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= -1.29 K(o=-1.3,f=-4.3!) USER MOD Set 1.2: A 96 MET CE :methyl -150:sc= -0.0464 (180deg=-0.713) USER MOD Single : A 19 GLN : amide:sc= -0.367 K(o=-0.37,f=-2.2) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 41 SER OG : rot 61:sc= 1.19 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 -125:sc= -0.0178 (180deg=-0.712) USER MOD Single : A 60 MET CE :methyl -146:sc= -0.0565 (180deg=-2.11) USER MOD Single : A 61 HIS : no HD1:sc=-0.00172 X(o=-0.0017,f=-0.015) USER MOD Single : A 62 ASN : amide:sc= -0.458 K(o=-0.46,f=-1.5) USER MOD Single : A 63 TYR OH : rot 180:sc= -0.0754 USER MOD Single : A 67 ASN : amide:sc= 0.137 K(o=0.14,f=-4.6!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= -0.162 K(o=-0.16,f=-2.1!) USER MOD Single : A 71 GLN : amide:sc= -0.619 K(o=-0.62,f=-1.3) USER MOD Single : A 72 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0179) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= 0.0582 K(o=0.058,f=-1.2!) USER MOD Single : A 78 HIS : no HE2:sc= -1.35 K(o=-1.4,f=-2.1) 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 K(o=0,f=-0.65) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ -155:sc= -0.503 (180deg=-1.36!) USER MOD Single : A 101 GLN :FLIP amide:sc= -0.101 F(o=-0.78,f=-0.1) USER MOD Single : A 102 CYS SG : rot -14:sc= 0.0583 USER MOD Single : A 116 GLN : amide:sc= -3.73 K(o=-3.7,f=-11!) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 220 N GLN A 19 8.035 15.054 0.959 1.00 0.00 N ATOM 221 CA GLN A 19 9.005 14.004 1.249 1.00 0.00 C ATOM 222 C GLN A 19 8.391 12.624 1.042 1.00 0.00 C ATOM 223 O GLN A 19 9.043 11.713 0.529 1.00 0.00 O ATOM 224 CB GLN A 19 9.518 14.137 2.684 1.00 0.00 C ATOM 225 CG GLN A 19 10.632 15.160 2.840 1.00 0.00 C ATOM 226 CD GLN A 19 11.907 14.746 2.132 1.00 0.00 C ATOM 227 OE1 GLN A 19 11.981 13.668 1.542 1.00 0.00 O ATOM 228 NE2 GLN A 19 12.920 15.602 2.188 1.00 0.00 N ATOM 0 HA GLN A 19 9.842 14.116 0.560 1.00 0.00 H new ATOM 0 HB2 GLN A 19 8.688 14.414 3.333 1.00 0.00 H new ATOM 0 HB3 GLN A 19 9.878 13.166 3.024 1.00 0.00 H new ATOM 0 HG2 GLN A 19 10.297 16.119 2.446 1.00 0.00 H new ATOM 0 HG3 GLN A 19 10.840 15.306 3.900 1.00 0.00 H new ATOM 0 HE21 GLN A 19 12.815 16.485 2.688 1.00 0.00 H new ATOM 0 HE22 GLN A 19 13.804 15.377 1.731 1.00 0.00 H new ATOM 237 N LEU A 20 7.133 12.475 1.444 1.00 0.00 N ATOM 238 CA LEU A 20 6.430 11.204 1.303 1.00 0.00 C ATOM 239 C LEU A 20 6.096 10.926 -0.159 1.00 0.00 C ATOM 240 O LEU A 20 6.159 9.784 -0.615 1.00 0.00 O ATOM 241 CB LEU A 20 5.149 11.212 2.138 1.00 0.00 C ATOM 242 CG LEU A 20 4.092 10.175 1.756 1.00 0.00 C ATOM 243 CD1 LEU A 20 4.531 8.783 2.185 1.00 0.00 C ATOM 244 CD2 LEU A 20 2.749 10.528 2.378 1.00 0.00 C ATOM 0 H LEU A 20 6.579 13.218 1.870 1.00 0.00 H new ATOM 0 HA LEU A 20 7.086 10.412 1.664 1.00 0.00 H new ATOM 0 HB2 LEU A 20 5.419 11.058 3.183 1.00 0.00 H new ATOM 0 HB3 LEU A 20 4.699 12.202 2.068 1.00 0.00 H new ATOM 0 HG LEU A 20 3.980 10.181 0.672 1.00 0.00 H new ATOM 0 HD11 LEU A 20 3.767 8.058 1.905 1.00 0.00 H new ATOM 0 HD12 LEU A 20 5.470 8.529 1.692 1.00 0.00 H new ATOM 0 HD13 LEU A 20 4.672 8.763 3.266 1.00 0.00 H new ATOM 0 HD21 LEU A 20 2.009 9.779 2.095 1.00 0.00 H new ATOM 0 HD22 LEU A 20 2.846 10.551 3.463 1.00 0.00 H new ATOM 0 HD23 LEU A 20 2.429 11.507 2.021 1.00 0.00 H new ATOM 256 N TYR A 21 5.743 11.978 -0.890 1.00 0.00 N ATOM 257 CA TYR A 21 5.399 11.847 -2.301 1.00 0.00 C ATOM 258 C TYR A 21 6.599 11.370 -3.112 1.00 0.00 C ATOM 259 O TYR A 21 6.491 10.446 -3.919 1.00 0.00 O ATOM 260 CB TYR A 21 4.896 13.183 -2.850 1.00 0.00 C ATOM 261 CG TYR A 21 3.411 13.396 -2.660 1.00 0.00 C ATOM 262 CD1 TYR A 21 2.894 13.755 -1.421 1.00 0.00 C ATOM 263 CD2 TYR A 21 2.525 13.237 -3.718 1.00 0.00 C ATOM 264 CE1 TYR A 21 1.538 13.950 -1.243 1.00 0.00 C ATOM 265 CE2 TYR A 21 1.168 13.431 -3.549 1.00 0.00 C ATOM 266 CZ TYR A 21 0.679 13.787 -2.310 1.00 0.00 C ATOM 267 OH TYR A 21 -0.672 13.980 -2.137 1.00 0.00 O ATOM 0 H TYR A 21 5.688 12.930 -0.529 1.00 0.00 H new ATOM 0 HA TYR A 21 4.606 11.104 -2.389 1.00 0.00 H new ATOM 0 HB2 TYR A 21 5.436 13.994 -2.361 1.00 0.00 H new ATOM 0 HB3 TYR A 21 5.130 13.240 -3.913 1.00 0.00 H new ATOM 0 HD1 TYR A 21 3.563 13.884 -0.583 1.00 0.00 H new ATOM 0 HD2 TYR A 21 2.904 12.957 -4.690 1.00 0.00 H new ATOM 0 HE1 TYR A 21 1.152 14.229 -0.273 1.00 0.00 H new ATOM 0 HE2 TYR A 21 0.494 13.305 -4.383 1.00 0.00 H new ATOM 0 HH TYR A 21 -1.136 13.827 -2.987 1.00 0.00 H new ATOM 277 N LEU A 22 7.744 12.006 -2.892 1.00 0.00 N ATOM 278 CA LEU A 22 8.968 11.648 -3.602 1.00 0.00 C ATOM 279 C LEU A 22 9.243 10.152 -3.490 1.00 0.00 C ATOM 280 O LEU A 22 9.566 9.495 -4.480 1.00 0.00 O ATOM 281 CB LEU A 22 10.153 12.439 -3.047 1.00 0.00 C ATOM 282 CG LEU A 22 10.262 13.894 -3.504 1.00 0.00 C ATOM 283 CD1 LEU A 22 11.389 14.602 -2.768 1.00 0.00 C ATOM 284 CD2 LEU A 22 10.478 13.966 -5.008 1.00 0.00 C ATOM 0 H LEU A 22 7.851 12.772 -2.228 1.00 0.00 H new ATOM 0 HA LEU A 22 8.835 11.897 -4.655 1.00 0.00 H new ATOM 0 HB2 LEU A 22 10.096 12.424 -1.959 1.00 0.00 H new ATOM 0 HB3 LEU A 22 11.071 11.922 -3.325 1.00 0.00 H new ATOM 0 HG LEU A 22 9.326 14.400 -3.267 1.00 0.00 H new ATOM 0 HD11 LEU A 22 11.451 15.636 -3.106 1.00 0.00 H new ATOM 0 HD12 LEU A 22 11.192 14.582 -1.696 1.00 0.00 H new ATOM 0 HD13 LEU A 22 12.332 14.096 -2.973 1.00 0.00 H new ATOM 0 HD21 LEU A 22 10.553 15.009 -5.315 1.00 0.00 H new ATOM 0 HD22 LEU A 22 11.398 13.444 -5.269 1.00 0.00 H new ATOM 0 HD23 LEU A 22 9.637 13.497 -5.519 1.00 0.00 H new ATOM 296 N TRP A 23 9.112 9.620 -2.280 1.00 0.00 N ATOM 297 CA TRP A 23 9.346 8.201 -2.040 1.00 0.00 C ATOM 298 C TRP A 23 8.587 7.346 -3.049 1.00 0.00 C ATOM 299 O TRP A 23 9.036 6.262 -3.421 1.00 0.00 O ATOM 300 CB TRP A 23 8.924 7.827 -0.618 1.00 0.00 C ATOM 301 CG TRP A 23 8.769 6.351 -0.413 1.00 0.00 C ATOM 302 CD1 TRP A 23 9.734 5.396 -0.562 1.00 0.00 C ATOM 303 CD2 TRP A 23 7.576 5.660 -0.023 1.00 0.00 C ATOM 304 NE1 TRP A 23 9.214 4.154 -0.289 1.00 0.00 N ATOM 305 CE2 TRP A 23 7.892 4.289 0.045 1.00 0.00 C ATOM 306 CE3 TRP A 23 6.274 6.067 0.276 1.00 0.00 C ATOM 307 CZ2 TRP A 23 6.952 3.326 0.399 1.00 0.00 C ATOM 308 CZ3 TRP A 23 5.341 5.109 0.627 1.00 0.00 C ATOM 309 CH2 TRP A 23 5.684 3.752 0.687 1.00 0.00 C ATOM 0 H TRP A 23 8.845 10.150 -1.450 1.00 0.00 H new ATOM 0 HA TRP A 23 10.412 8.009 -2.158 1.00 0.00 H new ATOM 0 HB2 TRP A 23 9.664 8.208 0.085 1.00 0.00 H new ATOM 0 HB3 TRP A 23 7.980 8.320 -0.385 1.00 0.00 H new ATOM 0 HD1 TRP A 23 10.756 5.589 -0.852 1.00 0.00 H new ATOM 0 HE1 TRP A 23 9.729 3.274 -0.329 1.00 0.00 H new ATOM 0 HE3 TRP A 23 6.001 7.111 0.234 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 7.214 2.279 0.445 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 4.331 5.412 0.859 1.00 0.00 H new ATOM 0 HH2 TRP A 23 4.933 3.028 0.966 1.00 0.00 H new ATOM 320 N VAL A 24 7.434 7.841 -3.490 1.00 0.00 N ATOM 321 CA VAL A 24 6.614 7.123 -4.458 1.00 0.00 C ATOM 322 C VAL A 24 7.298 7.058 -5.818 1.00 0.00 C ATOM 323 O VAL A 24 7.453 5.982 -6.397 1.00 0.00 O ATOM 324 CB VAL A 24 5.232 7.783 -4.621 1.00 0.00 C ATOM 325 CG1 VAL A 24 4.423 7.070 -5.694 1.00 0.00 C ATOM 326 CG2 VAL A 24 4.485 7.791 -3.296 1.00 0.00 C ATOM 0 H VAL A 24 7.047 8.737 -3.192 1.00 0.00 H new ATOM 0 HA VAL A 24 6.483 6.112 -4.073 1.00 0.00 H new ATOM 0 HB VAL A 24 5.378 8.816 -4.936 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.450 7.550 -5.795 1.00 0.00 H new ATOM 0 HG12 VAL A 24 4.954 7.122 -6.645 1.00 0.00 H new ATOM 0 HG13 VAL A 24 4.285 6.026 -5.412 1.00 0.00 H new ATOM 0 HG21 VAL A 24 3.511 8.261 -3.430 1.00 0.00 H new ATOM 0 HG22 VAL A 24 4.349 6.767 -2.949 1.00 0.00 H new ATOM 0 HG23 VAL A 24 5.059 8.351 -2.558 1.00 0.00 H new ATOM 336 N ASP A 25 7.708 8.217 -6.324 1.00 0.00 N ATOM 337 CA ASP A 25 8.378 8.292 -7.616 1.00 0.00 C ATOM 338 C ASP A 25 9.403 7.172 -7.764 1.00 0.00 C ATOM 339 O ASP A 25 9.405 6.447 -8.757 1.00 0.00 O ATOM 340 CB ASP A 25 9.062 9.650 -7.781 1.00 0.00 C ATOM 341 CG ASP A 25 9.711 9.810 -9.142 1.00 0.00 C ATOM 342 OD1 ASP A 25 10.442 8.889 -9.563 1.00 0.00 O ATOM 343 OD2 ASP A 25 9.488 10.856 -9.786 1.00 0.00 O ATOM 0 H ASP A 25 7.588 9.117 -5.858 1.00 0.00 H new ATOM 0 HA ASP A 25 7.625 8.175 -8.395 1.00 0.00 H new ATOM 0 HB2 ASP A 25 8.328 10.443 -7.636 1.00 0.00 H new ATOM 0 HB3 ASP A 25 9.818 9.769 -7.005 1.00 0.00 H new ATOM 348 N ASN A 26 10.273 7.038 -6.768 1.00 0.00 N ATOM 349 CA ASN A 26 11.304 6.006 -6.787 1.00 0.00 C ATOM 350 C ASN A 26 10.716 4.657 -7.190 1.00 0.00 C ATOM 351 O ASN A 26 11.346 3.885 -7.914 1.00 0.00 O ATOM 352 CB ASN A 26 11.970 5.896 -5.415 1.00 0.00 C ATOM 353 CG ASN A 26 12.922 4.718 -5.327 1.00 0.00 C ATOM 354 OD1 ASN A 26 13.622 4.399 -6.287 1.00 0.00 O ATOM 355 ND2 ASN A 26 12.950 4.066 -4.170 1.00 0.00 N ATOM 0 H ASN A 26 10.285 7.631 -5.938 1.00 0.00 H new ATOM 0 HA ASN A 26 12.054 6.290 -7.525 1.00 0.00 H new ATOM 0 HB2 ASN A 26 12.515 6.816 -5.204 1.00 0.00 H new ATOM 0 HB3 ASN A 26 11.202 5.797 -4.648 1.00 0.00 H new ATOM 0 HD21 ASN A 26 13.570 3.265 -4.051 1.00 0.00 H new ATOM 0 HD22 ASN A 26 12.351 4.366 -3.401 1.00 0.00 H new ATOM 362 N ILE A 27 9.506 4.380 -6.715 1.00 0.00 N ATOM 363 CA ILE A 27 8.833 3.125 -7.027 1.00 0.00 C ATOM 364 C ILE A 27 7.976 3.258 -8.281 1.00 0.00 C ATOM 365 O ILE A 27 7.195 4.197 -8.432 1.00 0.00 O ATOM 366 CB ILE A 27 7.945 2.658 -5.858 1.00 0.00 C ATOM 367 CG1 ILE A 27 8.794 2.418 -4.608 1.00 0.00 C ATOM 368 CG2 ILE A 27 7.187 1.395 -6.241 1.00 0.00 C ATOM 369 CD1 ILE A 27 7.976 2.121 -3.371 1.00 0.00 C ATOM 0 H ILE A 27 8.972 5.007 -6.113 1.00 0.00 H new ATOM 0 HA ILE A 27 9.612 2.383 -7.200 1.00 0.00 H new ATOM 0 HB ILE A 27 7.220 3.441 -5.636 1.00 0.00 H new ATOM 0 HG12 ILE A 27 9.473 1.585 -4.794 1.00 0.00 H new ATOM 0 HG13 ILE A 27 9.411 3.297 -4.423 1.00 0.00 H new ATOM 0 HG21 ILE A 27 6.564 1.077 -5.405 1.00 0.00 H new ATOM 0 HG22 ILE A 27 6.557 1.597 -7.107 1.00 0.00 H new ATOM 0 HG23 ILE A 27 7.897 0.605 -6.486 1.00 0.00 H new ATOM 0 HD11 ILE A 27 8.643 1.962 -2.524 1.00 0.00 H new ATOM 0 HD12 ILE A 27 7.316 2.963 -3.160 1.00 0.00 H new ATOM 0 HD13 ILE A 27 7.379 1.224 -3.536 1.00 0.00 H new ATOM 577 N ASP A 39 -5.437 8.593 -7.677 1.00 0.00 N ATOM 578 CA ASP A 39 -5.324 7.158 -7.909 1.00 0.00 C ATOM 579 C ASP A 39 -5.196 6.403 -6.589 1.00 0.00 C ATOM 580 O ASP A 39 -5.870 5.396 -6.370 1.00 0.00 O ATOM 581 CB ASP A 39 -4.120 6.857 -8.802 1.00 0.00 C ATOM 582 CG ASP A 39 -4.301 5.588 -9.611 1.00 0.00 C ATOM 583 OD1 ASP A 39 -5.389 4.980 -9.525 1.00 0.00 O ATOM 584 OD2 ASP A 39 -3.356 5.203 -10.330 1.00 0.00 O ATOM 0 HA ASP A 39 -6.231 6.824 -8.412 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -3.955 7.695 -9.479 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -3.227 6.766 -8.184 1.00 0.00 H new ATOM 589 N PHE A 40 -4.326 6.895 -5.714 1.00 0.00 N ATOM 590 CA PHE A 40 -4.107 6.266 -4.417 1.00 0.00 C ATOM 591 C PHE A 40 -5.430 6.046 -3.689 1.00 0.00 C ATOM 592 O PHE A 40 -5.591 5.075 -2.950 1.00 0.00 O ATOM 593 CB PHE A 40 -3.177 7.127 -3.559 1.00 0.00 C ATOM 594 CG PHE A 40 -1.723 6.793 -3.731 1.00 0.00 C ATOM 595 CD1 PHE A 40 -1.083 7.029 -4.937 1.00 0.00 C ATOM 596 CD2 PHE A 40 -0.997 6.243 -2.687 1.00 0.00 C ATOM 597 CE1 PHE A 40 0.255 6.721 -5.098 1.00 0.00 C ATOM 598 CE2 PHE A 40 0.342 5.934 -2.842 1.00 0.00 C ATOM 599 CZ PHE A 40 0.969 6.175 -4.049 1.00 0.00 C ATOM 0 H PHE A 40 -3.761 7.728 -5.879 1.00 0.00 H new ATOM 0 HA PHE A 40 -3.640 5.296 -4.586 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -3.333 8.176 -3.809 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -3.448 7.006 -2.510 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -1.635 7.458 -5.760 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -1.482 6.053 -1.741 1.00 0.00 H new ATOM 0 HE1 PHE A 40 0.742 6.907 -6.044 1.00 0.00 H new ATOM 0 HE2 PHE A 40 0.897 5.505 -2.021 1.00 0.00 H new ATOM 0 HZ PHE A 40 2.015 5.937 -4.172 1.00 0.00 H new ATOM 609 N SER A 41 -6.375 6.956 -3.904 1.00 0.00 N ATOM 610 CA SER A 41 -7.683 6.865 -3.266 1.00 0.00 C ATOM 611 C SER A 41 -8.132 5.412 -3.151 1.00 0.00 C ATOM 612 O SER A 41 -8.848 5.043 -2.220 1.00 0.00 O ATOM 613 CB SER A 41 -8.717 7.669 -4.057 1.00 0.00 C ATOM 614 OG SER A 41 -10.022 7.470 -3.540 1.00 0.00 O ATOM 0 H SER A 41 -6.259 7.764 -4.515 1.00 0.00 H new ATOM 0 HA SER A 41 -7.599 7.282 -2.262 1.00 0.00 H new ATOM 0 HB2 SER A 41 -8.465 8.729 -4.019 1.00 0.00 H new ATOM 0 HB3 SER A 41 -8.689 7.372 -5.105 1.00 0.00 H new ATOM 0 HG SER A 41 -10.052 7.764 -2.606 1.00 0.00 H new ATOM 620 N ASP A 42 -7.704 4.590 -4.104 1.00 0.00 N ATOM 621 CA ASP A 42 -8.060 3.176 -4.110 1.00 0.00 C ATOM 622 C ASP A 42 -6.904 2.323 -3.597 1.00 0.00 C ATOM 623 O ASP A 42 -5.737 2.650 -3.807 1.00 0.00 O ATOM 624 CB ASP A 42 -8.450 2.733 -5.521 1.00 0.00 C ATOM 625 CG ASP A 42 -7.282 2.778 -6.486 1.00 0.00 C ATOM 626 OD1 ASP A 42 -6.202 2.258 -6.135 1.00 0.00 O ATOM 627 OD2 ASP A 42 -7.448 3.333 -7.592 1.00 0.00 O ATOM 0 H ASP A 42 -7.110 4.879 -4.882 1.00 0.00 H new ATOM 0 HA ASP A 42 -8.913 3.038 -3.445 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -8.847 1.719 -5.483 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -9.249 3.375 -5.892 1.00 0.00 H new ATOM 632 N GLY A 43 -7.238 1.227 -2.922 1.00 0.00 N ATOM 633 CA GLY A 43 -6.218 0.344 -2.388 1.00 0.00 C ATOM 634 C GLY A 43 -5.468 -0.400 -3.476 1.00 0.00 C ATOM 635 O GLY A 43 -4.276 -0.677 -3.340 1.00 0.00 O ATOM 0 H GLY A 43 -8.197 0.935 -2.736 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -5.511 0.926 -1.797 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -6.682 -0.376 -1.713 1.00 0.00 H new ATOM 639 N VAL A 44 -6.168 -0.726 -4.558 1.00 0.00 N ATOM 640 CA VAL A 44 -5.562 -1.444 -5.673 1.00 0.00 C ATOM 641 C VAL A 44 -4.121 -0.998 -5.895 1.00 0.00 C ATOM 642 O VAL A 44 -3.196 -1.811 -5.866 1.00 0.00 O ATOM 643 CB VAL A 44 -6.358 -1.234 -6.974 1.00 0.00 C ATOM 644 CG1 VAL A 44 -5.636 -1.872 -8.151 1.00 0.00 C ATOM 645 CG2 VAL A 44 -7.765 -1.797 -6.834 1.00 0.00 C ATOM 0 H VAL A 44 -7.155 -0.504 -4.686 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.576 -2.503 -5.413 1.00 0.00 H new ATOM 0 HB VAL A 44 -6.436 -0.163 -7.163 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -6.214 -1.713 -9.062 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -4.651 -1.419 -8.263 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -5.525 -2.942 -7.973 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.314 -1.640 -7.763 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -7.710 -2.865 -6.621 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -8.280 -1.290 -6.018 1.00 0.00 H new ATOM 655 N LEU A 45 -3.936 0.299 -6.115 1.00 0.00 N ATOM 656 CA LEU A 45 -2.606 0.855 -6.341 1.00 0.00 C ATOM 657 C LEU A 45 -1.728 0.685 -5.106 1.00 0.00 C ATOM 658 O LEU A 45 -0.600 0.198 -5.195 1.00 0.00 O ATOM 659 CB LEU A 45 -2.707 2.336 -6.709 1.00 0.00 C ATOM 660 CG LEU A 45 -1.388 3.038 -7.036 1.00 0.00 C ATOM 661 CD1 LEU A 45 -0.866 2.590 -8.392 1.00 0.00 C ATOM 662 CD2 LEU A 45 -1.565 4.549 -7.003 1.00 0.00 C ATOM 0 H LEU A 45 -4.690 0.985 -6.142 1.00 0.00 H new ATOM 0 HA LEU A 45 -2.148 0.312 -7.167 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -3.369 2.432 -7.569 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -3.181 2.864 -5.882 1.00 0.00 H new ATOM 0 HG LEU A 45 -0.655 2.762 -6.278 1.00 0.00 H new ATOM 0 HD11 LEU A 45 0.073 3.100 -8.607 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.699 1.513 -8.380 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -1.597 2.835 -9.162 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -0.616 5.032 -7.238 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -2.314 4.844 -7.738 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -1.892 4.855 -6.009 1.00 0.00 H new ATOM 674 N VAL A 46 -2.252 1.087 -3.953 1.00 0.00 N ATOM 675 CA VAL A 46 -1.518 0.976 -2.698 1.00 0.00 C ATOM 676 C VAL A 46 -0.838 -0.383 -2.577 1.00 0.00 C ATOM 677 O VAL A 46 0.343 -0.470 -2.244 1.00 0.00 O ATOM 678 CB VAL A 46 -2.443 1.185 -1.485 1.00 0.00 C ATOM 679 CG1 VAL A 46 -1.682 0.959 -0.187 1.00 0.00 C ATOM 680 CG2 VAL A 46 -3.058 2.576 -1.517 1.00 0.00 C ATOM 0 H VAL A 46 -3.183 1.493 -3.862 1.00 0.00 H new ATOM 0 HA VAL A 46 -0.760 1.759 -2.705 1.00 0.00 H new ATOM 0 HB VAL A 46 -3.250 0.455 -1.536 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -2.352 1.111 0.659 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -1.295 -0.060 -0.165 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -0.853 1.663 -0.124 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -3.709 2.706 -0.652 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -2.266 3.325 -1.491 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -3.640 2.695 -2.431 1.00 0.00 H new ATOM 690 N ALA A 47 -1.593 -1.442 -2.852 1.00 0.00 N ATOM 691 CA ALA A 47 -1.063 -2.798 -2.776 1.00 0.00 C ATOM 692 C ALA A 47 0.267 -2.909 -3.514 1.00 0.00 C ATOM 693 O ALA A 47 1.199 -3.555 -3.037 1.00 0.00 O ATOM 694 CB ALA A 47 -2.068 -3.790 -3.343 1.00 0.00 C ATOM 0 H ALA A 47 -2.573 -1.387 -3.129 1.00 0.00 H new ATOM 0 HA ALA A 47 -0.888 -3.035 -1.727 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -1.659 -4.798 -3.280 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -2.994 -3.737 -2.770 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -2.272 -3.546 -4.386 1.00 0.00 H new ATOM 700 N GLU A 48 0.346 -2.276 -4.681 1.00 0.00 N ATOM 701 CA GLU A 48 1.562 -2.307 -5.485 1.00 0.00 C ATOM 702 C GLU A 48 2.766 -1.843 -4.669 1.00 0.00 C ATOM 703 O GLU A 48 3.837 -2.448 -4.724 1.00 0.00 O ATOM 704 CB GLU A 48 1.403 -1.424 -6.725 1.00 0.00 C ATOM 705 CG GLU A 48 0.228 -1.817 -7.604 1.00 0.00 C ATOM 706 CD GLU A 48 0.426 -1.420 -9.054 1.00 0.00 C ATOM 707 OE1 GLU A 48 0.072 -0.277 -9.411 1.00 0.00 O ATOM 708 OE2 GLU A 48 0.936 -2.254 -9.833 1.00 0.00 O ATOM 0 H GLU A 48 -0.417 -1.736 -5.090 1.00 0.00 H new ATOM 0 HA GLU A 48 1.732 -3.337 -5.800 1.00 0.00 H new ATOM 0 HB2 GLU A 48 1.280 -0.388 -6.410 1.00 0.00 H new ATOM 0 HB3 GLU A 48 2.319 -1.471 -7.314 1.00 0.00 H new ATOM 0 HG2 GLU A 48 0.078 -2.895 -7.543 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -0.679 -1.347 -7.223 1.00 0.00 H new ATOM 715 N VAL A 49 2.581 -0.766 -3.912 1.00 0.00 N ATOM 716 CA VAL A 49 3.650 -0.221 -3.084 1.00 0.00 C ATOM 717 C VAL A 49 4.306 -1.312 -2.246 1.00 0.00 C ATOM 718 O VAL A 49 5.529 -1.461 -2.250 1.00 0.00 O ATOM 719 CB VAL A 49 3.127 0.885 -2.149 1.00 0.00 C ATOM 720 CG1 VAL A 49 4.237 1.380 -1.234 1.00 0.00 C ATOM 721 CG2 VAL A 49 2.539 2.032 -2.957 1.00 0.00 C ATOM 0 H VAL A 49 1.701 -0.254 -3.855 1.00 0.00 H new ATOM 0 HA VAL A 49 4.389 0.206 -3.762 1.00 0.00 H new ATOM 0 HB VAL A 49 2.336 0.467 -1.527 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.849 2.161 -0.581 1.00 0.00 H new ATOM 0 HG12 VAL A 49 4.607 0.552 -0.629 1.00 0.00 H new ATOM 0 HG13 VAL A 49 5.052 1.782 -1.836 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.174 2.805 -2.280 1.00 0.00 H new ATOM 0 HG22 VAL A 49 3.308 2.452 -3.606 1.00 0.00 H new ATOM 0 HG23 VAL A 49 1.713 1.663 -3.565 1.00 0.00 H new ATOM 731 N ILE A 50 3.487 -2.073 -1.528 1.00 0.00 N ATOM 732 CA ILE A 50 3.988 -3.151 -0.686 1.00 0.00 C ATOM 733 C ILE A 50 4.784 -4.163 -1.504 1.00 0.00 C ATOM 734 O ILE A 50 5.884 -4.561 -1.120 1.00 0.00 O ATOM 735 CB ILE A 50 2.840 -3.882 0.036 1.00 0.00 C ATOM 736 CG1 ILE A 50 1.972 -2.881 0.802 1.00 0.00 C ATOM 737 CG2 ILE A 50 3.395 -4.940 0.978 1.00 0.00 C ATOM 738 CD1 ILE A 50 0.525 -3.305 0.923 1.00 0.00 C ATOM 0 H ILE A 50 2.473 -1.962 -1.513 1.00 0.00 H new ATOM 0 HA ILE A 50 4.641 -2.693 0.057 1.00 0.00 H new ATOM 0 HB ILE A 50 2.218 -4.378 -0.710 1.00 0.00 H new ATOM 0 HG12 ILE A 50 2.386 -2.743 1.801 1.00 0.00 H new ATOM 0 HG13 ILE A 50 2.018 -1.914 0.301 1.00 0.00 H new ATOM 0 HG21 ILE A 50 2.572 -5.448 1.481 1.00 0.00 H new ATOM 0 HG22 ILE A 50 3.975 -5.666 0.408 1.00 0.00 H new ATOM 0 HG23 ILE A 50 4.036 -4.465 1.721 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -0.031 -2.549 1.477 1.00 0.00 H new ATOM 0 HD12 ILE A 50 0.094 -3.416 -0.072 1.00 0.00 H new ATOM 0 HD13 ILE A 50 0.468 -4.257 1.451 1.00 0.00 H new ATOM 750 N LYS A 51 4.222 -4.574 -2.635 1.00 0.00 N ATOM 751 CA LYS A 51 4.879 -5.537 -3.511 1.00 0.00 C ATOM 752 C LYS A 51 6.390 -5.329 -3.511 1.00 0.00 C ATOM 753 O LYS A 51 7.146 -6.196 -3.073 1.00 0.00 O ATOM 754 CB LYS A 51 4.337 -5.414 -4.936 1.00 0.00 C ATOM 755 CG LYS A 51 4.365 -6.719 -5.713 1.00 0.00 C ATOM 756 CD LYS A 51 5.788 -7.149 -6.029 1.00 0.00 C ATOM 757 CE LYS A 51 6.378 -6.328 -7.166 1.00 0.00 C ATOM 758 NZ LYS A 51 5.929 -6.822 -8.497 1.00 0.00 N ATOM 0 H LYS A 51 3.312 -4.255 -2.967 1.00 0.00 H new ATOM 0 HA LYS A 51 4.667 -6.537 -3.134 1.00 0.00 H new ATOM 0 HB2 LYS A 51 3.311 -5.047 -4.895 1.00 0.00 H new ATOM 0 HB3 LYS A 51 4.921 -4.668 -5.475 1.00 0.00 H new ATOM 0 HG2 LYS A 51 3.868 -7.498 -5.135 1.00 0.00 H new ATOM 0 HG3 LYS A 51 3.804 -6.603 -6.641 1.00 0.00 H new ATOM 0 HD2 LYS A 51 6.408 -7.040 -5.140 1.00 0.00 H new ATOM 0 HD3 LYS A 51 5.799 -8.205 -6.297 1.00 0.00 H new ATOM 0 HE2 LYS A 51 6.087 -5.284 -7.049 1.00 0.00 H new ATOM 0 HE3 LYS A 51 7.466 -6.364 -7.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 6.352 -6.237 -9.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 6.228 -7.810 -8.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 4.892 -6.764 -8.557 1.00 0.00 H new ATOM 772 N PHE A 52 6.824 -4.173 -4.004 1.00 0.00 N ATOM 773 CA PHE A 52 8.245 -3.851 -4.060 1.00 0.00 C ATOM 774 C PHE A 52 8.979 -4.415 -2.846 1.00 0.00 C ATOM 775 O PHE A 52 9.890 -5.231 -2.982 1.00 0.00 O ATOM 776 CB PHE A 52 8.444 -2.336 -4.132 1.00 0.00 C ATOM 777 CG PHE A 52 9.780 -1.932 -4.688 1.00 0.00 C ATOM 778 CD1 PHE A 52 10.909 -1.936 -3.885 1.00 0.00 C ATOM 779 CD2 PHE A 52 9.907 -1.550 -6.014 1.00 0.00 C ATOM 780 CE1 PHE A 52 12.139 -1.564 -4.393 1.00 0.00 C ATOM 781 CE2 PHE A 52 11.134 -1.178 -6.528 1.00 0.00 C ATOM 782 CZ PHE A 52 12.252 -1.186 -5.717 1.00 0.00 C ATOM 0 H PHE A 52 6.212 -3.444 -4.370 1.00 0.00 H new ATOM 0 HA PHE A 52 8.660 -4.308 -4.958 1.00 0.00 H new ATOM 0 HB2 PHE A 52 7.657 -1.903 -4.749 1.00 0.00 H new ATOM 0 HB3 PHE A 52 8.333 -1.915 -3.133 1.00 0.00 H new ATOM 0 HD1 PHE A 52 10.827 -2.233 -2.850 1.00 0.00 H new ATOM 0 HD2 PHE A 52 9.036 -1.543 -6.653 1.00 0.00 H new ATOM 0 HE1 PHE A 52 13.011 -1.569 -3.756 1.00 0.00 H new ATOM 0 HE2 PHE A 52 11.219 -0.881 -7.563 1.00 0.00 H new ATOM 0 HZ PHE A 52 13.213 -0.897 -6.117 1.00 0.00 H new ATOM 792 N TYR A 53 8.575 -3.972 -1.661 1.00 0.00 N ATOM 793 CA TYR A 53 9.195 -4.429 -0.423 1.00 0.00 C ATOM 794 C TYR A 53 8.973 -5.925 -0.222 1.00 0.00 C ATOM 795 O TYR A 53 9.926 -6.699 -0.131 1.00 0.00 O ATOM 796 CB TYR A 53 8.633 -3.654 0.770 1.00 0.00 C ATOM 797 CG TYR A 53 9.205 -2.262 0.912 1.00 0.00 C ATOM 798 CD1 TYR A 53 8.750 -1.218 0.116 1.00 0.00 C ATOM 799 CD2 TYR A 53 10.201 -1.990 1.843 1.00 0.00 C ATOM 800 CE1 TYR A 53 9.271 0.056 0.242 1.00 0.00 C ATOM 801 CE2 TYR A 53 10.727 -0.720 1.976 1.00 0.00 C ATOM 802 CZ TYR A 53 10.259 0.300 1.173 1.00 0.00 C ATOM 803 OH TYR A 53 10.779 1.567 1.303 1.00 0.00 O ATOM 0 H TYR A 53 7.821 -3.297 -1.531 1.00 0.00 H new ATOM 0 HA TYR A 53 10.267 -4.246 -0.495 1.00 0.00 H new ATOM 0 HB2 TYR A 53 7.550 -3.584 0.669 1.00 0.00 H new ATOM 0 HB3 TYR A 53 8.833 -4.215 1.683 1.00 0.00 H new ATOM 0 HD1 TYR A 53 7.976 -1.405 -0.614 1.00 0.00 H new ATOM 0 HD2 TYR A 53 10.570 -2.786 2.473 1.00 0.00 H new ATOM 0 HE1 TYR A 53 8.906 0.856 -0.385 1.00 0.00 H new ATOM 0 HE2 TYR A 53 11.500 -0.526 2.704 1.00 0.00 H new ATOM 0 HH TYR A 53 11.464 1.569 2.003 1.00 0.00 H new ATOM 813 N PHE A 54 7.708 -6.325 -0.154 1.00 0.00 N ATOM 814 CA PHE A 54 7.358 -7.728 0.036 1.00 0.00 C ATOM 815 C PHE A 54 6.324 -8.175 -0.993 1.00 0.00 C ATOM 816 O PHE A 54 5.121 -7.972 -0.830 1.00 0.00 O ATOM 817 CB PHE A 54 6.818 -7.954 1.450 1.00 0.00 C ATOM 818 CG PHE A 54 7.729 -7.440 2.529 1.00 0.00 C ATOM 819 CD1 PHE A 54 8.918 -8.091 2.817 1.00 0.00 C ATOM 820 CD2 PHE A 54 7.396 -6.308 3.254 1.00 0.00 C ATOM 821 CE1 PHE A 54 9.758 -7.621 3.809 1.00 0.00 C ATOM 822 CE2 PHE A 54 8.232 -5.833 4.247 1.00 0.00 C ATOM 823 CZ PHE A 54 9.414 -6.491 4.525 1.00 0.00 C ATOM 0 H PHE A 54 6.907 -5.697 -0.228 1.00 0.00 H new ATOM 0 HA PHE A 54 8.261 -8.323 -0.100 1.00 0.00 H new ATOM 0 HB2 PHE A 54 5.848 -7.466 1.542 1.00 0.00 H new ATOM 0 HB3 PHE A 54 6.654 -9.021 1.602 1.00 0.00 H new ATOM 0 HD1 PHE A 54 9.191 -8.975 2.260 1.00 0.00 H new ATOM 0 HD2 PHE A 54 6.472 -5.790 3.041 1.00 0.00 H new ATOM 0 HE1 PHE A 54 10.682 -8.137 4.024 1.00 0.00 H new ATOM 0 HE2 PHE A 54 7.961 -4.949 4.805 1.00 0.00 H new ATOM 0 HZ PHE A 54 10.068 -6.123 5.301 1.00 0.00 H new ATOM 833 N PRO A 55 6.803 -8.799 -2.079 1.00 0.00 N ATOM 834 CA PRO A 55 5.938 -9.288 -3.157 1.00 0.00 C ATOM 835 C PRO A 55 5.093 -10.481 -2.725 1.00 0.00 C ATOM 836 O PRO A 55 4.087 -10.804 -3.357 1.00 0.00 O ATOM 837 CB PRO A 55 6.930 -9.702 -4.247 1.00 0.00 C ATOM 838 CG PRO A 55 8.190 -10.011 -3.516 1.00 0.00 C ATOM 839 CD PRO A 55 8.226 -9.074 -2.340 1.00 0.00 C ATOM 0 HA PRO A 55 5.221 -8.533 -3.479 1.00 0.00 H new ATOM 0 HB2 PRO A 55 6.571 -10.570 -4.800 1.00 0.00 H new ATOM 0 HB3 PRO A 55 7.079 -8.901 -4.971 1.00 0.00 H new ATOM 0 HG2 PRO A 55 8.206 -11.050 -3.188 1.00 0.00 H new ATOM 0 HG3 PRO A 55 9.059 -9.866 -4.158 1.00 0.00 H new ATOM 0 HD2 PRO A 55 8.712 -9.530 -1.477 1.00 0.00 H new ATOM 0 HD3 PRO A 55 8.776 -8.161 -2.570 1.00 0.00 H new ATOM 847 N LYS A 56 5.506 -11.133 -1.643 1.00 0.00 N ATOM 848 CA LYS A 56 4.786 -12.289 -1.124 1.00 0.00 C ATOM 849 C LYS A 56 3.536 -11.856 -0.364 1.00 0.00 C ATOM 850 O LYS A 56 2.522 -12.554 -0.370 1.00 0.00 O ATOM 851 CB LYS A 56 5.694 -13.112 -0.207 1.00 0.00 C ATOM 852 CG LYS A 56 6.245 -12.324 0.968 1.00 0.00 C ATOM 853 CD LYS A 56 6.806 -13.243 2.041 1.00 0.00 C ATOM 854 CE LYS A 56 8.193 -13.747 1.674 1.00 0.00 C ATOM 855 NZ LYS A 56 8.620 -14.878 2.544 1.00 0.00 N ATOM 0 H LYS A 56 6.337 -10.880 -1.108 1.00 0.00 H new ATOM 0 HA LYS A 56 4.480 -12.905 -1.970 1.00 0.00 H new ATOM 0 HB2 LYS A 56 5.135 -13.968 0.170 1.00 0.00 H new ATOM 0 HB3 LYS A 56 6.525 -13.506 -0.791 1.00 0.00 H new ATOM 0 HG2 LYS A 56 7.027 -11.649 0.620 1.00 0.00 H new ATOM 0 HG3 LYS A 56 5.456 -11.705 1.394 1.00 0.00 H new ATOM 0 HD2 LYS A 56 6.851 -12.710 2.991 1.00 0.00 H new ATOM 0 HD3 LYS A 56 6.135 -14.091 2.183 1.00 0.00 H new ATOM 0 HE2 LYS A 56 8.199 -14.068 0.632 1.00 0.00 H new ATOM 0 HE3 LYS A 56 8.911 -12.931 1.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 9.570 -15.193 2.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 8.639 -14.565 3.536 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 7.949 -15.666 2.442 1.00 0.00 H new ATOM 869 N MET A 57 3.616 -10.701 0.288 1.00 0.00 N ATOM 870 CA MET A 57 2.490 -10.174 1.050 1.00 0.00 C ATOM 871 C MET A 57 1.323 -9.832 0.129 1.00 0.00 C ATOM 872 O MET A 57 0.177 -10.188 0.405 1.00 0.00 O ATOM 873 CB MET A 57 2.915 -8.933 1.837 1.00 0.00 C ATOM 874 CG MET A 57 3.768 -9.248 3.055 1.00 0.00 C ATOM 875 SD MET A 57 4.478 -7.772 3.807 1.00 0.00 S ATOM 876 CE MET A 57 3.114 -7.223 4.831 1.00 0.00 C ATOM 0 H MET A 57 4.449 -10.112 0.304 1.00 0.00 H new ATOM 0 HA MET A 57 2.164 -10.944 1.749 1.00 0.00 H new ATOM 0 HB2 MET A 57 3.471 -8.267 1.177 1.00 0.00 H new ATOM 0 HB3 MET A 57 2.024 -8.393 2.158 1.00 0.00 H new ATOM 0 HG2 MET A 57 3.160 -9.771 3.794 1.00 0.00 H new ATOM 0 HG3 MET A 57 4.571 -9.926 2.766 1.00 0.00 H new ATOM 0 HE1 MET A 57 2.868 -6.190 4.586 1.00 0.00 H new ATOM 0 HE2 MET A 57 2.245 -7.855 4.649 1.00 0.00 H new ATOM 0 HE3 MET A 57 3.398 -7.290 5.881 1.00 0.00 H new ATOM 886 N VAL A 58 1.622 -9.139 -0.965 1.00 0.00 N ATOM 887 CA VAL A 58 0.597 -8.749 -1.927 1.00 0.00 C ATOM 888 C VAL A 58 -0.045 -9.973 -2.571 1.00 0.00 C ATOM 889 O VAL A 58 0.643 -10.923 -2.943 1.00 0.00 O ATOM 890 CB VAL A 58 1.178 -7.846 -3.031 1.00 0.00 C ATOM 891 CG1 VAL A 58 0.102 -7.476 -4.040 1.00 0.00 C ATOM 892 CG2 VAL A 58 1.803 -6.599 -2.424 1.00 0.00 C ATOM 0 H VAL A 58 2.565 -8.836 -1.208 1.00 0.00 H new ATOM 0 HA VAL A 58 -0.161 -8.193 -1.375 1.00 0.00 H new ATOM 0 HB VAL A 58 1.958 -8.398 -3.555 1.00 0.00 H new ATOM 0 HG11 VAL A 58 0.531 -6.838 -4.812 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -0.295 -8.382 -4.497 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -0.703 -6.942 -3.534 1.00 0.00 H new ATOM 0 HG21 VAL A 58 2.209 -5.972 -3.218 1.00 0.00 H new ATOM 0 HG22 VAL A 58 1.044 -6.042 -1.874 1.00 0.00 H new ATOM 0 HG23 VAL A 58 2.605 -6.888 -1.744 1.00 0.00 H new ATOM 902 N GLU A 59 -1.368 -9.941 -2.701 1.00 0.00 N ATOM 903 CA GLU A 59 -2.103 -11.048 -3.301 1.00 0.00 C ATOM 904 C GLU A 59 -2.472 -10.735 -4.748 1.00 0.00 C ATOM 905 O GLU A 59 -2.202 -11.524 -5.653 1.00 0.00 O ATOM 906 CB GLU A 59 -3.368 -11.346 -2.494 1.00 0.00 C ATOM 907 CG GLU A 59 -4.022 -12.670 -2.854 1.00 0.00 C ATOM 908 CD GLU A 59 -3.015 -13.792 -3.021 1.00 0.00 C ATOM 909 OE1 GLU A 59 -2.117 -13.917 -2.162 1.00 0.00 O ATOM 910 OE2 GLU A 59 -3.126 -14.545 -4.011 1.00 0.00 O ATOM 0 H GLU A 59 -1.952 -9.161 -2.399 1.00 0.00 H new ATOM 0 HA GLU A 59 -1.458 -11.927 -3.290 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -3.119 -11.350 -1.433 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -4.086 -10.541 -2.650 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -4.737 -12.941 -2.077 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -4.586 -12.553 -3.779 1.00 0.00 H new ATOM 917 N MET A 60 -3.091 -9.578 -4.958 1.00 0.00 N ATOM 918 CA MET A 60 -3.497 -9.160 -6.295 1.00 0.00 C ATOM 919 C MET A 60 -4.114 -10.324 -7.064 1.00 0.00 C ATOM 920 O MET A 60 -3.820 -10.527 -8.242 1.00 0.00 O ATOM 921 CB MET A 60 -2.298 -8.603 -7.064 1.00 0.00 C ATOM 922 CG MET A 60 -2.046 -7.126 -6.811 1.00 0.00 C ATOM 923 SD MET A 60 -3.052 -6.060 -7.860 1.00 0.00 S ATOM 924 CE MET A 60 -4.207 -5.398 -6.662 1.00 0.00 C ATOM 0 H MET A 60 -3.322 -8.913 -4.220 1.00 0.00 H new ATOM 0 HA MET A 60 -4.248 -8.377 -6.192 1.00 0.00 H new ATOM 0 HB2 MET A 60 -1.407 -9.167 -6.789 1.00 0.00 H new ATOM 0 HB3 MET A 60 -2.457 -8.758 -8.131 1.00 0.00 H new ATOM 0 HG2 MET A 60 -2.253 -6.900 -5.765 1.00 0.00 H new ATOM 0 HG3 MET A 60 -0.992 -6.907 -6.982 1.00 0.00 H new ATOM 0 HE1 MET A 60 -5.177 -5.249 -7.136 1.00 0.00 H new ATOM 0 HE2 MET A 60 -4.312 -6.097 -5.832 1.00 0.00 H new ATOM 0 HE3 MET A 60 -3.836 -4.444 -6.288 1.00 0.00 H new ATOM 934 N HIS A 61 -4.971 -11.085 -6.390 1.00 0.00 N ATOM 935 CA HIS A 61 -5.629 -12.229 -7.012 1.00 0.00 C ATOM 936 C HIS A 61 -7.147 -12.095 -6.925 1.00 0.00 C ATOM 937 O HIS A 61 -7.881 -12.756 -7.658 1.00 0.00 O ATOM 938 CB HIS A 61 -5.181 -13.528 -6.342 1.00 0.00 C ATOM 939 CG HIS A 61 -5.619 -14.760 -7.072 1.00 0.00 C ATOM 940 ND1 HIS A 61 -5.263 -15.028 -8.377 1.00 0.00 N ATOM 941 CD2 HIS A 61 -6.387 -15.801 -6.672 1.00 0.00 C ATOM 942 CE1 HIS A 61 -5.794 -16.179 -8.748 1.00 0.00 C ATOM 943 NE2 HIS A 61 -6.481 -16.669 -7.732 1.00 0.00 N ATOM 0 H HIS A 61 -5.226 -10.930 -5.414 1.00 0.00 H new ATOM 0 HA HIS A 61 -5.343 -12.254 -8.064 1.00 0.00 H new ATOM 0 HB2 HIS A 61 -4.094 -13.530 -6.262 1.00 0.00 H new ATOM 0 HB3 HIS A 61 -5.575 -13.558 -5.326 1.00 0.00 H new ATOM 0 HD2 HIS A 61 -6.841 -15.926 -5.700 1.00 0.00 H new ATOM 0 HE1 HIS A 61 -5.685 -16.641 -9.718 1.00 0.00 H new ATOM 0 HE2 HIS A 61 -6.997 -17.549 -7.734 1.00 0.00 H new ATOM 952 N ASN A 62 -7.610 -11.235 -6.023 1.00 0.00 N ATOM 953 CA ASN A 62 -9.040 -11.016 -5.839 1.00 0.00 C ATOM 954 C ASN A 62 -9.388 -9.539 -5.996 1.00 0.00 C ATOM 955 O ASN A 62 -10.500 -9.191 -6.394 1.00 0.00 O ATOM 956 CB ASN A 62 -9.480 -11.513 -4.461 1.00 0.00 C ATOM 957 CG ASN A 62 -8.960 -10.636 -3.338 1.00 0.00 C ATOM 958 OD1 ASN A 62 -9.434 -9.518 -3.138 1.00 0.00 O ATOM 959 ND2 ASN A 62 -7.980 -11.142 -2.598 1.00 0.00 N ATOM 0 H ASN A 62 -7.016 -10.679 -5.408 1.00 0.00 H new ATOM 0 HA ASN A 62 -9.571 -11.579 -6.606 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -10.569 -11.545 -4.420 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -9.126 -12.534 -4.315 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -7.590 -10.599 -1.828 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -7.617 -12.074 -2.800 1.00 0.00 H new ATOM 966 N TYR A 63 -8.430 -8.675 -5.680 1.00 0.00 N ATOM 967 CA TYR A 63 -8.636 -7.235 -5.783 1.00 0.00 C ATOM 968 C TYR A 63 -8.765 -6.806 -7.242 1.00 0.00 C ATOM 969 O TYR A 63 -7.857 -7.016 -8.046 1.00 0.00 O ATOM 970 CB TYR A 63 -7.479 -6.484 -5.120 1.00 0.00 C ATOM 971 CG TYR A 63 -7.284 -6.838 -3.663 1.00 0.00 C ATOM 972 CD1 TYR A 63 -8.262 -6.548 -2.720 1.00 0.00 C ATOM 973 CD2 TYR A 63 -6.121 -7.464 -3.230 1.00 0.00 C ATOM 974 CE1 TYR A 63 -8.087 -6.868 -1.388 1.00 0.00 C ATOM 975 CE2 TYR A 63 -5.938 -7.790 -1.900 1.00 0.00 C ATOM 976 CZ TYR A 63 -6.924 -7.490 -0.983 1.00 0.00 C ATOM 977 OH TYR A 63 -6.747 -7.812 0.343 1.00 0.00 O ATOM 0 H TYR A 63 -7.504 -8.946 -5.351 1.00 0.00 H new ATOM 0 HA TYR A 63 -9.564 -6.989 -5.267 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -6.559 -6.698 -5.664 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -7.657 -5.412 -5.204 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -9.175 -6.064 -3.034 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -5.347 -7.700 -3.946 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -8.856 -6.633 -0.667 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -5.029 -8.277 -1.580 1.00 0.00 H new ATOM 0 HH TYR A 63 -5.876 -8.246 0.461 1.00 0.00 H new ATOM 987 N VAL A 64 -9.902 -6.203 -7.576 1.00 0.00 N ATOM 988 CA VAL A 64 -10.151 -5.742 -8.936 1.00 0.00 C ATOM 989 C VAL A 64 -10.526 -4.265 -8.956 1.00 0.00 C ATOM 990 O VAL A 64 -11.308 -3.786 -8.134 1.00 0.00 O ATOM 991 CB VAL A 64 -11.276 -6.554 -9.606 1.00 0.00 C ATOM 992 CG1 VAL A 64 -11.563 -6.019 -11.000 1.00 0.00 C ATOM 993 CG2 VAL A 64 -10.909 -8.030 -9.658 1.00 0.00 C ATOM 0 H VAL A 64 -10.665 -6.023 -6.923 1.00 0.00 H new ATOM 0 HA VAL A 64 -9.226 -5.887 -9.493 1.00 0.00 H new ATOM 0 HB VAL A 64 -12.182 -6.449 -9.009 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -12.360 -6.605 -11.458 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -11.872 -4.976 -10.933 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -10.663 -6.092 -11.610 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -11.715 -8.589 -10.134 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -9.991 -8.157 -10.232 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -10.758 -8.403 -8.645 1.00 0.00 H new ATOM 1003 N PRO A 65 -9.956 -3.523 -9.917 1.00 0.00 N ATOM 1004 CA PRO A 65 -10.216 -2.088 -10.068 1.00 0.00 C ATOM 1005 C PRO A 65 -11.633 -1.803 -10.553 1.00 0.00 C ATOM 1006 O PRO A 65 -12.061 -2.318 -11.585 1.00 0.00 O ATOM 1007 CB PRO A 65 -9.193 -1.651 -11.120 1.00 0.00 C ATOM 1008 CG PRO A 65 -8.904 -2.885 -11.902 1.00 0.00 C ATOM 1009 CD PRO A 65 -9.014 -4.027 -10.930 1.00 0.00 C ATOM 0 HA PRO A 65 -10.128 -1.556 -9.121 1.00 0.00 H new ATOM 0 HB2 PRO A 65 -9.593 -0.863 -11.758 1.00 0.00 H new ATOM 0 HB3 PRO A 65 -8.290 -1.257 -10.654 1.00 0.00 H new ATOM 0 HG2 PRO A 65 -9.612 -3.002 -12.723 1.00 0.00 H new ATOM 0 HG3 PRO A 65 -7.908 -2.843 -12.343 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -9.388 -4.930 -11.412 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -8.048 -4.276 -10.492 1.00 0.00 H new ATOM 1017 N ALA A 66 -12.356 -0.980 -9.801 1.00 0.00 N ATOM 1018 CA ALA A 66 -13.725 -0.625 -10.156 1.00 0.00 C ATOM 1019 C ALA A 66 -13.930 0.885 -10.112 1.00 0.00 C ATOM 1020 O ALA A 66 -13.057 1.626 -9.662 1.00 0.00 O ATOM 1021 CB ALA A 66 -14.709 -1.320 -9.226 1.00 0.00 C ATOM 0 H ALA A 66 -12.017 -0.547 -8.942 1.00 0.00 H new ATOM 0 HA ALA A 66 -13.907 -0.961 -11.177 1.00 0.00 H new ATOM 0 HB1 ALA A 66 -15.727 -1.046 -9.503 1.00 0.00 H new ATOM 0 HB2 ALA A 66 -14.589 -2.400 -9.310 1.00 0.00 H new ATOM 0 HB3 ALA A 66 -14.517 -1.013 -8.198 1.00 0.00 H new ATOM 1027 N ASN A 67 -15.088 1.335 -10.582 1.00 0.00 N ATOM 1028 CA ASN A 67 -15.407 2.758 -10.598 1.00 0.00 C ATOM 1029 C ASN A 67 -16.579 3.063 -9.670 1.00 0.00 C ATOM 1030 O ASN A 67 -17.300 4.042 -9.864 1.00 0.00 O ATOM 1031 CB ASN A 67 -15.737 3.213 -12.021 1.00 0.00 C ATOM 1032 CG ASN A 67 -17.011 2.582 -12.549 1.00 0.00 C ATOM 1033 OD1 ASN A 67 -17.299 1.417 -12.275 1.00 0.00 O ATOM 1034 ND2 ASN A 67 -17.780 3.352 -13.310 1.00 0.00 N ATOM 0 H ASN A 67 -15.822 0.734 -10.957 1.00 0.00 H new ATOM 0 HA ASN A 67 -14.533 3.304 -10.243 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -15.838 4.298 -12.038 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -14.908 2.959 -12.682 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -18.650 2.983 -13.694 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -17.501 4.312 -13.510 1.00 0.00 H new ATOM 1041 N SER A 68 -16.762 2.219 -8.660 1.00 0.00 N ATOM 1042 CA SER A 68 -17.849 2.396 -7.703 1.00 0.00 C ATOM 1043 C SER A 68 -17.308 2.491 -6.279 1.00 0.00 C ATOM 1044 O SER A 68 -16.491 1.672 -5.857 1.00 0.00 O ATOM 1045 CB SER A 68 -18.842 1.237 -7.807 1.00 0.00 C ATOM 1046 OG SER A 68 -19.473 1.219 -9.076 1.00 0.00 O ATOM 0 H SER A 68 -16.172 1.406 -8.483 1.00 0.00 H new ATOM 0 HA SER A 68 -18.363 3.327 -7.941 1.00 0.00 H new ATOM 0 HB2 SER A 68 -18.323 0.293 -7.642 1.00 0.00 H new ATOM 0 HB3 SER A 68 -19.595 1.328 -7.024 1.00 0.00 H new ATOM 0 HG SER A 68 -20.102 0.468 -9.118 1.00 0.00 H new ATOM 1052 N LEU A 69 -17.771 3.496 -5.544 1.00 0.00 N ATOM 1053 CA LEU A 69 -17.335 3.700 -4.167 1.00 0.00 C ATOM 1054 C LEU A 69 -17.471 2.415 -3.357 1.00 0.00 C ATOM 1055 O LEU A 69 -16.543 2.011 -2.656 1.00 0.00 O ATOM 1056 CB LEU A 69 -18.151 4.817 -3.513 1.00 0.00 C ATOM 1057 CG LEU A 69 -18.038 4.928 -1.992 1.00 0.00 C ATOM 1058 CD1 LEU A 69 -16.632 5.345 -1.590 1.00 0.00 C ATOM 1059 CD2 LEU A 69 -19.064 5.914 -1.453 1.00 0.00 C ATOM 0 H LEU A 69 -18.448 4.182 -5.878 1.00 0.00 H new ATOM 0 HA LEU A 69 -16.284 3.988 -4.184 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -17.845 5.767 -3.950 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -19.200 4.671 -3.770 1.00 0.00 H new ATOM 0 HG LEU A 69 -18.241 3.949 -1.559 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -16.571 5.419 -0.504 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -15.917 4.602 -1.944 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -16.399 6.313 -2.033 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -18.970 5.981 -0.369 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -18.891 6.896 -1.894 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -20.067 5.572 -1.710 1.00 0.00 H new ATOM 1071 N GLN A 70 -18.632 1.776 -3.460 1.00 0.00 N ATOM 1072 CA GLN A 70 -18.888 0.535 -2.738 1.00 0.00 C ATOM 1073 C GLN A 70 -17.754 -0.462 -2.951 1.00 0.00 C ATOM 1074 O GLN A 70 -17.249 -1.054 -1.997 1.00 0.00 O ATOM 1075 CB GLN A 70 -20.214 -0.078 -3.190 1.00 0.00 C ATOM 1076 CG GLN A 70 -21.412 0.830 -2.966 1.00 0.00 C ATOM 1077 CD GLN A 70 -22.523 0.588 -3.969 1.00 0.00 C ATOM 1078 OE1 GLN A 70 -22.414 -0.278 -4.837 1.00 0.00 O ATOM 1079 NE2 GLN A 70 -23.601 1.356 -3.855 1.00 0.00 N ATOM 0 H GLN A 70 -19.410 2.097 -4.036 1.00 0.00 H new ATOM 0 HA GLN A 70 -18.947 0.768 -1.675 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -20.148 -0.324 -4.250 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -20.373 -1.014 -2.655 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -21.797 0.675 -1.958 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -21.092 1.870 -3.028 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -23.649 2.062 -3.120 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -24.381 1.240 -4.502 1.00 0.00 H new ATOM 1088 N GLN A 71 -17.359 -0.643 -4.207 1.00 0.00 N ATOM 1089 CA GLN A 71 -16.285 -1.570 -4.544 1.00 0.00 C ATOM 1090 C GLN A 71 -14.962 -1.114 -3.937 1.00 0.00 C ATOM 1091 O GLN A 71 -14.237 -1.906 -3.334 1.00 0.00 O ATOM 1092 CB GLN A 71 -16.147 -1.694 -6.062 1.00 0.00 C ATOM 1093 CG GLN A 71 -15.521 -3.005 -6.511 1.00 0.00 C ATOM 1094 CD GLN A 71 -16.044 -4.197 -5.735 1.00 0.00 C ATOM 1095 OE1 GLN A 71 -17.241 -4.303 -5.469 1.00 0.00 O ATOM 1096 NE2 GLN A 71 -15.146 -5.104 -5.367 1.00 0.00 N ATOM 0 H GLN A 71 -17.766 -0.160 -5.008 1.00 0.00 H new ATOM 0 HA GLN A 71 -16.538 -2.546 -4.128 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -17.133 -1.597 -6.517 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -15.542 -0.866 -6.432 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -15.718 -3.153 -7.573 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -14.439 -2.946 -6.393 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -14.163 -4.976 -5.609 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -15.439 -5.928 -4.843 1.00 0.00 H new ATOM 1105 N LYS A 72 -14.652 0.168 -4.101 1.00 0.00 N ATOM 1106 CA LYS A 72 -13.417 0.731 -3.570 1.00 0.00 C ATOM 1107 C LYS A 72 -13.190 0.284 -2.129 1.00 0.00 C ATOM 1108 O LYS A 72 -12.237 -0.438 -1.835 1.00 0.00 O ATOM 1109 CB LYS A 72 -13.457 2.259 -3.640 1.00 0.00 C ATOM 1110 CG LYS A 72 -13.515 2.802 -5.057 1.00 0.00 C ATOM 1111 CD LYS A 72 -12.125 2.994 -5.638 1.00 0.00 C ATOM 1112 CE LYS A 72 -12.143 2.937 -7.158 1.00 0.00 C ATOM 1113 NZ LYS A 72 -12.973 4.026 -7.744 1.00 0.00 N ATOM 0 H LYS A 72 -15.240 0.837 -4.598 1.00 0.00 H new ATOM 0 HA LYS A 72 -12.590 0.367 -4.180 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -14.325 2.617 -3.087 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -12.574 2.660 -3.142 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -14.082 2.117 -5.687 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -14.047 3.753 -5.061 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -11.723 3.954 -5.314 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -11.458 2.223 -5.252 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -11.124 3.014 -7.536 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -12.531 1.971 -7.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -12.892 4.005 -8.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -13.967 3.889 -7.472 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -12.640 4.945 -7.390 1.00 0.00 H new ATOM 1127 N LEU A 73 -14.073 0.715 -1.235 1.00 0.00 N ATOM 1128 CA LEU A 73 -13.970 0.357 0.176 1.00 0.00 C ATOM 1129 C LEU A 73 -13.896 -1.157 0.349 1.00 0.00 C ATOM 1130 O LEU A 73 -13.062 -1.666 1.098 1.00 0.00 O ATOM 1131 CB LEU A 73 -15.166 0.913 0.951 1.00 0.00 C ATOM 1132 CG LEU A 73 -15.237 2.435 1.074 1.00 0.00 C ATOM 1133 CD1 LEU A 73 -16.586 2.863 1.632 1.00 0.00 C ATOM 1134 CD2 LEU A 73 -14.106 2.953 1.951 1.00 0.00 C ATOM 0 H LEU A 73 -14.868 1.313 -1.462 1.00 0.00 H new ATOM 0 HA LEU A 73 -13.053 0.794 0.572 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -16.079 0.564 0.469 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -15.153 0.488 1.954 1.00 0.00 H new ATOM 0 HG LEU A 73 -15.125 2.866 0.079 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -16.618 3.950 1.713 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -17.379 2.525 0.965 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -16.728 2.422 2.618 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -14.173 4.038 2.027 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.186 2.514 2.945 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -13.148 2.678 1.509 1.00 0.00 H new ATOM 1146 N SER A 74 -14.773 -1.871 -0.349 1.00 0.00 N ATOM 1147 CA SER A 74 -14.808 -3.327 -0.271 1.00 0.00 C ATOM 1148 C SER A 74 -13.399 -3.908 -0.332 1.00 0.00 C ATOM 1149 O SER A 74 -13.055 -4.811 0.430 1.00 0.00 O ATOM 1150 CB SER A 74 -15.657 -3.899 -1.407 1.00 0.00 C ATOM 1151 OG SER A 74 -16.177 -5.173 -1.064 1.00 0.00 O ATOM 0 H SER A 74 -15.469 -1.465 -0.975 1.00 0.00 H new ATOM 0 HA SER A 74 -15.256 -3.605 0.683 1.00 0.00 H new ATOM 0 HB2 SER A 74 -16.477 -3.217 -1.632 1.00 0.00 H new ATOM 0 HB3 SER A 74 -15.053 -3.980 -2.311 1.00 0.00 H new ATOM 0 HG SER A 74 -16.717 -5.516 -1.806 1.00 0.00 H new ATOM 1157 N ASN A 75 -12.587 -3.383 -1.244 1.00 0.00 N ATOM 1158 CA ASN A 75 -11.215 -3.849 -1.406 1.00 0.00 C ATOM 1159 C ASN A 75 -10.343 -3.387 -0.243 1.00 0.00 C ATOM 1160 O ASN A 75 -9.431 -4.096 0.183 1.00 0.00 O ATOM 1161 CB ASN A 75 -10.634 -3.342 -2.727 1.00 0.00 C ATOM 1162 CG ASN A 75 -11.267 -4.011 -3.932 1.00 0.00 C ATOM 1163 OD1 ASN A 75 -11.779 -5.127 -3.838 1.00 0.00 O ATOM 1164 ND2 ASN A 75 -11.234 -3.331 -5.071 1.00 0.00 N ATOM 0 H ASN A 75 -12.856 -2.634 -1.882 1.00 0.00 H new ATOM 0 HA ASN A 75 -11.227 -4.939 -1.417 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -10.780 -2.264 -2.795 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -9.559 -3.519 -2.740 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -11.644 -3.730 -5.915 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -10.799 -2.409 -5.102 1.00 0.00 H new ATOM 1171 N TRP A 76 -10.629 -2.194 0.267 1.00 0.00 N ATOM 1172 CA TRP A 76 -9.872 -1.637 1.381 1.00 0.00 C ATOM 1173 C TRP A 76 -10.075 -2.464 2.646 1.00 0.00 C ATOM 1174 O TRP A 76 -9.121 -2.999 3.208 1.00 0.00 O ATOM 1175 CB TRP A 76 -10.288 -0.187 1.633 1.00 0.00 C ATOM 1176 CG TRP A 76 -9.494 0.806 0.839 1.00 0.00 C ATOM 1177 CD1 TRP A 76 -9.875 1.421 -0.319 1.00 0.00 C ATOM 1178 CD2 TRP A 76 -8.183 1.295 1.143 1.00 0.00 C ATOM 1179 NE1 TRP A 76 -8.880 2.264 -0.753 1.00 0.00 N ATOM 1180 CE2 TRP A 76 -7.832 2.205 0.127 1.00 0.00 C ATOM 1181 CE3 TRP A 76 -7.273 1.055 2.176 1.00 0.00 C ATOM 1182 CZ2 TRP A 76 -6.610 2.873 0.116 1.00 0.00 C ATOM 1183 CZ3 TRP A 76 -6.061 1.718 2.163 1.00 0.00 C ATOM 1184 CH2 TRP A 76 -5.738 2.618 1.139 1.00 0.00 C ATOM 0 H TRP A 76 -11.380 -1.594 -0.074 1.00 0.00 H new ATOM 0 HA TRP A 76 -8.815 -1.664 1.118 1.00 0.00 H new ATOM 0 HB2 TRP A 76 -11.345 -0.073 1.391 1.00 0.00 H new ATOM 0 HB3 TRP A 76 -10.178 0.036 2.694 1.00 0.00 H new ATOM 0 HD1 TRP A 76 -10.819 1.268 -0.820 1.00 0.00 H new ATOM 0 HE1 TRP A 76 -8.916 2.840 -1.594 1.00 0.00 H new ATOM 0 HE3 TRP A 76 -7.513 0.364 2.970 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 -6.360 3.568 -0.672 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 -5.350 1.539 2.956 1.00 0.00 H new ATOM 0 HH2 TRP A 76 -4.782 3.120 1.158 1.00 0.00 H new ATOM 1195 N GLY A 77 -11.325 -2.565 3.087 1.00 0.00 N ATOM 1196 CA GLY A 77 -11.630 -3.329 4.283 1.00 0.00 C ATOM 1197 C GLY A 77 -10.912 -4.663 4.317 1.00 0.00 C ATOM 1198 O GLY A 77 -10.374 -5.061 5.351 1.00 0.00 O ATOM 0 H GLY A 77 -12.132 -2.132 2.638 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -11.352 -2.748 5.162 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -12.706 -3.497 4.339 1.00 0.00 H new ATOM 1202 N HIS A 78 -10.903 -5.358 3.183 1.00 0.00 N ATOM 1203 CA HIS A 78 -10.246 -6.657 3.088 1.00 0.00 C ATOM 1204 C HIS A 78 -8.733 -6.511 3.215 1.00 0.00 C ATOM 1205 O HIS A 78 -8.086 -7.262 3.946 1.00 0.00 O ATOM 1206 CB HIS A 78 -10.595 -7.332 1.761 1.00 0.00 C ATOM 1207 CG HIS A 78 -10.487 -8.825 1.803 1.00 0.00 C ATOM 1208 ND1 HIS A 78 -10.189 -9.589 0.694 1.00 0.00 N ATOM 1209 CD2 HIS A 78 -10.638 -9.696 2.828 1.00 0.00 C ATOM 1210 CE1 HIS A 78 -10.163 -10.865 1.036 1.00 0.00 C ATOM 1211 NE2 HIS A 78 -10.432 -10.957 2.326 1.00 0.00 N ATOM 0 H HIS A 78 -11.343 -5.043 2.318 1.00 0.00 H new ATOM 0 HA HIS A 78 -10.604 -7.279 3.909 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -11.611 -7.057 1.479 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -9.934 -6.950 0.983 1.00 0.00 H new ATOM 0 HD1 HIS A 78 -10.016 -9.226 -0.243 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -10.876 -9.445 3.851 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -9.957 -11.692 0.373 1.00 0.00 H new ATOM 1220 N LEU A 79 -8.175 -5.541 2.499 1.00 0.00 N ATOM 1221 CA LEU A 79 -6.737 -5.297 2.531 1.00 0.00 C ATOM 1222 C LEU A 79 -6.265 -5.007 3.952 1.00 0.00 C ATOM 1223 O LEU A 79 -5.077 -5.104 4.254 1.00 0.00 O ATOM 1224 CB LEU A 79 -6.378 -4.127 1.614 1.00 0.00 C ATOM 1225 CG LEU A 79 -4.901 -3.997 1.238 1.00 0.00 C ATOM 1226 CD1 LEU A 79 -4.596 -4.807 -0.012 1.00 0.00 C ATOM 1227 CD2 LEU A 79 -4.529 -2.536 1.033 1.00 0.00 C ATOM 0 H LEU A 79 -8.696 -4.911 1.889 1.00 0.00 H new ATOM 0 HA LEU A 79 -6.233 -6.196 2.177 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -6.959 -4.219 0.696 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -6.692 -3.202 2.098 1.00 0.00 H new ATOM 0 HG LEU A 79 -4.301 -4.392 2.058 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -3.541 -4.703 -0.265 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -4.823 -5.857 0.171 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -5.205 -4.442 -0.839 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -3.475 -2.463 0.766 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -5.136 -2.115 0.232 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -4.709 -1.982 1.954 1.00 0.00 H new ATOM 1239 N ASN A 80 -7.206 -4.654 4.822 1.00 0.00 N ATOM 1240 CA ASN A 80 -6.887 -4.351 6.213 1.00 0.00 C ATOM 1241 C ASN A 80 -6.606 -5.630 6.996 1.00 0.00 C ATOM 1242 O ASN A 80 -5.737 -5.657 7.868 1.00 0.00 O ATOM 1243 CB ASN A 80 -8.037 -3.582 6.866 1.00 0.00 C ATOM 1244 CG ASN A 80 -7.711 -3.146 8.281 1.00 0.00 C ATOM 1245 OD1 ASN A 80 -6.611 -3.388 8.779 1.00 0.00 O ATOM 1246 ND2 ASN A 80 -8.668 -2.501 8.937 1.00 0.00 N ATOM 0 H ASN A 80 -8.195 -4.571 4.589 1.00 0.00 H new ATOM 0 HA ASN A 80 -5.990 -3.731 6.228 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -8.272 -2.705 6.263 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -8.929 -4.209 6.878 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -8.507 -2.184 9.893 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -9.565 -2.322 8.485 1.00 0.00 H new ATOM 1253 N ARG A 81 -7.346 -6.687 6.679 1.00 0.00 N ATOM 1254 CA ARG A 81 -7.177 -7.968 7.354 1.00 0.00 C ATOM 1255 C ARG A 81 -6.461 -8.968 6.450 1.00 0.00 C ATOM 1256 O ARG A 81 -6.278 -10.130 6.814 1.00 0.00 O ATOM 1257 CB ARG A 81 -8.536 -8.529 7.776 1.00 0.00 C ATOM 1258 CG ARG A 81 -9.142 -7.819 8.976 1.00 0.00 C ATOM 1259 CD ARG A 81 -10.111 -8.720 9.726 1.00 0.00 C ATOM 1260 NE ARG A 81 -9.418 -9.652 10.612 1.00 0.00 N ATOM 1261 CZ ARG A 81 -9.990 -10.230 11.662 1.00 0.00 C ATOM 1262 NH1 ARG A 81 -11.257 -9.975 11.956 1.00 0.00 N ATOM 1263 NH2 ARG A 81 -9.293 -11.067 12.421 1.00 0.00 N ATOM 0 H ARG A 81 -8.068 -6.682 5.959 1.00 0.00 H new ATOM 0 HA ARG A 81 -6.567 -7.805 8.242 1.00 0.00 H new ATOM 0 HB2 ARG A 81 -9.226 -8.457 6.935 1.00 0.00 H new ATOM 0 HB3 ARG A 81 -8.426 -9.588 8.009 1.00 0.00 H new ATOM 0 HG2 ARG A 81 -8.347 -7.497 9.649 1.00 0.00 H new ATOM 0 HG3 ARG A 81 -9.662 -6.920 8.644 1.00 0.00 H new ATOM 0 HD2 ARG A 81 -10.798 -8.107 10.310 1.00 0.00 H new ATOM 0 HD3 ARG A 81 -10.713 -9.280 9.010 1.00 0.00 H new ATOM 0 HE ARG A 81 -8.442 -9.871 10.413 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -11.796 -9.333 11.375 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -11.693 -10.421 12.763 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -8.318 -11.266 12.198 1.00 0.00 H new ATOM 0 HH22 ARG A 81 -9.733 -11.511 13.227 1.00 0.00 H new ATOM 1277 N LYS A 82 -6.058 -8.508 5.271 1.00 0.00 N ATOM 1278 CA LYS A 82 -5.361 -9.360 4.315 1.00 0.00 C ATOM 1279 C LYS A 82 -3.908 -8.922 4.154 1.00 0.00 C ATOM 1280 O LYS A 82 -3.053 -9.709 3.748 1.00 0.00 O ATOM 1281 CB LYS A 82 -6.068 -9.324 2.958 1.00 0.00 C ATOM 1282 CG LYS A 82 -7.201 -10.329 2.837 1.00 0.00 C ATOM 1283 CD LYS A 82 -6.690 -11.697 2.418 1.00 0.00 C ATOM 1284 CE LYS A 82 -7.633 -12.805 2.862 1.00 0.00 C ATOM 1285 NZ LYS A 82 -7.110 -14.154 2.511 1.00 0.00 N ATOM 0 H LYS A 82 -6.202 -7.549 4.954 1.00 0.00 H new ATOM 0 HA LYS A 82 -5.375 -10.380 4.698 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -6.462 -8.322 2.789 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -5.338 -9.516 2.172 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -7.720 -10.410 3.792 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -7.929 -9.972 2.108 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -6.576 -11.728 1.334 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -5.702 -11.865 2.847 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -7.783 -12.743 3.940 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -8.607 -12.661 2.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -7.782 -14.881 2.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -6.990 -14.223 1.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -6.192 -14.302 2.977 1.00 0.00 H new ATOM 1299 N VAL A 83 -3.636 -7.661 4.475 1.00 0.00 N ATOM 1300 CA VAL A 83 -2.286 -7.120 4.369 1.00 0.00 C ATOM 1301 C VAL A 83 -1.884 -6.392 5.647 1.00 0.00 C ATOM 1302 O VAL A 83 -1.011 -6.850 6.386 1.00 0.00 O ATOM 1303 CB VAL A 83 -2.163 -6.150 3.178 1.00 0.00 C ATOM 1304 CG1 VAL A 83 -0.730 -5.660 3.035 1.00 0.00 C ATOM 1305 CG2 VAL A 83 -2.638 -6.818 1.897 1.00 0.00 C ATOM 0 H VAL A 83 -4.332 -6.995 4.810 1.00 0.00 H new ATOM 0 HA VAL A 83 -1.617 -7.966 4.210 1.00 0.00 H new ATOM 0 HB VAL A 83 -2.800 -5.286 3.367 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -0.662 -4.976 2.189 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -0.430 -5.142 3.946 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -0.070 -6.511 2.868 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -2.544 -6.119 1.066 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -2.029 -7.700 1.699 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -3.681 -7.114 2.006 1.00 0.00 H new ATOM 1315 N LEU A 84 -2.525 -5.257 5.902 1.00 0.00 N ATOM 1316 CA LEU A 84 -2.234 -4.465 7.092 1.00 0.00 C ATOM 1317 C LEU A 84 -2.033 -5.363 8.308 1.00 0.00 C ATOM 1318 O LEU A 84 -1.048 -5.232 9.034 1.00 0.00 O ATOM 1319 CB LEU A 84 -3.369 -3.474 7.358 1.00 0.00 C ATOM 1320 CG LEU A 84 -3.714 -2.525 6.209 1.00 0.00 C ATOM 1321 CD1 LEU A 84 -4.889 -1.636 6.586 1.00 0.00 C ATOM 1322 CD2 LEU A 84 -2.505 -1.681 5.833 1.00 0.00 C ATOM 0 H LEU A 84 -3.250 -4.864 5.301 1.00 0.00 H new ATOM 0 HA LEU A 84 -1.311 -3.913 6.915 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -4.264 -4.039 7.618 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.105 -2.876 8.230 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.999 -3.122 5.343 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.120 -0.968 5.757 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -5.758 -2.256 6.806 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -4.632 -1.047 7.466 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -2.769 -1.012 5.014 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -2.190 -1.093 6.695 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -1.689 -2.333 5.520 1.00 0.00 H new ATOM 1334 N LYS A 85 -2.972 -6.278 8.523 1.00 0.00 N ATOM 1335 CA LYS A 85 -2.897 -7.201 9.649 1.00 0.00 C ATOM 1336 C LYS A 85 -1.452 -7.595 9.935 1.00 0.00 C ATOM 1337 O LYS A 85 -0.952 -7.398 11.043 1.00 0.00 O ATOM 1338 CB LYS A 85 -3.731 -8.453 9.365 1.00 0.00 C ATOM 1339 CG LYS A 85 -3.962 -9.321 10.590 1.00 0.00 C ATOM 1340 CD LYS A 85 -4.648 -10.627 10.226 1.00 0.00 C ATOM 1341 CE LYS A 85 -3.674 -11.611 9.597 1.00 0.00 C ATOM 1342 NZ LYS A 85 -4.361 -12.845 9.122 1.00 0.00 N ATOM 0 H LYS A 85 -3.794 -6.400 7.932 1.00 0.00 H new ATOM 0 HA LYS A 85 -3.298 -6.696 10.528 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -4.696 -8.152 8.956 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -3.231 -9.046 8.599 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -3.008 -9.532 11.073 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -4.571 -8.778 11.312 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -5.088 -11.070 11.120 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -5.466 -10.429 9.533 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -3.165 -11.133 8.760 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -2.908 -11.879 10.325 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -3.663 -13.490 8.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -4.825 -13.315 9.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -5.075 -12.592 8.409 1.00 0.00 H new ATOM 1356 N ARG A 86 -0.784 -8.150 8.929 1.00 0.00 N ATOM 1357 CA ARG A 86 0.604 -8.571 9.073 1.00 0.00 C ATOM 1358 C ARG A 86 1.464 -7.431 9.611 1.00 0.00 C ATOM 1359 O ARG A 86 2.356 -7.647 10.433 1.00 0.00 O ATOM 1360 CB ARG A 86 1.156 -9.050 7.729 1.00 0.00 C ATOM 1361 CG ARG A 86 0.525 -10.342 7.237 1.00 0.00 C ATOM 1362 CD ARG A 86 -0.916 -10.127 6.800 1.00 0.00 C ATOM 1363 NE ARG A 86 -1.332 -11.097 5.790 1.00 0.00 N ATOM 1364 CZ ARG A 86 -0.927 -11.062 4.526 1.00 0.00 C ATOM 1365 NH1 ARG A 86 -0.099 -10.110 4.118 1.00 0.00 N ATOM 1366 NH2 ARG A 86 -1.350 -11.981 3.667 1.00 0.00 N ATOM 0 H ARG A 86 -1.182 -8.319 8.005 1.00 0.00 H new ATOM 0 HA ARG A 86 0.636 -9.395 9.785 1.00 0.00 H new ATOM 0 HB2 ARG A 86 0.998 -8.271 6.983 1.00 0.00 H new ATOM 0 HB3 ARG A 86 2.233 -9.193 7.818 1.00 0.00 H new ATOM 0 HG2 ARG A 86 1.105 -10.736 6.402 1.00 0.00 H new ATOM 0 HG3 ARG A 86 0.558 -11.089 8.030 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -1.573 -10.202 7.667 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -1.027 -9.118 6.402 1.00 0.00 H new ATOM 0 HE ARG A 86 -1.969 -11.842 6.071 1.00 0.00 H new ATOM 0 HH11 ARG A 86 0.228 -9.402 4.776 1.00 0.00 H new ATOM 0 HH12 ARG A 86 0.211 -10.085 3.146 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -1.987 -12.715 3.978 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -1.038 -11.953 2.696 1.00 0.00 H new ATOM 1380 N LEU A 87 1.192 -6.219 9.141 1.00 0.00 N ATOM 1381 CA LEU A 87 1.941 -5.044 9.574 1.00 0.00 C ATOM 1382 C LEU A 87 1.337 -4.451 10.843 1.00 0.00 C ATOM 1383 O LEU A 87 1.435 -3.249 11.086 1.00 0.00 O ATOM 1384 CB LEU A 87 1.962 -3.991 8.465 1.00 0.00 C ATOM 1385 CG LEU A 87 2.752 -4.356 7.208 1.00 0.00 C ATOM 1386 CD1 LEU A 87 2.154 -3.676 5.986 1.00 0.00 C ATOM 1387 CD2 LEU A 87 4.216 -3.975 7.369 1.00 0.00 C ATOM 0 H LEU A 87 0.458 -6.024 8.460 1.00 0.00 H new ATOM 0 HA LEU A 87 2.963 -5.354 9.791 1.00 0.00 H new ATOM 0 HB2 LEU A 87 0.933 -3.778 8.174 1.00 0.00 H new ATOM 0 HB3 LEU A 87 2.375 -3.069 8.875 1.00 0.00 H new ATOM 0 HG LEU A 87 2.692 -5.435 7.064 1.00 0.00 H new ATOM 0 HD11 LEU A 87 2.729 -3.947 5.101 1.00 0.00 H new ATOM 0 HD12 LEU A 87 1.120 -3.998 5.860 1.00 0.00 H new ATOM 0 HD13 LEU A 87 2.183 -2.595 6.120 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.763 -4.242 6.465 1.00 0.00 H new ATOM 0 HD22 LEU A 87 4.296 -2.901 7.538 1.00 0.00 H new ATOM 0 HD23 LEU A 87 4.639 -4.508 8.220 1.00 0.00 H new ATOM 1399 N ASN A 88 0.716 -5.304 11.651 1.00 0.00 N ATOM 1400 CA ASN A 88 0.098 -4.864 12.897 1.00 0.00 C ATOM 1401 C ASN A 88 -0.522 -3.479 12.738 1.00 0.00 C ATOM 1402 O ASN A 88 -0.486 -2.662 13.658 1.00 0.00 O ATOM 1403 CB ASN A 88 1.132 -4.846 14.025 1.00 0.00 C ATOM 1404 CG ASN A 88 1.277 -6.197 14.698 1.00 0.00 C ATOM 1405 OD1 ASN A 88 0.954 -7.232 14.114 1.00 0.00 O ATOM 1406 ND2 ASN A 88 1.765 -6.194 15.933 1.00 0.00 N ATOM 0 H ASN A 88 0.627 -6.303 11.466 1.00 0.00 H new ATOM 0 HA ASN A 88 -0.693 -5.570 13.150 1.00 0.00 H new ATOM 0 HB2 ASN A 88 2.098 -4.537 13.624 1.00 0.00 H new ATOM 0 HB3 ASN A 88 0.843 -4.102 14.768 1.00 0.00 H new ATOM 0 HD21 ASN A 88 1.885 -7.073 16.436 1.00 0.00 H new ATOM 0 HD22 ASN A 88 2.020 -5.313 16.379 1.00 0.00 H new ATOM 1413 N PHE A 89 -1.091 -3.223 11.565 1.00 0.00 N ATOM 1414 CA PHE A 89 -1.718 -1.937 11.284 1.00 0.00 C ATOM 1415 C PHE A 89 -3.232 -2.086 11.157 1.00 0.00 C ATOM 1416 O PHE A 89 -3.723 -2.846 10.322 1.00 0.00 O ATOM 1417 CB PHE A 89 -1.144 -1.335 10.000 1.00 0.00 C ATOM 1418 CG PHE A 89 -1.234 0.164 9.948 1.00 0.00 C ATOM 1419 CD1 PHE A 89 -2.356 0.786 9.424 1.00 0.00 C ATOM 1420 CD2 PHE A 89 -0.198 0.950 10.424 1.00 0.00 C ATOM 1421 CE1 PHE A 89 -2.441 2.164 9.375 1.00 0.00 C ATOM 1422 CE2 PHE A 89 -0.277 2.329 10.377 1.00 0.00 C ATOM 1423 CZ PHE A 89 -1.401 2.937 9.853 1.00 0.00 C ATOM 0 H PHE A 89 -1.131 -3.889 10.794 1.00 0.00 H new ATOM 0 HA PHE A 89 -1.505 -1.268 12.117 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.100 -1.632 9.904 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.674 -1.753 9.144 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -3.173 0.187 9.050 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.682 0.480 10.837 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -3.320 2.637 8.963 1.00 0.00 H new ATOM 0 HE2 PHE A 89 0.539 2.930 10.750 1.00 0.00 H new ATOM 0 HZ PHE A 89 -1.467 4.014 9.817 1.00 0.00 H new ATOM 1433 N SER A 90 -3.965 -1.356 11.991 1.00 0.00 N ATOM 1434 CA SER A 90 -5.422 -1.410 11.976 1.00 0.00 C ATOM 1435 C SER A 90 -6.014 -0.025 11.737 1.00 0.00 C ATOM 1436 O SER A 90 -5.694 0.931 12.444 1.00 0.00 O ATOM 1437 CB SER A 90 -5.946 -1.981 13.295 1.00 0.00 C ATOM 1438 OG SER A 90 -5.458 -3.293 13.513 1.00 0.00 O ATOM 0 H SER A 90 -3.574 -0.720 12.686 1.00 0.00 H new ATOM 0 HA SER A 90 -5.729 -2.063 11.159 1.00 0.00 H new ATOM 0 HB2 SER A 90 -5.644 -1.336 14.120 1.00 0.00 H new ATOM 0 HB3 SER A 90 -7.036 -1.993 13.282 1.00 0.00 H new ATOM 0 HG SER A 90 -5.806 -3.634 14.363 1.00 0.00 H new ATOM 1444 N VAL A 91 -6.881 0.076 10.734 1.00 0.00 N ATOM 1445 CA VAL A 91 -7.520 1.344 10.401 1.00 0.00 C ATOM 1446 C VAL A 91 -9.036 1.245 10.528 1.00 0.00 C ATOM 1447 O VAL A 91 -9.653 0.254 10.137 1.00 0.00 O ATOM 1448 CB VAL A 91 -7.164 1.793 8.971 1.00 0.00 C ATOM 1449 CG1 VAL A 91 -7.891 3.082 8.620 1.00 0.00 C ATOM 1450 CG2 VAL A 91 -5.659 1.964 8.827 1.00 0.00 C ATOM 0 H VAL A 91 -7.157 -0.705 10.138 1.00 0.00 H new ATOM 0 HA VAL A 91 -7.146 2.083 11.110 1.00 0.00 H new ATOM 0 HB VAL A 91 -7.488 1.020 8.274 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.627 3.384 7.606 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -8.967 2.921 8.682 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -7.600 3.866 9.319 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.424 2.281 7.811 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -5.309 2.718 9.532 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -5.164 1.015 9.034 1.00 0.00 H new ATOM 1460 N PRO A 92 -9.653 2.296 11.087 1.00 0.00 N ATOM 1461 CA PRO A 92 -11.105 2.353 11.278 1.00 0.00 C ATOM 1462 C PRO A 92 -11.858 2.488 9.959 1.00 0.00 C ATOM 1463 O PRO A 92 -11.259 2.447 8.884 1.00 0.00 O ATOM 1464 CB PRO A 92 -11.302 3.604 12.137 1.00 0.00 C ATOM 1465 CG PRO A 92 -10.118 4.458 11.839 1.00 0.00 C ATOM 1466 CD PRO A 92 -8.980 3.511 11.576 1.00 0.00 C ATOM 0 HA PRO A 92 -11.492 1.442 11.734 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -12.232 4.114 11.886 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -11.353 3.353 13.196 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -10.304 5.095 10.974 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -9.891 5.117 12.677 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -8.287 3.912 10.836 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -8.403 3.315 12.480 1.00 0.00 H new ATOM 1474 N ASP A 93 -13.174 2.650 10.048 1.00 0.00 N ATOM 1475 CA ASP A 93 -14.009 2.794 8.861 1.00 0.00 C ATOM 1476 C ASP A 93 -14.156 4.262 8.475 1.00 0.00 C ATOM 1477 O ASP A 93 -14.009 4.625 7.307 1.00 0.00 O ATOM 1478 CB ASP A 93 -15.387 2.176 9.104 1.00 0.00 C ATOM 1479 CG ASP A 93 -16.275 3.059 9.958 1.00 0.00 C ATOM 1480 OD1 ASP A 93 -15.922 3.297 11.133 1.00 0.00 O ATOM 1481 OD2 ASP A 93 -17.322 3.514 9.452 1.00 0.00 O ATOM 0 H ASP A 93 -13.685 2.685 10.930 1.00 0.00 H new ATOM 0 HA ASP A 93 -13.524 2.268 8.039 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -15.874 1.994 8.146 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -15.267 1.208 9.590 1.00 0.00 H new ATOM 1486 N ASP A 94 -14.448 5.102 9.462 1.00 0.00 N ATOM 1487 CA ASP A 94 -14.616 6.531 9.225 1.00 0.00 C ATOM 1488 C ASP A 94 -13.424 7.099 8.462 1.00 0.00 C ATOM 1489 O ASP A 94 -13.516 8.161 7.846 1.00 0.00 O ATOM 1490 CB ASP A 94 -14.788 7.272 10.552 1.00 0.00 C ATOM 1491 CG ASP A 94 -13.778 6.836 11.595 1.00 0.00 C ATOM 1492 OD1 ASP A 94 -12.581 7.151 11.429 1.00 0.00 O ATOM 1493 OD2 ASP A 94 -14.184 6.178 12.576 1.00 0.00 O ATOM 0 H ASP A 94 -14.573 4.818 10.434 1.00 0.00 H new ATOM 0 HA ASP A 94 -15.512 6.672 8.620 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -14.690 8.344 10.381 1.00 0.00 H new ATOM 0 HB3 ASP A 94 -15.795 7.101 10.932 1.00 0.00 H new ATOM 1498 N VAL A 95 -12.303 6.385 8.508 1.00 0.00 N ATOM 1499 CA VAL A 95 -11.092 6.818 7.821 1.00 0.00 C ATOM 1500 C VAL A 95 -11.066 6.313 6.383 1.00 0.00 C ATOM 1501 O VAL A 95 -10.625 7.017 5.475 1.00 0.00 O ATOM 1502 CB VAL A 95 -9.828 6.325 8.549 1.00 0.00 C ATOM 1503 CG1 VAL A 95 -8.605 6.471 7.656 1.00 0.00 C ATOM 1504 CG2 VAL A 95 -9.637 7.081 9.855 1.00 0.00 C ATOM 0 H VAL A 95 -12.209 5.504 9.014 1.00 0.00 H new ATOM 0 HA VAL A 95 -11.101 7.908 7.820 1.00 0.00 H new ATOM 0 HB VAL A 95 -9.954 5.268 8.782 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.722 6.117 8.188 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -8.743 5.881 6.750 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -8.472 7.519 7.389 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -8.739 6.720 10.356 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -9.533 8.146 9.647 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -10.502 6.920 10.499 1.00 0.00 H new ATOM 1514 N MET A 96 -11.543 5.089 6.182 1.00 0.00 N ATOM 1515 CA MET A 96 -11.576 4.490 4.853 1.00 0.00 C ATOM 1516 C MET A 96 -12.593 5.197 3.963 1.00 0.00 C ATOM 1517 O MET A 96 -12.318 5.486 2.798 1.00 0.00 O ATOM 1518 CB MET A 96 -11.913 3.001 4.949 1.00 0.00 C ATOM 1519 CG MET A 96 -10.840 2.178 5.644 1.00 0.00 C ATOM 1520 SD MET A 96 -10.880 0.440 5.167 1.00 0.00 S ATOM 1521 CE MET A 96 -10.834 -0.352 6.773 1.00 0.00 C ATOM 0 H MET A 96 -11.912 4.493 6.923 1.00 0.00 H new ATOM 0 HA MET A 96 -10.588 4.603 4.407 1.00 0.00 H new ATOM 0 HB2 MET A 96 -12.854 2.884 5.486 1.00 0.00 H new ATOM 0 HB3 MET A 96 -12.068 2.607 3.945 1.00 0.00 H new ATOM 0 HG2 MET A 96 -9.860 2.593 5.409 1.00 0.00 H new ATOM 0 HG3 MET A 96 -10.969 2.258 6.723 1.00 0.00 H new ATOM 0 HE1 MET A 96 -10.336 -1.318 6.688 1.00 0.00 H new ATOM 0 HE2 MET A 96 -10.287 0.278 7.474 1.00 0.00 H new ATOM 0 HE3 MET A 96 -11.851 -0.499 7.135 1.00 0.00 H new ATOM 1531 N ARG A 97 -13.768 5.474 4.519 1.00 0.00 N ATOM 1532 CA ARG A 97 -14.826 6.146 3.775 1.00 0.00 C ATOM 1533 C ARG A 97 -14.310 7.433 3.139 1.00 0.00 C ATOM 1534 O ARG A 97 -14.769 7.838 2.070 1.00 0.00 O ATOM 1535 CB ARG A 97 -16.007 6.458 4.696 1.00 0.00 C ATOM 1536 CG ARG A 97 -16.953 5.284 4.892 1.00 0.00 C ATOM 1537 CD ARG A 97 -18.338 5.749 5.315 1.00 0.00 C ATOM 1538 NE ARG A 97 -18.437 5.929 6.760 1.00 0.00 N ATOM 1539 CZ ARG A 97 -19.446 6.556 7.355 1.00 0.00 C ATOM 1540 NH1 ARG A 97 -20.437 7.059 6.632 1.00 0.00 N ATOM 1541 NH2 ARG A 97 -19.466 6.680 8.676 1.00 0.00 N ATOM 0 H ARG A 97 -14.011 5.243 5.482 1.00 0.00 H new ATOM 0 HA ARG A 97 -15.159 5.477 2.982 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -15.626 6.773 5.667 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -16.565 7.299 4.285 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -17.026 4.716 3.965 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -16.548 4.611 5.647 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -18.573 6.689 4.816 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -19.080 5.021 4.989 1.00 0.00 H new ATOM 0 HE ARG A 97 -17.691 5.553 7.345 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -20.426 6.965 5.616 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -21.210 7.540 7.091 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -18.706 6.294 9.236 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -20.241 7.162 9.131 1.00 0.00 H new ATOM 1555 N LYS A 98 -13.353 8.073 3.802 1.00 0.00 N ATOM 1556 CA LYS A 98 -12.773 9.314 3.303 1.00 0.00 C ATOM 1557 C LYS A 98 -11.717 9.031 2.239 1.00 0.00 C ATOM 1558 O LYS A 98 -11.661 9.708 1.212 1.00 0.00 O ATOM 1559 CB LYS A 98 -12.153 10.110 4.453 1.00 0.00 C ATOM 1560 CG LYS A 98 -13.039 10.190 5.684 1.00 0.00 C ATOM 1561 CD LYS A 98 -12.263 10.674 6.898 1.00 0.00 C ATOM 1562 CE LYS A 98 -12.330 12.187 7.035 1.00 0.00 C ATOM 1563 NZ LYS A 98 -11.630 12.877 5.916 1.00 0.00 N ATOM 0 H LYS A 98 -12.962 7.752 4.688 1.00 0.00 H new ATOM 0 HA LYS A 98 -13.571 9.903 2.851 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -11.202 9.653 4.729 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -11.933 11.120 4.108 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -13.872 10.865 5.491 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -13.466 9.209 5.891 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -12.665 10.208 7.798 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -11.222 10.361 6.815 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -13.373 12.503 7.061 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -11.882 12.486 7.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -11.324 13.821 6.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -10.799 12.321 5.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -12.277 12.972 5.108 1.00 0.00 H new ATOM 1577 N ILE A 99 -10.884 8.027 2.490 1.00 0.00 N ATOM 1578 CA ILE A 99 -9.833 7.654 1.553 1.00 0.00 C ATOM 1579 C ILE A 99 -10.402 7.399 0.161 1.00 0.00 C ATOM 1580 O ILE A 99 -9.910 7.938 -0.830 1.00 0.00 O ATOM 1581 CB ILE A 99 -9.077 6.397 2.024 1.00 0.00 C ATOM 1582 CG1 ILE A 99 -8.295 6.696 3.305 1.00 0.00 C ATOM 1583 CG2 ILE A 99 -8.144 5.899 0.931 1.00 0.00 C ATOM 1584 CD1 ILE A 99 -7.726 5.461 3.967 1.00 0.00 C ATOM 0 H ILE A 99 -10.917 7.457 3.335 1.00 0.00 H new ATOM 0 HA ILE A 99 -9.137 8.492 1.511 1.00 0.00 H new ATOM 0 HB ILE A 99 -9.803 5.613 2.239 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -7.480 7.382 3.072 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -8.950 7.207 4.010 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -7.617 5.011 1.279 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -8.724 5.652 0.042 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -7.421 6.677 0.687 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -7.185 5.748 4.869 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -8.538 4.783 4.231 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -7.045 4.960 3.279 1.00 0.00 H new ATOM 1596 N ALA A 100 -11.443 6.575 0.095 1.00 0.00 N ATOM 1597 CA ALA A 100 -12.082 6.252 -1.174 1.00 0.00 C ATOM 1598 C ALA A 100 -12.836 7.454 -1.731 1.00 0.00 C ATOM 1599 O ALA A 100 -13.140 7.510 -2.922 1.00 0.00 O ATOM 1600 CB ALA A 100 -13.023 5.069 -1.004 1.00 0.00 C ATOM 0 H ALA A 100 -11.861 6.119 0.906 1.00 0.00 H new ATOM 0 HA ALA A 100 -11.303 5.983 -1.887 1.00 0.00 H new ATOM 0 HB1 ALA A 100 -13.494 4.838 -1.960 1.00 0.00 H new ATOM 0 HB2 ALA A 100 -12.459 4.202 -0.659 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -13.791 5.317 -0.272 1.00 0.00 H new ATOM 1606 N GLN A 101 -13.134 8.414 -0.862 1.00 0.00 N ATOM 1607 CA GLN A 101 -13.854 9.615 -1.268 1.00 0.00 C ATOM 1608 C GLN A 101 -12.884 10.727 -1.655 1.00 0.00 C ATOM 1609 O GLN A 101 -13.198 11.911 -1.527 1.00 0.00 O ATOM 1610 CB GLN A 101 -14.771 10.092 -0.140 1.00 0.00 C ATOM 1611 CG GLN A 101 -16.042 9.270 -0.001 1.00 0.00 C ATOM 1612 CD GLN A 101 -17.071 9.602 -1.063 1.00 0.00 C ATOM 1613 OE1 GLN A 101 -16.904 9.029 -2.249 1.00 0.00 O flip ATOM 1614 NE2 GLN A 101 -18.007 10.365 -0.820 1.00 0.00 N flip ATOM 0 H GLN A 101 -12.888 8.384 0.127 1.00 0.00 H new ATOM 0 HA GLN A 101 -14.460 9.367 -2.139 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -14.222 10.060 0.801 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -15.039 11.134 -0.317 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -15.793 8.210 -0.060 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -16.475 9.441 0.985 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -18.097 10.783 0.106 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -18.692 10.578 -1.545 1.00 0.00 H new ATOM 1623 N CYS A 102 -11.705 10.338 -2.127 1.00 0.00 N ATOM 1624 CA CYS A 102 -10.688 11.303 -2.531 1.00 0.00 C ATOM 1625 C CYS A 102 -10.689 12.514 -1.605 1.00 0.00 C ATOM 1626 O CYS A 102 -10.774 13.655 -2.059 1.00 0.00 O ATOM 1627 CB CYS A 102 -10.923 11.748 -3.975 1.00 0.00 C ATOM 1628 SG CYS A 102 -12.388 12.785 -4.198 1.00 0.00 S ATOM 0 H CYS A 102 -11.430 9.362 -2.239 1.00 0.00 H new ATOM 0 HA CYS A 102 -9.714 10.818 -2.462 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -10.047 12.296 -4.322 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -11.017 10.864 -4.606 1.00 0.00 H new ATOM 0 HG CYS A 102 -13.140 12.708 -3.140 1.00 0.00 H new ATOM 1634 N ALA A 103 -10.595 12.259 -0.304 1.00 0.00 N ATOM 1635 CA ALA A 103 -10.585 13.328 0.686 1.00 0.00 C ATOM 1636 C ALA A 103 -9.234 14.035 0.716 1.00 0.00 C ATOM 1637 O ALA A 103 -8.231 13.530 0.212 1.00 0.00 O ATOM 1638 CB ALA A 103 -10.925 12.777 2.062 1.00 0.00 C ATOM 0 H ALA A 103 -10.525 11.320 0.089 1.00 0.00 H new ATOM 0 HA ALA A 103 -11.342 14.059 0.403 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -10.914 13.587 2.791 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -11.916 12.324 2.038 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -10.189 12.024 2.345 1.00 0.00 H new ATOM 1644 N PRO A 104 -9.205 15.233 1.320 1.00 0.00 N ATOM 1645 CA PRO A 104 -7.983 16.035 1.430 1.00 0.00 C ATOM 1646 C PRO A 104 -6.970 15.418 2.388 1.00 0.00 C ATOM 1647 O PRO A 104 -7.250 15.237 3.572 1.00 0.00 O ATOM 1648 CB PRO A 104 -8.486 17.374 1.974 1.00 0.00 C ATOM 1649 CG PRO A 104 -9.746 17.042 2.695 1.00 0.00 C ATOM 1650 CD PRO A 104 -10.364 15.895 1.942 1.00 0.00 C ATOM 0 HA PRO A 104 -7.461 16.116 0.477 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -7.755 17.829 2.643 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -8.667 18.086 1.168 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -9.542 16.765 3.729 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -10.418 17.899 2.721 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -10.903 15.221 2.608 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -11.077 16.242 1.195 1.00 0.00 H new ATOM 1658 N GLY A 105 -5.789 15.096 1.867 1.00 0.00 N ATOM 1659 CA GLY A 105 -4.752 14.504 2.690 1.00 0.00 C ATOM 1660 C GLY A 105 -5.312 13.577 3.751 1.00 0.00 C ATOM 1661 O GLY A 105 -5.540 13.989 4.888 1.00 0.00 O ATOM 0 H GLY A 105 -5.533 15.235 0.889 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -4.061 13.949 2.055 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -4.177 15.296 3.170 1.00 0.00 H new ATOM 1665 N VAL A 106 -5.536 12.321 3.379 1.00 0.00 N ATOM 1666 CA VAL A 106 -6.074 11.332 4.306 1.00 0.00 C ATOM 1667 C VAL A 106 -5.304 10.019 4.218 1.00 0.00 C ATOM 1668 O VAL A 106 -4.744 9.548 5.207 1.00 0.00 O ATOM 1669 CB VAL A 106 -7.565 11.060 4.033 1.00 0.00 C ATOM 1670 CG1 VAL A 106 -8.049 9.873 4.852 1.00 0.00 C ATOM 1671 CG2 VAL A 106 -8.396 12.299 4.332 1.00 0.00 C ATOM 0 H VAL A 106 -5.353 11.964 2.441 1.00 0.00 H new ATOM 0 HA VAL A 106 -5.965 11.746 5.308 1.00 0.00 H new ATOM 0 HB VAL A 106 -7.685 10.816 2.977 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -9.105 9.695 4.646 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -7.473 8.987 4.584 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -7.917 10.085 5.913 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -9.447 12.089 4.134 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -8.273 12.576 5.379 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -8.064 13.121 3.698 1.00 0.00 H new ATOM 1681 N VAL A 107 -5.279 9.433 3.025 1.00 0.00 N ATOM 1682 CA VAL A 107 -4.577 8.175 2.806 1.00 0.00 C ATOM 1683 C VAL A 107 -3.085 8.322 3.087 1.00 0.00 C ATOM 1684 O VAL A 107 -2.439 7.390 3.564 1.00 0.00 O ATOM 1685 CB VAL A 107 -4.769 7.668 1.364 1.00 0.00 C ATOM 1686 CG1 VAL A 107 -4.341 8.731 0.363 1.00 0.00 C ATOM 1687 CG2 VAL A 107 -3.995 6.377 1.146 1.00 0.00 C ATOM 0 H VAL A 107 -5.737 9.810 2.195 1.00 0.00 H new ATOM 0 HA VAL A 107 -5.005 7.450 3.498 1.00 0.00 H new ATOM 0 HB VAL A 107 -5.828 7.461 1.208 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -4.484 8.355 -0.650 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -4.943 9.628 0.505 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -3.289 8.972 0.516 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -4.142 6.033 0.122 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -2.934 6.555 1.320 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -4.354 5.616 1.839 1.00 0.00 H new ATOM 1697 N GLU A 108 -2.546 9.499 2.788 1.00 0.00 N ATOM 1698 CA GLU A 108 -1.130 9.768 3.008 1.00 0.00 C ATOM 1699 C GLU A 108 -0.755 9.545 4.471 1.00 0.00 C ATOM 1700 O GLU A 108 0.375 9.166 4.783 1.00 0.00 O ATOM 1701 CB GLU A 108 -0.789 11.202 2.596 1.00 0.00 C ATOM 1702 CG GLU A 108 -0.868 11.439 1.098 1.00 0.00 C ATOM 1703 CD GLU A 108 0.381 10.984 0.368 1.00 0.00 C ATOM 1704 OE1 GLU A 108 1.346 11.774 0.293 1.00 0.00 O ATOM 1705 OE2 GLU A 108 0.393 9.838 -0.128 1.00 0.00 O ATOM 0 H GLU A 108 -3.068 10.281 2.393 1.00 0.00 H new ATOM 0 HA GLU A 108 -0.556 9.075 2.393 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -1.470 11.888 3.100 1.00 0.00 H new ATOM 0 HB3 GLU A 108 0.217 11.441 2.941 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -1.732 10.911 0.696 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -1.028 12.501 0.910 1.00 0.00 H new ATOM 1712 N LEU A 109 -1.710 9.783 5.363 1.00 0.00 N ATOM 1713 CA LEU A 109 -1.481 9.609 6.793 1.00 0.00 C ATOM 1714 C LEU A 109 -1.221 8.143 7.128 1.00 0.00 C ATOM 1715 O LEU A 109 -0.574 7.830 8.128 1.00 0.00 O ATOM 1716 CB LEU A 109 -2.684 10.120 7.588 1.00 0.00 C ATOM 1717 CG LEU A 109 -2.956 11.622 7.502 1.00 0.00 C ATOM 1718 CD1 LEU A 109 -4.387 11.930 7.916 1.00 0.00 C ATOM 1719 CD2 LEU A 109 -1.970 12.393 8.367 1.00 0.00 C ATOM 0 H LEU A 109 -2.650 10.097 5.121 1.00 0.00 H new ATOM 0 HA LEU A 109 -0.599 10.188 7.068 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -3.573 9.590 7.245 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -2.540 9.856 8.636 1.00 0.00 H new ATOM 0 HG LEU A 109 -2.824 11.937 6.467 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -4.562 13.004 7.849 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -5.078 11.407 7.254 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -4.548 11.600 8.942 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -2.179 13.460 8.293 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -2.070 12.074 9.405 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -0.954 12.197 8.023 1.00 0.00 H new ATOM 1731 N VAL A 110 -1.728 7.250 6.285 1.00 0.00 N ATOM 1732 CA VAL A 110 -1.548 5.817 6.490 1.00 0.00 C ATOM 1733 C VAL A 110 -0.331 5.302 5.729 1.00 0.00 C ATOM 1734 O VAL A 110 0.161 4.205 5.993 1.00 0.00 O ATOM 1735 CB VAL A 110 -2.791 5.026 6.045 1.00 0.00 C ATOM 1736 CG1 VAL A 110 -2.621 3.546 6.351 1.00 0.00 C ATOM 1737 CG2 VAL A 110 -4.041 5.577 6.714 1.00 0.00 C ATOM 0 H VAL A 110 -2.267 7.493 5.454 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.395 5.667 7.559 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.904 5.138 4.967 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -3.510 3.003 6.029 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -1.750 3.162 5.820 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -2.481 3.410 7.423 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -4.910 5.006 6.388 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -3.940 5.497 7.796 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -4.170 6.624 6.438 1.00 0.00 H new ATOM 1747 N LEU A 111 0.149 6.101 4.782 1.00 0.00 N ATOM 1748 CA LEU A 111 1.310 5.726 3.982 1.00 0.00 C ATOM 1749 C LEU A 111 2.606 6.041 4.721 1.00 0.00 C ATOM 1750 O LEU A 111 3.625 5.380 4.517 1.00 0.00 O ATOM 1751 CB LEU A 111 1.285 6.458 2.638 1.00 0.00 C ATOM 1752 CG LEU A 111 0.104 6.138 1.722 1.00 0.00 C ATOM 1753 CD1 LEU A 111 -0.025 7.189 0.630 1.00 0.00 C ATOM 1754 CD2 LEU A 111 0.261 4.752 1.114 1.00 0.00 C ATOM 0 H LEU A 111 -0.247 7.012 4.550 1.00 0.00 H new ATOM 0 HA LEU A 111 1.267 4.651 3.805 1.00 0.00 H new ATOM 0 HB2 LEU A 111 1.289 7.531 2.831 1.00 0.00 H new ATOM 0 HB3 LEU A 111 2.207 6.227 2.104 1.00 0.00 H new ATOM 0 HG LEU A 111 -0.808 6.150 2.319 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.871 6.944 -0.012 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -0.185 8.167 1.084 1.00 0.00 H new ATOM 0 HD13 LEU A 111 0.888 7.210 0.035 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -0.589 4.541 0.465 1.00 0.00 H new ATOM 0 HD22 LEU A 111 1.181 4.712 0.531 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.303 4.008 1.910 1.00 0.00 H new ATOM 1766 N ILE A 112 2.560 7.052 5.582 1.00 0.00 N ATOM 1767 CA ILE A 112 3.730 7.452 6.354 1.00 0.00 C ATOM 1768 C ILE A 112 4.254 6.294 7.197 1.00 0.00 C ATOM 1769 O ILE A 112 5.408 5.881 7.080 1.00 0.00 O ATOM 1770 CB ILE A 112 3.414 8.643 7.278 1.00 0.00 C ATOM 1771 CG1 ILE A 112 3.687 9.964 6.554 1.00 0.00 C ATOM 1772 CG2 ILE A 112 4.235 8.554 8.556 1.00 0.00 C ATOM 1773 CD1 ILE A 112 3.127 11.172 7.272 1.00 0.00 C ATOM 0 H ILE A 112 1.725 7.609 5.763 1.00 0.00 H new ATOM 0 HA ILE A 112 4.494 7.752 5.637 1.00 0.00 H new ATOM 0 HB ILE A 112 2.358 8.607 7.545 1.00 0.00 H new ATOM 0 HG12 ILE A 112 4.763 10.088 6.435 1.00 0.00 H new ATOM 0 HG13 ILE A 112 3.259 9.916 5.553 1.00 0.00 H new ATOM 0 HG21 ILE A 112 4.001 9.403 9.199 1.00 0.00 H new ATOM 0 HG22 ILE A 112 3.997 7.627 9.078 1.00 0.00 H new ATOM 0 HG23 ILE A 112 5.296 8.569 8.308 1.00 0.00 H new ATOM 0 HD11 ILE A 112 3.357 12.073 6.703 1.00 0.00 H new ATOM 0 HD12 ILE A 112 2.046 11.070 7.368 1.00 0.00 H new ATOM 0 HD13 ILE A 112 3.574 11.245 8.264 1.00 0.00 H new ATOM 1785 N PRO A 113 3.386 5.755 8.066 1.00 0.00 N ATOM 1786 CA PRO A 113 3.738 4.635 8.944 1.00 0.00 C ATOM 1787 C PRO A 113 3.928 3.333 8.175 1.00 0.00 C ATOM 1788 O PRO A 113 4.777 2.511 8.523 1.00 0.00 O ATOM 1789 CB PRO A 113 2.535 4.531 9.885 1.00 0.00 C ATOM 1790 CG PRO A 113 1.401 5.114 9.115 1.00 0.00 C ATOM 1791 CD PRO A 113 1.995 6.197 8.258 1.00 0.00 C ATOM 0 HA PRO A 113 4.685 4.801 9.458 1.00 0.00 H new ATOM 0 HB2 PRO A 113 2.336 3.495 10.160 1.00 0.00 H new ATOM 0 HB3 PRO A 113 2.708 5.079 10.811 1.00 0.00 H new ATOM 0 HG2 PRO A 113 0.914 4.355 8.503 1.00 0.00 H new ATOM 0 HG3 PRO A 113 0.642 5.519 9.785 1.00 0.00 H new ATOM 0 HD2 PRO A 113 1.469 6.292 7.308 1.00 0.00 H new ATOM 0 HD3 PRO A 113 1.946 7.169 8.748 1.00 0.00 H new ATOM 1799 N LEU A 114 3.132 3.149 7.127 1.00 0.00 N ATOM 1800 CA LEU A 114 3.212 1.945 6.307 1.00 0.00 C ATOM 1801 C LEU A 114 4.662 1.609 5.973 1.00 0.00 C ATOM 1802 O LEU A 114 5.050 0.441 5.950 1.00 0.00 O ATOM 1803 CB LEU A 114 2.410 2.128 5.017 1.00 0.00 C ATOM 1804 CG LEU A 114 2.254 0.884 4.141 1.00 0.00 C ATOM 1805 CD1 LEU A 114 1.016 0.099 4.545 1.00 0.00 C ATOM 1806 CD2 LEU A 114 2.187 1.272 2.672 1.00 0.00 C ATOM 0 H LEU A 114 2.424 3.818 6.825 1.00 0.00 H new ATOM 0 HA LEU A 114 2.788 1.118 6.877 1.00 0.00 H new ATOM 0 HB2 LEU A 114 1.416 2.490 5.279 1.00 0.00 H new ATOM 0 HB3 LEU A 114 2.887 2.908 4.424 1.00 0.00 H new ATOM 0 HG LEU A 114 3.126 0.247 4.288 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.921 -0.783 3.911 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.105 -0.211 5.586 1.00 0.00 H new ATOM 0 HD13 LEU A 114 0.133 0.727 4.428 1.00 0.00 H new ATOM 0 HD21 LEU A 114 2.076 0.375 2.063 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.333 1.930 2.508 1.00 0.00 H new ATOM 0 HD23 LEU A 114 3.104 1.790 2.390 1.00 0.00 H new ATOM 1818 N ARG A 115 5.460 2.642 5.717 1.00 0.00 N ATOM 1819 CA ARG A 115 6.867 2.456 5.386 1.00 0.00 C ATOM 1820 C ARG A 115 7.672 2.076 6.626 1.00 0.00 C ATOM 1821 O ARG A 115 8.535 1.200 6.572 1.00 0.00 O ATOM 1822 CB ARG A 115 7.440 3.732 4.766 1.00 0.00 C ATOM 1823 CG ARG A 115 8.919 3.636 4.431 1.00 0.00 C ATOM 1824 CD ARG A 115 9.463 4.963 3.925 1.00 0.00 C ATOM 1825 NE ARG A 115 9.731 5.896 5.016 1.00 0.00 N ATOM 1826 CZ ARG A 115 10.342 7.064 4.850 1.00 0.00 C ATOM 1827 NH1 ARG A 115 10.746 7.440 3.644 1.00 0.00 N ATOM 1828 NH2 ARG A 115 10.550 7.859 5.892 1.00 0.00 N ATOM 0 H ARG A 115 5.155 3.615 5.733 1.00 0.00 H new ATOM 0 HA ARG A 115 6.939 1.644 4.663 1.00 0.00 H new ATOM 0 HB2 ARG A 115 6.885 3.965 3.857 1.00 0.00 H new ATOM 0 HB3 ARG A 115 7.286 4.562 5.456 1.00 0.00 H new ATOM 0 HG2 ARG A 115 9.475 3.328 5.317 1.00 0.00 H new ATOM 0 HG3 ARG A 115 9.073 2.866 3.675 1.00 0.00 H new ATOM 0 HD2 ARG A 115 10.381 4.788 3.364 1.00 0.00 H new ATOM 0 HD3 ARG A 115 8.747 5.409 3.234 1.00 0.00 H new ATOM 0 HE ARG A 115 9.433 5.637 5.956 1.00 0.00 H new ATOM 0 HH11 ARG A 115 10.588 6.832 2.841 1.00 0.00 H new ATOM 0 HH12 ARG A 115 11.215 8.337 3.520 1.00 0.00 H new ATOM 0 HH21 ARG A 115 10.241 7.573 6.821 1.00 0.00 H new ATOM 0 HH22 ARG A 115 11.019 8.756 5.764 1.00 0.00 H new ATOM 1842 N GLN A 116 7.383 2.740 7.740 1.00 0.00 N ATOM 1843 CA GLN A 116 8.080 2.472 8.992 1.00 0.00 C ATOM 1844 C GLN A 116 7.859 1.032 9.441 1.00 0.00 C ATOM 1845 O GLN A 116 8.747 0.408 10.021 1.00 0.00 O ATOM 1846 CB GLN A 116 7.607 3.437 10.081 1.00 0.00 C ATOM 1847 CG GLN A 116 8.196 4.832 9.954 1.00 0.00 C ATOM 1848 CD GLN A 116 8.456 5.228 8.514 1.00 0.00 C ATOM 1849 OE1 GLN A 116 9.268 4.610 7.826 1.00 0.00 O ATOM 1850 NE2 GLN A 116 7.765 6.263 8.051 1.00 0.00 N ATOM 0 H GLN A 116 6.671 3.468 7.801 1.00 0.00 H new ATOM 0 HA GLN A 116 9.147 2.621 8.823 1.00 0.00 H new ATOM 0 HB2 GLN A 116 6.520 3.506 10.047 1.00 0.00 H new ATOM 0 HB3 GLN A 116 7.870 3.028 11.057 1.00 0.00 H new ATOM 0 HG2 GLN A 116 7.515 5.552 10.407 1.00 0.00 H new ATOM 0 HG3 GLN A 116 9.130 4.880 10.514 1.00 0.00 H new ATOM 0 HE21 GLN A 116 7.102 6.746 8.657 1.00 0.00 H new ATOM 0 HE22 GLN A 116 7.897 6.575 7.089 1.00 0.00 H new ATOM 1859 N ARG A 117 6.668 0.509 9.168 1.00 0.00 N ATOM 1860 CA ARG A 117 6.329 -0.858 9.545 1.00 0.00 C ATOM 1861 C ARG A 117 7.072 -1.864 8.671 1.00 0.00 C ATOM 1862 O ARG A 117 7.639 -2.837 9.169 1.00 0.00 O ATOM 1863 CB ARG A 117 4.820 -1.083 9.430 1.00 0.00 C ATOM 1864 CG ARG A 117 4.011 -0.336 10.478 1.00 0.00 C ATOM 1865 CD ARG A 117 4.052 -1.046 11.822 1.00 0.00 C ATOM 1866 NE ARG A 117 3.753 -0.140 12.929 1.00 0.00 N ATOM 1867 CZ ARG A 117 4.608 0.766 13.388 1.00 0.00 C ATOM 1868 NH1 ARG A 117 5.809 0.887 12.840 1.00 0.00 N ATOM 1869 NH2 ARG A 117 4.262 1.554 14.399 1.00 0.00 N ATOM 0 H ARG A 117 5.922 1.011 8.687 1.00 0.00 H new ATOM 0 HA ARG A 117 6.634 -1.008 10.581 1.00 0.00 H new ATOM 0 HB2 ARG A 117 4.489 -0.773 8.439 1.00 0.00 H new ATOM 0 HB3 ARG A 117 4.613 -2.150 9.516 1.00 0.00 H new ATOM 0 HG2 ARG A 117 4.401 0.676 10.588 1.00 0.00 H new ATOM 0 HG3 ARG A 117 2.977 -0.245 10.145 1.00 0.00 H new ATOM 0 HD2 ARG A 117 3.334 -1.866 11.821 1.00 0.00 H new ATOM 0 HD3 ARG A 117 5.038 -1.486 11.970 1.00 0.00 H new ATOM 0 HE ARG A 117 2.837 -0.207 13.373 1.00 0.00 H new ATOM 0 HH11 ARG A 117 6.078 0.283 12.063 1.00 0.00 H new ATOM 0 HH12 ARG A 117 6.464 1.584 13.195 1.00 0.00 H new ATOM 0 HH21 ARG A 117 3.339 1.463 14.823 1.00 0.00 H new ATOM 0 HH22 ARG A 117 4.919 2.250 14.751 1.00 0.00 H new ATOM 1883 N LEU A 118 7.064 -1.623 7.364 1.00 0.00 N ATOM 1884 CA LEU A 118 7.737 -2.507 6.419 1.00 0.00 C ATOM 1885 C LEU A 118 9.244 -2.511 6.655 1.00 0.00 C ATOM 1886 O LEU A 118 9.862 -3.570 6.760 1.00 0.00 O ATOM 1887 CB LEU A 118 7.435 -2.076 4.983 1.00 0.00 C ATOM 1888 CG LEU A 118 5.970 -2.151 4.554 1.00 0.00 C ATOM 1889 CD1 LEU A 118 5.704 -1.203 3.395 1.00 0.00 C ATOM 1890 CD2 LEU A 118 5.597 -3.577 4.175 1.00 0.00 C ATOM 0 H LEU A 118 6.599 -0.823 6.935 1.00 0.00 H new ATOM 0 HA LEU A 118 7.361 -3.518 6.575 1.00 0.00 H new ATOM 0 HB2 LEU A 118 7.779 -1.050 4.853 1.00 0.00 H new ATOM 0 HB3 LEU A 118 8.023 -2.697 4.307 1.00 0.00 H new ATOM 0 HG LEU A 118 5.349 -1.846 5.396 1.00 0.00 H new ATOM 0 HD11 LEU A 118 4.656 -1.270 3.103 1.00 0.00 H new ATOM 0 HD12 LEU A 118 5.931 -0.182 3.701 1.00 0.00 H new ATOM 0 HD13 LEU A 118 6.334 -1.477 2.549 1.00 0.00 H new ATOM 0 HD21 LEU A 118 4.550 -3.611 3.872 1.00 0.00 H new ATOM 0 HD22 LEU A 118 6.225 -3.910 3.349 1.00 0.00 H new ATOM 0 HD23 LEU A 118 5.748 -4.233 5.032 1.00 0.00 H new ATOM 1902 N GLU A 119 9.828 -1.320 6.739 1.00 0.00 N ATOM 1903 CA GLU A 119 11.262 -1.187 6.964 1.00 0.00 C ATOM 1904 C GLU A 119 11.713 -2.059 8.132 1.00 0.00 C ATOM 1905 O GLU A 119 12.824 -2.588 8.132 1.00 0.00 O ATOM 1906 CB GLU A 119 11.625 0.275 7.235 1.00 0.00 C ATOM 1907 CG GLU A 119 11.613 1.146 5.990 1.00 0.00 C ATOM 1908 CD GLU A 119 12.224 2.513 6.228 1.00 0.00 C ATOM 1909 OE1 GLU A 119 13.109 2.624 7.102 1.00 0.00 O ATOM 1910 OE2 GLU A 119 11.817 3.472 5.540 1.00 0.00 O ATOM 0 H GLU A 119 9.330 -0.434 6.655 1.00 0.00 H new ATOM 0 HA GLU A 119 11.777 -1.521 6.063 1.00 0.00 H new ATOM 0 HB2 GLU A 119 10.925 0.686 7.962 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.616 0.317 7.688 1.00 0.00 H new ATOM 0 HG2 GLU A 119 12.160 0.642 5.193 1.00 0.00 H new ATOM 0 HG3 GLU A 119 10.586 1.266 5.645 1.00 0.00 H new ATOM 1917 N GLU A 120 10.842 -2.203 9.126 1.00 0.00 N ATOM 1918 CA GLU A 120 11.151 -3.009 10.301 1.00 0.00 C ATOM 1919 C GLU A 120 11.620 -4.404 9.896 1.00 0.00 C ATOM 1920 O GLU A 120 12.664 -4.874 10.347 1.00 0.00 O ATOM 1921 CB GLU A 120 9.925 -3.116 11.211 1.00 0.00 C ATOM 1922 CG GLU A 120 10.270 -3.334 12.674 1.00 0.00 C ATOM 1923 CD GLU A 120 9.121 -3.934 13.461 1.00 0.00 C ATOM 1924 OE1 GLU A 120 8.536 -4.932 12.992 1.00 0.00 O ATOM 1925 OE2 GLU A 120 8.807 -3.404 14.548 1.00 0.00 O ATOM 0 H GLU A 120 9.918 -1.772 9.141 1.00 0.00 H new ATOM 0 HA GLU A 120 11.957 -2.517 10.845 1.00 0.00 H new ATOM 0 HB2 GLU A 120 9.333 -2.205 11.118 1.00 0.00 H new ATOM 0 HB3 GLU A 120 9.299 -3.939 10.868 1.00 0.00 H new ATOM 0 HG2 GLU A 120 11.137 -3.991 12.745 1.00 0.00 H new ATOM 0 HG3 GLU A 120 10.554 -2.382 13.122 1.00 0.00 H new ATOM 1932 N ARG A 121 10.841 -5.059 9.042 1.00 0.00 N ATOM 1933 CA ARG A 121 11.175 -6.400 8.577 1.00 0.00 C ATOM 1934 C ARG A 121 12.343 -6.359 7.596 1.00 0.00 C ATOM 1935 O ARG A 121 13.141 -7.294 7.528 1.00 0.00 O ATOM 1936 CB ARG A 121 9.959 -7.050 7.913 1.00 0.00 C ATOM 1937 CG ARG A 121 8.893 -7.497 8.900 1.00 0.00 C ATOM 1938 CD ARG A 121 7.558 -7.730 8.210 1.00 0.00 C ATOM 1939 NE ARG A 121 6.714 -8.662 8.952 1.00 0.00 N ATOM 1940 CZ ARG A 121 6.128 -8.364 10.106 1.00 0.00 C ATOM 1941 NH1 ARG A 121 6.294 -7.165 10.647 1.00 0.00 N ATOM 1942 NH2 ARG A 121 5.374 -9.266 10.722 1.00 0.00 N ATOM 0 H ARG A 121 9.974 -4.683 8.658 1.00 0.00 H new ATOM 0 HA ARG A 121 11.469 -6.995 9.441 1.00 0.00 H new ATOM 0 HB2 ARG A 121 9.518 -6.343 7.210 1.00 0.00 H new ATOM 0 HB3 ARG A 121 10.290 -7.912 7.333 1.00 0.00 H new ATOM 0 HG2 ARG A 121 9.214 -8.415 9.393 1.00 0.00 H new ATOM 0 HG3 ARG A 121 8.775 -6.742 9.677 1.00 0.00 H new ATOM 0 HD2 ARG A 121 7.037 -6.779 8.098 1.00 0.00 H new ATOM 0 HD3 ARG A 121 7.732 -8.118 7.206 1.00 0.00 H new ATOM 0 HE ARG A 121 6.566 -9.593 8.563 1.00 0.00 H new ATOM 0 HH11 ARG A 121 6.873 -6.469 10.177 1.00 0.00 H new ATOM 0 HH12 ARG A 121 5.843 -6.939 11.533 1.00 0.00 H new ATOM 0 HH21 ARG A 121 5.244 -10.190 10.309 1.00 0.00 H new ATOM 0 HH22 ARG A 121 4.925 -9.036 11.608 1.00 0.00 H new ATOM 1956 N GLN A 122 12.435 -5.271 6.838 1.00 0.00 N ATOM 1957 CA GLN A 122 13.505 -5.111 5.860 1.00 0.00 C ATOM 1958 C GLN A 122 14.867 -5.361 6.498 1.00 0.00 C ATOM 1959 O GLN A 122 15.725 -6.023 5.913 1.00 0.00 O ATOM 1960 CB GLN A 122 13.463 -3.707 5.253 1.00 0.00 C ATOM 1961 CG GLN A 122 14.370 -3.540 4.045 1.00 0.00 C ATOM 1962 CD GLN A 122 14.764 -2.095 3.806 1.00 0.00 C ATOM 1963 OE1 GLN A 122 13.910 -1.211 3.731 1.00 0.00 O ATOM 1964 NE2 GLN A 122 16.063 -1.847 3.686 1.00 0.00 N ATOM 0 H GLN A 122 11.783 -4.488 6.882 1.00 0.00 H new ATOM 0 HA GLN A 122 13.354 -5.846 5.069 1.00 0.00 H new ATOM 0 HB2 GLN A 122 12.438 -3.476 4.962 1.00 0.00 H new ATOM 0 HB3 GLN A 122 13.749 -2.982 6.015 1.00 0.00 H new ATOM 0 HG2 GLN A 122 15.270 -4.139 4.185 1.00 0.00 H new ATOM 0 HG3 GLN A 122 13.865 -3.926 3.160 1.00 0.00 H new ATOM 0 HE21 GLN A 122 16.736 -2.610 3.755 1.00 0.00 H new ATOM 0 HE22 GLN A 122 16.387 -0.893 3.525 1.00 0.00 H new