LYS A 51 4.763 -6.928 -6.340 1.00 0.00 C ATOM 756 CD LYS A 51 3.819 -8.107 -6.170 1.00 0.00 C ATOM 757 CE LYS A 51 4.006 -9.134 -7.276 1.00 0.00 C ATOM 758 NZ LYS A 51 5.409 -9.630 -7.341 1.00 0.00 N ATOM 0 H LYS A 51 3.573 -4.532 -3.414 1.00 0.00 H new ATOM 0 HA LYS A 51 4.848 -6.877 -3.610 1.00 0.00 H new ATOM 0 HB2 LYS A 51 3.316 -5.755 -5.289 1.00 0.00 H new ATOM 0 HB3 LYS A 51 4.696 -4.843 -5.869 1.00 0.00 H new ATOM 0 HG2 LYS A 51 4.731 -6.581 -7.373 1.00 0.00 H new ATOM 0 HG3 LYS A 51 5.786 -7.248 -6.143 1.00 0.00 H new ATOM 0 HD2 LYS A 51 3.993 -8.577 -5.202 1.00 0.00 H new ATOM 0 HD3 LYS A 51 2.788 -7.752 -6.172 1.00 0.00 H new ATOM 0 HE2 LYS A 51 3.331 -9.974 -7.110 1.00 0.00 H new ATOM 0 HE3 LYS A 51 3.733 -8.690 -8.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 5.651 -9.859 -8.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 6.054 -8.894 -6.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 5.503 -10.483 -6.754 1.00 0.00 H new ATOM 772 N PHE A 52 7.001 -4.465 -4.226 1.00 0.00 N ATOM 773 CA PHE A 52 8.423 -4.163 -4.346 1.00 0.00 C ATOM 774 C PHE A 52 9.202 -4.737 -3.166 1.00 0.00 C ATOM 775 O PHE A 52 10.185 -5.456 -3.348 1.00 0.00 O ATOM 776 CB PHE A 52 8.640 -2.650 -4.426 1.00 0.00 C ATOM 777 CG PHE A 52 10.086 -2.248 -4.371 1.00 0.00 C ATOM 778 CD1 PHE A 52 10.710 -2.025 -3.154 1.00 0.00 C ATOM 779 CD2 PHE A 52 10.821 -2.094 -5.535 1.00 0.00 C ATOM 780 CE1 PHE A 52 12.040 -1.653 -3.100 1.00 0.00 C ATOM 781 CE2 PHE A 52 12.151 -1.723 -5.487 1.00 0.00 C ATOM 782 CZ PHE A 52 12.762 -1.504 -4.268 1.00 0.00 C ATOM 0 H PHE A 52 6.395 -3.644 -4.208 1.00 0.00 H new ATOM 0 HA PHE A 52 8.791 -4.625 -5.262 1.00 0.00 H new ATOM 0 HB2 PHE A 52 8.202 -2.277 -5.352 1.00 0.00 H new ATOM 0 HB3 PHE A 52 8.106 -2.171 -3.605 1.00 0.00 H new ATOM 0 HD1 PHE A 52 10.151 -2.143 -2.238 1.00 0.00 H new ATOM 0 HD2 PHE A 52 10.349 -2.266 -6.491 1.00 0.00 H new ATOM 0 HE1 PHE A 52 12.514 -1.479 -2.145 1.00 0.00 H new ATOM 0 HE2 PHE A 52 12.712 -1.604 -6.402 1.00 0.00 H new ATOM 0 HZ PHE A 52 13.802 -1.217 -4.228 1.00 0.00 H new ATOM 792 N TYR A 53 8.755 -4.415 -1.957 1.00 0.00 N ATOM 793 CA TYR A 53 9.411 -4.896 -0.747 1.00 0.00 C ATOM 794 C TYR A 53 9.115 -6.374 -0.517 1.00 0.00 C ATOM 795 O TYR A 53 10.028 -7.191 -0.396 1.00 0.00 O ATOM 796 CB TYR A 53 8.957 -4.079 0.464 1.00 0.00 C ATOM 797 CG TYR A 53 9.352 -2.621 0.393 1.00 0.00 C ATOM 798 CD1 TYR A 53 8.678 -1.738 -0.441 1.00 0.00 C ATOM 799 CD2 TYR A 53 10.398 -2.127 1.163 1.00 0.00 C ATOM 800 CE1 TYR A 53 9.037 -0.405 -0.509 1.00 0.00 C ATOM 801 CE2 TYR A 53 10.762 -0.795 1.102 1.00 0.00 C ATOM 802 CZ TYR A 53 10.079 0.061 0.265 1.00 0.00 C ATOM 803 OH TYR A 53 10.438 1.388 0.201 1.00 0.00 O ATOM 0 H TYR A 53 7.941 -3.823 -1.789 1.00 0.00 H new ATOM 0 HA TYR A 53 10.487 -4.776 -0.876 1.00 0.00 H new ATOM 0 HB2 TYR A 53 7.873 -4.149 0.553 1.00 0.00 H new ATOM 0 HB3 TYR A 53 9.380 -4.518 1.367 1.00 0.00 H new ATOM 0 HD1 TYR A 53 7.860 -2.099 -1.046 1.00 0.00 H new ATOM 0 HD2 TYR A 53 10.935 -2.795 1.820 1.00 0.00 H new ATOM 0 HE1 TYR A 53 8.504 0.268 -1.165 1.00 0.00 H new ATOM 0 HE2 TYR A 53 11.577 -0.427 1.707 1.00 0.00 H new ATOM 0 HH TYR A 53 11.189 1.553 0.809 1.00 0.00 H new ATOM 813 N PHE A 54 7.831 -6.711 -0.458 1.00 0.00 N ATOM 814 CA PHE A 54 7.411 -8.091 -0.243 1.00 0.00 C ATOM 815 C PHE A 54 6.423 -8.533 -1.318 1.00 0.00 C ATOM 816 O PHE A 54 5.213 -8.335 -1.204 1.00 0.00 O ATOM 817 CB PHE A 54 6.778 -8.244 1.142 1.00 0.00 C ATOM 818 CG PHE A 54 7.479 -7.456 2.212 1.00 0.00 C ATOM 819 CD1 PHE A 54 8.854 -7.538 2.363 1.00 0.00 C ATOM 820 CD2 PHE A 54 6.763 -6.632 3.065 1.00 0.00 C ATOM 821 CE1 PHE A 54 9.502 -6.814 3.346 1.00 0.00 C ATOM 822 CE2 PHE A 54 7.405 -5.905 4.050 1.00 0.00 C ATOM 823 CZ PHE A 54 8.776 -5.997 4.191 1.00 0.00 C ATOM 0 H PHE A 54 7.063 -6.047 -0.556 1.00 0.00 H new ATOM 0 HA PHE A 54 8.294 -8.727 -0.303 1.00 0.00 H new ATOM 0 HB2 PHE A 54 5.736 -7.928 1.093 1.00 0.00 H new ATOM 0 HB3 PHE A 54 6.779 -9.298 1.419 1.00 0.00 H new ATOM 0 HD1 PHE A 54 9.426 -8.175 1.705 1.00 0.00 H new ATOM 0 HD2 PHE A 54 5.691 -6.557 2.959 1.00 0.00 H new ATOM 0 HE1 PHE A 54 10.574 -6.887 3.453 1.00 0.00 H new ATOM 0 HE2 PHE A 54 6.835 -5.266 4.708 1.00 0.00 H new ATOM 0 HZ PHE A 54 9.280 -5.431 4.961 1.00 0.00 H new ATOM 833 N PRO A 55 6.948 -9.148 -2.388 1.00 0.00 N ATOM 834 CA PRO A 55 6.131 -9.631 -3.504 1.00 0.00 C ATOM 835 C PRO A 55 5.271 -10.829 -3.117 1.00 0.00 C ATOM 836 O PRO A 55 4.135 -10.965 -3.573 1.00 0.00 O ATOM 837 CB PRO A 55 7.168 -10.035 -4.555 1.00 0.00 C ATOM 838 CG PRO A 55 8.398 -10.345 -3.773 1.00 0.00 C ATOM 839 CD PRO A 55 8.382 -9.418 -2.590 1.00 0.00 C ATOM 0 HA PRO A 55 5.426 -8.875 -3.850 1.00 0.00 H new ATOM 0 HB2 PRO A 55 6.835 -10.900 -5.128 1.00 0.00 H new ATOM 0 HB3 PRO A 55 7.344 -9.229 -5.268 1.00 0.00 H new ATOM 0 HG2 PRO A 55 8.404 -11.387 -3.452 1.00 0.00 H new ATOM 0 HG3 PRO A 55 9.293 -10.192 -4.376 1.00 0.00 H new ATOM 0 HD2 PRO A 55 8.832 -9.880 -1.711 1.00 0.00 H new ATOM 0 HD3 PRO A 55 8.939 -8.503 -2.789 1.00 0.00 H new ATOM 847 N LYS A 56 5.819 -11.696 -2.273 1.00 0.00 N ATOM 848 CA LYS A 56 5.102 -12.883 -1.822 1.00 0.00 C ATOM 849 C LYS A 56 3.828 -12.499 -1.076 1.00 0.00 C ATOM 850 O LYS A 56 2.749 -13.015 -1.365 1.00 0.00 O ATOM 851 CB LYS A 56 5.998 -13.733 -0.917 1.00 0.00 C ATOM 852 CG LYS A 56 6.594 -12.961 0.247 1.00 0.00 C ATOM 853 CD LYS A 56 7.772 -13.699 0.860 1.00 0.00 C ATOM 854 CE LYS A 56 7.313 -14.882 1.699 1.00 0.00 C ATOM 855 NZ LYS A 56 7.053 -14.493 3.112 1.00 0.00 N ATOM 0 H LYS A 56 6.758 -11.599 -1.887 1.00 0.00 H new ATOM 0 HA LYS A 56 4.826 -13.465 -2.701 1.00 0.00 H new ATOM 0 HB2 LYS A 56 5.418 -14.570 -0.528 1.00 0.00 H new ATOM 0 HB3 LYS A 56 6.806 -14.156 -1.514 1.00 0.00 H new ATOM 0 HG2 LYS A 56 6.917 -11.978 -0.095 1.00 0.00 H new ATOM 0 HG3 LYS A 56 5.830 -12.799 1.007 1.00 0.00 H new ATOM 0 HD2 LYS A 56 8.435 -14.048 0.069 1.00 0.00 H new ATOM 0 HD3 LYS A 56 8.349 -13.014 1.481 1.00 0.00 H new ATOM 0 HE2 LYS A 56 6.406 -15.304 1.266 1.00 0.00 H new ATOM 0 HE3 LYS A 56 8.073 -15.663 1.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 6.742 -15.327 3.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 7.925 -14.114 3.534 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 6.310 -13.766 3.141 1.00 0.00 H new ATOM 869 N MET A 57 3.961 -11.588 -0.117 1.00 0.00 N ATOM 870 CA MET A 57 2.819 -11.133 0.667 1.00 0.00 C ATOM 871 C MET A 57 1.648 -10.766 -0.239 1.00 0.00 C ATOM 872 O MET A 57 0.530 -11.246 -0.051 1.00 0.00 O ATOM 873 CB MET A 57 3.211 -9.930 1.527 1.00 0.00 C ATOM 874 CG MET A 57 3.913 -10.310 2.820 1.00 0.00 C ATOM 875 SD MET A 57 2.762 -10.596 4.178 1.00 0.00 S ATOM 876 CE MET A 57 2.686 -8.962 4.908 1.00 0.00 C ATOM 0 H MET A 57 4.847 -11.151 0.135 1.00 0.00 H new ATOM 0 HA MET A 57 2.508 -11.950 1.318 1.00 0.00 H new ATOM 0 HB2 MET A 57 3.863 -9.277 0.948 1.00 0.00 H new ATOM 0 HB3 MET A 57 2.315 -9.356 1.765 1.00 0.00 H new ATOM 0 HG2 MET A 57 4.506 -11.210 2.656 1.00 0.00 H new ATOM 0 HG3 MET A 57 4.607 -9.517 3.098 1.00 0.00 H new ATOM 0 HE1 MET A 57 3.121 -8.989 5.907 1.00 0.00 H new ATOM 0 HE2 MET A 57 3.244 -8.260 4.288 1.00 0.00 H new ATOM 0 HE3 MET A 57 1.646 -8.641 4.974 1.00 0.00 H new ATOM 886 N VAL A 58 1.912 -9.911 -1.222 1.00 0.00 N ATOM 887 CA VAL A 58 0.881 -9.480 -2.158 1.00 0.00 C ATOM 888 C VAL A 58 0.422 -10.636 -3.041 1.00 0.00 C ATOM 889 O VAL A 58 1.206 -11.523 -3.375 1.00 0.00 O ATOM 890 CB VAL A 58 1.381 -8.331 -3.054 1.00 0.00 C ATOM 891 CG1 VAL A 58 0.258 -7.822 -3.946 1.00 0.00 C ATOM 892 CG2 VAL A 58 1.951 -7.205 -2.207 1.00 0.00 C ATOM 0 H VAL A 58 2.832 -9.503 -1.391 1.00 0.00 H new ATOM 0 HA VAL A 58 0.040 -9.126 -1.562 1.00 0.00 H new ATOM 0 HB VAL A 58 2.177 -8.712 -3.694 1.00 0.00 H new ATOM 0 HG11 VAL A 58 0.630 -7.011 -4.572 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -0.100 -8.634 -4.579 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -0.561 -7.456 -3.327 1.00 0.00 H new ATOM 0 HG21 VAL A 58 2.299 -6.402 -2.856 1.00 0.00 H new ATOM 0 HG22 VAL A 58 1.177 -6.823 -1.541 1.00 0.00 H new ATOM 0 HG23 VAL A 58 2.786 -7.581 -1.616 1.00 0.00 H new ATOM 902 N GLU A 59 -0.853 -10.617 -3.415 1.00 0.00 N ATOM 903 CA GLU A 59 -1.417 -11.664 -4.259 1.00 0.00 C ATOM 904 C GLU A 59 -1.932 -11.085 -5.574 1.00 0.00 C ATOM 905 O GLU A 59 -1.744 -11.672 -6.639 1.00 0.00 O ATOM 906 CB GLU A 59 -2.550 -12.385 -3.527 1.00 0.00 C ATOM 907 CG GLU A 59 -2.066 -13.425 -2.530 1.00 0.00 C ATOM 908 CD GLU A 59 -1.675 -14.731 -3.192 1.00 0.00 C ATOM 909 OE1 GLU A 59 -2.493 -15.271 -3.967 1.00 0.00 O ATOM 910 OE2 GLU A 59 -0.552 -15.214 -2.936 1.00 0.00 O ATOM 0 H GLU A 59 -1.515 -9.889 -3.147 1.00 0.00 H new ATOM 0 HA GLU A 59 -0.626 -12.380 -4.483 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -3.160 -11.648 -3.004 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -3.195 -12.869 -4.260 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -1.210 -13.028 -1.984 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -2.851 -13.614 -1.798 1.00 0.00 H new ATOM 917 N MET A 60 -2.584 -9.930 -5.489 1.00 0.00 N ATOM 918 CA MET A 60 -3.127 -9.271 -6.671 1.00 0.00 C ATOM 919 C MET A 60 -3.921 -10.254 -7.526 1.00 0.00 C ATOM 920 O MET A 60 -3.756 -10.306 -8.745 1.00 0.00 O ATOM 921 CB MET A 60 -2.000 -8.652 -7.499 1.00 0.00 C ATOM 922 CG MET A 60 -1.560 -7.284 -7.002 1.00 0.00 C ATOM 923 SD MET A 60 -2.788 -6.003 -7.319 1.00 0.00 S ATOM 924 CE MET A 60 -3.670 -5.985 -5.761 1.00 0.00 C ATOM 0 H MET A 60 -2.749 -9.431 -4.615 1.00 0.00 H new ATOM 0 HA MET A 60 -3.800 -8.481 -6.338 1.00 0.00 H new ATOM 0 HB2 MET A 60 -1.143 -9.325 -7.491 1.00 0.00 H new ATOM 0 HB3 MET A 60 -2.327 -8.565 -8.535 1.00 0.00 H new ATOM 0 HG2 MET A 60 -1.363 -7.337 -5.931 1.00 0.00 H new ATOM 0 HG3 MET A 60 -0.622 -7.010 -7.485 1.00 0.00 H new ATOM 0 HE1 MET A 60 -3.903 -4.956 -5.487 1.00 0.00 H new ATOM 0 HE2 MET A 60 -4.595 -6.553 -5.860 1.00 0.00 H new ATOM 0 HE3 MET A 60 -3.049 -6.435 -4.986 1.00 0.00 H new ATOM 934 N HIS A 61 -4.781 -11.034 -6.878 1.00 0.00 N ATOM 935 CA HIS A 61 -5.601 -12.015 -7.580 1.00 0.00 C ATOM 936 C HIS A 61 -7.077 -11.830 -7.245 1.00 0.00 C ATOM 937 O HIS A 61 -7.950 -12.121 -8.061 1.00 0.00 O ATOM 938 CB HIS A 61 -5.157 -13.433 -7.217 1.00 0.00 C ATOM 939 CG HIS A 61 -6.063 -14.499 -7.752 1.00 0.00 C ATOM 940 ND1 HIS A 61 -6.817 -15.323 -6.942 1.00 0.00 N ATOM 941 CD2 HIS A 61 -6.336 -14.873 -9.024 1.00 0.00 C ATOM 942 CE1 HIS A 61 -7.512 -16.158 -7.693 1.00 0.00 C ATOM 943 NE2 HIS A 61 -7.239 -15.906 -8.961 1.00 0.00 N ATOM 0 H HIS A 61 -4.928 -11.006 -5.869 1.00 0.00 H new ATOM 0 HA HIS A 61 -5.469 -11.863 -8.651 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -4.150 -13.598 -7.599 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -5.105 -13.522 -6.132 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -5.921 -14.440 -9.922 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -8.189 -16.918 -7.332 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -7.634 -16.398 -9.762 1.00 0.00 H new ATOM 952 N ASN A 62 -7.349 -11.344 -6.038 1.00 0.00 N ATOM 953 CA ASN A 62 -8.720 -11.121 -5.594 1.00 0.00 C ATOM 954 C ASN A 62 -9.145 -9.678 -5.847 1.00 0.00 C ATOM 955 O ASN A 62 -10.199 -9.423 -6.430 1.00 0.00 O ATOM 956 CB ASN A 62 -8.857 -11.452 -4.106 1.00 0.00 C ATOM 957 CG ASN A 62 -8.274 -12.808 -3.760 1.00 0.00 C ATOM 958 OD1 ASN A 62 -8.859 -13.845 -4.071 1.00 0.00 O ATOM 959 ND2 ASN A 62 -7.115 -12.805 -3.112 1.00 0.00 N ATOM 0 H ASN A 62 -6.638 -11.097 -5.350 1.00 0.00 H new ATOM 0 HA ASN A 62 -9.373 -11.779 -6.167 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -8.356 -10.683 -3.518 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -9.911 -11.431 -3.827 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -6.674 -13.687 -2.852 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -6.666 -11.921 -2.875 1.00 0.00 H new ATOM 966 N TYR A 63 -8.319 -8.737 -5.404 1.00 0.00 N ATOM 967 CA TYR A 63 -8.610 -7.319 -5.580 1.00 0.00 C ATOM 968 C TYR A 63 -8.769 -6.975 -7.058 1.00 0.00 C ATOM 969 O TYR A 63 -8.028 -7.471 -7.907 1.00 0.00 O ATOM 970 CB TYR A 63 -7.498 -6.468 -4.965 1.00 0.00 C ATOM 971 CG TYR A 63 -7.162 -6.849 -3.540 1.00 0.00 C ATOM 972 CD1 TYR A 63 -8.087 -6.673 -2.518 1.00 0.00 C ATOM 973 CD2 TYR A 63 -5.922 -7.384 -3.217 1.00 0.00 C ATOM 974 CE1 TYR A 63 -7.784 -7.019 -1.215 1.00 0.00 C ATOM 975 CE2 TYR A 63 -5.611 -7.734 -1.917 1.00 0.00 C ATOM 976 CZ TYR A 63 -6.545 -7.549 -0.919 1.00 0.00 C ATOM 977 OH TYR A 63 -6.241 -7.895 0.377 1.00 0.00 O ATOM 0 H TYR A 63 -7.442 -8.930 -4.920 1.00 0.00 H new ATOM 0 HA TYR A 63 -9.549 -7.101 -5.071 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -6.601 -6.559 -5.578 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -7.797 -5.420 -4.991 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -9.058 -6.259 -2.746 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -5.188 -7.529 -3.996 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -8.514 -6.875 -0.432 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -4.642 -8.150 -1.684 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.330 -8.254 0.415 1.00 0.00 H new ATOM 987 N VAL A 64 -9.743 -6.122 -7.359 1.00 0.00 N ATOM 988 CA VAL A 64 -10.000 -5.709 -8.733 1.00 0.00 C ATOM 989 C VAL A 64 -10.203 -4.200 -8.825 1.00 0.00 C ATOM 990 O VAL A 64 -10.968 -3.604 -8.067 1.00 0.00 O ATOM 991 CB VAL A 64 -11.240 -6.418 -9.309 1.00 0.00 C ATOM 992 CG1 VAL A 64 -11.561 -5.889 -10.699 1.00 0.00 C ATOM 993 CG2 VAL A 64 -11.026 -7.924 -9.339 1.00 0.00 C ATOM 0 H VAL A 64 -10.367 -5.704 -6.669 1.00 0.00 H new ATOM 0 HA VAL A 64 -9.124 -5.991 -9.317 1.00 0.00 H new ATOM 0 HB VAL A 64 -12.091 -6.207 -8.661 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -12.440 -6.402 -11.089 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -11.760 -4.819 -10.644 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -10.713 -6.067 -11.361 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -11.912 -8.409 -9.749 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.163 -8.157 -9.963 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -10.849 -8.287 -8.326 1.00 0.00 H new ATOM 1003 N PRO A 65 -9.501 -3.566 -9.776 1.00 0.00 N ATOM 1004 CA PRO A 65 -9.587 -2.119 -9.991 1.00 0.00 C ATOM 1005 C PRO A 65 -10.935 -1.697 -10.567 1.00 0.00 C ATOM 1006 O PRO A 65 -11.337 -2.162 -11.633 1.00 0.00 O ATOM 1007 CB PRO A 65 -8.466 -1.841 -10.995 1.00 0.00 C ATOM 1008 CG PRO A 65 -8.277 -3.131 -11.717 1.00 0.00 C ATOM 1009 CD PRO A 65 -8.569 -4.213 -10.715 1.00 0.00 C ATOM 0 HA PRO A 65 -9.490 -1.563 -9.059 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -8.739 -1.039 -11.681 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -7.551 -1.531 -10.491 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -8.948 -3.201 -12.573 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -7.260 -3.218 -12.100 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -9.017 -5.088 -11.187 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -7.663 -4.551 -10.213 1.00 0.00 H new ATOM 1017 N ALA A 66 -11.628 -0.814 -9.855 1.00 0.00 N ATOM 1018 CA ALA A 66 -12.929 -0.329 -10.297 1.00 0.00 C ATOM 1019 C ALA A 66 -13.022 1.188 -10.168 1.00 0.00 C ATOM 1020 O ALA A 66 -12.087 1.839 -9.705 1.00 0.00 O ATOM 1021 CB ALA A 66 -14.040 -0.997 -9.501 1.00 0.00 C ATOM 0 H ALA A 66 -11.310 -0.420 -8.970 1.00 0.00 H new ATOM 0 HA ALA A 66 -13.046 -0.586 -11.350 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -15.006 -0.625 -9.842 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -13.994 -2.076 -9.648 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -13.917 -0.769 -8.442 1.00 0.00 H new ATOM 1027 N ASN A 67 -14.156 1.744 -10.582 1.00 0.00 N ATOM 1028 CA ASN A 67 -14.370 3.185 -10.514 1.00 0.00 C ATOM 1029 C ASN A 67 -15.661 3.508 -9.769 1.00 0.00 C ATOM 1030 O ASN A 67 -16.394 4.423 -10.144 1.00 0.00 O ATOM 1031 CB ASN A 67 -14.417 3.782 -11.922 1.00 0.00 C ATOM 1032 CG ASN A 67 -15.477 3.131 -12.790 1.00 0.00 C ATOM 1033 OD1 ASN A 67 -16.631 2.993 -12.382 1.00 0.00 O ATOM 1034 ND2 ASN A 67 -15.090 2.728 -13.995 1.00 0.00 N ATOM 0 H ASN A 67 -14.941 1.219 -10.968 1.00 0.00 H new ATOM 0 HA ASN A 67 -13.536 3.626 -9.968 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -14.614 4.852 -11.854 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -13.442 3.667 -12.396 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -15.759 2.284 -14.624 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -14.123 2.863 -14.292 1.00 0.00 H new ATOM 1041 N SER A 68 -15.933 2.751 -8.710 1.00 0.00 N ATOM 1042 CA SER A 68 -17.137 2.955 -7.914 1.00 0.00 C ATOM 1043 C SER A 68 -16.834 2.814 -6.425 1.00 0.00 C ATOM 1044 O SER A 68 -16.218 1.838 -5.995 1.00 0.00 O ATOM 1045 CB SER A 68 -18.220 1.954 -8.322 1.00 0.00 C ATOM 1046 OG SER A 68 -19.513 2.461 -8.045 1.00 0.00 O ATOM 0 H SER A 68 -15.336 1.991 -8.384 1.00 0.00 H new ATOM 0 HA SER A 68 -17.498 3.966 -8.100 1.00 0.00 H new ATOM 0 HB2 SER A 68 -18.133 1.733 -9.386 1.00 0.00 H new ATOM 0 HB3 SER A 68 -18.072 1.015 -7.788 1.00 0.00 H new ATOM 0 HG SER A 68 -20.187 1.804 -8.316 1.00 0.00 H new ATOM 1052 N LEU A 69 -17.270 3.795 -5.644 1.00 0.00 N ATOM 1053 CA LEU A 69 -17.047 3.782 -4.202 1.00 0.00 C ATOM 1054 C LEU A 69 -17.364 2.411 -3.614 1.00 0.00 C ATOM 1055 O LEU A 69 -16.570 1.851 -2.859 1.00 0.00 O ATOM 1056 CB LEU A 69 -17.904 4.852 -3.523 1.00 0.00 C ATOM 1057 CG LEU A 69 -17.988 4.777 -1.998 1.00 0.00 C ATOM 1058 CD1 LEU A 69 -16.637 5.085 -1.373 1.00 0.00 C ATOM 1059 CD2 LEU A 69 -19.051 5.733 -1.475 1.00 0.00 C ATOM 0 H LEU A 69 -17.780 4.610 -5.984 1.00 0.00 H new ATOM 0 HA LEU A 69 -15.995 4.000 -4.020 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -17.512 5.831 -3.797 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -18.915 4.789 -3.926 1.00 0.00 H new ATOM 0 HG LEU A 69 -18.271 3.762 -1.718 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -16.717 5.027 -0.287 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -15.901 4.361 -1.722 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -16.323 6.089 -1.661 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -19.097 5.666 -0.388 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -18.798 6.753 -1.766 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -20.020 5.465 -1.896 1.00 0.00 H new ATOM 1071 N GLN A 70 -18.529 1.877 -3.967 1.00 0.00 N ATOM 1072 CA GLN A 70 -18.950 0.571 -3.475 1.00 0.00 C ATOM 1073 C GLN A 70 -17.785 -0.414 -3.477 1.00 0.00 C ATOM 1074 O GLN A 70 -17.430 -0.971 -2.439 1.00 0.00 O ATOM 1075 CB GLN A 70 -20.095 0.025 -4.330 1.00 0.00 C ATOM 1076 CG GLN A 70 -20.844 -1.127 -3.680 1.00 0.00 C ATOM 1077 CD GLN A 70 -21.530 -2.023 -4.693 1.00 0.00 C ATOM 1078 OE1 GLN A 70 -20.879 -2.798 -5.395 1.00 0.00 O ATOM 1079 NE2 GLN A 70 -22.851 -1.922 -4.774 1.00 0.00 N ATOM 0 H GLN A 70 -19.197 2.328 -4.591 1.00 0.00 H new ATOM 0 HA GLN A 70 -19.297 0.693 -2.449 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -20.797 0.832 -4.540 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -19.695 -0.307 -5.288 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -20.147 -1.721 -3.089 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -21.588 -0.728 -2.990 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -23.350 -1.266 -4.173 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -23.367 -2.500 -5.437 1.00 0.00 H new ATOM 1088 N GLN A 71 -17.195 -0.622 -4.649 1.00 0.00 N ATOM 1089 CA GLN A 71 -16.070 -1.540 -4.786 1.00 0.00 C ATOM 1090 C GLN A 71 -14.849 -1.019 -4.036 1.00 0.00 C ATOM 1091 O GLN A 71 -14.172 -1.770 -3.332 1.00 0.00 O ATOM 1092 CB GLN A 71 -15.728 -1.745 -6.262 1.00 0.00 C ATOM 1093 CG GLN A 71 -16.538 -2.845 -6.928 1.00 0.00 C ATOM 1094 CD GLN A 71 -16.497 -4.149 -6.155 1.00 0.00 C ATOM 1095 OE1 GLN A 71 -17.535 -4.685 -5.764 1.00 0.00 O ATOM 1096 NE2 GLN A 71 -15.296 -4.667 -5.931 1.00 0.00 N ATOM 0 H GLN A 71 -17.477 -0.168 -5.518 1.00 0.00 H new ATOM 0 HA GLN A 71 -16.359 -2.497 -4.352 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -15.892 -0.810 -6.797 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -14.668 -1.982 -6.351 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -17.573 -2.519 -7.028 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -16.157 -3.012 -7.936 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -14.462 -4.189 -6.273 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -15.206 -5.543 -5.417 1.00 0.00 H new ATOM 1105 N LYS A 72 -14.571 0.271 -4.191 1.00 0.00 N ATOM 1106 CA LYS A 72 -13.431 0.893 -3.528 1.00 0.00 C ATOM 1107 C LYS A 72 -13.343 0.454 -2.070 1.00 0.00 C ATOM 1108 O LYS A 72 -12.383 -0.204 -1.666 1.00 0.00 O ATOM 1109 CB LYS A 72 -13.540 2.418 -3.606 1.00 0.00 C ATOM 1110 CG LYS A 72 -13.513 2.957 -5.026 1.00 0.00 C ATOM 1111 CD LYS A 72 -12.092 3.229 -5.492 1.00 0.00 C ATOM 1112 CE LYS A 72 -12.035 3.474 -6.992 1.00 0.00 C ATOM 1113 NZ LYS A 72 -12.668 4.768 -7.367 1.00 0.00 N ATOM 0 H LYS A 72 -15.120 0.906 -4.770 1.00 0.00 H new ATOM 0 HA LYS A 72 -12.525 0.572 -4.041 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -14.466 2.733 -3.124 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -12.720 2.862 -3.042 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -13.986 2.240 -5.697 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -14.096 3.876 -5.078 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -11.695 4.097 -4.965 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -11.456 2.382 -5.236 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -10.996 3.469 -7.322 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -12.538 2.659 -7.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -12.609 4.898 -8.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -13.666 4.763 -7.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -12.172 5.548 -6.891 1.00 0.00 H new ATOM 1127 N LEU A 73 -14.350 0.819 -1.285 1.00 0.00 N ATOM 1128 CA LEU A 73 -14.387 0.461 0.129 1.00 0.00 C ATOM 1129 C LEU A 73 -14.285 -1.050 0.311 1.00 0.00 C ATOM 1130 O LEU A 73 -13.504 -1.535 1.130 1.00 0.00 O ATOM 1131 CB LEU A 73 -15.674 0.978 0.773 1.00 0.00 C ATOM 1132 CG LEU A 73 -15.633 2.413 1.298 1.00 0.00 C ATOM 1133 CD1 LEU A 73 -17.012 2.849 1.770 1.00 0.00 C ATOM 1134 CD2 LEU A 73 -14.618 2.540 2.425 1.00 0.00 C ATOM 0 H LEU A 73 -15.152 1.363 -1.603 1.00 0.00 H new ATOM 0 HA LEU A 73 -13.531 0.926 0.618 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -16.478 0.903 0.041 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -15.933 0.317 1.600 1.00 0.00 H new ATOM 0 HG LEU A 73 -15.326 3.068 0.483 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -16.963 3.873 2.140 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -17.715 2.797 0.938 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -17.348 2.190 2.570 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -14.602 3.568 2.786 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.895 1.873 3.241 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -13.629 2.270 2.056 1.00 0.00 H new ATOM 1146 N SER A 74 -15.077 -1.788 -0.460 1.00 0.00 N ATOM 1147 CA SER A 74 -15.077 -3.244 -0.383 1.00 0.00 C ATOM 1148 C SER A 74 -13.659 -3.795 -0.501 1.00 0.00 C ATOM 1149 O SER A 74 -13.314 -4.792 0.131 1.00 0.00 O ATOM 1150 CB SER A 74 -15.959 -3.834 -1.485 1.00 0.00 C ATOM 1151 OG SER A 74 -16.452 -5.111 -1.116 1.00 0.00 O ATOM 0 H SER A 74 -15.727 -1.402 -1.145 1.00 0.00 H new ATOM 0 HA SER A 74 -15.480 -3.532 0.588 1.00 0.00 H new ATOM 0 HB2 SER A 74 -16.794 -3.163 -1.685 1.00 0.00 H new ATOM 0 HB3 SER A 74 -15.386 -3.915 -2.409 1.00 0.00 H new ATOM 0 HG SER A 74 -17.014 -5.465 -1.836 1.00 0.00 H new ATOM 1157 N ASN A 75 -12.842 -3.137 -1.317 1.00 0.00 N ATOM 1158 CA ASN A 75 -11.461 -3.559 -1.520 1.00 0.00 C ATOM 1159 C ASN A 75 -10.602 -3.212 -0.307 1.00 0.00 C ATOM 1160 O ASN A 75 -9.868 -4.055 0.208 1.00 0.00 O ATOM 1161 CB ASN A 75 -10.883 -2.900 -2.774 1.00 0.00 C ATOM 1162 CG ASN A 75 -11.420 -3.517 -4.051 1.00 0.00 C ATOM 1163 OD1 ASN A 75 -12.108 -4.537 -4.019 1.00 0.00 O ATOM 1164 ND2 ASN A 75 -11.107 -2.899 -5.184 1.00 0.00 N ATOM 0 H ASN A 75 -13.112 -2.309 -1.848 1.00 0.00 H new ATOM 0 HA ASN A 75 -11.454 -4.641 -1.651 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -11.116 -1.835 -2.762 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -9.797 -2.988 -2.760 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -11.440 -3.268 -6.075 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -10.534 -2.056 -5.163 1.00 0.00 H new ATOM 1171 N TRP A 76 -10.700 -1.967 0.143 1.00 0.00 N ATOM 1172 CA TRP A 76 -9.933 -1.508 1.295 1.00 0.00 C ATOM 1173 C TRP A 76 -10.214 -2.375 2.517 1.00 0.00 C ATOM 1174 O TRP A 76 -9.293 -2.829 3.194 1.00 0.00 O ATOM 1175 CB TRP A 76 -10.263 -0.047 1.605 1.00 0.00 C ATOM 1176 CG TRP A 76 -9.401 0.927 0.859 1.00 0.00 C ATOM 1177 CD1 TRP A 76 -9.685 1.526 -0.335 1.00 0.00 C ATOM 1178 CD2 TRP A 76 -8.115 1.413 1.258 1.00 0.00 C ATOM 1179 NE1 TRP A 76 -8.653 2.355 -0.702 1.00 0.00 N ATOM 1180 CE2 TRP A 76 -7.678 2.304 0.259 1.00 0.00 C ATOM 1181 CE3 TRP A 76 -7.291 1.184 2.363 1.00 0.00 C ATOM 1182 CZ2 TRP A 76 -6.453 2.963 0.333 1.00 0.00 C ATOM 1183 CZ3 TRP A 76 -6.076 1.839 2.435 1.00 0.00 C ATOM 1184 CH2 TRP A 76 -5.667 2.720 1.426 1.00 0.00 C ATOM 0 H TRP A 76 -11.303 -1.257 -0.272 1.00 0.00 H new ATOM 0 HA TRP A 76 -8.874 -1.590 1.050 1.00 0.00 H new ATOM 0 HB2 TRP A 76 -11.308 0.142 1.360 1.00 0.00 H new ATOM 0 HB3 TRP A 76 -10.150 0.124 2.676 1.00 0.00 H new ATOM 0 HD1 TRP A 76 -10.588 1.371 -0.907 1.00 0.00 H new ATOM 0 HE1 TRP A 76 -8.618 2.917 -1.552 1.00 0.00 H new ATOM 0 HE3 TRP A 76 -7.598 0.507 3.147 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 -6.135 3.642 -0.445 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 -5.431 1.668 3.284 1.00 0.00 H new ATOM 0 HH2 TRP A 76 -4.712 3.217 1.513 1.00 0.00 H new ATOM 1195 N GLY A 77 -11.495 -2.603 2.793 1.00 0.00 N ATOM 1196 CA GLY A 77 -11.874 -3.416 3.934 1.00 0.00 C ATOM 1197 C GLY A 77 -11.030 -4.669 4.060 1.00 0.00 C ATOM 1198 O GLY A 77 -10.488 -4.957 5.128 1.00 0.00 O ATOM 0 H GLY A 77 -12.276 -2.239 2.247 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -11.779 -2.825 4.845 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -12.923 -3.696 3.844 1.00 0.00 H new ATOM 1202 N HIS A 78 -10.918 -5.417 2.967 1.00 0.00 N ATOM 1203 CA HIS A 78 -10.134 -6.648 2.960 1.00 0.00 C ATOM 1204 C HIS A 78 -8.655 -6.351 3.188 1.00 0.00 C ATOM 1205 O HIS A 78 -8.009 -6.975 4.030 1.00 0.00 O ATOM 1206 CB HIS A 78 -10.319 -7.387 1.635 1.00 0.00 C ATOM 1207 CG HIS A 78 -11.495 -8.315 1.626 1.00 0.00 C ATOM 1208 ND1 HIS A 78 -11.371 -9.687 1.582 1.00 0.00 N ATOM 1209 CD2 HIS A 78 -12.824 -8.060 1.657 1.00 0.00 C ATOM 1210 CE1 HIS A 78 -12.572 -10.237 1.585 1.00 0.00 C ATOM 1211 NE2 HIS A 78 -13.472 -9.271 1.631 1.00 0.00 N ATOM 0 H HIS A 78 -11.360 -5.193 2.075 1.00 0.00 H new ATOM 0 HA HIS A 78 -10.489 -7.281 3.773 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -10.437 -6.657 0.834 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -9.416 -7.956 1.417 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -13.289 -7.086 1.695 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -12.782 -11.296 1.555 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -14.483 -9.403 1.645 1.00 0.00 H new ATOM 1220 N LEU A 79 -8.125 -5.395 2.433 1.00 0.00 N ATOM 1221 CA LEU A 79 -6.722 -5.015 2.552 1.00 0.00 C ATOM 1222 C LEU A 79 -6.374 -4.664 3.995 1.00 0.00 C ATOM 1223 O LEU A 79 -5.201 -4.601 4.363 1.00 0.00 O ATOM 1224 CB LEU A 79 -6.415 -3.828 1.638 1.00 0.00 C ATOM 1225 CG LEU A 79 -4.968 -3.707 1.159 1.00 0.00 C ATOM 1226 CD1 LEU A 79 -4.744 -4.554 -0.084 1.00 0.00 C ATOM 1227 CD2 LEU A 79 -4.617 -2.252 0.884 1.00 0.00 C ATOM 0 H LEU A 79 -8.646 -4.869 1.732 1.00 0.00 H new ATOM 0 HA LEU A 79 -6.113 -5.866 2.247 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -7.062 -3.892 0.763 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -6.680 -2.911 2.165 1.00 0.00 H new ATOM 0 HG LEU A 79 -4.313 -4.076 1.948 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -3.709 -4.455 -0.410 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -4.954 -5.599 0.145 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -5.409 -4.216 -0.879 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -3.584 -2.185 0.544 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -5.279 -1.858 0.113 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -4.737 -1.670 1.798 1.00 0.00 H new ATOM 1239 N ASN A 80 -7.400 -4.438 4.808 1.00 0.00 N ATOM 1240 CA ASN A 80 -7.203 -4.095 6.211 1.00 0.00 C ATOM 1241 C ASN A 80 -7.022 -5.351 7.059 1.00 0.00 C ATOM 1242 O ASN A 80 -6.354 -5.324 8.092 1.00 0.00 O ATOM 1243 CB ASN A 80 -8.390 -3.282 6.731 1.00 0.00 C ATOM 1244 CG ASN A 80 -8.171 -2.777 8.144 1.00 0.00 C ATOM 1245 OD1 ASN A 80 -7.781 -3.534 9.033 1.00 0.00 O ATOM 1246 ND2 ASN A 80 -8.421 -1.490 8.358 1.00 0.00 N ATOM 0 H ASN A 80 -8.377 -4.486 4.519 1.00 0.00 H new ATOM 0 HA ASN A 80 -6.298 -3.493 6.288 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -8.564 -2.434 6.068 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -9.289 -3.898 6.704 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -8.291 -1.093 9.289 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -8.743 -0.899 7.592 1.00 0.00 H new ATOM 1253 N ARG A 81 -7.623 -6.450 6.613 1.00 0.00 N ATOM 1254 CA ARG A 81 -7.529 -7.715 7.330 1.00 0.00 C ATOM 1255 C ARG A 81 -6.689 -8.722 6.549 1.00 0.00 C ATOM 1256 O ARG A 81 -6.555 -9.879 6.948 1.00 0.00 O ATOM 1257 CB ARG A 81 -8.925 -8.287 7.583 1.00 0.00 C ATOM 1258 CG ARG A 81 -9.656 -7.621 8.737 1.00 0.00 C ATOM 1259 CD ARG A 81 -10.685 -8.554 9.357 1.00 0.00 C ATOM 1260 NE ARG A 81 -11.772 -8.863 8.432 1.00 0.00 N ATOM 1261 CZ ARG A 81 -12.650 -9.839 8.631 1.00 0.00 C ATOM 1262 NH1 ARG A 81 -12.571 -10.596 9.716 1.00 0.00 N ATOM 1263 NH2 ARG A 81 -13.612 -10.058 7.743 1.00 0.00 N ATOM 0 H ARG A 81 -8.180 -6.489 5.759 1.00 0.00 H new ATOM 0 HA ARG A 81 -7.042 -7.526 8.287 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -9.521 -8.181 6.677 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -8.840 -9.355 7.786 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -8.937 -7.315 9.496 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -10.150 -6.716 8.383 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -10.197 -9.479 9.664 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -11.094 -8.095 10.257 1.00 0.00 H new ATOM 0 HE ARG A 81 -11.862 -8.298 7.587 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -11.834 -10.430 10.401 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -13.247 -11.345 9.866 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -13.677 -9.476 6.908 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -14.286 -10.808 7.896 1.00 0.00 H new ATOM 1277 N LYS A 82 -6.125 -8.274 5.432 1.00 0.00 N ATOM 1278 CA LYS A 82 -5.298 -9.133 4.594 1.00 0.00 C ATOM 1279 C LYS A 82 -3.873 -8.597 4.504 1.00 0.00 C ATOM 1280 O LYS A 82 -2.913 -9.364 4.432 1.00 0.00 O ATOM 1281 CB LYS A 82 -5.901 -9.247 3.192 1.00 0.00 C ATOM 1282 CG LYS A 82 -6.981 -10.309 3.079 1.00 0.00 C ATOM 1283 CD LYS A 82 -6.394 -11.709 3.136 1.00 0.00 C ATOM 1284 CE LYS A 82 -7.465 -12.751 3.422 1.00 0.00 C ATOM 1285 NZ LYS A 82 -6.929 -14.137 3.329 1.00 0.00 N ATOM 0 H LYS A 82 -6.226 -7.320 5.086 1.00 0.00 H new ATOM 0 HA LYS A 82 -5.267 -10.122 5.051 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -6.321 -8.282 2.906 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -5.106 -9.472 2.481 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -7.703 -10.183 3.886 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -7.524 -10.179 2.143 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -5.905 -11.939 2.189 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -5.627 -11.752 3.909 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -7.875 -12.586 4.418 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -8.286 -12.631 2.715 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -7.689 -14.817 3.530 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -6.561 -14.303 2.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -6.162 -14.260 4.021 1.00 0.00 H new ATOM 1299 N VAL A 83 -3.742 -7.274 4.509 1.00 0.00 N ATOM 1300 CA VAL A 83 -2.434 -6.635 4.431 1.00 0.00 C ATOM 1301 C VAL A 83 -2.078 -5.948 5.745 1.00 0.00 C ATOM 1302 O VAL A 83 -1.157 -6.367 6.447 1.00 0.00 O ATOM 1303 CB VAL A 83 -2.383 -5.598 3.293 1.00 0.00 C ATOM 1304 CG1 VAL A 83 -1.074 -4.825 3.332 1.00 0.00 C ATOM 1305 CG2 VAL A 83 -2.570 -6.277 1.945 1.00 0.00 C ATOM 0 H VAL A 83 -4.526 -6.624 4.566 1.00 0.00 H new ATOM 0 HA VAL A 83 -1.709 -7.423 4.228 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.199 -4.890 3.434 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -1.057 -4.097 2.521 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -0.986 -4.306 4.287 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -0.239 -5.517 3.217 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -2.531 -5.530 1.153 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -1.776 -7.009 1.793 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -3.537 -6.780 1.922 1.00 0.00 H new ATOM 1315 N LEU A 84 -2.814 -4.892 6.072 1.00 0.00 N ATOM 1316 CA LEU A 84 -2.576 -4.147 7.304 1.00 0.00 C ATOM 1317 C LEU A 84 -2.353 -5.093 8.479 1.00 0.00 C ATOM 1318 O LEU A 84 -1.320 -5.039 9.147 1.00 0.00 O ATOM 1319 CB LEU A 84 -3.757 -3.220 7.598 1.00 0.00 C ATOM 1320 CG LEU A 84 -4.034 -2.134 6.557 1.00 0.00 C ATOM 1321 CD1 LEU A 84 -5.207 -1.268 6.988 1.00 0.00 C ATOM 1322 CD2 LEU A 84 -2.793 -1.282 6.332 1.00 0.00 C ATOM 0 H LEU A 84 -3.580 -4.532 5.502 1.00 0.00 H new ATOM 0 HA LEU A 84 -1.676 -3.548 7.169 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -4.654 -3.830 7.705 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.583 -2.737 8.560 1.00 0.00 H new ATOM 0 HG LEU A 84 -4.294 -2.618 5.615 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.389 -0.501 6.235 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -6.097 -1.888 7.097 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -4.977 -0.793 7.942 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -3.008 -0.515 5.588 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -2.503 -0.808 7.269 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -1.978 -1.913 5.977 1.00 0.00 H new ATOM 1334 N LYS A 85 -3.328 -5.962 8.725 1.00 0.00 N ATOM 1335 CA LYS A 85 -3.238 -6.924 9.817 1.00 0.00 C ATOM 1336 C LYS A 85 -1.813 -7.449 9.964 1.00 0.00 C ATOM 1337 O LYS A 85 -1.201 -7.320 11.024 1.00 0.00 O ATOM 1338 CB LYS A 85 -4.200 -8.090 9.578 1.00 0.00 C ATOM 1339 CG LYS A 85 -4.473 -8.919 10.821 1.00 0.00 C ATOM 1340 CD LYS A 85 -5.589 -9.923 10.587 1.00 0.00 C ATOM 1341 CE LYS A 85 -6.233 -10.355 11.896 1.00 0.00 C ATOM 1342 NZ LYS A 85 -7.144 -11.518 11.709 1.00 0.00 N ATOM 0 H LYS A 85 -4.190 -6.020 8.183 1.00 0.00 H new ATOM 0 HA LYS A 85 -3.516 -6.415 10.740 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -5.144 -7.699 9.198 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -3.788 -8.737 8.804 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -3.565 -9.445 11.115 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -4.742 -8.260 11.647 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -6.345 -9.484 9.936 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -5.192 -10.796 10.070 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -5.456 -10.615 12.615 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -6.792 -9.520 12.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -7.563 -11.782 12.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -7.901 -11.263 11.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -6.606 -12.323 11.330 1.00 0.00 H new ATOM 1356 N ARG A 86 -1.292 -8.040 8.893 1.00 0.00 N ATOM 1357 CA ARG A 86 0.061 -8.584 8.904 1.00 0.00 C ATOM 1358 C ARG A 86 1.058 -7.550 9.418 1.00 0.00 C ATOM 1359 O ARG A 86 2.015 -7.888 10.116 1.00 0.00 O ATOM 1360 CB ARG A 86 0.461 -9.039 7.499 1.00 0.00 C ATOM 1361 CG ARG A 86 -0.355 -10.214 6.985 1.00 0.00 C ATOM 1362 CD ARG A 86 0.079 -11.520 7.631 1.00 0.00 C ATOM 1363 NE ARG A 86 -0.654 -11.790 8.865 1.00 0.00 N ATOM 1364 CZ ARG A 86 -0.528 -12.914 9.563 1.00 0.00 C ATOM 1365 NH1 ARG A 86 0.297 -13.866 9.151 1.00 0.00 N ATOM 1366 NH2 ARG A 86 -1.229 -13.086 10.676 1.00 0.00 N ATOM 0 H ARG A 86 -1.786 -8.154 8.008 1.00 0.00 H new ATOM 0 HA ARG A 86 0.076 -9.443 9.575 1.00 0.00 H new ATOM 0 HB2 ARG A 86 0.351 -8.202 6.810 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.516 -9.313 7.501 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -1.412 -10.040 7.188 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -0.246 -10.288 5.903 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -0.076 -12.340 6.930 1.00 0.00 H new ATOM 0 HD3 ARG A 86 1.147 -11.481 7.845 1.00 0.00 H new ATOM 0 HE ARG A 86 -1.297 -11.078 9.210 1.00 0.00 H new ATOM 0 HH11 ARG A 86 0.838 -13.737 8.296 1.00 0.00 H new ATOM 0 HH12 ARG A 86 0.391 -14.727 9.689 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -1.865 -12.356 10.996 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -1.132 -13.949 11.212 1.00 0.00 H new ATOM 1380 N LEU A 87 0.829 -6.289 9.069 1.00 0.00 N ATOM 1381 CA LEU A 87 1.707 -5.205 9.494 1.00 0.00 C ATOM 1382 C LEU A 87 1.240 -4.615 10.821 1.00 0.00 C ATOM 1383 O LEU A 87 1.460 -3.437 11.099 1.00 0.00 O ATOM 1384 CB LEU A 87 1.755 -4.112 8.426 1.00 0.00 C ATOM 1385 CG LEU A 87 2.220 -4.551 7.036 1.00 0.00 C ATOM 1386 CD1 LEU A 87 1.603 -3.667 5.963 1.00 0.00 C ATOM 1387 CD2 LEU A 87 3.739 -4.520 6.947 1.00 0.00 C ATOM 0 H LEU A 87 0.042 -5.992 8.492 1.00 0.00 H new ATOM 0 HA LEU A 87 2.708 -5.614 9.631 1.00 0.00 H new ATOM 0 HB2 LEU A 87 0.759 -3.678 8.334 1.00 0.00 H new ATOM 0 HB3 LEU A 87 2.417 -3.320 8.775 1.00 0.00 H new ATOM 0 HG LEU A 87 1.887 -5.576 6.869 1.00 0.00 H new ATOM 0 HD11 LEU A 87 1.945 -3.994 4.981 1.00 0.00 H new ATOM 0 HD12 LEU A 87 0.517 -3.740 6.012 1.00 0.00 H new ATOM 0 HD13 LEU A 87 1.905 -2.632 6.126 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.052 -4.835 5.952 1.00 0.00 H new ATOM 0 HD22 LEU A 87 4.094 -3.507 7.135 1.00 0.00 H new ATOM 0 HD23 LEU A 87 4.161 -5.196 7.691 1.00 0.00 H new ATOM 1399 N ASN A 88 0.597 -5.443 11.638 1.00 0.00 N ATOM 1400 CA ASN A 88 0.101 -5.003 12.937 1.00 0.00 C ATOM 1401 C ASN A 88 -0.507 -3.607 12.843 1.00 0.00 C ATOM 1402 O ASN A 88 -0.550 -2.869 13.828 1.00 0.00 O ATOM 1403 CB ASN A 88 1.232 -5.011 13.967 1.00 0.00 C ATOM 1404 CG ASN A 88 0.735 -4.729 15.372 1.00 0.00 C ATOM 1405 OD1 ASN A 88 -0.065 -5.485 15.923 1.00 0.00 O ATOM 1406 ND2 ASN A 88 1.209 -3.636 15.958 1.00 0.00 N ATOM 0 H ASN A 88 0.407 -6.422 11.424 1.00 0.00 H new ATOM 0 HA ASN A 88 -0.676 -5.697 13.256 1.00 0.00 H new ATOM 0 HB2 ASN A 88 1.730 -5.980 13.948 1.00 0.00 H new ATOM 0 HB3 ASN A 88 1.977 -4.264 13.691 1.00 0.00 H new ATOM 0 HD21 ASN A 88 0.911 -3.394 16.903 1.00 0.00 H new ATOM 0 HD22 ASN A 88 1.871 -3.038 15.463 1.00 0.00 H new ATOM 1413 N PHE A 89 -0.976 -3.251 11.651 1.00 0.00 N ATOM 1414 CA PHE A 89 -1.581 -1.943 11.428 1.00 0.00 C ATOM 1415 C PHE A 89 -3.103 -2.033 11.476 1.00 0.00 C ATOM 1416 O PHE A 89 -3.704 -2.914 10.862 1.00 0.00 O ATOM 1417 CB PHE A 89 -1.135 -1.375 10.079 1.00 0.00 C ATOM 1418 CG PHE A 89 -1.255 0.120 9.989 1.00 0.00 C ATOM 1419 CD1 PHE A 89 -0.278 0.940 10.531 1.00 0.00 C ATOM 1420 CD2 PHE A 89 -2.344 0.704 9.363 1.00 0.00 C ATOM 1421 CE1 PHE A 89 -0.385 2.316 10.449 1.00 0.00 C ATOM 1422 CE2 PHE A 89 -2.455 2.079 9.278 1.00 0.00 C ATOM 1423 CZ PHE A 89 -1.476 2.886 9.823 1.00 0.00 C ATOM 0 H PHE A 89 -0.949 -3.850 10.826 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.249 -1.276 12.223 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.098 -1.660 9.899 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.732 -1.828 9.288 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.576 0.499 11.023 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -3.114 0.078 8.937 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.384 2.944 10.874 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.308 2.522 8.785 1.00 0.00 H new ATOM 0 HZ PHE A 89 -1.563 3.961 9.760 1.00 0.00 H new ATOM 1433 N SER A 90 -3.721 -1.114 12.212 1.00 0.00 N ATOM 1434 CA SER A 90 -5.173 -1.091 12.346 1.00 0.00 C ATOM 1435 C SER A 90 -5.723 0.303 12.063 1.00 0.00 C ATOM 1436 O SER A 90 -5.068 1.309 12.337 1.00 0.00 O ATOM 1437 CB SER A 90 -5.585 -1.539 13.750 1.00 0.00 C ATOM 1438 OG SER A 90 -5.092 -2.837 14.036 1.00 0.00 O ATOM 0 H SER A 90 -3.239 -0.376 12.724 1.00 0.00 H new ATOM 0 HA SER A 90 -5.591 -1.783 11.615 1.00 0.00 H new ATOM 0 HB2 SER A 90 -5.205 -0.832 14.487 1.00 0.00 H new ATOM 0 HB3 SER A 90 -6.672 -1.533 13.833 1.00 0.00 H new ATOM 0 HG SER A 90 -5.367 -3.100 14.939 1.00 0.00 H new ATOM 1444 N VAL A 91 -6.931 0.356 11.511 1.00 0.00 N ATOM 1445 CA VAL A 91 -7.571 1.626 11.191 1.00 0.00 C ATOM 1446 C VAL A 91 -9.090 1.502 11.232 1.00 0.00 C ATOM 1447 O VAL A 91 -9.671 0.528 10.754 1.00 0.00 O ATOM 1448 CB VAL A 91 -7.146 2.135 9.801 1.00 0.00 C ATOM 1449 CG1 VAL A 91 -7.902 3.404 9.442 1.00 0.00 C ATOM 1450 CG2 VAL A 91 -5.643 2.368 9.757 1.00 0.00 C ATOM 0 H VAL A 91 -7.486 -0.467 11.276 1.00 0.00 H new ATOM 0 HA VAL A 91 -7.247 2.342 11.946 1.00 0.00 H new ATOM 0 HB VAL A 91 -7.395 1.373 9.062 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.588 3.748 8.457 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -8.972 3.199 9.431 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -7.688 4.176 10.181 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.359 2.727 8.768 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -5.368 3.111 10.506 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -5.124 1.433 9.966 1.00 0.00 H new ATOM 1460 N PRO A 92 -9.751 2.512 11.817 1.00 0.00 N ATOM 1461 CA PRO A 92 -11.212 2.541 11.934 1.00 0.00 C ATOM 1462 C PRO A 92 -11.897 2.743 10.587 1.00 0.00 C ATOM 1463 O PRO A 92 -11.275 3.195 9.625 1.00 0.00 O ATOM 1464 CB PRO A 92 -11.471 3.738 12.851 1.00 0.00 C ATOM 1465 CG PRO A 92 -10.287 4.622 12.664 1.00 0.00 C ATOM 1466 CD PRO A 92 -9.122 3.705 12.409 1.00 0.00 C ATOM 0 HA PRO A 92 -11.609 1.601 12.316 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -12.394 4.251 12.581 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -11.572 3.426 13.890 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -10.437 5.304 11.827 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -10.114 5.236 13.548 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -8.397 4.155 11.731 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -8.591 3.464 13.330 1.00 0.00 H new ATOM 1474 N ASP A 93 -13.180 2.405 10.525 1.00 0.00 N ATOM 1475 CA ASP A 93 -13.951 2.551 9.295 1.00 0.00 C ATOM 1476 C ASP A 93 -14.096 4.022 8.916 1.00 0.00 C ATOM 1477 O ASP A 93 -13.952 4.391 7.751 1.00 0.00 O ATOM 1478 CB ASP A 93 -15.332 1.914 9.454 1.00 0.00 C ATOM 1479 CG ASP A 93 -16.065 2.419 10.681 1.00 0.00 C ATOM 1480 OD1 ASP A 93 -15.558 2.209 11.804 1.00 0.00 O ATOM 1481 OD2 ASP A 93 -17.144 3.026 10.519 1.00 0.00 O ATOM 0 H ASP A 93 -13.709 2.028 11.312 1.00 0.00 H new ATOM 0 HA ASP A 93 -13.414 2.040 8.496 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -15.929 2.122 8.566 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -15.224 0.831 9.519 1.00 0.00 H new ATOM 1486 N ASP A 94 -14.385 4.857 9.909 1.00 0.00 N ATOM 1487 CA ASP A 94 -14.550 6.288 9.680 1.00 0.00 C ATOM 1488 C ASP A 94 -13.399 6.842 8.846 1.00 0.00 C ATOM 1489 O ASP A 94 -13.607 7.652 7.943 1.00 0.00 O ATOM 1490 CB ASP A 94 -14.635 7.033 11.013 1.00 0.00 C ATOM 1491 CG ASP A 94 -15.741 6.502 11.903 1.00 0.00 C ATOM 1492 OD1 ASP A 94 -16.789 6.086 11.365 1.00 0.00 O ATOM 1493 OD2 ASP A 94 -15.560 6.502 13.139 1.00 0.00 O ATOM 0 H ASP A 94 -14.510 4.568 10.879 1.00 0.00 H new ATOM 0 HA ASP A 94 -15.479 6.438 9.129 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -13.681 6.949 11.534 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -14.803 8.093 10.823 1.00 0.00 H new ATOM 1498 N VAL A 95 -12.184 6.399 9.155 1.00 0.00 N ATOM 1499 CA VAL A 95 -11.000 6.850 8.435 1.00 0.00 C ATOM 1500 C VAL A 95 -10.985 6.311 7.009 1.00 0.00 C ATOM 1501 O VAL A 95 -10.648 7.027 6.067 1.00 0.00 O ATOM 1502 CB VAL A 95 -9.708 6.414 9.151 1.00 0.00 C ATOM 1503 CG1 VAL A 95 -8.492 6.713 8.287 1.00 0.00 C ATOM 1504 CG2 VAL A 95 -9.591 7.100 10.504 1.00 0.00 C ATOM 0 H VAL A 95 -11.995 5.728 9.899 1.00 0.00 H new ATOM 0 HA VAL A 95 -11.042 7.939 8.408 1.00 0.00 H new ATOM 0 HB VAL A 95 -9.751 5.338 9.317 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.588 6.398 8.809 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -8.574 6.172 7.344 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -8.442 7.783 8.088 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -8.672 6.780 10.996 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -9.570 8.181 10.363 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -10.447 6.831 11.123 1.00 0.00 H new ATOM 1514 N MET A 96 -11.354 5.043 6.859 1.00 0.00 N ATOM 1515 CA MET A 96 -11.385 4.407 5.547 1.00 0.00 C ATOM 1516 C MET A 96 -12.347 5.134 4.613 1.00 0.00 C ATOM 1517 O MET A 96 -11.981 5.508 3.498 1.00 0.00 O ATOM 1518 CB MET A 96 -11.794 2.938 5.677 1.00 0.00 C ATOM 1519 CG MET A 96 -10.748 2.075 6.365 1.00 0.00 C ATOM 1520 SD MET A 96 -10.933 0.323 5.982 1.00 0.00 S ATOM 1521 CE MET A 96 -11.420 -0.323 7.580 1.00 0.00 C ATOM 0 H MET A 96 -11.635 4.436 7.629 1.00 0.00 H new ATOM 0 HA MET A 96 -10.383 4.461 5.122 1.00 0.00 H new ATOM 0 HB2 MET A 96 -12.728 2.877 6.236 1.00 0.00 H new ATOM 0 HB3 MET A 96 -11.990 2.535 4.684 1.00 0.00 H new ATOM 0 HG2 MET A 96 -9.754 2.406 6.064 1.00 0.00 H new ATOM 0 HG3 MET A 96 -10.818 2.217 7.444 1.00 0.00 H new ATOM 0 HE1 MET A 96 -11.417 -1.413 7.548 1.00 0.00 H new ATOM 0 HE2 MET A 96 -10.718 0.020 8.340 1.00 0.00 H new ATOM 0 HE3 MET A 96 -12.422 0.030 7.825 1.00 0.00 H new ATOM 1531 N ARG A 97 -13.578 5.330 5.075 1.00 0.00 N ATOM 1532 CA ARG A 97 -14.593 6.011 4.279 1.00 0.00 C ATOM 1533 C ARG A 97 -13.996 7.210 3.549 1.00 0.00 C ATOM 1534 O ARG A 97 -14.244 7.413 2.360 1.00 0.00 O ATOM 1535 CB ARG A 97 -15.749 6.466 5.171 1.00 0.00 C ATOM 1536 CG ARG A 97 -16.684 5.339 5.579 1.00 0.00 C ATOM 1537 CD ARG A 97 -17.530 5.725 6.782 1.00 0.00 C ATOM 1538 NE ARG A 97 -18.264 4.584 7.324 1.00 0.00 N ATOM 1539 CZ ARG A 97 -19.345 4.068 6.751 1.00 0.00 C ATOM 1540 NH1 ARG A 97 -19.816 4.587 5.625 1.00 0.00 N ATOM 1541 NH2 ARG A 97 -19.958 3.029 7.304 1.00 0.00 N ATOM 0 H ARG A 97 -13.896 5.027 5.995 1.00 0.00 H new ATOM 0 HA ARG A 97 -14.971 5.308 3.537 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -15.342 6.932 6.068 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -16.322 7.230 4.647 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -17.334 5.083 4.742 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -16.101 4.448 5.813 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -16.888 6.144 7.557 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -18.234 6.506 6.494 1.00 0.00 H new ATOM 0 HE ARG A 97 -17.928 4.161 8.189 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -19.348 5.385 5.196 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -20.647 4.188 5.188 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -19.599 2.626 8.170 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -20.788 2.633 6.863 1.00 0.00 H new ATOM 1555 N LYS A 98 -13.210 8.004 4.268 1.00 0.00 N ATOM 1556 CA LYS A 98 -12.577 9.183 3.690 1.00 0.00 C ATOM 1557 C LYS A 98 -11.560 8.788 2.625 1.00 0.00 C ATOM 1558 O LYS A 98 -11.518 9.377 1.544 1.00 0.00 O ATOM 1559 CB LYS A 98 -11.893 10.007 4.783 1.00 0.00 C ATOM 1560 CG LYS A 98 -12.853 10.548 5.828 1.00 0.00 C ATOM 1561 CD LYS A 98 -12.151 10.801 7.152 1.00 0.00 C ATOM 1562 CE LYS A 98 -13.068 11.500 8.145 1.00 0.00 C ATOM 1563 NZ LYS A 98 -12.300 12.216 9.200 1.00 0.00 N ATOM 0 H LYS A 98 -12.996 7.852 5.254 1.00 0.00 H new ATOM 0 HA LYS A 98 -13.353 9.787 3.220 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -11.143 9.389 5.276 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -11.365 10.841 4.321 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -13.299 11.475 5.468 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -13.668 9.839 5.977 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -11.812 9.854 7.572 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -11.263 11.411 6.984 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -13.704 12.209 7.615 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -13.726 10.766 8.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -12.961 12.679 9.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -11.712 11.536 9.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -11.690 12.934 8.759 1.00 0.00 H new ATOM 1577 N ILE A 99 -10.743 7.787 2.936 1.00 0.00 N ATOM 1578 CA ILE A 99 -9.728 7.312 2.003 1.00 0.00 C ATOM 1579 C ILE A 99 -10.339 6.988 0.644 1.00 0.00 C ATOM 1580 O ILE A 99 -9.955 7.564 -0.374 1.00 0.00 O ATOM 1581 CB ILE A 99 -9.010 6.061 2.542 1.00 0.00 C ATOM 1582 CG1 ILE A 99 -8.343 6.368 3.885 1.00 0.00 C ATOM 1583 CG2 ILE A 99 -7.983 5.565 1.535 1.00 0.00 C ATOM 1584 CD1 ILE A 99 -7.790 5.143 4.578 1.00 0.00 C ATOM 0 H ILE A 99 -10.764 7.289 3.826 1.00 0.00 H new ATOM 0 HA ILE A 99 -9.002 8.117 1.889 1.00 0.00 H new ATOM 0 HB ILE A 99 -9.748 5.274 2.696 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -7.534 7.081 3.725 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -9.069 6.850 4.540 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -7.484 4.680 1.930 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -8.483 5.312 0.600 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -7.246 6.347 1.352 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -7.332 5.435 5.523 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -8.598 4.437 4.769 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -7.040 4.672 3.942 1.00 0.00 H new ATOM 1596 N ALA A 100 -11.294 6.064 0.636 1.00 0.00 N ATOM 1597 CA ALA A 100 -11.961 5.666 -0.597 1.00 0.00 C ATOM 1598 C ALA A 100 -12.569 6.871 -1.306 1.00 0.00 C ATOM 1599 O ALA A 100 -12.738 6.865 -2.525 1.00 0.00 O ATOM 1600 CB ALA A 100 -13.034 4.627 -0.305 1.00 0.00 C ATOM 0 H ALA A 100 -11.623 5.577 1.470 1.00 0.00 H new ATOM 0 HA ALA A 100 -11.215 5.226 -1.259 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -13.524 4.339 -1.235 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -12.576 3.749 0.151 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -13.772 5.048 0.378 1.00 0.00 H new ATOM 1606 N GLN A 101 -12.896 7.903 -0.535 1.00 0.00 N ATOM 1607 CA GLN A 101 -13.487 9.115 -1.090 1.00 0.00 C ATOM 1608 C GLN A 101 -12.406 10.068 -1.589 1.00 0.00 C ATOM 1609 O GLN A 101 -12.618 11.279 -1.661 1.00 0.00 O ATOM 1610 CB GLN A 101 -14.354 9.812 -0.041 1.00 0.00 C ATOM 1611 CG GLN A 101 -15.748 9.219 0.088 1.00 0.00 C ATOM 1612 CD GLN A 101 -16.704 9.738 -0.967 1.00 0.00 C ATOM 1613 OE1 GLN A 101 -17.024 10.927 -1.000 1.00 0.00 O ATOM 1614 NE2 GLN A 101 -17.165 8.849 -1.838 1.00 0.00 N ATOM 0 H GLN A 101 -12.762 7.924 0.476 1.00 0.00 H new ATOM 0 HA GLN A 101 -14.113 8.830 -1.936 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -13.854 9.757 0.926 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -14.440 10.868 -0.296 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -15.685 8.133 0.013 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -16.146 9.448 1.077 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -16.874 7.874 -1.774 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -17.811 9.141 -2.572 1.00 0.00 H new ATOM 1623 N CYS A 102 -11.248 9.515 -1.931 1.00 0.00 N ATOM 1624 CA CYS A 102 -10.133 10.316 -2.421 1.00 0.00 C ATOM 1625 C CYS A 102 -9.982 11.596 -1.605 1.00 0.00 C ATOM 1626 O CYS A 102 -9.955 12.696 -2.156 1.00 0.00 O ATOM 1627 CB CYS A 102 -10.335 10.660 -3.898 1.00 0.00 C ATOM 1628 SG CYS A 102 -8.950 11.549 -4.646 1.00 0.00 S ATOM 0 H CYS A 102 -11.057 8.514 -1.878 1.00 0.00 H new ATOM 0 HA CYS A 102 -9.221 9.728 -2.313 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -10.504 9.738 -4.455 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -11.237 11.263 -3.999 1.00 0.00 H new ATOM 0 HG CYS A 102 -8.645 12.576 -3.910 1.00 0.00 H new ATOM 1634 N ALA A 103 -9.887 11.444 -0.288 1.00 0.00 N ATOM 1635 CA ALA A 103 -9.739 12.587 0.604 1.00 0.00 C ATOM 1636 C ALA A 103 -8.273 12.977 0.758 1.00 0.00 C ATOM 1637 O ALA A 103 -7.414 12.150 1.064 1.00 0.00 O ATOM 1638 CB ALA A 103 -10.351 12.278 1.963 1.00 0.00 C ATOM 0 H ALA A 103 -9.910 10.540 0.185 1.00 0.00 H new ATOM 0 HA ALA A 103 -10.268 13.432 0.163 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.233 13.140 2.619 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -11.411 12.056 1.842 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -9.847 11.417 2.402 1.00 0.00 H new ATOM 1644 N PRO A 104 -7.977 14.267 0.541 1.00 0.00 N ATOM 1645 CA PRO A 104 -6.615 14.796 0.650 1.00 0.00 C ATOM 1646 C PRO A 104 -6.117 14.823 2.091 1.00 0.00 C ATOM 1647 O PRO A 104 -6.784 15.352 2.979 1.00 0.00 O ATOM 1648 CB PRO A 104 -6.742 16.220 0.102 1.00 0.00 C ATOM 1649 CG PRO A 104 -8.169 16.585 0.323 1.00 0.00 C ATOM 1650 CD PRO A 104 -8.951 15.309 0.173 1.00 0.00 C ATOM 0 HA PRO A 104 -5.895 14.180 0.112 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -6.073 16.905 0.622 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -6.482 16.262 -0.956 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -8.313 17.016 1.314 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -8.497 17.331 -0.400 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -9.823 15.293 0.827 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -9.314 15.178 -0.846 1.00 0.00 H new ATOM 1658 N GLY A 105 -4.939 14.249 2.317 1.00 0.00 N ATOM 1659 CA GLY A 105 -4.372 14.218 3.652 1.00 0.00 C ATOM 1660 C GLY A 105 -4.778 12.980 4.426 1.00 0.00 C ATOM 1661 O GLY A 105 -3.977 12.412 5.168 1.00 0.00 O ATOM 0 H GLY A 105 -4.367 13.805 1.599 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -3.285 14.259 3.583 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -4.690 15.105 4.199 1.00 0.00 H new ATOM 1665 N VAL A 106 -6.028 12.561 4.256 1.00 0.00 N ATOM 1666 CA VAL A 106 -6.540 11.383 4.945 1.00 0.00 C ATOM 1667 C VAL A 106 -5.707 10.149 4.618 1.00 0.00 C ATOM 1668 O VAL A 106 -5.004 9.615 5.477 1.00 0.00 O ATOM 1669 CB VAL A 106 -8.010 11.110 4.573 1.00 0.00 C ATOM 1670 CG1 VAL A 106 -8.538 9.904 5.336 1.00 0.00 C ATOM 1671 CG2 VAL A 106 -8.865 12.338 4.844 1.00 0.00 C ATOM 0 H VAL A 106 -6.705 13.020 3.647 1.00 0.00 H new ATOM 0 HA VAL A 106 -6.475 11.588 6.014 1.00 0.00 H new ATOM 0 HB VAL A 106 -8.062 10.888 3.507 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -9.578 9.726 5.061 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -7.941 9.026 5.087 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -8.474 10.095 6.407 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -9.900 12.127 4.575 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -8.809 12.594 5.902 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -8.499 13.175 4.249 1.00 0.00 H new ATOM 1681 N VAL A 107 -5.788 9.701 3.369 1.00 0.00 N ATOM 1682 CA VAL A 107 -5.040 8.530 2.927 1.00 0.00 C ATOM 1683 C VAL A 107 -3.543 8.721 3.143 1.00 0.00 C ATOM 1684 O VAL A 107 -2.816 7.762 3.398 1.00 0.00 O ATOM 1685 CB VAL A 107 -5.299 8.228 1.439 1.00 0.00 C ATOM 1686 CG1 VAL A 107 -5.208 9.502 0.612 1.00 0.00 C ATOM 1687 CG2 VAL A 107 -4.319 7.182 0.930 1.00 0.00 C ATOM 0 H VAL A 107 -6.364 10.131 2.646 1.00 0.00 H new ATOM 0 HA VAL A 107 -5.386 7.688 3.526 1.00 0.00 H new ATOM 0 HB VAL A 107 -6.308 7.828 1.337 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -5.394 9.269 -0.437 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -5.952 10.217 0.962 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -4.213 9.934 0.717 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -4.516 6.981 -0.123 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -3.300 7.552 1.044 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -4.437 6.263 1.504 1.00 0.00 H new ATOM 1697 N GLU A 108 -3.090 9.966 3.039 1.00 0.00 N ATOM 1698 CA GLU A 108 -1.678 10.282 3.223 1.00 0.00 C ATOM 1699 C GLU A 108 -1.237 9.989 4.654 1.00 0.00 C ATOM 1700 O GLU A 108 -0.122 9.522 4.888 1.00 0.00 O ATOM 1701 CB GLU A 108 -1.414 11.752 2.887 1.00 0.00 C ATOM 1702 CG GLU A 108 -0.088 12.269 3.420 1.00 0.00 C ATOM 1703 CD GLU A 108 -0.198 12.803 4.835 1.00 0.00 C ATOM 1704 OE1 GLU A 108 -1.291 12.689 5.429 1.00 0.00 O ATOM 1705 OE2 GLU A 108 0.808 13.336 5.348 1.00 0.00 O ATOM 0 H GLU A 108 -3.679 10.772 2.829 1.00 0.00 H new ATOM 0 HA GLU A 108 -1.100 9.652 2.547 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -1.435 11.878 1.805 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -2.222 12.360 3.294 1.00 0.00 H new ATOM 0 HG2 GLU A 108 0.648 11.465 3.395 1.00 0.00 H new ATOM 0 HG3 GLU A 108 0.280 13.059 2.765 1.00 0.00 H new ATOM 1712 N LEU A 109 -2.119 10.267 5.607 1.00 0.00 N ATOM 1713 CA LEU A 109 -1.822 10.034 7.016 1.00 0.00 C ATOM 1714 C LEU A 109 -1.490 8.567 7.267 1.00 0.00 C ATOM 1715 O LEU A 109 -0.966 8.210 8.323 1.00 0.00 O ATOM 1716 CB LEU A 109 -3.009 10.456 7.885 1.00 0.00 C ATOM 1717 CG LEU A 109 -3.164 11.959 8.124 1.00 0.00 C ATOM 1718 CD1 LEU A 109 -4.535 12.267 8.707 1.00 0.00 C ATOM 1719 CD2 LEU A 109 -2.065 12.469 9.044 1.00 0.00 C ATOM 0 H LEU A 109 -3.046 10.654 5.430 1.00 0.00 H new ATOM 0 HA LEU A 109 -0.953 10.635 7.283 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -3.923 10.086 7.421 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.920 9.962 8.852 1.00 0.00 H new ATOM 0 HG LEU A 109 -3.075 12.471 7.166 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -4.628 13.341 8.871 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -5.308 11.938 8.013 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -4.653 11.744 9.656 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -2.191 13.540 9.203 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -2.122 11.951 10.001 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -1.093 12.282 8.588 1.00 0.00 H new ATOM 1731 N VAL A 110 -1.796 7.720 6.289 1.00 0.00 N ATOM 1732 CA VAL A 110 -1.527 6.292 6.403 1.00 0.00 C ATOM 1733 C VAL A 110 -0.322 5.891 5.560 1.00 0.00 C ATOM 1734 O VAL A 110 0.335 4.886 5.835 1.00 0.00 O ATOM 1735 CB VAL A 110 -2.745 5.455 5.968 1.00 0.00 C ATOM 1736 CG1 VAL A 110 -2.464 3.971 6.144 1.00 0.00 C ATOM 1737 CG2 VAL A 110 -3.982 5.869 6.751 1.00 0.00 C ATOM 0 H VAL A 110 -2.230 7.998 5.409 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.315 6.093 7.453 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.933 5.641 4.911 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -3.336 3.396 5.832 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -1.606 3.688 5.535 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -2.249 3.763 7.192 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -4.833 5.268 6.431 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -3.808 5.714 7.816 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -4.193 6.923 6.568 1.00 0.00 H new ATOM 1747 N LEU A 111 -0.036 6.683 4.532 1.00 0.00 N ATOM 1748 CA LEU A 111 1.092 6.412 3.648 1.00 0.00 C ATOM 1749 C LEU A 111 2.417 6.643 4.368 1.00 0.00 C ATOM 1750 O LEU A 111 3.361 5.868 4.216 1.00 0.00 O ATOM 1751 CB LEU A 111 1.014 7.297 2.403 1.00 0.00 C ATOM 1752 CG LEU A 111 -0.106 6.967 1.415 1.00 0.00 C ATOM 1753 CD1 LEU A 111 -0.135 7.983 0.283 1.00 0.00 C ATOM 1754 CD2 LEU A 111 0.065 5.558 0.866 1.00 0.00 C ATOM 0 H LEU A 111 -0.570 7.518 4.290 1.00 0.00 H new ATOM 0 HA LEU A 111 1.042 5.366 3.346 1.00 0.00 H new ATOM 0 HB2 LEU A 111 0.895 8.332 2.724 1.00 0.00 H new ATOM 0 HB3 LEU A 111 1.966 7.234 1.876 1.00 0.00 H new ATOM 0 HG LEU A 111 -1.058 7.016 1.944 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.938 7.732 -0.410 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -0.306 8.979 0.692 1.00 0.00 H new ATOM 0 HD13 LEU A 111 0.818 7.967 -0.245 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -0.741 5.340 0.165 1.00 0.00 H new ATOM 0 HD22 LEU A 111 1.023 5.481 0.353 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.035 4.842 1.687 1.00 0.00 H new ATOM 1766 N ILE A 112 2.478 7.714 5.153 1.00 0.00 N ATOM 1767 CA ILE A 112 3.685 8.045 5.899 1.00 0.00 C ATOM 1768 C ILE A 112 4.123 6.881 6.782 1.00 0.00 C ATOM 1769 O ILE A 112 5.238 6.371 6.672 1.00 0.00 O ATOM 1770 CB ILE A 112 3.479 9.292 6.779 1.00 0.00 C ATOM 1771 CG1 ILE A 112 3.849 10.558 6.003 1.00 0.00 C ATOM 1772 CG2 ILE A 112 4.305 9.185 8.052 1.00 0.00 C ATOM 1773 CD1 ILE A 112 3.476 11.837 6.719 1.00 0.00 C ATOM 0 H ILE A 112 1.706 8.367 5.288 1.00 0.00 H new ATOM 0 HA ILE A 112 4.462 8.253 5.164 1.00 0.00 H new ATOM 0 HB ILE A 112 2.427 9.352 7.056 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.922 10.557 5.813 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.354 10.537 5.032 1.00 0.00 H new ATOM 0 HG21 ILE A 112 4.148 10.074 8.663 1.00 0.00 H new ATOM 0 HG22 ILE A 112 3.998 8.301 8.612 1.00 0.00 H new ATOM 0 HG23 ILE A 112 5.361 9.103 7.795 1.00 0.00 H new ATOM 0 HD11 ILE A 112 3.768 12.693 6.111 1.00 0.00 H new ATOM 0 HD12 ILE A 112 2.399 11.860 6.885 1.00 0.00 H new ATOM 0 HD13 ILE A 112 3.992 11.881 7.678 1.00 0.00 H new ATOM 1785 N PRO A 113 3.225 6.448 7.678 1.00 0.00 N ATOM 1786 CA PRO A 113 3.494 5.337 8.596 1.00 0.00 C ATOM 1787 C PRO A 113 3.569 3.995 7.876 1.00 0.00 C ATOM 1788 O PRO A 113 4.313 3.101 8.282 1.00 0.00 O ATOM 1789 CB PRO A 113 2.298 5.366 9.550 1.00 0.00 C ATOM 1790 CG PRO A 113 1.206 6.010 8.768 1.00 0.00 C ATOM 1791 CD PRO A 113 1.876 7.009 7.865 1.00 0.00 C ATOM 0 HA PRO A 113 4.457 5.446 9.095 1.00 0.00 H new ATOM 0 HB2 PRO A 113 2.019 4.361 9.866 1.00 0.00 H new ATOM 0 HB3 PRO A 113 2.525 5.932 10.453 1.00 0.00 H new ATOM 0 HG2 PRO A 113 0.652 5.271 8.189 1.00 0.00 H new ATOM 0 HG3 PRO A 113 0.490 6.499 9.428 1.00 0.00 H new ATOM 0 HD2 PRO A 113 1.348 7.111 6.917 1.00 0.00 H new ATOM 0 HD3 PRO A 113 1.912 8.000 8.318 1.00 0.00 H new ATOM 1799 N LEU A 114 2.793 3.860 6.806 1.00 0.00 N ATOM 1800 CA LEU A 114 2.772 2.626 6.028 1.00 0.00 C ATOM 1801 C LEU A 114 4.184 2.206 5.632 1.00 0.00 C ATOM 1802 O LEU A 114 4.583 1.060 5.839 1.00 0.00 O ATOM 1803 CB LEU A 114 1.911 2.804 4.776 1.00 0.00 C ATOM 1804 CG LEU A 114 2.020 1.700 3.724 1.00 0.00 C ATOM 1805 CD1 LEU A 114 1.208 0.483 4.141 1.00 0.00 C ATOM 1806 CD2 LEU A 114 1.561 2.210 2.366 1.00 0.00 C ATOM 0 H LEU A 114 2.171 4.589 6.458 1.00 0.00 H new ATOM 0 HA LEU A 114 2.341 1.842 6.650 1.00 0.00 H new ATOM 0 HB2 LEU A 114 0.869 2.883 5.085 1.00 0.00 H new ATOM 0 HB3 LEU A 114 2.177 3.752 4.308 1.00 0.00 H new ATOM 0 HG LEU A 114 3.066 1.403 3.644 1.00 0.00 H new ATOM 0 HD11 LEU A 114 1.298 -0.292 3.380 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.583 0.104 5.092 1.00 0.00 H new ATOM 0 HD13 LEU A 114 0.161 0.765 4.251 1.00 0.00 H new ATOM 0 HD21 LEU A 114 1.646 1.411 1.630 1.00 0.00 H new ATOM 0 HD22 LEU A 114 0.523 2.535 2.431 1.00 0.00 H new ATOM 0 HD23 LEU A 114 2.186 3.050 2.063 1.00 0.00 H new ATOM 1818 N ARG A 115 4.936 3.143 5.064 1.00 0.00 N ATOM 1819 CA ARG A 115 6.305 2.871 4.641 1.00 0.00 C ATOM 1820 C ARG A 115 7.187 2.529 5.838 1.00 0.00 C ATOM 1821 O ARG A 115 7.971 1.582 5.792 1.00 0.00 O ATOM 1822 CB ARG A 115 6.881 4.078 3.898 1.00 0.00 C ATOM 1823 CG ARG A 115 8.317 3.883 3.440 1.00 0.00 C ATOM 1824 CD ARG A 115 9.298 4.082 4.585 1.00 0.00 C ATOM 1825 NE ARG A 115 10.600 4.549 4.115 1.00 0.00 N ATOM 1826 CZ ARG A 115 10.844 5.803 3.752 1.00 0.00 C ATOM 1827 NH1 ARG A 115 9.879 6.711 3.806 1.00 0.00 N ATOM 1828 NH2 ARG A 115 12.054 6.151 3.336 1.00 0.00 N ATOM 0 H ARG A 115 4.621 4.097 4.886 1.00 0.00 H new ATOM 0 HA ARG A 115 6.287 2.013 3.969 1.00 0.00 H new ATOM 0 HB2 ARG A 115 6.257 4.291 3.030 1.00 0.00 H new ATOM 0 HB3 ARG A 115 6.831 4.952 4.548 1.00 0.00 H new ATOM 0 HG2 ARG A 115 8.436 2.881 3.027 1.00 0.00 H new ATOM 0 HG3 ARG A 115 8.543 4.587 2.639 1.00 0.00 H new ATOM 0 HD2 ARG A 115 8.888 4.803 5.293 1.00 0.00 H new ATOM 0 HD3 ARG A 115 9.422 3.142 5.123 1.00 0.00 H new ATOM 0 HE ARG A 115 11.364 3.875 4.063 1.00 0.00 H new ATOM 0 HH11 ARG A 115 8.947 6.447 4.127 1.00 0.00 H new ATOM 0 HH12 ARG A 115 10.068 7.674 3.527 1.00 0.00 H new ATOM 0 HH21 ARG A 115 12.799 5.455 3.294 1.00 0.00 H new ATOM 0 HH22 ARG A 115 12.240 7.114 3.057 1.00 0.00 H new ATOM 1842 N GLN A 116 7.052 3.307 6.907 1.00 0.00 N ATOM 1843 CA GLN A 116 7.837 3.087 8.116 1.00 0.00 C ATOM 1844 C GLN A 116 7.664 1.659 8.625 1.00 0.00 C ATOM 1845 O GLN A 116 8.602 1.059 9.149 1.00 0.00 O ATOM 1846 CB GLN A 116 7.429 4.082 9.203 1.00 0.00 C ATOM 1847 CG GLN A 116 7.957 5.488 8.970 1.00 0.00 C ATOM 1848 CD GLN A 116 8.009 6.310 10.243 1.00 0.00 C ATOM 1849 OE1 GLN A 116 7.641 5.835 11.318 1.00 0.00 O ATOM 1850 NE2 GLN A 116 8.466 7.551 10.128 1.00 0.00 N ATOM 0 H GLN A 116 6.407 4.095 6.961 1.00 0.00 H new ATOM 0 HA GLN A 116 8.888 3.241 7.870 1.00 0.00 H new ATOM 0 HB2 GLN A 116 6.341 4.117 9.262 1.00 0.00 H new ATOM 0 HB3 GLN A 116 7.790 3.723 10.167 1.00 0.00 H new ATOM 0 HG2 GLN A 116 8.956 5.430 8.538 1.00 0.00 H new ATOM 0 HG3 GLN A 116 7.324 5.994 8.241 1.00 0.00 H new ATOM 0 HE21 GLN A 116 8.760 7.904 9.217 1.00 0.00 H new ATOM 0 HE22 GLN A 116 8.523 8.152 10.950 1.00 0.00 H new ATOM 1859 N ARG A 117 6.458 1.123 8.468 1.00 0.00 N ATOM 1860 CA ARG A 117 6.162 -0.234 8.913 1.00 0.00 C ATOM 1861 C ARG A 117 6.881 -1.261 8.043 1.00 0.00 C ATOM 1862 O ARG A 117 7.660 -2.075 8.541 1.00 0.00 O ATOM 1863 CB ARG A 117 4.654 -0.486 8.878 1.00 0.00 C ATOM 1864 CG ARG A 117 3.881 0.297 9.927 1.00 0.00 C ATOM 1865 CD ARG A 117 3.819 -0.453 11.249 1.00 0.00 C ATOM 1866 NE ARG A 117 3.189 0.342 12.300 1.00 0.00 N ATOM 1867 CZ ARG A 117 3.767 1.392 12.873 1.00 0.00 C ATOM 1868 NH1 ARG A 117 4.981 1.771 12.498 1.00 0.00 N ATOM 1869 NH2 ARG A 117 3.130 2.065 13.823 1.00 0.00 N ATOM 0 H ARG A 117 5.671 1.607 8.036 1.00 0.00 H new ATOM 0 HA ARG A 117 6.518 -0.340 9.938 1.00 0.00 H new ATOM 0 HB2 ARG A 117 4.274 -0.227 7.890 1.00 0.00 H new ATOM 0 HB3 ARG A 117 4.469 -1.550 9.022 1.00 0.00 H new ATOM 0 HG2 ARG A 117 4.354 1.267 10.080 1.00 0.00 H new ATOM 0 HG3 ARG A 117 2.870 0.488 9.568 1.00 0.00 H new ATOM 0 HD2 ARG A 117 3.263 -1.381 11.114 1.00 0.00 H new ATOM 0 HD3 ARG A 117 4.828 -0.728 11.558 1.00 0.00 H new ATOM 0 HE ARG A 117 2.254 0.077 12.611 1.00 0.00 H new ATOM 0 HH11 ARG A 117 5.473 1.256 11.768 1.00 0.00 H new ATOM 0 HH12 ARG A 117 5.423 2.578 12.939 1.00 0.00 H new ATOM 0 HH21 ARG A 117 2.196 1.776 14.114 1.00 0.00 H new ATOM 0 HH22 ARG A 117 3.574 2.871 14.262 1.00 0.00 H new ATOM 1883 N LEU A 118 6.614 -1.217 6.743 1.00 0.00 N ATOM 1884 CA LEU A 118 7.235 -2.144 5.803 1.00 0.00 C ATOM 1885 C LEU A 118 8.686 -2.418 6.186 1.00 0.00 C ATOM 1886 O LEU A 118 9.091 -3.570 6.334 1.00 0.00 O ATOM 1887 CB LEU A 118 7.168 -1.581 4.382 1.00 0.00 C ATOM 1888 CG LEU A 118 5.768 -1.294 3.839 1.00 0.00 C ATOM 1889 CD1 LEU A 118 5.838 -0.323 2.670 1.00 0.00 C ATOM 1890 CD2 LEU A 118 5.082 -2.587 3.421 1.00 0.00 C ATOM 0 H LEU A 118 5.972 -0.550 6.315 1.00 0.00 H new ATOM 0 HA LEU A 118 6.685 -3.084 5.841 1.00 0.00 H new ATOM 0 HB2 LEU A 118 7.744 -0.656 4.352 1.00 0.00 H new ATOM 0 HB3 LEU A 118 7.659 -2.285 3.710 1.00 0.00 H new ATOM 0 HG LEU A 118 5.179 -0.834 4.632 1.00 0.00 H new ATOM 0 HD11 LEU A 118 4.832 -0.130 2.296 1.00 0.00 H new ATOM 0 HD12 LEU A 118 6.288 0.613 3.001 1.00 0.00 H new ATOM 0 HD13 LEU A 118 6.444 -0.755 1.874 1.00 0.00 H new ATOM 0 HD21 LEU A 118 4.087 -2.363 3.037 1.00 0.00 H new ATOM 0 HD22 LEU A 118 5.669 -3.076 2.644 1.00 0.00 H new ATOM 0 HD23 LEU A 118 4.998 -3.249 4.283 1.00 0.00 H new ATOM 1902 N GLU A 119 9.462 -1.351 6.346 1.00 0.00 N ATOM 1903 CA GLU A 119 10.867 -1.477 6.713 1.00 0.00 C ATOM 1904 C GLU A 119 11.024 -2.299 7.990 1.00 0.00 C ATOM 1905 O GLU A 119 11.939 -3.113 8.107 1.00 0.00 O ATOM 1906 CB GLU A 119 11.494 -0.095 6.903 1.00 0.00 C ATOM 1907 CG GLU A 119 11.617 0.700 5.614 1.00 0.00 C ATOM 1908 CD GLU A 119 12.337 2.020 5.809 1.00 0.00 C ATOM 1909 OE1 GLU A 119 13.570 2.000 6.009 1.00 0.00 O ATOM 1910 OE2 GLU A 119 11.668 3.074 5.761 1.00 0.00 O ATOM 0 H GLU A 119 9.141 -0.390 6.227 1.00 0.00 H new ATOM 0 HA GLU A 119 11.382 -1.993 5.903 1.00 0.00 H new ATOM 0 HB2 GLU A 119 10.894 0.472 7.614 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.484 -0.212 7.344 1.00 0.00 H new ATOM 0 HG2 GLU A 119 12.152 0.105 4.874 1.00 0.00 H new ATOM 0 HG3 GLU A 119 10.622 0.889 5.212 1.00 0.00 H new ATOM 1917 N GLU A 120 10.124 -2.078 8.943 1.00 0.00 N ATOM 1918 CA GLU A 120 10.164 -2.796 10.211 1.00 0.00 C ATOM 1919 C GLU A 120 10.238 -4.303 9.981 1.00 0.00 C ATOM 1920 O GLU A 120 10.854 -5.031 10.759 1.00 0.00 O ATOM 1921 CB GLU A 120 8.931 -2.458 11.053 1.00 0.00 C ATOM 1922 CG GLU A 120 9.089 -2.796 12.526 1.00 0.00 C ATOM 1923 CD GLU A 120 8.174 -1.975 13.414 1.00 0.00 C ATOM 1924 OE1 GLU A 120 6.945 -2.190 13.360 1.00 0.00 O ATOM 1925 OE2 GLU A 120 8.688 -1.119 14.164 1.00 0.00 O ATOM 0 H GLU A 120 9.359 -1.408 8.861 1.00 0.00 H new ATOM 0 HA GLU A 120 11.059 -2.483 10.748 1.00 0.00 H new ATOM 0 HB2 GLU A 120 8.714 -1.394 10.954 1.00 0.00 H new ATOM 0 HB3 GLU A 120 8.071 -2.997 10.655 1.00 0.00 H new ATOM 0 HG2 GLU A 120 8.881 -3.855 12.676 1.00 0.00 H new ATOM 0 HG3 GLU A 120 10.124 -2.629 12.824 1.00 0.00 H new ATOM 1932 N ARG A 121 9.604 -4.763 8.907 1.00 0.00 N ATOM 1933 CA ARG A 121 9.596 -6.182 8.575 1.00 0.00 C ATOM 1934 C ARG A 121 10.918 -6.599 7.938 1.00 0.00 C ATOM 1935 O ARG A 121 11.407 -7.705 8.168 1.00 0.00 O ATOM 1936 CB ARG A 121 8.438 -6.499 7.626 1.00 0.00 C ATOM 1937 CG ARG A 121 7.068 -6.347 8.265 1.00 0.00 C ATOM 1938 CD ARG A 121 6.606 -7.645 8.909 1.00 0.00 C ATOM 1939 NE ARG A 121 7.064 -7.763 10.291 1.00 0.00 N ATOM 1940 CZ ARG A 121 6.689 -6.938 11.263 1.00 0.00 C ATOM 1941 NH1 ARG A 121 5.854 -5.941 11.005 1.00 0.00 N ATOM 1942 NH2 ARG A 121 7.148 -7.111 12.496 1.00 0.00 N ATOM 0 H ARG A 121 9.090 -4.174 8.253 1.00 0.00 H new ATOM 0 HA ARG A 121 9.464 -6.745 9.499 1.00 0.00 H new ATOM 0 HB2 ARG A 121 8.500 -5.842 6.759 1.00 0.00 H new ATOM 0 HB3 ARG A 121 8.548 -7.520 7.261 1.00 0.00 H new ATOM 0 HG2 ARG A 121 7.102 -5.558 9.017 1.00 0.00 H new ATOM 0 HG3 ARG A 121 6.346 -6.037 7.510 1.00 0.00 H new ATOM 0 HD2 ARG A 121 5.518 -7.696 8.882 1.00 0.00 H new ATOM 0 HD3 ARG A 121 6.979 -8.490 8.330 1.00 0.00 H new ATOM 0 HE ARG A 121 7.707 -8.520 10.523 1.00 0.00 H new ATOM 0 HH11 ARG A 121 5.498 -5.806 10.059 1.00 0.00 H new ATOM 0 HH12 ARG A 121 5.568 -5.309 11.753 1.00 0.00 H new ATOM 0 HH21 ARG A 121 7.789 -7.878 12.699 1.00 0.00 H new ATOM 0 HH22 ARG A 121 6.859 -6.477 13.241 1.00 0.00 H new ATOM 1956 N GLN A 122 11.490 -5.707 7.136 1.00 0.00 N ATOM 1957 CA GLN A 122 12.755 -5.983 6.465 1.00 0.00 C ATOM 1958 C GLN A 122 13.829 -6.384 7.472 1.00 0.00 C ATOM 1959 O GLN A 122 14.441 -7.445 7.350 1.00 0.00 O ATOM 1960 CB GLN A 122 13.215 -4.758 5.673 1.00 0.00 C ATOM 1961 CG GLN A 122 14.551 -4.951 4.975 1.00 0.00 C ATOM 1962 CD GLN A 122 15.720 -4.943 5.940 1.00 0.00 C ATOM 1963 OE1 GLN A 122 15.778 -4.122 6.857 1.00 0.00 O ATOM 1964 NE2 GLN A 122 16.660 -5.859 5.740 1.00 0.00 N ATOM 0 H GLN A 122 11.098 -4.787 6.935 1.00 0.00 H new ATOM 0 HA GLN A 122 12.598 -6.814 5.777 1.00 0.00 H new ATOM 0 HB2 GLN A 122 12.458 -4.512 4.929 1.00 0.00 H new ATOM 0 HB3 GLN A 122 13.287 -3.905 6.348 1.00 0.00 H new ATOM 0 HG2 GLN A 122 14.540 -5.896 4.432 1.00 0.00 H new ATOM 0 HG3 GLN A 122 14.689 -4.161 4.237 1.00 0.00 H new ATOM 0 HE21 GLN A 122 16.572 -6.520 4.968 1.00 0.00 H new ATOM 0 HE22 GLN A 122 17.470 -5.902 6.358 1.00 0.00 H new