USER MOD reduce.3.24.130724 H: found=0, std=0, add=576, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 577 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 473 THR OG1 : rot -111:sc= 1.34 USER MOD Set 1.2: A 479 TYR OH : rot 110:sc= -1.11 USER MOD Set 2.1: A 470 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 475 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 430 ASN : amide:sc= -0.743 X(o=-1,f=-1.1) USER MOD Set 3.2: A 431 MET CE :methyl -144:sc= -0.282 (180deg=-2.21!) USER MOD Set 4.1: A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 423 TYR OH : rot 180:sc= 0 USER MOD Single : A 413 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 416 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 420 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 424 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 427 GLN : amide:sc= -6.82! C(o=-6.8!,f=-6.2!) USER MOD Single : A 429 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 433 SER OG : rot -10:sc= 0.421 USER MOD Single : A 435 GLN : amide:sc= -0.0575 X(o=-0.058,f=-0.045) USER MOD Single : A 437 LYS NZ :NH3+ -144:sc= -0.43 (180deg=-1.6) USER MOD Single : A 439 THR OG1 : rot 130:sc= -0.11 USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 445 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= -0.303 X(o=-0.3,f=-0.1) USER MOD Single : A 447 HIS : no HE2:sc= -15.2! C(o=-15!,f=-13!) USER MOD Single : A 449 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 450 ASN : amide:sc= -7.72 K(o=-7.7,f=-14!) USER MOD Single : A 456 SER OG : rot 180:sc= 0 USER MOD Single : A 461 LYS NZ :NH3+ -162:sc= -3.14 (180deg=-3.84!) USER MOD Single : A 462 THR OG1 : rot 180:sc= -0.881 USER MOD Single : A 466 CYS SG : rot 81:sc= -0.46 USER MOD Single : A 469 TYR OH : rot 48:sc= -3.76! USER MOD Single : A 471 TYR OH : rot 180:sc= 0 USER MOD Single : A 474 LYS NZ :NH3+ 179:sc= 0 (180deg=-8.07e-05) USER MOD Single : A 476 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 478 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 480 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 413 14.857 4.576 11.159 1.00 10.00 N ATOM 2 CA ASN A 413 13.455 4.961 11.049 1.00 10.00 C ATOM 3 C ASN A 413 12.548 3.737 11.137 1.00 10.00 C ATOM 4 O ASN A 413 12.631 2.830 10.310 1.00 10.00 O ATOM 5 CB ASN A 413 13.208 5.700 9.733 1.00 10.00 C ATOM 6 CG ASN A 413 12.115 6.743 9.852 1.00 10.00 C ATOM 7 OD1 ASN A 413 11.159 6.575 10.610 1.00 10.00 O ATOM 8 ND2 ASN A 413 12.251 7.831 9.102 1.00 10.00 N ATOM 0 HA ASN A 413 13.220 5.627 11.880 1.00 10.00 H new ATOM 0 HB2 ASN A 413 14.132 6.181 9.411 1.00 10.00 H new ATOM 0 HB3 ASN A 413 12.937 4.980 8.961 1.00 10.00 H new ATOM 0 HD21 ASN A 413 11.547 8.568 9.141 1.00 10.00 H new ATOM 0 HD22 ASN A 413 13.059 7.929 8.488 1.00 10.00 H new ATOM 15 N GLY A 414 11.681 3.722 12.145 1.00 10.00 N ATOM 16 CA GLY A 414 10.771 2.606 12.322 1.00 10.00 C ATOM 17 C GLY A 414 11.347 1.522 13.213 1.00 10.00 C ATOM 18 O GLY A 414 11.749 0.462 12.731 1.00 10.00 O ATOM 0 H GLY A 414 11.593 4.462 12.841 1.00 10.00 H new ATOM 0 HA2 GLY A 414 9.837 2.968 12.753 1.00 10.00 H new ATOM 0 HA3 GLY A 414 10.529 2.181 11.348 1.00 10.00 H new ATOM 22 N LEU A 415 11.388 1.789 14.514 1.00 10.00 N ATOM 23 CA LEU A 415 11.920 0.828 15.473 1.00 10.00 C ATOM 24 C LEU A 415 10.998 0.699 16.682 1.00 10.00 C ATOM 25 O LEU A 415 11.454 0.468 17.801 1.00 10.00 O ATOM 26 CB LEU A 415 13.319 1.250 15.927 1.00 10.00 C ATOM 27 CG LEU A 415 14.288 0.097 16.197 1.00 10.00 C ATOM 28 CD1 LEU A 415 14.860 -0.435 14.893 1.00 10.00 C ATOM 29 CD2 LEU A 415 15.403 0.546 17.128 1.00 10.00 C ATOM 0 H LEU A 415 11.060 2.661 14.928 1.00 10.00 H new ATOM 0 HA LEU A 415 11.983 -0.142 14.981 1.00 10.00 H new ATOM 0 HB2 LEU A 415 13.752 1.897 15.164 1.00 10.00 H new ATOM 0 HB3 LEU A 415 13.225 1.846 16.835 1.00 10.00 H new ATOM 0 HG LEU A 415 13.739 -0.709 16.684 1.00 10.00 H new ATOM 0 HD11 LEU A 415 15.547 -1.254 15.105 1.00 10.00 H new ATOM 0 HD12 LEU A 415 14.049 -0.796 14.260 1.00 10.00 H new ATOM 0 HD13 LEU A 415 15.395 0.363 14.378 1.00 10.00 H new ATOM 0 HD21 LEU A 415 16.083 -0.286 17.309 1.00 10.00 H new ATOM 0 HD22 LEU A 415 15.951 1.369 16.669 1.00 10.00 H new ATOM 0 HD23 LEU A 415 14.975 0.878 18.074 1.00 10.00 H new ATOM 41 N MET A 416 9.699 0.850 16.447 1.00 10.00 N ATOM 42 CA MET A 416 8.711 0.750 17.515 1.00 10.00 C ATOM 43 C MET A 416 7.375 0.252 16.977 1.00 10.00 C ATOM 44 O MET A 416 6.869 0.760 15.975 1.00 10.00 O ATOM 45 CB MET A 416 8.527 2.109 18.195 1.00 10.00 C ATOM 46 CG MET A 416 9.634 2.454 19.177 1.00 10.00 C ATOM 47 SD MET A 416 10.976 3.384 18.411 1.00 10.00 S ATOM 48 CE MET A 416 12.007 3.726 19.835 1.00 10.00 C ATOM 0 H MET A 416 9.306 1.042 15.526 1.00 10.00 H new ATOM 0 HA MET A 416 9.076 0.030 18.248 1.00 10.00 H new ATOM 0 HB2 MET A 416 8.477 2.884 17.430 1.00 10.00 H new ATOM 0 HB3 MET A 416 7.572 2.117 18.720 1.00 10.00 H new ATOM 0 HG2 MET A 416 9.217 3.036 19.999 1.00 10.00 H new ATOM 0 HG3 MET A 416 10.033 1.535 19.607 1.00 10.00 H new ATOM 0 HE1 MET A 416 12.881 4.297 19.523 1.00 10.00 H new ATOM 0 HE2 MET A 416 11.439 4.302 20.565 1.00 10.00 H new ATOM 0 HE3 MET A 416 12.329 2.787 20.285 1.00 10.00 H new ATOM 58 N ALA A 417 6.806 -0.744 17.648 1.00 10.00 N ATOM 59 CA ALA A 417 5.528 -1.311 17.237 1.00 10.00 C ATOM 60 C ALA A 417 5.611 -1.888 15.827 1.00 10.00 C ATOM 61 O ALA A 417 5.727 -1.149 14.850 1.00 10.00 O ATOM 62 CB ALA A 417 4.434 -0.257 17.314 1.00 10.00 C ATOM 0 H ALA A 417 7.211 -1.175 18.479 1.00 10.00 H new ATOM 0 HA ALA A 417 5.283 -2.124 17.920 1.00 10.00 H new ATOM 0 HB1 ALA A 417 3.485 -0.694 17.004 1.00 10.00 H new ATOM 0 HB2 ALA A 417 4.349 0.105 18.339 1.00 10.00 H new ATOM 0 HB3 ALA A 417 4.683 0.574 16.655 1.00 10.00 H new ATOM 68 N ASP A 418 5.551 -3.212 15.731 1.00 10.00 N ATOM 69 CA ASP A 418 5.619 -3.888 14.441 1.00 10.00 C ATOM 70 C ASP A 418 4.369 -3.605 13.611 1.00 10.00 C ATOM 71 O ASP A 418 3.300 -3.335 14.157 1.00 10.00 O ATOM 72 CB ASP A 418 5.784 -5.396 14.640 1.00 10.00 C ATOM 73 CG ASP A 418 4.708 -5.981 15.533 1.00 10.00 C ATOM 74 OD1 ASP A 418 4.852 -5.897 16.771 1.00 10.00 O ATOM 75 OD2 ASP A 418 3.721 -6.525 14.994 1.00 10.00 O ATOM 0 H ASP A 418 5.455 -3.838 16.531 1.00 10.00 H new ATOM 0 HA ASP A 418 6.485 -3.503 13.902 1.00 10.00 H new ATOM 0 HB2 ASP A 418 5.758 -5.893 13.670 1.00 10.00 H new ATOM 0 HB3 ASP A 418 6.763 -5.598 15.075 1.00 10.00 H new ATOM 80 N PRO A 419 4.490 -3.665 12.273 1.00 10.00 N ATOM 81 CA PRO A 419 3.364 -3.414 11.368 1.00 10.00 C ATOM 82 C PRO A 419 2.320 -4.527 11.419 1.00 10.00 C ATOM 83 O PRO A 419 2.553 -5.582 12.009 1.00 10.00 O ATOM 84 CB PRO A 419 4.021 -3.362 9.987 1.00 10.00 C ATOM 85 CG PRO A 419 5.258 -4.181 10.126 1.00 10.00 C ATOM 86 CD PRO A 419 5.730 -3.982 11.540 1.00 10.00 C ATOM 0 HA PRO A 419 2.825 -2.504 11.633 1.00 10.00 H new ATOM 0 HB2 PRO A 419 3.362 -3.767 9.219 1.00 10.00 H new ATOM 0 HB3 PRO A 419 4.255 -2.337 9.698 1.00 10.00 H new ATOM 0 HG2 PRO A 419 5.054 -5.233 9.927 1.00 10.00 H new ATOM 0 HG3 PRO A 419 6.018 -3.864 9.412 1.00 10.00 H new ATOM 0 HD2 PRO A 419 6.211 -4.878 11.933 1.00 10.00 H new ATOM 0 HD3 PRO A 419 6.457 -3.173 11.611 1.00 10.00 H new ATOM 94 N MET A 420 1.172 -4.282 10.798 1.00 10.00 N ATOM 95 CA MET A 420 0.094 -5.260 10.771 1.00 10.00 C ATOM 96 C MET A 420 -0.358 -5.517 9.344 1.00 10.00 C ATOM 97 O MET A 420 0.101 -6.461 8.709 1.00 10.00 O ATOM 98 CB MET A 420 -1.081 -4.771 11.620 1.00 10.00 C ATOM 99 CG MET A 420 -2.256 -5.736 11.652 1.00 10.00 C ATOM 100 SD MET A 420 -2.274 -6.759 13.136 1.00 10.00 S ATOM 101 CE MET A 420 -1.720 -8.328 12.473 1.00 10.00 C ATOM 0 H MET A 420 0.965 -3.413 10.306 1.00 10.00 H new ATOM 0 HA MET A 420 0.464 -6.197 11.188 1.00 10.00 H new ATOM 0 HB2 MET A 420 -0.735 -4.600 12.639 1.00 10.00 H new ATOM 0 HB3 MET A 420 -1.422 -3.810 11.234 1.00 10.00 H new ATOM 0 HG2 MET A 420 -3.187 -5.171 11.593 1.00 10.00 H new ATOM 0 HG3 MET A 420 -2.217 -6.379 10.773 1.00 10.00 H new ATOM 0 HE1 MET A 420 -1.679 -9.067 13.273 1.00 10.00 H new ATOM 0 HE2 MET A 420 -2.415 -8.664 11.704 1.00 10.00 H new ATOM 0 HE3 MET A 420 -0.728 -8.209 12.038 1.00 10.00 H new ATOM 111 N LYS A 421 -1.250 -4.674 8.835 1.00 10.00 N ATOM 112 CA LYS A 421 -1.746 -4.830 7.473 1.00 10.00 C ATOM 113 C LYS A 421 -0.591 -5.032 6.504 1.00 10.00 C ATOM 114 O LYS A 421 0.087 -4.079 6.122 1.00 10.00 O ATOM 115 CB LYS A 421 -2.575 -3.622 7.051 1.00 10.00 C ATOM 116 CG LYS A 421 -2.972 -3.661 5.585 1.00 10.00 C ATOM 117 CD LYS A 421 -4.209 -4.510 5.351 1.00 10.00 C ATOM 118 CE LYS A 421 -5.396 -4.026 6.172 1.00 10.00 C ATOM 119 NZ LYS A 421 -5.834 -5.044 7.167 1.00 10.00 N ATOM 0 H LYS A 421 -1.642 -3.880 9.342 1.00 10.00 H new ATOM 0 HA LYS A 421 -2.386 -5.712 7.449 1.00 10.00 H new ATOM 0 HB2 LYS A 421 -3.474 -3.573 7.665 1.00 10.00 H new ATOM 0 HB3 LYS A 421 -2.007 -2.712 7.244 1.00 10.00 H new ATOM 0 HG2 LYS A 421 -3.157 -2.646 5.233 1.00 10.00 H new ATOM 0 HG3 LYS A 421 -2.144 -4.057 4.996 1.00 10.00 H new ATOM 0 HD2 LYS A 421 -4.468 -4.490 4.292 1.00 10.00 H new ATOM 0 HD3 LYS A 421 -3.991 -5.547 5.606 1.00 10.00 H new ATOM 0 HE2 LYS A 421 -5.128 -3.104 6.689 1.00 10.00 H new ATOM 0 HE3 LYS A 421 -6.226 -3.789 5.506 1.00 10.00 H new ATOM 0 HZ1 LYS A 421 -6.644 -4.677 7.706 1.00 10.00 H new ATOM 0 HZ2 LYS A 421 -6.114 -5.915 6.672 1.00 10.00 H new ATOM 0 HZ3 LYS A 421 -5.051 -5.252 7.819 1.00 10.00 H new ATOM 133 N VAL A 422 -0.376 -6.281 6.116 1.00 10.00 N ATOM 134 CA VAL A 422 0.696 -6.626 5.201 1.00 10.00 C ATOM 135 C VAL A 422 0.733 -8.135 4.976 1.00 10.00 C ATOM 136 O VAL A 422 0.817 -8.616 3.848 1.00 10.00 O ATOM 137 CB VAL A 422 2.046 -6.119 5.742 1.00 10.00 C ATOM 138 CG1 VAL A 422 2.613 -7.051 6.806 1.00 10.00 C ATOM 139 CG2 VAL A 422 3.038 -5.921 4.611 1.00 10.00 C ATOM 0 H VAL A 422 -0.936 -7.076 6.425 1.00 10.00 H new ATOM 0 HA VAL A 422 0.510 -6.141 4.243 1.00 10.00 H new ATOM 0 HB VAL A 422 1.868 -5.154 6.216 1.00 10.00 H new ATOM 0 HG11 VAL A 422 3.566 -6.659 7.163 1.00 10.00 H new ATOM 0 HG12 VAL A 422 1.914 -7.120 7.639 1.00 10.00 H new ATOM 0 HG13 VAL A 422 2.766 -8.042 6.378 1.00 10.00 H new ATOM 0 HG21 VAL A 422 3.984 -5.563 5.016 1.00 10.00 H new ATOM 0 HG22 VAL A 422 3.199 -6.869 4.098 1.00 10.00 H new ATOM 0 HG23 VAL A 422 2.644 -5.189 3.906 1.00 10.00 H new ATOM 149 N TYR A 423 0.637 -8.859 6.075 1.00 10.00 N ATOM 150 CA TYR A 423 0.611 -10.316 6.087 1.00 10.00 C ATOM 151 C TYR A 423 -0.319 -10.858 4.999 1.00 10.00 C ATOM 152 O TYR A 423 -0.100 -11.948 4.470 1.00 10.00 O ATOM 153 CB TYR A 423 0.120 -10.780 7.465 1.00 10.00 C ATOM 154 CG TYR A 423 -1.174 -10.108 7.879 1.00 10.00 C ATOM 155 CD1 TYR A 423 -1.222 -8.736 8.044 1.00 10.00 C ATOM 156 CD2 TYR A 423 -2.343 -10.831 8.079 1.00 10.00 C ATOM 157 CE1 TYR A 423 -2.374 -8.089 8.393 1.00 10.00 C ATOM 158 CE2 TYR A 423 -3.518 -10.191 8.439 1.00 10.00 C ATOM 159 CZ TYR A 423 -3.529 -8.817 8.592 1.00 10.00 C ATOM 160 OH TYR A 423 -4.693 -8.174 8.944 1.00 10.00 O ATOM 0 H TYR A 423 0.573 -8.446 7.005 1.00 10.00 H new ATOM 0 HA TYR A 423 1.614 -10.695 5.890 1.00 10.00 H new ATOM 0 HB2 TYR A 423 -0.024 -11.860 7.450 1.00 10.00 H new ATOM 0 HB3 TYR A 423 0.888 -10.571 8.210 1.00 10.00 H new ATOM 0 HD1 TYR A 423 -0.322 -8.158 7.893 1.00 10.00 H new ATOM 0 HD2 TYR A 423 -2.336 -11.904 7.953 1.00 10.00 H new ATOM 0 HE1 TYR A 423 -2.380 -7.016 8.512 1.00 10.00 H new ATOM 0 HE2 TYR A 423 -4.420 -10.762 8.599 1.00 10.00 H new ATOM 0 HH TYR A 423 -5.413 -8.832 9.044 1.00 10.00 H new ATOM 170 N LYS A 424 -1.360 -10.092 4.677 1.00 10.00 N ATOM 171 CA LYS A 424 -2.326 -10.499 3.659 1.00 10.00 C ATOM 172 C LYS A 424 -2.203 -9.645 2.397 1.00 10.00 C ATOM 173 O LYS A 424 -3.041 -9.726 1.500 1.00 10.00 O ATOM 174 CB LYS A 424 -3.746 -10.399 4.213 1.00 10.00 C ATOM 175 CG LYS A 424 -4.115 -11.535 5.153 1.00 10.00 C ATOM 176 CD LYS A 424 -5.588 -11.894 5.042 1.00 10.00 C ATOM 177 CE LYS A 424 -5.872 -13.267 5.628 1.00 10.00 C ATOM 178 NZ LYS A 424 -6.082 -13.212 7.100 1.00 10.00 N ATOM 0 H LYS A 424 -1.556 -9.187 5.106 1.00 10.00 H new ATOM 0 HA LYS A 424 -2.111 -11.533 3.391 1.00 10.00 H new ATOM 0 HB2 LYS A 424 -3.855 -9.452 4.741 1.00 10.00 H new ATOM 0 HB3 LYS A 424 -4.451 -10.383 3.382 1.00 10.00 H new ATOM 0 HG2 LYS A 424 -3.508 -12.411 4.923 1.00 10.00 H new ATOM 0 HG3 LYS A 424 -3.886 -11.248 6.179 1.00 10.00 H new ATOM 0 HD2 LYS A 424 -6.186 -11.145 5.561 1.00 10.00 H new ATOM 0 HD3 LYS A 424 -5.891 -11.874 3.995 1.00 10.00 H new ATOM 0 HE2 LYS A 424 -6.757 -13.689 5.151 1.00 10.00 H new ATOM 0 HE3 LYS A 424 -5.040 -13.935 5.405 1.00 10.00 H new ATOM 0 HZ1 LYS A 424 -6.273 -14.169 7.459 1.00 10.00 H new ATOM 0 HZ2 LYS A 424 -5.229 -12.834 7.559 1.00 10.00 H new ATOM 0 HZ3 LYS A 424 -6.892 -12.595 7.312 1.00 10.00 H new ATOM 192 N ASP A 425 -1.159 -8.827 2.337 1.00 10.00 N ATOM 193 CA ASP A 425 -0.927 -7.957 1.191 1.00 10.00 C ATOM 194 C ASP A 425 0.337 -8.356 0.427 1.00 10.00 C ATOM 195 O ASP A 425 0.617 -7.810 -0.638 1.00 10.00 O ATOM 196 CB ASP A 425 -0.817 -6.503 1.650 1.00 10.00 C ATOM 197 CG ASP A 425 -2.112 -5.988 2.247 1.00 10.00 C ATOM 198 OD1 ASP A 425 -3.183 -6.530 1.900 1.00 10.00 O ATOM 199 OD2 ASP A 425 -2.054 -5.046 3.062 1.00 10.00 O ATOM 0 H ASP A 425 -0.457 -8.748 3.073 1.00 10.00 H new ATOM 0 HA ASP A 425 -1.776 -8.064 0.516 1.00 10.00 H new ATOM 0 HB2 ASP A 425 -0.020 -6.417 2.388 1.00 10.00 H new ATOM 0 HB3 ASP A 425 -0.536 -5.877 0.803 1.00 10.00 H new ATOM 204 N ARG A 426 1.099 -9.309 0.964 1.00 10.00 N ATOM 205 CA ARG A 426 2.322 -9.760 0.302 1.00 10.00 C ATOM 206 C ARG A 426 2.037 -10.165 -1.141 1.00 10.00 C ATOM 207 O ARG A 426 2.921 -10.124 -1.996 1.00 10.00 O ATOM 208 CB ARG A 426 2.954 -10.924 1.070 1.00 10.00 C ATOM 209 CG ARG A 426 2.128 -12.200 1.039 1.00 10.00 C ATOM 210 CD ARG A 426 3.011 -13.433 0.927 1.00 10.00 C ATOM 211 NE ARG A 426 2.334 -14.531 0.243 1.00 10.00 N ATOM 212 CZ ARG A 426 2.049 -14.531 -1.058 1.00 10.00 C ATOM 213 NH1 ARG A 426 2.382 -13.495 -1.817 1.00 10.00 N ATOM 214 NH2 ARG A 426 1.431 -15.572 -1.601 1.00 10.00 N ATOM 0 H ARG A 426 0.894 -9.779 1.846 1.00 10.00 H new ATOM 0 HA ARG A 426 3.029 -8.930 0.292 1.00 10.00 H new ATOM 0 HB2 ARG A 426 3.940 -11.130 0.652 1.00 10.00 H new ATOM 0 HB3 ARG A 426 3.104 -10.624 2.107 1.00 10.00 H new ATOM 0 HG2 ARG A 426 1.523 -12.265 1.944 1.00 10.00 H new ATOM 0 HG3 ARG A 426 1.438 -12.168 0.196 1.00 10.00 H new ATOM 0 HD2 ARG A 426 3.923 -13.178 0.388 1.00 10.00 H new ATOM 0 HD3 ARG A 426 3.310 -13.756 1.924 1.00 10.00 H new ATOM 0 HE ARG A 426 2.063 -15.346 0.794 1.00 10.00 H new ATOM 0 HH11 ARG A 426 2.859 -12.693 -1.405 1.00 10.00 H new ATOM 0 HH12 ARG A 426 2.161 -13.500 -2.813 1.00 10.00 H new ATOM 0 HH21 ARG A 426 1.174 -16.372 -1.022 1.00 10.00 H new ATOM 0 HH22 ARG A 426 1.212 -15.573 -2.597 1.00 10.00 H new ATOM 228 N GLN A 427 0.786 -10.526 -1.409 1.00 10.00 N ATOM 229 CA GLN A 427 0.366 -10.902 -2.753 1.00 10.00 C ATOM 230 C GLN A 427 -0.291 -9.710 -3.434 1.00 10.00 C ATOM 231 O GLN A 427 -1.193 -9.859 -4.256 1.00 10.00 O ATOM 232 CB GLN A 427 -0.595 -12.097 -2.710 1.00 10.00 C ATOM 233 CG GLN A 427 -1.524 -12.101 -1.503 1.00 10.00 C ATOM 234 CD GLN A 427 -0.899 -12.753 -0.282 1.00 10.00 C ATOM 235 OE1 GLN A 427 -0.520 -13.925 -0.315 1.00 10.00 O ATOM 236 NE2 GLN A 427 -0.790 -11.995 0.805 1.00 10.00 N ATOM 0 H GLN A 427 0.044 -10.566 -0.710 1.00 10.00 H new ATOM 0 HA GLN A 427 1.244 -11.201 -3.326 1.00 10.00 H new ATOM 0 HB2 GLN A 427 -1.197 -12.099 -3.619 1.00 10.00 H new ATOM 0 HB3 GLN A 427 -0.013 -13.019 -2.711 1.00 10.00 H new ATOM 0 HG2 GLN A 427 -1.801 -11.075 -1.260 1.00 10.00 H new ATOM 0 HG3 GLN A 427 -2.444 -12.627 -1.760 1.00 10.00 H new ATOM 0 HE21 GLN A 427 -1.117 -11.029 0.788 1.00 10.00 H new ATOM 0 HE22 GLN A 427 -0.379 -12.380 1.656 1.00 10.00 H new ATOM 245 N VAL A 428 0.188 -8.525 -3.076 1.00 10.00 N ATOM 246 CA VAL A 428 -0.312 -7.276 -3.628 1.00 10.00 C ATOM 247 C VAL A 428 0.738 -6.647 -4.526 1.00 10.00 C ATOM 248 O VAL A 428 0.409 -5.990 -5.514 1.00 10.00 O ATOM 249 CB VAL A 428 -0.688 -6.288 -2.512 1.00 10.00 C ATOM 250 CG1 VAL A 428 -1.092 -4.940 -3.085 1.00 10.00 C ATOM 251 CG2 VAL A 428 -1.798 -6.864 -1.651 1.00 10.00 C ATOM 0 H VAL A 428 0.936 -8.405 -2.393 1.00 10.00 H new ATOM 0 HA VAL A 428 -1.206 -7.500 -4.209 1.00 10.00 H new ATOM 0 HB VAL A 428 0.190 -6.130 -1.886 1.00 10.00 H new ATOM 0 HG11 VAL A 428 -1.352 -4.262 -2.272 1.00 10.00 H new ATOM 0 HG12 VAL A 428 -0.261 -4.522 -3.653 1.00 10.00 H new ATOM 0 HG13 VAL A 428 -1.953 -5.067 -3.741 1.00 10.00 H new ATOM 0 HG21 VAL A 428 -2.054 -6.154 -0.865 1.00 10.00 H new ATOM 0 HG22 VAL A 428 -2.676 -7.054 -2.268 1.00 10.00 H new ATOM 0 HG23 VAL A 428 -1.462 -7.798 -1.201 1.00 10.00 H new ATOM 261 N MET A 429 2.007 -6.869 -4.191 1.00 10.00 N ATOM 262 CA MET A 429 3.107 -6.337 -4.988 1.00 10.00 C ATOM 263 C MET A 429 2.860 -6.590 -6.475 1.00 10.00 C ATOM 264 O MET A 429 3.353 -5.858 -7.332 1.00 10.00 O ATOM 265 CB MET A 429 4.429 -6.978 -4.563 1.00 10.00 C ATOM 266 CG MET A 429 4.480 -8.479 -4.796 1.00 10.00 C ATOM 267 SD MET A 429 5.480 -9.340 -3.566 1.00 10.00 S ATOM 268 CE MET A 429 6.153 -10.676 -4.552 1.00 10.00 C ATOM 0 H MET A 429 2.297 -7.411 -3.377 1.00 10.00 H new ATOM 0 HA MET A 429 3.165 -5.262 -4.820 1.00 10.00 H new ATOM 0 HB2 MET A 429 5.245 -6.506 -5.111 1.00 10.00 H new ATOM 0 HB3 MET A 429 4.597 -6.777 -3.505 1.00 10.00 H new ATOM 0 HG2 MET A 429 3.467 -8.880 -4.780 1.00 10.00 H new ATOM 0 HG3 MET A 429 4.884 -8.675 -5.789 1.00 10.00 H new ATOM 0 HE1 MET A 429 6.795 -11.299 -3.930 1.00 10.00 H new ATOM 0 HE2 MET A 429 5.338 -11.280 -4.951 1.00 10.00 H new ATOM 0 HE3 MET A 429 6.736 -10.263 -5.375 1.00 10.00 H new ATOM 278 N ASN A 430 2.089 -7.636 -6.765 1.00 10.00 N ATOM 279 CA ASN A 430 1.764 -7.997 -8.137 1.00 10.00 C ATOM 280 C ASN A 430 0.255 -8.148 -8.323 1.00 10.00 C ATOM 281 O ASN A 430 -0.200 -8.844 -9.231 1.00 10.00 O ATOM 282 CB ASN A 430 2.470 -9.303 -8.505 1.00 10.00 C ATOM 283 CG ASN A 430 2.273 -9.682 -9.960 1.00 10.00 C ATOM 284 OD1 ASN A 430 1.571 -10.643 -10.275 1.00 10.00 O ATOM 285 ND2 ASN A 430 2.895 -8.926 -10.858 1.00 10.00 N ATOM 0 H ASN A 430 1.677 -8.249 -6.062 1.00 10.00 H new ATOM 0 HA ASN A 430 2.107 -7.198 -8.795 1.00 10.00 H new ATOM 0 HB2 ASN A 430 3.536 -9.206 -8.300 1.00 10.00 H new ATOM 0 HB3 ASN A 430 2.095 -10.106 -7.870 1.00 10.00 H new ATOM 0 HD21 ASN A 430 2.800 -9.133 -11.852 1.00 10.00 H new ATOM 0 HD22 ASN A 430 3.467 -8.139 -10.553 1.00 10.00 H new ATOM 292 N MET A 431 -0.520 -7.487 -7.464 1.00 10.00 N ATOM 293 CA MET A 431 -1.978 -7.548 -7.543 1.00 10.00 C ATOM 294 C MET A 431 -2.632 -6.901 -6.328 1.00 10.00 C ATOM 295 O MET A 431 -3.014 -7.587 -5.380 1.00 10.00 O ATOM 296 CB MET A 431 -2.475 -8.993 -7.666 1.00 10.00 C ATOM 297 CG MET A 431 -1.621 -10.015 -6.928 1.00 10.00 C ATOM 298 SD MET A 431 -1.030 -11.340 -7.999 1.00 10.00 S ATOM 299 CE MET A 431 0.332 -11.981 -7.028 1.00 10.00 C ATOM 0 H MET A 431 -0.163 -6.904 -6.707 1.00 10.00 H new ATOM 0 HA MET A 431 -2.262 -6.995 -8.438 1.00 10.00 H new ATOM 0 HB2 MET A 431 -3.495 -9.047 -7.286 1.00 10.00 H new ATOM 0 HB3 MET A 431 -2.513 -9.263 -8.721 1.00 10.00 H new ATOM 0 HG2 MET A 431 -0.766 -9.510 -6.478 1.00 10.00 H new ATOM 0 HG3 MET A 431 -2.202 -10.446 -6.113 1.00 10.00 H new ATOM 0 HE1 MET A 431 1.139 -12.289 -7.692 1.00 10.00 H new ATOM 0 HE2 MET A 431 0.693 -11.206 -6.352 1.00 10.00 H new ATOM 0 HE3 MET A 431 -0.007 -12.839 -6.448 1.00 10.00 H new ATOM 309 N TRP A 432 -2.793 -5.588 -6.378 1.00 10.00 N ATOM 310 CA TRP A 432 -3.443 -4.863 -5.296 1.00 10.00 C ATOM 311 C TRP A 432 -4.948 -4.986 -5.468 1.00 10.00 C ATOM 312 O TRP A 432 -5.562 -4.265 -6.255 1.00 10.00 O ATOM 313 CB TRP A 432 -3.026 -3.388 -5.276 1.00 10.00 C ATOM 314 CG TRP A 432 -1.587 -3.122 -5.642 1.00 10.00 C ATOM 315 CD1 TRP A 432 -0.984 -3.372 -6.837 1.00 10.00 C ATOM 316 CD2 TRP A 432 -0.577 -2.529 -4.810 1.00 10.00 C ATOM 317 NE1 TRP A 432 0.316 -2.943 -6.811 1.00 10.00 N ATOM 318 CE2 TRP A 432 0.593 -2.432 -5.581 1.00 10.00 C ATOM 319 CE3 TRP A 432 -0.550 -2.063 -3.499 1.00 10.00 C ATOM 320 CZ2 TRP A 432 1.771 -1.883 -5.086 1.00 10.00 C ATOM 321 CZ3 TRP A 432 0.621 -1.526 -3.001 1.00 10.00 C ATOM 322 CH2 TRP A 432 1.768 -1.435 -3.795 1.00 10.00 C ATOM 0 H TRP A 432 -2.483 -5.003 -7.154 1.00 10.00 H new ATOM 0 HA TRP A 432 -3.136 -5.296 -4.344 1.00 10.00 H new ATOM 0 HB2 TRP A 432 -3.667 -2.837 -5.964 1.00 10.00 H new ATOM 0 HB3 TRP A 432 -3.210 -2.988 -4.279 1.00 10.00 H new ATOM 0 HD1 TRP A 432 -1.463 -3.841 -7.684 1.00 10.00 H new ATOM 0 HE1 TRP A 432 0.972 -2.998 -7.590 1.00 10.00 H new ATOM 0 HE3 TRP A 432 -1.433 -2.120 -2.879 1.00 10.00 H new ATOM 0 HZ2 TRP A 432 2.657 -1.813 -5.700 1.00 10.00 H new ATOM 0 HZ3 TRP A 432 0.651 -1.171 -1.982 1.00 10.00 H new ATOM 0 HH2 TRP A 432 2.667 -1.003 -3.381 1.00 10.00 H new ATOM 333 N SER A 433 -5.522 -5.931 -4.743 1.00 10.00 N ATOM 334 CA SER A 433 -6.954 -6.201 -4.820 1.00 10.00 C ATOM 335 C SER A 433 -7.777 -4.968 -4.482 1.00 10.00 C ATOM 336 O SER A 433 -7.360 -4.131 -3.682 1.00 10.00 O ATOM 337 CB SER A 433 -7.327 -7.348 -3.878 1.00 10.00 C ATOM 338 OG SER A 433 -8.550 -7.949 -4.263 1.00 10.00 O ATOM 0 H SER A 433 -5.017 -6.530 -4.089 1.00 10.00 H new ATOM 0 HA SER A 433 -7.181 -6.485 -5.848 1.00 10.00 H new ATOM 0 HB2 SER A 433 -6.534 -8.096 -3.880 1.00 10.00 H new ATOM 0 HB3 SER A 433 -7.408 -6.973 -2.858 1.00 10.00 H new ATOM 0 HG SER A 433 -8.981 -7.402 -4.952 1.00 10.00 H new ATOM 344 N GLU A 434 -8.961 -4.867 -5.085 1.00 10.00 N ATOM 345 CA GLU A 434 -9.850 -3.739 -4.831 1.00 10.00 C ATOM 346 C GLU A 434 -10.018 -3.533 -3.330 1.00 10.00 C ATOM 347 O GLU A 434 -10.229 -2.415 -2.862 1.00 10.00 O ATOM 348 CB GLU A 434 -11.213 -3.976 -5.484 1.00 10.00 C ATOM 349 CG GLU A 434 -11.838 -5.312 -5.120 1.00 10.00 C ATOM 350 CD GLU A 434 -11.571 -6.383 -6.160 1.00 10.00 C ATOM 351 OE1 GLU A 434 -10.402 -6.805 -6.290 1.00 10.00 O ATOM 352 OE2 GLU A 434 -12.530 -6.802 -6.842 1.00 10.00 O ATOM 0 H GLU A 434 -9.324 -5.550 -5.750 1.00 10.00 H new ATOM 0 HA GLU A 434 -9.407 -2.842 -5.265 1.00 10.00 H new ATOM 0 HB2 GLU A 434 -11.891 -3.175 -5.190 1.00 10.00 H new ATOM 0 HB3 GLU A 434 -11.103 -3.919 -6.567 1.00 10.00 H new ATOM 0 HG2 GLU A 434 -11.448 -5.641 -4.157 1.00 10.00 H new ATOM 0 HG3 GLU A 434 -12.914 -5.185 -5.002 1.00 10.00 H new ATOM 359 N GLN A 435 -9.904 -4.628 -2.583 1.00 10.00 N ATOM 360 CA GLN A 435 -10.023 -4.583 -1.134 1.00 10.00 C ATOM 361 C GLN A 435 -8.667 -4.289 -0.505 1.00 10.00 C ATOM 362 O GLN A 435 -8.587 -3.671 0.558 1.00 10.00 O ATOM 363 CB GLN A 435 -10.571 -5.908 -0.602 1.00 10.00 C ATOM 364 CG GLN A 435 -11.912 -6.296 -1.201 1.00 10.00 C ATOM 365 CD GLN A 435 -12.996 -5.276 -0.912 1.00 10.00 C ATOM 366 OE1 GLN A 435 -13.670 -5.342 0.115 1.00 10.00 O ATOM 367 NE2 GLN A 435 -13.170 -4.323 -1.822 1.00 10.00 N ATOM 0 H GLN A 435 -9.729 -5.559 -2.962 1.00 10.00 H new ATOM 0 HA GLN A 435 -10.717 -3.786 -0.868 1.00 10.00 H new ATOM 0 HB2 GLN A 435 -9.849 -6.698 -0.806 1.00 10.00 H new ATOM 0 HB3 GLN A 435 -10.672 -5.841 0.481 1.00 10.00 H new ATOM 0 HG2 GLN A 435 -11.804 -6.411 -2.280 1.00 10.00 H new ATOM 0 HG3 GLN A 435 -12.216 -7.265 -0.806 1.00 10.00 H new ATOM 0 HE21 GLN A 435 -12.589 -4.306 -2.660 1.00 10.00 H new ATOM 0 HE22 GLN A 435 -13.885 -3.609 -1.682 1.00 10.00 H new ATOM 376 N GLU A 436 -7.601 -4.720 -1.175 1.00 10.00 N ATOM 377 CA GLU A 436 -6.259 -4.488 -0.692 1.00 10.00 C ATOM 378 C GLU A 436 -5.886 -3.034 -0.913 1.00 10.00 C ATOM 379 O GLU A 436 -5.538 -2.321 0.029 1.00 10.00 O ATOM 380 CB GLU A 436 -5.296 -5.441 -1.403 1.00 10.00 C ATOM 381 CG GLU A 436 -4.650 -6.449 -0.466 1.00 10.00 C ATOM 382 CD GLU A 436 -4.609 -7.848 -1.051 1.00 10.00 C ATOM 383 OE1 GLU A 436 -4.550 -7.970 -2.294 1.00 10.00 O ATOM 384 OE2 GLU A 436 -4.637 -8.821 -0.269 1.00 10.00 O ATOM 0 H GLU A 436 -7.650 -5.232 -2.056 1.00 10.00 H new ATOM 0 HA GLU A 436 -6.198 -4.686 0.378 1.00 10.00 H new ATOM 0 HB2 GLU A 436 -5.835 -5.975 -2.185 1.00 10.00 H new ATOM 0 HB3 GLU A 436 -4.516 -4.859 -1.894 1.00 10.00 H new ATOM 0 HG2 GLU A 436 -3.635 -6.126 -0.235 1.00 10.00 H new ATOM 0 HG3 GLU A 436 -5.200 -6.469 0.475 1.00 10.00 H new ATOM 391 N LYS A 437 -6.012 -2.577 -2.153 1.00 10.00 N ATOM 392 CA LYS A 437 -5.740 -1.182 -2.483 1.00 10.00 C ATOM 393 C LYS A 437 -6.577 -0.280 -1.588 1.00 10.00 C ATOM 394 O LYS A 437 -6.265 0.888 -1.396 1.00 10.00 O ATOM 395 CB LYS A 437 -6.064 -0.908 -3.953 1.00 10.00 C ATOM 396 CG LYS A 437 -5.705 0.499 -4.403 1.00 10.00 C ATOM 397 CD LYS A 437 -5.413 0.549 -5.894 1.00 10.00 C ATOM 398 CE LYS A 437 -6.621 0.121 -6.713 1.00 10.00 C ATOM 399 NZ LYS A 437 -6.663 -1.354 -6.911 1.00 10.00 N ATOM 0 H LYS A 437 -6.300 -3.150 -2.946 1.00 10.00 H new ATOM 0 HA LYS A 437 -4.682 -0.977 -2.320 1.00 10.00 H new ATOM 0 HB2 LYS A 437 -5.530 -1.627 -4.574 1.00 10.00 H new ATOM 0 HB3 LYS A 437 -7.129 -1.073 -4.119 1.00 10.00 H new ATOM 0 HG2 LYS A 437 -6.525 1.178 -4.169 1.00 10.00 H new ATOM 0 HG3 LYS A 437 -4.834 0.848 -3.849 1.00 10.00 H new ATOM 0 HD2 LYS A 437 -5.122 1.561 -6.175 1.00 10.00 H new ATOM 0 HD3 LYS A 437 -4.568 -0.101 -6.122 1.00 10.00 H new ATOM 0 HE2 LYS A 437 -7.533 0.446 -6.212 1.00 10.00 H new ATOM 0 HE3 LYS A 437 -6.596 0.617 -7.683 1.00 10.00 H new ATOM 0 HZ1 LYS A 437 -7.035 -1.567 -7.859 1.00 10.00 H new ATOM 0 HZ2 LYS A 437 -5.703 -1.744 -6.820 1.00 10.00 H new ATOM 0 HZ3 LYS A 437 -7.281 -1.783 -6.193 1.00 10.00 H new ATOM 413 N GLU A 438 -7.638 -0.850 -1.029 1.00 10.00 N ATOM 414 CA GLU A 438 -8.523 -0.114 -0.144 1.00 10.00 C ATOM 415 C GLU A 438 -7.786 0.362 1.099 1.00 10.00 C ATOM 416 O GLU A 438 -8.160 1.366 1.702 1.00 10.00 O ATOM 417 CB GLU A 438 -9.705 -0.991 0.264 1.00 10.00 C ATOM 418 CG GLU A 438 -11.005 -0.223 0.432 1.00 10.00 C ATOM 419 CD GLU A 438 -11.825 -0.715 1.608 1.00 10.00 C ATOM 420 OE1 GLU A 438 -12.649 -1.635 1.415 1.00 10.00 O ATOM 421 OE2 GLU A 438 -11.643 -0.182 2.723 1.00 10.00 O ATOM 0 H GLU A 438 -7.904 -1.824 -1.176 1.00 10.00 H new ATOM 0 HA GLU A 438 -8.887 0.760 -0.684 1.00 10.00 H new ATOM 0 HB2 GLU A 438 -9.846 -1.768 -0.488 1.00 10.00 H new ATOM 0 HB3 GLU A 438 -9.467 -1.494 1.201 1.00 10.00 H new ATOM 0 HG2 GLU A 438 -10.783 0.836 0.567 1.00 10.00 H new ATOM 0 HG3 GLU A 438 -11.595 -0.311 -0.480 1.00 10.00 H new ATOM 428 N THR A 439 -6.746 -0.365 1.495 1.00 10.00 N ATOM 429 CA THR A 439 -5.985 0.002 2.682 1.00 10.00 C ATOM 430 C THR A 439 -4.851 0.970 2.350 1.00 10.00 C ATOM 431 O THR A 439 -4.706 2.008 2.995 1.00 10.00 O ATOM 432 CB THR A 439 -5.431 -1.245 3.368 1.00 10.00 C ATOM 433 OG1 THR A 439 -6.477 -2.141 3.697 1.00 10.00 O ATOM 434 CG2 THR A 439 -4.675 -0.933 4.642 1.00 10.00 C ATOM 0 H THR A 439 -6.414 -1.203 1.017 1.00 10.00 H new ATOM 0 HA THR A 439 -6.667 0.510 3.364 1.00 10.00 H new ATOM 0 HB THR A 439 -4.741 -1.692 2.652 1.00 10.00 H new ATOM 0 HG1 THR A 439 -6.252 -3.039 3.375 1.00 10.00 H new ATOM 0 HG21 THR A 439 -4.306 -1.859 5.082 1.00 10.00 H new ATOM 0 HG22 THR A 439 -3.833 -0.279 4.415 1.00 10.00 H new ATOM 0 HG23 THR A 439 -5.341 -0.436 5.348 1.00 10.00 H new ATOM 442 N PHE A 440 -4.048 0.632 1.347 1.00 10.00 N ATOM 443 CA PHE A 440 -2.936 1.478 0.946 1.00 10.00 C ATOM 444 C PHE A 440 -3.445 2.730 0.239 1.00 10.00 C ATOM 445 O PHE A 440 -2.851 3.801 0.353 1.00 10.00 O ATOM 446 CB PHE A 440 -1.977 0.707 0.031 1.00 10.00 C ATOM 447 CG PHE A 440 -2.355 -0.721 -0.182 1.00 10.00 C ATOM 448 CD1 PHE A 440 -2.306 -1.646 0.847 1.00 10.00 C ATOM 449 CD2 PHE A 440 -2.779 -1.128 -1.420 1.00 10.00 C ATOM 450 CE1 PHE A 440 -2.673 -2.952 0.622 1.00 10.00 C ATOM 451 CE2 PHE A 440 -3.149 -2.425 -1.648 1.00 10.00 C ATOM 452 CZ PHE A 440 -3.094 -3.332 -0.634 1.00 10.00 C ATOM 0 H PHE A 440 -4.148 -0.222 0.799 1.00 10.00 H new ATOM 0 HA PHE A 440 -2.395 1.780 1.843 1.00 10.00 H new ATOM 0 HB2 PHE A 440 -1.933 1.208 -0.936 1.00 10.00 H new ATOM 0 HB3 PHE A 440 -0.974 0.747 0.457 1.00 10.00 H new ATOM 0 HD1 PHE A 440 -1.978 -1.341 1.830 1.00 10.00 H new ATOM 0 HD2 PHE A 440 -2.822 -0.413 -2.229 1.00 10.00 H new ATOM 0 HE1 PHE A 440 -2.632 -3.675 1.424 1.00 10.00 H new ATOM 0 HE2 PHE A 440 -3.484 -2.729 -2.629 1.00 10.00 H new ATOM 0 HZ PHE A 440 -3.382 -4.357 -0.815 1.00 10.00 H new ATOM 462 N ARG A 441 -4.556 2.592 -0.483 1.00 10.00 N ATOM 463 CA ARG A 441 -5.141 3.723 -1.193 1.00 10.00 C ATOM 464 C ARG A 441 -5.893 4.629 -0.224 1.00 10.00 C ATOM 465 O ARG A 441 -5.994 5.836 -0.439 1.00 10.00 O ATOM 466 CB ARG A 441 -6.084 3.253 -2.301 1.00 10.00 C ATOM 467 CG ARG A 441 -6.437 4.342 -3.301 1.00 10.00 C ATOM 468 CD ARG A 441 -7.611 5.182 -2.822 1.00 10.00 C ATOM 469 NE ARG A 441 -8.817 4.935 -3.609 1.00 10.00 N ATOM 470 CZ ARG A 441 -10.018 5.420 -3.296 1.00 10.00 C ATOM 471 NH1 ARG A 441 -10.175 6.175 -2.217 1.00 10.00 N ATOM 472 NH2 ARG A 441 -11.062 5.147 -4.066 1.00 10.00 N ATOM 0 H ARG A 441 -5.064 1.714 -0.590 1.00 10.00 H new ATOM 0 HA ARG A 441 -4.327 4.285 -1.650 1.00 10.00 H new ATOM 0 HB2 ARG A 441 -5.622 2.420 -2.831 1.00 10.00 H new ATOM 0 HB3 ARG A 441 -7.001 2.874 -1.850 1.00 10.00 H new ATOM 0 HG2 ARG A 441 -5.571 4.984 -3.462 1.00 10.00 H new ATOM 0 HG3 ARG A 441 -6.681 3.889 -4.262 1.00 10.00 H new ATOM 0 HD2 ARG A 441 -7.811 4.962 -1.773 1.00 10.00 H new ATOM 0 HD3 ARG A 441 -7.349 6.238 -2.881 1.00 10.00 H new ATOM 0 HE ARG A 441 -8.735 4.358 -4.446 1.00 10.00 H new ATOM 0 HH11 ARG A 441 -9.374 6.387 -1.622 1.00 10.00 H new ATOM 0 HH12 ARG A 441 -11.097 6.544 -1.982 1.00 10.00 H new ATOM 0 HH21 ARG A 441 -10.945 4.567 -4.897 1.00 10.00 H new ATOM 0 HH22 ARG A 441 -11.982 5.517 -3.828 1.00 10.00 H new ATOM 486 N GLU A 442 -6.420 4.036 0.849 1.00 10.00 N ATOM 487 CA GLU A 442 -7.160 4.795 1.851 1.00 10.00 C ATOM 488 C GLU A 442 -6.206 5.520 2.788 1.00 10.00 C ATOM 489 O GLU A 442 -6.471 6.646 3.207 1.00 10.00 O ATOM 490 CB GLU A 442 -8.085 3.876 2.652 1.00 10.00 C ATOM 491 CG GLU A 442 -8.838 4.586 3.766 1.00 10.00 C ATOM 492 CD GLU A 442 -9.662 3.635 4.611 1.00 10.00 C ATOM 493 OE1 GLU A 442 -9.097 3.031 5.548 1.00 10.00 O ATOM 494 OE2 GLU A 442 -10.872 3.492 4.336 1.00 10.00 O ATOM 0 H GLU A 442 -6.347 3.037 1.043 1.00 10.00 H new ATOM 0 HA GLU A 442 -7.769 5.535 1.331 1.00 10.00 H new ATOM 0 HB2 GLU A 442 -8.805 3.419 1.973 1.00 10.00 H new ATOM 0 HB3 GLU A 442 -7.495 3.067 3.083 1.00 10.00 H new ATOM 0 HG2 GLU A 442 -8.126 5.110 4.404 1.00 10.00 H new ATOM 0 HG3 GLU A 442 -9.493 5.342 3.332 1.00 10.00 H new ATOM 501 N LYS A 443 -5.086 4.878 3.104 1.00 10.00 N ATOM 502 CA LYS A 443 -4.098 5.481 3.975 1.00 10.00 C ATOM 503 C LYS A 443 -3.448 6.654 3.263 1.00 10.00 C ATOM 504 O LYS A 443 -3.242 7.712 3.847 1.00 10.00 O ATOM 505 CB LYS A 443 -3.042 4.453 4.382 1.00 10.00 C ATOM 506 CG LYS A 443 -3.513 3.493 5.463 1.00 10.00 C ATOM 507 CD LYS A 443 -3.510 4.151 6.833 1.00 10.00 C ATOM 508 CE LYS A 443 -4.480 3.467 7.783 1.00 10.00 C ATOM 509 NZ LYS A 443 -3.915 2.207 8.340 1.00 10.00 N ATOM 0 H LYS A 443 -4.846 3.945 2.769 1.00 10.00 H new ATOM 0 HA LYS A 443 -4.590 5.837 4.880 1.00 10.00 H new ATOM 0 HB2 LYS A 443 -2.746 3.880 3.503 1.00 10.00 H new ATOM 0 HB3 LYS A 443 -2.154 4.977 4.735 1.00 10.00 H new ATOM 0 HG2 LYS A 443 -4.519 3.144 5.228 1.00 10.00 H new ATOM 0 HG3 LYS A 443 -2.867 2.615 5.478 1.00 10.00 H new ATOM 0 HD2 LYS A 443 -2.504 4.117 7.252 1.00 10.00 H new ATOM 0 HD3 LYS A 443 -3.778 5.203 6.733 1.00 10.00 H new ATOM 0 HE2 LYS A 443 -4.728 4.146 8.599 1.00 10.00 H new ATOM 0 HE3 LYS A 443 -5.409 3.247 7.257 1.00 10.00 H new ATOM 0 HZ1 LYS A 443 -4.607 1.771 8.983 1.00 10.00 H new ATOM 0 HZ2 LYS A 443 -3.701 1.549 7.563 1.00 10.00 H new ATOM 0 HZ3 LYS A 443 -3.042 2.420 8.864 1.00 10.00 H new ATOM 523 N PHE A 444 -3.157 6.468 1.980 1.00 10.00 N ATOM 524 CA PHE A 444 -2.561 7.521 1.181 1.00 10.00 C ATOM 525 C PHE A 444 -3.545 8.667 1.078 1.00 10.00 C ATOM 526 O PHE A 444 -3.161 9.837 1.054 1.00 10.00 O ATOM 527 CB PHE A 444 -2.174 6.980 -0.193 1.00 10.00 C ATOM 528 CG PHE A 444 -1.477 7.980 -1.066 1.00 10.00 C ATOM 529 CD1 PHE A 444 -2.150 9.087 -1.560 1.00 10.00 C ATOM 530 CD2 PHE A 444 -0.145 7.808 -1.395 1.00 10.00 C ATOM 531 CE1 PHE A 444 -1.503 10.004 -2.367 1.00 10.00 C ATOM 532 CE2 PHE A 444 0.509 8.721 -2.199 1.00 10.00 C ATOM 533 CZ PHE A 444 -0.171 9.821 -2.687 1.00 10.00 C ATOM 0 H PHE A 444 -3.326 5.597 1.476 1.00 10.00 H new ATOM 0 HA PHE A 444 -1.649 7.887 1.652 1.00 10.00 H new ATOM 0 HB2 PHE A 444 -1.526 6.113 -0.062 1.00 10.00 H new ATOM 0 HB3 PHE A 444 -3.073 6.632 -0.702 1.00 10.00 H new ATOM 0 HD1 PHE A 444 -3.191 9.234 -1.312 1.00 10.00 H new ATOM 0 HD2 PHE A 444 0.391 6.949 -1.019 1.00 10.00 H new ATOM 0 HE1 PHE A 444 -2.038 10.862 -2.747 1.00 10.00 H new ATOM 0 HE2 PHE A 444 1.550 8.576 -2.446 1.00 10.00 H new ATOM 0 HZ PHE A 444 0.337 10.536 -3.317 1.00 10.00 H new ATOM 543 N MET A 445 -4.826 8.320 1.085 1.00 10.00 N ATOM 544 CA MET A 445 -5.871 9.318 1.066 1.00 10.00 C ATOM 545 C MET A 445 -5.952 9.940 2.456 1.00 10.00 C ATOM 546 O MET A 445 -6.293 11.112 2.620 1.00 10.00 O ATOM 547 CB MET A 445 -7.213 8.695 0.673 1.00 10.00 C ATOM 548 CG MET A 445 -8.379 9.670 0.735 1.00 10.00 C ATOM 549 SD MET A 445 -9.534 9.462 -0.634 1.00 10.00 S ATOM 550 CE MET A 445 -9.899 11.170 -1.031 1.00 10.00 C ATOM 0 H MET A 445 -5.159 7.356 1.104 1.00 10.00 H new ATOM 0 HA MET A 445 -5.642 10.083 0.325 1.00 10.00 H new ATOM 0 HB2 MET A 445 -7.137 8.297 -0.339 1.00 10.00 H new ATOM 0 HB3 MET A 445 -7.420 7.852 1.332 1.00 10.00 H new ATOM 0 HG2 MET A 445 -8.910 9.535 1.677 1.00 10.00 H new ATOM 0 HG3 MET A 445 -7.995 10.690 0.729 1.00 10.00 H new ATOM 0 HE1 MET A 445 -10.603 11.208 -1.862 1.00 10.00 H new ATOM 0 HE2 MET A 445 -10.337 11.660 -0.162 1.00 10.00 H new ATOM 0 HE3 MET A 445 -8.979 11.683 -1.311 1.00 10.00 H new ATOM 560 N GLN A 446 -5.594 9.125 3.449 1.00 10.00 N ATOM 561 CA GLN A 446 -5.569 9.537 4.844 1.00 10.00 C ATOM 562 C GLN A 446 -4.394 10.469 5.087 1.00 10.00 C ATOM 563 O GLN A 446 -4.479 11.428 5.853 1.00 10.00 O ATOM 564 CB GLN A 446 -5.416 8.302 5.738 1.00 10.00 C ATOM 565 CG GLN A 446 -5.824 8.536 7.182 1.00 10.00 C ATOM 566 CD GLN A 446 -6.497 7.326 7.800 1.00 10.00 C ATOM 567 OE1 GLN A 446 -6.115 6.871 8.878 1.00 10.00 O ATOM 568 NE2 GLN A 446 -7.505 6.797 7.117 1.00 10.00 N ATOM 0 H GLN A 446 -5.312 8.156 3.302 1.00 10.00 H new ATOM 0 HA GLN A 446 -6.499 10.054 5.078 1.00 10.00 H new ATOM 0 HB2 GLN A 446 -6.017 7.491 5.327 1.00 10.00 H new ATOM 0 HB3 GLN A 446 -4.377 7.973 5.713 1.00 10.00 H new ATOM 0 HG2 GLN A 446 -4.942 8.795 7.768 1.00 10.00 H new ATOM 0 HG3 GLN A 446 -6.501 9.389 7.231 1.00 10.00 H new ATOM 0 HE21 GLN A 446 -7.789 7.207 6.227 1.00 10.00 H new ATOM 0 HE22 GLN A 446 -7.996 5.981 7.482 1.00 10.00 H new ATOM 577 N HIS A 447 -3.289 10.150 4.428 1.00 10.00 N ATOM 578 CA HIS A 447 -2.061 10.913 4.549 1.00 10.00 C ATOM 579 C HIS A 447 -1.797 11.713 3.272 1.00 10.00 C ATOM 580 O HIS A 447 -1.274 11.182 2.292 1.00 10.00 O ATOM 581 CB HIS A 447 -0.910 9.948 4.848 1.00 10.00 C ATOM 582 CG HIS A 447 -1.244 8.971 5.939 1.00 10.00 C ATOM 583 ND1 HIS A 447 -1.311 9.336 7.267 1.00 10.00 N ATOM 584 CD2 HIS A 447 -1.564 7.648 5.900 1.00 10.00 C ATOM 585 CE1 HIS A 447 -1.655 8.289 7.994 1.00 10.00 C ATOM 586 NE2 HIS A 447 -1.817 7.255 7.190 1.00 10.00 N ATOM 0 H HIS A 447 -3.222 9.353 3.794 1.00 10.00 H new ATOM 0 HA HIS A 447 -2.149 11.629 5.366 1.00 10.00 H new ATOM 0 HB2 HIS A 447 -0.655 9.401 3.941 1.00 10.00 H new ATOM 0 HB3 HIS A 447 -0.027 10.519 5.135 1.00 10.00 H new ATOM 0 HD1 HIS A 447 -1.124 10.270 7.631 1.00 10.00 H new ATOM 0 HD2 HIS A 447 -1.610 7.025 5.019 1.00 10.00 H new ATOM 0 HE1 HIS A 447 -1.782 8.280 9.066 1.00 10.00 H new ATOM 595 N PRO A 448 -2.177 13.006 3.267 1.00 10.00 N ATOM 596 CA PRO A 448 -2.006 13.892 2.111 1.00 10.00 C ATOM 597 C PRO A 448 -0.693 13.679 1.363 1.00 10.00 C ATOM 598 O PRO A 448 0.333 14.261 1.714 1.00 10.00 O ATOM 599 CB PRO A 448 -2.041 15.277 2.749 1.00 10.00 C ATOM 600 CG PRO A 448 -2.970 15.130 3.904 1.00 10.00 C ATOM 601 CD PRO A 448 -2.823 13.710 4.395 1.00 10.00 C ATOM 0 HA PRO A 448 -2.769 13.718 1.352 1.00 10.00 H new ATOM 0 HB2 PRO A 448 -1.049 15.590 3.075 1.00 10.00 H new ATOM 0 HB3 PRO A 448 -2.398 16.030 2.046 1.00 10.00 H new ATOM 0 HG2 PRO A 448 -2.723 15.841 4.693 1.00 10.00 H new ATOM 0 HG3 PRO A 448 -3.998 15.332 3.603 1.00 10.00 H new ATOM 0 HD2 PRO A 448 -2.214 13.661 5.297 1.00 10.00 H new ATOM 0 HD3 PRO A 448 -3.790 13.270 4.639 1.00 10.00 H new ATOM 609 N LYS A 449 -0.745 12.851 0.321 1.00 10.00 N ATOM 610 CA LYS A 449 0.426 12.557 -0.507 1.00 10.00 C ATOM 611 C LYS A 449 1.685 12.363 0.334 1.00 10.00 C ATOM 612 O LYS A 449 2.345 13.330 0.714 1.00 10.00 O ATOM 613 CB LYS A 449 0.649 13.681 -1.521 1.00 10.00 C ATOM 614 CG LYS A 449 -0.096 13.473 -2.830 1.00 10.00 C ATOM 615 CD LYS A 449 0.753 13.878 -4.025 1.00 10.00 C ATOM 616 CE LYS A 449 1.669 12.747 -4.465 1.00 10.00 C ATOM 617 NZ LYS A 449 3.000 13.250 -4.904 1.00 10.00 N ATOM 0 H LYS A 449 -1.594 12.367 0.027 1.00 10.00 H new ATOM 0 HA LYS A 449 0.229 11.622 -1.032 1.00 10.00 H new ATOM 0 HB2 LYS A 449 0.334 14.626 -1.079 1.00 10.00 H new ATOM 0 HB3 LYS A 449 1.716 13.766 -1.729 1.00 10.00 H new ATOM 0 HG2 LYS A 449 -0.383 12.426 -2.924 1.00 10.00 H new ATOM 0 HG3 LYS A 449 -1.017 14.056 -2.822 1.00 10.00 H new ATOM 0 HD2 LYS A 449 0.105 14.166 -4.853 1.00 10.00 H new ATOM 0 HD3 LYS A 449 1.350 14.753 -3.769 1.00 10.00 H new ATOM 0 HE2 LYS A 449 1.800 12.044 -3.642 1.00 10.00 H new ATOM 0 HE3 LYS A 449 1.201 12.198 -5.282 1.00 10.00 H new ATOM 0 HZ1 LYS A 449 3.595 12.449 -5.196 1.00 10.00 H new ATOM 0 HZ2 LYS A 449 2.878 13.901 -5.706 1.00 10.00 H new ATOM 0 HZ3 LYS A 449 3.458 13.752 -4.117 1.00 10.00 H new ATOM 631 N ASN A 450 2.019 11.109 0.612 1.00 10.00 N ATOM 632 CA ASN A 450 3.204 10.797 1.399 1.00 10.00 C ATOM 633 C ASN A 450 3.927 9.575 0.846 1.00 10.00 C ATOM 634 O ASN A 450 5.109 9.641 0.507 1.00 10.00 O ATOM 635 CB ASN A 450 2.832 10.569 2.869 1.00 10.00 C ATOM 636 CG ASN A 450 1.640 9.647 3.039 1.00 10.00 C ATOM 637 OD1 ASN A 450 0.701 9.673 2.244 1.00 10.00 O ATOM 638 ND2 ASN A 450 1.673 8.822 4.080 1.00 10.00 N ATOM 0 H ASN A 450 1.488 10.294 0.305 1.00 10.00 H new ATOM 0 HA ASN A 450 3.879 11.651 1.335 1.00 10.00 H new ATOM 0 HB2 ASN A 450 3.689 10.148 3.394 1.00 10.00 H new ATOM 0 HB3 ASN A 450 2.612 11.529 3.336 1.00 10.00 H new ATOM 0 HD21 ASN A 450 0.900 8.177 4.244 1.00 10.00 H new ATOM 0 HD22 ASN A 450 2.471 8.833 4.715 1.00 10.00 H new ATOM 645 N PHE A 451 3.212 8.459 0.763 1.00 10.00 N ATOM 646 CA PHE A 451 3.783 7.213 0.258 1.00 10.00 C ATOM 647 C PHE A 451 4.825 6.648 1.226 1.00 10.00 C ATOM 648 O PHE A 451 5.406 5.593 0.973 1.00 10.00 O ATOM 649 CB PHE A 451 4.405 7.435 -1.130 1.00 10.00 C ATOM 650 CG PHE A 451 3.753 6.656 -2.247 1.00 10.00 C ATOM 651 CD1 PHE A 451 2.482 6.119 -2.104 1.00 10.00 C ATOM 652 CD2 PHE A 451 4.419 6.470 -3.449 1.00 10.00 C ATOM 653 CE1 PHE A 451 1.891 5.413 -3.132 1.00 10.00 C ATOM 654 CE2 PHE A 451 3.832 5.763 -4.481 1.00 10.00 C ATOM 655 CZ PHE A 451 2.567 5.233 -4.322 1.00 10.00 C ATOM 0 H PHE A 451 2.233 8.390 1.040 1.00 10.00 H new ATOM 0 HA PHE A 451 2.977 6.484 0.171 1.00 10.00 H new ATOM 0 HB2 PHE A 451 4.355 8.497 -1.369 1.00 10.00 H new ATOM 0 HB3 PHE A 451 5.461 7.167 -1.087 1.00 10.00 H new ATOM 0 HD1 PHE A 451 1.948 6.255 -1.175 1.00 10.00 H new ATOM 0 HD2 PHE A 451 5.408 6.883 -3.580 1.00 10.00 H new ATOM 0 HE1 PHE A 451 0.900 5.002 -3.006 1.00 10.00 H new ATOM 0 HE2 PHE A 451 4.362 5.625 -5.412 1.00 10.00 H new ATOM 0 HZ PHE A 451 2.107 4.679 -5.127 1.00 10.00 H new ATOM 665 N GLY A 452 5.045 7.344 2.340 1.00 10.00 N ATOM 666 CA GLY A 452 6.000 6.884 3.326 1.00 10.00 C ATOM 667 C GLY A 452 5.338 6.043 4.396 1.00 10.00 C ATOM 668 O GLY A 452 5.861 4.999 4.785 1.00 10.00 O ATOM 0 H GLY A 452 4.576 8.219 2.574 1.00 10.00 H new ATOM 0 HA2 GLY A 452 6.778 6.301 2.834 1.00 10.00 H new ATOM 0 HA3 GLY A 452 6.488 7.742 3.788 1.00 10.00 H new ATOM 672 N LEU A 453 4.175 6.491 4.866 1.00 10.00 N ATOM 673 CA LEU A 453 3.440 5.758 5.888 1.00 10.00 C ATOM 674 C LEU A 453 2.868 4.478 5.309 1.00 10.00 C ATOM 675 O LEU A 453 3.070 3.393 5.854 1.00 10.00 O ATOM 676 CB LEU A 453 2.310 6.602 6.475 1.00 10.00 C ATOM 677 CG LEU A 453 1.312 5.817 7.333 1.00 10.00 C ATOM 678 CD1 LEU A 453 0.744 6.694 8.433 1.00 10.00 C ATOM 679 CD2 LEU A 453 0.201 5.235 6.465 1.00 10.00 C ATOM 0 H LEU A 453 3.726 7.353 4.556 1.00 10.00 H new ATOM 0 HA LEU A 453 4.140 5.516 6.687 1.00 10.00 H new ATOM 0 HB2 LEU A 453 2.744 7.397 7.081 1.00 10.00 H new ATOM 0 HB3 LEU A 453 1.770 7.082 5.659 1.00 10.00 H new ATOM 0 HG LEU A 453 1.840 4.988 7.805 1.00 10.00 H new ATOM 0 HD11 LEU A 453 0.038 6.117 9.030 1.00 10.00 H new ATOM 0 HD12 LEU A 453 1.554 7.048 9.071 1.00 10.00 H new ATOM 0 HD13 LEU A 453 0.232 7.548 7.990 1.00 10.00 H new ATOM 0 HD21 LEU A 453 -0.498 4.681 7.092 1.00 10.00 H new ATOM 0 HD22 LEU A 453 -0.327 6.043 5.959 1.00 10.00 H new ATOM 0 HD23 LEU A 453 0.633 4.564 5.723 1.00 10.00 H new ATOM 691 N ILE A 454 2.156 4.607 4.196 1.00 10.00 N ATOM 692 CA ILE A 454 1.563 3.453 3.547 1.00 10.00 C ATOM 693 C ILE A 454 2.622 2.397 3.301 1.00 10.00 C ATOM 694 O ILE A 454 2.458 1.243 3.680 1.00 10.00 O ATOM 695 CB ILE A 454 0.873 3.856 2.233 1.00 10.00 C ATOM 696 CG1 ILE A 454 -0.468 4.481 2.563 1.00 10.00 C ATOM 697 CG2 ILE A 454 0.702 2.665 1.296 1.00 10.00 C ATOM 698 CD1 ILE A 454 -0.406 5.989 2.599 1.00 10.00 C ATOM 0 H ILE A 454 1.978 5.496 3.729 1.00 10.00 H new ATOM 0 HA ILE A 454 0.801 3.036 4.205 1.00 10.00 H new ATOM 0 HB ILE A 454 1.500 4.578 1.709 1.00 10.00 H new ATOM 0 HG12 ILE A 454 -1.204 4.168 1.823 1.00 10.00 H new ATOM 0 HG13 ILE A 454 -0.811 4.111 3.529 1.00 10.00 H new ATOM 0 HG21 ILE A 454 0.211 2.991 0.379 1.00 10.00 H new ATOM 0 HG22 ILE A 454 1.680 2.248 1.055 1.00 10.00 H new ATOM 0 HG23 ILE A 454 0.093 1.903 1.783 1.00 10.00 H new ATOM 0 HD11 ILE A 454 -1.391 6.388 2.839 1.00 10.00 H new ATOM 0 HD12 ILE A 454 0.309 6.306 3.358 1.00 10.00 H new ATOM 0 HD13 ILE A 454 -0.091 6.364 1.625 1.00 10.00 H new ATOM 710 N ALA A 455 3.728 2.819 2.710 1.00 10.00 N ATOM 711 CA ALA A 455 4.844 1.924 2.451 1.00 10.00 C ATOM 712 C ALA A 455 5.493 1.471 3.760 1.00 10.00 C ATOM 713 O ALA A 455 6.496 0.759 3.749 1.00 10.00 O ATOM 714 CB ALA A 455 5.872 2.608 1.561 1.00 10.00 C ATOM 0 H ALA A 455 3.877 3.779 2.400 1.00 10.00 H new ATOM 0 HA ALA A 455 4.463 1.042 1.936 1.00 10.00 H new ATOM 0 HB1 ALA A 455 6.703 1.927 1.375 1.00 10.00 H new ATOM 0 HB2 ALA A 455 5.408 2.882 0.614 1.00 10.00 H new ATOM 0 HB3 ALA A 455 6.243 3.505 2.057 1.00 10.00 H new ATOM 720 N SER A 456 4.918 1.896 4.889 1.00 10.00 N ATOM 721 CA SER A 456 5.449 1.538 6.197 1.00 10.00 C ATOM 722 C SER A 456 4.564 0.510 6.897 1.00 10.00 C ATOM 723 O SER A 456 5.069 -0.370 7.596 1.00 10.00 O ATOM 724 CB SER A 456 5.586 2.785 7.074 1.00 10.00 C ATOM 725 OG SER A 456 6.427 2.536 8.187 1.00 10.00 O ATOM 0 H SER A 456 4.087 2.487 4.918 1.00 10.00 H new ATOM 0 HA SER A 456 6.432 1.093 6.044 1.00 10.00 H new ATOM 0 HB2 SER A 456 5.993 3.606 6.483 1.00 10.00 H new ATOM 0 HB3 SER A 456 4.602 3.099 7.421 1.00 10.00 H new ATOM 0 HG SER A 456 6.499 3.348 8.730 1.00 10.00 H new ATOM 731 N PHE A 457 3.247 0.612 6.715 1.00 10.00 N ATOM 732 CA PHE A 457 2.335 -0.335 7.350 1.00 10.00 C ATOM 733 C PHE A 457 2.284 -1.645 6.562 1.00 10.00 C ATOM 734 O PHE A 457 2.017 -2.708 7.122 1.00 10.00 O ATOM 735 CB PHE A 457 0.935 0.277 7.517 1.00 10.00 C ATOM 736 CG PHE A 457 0.086 0.232 6.280 1.00 10.00 C ATOM 737 CD1 PHE A 457 -0.469 -0.964 5.852 1.00 10.00 C ATOM 738 CD2 PHE A 457 -0.152 1.383 5.543 1.00 10.00 C ATOM 739 CE1 PHE A 457 -1.242 -1.013 4.713 1.00 10.00 C ATOM 740 CE2 PHE A 457 -0.929 1.338 4.404 1.00 10.00 C ATOM 741 CZ PHE A 457 -1.473 0.143 3.988 1.00 10.00 C ATOM 0 H PHE A 457 2.796 1.327 6.144 1.00 10.00 H new ATOM 0 HA PHE A 457 2.714 -0.561 8.347 1.00 10.00 H new ATOM 0 HB2 PHE A 457 0.416 -0.248 8.318 1.00 10.00 H new ATOM 0 HB3 PHE A 457 1.041 1.315 7.832 1.00 10.00 H new ATOM 0 HD1 PHE A 457 -0.293 -1.867 6.418 1.00 10.00 H new ATOM 0 HD2 PHE A 457 0.275 2.322 5.864 1.00 10.00 H new ATOM 0 HE1 PHE A 457 -1.667 -1.951 4.387 1.00 10.00 H new ATOM 0 HE2 PHE A 457 -1.111 2.240 3.838 1.00 10.00 H new ATOM 0 HZ PHE A 457 -2.080 0.108 3.096 1.00 10.00 H new ATOM 751 N LEU A 458 2.568 -1.562 5.263 1.00 10.00 N ATOM 752 CA LEU A 458 2.582 -2.740 4.400 1.00 10.00 C ATOM 753 C LEU A 458 3.997 -2.974 3.870 1.00 10.00 C ATOM 754 O LEU A 458 4.220 -3.073 2.667 1.00 10.00 O ATOM 755 CB LEU A 458 1.588 -2.578 3.245 1.00 10.00 C ATOM 756 CG LEU A 458 1.500 -1.170 2.659 1.00 10.00 C ATOM 757 CD1 LEU A 458 2.861 -0.738 2.145 1.00 10.00 C ATOM 758 CD2 LEU A 458 0.454 -1.107 1.550 1.00 10.00 C ATOM 0 H LEU A 458 2.792 -0.689 4.785 1.00 10.00 H new ATOM 0 HA LEU A 458 2.276 -3.609 4.983 1.00 10.00 H new ATOM 0 HB2 LEU A 458 1.864 -3.270 2.449 1.00 10.00 H new ATOM 0 HB3 LEU A 458 0.598 -2.872 3.594 1.00 10.00 H new ATOM 0 HG LEU A 458 1.190 -0.483 3.446 1.00 10.00 H new ATOM 0 HD11 LEU A 458 2.790 0.267 1.729 1.00 10.00 H new ATOM 0 HD12 LEU A 458 3.578 -0.741 2.966 1.00 10.00 H new ATOM 0 HD13 LEU A 458 3.194 -1.429 1.371 1.00 10.00 H new ATOM 0 HD21 LEU A 458 0.410 -0.095 1.149 1.00 10.00 H new ATOM 0 HD22 LEU A 458 0.725 -1.801 0.755 1.00 10.00 H new ATOM 0 HD23 LEU A 458 -0.521 -1.380 1.954 1.00 10.00 H new ATOM 770 N GLU A 459 4.940 -3.038 4.811 1.00 10.00 N ATOM 771 CA GLU A 459 6.370 -3.239 4.532 1.00 10.00 C ATOM 772 C GLU A 459 6.630 -3.997 3.232 1.00 10.00 C ATOM 773 O GLU A 459 7.526 -3.636 2.470 1.00 10.00 O ATOM 774 CB GLU A 459 7.027 -3.981 5.696 1.00 10.00 C ATOM 775 CG GLU A 459 8.504 -3.666 5.864 1.00 10.00 C ATOM 776 CD GLU A 459 9.103 -4.317 7.095 1.00 10.00 C ATOM 777 OE1 GLU A 459 8.355 -4.548 8.067 1.00 10.00 O ATOM 778 OE2 GLU A 459 10.321 -4.596 7.085 1.00 10.00 O ATOM 0 H GLU A 459 4.732 -2.951 5.806 1.00 10.00 H new ATOM 0 HA GLU A 459 6.807 -2.247 4.415 1.00 10.00 H new ATOM 0 HB2 GLU A 459 6.503 -3.729 6.618 1.00 10.00 H new ATOM 0 HB3 GLU A 459 6.908 -5.054 5.545 1.00 10.00 H new ATOM 0 HG2 GLU A 459 9.046 -4.002 4.980 1.00 10.00 H new ATOM 0 HG3 GLU A 459 8.636 -2.586 5.928 1.00 10.00 H new ATOM 785 N ARG A 460 5.852 -5.046 2.981 1.00 10.00 N ATOM 786 CA ARG A 460 6.012 -5.844 1.766 1.00 10.00 C ATOM 787 C ARG A 460 6.169 -4.943 0.545 1.00 10.00 C ATOM 788 O ARG A 460 6.799 -5.317 -0.445 1.00 10.00 O ATOM 789 CB ARG A 460 4.809 -6.775 1.582 1.00 10.00 C ATOM 790 CG ARG A 460 5.078 -8.208 2.013 1.00 10.00 C ATOM 791 CD ARG A 460 5.570 -8.275 3.451 1.00 10.00 C ATOM 792 NE ARG A 460 6.998 -8.576 3.526 1.00 10.00 N ATOM 793 CZ ARG A 460 7.639 -8.857 4.658 1.00 10.00 C ATOM 794 NH1 ARG A 460 6.983 -8.875 5.813 1.00 10.00 N ATOM 795 NH2 ARG A 460 8.938 -9.118 4.639 1.00 10.00 N ATOM 0 H ARG A 460 5.106 -5.364 3.600 1.00 10.00 H new ATOM 0 HA ARG A 460 6.914 -6.447 1.868 1.00 10.00 H new ATOM 0 HB2 ARG A 460 3.967 -6.384 2.153 1.00 10.00 H new ATOM 0 HB3 ARG A 460 4.513 -6.769 0.533 1.00 10.00 H new ATOM 0 HG2 ARG A 460 4.166 -8.797 1.912 1.00 10.00 H new ATOM 0 HG3 ARG A 460 5.821 -8.654 1.352 1.00 10.00 H new ATOM 0 HD2 ARG A 460 5.373 -7.324 3.946 1.00 10.00 H new ATOM 0 HD3 ARG A 460 5.009 -9.038 3.991 1.00 10.00 H new ATOM 0 HE ARG A 460 7.536 -8.570 2.659 1.00 10.00 H new ATOM 0 HH11 ARG A 460 5.983 -8.673 5.835 1.00 10.00 H new ATOM 0 HH12 ARG A 460 7.479 -9.091 6.678 1.00 10.00 H new ATOM 0 HH21 ARG A 460 9.448 -9.104 3.756 1.00 10.00 H new ATOM 0 HH22 ARG A 460 9.428 -9.333 5.508 1.00 10.00 H new ATOM 809 N LYS A 461 5.594 -3.748 0.630 1.00 10.00 N ATOM 810 CA LYS A 461 5.666 -2.776 -0.452 1.00 10.00 C ATOM 811 C LYS A 461 6.681 -1.686 -0.118 1.00 10.00 C ATOM 812 O LYS A 461 7.495 -1.842 0.793 1.00 10.00 O ATOM 813 CB LYS A 461 4.287 -2.151 -0.707 1.00 10.00 C ATOM 814 CG LYS A 461 3.112 -3.032 -0.292 1.00 10.00 C ATOM 815 CD LYS A 461 2.635 -3.916 -1.438 1.00 10.00 C ATOM 816 CE LYS A 461 3.780 -4.687 -2.076 1.00 10.00 C ATOM 817 NZ LYS A 461 4.322 -3.987 -3.274 1.00 10.00 N ATOM 0 H LYS A 461 5.069 -3.429 1.444 1.00 10.00 H new ATOM 0 HA LYS A 461 5.987 -3.292 -1.357 1.00 10.00 H new ATOM 0 HB2 LYS A 461 4.225 -1.205 -0.169 1.00 10.00 H new ATOM 0 HB3 LYS A 461 4.196 -1.921 -1.768 1.00 10.00 H new ATOM 0 HG2 LYS A 461 3.406 -3.657 0.551 1.00 10.00 H new ATOM 0 HG3 LYS A 461 2.289 -2.404 0.049 1.00 10.00 H new ATOM 0 HD2 LYS A 461 1.887 -4.617 -1.068 1.00 10.00 H new ATOM 0 HD3 LYS A 461 2.148 -3.299 -2.193 1.00 10.00 H new ATOM 0 HE2 LYS A 461 4.577 -4.825 -1.345 1.00 10.00 H new ATOM 0 HE3 LYS A 461 3.434 -5.680 -2.362 1.00 10.00 H new ATOM 0 HZ1 LYS A 461 4.871 -4.657 -3.849 1.00 10.00 H new ATOM 0 HZ2 LYS A 461 3.536 -3.608 -3.840 1.00 10.00 H new ATOM 0 HZ3 LYS A 461 4.938 -3.206 -2.971 1.00 10.00 H new ATOM 831 N THR A 462 6.629 -0.581 -0.852 1.00 10.00 N ATOM 832 CA THR A 462 7.545 0.531 -0.625 1.00 10.00 C ATOM 833 C THR A 462 7.029 1.798 -1.295 1.00 10.00 C ATOM 834 O THR A 462 6.009 1.773 -1.981 1.00 10.00 O ATOM 835 CB THR A 462 8.940 0.192 -1.156 1.00 10.00 C ATOM 836 OG1 THR A 462 9.110 -1.210 -1.263 1.00 10.00 O ATOM 837 CG2 THR A 462 10.058 0.725 -0.286 1.00 10.00 C ATOM 0 H THR A 462 5.963 -0.431 -1.609 1.00 10.00 H new ATOM 0 HA THR A 462 7.608 0.704 0.449 1.00 10.00 H new ATOM 0 HB THR A 462 9.001 0.672 -2.133 1.00 10.00 H new ATOM 0 HG1 THR A 462 10.007 -1.406 -1.605 1.00 10.00 H new ATOM 0 HG21 THR A 462 11.019 0.449 -0.720 1.00 10.00 H new ATOM 0 HG22 THR A 462 9.985 1.811 -0.225 1.00 10.00 H new ATOM 0 HG23 THR A 462 9.975 0.299 0.714 1.00 10.00 H new ATOM 845 N VAL A 463 7.737 2.905 -1.096 1.00 10.00 N ATOM 846 CA VAL A 463 7.340 4.173 -1.693 1.00 10.00 C ATOM 847 C VAL A 463 7.463 4.110 -3.211 1.00 10.00 C ATOM 848 O VAL A 463 6.507 4.390 -3.934 1.00 10.00 O ATOM 849 CB VAL A 463 8.188 5.344 -1.150 1.00 10.00 C ATOM 850 CG1 VAL A 463 7.780 6.660 -1.801 1.00 10.00 C ATOM 851 CG2 VAL A 463 8.068 5.433 0.366 1.00 10.00 C ATOM 0 H VAL A 463 8.584 2.949 -0.529 1.00 10.00 H new ATOM 0 HA VAL A 463 6.299 4.350 -1.423 1.00 10.00 H new ATOM 0 HB VAL A 463 9.231 5.153 -1.402 1.00 10.00 H new ATOM 0 HG11 VAL A 463 8.392 7.469 -1.402 1.00 10.00 H new ATOM 0 HG12 VAL A 463 7.926 6.593 -2.879 1.00 10.00 H new ATOM 0 HG13 VAL A 463 6.730 6.861 -1.589 1.00 10.00 H new ATOM 0 HG21 VAL A 463 8.672 6.264 0.731 1.00 10.00 H new ATOM 0 HG22 VAL A 463 7.025 5.595 0.640 1.00 10.00 H new ATOM 0 HG23 VAL A 463 8.420 4.504 0.814 1.00 10.00 H new ATOM 861 N ALA A 464 8.641 3.723 -3.688 1.00 10.00 N ATOM 862 CA ALA A 464 8.878 3.603 -5.121 1.00 10.00 C ATOM 863 C ALA A 464 8.196 2.356 -5.671 1.00 10.00 C ATOM 864 O ALA A 464 7.876 2.282 -6.857 1.00 10.00 O ATOM 865 CB ALA A 464 10.371 3.566 -5.410 1.00 10.00 C ATOM 0 H ALA A 464 9.444 3.488 -3.105 1.00 10.00 H new ATOM 0 HA ALA A 464 8.452 4.475 -5.617 1.00 10.00 H new ATOM 0 HB1 ALA A 464 10.532 3.476 -6.484 1.00 10.00 H new ATOM 0 HB2 ALA A 464 10.834 4.484 -5.049 1.00 10.00 H new ATOM 0 HB3 ALA A 464 10.819 2.711 -4.904 1.00 10.00 H new ATOM 871 N GLU A 465 7.970 1.378 -4.796 1.00 10.00 N ATOM 872 CA GLU A 465 7.321 0.135 -5.187 1.00 10.00 C ATOM 873 C GLU A 465 5.804 0.297 -5.189 1.00 10.00 C ATOM 874 O GLU A 465 5.100 -0.383 -5.936 1.00 10.00 O ATOM 875 CB GLU A 465 7.724 -0.996 -4.238 1.00 10.00 C ATOM 876 CG GLU A 465 7.359 -2.379 -4.753 1.00 10.00 C ATOM 877 CD GLU A 465 8.302 -2.864 -5.837 1.00 10.00 C ATOM 878 OE1 GLU A 465 8.614 -2.071 -6.750 1.00 10.00 O ATOM 879 OE2 GLU A 465 8.726 -4.038 -5.773 1.00 10.00 O ATOM 0 H GLU A 465 8.228 1.426 -3.810 1.00 10.00 H new ATOM 0 HA GLU A 465 7.646 -0.117 -6.197 1.00 10.00 H new ATOM 0 HB2 GLU A 465 8.800 -0.952 -4.069 1.00 10.00 H new ATOM 0 HB3 GLU A 465 7.243 -0.838 -3.272 1.00 10.00 H new ATOM 0 HG2 GLU A 465 7.370 -3.086 -3.924 1.00 10.00 H new ATOM 0 HG3 GLU A 465 6.341 -2.361 -5.143 1.00 10.00 H new ATOM 886 N CYS A 466 5.303 1.204 -4.352 1.00 10.00 N ATOM 887 CA CYS A 466 3.868 1.451 -4.272 1.00 10.00 C ATOM 888 C CYS A 466 3.365 2.084 -5.562 1.00 10.00 C ATOM 889 O CYS A 466 2.189 1.964 -5.904 1.00 10.00 O ATOM 890 CB CYS A 466 3.539 2.347 -3.075 1.00 10.00 C ATOM 891 SG CYS A 466 3.142 1.439 -1.562 1.00 10.00 S ATOM 0 H CYS A 466 5.867 1.776 -3.724 1.00 10.00 H new ATOM 0 HA CYS A 466 3.364 0.495 -4.134 1.00 10.00 H new ATOM 0 HB2 CYS A 466 4.388 3.002 -2.881 1.00 10.00 H new ATOM 0 HB3 CYS A 466 2.695 2.987 -3.334 1.00 10.00 H new ATOM 0 HG CYS A 466 4.242 1.072 -0.975 1.00 10.00 H new ATOM 897 N VAL A 467 4.268 2.740 -6.289 1.00 10.00 N ATOM 898 CA VAL A 467 3.912 3.364 -7.556 1.00 10.00 C ATOM 899 C VAL A 467 3.272 2.337 -8.487 1.00 10.00 C ATOM 900 O VAL A 467 2.547 2.688 -9.416 1.00 10.00 O ATOM 901 CB VAL A 467 5.146 3.982 -8.248 1.00 10.00 C ATOM 902 CG1 VAL A 467 4.773 4.562 -9.607 1.00 10.00 C ATOM 903 CG2 VAL A 467 5.774 5.049 -7.363 1.00 10.00 C ATOM 0 H VAL A 467 5.246 2.851 -6.022 1.00 10.00 H new ATOM 0 HA VAL A 467 3.201 4.162 -7.342 1.00 10.00 H new ATOM 0 HB VAL A 467 5.879 3.191 -8.408 1.00 10.00 H new ATOM 0 HG11 VAL A 467 5.659 4.992 -10.075 1.00 10.00 H new ATOM 0 HG12 VAL A 467 4.374 3.772 -10.243 1.00 10.00 H new ATOM 0 HG13 VAL A 467 4.019 5.338 -9.477 1.00 10.00 H new ATOM 0 HG21 VAL A 467 6.642 5.474 -7.866 1.00 10.00 H new ATOM 0 HG22 VAL A 467 5.045 5.836 -7.169 1.00 10.00 H new ATOM 0 HG23 VAL A 467 6.085 4.602 -6.419 1.00 10.00 H new ATOM 913 N LEU A 468 3.545 1.062 -8.224 1.00 10.00 N ATOM 914 CA LEU A 468 2.997 -0.020 -9.025 1.00 10.00 C ATOM 915 C LEU A 468 1.495 -0.183 -8.789 1.00 10.00 C ATOM 916 O LEU A 468 0.843 -0.984 -9.456 1.00 10.00 O ATOM 917 CB LEU A 468 3.729 -1.326 -8.707 1.00 10.00 C ATOM 918 CG LEU A 468 4.421 -1.988 -9.900 1.00 10.00 C ATOM 919 CD1 LEU A 468 5.689 -1.232 -10.268 1.00 10.00 C ATOM 920 CD2 LEU A 468 4.736 -3.443 -9.592 1.00 10.00 C ATOM 0 H LEU A 468 4.145 0.756 -7.458 1.00 10.00 H new ATOM 0 HA LEU A 468 3.143 0.228 -10.076 1.00 10.00 H new ATOM 0 HB2 LEU A 468 4.475 -1.128 -7.938 1.00 10.00 H new ATOM 0 HB3 LEU A 468 3.014 -2.032 -8.284 1.00 10.00 H new ATOM 0 HG LEU A 468 3.743 -1.956 -10.753 1.00 10.00 H new ATOM 0 HD11 LEU A 468 6.168 -1.717 -11.119 1.00 10.00 H new ATOM 0 HD12 LEU A 468 5.437 -0.205 -10.531 1.00 10.00 H new ATOM 0 HD13 LEU A 468 6.372 -1.232 -9.419 1.00 10.00 H new ATOM 0 HD21 LEU A 468 5.228 -3.899 -10.451 1.00 10.00 H new ATOM 0 HD22 LEU A 468 5.395 -3.497 -8.726 1.00 10.00 H new ATOM 0 HD23 LEU A 468 3.811 -3.978 -9.378 1.00 10.00 H new ATOM 932 N TYR A 469 0.950 0.573 -7.839 1.00 10.00 N ATOM 933 CA TYR A 469 -0.473 0.506 -7.534 1.00 10.00 C ATOM 934 C TYR A 469 -1.170 1.833 -7.841 1.00 10.00 C ATOM 935 O TYR A 469 -2.392 1.933 -7.752 1.00 10.00 O ATOM 936 CB TYR A 469 -0.679 0.080 -6.068 1.00 10.00 C ATOM 937 CG TYR A 469 -1.215 1.122 -5.104 1.00 10.00 C ATOM 938 CD1 TYR A 469 -0.821 2.451 -5.183 1.00 10.00 C ATOM 939 CD2 TYR A 469 -2.106 0.761 -4.092 1.00 10.00 C ATOM 940 CE1 TYR A 469 -1.295 3.392 -4.294 1.00 10.00 C ATOM 941 CE2 TYR A 469 -2.584 1.701 -3.203 1.00 10.00 C ATOM 942 CZ TYR A 469 -2.175 3.015 -3.309 1.00 10.00 C ATOM 943 OH TYR A 469 -2.640 3.952 -2.422 1.00 10.00 O ATOM 0 H TYR A 469 1.473 1.238 -7.269 1.00 10.00 H new ATOM 0 HA TYR A 469 -0.931 -0.247 -8.175 1.00 10.00 H new ATOM 0 HB2 TYR A 469 -1.361 -0.770 -6.058 1.00 10.00 H new ATOM 0 HB3 TYR A 469 0.277 -0.274 -5.683 1.00 10.00 H new ATOM 0 HD1 TYR A 469 -0.130 2.753 -5.956 1.00 10.00 H new ATOM 0 HD2 TYR A 469 -2.425 -0.267 -4.004 1.00 10.00 H new ATOM 0 HE1 TYR A 469 -0.976 4.421 -4.372 1.00 10.00 H new ATOM 0 HE2 TYR A 469 -3.276 1.410 -2.427 1.00 10.00 H new ATOM 0 HH TYR A 469 -2.941 4.746 -2.912 1.00 10.00 H new ATOM 953 N TYR A 470 -0.382 2.853 -8.187 1.00 10.00 N ATOM 954 CA TYR A 470 -0.929 4.170 -8.483 1.00 10.00 C ATOM 955 C TYR A 470 -1.197 4.339 -9.976 1.00 10.00 C ATOM 956 O TYR A 470 -2.103 5.074 -10.369 1.00 10.00 O ATOM 957 CB TYR A 470 0.017 5.265 -7.959 1.00 10.00 C ATOM 958 CG TYR A 470 0.644 6.134 -9.031 1.00 10.00 C ATOM 959 CD1 TYR A 470 1.487 5.587 -9.988 1.00 10.00 C ATOM 960 CD2 TYR A 470 0.392 7.499 -9.083 1.00 10.00 C ATOM 961 CE1 TYR A 470 2.062 6.372 -10.965 1.00 10.00 C ATOM 962 CE2 TYR A 470 0.964 8.293 -10.057 1.00 10.00 C ATOM 963 CZ TYR A 470 1.799 7.726 -10.997 1.00 10.00 C ATOM 964 OH TYR A 470 2.371 8.513 -11.970 1.00 10.00 O ATOM 0 H TYR A 470 0.633 2.789 -8.268 1.00 10.00 H new ATOM 0 HA TYR A 470 -1.887 4.266 -7.972 1.00 10.00 H new ATOM 0 HB2 TYR A 470 -0.537 5.904 -7.271 1.00 10.00 H new ATOM 0 HB3 TYR A 470 0.813 4.792 -7.384 1.00 10.00 H new ATOM 0 HD1 TYR A 470 1.696 4.528 -9.967 1.00 10.00 H new ATOM 0 HD2 TYR A 470 -0.262 7.947 -8.349 1.00 10.00 H new ATOM 0 HE1 TYR A 470 2.715 5.929 -11.702 1.00 10.00 H new ATOM 0 HE2 TYR A 470 0.759 9.353 -10.083 1.00 10.00 H new ATOM 0 HH TYR A 470 2.082 9.442 -11.851 1.00 10.00 H new ATOM 974 N TYR A 471 -0.411 3.663 -10.812 1.00 10.00 N ATOM 975 CA TYR A 471 -0.598 3.770 -12.254 1.00 10.00 C ATOM 976 C TYR A 471 -1.672 2.799 -12.748 1.00 10.00 C ATOM 977 O TYR A 471 -2.018 2.792 -13.929 1.00 10.00 O ATOM 978 CB TYR A 471 0.730 3.558 -12.995 1.00 10.00 C ATOM 979 CG TYR A 471 1.109 2.109 -13.215 1.00 10.00 C ATOM 980 CD1 TYR A 471 0.573 1.385 -14.272 1.00 10.00 C ATOM 981 CD2 TYR A 471 2.007 1.470 -12.369 1.00 10.00 C ATOM 982 CE1 TYR A 471 0.919 0.064 -14.480 1.00 10.00 C ATOM 983 CE2 TYR A 471 2.358 0.148 -12.571 1.00 10.00 C ATOM 984 CZ TYR A 471 1.811 -0.550 -13.626 1.00 10.00 C ATOM 985 OH TYR A 471 2.159 -1.866 -13.831 1.00 10.00 O ATOM 0 H TYR A 471 0.348 3.046 -10.521 1.00 10.00 H new ATOM 0 HA TYR A 471 -0.945 4.780 -12.473 1.00 10.00 H new ATOM 0 HB2 TYR A 471 0.673 4.055 -13.963 1.00 10.00 H new ATOM 0 HB3 TYR A 471 1.526 4.046 -12.432 1.00 10.00 H new ATOM 0 HD1 TYR A 471 -0.126 1.863 -14.943 1.00 10.00 H new ATOM 0 HD2 TYR A 471 2.437 2.014 -11.541 1.00 10.00 H new ATOM 0 HE1 TYR A 471 0.493 -0.485 -15.307 1.00 10.00 H new ATOM 0 HE2 TYR A 471 3.058 -0.335 -11.905 1.00 10.00 H new ATOM 0 HH TYR A 471 2.797 -2.147 -13.142 1.00 10.00 H new ATOM 995 N LEU A 472 -2.219 2.001 -11.833 1.00 10.00 N ATOM 996 CA LEU A 472 -3.278 1.057 -12.176 1.00 10.00 C ATOM 997 C LEU A 472 -4.593 1.476 -11.520 1.00 10.00 C ATOM 998 O LEU A 472 -5.642 0.880 -11.767 1.00 10.00 O ATOM 999 CB LEU A 472 -2.913 -0.372 -11.748 1.00 10.00 C ATOM 1000 CG LEU A 472 -1.701 -0.496 -10.825 1.00 10.00 C ATOM 1001 CD1 LEU A 472 -1.607 -1.903 -10.255 1.00 10.00 C ATOM 1002 CD2 LEU A 472 -0.428 -0.134 -11.575 1.00 10.00 C ATOM 0 H LEU A 472 -1.946 1.990 -10.850 1.00 10.00 H new ATOM 0 HA LEU A 472 -3.396 1.068 -13.260 1.00 10.00 H new ATOM 0 HB2 LEU A 472 -3.775 -0.813 -11.248 1.00 10.00 H new ATOM 0 HB3 LEU A 472 -2.727 -0.964 -12.644 1.00 10.00 H new ATOM 0 HG LEU A 472 -1.822 0.200 -9.995 1.00 10.00 H new ATOM 0 HD11 LEU A 472 -0.738 -1.973 -9.600 1.00 10.00 H new ATOM 0 HD12 LEU A 472 -2.509 -2.126 -9.686 1.00 10.00 H new ATOM 0 HD13 LEU A 472 -1.506 -2.620 -11.070 1.00 10.00 H new ATOM 0 HD21 LEU A 472 0.427 -0.227 -10.906 1.00 10.00 H new ATOM 0 HD22 LEU A 472 -0.301 -0.808 -12.422 1.00 10.00 H new ATOM 0 HD23 LEU A 472 -0.497 0.892 -11.935 1.00 10.00 H new ATOM 1014 N THR A 473 -4.524 2.508 -10.679 1.00 10.00 N ATOM 1015 CA THR A 473 -5.698 3.014 -9.982 1.00 10.00 C ATOM 1016 C THR A 473 -6.059 4.414 -10.462 1.00 10.00 C ATOM 1017 O THR A 473 -7.222 4.814 -10.402 1.00 10.00 O ATOM 1018 CB THR A 473 -5.454 3.022 -8.469 1.00 10.00 C ATOM 1019 OG1 THR A 473 -6.604 3.473 -7.778 1.00 10.00 O ATOM 1020 CG2 THR A 473 -4.293 3.901 -8.050 1.00 10.00 C ATOM 0 H THR A 473 -3.662 3.009 -10.466 1.00 10.00 H new ATOM 0 HA THR A 473 -6.535 2.352 -10.204 1.00 10.00 H new ATOM 0 HB THR A 473 -5.217 1.990 -8.212 1.00 10.00 H new ATOM 0 HG1 THR A 473 -6.425 4.353 -7.385 1.00 10.00 H new ATOM 0 HG21 THR A 473 -4.177 3.859 -6.967 1.00 10.00 H new ATOM 0 HG22 THR A 473 -3.379 3.547 -8.526 1.00 10.00 H new ATOM 0 HG23 THR A 473 -4.487 4.929 -8.355 1.00 10.00 H new ATOM 1028 N LYS A 474 -5.064 5.163 -10.927 1.00 10.00 N ATOM 1029 CA LYS A 474 -5.304 6.524 -11.395 1.00 10.00 C ATOM 1030 C LYS A 474 -5.045 6.656 -12.893 1.00 10.00 C ATOM 1031 O LYS A 474 -5.777 7.352 -13.596 1.00 10.00 O ATOM 1032 CB LYS A 474 -4.430 7.521 -10.625 1.00 10.00 C ATOM 1033 CG LYS A 474 -4.052 7.069 -9.221 1.00 10.00 C ATOM 1034 CD LYS A 474 -2.889 7.878 -8.673 1.00 10.00 C ATOM 1035 CE LYS A 474 -3.273 9.333 -8.463 1.00 10.00 C ATOM 1036 NZ LYS A 474 -4.111 9.517 -7.245 1.00 10.00 N ATOM 0 H LYS A 474 -4.094 4.855 -10.990 1.00 10.00 H new ATOM 0 HA LYS A 474 -6.354 6.752 -11.211 1.00 10.00 H new ATOM 0 HB2 LYS A 474 -3.518 7.702 -11.194 1.00 10.00 H new ATOM 0 HB3 LYS A 474 -4.957 8.473 -10.558 1.00 10.00 H new ATOM 0 HG2 LYS A 474 -4.912 7.172 -8.560 1.00 10.00 H new ATOM 0 HG3 LYS A 474 -3.787 6.012 -9.236 1.00 10.00 H new ATOM 0 HD2 LYS A 474 -2.559 7.448 -7.728 1.00 10.00 H new ATOM 0 HD3 LYS A 474 -2.046 7.819 -9.362 1.00 10.00 H new ATOM 0 HE2 LYS A 474 -2.370 9.938 -8.377 1.00 10.00 H new ATOM 0 HE3 LYS A 474 -3.817 9.694 -9.336 1.00 10.00 H new ATOM 0 HZ1 LYS A 474 -4.337 10.525 -7.128 1.00 10.00 H new ATOM 0 HZ2 LYS A 474 -4.992 8.974 -7.345 1.00 10.00 H new ATOM 0 HZ3 LYS A 474 -3.589 9.181 -6.411 1.00 10.00 H new ATOM 1050 N LYS A 475 -4.006 5.990 -13.379 1.00 10.00 N ATOM 1051 CA LYS A 475 -3.668 6.046 -14.797 1.00 10.00 C ATOM 1052 C LYS A 475 -4.833 5.562 -15.659 1.00 10.00 C ATOM 1053 O LYS A 475 -4.905 5.873 -16.848 1.00 10.00 O ATOM 1054 CB LYS A 475 -2.424 5.205 -15.084 1.00 10.00 C ATOM 1055 CG LYS A 475 -1.474 5.846 -16.084 1.00 10.00 C ATOM 1056 CD LYS A 475 -0.528 6.823 -15.407 1.00 10.00 C ATOM 1057 CE LYS A 475 0.804 6.905 -16.136 1.00 10.00 C ATOM 1058 NZ LYS A 475 1.927 7.210 -15.207 1.00 10.00 N ATOM 0 H LYS A 475 -3.385 5.408 -12.817 1.00 10.00 H new ATOM 0 HA LYS A 475 -3.461 7.086 -15.050 1.00 10.00 H new ATOM 0 HB2 LYS A 475 -1.891 5.029 -14.150 1.00 10.00 H new ATOM 0 HB3 LYS A 475 -2.733 4.231 -15.462 1.00 10.00 H new ATOM 0 HG2 LYS A 475 -0.898 5.070 -16.588 1.00 10.00 H new ATOM 0 HG3 LYS A 475 -2.048 6.366 -16.851 1.00 10.00 H new ATOM 0 HD2 LYS A 475 -0.987 7.811 -15.373 1.00 10.00 H new ATOM 0 HD3 LYS A 475 -0.361 6.514 -14.375 1.00 10.00 H new ATOM 0 HE2 LYS A 475 0.999 5.960 -16.644 1.00 10.00 H new ATOM 0 HE3 LYS A 475 0.750 7.675 -16.906 1.00 10.00 H new ATOM 0 HZ1 LYS A 475 2.817 7.257 -15.742 1.00 10.00 H new ATOM 0 HZ2 LYS A 475 1.754 8.124 -14.741 1.00 10.00 H new ATOM 0 HZ3 LYS A 475 1.995 6.462 -14.487 1.00 10.00 H new ATOM 1072 N ASN A 476 -5.742 4.798 -15.057 1.00 10.00 N ATOM 1073 CA ASN A 476 -6.895 4.272 -15.780 1.00 10.00 C ATOM 1074 C ASN A 476 -8.214 4.737 -15.160 1.00 10.00 C ATOM 1075 O ASN A 476 -9.280 4.536 -15.742 1.00 10.00 O ATOM 1076 CB ASN A 476 -6.847 2.743 -15.808 1.00 10.00 C ATOM 1077 CG ASN A 476 -5.774 2.214 -16.738 1.00 10.00 C ATOM 1078 OD1 ASN A 476 -5.997 2.061 -17.939 1.00 10.00 O ATOM 1079 ND2 ASN A 476 -4.600 1.932 -16.187 1.00 10.00 N ATOM 0 H ASN A 476 -5.702 4.531 -14.073 1.00 10.00 H new ATOM 0 HA ASN A 476 -6.848 4.658 -16.798 1.00 10.00 H new ATOM 0 HB2 ASN A 476 -6.666 2.370 -14.800 1.00 10.00 H new ATOM 0 HB3 ASN A 476 -7.817 2.358 -16.121 1.00 10.00 H new ATOM 0 HD21 ASN A 476 -3.839 1.573 -16.764 1.00 10.00 H new ATOM 0 HD22 ASN A 476 -4.459 2.074 -15.187 1.00 10.00 H new ATOM 1086 N GLU A 477 -8.145 5.355 -13.982 1.00 10.00 N ATOM 1087 CA GLU A 477 -9.349 5.833 -13.307 1.00 10.00 C ATOM 1088 C GLU A 477 -9.352 7.355 -13.199 1.00 10.00 C ATOM 1089 O GLU A 477 -10.388 7.997 -13.374 1.00 10.00 O ATOM 1090 CB GLU A 477 -9.459 5.213 -11.914 1.00 10.00 C ATOM 1091 CG GLU A 477 -10.887 4.918 -11.488 1.00 10.00 C ATOM 1092 CD GLU A 477 -10.995 3.680 -10.621 1.00 10.00 C ATOM 1093 OE1 GLU A 477 -10.392 3.667 -9.527 1.00 10.00 O ATOM 1094 OE2 GLU A 477 -11.681 2.722 -11.036 1.00 10.00 O ATOM 0 H GLU A 477 -7.276 5.535 -13.479 1.00 10.00 H new ATOM 0 HA GLU A 477 -10.209 5.529 -13.903 1.00 10.00 H new ATOM 0 HB2 GLU A 477 -8.884 4.287 -11.892 1.00 10.00 H new ATOM 0 HB3 GLU A 477 -9.005 5.888 -11.189 1.00 10.00 H new ATOM 0 HG2 GLU A 477 -11.283 5.774 -10.942 1.00 10.00 H new ATOM 0 HG3 GLU A 477 -11.507 4.791 -12.375 1.00 10.00 H new ATOM 1101 N ASN A 478 -8.189 7.926 -12.907 1.00 10.00 N ATOM 1102 CA ASN A 478 -8.057 9.372 -12.772 1.00 10.00 C ATOM 1103 C ASN A 478 -8.868 9.881 -11.584 1.00 10.00 C ATOM 1104 O ASN A 478 -9.891 10.545 -11.756 1.00 10.00 O ATOM 1105 CB ASN A 478 -8.510 10.072 -14.056 1.00 10.00 C ATOM 1106 CG ASN A 478 -7.904 11.454 -14.206 1.00 10.00 C ATOM 1107 OD1 ASN A 478 -8.532 12.459 -13.876 1.00 10.00 O ATOM 1108 ND2 ASN A 478 -6.676 11.509 -14.708 1.00 10.00 N ATOM 0 H ASN A 478 -7.322 7.409 -12.759 1.00 10.00 H new ATOM 0 HA ASN A 478 -7.006 9.602 -12.597 1.00 10.00 H new ATOM 0 HB2 ASN A 478 -8.234 9.462 -14.916 1.00 10.00 H new ATOM 0 HB3 ASN A 478 -9.597 10.153 -14.058 1.00 10.00 H new ATOM 0 HD21 ASN A 478 -6.216 12.411 -14.833 1.00 10.00 H new ATOM 0 HD22 ASN A 478 -6.192 10.649 -14.968 1.00 10.00 H new ATOM 1115 N TYR A 479 -8.404 9.563 -10.380 1.00 10.00 N ATOM 1116 CA TYR A 479 -9.075 9.980 -9.167 1.00 10.00 C ATOM 1117 C TYR A 479 -8.080 10.633 -8.214 1.00 10.00 C ATOM 1118 O TYR A 479 -7.050 11.160 -8.635 1.00 10.00 O ATOM 1119 CB TYR A 479 -9.755 8.772 -8.510 1.00 10.00 C ATOM 1120 CG TYR A 479 -8.794 7.820 -7.830 1.00 10.00 C ATOM 1121 CD1 TYR A 479 -7.919 7.036 -8.573 1.00 10.00 C ATOM 1122 CD2 TYR A 479 -8.764 7.706 -6.446 1.00 10.00 C ATOM 1123 CE1 TYR A 479 -7.041 6.166 -7.954 1.00 10.00 C ATOM 1124 CE2 TYR A 479 -7.889 6.839 -5.821 1.00 10.00 C ATOM 1125 CZ TYR A 479 -7.029 6.072 -6.578 1.00 10.00 C ATOM 1126 OH TYR A 479 -6.156 5.207 -5.960 1.00 10.00 O ATOM 0 H TYR A 479 -7.559 9.013 -10.224 1.00 10.00 H new ATOM 0 HA TYR A 479 -9.840 10.716 -9.412 1.00 10.00 H new ATOM 0 HB2 TYR A 479 -10.477 9.129 -7.776 1.00 10.00 H new ATOM 0 HB3 TYR A 479 -10.315 8.226 -9.269 1.00 10.00 H new ATOM 0 HD1 TYR A 479 -7.925 7.108 -9.651 1.00 10.00 H new ATOM 0 HD2 TYR A 479 -9.436 8.305 -5.849 1.00 10.00 H new ATOM 0 HE1 TYR A 479 -6.368 5.563 -8.545 1.00 10.00 H new ATOM 0 HE2 TYR A 479 -7.879 6.762 -4.744 1.00 10.00 H new ATOM 0 HH TYR A 479 -5.463 5.719 -5.494 1.00 10.00 H new ATOM 1136 N LYS A 480 -8.395 10.590 -6.934 1.00 10.00 N ATOM 1137 CA LYS A 480 -7.539 11.172 -5.908 1.00 10.00 C ATOM 1138 C LYS A 480 -7.359 10.208 -4.739 1.00 10.00 C ATOM 1139 O LYS A 480 -6.350 9.472 -4.731 1.00 10.00 O ATOM 1140 CB LYS A 480 -8.131 12.492 -5.409 1.00 10.00 C ATOM 1141 CG LYS A 480 -8.366 13.508 -6.514 1.00 10.00 C ATOM 1142 CD LYS A 480 -9.587 14.367 -6.230 1.00 10.00 C ATOM 1143 CE LYS A 480 -10.285 14.785 -7.514 1.00 10.00 C ATOM 1144 NZ LYS A 480 -9.647 15.980 -8.129 1.00 10.00 N ATOM 1145 OXT LYS A 480 -8.227 10.199 -3.841 1.00 10.00 O ATOM 0 H LYS A 480 -9.244 10.155 -6.574 1.00 10.00 H new ATOM 0 HA LYS A 480 -6.562 11.364 -6.351 1.00 10.00 H new ATOM 0 HB2 LYS A 480 -9.076 12.290 -4.906 1.00 10.00 H new ATOM 0 HB3 LYS A 480 -7.460 12.924 -4.666 1.00 10.00 H new ATOM 0 HG2 LYS A 480 -7.488 14.145 -6.617 1.00 10.00 H new ATOM 0 HG3 LYS A 480 -8.497 12.990 -7.464 1.00 10.00 H new ATOM 0 HD2 LYS A 480 -10.283 13.814 -5.599 1.00 10.00 H new ATOM 0 HD3 LYS A 480 -9.287 15.254 -5.672 1.00 10.00 H new ATOM 0 HE2 LYS A 480 -10.266 13.958 -8.223 1.00 10.00 H new ATOM 0 HE3 LYS A 480 -11.333 15.001 -7.304 1.00 10.00 H new ATOM 0 HZ1 LYS A 480 -10.152 16.233 -9.002 1.00 10.00 H new ATOM 0 HZ2 LYS A 480 -9.688 16.777 -7.462 1.00 10.00 H new ATOM 0 HZ3 LYS A 480 -8.654 15.767 -8.353 1.00 10.00 H new TER 1159 LYS A 480