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 470 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 474 LYS NZ :NH3+ 157:sc= -1.06 (180deg=-0.395) USER MOD Set 1.3: A 480 LYS NZ :NH3+ 180:sc= -0.13 (180deg=0) USER MOD Set 2.1: A 473 THR OG1 : rot -77:sc= 1.98 USER MOD Set 2.2: A 479 TYR OH : rot 12:sc= 0.81 USER MOD Set 3.1: A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 447 HIS : no HE2:sc= -14.1! C(o=-14!,f=-12!) USER MOD Set 4.1: A 420 MET CE :methyl 180:sc=-0.000249 (180deg=0) USER MOD Set 4.2: A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.3: A 423 TYR OH : rot -13:sc= 0.0781 USER MOD Single : A 413 ASN : amide:sc= -0.274 K(o=-0.27,f=0.33) USER MOD Single : A 416 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 424 LYS NZ :NH3+ 150:sc= -0.151 (180deg=-0.446) USER MOD Single : A 427 GLN : amide:sc= -5.42 K(o=-5.4,f=-2.6) USER MOD Single : A 429 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 431 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD Single : A 435 GLN : amide:sc= -3.1 K(o=-3.1,f=-1.3) USER MOD Single : A 437 LYS NZ :NH3+ -147:sc= -0.134 (180deg=-0.521) USER MOD Single : A 439 THR OG1 : rot 140:sc= 0 USER MOD Single : A 445 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= -0.333 X(o=-0.33,f=-0.1) USER MOD Single : A 449 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 450 ASN : amide:sc= -5.72 K(o=-5.7,f=-13!) USER MOD Single : A 456 SER OG : rot 180:sc= 0 USER MOD Single : A 461 LYS NZ :NH3+ -177:sc= -1.47 (180deg=-1.7) USER MOD Single : A 462 THR OG1 : rot -170:sc= -2.13 USER MOD Single : A 466 CYS SG : rot -43:sc= -0.831 USER MOD Single : A 469 TYR OH : rot -99:sc= -3.38! USER MOD Single : A 471 TYR OH : rot 150:sc= -4.64! USER MOD Single : A 475 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 ----------------------------------------------------------------- ATOM 1 N ASN A 413 19.245 -4.233 15.097 1.00 10.00 N ATOM 2 CA ASN A 413 18.208 -3.300 15.521 1.00 10.00 C ATOM 3 C ASN A 413 18.225 -2.040 14.661 1.00 10.00 C ATOM 4 O ASN A 413 19.240 -1.709 14.046 1.00 10.00 O ATOM 5 CB ASN A 413 18.397 -2.929 16.993 1.00 10.00 C ATOM 6 CG ASN A 413 19.749 -2.299 17.261 1.00 10.00 C ATOM 7 OD1 ASN A 413 20.787 -2.853 16.900 1.00 10.00 O ATOM 8 ND2 ASN A 413 19.743 -1.135 17.900 1.00 10.00 N ATOM 0 HA ASN A 413 17.242 -3.789 15.398 1.00 10.00 H new ATOM 0 HB2 ASN A 413 17.611 -2.237 17.294 1.00 10.00 H new ATOM 0 HB3 ASN A 413 18.288 -3.823 17.607 1.00 10.00 H new ATOM 0 HD21 ASN A 413 20.623 -0.664 18.110 1.00 10.00 H new ATOM 0 HD22 ASN A 413 18.858 -0.712 18.181 1.00 10.00 H new ATOM 15 N GLY A 414 17.096 -1.341 14.622 1.00 10.00 N ATOM 16 CA GLY A 414 17.003 -0.126 13.835 1.00 10.00 C ATOM 17 C GLY A 414 15.616 0.089 13.259 1.00 10.00 C ATOM 18 O GLY A 414 15.092 1.202 13.283 1.00 10.00 O ATOM 0 H GLY A 414 16.244 -1.594 15.122 1.00 10.00 H new ATOM 0 HA2 GLY A 414 17.270 0.728 14.458 1.00 10.00 H new ATOM 0 HA3 GLY A 414 17.728 -0.167 13.022 1.00 10.00 H new ATOM 22 N LEU A 415 15.021 -0.980 12.742 1.00 10.00 N ATOM 23 CA LEU A 415 13.686 -0.905 12.159 1.00 10.00 C ATOM 24 C LEU A 415 12.659 -0.483 13.203 1.00 10.00 C ATOM 25 O LEU A 415 11.918 0.480 13.005 1.00 10.00 O ATOM 26 CB LEU A 415 13.293 -2.256 11.556 1.00 10.00 C ATOM 27 CG LEU A 415 13.988 -2.605 10.240 1.00 10.00 C ATOM 28 CD1 LEU A 415 13.719 -4.053 9.863 1.00 10.00 C ATOM 29 CD2 LEU A 415 13.528 -1.669 9.131 1.00 10.00 C ATOM 0 H LEU A 415 15.442 -1.909 12.715 1.00 10.00 H new ATOM 0 HA LEU A 415 13.704 -0.154 11.369 1.00 10.00 H new ATOM 0 HB2 LEU A 415 13.511 -3.038 12.283 1.00 10.00 H new ATOM 0 HB3 LEU A 415 12.215 -2.264 11.393 1.00 10.00 H new ATOM 0 HG LEU A 415 15.063 -2.479 10.373 1.00 10.00 H new ATOM 0 HD11 LEU A 415 14.221 -4.284 8.924 1.00 10.00 H new ATOM 0 HD12 LEU A 415 14.096 -4.709 10.647 1.00 10.00 H new ATOM 0 HD13 LEU A 415 12.646 -4.206 9.748 1.00 10.00 H new ATOM 0 HD21 LEU A 415 14.032 -1.931 8.201 1.00 10.00 H new ATOM 0 HD22 LEU A 415 12.450 -1.764 8.998 1.00 10.00 H new ATOM 0 HD23 LEU A 415 13.772 -0.641 9.398 1.00 10.00 H new ATOM 41 N MET A 416 12.621 -1.208 14.316 1.00 10.00 N ATOM 42 CA MET A 416 11.684 -0.908 15.393 1.00 10.00 C ATOM 43 C MET A 416 10.243 -1.007 14.903 1.00 10.00 C ATOM 44 O MET A 416 9.992 -1.339 13.745 1.00 10.00 O ATOM 45 CB MET A 416 11.950 0.490 15.952 1.00 10.00 C ATOM 46 CG MET A 416 12.972 0.512 17.076 1.00 10.00 C ATOM 47 SD MET A 416 12.785 1.943 18.157 1.00 10.00 S ATOM 48 CE MET A 416 12.845 1.161 19.767 1.00 10.00 C ATOM 0 H MET A 416 13.228 -2.008 14.496 1.00 10.00 H new ATOM 0 HA MET A 416 11.831 -1.643 16.185 1.00 10.00 H new ATOM 0 HB2 MET A 416 12.297 1.135 15.145 1.00 10.00 H new ATOM 0 HB3 MET A 416 11.013 0.911 16.316 1.00 10.00 H new ATOM 0 HG2 MET A 416 12.877 -0.399 17.666 1.00 10.00 H new ATOM 0 HG3 MET A 416 13.975 0.512 16.650 1.00 10.00 H new ATOM 0 HE1 MET A 416 12.742 1.919 20.544 1.00 10.00 H new ATOM 0 HE2 MET A 416 12.031 0.441 19.852 1.00 10.00 H new ATOM 0 HE3 MET A 416 13.798 0.646 19.886 1.00 10.00 H new ATOM 58 N ALA A 417 9.300 -0.716 15.794 1.00 10.00 N ATOM 59 CA ALA A 417 7.883 -0.773 15.452 1.00 10.00 C ATOM 60 C ALA A 417 7.476 -2.179 15.028 1.00 10.00 C ATOM 61 O ALA A 417 8.304 -3.089 14.980 1.00 10.00 O ATOM 62 CB ALA A 417 7.567 0.226 14.350 1.00 10.00 C ATOM 0 H ALA A 417 9.491 -0.439 16.757 1.00 10.00 H new ATOM 0 HA ALA A 417 7.309 -0.511 16.341 1.00 10.00 H new ATOM 0 HB1 ALA A 417 6.506 0.173 14.104 1.00 10.00 H new ATOM 0 HB2 ALA A 417 7.811 1.232 14.690 1.00 10.00 H new ATOM 0 HB3 ALA A 417 8.157 -0.011 13.464 1.00 10.00 H new ATOM 68 N ASP A 418 6.194 -2.351 14.721 1.00 10.00 N ATOM 69 CA ASP A 418 5.676 -3.647 14.300 1.00 10.00 C ATOM 70 C ASP A 418 4.423 -3.480 13.443 1.00 10.00 C ATOM 71 O ASP A 418 3.303 -3.540 13.950 1.00 10.00 O ATOM 72 CB ASP A 418 5.363 -4.516 15.519 1.00 10.00 C ATOM 73 CG ASP A 418 5.341 -5.994 15.186 1.00 10.00 C ATOM 74 OD1 ASP A 418 5.041 -6.337 14.023 1.00 10.00 O ATOM 75 OD2 ASP A 418 5.624 -6.811 16.089 1.00 10.00 O ATOM 0 H ASP A 418 5.495 -1.609 14.756 1.00 10.00 H new ATOM 0 HA ASP A 418 6.442 -4.139 13.700 1.00 10.00 H new ATOM 0 HB2 ASP A 418 6.108 -4.332 16.293 1.00 10.00 H new ATOM 0 HB3 ASP A 418 4.397 -4.225 15.931 1.00 10.00 H new ATOM 80 N PRO A 419 4.597 -3.269 12.128 1.00 10.00 N ATOM 81 CA PRO A 419 3.475 -3.092 11.201 1.00 10.00 C ATOM 82 C PRO A 419 2.449 -4.215 11.310 1.00 10.00 C ATOM 83 O PRO A 419 2.712 -5.252 11.919 1.00 10.00 O ATOM 84 CB PRO A 419 4.143 -3.112 9.824 1.00 10.00 C ATOM 85 CG PRO A 419 5.541 -2.667 10.075 1.00 10.00 C ATOM 86 CD PRO A 419 5.901 -3.182 11.442 1.00 10.00 C ATOM 0 HA PRO A 419 2.919 -2.177 11.407 1.00 10.00 H new ATOM 0 HB2 PRO A 419 4.118 -4.110 9.386 1.00 10.00 H new ATOM 0 HB3 PRO A 419 3.634 -2.445 9.128 1.00 10.00 H new ATOM 0 HG2 PRO A 419 6.218 -3.063 9.318 1.00 10.00 H new ATOM 0 HG3 PRO A 419 5.618 -1.580 10.035 1.00 10.00 H new ATOM 0 HD2 PRO A 419 6.393 -4.153 11.389 1.00 10.00 H new ATOM 0 HD3 PRO A 419 6.583 -2.507 11.959 1.00 10.00 H new ATOM 94 N MET A 420 1.280 -4.001 10.716 1.00 10.00 N ATOM 95 CA MET A 420 0.212 -4.992 10.744 1.00 10.00 C ATOM 96 C MET A 420 -0.275 -5.292 9.336 1.00 10.00 C ATOM 97 O MET A 420 0.170 -6.251 8.717 1.00 10.00 O ATOM 98 CB MET A 420 -0.944 -4.498 11.614 1.00 10.00 C ATOM 99 CG MET A 420 -2.112 -5.470 11.688 1.00 10.00 C ATOM 100 SD MET A 420 -3.544 -4.910 10.745 1.00 10.00 S ATOM 101 CE MET A 420 -4.875 -5.686 11.661 1.00 10.00 C ATOM 0 H MET A 420 1.048 -3.147 10.208 1.00 10.00 H new ATOM 0 HA MET A 420 0.605 -5.913 11.175 1.00 10.00 H new ATOM 0 HB2 MET A 420 -0.574 -4.311 12.622 1.00 10.00 H new ATOM 0 HB3 MET A 420 -1.300 -3.545 11.223 1.00 10.00 H new ATOM 0 HG2 MET A 420 -1.794 -6.443 11.314 1.00 10.00 H new ATOM 0 HG3 MET A 420 -2.400 -5.607 12.730 1.00 10.00 H new ATOM 0 HE1 MET A 420 -5.830 -5.434 11.200 1.00 10.00 H new ATOM 0 HE2 MET A 420 -4.742 -6.768 11.650 1.00 10.00 H new ATOM 0 HE3 MET A 420 -4.864 -5.329 12.691 1.00 10.00 H new ATOM 111 N LYS A 421 -1.183 -4.466 8.827 1.00 10.00 N ATOM 112 CA LYS A 421 -1.715 -4.661 7.482 1.00 10.00 C ATOM 113 C LYS A 421 -0.587 -4.906 6.490 1.00 10.00 C ATOM 114 O LYS A 421 0.082 -3.972 6.050 1.00 10.00 O ATOM 115 CB LYS A 421 -2.543 -3.458 7.044 1.00 10.00 C ATOM 116 CG LYS A 421 -2.988 -3.544 5.595 1.00 10.00 C ATOM 117 CD LYS A 421 -4.248 -4.376 5.432 1.00 10.00 C ATOM 118 CE LYS A 421 -5.399 -3.833 6.265 1.00 10.00 C ATOM 119 NZ LYS A 421 -5.828 -4.797 7.316 1.00 10.00 N ATOM 0 H LYS A 421 -1.564 -3.660 9.322 1.00 10.00 H new ATOM 0 HA LYS A 421 -2.362 -5.538 7.502 1.00 10.00 H new ATOM 0 HB2 LYS A 421 -3.421 -3.375 7.684 1.00 10.00 H new ATOM 0 HB3 LYS A 421 -1.958 -2.549 7.186 1.00 10.00 H new ATOM 0 HG2 LYS A 421 -3.165 -2.540 5.211 1.00 10.00 H new ATOM 0 HG3 LYS A 421 -2.188 -3.978 4.996 1.00 10.00 H new ATOM 0 HD2 LYS A 421 -4.537 -4.394 4.381 1.00 10.00 H new ATOM 0 HD3 LYS A 421 -4.043 -5.406 5.724 1.00 10.00 H new ATOM 0 HE2 LYS A 421 -5.098 -2.896 6.733 1.00 10.00 H new ATOM 0 HE3 LYS A 421 -6.243 -3.607 5.614 1.00 10.00 H new ATOM 0 HZ1 LYS A 421 -6.614 -4.389 7.861 1.00 10.00 H new ATOM 0 HZ2 LYS A 421 -6.140 -5.682 6.868 1.00 10.00 H new ATOM 0 HZ3 LYS A 421 -5.030 -4.994 7.953 1.00 10.00 H new ATOM 133 N VAL A 422 -0.385 -6.171 6.149 1.00 10.00 N ATOM 134 CA VAL A 422 0.661 -6.557 5.219 1.00 10.00 C ATOM 135 C VAL A 422 0.682 -8.073 5.049 1.00 10.00 C ATOM 136 O VAL A 422 0.740 -8.596 3.938 1.00 10.00 O ATOM 137 CB VAL A 422 2.030 -6.045 5.710 1.00 10.00 C ATOM 138 CG1 VAL A 422 2.614 -6.947 6.790 1.00 10.00 C ATOM 139 CG2 VAL A 422 2.997 -5.893 4.548 1.00 10.00 C ATOM 0 H VAL A 422 -0.937 -6.951 6.507 1.00 10.00 H new ATOM 0 HA VAL A 422 0.454 -6.104 4.249 1.00 10.00 H new ATOM 0 HB VAL A 422 1.873 -5.063 6.156 1.00 10.00 H new ATOM 0 HG11 VAL A 422 3.579 -6.553 7.110 1.00 10.00 H new ATOM 0 HG12 VAL A 422 1.935 -6.981 7.642 1.00 10.00 H new ATOM 0 HG13 VAL A 422 2.747 -7.953 6.391 1.00 10.00 H new ATOM 0 HG21 VAL A 422 3.956 -5.531 4.918 1.00 10.00 H new ATOM 0 HG22 VAL A 422 3.137 -6.859 4.062 1.00 10.00 H new ATOM 0 HG23 VAL A 422 2.593 -5.180 3.829 1.00 10.00 H new ATOM 149 N TYR A 423 0.601 -8.756 6.177 1.00 10.00 N ATOM 150 CA TYR A 423 0.565 -10.211 6.241 1.00 10.00 C ATOM 151 C TYR A 423 -0.374 -10.789 5.179 1.00 10.00 C ATOM 152 O TYR A 423 -0.164 -11.900 4.692 1.00 10.00 O ATOM 153 CB TYR A 423 0.078 -10.622 7.638 1.00 10.00 C ATOM 154 CG TYR A 423 -1.201 -9.915 8.040 1.00 10.00 C ATOM 155 CD1 TYR A 423 -1.220 -8.538 8.179 1.00 10.00 C ATOM 156 CD2 TYR A 423 -2.383 -10.608 8.261 1.00 10.00 C ATOM 157 CE1 TYR A 423 -2.356 -7.863 8.521 1.00 10.00 C ATOM 158 CE2 TYR A 423 -3.544 -9.937 8.608 1.00 10.00 C ATOM 159 CZ TYR A 423 -3.526 -8.561 8.735 1.00 10.00 C ATOM 160 OH TYR A 423 -4.675 -7.888 9.080 1.00 10.00 O ATOM 0 H TYR A 423 0.557 -8.309 7.093 1.00 10.00 H new ATOM 0 HA TYR A 423 1.565 -10.601 6.051 1.00 10.00 H new ATOM 0 HB2 TYR A 423 -0.084 -11.700 7.660 1.00 10.00 H new ATOM 0 HB3 TYR A 423 0.856 -10.402 8.369 1.00 10.00 H new ATOM 0 HD1 TYR A 423 -0.310 -7.982 8.012 1.00 10.00 H new ATOM 0 HD2 TYR A 423 -2.398 -11.683 8.161 1.00 10.00 H new ATOM 0 HE1 TYR A 423 -2.339 -6.788 8.623 1.00 10.00 H new ATOM 0 HE2 TYR A 423 -4.458 -10.486 8.778 1.00 10.00 H new ATOM 0 HH TYR A 423 -4.452 -6.968 9.333 1.00 10.00 H new ATOM 170 N LYS A 424 -1.412 -10.030 4.831 1.00 10.00 N ATOM 171 CA LYS A 424 -2.384 -10.473 3.834 1.00 10.00 C ATOM 172 C LYS A 424 -2.287 -9.652 2.548 1.00 10.00 C ATOM 173 O LYS A 424 -3.123 -9.784 1.653 1.00 10.00 O ATOM 174 CB LYS A 424 -3.801 -10.379 4.401 1.00 10.00 C ATOM 175 CG LYS A 424 -4.253 -11.640 5.122 1.00 10.00 C ATOM 176 CD LYS A 424 -5.468 -11.377 5.995 1.00 10.00 C ATOM 177 CE LYS A 424 -6.673 -10.964 5.165 1.00 10.00 C ATOM 178 NZ LYS A 424 -6.884 -11.870 4.003 1.00 10.00 N ATOM 0 H LYS A 424 -1.601 -9.108 5.224 1.00 10.00 H new ATOM 0 HA LYS A 424 -2.156 -11.511 3.590 1.00 10.00 H new ATOM 0 HB2 LYS A 424 -3.852 -9.537 5.092 1.00 10.00 H new ATOM 0 HB3 LYS A 424 -4.495 -10.167 3.588 1.00 10.00 H new ATOM 0 HG2 LYS A 424 -4.489 -12.413 4.391 1.00 10.00 H new ATOM 0 HG3 LYS A 424 -3.438 -12.021 5.737 1.00 10.00 H new ATOM 0 HD2 LYS A 424 -5.708 -12.274 6.565 1.00 10.00 H new ATOM 0 HD3 LYS A 424 -5.236 -10.593 6.716 1.00 10.00 H new ATOM 0 HE2 LYS A 424 -7.564 -10.966 5.793 1.00 10.00 H new ATOM 0 HE3 LYS A 424 -6.536 -9.943 4.809 1.00 10.00 H new ATOM 0 HZ1 LYS A 424 -7.898 -11.911 3.774 1.00 10.00 H new ATOM 0 HZ2 LYS A 424 -6.358 -11.509 3.182 1.00 10.00 H new ATOM 0 HZ3 LYS A 424 -6.544 -12.824 4.240 1.00 10.00 H new ATOM 192 N ASP A 425 -1.269 -8.804 2.463 1.00 10.00 N ATOM 193 CA ASP A 425 -1.062 -7.962 1.291 1.00 10.00 C ATOM 194 C ASP A 425 0.225 -8.328 0.553 1.00 10.00 C ATOM 195 O ASP A 425 0.500 -7.794 -0.520 1.00 10.00 O ATOM 196 CB ASP A 425 -1.025 -6.490 1.702 1.00 10.00 C ATOM 197 CG ASP A 425 -2.303 -6.053 2.388 1.00 10.00 C ATOM 198 OD1 ASP A 425 -3.341 -6.718 2.190 1.00 10.00 O ATOM 199 OD2 ASP A 425 -2.266 -5.049 3.128 1.00 10.00 O ATOM 0 H ASP A 425 -0.570 -8.681 3.196 1.00 10.00 H new ATOM 0 HA ASP A 425 -1.897 -8.130 0.611 1.00 10.00 H new ATOM 0 HB2 ASP A 425 -0.181 -6.323 2.371 1.00 10.00 H new ATOM 0 HB3 ASP A 425 -0.860 -5.872 0.819 1.00 10.00 H new ATOM 204 N ARG A 426 1.011 -9.245 1.118 1.00 10.00 N ATOM 205 CA ARG A 426 2.258 -9.667 0.481 1.00 10.00 C ATOM 206 C ARG A 426 2.004 -10.111 -0.955 1.00 10.00 C ATOM 207 O ARG A 426 2.901 -10.066 -1.797 1.00 10.00 O ATOM 208 CB ARG A 426 2.913 -10.798 1.278 1.00 10.00 C ATOM 209 CG ARG A 426 2.082 -12.068 1.329 1.00 10.00 C ATOM 210 CD ARG A 426 2.959 -13.309 1.369 1.00 10.00 C ATOM 211 NE ARG A 426 2.351 -14.383 2.150 1.00 10.00 N ATOM 212 CZ ARG A 426 2.910 -15.579 2.328 1.00 10.00 C ATOM 213 NH1 ARG A 426 4.087 -15.857 1.780 1.00 10.00 N ATOM 214 NH2 ARG A 426 2.290 -16.498 3.055 1.00 10.00 N ATOM 0 H ARG A 426 0.809 -9.705 2.006 1.00 10.00 H new ATOM 0 HA ARG A 426 2.938 -8.815 0.465 1.00 10.00 H new ATOM 0 HB2 ARG A 426 3.883 -11.027 0.837 1.00 10.00 H new ATOM 0 HB3 ARG A 426 3.098 -10.454 2.296 1.00 10.00 H new ATOM 0 HG2 ARG A 426 1.439 -12.048 2.209 1.00 10.00 H new ATOM 0 HG3 ARG A 426 1.429 -12.111 0.458 1.00 10.00 H new ATOM 0 HD2 ARG A 426 3.140 -13.658 0.352 1.00 10.00 H new ATOM 0 HD3 ARG A 426 3.929 -13.054 1.796 1.00 10.00 H new ATOM 0 HE ARG A 426 1.445 -14.207 2.585 1.00 10.00 H new ATOM 0 HH11 ARG A 426 4.568 -15.153 1.220 1.00 10.00 H new ATOM 0 HH12 ARG A 426 4.511 -16.774 1.919 1.00 10.00 H new ATOM 0 HH21 ARG A 426 1.385 -16.289 3.478 1.00 10.00 H new ATOM 0 HH22 ARG A 426 2.717 -17.414 3.192 1.00 10.00 H new ATOM 228 N GLN A 427 0.767 -10.510 -1.233 1.00 10.00 N ATOM 229 CA GLN A 427 0.384 -10.926 -2.574 1.00 10.00 C ATOM 230 C GLN A 427 -0.262 -9.759 -3.308 1.00 10.00 C ATOM 231 O GLN A 427 -1.127 -9.940 -4.163 1.00 10.00 O ATOM 232 CB GLN A 427 -0.568 -12.127 -2.527 1.00 10.00 C ATOM 233 CG GLN A 427 -1.514 -12.122 -1.334 1.00 10.00 C ATOM 234 CD GLN A 427 -0.900 -12.748 -0.095 1.00 10.00 C ATOM 235 OE1 GLN A 427 -0.501 -13.913 -0.107 1.00 10.00 O ATOM 236 NE2 GLN A 427 -0.822 -11.975 0.983 1.00 10.00 N ATOM 0 H GLN A 427 0.014 -10.553 -0.546 1.00 10.00 H new ATOM 0 HA GLN A 427 1.280 -11.234 -3.113 1.00 10.00 H new ATOM 0 HB2 GLN A 427 -1.157 -12.147 -3.444 1.00 10.00 H new ATOM 0 HB3 GLN A 427 0.021 -13.044 -2.506 1.00 10.00 H new ATOM 0 HG2 GLN A 427 -1.805 -11.096 -1.111 1.00 10.00 H new ATOM 0 HG3 GLN A 427 -2.424 -12.662 -1.595 1.00 10.00 H new ATOM 0 HE21 GLN A 427 -1.165 -11.015 0.948 1.00 10.00 H new ATOM 0 HE22 GLN A 427 -0.419 -12.342 1.845 1.00 10.00 H new ATOM 245 N VAL A 428 0.185 -8.558 -2.960 1.00 10.00 N ATOM 246 CA VAL A 428 -0.310 -7.333 -3.566 1.00 10.00 C ATOM 247 C VAL A 428 0.744 -6.744 -4.486 1.00 10.00 C ATOM 248 O VAL A 428 0.419 -6.124 -5.499 1.00 10.00 O ATOM 249 CB VAL A 428 -0.687 -6.292 -2.499 1.00 10.00 C ATOM 250 CG1 VAL A 428 -1.036 -4.962 -3.145 1.00 10.00 C ATOM 251 CG2 VAL A 428 -1.836 -6.799 -1.646 1.00 10.00 C ATOM 0 H VAL A 428 0.901 -8.409 -2.249 1.00 10.00 H new ATOM 0 HA VAL A 428 -1.204 -7.585 -4.137 1.00 10.00 H new ATOM 0 HB VAL A 428 0.175 -6.134 -1.851 1.00 10.00 H new ATOM 0 HG11 VAL A 428 -1.300 -4.240 -2.372 1.00 10.00 H new ATOM 0 HG12 VAL A 428 -0.178 -4.594 -3.707 1.00 10.00 H new ATOM 0 HG13 VAL A 428 -1.881 -5.096 -3.820 1.00 10.00 H new ATOM 0 HG21 VAL A 428 -2.090 -6.050 -0.896 1.00 10.00 H new ATOM 0 HG22 VAL A 428 -2.703 -6.988 -2.279 1.00 10.00 H new ATOM 0 HG23 VAL A 428 -1.541 -7.724 -1.150 1.00 10.00 H new ATOM 261 N MET A 429 2.011 -6.953 -4.136 1.00 10.00 N ATOM 262 CA MET A 429 3.117 -6.453 -4.947 1.00 10.00 C ATOM 263 C MET A 429 2.878 -6.748 -6.428 1.00 10.00 C ATOM 264 O MET A 429 3.379 -6.042 -7.304 1.00 10.00 O ATOM 265 CB MET A 429 4.436 -7.085 -4.498 1.00 10.00 C ATOM 266 CG MET A 429 4.493 -8.589 -4.706 1.00 10.00 C ATOM 267 SD MET A 429 6.149 -9.263 -4.467 1.00 10.00 S ATOM 268 CE MET A 429 5.764 -10.893 -3.834 1.00 10.00 C ATOM 0 H MET A 429 2.296 -7.463 -3.300 1.00 10.00 H new ATOM 0 HA MET A 429 3.176 -5.373 -4.811 1.00 10.00 H new ATOM 0 HB2 MET A 429 5.256 -6.620 -5.045 1.00 10.00 H new ATOM 0 HB3 MET A 429 4.593 -6.867 -3.442 1.00 10.00 H new ATOM 0 HG2 MET A 429 3.805 -9.074 -4.014 1.00 10.00 H new ATOM 0 HG3 MET A 429 4.151 -8.825 -5.714 1.00 10.00 H new ATOM 0 HE1 MET A 429 6.689 -11.435 -3.637 1.00 10.00 H new ATOM 0 HE2 MET A 429 5.194 -10.799 -2.909 1.00 10.00 H new ATOM 0 HE3 MET A 429 5.174 -11.439 -4.570 1.00 10.00 H new ATOM 278 N ASN A 430 2.105 -7.800 -6.697 1.00 10.00 N ATOM 279 CA ASN A 430 1.792 -8.196 -8.065 1.00 10.00 C ATOM 280 C ASN A 430 0.284 -8.338 -8.270 1.00 10.00 C ATOM 281 O ASN A 430 -0.160 -9.028 -9.189 1.00 10.00 O ATOM 282 CB ASN A 430 2.486 -9.519 -8.390 1.00 10.00 C ATOM 283 CG ASN A 430 3.882 -9.320 -8.944 1.00 10.00 C ATOM 284 OD1 ASN A 430 4.553 -8.336 -8.632 1.00 10.00 O ATOM 285 ND2 ASN A 430 4.328 -10.257 -9.774 1.00 10.00 N ATOM 0 H ASN A 430 1.684 -8.393 -5.982 1.00 10.00 H new ATOM 0 HA ASN A 430 2.153 -7.417 -8.736 1.00 10.00 H new ATOM 0 HB2 ASN A 430 2.540 -10.129 -7.488 1.00 10.00 H new ATOM 0 HB3 ASN A 430 1.887 -10.072 -9.113 1.00 10.00 H new ATOM 0 HD21 ASN A 430 5.260 -10.177 -10.180 1.00 10.00 H new ATOM 0 HD22 ASN A 430 3.738 -11.056 -10.005 1.00 10.00 H new ATOM 292 N MET A 431 -0.501 -7.682 -7.416 1.00 10.00 N ATOM 293 CA MET A 431 -1.960 -7.735 -7.510 1.00 10.00 C ATOM 294 C MET A 431 -2.615 -7.055 -6.313 1.00 10.00 C ATOM 295 O MET A 431 -2.970 -7.709 -5.333 1.00 10.00 O ATOM 296 CB MET A 431 -2.469 -9.181 -7.610 1.00 10.00 C ATOM 297 CG MET A 431 -1.527 -10.223 -7.025 1.00 10.00 C ATOM 298 SD MET A 431 -2.402 -11.566 -6.201 1.00 10.00 S ATOM 299 CE MET A 431 -2.316 -12.845 -7.452 1.00 10.00 C ATOM 0 H MET A 431 -0.151 -7.107 -6.650 1.00 10.00 H new ATOM 0 HA MET A 431 -2.234 -7.202 -8.420 1.00 10.00 H new ATOM 0 HB2 MET A 431 -3.430 -9.251 -7.100 1.00 10.00 H new ATOM 0 HB3 MET A 431 -2.647 -9.418 -8.659 1.00 10.00 H new ATOM 0 HG2 MET A 431 -0.906 -10.634 -7.821 1.00 10.00 H new ATOM 0 HG3 MET A 431 -0.856 -9.742 -6.314 1.00 10.00 H new ATOM 0 HE1 MET A 431 -2.816 -13.743 -7.089 1.00 10.00 H new ATOM 0 HE2 MET A 431 -2.807 -12.498 -8.361 1.00 10.00 H new ATOM 0 HE3 MET A 431 -1.272 -13.073 -7.668 1.00 10.00 H new ATOM 309 N TRP A 432 -2.801 -5.747 -6.414 1.00 10.00 N ATOM 310 CA TRP A 432 -3.445 -4.983 -5.353 1.00 10.00 C ATOM 311 C TRP A 432 -4.951 -5.124 -5.487 1.00 10.00 C ATOM 312 O TRP A 432 -5.588 -4.441 -6.288 1.00 10.00 O ATOM 313 CB TRP A 432 -3.039 -3.506 -5.411 1.00 10.00 C ATOM 314 CG TRP A 432 -1.598 -3.259 -5.775 1.00 10.00 C ATOM 315 CD1 TRP A 432 -0.981 -3.572 -6.949 1.00 10.00 C ATOM 316 CD2 TRP A 432 -0.597 -2.625 -4.965 1.00 10.00 C ATOM 317 NE1 TRP A 432 0.321 -3.147 -6.928 1.00 10.00 N ATOM 318 CE2 TRP A 432 0.583 -2.573 -5.724 1.00 10.00 C ATOM 319 CE3 TRP A 432 -0.587 -2.090 -3.683 1.00 10.00 C ATOM 320 CZ2 TRP A 432 1.757 -2.002 -5.242 1.00 10.00 C ATOM 321 CZ3 TRP A 432 0.578 -1.530 -3.197 1.00 10.00 C ATOM 322 CH2 TRP A 432 1.736 -1.485 -3.977 1.00 10.00 C ATOM 0 H TRP A 432 -2.515 -5.191 -7.220 1.00 10.00 H new ATOM 0 HA TRP A 432 -3.123 -5.374 -4.388 1.00 10.00 H new ATOM 0 HB2 TRP A 432 -3.674 -2.998 -6.136 1.00 10.00 H new ATOM 0 HB3 TRP A 432 -3.237 -3.051 -4.440 1.00 10.00 H new ATOM 0 HD1 TRP A 432 -1.451 -4.082 -7.777 1.00 10.00 H new ATOM 0 HE1 TRP A 432 0.988 -3.246 -7.694 1.00 10.00 H new ATOM 0 HE3 TRP A 432 -1.479 -2.112 -3.074 1.00 10.00 H new ATOM 0 HZ2 TRP A 432 2.652 -1.969 -5.846 1.00 10.00 H new ATOM 0 HZ3 TRP A 432 0.594 -1.120 -2.198 1.00 10.00 H new ATOM 0 HH2 TRP A 432 2.630 -1.034 -3.573 1.00 10.00 H new ATOM 333 N SER A 433 -5.503 -6.040 -4.709 1.00 10.00 N ATOM 334 CA SER A 433 -6.935 -6.318 -4.739 1.00 10.00 C ATOM 335 C SER A 433 -7.751 -5.076 -4.407 1.00 10.00 C ATOM 336 O SER A 433 -7.313 -4.221 -3.638 1.00 10.00 O ATOM 337 CB SER A 433 -7.276 -7.441 -3.759 1.00 10.00 C ATOM 338 OG SER A 433 -8.254 -8.312 -4.302 1.00 10.00 O ATOM 0 H SER A 433 -4.980 -6.609 -4.044 1.00 10.00 H new ATOM 0 HA SER A 433 -7.191 -6.631 -5.751 1.00 10.00 H new ATOM 0 HB2 SER A 433 -6.375 -8.005 -3.520 1.00 10.00 H new ATOM 0 HB3 SER A 433 -7.642 -7.014 -2.825 1.00 10.00 H new ATOM 0 HG SER A 433 -8.454 -9.022 -3.657 1.00 10.00 H new ATOM 344 N GLU A 434 -8.949 -4.988 -4.982 1.00 10.00 N ATOM 345 CA GLU A 434 -9.832 -3.854 -4.733 1.00 10.00 C ATOM 346 C GLU A 434 -9.956 -3.602 -3.235 1.00 10.00 C ATOM 347 O GLU A 434 -10.152 -2.469 -2.796 1.00 10.00 O ATOM 348 CB GLU A 434 -11.214 -4.111 -5.338 1.00 10.00 C ATOM 349 CG GLU A 434 -11.287 -3.831 -6.830 1.00 10.00 C ATOM 350 CD GLU A 434 -12.701 -3.555 -7.302 1.00 10.00 C ATOM 351 OE1 GLU A 434 -13.540 -4.478 -7.233 1.00 10.00 O ATOM 352 OE2 GLU A 434 -12.969 -2.417 -7.743 1.00 10.00 O ATOM 0 H GLU A 434 -9.328 -5.687 -5.621 1.00 10.00 H new ATOM 0 HA GLU A 434 -9.403 -2.970 -5.205 1.00 10.00 H new ATOM 0 HB2 GLU A 434 -11.493 -5.149 -5.158 1.00 10.00 H new ATOM 0 HB3 GLU A 434 -11.948 -3.490 -4.824 1.00 10.00 H new ATOM 0 HG2 GLU A 434 -10.655 -2.975 -7.067 1.00 10.00 H new ATOM 0 HG3 GLU A 434 -10.885 -4.684 -7.376 1.00 10.00 H new ATOM 359 N GLN A 435 -9.823 -4.671 -2.457 1.00 10.00 N ATOM 360 CA GLN A 435 -9.901 -4.581 -1.007 1.00 10.00 C ATOM 361 C GLN A 435 -8.527 -4.276 -0.425 1.00 10.00 C ATOM 362 O GLN A 435 -8.412 -3.620 0.610 1.00 10.00 O ATOM 363 CB GLN A 435 -10.440 -5.885 -0.419 1.00 10.00 C ATOM 364 CG GLN A 435 -11.930 -6.086 -0.648 1.00 10.00 C ATOM 365 CD GLN A 435 -12.307 -6.019 -2.115 1.00 10.00 C ATOM 366 OE1 GLN A 435 -12.338 -7.037 -2.807 1.00 10.00 O ATOM 367 NE2 GLN A 435 -12.598 -4.816 -2.598 1.00 10.00 N ATOM 0 H GLN A 435 -9.660 -5.614 -2.811 1.00 10.00 H new ATOM 0 HA GLN A 435 -10.584 -3.772 -0.747 1.00 10.00 H new ATOM 0 HB2 GLN A 435 -9.897 -6.723 -0.857 1.00 10.00 H new ATOM 0 HB3 GLN A 435 -10.240 -5.901 0.652 1.00 10.00 H new ATOM 0 HG2 GLN A 435 -12.229 -7.053 -0.243 1.00 10.00 H new ATOM 0 HG3 GLN A 435 -12.484 -5.325 -0.099 1.00 10.00 H new ATOM 0 HE21 GLN A 435 -12.560 -3.999 -1.989 1.00 10.00 H new ATOM 0 HE22 GLN A 435 -12.860 -4.710 -3.578 1.00 10.00 H new ATOM 376 N GLU A 436 -7.484 -4.745 -1.106 1.00 10.00 N ATOM 377 CA GLU A 436 -6.127 -4.512 -0.670 1.00 10.00 C ATOM 378 C GLU A 436 -5.750 -3.067 -0.947 1.00 10.00 C ATOM 379 O GLU A 436 -5.423 -2.314 -0.029 1.00 10.00 O ATOM 380 CB GLU A 436 -5.196 -5.494 -1.386 1.00 10.00 C ATOM 381 CG GLU A 436 -4.564 -6.523 -0.459 1.00 10.00 C ATOM 382 CD GLU A 436 -5.553 -7.115 0.528 1.00 10.00 C ATOM 383 OE1 GLU A 436 -5.745 -6.517 1.608 1.00 10.00 O ATOM 384 OE2 GLU A 436 -6.136 -8.176 0.221 1.00 10.00 O ATOM 0 H GLU A 436 -7.563 -5.290 -1.965 1.00 10.00 H new ATOM 0 HA GLU A 436 -6.033 -4.680 0.403 1.00 10.00 H new ATOM 0 HB2 GLU A 436 -5.758 -6.014 -2.162 1.00 10.00 H new ATOM 0 HB3 GLU A 436 -4.406 -4.934 -1.885 1.00 10.00 H new ATOM 0 HG2 GLU A 436 -4.130 -7.325 -1.056 1.00 10.00 H new ATOM 0 HG3 GLU A 436 -3.746 -6.056 0.090 1.00 10.00 H new ATOM 391 N LYS A 437 -5.850 -2.669 -2.207 1.00 10.00 N ATOM 392 CA LYS A 437 -5.573 -1.290 -2.595 1.00 10.00 C ATOM 393 C LYS A 437 -6.426 -0.349 -1.756 1.00 10.00 C ATOM 394 O LYS A 437 -6.119 0.830 -1.617 1.00 10.00 O ATOM 395 CB LYS A 437 -5.879 -1.092 -4.081 1.00 10.00 C ATOM 396 CG LYS A 437 -5.278 0.177 -4.664 1.00 10.00 C ATOM 397 CD LYS A 437 -6.349 1.198 -5.021 1.00 10.00 C ATOM 398 CE LYS A 437 -7.390 0.619 -5.968 1.00 10.00 C ATOM 399 NZ LYS A 437 -8.716 0.461 -5.309 1.00 10.00 N ATOM 0 H LYS A 437 -6.120 -3.279 -2.978 1.00 10.00 H new ATOM 0 HA LYS A 437 -4.519 -1.071 -2.424 1.00 10.00 H new ATOM 0 HB2 LYS A 437 -5.504 -1.951 -4.638 1.00 10.00 H new ATOM 0 HB3 LYS A 437 -6.960 -1.069 -4.221 1.00 10.00 H new ATOM 0 HG2 LYS A 437 -4.584 0.614 -3.946 1.00 10.00 H new ATOM 0 HG3 LYS A 437 -4.700 -0.070 -5.555 1.00 10.00 H new ATOM 0 HD2 LYS A 437 -6.839 1.544 -4.111 1.00 10.00 H new ATOM 0 HD3 LYS A 437 -5.882 2.068 -5.483 1.00 10.00 H new ATOM 0 HE2 LYS A 437 -7.492 1.270 -6.837 1.00 10.00 H new ATOM 0 HE3 LYS A 437 -7.049 -0.350 -6.334 1.00 10.00 H new ATOM 0 HZ1 LYS A 437 -9.201 -0.371 -5.701 1.00 10.00 H new ATOM 0 HZ2 LYS A 437 -8.582 0.334 -4.285 1.00 10.00 H new ATOM 0 HZ3 LYS A 437 -9.292 1.310 -5.480 1.00 10.00 H new ATOM 413 N GLU A 438 -7.497 -0.894 -1.188 1.00 10.00 N ATOM 414 CA GLU A 438 -8.398 -0.121 -0.353 1.00 10.00 C ATOM 415 C GLU A 438 -7.693 0.381 0.900 1.00 10.00 C ATOM 416 O GLU A 438 -8.097 1.383 1.482 1.00 10.00 O ATOM 417 CB GLU A 438 -9.605 -0.971 0.041 1.00 10.00 C ATOM 418 CG GLU A 438 -10.907 -0.188 0.108 1.00 10.00 C ATOM 419 CD GLU A 438 -11.862 -0.734 1.152 1.00 10.00 C ATOM 420 OE1 GLU A 438 -11.387 -1.364 2.120 1.00 10.00 O ATOM 421 OE2 GLU A 438 -13.085 -0.531 1.001 1.00 10.00 O ATOM 0 H GLU A 438 -7.760 -1.874 -1.294 1.00 10.00 H new ATOM 0 HA GLU A 438 -8.732 0.743 -0.928 1.00 10.00 H new ATOM 0 HB2 GLU A 438 -9.716 -1.783 -0.677 1.00 10.00 H new ATOM 0 HB3 GLU A 438 -9.415 -1.428 1.012 1.00 10.00 H new ATOM 0 HG2 GLU A 438 -10.688 0.856 0.332 1.00 10.00 H new ATOM 0 HG3 GLU A 438 -11.391 -0.210 -0.869 1.00 10.00 H new ATOM 428 N THR A 439 -6.647 -0.323 1.326 1.00 10.00 N ATOM 429 CA THR A 439 -5.918 0.076 2.525 1.00 10.00 C ATOM 430 C THR A 439 -4.753 1.011 2.202 1.00 10.00 C ATOM 431 O THR A 439 -4.574 2.036 2.859 1.00 10.00 O ATOM 432 CB THR A 439 -5.411 -1.154 3.277 1.00 10.00 C ATOM 433 OG1 THR A 439 -6.474 -2.049 3.550 1.00 10.00 O ATOM 434 CG2 THR A 439 -4.748 -0.813 4.595 1.00 10.00 C ATOM 0 H THR A 439 -6.290 -1.160 0.866 1.00 10.00 H new ATOM 0 HA THR A 439 -6.615 0.623 3.160 1.00 10.00 H new ATOM 0 HB THR A 439 -4.670 -1.611 2.621 1.00 10.00 H new ATOM 0 HG1 THR A 439 -6.169 -2.970 3.415 1.00 10.00 H new ATOM 0 HG21 THR A 439 -4.410 -1.729 5.080 1.00 10.00 H new ATOM 0 HG22 THR A 439 -3.893 -0.161 4.414 1.00 10.00 H new ATOM 0 HG23 THR A 439 -5.463 -0.303 5.241 1.00 10.00 H new ATOM 442 N PHE A 440 -3.961 0.657 1.196 1.00 10.00 N ATOM 443 CA PHE A 440 -2.821 1.469 0.806 1.00 10.00 C ATOM 444 C PHE A 440 -3.281 2.705 0.039 1.00 10.00 C ATOM 445 O PHE A 440 -2.645 3.757 0.100 1.00 10.00 O ATOM 446 CB PHE A 440 -1.847 0.648 -0.047 1.00 10.00 C ATOM 447 CG PHE A 440 -2.241 -0.781 -0.226 1.00 10.00 C ATOM 448 CD1 PHE A 440 -2.284 -1.664 0.841 1.00 10.00 C ATOM 449 CD2 PHE A 440 -2.581 -1.237 -1.474 1.00 10.00 C ATOM 450 CE1 PHE A 440 -2.661 -2.972 0.644 1.00 10.00 C ATOM 451 CE2 PHE A 440 -2.956 -2.537 -1.674 1.00 10.00 C ATOM 452 CZ PHE A 440 -2.995 -3.399 -0.623 1.00 10.00 C ATOM 0 H PHE A 440 -4.090 -0.187 0.638 1.00 10.00 H new ATOM 0 HA PHE A 440 -2.306 1.794 1.710 1.00 10.00 H new ATOM 0 HB2 PHE A 440 -1.760 1.114 -1.028 1.00 10.00 H new ATOM 0 HB3 PHE A 440 -0.859 0.686 0.413 1.00 10.00 H new ATOM 0 HD1 PHE A 440 -2.020 -1.324 1.832 1.00 10.00 H new ATOM 0 HD2 PHE A 440 -2.552 -0.558 -2.313 1.00 10.00 H new ATOM 0 HE1 PHE A 440 -2.695 -3.659 1.476 1.00 10.00 H new ATOM 0 HE2 PHE A 440 -3.220 -2.878 -2.664 1.00 10.00 H new ATOM 0 HZ PHE A 440 -3.290 -4.426 -0.782 1.00 10.00 H new ATOM 462 N ARG A 441 -4.395 2.576 -0.678 1.00 10.00 N ATOM 463 CA ARG A 441 -4.935 3.691 -1.444 1.00 10.00 C ATOM 464 C ARG A 441 -5.749 4.616 -0.545 1.00 10.00 C ATOM 465 O ARG A 441 -5.834 5.819 -0.792 1.00 10.00 O ATOM 466 CB ARG A 441 -5.808 3.194 -2.597 1.00 10.00 C ATOM 467 CG ARG A 441 -6.073 4.253 -3.655 1.00 10.00 C ATOM 468 CD ARG A 441 -7.359 5.013 -3.374 1.00 10.00 C ATOM 469 NE ARG A 441 -8.537 4.285 -3.840 1.00 10.00 N ATOM 470 CZ ARG A 441 -9.779 4.761 -3.771 1.00 10.00 C ATOM 471 NH1 ARG A 441 -10.008 5.963 -3.257 1.00 10.00 N ATOM 472 NH2 ARG A 441 -10.793 4.033 -4.217 1.00 10.00 N ATOM 0 H ARG A 441 -4.937 1.714 -0.743 1.00 10.00 H new ATOM 0 HA ARG A 441 -4.093 4.246 -1.858 1.00 10.00 H new ATOM 0 HB2 ARG A 441 -5.325 2.337 -3.065 1.00 10.00 H new ATOM 0 HB3 ARG A 441 -6.760 2.844 -2.197 1.00 10.00 H new ATOM 0 HG2 ARG A 441 -5.237 4.951 -3.689 1.00 10.00 H new ATOM 0 HG3 ARG A 441 -6.135 3.781 -4.636 1.00 10.00 H new ATOM 0 HD2 ARG A 441 -7.446 5.196 -2.303 1.00 10.00 H new ATOM 0 HD3 ARG A 441 -7.318 5.987 -3.861 1.00 10.00 H new ATOM 0 HE ARG A 441 -8.400 3.358 -4.242 1.00 10.00 H new ATOM 0 HH11 ARG A 441 -9.231 6.527 -2.913 1.00 10.00 H new ATOM 0 HH12 ARG A 441 -10.961 6.323 -3.206 1.00 10.00 H new ATOM 0 HH21 ARG A 441 -10.622 3.109 -4.613 1.00 10.00 H new ATOM 0 HH22 ARG A 441 -11.744 4.397 -4.164 1.00 10.00 H new ATOM 486 N GLU A 442 -6.351 4.049 0.502 1.00 10.00 N ATOM 487 CA GLU A 442 -7.158 4.834 1.432 1.00 10.00 C ATOM 488 C GLU A 442 -6.279 5.540 2.453 1.00 10.00 C ATOM 489 O GLU A 442 -6.579 6.658 2.871 1.00 10.00 O ATOM 490 CB GLU A 442 -8.179 3.949 2.148 1.00 10.00 C ATOM 491 CG GLU A 442 -9.081 4.711 3.104 1.00 10.00 C ATOM 492 CD GLU A 442 -10.468 4.109 3.202 1.00 10.00 C ATOM 493 OE1 GLU A 442 -10.623 3.085 3.901 1.00 10.00 O ATOM 494 OE2 GLU A 442 -11.400 4.660 2.579 1.00 10.00 O ATOM 0 H GLU A 442 -6.295 3.055 0.725 1.00 10.00 H new ATOM 0 HA GLU A 442 -7.692 5.587 0.852 1.00 10.00 H new ATOM 0 HB2 GLU A 442 -8.796 3.445 1.404 1.00 10.00 H new ATOM 0 HB3 GLU A 442 -7.650 3.173 2.702 1.00 10.00 H new ATOM 0 HG2 GLU A 442 -8.625 4.726 4.094 1.00 10.00 H new ATOM 0 HG3 GLU A 442 -9.161 5.747 2.774 1.00 10.00 H new ATOM 501 N LYS A 443 -5.186 4.894 2.846 1.00 10.00 N ATOM 502 CA LYS A 443 -4.274 5.485 3.804 1.00 10.00 C ATOM 503 C LYS A 443 -3.627 6.711 3.188 1.00 10.00 C ATOM 504 O LYS A 443 -3.481 7.744 3.835 1.00 10.00 O ATOM 505 CB LYS A 443 -3.205 4.476 4.225 1.00 10.00 C ATOM 506 CG LYS A 443 -3.667 3.517 5.311 1.00 10.00 C ATOM 507 CD LYS A 443 -4.179 4.263 6.534 1.00 10.00 C ATOM 508 CE LYS A 443 -3.670 3.636 7.823 1.00 10.00 C ATOM 509 NZ LYS A 443 -3.848 4.544 8.990 1.00 10.00 N ATOM 0 H LYS A 443 -4.916 3.968 2.515 1.00 10.00 H new ATOM 0 HA LYS A 443 -4.832 5.777 4.694 1.00 10.00 H new ATOM 0 HB2 LYS A 443 -2.896 3.901 3.352 1.00 10.00 H new ATOM 0 HB3 LYS A 443 -2.327 5.016 4.578 1.00 10.00 H new ATOM 0 HG2 LYS A 443 -4.456 2.875 4.919 1.00 10.00 H new ATOM 0 HG3 LYS A 443 -2.841 2.867 5.600 1.00 10.00 H new ATOM 0 HD2 LYS A 443 -3.862 5.305 6.485 1.00 10.00 H new ATOM 0 HD3 LYS A 443 -5.269 4.261 6.533 1.00 10.00 H new ATOM 0 HE2 LYS A 443 -4.200 2.701 8.006 1.00 10.00 H new ATOM 0 HE3 LYS A 443 -2.614 3.388 7.714 1.00 10.00 H new ATOM 0 HZ1 LYS A 443 -3.489 4.080 9.849 1.00 10.00 H new ATOM 0 HZ2 LYS A 443 -3.322 5.426 8.827 1.00 10.00 H new ATOM 0 HZ3 LYS A 443 -4.858 4.761 9.110 1.00 10.00 H new ATOM 523 N PHE A 444 -3.268 6.597 1.915 1.00 10.00 N ATOM 524 CA PHE A 444 -2.662 7.699 1.198 1.00 10.00 C ATOM 525 C PHE A 444 -3.667 8.826 1.096 1.00 10.00 C ATOM 526 O PHE A 444 -3.310 10.003 1.152 1.00 10.00 O ATOM 527 CB PHE A 444 -2.192 7.232 -0.177 1.00 10.00 C ATOM 528 CG PHE A 444 -1.523 8.302 -0.986 1.00 10.00 C ATOM 529 CD1 PHE A 444 -2.243 9.378 -1.479 1.00 10.00 C ATOM 530 CD2 PHE A 444 -0.169 8.227 -1.251 1.00 10.00 C ATOM 531 CE1 PHE A 444 -1.619 10.361 -2.225 1.00 10.00 C ATOM 532 CE2 PHE A 444 0.462 9.204 -1.996 1.00 10.00 C ATOM 533 CZ PHE A 444 -0.264 10.275 -2.483 1.00 10.00 C ATOM 0 H PHE A 444 -3.389 5.748 1.362 1.00 10.00 H new ATOM 0 HA PHE A 444 -1.785 8.064 1.733 1.00 10.00 H new ATOM 0 HB2 PHE A 444 -1.500 6.400 -0.050 1.00 10.00 H new ATOM 0 HB3 PHE A 444 -3.049 6.852 -0.733 1.00 10.00 H new ATOM 0 HD1 PHE A 444 -3.302 9.450 -1.279 1.00 10.00 H new ATOM 0 HD2 PHE A 444 0.403 7.394 -0.871 1.00 10.00 H new ATOM 0 HE1 PHE A 444 -2.190 11.195 -2.606 1.00 10.00 H new ATOM 0 HE2 PHE A 444 1.521 9.131 -2.198 1.00 10.00 H new ATOM 0 HZ PHE A 444 0.226 11.042 -3.064 1.00 10.00 H new ATOM 543 N MET A 445 -4.938 8.454 1.012 1.00 10.00 N ATOM 544 CA MET A 445 -6.001 9.432 0.980 1.00 10.00 C ATOM 545 C MET A 445 -6.136 10.023 2.380 1.00 10.00 C ATOM 546 O MET A 445 -6.516 11.180 2.557 1.00 10.00 O ATOM 547 CB MET A 445 -7.318 8.797 0.533 1.00 10.00 C ATOM 548 CG MET A 445 -8.359 9.808 0.080 1.00 10.00 C ATOM 549 SD MET A 445 -7.888 10.656 -1.440 1.00 10.00 S ATOM 550 CE MET A 445 -9.104 11.968 -1.487 1.00 10.00 C ATOM 0 H MET A 445 -5.250 7.484 0.965 1.00 10.00 H new ATOM 0 HA MET A 445 -5.763 10.215 0.260 1.00 10.00 H new ATOM 0 HB2 MET A 445 -7.118 8.103 -0.284 1.00 10.00 H new ATOM 0 HB3 MET A 445 -7.727 8.211 1.356 1.00 10.00 H new ATOM 0 HG2 MET A 445 -9.311 9.300 -0.072 1.00 10.00 H new ATOM 0 HG3 MET A 445 -8.513 10.544 0.869 1.00 10.00 H new ATOM 0 HE1 MET A 445 -8.943 12.582 -2.373 1.00 10.00 H new ATOM 0 HE2 MET A 445 -10.104 11.536 -1.521 1.00 10.00 H new ATOM 0 HE3 MET A 445 -9.006 12.587 -0.595 1.00 10.00 H new ATOM 560 N GLN A 446 -5.783 9.198 3.366 1.00 10.00 N ATOM 561 CA GLN A 446 -5.809 9.581 4.769 1.00 10.00 C ATOM 562 C GLN A 446 -4.645 10.509 5.071 1.00 10.00 C ATOM 563 O GLN A 446 -4.766 11.467 5.836 1.00 10.00 O ATOM 564 CB GLN A 446 -5.689 8.328 5.642 1.00 10.00 C ATOM 565 CG GLN A 446 -6.200 8.516 7.060 1.00 10.00 C ATOM 566 CD GLN A 446 -6.948 7.301 7.573 1.00 10.00 C ATOM 567 OE1 GLN A 446 -6.672 6.805 8.666 1.00 10.00 O ATOM 568 NE2 GLN A 446 -7.900 6.815 6.785 1.00 10.00 N ATOM 0 H GLN A 446 -5.470 8.240 3.208 1.00 10.00 H new ATOM 0 HA GLN A 446 -6.748 10.093 4.982 1.00 10.00 H new ATOM 0 HB2 GLN A 446 -6.242 7.515 5.172 1.00 10.00 H new ATOM 0 HB3 GLN A 446 -4.643 8.022 5.680 1.00 10.00 H new ATOM 0 HG2 GLN A 446 -5.359 8.727 7.721 1.00 10.00 H new ATOM 0 HG3 GLN A 446 -6.858 9.385 7.094 1.00 10.00 H new ATOM 0 HE21 GLN A 446 -8.095 7.258 5.887 1.00 10.00 H new ATOM 0 HE22 GLN A 446 -8.437 5.998 7.078 1.00 10.00 H new ATOM 577 N HIS A 447 -3.510 10.193 4.463 1.00 10.00 N ATOM 578 CA HIS A 447 -2.288 10.956 4.644 1.00 10.00 C ATOM 579 C HIS A 447 -1.989 11.792 3.399 1.00 10.00 C ATOM 580 O HIS A 447 -1.514 11.271 2.391 1.00 10.00 O ATOM 581 CB HIS A 447 -1.140 9.991 4.947 1.00 10.00 C ATOM 582 CG HIS A 447 -1.492 8.987 6.008 1.00 10.00 C ATOM 583 ND1 HIS A 447 -1.559 9.311 7.347 1.00 10.00 N ATOM 584 CD2 HIS A 447 -1.827 7.669 5.927 1.00 10.00 C ATOM 585 CE1 HIS A 447 -1.916 8.246 8.040 1.00 10.00 C ATOM 586 NE2 HIS A 447 -2.086 7.239 7.204 1.00 10.00 N ATOM 0 H HIS A 447 -3.413 9.399 3.830 1.00 10.00 H new ATOM 0 HA HIS A 447 -2.406 11.644 5.481 1.00 10.00 H new ATOM 0 HB2 HIS A 447 -0.861 9.466 4.033 1.00 10.00 H new ATOM 0 HB3 HIS A 447 -0.267 10.560 5.266 1.00 10.00 H new ATOM 0 HD1 HIS A 447 -1.363 10.231 7.741 1.00 10.00 H new ATOM 0 HD2 HIS A 447 -1.879 7.074 5.027 1.00 10.00 H new ATOM 0 HE1 HIS A 447 -2.047 8.205 9.111 1.00 10.00 H new ATOM 595 N PRO A 448 -2.287 13.106 3.450 1.00 10.00 N ATOM 596 CA PRO A 448 -2.070 14.021 2.321 1.00 10.00 C ATOM 597 C PRO A 448 -0.703 13.861 1.662 1.00 10.00 C ATOM 598 O PRO A 448 0.247 14.560 2.008 1.00 10.00 O ATOM 599 CB PRO A 448 -2.190 15.399 2.967 1.00 10.00 C ATOM 600 CG PRO A 448 -3.129 15.198 4.104 1.00 10.00 C ATOM 601 CD PRO A 448 -2.877 13.803 4.612 1.00 10.00 C ATOM 0 HA PRO A 448 -2.780 13.835 1.515 1.00 10.00 H new ATOM 0 HB2 PRO A 448 -1.221 15.761 3.312 1.00 10.00 H new ATOM 0 HB3 PRO A 448 -2.573 16.136 2.261 1.00 10.00 H new ATOM 0 HG2 PRO A 448 -2.956 15.935 4.888 1.00 10.00 H new ATOM 0 HG3 PRO A 448 -4.163 15.314 3.780 1.00 10.00 H new ATOM 0 HD2 PRO A 448 -2.198 13.804 5.465 1.00 10.00 H new ATOM 0 HD3 PRO A 448 -3.800 13.324 4.940 1.00 10.00 H new ATOM 609 N LYS A 449 -0.624 12.951 0.694 1.00 10.00 N ATOM 610 CA LYS A 449 0.615 12.702 -0.041 1.00 10.00 C ATOM 611 C LYS A 449 1.787 12.414 0.895 1.00 10.00 C ATOM 612 O LYS A 449 2.214 13.278 1.659 1.00 10.00 O ATOM 613 CB LYS A 449 0.948 13.901 -0.932 1.00 10.00 C ATOM 614 CG LYS A 449 1.507 13.514 -2.291 1.00 10.00 C ATOM 615 CD LYS A 449 0.425 13.516 -3.359 1.00 10.00 C ATOM 616 CE LYS A 449 0.350 14.856 -4.073 1.00 10.00 C ATOM 617 NZ LYS A 449 -0.574 14.813 -5.240 1.00 10.00 N ATOM 0 H LYS A 449 -1.409 12.370 0.399 1.00 10.00 H new ATOM 0 HA LYS A 449 0.456 11.817 -0.658 1.00 10.00 H new ATOM 0 HB2 LYS A 449 0.047 14.497 -1.076 1.00 10.00 H new ATOM 0 HB3 LYS A 449 1.671 14.535 -0.418 1.00 10.00 H new ATOM 0 HG2 LYS A 449 2.298 14.209 -2.572 1.00 10.00 H new ATOM 0 HG3 LYS A 449 1.959 12.524 -2.231 1.00 10.00 H new ATOM 0 HD2 LYS A 449 0.626 12.727 -4.084 1.00 10.00 H new ATOM 0 HD3 LYS A 449 -0.539 13.291 -2.902 1.00 10.00 H new ATOM 0 HE2 LYS A 449 0.015 15.622 -3.373 1.00 10.00 H new ATOM 0 HE3 LYS A 449 1.346 15.144 -4.409 1.00 10.00 H new ATOM 0 HZ1 LYS A 449 -0.597 15.746 -5.699 1.00 10.00 H new ATOM 0 HZ2 LYS A 449 -0.241 14.100 -5.920 1.00 10.00 H new ATOM 0 HZ3 LYS A 449 -1.530 14.563 -4.917 1.00 10.00 H new ATOM 631 N ASN A 450 2.311 11.196 0.819 1.00 10.00 N ATOM 632 CA ASN A 450 3.441 10.802 1.650 1.00 10.00 C ATOM 633 C ASN A 450 4.064 9.504 1.148 1.00 10.00 C ATOM 634 O ASN A 450 5.242 9.466 0.792 1.00 10.00 O ATOM 635 CB ASN A 450 3.014 10.653 3.114 1.00 10.00 C ATOM 636 CG ASN A 450 1.693 9.923 3.271 1.00 10.00 C ATOM 637 OD1 ASN A 450 0.714 10.235 2.595 1.00 10.00 O ATOM 638 ND2 ASN A 450 1.661 8.942 4.167 1.00 10.00 N ATOM 0 H ASN A 450 1.972 10.466 0.192 1.00 10.00 H new ATOM 0 HA ASN A 450 4.191 11.590 1.585 1.00 10.00 H new ATOM 0 HB2 ASN A 450 3.788 10.115 3.660 1.00 10.00 H new ATOM 0 HB3 ASN A 450 2.933 11.641 3.566 1.00 10.00 H new ATOM 0 HD21 ASN A 450 0.801 8.415 4.315 1.00 10.00 H new ATOM 0 HD22 ASN A 450 2.497 8.716 4.706 1.00 10.00 H new ATOM 645 N PHE A 451 3.267 8.443 1.128 1.00 10.00 N ATOM 646 CA PHE A 451 3.726 7.128 0.677 1.00 10.00 C ATOM 647 C PHE A 451 4.591 6.445 1.736 1.00 10.00 C ATOM 648 O PHE A 451 4.652 5.218 1.799 1.00 10.00 O ATOM 649 CB PHE A 451 4.492 7.243 -0.649 1.00 10.00 C ATOM 650 CG PHE A 451 3.875 6.457 -1.774 1.00 10.00 C ATOM 651 CD1 PHE A 451 2.500 6.327 -1.867 1.00 10.00 C ATOM 652 CD2 PHE A 451 4.667 5.852 -2.737 1.00 10.00 C ATOM 653 CE1 PHE A 451 1.923 5.609 -2.895 1.00 10.00 C ATOM 654 CE2 PHE A 451 4.096 5.132 -3.770 1.00 10.00 C ATOM 655 CZ PHE A 451 2.721 5.011 -3.849 1.00 10.00 C ATOM 0 H PHE A 451 2.290 8.465 1.421 1.00 10.00 H new ATOM 0 HA PHE A 451 2.843 6.510 0.515 1.00 10.00 H new ATOM 0 HB2 PHE A 451 4.546 8.293 -0.938 1.00 10.00 H new ATOM 0 HB3 PHE A 451 5.516 6.901 -0.498 1.00 10.00 H new ATOM 0 HD1 PHE A 451 1.870 6.794 -1.125 1.00 10.00 H new ATOM 0 HD2 PHE A 451 5.742 5.944 -2.680 1.00 10.00 H new ATOM 0 HE1 PHE A 451 0.849 5.515 -2.953 1.00 10.00 H new ATOM 0 HE2 PHE A 451 4.723 4.665 -4.514 1.00 10.00 H new ATOM 0 HZ PHE A 451 2.272 4.450 -4.655 1.00 10.00 H new ATOM 665 N GLY A 452 5.248 7.242 2.574 1.00 10.00 N ATOM 666 CA GLY A 452 6.082 6.689 3.620 1.00 10.00 C ATOM 667 C GLY A 452 5.283 5.838 4.584 1.00 10.00 C ATOM 668 O GLY A 452 5.662 4.706 4.884 1.00 10.00 O ATOM 0 H GLY A 452 5.216 8.261 2.545 1.00 10.00 H new ATOM 0 HA2 GLY A 452 6.874 6.087 3.174 1.00 10.00 H new ATOM 0 HA3 GLY A 452 6.566 7.499 4.165 1.00 10.00 H new ATOM 672 N LEU A 453 4.164 6.378 5.061 1.00 10.00 N ATOM 673 CA LEU A 453 3.307 5.648 5.983 1.00 10.00 C ATOM 674 C LEU A 453 2.716 4.432 5.294 1.00 10.00 C ATOM 675 O LEU A 453 2.845 3.306 5.775 1.00 10.00 O ATOM 676 CB LEU A 453 2.183 6.537 6.514 1.00 10.00 C ATOM 677 CG LEU A 453 1.097 5.792 7.293 1.00 10.00 C ATOM 678 CD1 LEU A 453 0.522 6.675 8.386 1.00 10.00 C ATOM 679 CD2 LEU A 453 0.002 5.306 6.349 1.00 10.00 C ATOM 0 H LEU A 453 3.833 7.313 4.824 1.00 10.00 H new ATOM 0 HA LEU A 453 3.918 5.327 6.827 1.00 10.00 H new ATOM 0 HB2 LEU A 453 2.616 7.301 7.160 1.00 10.00 H new ATOM 0 HB3 LEU A 453 1.719 7.055 5.674 1.00 10.00 H new ATOM 0 HG LEU A 453 1.547 4.920 7.768 1.00 10.00 H new ATOM 0 HD11 LEU A 453 -0.249 6.127 8.929 1.00 10.00 H new ATOM 0 HD12 LEU A 453 1.315 6.964 9.075 1.00 10.00 H new ATOM 0 HD13 LEU A 453 0.086 7.569 7.940 1.00 10.00 H new ATOM 0 HD21 LEU A 453 -0.762 4.778 6.919 1.00 10.00 H new ATOM 0 HD22 LEU A 453 -0.448 6.160 5.843 1.00 10.00 H new ATOM 0 HD23 LEU A 453 0.433 4.632 5.609 1.00 10.00 H new ATOM 691 N ILE A 454 2.071 4.661 4.158 1.00 10.00 N ATOM 692 CA ILE A 454 1.472 3.579 3.402 1.00 10.00 C ATOM 693 C ILE A 454 2.513 2.528 3.078 1.00 10.00 C ATOM 694 O ILE A 454 2.286 1.340 3.276 1.00 10.00 O ATOM 695 CB ILE A 454 0.810 4.108 2.123 1.00 10.00 C ATOM 696 CG1 ILE A 454 -0.562 4.639 2.482 1.00 10.00 C ATOM 697 CG2 ILE A 454 0.713 3.034 1.045 1.00 10.00 C ATOM 698 CD1 ILE A 454 -0.558 6.132 2.699 1.00 10.00 C ATOM 0 H ILE A 454 1.951 5.585 3.744 1.00 10.00 H new ATOM 0 HA ILE A 454 0.695 3.118 4.012 1.00 10.00 H new ATOM 0 HB ILE A 454 1.425 4.906 1.707 1.00 10.00 H new ATOM 0 HG12 ILE A 454 -1.265 4.391 1.686 1.00 10.00 H new ATOM 0 HG13 ILE A 454 -0.916 4.143 3.386 1.00 10.00 H new ATOM 0 HG21 ILE A 454 0.238 3.452 0.157 1.00 10.00 H new ATOM 0 HG22 ILE A 454 1.713 2.683 0.790 1.00 10.00 H new ATOM 0 HG23 ILE A 454 0.118 2.199 1.416 1.00 10.00 H new ATOM 0 HD11 ILE A 454 -1.564 6.465 2.954 1.00 10.00 H new ATOM 0 HD12 ILE A 454 0.124 6.380 3.513 1.00 10.00 H new ATOM 0 HD13 ILE A 454 -0.231 6.631 1.787 1.00 10.00 H new ATOM 710 N ALA A 455 3.669 2.979 2.623 1.00 10.00 N ATOM 711 CA ALA A 455 4.764 2.076 2.316 1.00 10.00 C ATOM 712 C ALA A 455 5.459 1.631 3.600 1.00 10.00 C ATOM 713 O ALA A 455 6.514 0.999 3.560 1.00 10.00 O ATOM 714 CB ALA A 455 5.757 2.746 1.379 1.00 10.00 C ATOM 0 H ALA A 455 3.873 3.965 2.458 1.00 10.00 H new ATOM 0 HA ALA A 455 4.359 1.195 1.817 1.00 10.00 H new ATOM 0 HB1 ALA A 455 6.572 2.056 1.159 1.00 10.00 H new ATOM 0 HB2 ALA A 455 5.254 3.021 0.452 1.00 10.00 H new ATOM 0 HB3 ALA A 455 6.158 3.641 1.854 1.00 10.00 H new ATOM 720 N SER A 456 4.857 1.969 4.745 1.00 10.00 N ATOM 721 CA SER A 456 5.418 1.608 6.038 1.00 10.00 C ATOM 722 C SER A 456 4.526 0.606 6.764 1.00 10.00 C ATOM 723 O SER A 456 5.023 -0.271 7.470 1.00 10.00 O ATOM 724 CB SER A 456 5.616 2.854 6.903 1.00 10.00 C ATOM 725 OG SER A 456 5.822 2.506 8.261 1.00 10.00 O ATOM 0 H SER A 456 3.982 2.491 4.796 1.00 10.00 H new ATOM 0 HA SER A 456 6.387 1.141 5.862 1.00 10.00 H new ATOM 0 HB2 SER A 456 6.471 3.423 6.537 1.00 10.00 H new ATOM 0 HB3 SER A 456 4.743 3.501 6.819 1.00 10.00 H new ATOM 0 HG SER A 456 5.947 3.320 8.792 1.00 10.00 H new ATOM 731 N PHE A 457 3.208 0.726 6.592 1.00 10.00 N ATOM 732 CA PHE A 457 2.289 -0.199 7.248 1.00 10.00 C ATOM 733 C PHE A 457 2.234 -1.529 6.492 1.00 10.00 C ATOM 734 O PHE A 457 1.848 -2.556 7.052 1.00 10.00 O ATOM 735 CB PHE A 457 0.890 0.422 7.398 1.00 10.00 C ATOM 736 CG PHE A 457 0.031 0.341 6.168 1.00 10.00 C ATOM 737 CD1 PHE A 457 -0.498 -0.873 5.756 1.00 10.00 C ATOM 738 CD2 PHE A 457 -0.248 1.477 5.425 1.00 10.00 C ATOM 739 CE1 PHE A 457 -1.283 -0.951 4.625 1.00 10.00 C ATOM 740 CE2 PHE A 457 -1.034 1.404 4.295 1.00 10.00 C ATOM 741 CZ PHE A 457 -1.551 0.191 3.893 1.00 10.00 C ATOM 0 H PHE A 457 2.762 1.440 6.016 1.00 10.00 H new ATOM 0 HA PHE A 457 2.664 -0.399 8.252 1.00 10.00 H new ATOM 0 HB2 PHE A 457 0.373 -0.075 8.219 1.00 10.00 H new ATOM 0 HB3 PHE A 457 1.001 1.469 7.679 1.00 10.00 H new ATOM 0 HD1 PHE A 457 -0.293 -1.767 6.327 1.00 10.00 H new ATOM 0 HD2 PHE A 457 0.155 2.430 5.735 1.00 10.00 H new ATOM 0 HE1 PHE A 457 -1.688 -1.902 4.312 1.00 10.00 H new ATOM 0 HE2 PHE A 457 -1.245 2.297 3.725 1.00 10.00 H new ATOM 0 HZ PHE A 457 -2.165 0.133 3.007 1.00 10.00 H new ATOM 751 N LEU A 458 2.642 -1.505 5.223 1.00 10.00 N ATOM 752 CA LEU A 458 2.663 -2.708 4.394 1.00 10.00 C ATOM 753 C LEU A 458 4.066 -2.929 3.830 1.00 10.00 C ATOM 754 O LEU A 458 4.250 -3.076 2.623 1.00 10.00 O ATOM 755 CB LEU A 458 1.641 -2.597 3.258 1.00 10.00 C ATOM 756 CG LEU A 458 1.540 -1.215 2.614 1.00 10.00 C ATOM 757 CD1 LEU A 458 2.882 -0.811 2.025 1.00 10.00 C ATOM 758 CD2 LEU A 458 0.453 -1.194 1.546 1.00 10.00 C ATOM 0 H LEU A 458 2.963 -0.662 4.747 1.00 10.00 H new ATOM 0 HA LEU A 458 2.393 -3.564 5.013 1.00 10.00 H new ATOM 0 HB2 LEU A 458 1.897 -3.323 2.486 1.00 10.00 H new ATOM 0 HB3 LEU A 458 0.660 -2.874 3.644 1.00 10.00 H new ATOM 0 HG LEU A 458 1.268 -0.493 3.384 1.00 10.00 H new ATOM 0 HD11 LEU A 458 2.797 0.175 1.569 1.00 10.00 H new ATOM 0 HD12 LEU A 458 3.632 -0.782 2.815 1.00 10.00 H new ATOM 0 HD13 LEU A 458 3.180 -1.536 1.268 1.00 10.00 H new ATOM 0 HD21 LEU A 458 0.399 -0.200 1.101 1.00 10.00 H new ATOM 0 HD22 LEU A 458 0.688 -1.925 0.773 1.00 10.00 H new ATOM 0 HD23 LEU A 458 -0.507 -1.441 1.999 1.00 10.00 H new ATOM 770 N GLU A 459 5.046 -2.934 4.732 1.00 10.00 N ATOM 771 CA GLU A 459 6.464 -3.113 4.392 1.00 10.00 C ATOM 772 C GLU A 459 6.678 -3.961 3.138 1.00 10.00 C ATOM 773 O GLU A 459 7.529 -3.643 2.307 1.00 10.00 O ATOM 774 CB GLU A 459 7.205 -3.748 5.571 1.00 10.00 C ATOM 775 CG GLU A 459 7.537 -2.765 6.681 1.00 10.00 C ATOM 776 CD GLU A 459 8.852 -3.081 7.365 1.00 10.00 C ATOM 777 OE1 GLU A 459 9.901 -2.603 6.886 1.00 10.00 O ATOM 778 OE2 GLU A 459 8.833 -3.807 8.382 1.00 10.00 O ATOM 0 H GLU A 459 4.880 -2.813 5.731 1.00 10.00 H new ATOM 0 HA GLU A 459 6.863 -2.121 4.180 1.00 10.00 H new ATOM 0 HB2 GLU A 459 6.596 -4.554 5.981 1.00 10.00 H new ATOM 0 HB3 GLU A 459 8.129 -4.199 5.208 1.00 10.00 H new ATOM 0 HG2 GLU A 459 7.579 -1.757 6.268 1.00 10.00 H new ATOM 0 HG3 GLU A 459 6.736 -2.773 7.420 1.00 10.00 H new ATOM 785 N ARG A 460 5.913 -5.041 3.005 1.00 10.00 N ATOM 786 CA ARG A 460 6.032 -5.928 1.848 1.00 10.00 C ATOM 787 C ARG A 460 6.085 -5.128 0.547 1.00 10.00 C ATOM 788 O ARG A 460 6.660 -5.572 -0.446 1.00 10.00 O ATOM 789 CB ARG A 460 4.861 -6.912 1.810 1.00 10.00 C ATOM 790 CG ARG A 460 5.187 -8.268 2.416 1.00 10.00 C ATOM 791 CD ARG A 460 5.608 -8.143 3.871 1.00 10.00 C ATOM 792 NE ARG A 460 6.684 -9.069 4.211 1.00 10.00 N ATOM 793 CZ ARG A 460 6.519 -10.385 4.331 1.00 10.00 C ATOM 794 NH1 ARG A 460 5.325 -10.931 4.141 1.00 10.00 N ATOM 795 NH2 ARG A 460 7.553 -11.156 4.643 1.00 10.00 N ATOM 0 H ARG A 460 5.205 -5.324 3.682 1.00 10.00 H new ATOM 0 HA ARG A 460 6.963 -6.486 1.946 1.00 10.00 H new ATOM 0 HB2 ARG A 460 4.015 -6.478 2.344 1.00 10.00 H new ATOM 0 HB3 ARG A 460 4.548 -7.051 0.775 1.00 10.00 H new ATOM 0 HG2 ARG A 460 4.316 -8.919 2.343 1.00 10.00 H new ATOM 0 HG3 ARG A 460 5.986 -8.740 1.845 1.00 10.00 H new ATOM 0 HD2 ARG A 460 5.933 -7.121 4.068 1.00 10.00 H new ATOM 0 HD3 ARG A 460 4.749 -8.333 4.514 1.00 10.00 H new ATOM 0 HE ARG A 460 7.617 -8.686 4.366 1.00 10.00 H new ATOM 0 HH11 ARG A 460 4.527 -10.342 3.902 1.00 10.00 H new ATOM 0 HH12 ARG A 460 5.205 -11.940 4.234 1.00 10.00 H new ATOM 0 HH21 ARG A 460 8.473 -10.741 4.791 1.00 10.00 H new ATOM 0 HH22 ARG A 460 7.428 -12.164 4.735 1.00 10.00 H new ATOM 809 N LYS A 461 5.486 -3.942 0.570 1.00 10.00 N ATOM 810 CA LYS A 461 5.463 -3.067 -0.594 1.00 10.00 C ATOM 811 C LYS A 461 6.431 -1.904 -0.400 1.00 10.00 C ATOM 812 O LYS A 461 6.464 -1.286 0.664 1.00 10.00 O ATOM 813 CB LYS A 461 4.049 -2.524 -0.844 1.00 10.00 C ATOM 814 CG LYS A 461 2.931 -3.361 -0.232 1.00 10.00 C ATOM 815 CD LYS A 461 2.348 -4.331 -1.245 1.00 10.00 C ATOM 816 CE LYS A 461 3.279 -5.505 -1.494 1.00 10.00 C ATOM 817 NZ LYS A 461 2.839 -6.728 -0.766 1.00 10.00 N ATOM 0 H LYS A 461 5.008 -3.564 1.388 1.00 10.00 H new ATOM 0 HA LYS A 461 5.770 -3.652 -1.461 1.00 10.00 H new ATOM 0 HB2 LYS A 461 3.987 -1.511 -0.445 1.00 10.00 H new ATOM 0 HB3 LYS A 461 3.886 -2.454 -1.919 1.00 10.00 H new ATOM 0 HG2 LYS A 461 3.316 -3.914 0.625 1.00 10.00 H new ATOM 0 HG3 LYS A 461 2.144 -2.704 0.140 1.00 10.00 H new ATOM 0 HD2 LYS A 461 1.386 -4.698 -0.887 1.00 10.00 H new ATOM 0 HD3 LYS A 461 2.160 -3.809 -2.183 1.00 10.00 H new ATOM 0 HE2 LYS A 461 3.321 -5.714 -2.563 1.00 10.00 H new ATOM 0 HE3 LYS A 461 4.289 -5.240 -1.181 1.00 10.00 H new ATOM 0 HZ1 LYS A 461 3.528 -7.491 -0.921 1.00 10.00 H new ATOM 0 HZ2 LYS A 461 2.774 -6.522 0.251 1.00 10.00 H new ATOM 0 HZ3 LYS A 461 1.907 -7.026 -1.119 1.00 10.00 H new ATOM 831 N THR A 462 7.216 -1.610 -1.429 1.00 10.00 N ATOM 832 CA THR A 462 8.181 -0.518 -1.359 1.00 10.00 C ATOM 833 C THR A 462 7.496 0.825 -1.585 1.00 10.00 C ATOM 834 O THR A 462 6.369 0.883 -2.079 1.00 10.00 O ATOM 835 CB THR A 462 9.299 -0.718 -2.386 1.00 10.00 C ATOM 836 OG1 THR A 462 9.108 -1.919 -3.112 1.00 10.00 O ATOM 837 CG2 THR A 462 10.677 -0.773 -1.765 1.00 10.00 C ATOM 0 H THR A 462 7.204 -2.109 -2.318 1.00 10.00 H new ATOM 0 HA THR A 462 8.619 -0.520 -0.361 1.00 10.00 H new ATOM 0 HB THR A 462 9.246 0.151 -3.042 1.00 10.00 H new ATOM 0 HG1 THR A 462 9.907 -2.108 -3.647 1.00 10.00 H new ATOM 0 HG21 THR A 462 11.423 -0.916 -2.547 1.00 10.00 H new ATOM 0 HG22 THR A 462 10.877 0.161 -1.240 1.00 10.00 H new ATOM 0 HG23 THR A 462 10.726 -1.603 -1.061 1.00 10.00 H new ATOM 845 N VAL A 463 8.182 1.904 -1.224 1.00 10.00 N ATOM 846 CA VAL A 463 7.636 3.245 -1.392 1.00 10.00 C ATOM 847 C VAL A 463 7.531 3.601 -2.869 1.00 10.00 C ATOM 848 O VAL A 463 6.434 3.759 -3.403 1.00 10.00 O ATOM 849 CB VAL A 463 8.493 4.308 -0.673 1.00 10.00 C ATOM 850 CG1 VAL A 463 7.708 5.601 -0.501 1.00 10.00 C ATOM 851 CG2 VAL A 463 8.976 3.789 0.675 1.00 10.00 C ATOM 0 H VAL A 463 9.116 1.876 -0.814 1.00 10.00 H new ATOM 0 HA VAL A 463 6.643 3.242 -0.944 1.00 10.00 H new ATOM 0 HB VAL A 463 9.367 4.517 -1.290 1.00 10.00 H new ATOM 0 HG11 VAL A 463 8.329 6.339 0.008 1.00 10.00 H new ATOM 0 HG12 VAL A 463 7.418 5.984 -1.480 1.00 10.00 H new ATOM 0 HG13 VAL A 463 6.814 5.408 0.092 1.00 10.00 H new ATOM 0 HG21 VAL A 463 9.578 4.554 1.165 1.00 10.00 H new ATOM 0 HG22 VAL A 463 8.117 3.547 1.301 1.00 10.00 H new ATOM 0 HG23 VAL A 463 9.579 2.893 0.525 1.00 10.00 H new ATOM 861 N ALA A 464 8.679 3.712 -3.530 1.00 10.00 N ATOM 862 CA ALA A 464 8.709 4.034 -4.952 1.00 10.00 C ATOM 863 C ALA A 464 8.046 2.929 -5.765 1.00 10.00 C ATOM 864 O ALA A 464 7.512 3.175 -6.846 1.00 10.00 O ATOM 865 CB ALA A 464 10.141 4.251 -5.416 1.00 10.00 C ATOM 0 H ALA A 464 9.598 3.584 -3.105 1.00 10.00 H new ATOM 0 HA ALA A 464 8.151 4.957 -5.109 1.00 10.00 H new ATOM 0 HB1 ALA A 464 10.147 4.490 -6.479 1.00 10.00 H new ATOM 0 HB2 ALA A 464 10.584 5.075 -4.856 1.00 10.00 H new ATOM 0 HB3 ALA A 464 10.720 3.344 -5.245 1.00 10.00 H new ATOM 871 N GLU A 465 8.076 1.710 -5.232 1.00 10.00 N ATOM 872 CA GLU A 465 7.471 0.569 -5.903 1.00 10.00 C ATOM 873 C GLU A 465 5.956 0.590 -5.731 1.00 10.00 C ATOM 874 O GLU A 465 5.216 0.123 -6.597 1.00 10.00 O ATOM 875 CB GLU A 465 8.039 -0.739 -5.351 1.00 10.00 C ATOM 876 CG GLU A 465 7.780 -1.940 -6.244 1.00 10.00 C ATOM 877 CD GLU A 465 8.550 -3.171 -5.805 1.00 10.00 C ATOM 878 OE1 GLU A 465 8.173 -3.770 -4.777 1.00 10.00 O ATOM 879 OE2 GLU A 465 9.529 -3.533 -6.490 1.00 10.00 O ATOM 0 H GLU A 465 8.514 1.490 -4.337 1.00 10.00 H new ATOM 0 HA GLU A 465 7.706 0.635 -6.965 1.00 10.00 H new ATOM 0 HB2 GLU A 465 9.114 -0.627 -5.209 1.00 10.00 H new ATOM 0 HB3 GLU A 465 7.606 -0.927 -4.369 1.00 10.00 H new ATOM 0 HG2 GLU A 465 6.713 -2.164 -6.244 1.00 10.00 H new ATOM 0 HG3 GLU A 465 8.054 -1.691 -7.269 1.00 10.00 H new ATOM 886 N CYS A 466 5.501 1.138 -4.607 1.00 10.00 N ATOM 887 CA CYS A 466 4.074 1.224 -4.324 1.00 10.00 C ATOM 888 C CYS A 466 3.356 2.001 -5.420 1.00 10.00 C ATOM 889 O CYS A 466 2.195 1.732 -5.726 1.00 10.00 O ATOM 890 CB CYS A 466 3.836 1.884 -2.963 1.00 10.00 C ATOM 891 SG CYS A 466 3.292 0.740 -1.673 1.00 10.00 S ATOM 0 H CYS A 466 6.100 1.528 -3.879 1.00 10.00 H new ATOM 0 HA CYS A 466 3.670 0.212 -4.296 1.00 10.00 H new ATOM 0 HB2 CYS A 466 4.758 2.368 -2.640 1.00 10.00 H new ATOM 0 HB3 CYS A 466 3.088 2.668 -3.077 1.00 10.00 H new ATOM 0 HG CYS A 466 2.402 -0.073 -2.161 1.00 10.00 H new ATOM 897 N VAL A 467 4.060 2.957 -6.021 1.00 10.00 N ATOM 898 CA VAL A 467 3.491 3.758 -7.098 1.00 10.00 C ATOM 899 C VAL A 467 2.926 2.856 -8.193 1.00 10.00 C ATOM 900 O VAL A 467 2.058 3.263 -8.962 1.00 10.00 O ATOM 901 CB VAL A 467 4.546 4.712 -7.707 1.00 10.00 C ATOM 902 CG1 VAL A 467 4.035 5.344 -8.997 1.00 10.00 C ATOM 903 CG2 VAL A 467 4.932 5.787 -6.703 1.00 10.00 C ATOM 0 H VAL A 467 5.022 3.194 -5.780 1.00 10.00 H new ATOM 0 HA VAL A 467 2.687 4.358 -6.672 1.00 10.00 H new ATOM 0 HB VAL A 467 5.433 4.126 -7.948 1.00 10.00 H new ATOM 0 HG11 VAL A 467 4.797 6.010 -9.403 1.00 10.00 H new ATOM 0 HG12 VAL A 467 3.813 4.561 -9.723 1.00 10.00 H new ATOM 0 HG13 VAL A 467 3.129 5.914 -8.789 1.00 10.00 H new ATOM 0 HG21 VAL A 467 5.675 6.450 -7.147 1.00 10.00 H new ATOM 0 HG22 VAL A 467 4.048 6.364 -6.430 1.00 10.00 H new ATOM 0 HG23 VAL A 467 5.350 5.319 -5.812 1.00 10.00 H new ATOM 913 N LEU A 468 3.427 1.626 -8.256 1.00 10.00 N ATOM 914 CA LEU A 468 2.976 0.668 -9.253 1.00 10.00 C ATOM 915 C LEU A 468 1.485 0.368 -9.111 1.00 10.00 C ATOM 916 O LEU A 468 0.866 -0.178 -10.024 1.00 10.00 O ATOM 917 CB LEU A 468 3.784 -0.628 -9.140 1.00 10.00 C ATOM 918 CG LEU A 468 3.374 -1.739 -10.112 1.00 10.00 C ATOM 919 CD1 LEU A 468 4.584 -2.260 -10.873 1.00 10.00 C ATOM 920 CD2 LEU A 468 2.683 -2.873 -9.370 1.00 10.00 C ATOM 0 H LEU A 468 4.147 1.271 -7.626 1.00 10.00 H new ATOM 0 HA LEU A 468 3.136 1.111 -10.236 1.00 10.00 H new ATOM 0 HB2 LEU A 468 4.837 -0.396 -9.301 1.00 10.00 H new ATOM 0 HB3 LEU A 468 3.693 -1.006 -8.122 1.00 10.00 H new ATOM 0 HG LEU A 468 2.670 -1.320 -10.831 1.00 10.00 H new ATOM 0 HD11 LEU A 468 4.271 -3.048 -11.558 1.00 10.00 H new ATOM 0 HD12 LEU A 468 5.036 -1.446 -11.439 1.00 10.00 H new ATOM 0 HD13 LEU A 468 5.313 -2.660 -10.168 1.00 10.00 H new ATOM 0 HD21 LEU A 468 2.400 -3.652 -10.078 1.00 10.00 H new ATOM 0 HD22 LEU A 468 3.363 -3.289 -8.626 1.00 10.00 H new ATOM 0 HD23 LEU A 468 1.791 -2.492 -8.873 1.00 10.00 H new ATOM 932 N TYR A 469 0.914 0.716 -7.960 1.00 10.00 N ATOM 933 CA TYR A 469 -0.496 0.471 -7.703 1.00 10.00 C ATOM 934 C TYR A 469 -1.350 1.726 -7.903 1.00 10.00 C ATOM 935 O TYR A 469 -2.575 1.660 -7.836 1.00 10.00 O ATOM 936 CB TYR A 469 -0.690 -0.081 -6.283 1.00 10.00 C ATOM 937 CG TYR A 469 -1.116 0.923 -5.230 1.00 10.00 C ATOM 938 CD1 TYR A 469 -0.594 2.207 -5.233 1.00 10.00 C ATOM 939 CD2 TYR A 469 -2.028 0.583 -4.227 1.00 10.00 C ATOM 940 CE1 TYR A 469 -0.959 3.132 -4.279 1.00 10.00 C ATOM 941 CE2 TYR A 469 -2.399 1.509 -3.272 1.00 10.00 C ATOM 942 CZ TYR A 469 -1.862 2.780 -3.303 1.00 10.00 C ATOM 943 OH TYR A 469 -2.223 3.700 -2.349 1.00 10.00 O ATOM 0 H TYR A 469 1.410 1.169 -7.192 1.00 10.00 H new ATOM 0 HA TYR A 469 -0.832 -0.269 -8.429 1.00 10.00 H new ATOM 0 HB2 TYR A 469 -1.436 -0.875 -6.322 1.00 10.00 H new ATOM 0 HB3 TYR A 469 0.246 -0.539 -5.962 1.00 10.00 H new ATOM 0 HD1 TYR A 469 0.114 2.488 -5.999 1.00 10.00 H new ATOM 0 HD2 TYR A 469 -2.446 -0.412 -4.199 1.00 10.00 H new ATOM 0 HE1 TYR A 469 -0.539 4.127 -4.298 1.00 10.00 H new ATOM 0 HE2 TYR A 469 -3.108 1.239 -2.503 1.00 10.00 H new ATOM 0 HH TYR A 469 -1.710 3.540 -1.530 1.00 10.00 H new ATOM 953 N TYR A 470 -0.706 2.873 -8.109 1.00 10.00 N ATOM 954 CA TYR A 470 -1.435 4.126 -8.269 1.00 10.00 C ATOM 955 C TYR A 470 -1.745 4.435 -9.733 1.00 10.00 C ATOM 956 O TYR A 470 -2.727 5.115 -10.029 1.00 10.00 O ATOM 957 CB TYR A 470 -0.650 5.277 -7.616 1.00 10.00 C ATOM 958 CG TYR A 470 -0.134 6.330 -8.578 1.00 10.00 C ATOM 959 CD1 TYR A 470 0.746 5.996 -9.597 1.00 10.00 C ATOM 960 CD2 TYR A 470 -0.527 7.657 -8.459 1.00 10.00 C ATOM 961 CE1 TYR A 470 1.220 6.951 -10.473 1.00 10.00 C ATOM 962 CE2 TYR A 470 -0.056 8.620 -9.332 1.00 10.00 C ATOM 963 CZ TYR A 470 0.816 8.263 -10.337 1.00 10.00 C ATOM 964 OH TYR A 470 1.288 9.218 -11.208 1.00 10.00 O ATOM 0 H TYR A 470 0.309 2.959 -8.168 1.00 10.00 H new ATOM 0 HA TYR A 470 -2.395 4.018 -7.765 1.00 10.00 H new ATOM 0 HB2 TYR A 470 -1.291 5.762 -6.880 1.00 10.00 H new ATOM 0 HB3 TYR A 470 0.197 4.857 -7.073 1.00 10.00 H new ATOM 0 HD1 TYR A 470 1.066 4.970 -9.707 1.00 10.00 H new ATOM 0 HD2 TYR A 470 -1.211 7.941 -7.673 1.00 10.00 H new ATOM 0 HE1 TYR A 470 1.904 6.673 -11.261 1.00 10.00 H new ATOM 0 HE2 TYR A 470 -0.370 9.648 -9.227 1.00 10.00 H new ATOM 0 HH TYR A 470 0.906 10.090 -10.976 1.00 10.00 H new ATOM 974 N TYR A 471 -0.909 3.953 -10.648 1.00 10.00 N ATOM 975 CA TYR A 471 -1.131 4.220 -12.064 1.00 10.00 C ATOM 976 C TYR A 471 -2.044 3.181 -12.704 1.00 10.00 C ATOM 977 O TYR A 471 -2.634 3.432 -13.756 1.00 10.00 O ATOM 978 CB TYR A 471 0.196 4.309 -12.828 1.00 10.00 C ATOM 979 CG TYR A 471 1.131 3.122 -12.662 1.00 10.00 C ATOM 980 CD1 TYR A 471 0.662 1.809 -12.649 1.00 10.00 C ATOM 981 CD2 TYR A 471 2.502 3.322 -12.542 1.00 10.00 C ATOM 982 CE1 TYR A 471 1.527 0.742 -12.523 1.00 10.00 C ATOM 983 CE2 TYR A 471 3.372 2.257 -12.411 1.00 10.00 C ATOM 984 CZ TYR A 471 2.880 0.971 -12.406 1.00 10.00 C ATOM 985 OH TYR A 471 3.747 -0.091 -12.284 1.00 10.00 O ATOM 0 H TYR A 471 -0.087 3.386 -10.440 1.00 10.00 H new ATOM 0 HA TYR A 471 -1.632 5.186 -12.128 1.00 10.00 H new ATOM 0 HB2 TYR A 471 -0.024 4.430 -13.889 1.00 10.00 H new ATOM 0 HB3 TYR A 471 0.720 5.209 -12.506 1.00 10.00 H new ATOM 0 HD1 TYR A 471 -0.398 1.624 -12.739 1.00 10.00 H new ATOM 0 HD2 TYR A 471 2.894 4.328 -12.551 1.00 10.00 H new ATOM 0 HE1 TYR A 471 1.145 -0.268 -12.516 1.00 10.00 H new ATOM 0 HE2 TYR A 471 4.433 2.432 -12.313 1.00 10.00 H new ATOM 0 HH TYR A 471 4.612 0.146 -12.678 1.00 10.00 H new ATOM 995 N LEU A 472 -2.163 2.018 -12.076 1.00 10.00 N ATOM 996 CA LEU A 472 -3.013 0.960 -12.614 1.00 10.00 C ATOM 997 C LEU A 472 -4.388 0.965 -11.939 1.00 10.00 C ATOM 998 O LEU A 472 -5.273 0.189 -12.301 1.00 10.00 O ATOM 999 CB LEU A 472 -2.327 -0.402 -12.463 1.00 10.00 C ATOM 1000 CG LEU A 472 -2.547 -1.111 -11.130 1.00 10.00 C ATOM 1001 CD1 LEU A 472 -1.649 -2.333 -11.021 1.00 10.00 C ATOM 1002 CD2 LEU A 472 -2.288 -0.157 -9.982 1.00 10.00 C ATOM 0 H LEU A 472 -1.689 1.784 -11.204 1.00 10.00 H new ATOM 0 HA LEU A 472 -3.168 1.148 -13.676 1.00 10.00 H new ATOM 0 HB2 LEU A 472 -2.677 -1.055 -13.263 1.00 10.00 H new ATOM 0 HB3 LEU A 472 -1.255 -0.266 -12.609 1.00 10.00 H new ATOM 0 HG LEU A 472 -3.584 -1.444 -11.079 1.00 10.00 H new ATOM 0 HD11 LEU A 472 -1.820 -2.826 -10.064 1.00 10.00 H new ATOM 0 HD12 LEU A 472 -1.877 -3.025 -11.831 1.00 10.00 H new ATOM 0 HD13 LEU A 472 -0.606 -2.025 -11.089 1.00 10.00 H new ATOM 0 HD21 LEU A 472 -2.448 -0.674 -9.036 1.00 10.00 H new ATOM 0 HD22 LEU A 472 -1.259 0.200 -10.031 1.00 10.00 H new ATOM 0 HD23 LEU A 472 -2.970 0.690 -10.052 1.00 10.00 H new ATOM 1014 N THR A 473 -4.555 1.855 -10.963 1.00 10.00 N ATOM 1015 CA THR A 473 -5.812 1.985 -10.238 1.00 10.00 C ATOM 1016 C THR A 473 -6.566 3.224 -10.707 1.00 10.00 C ATOM 1017 O THR A 473 -7.785 3.315 -10.560 1.00 10.00 O ATOM 1018 CB THR A 473 -5.547 2.059 -8.731 1.00 10.00 C ATOM 1019 OG1 THR A 473 -4.543 3.017 -8.449 1.00 10.00 O ATOM 1020 CG2 THR A 473 -5.106 0.739 -8.129 1.00 10.00 C ATOM 0 H THR A 473 -3.827 2.501 -10.656 1.00 10.00 H new ATOM 0 HA THR A 473 -6.427 1.108 -10.441 1.00 10.00 H new ATOM 0 HB THR A 473 -6.501 2.339 -8.284 1.00 10.00 H new ATOM 0 HG1 THR A 473 -3.663 2.641 -8.661 1.00 10.00 H new ATOM 0 HG21 THR A 473 -4.936 0.865 -7.060 1.00 10.00 H new ATOM 0 HG22 THR A 473 -5.882 -0.010 -8.287 1.00 10.00 H new ATOM 0 HG23 THR A 473 -4.183 0.412 -8.607 1.00 10.00 H new ATOM 1028 N LYS A 474 -5.831 4.177 -11.275 1.00 10.00 N ATOM 1029 CA LYS A 474 -6.425 5.411 -11.769 1.00 10.00 C ATOM 1030 C LYS A 474 -6.645 5.349 -13.279 1.00 10.00 C ATOM 1031 O LYS A 474 -7.478 6.075 -13.823 1.00 10.00 O ATOM 1032 CB LYS A 474 -5.530 6.602 -11.413 1.00 10.00 C ATOM 1033 CG LYS A 474 -4.257 6.680 -12.238 1.00 10.00 C ATOM 1034 CD LYS A 474 -3.240 7.614 -11.602 1.00 10.00 C ATOM 1035 CE LYS A 474 -1.953 7.675 -12.409 1.00 10.00 C ATOM 1036 NZ LYS A 474 -1.803 8.975 -13.117 1.00 10.00 N ATOM 0 H LYS A 474 -4.821 4.116 -11.404 1.00 10.00 H new ATOM 0 HA LYS A 474 -7.397 5.538 -11.291 1.00 10.00 H new ATOM 0 HB2 LYS A 474 -6.096 7.523 -11.548 1.00 10.00 H new ATOM 0 HB3 LYS A 474 -5.265 6.543 -10.357 1.00 10.00 H new ATOM 0 HG2 LYS A 474 -3.825 5.684 -12.339 1.00 10.00 H new ATOM 0 HG3 LYS A 474 -4.494 7.028 -13.243 1.00 10.00 H new ATOM 0 HD2 LYS A 474 -3.666 8.614 -11.519 1.00 10.00 H new ATOM 0 HD3 LYS A 474 -3.019 7.277 -10.589 1.00 10.00 H new ATOM 0 HE2 LYS A 474 -1.101 7.522 -11.746 1.00 10.00 H new ATOM 0 HE3 LYS A 474 -1.941 6.862 -13.135 1.00 10.00 H new ATOM 0 HZ1 LYS A 474 -0.798 9.145 -13.322 1.00 10.00 H new ATOM 0 HZ2 LYS A 474 -2.339 8.949 -14.008 1.00 10.00 H new ATOM 0 HZ3 LYS A 474 -2.168 9.742 -12.516 1.00 10.00 H new ATOM 1050 N LYS A 475 -5.899 4.480 -13.951 1.00 10.00 N ATOM 1051 CA LYS A 475 -6.021 4.329 -15.396 1.00 10.00 C ATOM 1052 C LYS A 475 -7.440 3.918 -15.785 1.00 10.00 C ATOM 1053 O LYS A 475 -7.864 4.125 -16.923 1.00 10.00 O ATOM 1054 CB LYS A 475 -5.020 3.292 -15.907 1.00 10.00 C ATOM 1055 CG LYS A 475 -3.674 3.885 -16.294 1.00 10.00 C ATOM 1056 CD LYS A 475 -3.579 4.118 -17.793 1.00 10.00 C ATOM 1057 CE LYS A 475 -3.069 2.882 -18.517 1.00 10.00 C ATOM 1058 NZ LYS A 475 -2.674 3.184 -19.920 1.00 10.00 N ATOM 0 H LYS A 475 -5.204 3.870 -13.519 1.00 10.00 H new ATOM 0 HA LYS A 475 -5.803 5.293 -15.856 1.00 10.00 H new ATOM 0 HB2 LYS A 475 -4.867 2.536 -15.136 1.00 10.00 H new ATOM 0 HB3 LYS A 475 -5.446 2.783 -16.772 1.00 10.00 H new ATOM 0 HG2 LYS A 475 -3.526 4.828 -15.768 1.00 10.00 H new ATOM 0 HG3 LYS A 475 -2.875 3.214 -15.977 1.00 10.00 H new ATOM 0 HD2 LYS A 475 -4.560 4.391 -18.183 1.00 10.00 H new ATOM 0 HD3 LYS A 475 -2.913 4.958 -17.990 1.00 10.00 H new ATOM 0 HE2 LYS A 475 -2.214 2.473 -17.979 1.00 10.00 H new ATOM 0 HE3 LYS A 475 -3.843 2.115 -18.515 1.00 10.00 H new ATOM 0 HZ1 LYS A 475 -2.332 2.316 -20.379 1.00 10.00 H new ATOM 0 HZ2 LYS A 475 -3.496 3.550 -20.441 1.00 10.00 H new ATOM 0 HZ3 LYS A 475 -1.917 3.897 -19.922 1.00 10.00 H new ATOM 1072 N ASN A 476 -8.167 3.329 -14.838 1.00 10.00 N ATOM 1073 CA ASN A 476 -9.535 2.886 -15.092 1.00 10.00 C ATOM 1074 C ASN A 476 -10.536 3.605 -14.190 1.00 10.00 C ATOM 1075 O ASN A 476 -11.708 3.742 -14.540 1.00 10.00 O ATOM 1076 CB ASN A 476 -9.644 1.374 -14.886 1.00 10.00 C ATOM 1077 CG ASN A 476 -10.581 0.721 -15.885 1.00 10.00 C ATOM 1078 OD1 ASN A 476 -11.801 0.866 -15.794 1.00 10.00 O ATOM 1079 ND2 ASN A 476 -10.015 -0.002 -16.842 1.00 10.00 N ATOM 0 H ASN A 476 -7.833 3.148 -13.891 1.00 10.00 H new ATOM 0 HA ASN A 476 -9.777 3.132 -16.126 1.00 10.00 H new ATOM 0 HB2 ASN A 476 -8.654 0.926 -14.973 1.00 10.00 H new ATOM 0 HB3 ASN A 476 -9.997 1.172 -13.875 1.00 10.00 H new ATOM 0 HD21 ASN A 476 -10.595 -0.465 -17.542 1.00 10.00 H new ATOM 0 HD22 ASN A 476 -9.000 -0.095 -16.878 1.00 10.00 H new ATOM 1086 N GLU A 477 -10.075 4.058 -13.027 1.00 10.00 N ATOM 1087 CA GLU A 477 -10.946 4.755 -12.085 1.00 10.00 C ATOM 1088 C GLU A 477 -10.791 6.267 -12.209 1.00 10.00 C ATOM 1089 O GLU A 477 -11.762 7.013 -12.081 1.00 10.00 O ATOM 1090 CB GLU A 477 -10.637 4.316 -10.652 1.00 10.00 C ATOM 1091 CG GLU A 477 -10.787 2.819 -10.429 1.00 10.00 C ATOM 1092 CD GLU A 477 -11.356 2.488 -9.064 1.00 10.00 C ATOM 1093 OE1 GLU A 477 -10.630 2.652 -8.062 1.00 10.00 O ATOM 1094 OE2 GLU A 477 -12.530 2.064 -8.997 1.00 10.00 O ATOM 0 H GLU A 477 -9.109 3.956 -12.716 1.00 10.00 H new ATOM 0 HA GLU A 477 -11.977 4.495 -12.325 1.00 10.00 H new ATOM 0 HB2 GLU A 477 -9.618 4.612 -10.402 1.00 10.00 H new ATOM 0 HB3 GLU A 477 -11.300 4.845 -9.968 1.00 10.00 H new ATOM 0 HG2 GLU A 477 -11.436 2.404 -11.200 1.00 10.00 H new ATOM 0 HG3 GLU A 477 -9.814 2.340 -10.539 1.00 10.00 H new ATOM 1101 N ASN A 478 -9.564 6.711 -12.456 1.00 10.00 N ATOM 1102 CA ASN A 478 -9.277 8.134 -12.596 1.00 10.00 C ATOM 1103 C ASN A 478 -9.536 8.867 -11.285 1.00 10.00 C ATOM 1104 O ASN A 478 -10.284 9.845 -11.243 1.00 10.00 O ATOM 1105 CB ASN A 478 -10.124 8.742 -13.716 1.00 10.00 C ATOM 1106 CG ASN A 478 -9.353 9.755 -14.540 1.00 10.00 C ATOM 1107 OD1 ASN A 478 -9.264 10.928 -14.177 1.00 10.00 O ATOM 1108 ND2 ASN A 478 -8.792 9.306 -15.656 1.00 10.00 N ATOM 0 H ASN A 478 -8.751 6.105 -12.564 1.00 10.00 H new ATOM 0 HA ASN A 478 -8.224 8.246 -12.853 1.00 10.00 H new ATOM 0 HB2 ASN A 478 -10.484 7.946 -14.368 1.00 10.00 H new ATOM 0 HB3 ASN A 478 -11.002 9.222 -13.284 1.00 10.00 H new ATOM 0 HD21 ASN A 478 -8.261 9.942 -16.252 1.00 10.00 H new ATOM 0 HD22 ASN A 478 -8.892 8.325 -15.918 1.00 10.00 H new ATOM 1115 N TYR A 479 -8.914 8.387 -10.212 1.00 10.00 N ATOM 1116 CA TYR A 479 -9.079 8.995 -8.898 1.00 10.00 C ATOM 1117 C TYR A 479 -7.847 9.803 -8.510 1.00 10.00 C ATOM 1118 O TYR A 479 -7.461 9.850 -7.342 1.00 10.00 O ATOM 1119 CB TYR A 479 -9.361 7.917 -7.846 1.00 10.00 C ATOM 1120 CG TYR A 479 -8.170 7.034 -7.534 1.00 10.00 C ATOM 1121 CD1 TYR A 479 -7.883 5.915 -8.308 1.00 10.00 C ATOM 1122 CD2 TYR A 479 -7.337 7.318 -6.460 1.00 10.00 C ATOM 1123 CE1 TYR A 479 -6.800 5.106 -8.019 1.00 10.00 C ATOM 1124 CE2 TYR A 479 -6.252 6.518 -6.166 1.00 10.00 C ATOM 1125 CZ TYR A 479 -5.988 5.413 -6.947 1.00 10.00 C ATOM 1126 OH TYR A 479 -4.908 4.612 -6.651 1.00 10.00 O ATOM 0 H TYR A 479 -8.292 7.579 -10.228 1.00 10.00 H new ATOM 0 HA TYR A 479 -9.929 9.675 -8.943 1.00 10.00 H new ATOM 0 HB2 TYR A 479 -9.694 8.399 -6.927 1.00 10.00 H new ATOM 0 HB3 TYR A 479 -10.183 7.291 -8.193 1.00 10.00 H new ATOM 0 HD1 TYR A 479 -8.517 5.674 -9.149 1.00 10.00 H new ATOM 0 HD2 TYR A 479 -7.542 8.181 -5.844 1.00 10.00 H new ATOM 0 HE1 TYR A 479 -6.591 4.239 -8.629 1.00 10.00 H new ATOM 0 HE2 TYR A 479 -5.613 6.756 -5.329 1.00 10.00 H new ATOM 0 HH TYR A 479 -4.747 3.992 -7.393 1.00 10.00 H new ATOM 1136 N LYS A 480 -7.236 10.443 -9.498 1.00 10.00 N ATOM 1137 CA LYS A 480 -6.046 11.252 -9.262 1.00 10.00 C ATOM 1138 C LYS A 480 -6.342 12.382 -8.279 1.00 10.00 C ATOM 1139 O LYS A 480 -7.100 13.303 -8.649 1.00 10.00 O ATOM 1140 CB LYS A 480 -5.528 11.831 -10.580 1.00 10.00 C ATOM 1141 CG LYS A 480 -4.547 10.920 -11.299 1.00 10.00 C ATOM 1142 CD LYS A 480 -3.937 11.606 -12.511 1.00 10.00 C ATOM 1143 CE LYS A 480 -2.888 12.627 -12.103 1.00 10.00 C ATOM 1144 NZ LYS A 480 -1.509 12.070 -12.184 1.00 10.00 N ATOM 1145 OXT LYS A 480 -5.814 12.334 -7.149 1.00 10.00 O ATOM 0 H LYS A 480 -7.544 10.418 -10.470 1.00 10.00 H new ATOM 0 HA LYS A 480 -5.280 10.609 -8.829 1.00 10.00 H new ATOM 0 HB2 LYS A 480 -6.374 12.031 -11.237 1.00 10.00 H new ATOM 0 HB3 LYS A 480 -5.045 12.788 -10.382 1.00 10.00 H new ATOM 0 HG2 LYS A 480 -3.755 10.621 -10.612 1.00 10.00 H new ATOM 0 HG3 LYS A 480 -5.057 10.009 -11.613 1.00 10.00 H new ATOM 0 HD2 LYS A 480 -3.485 10.859 -13.164 1.00 10.00 H new ATOM 0 HD3 LYS A 480 -4.722 12.098 -13.085 1.00 10.00 H new ATOM 0 HE2 LYS A 480 -2.964 13.503 -12.747 1.00 10.00 H new ATOM 0 HE3 LYS A 480 -3.085 12.962 -11.085 1.00 10.00 H new ATOM 0 HZ1 LYS A 480 -0.823 12.798 -11.898 1.00 10.00 H new ATOM 0 HZ2 LYS A 480 -1.428 11.250 -11.550 1.00 10.00 H new ATOM 0 HZ3 LYS A 480 -1.311 11.773 -13.161 1.00 10.00 H new TER 1159 LYS A 480