USER MOD reduce.3.24.130724 H: found=0, std=0, add=984, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 984 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 464 ASN : amide:sc= -0.697! C(o=-0.7!,f=-6.2!) USER MOD Set 1.2: A 466 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 443 THR OG1 : rot 90:sc= 0.268 USER MOD Set 2.2: A 502 LYS NZ :NH3+ 170:sc= 1.28 (180deg=1.01) USER MOD Set 3.1: A 440 GLN : amide:sc= -0.491 K(o=0.14,f=-4.4!) USER MOD Set 3.2: A 476 SER OG : rot -8:sc= 0.634 USER MOD Set 4.1: A 413 ASN : amide:sc= 0.363 K(o=0.33,f=-9.7!) USER MOD Set 4.2: A 421 THR OG1 : rot 180:sc= -0.0284 USER MOD Single : A 391 SER OG : rot 180:sc= 0 USER MOD Single : A 392 HIS : no HE2:sc= 0.908 K(o=0.91,f=-4.7!) USER MOD Single : A 393 MET CE :methyl 141:sc= -0.18 (180deg=-0.47) USER MOD Single : A 396 HIS :FLIP no HD1:sc= -0.136 F(o=-0.69,f=-0.14) USER MOD Single : A 400 MET CE :methyl -156:sc= -0.182 (180deg=-0.812) USER MOD Single : A 405 SER OG : rot 0:sc= 0.382 USER MOD Single : A 407 MET CE :methyl -163:sc= -0.0891 (180deg=-0.59) USER MOD Single : A 411 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 415 ASN :FLIP amide:sc= -0.0038 F(o=-0.84,f=-0.0038) USER MOD Single : A 426 LYS NZ :NH3+ -172:sc= 0.895 (180deg=0.831) USER MOD Single : A 429 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.107) USER MOD Single : A 436 THR OG1 : rot -42:sc= -0.387 USER MOD Single : A 445 LYS NZ :NH3+ -166:sc= -0.537! (180deg=-1.77!) USER MOD Single : A 454 THR OG1 : rot 180:sc= 0 USER MOD Single : A 455 THR OG1 : rot 148:sc= 1.28 USER MOD Single : A 456 TYR OH : rot 180:sc= 0 USER MOD Single : A 462 MET CE :methyl 172:sc= -6.23! (180deg=-6.83!) USER MOD Single : A 471 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 477 MET CE :methyl 161:sc= 0 (180deg=-0.181) USER MOD Single : A 482 THR OG1 : rot -110:sc= 0.102 USER MOD Single : A 485 HIS : no HD1:sc= -0.1 X(o=-0.1,f=-0.1) USER MOD Single : A 489 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 495 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 501 LYS NZ :NH3+ -149:sc= 0.929 (180deg=0.115) USER MOD Single : A 505 GLN :FLIP amide:sc= -0.043 F(o=-1.2!,f=-0.043) USER MOD Single : A 512 GLN : amide:sc= 0 K(o=0,f=-1.8!) USER MOD Single : A 514 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 390 -7.240 17.864 -13.740 1.00 0.00 N ATOM 2 CA GLY A 390 -7.755 18.848 -14.693 1.00 0.00 C ATOM 3 C GLY A 390 -6.783 19.968 -14.903 1.00 0.00 C ATOM 4 O GLY A 390 -5.883 20.164 -14.071 1.00 0.00 O ATOM 0 HA2 GLY A 390 -7.961 18.360 -15.646 1.00 0.00 H new ATOM 0 HA3 GLY A 390 -8.701 19.249 -14.329 1.00 0.00 H new ATOM 10 N SER A 391 -6.974 20.714 -16.006 1.00 0.00 N ATOM 11 CA SER A 391 -6.108 21.811 -16.420 1.00 0.00 C ATOM 12 C SER A 391 -4.731 21.323 -16.907 1.00 0.00 C ATOM 13 O SER A 391 -4.134 20.404 -16.345 1.00 0.00 O ATOM 14 CB SER A 391 -6.002 22.892 -15.332 1.00 0.00 C ATOM 15 OG SER A 391 -7.284 23.489 -15.106 1.00 0.00 O ATOM 0 H SER A 391 -7.756 20.560 -16.643 1.00 0.00 H new ATOM 0 HA SER A 391 -6.580 22.279 -17.284 1.00 0.00 H new ATOM 0 HB2 SER A 391 -5.628 22.453 -14.407 1.00 0.00 H new ATOM 0 HB3 SER A 391 -5.285 23.655 -15.635 1.00 0.00 H new ATOM 0 HG SER A 391 -7.207 24.175 -14.410 1.00 0.00 H new ATOM 21 N HIS A 392 -4.282 21.879 -18.000 1.00 0.00 N ATOM 22 CA HIS A 392 -2.986 21.550 -18.545 1.00 0.00 C ATOM 23 C HIS A 392 -2.086 22.744 -18.502 1.00 0.00 C ATOM 24 O HIS A 392 -2.507 23.860 -18.813 1.00 0.00 O ATOM 25 CB HIS A 392 -3.081 20.986 -19.968 1.00 0.00 C ATOM 26 CG HIS A 392 -3.577 19.579 -20.020 1.00 0.00 C ATOM 27 ND1 HIS A 392 -2.756 18.483 -19.893 1.00 0.00 N ATOM 28 CD2 HIS A 392 -4.829 19.094 -20.157 1.00 0.00 C ATOM 29 CE1 HIS A 392 -3.504 17.391 -19.955 1.00 0.00 C ATOM 30 NE2 HIS A 392 -4.781 17.700 -20.111 1.00 0.00 N ATOM 0 H HIS A 392 -4.801 22.572 -18.539 1.00 0.00 H new ATOM 0 HA HIS A 392 -2.559 20.764 -17.922 1.00 0.00 H new ATOM 0 HB2 HIS A 392 -3.745 21.619 -20.557 1.00 0.00 H new ATOM 0 HB3 HIS A 392 -2.097 21.033 -20.435 1.00 0.00 H new ATOM 0 HD1 HIS A 392 -1.744 18.507 -19.772 1.00 0.00 H new ATOM 0 HD2 HIS A 392 -5.722 19.688 -20.282 1.00 0.00 H new ATOM 0 HE1 HIS A 392 -3.122 16.383 -19.887 1.00 0.00 H new ATOM 38 N MET A 393 -0.878 22.529 -18.073 1.00 0.00 N ATOM 39 CA MET A 393 0.089 23.585 -17.963 1.00 0.00 C ATOM 40 C MET A 393 1.216 23.341 -18.932 1.00 0.00 C ATOM 41 O MET A 393 1.562 24.229 -19.727 1.00 0.00 O ATOM 42 CB MET A 393 0.653 23.698 -16.528 1.00 0.00 C ATOM 43 CG MET A 393 -0.325 24.199 -15.449 1.00 0.00 C ATOM 44 SD MET A 393 -1.743 23.111 -15.114 1.00 0.00 S ATOM 45 CE MET A 393 -0.930 21.613 -14.546 1.00 0.00 C ATOM 0 H MET A 393 -0.532 21.613 -17.788 1.00 0.00 H new ATOM 0 HA MET A 393 -0.412 24.524 -18.200 1.00 0.00 H new ATOM 0 HB2 MET A 393 1.022 22.717 -16.227 1.00 0.00 H new ATOM 0 HB3 MET A 393 1.512 24.369 -16.550 1.00 0.00 H new ATOM 0 HG2 MET A 393 0.228 24.343 -14.521 1.00 0.00 H new ATOM 0 HG3 MET A 393 -0.702 25.176 -15.750 1.00 0.00 H new ATOM 0 HE1 MET A 393 -1.500 21.178 -13.725 1.00 0.00 H new ATOM 0 HE2 MET A 393 -0.872 20.897 -15.366 1.00 0.00 H new ATOM 0 HE3 MET A 393 0.076 21.853 -14.202 1.00 0.00 H new ATOM 55 N LEU A 394 1.742 22.108 -18.903 1.00 0.00 N ATOM 56 CA LEU A 394 2.893 21.687 -19.714 1.00 0.00 C ATOM 57 C LEU A 394 4.174 22.460 -19.338 1.00 0.00 C ATOM 58 O LEU A 394 4.188 23.225 -18.359 1.00 0.00 O ATOM 59 CB LEU A 394 2.621 21.771 -21.251 1.00 0.00 C ATOM 60 CG LEU A 394 1.637 20.750 -21.883 1.00 0.00 C ATOM 61 CD1 LEU A 394 2.050 19.321 -21.592 1.00 0.00 C ATOM 62 CD2 LEU A 394 0.199 20.996 -21.468 1.00 0.00 C ATOM 0 H LEU A 394 1.375 21.366 -18.308 1.00 0.00 H new ATOM 0 HA LEU A 394 3.052 20.634 -19.479 1.00 0.00 H new ATOM 0 HB2 LEU A 394 2.246 22.771 -21.468 1.00 0.00 H new ATOM 0 HB3 LEU A 394 3.578 21.671 -21.764 1.00 0.00 H new ATOM 0 HG LEU A 394 1.689 20.902 -22.961 1.00 0.00 H new ATOM 0 HD11 LEU A 394 1.337 18.636 -22.051 1.00 0.00 H new ATOM 0 HD12 LEU A 394 3.044 19.139 -22.002 1.00 0.00 H new ATOM 0 HD13 LEU A 394 2.067 19.159 -20.514 1.00 0.00 H new ATOM 0 HD21 LEU A 394 -0.447 20.254 -21.938 1.00 0.00 H new ATOM 0 HD22 LEU A 394 0.114 20.917 -20.384 1.00 0.00 H new ATOM 0 HD23 LEU A 394 -0.105 21.994 -21.783 1.00 0.00 H new ATOM 74 N ASP A 395 5.241 22.209 -20.099 1.00 0.00 N ATOM 75 CA ASP A 395 6.575 22.834 -19.941 1.00 0.00 C ATOM 76 C ASP A 395 7.264 22.379 -18.658 1.00 0.00 C ATOM 77 O ASP A 395 8.059 21.420 -18.677 1.00 0.00 O ATOM 78 CB ASP A 395 6.545 24.379 -20.062 1.00 0.00 C ATOM 79 CG ASP A 395 7.933 25.008 -20.010 1.00 0.00 C ATOM 80 OD1 ASP A 395 8.642 25.011 -21.041 1.00 0.00 O ATOM 81 OD2 ASP A 395 8.333 25.534 -18.951 1.00 0.00 O ATOM 0 H ASP A 395 5.209 21.544 -20.871 1.00 0.00 H new ATOM 0 HA ASP A 395 7.174 22.480 -20.780 1.00 0.00 H new ATOM 0 HB2 ASP A 395 6.062 24.655 -20.999 1.00 0.00 H new ATOM 0 HB3 ASP A 395 5.936 24.789 -19.257 1.00 0.00 H new ATOM 86 N HIS A 396 6.931 22.997 -17.553 1.00 0.00 N ATOM 87 CA HIS A 396 7.501 22.622 -16.288 1.00 0.00 C ATOM 88 C HIS A 396 6.634 21.521 -15.713 1.00 0.00 C ATOM 89 O HIS A 396 5.588 21.798 -15.120 1.00 0.00 O ATOM 90 CB HIS A 396 7.563 23.825 -15.330 1.00 0.00 C ATOM 91 CG HIS A 396 8.439 23.609 -14.130 1.00 0.00 C ATOM 92 ND1 HIS A 396 8.164 23.051 -12.925 1.00 0.00 N flip ATOM 93 CD2 HIS A 396 9.766 23.966 -14.090 1.00 0.00 C flip ATOM 94 CE1 HIS A 396 9.321 23.058 -12.144 1.00 0.00 C flip ATOM 95 NE2 HIS A 396 10.255 23.622 -12.898 1.00 0.00 N flip ATOM 0 H HIS A 396 6.263 23.767 -17.506 1.00 0.00 H new ATOM 0 HA HIS A 396 8.525 22.274 -16.422 1.00 0.00 H new ATOM 0 HB2 HIS A 396 7.925 24.694 -15.879 1.00 0.00 H new ATOM 0 HB3 HIS A 396 6.553 24.059 -14.992 1.00 0.00 H new ATOM 0 HD2 HIS A 396 10.317 24.443 -14.887 1.00 0.00 H new ATOM 0 HE1 HIS A 396 9.432 22.683 -11.137 1.00 0.00 H new ATOM 0 HE2 HIS A 396 11.220 23.773 -12.605 1.00 0.00 H new ATOM 103 N LEU A 397 7.051 20.279 -15.953 1.00 0.00 N ATOM 104 CA LEU A 397 6.312 19.068 -15.575 1.00 0.00 C ATOM 105 C LEU A 397 5.117 18.834 -16.486 1.00 0.00 C ATOM 106 O LEU A 397 4.559 19.768 -17.083 1.00 0.00 O ATOM 107 CB LEU A 397 5.920 18.992 -14.070 1.00 0.00 C ATOM 108 CG LEU A 397 7.010 18.532 -13.070 1.00 0.00 C ATOM 109 CD1 LEU A 397 7.435 17.101 -13.355 1.00 0.00 C ATOM 110 CD2 LEU A 397 8.220 19.452 -13.088 1.00 0.00 C ATOM 0 H LEU A 397 7.932 20.078 -16.426 1.00 0.00 H new ATOM 0 HA LEU A 397 7.016 18.248 -15.720 1.00 0.00 H new ATOM 0 HB2 LEU A 397 5.576 19.979 -13.762 1.00 0.00 H new ATOM 0 HB3 LEU A 397 5.071 18.315 -13.977 1.00 0.00 H new ATOM 0 HG LEU A 397 6.571 18.579 -12.073 1.00 0.00 H new ATOM 0 HD11 LEU A 397 8.201 16.800 -12.640 1.00 0.00 H new ATOM 0 HD12 LEU A 397 6.573 16.440 -13.263 1.00 0.00 H new ATOM 0 HD13 LEU A 397 7.836 17.035 -14.366 1.00 0.00 H new ATOM 0 HD21 LEU A 397 8.960 19.094 -12.373 1.00 0.00 H new ATOM 0 HD22 LEU A 397 8.656 19.461 -14.087 1.00 0.00 H new ATOM 0 HD23 LEU A 397 7.913 20.462 -12.817 1.00 0.00 H new ATOM 122 N LEU A 398 4.738 17.600 -16.614 1.00 0.00 N ATOM 123 CA LEU A 398 3.662 17.226 -17.491 1.00 0.00 C ATOM 124 C LEU A 398 2.542 16.627 -16.668 1.00 0.00 C ATOM 125 O LEU A 398 2.788 16.068 -15.574 1.00 0.00 O ATOM 126 CB LEU A 398 4.165 16.212 -18.531 1.00 0.00 C ATOM 127 CG LEU A 398 5.389 16.645 -19.367 1.00 0.00 C ATOM 128 CD1 LEU A 398 5.813 15.539 -20.308 1.00 0.00 C ATOM 129 CD2 LEU A 398 5.102 17.918 -20.148 1.00 0.00 C ATOM 0 H LEU A 398 5.164 16.819 -16.114 1.00 0.00 H new ATOM 0 HA LEU A 398 3.291 18.105 -18.018 1.00 0.00 H new ATOM 0 HB2 LEU A 398 4.414 15.285 -18.014 1.00 0.00 H new ATOM 0 HB3 LEU A 398 3.346 15.986 -19.214 1.00 0.00 H new ATOM 0 HG LEU A 398 6.206 16.848 -18.675 1.00 0.00 H new ATOM 0 HD11 LEU A 398 6.677 15.865 -20.887 1.00 0.00 H new ATOM 0 HD12 LEU A 398 6.077 14.652 -19.732 1.00 0.00 H new ATOM 0 HD13 LEU A 398 4.992 15.302 -20.984 1.00 0.00 H new ATOM 0 HD21 LEU A 398 5.983 18.197 -20.726 1.00 0.00 H new ATOM 0 HD22 LEU A 398 4.263 17.749 -20.823 1.00 0.00 H new ATOM 0 HD23 LEU A 398 4.854 18.722 -19.455 1.00 0.00 H new ATOM 141 N GLU A 399 1.333 16.752 -17.155 1.00 0.00 N ATOM 142 CA GLU A 399 0.186 16.230 -16.465 1.00 0.00 C ATOM 143 C GLU A 399 0.122 14.721 -16.671 1.00 0.00 C ATOM 144 O GLU A 399 0.253 14.230 -17.801 1.00 0.00 O ATOM 145 CB GLU A 399 -1.120 16.892 -16.950 1.00 0.00 C ATOM 146 CG GLU A 399 -1.190 18.429 -16.819 1.00 0.00 C ATOM 147 CD GLU A 399 -0.290 19.168 -17.797 1.00 0.00 C ATOM 148 OE1 GLU A 399 -0.227 18.763 -18.960 1.00 0.00 O ATOM 149 OE2 GLU A 399 0.367 20.162 -17.404 1.00 0.00 O ATOM 0 H GLU A 399 1.119 17.217 -18.037 1.00 0.00 H new ATOM 0 HA GLU A 399 0.289 16.455 -15.404 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -1.270 16.629 -17.997 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -1.951 16.462 -16.391 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -2.220 18.751 -16.972 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -0.916 18.711 -15.802 1.00 0.00 H new ATOM 156 N MET A 400 -0.051 13.988 -15.595 1.00 0.00 N ATOM 157 CA MET A 400 -0.100 12.537 -15.672 1.00 0.00 C ATOM 158 C MET A 400 -1.469 12.094 -16.143 1.00 0.00 C ATOM 159 O MET A 400 -1.603 11.152 -16.923 1.00 0.00 O ATOM 160 CB MET A 400 0.248 11.911 -14.318 1.00 0.00 C ATOM 161 CG MET A 400 0.233 10.383 -14.313 1.00 0.00 C ATOM 162 SD MET A 400 0.761 9.678 -12.734 1.00 0.00 S ATOM 163 CE MET A 400 2.446 10.286 -12.651 1.00 0.00 C ATOM 0 H MET A 400 -0.161 14.368 -14.655 1.00 0.00 H new ATOM 0 HA MET A 400 0.642 12.195 -16.394 1.00 0.00 H new ATOM 0 HB2 MET A 400 1.237 12.255 -14.015 1.00 0.00 H new ATOM 0 HB3 MET A 400 -0.458 12.273 -13.571 1.00 0.00 H new ATOM 0 HG2 MET A 400 -0.774 10.034 -14.542 1.00 0.00 H new ATOM 0 HG3 MET A 400 0.886 10.016 -15.105 1.00 0.00 H new ATOM 0 HE1 MET A 400 3.036 9.635 -12.006 1.00 0.00 H new ATOM 0 HE2 MET A 400 2.879 10.296 -13.651 1.00 0.00 H new ATOM 0 HE3 MET A 400 2.448 11.297 -12.245 1.00 0.00 H new ATOM 173 N ILE A 401 -2.473 12.774 -15.670 1.00 0.00 N ATOM 174 CA ILE A 401 -3.820 12.523 -16.089 1.00 0.00 C ATOM 175 C ILE A 401 -4.098 13.440 -17.268 1.00 0.00 C ATOM 176 O ILE A 401 -4.133 14.666 -17.109 1.00 0.00 O ATOM 177 CB ILE A 401 -4.829 12.815 -14.942 1.00 0.00 C ATOM 178 CG1 ILE A 401 -4.486 11.973 -13.698 1.00 0.00 C ATOM 179 CG2 ILE A 401 -6.253 12.526 -15.402 1.00 0.00 C ATOM 180 CD1 ILE A 401 -5.371 12.246 -12.493 1.00 0.00 C ATOM 0 H ILE A 401 -2.380 13.520 -14.981 1.00 0.00 H new ATOM 0 HA ILE A 401 -3.938 11.475 -16.364 1.00 0.00 H new ATOM 0 HB ILE A 401 -4.757 13.870 -14.677 1.00 0.00 H new ATOM 0 HG12 ILE A 401 -4.561 10.917 -13.957 1.00 0.00 H new ATOM 0 HG13 ILE A 401 -3.448 12.161 -13.422 1.00 0.00 H new ATOM 0 HG21 ILE A 401 -6.948 12.735 -14.588 1.00 0.00 H new ATOM 0 HG22 ILE A 401 -6.495 13.158 -16.257 1.00 0.00 H new ATOM 0 HG23 ILE A 401 -6.337 11.478 -15.690 1.00 0.00 H new ATOM 0 HD11 ILE A 401 -5.061 11.611 -11.663 1.00 0.00 H new ATOM 0 HD12 ILE A 401 -5.279 13.293 -12.204 1.00 0.00 H new ATOM 0 HD13 ILE A 401 -6.409 12.030 -12.747 1.00 0.00 H new ATOM 192 N LEU A 402 -4.245 12.869 -18.440 1.00 0.00 N ATOM 193 CA LEU A 402 -4.453 13.659 -19.636 1.00 0.00 C ATOM 194 C LEU A 402 -5.911 13.980 -19.861 1.00 0.00 C ATOM 195 O LEU A 402 -6.797 13.473 -19.143 1.00 0.00 O ATOM 196 CB LEU A 402 -3.873 12.970 -20.867 1.00 0.00 C ATOM 197 CG LEU A 402 -2.356 12.761 -20.872 1.00 0.00 C ATOM 198 CD1 LEU A 402 -1.934 12.046 -22.129 1.00 0.00 C ATOM 199 CD2 LEU A 402 -1.618 14.090 -20.750 1.00 0.00 C ATOM 0 H LEU A 402 -4.225 11.861 -18.594 1.00 0.00 H new ATOM 0 HA LEU A 402 -3.924 14.599 -19.480 1.00 0.00 H new ATOM 0 HB2 LEU A 402 -4.353 11.997 -20.974 1.00 0.00 H new ATOM 0 HB3 LEU A 402 -4.141 13.556 -21.746 1.00 0.00 H new ATOM 0 HG LEU A 402 -2.096 12.148 -20.009 1.00 0.00 H new ATOM 0 HD11 LEU A 402 -0.853 11.903 -22.121 1.00 0.00 H new ATOM 0 HD12 LEU A 402 -2.428 11.076 -22.179 1.00 0.00 H new ATOM 0 HD13 LEU A 402 -2.215 12.641 -22.998 1.00 0.00 H new ATOM 0 HD21 LEU A 402 -0.543 13.911 -20.756 1.00 0.00 H new ATOM 0 HD22 LEU A 402 -1.884 14.732 -21.590 1.00 0.00 H new ATOM 0 HD23 LEU A 402 -1.899 14.578 -19.817 1.00 0.00 H new ATOM 211 N LEU A 403 -6.152 14.844 -20.857 1.00 0.00 N ATOM 212 CA LEU A 403 -7.478 15.289 -21.283 1.00 0.00 C ATOM 213 C LEU A 403 -8.090 16.248 -20.262 1.00 0.00 C ATOM 214 O LEU A 403 -8.329 17.414 -20.566 1.00 0.00 O ATOM 215 CB LEU A 403 -8.408 14.094 -21.582 1.00 0.00 C ATOM 216 CG LEU A 403 -9.808 14.421 -22.089 1.00 0.00 C ATOM 217 CD1 LEU A 403 -9.740 15.164 -23.409 1.00 0.00 C ATOM 218 CD2 LEU A 403 -10.619 13.147 -22.231 1.00 0.00 C ATOM 0 H LEU A 403 -5.401 15.264 -21.404 1.00 0.00 H new ATOM 0 HA LEU A 403 -7.361 15.839 -22.217 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -7.919 13.460 -22.321 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -8.506 13.504 -20.671 1.00 0.00 H new ATOM 0 HG LEU A 403 -10.300 15.069 -21.364 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -10.750 15.388 -23.753 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -9.188 16.094 -23.275 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -9.233 14.545 -24.149 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -11.618 13.390 -22.594 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -10.128 12.480 -22.940 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -10.695 12.654 -21.262 1.00 0.00 H new ATOM 230 N VAL A 404 -8.310 15.749 -19.070 1.00 0.00 N ATOM 231 CA VAL A 404 -8.847 16.495 -17.952 1.00 0.00 C ATOM 232 C VAL A 404 -8.923 15.567 -16.753 1.00 0.00 C ATOM 233 O VAL A 404 -8.468 15.894 -15.659 1.00 0.00 O ATOM 234 CB VAL A 404 -10.255 17.177 -18.244 1.00 0.00 C ATOM 235 CG1 VAL A 404 -11.336 16.180 -18.680 1.00 0.00 C ATOM 236 CG2 VAL A 404 -10.730 17.980 -17.038 1.00 0.00 C ATOM 0 H VAL A 404 -8.113 14.775 -18.841 1.00 0.00 H new ATOM 0 HA VAL A 404 -8.174 17.329 -17.754 1.00 0.00 H new ATOM 0 HB VAL A 404 -10.094 17.850 -19.086 1.00 0.00 H new ATOM 0 HG11 VAL A 404 -12.270 16.712 -18.862 1.00 0.00 H new ATOM 0 HG12 VAL A 404 -11.020 15.678 -19.594 1.00 0.00 H new ATOM 0 HG13 VAL A 404 -11.488 15.441 -17.894 1.00 0.00 H new ATOM 0 HG21 VAL A 404 -11.694 18.437 -17.262 1.00 0.00 H new ATOM 0 HG22 VAL A 404 -10.833 17.318 -16.178 1.00 0.00 H new ATOM 0 HG23 VAL A 404 -10.003 18.760 -16.811 1.00 0.00 H new ATOM 246 N SER A 405 -9.465 14.399 -16.987 1.00 0.00 N ATOM 247 CA SER A 405 -9.633 13.372 -16.011 1.00 0.00 C ATOM 248 C SER A 405 -9.906 12.098 -16.771 1.00 0.00 C ATOM 249 O SER A 405 -10.359 12.166 -17.924 1.00 0.00 O ATOM 250 CB SER A 405 -10.831 13.689 -15.088 1.00 0.00 C ATOM 251 OG SER A 405 -10.655 14.926 -14.397 1.00 0.00 O ATOM 0 H SER A 405 -9.815 14.134 -17.908 1.00 0.00 H new ATOM 0 HA SER A 405 -8.745 13.287 -15.385 1.00 0.00 H new ATOM 0 HB2 SER A 405 -11.745 13.730 -15.680 1.00 0.00 H new ATOM 0 HB3 SER A 405 -10.956 12.883 -14.365 1.00 0.00 H new ATOM 0 HG SER A 405 -9.799 15.327 -14.657 1.00 0.00 H new ATOM 257 N GLU A 406 -9.607 10.965 -16.180 1.00 0.00 N ATOM 258 CA GLU A 406 -9.918 9.705 -16.801 1.00 0.00 C ATOM 259 C GLU A 406 -11.398 9.462 -16.637 1.00 0.00 C ATOM 260 O GLU A 406 -11.876 9.145 -15.529 1.00 0.00 O ATOM 261 CB GLU A 406 -9.123 8.560 -16.178 1.00 0.00 C ATOM 262 CG GLU A 406 -7.619 8.676 -16.343 1.00 0.00 C ATOM 263 CD GLU A 406 -7.190 8.605 -17.783 1.00 0.00 C ATOM 264 OE1 GLU A 406 -7.016 7.493 -18.301 1.00 0.00 O ATOM 265 OE2 GLU A 406 -7.001 9.653 -18.418 1.00 0.00 O ATOM 0 H GLU A 406 -9.149 10.893 -15.271 1.00 0.00 H new ATOM 0 HA GLU A 406 -9.646 9.744 -17.856 1.00 0.00 H new ATOM 0 HB2 GLU A 406 -9.356 8.509 -15.114 1.00 0.00 H new ATOM 0 HB3 GLU A 406 -9.453 7.621 -16.622 1.00 0.00 H new ATOM 0 HG2 GLU A 406 -7.281 9.619 -15.913 1.00 0.00 H new ATOM 0 HG3 GLU A 406 -7.133 7.878 -15.783 1.00 0.00 H new ATOM 272 N MET A 407 -12.133 9.682 -17.704 1.00 0.00 N ATOM 273 CA MET A 407 -13.579 9.527 -17.705 1.00 0.00 C ATOM 274 C MET A 407 -13.966 8.113 -17.383 1.00 0.00 C ATOM 275 O MET A 407 -14.972 7.868 -16.721 1.00 0.00 O ATOM 276 CB MET A 407 -14.181 9.960 -19.041 1.00 0.00 C ATOM 277 CG MET A 407 -13.993 11.436 -19.340 1.00 0.00 C ATOM 278 SD MET A 407 -14.731 12.498 -18.080 1.00 0.00 S ATOM 279 CE MET A 407 -16.455 12.030 -18.220 1.00 0.00 C ATOM 0 H MET A 407 -11.747 9.975 -18.602 1.00 0.00 H new ATOM 0 HA MET A 407 -13.982 10.177 -16.929 1.00 0.00 H new ATOM 0 HB2 MET A 407 -13.728 9.375 -19.841 1.00 0.00 H new ATOM 0 HB3 MET A 407 -15.246 9.730 -19.042 1.00 0.00 H new ATOM 0 HG2 MET A 407 -12.928 11.655 -19.416 1.00 0.00 H new ATOM 0 HG3 MET A 407 -14.436 11.666 -20.309 1.00 0.00 H new ATOM 0 HE1 MET A 407 -17.077 12.786 -17.742 1.00 0.00 H new ATOM 0 HE2 MET A 407 -16.726 11.950 -19.273 1.00 0.00 H new ATOM 0 HE3 MET A 407 -16.612 11.069 -17.731 1.00 0.00 H new ATOM 289 N GLU A 408 -13.175 7.193 -17.852 1.00 0.00 N ATOM 290 CA GLU A 408 -13.371 5.806 -17.576 1.00 0.00 C ATOM 291 C GLU A 408 -12.047 5.168 -17.233 1.00 0.00 C ATOM 292 O GLU A 408 -11.110 5.186 -18.047 1.00 0.00 O ATOM 293 CB GLU A 408 -13.972 5.091 -18.774 1.00 0.00 C ATOM 294 CG GLU A 408 -15.361 5.549 -19.173 1.00 0.00 C ATOM 295 CD GLU A 408 -15.849 4.810 -20.375 1.00 0.00 C ATOM 296 OE1 GLU A 408 -16.073 3.578 -20.274 1.00 0.00 O ATOM 297 OE2 GLU A 408 -15.979 5.425 -21.454 1.00 0.00 O ATOM 0 H GLU A 408 -12.368 7.390 -18.443 1.00 0.00 H new ATOM 0 HA GLU A 408 -14.060 5.719 -16.736 1.00 0.00 H new ATOM 0 HB2 GLU A 408 -13.305 5.222 -19.626 1.00 0.00 H new ATOM 0 HB3 GLU A 408 -14.008 4.023 -18.559 1.00 0.00 H new ATOM 0 HG2 GLU A 408 -16.050 5.394 -18.343 1.00 0.00 H new ATOM 0 HG3 GLU A 408 -15.348 6.619 -19.381 1.00 0.00 H new ATOM 304 N GLU A 409 -11.941 4.648 -16.040 1.00 0.00 N ATOM 305 CA GLU A 409 -10.758 3.948 -15.642 1.00 0.00 C ATOM 306 C GLU A 409 -11.103 2.800 -14.707 1.00 0.00 C ATOM 307 O GLU A 409 -11.999 2.912 -13.864 1.00 0.00 O ATOM 308 CB GLU A 409 -9.716 4.884 -14.981 1.00 0.00 C ATOM 309 CG GLU A 409 -10.169 5.555 -13.685 1.00 0.00 C ATOM 310 CD GLU A 409 -9.061 6.343 -13.027 1.00 0.00 C ATOM 311 OE1 GLU A 409 -8.108 5.721 -12.512 1.00 0.00 O ATOM 312 OE2 GLU A 409 -9.119 7.596 -13.012 1.00 0.00 O ATOM 0 H GLU A 409 -12.667 4.699 -15.325 1.00 0.00 H new ATOM 0 HA GLU A 409 -10.306 3.546 -16.549 1.00 0.00 H new ATOM 0 HB2 GLU A 409 -8.813 4.308 -14.776 1.00 0.00 H new ATOM 0 HB3 GLU A 409 -9.444 5.660 -15.696 1.00 0.00 H new ATOM 0 HG2 GLU A 409 -11.007 6.219 -13.896 1.00 0.00 H new ATOM 0 HG3 GLU A 409 -10.531 4.795 -12.993 1.00 0.00 H new ATOM 319 N LEU A 410 -10.433 1.689 -14.897 1.00 0.00 N ATOM 320 CA LEU A 410 -10.530 0.549 -13.986 1.00 0.00 C ATOM 321 C LEU A 410 -9.278 0.532 -13.131 1.00 0.00 C ATOM 322 O LEU A 410 -9.053 -0.354 -12.309 1.00 0.00 O ATOM 323 CB LEU A 410 -10.686 -0.800 -14.736 1.00 0.00 C ATOM 324 CG LEU A 410 -12.053 -1.109 -15.399 1.00 0.00 C ATOM 325 CD1 LEU A 410 -12.376 -0.151 -16.532 1.00 0.00 C ATOM 326 CD2 LEU A 410 -12.092 -2.547 -15.893 1.00 0.00 C ATOM 0 H LEU A 410 -9.802 1.539 -15.684 1.00 0.00 H new ATOM 0 HA LEU A 410 -11.424 0.663 -13.373 1.00 0.00 H new ATOM 0 HB2 LEU A 410 -9.921 -0.841 -15.512 1.00 0.00 H new ATOM 0 HB3 LEU A 410 -10.468 -1.602 -14.030 1.00 0.00 H new ATOM 0 HG LEU A 410 -12.818 -0.972 -14.634 1.00 0.00 H new ATOM 0 HD11 LEU A 410 -13.343 -0.410 -16.963 1.00 0.00 H new ATOM 0 HD12 LEU A 410 -12.411 0.868 -16.148 1.00 0.00 H new ATOM 0 HD13 LEU A 410 -11.606 -0.223 -17.300 1.00 0.00 H new ATOM 0 HD21 LEU A 410 -13.059 -2.747 -16.356 1.00 0.00 H new ATOM 0 HD22 LEU A 410 -11.300 -2.702 -16.626 1.00 0.00 H new ATOM 0 HD23 LEU A 410 -11.945 -3.225 -15.052 1.00 0.00 H new ATOM 338 N LYS A 411 -8.488 1.571 -13.318 1.00 0.00 N ATOM 339 CA LYS A 411 -7.216 1.754 -12.646 1.00 0.00 C ATOM 340 C LYS A 411 -7.425 2.307 -11.246 1.00 0.00 C ATOM 341 O LYS A 411 -6.508 2.333 -10.436 1.00 0.00 O ATOM 342 CB LYS A 411 -6.361 2.726 -13.444 1.00 0.00 C ATOM 343 CG LYS A 411 -6.051 2.284 -14.872 1.00 0.00 C ATOM 344 CD LYS A 411 -5.379 3.407 -15.656 1.00 0.00 C ATOM 345 CE LYS A 411 -4.050 3.825 -15.040 1.00 0.00 C ATOM 346 NZ LYS A 411 -3.539 5.069 -15.635 1.00 0.00 N ATOM 0 H LYS A 411 -8.719 2.331 -13.958 1.00 0.00 H new ATOM 0 HA LYS A 411 -6.717 0.788 -12.572 1.00 0.00 H new ATOM 0 HB2 LYS A 411 -6.869 3.690 -13.479 1.00 0.00 H new ATOM 0 HB3 LYS A 411 -5.421 2.880 -12.914 1.00 0.00 H new ATOM 0 HG2 LYS A 411 -5.401 1.409 -14.853 1.00 0.00 H new ATOM 0 HG3 LYS A 411 -6.972 1.986 -15.373 1.00 0.00 H new ATOM 0 HD2 LYS A 411 -5.215 3.082 -16.684 1.00 0.00 H new ATOM 0 HD3 LYS A 411 -6.045 4.269 -15.696 1.00 0.00 H new ATOM 0 HE2 LYS A 411 -4.174 3.960 -13.966 1.00 0.00 H new ATOM 0 HE3 LYS A 411 -3.319 3.029 -15.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 411 -2.633 5.320 -15.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 411 -3.397 4.932 -16.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 411 -4.225 5.835 -15.481 1.00 0.00 H new ATOM 360 N ALA A 412 -8.646 2.731 -10.972 1.00 0.00 N ATOM 361 CA ALA A 412 -9.000 3.302 -9.684 1.00 0.00 C ATOM 362 C ALA A 412 -9.416 2.211 -8.707 1.00 0.00 C ATOM 363 O ALA A 412 -9.851 2.507 -7.587 1.00 0.00 O ATOM 364 CB ALA A 412 -10.117 4.320 -9.855 1.00 0.00 C ATOM 0 H ALA A 412 -9.420 2.689 -11.635 1.00 0.00 H new ATOM 0 HA ALA A 412 -8.125 3.806 -9.275 1.00 0.00 H new ATOM 0 HB1 ALA A 412 -10.376 4.743 -8.884 1.00 0.00 H new ATOM 0 HB2 ALA A 412 -9.785 5.117 -10.521 1.00 0.00 H new ATOM 0 HB3 ALA A 412 -10.992 3.831 -10.283 1.00 0.00 H new ATOM 370 N ASN A 413 -9.276 0.955 -9.156 1.00 0.00 N ATOM 371 CA ASN A 413 -9.605 -0.259 -8.389 1.00 0.00 C ATOM 372 C ASN A 413 -11.134 -0.459 -8.327 1.00 0.00 C ATOM 373 O ASN A 413 -11.883 0.465 -7.976 1.00 0.00 O ATOM 374 CB ASN A 413 -8.933 -0.247 -6.974 1.00 0.00 C ATOM 375 CG ASN A 413 -9.075 -1.538 -6.160 1.00 0.00 C ATOM 376 OD1 ASN A 413 -10.047 -2.268 -6.256 1.00 0.00 O ATOM 377 ND2 ASN A 413 -8.080 -1.831 -5.365 1.00 0.00 N ATOM 0 H ASN A 413 -8.921 0.748 -10.089 1.00 0.00 H new ATOM 0 HA ASN A 413 -9.189 -1.122 -8.909 1.00 0.00 H new ATOM 0 HB2 ASN A 413 -7.872 -0.032 -7.098 1.00 0.00 H new ATOM 0 HB3 ASN A 413 -9.359 0.574 -6.397 1.00 0.00 H new ATOM 0 HD21 ASN A 413 -8.106 -2.685 -4.809 1.00 0.00 H new ATOM 0 HD22 ASN A 413 -7.277 -1.205 -5.301 1.00 0.00 H new ATOM 384 N PRO A 414 -11.624 -1.656 -8.734 1.00 0.00 N ATOM 385 CA PRO A 414 -13.064 -1.977 -8.739 1.00 0.00 C ATOM 386 C PRO A 414 -13.678 -2.096 -7.330 1.00 0.00 C ATOM 387 O PRO A 414 -14.903 -2.146 -7.182 1.00 0.00 O ATOM 388 CB PRO A 414 -13.125 -3.334 -9.451 1.00 0.00 C ATOM 389 CG PRO A 414 -11.780 -3.931 -9.240 1.00 0.00 C ATOM 390 CD PRO A 414 -10.817 -2.783 -9.260 1.00 0.00 C ATOM 0 HA PRO A 414 -13.637 -1.185 -9.221 1.00 0.00 H new ATOM 0 HB2 PRO A 414 -13.909 -3.966 -9.033 1.00 0.00 H new ATOM 0 HB3 PRO A 414 -13.344 -3.215 -10.512 1.00 0.00 H new ATOM 0 HG2 PRO A 414 -11.733 -4.464 -8.290 1.00 0.00 H new ATOM 0 HG3 PRO A 414 -11.545 -4.652 -10.023 1.00 0.00 H new ATOM 0 HD2 PRO A 414 -9.944 -2.979 -8.637 1.00 0.00 H new ATOM 0 HD3 PRO A 414 -10.451 -2.581 -10.267 1.00 0.00 H new ATOM 398 N ASN A 415 -12.839 -2.176 -6.320 1.00 0.00 N ATOM 399 CA ASN A 415 -13.294 -2.256 -4.934 1.00 0.00 C ATOM 400 C ASN A 415 -13.495 -0.849 -4.396 1.00 0.00 C ATOM 401 O ASN A 415 -13.460 0.127 -5.167 1.00 0.00 O ATOM 402 CB ASN A 415 -12.275 -3.016 -4.051 1.00 0.00 C ATOM 403 CG ASN A 415 -12.151 -4.511 -4.347 1.00 0.00 C ATOM 404 OD1 ASN A 415 -13.237 -5.147 -4.716 1.00 0.00 O flip ATOM 405 ND2 ASN A 415 -11.066 -5.101 -4.201 1.00 0.00 N flip ATOM 0 H ASN A 415 -11.825 -2.188 -6.427 1.00 0.00 H new ATOM 0 HA ASN A 415 -14.235 -2.806 -4.907 1.00 0.00 H new ATOM 0 HB2 ASN A 415 -11.295 -2.554 -4.174 1.00 0.00 H new ATOM 0 HB3 ASN A 415 -12.558 -2.890 -3.006 1.00 0.00 H new ATOM 0 HD21 ASN A 415 -10.237 -4.581 -3.913 1.00 0.00 H new ATOM 0 HD22 ASN A 415 -11.005 -6.105 -4.369 1.00 0.00 H new ATOM 412 N ARG A 416 -13.710 -0.722 -3.098 1.00 0.00 N ATOM 413 CA ARG A 416 -13.874 0.589 -2.493 1.00 0.00 C ATOM 414 C ARG A 416 -12.533 1.317 -2.449 1.00 0.00 C ATOM 415 O ARG A 416 -11.497 0.739 -2.762 1.00 0.00 O ATOM 416 CB ARG A 416 -14.450 0.489 -1.082 1.00 0.00 C ATOM 417 CG ARG A 416 -15.850 -0.088 -0.999 1.00 0.00 C ATOM 418 CD ARG A 416 -16.395 -0.013 0.424 1.00 0.00 C ATOM 419 NE ARG A 416 -16.446 1.378 0.929 1.00 0.00 N ATOM 420 CZ ARG A 416 -17.387 1.882 1.750 1.00 0.00 C ATOM 421 NH1 ARG A 416 -18.364 1.113 2.205 1.00 0.00 N ATOM 422 NH2 ARG A 416 -17.327 3.152 2.131 1.00 0.00 N ATOM 0 H ARG A 416 -13.775 -1.504 -2.447 1.00 0.00 H new ATOM 0 HA ARG A 416 -14.577 1.151 -3.107 1.00 0.00 H new ATOM 0 HB2 ARG A 416 -13.784 -0.126 -0.477 1.00 0.00 H new ATOM 0 HB3 ARG A 416 -14.457 1.484 -0.638 1.00 0.00 H new ATOM 0 HG2 ARG A 416 -16.511 0.456 -1.673 1.00 0.00 H new ATOM 0 HG3 ARG A 416 -15.839 -1.126 -1.333 1.00 0.00 H new ATOM 0 HD2 ARG A 416 -17.395 -0.445 0.452 1.00 0.00 H new ATOM 0 HD3 ARG A 416 -15.770 -0.615 1.083 1.00 0.00 H new ATOM 0 HE ARG A 416 -15.704 2.010 0.629 1.00 0.00 H new ATOM 0 HH11 ARG A 416 -18.408 0.131 1.934 1.00 0.00 H new ATOM 0 HH12 ARG A 416 -19.073 1.503 2.826 1.00 0.00 H new ATOM 0 HH21 ARG A 416 -16.567 3.748 1.802 1.00 0.00 H new ATOM 0 HH22 ARG A 416 -18.041 3.532 2.753 1.00 0.00 H new ATOM 436 N ARG A 417 -12.543 2.560 -2.018 1.00 0.00 N ATOM 437 CA ARG A 417 -11.314 3.348 -1.962 1.00 0.00 C ATOM 438 C ARG A 417 -10.555 3.089 -0.659 1.00 0.00 C ATOM 439 O ARG A 417 -9.574 3.744 -0.359 1.00 0.00 O ATOM 440 CB ARG A 417 -11.604 4.841 -2.109 1.00 0.00 C ATOM 441 CG ARG A 417 -12.342 5.469 -0.938 1.00 0.00 C ATOM 442 CD ARG A 417 -12.537 6.953 -1.153 1.00 0.00 C ATOM 443 NE ARG A 417 -11.259 7.645 -1.403 1.00 0.00 N ATOM 444 CZ ARG A 417 -10.889 8.804 -0.857 1.00 0.00 C ATOM 445 NH1 ARG A 417 -11.676 9.419 0.032 1.00 0.00 N ATOM 446 NH2 ARG A 417 -9.728 9.354 -1.202 1.00 0.00 N ATOM 0 H ARG A 417 -13.379 3.051 -1.701 1.00 0.00 H new ATOM 0 HA ARG A 417 -10.690 3.035 -2.799 1.00 0.00 H new ATOM 0 HB2 ARG A 417 -10.660 5.367 -2.249 1.00 0.00 H new ATOM 0 HB3 ARG A 417 -12.192 4.995 -3.014 1.00 0.00 H new ATOM 0 HG2 ARG A 417 -13.311 4.986 -0.813 1.00 0.00 H new ATOM 0 HG3 ARG A 417 -11.781 5.302 -0.018 1.00 0.00 H new ATOM 0 HD2 ARG A 417 -13.207 7.112 -1.998 1.00 0.00 H new ATOM 0 HD3 ARG A 417 -13.019 7.386 -0.277 1.00 0.00 H new ATOM 0 HE ARG A 417 -10.604 7.201 -2.046 1.00 0.00 H new ATOM 0 HH11 ARG A 417 -12.568 9.002 0.298 1.00 0.00 H new ATOM 0 HH12 ARG A 417 -11.384 10.305 0.444 1.00 0.00 H new ATOM 0 HH21 ARG A 417 -9.125 8.889 -1.881 1.00 0.00 H new ATOM 0 HH22 ARG A 417 -9.440 10.240 -0.787 1.00 0.00 H new ATOM 460 N ALA A 418 -11.012 2.114 0.095 1.00 0.00 N ATOM 461 CA ALA A 418 -10.378 1.731 1.340 1.00 0.00 C ATOM 462 C ALA A 418 -9.206 0.793 1.077 1.00 0.00 C ATOM 463 O ALA A 418 -8.577 0.273 2.011 1.00 0.00 O ATOM 464 CB ALA A 418 -11.382 1.070 2.258 1.00 0.00 C ATOM 0 H ALA A 418 -11.837 1.561 -0.138 1.00 0.00 H new ATOM 0 HA ALA A 418 -9.999 2.630 1.825 1.00 0.00 H new ATOM 0 HB1 ALA A 418 -10.892 0.787 3.190 1.00 0.00 H new ATOM 0 HB2 ALA A 418 -12.193 1.766 2.471 1.00 0.00 H new ATOM 0 HB3 ALA A 418 -11.785 0.180 1.775 1.00 0.00 H new ATOM 470 N VAL A 419 -8.898 0.603 -0.189 1.00 0.00 N ATOM 471 CA VAL A 419 -7.822 -0.234 -0.633 1.00 0.00 C ATOM 472 C VAL A 419 -7.093 0.466 -1.768 1.00 0.00 C ATOM 473 O VAL A 419 -7.439 1.583 -2.123 1.00 0.00 O ATOM 474 CB VAL A 419 -8.310 -1.648 -1.084 1.00 0.00 C ATOM 475 CG1 VAL A 419 -8.877 -2.408 0.095 1.00 0.00 C ATOM 476 CG2 VAL A 419 -9.343 -1.556 -2.194 1.00 0.00 C ATOM 0 H VAL A 419 -9.409 1.043 -0.954 1.00 0.00 H new ATOM 0 HA VAL A 419 -7.147 -0.395 0.207 1.00 0.00 H new ATOM 0 HB VAL A 419 -7.447 -2.186 -1.476 1.00 0.00 H new ATOM 0 HG11 VAL A 419 -9.213 -3.391 -0.234 1.00 0.00 H new ATOM 0 HG12 VAL A 419 -8.107 -2.524 0.858 1.00 0.00 H new ATOM 0 HG13 VAL A 419 -9.720 -1.857 0.512 1.00 0.00 H new ATOM 0 HG21 VAL A 419 -9.659 -2.559 -2.481 1.00 0.00 H new ATOM 0 HG22 VAL A 419 -10.206 -0.991 -1.842 1.00 0.00 H new ATOM 0 HG23 VAL A 419 -8.907 -1.052 -3.056 1.00 0.00 H new ATOM 486 N GLY A 420 -6.081 -0.158 -2.291 1.00 0.00 N ATOM 487 CA GLY A 420 -5.347 0.404 -3.393 1.00 0.00 C ATOM 488 C GLY A 420 -4.827 -0.688 -4.279 1.00 0.00 C ATOM 489 O GLY A 420 -5.109 -1.873 -4.026 1.00 0.00 O ATOM 0 H GLY A 420 -5.740 -1.065 -1.972 1.00 0.00 H new ATOM 0 HA2 GLY A 420 -5.991 1.071 -3.966 1.00 0.00 H new ATOM 0 HA3 GLY A 420 -4.518 1.005 -3.019 1.00 0.00 H new ATOM 493 N THR A 421 -4.059 -0.332 -5.274 1.00 0.00 N ATOM 494 CA THR A 421 -3.517 -1.301 -6.193 1.00 0.00 C ATOM 495 C THR A 421 -1.976 -1.188 -6.228 1.00 0.00 C ATOM 496 O THR A 421 -1.412 -0.084 -6.115 1.00 0.00 O ATOM 497 CB THR A 421 -4.102 -1.078 -7.602 1.00 0.00 C ATOM 498 OG1 THR A 421 -5.531 -0.860 -7.485 1.00 0.00 O ATOM 499 CG2 THR A 421 -3.873 -2.307 -8.467 1.00 0.00 C ATOM 0 H THR A 421 -3.792 0.632 -5.471 1.00 0.00 H new ATOM 0 HA THR A 421 -3.789 -2.302 -5.857 1.00 0.00 H new ATOM 0 HB THR A 421 -3.614 -0.217 -8.058 1.00 0.00 H new ATOM 0 HG1 THR A 421 -5.914 -0.715 -8.375 1.00 0.00 H new ATOM 0 HG21 THR A 421 -4.291 -2.137 -9.459 1.00 0.00 H new ATOM 0 HG22 THR A 421 -2.803 -2.498 -8.552 1.00 0.00 H new ATOM 0 HG23 THR A 421 -4.361 -3.169 -8.011 1.00 0.00 H new ATOM 507 N VAL A 422 -1.310 -2.318 -6.324 1.00 0.00 N ATOM 508 CA VAL A 422 0.148 -2.367 -6.353 1.00 0.00 C ATOM 509 C VAL A 422 0.632 -2.148 -7.789 1.00 0.00 C ATOM 510 O VAL A 422 0.051 -2.693 -8.718 1.00 0.00 O ATOM 511 CB VAL A 422 0.668 -3.747 -5.844 1.00 0.00 C ATOM 512 CG1 VAL A 422 2.182 -3.766 -5.756 1.00 0.00 C ATOM 513 CG2 VAL A 422 0.056 -4.102 -4.501 1.00 0.00 C ATOM 0 H VAL A 422 -1.758 -3.233 -6.385 1.00 0.00 H new ATOM 0 HA VAL A 422 0.534 -1.585 -5.699 1.00 0.00 H new ATOM 0 HB VAL A 422 0.360 -4.499 -6.570 1.00 0.00 H new ATOM 0 HG11 VAL A 422 2.513 -4.741 -5.398 1.00 0.00 H new ATOM 0 HG12 VAL A 422 2.606 -3.578 -6.742 1.00 0.00 H new ATOM 0 HG13 VAL A 422 2.516 -2.993 -5.064 1.00 0.00 H new ATOM 0 HG21 VAL A 422 0.437 -5.069 -4.172 1.00 0.00 H new ATOM 0 HG22 VAL A 422 0.319 -3.339 -3.768 1.00 0.00 H new ATOM 0 HG23 VAL A 422 -1.029 -4.153 -4.598 1.00 0.00 H new ATOM 523 N ILE A 423 1.691 -1.377 -7.973 1.00 0.00 N ATOM 524 CA ILE A 423 2.198 -1.109 -9.308 1.00 0.00 C ATOM 525 C ILE A 423 3.311 -2.078 -9.696 1.00 0.00 C ATOM 526 O ILE A 423 3.321 -2.603 -10.809 1.00 0.00 O ATOM 527 CB ILE A 423 2.621 0.371 -9.524 1.00 0.00 C ATOM 528 CG1 ILE A 423 3.628 0.844 -8.470 1.00 0.00 C ATOM 529 CG2 ILE A 423 1.398 1.274 -9.545 1.00 0.00 C ATOM 530 CD1 ILE A 423 4.037 2.302 -8.610 1.00 0.00 C ATOM 0 H ILE A 423 2.213 -0.928 -7.220 1.00 0.00 H new ATOM 0 HA ILE A 423 1.360 -1.279 -9.983 1.00 0.00 H new ATOM 0 HB ILE A 423 3.120 0.430 -10.491 1.00 0.00 H new ATOM 0 HG12 ILE A 423 3.199 0.692 -7.480 1.00 0.00 H new ATOM 0 HG13 ILE A 423 4.520 0.220 -8.530 1.00 0.00 H new ATOM 0 HG21 ILE A 423 1.711 2.307 -9.697 1.00 0.00 H new ATOM 0 HG22 ILE A 423 0.737 0.972 -10.357 1.00 0.00 H new ATOM 0 HG23 ILE A 423 0.868 1.191 -8.596 1.00 0.00 H new ATOM 0 HD11 ILE A 423 4.751 2.556 -7.827 1.00 0.00 H new ATOM 0 HD12 ILE A 423 4.498 2.459 -9.585 1.00 0.00 H new ATOM 0 HD13 ILE A 423 3.156 2.937 -8.519 1.00 0.00 H new ATOM 542 N GLU A 424 4.201 -2.350 -8.771 1.00 0.00 N ATOM 543 CA GLU A 424 5.278 -3.300 -8.977 1.00 0.00 C ATOM 544 C GLU A 424 5.613 -3.923 -7.644 1.00 0.00 C ATOM 545 O GLU A 424 5.492 -3.269 -6.605 1.00 0.00 O ATOM 546 CB GLU A 424 6.540 -2.663 -9.607 1.00 0.00 C ATOM 547 CG GLU A 424 7.155 -1.552 -8.790 1.00 0.00 C ATOM 548 CD GLU A 424 8.524 -1.144 -9.258 1.00 0.00 C ATOM 549 OE1 GLU A 424 9.534 -1.716 -8.775 1.00 0.00 O ATOM 550 OE2 GLU A 424 8.632 -0.229 -10.115 1.00 0.00 O ATOM 0 H GLU A 424 4.202 -1.918 -7.847 1.00 0.00 H new ATOM 0 HA GLU A 424 4.938 -4.052 -9.689 1.00 0.00 H new ATOM 0 HB2 GLU A 424 7.287 -3.442 -9.759 1.00 0.00 H new ATOM 0 HB3 GLU A 424 6.282 -2.273 -10.591 1.00 0.00 H new ATOM 0 HG2 GLU A 424 6.497 -0.684 -8.820 1.00 0.00 H new ATOM 0 HG3 GLU A 424 7.216 -1.870 -7.749 1.00 0.00 H new ATOM 557 N ALA A 425 6.003 -5.158 -7.651 1.00 0.00 N ATOM 558 CA ALA A 425 6.305 -5.850 -6.426 1.00 0.00 C ATOM 559 C ALA A 425 7.340 -6.902 -6.674 1.00 0.00 C ATOM 560 O ALA A 425 7.286 -7.592 -7.700 1.00 0.00 O ATOM 561 CB ALA A 425 5.049 -6.477 -5.867 1.00 0.00 C ATOM 0 H ALA A 425 6.122 -5.717 -8.496 1.00 0.00 H new ATOM 0 HA ALA A 425 6.697 -5.136 -5.701 1.00 0.00 H new ATOM 0 HB1 ALA A 425 5.285 -6.999 -4.940 1.00 0.00 H new ATOM 0 HB2 ALA A 425 4.312 -5.699 -5.668 1.00 0.00 H new ATOM 0 HB3 ALA A 425 4.643 -7.185 -6.589 1.00 0.00 H new ATOM 567 N LYS A 426 8.283 -7.025 -5.761 1.00 0.00 N ATOM 568 CA LYS A 426 9.344 -8.014 -5.867 1.00 0.00 C ATOM 569 C LYS A 426 10.102 -8.061 -4.561 1.00 0.00 C ATOM 570 O LYS A 426 9.796 -7.330 -3.629 1.00 0.00 O ATOM 571 CB LYS A 426 10.339 -7.762 -7.048 1.00 0.00 C ATOM 572 CG LYS A 426 11.414 -6.699 -6.807 1.00 0.00 C ATOM 573 CD LYS A 426 10.815 -5.306 -6.648 1.00 0.00 C ATOM 574 CE LYS A 426 11.882 -4.214 -6.605 1.00 0.00 C ATOM 575 NZ LYS A 426 11.291 -2.851 -6.499 1.00 0.00 N ATOM 0 H LYS A 426 8.338 -6.444 -4.924 1.00 0.00 H new ATOM 0 HA LYS A 426 8.863 -8.968 -6.082 1.00 0.00 H new ATOM 0 HB2 LYS A 426 10.834 -8.703 -7.286 1.00 0.00 H new ATOM 0 HB3 LYS A 426 9.762 -7.474 -7.927 1.00 0.00 H new ATOM 0 HG2 LYS A 426 11.981 -6.954 -5.912 1.00 0.00 H new ATOM 0 HG3 LYS A 426 12.117 -6.698 -7.640 1.00 0.00 H new ATOM 0 HD2 LYS A 426 10.132 -5.111 -7.475 1.00 0.00 H new ATOM 0 HD3 LYS A 426 10.225 -5.270 -5.732 1.00 0.00 H new ATOM 0 HE2 LYS A 426 12.543 -4.388 -5.756 1.00 0.00 H new ATOM 0 HE3 LYS A 426 12.496 -4.273 -7.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 426 12.040 -2.138 -6.609 1.00 0.00 H new ATOM 0 HZ2 LYS A 426 10.578 -2.723 -7.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 426 10.841 -2.739 -5.568 1.00 0.00 H new ATOM 589 N LEU A 427 11.038 -8.924 -4.483 1.00 0.00 N ATOM 590 CA LEU A 427 11.836 -9.056 -3.298 1.00 0.00 C ATOM 591 C LEU A 427 13.101 -8.222 -3.426 1.00 0.00 C ATOM 592 O LEU A 427 13.580 -7.968 -4.539 1.00 0.00 O ATOM 593 CB LEU A 427 12.213 -10.520 -3.092 1.00 0.00 C ATOM 594 CG LEU A 427 13.456 -11.082 -3.850 1.00 0.00 C ATOM 595 CD1 LEU A 427 13.720 -12.503 -3.404 1.00 0.00 C ATOM 596 CD2 LEU A 427 13.262 -11.056 -5.363 1.00 0.00 C ATOM 0 H LEU A 427 11.285 -9.568 -5.234 1.00 0.00 H new ATOM 0 HA LEU A 427 11.259 -8.704 -2.443 1.00 0.00 H new ATOM 0 HB2 LEU A 427 12.378 -10.673 -2.025 1.00 0.00 H new ATOM 0 HB3 LEU A 427 11.352 -11.127 -3.372 1.00 0.00 H new ATOM 0 HG LEU A 427 14.306 -10.444 -3.610 1.00 0.00 H new ATOM 0 HD11 LEU A 427 14.588 -12.895 -3.934 1.00 0.00 H new ATOM 0 HD12 LEU A 427 13.912 -12.518 -2.331 1.00 0.00 H new ATOM 0 HD13 LEU A 427 12.850 -13.121 -3.625 1.00 0.00 H new ATOM 0 HD21 LEU A 427 14.151 -11.456 -5.851 1.00 0.00 H new ATOM 0 HD22 LEU A 427 12.397 -11.664 -5.629 1.00 0.00 H new ATOM 0 HD23 LEU A 427 13.099 -10.030 -5.691 1.00 0.00 H new ATOM 608 N ASP A 428 13.610 -7.762 -2.329 1.00 0.00 N ATOM 609 CA ASP A 428 14.892 -7.122 -2.334 1.00 0.00 C ATOM 610 C ASP A 428 15.771 -7.773 -1.291 1.00 0.00 C ATOM 611 O ASP A 428 15.365 -7.949 -0.147 1.00 0.00 O ATOM 612 CB ASP A 428 14.817 -5.612 -2.125 1.00 0.00 C ATOM 613 CG ASP A 428 16.169 -4.959 -2.318 1.00 0.00 C ATOM 614 OD1 ASP A 428 16.933 -4.855 -1.355 1.00 0.00 O ATOM 615 OD2 ASP A 428 16.497 -4.570 -3.445 1.00 0.00 O ATOM 0 H ASP A 428 13.160 -7.816 -1.415 1.00 0.00 H new ATOM 0 HA ASP A 428 15.324 -7.256 -3.326 1.00 0.00 H new ATOM 0 HB2 ASP A 428 14.100 -5.182 -2.825 1.00 0.00 H new ATOM 0 HB3 ASP A 428 14.449 -5.400 -1.121 1.00 0.00 H new ATOM 620 N LYS A 429 16.948 -8.141 -1.687 1.00 0.00 N ATOM 621 CA LYS A 429 17.910 -8.820 -0.814 1.00 0.00 C ATOM 622 C LYS A 429 18.429 -7.920 0.324 1.00 0.00 C ATOM 623 O LYS A 429 18.993 -8.411 1.297 1.00 0.00 O ATOM 624 CB LYS A 429 19.106 -9.385 -1.621 1.00 0.00 C ATOM 625 CG LYS A 429 19.811 -8.362 -2.513 1.00 0.00 C ATOM 626 CD LYS A 429 19.149 -8.232 -3.878 1.00 0.00 C ATOM 627 CE LYS A 429 18.988 -6.778 -4.292 1.00 0.00 C ATOM 628 NZ LYS A 429 20.259 -6.012 -4.269 1.00 0.00 N ATOM 0 H LYS A 429 17.292 -7.986 -2.635 1.00 0.00 H new ATOM 0 HA LYS A 429 17.363 -9.645 -0.357 1.00 0.00 H new ATOM 0 HB2 LYS A 429 19.833 -9.802 -0.924 1.00 0.00 H new ATOM 0 HB3 LYS A 429 18.752 -10.207 -2.243 1.00 0.00 H new ATOM 0 HG2 LYS A 429 19.812 -7.391 -2.018 1.00 0.00 H new ATOM 0 HG3 LYS A 429 20.853 -8.654 -2.643 1.00 0.00 H new ATOM 0 HD2 LYS A 429 19.746 -8.758 -4.623 1.00 0.00 H new ATOM 0 HD3 LYS A 429 18.171 -8.714 -3.855 1.00 0.00 H new ATOM 0 HE2 LYS A 429 18.568 -6.739 -5.297 1.00 0.00 H new ATOM 0 HE3 LYS A 429 18.271 -6.296 -3.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 429 20.137 -5.122 -4.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 429 20.520 -5.801 -3.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 429 21.012 -6.575 -4.714 1.00 0.00 H new ATOM 642 N GLY A 430 18.250 -6.628 0.199 1.00 0.00 N ATOM 643 CA GLY A 430 18.724 -5.727 1.210 1.00 0.00 C ATOM 644 C GLY A 430 17.596 -5.092 1.968 1.00 0.00 C ATOM 645 O GLY A 430 17.532 -5.194 3.191 1.00 0.00 O ATOM 0 H GLY A 430 17.782 -6.182 -0.590 1.00 0.00 H new ATOM 0 HA2 GLY A 430 19.369 -6.267 1.904 1.00 0.00 H new ATOM 0 HA3 GLY A 430 19.333 -4.950 0.747 1.00 0.00 H new ATOM 649 N ARG A 431 16.675 -4.481 1.246 1.00 0.00 N ATOM 650 CA ARG A 431 15.537 -3.781 1.850 1.00 0.00 C ATOM 651 C ARG A 431 14.551 -4.787 2.433 1.00 0.00 C ATOM 652 O ARG A 431 13.846 -4.509 3.419 1.00 0.00 O ATOM 653 CB ARG A 431 14.800 -2.916 0.805 1.00 0.00 C ATOM 654 CG ARG A 431 15.647 -1.848 0.126 1.00 0.00 C ATOM 655 CD ARG A 431 14.827 -1.048 -0.893 1.00 0.00 C ATOM 656 NE ARG A 431 15.632 -0.016 -1.566 1.00 0.00 N ATOM 657 CZ ARG A 431 15.168 0.907 -2.431 1.00 0.00 C ATOM 658 NH1 ARG A 431 13.883 0.943 -2.766 1.00 0.00 N ATOM 659 NH2 ARG A 431 16.003 1.788 -2.979 1.00 0.00 N ATOM 0 H ARG A 431 16.687 -4.451 0.227 1.00 0.00 H new ATOM 0 HA ARG A 431 15.926 -3.137 2.639 1.00 0.00 H new ATOM 0 HB2 ARG A 431 14.391 -3.573 0.038 1.00 0.00 H new ATOM 0 HB3 ARG A 431 13.955 -2.430 1.292 1.00 0.00 H new ATOM 0 HG2 ARG A 431 16.055 -1.172 0.878 1.00 0.00 H new ATOM 0 HG3 ARG A 431 16.494 -2.317 -0.374 1.00 0.00 H new ATOM 0 HD2 ARG A 431 14.414 -1.728 -1.638 1.00 0.00 H new ATOM 0 HD3 ARG A 431 13.983 -0.577 -0.389 1.00 0.00 H new ATOM 0 HE ARG A 431 16.631 0.002 -1.359 1.00 0.00 H new ATOM 0 HH11 ARG A 431 13.233 0.266 -2.367 1.00 0.00 H new ATOM 0 HH12 ARG A 431 13.547 1.648 -3.422 1.00 0.00 H new ATOM 0 HH21 ARG A 431 16.995 1.765 -2.744 1.00 0.00 H new ATOM 0 HH22 ARG A 431 15.650 2.486 -3.634 1.00 0.00 H new ATOM 673 N GLY A 432 14.520 -5.946 1.833 1.00 0.00 N ATOM 674 CA GLY A 432 13.593 -6.966 2.206 1.00 0.00 C ATOM 675 C GLY A 432 12.513 -7.015 1.178 1.00 0.00 C ATOM 676 O GLY A 432 12.621 -6.320 0.178 1.00 0.00 O ATOM 0 H GLY A 432 15.143 -6.205 1.068 1.00 0.00 H new ATOM 0 HA2 GLY A 432 14.096 -7.930 2.274 1.00 0.00 H new ATOM 0 HA3 GLY A 432 13.172 -6.756 3.189 1.00 0.00 H new ATOM 680 N PRO A 433 11.518 -7.888 1.316 1.00 0.00 N ATOM 681 CA PRO A 433 10.329 -7.865 0.457 1.00 0.00 C ATOM 682 C PRO A 433 9.729 -6.454 0.378 1.00 0.00 C ATOM 683 O PRO A 433 9.355 -5.856 1.413 1.00 0.00 O ATOM 684 CB PRO A 433 9.395 -8.810 1.185 1.00 0.00 C ATOM 685 CG PRO A 433 10.317 -9.823 1.752 1.00 0.00 C ATOM 686 CD PRO A 433 11.498 -9.039 2.241 1.00 0.00 C ATOM 0 HA PRO A 433 10.529 -8.150 -0.576 1.00 0.00 H new ATOM 0 HB2 PRO A 433 8.830 -8.298 1.964 1.00 0.00 H new ATOM 0 HB3 PRO A 433 8.669 -9.260 0.508 1.00 0.00 H new ATOM 0 HG2 PRO A 433 9.845 -10.375 2.565 1.00 0.00 H new ATOM 0 HG3 PRO A 433 10.612 -10.554 0.999 1.00 0.00 H new ATOM 0 HD2 PRO A 433 11.376 -8.725 3.278 1.00 0.00 H new ATOM 0 HD3 PRO A 433 12.420 -9.618 2.189 1.00 0.00 H new ATOM 694 N VAL A 434 9.685 -5.930 -0.827 1.00 0.00 N ATOM 695 CA VAL A 434 9.232 -4.587 -1.097 1.00 0.00 C ATOM 696 C VAL A 434 8.000 -4.611 -1.992 1.00 0.00 C ATOM 697 O VAL A 434 7.737 -5.600 -2.687 1.00 0.00 O ATOM 698 CB VAL A 434 10.350 -3.732 -1.786 1.00 0.00 C ATOM 699 CG1 VAL A 434 11.509 -3.478 -0.853 1.00 0.00 C ATOM 700 CG2 VAL A 434 10.861 -4.406 -3.044 1.00 0.00 C ATOM 0 H VAL A 434 9.970 -6.439 -1.664 1.00 0.00 H new ATOM 0 HA VAL A 434 8.983 -4.130 -0.139 1.00 0.00 H new ATOM 0 HB VAL A 434 9.895 -2.777 -2.051 1.00 0.00 H new ATOM 0 HG11 VAL A 434 12.265 -2.882 -1.365 1.00 0.00 H new ATOM 0 HG12 VAL A 434 11.157 -2.939 0.026 1.00 0.00 H new ATOM 0 HG13 VAL A 434 11.944 -4.429 -0.546 1.00 0.00 H new ATOM 0 HG21 VAL A 434 11.635 -3.788 -3.499 1.00 0.00 H new ATOM 0 HG22 VAL A 434 11.277 -5.381 -2.791 1.00 0.00 H new ATOM 0 HG23 VAL A 434 10.039 -4.534 -3.748 1.00 0.00 H new ATOM 710 N ALA A 435 7.253 -3.544 -1.964 1.00 0.00 N ATOM 711 CA ALA A 435 6.063 -3.420 -2.777 1.00 0.00 C ATOM 712 C ALA A 435 5.813 -1.969 -3.113 1.00 0.00 C ATOM 713 O ALA A 435 5.537 -1.166 -2.219 1.00 0.00 O ATOM 714 CB ALA A 435 4.851 -3.990 -2.045 1.00 0.00 C ATOM 0 H ALA A 435 7.447 -2.732 -1.379 1.00 0.00 H new ATOM 0 HA ALA A 435 6.217 -3.984 -3.697 1.00 0.00 H new ATOM 0 HB1 ALA A 435 3.966 -3.888 -2.673 1.00 0.00 H new ATOM 0 HB2 ALA A 435 5.021 -5.044 -1.826 1.00 0.00 H new ATOM 0 HB3 ALA A 435 4.700 -3.446 -1.113 1.00 0.00 H new ATOM 720 N THR A 436 5.931 -1.622 -4.368 1.00 0.00 N ATOM 721 CA THR A 436 5.652 -0.286 -4.802 1.00 0.00 C ATOM 722 C THR A 436 4.195 -0.249 -5.173 1.00 0.00 C ATOM 723 O THR A 436 3.740 -0.988 -6.052 1.00 0.00 O ATOM 724 CB THR A 436 6.482 0.097 -6.021 1.00 0.00 C ATOM 725 OG1 THR A 436 7.777 -0.520 -5.915 1.00 0.00 O ATOM 726 CG2 THR A 436 6.677 1.608 -6.060 1.00 0.00 C ATOM 0 H THR A 436 6.222 -2.257 -5.112 1.00 0.00 H new ATOM 0 HA THR A 436 5.897 0.417 -4.006 1.00 0.00 H new ATOM 0 HB THR A 436 5.968 -0.234 -6.923 1.00 0.00 H new ATOM 0 HG1 THR A 436 8.103 -0.440 -4.994 1.00 0.00 H new ATOM 0 HG21 THR A 436 7.271 1.876 -6.934 1.00 0.00 H new ATOM 0 HG22 THR A 436 5.705 2.099 -6.118 1.00 0.00 H new ATOM 0 HG23 THR A 436 7.194 1.932 -5.157 1.00 0.00 H new ATOM 734 N LEU A 437 3.473 0.562 -4.525 1.00 0.00 N ATOM 735 CA LEU A 437 2.069 0.587 -4.680 1.00 0.00 C ATOM 736 C LEU A 437 1.551 2.000 -4.817 1.00 0.00 C ATOM 737 O LEU A 437 2.313 2.960 -4.669 1.00 0.00 O ATOM 738 CB LEU A 437 1.457 -0.149 -3.482 1.00 0.00 C ATOM 739 CG LEU A 437 1.981 0.243 -2.076 1.00 0.00 C ATOM 740 CD1 LEU A 437 1.598 1.654 -1.696 1.00 0.00 C ATOM 741 CD2 LEU A 437 1.491 -0.724 -1.031 1.00 0.00 C ATOM 0 H LEU A 437 3.837 1.243 -3.858 1.00 0.00 H new ATOM 0 HA LEU A 437 1.779 0.083 -5.602 1.00 0.00 H new ATOM 0 HB2 LEU A 437 0.379 0.012 -3.499 1.00 0.00 H new ATOM 0 HB3 LEU A 437 1.622 -1.218 -3.620 1.00 0.00 H new ATOM 0 HG LEU A 437 3.069 0.197 -2.122 1.00 0.00 H new ATOM 0 HD11 LEU A 437 1.987 1.882 -0.704 1.00 0.00 H new ATOM 0 HD12 LEU A 437 2.018 2.352 -2.420 1.00 0.00 H new ATOM 0 HD13 LEU A 437 0.512 1.747 -1.690 1.00 0.00 H new ATOM 0 HD21 LEU A 437 1.872 -0.428 -0.054 1.00 0.00 H new ATOM 0 HD22 LEU A 437 0.401 -0.718 -1.013 1.00 0.00 H new ATOM 0 HD23 LEU A 437 1.845 -1.727 -1.269 1.00 0.00 H new ATOM 753 N LEU A 438 0.285 2.124 -5.100 1.00 0.00 N ATOM 754 CA LEU A 438 -0.356 3.404 -5.170 1.00 0.00 C ATOM 755 C LEU A 438 -1.419 3.407 -4.066 1.00 0.00 C ATOM 756 O LEU A 438 -2.442 2.721 -4.171 1.00 0.00 O ATOM 757 CB LEU A 438 -0.971 3.587 -6.588 1.00 0.00 C ATOM 758 CG LEU A 438 -1.418 5.002 -7.051 1.00 0.00 C ATOM 759 CD1 LEU A 438 -2.532 5.582 -6.201 1.00 0.00 C ATOM 760 CD2 LEU A 438 -0.236 5.959 -7.117 1.00 0.00 C ATOM 0 H LEU A 438 -0.333 1.335 -5.289 1.00 0.00 H new ATOM 0 HA LEU A 438 0.333 4.235 -5.018 1.00 0.00 H new ATOM 0 HB2 LEU A 438 -0.241 3.222 -7.310 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -1.840 2.932 -6.654 1.00 0.00 H new ATOM 0 HG LEU A 438 -1.824 4.878 -8.055 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -2.798 6.570 -6.575 1.00 0.00 H new ATOM 0 HD12 LEU A 438 -3.403 4.929 -6.248 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -2.196 5.664 -5.167 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -0.580 6.940 -7.444 1.00 0.00 H new ATOM 0 HD22 LEU A 438 0.219 6.044 -6.130 1.00 0.00 H new ATOM 0 HD23 LEU A 438 0.501 5.579 -7.824 1.00 0.00 H new ATOM 772 N VAL A 439 -1.157 4.133 -2.996 1.00 0.00 N ATOM 773 CA VAL A 439 -2.050 4.130 -1.844 1.00 0.00 C ATOM 774 C VAL A 439 -3.279 5.007 -2.056 1.00 0.00 C ATOM 775 O VAL A 439 -3.176 6.178 -2.396 1.00 0.00 O ATOM 776 CB VAL A 439 -1.312 4.486 -0.503 1.00 0.00 C ATOM 777 CG1 VAL A 439 -0.661 5.856 -0.552 1.00 0.00 C ATOM 778 CG2 VAL A 439 -2.253 4.374 0.698 1.00 0.00 C ATOM 0 H VAL A 439 -0.337 4.732 -2.897 1.00 0.00 H new ATOM 0 HA VAL A 439 -2.403 3.103 -1.747 1.00 0.00 H new ATOM 0 HB VAL A 439 -0.515 3.753 -0.381 1.00 0.00 H new ATOM 0 HG11 VAL A 439 -0.164 6.057 0.397 1.00 0.00 H new ATOM 0 HG12 VAL A 439 0.072 5.882 -1.358 1.00 0.00 H new ATOM 0 HG13 VAL A 439 -1.423 6.615 -0.730 1.00 0.00 H new ATOM 0 HG21 VAL A 439 -1.711 4.627 1.609 1.00 0.00 H new ATOM 0 HG22 VAL A 439 -3.089 5.061 0.570 1.00 0.00 H new ATOM 0 HG23 VAL A 439 -2.630 3.354 0.771 1.00 0.00 H new ATOM 788 N GLN A 440 -4.439 4.402 -1.918 1.00 0.00 N ATOM 789 CA GLN A 440 -5.705 5.116 -2.001 1.00 0.00 C ATOM 790 C GLN A 440 -6.499 4.877 -0.740 1.00 0.00 C ATOM 791 O GLN A 440 -7.409 5.633 -0.411 1.00 0.00 O ATOM 792 CB GLN A 440 -6.525 4.683 -3.225 1.00 0.00 C ATOM 793 CG GLN A 440 -5.921 5.050 -4.579 1.00 0.00 C ATOM 794 CD GLN A 440 -5.853 6.562 -4.854 1.00 0.00 C ATOM 795 OE1 GLN A 440 -5.706 7.396 -3.950 1.00 0.00 O ATOM 796 NE2 GLN A 440 -5.959 6.925 -6.104 1.00 0.00 N ATOM 0 H GLN A 440 -4.536 3.402 -1.745 1.00 0.00 H new ATOM 0 HA GLN A 440 -5.488 6.179 -2.110 1.00 0.00 H new ATOM 0 HB2 GLN A 440 -6.660 3.602 -3.187 1.00 0.00 H new ATOM 0 HB3 GLN A 440 -7.516 5.131 -3.155 1.00 0.00 H new ATOM 0 HG2 GLN A 440 -4.914 4.636 -4.639 1.00 0.00 H new ATOM 0 HG3 GLN A 440 -6.508 4.576 -5.366 1.00 0.00 H new ATOM 0 HE21 GLN A 440 -6.079 6.220 -6.831 1.00 0.00 H new ATOM 0 HE22 GLN A 440 -5.921 7.913 -6.353 1.00 0.00 H new ATOM 805 N ALA A 441 -6.082 3.837 0.009 1.00 0.00 N ATOM 806 CA ALA A 441 -6.763 3.375 1.186 1.00 0.00 C ATOM 807 C ALA A 441 -6.779 4.418 2.300 1.00 0.00 C ATOM 808 O ALA A 441 -7.579 4.332 3.233 1.00 0.00 O ATOM 809 CB ALA A 441 -6.101 2.104 1.643 1.00 0.00 C ATOM 0 H ALA A 441 -5.244 3.299 -0.210 1.00 0.00 H new ATOM 0 HA ALA A 441 -7.808 3.190 0.938 1.00 0.00 H new ATOM 0 HB1 ALA A 441 -6.602 1.734 2.537 1.00 0.00 H new ATOM 0 HB2 ALA A 441 -6.167 1.355 0.854 1.00 0.00 H new ATOM 0 HB3 ALA A 441 -5.053 2.301 1.870 1.00 0.00 H new ATOM 815 N GLY A 442 -5.925 5.397 2.196 1.00 0.00 N ATOM 816 CA GLY A 442 -5.906 6.434 3.164 1.00 0.00 C ATOM 817 C GLY A 442 -4.618 7.176 3.140 1.00 0.00 C ATOM 818 O GLY A 442 -4.454 8.105 2.383 1.00 0.00 O ATOM 0 H GLY A 442 -5.237 5.491 1.448 1.00 0.00 H new ATOM 0 HA2 GLY A 442 -6.729 7.124 2.976 1.00 0.00 H new ATOM 0 HA3 GLY A 442 -6.065 6.011 4.156 1.00 0.00 H new ATOM 822 N THR A 443 -3.717 6.751 3.952 1.00 0.00 N ATOM 823 CA THR A 443 -2.418 7.346 4.093 1.00 0.00 C ATOM 824 C THR A 443 -1.519 6.196 4.442 1.00 0.00 C ATOM 825 O THR A 443 -1.958 5.303 5.159 1.00 0.00 O ATOM 826 CB THR A 443 -2.406 8.342 5.287 1.00 0.00 C ATOM 827 OG1 THR A 443 -3.601 9.122 5.292 1.00 0.00 O ATOM 828 CG2 THR A 443 -1.210 9.277 5.233 1.00 0.00 C ATOM 0 H THR A 443 -3.861 5.948 4.564 1.00 0.00 H new ATOM 0 HA THR A 443 -2.121 7.885 3.193 1.00 0.00 H new ATOM 0 HB THR A 443 -2.340 7.748 6.198 1.00 0.00 H new ATOM 0 HG1 THR A 443 -4.288 8.665 5.821 1.00 0.00 H new ATOM 0 HG21 THR A 443 -1.240 9.956 6.085 1.00 0.00 H new ATOM 0 HG22 THR A 443 -0.290 8.693 5.267 1.00 0.00 H new ATOM 0 HG23 THR A 443 -1.240 9.854 4.308 1.00 0.00 H new ATOM 836 N LEU A 444 -0.329 6.167 3.944 1.00 0.00 N ATOM 837 CA LEU A 444 0.543 5.075 4.258 1.00 0.00 C ATOM 838 C LEU A 444 1.625 5.589 5.161 1.00 0.00 C ATOM 839 O LEU A 444 2.377 6.495 4.788 1.00 0.00 O ATOM 840 CB LEU A 444 1.126 4.461 2.983 1.00 0.00 C ATOM 841 CG LEU A 444 1.056 2.929 2.879 1.00 0.00 C ATOM 842 CD1 LEU A 444 1.537 2.493 1.546 1.00 0.00 C ATOM 843 CD2 LEU A 444 1.859 2.235 3.959 1.00 0.00 C ATOM 0 H LEU A 444 0.063 6.876 3.324 1.00 0.00 H new ATOM 0 HA LEU A 444 -0.011 4.284 4.764 1.00 0.00 H new ATOM 0 HB2 LEU A 444 0.604 4.888 2.127 1.00 0.00 H new ATOM 0 HB3 LEU A 444 2.170 4.763 2.903 1.00 0.00 H new ATOM 0 HG LEU A 444 0.012 2.646 3.016 1.00 0.00 H new ATOM 0 HD11 LEU A 444 1.485 1.406 1.478 1.00 0.00 H new ATOM 0 HD12 LEU A 444 0.911 2.935 0.771 1.00 0.00 H new ATOM 0 HD13 LEU A 444 2.569 2.816 1.408 1.00 0.00 H new ATOM 0 HD21 LEU A 444 1.774 1.155 3.838 1.00 0.00 H new ATOM 0 HD22 LEU A 444 2.906 2.528 3.879 1.00 0.00 H new ATOM 0 HD23 LEU A 444 1.476 2.522 4.938 1.00 0.00 H new ATOM 855 N LYS A 445 1.681 5.064 6.350 1.00 0.00 N ATOM 856 CA LYS A 445 2.653 5.484 7.311 1.00 0.00 C ATOM 857 C LYS A 445 3.429 4.272 7.809 1.00 0.00 C ATOM 858 O LYS A 445 2.946 3.134 7.752 1.00 0.00 O ATOM 859 CB LYS A 445 1.951 6.164 8.490 1.00 0.00 C ATOM 860 CG LYS A 445 2.882 6.635 9.599 1.00 0.00 C ATOM 861 CD LYS A 445 2.191 6.693 10.950 1.00 0.00 C ATOM 862 CE LYS A 445 1.635 5.328 11.346 1.00 0.00 C ATOM 863 NZ LYS A 445 0.192 5.187 10.997 1.00 0.00 N ATOM 0 H LYS A 445 1.052 4.332 6.679 1.00 0.00 H new ATOM 0 HA LYS A 445 3.341 6.190 6.846 1.00 0.00 H new ATOM 0 HB2 LYS A 445 1.390 7.021 8.116 1.00 0.00 H new ATOM 0 HB3 LYS A 445 1.226 5.469 8.914 1.00 0.00 H new ATOM 0 HG2 LYS A 445 3.738 5.963 9.661 1.00 0.00 H new ATOM 0 HG3 LYS A 445 3.269 7.623 9.349 1.00 0.00 H new ATOM 0 HD2 LYS A 445 2.896 7.035 11.708 1.00 0.00 H new ATOM 0 HD3 LYS A 445 1.382 7.422 10.916 1.00 0.00 H new ATOM 0 HE2 LYS A 445 2.206 4.546 10.847 1.00 0.00 H new ATOM 0 HE3 LYS A 445 1.764 5.182 12.418 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 -0.204 4.359 11.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 -0.322 6.042 11.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 0.094 5.062 9.969 1.00 0.00 H new ATOM 877 N VAL A 446 4.641 4.504 8.240 1.00 0.00 N ATOM 878 CA VAL A 446 5.426 3.464 8.817 1.00 0.00 C ATOM 879 C VAL A 446 4.886 3.076 10.184 1.00 0.00 C ATOM 880 O VAL A 446 4.472 3.937 10.977 1.00 0.00 O ATOM 881 CB VAL A 446 6.935 3.801 8.867 1.00 0.00 C ATOM 882 CG1 VAL A 446 7.466 4.039 7.469 1.00 0.00 C ATOM 883 CG2 VAL A 446 7.208 5.010 9.747 1.00 0.00 C ATOM 0 H VAL A 446 5.102 5.413 8.198 1.00 0.00 H new ATOM 0 HA VAL A 446 5.339 2.599 8.159 1.00 0.00 H new ATOM 0 HB VAL A 446 7.452 2.947 9.305 1.00 0.00 H new ATOM 0 HG11 VAL A 446 8.529 4.275 7.519 1.00 0.00 H new ATOM 0 HG12 VAL A 446 7.321 3.142 6.867 1.00 0.00 H new ATOM 0 HG13 VAL A 446 6.930 4.872 7.013 1.00 0.00 H new ATOM 0 HG21 VAL A 446 8.278 5.217 9.759 1.00 0.00 H new ATOM 0 HG22 VAL A 446 6.675 5.875 9.352 1.00 0.00 H new ATOM 0 HG23 VAL A 446 6.867 4.806 10.762 1.00 0.00 H new ATOM 893 N GLY A 447 4.871 1.799 10.446 1.00 0.00 N ATOM 894 CA GLY A 447 4.329 1.314 11.677 1.00 0.00 C ATOM 895 C GLY A 447 2.937 0.746 11.510 1.00 0.00 C ATOM 896 O GLY A 447 2.424 0.106 12.423 1.00 0.00 O ATOM 0 H GLY A 447 5.229 1.077 9.821 1.00 0.00 H new ATOM 0 HA2 GLY A 447 4.986 0.545 12.082 1.00 0.00 H new ATOM 0 HA3 GLY A 447 4.302 2.126 12.404 1.00 0.00 H new ATOM 900 N ASP A 448 2.331 0.953 10.347 1.00 0.00 N ATOM 901 CA ASP A 448 0.976 0.443 10.087 1.00 0.00 C ATOM 902 C ASP A 448 0.992 -1.016 9.672 1.00 0.00 C ATOM 903 O ASP A 448 1.886 -1.440 8.918 1.00 0.00 O ATOM 904 CB ASP A 448 0.221 1.264 9.015 1.00 0.00 C ATOM 905 CG ASP A 448 -0.148 2.644 9.481 1.00 0.00 C ATOM 906 OD1 ASP A 448 -0.693 2.776 10.598 1.00 0.00 O ATOM 907 OD2 ASP A 448 0.109 3.640 8.759 1.00 0.00 O ATOM 0 H ASP A 448 2.747 1.466 9.569 1.00 0.00 H new ATOM 0 HA ASP A 448 0.444 0.544 11.033 1.00 0.00 H new ATOM 0 HB2 ASP A 448 0.841 1.342 8.122 1.00 0.00 H new ATOM 0 HB3 ASP A 448 -0.685 0.730 8.728 1.00 0.00 H new ATOM 912 N PRO A 449 0.044 -1.830 10.193 1.00 0.00 N ATOM 913 CA PRO A 449 -0.115 -3.199 9.777 1.00 0.00 C ATOM 914 C PRO A 449 -0.967 -3.269 8.508 1.00 0.00 C ATOM 915 O PRO A 449 -2.193 -3.070 8.526 1.00 0.00 O ATOM 916 CB PRO A 449 -0.808 -3.885 10.957 1.00 0.00 C ATOM 917 CG PRO A 449 -1.404 -2.787 11.790 1.00 0.00 C ATOM 918 CD PRO A 449 -0.928 -1.465 11.231 1.00 0.00 C ATOM 0 HA PRO A 449 0.832 -3.681 9.534 1.00 0.00 H new ATOM 0 HB2 PRO A 449 -1.579 -4.572 10.609 1.00 0.00 H new ATOM 0 HB3 PRO A 449 -0.097 -4.472 11.538 1.00 0.00 H new ATOM 0 HG2 PRO A 449 -2.492 -2.840 11.768 1.00 0.00 H new ATOM 0 HG3 PRO A 449 -1.101 -2.892 12.832 1.00 0.00 H new ATOM 0 HD2 PRO A 449 -1.755 -0.890 10.815 1.00 0.00 H new ATOM 0 HD3 PRO A 449 -0.469 -0.850 12.005 1.00 0.00 H new ATOM 926 N ILE A 450 -0.319 -3.548 7.436 1.00 0.00 N ATOM 927 CA ILE A 450 -0.917 -3.521 6.134 1.00 0.00 C ATOM 928 C ILE A 450 -1.095 -4.919 5.590 1.00 0.00 C ATOM 929 O ILE A 450 -0.475 -5.859 6.084 1.00 0.00 O ATOM 930 CB ILE A 450 -0.059 -2.635 5.169 1.00 0.00 C ATOM 931 CG1 ILE A 450 1.443 -3.057 5.152 1.00 0.00 C ATOM 932 CG2 ILE A 450 -0.185 -1.168 5.553 1.00 0.00 C ATOM 933 CD1 ILE A 450 1.775 -4.285 4.320 1.00 0.00 C ATOM 0 H ILE A 450 0.667 -3.809 7.430 1.00 0.00 H new ATOM 0 HA ILE A 450 -1.910 -3.078 6.213 1.00 0.00 H new ATOM 0 HB ILE A 450 -0.449 -2.785 4.162 1.00 0.00 H new ATOM 0 HG12 ILE A 450 2.032 -2.219 4.780 1.00 0.00 H new ATOM 0 HG13 ILE A 450 1.761 -3.240 6.178 1.00 0.00 H new ATOM 0 HG21 ILE A 450 0.416 -0.562 4.875 1.00 0.00 H new ATOM 0 HG22 ILE A 450 -1.229 -0.862 5.485 1.00 0.00 H new ATOM 0 HG23 ILE A 450 0.168 -1.028 6.575 1.00 0.00 H new ATOM 0 HD11 ILE A 450 2.844 -4.487 4.380 1.00 0.00 H new ATOM 0 HD12 ILE A 450 1.222 -5.143 4.701 1.00 0.00 H new ATOM 0 HD13 ILE A 450 1.497 -4.107 3.281 1.00 0.00 H new ATOM 945 N VAL A 451 -1.921 -5.055 4.592 1.00 0.00 N ATOM 946 CA VAL A 451 -2.142 -6.327 3.957 1.00 0.00 C ATOM 947 C VAL A 451 -2.083 -6.165 2.445 1.00 0.00 C ATOM 948 O VAL A 451 -2.764 -5.303 1.874 1.00 0.00 O ATOM 949 CB VAL A 451 -3.477 -7.008 4.430 1.00 0.00 C ATOM 950 CG1 VAL A 451 -4.683 -6.112 4.216 1.00 0.00 C ATOM 951 CG2 VAL A 451 -3.689 -8.363 3.756 1.00 0.00 C ATOM 0 H VAL A 451 -2.462 -4.287 4.194 1.00 0.00 H new ATOM 0 HA VAL A 451 -1.344 -7.004 4.262 1.00 0.00 H new ATOM 0 HB VAL A 451 -3.375 -7.174 5.502 1.00 0.00 H new ATOM 0 HG11 VAL A 451 -5.582 -6.625 4.557 1.00 0.00 H new ATOM 0 HG12 VAL A 451 -4.555 -5.189 4.781 1.00 0.00 H new ATOM 0 HG13 VAL A 451 -4.779 -5.878 3.156 1.00 0.00 H new ATOM 0 HG21 VAL A 451 -4.622 -8.803 4.108 1.00 0.00 H new ATOM 0 HG22 VAL A 451 -3.737 -8.228 2.675 1.00 0.00 H new ATOM 0 HG23 VAL A 451 -2.860 -9.026 4.003 1.00 0.00 H new ATOM 961 N VAL A 452 -1.239 -6.950 1.814 1.00 0.00 N ATOM 962 CA VAL A 452 -1.038 -6.901 0.383 1.00 0.00 C ATOM 963 C VAL A 452 -1.276 -8.290 -0.182 1.00 0.00 C ATOM 964 O VAL A 452 -0.674 -9.265 0.288 1.00 0.00 O ATOM 965 CB VAL A 452 0.411 -6.452 0.011 1.00 0.00 C ATOM 966 CG1 VAL A 452 0.578 -6.331 -1.498 1.00 0.00 C ATOM 967 CG2 VAL A 452 0.783 -5.141 0.689 1.00 0.00 C ATOM 0 H VAL A 452 -0.666 -7.649 2.286 1.00 0.00 H new ATOM 0 HA VAL A 452 -1.734 -6.173 -0.035 1.00 0.00 H new ATOM 0 HB VAL A 452 1.089 -7.224 0.374 1.00 0.00 H new ATOM 0 HG11 VAL A 452 1.596 -6.017 -1.727 1.00 0.00 H new ATOM 0 HG12 VAL A 452 0.382 -7.297 -1.964 1.00 0.00 H new ATOM 0 HG13 VAL A 452 -0.125 -5.593 -1.884 1.00 0.00 H new ATOM 0 HG21 VAL A 452 1.798 -4.860 0.407 1.00 0.00 H new ATOM 0 HG22 VAL A 452 0.090 -4.360 0.376 1.00 0.00 H new ATOM 0 HG23 VAL A 452 0.728 -5.262 1.771 1.00 0.00 H new ATOM 977 N GLY A 453 -2.158 -8.389 -1.151 1.00 0.00 N ATOM 978 CA GLY A 453 -2.448 -9.661 -1.751 1.00 0.00 C ATOM 979 C GLY A 453 -3.210 -10.554 -0.802 1.00 0.00 C ATOM 980 O GLY A 453 -4.418 -10.383 -0.614 1.00 0.00 O ATOM 0 H GLY A 453 -2.683 -7.604 -1.536 1.00 0.00 H new ATOM 0 HA2 GLY A 453 -3.030 -9.512 -2.660 1.00 0.00 H new ATOM 0 HA3 GLY A 453 -1.518 -10.148 -2.044 1.00 0.00 H new ATOM 984 N THR A 454 -2.517 -11.509 -0.217 1.00 0.00 N ATOM 985 CA THR A 454 -3.074 -12.401 0.730 1.00 0.00 C ATOM 986 C THR A 454 -2.214 -12.382 2.043 1.00 0.00 C ATOM 987 O THR A 454 -2.534 -13.039 3.039 1.00 0.00 O ATOM 988 CB THR A 454 -3.058 -13.798 0.089 1.00 0.00 C ATOM 989 OG1 THR A 454 -3.630 -13.701 -1.228 1.00 0.00 O ATOM 990 CG2 THR A 454 -3.863 -14.763 0.890 1.00 0.00 C ATOM 0 H THR A 454 -1.528 -11.675 -0.404 1.00 0.00 H new ATOM 0 HA THR A 454 -4.092 -12.116 0.997 1.00 0.00 H new ATOM 0 HB THR A 454 -2.029 -14.155 0.046 1.00 0.00 H new ATOM 0 HG1 THR A 454 -3.626 -14.584 -1.652 1.00 0.00 H new ATOM 0 HG21 THR A 454 -3.835 -15.743 0.414 1.00 0.00 H new ATOM 0 HG22 THR A 454 -3.449 -14.836 1.896 1.00 0.00 H new ATOM 0 HG23 THR A 454 -4.895 -14.417 0.947 1.00 0.00 H new ATOM 998 N THR A 455 -1.170 -11.578 2.055 1.00 0.00 N ATOM 999 CA THR A 455 -0.250 -11.555 3.174 1.00 0.00 C ATOM 1000 C THR A 455 -0.264 -10.185 3.877 1.00 0.00 C ATOM 1001 O THR A 455 -0.460 -9.158 3.235 1.00 0.00 O ATOM 1002 CB THR A 455 1.178 -11.901 2.681 1.00 0.00 C ATOM 1003 OG1 THR A 455 1.165 -13.183 2.024 1.00 0.00 O ATOM 1004 CG2 THR A 455 2.159 -11.949 3.835 1.00 0.00 C ATOM 0 H THR A 455 -0.937 -10.931 1.301 1.00 0.00 H new ATOM 0 HA THR A 455 -0.568 -12.302 3.902 1.00 0.00 H new ATOM 0 HB THR A 455 1.493 -11.123 1.986 1.00 0.00 H new ATOM 0 HG1 THR A 455 1.838 -13.192 1.311 1.00 0.00 H new ATOM 0 HG21 THR A 455 3.152 -12.194 3.458 1.00 0.00 H new ATOM 0 HG22 THR A 455 2.188 -10.978 4.329 1.00 0.00 H new ATOM 0 HG23 THR A 455 1.844 -12.710 4.549 1.00 0.00 H new ATOM 1012 N TYR A 456 -0.081 -10.174 5.190 1.00 0.00 N ATOM 1013 CA TYR A 456 -0.055 -8.932 5.930 1.00 0.00 C ATOM 1014 C TYR A 456 1.288 -8.741 6.627 1.00 0.00 C ATOM 1015 O TYR A 456 2.036 -9.710 6.842 1.00 0.00 O ATOM 1016 CB TYR A 456 -1.228 -8.827 6.933 1.00 0.00 C ATOM 1017 CG TYR A 456 -1.236 -9.863 8.039 1.00 0.00 C ATOM 1018 CD1 TYR A 456 -1.884 -11.071 7.873 1.00 0.00 C ATOM 1019 CD2 TYR A 456 -0.605 -9.620 9.253 1.00 0.00 C ATOM 1020 CE1 TYR A 456 -1.902 -12.013 8.875 1.00 0.00 C ATOM 1021 CE2 TYR A 456 -0.617 -10.554 10.259 1.00 0.00 C ATOM 1022 CZ TYR A 456 -1.267 -11.750 10.065 1.00 0.00 C ATOM 1023 OH TYR A 456 -1.278 -12.693 11.069 1.00 0.00 O ATOM 0 H TYR A 456 0.051 -11.011 5.758 1.00 0.00 H new ATOM 0 HA TYR A 456 -0.182 -8.124 5.210 1.00 0.00 H new ATOM 0 HB2 TYR A 456 -1.207 -7.836 7.387 1.00 0.00 H new ATOM 0 HB3 TYR A 456 -2.164 -8.904 6.380 1.00 0.00 H new ATOM 0 HD1 TYR A 456 -2.386 -11.280 6.940 1.00 0.00 H new ATOM 0 HD2 TYR A 456 -0.096 -8.680 9.408 1.00 0.00 H new ATOM 0 HE1 TYR A 456 -2.412 -12.954 8.728 1.00 0.00 H new ATOM 0 HE2 TYR A 456 -0.120 -10.351 11.196 1.00 0.00 H new ATOM 0 HH TYR A 456 -0.784 -12.352 11.843 1.00 0.00 H new ATOM 1033 N GLY A 457 1.582 -7.523 6.972 1.00 0.00 N ATOM 1034 CA GLY A 457 2.814 -7.189 7.623 1.00 0.00 C ATOM 1035 C GLY A 457 2.732 -5.819 8.225 1.00 0.00 C ATOM 1036 O GLY A 457 1.645 -5.271 8.349 1.00 0.00 O ATOM 0 H GLY A 457 0.968 -6.725 6.808 1.00 0.00 H new ATOM 0 HA2 GLY A 457 3.033 -7.922 8.400 1.00 0.00 H new ATOM 0 HA3 GLY A 457 3.634 -7.230 6.906 1.00 0.00 H new ATOM 1040 N ARG A 458 3.843 -5.251 8.574 1.00 0.00 N ATOM 1041 CA ARG A 458 3.851 -3.942 9.168 1.00 0.00 C ATOM 1042 C ARG A 458 4.939 -3.116 8.533 1.00 0.00 C ATOM 1043 O ARG A 458 6.089 -3.558 8.451 1.00 0.00 O ATOM 1044 CB ARG A 458 4.017 -4.022 10.686 1.00 0.00 C ATOM 1045 CG ARG A 458 3.940 -2.676 11.370 1.00 0.00 C ATOM 1046 CD ARG A 458 3.961 -2.804 12.880 1.00 0.00 C ATOM 1047 NE ARG A 458 2.848 -3.620 13.389 1.00 0.00 N ATOM 1048 CZ ARG A 458 1.787 -3.150 14.066 1.00 0.00 C ATOM 1049 NH1 ARG A 458 1.518 -1.846 14.085 1.00 0.00 N ATOM 1050 NH2 ARG A 458 0.960 -4.002 14.660 1.00 0.00 N ATOM 0 H ARG A 458 4.765 -5.673 8.459 1.00 0.00 H new ATOM 0 HA ARG A 458 2.891 -3.460 8.984 1.00 0.00 H new ATOM 0 HB2 ARG A 458 3.245 -4.674 11.095 1.00 0.00 H new ATOM 0 HB3 ARG A 458 4.978 -4.483 10.915 1.00 0.00 H new ATOM 0 HG2 ARG A 458 4.777 -2.057 11.047 1.00 0.00 H new ATOM 0 HG3 ARG A 458 3.028 -2.165 11.062 1.00 0.00 H new ATOM 0 HD2 ARG A 458 4.906 -3.249 13.191 1.00 0.00 H new ATOM 0 HD3 ARG A 458 3.914 -1.811 13.327 1.00 0.00 H new ATOM 0 HE ARG A 458 2.885 -4.624 13.214 1.00 0.00 H new ATOM 0 HH11 ARG A 458 2.120 -1.194 13.582 1.00 0.00 H new ATOM 0 HH12 ARG A 458 0.710 -1.499 14.602 1.00 0.00 H new ATOM 0 HH21 ARG A 458 1.132 -5.006 14.600 1.00 0.00 H new ATOM 0 HH22 ARG A 458 0.152 -3.653 15.176 1.00 0.00 H new ATOM 1064 N VAL A 459 4.580 -1.922 8.107 1.00 0.00 N ATOM 1065 CA VAL A 459 5.469 -1.078 7.344 1.00 0.00 C ATOM 1066 C VAL A 459 6.691 -0.646 8.131 1.00 0.00 C ATOM 1067 O VAL A 459 6.593 -0.006 9.177 1.00 0.00 O ATOM 1068 CB VAL A 459 4.778 0.162 6.771 1.00 0.00 C ATOM 1069 CG1 VAL A 459 5.753 0.917 5.873 1.00 0.00 C ATOM 1070 CG2 VAL A 459 3.542 -0.232 5.989 1.00 0.00 C ATOM 0 H VAL A 459 3.663 -1.512 8.282 1.00 0.00 H new ATOM 0 HA VAL A 459 5.791 -1.707 6.514 1.00 0.00 H new ATOM 0 HB VAL A 459 4.469 0.809 7.592 1.00 0.00 H new ATOM 0 HG11 VAL A 459 5.262 1.800 5.464 1.00 0.00 H new ATOM 0 HG12 VAL A 459 6.622 1.222 6.455 1.00 0.00 H new ATOM 0 HG13 VAL A 459 6.072 0.269 5.057 1.00 0.00 H new ATOM 0 HG21 VAL A 459 3.064 0.662 5.589 1.00 0.00 H new ATOM 0 HG22 VAL A 459 3.826 -0.890 5.168 1.00 0.00 H new ATOM 0 HG23 VAL A 459 2.846 -0.752 6.647 1.00 0.00 H new ATOM 1080 N ARG A 460 7.815 -1.006 7.600 1.00 0.00 N ATOM 1081 CA ARG A 460 9.100 -0.690 8.148 1.00 0.00 C ATOM 1082 C ARG A 460 9.565 0.696 7.683 1.00 0.00 C ATOM 1083 O ARG A 460 9.761 1.613 8.491 1.00 0.00 O ATOM 1084 CB ARG A 460 10.052 -1.732 7.624 1.00 0.00 C ATOM 1085 CG ARG A 460 11.499 -1.476 7.903 1.00 0.00 C ATOM 1086 CD ARG A 460 12.305 -2.357 7.013 1.00 0.00 C ATOM 1087 NE ARG A 460 13.726 -2.037 7.063 1.00 0.00 N ATOM 1088 CZ ARG A 460 14.482 -1.723 6.007 1.00 0.00 C ATOM 1089 NH1 ARG A 460 13.961 -1.735 4.776 1.00 0.00 N ATOM 1090 NH2 ARG A 460 15.758 -1.398 6.182 1.00 0.00 N ATOM 0 H ARG A 460 7.868 -1.550 6.739 1.00 0.00 H new ATOM 0 HA ARG A 460 9.060 -0.680 9.237 1.00 0.00 H new ATOM 0 HB2 ARG A 460 9.781 -2.696 8.054 1.00 0.00 H new ATOM 0 HB3 ARG A 460 9.916 -1.815 6.546 1.00 0.00 H new ATOM 0 HG2 ARG A 460 11.742 -0.429 7.723 1.00 0.00 H new ATOM 0 HG3 ARG A 460 11.727 -1.681 8.949 1.00 0.00 H new ATOM 0 HD2 ARG A 460 12.158 -3.397 7.304 1.00 0.00 H new ATOM 0 HD3 ARG A 460 11.948 -2.259 5.988 1.00 0.00 H new ATOM 0 HE ARG A 460 14.179 -2.054 7.977 1.00 0.00 H new ATOM 0 HH11 ARG A 460 12.982 -1.985 4.639 1.00 0.00 H new ATOM 0 HH12 ARG A 460 14.543 -1.494 3.974 1.00 0.00 H new ATOM 0 HH21 ARG A 460 16.158 -1.389 7.120 1.00 0.00 H new ATOM 0 HH22 ARG A 460 16.338 -1.158 5.378 1.00 0.00 H new ATOM 1104 N ALA A 461 9.694 0.842 6.386 1.00 0.00 N ATOM 1105 CA ALA A 461 10.188 2.050 5.776 1.00 0.00 C ATOM 1106 C ALA A 461 9.314 2.400 4.619 1.00 0.00 C ATOM 1107 O ALA A 461 8.598 1.536 4.091 1.00 0.00 O ATOM 1108 CB ALA A 461 11.626 1.851 5.311 1.00 0.00 C ATOM 0 H ALA A 461 9.454 0.112 5.715 1.00 0.00 H new ATOM 0 HA ALA A 461 10.172 2.862 6.503 1.00 0.00 H new ATOM 0 HB1 ALA A 461 11.990 2.770 4.851 1.00 0.00 H new ATOM 0 HB2 ALA A 461 12.253 1.600 6.166 1.00 0.00 H new ATOM 0 HB3 ALA A 461 11.664 1.041 4.583 1.00 0.00 H new ATOM 1114 N MET A 462 9.387 3.634 4.220 1.00 0.00 N ATOM 1115 CA MET A 462 8.575 4.160 3.178 1.00 0.00 C ATOM 1116 C MET A 462 9.499 4.876 2.231 1.00 0.00 C ATOM 1117 O MET A 462 10.189 5.807 2.631 1.00 0.00 O ATOM 1118 CB MET A 462 7.620 5.189 3.778 1.00 0.00 C ATOM 1119 CG MET A 462 6.436 5.561 2.905 1.00 0.00 C ATOM 1120 SD MET A 462 5.233 4.247 2.810 1.00 0.00 S ATOM 1121 CE MET A 462 4.803 4.137 4.540 1.00 0.00 C ATOM 0 H MET A 462 10.030 4.315 4.623 1.00 0.00 H new ATOM 0 HA MET A 462 8.010 3.373 2.677 1.00 0.00 H new ATOM 0 HB2 MET A 462 7.245 4.803 4.726 1.00 0.00 H new ATOM 0 HB3 MET A 462 8.183 6.095 4.004 1.00 0.00 H new ATOM 0 HG2 MET A 462 5.961 6.458 3.302 1.00 0.00 H new ATOM 0 HG3 MET A 462 6.788 5.803 1.902 1.00 0.00 H new ATOM 0 HE1 MET A 462 3.956 3.462 4.662 1.00 0.00 H new ATOM 0 HE2 MET A 462 5.655 3.756 5.103 1.00 0.00 H new ATOM 0 HE3 MET A 462 4.536 5.126 4.912 1.00 0.00 H new ATOM 1131 N VAL A 463 9.575 4.437 1.038 1.00 0.00 N ATOM 1132 CA VAL A 463 10.372 5.109 0.049 1.00 0.00 C ATOM 1133 C VAL A 463 9.497 5.342 -1.149 1.00 0.00 C ATOM 1134 O VAL A 463 8.690 4.501 -1.484 1.00 0.00 O ATOM 1135 CB VAL A 463 11.685 4.326 -0.288 1.00 0.00 C ATOM 1136 CG1 VAL A 463 11.404 2.905 -0.735 1.00 0.00 C ATOM 1137 CG2 VAL A 463 12.534 5.062 -1.316 1.00 0.00 C ATOM 0 H VAL A 463 9.093 3.603 0.702 1.00 0.00 H new ATOM 0 HA VAL A 463 10.724 6.067 0.432 1.00 0.00 H new ATOM 0 HB VAL A 463 12.257 4.269 0.638 1.00 0.00 H new ATOM 0 HG11 VAL A 463 12.344 2.401 -0.958 1.00 0.00 H new ATOM 0 HG12 VAL A 463 10.885 2.370 0.060 1.00 0.00 H new ATOM 0 HG13 VAL A 463 10.780 2.921 -1.629 1.00 0.00 H new ATOM 0 HG21 VAL A 463 13.436 4.486 -1.523 1.00 0.00 H new ATOM 0 HG22 VAL A 463 11.964 5.186 -2.237 1.00 0.00 H new ATOM 0 HG23 VAL A 463 12.811 6.041 -0.925 1.00 0.00 H new ATOM 1147 N ASN A 464 9.592 6.482 -1.753 1.00 0.00 N ATOM 1148 CA ASN A 464 8.672 6.785 -2.818 1.00 0.00 C ATOM 1149 C ASN A 464 9.353 6.637 -4.135 1.00 0.00 C ATOM 1150 O ASN A 464 10.559 6.406 -4.171 1.00 0.00 O ATOM 1151 CB ASN A 464 8.054 8.183 -2.652 1.00 0.00 C ATOM 1152 CG ASN A 464 8.902 9.342 -3.142 1.00 0.00 C ATOM 1153 OD1 ASN A 464 8.796 9.757 -4.281 1.00 0.00 O ATOM 1154 ND2 ASN A 464 9.734 9.869 -2.304 1.00 0.00 N ATOM 0 H ASN A 464 10.277 7.207 -1.540 1.00 0.00 H new ATOM 0 HA ASN A 464 7.848 6.073 -2.775 1.00 0.00 H new ATOM 0 HB2 ASN A 464 7.102 8.204 -3.182 1.00 0.00 H new ATOM 0 HB3 ASN A 464 7.834 8.339 -1.596 1.00 0.00 H new ATOM 0 HD21 ASN A 464 10.321 10.652 -2.592 1.00 0.00 H new ATOM 0 HD22 ASN A 464 9.803 9.502 -1.355 1.00 0.00 H new ATOM 1161 N ASP A 465 8.593 6.818 -5.201 1.00 0.00 N ATOM 1162 CA ASP A 465 9.077 6.670 -6.587 1.00 0.00 C ATOM 1163 C ASP A 465 10.345 7.477 -6.832 1.00 0.00 C ATOM 1164 O ASP A 465 11.287 7.002 -7.468 1.00 0.00 O ATOM 1165 CB ASP A 465 8.000 7.120 -7.579 1.00 0.00 C ATOM 1166 CG ASP A 465 8.442 6.988 -9.029 1.00 0.00 C ATOM 1167 OD1 ASP A 465 9.053 7.937 -9.578 1.00 0.00 O ATOM 1168 OD2 ASP A 465 8.180 5.955 -9.640 1.00 0.00 O ATOM 0 H ASP A 465 7.608 7.075 -5.141 1.00 0.00 H new ATOM 0 HA ASP A 465 9.304 5.614 -6.736 1.00 0.00 H new ATOM 0 HB2 ASP A 465 7.099 6.527 -7.423 1.00 0.00 H new ATOM 0 HB3 ASP A 465 7.737 8.158 -7.377 1.00 0.00 H new ATOM 1173 N SER A 466 10.405 8.658 -6.252 1.00 0.00 N ATOM 1174 CA SER A 466 11.504 9.555 -6.478 1.00 0.00 C ATOM 1175 C SER A 466 12.764 9.134 -5.695 1.00 0.00 C ATOM 1176 O SER A 466 13.808 9.764 -5.809 1.00 0.00 O ATOM 1177 CB SER A 466 11.081 10.975 -6.131 1.00 0.00 C ATOM 1178 OG SER A 466 9.907 11.343 -6.857 1.00 0.00 O ATOM 0 H SER A 466 9.694 9.016 -5.615 1.00 0.00 H new ATOM 0 HA SER A 466 11.771 9.513 -7.534 1.00 0.00 H new ATOM 0 HB2 SER A 466 10.892 11.052 -5.060 1.00 0.00 H new ATOM 0 HB3 SER A 466 11.890 11.668 -6.362 1.00 0.00 H new ATOM 0 HG SER A 466 9.649 12.258 -6.620 1.00 0.00 H new ATOM 1184 N GLY A 467 12.638 8.113 -4.852 1.00 0.00 N ATOM 1185 CA GLY A 467 13.808 7.556 -4.184 1.00 0.00 C ATOM 1186 C GLY A 467 14.027 8.150 -2.831 1.00 0.00 C ATOM 1187 O GLY A 467 14.988 7.832 -2.141 1.00 0.00 O ATOM 0 H GLY A 467 11.754 7.662 -4.619 1.00 0.00 H new ATOM 0 HA2 GLY A 467 13.690 6.477 -4.089 1.00 0.00 H new ATOM 0 HA3 GLY A 467 14.691 7.727 -4.800 1.00 0.00 H new ATOM 1191 N ARG A 468 13.134 9.009 -2.445 1.00 0.00 N ATOM 1192 CA ARG A 468 13.218 9.652 -1.164 1.00 0.00 C ATOM 1193 C ARG A 468 12.519 8.825 -0.115 1.00 0.00 C ATOM 1194 O ARG A 468 11.357 8.405 -0.302 1.00 0.00 O ATOM 1195 CB ARG A 468 12.659 11.076 -1.210 1.00 0.00 C ATOM 1196 CG ARG A 468 13.631 12.143 -1.734 1.00 0.00 C ATOM 1197 CD ARG A 468 14.093 11.897 -3.159 1.00 0.00 C ATOM 1198 NE ARG A 468 15.035 12.923 -3.601 1.00 0.00 N ATOM 1199 CZ ARG A 468 15.535 13.031 -4.838 1.00 0.00 C ATOM 1200 NH1 ARG A 468 15.244 12.123 -5.761 1.00 0.00 N ATOM 1201 NH2 ARG A 468 16.352 14.034 -5.138 1.00 0.00 N ATOM 0 H ARG A 468 12.328 9.285 -3.005 1.00 0.00 H new ATOM 0 HA ARG A 468 14.271 9.730 -0.895 1.00 0.00 H new ATOM 0 HB2 ARG A 468 11.768 11.079 -1.838 1.00 0.00 H new ATOM 0 HB3 ARG A 468 12.342 11.358 -0.206 1.00 0.00 H new ATOM 0 HG2 ARG A 468 13.149 13.119 -1.681 1.00 0.00 H new ATOM 0 HG3 ARG A 468 14.502 12.181 -1.080 1.00 0.00 H new ATOM 0 HD2 ARG A 468 14.564 10.916 -3.226 1.00 0.00 H new ATOM 0 HD3 ARG A 468 13.230 11.882 -3.825 1.00 0.00 H new ATOM 0 HE ARG A 468 15.336 13.612 -2.912 1.00 0.00 H new ATOM 0 HH11 ARG A 468 14.636 11.337 -5.530 1.00 0.00 H new ATOM 0 HH12 ARG A 468 15.628 12.211 -6.702 1.00 0.00 H new ATOM 0 HH21 ARG A 468 16.598 14.722 -4.426 1.00 0.00 H new ATOM 0 HH22 ARG A 468 16.733 14.117 -6.080 1.00 0.00 H new ATOM 1215 N ARG A 469 13.223 8.577 0.953 1.00 0.00 N ATOM 1216 CA ARG A 469 12.737 7.792 2.057 1.00 0.00 C ATOM 1217 C ARG A 469 11.939 8.747 2.945 1.00 0.00 C ATOM 1218 O ARG A 469 12.388 9.870 3.213 1.00 0.00 O ATOM 1219 CB ARG A 469 13.955 7.207 2.811 1.00 0.00 C ATOM 1220 CG ARG A 469 13.742 5.870 3.547 1.00 0.00 C ATOM 1221 CD ARG A 469 12.720 5.928 4.670 1.00 0.00 C ATOM 1222 NE ARG A 469 13.037 6.944 5.671 1.00 0.00 N ATOM 1223 CZ ARG A 469 12.870 6.817 6.989 1.00 0.00 C ATOM 1224 NH1 ARG A 469 12.637 5.627 7.534 1.00 0.00 N ATOM 1225 NH2 ARG A 469 13.017 7.875 7.767 1.00 0.00 N ATOM 0 H ARG A 469 14.174 8.922 1.085 1.00 0.00 H new ATOM 0 HA ARG A 469 12.105 6.962 1.741 1.00 0.00 H new ATOM 0 HB2 ARG A 469 14.766 7.075 2.095 1.00 0.00 H new ATOM 0 HB3 ARG A 469 14.290 7.946 3.539 1.00 0.00 H new ATOM 0 HG2 ARG A 469 13.427 5.117 2.824 1.00 0.00 H new ATOM 0 HG3 ARG A 469 14.696 5.539 3.957 1.00 0.00 H new ATOM 0 HD2 ARG A 469 11.736 6.133 4.249 1.00 0.00 H new ATOM 0 HD3 ARG A 469 12.663 4.953 5.154 1.00 0.00 H new ATOM 0 HE ARG A 469 13.419 7.827 5.333 1.00 0.00 H new ATOM 0 HH11 ARG A 469 12.584 4.797 6.943 1.00 0.00 H new ATOM 0 HH12 ARG A 469 12.511 5.544 8.543 1.00 0.00 H new ATOM 0 HH21 ARG A 469 13.256 8.779 7.359 1.00 0.00 H new ATOM 0 HH22 ARG A 469 12.891 7.788 8.775 1.00 0.00 H new ATOM 1239 N VAL A 470 10.776 8.333 3.369 1.00 0.00 N ATOM 1240 CA VAL A 470 9.895 9.176 4.154 1.00 0.00 C ATOM 1241 C VAL A 470 9.301 8.367 5.289 1.00 0.00 C ATOM 1242 O VAL A 470 9.555 7.164 5.398 1.00 0.00 O ATOM 1243 CB VAL A 470 8.740 9.815 3.290 1.00 0.00 C ATOM 1244 CG1 VAL A 470 9.284 10.770 2.240 1.00 0.00 C ATOM 1245 CG2 VAL A 470 7.891 8.749 2.620 1.00 0.00 C ATOM 0 H VAL A 470 10.405 7.401 3.183 1.00 0.00 H new ATOM 0 HA VAL A 470 10.493 9.998 4.547 1.00 0.00 H new ATOM 0 HB VAL A 470 8.113 10.380 3.980 1.00 0.00 H new ATOM 0 HG11 VAL A 470 8.457 11.189 1.666 1.00 0.00 H new ATOM 0 HG12 VAL A 470 9.831 11.576 2.730 1.00 0.00 H new ATOM 0 HG13 VAL A 470 9.954 10.231 1.570 1.00 0.00 H new ATOM 0 HG21 VAL A 470 7.105 9.225 2.033 1.00 0.00 H new ATOM 0 HG22 VAL A 470 8.517 8.144 1.964 1.00 0.00 H new ATOM 0 HG23 VAL A 470 7.440 8.112 3.381 1.00 0.00 H new ATOM 1255 N LYS A 471 8.541 9.018 6.134 1.00 0.00 N ATOM 1256 CA LYS A 471 7.880 8.352 7.248 1.00 0.00 C ATOM 1257 C LYS A 471 6.446 7.999 6.877 1.00 0.00 C ATOM 1258 O LYS A 471 5.919 6.961 7.292 1.00 0.00 O ATOM 1259 CB LYS A 471 7.899 9.249 8.493 1.00 0.00 C ATOM 1260 CG LYS A 471 9.300 9.604 8.990 1.00 0.00 C ATOM 1261 CD LYS A 471 10.078 8.386 9.491 1.00 0.00 C ATOM 1262 CE LYS A 471 9.444 7.767 10.729 1.00 0.00 C ATOM 1263 NZ LYS A 471 10.199 6.587 11.202 1.00 0.00 N ATOM 0 H LYS A 471 8.358 10.020 6.077 1.00 0.00 H new ATOM 0 HA LYS A 471 8.420 7.432 7.472 1.00 0.00 H new ATOM 0 HB2 LYS A 471 7.360 10.170 8.271 1.00 0.00 H new ATOM 0 HB3 LYS A 471 7.357 8.749 9.296 1.00 0.00 H new ATOM 0 HG2 LYS A 471 9.858 10.078 8.182 1.00 0.00 H new ATOM 0 HG3 LYS A 471 9.221 10.335 9.795 1.00 0.00 H new ATOM 0 HD2 LYS A 471 10.129 7.639 8.699 1.00 0.00 H new ATOM 0 HD3 LYS A 471 11.103 8.680 9.718 1.00 0.00 H new ATOM 0 HE2 LYS A 471 9.398 8.511 11.524 1.00 0.00 H new ATOM 0 HE3 LYS A 471 8.418 7.476 10.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 471 9.736 6.194 12.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 471 10.222 5.866 10.453 1.00 0.00 H new ATOM 0 HZ3 LYS A 471 11.171 6.870 11.440 1.00 0.00 H new ATOM 1277 N GLU A 472 5.824 8.862 6.103 1.00 0.00 N ATOM 1278 CA GLU A 472 4.467 8.664 5.664 1.00 0.00 C ATOM 1279 C GLU A 472 4.169 9.393 4.360 1.00 0.00 C ATOM 1280 O GLU A 472 4.796 10.415 4.045 1.00 0.00 O ATOM 1281 CB GLU A 472 3.437 8.967 6.790 1.00 0.00 C ATOM 1282 CG GLU A 472 3.699 10.204 7.658 1.00 0.00 C ATOM 1283 CD GLU A 472 3.580 11.498 6.926 1.00 0.00 C ATOM 1284 OE1 GLU A 472 2.448 11.915 6.636 1.00 0.00 O ATOM 1285 OE2 GLU A 472 4.607 12.129 6.631 1.00 0.00 O ATOM 0 H GLU A 472 6.251 9.723 5.761 1.00 0.00 H new ATOM 0 HA GLU A 472 4.356 7.603 5.438 1.00 0.00 H new ATOM 0 HB2 GLU A 472 2.455 9.078 6.330 1.00 0.00 H new ATOM 0 HB3 GLU A 472 3.386 8.098 7.446 1.00 0.00 H new ATOM 0 HG2 GLU A 472 2.997 10.205 8.492 1.00 0.00 H new ATOM 0 HG3 GLU A 472 4.700 10.130 8.084 1.00 0.00 H new ATOM 1292 N ALA A 473 3.250 8.859 3.602 1.00 0.00 N ATOM 1293 CA ALA A 473 2.865 9.408 2.320 1.00 0.00 C ATOM 1294 C ALA A 473 1.358 9.413 2.198 1.00 0.00 C ATOM 1295 O ALA A 473 0.683 8.560 2.794 1.00 0.00 O ATOM 1296 CB ALA A 473 3.484 8.604 1.199 1.00 0.00 C ATOM 0 H ALA A 473 2.736 8.016 3.858 1.00 0.00 H new ATOM 0 HA ALA A 473 3.228 10.433 2.248 1.00 0.00 H new ATOM 0 HB1 ALA A 473 3.186 9.028 0.240 1.00 0.00 H new ATOM 0 HB2 ALA A 473 4.570 8.633 1.287 1.00 0.00 H new ATOM 0 HB3 ALA A 473 3.143 7.571 1.261 1.00 0.00 H new ATOM 1302 N GLY A 474 0.837 10.352 1.442 1.00 0.00 N ATOM 1303 CA GLY A 474 -0.588 10.493 1.302 1.00 0.00 C ATOM 1304 C GLY A 474 -1.133 9.694 0.139 1.00 0.00 C ATOM 1305 O GLY A 474 -0.364 9.050 -0.583 1.00 0.00 O ATOM 0 H GLY A 474 1.385 11.031 0.913 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -1.075 10.169 2.222 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -0.835 11.546 1.164 1.00 0.00 H new ATOM 1309 N PRO A 475 -2.453 9.732 -0.087 1.00 0.00 N ATOM 1310 CA PRO A 475 -3.091 8.965 -1.144 1.00 0.00 C ATOM 1311 C PRO A 475 -2.784 9.508 -2.529 1.00 0.00 C ATOM 1312 O PRO A 475 -2.339 10.657 -2.680 1.00 0.00 O ATOM 1313 CB PRO A 475 -4.578 9.085 -0.834 1.00 0.00 C ATOM 1314 CG PRO A 475 -4.707 10.385 -0.119 1.00 0.00 C ATOM 1315 CD PRO A 475 -3.428 10.558 0.661 1.00 0.00 C ATOM 0 HA PRO A 475 -2.733 7.936 -1.164 1.00 0.00 H new ATOM 0 HB2 PRO A 475 -5.176 9.073 -1.746 1.00 0.00 H new ATOM 0 HB3 PRO A 475 -4.923 8.256 -0.216 1.00 0.00 H new ATOM 0 HG2 PRO A 475 -4.849 11.205 -0.823 1.00 0.00 H new ATOM 0 HG3 PRO A 475 -5.572 10.381 0.545 1.00 0.00 H new ATOM 0 HD2 PRO A 475 -3.121 11.603 0.702 1.00 0.00 H new ATOM 0 HD3 PRO A 475 -3.536 10.217 1.691 1.00 0.00 H new ATOM 1323 N SER A 476 -2.995 8.650 -3.530 1.00 0.00 N ATOM 1324 CA SER A 476 -2.747 8.946 -4.932 1.00 0.00 C ATOM 1325 C SER A 476 -1.244 9.116 -5.190 1.00 0.00 C ATOM 1326 O SER A 476 -0.824 9.723 -6.175 1.00 0.00 O ATOM 1327 CB SER A 476 -3.549 10.175 -5.366 1.00 0.00 C ATOM 1328 OG SER A 476 -4.931 9.990 -5.040 1.00 0.00 O ATOM 0 H SER A 476 -3.353 7.707 -3.378 1.00 0.00 H new ATOM 0 HA SER A 476 -3.084 8.105 -5.538 1.00 0.00 H new ATOM 0 HB2 SER A 476 -3.165 11.066 -4.869 1.00 0.00 H new ATOM 0 HB3 SER A 476 -3.437 10.334 -6.438 1.00 0.00 H new ATOM 0 HG SER A 476 -5.074 9.071 -4.732 1.00 0.00 H new ATOM 1334 N MET A 477 -0.452 8.530 -4.319 1.00 0.00 N ATOM 1335 CA MET A 477 0.972 8.617 -4.415 1.00 0.00 C ATOM 1336 C MET A 477 1.604 7.225 -4.419 1.00 0.00 C ATOM 1337 O MET A 477 1.143 6.330 -3.689 1.00 0.00 O ATOM 1338 CB MET A 477 1.529 9.467 -3.275 1.00 0.00 C ATOM 1339 CG MET A 477 3.039 9.552 -3.261 1.00 0.00 C ATOM 1340 SD MET A 477 3.651 10.772 -2.076 1.00 0.00 S ATOM 1341 CE MET A 477 5.405 10.679 -2.379 1.00 0.00 C ATOM 0 H MET A 477 -0.786 7.981 -3.527 1.00 0.00 H new ATOM 0 HA MET A 477 1.225 9.100 -5.359 1.00 0.00 H new ATOM 0 HB2 MET A 477 1.118 10.474 -3.350 1.00 0.00 H new ATOM 0 HB3 MET A 477 1.188 9.054 -2.326 1.00 0.00 H new ATOM 0 HG2 MET A 477 3.453 8.574 -3.017 1.00 0.00 H new ATOM 0 HG3 MET A 477 3.395 9.809 -4.259 1.00 0.00 H new ATOM 0 HE1 MET A 477 5.889 11.576 -1.993 1.00 0.00 H new ATOM 0 HE2 MET A 477 5.815 9.802 -1.878 1.00 0.00 H new ATOM 0 HE3 MET A 477 5.585 10.602 -3.451 1.00 0.00 H new ATOM 1351 N PRO A 478 2.615 6.998 -5.290 1.00 0.00 N ATOM 1352 CA PRO A 478 3.341 5.739 -5.352 1.00 0.00 C ATOM 1353 C PRO A 478 4.453 5.666 -4.311 1.00 0.00 C ATOM 1354 O PRO A 478 5.348 6.540 -4.264 1.00 0.00 O ATOM 1355 CB PRO A 478 3.992 5.770 -6.743 1.00 0.00 C ATOM 1356 CG PRO A 478 3.511 7.016 -7.401 1.00 0.00 C ATOM 1357 CD PRO A 478 3.109 7.928 -6.305 1.00 0.00 C ATOM 0 HA PRO A 478 2.680 4.892 -5.170 1.00 0.00 H new ATOM 0 HB2 PRO A 478 5.079 5.767 -6.664 1.00 0.00 H new ATOM 0 HB3 PRO A 478 3.712 4.891 -7.323 1.00 0.00 H new ATOM 0 HG2 PRO A 478 4.296 7.462 -8.012 1.00 0.00 H new ATOM 0 HG3 PRO A 478 2.671 6.808 -8.063 1.00 0.00 H new ATOM 0 HD2 PRO A 478 3.948 8.520 -5.940 1.00 0.00 H new ATOM 0 HD3 PRO A 478 2.338 8.630 -6.623 1.00 0.00 H new ATOM 1365 N VAL A 479 4.426 4.627 -3.517 1.00 0.00 N ATOM 1366 CA VAL A 479 5.436 4.384 -2.506 1.00 0.00 C ATOM 1367 C VAL A 479 5.727 2.911 -2.404 1.00 0.00 C ATOM 1368 O VAL A 479 4.876 2.083 -2.731 1.00 0.00 O ATOM 1369 CB VAL A 479 5.074 4.947 -1.092 1.00 0.00 C ATOM 1370 CG1 VAL A 479 5.156 6.459 -1.063 1.00 0.00 C ATOM 1371 CG2 VAL A 479 3.691 4.495 -0.657 1.00 0.00 C ATOM 0 H VAL A 479 3.696 3.915 -3.550 1.00 0.00 H new ATOM 0 HA VAL A 479 6.321 4.928 -2.836 1.00 0.00 H new ATOM 0 HB VAL A 479 5.807 4.548 -0.391 1.00 0.00 H new ATOM 0 HG11 VAL A 479 4.899 6.818 -0.067 1.00 0.00 H new ATOM 0 HG12 VAL A 479 6.170 6.773 -1.311 1.00 0.00 H new ATOM 0 HG13 VAL A 479 4.459 6.875 -1.790 1.00 0.00 H new ATOM 0 HG21 VAL A 479 3.469 4.902 0.329 1.00 0.00 H new ATOM 0 HG22 VAL A 479 2.950 4.851 -1.372 1.00 0.00 H new ATOM 0 HG23 VAL A 479 3.660 3.406 -0.615 1.00 0.00 H new ATOM 1381 N GLU A 480 6.920 2.600 -2.012 1.00 0.00 N ATOM 1382 CA GLU A 480 7.351 1.259 -1.819 1.00 0.00 C ATOM 1383 C GLU A 480 7.500 1.009 -0.335 1.00 0.00 C ATOM 1384 O GLU A 480 8.268 1.701 0.365 1.00 0.00 O ATOM 1385 CB GLU A 480 8.659 0.993 -2.587 1.00 0.00 C ATOM 1386 CG GLU A 480 9.212 -0.417 -2.438 1.00 0.00 C ATOM 1387 CD GLU A 480 10.390 -0.681 -3.345 1.00 0.00 C ATOM 1388 OE1 GLU A 480 11.528 -0.300 -3.011 1.00 0.00 O ATOM 1389 OE2 GLU A 480 10.200 -1.281 -4.421 1.00 0.00 O ATOM 0 H GLU A 480 7.640 3.294 -1.812 1.00 0.00 H new ATOM 0 HA GLU A 480 6.611 0.565 -2.217 1.00 0.00 H new ATOM 0 HB2 GLU A 480 8.489 1.191 -3.645 1.00 0.00 H new ATOM 0 HB3 GLU A 480 9.414 1.702 -2.247 1.00 0.00 H new ATOM 0 HG2 GLU A 480 9.513 -0.577 -1.403 1.00 0.00 H new ATOM 0 HG3 GLU A 480 8.423 -1.137 -2.655 1.00 0.00 H new ATOM 1396 N ILE A 481 6.735 0.070 0.144 1.00 0.00 N ATOM 1397 CA ILE A 481 6.726 -0.281 1.534 1.00 0.00 C ATOM 1398 C ILE A 481 7.595 -1.491 1.773 1.00 0.00 C ATOM 1399 O ILE A 481 8.058 -2.137 0.827 1.00 0.00 O ATOM 1400 CB ILE A 481 5.305 -0.603 2.032 1.00 0.00 C ATOM 1401 CG1 ILE A 481 4.698 -1.768 1.236 1.00 0.00 C ATOM 1402 CG2 ILE A 481 4.440 0.634 1.934 1.00 0.00 C ATOM 1403 CD1 ILE A 481 3.386 -2.257 1.787 1.00 0.00 C ATOM 0 H ILE A 481 6.093 -0.479 -0.427 1.00 0.00 H new ATOM 0 HA ILE A 481 7.109 0.580 2.082 1.00 0.00 H new ATOM 0 HB ILE A 481 5.356 -0.912 3.076 1.00 0.00 H new ATOM 0 HG12 ILE A 481 4.554 -1.454 0.202 1.00 0.00 H new ATOM 0 HG13 ILE A 481 5.407 -2.596 1.222 1.00 0.00 H new ATOM 0 HG21 ILE A 481 3.435 0.404 2.287 1.00 0.00 H new ATOM 0 HG22 ILE A 481 4.868 1.427 2.548 1.00 0.00 H new ATOM 0 HG23 ILE A 481 4.393 0.964 0.896 1.00 0.00 H new ATOM 0 HD11 ILE A 481 3.018 -3.080 1.174 1.00 0.00 H new ATOM 0 HD12 ILE A 481 3.528 -2.603 2.811 1.00 0.00 H new ATOM 0 HD13 ILE A 481 2.661 -1.443 1.776 1.00 0.00 H new ATOM 1415 N THR A 482 7.781 -1.807 3.024 1.00 0.00 N ATOM 1416 CA THR A 482 8.583 -2.922 3.457 1.00 0.00 C ATOM 1417 C THR A 482 8.014 -3.459 4.748 1.00 0.00 C ATOM 1418 O THR A 482 7.317 -2.727 5.453 1.00 0.00 O ATOM 1419 CB THR A 482 10.042 -2.485 3.693 1.00 0.00 C ATOM 1420 OG1 THR A 482 10.061 -1.158 4.263 1.00 0.00 O ATOM 1421 CG2 THR A 482 10.854 -2.519 2.413 1.00 0.00 C ATOM 0 H THR A 482 7.368 -1.282 3.795 1.00 0.00 H new ATOM 0 HA THR A 482 8.569 -3.690 2.683 1.00 0.00 H new ATOM 0 HB THR A 482 10.500 -3.190 4.387 1.00 0.00 H new ATOM 0 HG1 THR A 482 10.409 -0.523 3.602 1.00 0.00 H new ATOM 0 HG21 THR A 482 11.876 -2.204 2.622 1.00 0.00 H new ATOM 0 HG22 THR A 482 10.861 -3.533 2.014 1.00 0.00 H new ATOM 0 HG23 THR A 482 10.409 -1.844 1.682 1.00 0.00 H new ATOM 1429 N GLY A 483 8.296 -4.700 5.051 1.00 0.00 N ATOM 1430 CA GLY A 483 7.834 -5.297 6.284 1.00 0.00 C ATOM 1431 C GLY A 483 6.719 -6.287 6.060 1.00 0.00 C ATOM 1432 O GLY A 483 5.877 -6.501 6.932 1.00 0.00 O ATOM 0 H GLY A 483 8.846 -5.322 4.459 1.00 0.00 H new ATOM 0 HA2 GLY A 483 8.667 -5.798 6.777 1.00 0.00 H new ATOM 0 HA3 GLY A 483 7.490 -4.512 6.958 1.00 0.00 H new ATOM 1436 N LEU A 484 6.711 -6.896 4.899 1.00 0.00 N ATOM 1437 CA LEU A 484 5.702 -7.873 4.570 1.00 0.00 C ATOM 1438 C LEU A 484 6.259 -9.279 4.804 1.00 0.00 C ATOM 1439 O LEU A 484 5.524 -10.207 5.156 1.00 0.00 O ATOM 1440 CB LEU A 484 5.279 -7.706 3.109 1.00 0.00 C ATOM 1441 CG LEU A 484 4.088 -8.542 2.643 1.00 0.00 C ATOM 1442 CD1 LEU A 484 2.821 -8.122 3.366 1.00 0.00 C ATOM 1443 CD2 LEU A 484 3.911 -8.415 1.151 1.00 0.00 C ATOM 0 H LEU A 484 7.397 -6.731 4.162 1.00 0.00 H new ATOM 0 HA LEU A 484 4.829 -7.726 5.206 1.00 0.00 H new ATOM 0 HB2 LEU A 484 5.045 -6.655 2.940 1.00 0.00 H new ATOM 0 HB3 LEU A 484 6.133 -7.948 2.477 1.00 0.00 H new ATOM 0 HG LEU A 484 4.286 -9.587 2.883 1.00 0.00 H new ATOM 0 HD11 LEU A 484 1.986 -8.730 3.019 1.00 0.00 H new ATOM 0 HD12 LEU A 484 2.951 -8.262 4.439 1.00 0.00 H new ATOM 0 HD13 LEU A 484 2.616 -7.072 3.160 1.00 0.00 H new ATOM 0 HD21 LEU A 484 3.059 -9.016 0.833 1.00 0.00 H new ATOM 0 HD22 LEU A 484 3.735 -7.371 0.893 1.00 0.00 H new ATOM 0 HD23 LEU A 484 4.811 -8.766 0.647 1.00 0.00 H new ATOM 1455 N HIS A 485 7.582 -9.410 4.595 1.00 0.00 N ATOM 1456 CA HIS A 485 8.344 -10.668 4.747 1.00 0.00 C ATOM 1457 C HIS A 485 7.814 -11.760 3.772 1.00 0.00 C ATOM 1458 O HIS A 485 8.059 -12.961 3.930 1.00 0.00 O ATOM 1459 CB HIS A 485 8.317 -11.131 6.229 1.00 0.00 C ATOM 1460 CG HIS A 485 9.268 -12.255 6.570 1.00 0.00 C ATOM 1461 ND1 HIS A 485 8.877 -13.467 7.092 1.00 0.00 N ATOM 1462 CD2 HIS A 485 10.619 -12.306 6.496 1.00 0.00 C ATOM 1463 CE1 HIS A 485 9.965 -14.199 7.319 1.00 0.00 C ATOM 1464 NE2 HIS A 485 11.061 -13.539 6.973 1.00 0.00 N ATOM 0 H HIS A 485 8.167 -8.625 4.308 1.00 0.00 H new ATOM 0 HA HIS A 485 9.385 -10.491 4.478 1.00 0.00 H new ATOM 0 HB2 HIS A 485 8.548 -10.276 6.864 1.00 0.00 H new ATOM 0 HB3 HIS A 485 7.303 -11.447 6.476 1.00 0.00 H new ATOM 0 HD2 HIS A 485 11.255 -11.515 6.125 1.00 0.00 H new ATOM 0 HE1 HIS A 485 9.956 -15.198 7.730 1.00 0.00 H new ATOM 0 HE2 HIS A 485 12.025 -13.865 7.041 1.00 0.00 H new ATOM 1472 N ASP A 486 7.146 -11.317 2.735 1.00 0.00 N ATOM 1473 CA ASP A 486 6.566 -12.189 1.742 1.00 0.00 C ATOM 1474 C ASP A 486 6.604 -11.481 0.416 1.00 0.00 C ATOM 1475 O ASP A 486 6.833 -10.276 0.370 1.00 0.00 O ATOM 1476 CB ASP A 486 5.131 -12.541 2.128 1.00 0.00 C ATOM 1477 CG ASP A 486 4.458 -13.523 1.197 1.00 0.00 C ATOM 1478 OD1 ASP A 486 4.977 -14.632 1.009 1.00 0.00 O ATOM 1479 OD2 ASP A 486 3.417 -13.185 0.624 1.00 0.00 O ATOM 0 H ASP A 486 6.987 -10.326 2.554 1.00 0.00 H new ATOM 0 HA ASP A 486 7.130 -13.119 1.677 1.00 0.00 H new ATOM 0 HB2 ASP A 486 5.130 -12.955 3.136 1.00 0.00 H new ATOM 0 HB3 ASP A 486 4.541 -11.625 2.159 1.00 0.00 H new ATOM 1484 N VAL A 487 6.360 -12.195 -0.627 1.00 0.00 N ATOM 1485 CA VAL A 487 6.438 -11.663 -1.952 1.00 0.00 C ATOM 1486 C VAL A 487 5.050 -11.192 -2.435 1.00 0.00 C ATOM 1487 O VAL A 487 4.103 -11.984 -2.525 1.00 0.00 O ATOM 1488 CB VAL A 487 7.085 -12.698 -2.931 1.00 0.00 C ATOM 1489 CG1 VAL A 487 6.369 -14.043 -2.890 1.00 0.00 C ATOM 1490 CG2 VAL A 487 7.148 -12.154 -4.354 1.00 0.00 C ATOM 0 H VAL A 487 6.096 -13.180 -0.588 1.00 0.00 H new ATOM 0 HA VAL A 487 7.087 -10.788 -1.938 1.00 0.00 H new ATOM 0 HB VAL A 487 8.107 -12.863 -2.590 1.00 0.00 H new ATOM 0 HG11 VAL A 487 6.850 -14.732 -3.584 1.00 0.00 H new ATOM 0 HG12 VAL A 487 6.419 -14.451 -1.880 1.00 0.00 H new ATOM 0 HG13 VAL A 487 5.326 -13.909 -3.176 1.00 0.00 H new ATOM 0 HG21 VAL A 487 7.603 -12.898 -5.008 1.00 0.00 H new ATOM 0 HG22 VAL A 487 6.140 -11.931 -4.703 1.00 0.00 H new ATOM 0 HG23 VAL A 487 7.747 -11.243 -4.369 1.00 0.00 H new ATOM 1500 N PRO A 488 4.883 -9.890 -2.682 1.00 0.00 N ATOM 1501 CA PRO A 488 3.632 -9.351 -3.166 1.00 0.00 C ATOM 1502 C PRO A 488 3.526 -9.453 -4.687 1.00 0.00 C ATOM 1503 O PRO A 488 4.483 -9.841 -5.368 1.00 0.00 O ATOM 1504 CB PRO A 488 3.662 -7.883 -2.723 1.00 0.00 C ATOM 1505 CG PRO A 488 5.068 -7.601 -2.264 1.00 0.00 C ATOM 1506 CD PRO A 488 5.890 -8.835 -2.502 1.00 0.00 C ATOM 0 HA PRO A 488 2.773 -9.896 -2.775 1.00 0.00 H new ATOM 0 HB2 PRO A 488 3.383 -7.224 -3.546 1.00 0.00 H new ATOM 0 HB3 PRO A 488 2.949 -7.707 -1.918 1.00 0.00 H new ATOM 0 HG2 PRO A 488 5.485 -6.754 -2.810 1.00 0.00 H new ATOM 0 HG3 PRO A 488 5.078 -7.335 -1.207 1.00 0.00 H new ATOM 0 HD2 PRO A 488 6.524 -8.731 -3.383 1.00 0.00 H new ATOM 0 HD3 PRO A 488 6.548 -9.048 -1.659 1.00 0.00 H new ATOM 1514 N GLN A 489 2.378 -9.110 -5.220 1.00 0.00 N ATOM 1515 CA GLN A 489 2.170 -9.153 -6.645 1.00 0.00 C ATOM 1516 C GLN A 489 1.761 -7.809 -7.180 1.00 0.00 C ATOM 1517 O GLN A 489 0.951 -7.100 -6.569 1.00 0.00 O ATOM 1518 CB GLN A 489 1.146 -10.214 -7.034 1.00 0.00 C ATOM 1519 CG GLN A 489 1.651 -11.638 -6.907 1.00 0.00 C ATOM 1520 CD GLN A 489 0.604 -12.652 -7.286 1.00 0.00 C ATOM 1521 OE1 GLN A 489 -0.146 -13.127 -6.442 1.00 0.00 O ATOM 1522 NE2 GLN A 489 0.504 -12.952 -8.552 1.00 0.00 N ATOM 0 H GLN A 489 1.569 -8.796 -4.683 1.00 0.00 H new ATOM 0 HA GLN A 489 3.124 -9.425 -7.096 1.00 0.00 H new ATOM 0 HB2 GLN A 489 0.261 -10.096 -6.408 1.00 0.00 H new ATOM 0 HB3 GLN A 489 0.833 -10.041 -8.064 1.00 0.00 H new ATOM 0 HG2 GLN A 489 2.527 -11.769 -7.543 1.00 0.00 H new ATOM 0 HG3 GLN A 489 1.972 -11.817 -5.881 1.00 0.00 H new ATOM 0 HE21 GLN A 489 1.146 -12.537 -9.227 1.00 0.00 H new ATOM 0 HE22 GLN A 489 -0.217 -13.602 -8.867 1.00 0.00 H new ATOM 1531 N ALA A 490 2.346 -7.446 -8.291 1.00 0.00 N ATOM 1532 CA ALA A 490 2.016 -6.227 -8.971 1.00 0.00 C ATOM 1533 C ALA A 490 0.641 -6.364 -9.583 1.00 0.00 C ATOM 1534 O ALA A 490 0.281 -7.439 -10.068 1.00 0.00 O ATOM 1535 CB ALA A 490 3.039 -5.940 -10.046 1.00 0.00 C ATOM 0 H ALA A 490 3.072 -7.995 -8.752 1.00 0.00 H new ATOM 0 HA ALA A 490 2.019 -5.399 -8.262 1.00 0.00 H new ATOM 0 HB1 ALA A 490 2.780 -5.013 -10.557 1.00 0.00 H new ATOM 0 HB2 ALA A 490 4.025 -5.841 -9.593 1.00 0.00 H new ATOM 0 HB3 ALA A 490 3.051 -6.759 -10.765 1.00 0.00 H new ATOM 1541 N GLY A 491 -0.134 -5.318 -9.527 1.00 0.00 N ATOM 1542 CA GLY A 491 -1.458 -5.353 -10.084 1.00 0.00 C ATOM 1543 C GLY A 491 -2.473 -5.939 -9.131 1.00 0.00 C ATOM 1544 O GLY A 491 -3.654 -6.040 -9.464 1.00 0.00 O ATOM 0 H GLY A 491 0.128 -4.429 -9.101 1.00 0.00 H new ATOM 0 HA2 GLY A 491 -1.761 -4.342 -10.355 1.00 0.00 H new ATOM 0 HA3 GLY A 491 -1.446 -5.940 -11.003 1.00 0.00 H new ATOM 1548 N ASP A 492 -2.021 -6.341 -7.948 1.00 0.00 N ATOM 1549 CA ASP A 492 -2.933 -6.889 -6.965 1.00 0.00 C ATOM 1550 C ASP A 492 -3.407 -5.746 -6.090 1.00 0.00 C ATOM 1551 O ASP A 492 -3.025 -4.585 -6.299 1.00 0.00 O ATOM 1552 CB ASP A 492 -2.267 -7.950 -6.085 1.00 0.00 C ATOM 1553 CG ASP A 492 -3.249 -9.014 -5.578 1.00 0.00 C ATOM 1554 OD1 ASP A 492 -4.192 -8.686 -4.823 1.00 0.00 O ATOM 1555 OD2 ASP A 492 -3.104 -10.188 -5.948 1.00 0.00 O ATOM 0 H ASP A 492 -1.045 -6.297 -7.655 1.00 0.00 H new ATOM 0 HA ASP A 492 -3.760 -7.372 -7.486 1.00 0.00 H new ATOM 0 HB2 ASP A 492 -1.473 -8.437 -6.651 1.00 0.00 H new ATOM 0 HB3 ASP A 492 -1.796 -7.462 -5.231 1.00 0.00 H new ATOM 1560 N ARG A 493 -4.175 -6.058 -5.108 1.00 0.00 N ATOM 1561 CA ARG A 493 -4.782 -5.084 -4.269 1.00 0.00 C ATOM 1562 C ARG A 493 -4.216 -5.173 -2.874 1.00 0.00 C ATOM 1563 O ARG A 493 -3.798 -6.247 -2.417 1.00 0.00 O ATOM 1564 CB ARG A 493 -6.307 -5.280 -4.220 1.00 0.00 C ATOM 1565 CG ARG A 493 -7.055 -5.057 -5.545 1.00 0.00 C ATOM 1566 CD ARG A 493 -6.830 -6.195 -6.530 1.00 0.00 C ATOM 1567 NE ARG A 493 -7.399 -5.931 -7.848 1.00 0.00 N ATOM 1568 CZ ARG A 493 -7.416 -6.824 -8.851 1.00 0.00 C ATOM 1569 NH1 ARG A 493 -6.961 -8.057 -8.651 1.00 0.00 N ATOM 1570 NH2 ARG A 493 -7.896 -6.485 -10.040 1.00 0.00 N ATOM 0 H ARG A 493 -4.405 -7.020 -4.859 1.00 0.00 H new ATOM 0 HA ARG A 493 -4.568 -4.099 -4.684 1.00 0.00 H new ATOM 0 HB2 ARG A 493 -6.513 -6.293 -3.875 1.00 0.00 H new ATOM 0 HB3 ARG A 493 -6.718 -4.600 -3.474 1.00 0.00 H new ATOM 0 HG2 ARG A 493 -8.122 -4.957 -5.346 1.00 0.00 H new ATOM 0 HG3 ARG A 493 -6.725 -4.120 -5.993 1.00 0.00 H new ATOM 0 HD2 ARG A 493 -5.760 -6.373 -6.632 1.00 0.00 H new ATOM 0 HD3 ARG A 493 -7.268 -7.108 -6.128 1.00 0.00 H new ATOM 0 HE ARG A 493 -7.809 -5.012 -8.018 1.00 0.00 H new ATOM 0 HH11 ARG A 493 -6.599 -8.325 -7.736 1.00 0.00 H new ATOM 0 HH12 ARG A 493 -6.974 -8.735 -9.413 1.00 0.00 H new ATOM 0 HH21 ARG A 493 -8.254 -5.543 -10.196 1.00 0.00 H new ATOM 0 HH22 ARG A 493 -7.907 -7.167 -10.799 1.00 0.00 H new ATOM 1584 N PHE A 494 -4.195 -4.070 -2.204 1.00 0.00 N ATOM 1585 CA PHE A 494 -3.724 -4.016 -0.840 1.00 0.00 C ATOM 1586 C PHE A 494 -4.628 -3.095 -0.051 1.00 0.00 C ATOM 1587 O PHE A 494 -5.373 -2.311 -0.637 1.00 0.00 O ATOM 1588 CB PHE A 494 -2.267 -3.514 -0.774 1.00 0.00 C ATOM 1589 CG PHE A 494 -2.096 -2.101 -1.228 1.00 0.00 C ATOM 1590 CD1 PHE A 494 -1.920 -1.806 -2.551 1.00 0.00 C ATOM 1591 CD2 PHE A 494 -2.128 -1.071 -0.321 1.00 0.00 C ATOM 1592 CE1 PHE A 494 -1.782 -0.511 -2.960 1.00 0.00 C ATOM 1593 CE2 PHE A 494 -1.989 0.233 -0.728 1.00 0.00 C ATOM 1594 CZ PHE A 494 -1.817 0.506 -2.051 1.00 0.00 C ATOM 0 H PHE A 494 -4.502 -3.172 -2.578 1.00 0.00 H new ATOM 0 HA PHE A 494 -3.747 -5.019 -0.415 1.00 0.00 H new ATOM 0 HB2 PHE A 494 -1.908 -3.603 0.251 1.00 0.00 H new ATOM 0 HB3 PHE A 494 -1.641 -4.162 -1.388 1.00 0.00 H new ATOM 0 HD1 PHE A 494 -1.890 -2.604 -3.278 1.00 0.00 H new ATOM 0 HD2 PHE A 494 -2.264 -1.289 0.728 1.00 0.00 H new ATOM 0 HE1 PHE A 494 -1.644 -0.290 -4.008 1.00 0.00 H new ATOM 0 HE2 PHE A 494 -2.016 1.035 -0.005 1.00 0.00 H new ATOM 0 HZ PHE A 494 -1.708 1.529 -2.381 1.00 0.00 H new ATOM 1604 N MET A 495 -4.537 -3.159 1.242 1.00 0.00 N ATOM 1605 CA MET A 495 -5.341 -2.334 2.125 1.00 0.00 C ATOM 1606 C MET A 495 -4.446 -1.663 3.149 1.00 0.00 C ATOM 1607 O MET A 495 -3.585 -2.316 3.750 1.00 0.00 O ATOM 1608 CB MET A 495 -6.379 -3.199 2.839 1.00 0.00 C ATOM 1609 CG MET A 495 -7.242 -2.454 3.838 1.00 0.00 C ATOM 1610 SD MET A 495 -8.363 -3.552 4.717 1.00 0.00 S ATOM 1611 CE MET A 495 -9.164 -2.385 5.809 1.00 0.00 C ATOM 0 H MET A 495 -3.899 -3.788 1.730 1.00 0.00 H new ATOM 0 HA MET A 495 -5.853 -1.572 1.537 1.00 0.00 H new ATOM 0 HB2 MET A 495 -7.026 -3.659 2.092 1.00 0.00 H new ATOM 0 HB3 MET A 495 -5.864 -4.009 3.356 1.00 0.00 H new ATOM 0 HG2 MET A 495 -6.603 -1.939 4.555 1.00 0.00 H new ATOM 0 HG3 MET A 495 -7.818 -1.689 3.318 1.00 0.00 H new ATOM 0 HE1 MET A 495 -9.894 -2.907 6.427 1.00 0.00 H new ATOM 0 HE2 MET A 495 -8.418 -1.914 6.449 1.00 0.00 H new ATOM 0 HE3 MET A 495 -9.669 -1.621 5.218 1.00 0.00 H new ATOM 1621 N VAL A 496 -4.625 -0.365 3.324 1.00 0.00 N ATOM 1622 CA VAL A 496 -3.860 0.398 4.289 1.00 0.00 C ATOM 1623 C VAL A 496 -4.808 1.209 5.171 1.00 0.00 C ATOM 1624 O VAL A 496 -5.797 1.753 4.682 1.00 0.00 O ATOM 1625 CB VAL A 496 -2.863 1.380 3.579 1.00 0.00 C ATOM 1626 CG1 VAL A 496 -2.110 2.217 4.596 1.00 0.00 C ATOM 1627 CG2 VAL A 496 -1.875 0.605 2.745 1.00 0.00 C ATOM 0 H VAL A 496 -5.305 0.187 2.801 1.00 0.00 H new ATOM 0 HA VAL A 496 -3.287 -0.305 4.893 1.00 0.00 H new ATOM 0 HB VAL A 496 -3.444 2.042 2.938 1.00 0.00 H new ATOM 0 HG11 VAL A 496 -1.426 2.889 4.079 1.00 0.00 H new ATOM 0 HG12 VAL A 496 -2.819 2.802 5.182 1.00 0.00 H new ATOM 0 HG13 VAL A 496 -1.544 1.562 5.259 1.00 0.00 H new ATOM 0 HG21 VAL A 496 -1.189 1.297 2.257 1.00 0.00 H new ATOM 0 HG22 VAL A 496 -1.312 -0.074 3.385 1.00 0.00 H new ATOM 0 HG23 VAL A 496 -2.409 0.030 1.988 1.00 0.00 H new ATOM 1637 N PHE A 497 -4.535 1.248 6.441 1.00 0.00 N ATOM 1638 CA PHE A 497 -5.249 2.095 7.351 1.00 0.00 C ATOM 1639 C PHE A 497 -4.224 2.785 8.221 1.00 0.00 C ATOM 1640 O PHE A 497 -3.388 2.130 8.826 1.00 0.00 O ATOM 1641 CB PHE A 497 -6.329 1.329 8.176 1.00 0.00 C ATOM 1642 CG PHE A 497 -5.840 0.181 9.036 1.00 0.00 C ATOM 1643 CD1 PHE A 497 -5.725 -1.096 8.512 1.00 0.00 C ATOM 1644 CD2 PHE A 497 -5.517 0.383 10.372 1.00 0.00 C ATOM 1645 CE1 PHE A 497 -5.294 -2.147 9.296 1.00 0.00 C ATOM 1646 CE2 PHE A 497 -5.087 -0.666 11.159 1.00 0.00 C ATOM 1647 CZ PHE A 497 -4.975 -1.932 10.621 1.00 0.00 C ATOM 0 H PHE A 497 -3.804 0.688 6.879 1.00 0.00 H new ATOM 0 HA PHE A 497 -5.823 2.836 6.794 1.00 0.00 H new ATOM 0 HB2 PHE A 497 -6.836 2.046 8.822 1.00 0.00 H new ATOM 0 HB3 PHE A 497 -7.075 0.941 7.483 1.00 0.00 H new ATOM 0 HD1 PHE A 497 -5.976 -1.272 7.476 1.00 0.00 H new ATOM 0 HD2 PHE A 497 -5.603 1.371 10.799 1.00 0.00 H new ATOM 0 HE1 PHE A 497 -5.207 -3.137 8.873 1.00 0.00 H new ATOM 0 HE2 PHE A 497 -4.838 -0.496 12.196 1.00 0.00 H new ATOM 0 HZ PHE A 497 -4.638 -2.753 11.236 1.00 0.00 H new ATOM 1657 N GLU A 498 -4.253 4.090 8.218 1.00 0.00 N ATOM 1658 CA GLU A 498 -3.277 4.883 8.936 1.00 0.00 C ATOM 1659 C GLU A 498 -3.807 5.203 10.315 1.00 0.00 C ATOM 1660 O GLU A 498 -3.087 5.178 11.304 1.00 0.00 O ATOM 1661 CB GLU A 498 -2.976 6.208 8.183 1.00 0.00 C ATOM 1662 CG GLU A 498 -4.145 7.229 8.139 1.00 0.00 C ATOM 1663 CD GLU A 498 -5.315 6.847 7.249 1.00 0.00 C ATOM 1664 OE1 GLU A 498 -6.099 5.952 7.633 1.00 0.00 O ATOM 1665 OE2 GLU A 498 -5.474 7.457 6.171 1.00 0.00 O ATOM 0 H GLU A 498 -4.952 4.640 7.719 1.00 0.00 H new ATOM 0 HA GLU A 498 -2.354 4.309 9.012 1.00 0.00 H new ATOM 0 HB2 GLU A 498 -2.116 6.686 8.653 1.00 0.00 H new ATOM 0 HB3 GLU A 498 -2.688 5.967 7.160 1.00 0.00 H new ATOM 0 HG2 GLU A 498 -4.516 7.374 9.154 1.00 0.00 H new ATOM 0 HG3 GLU A 498 -3.753 8.189 7.802 1.00 0.00 H new ATOM 1672 N ASP A 499 -5.084 5.534 10.328 1.00 0.00 N ATOM 1673 CA ASP A 499 -5.865 5.907 11.488 1.00 0.00 C ATOM 1674 C ASP A 499 -5.533 7.277 11.995 1.00 0.00 C ATOM 1675 O ASP A 499 -6.226 8.253 11.694 1.00 0.00 O ATOM 1676 CB ASP A 499 -5.691 4.952 12.631 1.00 0.00 C ATOM 1677 CG ASP A 499 -6.753 5.154 13.684 1.00 0.00 C ATOM 1678 OD1 ASP A 499 -7.904 4.722 13.474 1.00 0.00 O ATOM 1679 OD2 ASP A 499 -6.464 5.764 14.744 1.00 0.00 O ATOM 0 H ASP A 499 -5.638 5.550 9.472 1.00 0.00 H new ATOM 0 HA ASP A 499 -6.896 5.884 11.136 1.00 0.00 H new ATOM 0 HB2 ASP A 499 -5.734 3.928 12.261 1.00 0.00 H new ATOM 0 HB3 ASP A 499 -4.705 5.090 13.075 1.00 0.00 H new ATOM 1684 N GLU A 500 -4.421 7.366 12.676 1.00 0.00 N ATOM 1685 CA GLU A 500 -4.136 8.505 13.474 1.00 0.00 C ATOM 1686 C GLU A 500 -3.743 9.736 12.680 1.00 0.00 C ATOM 1687 O GLU A 500 -3.990 10.860 13.137 1.00 0.00 O ATOM 1688 CB GLU A 500 -3.198 8.172 14.636 1.00 0.00 C ATOM 1689 CG GLU A 500 -1.737 7.951 14.318 1.00 0.00 C ATOM 1690 CD GLU A 500 -1.414 6.925 13.273 1.00 0.00 C ATOM 1691 OE1 GLU A 500 -1.318 5.735 13.622 1.00 0.00 O ATOM 1692 OE2 GLU A 500 -1.171 7.306 12.103 1.00 0.00 O ATOM 0 H GLU A 500 -3.697 6.648 12.686 1.00 0.00 H new ATOM 0 HA GLU A 500 -5.080 8.798 13.933 1.00 0.00 H new ATOM 0 HB2 GLU A 500 -3.264 8.981 15.363 1.00 0.00 H new ATOM 0 HB3 GLU A 500 -3.575 7.273 15.124 1.00 0.00 H new ATOM 0 HG2 GLU A 500 -1.312 8.903 14.000 1.00 0.00 H new ATOM 0 HG3 GLU A 500 -1.229 7.667 15.240 1.00 0.00 H new ATOM 1699 N LYS A 501 -3.171 9.538 11.486 1.00 0.00 N ATOM 1700 CA LYS A 501 -2.902 10.659 10.575 1.00 0.00 C ATOM 1701 C LYS A 501 -4.183 11.423 10.284 1.00 0.00 C ATOM 1702 O LYS A 501 -4.191 12.644 10.264 1.00 0.00 O ATOM 1703 CB LYS A 501 -2.288 10.199 9.239 1.00 0.00 C ATOM 1704 CG LYS A 501 -0.766 10.068 9.200 1.00 0.00 C ATOM 1705 CD LYS A 501 -0.060 11.403 9.500 1.00 0.00 C ATOM 1706 CE LYS A 501 -0.488 12.556 8.563 1.00 0.00 C ATOM 1707 NZ LYS A 501 -0.108 12.351 7.147 1.00 0.00 N ATOM 0 H LYS A 501 -2.888 8.625 11.131 1.00 0.00 H new ATOM 0 HA LYS A 501 -2.180 11.302 11.079 1.00 0.00 H new ATOM 0 HB2 LYS A 501 -2.721 9.233 8.979 1.00 0.00 H new ATOM 0 HB3 LYS A 501 -2.590 10.903 8.464 1.00 0.00 H new ATOM 0 HG2 LYS A 501 -0.449 9.320 9.926 1.00 0.00 H new ATOM 0 HG3 LYS A 501 -0.459 9.709 8.218 1.00 0.00 H new ATOM 0 HD2 LYS A 501 -0.266 11.689 10.531 1.00 0.00 H new ATOM 0 HD3 LYS A 501 1.018 11.261 9.418 1.00 0.00 H new ATOM 0 HE2 LYS A 501 -1.569 12.679 8.625 1.00 0.00 H new ATOM 0 HE3 LYS A 501 -0.041 13.485 8.918 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 0.071 13.272 6.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 0.753 11.769 7.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 -0.881 11.867 6.647 1.00 0.00 H new ATOM 1721 N LYS A 502 -5.254 10.684 10.062 1.00 0.00 N ATOM 1722 CA LYS A 502 -6.550 11.266 9.774 1.00 0.00 C ATOM 1723 C LYS A 502 -7.239 11.707 11.043 1.00 0.00 C ATOM 1724 O LYS A 502 -7.854 12.750 11.075 1.00 0.00 O ATOM 1725 CB LYS A 502 -7.427 10.279 9.006 1.00 0.00 C ATOM 1726 CG LYS A 502 -6.876 9.916 7.644 1.00 0.00 C ATOM 1727 CD LYS A 502 -6.932 11.086 6.675 1.00 0.00 C ATOM 1728 CE LYS A 502 -6.195 10.770 5.382 1.00 0.00 C ATOM 1729 NZ LYS A 502 -6.643 9.503 4.768 1.00 0.00 N ATOM 0 H LYS A 502 -5.249 9.664 10.076 1.00 0.00 H new ATOM 0 HA LYS A 502 -6.391 12.145 9.150 1.00 0.00 H new ATOM 0 HB2 LYS A 502 -7.541 9.370 9.597 1.00 0.00 H new ATOM 0 HB3 LYS A 502 -8.422 10.707 8.884 1.00 0.00 H new ATOM 0 HG2 LYS A 502 -5.844 9.581 7.748 1.00 0.00 H new ATOM 0 HG3 LYS A 502 -7.443 9.080 7.235 1.00 0.00 H new ATOM 0 HD2 LYS A 502 -7.972 11.328 6.454 1.00 0.00 H new ATOM 0 HD3 LYS A 502 -6.492 11.968 7.141 1.00 0.00 H new ATOM 0 HE2 LYS A 502 -6.345 11.585 4.674 1.00 0.00 H new ATOM 0 HE3 LYS A 502 -5.125 10.714 5.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 502 -6.238 9.417 3.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 502 -6.325 8.703 5.352 1.00 0.00 H new ATOM 0 HZ3 LYS A 502 -7.681 9.495 4.706 1.00 0.00 H new ATOM 1743 N ALA A 503 -7.073 10.929 12.097 1.00 0.00 N ATOM 1744 CA ALA A 503 -7.718 11.174 13.379 1.00 0.00 C ATOM 1745 C ALA A 503 -7.423 12.578 13.891 1.00 0.00 C ATOM 1746 O ALA A 503 -8.337 13.388 14.107 1.00 0.00 O ATOM 1747 CB ALA A 503 -7.262 10.140 14.393 1.00 0.00 C ATOM 0 H ALA A 503 -6.480 10.099 12.089 1.00 0.00 H new ATOM 0 HA ALA A 503 -8.796 11.091 13.237 1.00 0.00 H new ATOM 0 HB1 ALA A 503 -7.749 10.329 15.350 1.00 0.00 H new ATOM 0 HB2 ALA A 503 -7.529 9.143 14.041 1.00 0.00 H new ATOM 0 HB3 ALA A 503 -6.181 10.204 14.517 1.00 0.00 H new ATOM 1753 N ARG A 504 -6.154 12.887 14.022 1.00 0.00 N ATOM 1754 CA ARG A 504 -5.717 14.154 14.529 1.00 0.00 C ATOM 1755 C ARG A 504 -5.943 15.272 13.504 1.00 0.00 C ATOM 1756 O ARG A 504 -5.979 16.445 13.840 1.00 0.00 O ATOM 1757 CB ARG A 504 -4.252 14.041 14.885 1.00 0.00 C ATOM 1758 CG ARG A 504 -3.288 13.931 13.706 1.00 0.00 C ATOM 1759 CD ARG A 504 -1.872 13.762 14.200 1.00 0.00 C ATOM 1760 NE ARG A 504 -0.895 13.683 13.119 1.00 0.00 N ATOM 1761 CZ ARG A 504 0.275 13.031 13.197 1.00 0.00 C ATOM 1762 NH1 ARG A 504 0.562 12.296 14.270 1.00 0.00 N ATOM 1763 NH2 ARG A 504 1.152 13.118 12.196 1.00 0.00 N ATOM 0 H ARG A 504 -5.393 12.255 13.775 1.00 0.00 H new ATOM 0 HA ARG A 504 -6.298 14.413 15.414 1.00 0.00 H new ATOM 0 HB2 ARG A 504 -3.973 14.912 15.478 1.00 0.00 H new ATOM 0 HB3 ARG A 504 -4.119 13.166 15.522 1.00 0.00 H new ATOM 0 HG2 ARG A 504 -3.565 13.083 13.079 1.00 0.00 H new ATOM 0 HG3 ARG A 504 -3.359 14.824 13.085 1.00 0.00 H new ATOM 0 HD2 ARG A 504 -1.618 14.599 14.851 1.00 0.00 H new ATOM 0 HD3 ARG A 504 -1.810 12.857 14.805 1.00 0.00 H new ATOM 0 HE ARG A 504 -1.117 14.156 12.243 1.00 0.00 H new ATOM 0 HH11 ARG A 504 -0.109 12.228 15.036 1.00 0.00 H new ATOM 0 HH12 ARG A 504 1.452 11.802 14.326 1.00 0.00 H new ATOM 0 HH21 ARG A 504 0.933 13.679 11.373 1.00 0.00 H new ATOM 0 HH22 ARG A 504 2.042 12.623 12.253 1.00 0.00 H new ATOM 1777 N GLN A 505 -6.095 14.883 12.270 1.00 0.00 N ATOM 1778 CA GLN A 505 -6.291 15.808 11.177 1.00 0.00 C ATOM 1779 C GLN A 505 -7.761 16.245 11.116 1.00 0.00 C ATOM 1780 O GLN A 505 -8.070 17.364 10.718 1.00 0.00 O ATOM 1781 CB GLN A 505 -5.855 15.132 9.883 1.00 0.00 C ATOM 1782 CG GLN A 505 -5.720 16.028 8.671 1.00 0.00 C ATOM 1783 CD GLN A 505 -5.148 15.283 7.463 1.00 0.00 C ATOM 1784 OE1 GLN A 505 -4.336 14.275 7.698 1.00 0.00 O flip ATOM 1785 NE2 GLN A 505 -5.437 15.614 6.325 1.00 0.00 N flip ATOM 0 H GLN A 505 -6.087 13.904 11.986 1.00 0.00 H new ATOM 0 HA GLN A 505 -5.689 16.705 11.326 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -4.895 14.646 10.058 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -6.573 14.346 9.649 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -6.697 16.438 8.414 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -5.074 16.872 8.915 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -6.069 16.399 6.167 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -5.047 15.106 5.531 1.00 0.00 H new ATOM 1794 N ILE A 506 -8.654 15.357 11.522 1.00 0.00 N ATOM 1795 CA ILE A 506 -10.075 15.652 11.541 1.00 0.00 C ATOM 1796 C ILE A 506 -10.436 16.310 12.867 1.00 0.00 C ATOM 1797 O ILE A 506 -10.997 17.411 12.903 1.00 0.00 O ATOM 1798 CB ILE A 506 -10.933 14.362 11.329 1.00 0.00 C ATOM 1799 CG1 ILE A 506 -10.631 13.741 9.951 1.00 0.00 C ATOM 1800 CG2 ILE A 506 -12.428 14.673 11.460 1.00 0.00 C ATOM 1801 CD1 ILE A 506 -11.341 12.423 9.687 1.00 0.00 C ATOM 0 H ILE A 506 -8.416 14.419 11.845 1.00 0.00 H new ATOM 0 HA ILE A 506 -10.296 16.332 10.718 1.00 0.00 H new ATOM 0 HB ILE A 506 -10.667 13.643 12.104 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -10.913 14.453 9.175 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -9.556 13.584 9.864 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -13.004 13.760 11.309 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -12.631 15.070 12.455 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -12.713 15.411 10.710 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -11.072 12.057 8.696 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -11.041 11.692 10.438 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -12.419 12.574 9.738 1.00 0.00 H new ATOM 1813 N GLY A 507 -10.084 15.661 13.956 1.00 0.00 N ATOM 1814 CA GLY A 507 -10.379 16.231 15.236 1.00 0.00 C ATOM 1815 C GLY A 507 -10.569 15.216 16.335 1.00 0.00 C ATOM 1816 O GLY A 507 -11.368 15.434 17.235 1.00 0.00 O ATOM 0 H GLY A 507 -9.605 14.761 13.975 1.00 0.00 H new ATOM 0 HA2 GLY A 507 -9.570 16.906 15.516 1.00 0.00 H new ATOM 0 HA3 GLY A 507 -11.283 16.834 15.153 1.00 0.00 H new ATOM 1820 N GLU A 508 -9.855 14.095 16.261 1.00 0.00 N ATOM 1821 CA GLU A 508 -9.875 13.104 17.355 1.00 0.00 C ATOM 1822 C GLU A 508 -9.223 13.751 18.564 1.00 0.00 C ATOM 1823 O GLU A 508 -9.662 13.606 19.703 1.00 0.00 O ATOM 1824 CB GLU A 508 -9.081 11.856 16.949 1.00 0.00 C ATOM 1825 CG GLU A 508 -8.975 10.762 18.014 1.00 0.00 C ATOM 1826 CD GLU A 508 -10.306 10.162 18.385 1.00 0.00 C ATOM 1827 OE1 GLU A 508 -10.802 9.301 17.635 1.00 0.00 O ATOM 1828 OE2 GLU A 508 -10.882 10.536 19.430 1.00 0.00 O ATOM 0 H GLU A 508 -9.261 13.844 15.471 1.00 0.00 H new ATOM 0 HA GLU A 508 -10.898 12.802 17.578 1.00 0.00 H new ATOM 0 HB2 GLU A 508 -9.542 11.428 16.059 1.00 0.00 H new ATOM 0 HB3 GLU A 508 -8.074 12.164 16.669 1.00 0.00 H new ATOM 0 HG2 GLU A 508 -8.317 9.973 17.650 1.00 0.00 H new ATOM 0 HG3 GLU A 508 -8.510 11.178 18.908 1.00 0.00 H new ATOM 1835 N ALA A 509 -8.195 14.493 18.270 1.00 0.00 N ATOM 1836 CA ALA A 509 -7.456 15.242 19.221 1.00 0.00 C ATOM 1837 C ALA A 509 -7.316 16.614 18.656 1.00 0.00 C ATOM 1838 O ALA A 509 -6.736 16.782 17.579 1.00 0.00 O ATOM 1839 CB ALA A 509 -6.095 14.639 19.393 1.00 0.00 C ATOM 0 H ALA A 509 -7.841 14.591 17.318 1.00 0.00 H new ATOM 0 HA ALA A 509 -7.955 15.252 20.190 1.00 0.00 H new ATOM 0 HB1 ALA A 509 -5.531 15.217 20.124 1.00 0.00 H new ATOM 0 HB2 ALA A 509 -6.194 13.611 19.742 1.00 0.00 H new ATOM 0 HB3 ALA A 509 -5.569 14.649 18.438 1.00 0.00 H new ATOM 1845 N ARG A 510 -7.881 17.576 19.299 1.00 0.00 N ATOM 1846 CA ARG A 510 -7.816 18.916 18.791 1.00 0.00 C ATOM 1847 C ARG A 510 -6.808 19.715 19.590 1.00 0.00 C ATOM 1848 O ARG A 510 -5.848 20.266 19.034 1.00 0.00 O ATOM 1849 CB ARG A 510 -9.198 19.560 18.810 1.00 0.00 C ATOM 1850 CG ARG A 510 -10.255 18.712 18.109 1.00 0.00 C ATOM 1851 CD ARG A 510 -11.586 19.446 17.978 1.00 0.00 C ATOM 1852 NE ARG A 510 -11.439 20.647 17.148 1.00 0.00 N ATOM 1853 CZ ARG A 510 -12.424 21.410 16.666 1.00 0.00 C ATOM 1854 NH1 ARG A 510 -13.692 21.137 16.935 1.00 0.00 N ATOM 1855 NH2 ARG A 510 -12.117 22.461 15.920 1.00 0.00 N ATOM 0 H ARG A 510 -8.393 17.469 20.175 1.00 0.00 H new ATOM 0 HA ARG A 510 -7.484 18.898 17.753 1.00 0.00 H new ATOM 0 HB2 ARG A 510 -9.501 19.729 19.843 1.00 0.00 H new ATOM 0 HB3 ARG A 510 -9.145 20.537 18.330 1.00 0.00 H new ATOM 0 HG2 ARG A 510 -9.896 18.433 17.118 1.00 0.00 H new ATOM 0 HG3 ARG A 510 -10.405 17.787 18.666 1.00 0.00 H new ATOM 0 HD2 ARG A 510 -12.330 18.783 17.537 1.00 0.00 H new ATOM 0 HD3 ARG A 510 -11.952 19.724 18.966 1.00 0.00 H new ATOM 0 HE ARG A 510 -10.487 20.928 16.915 1.00 0.00 H new ATOM 0 HH11 ARG A 510 -13.928 20.334 17.518 1.00 0.00 H new ATOM 0 HH12 ARG A 510 -14.432 21.730 16.559 1.00 0.00 H new ATOM 0 HH21 ARG A 510 -11.140 22.678 15.721 1.00 0.00 H new ATOM 0 HH22 ARG A 510 -12.857 23.054 15.544 1.00 0.00 H new ATOM 1869 N ALA A 511 -7.019 19.761 20.877 1.00 0.00 N ATOM 1870 CA ALA A 511 -6.104 20.387 21.789 1.00 0.00 C ATOM 1871 C ALA A 511 -5.053 19.374 22.183 1.00 0.00 C ATOM 1872 O ALA A 511 -3.876 19.691 22.266 1.00 0.00 O ATOM 1873 CB ALA A 511 -6.843 20.883 23.024 1.00 0.00 C ATOM 0 H ALA A 511 -7.842 19.359 21.326 1.00 0.00 H new ATOM 0 HA ALA A 511 -5.634 21.245 21.309 1.00 0.00 H new ATOM 0 HB1 ALA A 511 -6.136 21.355 23.706 1.00 0.00 H new ATOM 0 HB2 ALA A 511 -7.601 21.608 22.728 1.00 0.00 H new ATOM 0 HB3 ALA A 511 -7.322 20.041 23.524 1.00 0.00 H new ATOM 1879 N GLN A 512 -5.496 18.141 22.405 1.00 0.00 N ATOM 1880 CA GLN A 512 -4.630 17.028 22.772 1.00 0.00 C ATOM 1881 C GLN A 512 -5.454 15.752 22.759 1.00 0.00 C ATOM 1882 O GLN A 512 -6.681 15.817 22.627 1.00 0.00 O ATOM 1883 CB GLN A 512 -4.025 17.246 24.163 1.00 0.00 C ATOM 1884 CG GLN A 512 -5.055 17.397 25.263 1.00 0.00 C ATOM 1885 CD GLN A 512 -4.426 17.609 26.602 1.00 0.00 C ATOM 1886 OE1 GLN A 512 -4.150 16.663 27.337 1.00 0.00 O ATOM 1887 NE2 GLN A 512 -4.179 18.831 26.934 1.00 0.00 N ATOM 0 H GLN A 512 -6.481 17.884 22.334 1.00 0.00 H new ATOM 0 HA GLN A 512 -3.810 16.955 22.057 1.00 0.00 H new ATOM 0 HB2 GLN A 512 -3.374 16.405 24.401 1.00 0.00 H new ATOM 0 HB3 GLN A 512 -3.398 18.138 24.140 1.00 0.00 H new ATOM 0 HG2 GLN A 512 -5.708 18.239 25.033 1.00 0.00 H new ATOM 0 HG3 GLN A 512 -5.682 16.506 25.295 1.00 0.00 H new ATOM 0 HE21 GLN A 512 -4.422 19.591 26.299 1.00 0.00 H new ATOM 0 HE22 GLN A 512 -3.741 19.037 27.832 1.00 0.00 H new ATOM 1896 N ARG A 513 -4.811 14.607 22.882 1.00 0.00 N ATOM 1897 CA ARG A 513 -5.547 13.347 22.909 1.00 0.00 C ATOM 1898 C ARG A 513 -5.919 12.986 24.340 1.00 0.00 C ATOM 1899 O ARG A 513 -6.846 12.203 24.564 1.00 0.00 O ATOM 1900 CB ARG A 513 -4.763 12.177 22.269 1.00 0.00 C ATOM 1901 CG ARG A 513 -3.453 11.843 22.965 1.00 0.00 C ATOM 1902 CD ARG A 513 -2.965 10.434 22.641 1.00 0.00 C ATOM 1903 NE ARG A 513 -2.619 10.208 21.231 1.00 0.00 N ATOM 1904 CZ ARG A 513 -2.572 8.990 20.652 1.00 0.00 C ATOM 1905 NH1 ARG A 513 -3.051 7.930 21.291 1.00 0.00 N ATOM 1906 NH2 ARG A 513 -2.083 8.844 19.422 1.00 0.00 N ATOM 0 H ARG A 513 -3.798 14.517 22.964 1.00 0.00 H new ATOM 0 HA ARG A 513 -6.447 13.500 22.313 1.00 0.00 H new ATOM 0 HB2 ARG A 513 -5.396 11.290 22.267 1.00 0.00 H new ATOM 0 HB3 ARG A 513 -4.555 12.422 21.227 1.00 0.00 H new ATOM 0 HG2 ARG A 513 -2.693 12.565 22.668 1.00 0.00 H new ATOM 0 HG3 ARG A 513 -3.582 11.941 24.043 1.00 0.00 H new ATOM 0 HD2 ARG A 513 -2.090 10.219 23.254 1.00 0.00 H new ATOM 0 HD3 ARG A 513 -3.739 9.722 22.929 1.00 0.00 H new ATOM 0 HE ARG A 513 -2.401 11.021 20.655 1.00 0.00 H new ATOM 0 HH11 ARG A 513 -3.456 8.035 22.221 1.00 0.00 H new ATOM 0 HH12 ARG A 513 -3.015 7.010 20.852 1.00 0.00 H new ATOM 0 HH21 ARG A 513 -1.740 9.657 18.910 1.00 0.00 H new ATOM 0 HH22 ARG A 513 -2.051 7.920 18.992 1.00 0.00 H new ATOM 1920 N GLN A 514 -5.190 13.583 25.288 1.00 0.00 N ATOM 1921 CA GLN A 514 -5.328 13.333 26.718 1.00 0.00 C ATOM 1922 C GLN A 514 -4.879 11.923 27.039 1.00 0.00 C ATOM 1923 O GLN A 514 -5.720 11.004 27.103 1.00 0.00 O ATOM 1924 CB GLN A 514 -6.749 13.591 27.247 1.00 0.00 C ATOM 1925 CG GLN A 514 -7.223 15.022 27.131 1.00 0.00 C ATOM 1926 CD GLN A 514 -8.587 15.207 27.741 1.00 0.00 C ATOM 1927 OE1 GLN A 514 -8.711 15.493 28.936 1.00 0.00 O ATOM 1928 NE2 GLN A 514 -9.619 15.029 26.960 1.00 0.00 N ATOM 1929 OXT GLN A 514 -3.661 11.710 27.192 1.00 0.00 O ATOM 0 H GLN A 514 -4.469 14.271 25.071 1.00 0.00 H new ATOM 0 HA GLN A 514 -4.685 14.048 27.231 1.00 0.00 H new ATOM 0 HB2 GLN A 514 -7.444 12.949 26.706 1.00 0.00 H new ATOM 0 HB3 GLN A 514 -6.790 13.294 28.295 1.00 0.00 H new ATOM 0 HG2 GLN A 514 -6.511 15.683 27.625 1.00 0.00 H new ATOM 0 HG3 GLN A 514 -7.251 15.312 26.081 1.00 0.00 H new ATOM 0 HE21 GLN A 514 -9.480 14.794 25.977 1.00 0.00 H new ATOM 0 HE22 GLN A 514 -10.563 15.126 27.333 1.00 0.00 H new TER 1938 GLN A 514