USER MOD reduce.3.24.130724 H: found=0, std=0, add=764, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 764 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 423 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 1.2: A 424 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=-0.069) USER MOD Single : A -2 SER OG : rot 38:sc= 0.0413 USER MOD Single : A -3 GLY N :NH3+ -113:sc= 0.0623 (180deg=0) USER MOD Single : A 398 GLN : amide:sc= 0.377 K(o=0.38,f=-3.4!) USER MOD Single : A 399 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 406 ASN : amide:sc=-0.000883 K(o=-0.00088,f=-1.2) USER MOD Single : A 410 TYR OH : rot 50:sc= 0.905 USER MOD Single : A 411 HIS : no HD1:sc= -0.139 X(o=-0.14,f=-0.15) USER MOD Single : A 414 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 419 GLN : amide:sc= -0.306 K(o=-0.31,f=-1.2) USER MOD Single : A 426 MET CE :methyl -137:sc= -2.03! (180deg=-5.2!) USER MOD Single : A 430 ASN : amide:sc= 0.86 K(o=0.86,f=-0.32) USER MOD Single : A 433 SER OG : rot -150:sc= -0.0539 USER MOD Single : A 435 LYS NZ :NH3+ 132:sc=-0.00757 (180deg=-0.636) USER MOD Single : A 440 LYS NZ :NH3+ 170:sc=-0.00395 (180deg=-0.0901) USER MOD Single : A 441 GLN : amide:sc= -0.0348 X(o=-0.035,f=-0.36) USER MOD Single : A 442 THR OG1 : rot 180:sc= 0 USER MOD Single : A 443 ASN : amide:sc= -0.0281 K(o=-0.028,f=-1.3!) USER MOD Single : A 445 SER OG : rot 180:sc= 0 USER MOD Single : A 446 LYS NZ :NH3+ 162:sc= -0.317 (180deg=-0.757) USER MOD Single : A 447 CYS SG : rot 180:sc= -0.435 USER MOD Single : A 452 SER OG : rot 87:sc= 0.0387 USER MOD Single : A 453 TYR OH : rot 180:sc= -1.68! USER MOD Single : A 455 ASN : amide:sc= -0.0816 X(o=-0.082,f=-0.082) USER MOD Single : A 458 SER OG : rot 112:sc= 0.881 USER MOD Single : A 460 GLN : amide:sc= -0.434 K(o=-0.43,f=-3.3!) USER MOD Single : A 464 GLN : amide:sc= -0.67 X(o=-0.67,f=-1) USER MOD Single : A 466 MET CE :methyl 153:sc= 0 (180deg=-0.0736) USER MOD Single : A 467 ASN : amide:sc= -0.0345 K(o=-0.034,f=-1.1!) USER MOD Single : A 470 GLN :FLIP amide:sc= 0 F(o=-0.51,f=0) USER MOD Single : A 473 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 474 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 477 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00435) USER MOD Single : A 479 GLN : amide:sc= -0.19 K(o=-0.19,f=-0.7) USER MOD Single : A 481 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 483 SER OG : rot 180:sc= 0 USER MOD Single : A 484 LYS NZ :NH3+ 169:sc= 0.331 (180deg=0.15) USER MOD Single : A 485 ASN : amide:sc= 0 X(o=0,f=-0.082) USER MOD Single : A 487 SER OG : rot 180:sc= 0 USER MOD Single : A 488 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 490 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 -12.763 -9.474 3.269 1.00 64.01 N ATOM 2 CA GLY A -3 -12.808 -9.034 4.686 1.00 54.32 C ATOM 3 C GLY A -3 -11.573 -8.242 5.071 1.00 40.41 C ATOM 4 O GLY A -3 -10.530 -8.372 4.424 1.00 42.11 O ATOM 0 H1 GLY A -3 -13.505 -8.984 2.729 1.00 64.01 H new ATOM 0 H2 GLY A -3 -11.832 -9.246 2.864 1.00 64.01 H new ATOM 0 H3 GLY A -3 -12.920 -10.501 3.219 1.00 64.01 H new ATOM 0 HA2 GLY A -3 -13.696 -8.424 4.849 1.00 54.32 H new ATOM 0 HA3 GLY A -3 -12.897 -9.906 5.334 1.00 54.32 H new ATOM 10 N SER A -2 -11.696 -7.425 6.121 1.00 42.03 N ATOM 11 CA SER A -2 -10.606 -6.564 6.577 1.00 71.34 C ATOM 12 C SER A -2 -9.530 -7.361 7.330 1.00 31.44 C ATOM 13 O SER A -2 -9.819 -8.075 8.296 1.00 51.20 O ATOM 14 CB SER A -2 -11.176 -5.440 7.455 1.00 11.11 C ATOM 15 OG SER A -2 -12.009 -5.960 8.480 1.00 33.34 O ATOM 0 H SER A -2 -12.549 -7.343 6.674 1.00 42.03 H new ATOM 0 HA SER A -2 -10.121 -6.126 5.704 1.00 71.34 H new ATOM 0 HB2 SER A -2 -10.358 -4.873 7.900 1.00 11.11 H new ATOM 0 HB3 SER A -2 -11.746 -4.746 6.837 1.00 11.11 H new ATOM 0 HG SER A -2 -11.632 -6.801 8.813 1.00 33.34 H new ATOM 21 N HIS A -1 -8.294 -7.258 6.851 1.00 11.33 N ATOM 22 CA HIS A -1 -7.145 -7.896 7.482 1.00 4.30 C ATOM 23 C HIS A -1 -5.979 -6.917 7.554 1.00 14.31 C ATOM 24 O HIS A -1 -5.942 -5.931 6.809 1.00 43.50 O ATOM 25 CB HIS A -1 -6.720 -9.169 6.719 1.00 33.33 C ATOM 26 CG HIS A -1 -7.507 -10.404 7.061 1.00 53.41 C ATOM 27 ND1 HIS A -1 -7.555 -10.941 8.331 1.00 63.23 N ATOM 28 CD2 HIS A -1 -8.273 -11.213 6.288 1.00 43.12 C ATOM 29 CE1 HIS A -1 -8.301 -12.034 8.320 1.00 63.02 C ATOM 30 NE2 HIS A -1 -8.753 -12.218 7.093 1.00 4.41 N ATOM 0 H HIS A -1 -8.061 -6.728 6.011 1.00 11.33 H new ATOM 0 HA HIS A -1 -7.434 -8.189 8.491 1.00 4.30 H new ATOM 0 HB2 HIS A -1 -6.812 -8.982 5.649 1.00 33.33 H new ATOM 0 HB3 HIS A -1 -5.666 -9.360 6.919 1.00 33.33 H new ATOM 0 HD2 HIS A -1 -8.470 -11.090 5.233 1.00 43.12 H new ATOM 0 HE1 HIS A -1 -8.505 -12.668 9.170 1.00 63.02 H new ATOM 0 HE2 HIS A -1 -9.359 -12.981 6.792 1.00 4.41 H new ATOM 39 N MET A 0 -5.048 -7.186 8.479 1.00 74.25 N ATOM 40 CA MET A 0 -3.789 -6.440 8.587 1.00 62.01 C ATOM 41 C MET A 0 -2.933 -6.658 7.320 1.00 45.10 C ATOM 42 O MET A 0 -3.101 -7.670 6.628 1.00 20.31 O ATOM 43 CB MET A 0 -3.036 -6.909 9.852 1.00 42.22 C ATOM 44 CG MET A 0 -1.841 -6.043 10.265 1.00 32.52 C ATOM 45 SD MET A 0 -0.966 -6.698 11.699 1.00 31.45 S ATOM 46 CE MET A 0 0.346 -5.487 11.881 1.00 60.34 C ATOM 0 H MET A 0 -5.147 -7.927 9.173 1.00 74.25 H new ATOM 0 HA MET A 0 -3.995 -5.373 8.671 1.00 62.01 H new ATOM 0 HB2 MET A 0 -3.742 -6.944 10.682 1.00 42.22 H new ATOM 0 HB3 MET A 0 -2.685 -7.928 9.688 1.00 42.22 H new ATOM 0 HG2 MET A 0 -1.148 -5.964 9.427 1.00 32.52 H new ATOM 0 HG3 MET A 0 -2.189 -5.034 10.487 1.00 32.52 H new ATOM 0 HE1 MET A 0 0.974 -5.756 12.730 1.00 60.34 H new ATOM 0 HE2 MET A 0 0.951 -5.467 10.974 1.00 60.34 H new ATOM 0 HE3 MET A 0 -0.089 -4.502 12.049 1.00 60.34 H new ATOM 56 N GLN A 398 -2.052 -5.684 7.028 1.00 5.23 N ATOM 57 CA GLN A 398 -1.155 -5.709 5.851 1.00 52.21 C ATOM 58 C GLN A 398 -0.361 -7.018 5.767 1.00 60.24 C ATOM 59 O GLN A 398 0.265 -7.446 6.750 1.00 12.25 O ATOM 60 CB GLN A 398 -0.133 -4.520 5.865 1.00 53.43 C ATOM 61 CG GLN A 398 0.677 -4.293 7.186 1.00 44.34 C ATOM 62 CD GLN A 398 0.059 -3.275 8.157 1.00 21.14 C ATOM 63 OE1 GLN A 398 -1.158 -3.056 8.176 1.00 74.42 O ATOM 64 NE2 GLN A 398 0.913 -2.614 8.948 1.00 62.21 N ATOM 0 H GLN A 398 -1.939 -4.850 7.604 1.00 5.23 H new ATOM 0 HA GLN A 398 -1.808 -5.618 4.983 1.00 52.21 H new ATOM 0 HB2 GLN A 398 0.579 -4.676 5.054 1.00 53.43 H new ATOM 0 HB3 GLN A 398 -0.677 -3.603 5.640 1.00 53.43 H new ATOM 0 HG2 GLN A 398 0.780 -5.248 7.701 1.00 44.34 H new ATOM 0 HG3 GLN A 398 1.682 -3.961 6.926 1.00 44.34 H new ATOM 0 HE21 GLN A 398 1.911 -2.820 8.906 1.00 62.21 H new ATOM 0 HE22 GLN A 398 0.566 -1.904 9.593 1.00 62.21 H new ATOM 73 N LYS A 399 -0.414 -7.663 4.613 1.00 22.34 N ATOM 74 CA LYS A 399 0.415 -8.836 4.412 1.00 73.30 C ATOM 75 C LYS A 399 1.660 -8.385 3.627 1.00 30.52 C ATOM 76 O LYS A 399 1.573 -8.090 2.433 1.00 22.52 O ATOM 77 CB LYS A 399 -0.371 -9.935 3.632 1.00 71.44 C ATOM 78 CG LYS A 399 -1.553 -10.675 4.364 1.00 55.42 C ATOM 79 CD LYS A 399 -1.173 -12.036 5.031 1.00 15.53 C ATOM 80 CE LYS A 399 -0.614 -13.062 4.029 1.00 42.14 C ATOM 81 NZ LYS A 399 -0.052 -14.252 4.708 1.00 53.20 N ATOM 0 H LYS A 399 -1.005 -7.403 3.823 1.00 22.34 H new ATOM 0 HA LYS A 399 0.707 -9.272 5.367 1.00 73.30 H new ATOM 0 HB2 LYS A 399 -0.775 -9.476 2.730 1.00 71.44 H new ATOM 0 HB3 LYS A 399 0.346 -10.691 3.312 1.00 71.44 H new ATOM 0 HG2 LYS A 399 -1.956 -10.013 5.130 1.00 55.42 H new ATOM 0 HG3 LYS A 399 -2.352 -10.852 3.644 1.00 55.42 H new ATOM 0 HD2 LYS A 399 -0.433 -11.858 5.811 1.00 15.53 H new ATOM 0 HD3 LYS A 399 -2.054 -12.454 5.517 1.00 15.53 H new ATOM 0 HE2 LYS A 399 -1.407 -13.373 3.349 1.00 42.14 H new ATOM 0 HE3 LYS A 399 0.160 -12.592 3.422 1.00 42.14 H new ATOM 0 HZ1 LYS A 399 0.313 -14.917 3.997 1.00 53.20 H new ATOM 0 HZ2 LYS A 399 0.722 -13.959 5.338 1.00 53.20 H new ATOM 0 HZ3 LYS A 399 -0.796 -14.717 5.267 1.00 53.20 H new ATOM 95 N GLU A 400 2.808 -8.311 4.314 1.00 33.24 N ATOM 96 CA GLU A 400 4.118 -8.325 3.634 1.00 31.41 C ATOM 97 C GLU A 400 4.533 -9.803 3.615 1.00 31.13 C ATOM 98 O GLU A 400 4.190 -10.519 4.573 1.00 4.21 O ATOM 99 CB GLU A 400 5.170 -7.395 4.339 1.00 65.02 C ATOM 100 CG GLU A 400 5.497 -7.728 5.805 1.00 50.15 C ATOM 101 CD GLU A 400 6.525 -6.784 6.362 1.00 71.43 C ATOM 102 OE1 GLU A 400 6.158 -5.648 6.723 1.00 63.53 O ATOM 103 OE2 GLU A 400 7.705 -7.177 6.458 1.00 32.31 O ATOM 0 H GLU A 400 2.861 -8.241 5.330 1.00 33.24 H new ATOM 0 HA GLU A 400 4.059 -7.918 2.624 1.00 31.41 H new ATOM 0 HB2 GLU A 400 6.096 -7.429 3.765 1.00 65.02 H new ATOM 0 HB3 GLU A 400 4.805 -6.369 4.294 1.00 65.02 H new ATOM 0 HG2 GLU A 400 4.588 -7.674 6.404 1.00 50.15 H new ATOM 0 HG3 GLU A 400 5.864 -8.752 5.875 1.00 50.15 H new ATOM 110 N GLY A 401 5.196 -10.304 2.549 1.00 44.33 N ATOM 111 CA GLY A 401 5.179 -11.751 2.353 1.00 4.05 C ATOM 112 C GLY A 401 6.254 -12.486 3.149 1.00 21.31 C ATOM 113 O GLY A 401 7.001 -11.840 3.895 1.00 43.14 O ATOM 0 H GLY A 401 5.715 -9.762 1.858 1.00 44.33 H new ATOM 0 HA2 GLY A 401 4.200 -12.137 2.638 1.00 4.05 H new ATOM 0 HA3 GLY A 401 5.311 -11.968 1.293 1.00 4.05 H new ATOM 117 N PRO A 402 6.381 -13.842 3.010 1.00 1.13 N ATOM 118 CA PRO A 402 7.137 -14.686 3.941 1.00 61.32 C ATOM 119 C PRO A 402 8.648 -14.580 3.782 1.00 43.23 C ATOM 120 O PRO A 402 9.151 -13.763 3.007 1.00 64.11 O ATOM 121 CB PRO A 402 6.670 -16.106 3.610 1.00 22.32 C ATOM 122 CG PRO A 402 6.407 -16.059 2.160 1.00 31.32 C ATOM 123 CD PRO A 402 5.837 -14.698 1.918 1.00 0.24 C ATOM 0 HA PRO A 402 6.952 -14.382 4.971 1.00 61.32 H new ATOM 0 HB2 PRO A 402 7.433 -16.845 3.855 1.00 22.32 H new ATOM 0 HB3 PRO A 402 5.775 -16.374 4.171 1.00 22.32 H new ATOM 0 HG2 PRO A 402 7.322 -16.212 1.587 1.00 31.32 H new ATOM 0 HG3 PRO A 402 5.708 -16.840 1.859 1.00 31.32 H new ATOM 0 HD2 PRO A 402 6.129 -14.318 0.939 1.00 0.24 H new ATOM 0 HD3 PRO A 402 4.747 -14.719 1.940 1.00 0.24 H new ATOM 131 N GLU A 403 9.313 -15.424 4.579 1.00 24.20 N ATOM 132 CA GLU A 403 10.776 -15.583 4.684 1.00 4.54 C ATOM 133 C GLU A 403 11.587 -15.147 3.412 1.00 0.10 C ATOM 134 O GLU A 403 11.621 -15.866 2.399 1.00 34.14 O ATOM 135 CB GLU A 403 10.928 -17.116 4.880 1.00 71.14 C ATOM 136 CG GLU A 403 11.013 -17.497 6.340 1.00 12.30 C ATOM 137 CD GLU A 403 10.731 -18.965 6.592 1.00 53.01 C ATOM 138 OE1 GLU A 403 11.686 -19.771 6.538 1.00 52.03 O ATOM 139 OE2 GLU A 403 9.564 -19.311 6.858 1.00 0.53 O ATOM 0 H GLU A 403 8.817 -16.055 5.209 1.00 24.20 H new ATOM 0 HA GLU A 403 11.173 -14.950 5.478 1.00 4.54 H new ATOM 0 HB2 GLU A 403 10.080 -17.625 4.422 1.00 71.14 H new ATOM 0 HB3 GLU A 403 11.824 -17.460 4.363 1.00 71.14 H new ATOM 0 HG2 GLU A 403 12.008 -17.255 6.714 1.00 12.30 H new ATOM 0 HG3 GLU A 403 10.304 -16.895 6.908 1.00 12.30 H new ATOM 146 N GLY A 404 12.214 -13.938 3.484 1.00 53.41 N ATOM 147 CA GLY A 404 13.223 -13.531 2.536 1.00 42.44 C ATOM 148 C GLY A 404 12.791 -12.410 1.617 1.00 51.45 C ATOM 149 O GLY A 404 13.645 -11.582 1.278 1.00 24.00 O ATOM 0 H GLY A 404 12.017 -13.243 4.204 1.00 53.41 H new ATOM 0 HA2 GLY A 404 14.113 -13.217 3.081 1.00 42.44 H new ATOM 0 HA3 GLY A 404 13.507 -14.393 1.932 1.00 42.44 H new ATOM 153 N ALA A 405 11.501 -12.306 1.201 1.00 75.11 N ATOM 154 CA ALA A 405 11.138 -11.095 0.485 1.00 34.04 C ATOM 155 C ALA A 405 9.982 -10.304 1.086 1.00 13.44 C ATOM 156 O ALA A 405 8.894 -10.823 1.344 1.00 44.32 O ATOM 157 CB ALA A 405 10.862 -11.391 -0.958 1.00 64.33 C ATOM 0 H ALA A 405 10.762 -12.994 1.342 1.00 75.11 H new ATOM 0 HA ALA A 405 12.011 -10.450 0.580 1.00 34.04 H new ATOM 0 HB1 ALA A 405 10.592 -10.469 -1.473 1.00 64.33 H new ATOM 0 HB2 ALA A 405 11.753 -11.817 -1.419 1.00 64.33 H new ATOM 0 HB3 ALA A 405 10.039 -12.102 -1.033 1.00 64.33 H new ATOM 163 N ASN A 406 10.261 -9.014 1.259 1.00 63.31 N ATOM 164 CA ASN A 406 9.264 -7.961 1.540 1.00 1.42 C ATOM 165 C ASN A 406 9.723 -6.700 0.699 1.00 10.11 C ATOM 166 O ASN A 406 10.708 -6.065 1.090 1.00 73.14 O ATOM 167 CB ASN A 406 9.087 -7.756 3.129 1.00 21.15 C ATOM 168 CG ASN A 406 10.367 -7.950 3.945 1.00 4.20 C ATOM 169 OD1 ASN A 406 11.463 -7.594 3.527 1.00 2.02 O ATOM 170 ND2 ASN A 406 10.214 -8.561 5.139 1.00 45.05 N ATOM 0 H ASN A 406 11.213 -8.653 1.208 1.00 63.31 H new ATOM 0 HA ASN A 406 8.250 -8.211 1.226 1.00 1.42 H new ATOM 0 HB2 ASN A 406 8.704 -6.752 3.312 1.00 21.15 H new ATOM 0 HB3 ASN A 406 8.333 -8.455 3.490 1.00 21.15 H new ATOM 0 HD21 ASN A 406 11.027 -8.741 5.728 1.00 45.05 H new ATOM 0 HD22 ASN A 406 9.285 -8.843 5.452 1.00 45.05 H new ATOM 177 N LEU A 407 9.054 -6.313 -0.465 1.00 42.13 N ATOM 178 CA LEU A 407 9.736 -5.439 -1.472 1.00 33.33 C ATOM 179 C LEU A 407 9.035 -4.048 -1.393 1.00 4.14 C ATOM 180 O LEU A 407 7.863 -3.981 -1.770 1.00 21.51 O ATOM 181 CB LEU A 407 9.644 -6.131 -2.940 1.00 21.33 C ATOM 182 CG LEU A 407 10.488 -7.439 -3.258 1.00 0.42 C ATOM 183 CD1 LEU A 407 11.891 -7.455 -2.650 1.00 13.24 C ATOM 184 CD2 LEU A 407 9.796 -8.705 -2.815 1.00 23.45 C ATOM 0 H LEU A 407 8.100 -6.583 -0.703 1.00 42.13 H new ATOM 0 HA LEU A 407 10.800 -5.309 -1.273 1.00 33.33 H new ATOM 0 HB2 LEU A 407 8.596 -6.370 -3.120 1.00 21.33 H new ATOM 0 HB3 LEU A 407 9.929 -5.376 -3.672 1.00 21.33 H new ATOM 0 HG LEU A 407 10.576 -7.407 -4.344 1.00 0.42 H new ATOM 0 HD11 LEU A 407 12.393 -8.384 -2.919 1.00 13.24 H new ATOM 0 HD12 LEU A 407 12.463 -6.610 -3.032 1.00 13.24 H new ATOM 0 HD13 LEU A 407 11.818 -7.383 -1.565 1.00 13.24 H new ATOM 0 HD21 LEU A 407 10.420 -9.565 -3.058 1.00 23.45 H new ATOM 0 HD22 LEU A 407 9.629 -8.671 -1.738 1.00 23.45 H new ATOM 0 HD23 LEU A 407 8.838 -8.795 -3.328 1.00 23.45 H new ATOM 196 N PHE A 408 9.701 -2.915 -0.893 1.00 44.33 N ATOM 197 CA PHE A 408 8.873 -1.710 -0.563 1.00 32.32 C ATOM 198 C PHE A 408 8.891 -0.595 -1.656 1.00 4.04 C ATOM 199 O PHE A 408 9.940 0.009 -1.890 1.00 70.41 O ATOM 200 CB PHE A 408 9.241 -1.133 0.855 1.00 24.32 C ATOM 201 CG PHE A 408 10.618 -0.499 1.054 1.00 13.35 C ATOM 202 CD1 PHE A 408 11.756 -1.276 1.264 1.00 22.23 C ATOM 203 CD2 PHE A 408 10.775 0.893 1.036 1.00 3.21 C ATOM 204 CE1 PHE A 408 12.994 -0.687 1.438 1.00 52.41 C ATOM 205 CE2 PHE A 408 12.009 1.475 1.213 1.00 51.33 C ATOM 206 CZ PHE A 408 13.118 0.686 1.409 1.00 23.11 C ATOM 0 H PHE A 408 10.705 -2.832 -0.731 1.00 44.33 H new ATOM 0 HA PHE A 408 7.843 -2.067 -0.538 1.00 32.32 H new ATOM 0 HB2 PHE A 408 8.492 -0.384 1.112 1.00 24.32 H new ATOM 0 HB3 PHE A 408 9.142 -1.943 1.577 1.00 24.32 H new ATOM 0 HD1 PHE A 408 11.669 -2.352 1.291 1.00 22.23 H new ATOM 0 HD2 PHE A 408 9.911 1.521 0.880 1.00 3.21 H new ATOM 0 HE1 PHE A 408 13.866 -1.303 1.597 1.00 52.41 H new ATOM 0 HE2 PHE A 408 12.107 2.550 1.198 1.00 51.33 H new ATOM 0 HZ PHE A 408 14.088 1.143 1.540 1.00 23.11 H new ATOM 216 N ILE A 409 7.721 -0.303 -2.338 1.00 12.33 N ATOM 217 CA ILE A 409 7.706 0.826 -3.352 1.00 53.53 C ATOM 218 C ILE A 409 7.095 2.105 -2.775 1.00 65.44 C ATOM 219 O ILE A 409 6.018 2.090 -2.181 1.00 20.20 O ATOM 220 CB ILE A 409 6.996 0.525 -4.749 1.00 12.35 C ATOM 221 CG1 ILE A 409 6.960 -0.980 -5.117 1.00 1.30 C ATOM 222 CG2 ILE A 409 7.760 1.310 -5.866 1.00 3.22 C ATOM 223 CD1 ILE A 409 5.568 -1.574 -5.335 1.00 61.14 C ATOM 0 H ILE A 409 6.835 -0.795 -2.218 1.00 12.33 H new ATOM 0 HA ILE A 409 8.767 0.949 -3.568 1.00 53.53 H new ATOM 0 HB ILE A 409 5.958 0.845 -4.662 1.00 12.35 H new ATOM 0 HG12 ILE A 409 7.545 -1.128 -6.025 1.00 1.30 H new ATOM 0 HG13 ILE A 409 7.455 -1.541 -4.324 1.00 1.30 H new ATOM 0 HG21 ILE A 409 7.291 1.118 -6.831 1.00 3.22 H new ATOM 0 HG22 ILE A 409 7.723 2.378 -5.650 1.00 3.22 H new ATOM 0 HG23 ILE A 409 8.799 0.981 -5.896 1.00 3.22 H new ATOM 0 HD11 ILE A 409 5.659 -2.631 -5.587 1.00 61.14 H new ATOM 0 HD12 ILE A 409 4.980 -1.468 -4.423 1.00 61.14 H new ATOM 0 HD13 ILE A 409 5.071 -1.048 -6.150 1.00 61.14 H new ATOM 235 N TYR A 410 7.809 3.224 -2.991 1.00 22.52 N ATOM 236 CA TYR A 410 7.352 4.556 -2.547 1.00 52.33 C ATOM 237 C TYR A 410 7.558 5.592 -3.683 1.00 72.04 C ATOM 238 O TYR A 410 8.255 5.275 -4.659 1.00 53.35 O ATOM 239 CB TYR A 410 8.064 5.007 -1.212 1.00 71.01 C ATOM 240 CG TYR A 410 9.583 5.295 -1.270 1.00 51.21 C ATOM 241 CD1 TYR A 410 10.080 6.525 -1.724 1.00 25.43 C ATOM 242 CD2 TYR A 410 10.522 4.347 -0.852 1.00 44.32 C ATOM 243 CE1 TYR A 410 11.438 6.787 -1.771 1.00 23.55 C ATOM 244 CE2 TYR A 410 11.888 4.612 -0.901 1.00 73.23 C ATOM 245 CZ TYR A 410 12.338 5.830 -1.365 1.00 45.51 C ATOM 246 OH TYR A 410 13.691 6.092 -1.433 1.00 13.41 O ATOM 0 H TYR A 410 8.708 3.233 -3.472 1.00 22.52 H new ATOM 0 HA TYR A 410 6.287 4.495 -2.324 1.00 52.33 H new ATOM 0 HB2 TYR A 410 7.565 5.907 -0.853 1.00 71.01 H new ATOM 0 HB3 TYR A 410 7.898 4.231 -0.464 1.00 71.01 H new ATOM 0 HD1 TYR A 410 9.385 7.287 -2.045 1.00 25.43 H new ATOM 0 HD2 TYR A 410 10.181 3.391 -0.484 1.00 44.32 H new ATOM 0 HE1 TYR A 410 11.791 7.744 -2.127 1.00 23.55 H new ATOM 0 HE2 TYR A 410 12.595 3.863 -0.576 1.00 73.23 H new ATOM 0 HH TYR A 410 13.877 6.960 -1.018 1.00 13.41 H new ATOM 256 N HIS A 411 6.918 6.811 -3.569 1.00 65.12 N ATOM 257 CA HIS A 411 7.112 7.945 -4.525 1.00 61.43 C ATOM 258 C HIS A 411 6.418 7.669 -5.889 1.00 53.41 C ATOM 259 O HIS A 411 6.958 8.026 -6.934 1.00 23.52 O ATOM 260 CB HIS A 411 8.614 8.343 -4.747 1.00 24.31 C ATOM 261 CG HIS A 411 9.138 9.470 -3.882 1.00 34.23 C ATOM 262 ND1 HIS A 411 10.461 9.527 -3.481 1.00 25.20 N ATOM 263 CD2 HIS A 411 8.549 10.587 -3.333 1.00 54.12 C ATOM 264 CE1 HIS A 411 10.663 10.604 -2.750 1.00 4.20 C ATOM 265 NE2 HIS A 411 9.522 11.253 -2.639 1.00 72.52 N ATOM 0 H HIS A 411 6.262 7.023 -2.817 1.00 65.12 H new ATOM 0 HA HIS A 411 6.634 8.801 -4.049 1.00 61.43 H new ATOM 0 HB2 HIS A 411 9.232 7.462 -4.574 1.00 24.31 H new ATOM 0 HB3 HIS A 411 8.744 8.623 -5.792 1.00 24.31 H new ATOM 0 HD2 HIS A 411 7.515 10.882 -3.432 1.00 54.12 H new ATOM 0 HE1 HIS A 411 11.605 10.904 -2.315 1.00 4.20 H new ATOM 0 HE2 HIS A 411 9.385 12.118 -2.116 1.00 72.52 H new ATOM 274 N LEU A 412 5.213 7.028 -5.858 1.00 21.12 N ATOM 275 CA LEU A 412 4.393 6.759 -7.082 1.00 35.22 C ATOM 276 C LEU A 412 3.967 8.058 -7.809 1.00 51.41 C ATOM 277 O LEU A 412 3.578 9.044 -7.173 1.00 62.45 O ATOM 278 CB LEU A 412 3.118 5.901 -6.749 1.00 31.21 C ATOM 279 CG LEU A 412 2.302 6.388 -5.562 1.00 11.42 C ATOM 280 CD1 LEU A 412 1.053 7.197 -5.941 1.00 0.54 C ATOM 281 CD2 LEU A 412 1.918 5.229 -4.640 1.00 55.14 C ATOM 0 H LEU A 412 4.786 6.687 -4.997 1.00 21.12 H new ATOM 0 HA LEU A 412 5.039 6.192 -7.753 1.00 35.22 H new ATOM 0 HB2 LEU A 412 2.474 5.880 -7.628 1.00 31.21 H new ATOM 0 HB3 LEU A 412 3.430 4.874 -6.558 1.00 31.21 H new ATOM 0 HG LEU A 412 2.961 7.076 -5.032 1.00 11.42 H new ATOM 0 HD11 LEU A 412 0.530 7.505 -5.035 1.00 0.54 H new ATOM 0 HD12 LEU A 412 1.349 8.080 -6.507 1.00 0.54 H new ATOM 0 HD13 LEU A 412 0.392 6.581 -6.550 1.00 0.54 H new ATOM 0 HD21 LEU A 412 1.335 5.609 -3.801 1.00 55.14 H new ATOM 0 HD22 LEU A 412 1.323 4.504 -5.196 1.00 55.14 H new ATOM 0 HD23 LEU A 412 2.821 4.747 -4.266 1.00 55.14 H new ATOM 293 N PRO A 413 4.134 8.087 -9.148 1.00 14.42 N ATOM 294 CA PRO A 413 3.594 9.146 -10.046 1.00 22.02 C ATOM 295 C PRO A 413 2.071 9.124 -10.194 1.00 34.34 C ATOM 296 O PRO A 413 1.455 8.166 -9.816 1.00 35.34 O ATOM 297 CB PRO A 413 4.299 8.828 -11.361 1.00 74.04 C ATOM 298 CG PRO A 413 4.530 7.373 -11.294 1.00 72.32 C ATOM 299 CD PRO A 413 4.974 7.137 -9.904 1.00 2.31 C ATOM 0 HA PRO A 413 3.777 10.150 -9.663 1.00 22.02 H new ATOM 0 HB2 PRO A 413 3.684 9.096 -12.220 1.00 74.04 H new ATOM 0 HB3 PRO A 413 5.235 9.378 -11.456 1.00 74.04 H new ATOM 0 HG2 PRO A 413 3.622 6.815 -11.521 1.00 72.32 H new ATOM 0 HG3 PRO A 413 5.286 7.057 -12.012 1.00 72.32 H new ATOM 0 HD2 PRO A 413 4.806 6.106 -9.592 1.00 2.31 H new ATOM 0 HD3 PRO A 413 6.037 7.340 -9.775 1.00 2.31 H new ATOM 307 N GLN A 414 1.502 10.231 -10.709 1.00 2.33 N ATOM 308 CA GLN A 414 0.023 10.443 -10.882 1.00 13.32 C ATOM 309 C GLN A 414 -0.743 9.265 -11.610 1.00 23.33 C ATOM 310 O GLN A 414 -1.913 9.040 -11.310 1.00 22.34 O ATOM 311 CB GLN A 414 -0.188 11.836 -11.587 1.00 12.31 C ATOM 312 CG GLN A 414 -1.297 11.942 -12.677 1.00 24.11 C ATOM 313 CD GLN A 414 -1.187 13.251 -13.431 1.00 44.11 C ATOM 314 OE1 GLN A 414 -1.824 14.241 -13.077 1.00 44.25 O ATOM 315 NE2 GLN A 414 -0.354 13.272 -14.465 1.00 3.43 N ATOM 0 H GLN A 414 2.054 11.027 -11.027 1.00 2.33 H new ATOM 0 HA GLN A 414 -0.433 10.444 -9.892 1.00 13.32 H new ATOM 0 HB2 GLN A 414 -0.408 12.572 -10.814 1.00 12.31 H new ATOM 0 HB3 GLN A 414 0.758 12.126 -12.044 1.00 12.31 H new ATOM 0 HG2 GLN A 414 -1.210 11.108 -13.373 1.00 24.11 H new ATOM 0 HG3 GLN A 414 -2.280 11.867 -12.211 1.00 24.11 H new ATOM 0 HE21 GLN A 414 0.156 12.428 -14.726 1.00 3.43 H new ATOM 0 HE22 GLN A 414 -0.224 14.132 -14.998 1.00 3.43 H new ATOM 324 N GLU A 415 -0.099 8.506 -12.535 1.00 72.41 N ATOM 325 CA GLU A 415 -0.819 7.383 -13.224 1.00 34.11 C ATOM 326 C GLU A 415 -0.556 6.019 -12.495 1.00 14.22 C ATOM 327 O GLU A 415 -1.327 5.079 -12.671 1.00 51.25 O ATOM 328 CB GLU A 415 -0.509 7.377 -14.761 1.00 10.22 C ATOM 329 CG GLU A 415 -1.606 6.774 -15.695 1.00 43.15 C ATOM 330 CD GLU A 415 -1.173 6.793 -17.150 1.00 3.32 C ATOM 331 OE1 GLU A 415 -1.289 7.857 -17.794 1.00 32.04 O ATOM 332 OE2 GLU A 415 -0.719 5.748 -17.657 1.00 21.14 O ATOM 0 H GLU A 415 0.873 8.635 -12.817 1.00 72.41 H new ATOM 0 HA GLU A 415 -1.895 7.543 -13.152 1.00 34.11 H new ATOM 0 HB2 GLU A 415 -0.322 8.404 -15.075 1.00 10.22 H new ATOM 0 HB3 GLU A 415 0.416 6.822 -14.920 1.00 10.22 H new ATOM 0 HG2 GLU A 415 -1.820 5.749 -15.392 1.00 43.15 H new ATOM 0 HG3 GLU A 415 -2.531 7.339 -15.583 1.00 43.15 H new ATOM 339 N PHE A 416 0.535 5.919 -11.681 1.00 75.02 N ATOM 340 CA PHE A 416 0.628 4.858 -10.593 1.00 13.30 C ATOM 341 C PHE A 416 -0.163 5.304 -9.307 1.00 43.41 C ATOM 342 O PHE A 416 -0.528 6.467 -9.166 1.00 73.33 O ATOM 343 CB PHE A 416 2.087 4.369 -10.226 1.00 42.21 C ATOM 344 CG PHE A 416 2.846 3.452 -11.200 1.00 60.53 C ATOM 345 CD1 PHE A 416 2.246 2.730 -12.256 1.00 30.23 C ATOM 346 CD2 PHE A 416 4.206 3.261 -10.974 1.00 43.24 C ATOM 347 CE1 PHE A 416 3.013 1.875 -13.050 1.00 74.34 C ATOM 348 CE2 PHE A 416 4.952 2.406 -11.758 1.00 51.01 C ATOM 349 CZ PHE A 416 4.357 1.722 -12.797 1.00 63.10 C ATOM 0 H PHE A 416 1.348 6.533 -11.741 1.00 75.02 H new ATOM 0 HA PHE A 416 0.157 3.978 -11.031 1.00 13.30 H new ATOM 0 HB2 PHE A 416 2.699 5.257 -10.069 1.00 42.21 H new ATOM 0 HB3 PHE A 416 2.027 3.850 -9.269 1.00 42.21 H new ATOM 0 HD1 PHE A 416 1.189 2.840 -12.450 1.00 30.23 H new ATOM 0 HD2 PHE A 416 4.688 3.794 -10.167 1.00 43.24 H new ATOM 0 HE1 PHE A 416 2.551 1.334 -13.863 1.00 74.34 H new ATOM 0 HE2 PHE A 416 6.005 2.272 -11.558 1.00 51.01 H new ATOM 0 HZ PHE A 416 4.949 1.063 -13.415 1.00 63.10 H new ATOM 359 N GLY A 417 -0.500 4.360 -8.405 1.00 23.03 N ATOM 360 CA GLY A 417 -1.611 4.570 -7.439 1.00 13.21 C ATOM 361 C GLY A 417 -2.080 3.215 -6.860 1.00 31.15 C ATOM 362 O GLY A 417 -1.275 2.299 -6.851 1.00 64.21 O ATOM 0 H GLY A 417 -0.031 3.458 -8.321 1.00 23.03 H new ATOM 0 HA2 GLY A 417 -1.282 5.224 -6.632 1.00 13.21 H new ATOM 0 HA3 GLY A 417 -2.444 5.070 -7.934 1.00 13.21 H new ATOM 366 N ASP A 418 -3.347 3.050 -6.359 1.00 72.15 N ATOM 367 CA ASP A 418 -3.684 1.779 -5.632 1.00 25.55 C ATOM 368 C ASP A 418 -4.194 0.607 -6.472 1.00 43.41 C ATOM 369 O ASP A 418 -3.625 -0.467 -6.394 1.00 4.40 O ATOM 370 CB ASP A 418 -4.625 1.916 -4.427 1.00 4.45 C ATOM 371 CG ASP A 418 -5.765 2.894 -4.617 1.00 53.10 C ATOM 372 OD1 ASP A 418 -5.543 4.102 -4.414 1.00 72.22 O ATOM 373 OD2 ASP A 418 -6.886 2.456 -4.955 1.00 12.34 O ATOM 0 H ASP A 418 -4.104 3.729 -6.436 1.00 72.15 H new ATOM 0 HA ASP A 418 -2.677 1.544 -5.286 1.00 25.55 H new ATOM 0 HB2 ASP A 418 -5.041 0.935 -4.196 1.00 4.45 H new ATOM 0 HB3 ASP A 418 -4.040 2.226 -3.561 1.00 4.45 H new ATOM 378 N GLN A 419 -5.306 0.760 -7.210 1.00 55.33 N ATOM 379 CA GLN A 419 -5.893 -0.374 -7.920 1.00 61.24 C ATOM 380 C GLN A 419 -4.996 -0.759 -9.127 1.00 3.03 C ATOM 381 O GLN A 419 -4.777 -1.940 -9.417 1.00 34.25 O ATOM 382 CB GLN A 419 -7.361 -0.071 -8.333 1.00 3.34 C ATOM 383 CG GLN A 419 -8.106 -1.281 -8.941 1.00 74.22 C ATOM 384 CD GLN A 419 -7.890 -1.437 -10.442 1.00 73.40 C ATOM 385 OE1 GLN A 419 -7.745 -0.456 -11.171 1.00 52.31 O ATOM 386 NE2 GLN A 419 -7.822 -2.676 -10.898 1.00 63.43 N ATOM 0 H GLN A 419 -5.804 1.643 -7.326 1.00 55.33 H new ATOM 0 HA GLN A 419 -5.935 -1.237 -7.255 1.00 61.24 H new ATOM 0 HB2 GLN A 419 -7.909 0.278 -7.458 1.00 3.34 H new ATOM 0 HB3 GLN A 419 -7.363 0.745 -9.056 1.00 3.34 H new ATOM 0 HG2 GLN A 419 -7.777 -2.190 -8.438 1.00 74.22 H new ATOM 0 HG3 GLN A 419 -9.173 -1.177 -8.744 1.00 74.22 H new ATOM 0 HE21 GLN A 419 -7.948 -3.462 -10.260 1.00 63.43 H new ATOM 0 HE22 GLN A 419 -7.644 -2.846 -11.888 1.00 63.43 H new ATOM 395 N ASP A 420 -4.439 0.272 -9.773 1.00 24.13 N ATOM 396 CA ASP A 420 -3.504 0.141 -10.908 1.00 12.40 C ATOM 397 C ASP A 420 -2.103 -0.387 -10.496 1.00 34.20 C ATOM 398 O ASP A 420 -1.280 -0.667 -11.372 1.00 3.43 O ATOM 399 CB ASP A 420 -3.343 1.469 -11.680 1.00 23.23 C ATOM 400 CG ASP A 420 -3.537 2.678 -10.800 1.00 53.53 C ATOM 401 OD1 ASP A 420 -2.606 3.028 -10.072 1.00 5.31 O ATOM 402 OD2 ASP A 420 -4.646 3.250 -10.820 1.00 2.54 O ATOM 0 H ASP A 420 -4.626 1.242 -9.520 1.00 24.13 H new ATOM 0 HA ASP A 420 -3.960 -0.603 -11.561 1.00 12.40 H new ATOM 0 HB2 ASP A 420 -2.350 1.506 -12.129 1.00 23.23 H new ATOM 0 HB3 ASP A 420 -4.064 1.500 -12.497 1.00 23.23 H new ATOM 407 N ILE A 421 -1.818 -0.478 -9.169 1.00 41.33 N ATOM 408 CA ILE A 421 -0.427 -0.803 -8.649 1.00 61.14 C ATOM 409 C ILE A 421 -0.023 -2.257 -9.017 1.00 3.43 C ATOM 410 O ILE A 421 1.160 -2.592 -9.151 1.00 33.13 O ATOM 411 CB ILE A 421 -0.300 -0.563 -7.076 1.00 43.23 C ATOM 412 CG1 ILE A 421 1.174 -0.234 -6.587 1.00 14.33 C ATOM 413 CG2 ILE A 421 -0.878 -1.766 -6.248 1.00 64.05 C ATOM 414 CD1 ILE A 421 1.235 0.488 -5.219 1.00 70.34 C ATOM 0 H ILE A 421 -2.511 -0.336 -8.435 1.00 41.33 H new ATOM 0 HA ILE A 421 0.264 -0.116 -9.137 1.00 61.14 H new ATOM 0 HB ILE A 421 -0.903 0.325 -6.888 1.00 43.23 H new ATOM 0 HG12 ILE A 421 1.740 -1.163 -6.522 1.00 14.33 H new ATOM 0 HG13 ILE A 421 1.665 0.387 -7.337 1.00 14.33 H new ATOM 0 HG21 ILE A 421 -0.771 -1.560 -5.183 1.00 64.05 H new ATOM 0 HG22 ILE A 421 -1.933 -1.899 -6.487 1.00 64.05 H new ATOM 0 HG23 ILE A 421 -0.332 -2.676 -6.498 1.00 64.05 H new ATOM 0 HD11 ILE A 421 2.275 0.678 -4.954 1.00 70.34 H new ATOM 0 HD12 ILE A 421 0.698 1.434 -5.283 1.00 70.34 H new ATOM 0 HD13 ILE A 421 0.775 -0.139 -4.456 1.00 70.34 H new ATOM 426 N LEU A 422 -1.054 -3.084 -9.205 1.00 31.11 N ATOM 427 CA LEU A 422 -0.941 -4.461 -9.606 1.00 1.32 C ATOM 428 C LEU A 422 -0.471 -4.622 -11.112 1.00 15.32 C ATOM 429 O LEU A 422 -0.076 -5.730 -11.494 1.00 54.11 O ATOM 430 CB LEU A 422 -2.297 -5.208 -9.361 1.00 31.34 C ATOM 431 CG LEU A 422 -2.242 -6.482 -8.473 1.00 71.34 C ATOM 432 CD1 LEU A 422 -1.791 -6.175 -7.039 1.00 63.25 C ATOM 433 CD2 LEU A 422 -3.602 -7.180 -8.423 1.00 3.34 C ATOM 0 H LEU A 422 -2.021 -2.788 -9.073 1.00 31.11 H new ATOM 0 HA LEU A 422 -0.165 -4.915 -8.989 1.00 1.32 H new ATOM 0 HB2 LEU A 422 -2.995 -4.506 -8.905 1.00 31.34 H new ATOM 0 HB3 LEU A 422 -2.712 -5.486 -10.330 1.00 31.34 H new ATOM 0 HG LEU A 422 -1.506 -7.140 -8.935 1.00 71.34 H new ATOM 0 HD11 LEU A 422 -1.769 -7.098 -6.459 1.00 63.25 H new ATOM 0 HD12 LEU A 422 -0.794 -5.734 -7.058 1.00 63.25 H new ATOM 0 HD13 LEU A 422 -2.489 -5.475 -6.580 1.00 63.25 H new ATOM 0 HD21 LEU A 422 -3.532 -8.068 -7.794 1.00 3.34 H new ATOM 0 HD22 LEU A 422 -4.345 -6.499 -8.008 1.00 3.34 H new ATOM 0 HD23 LEU A 422 -3.899 -7.471 -9.431 1.00 3.34 H new ATOM 445 N GLN A 423 -0.496 -3.515 -11.976 1.00 72.15 N ATOM 446 CA GLN A 423 -0.535 -3.660 -13.466 1.00 72.21 C ATOM 447 C GLN A 423 0.850 -4.090 -13.997 1.00 71.40 C ATOM 448 O GLN A 423 0.962 -4.696 -15.065 1.00 24.33 O ATOM 449 CB GLN A 423 -1.012 -2.367 -14.230 1.00 4.32 C ATOM 450 CG GLN A 423 -1.660 -2.660 -15.610 1.00 60.50 C ATOM 451 CD GLN A 423 -1.021 -1.863 -16.730 1.00 20.15 C ATOM 452 OE1 GLN A 423 -1.436 -0.746 -17.031 1.00 21.12 O ATOM 453 NE2 GLN A 423 -0.025 -2.445 -17.372 1.00 34.33 N ATOM 0 H GLN A 423 -0.489 -2.548 -11.653 1.00 72.15 H new ATOM 0 HA GLN A 423 -1.281 -4.429 -13.666 1.00 72.21 H new ATOM 0 HB2 GLN A 423 -1.730 -1.832 -13.608 1.00 4.32 H new ATOM 0 HB3 GLN A 423 -0.158 -1.705 -14.373 1.00 4.32 H new ATOM 0 HG2 GLN A 423 -1.574 -3.724 -15.830 1.00 60.50 H new ATOM 0 HG3 GLN A 423 -2.724 -2.429 -15.565 1.00 60.50 H new ATOM 0 HE21 GLN A 423 0.290 -3.374 -17.091 1.00 34.33 H new ATOM 0 HE22 GLN A 423 0.430 -1.966 -18.149 1.00 34.33 H new ATOM 462 N MET A 424 1.914 -3.773 -13.232 1.00 33.33 N ATOM 463 CA MET A 424 3.279 -4.143 -13.613 1.00 41.35 C ATOM 464 C MET A 424 3.714 -5.570 -13.197 1.00 15.23 C ATOM 465 O MET A 424 4.438 -6.200 -13.958 1.00 1.14 O ATOM 466 CB MET A 424 4.310 -3.124 -13.065 1.00 25.03 C ATOM 467 CG MET A 424 4.337 -1.770 -13.775 1.00 42.12 C ATOM 468 SD MET A 424 4.624 -1.919 -15.547 1.00 34.24 S ATOM 469 CE MET A 424 3.060 -1.336 -16.188 1.00 1.32 C ATOM 0 H MET A 424 1.848 -3.263 -12.351 1.00 33.33 H new ATOM 0 HA MET A 424 3.261 -4.129 -14.703 1.00 41.35 H new ATOM 0 HB2 MET A 424 4.103 -2.957 -12.008 1.00 25.03 H new ATOM 0 HB3 MET A 424 5.303 -3.568 -13.129 1.00 25.03 H new ATOM 0 HG2 MET A 424 3.390 -1.257 -13.606 1.00 42.12 H new ATOM 0 HG3 MET A 424 5.118 -1.150 -13.336 1.00 42.12 H new ATOM 0 HE1 MET A 424 3.079 -1.367 -17.277 1.00 1.32 H new ATOM 0 HE2 MET A 424 2.256 -1.973 -15.820 1.00 1.32 H new ATOM 0 HE3 MET A 424 2.891 -0.311 -15.857 1.00 1.32 H new ATOM 479 N PHE A 425 3.299 -6.112 -12.021 1.00 43.23 N ATOM 480 CA PHE A 425 4.002 -7.280 -11.459 1.00 14.23 C ATOM 481 C PHE A 425 3.302 -8.624 -11.733 1.00 55.43 C ATOM 482 O PHE A 425 3.942 -9.644 -11.669 1.00 61.20 O ATOM 483 CB PHE A 425 4.270 -7.044 -9.974 1.00 62.23 C ATOM 484 CG PHE A 425 5.473 -6.163 -9.695 1.00 12.44 C ATOM 485 CD1 PHE A 425 5.426 -4.789 -9.948 1.00 30.15 C ATOM 486 CD2 PHE A 425 6.665 -6.690 -9.176 1.00 72.21 C ATOM 487 CE1 PHE A 425 6.503 -3.986 -9.705 1.00 65.43 C ATOM 488 CE2 PHE A 425 7.731 -5.862 -8.931 1.00 55.44 C ATOM 489 CZ PHE A 425 7.651 -4.519 -9.199 1.00 72.22 C ATOM 0 H PHE A 425 2.513 -5.771 -11.468 1.00 43.23 H new ATOM 0 HA PHE A 425 4.955 -7.373 -11.980 1.00 14.23 H new ATOM 0 HB2 PHE A 425 3.388 -6.589 -9.524 1.00 62.23 H new ATOM 0 HB3 PHE A 425 4.417 -8.007 -9.485 1.00 62.23 H new ATOM 0 HD1 PHE A 425 4.520 -4.354 -10.343 1.00 30.15 H new ATOM 0 HD2 PHE A 425 6.743 -7.747 -8.969 1.00 72.21 H new ATOM 0 HE1 PHE A 425 6.445 -2.928 -9.914 1.00 65.43 H new ATOM 0 HE2 PHE A 425 8.643 -6.272 -8.523 1.00 55.44 H new ATOM 0 HZ PHE A 425 8.501 -3.881 -9.008 1.00 72.22 H new ATOM 499 N MET A 426 1.992 -8.580 -11.991 1.00 52.13 N ATOM 500 CA MET A 426 1.187 -9.655 -12.563 1.00 12.53 C ATOM 501 C MET A 426 1.801 -10.284 -13.847 1.00 1.02 C ATOM 502 O MET A 426 1.967 -11.499 -13.875 1.00 4.14 O ATOM 503 CB MET A 426 -0.240 -9.149 -12.857 1.00 72.13 C ATOM 504 CG MET A 426 -1.215 -9.437 -11.748 1.00 62.41 C ATOM 505 SD MET A 426 -1.487 -11.204 -11.615 1.00 42.01 S ATOM 506 CE MET A 426 -2.437 -11.198 -10.125 1.00 1.33 C ATOM 0 H MET A 426 1.438 -7.747 -11.795 1.00 52.13 H new ATOM 0 HA MET A 426 1.162 -10.447 -11.815 1.00 12.53 H new ATOM 0 HB2 MET A 426 -0.208 -8.074 -13.032 1.00 72.13 H new ATOM 0 HB3 MET A 426 -0.600 -9.611 -13.776 1.00 72.13 H new ATOM 0 HG2 MET A 426 -0.831 -9.048 -10.805 1.00 62.41 H new ATOM 0 HG3 MET A 426 -2.160 -8.929 -11.942 1.00 62.41 H new ATOM 0 HE1 MET A 426 -2.102 -12.007 -9.477 1.00 1.33 H new ATOM 0 HE2 MET A 426 -2.305 -10.245 -9.613 1.00 1.33 H new ATOM 0 HE3 MET A 426 -3.491 -11.338 -10.365 1.00 1.33 H new ATOM 516 N PRO A 427 2.165 -9.493 -14.939 1.00 73.24 N ATOM 517 CA PRO A 427 2.801 -10.082 -16.118 1.00 23.21 C ATOM 518 C PRO A 427 4.237 -10.549 -15.860 1.00 72.15 C ATOM 519 O PRO A 427 4.729 -11.422 -16.566 1.00 22.11 O ATOM 520 CB PRO A 427 2.783 -8.987 -17.187 1.00 12.25 C ATOM 521 CG PRO A 427 2.252 -7.750 -16.565 1.00 0.32 C ATOM 522 CD PRO A 427 1.971 -8.033 -15.117 1.00 62.43 C ATOM 0 HA PRO A 427 2.260 -10.978 -16.422 1.00 23.21 H new ATOM 0 HB2 PRO A 427 3.787 -8.817 -17.576 1.00 12.25 H new ATOM 0 HB3 PRO A 427 2.161 -9.287 -18.030 1.00 12.25 H new ATOM 0 HG2 PRO A 427 2.973 -6.938 -16.660 1.00 0.32 H new ATOM 0 HG3 PRO A 427 1.342 -7.430 -17.073 1.00 0.32 H new ATOM 0 HD2 PRO A 427 2.644 -7.469 -14.472 1.00 62.43 H new ATOM 0 HD3 PRO A 427 0.955 -7.740 -14.852 1.00 62.43 H new ATOM 530 N PHE A 428 4.923 -9.965 -14.868 1.00 32.43 N ATOM 531 CA PHE A 428 6.225 -10.500 -14.460 1.00 13.22 C ATOM 532 C PHE A 428 6.109 -11.662 -13.430 1.00 3.11 C ATOM 533 O PHE A 428 7.138 -12.279 -13.176 1.00 21.21 O ATOM 534 CB PHE A 428 7.225 -9.406 -13.941 1.00 2.15 C ATOM 535 CG PHE A 428 7.608 -8.328 -14.945 1.00 55.13 C ATOM 536 CD1 PHE A 428 8.169 -8.652 -16.172 1.00 54.21 C ATOM 537 CD2 PHE A 428 7.403 -6.983 -14.656 1.00 54.22 C ATOM 538 CE1 PHE A 428 8.507 -7.666 -17.077 1.00 2.44 C ATOM 539 CE2 PHE A 428 7.737 -6.000 -15.564 1.00 65.34 C ATOM 540 CZ PHE A 428 8.290 -6.343 -16.769 1.00 63.42 C ATOM 0 H PHE A 428 4.609 -9.146 -14.348 1.00 32.43 H new ATOM 0 HA PHE A 428 6.645 -10.907 -15.380 1.00 13.22 H new ATOM 0 HB2 PHE A 428 6.785 -8.923 -13.068 1.00 2.15 H new ATOM 0 HB3 PHE A 428 8.135 -9.903 -13.605 1.00 2.15 H new ATOM 0 HD1 PHE A 428 8.343 -9.688 -16.422 1.00 54.21 H new ATOM 0 HD2 PHE A 428 6.975 -6.704 -13.705 1.00 54.22 H new ATOM 0 HE1 PHE A 428 8.942 -7.934 -18.028 1.00 2.44 H new ATOM 0 HE2 PHE A 428 7.563 -4.961 -15.325 1.00 65.34 H new ATOM 0 HZ PHE A 428 8.556 -5.574 -17.479 1.00 63.42 H new ATOM 550 N GLY A 429 4.900 -12.029 -12.861 1.00 41.50 N ATOM 551 CA GLY A 429 4.913 -13.079 -11.820 1.00 5.21 C ATOM 552 C GLY A 429 3.698 -13.074 -10.795 1.00 43.02 C ATOM 553 O GLY A 429 2.788 -12.262 -10.942 1.00 64.25 O ATOM 0 H GLY A 429 3.987 -11.639 -13.095 1.00 41.50 H new ATOM 0 HA2 GLY A 429 4.939 -14.050 -12.315 1.00 5.21 H new ATOM 0 HA3 GLY A 429 5.839 -12.986 -11.253 1.00 5.21 H new ATOM 557 N ASN A 430 3.683 -14.013 -9.765 1.00 23.15 N ATOM 558 CA ASN A 430 2.569 -14.164 -8.739 1.00 54.14 C ATOM 559 C ASN A 430 2.421 -12.925 -7.722 1.00 3.30 C ATOM 560 O ASN A 430 3.429 -12.521 -7.135 1.00 61.14 O ATOM 561 CB ASN A 430 2.807 -15.510 -7.971 1.00 70.24 C ATOM 562 CG ASN A 430 1.677 -15.928 -7.025 1.00 14.23 C ATOM 563 OD1 ASN A 430 0.520 -15.527 -7.183 1.00 23.54 O ATOM 564 ND2 ASN A 430 2.005 -16.793 -6.066 1.00 43.51 N ATOM 0 H ASN A 430 4.441 -14.681 -9.627 1.00 23.15 H new ATOM 0 HA ASN A 430 1.620 -14.176 -9.275 1.00 54.14 H new ATOM 0 HB2 ASN A 430 2.961 -16.304 -8.701 1.00 70.24 H new ATOM 0 HB3 ASN A 430 3.728 -15.424 -7.395 1.00 70.24 H new ATOM 0 HD21 ASN A 430 1.289 -17.147 -5.431 1.00 43.51 H new ATOM 0 HD22 ASN A 430 2.972 -17.102 -5.966 1.00 43.51 H new ATOM 571 N VAL A 431 1.169 -12.318 -7.507 1.00 15.31 N ATOM 572 CA VAL A 431 0.945 -11.255 -6.420 1.00 5.23 C ATOM 573 C VAL A 431 0.213 -11.900 -5.189 1.00 32.44 C ATOM 574 O VAL A 431 -0.537 -12.864 -5.385 1.00 23.31 O ATOM 575 CB VAL A 431 0.101 -9.950 -6.774 1.00 63.33 C ATOM 576 CG1 VAL A 431 0.683 -9.077 -7.876 1.00 73.30 C ATOM 577 CG2 VAL A 431 -1.390 -10.185 -7.035 1.00 41.51 C ATOM 0 H VAL A 431 0.335 -12.539 -8.051 1.00 15.31 H new ATOM 0 HA VAL A 431 1.966 -10.914 -6.245 1.00 5.23 H new ATOM 0 HB VAL A 431 0.186 -9.396 -5.839 1.00 63.33 H new ATOM 0 HG11 VAL A 431 0.034 -8.217 -8.040 1.00 73.30 H new ATOM 0 HG12 VAL A 431 1.675 -8.733 -7.582 1.00 73.30 H new ATOM 0 HG13 VAL A 431 0.758 -9.655 -8.797 1.00 73.30 H new ATOM 0 HG21 VAL A 431 -1.873 -9.236 -7.267 1.00 41.51 H new ATOM 0 HG22 VAL A 431 -1.509 -10.867 -7.877 1.00 41.51 H new ATOM 0 HG23 VAL A 431 -1.851 -10.619 -6.148 1.00 41.51 H new ATOM 587 N ILE A 432 0.422 -11.422 -3.917 1.00 12.43 N ATOM 588 CA ILE A 432 -0.356 -12.029 -2.757 1.00 71.35 C ATOM 589 C ILE A 432 -1.310 -10.978 -2.090 1.00 22.02 C ATOM 590 O ILE A 432 -2.508 -11.241 -2.002 1.00 11.25 O ATOM 591 CB ILE A 432 0.526 -12.864 -1.707 1.00 3.32 C ATOM 592 CG1 ILE A 432 1.631 -13.734 -2.440 1.00 1.30 C ATOM 593 CG2 ILE A 432 -0.323 -13.813 -0.807 1.00 11.14 C ATOM 594 CD1 ILE A 432 1.339 -15.267 -2.626 1.00 42.44 C ATOM 0 H ILE A 432 1.070 -10.675 -3.669 1.00 12.43 H new ATOM 0 HA ILE A 432 -0.989 -12.797 -3.202 1.00 71.35 H new ATOM 0 HB ILE A 432 0.994 -12.113 -1.071 1.00 3.32 H new ATOM 0 HG12 ILE A 432 1.801 -13.301 -3.426 1.00 1.30 H new ATOM 0 HG13 ILE A 432 2.563 -13.634 -1.883 1.00 1.30 H new ATOM 0 HG21 ILE A 432 0.334 -14.347 -0.121 1.00 11.14 H new ATOM 0 HG22 ILE A 432 -1.043 -13.226 -0.237 1.00 11.14 H new ATOM 0 HG23 ILE A 432 -0.854 -14.530 -1.433 1.00 11.14 H new ATOM 0 HD11 ILE A 432 2.177 -15.737 -3.141 1.00 42.44 H new ATOM 0 HD12 ILE A 432 1.205 -15.733 -1.650 1.00 42.44 H new ATOM 0 HD13 ILE A 432 0.432 -15.396 -3.217 1.00 42.44 H new ATOM 606 N SER A 433 -0.822 -9.780 -1.625 1.00 54.30 N ATOM 607 CA SER A 433 -1.773 -8.706 -1.099 1.00 2.23 C ATOM 608 C SER A 433 -1.299 -7.257 -1.447 1.00 41.53 C ATOM 609 O SER A 433 -0.124 -7.084 -1.792 1.00 33.01 O ATOM 610 CB SER A 433 -1.950 -8.800 0.439 1.00 74.22 C ATOM 611 OG SER A 433 -2.256 -10.129 0.841 1.00 74.43 O ATOM 0 H SER A 433 0.167 -9.530 -1.598 1.00 54.30 H new ATOM 0 HA SER A 433 -2.724 -8.897 -1.597 1.00 2.23 H new ATOM 0 HB2 SER A 433 -1.037 -8.469 0.934 1.00 74.22 H new ATOM 0 HB3 SER A 433 -2.747 -8.128 0.758 1.00 74.22 H new ATOM 0 HG SER A 433 -2.807 -10.107 1.651 1.00 74.43 H new ATOM 617 N ALA A 434 -2.208 -6.209 -1.369 1.00 53.32 N ATOM 618 CA ALA A 434 -1.755 -4.772 -1.511 1.00 10.52 C ATOM 619 C ALA A 434 -2.488 -3.737 -0.643 1.00 61.54 C ATOM 620 O ALA A 434 -3.688 -3.864 -0.393 1.00 12.44 O ATOM 621 CB ALA A 434 -1.878 -4.300 -2.947 1.00 4.32 C ATOM 0 H ALA A 434 -3.210 -6.327 -1.216 1.00 53.32 H new ATOM 0 HA ALA A 434 -0.723 -4.814 -1.164 1.00 10.52 H new ATOM 0 HB1 ALA A 434 -1.546 -3.264 -3.019 1.00 4.32 H new ATOM 0 HB2 ALA A 434 -1.259 -4.926 -3.590 1.00 4.32 H new ATOM 0 HB3 ALA A 434 -2.918 -4.370 -3.265 1.00 4.32 H new ATOM 627 N LYS A 435 -1.713 -2.712 -0.174 1.00 14.12 N ATOM 628 CA LYS A 435 -2.271 -1.417 0.342 1.00 35.14 C ATOM 629 C LYS A 435 -1.231 -0.241 0.277 1.00 40.13 C ATOM 630 O LYS A 435 -0.032 -0.502 0.417 1.00 14.11 O ATOM 631 CB LYS A 435 -2.796 -1.545 1.781 1.00 22.42 C ATOM 632 CG LYS A 435 -2.033 -2.505 2.693 1.00 51.00 C ATOM 633 CD LYS A 435 -2.697 -2.572 4.059 1.00 62.31 C ATOM 634 CE LYS A 435 -2.578 -1.261 4.852 1.00 33.11 C ATOM 635 NZ LYS A 435 -1.187 -0.975 5.303 1.00 71.12 N ATOM 0 H LYS A 435 -0.694 -2.757 -0.142 1.00 14.12 H new ATOM 0 HA LYS A 435 -3.103 -1.180 -0.321 1.00 35.14 H new ATOM 0 HB2 LYS A 435 -2.786 -0.556 2.239 1.00 22.42 H new ATOM 0 HB3 LYS A 435 -3.837 -1.866 1.739 1.00 22.42 H new ATOM 0 HG2 LYS A 435 -2.005 -3.498 2.245 1.00 51.00 H new ATOM 0 HG3 LYS A 435 -1.000 -2.174 2.799 1.00 51.00 H new ATOM 0 HD2 LYS A 435 -3.751 -2.819 3.932 1.00 62.31 H new ATOM 0 HD3 LYS A 435 -2.248 -3.381 4.636 1.00 62.31 H new ATOM 0 HE2 LYS A 435 -2.930 -0.436 4.233 1.00 33.11 H new ATOM 0 HE3 LYS A 435 -3.233 -1.309 5.722 1.00 33.11 H new ATOM 0 HZ1 LYS A 435 -0.943 0.009 5.072 1.00 71.12 H new ATOM 0 HZ2 LYS A 435 -1.119 -1.117 6.331 1.00 71.12 H new ATOM 0 HZ3 LYS A 435 -0.527 -1.618 4.821 1.00 71.12 H new ATOM 649 N VAL A 436 -1.676 1.059 0.084 1.00 63.01 N ATOM 650 CA VAL A 436 -0.755 2.239 0.198 1.00 11.23 C ATOM 651 C VAL A 436 -1.032 3.003 1.491 1.00 32.25 C ATOM 652 O VAL A 436 -2.137 3.542 1.635 1.00 30.23 O ATOM 653 CB VAL A 436 -0.858 3.276 -1.023 1.00 52.10 C ATOM 654 CG1 VAL A 436 0.261 3.106 -2.043 1.00 53.41 C ATOM 655 CG2 VAL A 436 -2.206 3.244 -1.767 1.00 21.13 C ATOM 0 H VAL A 436 -2.640 1.300 -0.144 1.00 63.01 H new ATOM 0 HA VAL A 436 0.250 1.817 0.186 1.00 11.23 H new ATOM 0 HB VAL A 436 -0.762 4.246 -0.535 1.00 52.10 H new ATOM 0 HG11 VAL A 436 0.137 3.835 -2.844 1.00 53.41 H new ATOM 0 HG12 VAL A 436 1.224 3.262 -1.556 1.00 53.41 H new ATOM 0 HG13 VAL A 436 0.224 2.099 -2.459 1.00 53.41 H new ATOM 0 HG21 VAL A 436 -2.192 3.974 -2.576 1.00 21.13 H new ATOM 0 HG22 VAL A 436 -2.371 2.248 -2.179 1.00 21.13 H new ATOM 0 HG23 VAL A 436 -3.011 3.487 -1.073 1.00 21.13 H new ATOM 665 N PHE A 437 -0.074 3.076 2.468 1.00 13.30 N ATOM 666 CA PHE A 437 -0.306 4.012 3.526 1.00 2.43 C ATOM 667 C PHE A 437 0.233 5.372 3.099 1.00 45.42 C ATOM 668 O PHE A 437 1.430 5.655 3.097 1.00 33.51 O ATOM 669 CB PHE A 437 0.192 3.559 4.941 1.00 0.32 C ATOM 670 CG PHE A 437 1.691 3.454 5.202 1.00 52.31 C ATOM 671 CD1 PHE A 437 2.493 2.501 4.569 1.00 34.32 C ATOM 672 CD2 PHE A 437 2.295 4.301 6.126 1.00 32.13 C ATOM 673 CE1 PHE A 437 3.842 2.414 4.856 1.00 24.35 C ATOM 674 CE2 PHE A 437 3.644 4.213 6.404 1.00 2.15 C ATOM 675 CZ PHE A 437 4.415 3.270 5.770 1.00 22.52 C ATOM 0 H PHE A 437 0.787 2.531 2.517 1.00 13.30 H new ATOM 0 HA PHE A 437 -1.384 4.077 3.676 1.00 2.43 H new ATOM 0 HB2 PHE A 437 -0.221 4.254 5.672 1.00 0.32 H new ATOM 0 HB3 PHE A 437 -0.246 2.582 5.146 1.00 0.32 H new ATOM 0 HD1 PHE A 437 2.055 1.826 3.849 1.00 34.32 H new ATOM 0 HD2 PHE A 437 1.697 5.042 6.636 1.00 32.13 H new ATOM 0 HE1 PHE A 437 4.450 1.671 4.361 1.00 24.35 H new ATOM 0 HE2 PHE A 437 4.093 4.886 7.120 1.00 2.15 H new ATOM 0 HZ PHE A 437 5.470 3.200 5.988 1.00 22.52 H new ATOM 685 N ILE A 438 -0.695 6.169 2.608 1.00 22.02 N ATOM 686 CA ILE A 438 -0.445 7.612 2.414 1.00 3.33 C ATOM 687 C ILE A 438 -1.366 8.339 3.382 1.00 23.22 C ATOM 688 O ILE A 438 -2.562 8.034 3.373 1.00 31.41 O ATOM 689 CB ILE A 438 -0.734 8.132 0.928 1.00 21.13 C ATOM 690 CG1 ILE A 438 -0.340 7.080 -0.161 1.00 41.34 C ATOM 691 CG2 ILE A 438 0.027 9.451 0.667 1.00 52.02 C ATOM 692 CD1 ILE A 438 -0.658 7.487 -1.610 1.00 72.34 C ATOM 0 H ILE A 438 -1.627 5.860 2.333 1.00 22.02 H new ATOM 0 HA ILE A 438 0.613 7.805 2.592 1.00 3.33 H new ATOM 0 HB ILE A 438 -1.809 8.299 0.854 1.00 21.13 H new ATOM 0 HG12 ILE A 438 0.729 6.882 -0.082 1.00 41.34 H new ATOM 0 HG13 ILE A 438 -0.854 6.144 0.058 1.00 41.34 H new ATOM 0 HG21 ILE A 438 -0.178 9.795 -0.347 1.00 52.02 H new ATOM 0 HG22 ILE A 438 -0.301 10.208 1.380 1.00 52.02 H new ATOM 0 HG23 ILE A 438 1.098 9.283 0.784 1.00 52.02 H new ATOM 0 HD11 ILE A 438 -0.347 6.692 -2.288 1.00 72.34 H new ATOM 0 HD12 ILE A 438 -1.730 7.654 -1.714 1.00 72.34 H new ATOM 0 HD13 ILE A 438 -0.122 8.404 -1.856 1.00 72.34 H new ATOM 704 N ASP A 439 -0.831 9.224 4.281 1.00 64.10 N ATOM 705 CA ASP A 439 -1.701 10.050 5.110 1.00 70.31 C ATOM 706 C ASP A 439 -2.632 10.907 4.188 1.00 54.22 C ATOM 707 O ASP A 439 -2.143 11.830 3.531 1.00 24.51 O ATOM 708 CB ASP A 439 -0.827 10.934 6.045 1.00 63.25 C ATOM 709 CG ASP A 439 -1.674 11.929 6.821 1.00 13.41 C ATOM 710 OD1 ASP A 439 -2.252 11.530 7.859 1.00 22.51 O ATOM 711 OD2 ASP A 439 -1.784 13.095 6.381 1.00 12.14 O ATOM 0 H ASP A 439 0.168 9.365 4.431 1.00 64.10 H new ATOM 0 HA ASP A 439 -2.339 9.429 5.739 1.00 70.31 H new ATOM 0 HB2 ASP A 439 -0.280 10.299 6.742 1.00 63.25 H new ATOM 0 HB3 ASP A 439 -0.085 11.470 5.453 1.00 63.25 H new ATOM 716 N LYS A 440 -3.962 10.569 4.067 1.00 74.14 N ATOM 717 CA LYS A 440 -4.821 11.221 3.067 1.00 52.22 C ATOM 718 C LYS A 440 -5.342 12.594 3.569 1.00 61.35 C ATOM 719 O LYS A 440 -6.109 13.242 2.855 1.00 11.50 O ATOM 720 CB LYS A 440 -6.022 10.321 2.613 1.00 70.15 C ATOM 721 CG LYS A 440 -5.665 9.008 1.878 1.00 40.01 C ATOM 722 CD LYS A 440 -4.915 9.242 0.563 1.00 30.40 C ATOM 723 CE LYS A 440 -4.671 7.936 -0.191 1.00 33.55 C ATOM 724 NZ LYS A 440 -5.928 7.311 -0.687 1.00 73.35 N ATOM 0 H LYS A 440 -4.431 9.868 4.640 1.00 74.14 H new ATOM 0 HA LYS A 440 -4.188 11.383 2.194 1.00 52.22 H new ATOM 0 HB2 LYS A 440 -6.611 10.068 3.495 1.00 70.15 H new ATOM 0 HB3 LYS A 440 -6.664 10.913 1.960 1.00 70.15 H new ATOM 0 HG2 LYS A 440 -5.054 8.386 2.533 1.00 40.01 H new ATOM 0 HG3 LYS A 440 -6.580 8.452 1.674 1.00 40.01 H new ATOM 0 HD2 LYS A 440 -5.488 9.923 -0.066 1.00 30.40 H new ATOM 0 HD3 LYS A 440 -3.961 9.726 0.770 1.00 30.40 H new ATOM 0 HE2 LYS A 440 -4.009 8.128 -1.035 1.00 33.55 H new ATOM 0 HE3 LYS A 440 -4.156 7.234 0.465 1.00 33.55 H new ATOM 0 HZ1 LYS A 440 -5.696 6.527 -1.330 1.00 73.35 H new ATOM 0 HZ2 LYS A 440 -6.476 6.947 0.118 1.00 73.35 H new ATOM 0 HZ3 LYS A 440 -6.491 8.021 -1.197 1.00 73.35 H new ATOM 738 N GLN A 441 -4.949 13.019 4.809 1.00 74.44 N ATOM 739 CA GLN A 441 -5.514 14.228 5.442 1.00 35.22 C ATOM 740 C GLN A 441 -5.225 15.506 4.656 1.00 15.43 C ATOM 741 O GLN A 441 -6.148 16.247 4.312 1.00 65.13 O ATOM 742 CB GLN A 441 -5.034 14.421 6.912 1.00 32.41 C ATOM 743 CG GLN A 441 -5.370 13.269 7.902 1.00 14.34 C ATOM 744 CD GLN A 441 -6.863 12.927 7.944 1.00 74.44 C ATOM 745 OE1 GLN A 441 -7.728 13.784 7.745 1.00 40.43 O ATOM 746 NE2 GLN A 441 -7.174 11.670 8.237 1.00 74.12 N ATOM 0 H GLN A 441 -4.249 12.539 5.376 1.00 74.44 H new ATOM 0 HA GLN A 441 -6.590 14.055 5.442 1.00 35.22 H new ATOM 0 HB2 GLN A 441 -3.953 14.561 6.904 1.00 32.41 H new ATOM 0 HB3 GLN A 441 -5.472 15.342 7.297 1.00 32.41 H new ATOM 0 HG2 GLN A 441 -4.808 12.379 7.619 1.00 14.34 H new ATOM 0 HG3 GLN A 441 -5.040 13.550 8.902 1.00 14.34 H new ATOM 0 HE21 GLN A 441 -6.435 10.985 8.396 1.00 74.12 H new ATOM 0 HE22 GLN A 441 -8.152 11.389 8.303 1.00 74.12 H new ATOM 755 N THR A 442 -3.948 15.784 4.399 1.00 11.21 N ATOM 756 CA THR A 442 -3.568 16.951 3.649 1.00 51.54 C ATOM 757 C THR A 442 -2.477 16.606 2.604 1.00 0.41 C ATOM 758 O THR A 442 -1.877 17.533 2.057 1.00 72.02 O ATOM 759 CB THR A 442 -3.165 18.164 4.594 1.00 14.21 C ATOM 760 OG1 THR A 442 -3.763 18.014 5.893 1.00 51.12 O ATOM 761 CG2 THR A 442 -3.683 19.475 4.013 1.00 60.43 C ATOM 0 H THR A 442 -3.166 15.206 4.706 1.00 11.21 H new ATOM 0 HA THR A 442 -4.441 17.292 3.093 1.00 51.54 H new ATOM 0 HB THR A 442 -2.078 18.172 4.672 1.00 14.21 H new ATOM 0 HG1 THR A 442 -3.503 18.768 6.462 1.00 51.12 H new ATOM 0 HG21 THR A 442 -3.402 20.300 4.668 1.00 60.43 H new ATOM 0 HG22 THR A 442 -3.249 19.632 3.025 1.00 60.43 H new ATOM 0 HG23 THR A 442 -4.769 19.432 3.930 1.00 60.43 H new ATOM 769 N ASN A 443 -2.243 15.260 2.291 1.00 64.14 N ATOM 770 CA ASN A 443 -1.006 14.819 1.609 1.00 64.52 C ATOM 771 C ASN A 443 0.249 15.260 2.383 1.00 34.30 C ATOM 772 O ASN A 443 1.063 16.042 1.872 1.00 10.30 O ATOM 773 CB ASN A 443 -0.945 15.287 0.135 1.00 50.21 C ATOM 774 CG ASN A 443 -1.907 14.520 -0.763 1.00 71.21 C ATOM 775 OD1 ASN A 443 -2.219 13.356 -0.516 1.00 34.21 O ATOM 776 ND2 ASN A 443 -2.362 15.166 -1.835 1.00 74.01 N ATOM 0 H ASN A 443 -2.895 14.506 2.507 1.00 64.14 H new ATOM 0 HA ASN A 443 -1.029 13.729 1.595 1.00 64.52 H new ATOM 0 HB2 ASN A 443 -1.177 16.351 0.085 1.00 50.21 H new ATOM 0 HB3 ASN A 443 0.071 15.165 -0.239 1.00 50.21 H new ATOM 0 HD21 ASN A 443 -2.992 14.695 -2.485 1.00 74.01 H new ATOM 0 HD22 ASN A 443 -2.081 16.131 -2.006 1.00 74.01 H new ATOM 783 N LEU A 444 0.377 14.795 3.629 1.00 21.40 N ATOM 784 CA LEU A 444 1.565 15.179 4.462 1.00 22.40 C ATOM 785 C LEU A 444 2.684 14.167 4.080 1.00 33.12 C ATOM 786 O LEU A 444 2.358 12.980 3.960 1.00 73.53 O ATOM 787 CB LEU A 444 1.195 15.272 6.047 1.00 22.24 C ATOM 788 CG LEU A 444 1.569 14.147 7.109 1.00 75.13 C ATOM 789 CD1 LEU A 444 3.062 13.812 7.250 1.00 63.33 C ATOM 790 CD2 LEU A 444 1.098 14.560 8.506 1.00 51.33 C ATOM 0 H LEU A 444 -0.290 14.174 4.088 1.00 21.40 H new ATOM 0 HA LEU A 444 1.921 16.189 4.258 1.00 22.40 H new ATOM 0 HB2 LEU A 444 1.642 16.197 6.411 1.00 22.24 H new ATOM 0 HB3 LEU A 444 0.114 15.397 6.102 1.00 22.24 H new ATOM 0 HG LEU A 444 1.069 13.262 6.716 1.00 75.13 H new ATOM 0 HD11 LEU A 444 3.191 13.033 8.002 1.00 63.33 H new ATOM 0 HD12 LEU A 444 3.448 13.460 6.293 1.00 63.33 H new ATOM 0 HD13 LEU A 444 3.608 14.705 7.555 1.00 63.33 H new ATOM 0 HD21 LEU A 444 1.360 13.782 9.223 1.00 51.33 H new ATOM 0 HD22 LEU A 444 1.581 15.494 8.792 1.00 51.33 H new ATOM 0 HD23 LEU A 444 0.017 14.698 8.499 1.00 51.33 H new ATOM 802 N SER A 445 3.987 14.622 3.833 1.00 44.43 N ATOM 803 CA SER A 445 5.021 13.758 3.182 1.00 2.04 C ATOM 804 C SER A 445 5.201 12.348 3.789 1.00 21.50 C ATOM 805 O SER A 445 5.623 12.187 4.941 1.00 62.51 O ATOM 806 CB SER A 445 6.389 14.461 3.182 1.00 32.42 C ATOM 807 OG SER A 445 6.305 15.723 2.543 1.00 63.13 O ATOM 0 H SER A 445 4.316 15.557 4.075 1.00 44.43 H new ATOM 0 HA SER A 445 4.637 13.609 2.173 1.00 2.04 H new ATOM 0 HB2 SER A 445 6.737 14.590 4.207 1.00 32.42 H new ATOM 0 HB3 SER A 445 7.123 13.838 2.672 1.00 32.42 H new ATOM 0 HG SER A 445 7.185 16.155 2.555 1.00 63.13 H new ATOM 813 N LYS A 446 4.888 11.332 2.953 1.00 65.14 N ATOM 814 CA LYS A 446 4.896 9.931 3.333 1.00 1.25 C ATOM 815 C LYS A 446 4.977 9.092 2.036 1.00 11.10 C ATOM 816 O LYS A 446 6.078 8.669 1.685 1.00 22.43 O ATOM 817 CB LYS A 446 3.679 9.599 4.229 1.00 33.24 C ATOM 818 CG LYS A 446 3.530 8.132 4.605 1.00 63.12 C ATOM 819 CD LYS A 446 2.305 7.918 5.496 1.00 53.32 C ATOM 820 CE LYS A 446 2.635 7.983 6.991 1.00 54.12 C ATOM 821 NZ LYS A 446 3.094 9.323 7.438 1.00 20.24 N ATOM 0 H LYS A 446 4.620 11.483 1.980 1.00 65.14 H new ATOM 0 HA LYS A 446 5.764 9.687 3.945 1.00 1.25 H new ATOM 0 HB2 LYS A 446 3.752 10.186 5.144 1.00 33.24 H new ATOM 0 HB3 LYS A 446 2.772 9.920 3.716 1.00 33.24 H new ATOM 0 HG2 LYS A 446 3.438 7.529 3.702 1.00 63.12 H new ATOM 0 HG3 LYS A 446 4.426 7.793 5.125 1.00 63.12 H new ATOM 0 HD2 LYS A 446 1.555 8.674 5.262 1.00 53.32 H new ATOM 0 HD3 LYS A 446 1.862 6.948 5.269 1.00 53.32 H new ATOM 0 HE2 LYS A 446 1.751 7.701 7.563 1.00 54.12 H new ATOM 0 HE3 LYS A 446 3.408 7.249 7.217 1.00 54.12 H new ATOM 0 HZ1 LYS A 446 3.009 9.392 8.472 1.00 20.24 H new ATOM 0 HZ2 LYS A 446 4.088 9.459 7.163 1.00 20.24 H new ATOM 0 HZ3 LYS A 446 2.508 10.057 6.992 1.00 20.24 H new ATOM 835 N CYS A 447 3.822 8.957 1.302 1.00 32.12 N ATOM 836 CA CYS A 447 3.713 8.239 -0.011 1.00 45.32 C ATOM 837 C CYS A 447 4.379 6.850 0.053 1.00 75.12 C ATOM 838 O CYS A 447 5.229 6.514 -0.773 1.00 62.44 O ATOM 839 CB CYS A 447 4.301 9.083 -1.183 1.00 33.43 C ATOM 840 SG CYS A 447 3.829 8.505 -2.832 1.00 42.34 S ATOM 0 H CYS A 447 2.933 9.349 1.612 1.00 32.12 H new ATOM 0 HA CYS A 447 2.651 8.096 -0.210 1.00 45.32 H new ATOM 0 HB2 CYS A 447 3.977 10.117 -1.068 1.00 33.43 H new ATOM 0 HB3 CYS A 447 5.388 9.079 -1.107 1.00 33.43 H new ATOM 0 HG CYS A 447 4.367 9.274 -3.732 1.00 42.34 H new ATOM 846 N PHE A 448 3.985 6.045 1.044 1.00 13.35 N ATOM 847 CA PHE A 448 4.822 4.893 1.444 1.00 23.43 C ATOM 848 C PHE A 448 4.056 3.543 1.278 1.00 0.44 C ATOM 849 O PHE A 448 2.834 3.494 1.420 1.00 14.52 O ATOM 850 CB PHE A 448 5.389 5.150 2.882 1.00 10.42 C ATOM 851 CG PHE A 448 6.791 4.588 3.128 1.00 33.34 C ATOM 852 CD1 PHE A 448 7.033 3.209 3.207 1.00 31.23 C ATOM 853 CD2 PHE A 448 7.886 5.450 3.255 1.00 11.35 C ATOM 854 CE1 PHE A 448 8.310 2.721 3.396 1.00 2.04 C ATOM 855 CE2 PHE A 448 9.161 4.951 3.454 1.00 44.23 C ATOM 856 CZ PHE A 448 9.371 3.590 3.517 1.00 42.04 C ATOM 0 H PHE A 448 3.121 6.157 1.574 1.00 13.35 H new ATOM 0 HA PHE A 448 5.679 4.797 0.777 1.00 23.43 H new ATOM 0 HB2 PHE A 448 5.406 6.225 3.064 1.00 10.42 H new ATOM 0 HB3 PHE A 448 4.705 4.714 3.610 1.00 10.42 H new ATOM 0 HD1 PHE A 448 6.207 2.518 3.119 1.00 31.23 H new ATOM 0 HD2 PHE A 448 7.734 6.518 3.197 1.00 11.35 H new ATOM 0 HE1 PHE A 448 8.477 1.655 3.449 1.00 2.04 H new ATOM 0 HE2 PHE A 448 9.994 5.630 3.560 1.00 44.23 H new ATOM 0 HZ PHE A 448 10.370 3.205 3.662 1.00 42.04 H new ATOM 866 N GLY A 449 4.783 2.471 0.915 1.00 4.33 N ATOM 867 CA GLY A 449 4.140 1.160 0.579 1.00 55.23 C ATOM 868 C GLY A 449 5.064 -0.080 0.739 1.00 11.15 C ATOM 869 O GLY A 449 6.274 0.080 0.851 1.00 12.22 O ATOM 0 H GLY A 449 5.800 2.471 0.843 1.00 4.33 H new ATOM 0 HA2 GLY A 449 3.264 1.027 1.215 1.00 55.23 H new ATOM 0 HA3 GLY A 449 3.784 1.199 -0.450 1.00 55.23 H new ATOM 873 N PHE A 450 4.464 -1.325 0.722 1.00 73.23 N ATOM 874 CA PHE A 450 5.230 -2.644 0.844 1.00 25.32 C ATOM 875 C PHE A 450 4.431 -3.824 0.188 1.00 62.23 C ATOM 876 O PHE A 450 3.204 -3.789 0.283 1.00 74.03 O ATOM 877 CB PHE A 450 5.677 -2.997 2.318 1.00 55.35 C ATOM 878 CG PHE A 450 4.856 -2.451 3.494 1.00 21.45 C ATOM 879 CD1 PHE A 450 3.533 -2.857 3.757 1.00 53.42 C ATOM 880 CD2 PHE A 450 5.435 -1.513 4.371 1.00 53.23 C ATOM 881 CE1 PHE A 450 2.834 -2.335 4.831 1.00 74.13 C ATOM 882 CE2 PHE A 450 4.721 -1.006 5.444 1.00 44.43 C ATOM 883 CZ PHE A 450 3.424 -1.414 5.664 1.00 23.34 C ATOM 0 H PHE A 450 3.456 -1.451 0.626 1.00 73.23 H new ATOM 0 HA PHE A 450 6.157 -2.499 0.289 1.00 25.32 H new ATOM 0 HB2 PHE A 450 5.695 -4.083 2.405 1.00 55.35 H new ATOM 0 HB3 PHE A 450 6.703 -2.650 2.443 1.00 55.35 H new ATOM 0 HD1 PHE A 450 3.059 -3.583 3.113 1.00 53.42 H new ATOM 0 HD2 PHE A 450 6.450 -1.184 4.204 1.00 53.23 H new ATOM 0 HE1 PHE A 450 1.819 -2.653 5.016 1.00 74.13 H new ATOM 0 HE2 PHE A 450 5.182 -0.290 6.109 1.00 44.43 H new ATOM 0 HZ PHE A 450 2.867 -1.008 6.496 1.00 23.34 H new ATOM 893 N VAL A 451 5.065 -4.896 -0.465 1.00 71.14 N ATOM 894 CA VAL A 451 4.212 -5.885 -1.229 1.00 50.12 C ATOM 895 C VAL A 451 4.750 -7.366 -1.181 1.00 50.03 C ATOM 896 O VAL A 451 5.922 -7.580 -0.860 1.00 73.01 O ATOM 897 CB VAL A 451 3.918 -5.332 -2.720 1.00 15.05 C ATOM 898 CG1 VAL A 451 5.159 -5.027 -3.536 1.00 60.52 C ATOM 899 CG2 VAL A 451 3.057 -6.229 -3.605 1.00 1.25 C ATOM 0 H VAL A 451 6.069 -5.075 -0.473 1.00 71.14 H new ATOM 0 HA VAL A 451 3.253 -5.959 -0.716 1.00 50.12 H new ATOM 0 HB VAL A 451 3.373 -4.421 -2.475 1.00 15.05 H new ATOM 0 HG11 VAL A 451 4.866 -4.662 -4.521 1.00 60.52 H new ATOM 0 HG12 VAL A 451 5.751 -4.266 -3.028 1.00 60.52 H new ATOM 0 HG13 VAL A 451 5.753 -5.934 -3.647 1.00 60.52 H new ATOM 0 HG21 VAL A 451 2.925 -5.760 -4.580 1.00 1.25 H new ATOM 0 HG22 VAL A 451 3.547 -7.195 -3.730 1.00 1.25 H new ATOM 0 HG23 VAL A 451 2.083 -6.374 -3.138 1.00 1.25 H new ATOM 909 N SER A 452 3.849 -8.379 -1.477 1.00 65.31 N ATOM 910 CA SER A 452 4.116 -9.827 -1.375 1.00 45.00 C ATOM 911 C SER A 452 4.493 -10.492 -2.734 1.00 50.32 C ATOM 912 O SER A 452 3.704 -10.420 -3.687 1.00 23.24 O ATOM 913 CB SER A 452 2.803 -10.460 -0.852 1.00 43.22 C ATOM 914 OG SER A 452 2.713 -10.395 0.556 1.00 3.31 O ATOM 0 H SER A 452 2.902 -8.179 -1.799 1.00 65.31 H new ATOM 0 HA SER A 452 4.972 -9.986 -0.719 1.00 45.00 H new ATOM 0 HB2 SER A 452 1.950 -9.946 -1.295 1.00 43.22 H new ATOM 0 HB3 SER A 452 2.749 -11.501 -1.172 1.00 43.22 H new ATOM 0 HG SER A 452 2.311 -9.541 0.819 1.00 3.31 H new ATOM 920 N TYR A 453 5.711 -11.120 -2.821 1.00 13.32 N ATOM 921 CA TYR A 453 6.083 -11.955 -3.994 1.00 12.01 C ATOM 922 C TYR A 453 6.632 -13.339 -3.505 1.00 73.35 C ATOM 923 O TYR A 453 7.391 -13.296 -2.544 1.00 10.13 O ATOM 924 CB TYR A 453 7.149 -11.178 -4.825 1.00 41.53 C ATOM 925 CG TYR A 453 7.267 -11.570 -6.309 1.00 72.20 C ATOM 926 CD1 TYR A 453 7.602 -12.853 -6.769 1.00 52.35 C ATOM 927 CD2 TYR A 453 7.047 -10.600 -7.285 1.00 32.15 C ATOM 928 CE1 TYR A 453 7.714 -13.113 -8.112 1.00 14.31 C ATOM 929 CE2 TYR A 453 7.174 -10.850 -8.604 1.00 61.04 C ATOM 930 CZ TYR A 453 7.507 -12.107 -9.023 1.00 72.10 C ATOM 931 OH TYR A 453 7.661 -12.361 -10.352 1.00 44.32 O ATOM 0 H TYR A 453 6.433 -11.060 -2.103 1.00 13.32 H new ATOM 0 HA TYR A 453 5.215 -12.151 -4.623 1.00 12.01 H new ATOM 0 HB2 TYR A 453 6.920 -10.114 -4.768 1.00 41.53 H new ATOM 0 HB3 TYR A 453 8.122 -11.320 -4.354 1.00 41.53 H new ATOM 0 HD1 TYR A 453 7.774 -13.646 -6.057 1.00 52.35 H new ATOM 0 HD2 TYR A 453 6.763 -9.606 -6.972 1.00 32.15 H new ATOM 0 HE1 TYR A 453 7.965 -14.107 -8.452 1.00 14.31 H new ATOM 0 HE2 TYR A 453 7.014 -10.062 -9.325 1.00 61.04 H new ATOM 0 HH TYR A 453 7.477 -11.546 -10.864 1.00 44.32 H new ATOM 941 N ASP A 454 6.250 -14.539 -4.163 1.00 5.12 N ATOM 942 CA ASP A 454 6.642 -15.945 -3.712 1.00 64.21 C ATOM 943 C ASP A 454 7.880 -16.080 -2.802 1.00 4.11 C ATOM 944 O ASP A 454 7.761 -16.097 -1.575 1.00 62.33 O ATOM 945 CB ASP A 454 6.893 -16.890 -4.907 1.00 22.14 C ATOM 946 CG ASP A 454 5.753 -16.945 -5.890 1.00 61.03 C ATOM 947 OD1 ASP A 454 4.750 -17.630 -5.604 1.00 51.41 O ATOM 948 OD2 ASP A 454 5.860 -16.295 -6.952 1.00 2.44 O ATOM 0 H ASP A 454 5.672 -14.539 -5.004 1.00 5.12 H new ATOM 0 HA ASP A 454 5.768 -16.217 -3.121 1.00 64.21 H new ATOM 0 HB2 ASP A 454 7.795 -16.569 -5.429 1.00 22.14 H new ATOM 0 HB3 ASP A 454 7.084 -17.895 -4.530 1.00 22.14 H new ATOM 953 N ASN A 455 9.059 -16.173 -3.426 1.00 73.32 N ATOM 954 CA ASN A 455 10.294 -16.509 -2.753 1.00 0.25 C ATOM 955 C ASN A 455 11.461 -15.892 -3.510 1.00 13.22 C ATOM 956 O ASN A 455 11.414 -15.832 -4.735 1.00 52.13 O ATOM 957 CB ASN A 455 10.398 -18.047 -2.641 1.00 42.11 C ATOM 958 CG ASN A 455 11.161 -18.501 -1.405 1.00 2.41 C ATOM 959 OD1 ASN A 455 12.381 -18.673 -1.429 1.00 4.22 O ATOM 960 ND2 ASN A 455 10.431 -18.671 -0.309 1.00 41.14 N ATOM 0 H ASN A 455 9.172 -16.013 -4.427 1.00 73.32 H new ATOM 0 HA ASN A 455 10.317 -16.103 -1.742 1.00 0.25 H new ATOM 0 HB2 ASN A 455 9.395 -18.473 -2.619 1.00 42.11 H new ATOM 0 HB3 ASN A 455 10.892 -18.438 -3.531 1.00 42.11 H new ATOM 0 HD21 ASN A 455 10.878 -18.956 0.562 1.00 41.14 H new ATOM 0 HD22 ASN A 455 9.423 -18.516 -0.338 1.00 41.14 H new ATOM 967 N PRO A 456 12.472 -15.318 -2.769 1.00 45.54 N ATOM 968 CA PRO A 456 13.691 -14.617 -3.301 1.00 12.50 C ATOM 969 C PRO A 456 14.397 -15.059 -4.641 1.00 40.53 C ATOM 970 O PRO A 456 15.239 -14.284 -5.111 1.00 35.12 O ATOM 971 CB PRO A 456 14.690 -14.708 -2.106 1.00 32.41 C ATOM 972 CG PRO A 456 13.955 -15.367 -0.992 1.00 54.31 C ATOM 973 CD PRO A 456 12.509 -15.158 -1.280 1.00 14.14 C ATOM 0 HA PRO A 456 13.353 -13.635 -3.631 1.00 12.50 H new ATOM 0 HB2 PRO A 456 15.574 -15.283 -2.382 1.00 32.41 H new ATOM 0 HB3 PRO A 456 15.034 -13.717 -1.811 1.00 32.41 H new ATOM 0 HG2 PRO A 456 14.194 -16.429 -0.940 1.00 54.31 H new ATOM 0 HG3 PRO A 456 14.229 -14.932 -0.031 1.00 54.31 H new ATOM 0 HD2 PRO A 456 11.880 -15.890 -0.773 1.00 14.14 H new ATOM 0 HD3 PRO A 456 12.167 -14.172 -0.965 1.00 14.14 H new ATOM 981 N VAL A 457 14.121 -16.233 -5.271 1.00 15.33 N ATOM 982 CA VAL A 457 14.831 -16.565 -6.525 1.00 42.03 C ATOM 983 C VAL A 457 14.097 -15.924 -7.758 1.00 33.30 C ATOM 984 O VAL A 457 14.741 -15.533 -8.742 1.00 34.12 O ATOM 985 CB VAL A 457 15.159 -18.102 -6.714 1.00 15.40 C ATOM 986 CG1 VAL A 457 13.929 -18.995 -6.821 1.00 23.44 C ATOM 987 CG2 VAL A 457 16.078 -18.339 -7.912 1.00 51.42 C ATOM 0 H VAL A 457 13.448 -16.929 -4.949 1.00 15.33 H new ATOM 0 HA VAL A 457 15.820 -16.113 -6.450 1.00 42.03 H new ATOM 0 HB VAL A 457 15.674 -18.389 -5.797 1.00 15.40 H new ATOM 0 HG11 VAL A 457 14.242 -20.031 -6.949 1.00 23.44 H new ATOM 0 HG12 VAL A 457 13.334 -18.905 -5.912 1.00 23.44 H new ATOM 0 HG13 VAL A 457 13.330 -18.688 -7.679 1.00 23.44 H new ATOM 0 HG21 VAL A 457 16.281 -19.406 -8.010 1.00 51.42 H new ATOM 0 HG22 VAL A 457 15.594 -17.977 -8.819 1.00 51.42 H new ATOM 0 HG23 VAL A 457 17.016 -17.804 -7.763 1.00 51.42 H new ATOM 997 N SER A 458 12.752 -15.795 -7.681 1.00 24.12 N ATOM 998 CA SER A 458 11.975 -14.999 -8.639 1.00 74.31 C ATOM 999 C SER A 458 12.107 -13.464 -8.378 1.00 71.02 C ATOM 1000 O SER A 458 11.742 -12.698 -9.277 1.00 15.34 O ATOM 1001 CB SER A 458 10.449 -15.406 -8.646 1.00 15.41 C ATOM 1002 OG SER A 458 9.922 -15.315 -7.341 1.00 43.41 O ATOM 0 H SER A 458 12.186 -16.238 -6.957 1.00 24.12 H new ATOM 0 HA SER A 458 12.399 -15.218 -9.619 1.00 74.31 H new ATOM 0 HB2 SER A 458 9.893 -14.753 -9.319 1.00 15.41 H new ATOM 0 HB3 SER A 458 10.336 -16.423 -9.023 1.00 15.41 H new ATOM 0 HG SER A 458 9.276 -14.580 -7.300 1.00 43.41 H new ATOM 1008 N ALA A 459 12.617 -12.967 -7.180 1.00 33.34 N ATOM 1009 CA ALA A 459 12.406 -11.551 -6.858 1.00 14.01 C ATOM 1010 C ALA A 459 13.190 -10.537 -7.750 1.00 75.13 C ATOM 1011 O ALA A 459 12.554 -9.653 -8.331 1.00 35.13 O ATOM 1012 CB ALA A 459 12.623 -11.191 -5.385 1.00 54.04 C ATOM 0 H ALA A 459 13.136 -13.507 -6.488 1.00 33.34 H new ATOM 0 HA ALA A 459 11.346 -11.443 -7.088 1.00 14.01 H new ATOM 0 HB1 ALA A 459 12.445 -10.125 -5.241 1.00 54.04 H new ATOM 0 HB2 ALA A 459 11.931 -11.761 -4.765 1.00 54.04 H new ATOM 0 HB3 ALA A 459 13.647 -11.430 -5.099 1.00 54.04 H new ATOM 1018 N GLN A 460 14.547 -10.713 -7.886 1.00 24.22 N ATOM 1019 CA GLN A 460 15.509 -9.693 -8.442 1.00 62.52 C ATOM 1020 C GLN A 460 15.195 -9.206 -9.889 1.00 32.42 C ATOM 1021 O GLN A 460 15.446 -8.036 -10.188 1.00 43.12 O ATOM 1022 CB GLN A 460 16.988 -10.199 -8.359 1.00 4.31 C ATOM 1023 CG GLN A 460 17.874 -9.556 -7.259 1.00 0.30 C ATOM 1024 CD GLN A 460 17.480 -9.869 -5.808 1.00 22.54 C ATOM 1025 OE1 GLN A 460 16.315 -10.077 -5.460 1.00 23.42 O ATOM 1026 NE2 GLN A 460 18.480 -9.918 -4.944 1.00 31.00 N ATOM 0 H GLN A 460 15.010 -11.579 -7.609 1.00 24.22 H new ATOM 0 HA GLN A 460 15.375 -8.822 -7.800 1.00 62.52 H new ATOM 0 HB2 GLN A 460 16.972 -11.277 -8.199 1.00 4.31 H new ATOM 0 HB3 GLN A 460 17.463 -10.027 -9.325 1.00 4.31 H new ATOM 0 HG2 GLN A 460 18.903 -9.881 -7.413 1.00 0.30 H new ATOM 0 HG3 GLN A 460 17.858 -8.474 -7.394 1.00 0.30 H new ATOM 0 HE21 GLN A 460 19.434 -9.742 -5.258 1.00 31.00 H new ATOM 0 HE22 GLN A 460 18.297 -10.132 -3.964 1.00 31.00 H new ATOM 1035 N ALA A 461 14.631 -10.095 -10.756 1.00 23.33 N ATOM 1036 CA ALA A 461 14.265 -9.791 -12.159 1.00 71.54 C ATOM 1037 C ALA A 461 13.300 -8.498 -12.372 1.00 55.33 C ATOM 1038 O ALA A 461 13.286 -7.964 -13.488 1.00 12.22 O ATOM 1039 CB ALA A 461 13.780 -11.128 -12.849 1.00 62.31 C ATOM 0 H ALA A 461 14.417 -11.056 -10.489 1.00 23.33 H new ATOM 0 HA ALA A 461 15.157 -9.440 -12.678 1.00 71.54 H new ATOM 0 HB1 ALA A 461 13.506 -10.924 -13.884 1.00 62.31 H new ATOM 0 HB2 ALA A 461 14.585 -11.863 -12.825 1.00 62.31 H new ATOM 0 HB3 ALA A 461 12.915 -11.520 -12.315 1.00 62.31 H new ATOM 1045 N ALA A 462 12.504 -7.983 -11.329 1.00 53.00 N ATOM 1046 CA ALA A 462 11.908 -6.581 -11.372 1.00 70.21 C ATOM 1047 C ALA A 462 12.835 -5.526 -10.746 1.00 42.23 C ATOM 1048 O ALA A 462 13.101 -4.505 -11.369 1.00 13.10 O ATOM 1049 CB ALA A 462 10.575 -6.530 -10.653 1.00 52.13 C ATOM 0 H ALA A 462 12.275 -8.506 -10.484 1.00 53.00 H new ATOM 0 HA ALA A 462 11.775 -6.349 -12.429 1.00 70.21 H new ATOM 0 HB1 ALA A 462 10.174 -5.517 -10.700 1.00 52.13 H new ATOM 0 HB2 ALA A 462 9.878 -7.219 -11.130 1.00 52.13 H new ATOM 0 HB3 ALA A 462 10.713 -6.817 -9.611 1.00 52.13 H new ATOM 1055 N ILE A 463 13.246 -5.806 -9.491 1.00 74.01 N ATOM 1056 CA ILE A 463 14.076 -4.930 -8.605 1.00 13.44 C ATOM 1057 C ILE A 463 15.240 -4.103 -9.313 1.00 40.32 C ATOM 1058 O ILE A 463 15.486 -2.985 -8.881 1.00 11.01 O ATOM 1059 CB ILE A 463 14.588 -5.742 -7.306 1.00 42.53 C ATOM 1060 CG1 ILE A 463 13.586 -6.882 -6.974 1.00 53.53 C ATOM 1061 CG2 ILE A 463 14.758 -4.853 -6.035 1.00 32.21 C ATOM 1062 CD1 ILE A 463 13.868 -7.707 -5.733 1.00 54.23 C ATOM 0 H ILE A 463 13.003 -6.687 -9.037 1.00 74.01 H new ATOM 0 HA ILE A 463 13.394 -4.143 -8.284 1.00 13.44 H new ATOM 0 HB ILE A 463 15.572 -6.133 -7.564 1.00 42.53 H new ATOM 0 HG12 ILE A 463 12.594 -6.442 -6.870 1.00 53.53 H new ATOM 0 HG13 ILE A 463 13.547 -7.558 -7.828 1.00 53.53 H new ATOM 0 HG21 ILE A 463 15.104 -5.468 -5.204 1.00 32.21 H new ATOM 0 HG22 ILE A 463 15.488 -4.069 -6.235 1.00 32.21 H new ATOM 0 HG23 ILE A 463 13.801 -4.400 -5.777 1.00 32.21 H new ATOM 0 HD11 ILE A 463 13.095 -8.466 -5.617 1.00 54.23 H new ATOM 0 HD12 ILE A 463 14.840 -8.191 -5.831 1.00 54.23 H new ATOM 0 HD13 ILE A 463 13.873 -7.058 -4.858 1.00 54.23 H new ATOM 1074 N GLN A 464 15.953 -4.604 -10.382 1.00 32.14 N ATOM 1075 CA GLN A 464 16.890 -3.752 -11.191 1.00 74.51 C ATOM 1076 C GLN A 464 16.308 -3.054 -12.490 1.00 74.21 C ATOM 1077 O GLN A 464 16.728 -1.932 -12.764 1.00 41.24 O ATOM 1078 CB GLN A 464 18.274 -4.455 -11.449 1.00 42.24 C ATOM 1079 CG GLN A 464 19.097 -4.710 -10.175 1.00 62.41 C ATOM 1080 CD GLN A 464 18.663 -5.948 -9.401 1.00 45.54 C ATOM 1081 OE1 GLN A 464 18.210 -6.937 -9.977 1.00 52.33 O ATOM 1082 NE2 GLN A 464 18.787 -5.898 -8.087 1.00 50.14 N ATOM 0 H GLN A 464 15.896 -5.573 -10.695 1.00 32.14 H new ATOM 0 HA GLN A 464 17.055 -2.901 -10.530 1.00 74.51 H new ATOM 0 HB2 GLN A 464 18.098 -5.406 -11.951 1.00 42.24 H new ATOM 0 HB3 GLN A 464 18.861 -3.839 -12.130 1.00 42.24 H new ATOM 0 HG2 GLN A 464 20.148 -4.812 -10.447 1.00 62.41 H new ATOM 0 HG3 GLN A 464 19.020 -3.840 -9.523 1.00 62.41 H new ATOM 0 HE21 GLN A 464 19.167 -5.062 -7.642 1.00 50.14 H new ATOM 0 HE22 GLN A 464 18.503 -6.695 -7.517 1.00 50.14 H new ATOM 1091 N ALA A 465 15.366 -3.665 -13.308 1.00 11.12 N ATOM 1092 CA ALA A 465 14.684 -2.929 -14.468 1.00 32.53 C ATOM 1093 C ALA A 465 13.818 -1.696 -14.036 1.00 54.53 C ATOM 1094 O ALA A 465 13.347 -0.938 -14.887 1.00 44.43 O ATOM 1095 CB ALA A 465 13.800 -3.854 -15.366 1.00 1.34 C ATOM 0 H ALA A 465 15.066 -4.633 -13.196 1.00 11.12 H new ATOM 0 HA ALA A 465 15.535 -2.569 -15.046 1.00 32.53 H new ATOM 0 HB1 ALA A 465 13.350 -3.264 -16.165 1.00 1.34 H new ATOM 0 HB2 ALA A 465 14.419 -4.639 -15.800 1.00 1.34 H new ATOM 0 HB3 ALA A 465 13.013 -4.305 -14.761 1.00 1.34 H new ATOM 1101 N MET A 466 13.636 -1.497 -12.735 1.00 45.44 N ATOM 1102 CA MET A 466 12.645 -0.566 -12.170 1.00 14.55 C ATOM 1103 C MET A 466 13.326 0.547 -11.322 1.00 43.41 C ATOM 1104 O MET A 466 12.656 1.467 -10.843 1.00 62.20 O ATOM 1105 CB MET A 466 11.727 -1.400 -11.266 1.00 40.02 C ATOM 1106 CG MET A 466 10.221 -1.103 -11.311 1.00 61.31 C ATOM 1107 SD MET A 466 9.439 -1.580 -12.871 1.00 3.52 S ATOM 1108 CE MET A 466 9.143 0.006 -13.651 1.00 14.21 C ATOM 0 H MET A 466 14.180 -1.984 -12.023 1.00 45.44 H new ATOM 0 HA MET A 466 12.097 -0.073 -12.973 1.00 14.55 H new ATOM 0 HB2 MET A 466 11.870 -2.450 -11.520 1.00 40.02 H new ATOM 0 HB3 MET A 466 12.064 -1.273 -10.237 1.00 40.02 H new ATOM 0 HG2 MET A 466 9.730 -1.629 -10.492 1.00 61.31 H new ATOM 0 HG3 MET A 466 10.064 -0.037 -11.146 1.00 61.31 H new ATOM 0 HE1 MET A 466 9.130 -0.118 -14.734 1.00 14.21 H new ATOM 0 HE2 MET A 466 8.183 0.401 -13.319 1.00 14.21 H new ATOM 0 HE3 MET A 466 9.936 0.701 -13.375 1.00 14.21 H new ATOM 1118 N ASN A 467 14.664 0.449 -11.145 1.00 64.02 N ATOM 1119 CA ASN A 467 15.407 1.244 -10.142 1.00 21.41 C ATOM 1120 C ASN A 467 15.779 2.665 -10.659 1.00 62.04 C ATOM 1121 O ASN A 467 16.578 2.751 -11.599 1.00 63.03 O ATOM 1122 CB ASN A 467 16.689 0.450 -9.719 1.00 71.34 C ATOM 1123 CG ASN A 467 17.234 0.943 -8.384 1.00 43.42 C ATOM 1124 OD1 ASN A 467 16.476 1.383 -7.510 1.00 14.24 O ATOM 1125 ND2 ASN A 467 18.547 0.882 -8.213 1.00 44.14 N ATOM 0 H ASN A 467 15.255 -0.179 -11.690 1.00 64.02 H new ATOM 0 HA ASN A 467 14.759 1.398 -9.279 1.00 21.41 H new ATOM 0 HB2 ASN A 467 16.454 -0.612 -9.648 1.00 71.34 H new ATOM 0 HB3 ASN A 467 17.455 0.556 -10.488 1.00 71.34 H new ATOM 0 HD21 ASN A 467 18.963 1.204 -7.339 1.00 44.14 H new ATOM 0 HD22 ASN A 467 19.141 0.513 -8.955 1.00 44.14 H new ATOM 1132 N GLY A 468 15.219 3.810 -10.090 1.00 61.24 N ATOM 1133 CA GLY A 468 15.626 5.126 -10.599 1.00 31.40 C ATOM 1134 C GLY A 468 14.960 5.506 -11.927 1.00 4.33 C ATOM 1135 O GLY A 468 15.378 6.457 -12.585 1.00 43.44 O ATOM 0 H GLY A 468 14.535 3.820 -9.333 1.00 61.24 H new ATOM 0 HA2 GLY A 468 15.387 5.884 -9.853 1.00 31.40 H new ATOM 0 HA3 GLY A 468 16.708 5.137 -10.729 1.00 31.40 H new ATOM 1139 N PHE A 469 13.903 4.777 -12.279 1.00 44.02 N ATOM 1140 CA PHE A 469 13.309 4.788 -13.621 1.00 1.12 C ATOM 1141 C PHE A 469 12.260 5.925 -13.649 1.00 75.01 C ATOM 1142 O PHE A 469 11.249 5.835 -12.938 1.00 3.45 O ATOM 1143 CB PHE A 469 12.736 3.329 -13.871 1.00 52.51 C ATOM 1144 CG PHE A 469 12.043 3.033 -15.188 1.00 13.21 C ATOM 1145 CD1 PHE A 469 10.689 3.293 -15.370 1.00 21.11 C ATOM 1146 CD2 PHE A 469 12.740 2.418 -16.233 1.00 11.20 C ATOM 1147 CE1 PHE A 469 10.059 2.969 -16.544 1.00 2.23 C ATOM 1148 CE2 PHE A 469 12.100 2.102 -17.413 1.00 21.44 C ATOM 1149 CZ PHE A 469 10.762 2.375 -17.570 1.00 12.14 C ATOM 0 H PHE A 469 13.425 4.151 -11.631 1.00 44.02 H new ATOM 0 HA PHE A 469 14.006 4.999 -14.432 1.00 1.12 H new ATOM 0 HB2 PHE A 469 13.564 2.627 -13.768 1.00 52.51 H new ATOM 0 HB3 PHE A 469 12.030 3.109 -13.070 1.00 52.51 H new ATOM 0 HD1 PHE A 469 10.125 3.757 -14.574 1.00 21.11 H new ATOM 0 HD2 PHE A 469 13.789 2.189 -16.115 1.00 11.20 H new ATOM 0 HE1 PHE A 469 9.007 3.180 -16.665 1.00 2.23 H new ATOM 0 HE2 PHE A 469 12.652 1.638 -18.217 1.00 21.44 H new ATOM 0 HZ PHE A 469 10.263 2.125 -18.495 1.00 12.14 H new ATOM 1159 N GLN A 470 12.529 7.040 -14.414 1.00 22.33 N ATOM 1160 CA GLN A 470 11.613 8.198 -14.446 1.00 1.42 C ATOM 1161 C GLN A 470 10.313 7.916 -15.221 1.00 41.31 C ATOM 1162 O GLN A 470 10.346 7.403 -16.339 1.00 14.00 O ATOM 1163 CB GLN A 470 12.327 9.413 -15.079 1.00 61.33 C ATOM 1164 CG GLN A 470 13.056 10.334 -14.092 1.00 31.15 C ATOM 1165 CD GLN A 470 12.171 11.445 -13.507 1.00 23.31 C ATOM 1166 OE1 GLN A 470 10.857 11.247 -13.471 1.00 5.53 O flip ATOM 1167 NE2 GLN A 470 12.678 12.491 -13.102 1.00 23.55 N flip ATOM 0 H GLN A 470 13.359 7.143 -14.998 1.00 22.33 H new ATOM 0 HA GLN A 470 11.337 8.408 -13.413 1.00 1.42 H new ATOM 0 HB2 GLN A 470 13.048 9.049 -15.811 1.00 61.33 H new ATOM 0 HB3 GLN A 470 11.590 10.003 -15.624 1.00 61.33 H new ATOM 0 HG2 GLN A 470 13.454 9.732 -13.275 1.00 31.15 H new ATOM 0 HG3 GLN A 470 13.908 10.790 -14.597 1.00 31.15 H new ATOM 0 HE21 GLN A 470 13.690 12.616 -13.141 1.00 23.55 H new ATOM 0 HE22 GLN A 470 12.087 13.233 -12.727 1.00 23.55 H new ATOM 1176 N ILE A 471 9.170 8.276 -14.607 1.00 1.44 N ATOM 1177 CA ILE A 471 7.860 8.180 -15.246 1.00 11.41 C ATOM 1178 C ILE A 471 7.101 9.508 -14.913 1.00 72.22 C ATOM 1179 O ILE A 471 6.605 9.637 -13.781 1.00 25.31 O ATOM 1180 CB ILE A 471 7.011 6.891 -14.760 1.00 20.14 C ATOM 1181 CG1 ILE A 471 7.633 5.543 -15.278 1.00 43.05 C ATOM 1182 CG2 ILE A 471 5.522 6.997 -15.163 1.00 33.31 C ATOM 1183 CD1 ILE A 471 6.796 4.265 -15.051 1.00 23.02 C ATOM 0 H ILE A 471 9.137 8.640 -13.655 1.00 1.44 H new ATOM 0 HA ILE A 471 7.987 8.047 -16.320 1.00 11.41 H new ATOM 0 HB ILE A 471 7.063 6.881 -13.671 1.00 20.14 H new ATOM 0 HG12 ILE A 471 7.820 5.643 -16.347 1.00 43.05 H new ATOM 0 HG13 ILE A 471 8.601 5.407 -14.796 1.00 43.05 H new ATOM 0 HG21 ILE A 471 4.988 6.112 -14.818 1.00 33.31 H new ATOM 0 HG22 ILE A 471 5.084 7.885 -14.708 1.00 33.31 H new ATOM 0 HG23 ILE A 471 5.443 7.069 -16.248 1.00 33.31 H new ATOM 0 HD11 ILE A 471 7.331 3.404 -15.451 1.00 23.02 H new ATOM 0 HD12 ILE A 471 6.629 4.124 -13.983 1.00 23.02 H new ATOM 0 HD13 ILE A 471 5.836 4.364 -15.558 1.00 23.02 H new ATOM 1195 N GLY A 472 7.088 10.555 -15.813 1.00 53.03 N ATOM 1196 CA GLY A 472 6.301 11.753 -15.508 1.00 5.43 C ATOM 1197 C GLY A 472 7.034 12.668 -14.548 1.00 12.12 C ATOM 1198 O GLY A 472 8.221 12.952 -14.730 1.00 52.45 O ATOM 0 H GLY A 472 7.592 10.574 -16.700 1.00 53.03 H new ATOM 0 HA2 GLY A 472 6.083 12.291 -16.430 1.00 5.43 H new ATOM 0 HA3 GLY A 472 5.344 11.461 -15.075 1.00 5.43 H new ATOM 1202 N MET A 473 6.334 13.095 -13.505 1.00 24.11 N ATOM 1203 CA MET A 473 6.931 13.964 -12.480 1.00 72.03 C ATOM 1204 C MET A 473 7.441 13.193 -11.239 1.00 72.23 C ATOM 1205 O MET A 473 7.817 13.827 -10.248 1.00 74.21 O ATOM 1206 CB MET A 473 5.951 15.098 -12.051 1.00 62.42 C ATOM 1207 CG MET A 473 4.513 14.648 -11.766 1.00 14.21 C ATOM 1208 SD MET A 473 3.690 15.657 -10.514 1.00 42.42 S ATOM 1209 CE MET A 473 2.594 16.651 -11.529 1.00 75.02 C ATOM 0 H MET A 473 5.355 12.859 -13.340 1.00 24.11 H new ATOM 0 HA MET A 473 7.805 14.413 -12.951 1.00 72.03 H new ATOM 0 HB2 MET A 473 6.347 15.579 -11.157 1.00 62.42 H new ATOM 0 HB3 MET A 473 5.929 15.853 -12.837 1.00 62.42 H new ATOM 0 HG2 MET A 473 3.937 14.685 -12.691 1.00 14.21 H new ATOM 0 HG3 MET A 473 4.522 13.609 -11.438 1.00 14.21 H new ATOM 0 HE1 MET A 473 2.020 17.324 -10.893 1.00 75.02 H new ATOM 0 HE2 MET A 473 3.183 17.235 -12.237 1.00 75.02 H new ATOM 0 HE3 MET A 473 1.913 15.999 -12.075 1.00 75.02 H new ATOM 1219 N LYS A 474 7.502 11.845 -11.290 1.00 73.22 N ATOM 1220 CA LYS A 474 8.004 11.058 -10.108 1.00 53.00 C ATOM 1221 C LYS A 474 8.955 9.919 -10.538 1.00 31.34 C ATOM 1222 O LYS A 474 8.979 9.545 -11.710 1.00 41.25 O ATOM 1223 CB LYS A 474 6.881 10.420 -9.226 1.00 63.20 C ATOM 1224 CG LYS A 474 5.774 11.324 -8.638 1.00 41.22 C ATOM 1225 CD LYS A 474 6.260 12.396 -7.632 1.00 11.15 C ATOM 1226 CE LYS A 474 5.116 12.832 -6.694 1.00 32.43 C ATOM 1227 NZ LYS A 474 5.425 14.086 -5.965 1.00 55.33 N ATOM 0 H LYS A 474 7.226 11.283 -12.095 1.00 73.22 H new ATOM 0 HA LYS A 474 8.526 11.804 -9.510 1.00 53.00 H new ATOM 0 HB2 LYS A 474 6.392 9.651 -9.824 1.00 63.20 H new ATOM 0 HB3 LYS A 474 7.368 9.914 -8.392 1.00 63.20 H new ATOM 0 HG2 LYS A 474 5.263 11.826 -9.460 1.00 41.22 H new ATOM 0 HG3 LYS A 474 5.037 10.692 -8.143 1.00 41.22 H new ATOM 0 HD2 LYS A 474 7.087 11.999 -7.043 1.00 11.15 H new ATOM 0 HD3 LYS A 474 6.641 13.262 -8.173 1.00 11.15 H new ATOM 0 HE2 LYS A 474 4.205 12.970 -7.277 1.00 32.43 H new ATOM 0 HE3 LYS A 474 4.917 12.037 -5.975 1.00 32.43 H new ATOM 0 HZ1 LYS A 474 4.625 14.335 -5.349 1.00 55.33 H new ATOM 0 HZ2 LYS A 474 6.278 13.950 -5.386 1.00 55.33 H new ATOM 0 HZ3 LYS A 474 5.588 14.853 -6.648 1.00 55.33 H new ATOM 1241 N ARG A 475 9.720 9.349 -9.567 1.00 42.54 N ATOM 1242 CA ARG A 475 10.704 8.273 -9.847 1.00 10.02 C ATOM 1243 C ARG A 475 10.559 7.098 -8.858 1.00 12.11 C ATOM 1244 O ARG A 475 10.270 7.326 -7.678 1.00 14.24 O ATOM 1245 CB ARG A 475 12.158 8.847 -9.795 1.00 35.25 C ATOM 1246 CG ARG A 475 12.329 10.128 -8.925 1.00 63.10 C ATOM 1247 CD ARG A 475 13.773 10.347 -8.483 1.00 24.31 C ATOM 1248 NE ARG A 475 14.165 9.241 -7.605 1.00 50.13 N ATOM 1249 CZ ARG A 475 15.275 9.162 -6.876 1.00 50.20 C ATOM 1250 NH1 ARG A 475 16.197 10.115 -6.880 1.00 32.24 N ATOM 1251 NH2 ARG A 475 15.439 8.104 -6.105 1.00 65.31 N ATOM 0 H ARG A 475 9.672 9.619 -8.585 1.00 42.54 H new ATOM 0 HA ARG A 475 10.504 7.890 -10.848 1.00 10.02 H new ATOM 0 HB2 ARG A 475 12.824 8.074 -9.412 1.00 35.25 H new ATOM 0 HB3 ARG A 475 12.481 9.071 -10.812 1.00 35.25 H new ATOM 0 HG2 ARG A 475 11.990 10.996 -9.491 1.00 63.10 H new ATOM 0 HG3 ARG A 475 11.691 10.053 -8.045 1.00 63.10 H new ATOM 0 HD2 ARG A 475 14.431 10.393 -9.350 1.00 24.31 H new ATOM 0 HD3 ARG A 475 13.868 11.298 -7.959 1.00 24.31 H new ATOM 0 HE ARG A 475 13.521 8.452 -7.547 1.00 50.13 H new ATOM 0 HH11 ARG A 475 16.068 10.947 -7.457 1.00 32.24 H new ATOM 0 HH12 ARG A 475 17.035 10.017 -6.307 1.00 32.24 H new ATOM 0 HH21 ARG A 475 14.725 7.376 -6.080 1.00 65.31 H new ATOM 0 HH22 ARG A 475 16.280 8.014 -5.534 1.00 65.31 H new ATOM 1265 N LEU A 476 10.814 5.851 -9.320 1.00 0.42 N ATOM 1266 CA LEU A 476 10.593 4.658 -8.430 1.00 1.12 C ATOM 1267 C LEU A 476 11.958 4.240 -7.776 1.00 10.22 C ATOM 1268 O LEU A 476 12.817 3.746 -8.491 1.00 75.40 O ATOM 1269 CB LEU A 476 10.007 3.397 -9.230 1.00 50.22 C ATOM 1270 CG LEU A 476 8.561 3.398 -9.886 1.00 74.15 C ATOM 1271 CD1 LEU A 476 7.467 3.786 -8.909 1.00 44.33 C ATOM 1272 CD2 LEU A 476 8.487 4.279 -11.134 1.00 12.04 C ATOM 0 H LEU A 476 11.157 5.636 -10.256 1.00 0.42 H new ATOM 0 HA LEU A 476 9.863 4.949 -7.675 1.00 1.12 H new ATOM 0 HB2 LEU A 476 10.713 3.182 -10.032 1.00 50.22 H new ATOM 0 HB3 LEU A 476 10.037 2.551 -8.543 1.00 50.22 H new ATOM 0 HG LEU A 476 8.385 2.365 -10.186 1.00 74.15 H new ATOM 0 HD11 LEU A 476 6.503 3.768 -9.417 1.00 44.33 H new ATOM 0 HD12 LEU A 476 7.453 3.080 -8.079 1.00 44.33 H new ATOM 0 HD13 LEU A 476 7.658 4.789 -8.528 1.00 44.33 H new ATOM 0 HD21 LEU A 476 7.478 4.245 -11.544 1.00 12.04 H new ATOM 0 HD22 LEU A 476 8.737 5.306 -10.869 1.00 12.04 H new ATOM 0 HD23 LEU A 476 9.194 3.914 -11.879 1.00 12.04 H new ATOM 1284 N LYS A 477 12.196 4.452 -6.431 1.00 43.00 N ATOM 1285 CA LYS A 477 13.411 3.853 -5.768 1.00 31.43 C ATOM 1286 C LYS A 477 13.045 2.656 -4.851 1.00 14.24 C ATOM 1287 O LYS A 477 12.152 2.788 -4.001 1.00 33.22 O ATOM 1288 CB LYS A 477 14.166 4.926 -4.942 1.00 3.44 C ATOM 1289 CG LYS A 477 15.614 4.536 -4.577 1.00 32.13 C ATOM 1290 CD LYS A 477 16.327 5.594 -3.720 1.00 33.44 C ATOM 1291 CE LYS A 477 17.831 5.678 -4.021 1.00 23.24 C ATOM 1292 NZ LYS A 477 18.536 4.370 -3.875 1.00 1.00 N ATOM 0 H LYS A 477 11.597 5.003 -5.816 1.00 43.00 H new ATOM 0 HA LYS A 477 14.057 3.483 -6.565 1.00 31.43 H new ATOM 0 HB2 LYS A 477 14.183 5.858 -5.507 1.00 3.44 H new ATOM 0 HB3 LYS A 477 13.611 5.120 -4.024 1.00 3.44 H new ATOM 0 HG2 LYS A 477 15.604 3.588 -4.039 1.00 32.13 H new ATOM 0 HG3 LYS A 477 16.183 4.376 -5.493 1.00 32.13 H new ATOM 0 HD2 LYS A 477 15.870 6.568 -3.896 1.00 33.44 H new ATOM 0 HD3 LYS A 477 16.183 5.360 -2.665 1.00 33.44 H new ATOM 0 HE2 LYS A 477 17.971 6.047 -5.037 1.00 23.24 H new ATOM 0 HE3 LYS A 477 18.288 6.406 -3.351 1.00 23.24 H new ATOM 0 HZ1 LYS A 477 19.551 4.501 -4.058 1.00 1.00 H new ATOM 0 HZ2 LYS A 477 18.402 4.009 -2.909 1.00 1.00 H new ATOM 0 HZ3 LYS A 477 18.146 3.688 -4.556 1.00 1.00 H new ATOM 1306 N VAL A 478 13.738 1.488 -5.023 1.00 50.40 N ATOM 1307 CA VAL A 478 13.340 0.249 -4.344 1.00 30.34 C ATOM 1308 C VAL A 478 14.611 -0.544 -3.902 1.00 3.41 C ATOM 1309 O VAL A 478 15.647 -0.403 -4.569 1.00 60.52 O ATOM 1310 CB VAL A 478 12.392 -0.592 -5.281 1.00 52.03 C ATOM 1311 CG1 VAL A 478 12.780 -2.049 -5.391 1.00 71.24 C ATOM 1312 CG2 VAL A 478 10.958 -0.517 -4.825 1.00 11.21 C ATOM 0 H VAL A 478 14.560 1.396 -5.620 1.00 50.40 H new ATOM 0 HA VAL A 478 12.776 0.479 -3.440 1.00 30.34 H new ATOM 0 HB VAL A 478 12.504 -0.138 -6.266 1.00 52.03 H new ATOM 0 HG11 VAL A 478 12.082 -2.563 -6.052 1.00 71.24 H new ATOM 0 HG12 VAL A 478 13.789 -2.127 -5.797 1.00 71.24 H new ATOM 0 HG13 VAL A 478 12.750 -2.509 -4.403 1.00 71.24 H new ATOM 0 HG21 VAL A 478 10.332 -1.108 -5.494 1.00 11.21 H new ATOM 0 HG22 VAL A 478 10.878 -0.909 -3.811 1.00 11.21 H new ATOM 0 HG23 VAL A 478 10.625 0.521 -4.840 1.00 11.21 H new ATOM 1322 N GLN A 479 14.570 -1.343 -2.787 1.00 61.03 N ATOM 1323 CA GLN A 479 15.693 -2.298 -2.523 1.00 1.53 C ATOM 1324 C GLN A 479 15.272 -3.553 -1.675 1.00 3.11 C ATOM 1325 O GLN A 479 14.184 -3.554 -1.094 1.00 43.52 O ATOM 1326 CB GLN A 479 16.872 -1.587 -1.863 1.00 63.24 C ATOM 1327 CG GLN A 479 18.226 -2.203 -2.224 1.00 53.12 C ATOM 1328 CD GLN A 479 19.391 -1.305 -1.909 1.00 14.01 C ATOM 1329 OE1 GLN A 479 19.938 -1.325 -0.808 1.00 25.24 O ATOM 1330 NE2 GLN A 479 19.780 -0.503 -2.890 1.00 75.43 N ATOM 0 H GLN A 479 13.819 -1.347 -2.096 1.00 61.03 H new ATOM 0 HA GLN A 479 15.995 -2.673 -3.501 1.00 1.53 H new ATOM 0 HB2 GLN A 479 16.867 -0.538 -2.159 1.00 63.24 H new ATOM 0 HB3 GLN A 479 16.745 -1.614 -0.781 1.00 63.24 H new ATOM 0 HG2 GLN A 479 18.345 -3.143 -1.685 1.00 53.12 H new ATOM 0 HG3 GLN A 479 18.237 -2.441 -3.288 1.00 53.12 H new ATOM 0 HE21 GLN A 479 19.295 -0.522 -3.787 1.00 75.43 H new ATOM 0 HE22 GLN A 479 20.565 0.133 -2.748 1.00 75.43 H new ATOM 1339 N LEU A 480 16.143 -4.625 -1.623 1.00 2.03 N ATOM 1340 CA LEU A 480 15.882 -5.850 -0.754 1.00 64.03 C ATOM 1341 C LEU A 480 16.110 -5.363 0.700 1.00 73.12 C ATOM 1342 O LEU A 480 17.172 -4.770 0.919 1.00 11.22 O ATOM 1343 CB LEU A 480 16.878 -7.028 -1.155 1.00 32.24 C ATOM 1344 CG LEU A 480 16.785 -8.463 -0.499 1.00 73.44 C ATOM 1345 CD1 LEU A 480 16.639 -9.521 -1.594 1.00 21.10 C ATOM 1346 CD2 LEU A 480 18.073 -8.754 0.273 1.00 3.52 C ATOM 0 H LEU A 480 17.011 -4.672 -2.156 1.00 2.03 H new ATOM 0 HA LEU A 480 14.877 -6.253 -0.878 1.00 64.03 H new ATOM 0 HB2 LEU A 480 16.782 -7.168 -2.232 1.00 32.24 H new ATOM 0 HB3 LEU A 480 17.888 -6.662 -0.970 1.00 32.24 H new ATOM 0 HG LEU A 480 15.925 -8.491 0.170 1.00 73.44 H new ATOM 0 HD11 LEU A 480 16.575 -10.509 -1.139 1.00 21.10 H new ATOM 0 HD12 LEU A 480 15.733 -9.327 -2.169 1.00 21.10 H new ATOM 0 HD13 LEU A 480 17.504 -9.482 -2.256 1.00 21.10 H new ATOM 0 HD21 LEU A 480 18.010 -9.743 0.726 1.00 3.52 H new ATOM 0 HD22 LEU A 480 18.922 -8.721 -0.410 1.00 3.52 H new ATOM 0 HD23 LEU A 480 18.206 -8.005 1.054 1.00 3.52 H new ATOM 1358 N LYS A 481 15.161 -5.603 1.680 1.00 33.34 N ATOM 1359 CA LYS A 481 15.007 -4.689 2.852 1.00 4.34 C ATOM 1360 C LYS A 481 16.296 -4.517 3.634 1.00 60.22 C ATOM 1361 O LYS A 481 16.915 -5.462 4.124 1.00 40.14 O ATOM 1362 CB LYS A 481 13.743 -4.973 3.801 1.00 3.54 C ATOM 1363 CG LYS A 481 13.744 -6.080 4.975 1.00 1.10 C ATOM 1364 CD LYS A 481 14.759 -5.868 6.177 1.00 52.11 C ATOM 1365 CE LYS A 481 14.494 -6.769 7.399 1.00 32.34 C ATOM 1366 NZ LYS A 481 15.608 -6.676 8.386 1.00 71.33 N ATOM 0 H LYS A 481 14.519 -6.396 1.673 1.00 33.34 H new ATOM 0 HA LYS A 481 14.772 -3.728 2.394 1.00 4.34 H new ATOM 0 HB2 LYS A 481 13.495 -4.023 4.275 1.00 3.54 H new ATOM 0 HB3 LYS A 481 12.914 -5.226 3.141 1.00 3.54 H new ATOM 0 HG2 LYS A 481 12.737 -6.133 5.389 1.00 1.10 H new ATOM 0 HG3 LYS A 481 13.954 -7.050 4.524 1.00 1.10 H new ATOM 0 HD2 LYS A 481 15.772 -6.051 5.818 1.00 52.11 H new ATOM 0 HD3 LYS A 481 14.717 -4.826 6.493 1.00 52.11 H new ATOM 0 HE2 LYS A 481 13.558 -6.477 7.874 1.00 32.34 H new ATOM 0 HE3 LYS A 481 14.377 -7.803 7.074 1.00 32.34 H new ATOM 0 HZ1 LYS A 481 15.404 -7.292 9.199 1.00 71.33 H new ATOM 0 HZ2 LYS A 481 16.496 -6.978 7.937 1.00 71.33 H new ATOM 0 HZ3 LYS A 481 15.702 -5.693 8.712 1.00 71.33 H new ATOM 1380 N ARG A 482 16.770 -3.310 3.535 1.00 30.11 N ATOM 1381 CA ARG A 482 17.931 -2.869 4.242 1.00 14.42 C ATOM 1382 C ARG A 482 17.440 -2.023 5.441 1.00 55.10 C ATOM 1383 O ARG A 482 16.872 -0.949 5.239 1.00 20.31 O ATOM 1384 CB ARG A 482 18.854 -2.108 3.199 1.00 41.43 C ATOM 1385 CG ARG A 482 18.417 -0.679 2.694 1.00 24.32 C ATOM 1386 CD ARG A 482 17.089 -0.599 1.891 1.00 22.34 C ATOM 1387 NE ARG A 482 16.661 0.795 1.642 1.00 75.31 N ATOM 1388 CZ ARG A 482 17.103 1.580 0.641 1.00 2.43 C ATOM 1389 NH1 ARG A 482 18.009 1.154 -0.228 1.00 33.24 N ATOM 1390 NH2 ARG A 482 16.607 2.808 0.519 1.00 73.33 N ATOM 0 H ARG A 482 16.349 -2.591 2.947 1.00 30.11 H new ATOM 0 HA ARG A 482 18.542 -3.668 4.662 1.00 14.42 H new ATOM 0 HB2 ARG A 482 19.844 -2.011 3.644 1.00 41.43 H new ATOM 0 HB3 ARG A 482 18.959 -2.749 2.324 1.00 41.43 H new ATOM 0 HG2 ARG A 482 18.331 -0.023 3.561 1.00 24.32 H new ATOM 0 HG3 ARG A 482 19.217 -0.279 2.070 1.00 24.32 H new ATOM 0 HD2 ARG A 482 17.213 -1.113 0.938 1.00 22.34 H new ATOM 0 HD3 ARG A 482 16.306 -1.124 2.437 1.00 22.34 H new ATOM 0 HE ARG A 482 15.974 1.195 2.281 1.00 75.31 H new ATOM 0 HH11 ARG A 482 18.389 0.211 -0.148 1.00 33.24 H new ATOM 0 HH12 ARG A 482 18.326 1.770 -0.977 1.00 33.24 H new ATOM 0 HH21 ARG A 482 15.903 3.142 1.178 1.00 73.33 H new ATOM 0 HH22 ARG A 482 16.930 3.416 -0.233 1.00 73.33 H new ATOM 1404 N SER A 483 17.604 -2.549 6.685 1.00 25.31 N ATOM 1405 CA SER A 483 17.252 -1.840 7.936 1.00 43.44 C ATOM 1406 C SER A 483 15.793 -1.303 7.971 1.00 15.21 C ATOM 1407 O SER A 483 15.525 -0.170 7.557 1.00 44.23 O ATOM 1408 CB SER A 483 18.291 -0.714 8.214 1.00 30.10 C ATOM 1409 OG SER A 483 19.598 -1.268 8.375 1.00 12.20 O ATOM 0 H SER A 483 17.986 -3.481 6.844 1.00 25.31 H new ATOM 0 HA SER A 483 17.293 -2.575 8.739 1.00 43.44 H new ATOM 0 HB2 SER A 483 18.291 0.000 7.391 1.00 30.10 H new ATOM 0 HB3 SER A 483 18.009 -0.165 9.112 1.00 30.10 H new ATOM 0 HG SER A 483 20.240 -0.548 8.547 1.00 12.20 H new ATOM 1415 N LYS A 484 14.860 -2.139 8.480 1.00 5.31 N ATOM 1416 CA LYS A 484 13.422 -1.797 8.540 1.00 75.44 C ATOM 1417 C LYS A 484 13.195 -0.605 9.522 1.00 2.51 C ATOM 1418 O LYS A 484 13.444 -0.738 10.723 1.00 61.45 O ATOM 1419 CB LYS A 484 12.632 -3.033 9.009 1.00 53.03 C ATOM 1420 CG LYS A 484 11.496 -3.476 8.061 1.00 50.40 C ATOM 1421 CD LYS A 484 10.387 -2.428 7.908 1.00 63.12 C ATOM 1422 CE LYS A 484 9.259 -2.893 6.968 1.00 70.23 C ATOM 1423 NZ LYS A 484 8.614 -4.147 7.446 1.00 42.23 N ATOM 0 H LYS A 484 15.080 -3.061 8.857 1.00 5.31 H new ATOM 0 HA LYS A 484 13.075 -1.498 7.551 1.00 75.44 H new ATOM 0 HB2 LYS A 484 13.326 -3.864 9.134 1.00 53.03 H new ATOM 0 HB3 LYS A 484 12.206 -2.823 9.990 1.00 53.03 H new ATOM 0 HG2 LYS A 484 11.917 -3.695 7.080 1.00 50.40 H new ATOM 0 HG3 LYS A 484 11.061 -4.403 8.435 1.00 50.40 H new ATOM 0 HD2 LYS A 484 9.968 -2.202 8.888 1.00 63.12 H new ATOM 0 HD3 LYS A 484 10.817 -1.503 7.524 1.00 63.12 H new ATOM 0 HE2 LYS A 484 8.508 -2.107 6.887 1.00 70.23 H new ATOM 0 HE3 LYS A 484 9.663 -3.052 5.968 1.00 70.23 H new ATOM 0 HZ1 LYS A 484 7.749 -4.324 6.897 1.00 42.23 H new ATOM 0 HZ2 LYS A 484 9.271 -4.944 7.323 1.00 42.23 H new ATOM 0 HZ3 LYS A 484 8.371 -4.051 8.453 1.00 42.23 H new ATOM 1437 N ASN A 485 12.747 0.551 8.999 1.00 55.41 N ATOM 1438 CA ASN A 485 12.688 1.814 9.768 1.00 53.04 C ATOM 1439 C ASN A 485 11.355 2.537 9.521 1.00 31.31 C ATOM 1440 O ASN A 485 10.572 2.666 10.462 1.00 13.21 O ATOM 1441 CB ASN A 485 13.916 2.691 9.404 1.00 1.11 C ATOM 1442 CG ASN A 485 13.902 4.085 10.039 1.00 71.44 C ATOM 1443 OD1 ASN A 485 13.453 5.054 9.428 1.00 3.01 O ATOM 1444 ND2 ASN A 485 14.397 4.192 11.272 1.00 34.43 N ATOM 0 H ASN A 485 12.417 0.639 8.038 1.00 55.41 H new ATOM 0 HA ASN A 485 12.731 1.601 10.836 1.00 53.04 H new ATOM 0 HB2 ASN A 485 14.823 2.172 9.713 1.00 1.11 H new ATOM 0 HB3 ASN A 485 13.964 2.798 8.320 1.00 1.11 H new ATOM 0 HD21 ASN A 485 14.412 5.099 11.739 1.00 34.43 H new ATOM 0 HD22 ASN A 485 14.761 3.367 11.749 1.00 34.43 H new ATOM 1451 N ASP A 486 11.127 3.009 8.266 1.00 12.22 N ATOM 1452 CA ASP A 486 9.822 3.650 7.841 1.00 65.23 C ATOM 1453 C ASP A 486 9.605 5.009 8.524 1.00 53.23 C ATOM 1454 O ASP A 486 8.790 5.133 9.449 1.00 70.23 O ATOM 1455 CB ASP A 486 8.536 2.735 8.062 1.00 51.14 C ATOM 1456 CG ASP A 486 8.502 1.521 7.153 1.00 21.12 C ATOM 1457 OD1 ASP A 486 9.449 0.702 7.195 1.00 22.14 O ATOM 1458 OD2 ASP A 486 7.523 1.387 6.394 1.00 40.11 O ATOM 0 H ASP A 486 11.821 2.964 7.520 1.00 12.22 H new ATOM 0 HA ASP A 486 9.930 3.790 6.765 1.00 65.23 H new ATOM 0 HB2 ASP A 486 8.508 2.404 9.100 1.00 51.14 H new ATOM 0 HB3 ASP A 486 7.640 3.332 7.893 1.00 51.14 H new ATOM 1463 N SER A 487 10.340 6.030 8.066 1.00 75.02 N ATOM 1464 CA SER A 487 10.200 7.374 8.619 1.00 63.53 C ATOM 1465 C SER A 487 10.511 8.436 7.556 1.00 4.43 C ATOM 1466 O SER A 487 11.676 8.823 7.398 1.00 21.42 O ATOM 1467 CB SER A 487 11.135 7.556 9.841 1.00 20.40 C ATOM 1468 OG SER A 487 10.858 8.766 10.536 1.00 44.32 O ATOM 0 H SER A 487 11.031 5.948 7.320 1.00 75.02 H new ATOM 0 HA SER A 487 9.167 7.501 8.943 1.00 63.53 H new ATOM 0 HB2 SER A 487 11.017 6.711 10.519 1.00 20.40 H new ATOM 0 HB3 SER A 487 12.173 7.556 9.509 1.00 20.40 H new ATOM 0 HG SER A 487 11.464 8.849 11.302 1.00 44.32 H new ATOM 1474 N LYS A 488 9.452 8.850 6.811 1.00 24.05 N ATOM 1475 CA LYS A 488 9.485 9.958 5.811 1.00 12.21 C ATOM 1476 C LYS A 488 10.331 9.637 4.543 1.00 3.30 C ATOM 1477 O LYS A 488 11.235 8.802 4.582 1.00 1.24 O ATOM 1478 CB LYS A 488 9.915 11.292 6.476 1.00 22.14 C ATOM 1479 CG LYS A 488 8.853 11.840 7.430 1.00 32.52 C ATOM 1480 CD LYS A 488 9.294 13.105 8.161 1.00 43.41 C ATOM 1481 CE LYS A 488 9.440 14.311 7.233 1.00 52.02 C ATOM 1482 NZ LYS A 488 9.711 15.555 7.996 1.00 12.21 N ATOM 0 H LYS A 488 8.532 8.416 6.888 1.00 24.05 H new ATOM 0 HA LYS A 488 8.464 10.071 5.447 1.00 12.21 H new ATOM 0 HB2 LYS A 488 10.845 11.138 7.023 1.00 22.14 H new ATOM 0 HB3 LYS A 488 10.119 12.031 5.701 1.00 22.14 H new ATOM 0 HG2 LYS A 488 7.944 12.052 6.867 1.00 32.52 H new ATOM 0 HG3 LYS A 488 8.603 11.073 8.163 1.00 32.52 H new ATOM 0 HD2 LYS A 488 8.569 13.339 8.940 1.00 43.41 H new ATOM 0 HD3 LYS A 488 10.246 12.918 8.657 1.00 43.41 H new ATOM 0 HE2 LYS A 488 10.251 14.132 6.527 1.00 52.02 H new ATOM 0 HE3 LYS A 488 8.529 14.433 6.647 1.00 52.02 H new ATOM 0 HZ1 LYS A 488 9.804 16.353 7.336 1.00 12.21 H new ATOM 0 HZ2 LYS A 488 8.925 15.738 8.652 1.00 12.21 H new ATOM 0 HZ3 LYS A 488 10.594 15.446 8.535 1.00 12.21 H new ATOM 1496 N PRO A 489 9.998 10.255 3.371 1.00 22.03 N ATOM 1497 CA PRO A 489 10.754 10.057 2.108 1.00 33.25 C ATOM 1498 C PRO A 489 12.237 10.473 2.160 1.00 51.33 C ATOM 1499 O PRO A 489 12.620 11.416 2.868 1.00 52.15 O ATOM 1500 CB PRO A 489 10.020 10.940 1.088 1.00 3.34 C ATOM 1501 CG PRO A 489 9.154 11.854 1.882 1.00 65.03 C ATOM 1502 CD PRO A 489 8.823 11.124 3.148 1.00 62.41 C ATOM 0 HA PRO A 489 10.781 8.994 1.869 1.00 33.25 H new ATOM 0 HB2 PRO A 489 10.727 11.504 0.480 1.00 3.34 H new ATOM 0 HB3 PRO A 489 9.425 10.334 0.405 1.00 3.34 H new ATOM 0 HG2 PRO A 489 9.670 12.790 2.096 1.00 65.03 H new ATOM 0 HG3 PRO A 489 8.248 12.108 1.331 1.00 65.03 H new ATOM 0 HD2 PRO A 489 8.671 11.813 3.979 1.00 62.41 H new ATOM 0 HD3 PRO A 489 7.908 10.541 3.046 1.00 62.41 H new ATOM 1510 N TYR A 490 13.043 9.745 1.391 1.00 53.10 N ATOM 1511 CA TYR A 490 14.463 10.040 1.216 1.00 71.11 C ATOM 1512 C TYR A 490 14.877 9.587 -0.187 1.00 64.03 C ATOM 1513 O TYR A 490 14.964 8.364 -0.415 1.00 53.13 O ATOM 1514 CB TYR A 490 15.323 9.360 2.314 1.00 25.43 C ATOM 1515 CG TYR A 490 16.821 9.565 2.156 1.00 11.13 C ATOM 1516 CD1 TYR A 490 17.396 10.814 2.366 1.00 34.31 C ATOM 1517 CD2 TYR A 490 17.650 8.516 1.775 1.00 14.24 C ATOM 1518 CE1 TYR A 490 18.756 11.011 2.203 1.00 11.22 C ATOM 1519 CE2 TYR A 490 19.008 8.704 1.607 1.00 72.11 C ATOM 1520 CZ TYR A 490 19.557 9.954 1.821 1.00 34.12 C ATOM 1521 OH TYR A 490 20.912 10.144 1.651 1.00 0.24 O ATOM 1522 OXT TYR A 490 15.072 10.449 -1.058 1.00 36.86 O ATOM 0 H TYR A 490 12.727 8.928 0.868 1.00 53.10 H new ATOM 0 HA TYR A 490 14.632 11.112 1.318 1.00 71.11 H new ATOM 0 HB2 TYR A 490 15.017 9.743 3.287 1.00 25.43 H new ATOM 0 HB3 TYR A 490 15.113 8.290 2.312 1.00 25.43 H new ATOM 0 HD1 TYR A 490 16.771 11.644 2.661 1.00 34.31 H new ATOM 0 HD2 TYR A 490 17.225 7.537 1.608 1.00 14.24 H new ATOM 0 HE1 TYR A 490 19.188 11.986 2.374 1.00 11.22 H new ATOM 0 HE2 TYR A 490 19.638 7.878 1.310 1.00 72.11 H new ATOM 0 HH TYR A 490 21.330 9.299 1.382 1.00 0.24 H new TER 1532 TYR A 490