USER MOD reduce.3.24.130724 H: found=0, std=0, add=798, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 795 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 59 ASN : amide:sc= -3.4 K(o=-3.4,f=-8.2!) USER MOD Set 1.2: A 60 CYS SG : rot 180:sc=-0.00839 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -130:sc= -0.149 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN : amide:sc= -0.1 X(o=-0.1,f=-0.49) USER MOD Single : A 17 ASN : amide:sc= -1.75 X(o=-1.8,f=-1.4!) USER MOD Single : A 18 THR OG1 : rot 99:sc= -0.384 USER MOD Single : A 20 TYR OH : rot 180:sc= -1.42 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 180:sc= -0.14 USER MOD Single : A 35 SER OG : rot 180:sc= 0.0623 USER MOD Single : A 36 LYS NZ :NH3+ 137:sc= 0.493 (180deg=-0.98!) USER MOD Single : A 39 MET CE :methyl -166:sc=-0.00501 (180deg=-0.262) USER MOD Single : A 40 HIS : no HD1:sc= -7.06! C(o=-7.1!,f=-6.2!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 180:sc= -0.139 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 LYS NZ :NH3+ 169:sc= -0.282 (180deg=-0.529) USER MOD Single : A 87 THR OG1 : rot 46:sc= -0.288 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 10.760 11.785 -14.714 1.00 0.00 N ATOM 2 CA GLY A 1 9.850 11.545 -13.606 1.00 0.00 C ATOM 3 C GLY A 1 9.868 12.714 -12.619 1.00 0.00 C ATOM 4 O GLY A 1 10.663 12.727 -11.681 1.00 0.00 O ATOM 0 H1 GLY A 1 10.730 10.978 -15.369 1.00 0.00 H new ATOM 0 H2 GLY A 1 10.475 12.650 -15.216 1.00 0.00 H new ATOM 0 H3 GLY A 1 11.728 11.899 -14.350 1.00 0.00 H new ATOM 0 HA2 GLY A 1 8.839 11.401 -13.986 1.00 0.00 H new ATOM 0 HA3 GLY A 1 10.131 10.626 -13.092 1.00 0.00 H new ATOM 8 N SER A 2 8.982 13.668 -12.865 1.00 0.00 N ATOM 9 CA SER A 2 8.886 14.839 -12.009 1.00 0.00 C ATOM 10 C SER A 2 7.566 15.568 -12.267 1.00 0.00 C ATOM 11 O SER A 2 6.775 15.770 -11.348 1.00 0.00 O ATOM 12 CB SER A 2 10.068 15.784 -12.234 1.00 0.00 C ATOM 13 OG SER A 2 10.866 15.929 -11.063 1.00 0.00 O ATOM 0 H SER A 2 8.324 13.654 -13.644 1.00 0.00 H new ATOM 0 HA SER A 2 8.914 14.508 -10.971 1.00 0.00 H new ATOM 0 HB2 SER A 2 10.685 15.405 -13.049 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.697 16.761 -12.543 1.00 0.00 H new ATOM 0 HG SER A 2 11.611 16.538 -11.248 1.00 0.00 H new ATOM 19 N SER A 3 7.371 15.945 -13.522 1.00 0.00 N ATOM 20 CA SER A 3 6.160 16.648 -13.913 1.00 0.00 C ATOM 21 C SER A 3 5.704 16.176 -15.295 1.00 0.00 C ATOM 22 O SER A 3 6.527 15.821 -16.137 1.00 0.00 O ATOM 23 CB SER A 3 6.379 18.162 -13.914 1.00 0.00 C ATOM 24 OG SER A 3 7.556 18.530 -14.629 1.00 0.00 O ATOM 0 H SER A 3 8.031 15.777 -14.281 1.00 0.00 H new ATOM 0 HA SER A 3 5.382 16.421 -13.184 1.00 0.00 H new ATOM 0 HB2 SER A 3 5.515 18.653 -14.361 1.00 0.00 H new ATOM 0 HB3 SER A 3 6.452 18.519 -12.887 1.00 0.00 H new ATOM 0 HG SER A 3 7.660 19.504 -14.608 1.00 0.00 H new ATOM 30 N GLY A 4 4.393 16.187 -15.485 1.00 0.00 N ATOM 31 CA GLY A 4 3.817 15.765 -16.751 1.00 0.00 C ATOM 32 C GLY A 4 3.425 14.287 -16.709 1.00 0.00 C ATOM 33 O GLY A 4 2.319 13.945 -16.295 1.00 0.00 O ATOM 0 H GLY A 4 3.713 16.481 -14.784 1.00 0.00 H new ATOM 0 HA2 GLY A 4 2.940 16.371 -16.976 1.00 0.00 H new ATOM 0 HA3 GLY A 4 4.534 15.932 -17.555 1.00 0.00 H new ATOM 37 N SER A 5 4.355 13.449 -17.143 1.00 0.00 N ATOM 38 CA SER A 5 4.122 12.015 -17.161 1.00 0.00 C ATOM 39 C SER A 5 4.199 11.455 -15.739 1.00 0.00 C ATOM 40 O SER A 5 5.121 11.775 -14.991 1.00 0.00 O ATOM 41 CB SER A 5 5.129 11.303 -18.067 1.00 0.00 C ATOM 42 OG SER A 5 4.489 10.433 -18.996 1.00 0.00 O ATOM 0 H SER A 5 5.272 13.736 -17.485 1.00 0.00 H new ATOM 0 HA SER A 5 3.125 11.836 -17.562 1.00 0.00 H new ATOM 0 HB2 SER A 5 5.716 12.044 -18.609 1.00 0.00 H new ATOM 0 HB3 SER A 5 5.826 10.730 -17.455 1.00 0.00 H new ATOM 0 HG SER A 5 5.165 9.999 -19.557 1.00 0.00 H new ATOM 48 N SER A 6 3.218 10.628 -15.409 1.00 0.00 N ATOM 49 CA SER A 6 3.163 10.020 -14.090 1.00 0.00 C ATOM 50 C SER A 6 4.199 8.898 -13.987 1.00 0.00 C ATOM 51 O SER A 6 3.848 7.720 -14.026 1.00 0.00 O ATOM 52 CB SER A 6 1.763 9.479 -13.791 1.00 0.00 C ATOM 53 OG SER A 6 1.718 8.769 -12.556 1.00 0.00 O ATOM 0 H SER A 6 2.455 10.365 -16.032 1.00 0.00 H new ATOM 0 HA SER A 6 3.393 10.787 -13.350 1.00 0.00 H new ATOM 0 HB2 SER A 6 1.054 10.306 -13.760 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.449 8.820 -14.600 1.00 0.00 H new ATOM 0 HG SER A 6 1.288 7.899 -12.694 1.00 0.00 H new ATOM 59 N GLY A 7 5.453 9.305 -13.859 1.00 0.00 N ATOM 60 CA GLY A 7 6.542 8.349 -13.750 1.00 0.00 C ATOM 61 C GLY A 7 6.489 7.607 -12.413 1.00 0.00 C ATOM 62 O GLY A 7 7.268 6.684 -12.179 1.00 0.00 O ATOM 0 H GLY A 7 5.739 10.283 -13.828 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.485 7.633 -14.570 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.496 8.867 -13.845 1.00 0.00 H new ATOM 66 N LEU A 8 5.561 8.037 -11.570 1.00 0.00 N ATOM 67 CA LEU A 8 5.395 7.424 -10.263 1.00 0.00 C ATOM 68 C LEU A 8 5.109 5.931 -10.437 1.00 0.00 C ATOM 69 O LEU A 8 5.720 5.097 -9.770 1.00 0.00 O ATOM 70 CB LEU A 8 4.328 8.165 -9.456 1.00 0.00 C ATOM 71 CG LEU A 8 4.462 9.689 -9.405 1.00 0.00 C ATOM 72 CD1 LEU A 8 3.256 10.322 -8.709 1.00 0.00 C ATOM 73 CD2 LEU A 8 5.783 10.101 -8.754 1.00 0.00 C ATOM 0 H LEU A 8 4.916 8.803 -11.767 1.00 0.00 H new ATOM 0 HA LEU A 8 6.314 7.507 -9.684 1.00 0.00 H new ATOM 0 HB2 LEU A 8 3.351 7.920 -9.872 1.00 0.00 H new ATOM 0 HB3 LEU A 8 4.344 7.784 -8.435 1.00 0.00 H new ATOM 0 HG LEU A 8 4.477 10.066 -10.428 1.00 0.00 H new ATOM 0 HD11 LEU A 8 3.376 11.405 -8.686 1.00 0.00 H new ATOM 0 HD12 LEU A 8 2.347 10.069 -9.255 1.00 0.00 H new ATOM 0 HD13 LEU A 8 3.184 9.943 -7.689 1.00 0.00 H new ATOM 0 HD21 LEU A 8 5.853 11.188 -8.730 1.00 0.00 H new ATOM 0 HD22 LEU A 8 5.824 9.712 -7.736 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.615 9.696 -9.331 1.00 0.00 H new ATOM 85 N ARG A 9 4.181 5.640 -11.336 1.00 0.00 N ATOM 86 CA ARG A 9 3.807 4.262 -11.605 1.00 0.00 C ATOM 87 C ARG A 9 5.036 3.354 -11.535 1.00 0.00 C ATOM 88 O ARG A 9 5.074 2.414 -10.742 1.00 0.00 O ATOM 89 CB ARG A 9 3.160 4.127 -12.985 1.00 0.00 C ATOM 90 CG ARG A 9 1.913 5.007 -13.095 1.00 0.00 C ATOM 91 CD ARG A 9 0.967 4.485 -14.179 1.00 0.00 C ATOM 92 NE ARG A 9 1.265 5.142 -15.471 1.00 0.00 N ATOM 93 CZ ARG A 9 2.228 4.743 -16.312 1.00 0.00 C ATOM 94 NH1 ARG A 9 2.993 3.687 -16.003 1.00 0.00 N ATOM 95 NH2 ARG A 9 2.428 5.401 -17.463 1.00 0.00 N ATOM 0 H ARG A 9 3.677 6.334 -11.887 1.00 0.00 H new ATOM 0 HA ARG A 9 3.085 3.960 -10.846 1.00 0.00 H new ATOM 0 HB2 ARG A 9 3.877 4.409 -13.756 1.00 0.00 H new ATOM 0 HB3 ARG A 9 2.892 3.086 -13.164 1.00 0.00 H new ATOM 0 HG2 ARG A 9 1.395 5.031 -12.136 1.00 0.00 H new ATOM 0 HG3 ARG A 9 2.206 6.031 -13.325 1.00 0.00 H new ATOM 0 HD2 ARG A 9 1.075 3.405 -14.278 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -0.067 4.677 -13.894 1.00 0.00 H new ATOM 0 HE ARG A 9 0.702 5.949 -15.738 1.00 0.00 H new ATOM 0 HH11 ARG A 9 2.842 3.187 -15.127 1.00 0.00 H new ATOM 0 HH12 ARG A 9 3.726 3.383 -16.644 1.00 0.00 H new ATOM 0 HH21 ARG A 9 1.847 6.206 -17.698 1.00 0.00 H new ATOM 0 HH22 ARG A 9 3.161 5.097 -18.103 1.00 0.00 H new ATOM 109 N LYS A 10 6.012 3.668 -12.374 1.00 0.00 N ATOM 110 CA LYS A 10 7.240 2.892 -12.417 1.00 0.00 C ATOM 111 C LYS A 10 7.849 2.831 -11.015 1.00 0.00 C ATOM 112 O LYS A 10 8.240 1.761 -10.550 1.00 0.00 O ATOM 113 CB LYS A 10 8.191 3.453 -13.476 1.00 0.00 C ATOM 114 CG LYS A 10 7.601 3.300 -14.879 1.00 0.00 C ATOM 115 CD LYS A 10 7.583 1.832 -15.310 1.00 0.00 C ATOM 116 CE LYS A 10 8.282 1.647 -16.658 1.00 0.00 C ATOM 117 NZ LYS A 10 7.745 0.461 -17.362 1.00 0.00 N ATOM 0 H LYS A 10 5.978 4.449 -13.029 1.00 0.00 H new ATOM 0 HA LYS A 10 7.032 1.866 -12.720 1.00 0.00 H new ATOM 0 HB2 LYS A 10 8.387 4.506 -13.273 1.00 0.00 H new ATOM 0 HB3 LYS A 10 9.148 2.934 -13.422 1.00 0.00 H new ATOM 0 HG2 LYS A 10 6.587 3.700 -14.897 1.00 0.00 H new ATOM 0 HG3 LYS A 10 8.187 3.884 -15.589 1.00 0.00 H new ATOM 0 HD2 LYS A 10 8.076 1.221 -14.554 1.00 0.00 H new ATOM 0 HD3 LYS A 10 6.553 1.482 -15.380 1.00 0.00 H new ATOM 0 HE2 LYS A 10 8.141 2.536 -17.272 1.00 0.00 H new ATOM 0 HE3 LYS A 10 9.355 1.532 -16.505 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 8.230 0.350 -18.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 7.901 -0.388 -16.781 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 6.725 0.586 -17.525 1.00 0.00 H new ATOM 131 N GLN A 11 7.910 3.992 -10.379 1.00 0.00 N ATOM 132 CA GLN A 11 8.464 4.084 -9.039 1.00 0.00 C ATOM 133 C GLN A 11 7.674 3.195 -8.076 1.00 0.00 C ATOM 134 O GLN A 11 8.255 2.382 -7.359 1.00 0.00 O ATOM 135 CB GLN A 11 8.486 5.534 -8.553 1.00 0.00 C ATOM 136 CG GLN A 11 9.004 6.471 -9.647 1.00 0.00 C ATOM 137 CD GLN A 11 9.895 7.565 -9.055 1.00 0.00 C ATOM 138 OE1 GLN A 11 10.767 7.318 -8.239 1.00 0.00 O ATOM 139 NE2 GLN A 11 9.627 8.786 -9.511 1.00 0.00 N ATOM 0 H GLN A 11 7.585 4.877 -10.767 1.00 0.00 H new ATOM 0 HA GLN A 11 9.494 3.730 -9.068 1.00 0.00 H new ATOM 0 HB2 GLN A 11 7.482 5.837 -8.255 1.00 0.00 H new ATOM 0 HB3 GLN A 11 9.119 5.616 -7.669 1.00 0.00 H new ATOM 0 HG2 GLN A 11 9.566 5.899 -10.385 1.00 0.00 H new ATOM 0 HG3 GLN A 11 8.163 6.926 -10.170 1.00 0.00 H new ATOM 0 HE21 GLN A 11 8.882 8.923 -10.195 1.00 0.00 H new ATOM 0 HE22 GLN A 11 10.166 9.585 -9.177 1.00 0.00 H new ATOM 148 N VAL A 12 6.362 3.380 -8.091 1.00 0.00 N ATOM 149 CA VAL A 12 5.487 2.605 -7.228 1.00 0.00 C ATOM 150 C VAL A 12 5.790 1.116 -7.407 1.00 0.00 C ATOM 151 O VAL A 12 6.093 0.420 -6.439 1.00 0.00 O ATOM 152 CB VAL A 12 4.026 2.957 -7.514 1.00 0.00 C ATOM 153 CG1 VAL A 12 3.080 2.078 -6.692 1.00 0.00 C ATOM 154 CG2 VAL A 12 3.758 4.441 -7.255 1.00 0.00 C ATOM 0 H VAL A 12 5.884 4.055 -8.687 1.00 0.00 H new ATOM 0 HA VAL A 12 5.667 2.849 -6.181 1.00 0.00 H new ATOM 0 HB VAL A 12 3.835 2.761 -8.569 1.00 0.00 H new ATOM 0 HG11 VAL A 12 2.048 2.348 -6.914 1.00 0.00 H new ATOM 0 HG12 VAL A 12 3.244 1.031 -6.946 1.00 0.00 H new ATOM 0 HG13 VAL A 12 3.274 2.228 -5.630 1.00 0.00 H new ATOM 0 HG21 VAL A 12 2.712 4.664 -7.466 1.00 0.00 H new ATOM 0 HG22 VAL A 12 3.975 4.673 -6.212 1.00 0.00 H new ATOM 0 HG23 VAL A 12 4.395 5.044 -7.902 1.00 0.00 H new ATOM 164 N GLU A 13 5.697 0.671 -8.651 1.00 0.00 N ATOM 165 CA GLU A 13 5.957 -0.722 -8.969 1.00 0.00 C ATOM 166 C GLU A 13 7.188 -1.220 -8.208 1.00 0.00 C ATOM 167 O GLU A 13 7.135 -2.253 -7.542 1.00 0.00 O ATOM 168 CB GLU A 13 6.128 -0.918 -10.477 1.00 0.00 C ATOM 169 CG GLU A 13 4.855 -0.526 -11.229 1.00 0.00 C ATOM 170 CD GLU A 13 4.493 -1.578 -12.280 1.00 0.00 C ATOM 171 OE1 GLU A 13 5.208 -1.625 -13.305 1.00 0.00 O ATOM 172 OE2 GLU A 13 3.511 -2.310 -12.035 1.00 0.00 O ATOM 0 H GLU A 13 5.445 1.251 -9.451 1.00 0.00 H new ATOM 0 HA GLU A 13 5.096 -1.312 -8.655 1.00 0.00 H new ATOM 0 HB2 GLU A 13 6.965 -0.317 -10.833 1.00 0.00 H new ATOM 0 HB3 GLU A 13 6.372 -1.959 -10.687 1.00 0.00 H new ATOM 0 HG2 GLU A 13 4.032 -0.413 -10.524 1.00 0.00 H new ATOM 0 HG3 GLU A 13 4.996 0.441 -11.711 1.00 0.00 H new ATOM 179 N LEU A 14 8.267 -0.461 -8.333 1.00 0.00 N ATOM 180 CA LEU A 14 9.509 -0.812 -7.665 1.00 0.00 C ATOM 181 C LEU A 14 9.261 -0.918 -6.159 1.00 0.00 C ATOM 182 O LEU A 14 9.724 -1.858 -5.515 1.00 0.00 O ATOM 183 CB LEU A 14 10.616 0.177 -8.038 1.00 0.00 C ATOM 184 CG LEU A 14 12.006 -0.130 -7.479 1.00 0.00 C ATOM 185 CD1 LEU A 14 12.476 -1.521 -7.911 1.00 0.00 C ATOM 186 CD2 LEU A 14 13.007 0.960 -7.868 1.00 0.00 C ATOM 0 H LEU A 14 8.307 0.395 -8.886 1.00 0.00 H new ATOM 0 HA LEU A 14 9.859 -1.788 -8.000 1.00 0.00 H new ATOM 0 HB2 LEU A 14 10.685 0.221 -9.125 1.00 0.00 H new ATOM 0 HB3 LEU A 14 10.320 1.169 -7.697 1.00 0.00 H new ATOM 0 HG LEU A 14 11.943 -0.135 -6.391 1.00 0.00 H new ATOM 0 HD11 LEU A 14 13.467 -1.714 -7.500 1.00 0.00 H new ATOM 0 HD12 LEU A 14 11.777 -2.272 -7.542 1.00 0.00 H new ATOM 0 HD13 LEU A 14 12.519 -1.569 -8.999 1.00 0.00 H new ATOM 0 HD21 LEU A 14 13.987 0.717 -7.458 1.00 0.00 H new ATOM 0 HD22 LEU A 14 13.073 1.022 -8.954 1.00 0.00 H new ATOM 0 HD23 LEU A 14 12.674 1.918 -7.469 1.00 0.00 H new ATOM 198 N LEU A 15 8.532 0.059 -5.641 1.00 0.00 N ATOM 199 CA LEU A 15 8.217 0.088 -4.223 1.00 0.00 C ATOM 200 C LEU A 15 7.483 -1.200 -3.842 1.00 0.00 C ATOM 201 O LEU A 15 7.992 -2.001 -3.061 1.00 0.00 O ATOM 202 CB LEU A 15 7.447 1.362 -3.870 1.00 0.00 C ATOM 203 CG LEU A 15 6.828 1.406 -2.472 1.00 0.00 C ATOM 204 CD1 LEU A 15 7.904 1.282 -1.392 1.00 0.00 C ATOM 205 CD2 LEU A 15 5.975 2.663 -2.290 1.00 0.00 C ATOM 0 H LEU A 15 8.150 0.837 -6.178 1.00 0.00 H new ATOM 0 HA LEU A 15 9.131 0.122 -3.631 1.00 0.00 H new ATOM 0 HB2 LEU A 15 8.122 2.211 -3.974 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.651 1.496 -4.602 1.00 0.00 H new ATOM 0 HG LEU A 15 6.164 0.548 -2.365 1.00 0.00 H new ATOM 0 HD11 LEU A 15 7.437 1.316 -0.408 1.00 0.00 H new ATOM 0 HD12 LEU A 15 8.431 0.336 -1.511 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.611 2.106 -1.487 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.546 2.670 -1.288 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.597 3.548 -2.425 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.173 2.668 -3.028 1.00 0.00 H new ATOM 217 N PHE A 16 6.297 -1.358 -4.413 1.00 0.00 N ATOM 218 CA PHE A 16 5.488 -2.534 -4.143 1.00 0.00 C ATOM 219 C PHE A 16 6.279 -3.816 -4.407 1.00 0.00 C ATOM 220 O PHE A 16 6.330 -4.705 -3.558 1.00 0.00 O ATOM 221 CB PHE A 16 4.291 -2.481 -5.095 1.00 0.00 C ATOM 222 CG PHE A 16 3.245 -1.429 -4.722 1.00 0.00 C ATOM 223 CD1 PHE A 16 3.481 -0.569 -3.696 1.00 0.00 C ATOM 224 CD2 PHE A 16 2.078 -1.354 -5.418 1.00 0.00 C ATOM 225 CE1 PHE A 16 2.510 0.407 -3.350 1.00 0.00 C ATOM 226 CE2 PHE A 16 1.107 -0.378 -5.072 1.00 0.00 C ATOM 227 CZ PHE A 16 1.343 0.482 -4.045 1.00 0.00 C ATOM 0 H PHE A 16 5.878 -0.691 -5.061 1.00 0.00 H new ATOM 0 HA PHE A 16 5.177 -2.540 -3.098 1.00 0.00 H new ATOM 0 HB2 PHE A 16 4.651 -2.279 -6.104 1.00 0.00 H new ATOM 0 HB3 PHE A 16 3.814 -3.461 -5.117 1.00 0.00 H new ATOM 0 HD1 PHE A 16 4.407 -0.628 -3.144 1.00 0.00 H new ATOM 0 HD2 PHE A 16 1.891 -2.037 -6.233 1.00 0.00 H new ATOM 0 HE1 PHE A 16 2.698 1.090 -2.535 1.00 0.00 H new ATOM 0 HE2 PHE A 16 0.181 -0.318 -5.624 1.00 0.00 H new ATOM 0 HZ PHE A 16 0.604 1.224 -3.781 1.00 0.00 H new ATOM 237 N ASN A 17 6.876 -3.872 -5.588 1.00 0.00 N ATOM 238 CA ASN A 17 7.663 -5.031 -5.975 1.00 0.00 C ATOM 239 C ASN A 17 8.777 -5.252 -4.950 1.00 0.00 C ATOM 240 O ASN A 17 8.958 -6.363 -4.454 1.00 0.00 O ATOM 241 CB ASN A 17 8.314 -4.823 -7.343 1.00 0.00 C ATOM 242 CG ASN A 17 7.292 -4.993 -8.469 1.00 0.00 C ATOM 243 OD1 ASN A 17 6.250 -4.359 -8.497 1.00 0.00 O ATOM 244 ND2 ASN A 17 7.647 -5.881 -9.393 1.00 0.00 N ATOM 0 H ASN A 17 6.831 -3.133 -6.290 1.00 0.00 H new ATOM 0 HA ASN A 17 6.995 -5.891 -6.020 1.00 0.00 H new ATOM 0 HB2 ASN A 17 8.753 -3.826 -7.393 1.00 0.00 H new ATOM 0 HB3 ASN A 17 9.127 -5.536 -7.475 1.00 0.00 H new ATOM 0 HD21 ASN A 17 7.032 -6.066 -10.186 1.00 0.00 H new ATOM 0 HD22 ASN A 17 8.534 -6.377 -9.309 1.00 0.00 H new ATOM 251 N THR A 18 9.494 -4.175 -4.661 1.00 0.00 N ATOM 252 CA THR A 18 10.585 -4.237 -3.704 1.00 0.00 C ATOM 253 C THR A 18 10.076 -4.726 -2.346 1.00 0.00 C ATOM 254 O THR A 18 10.648 -5.642 -1.758 1.00 0.00 O ATOM 255 CB THR A 18 11.241 -2.857 -3.646 1.00 0.00 C ATOM 256 OG1 THR A 18 11.877 -2.721 -4.914 1.00 0.00 O ATOM 257 CG2 THR A 18 12.395 -2.799 -2.643 1.00 0.00 C ATOM 0 H THR A 18 9.340 -3.255 -5.073 1.00 0.00 H new ATOM 0 HA THR A 18 11.341 -4.959 -4.012 1.00 0.00 H new ATOM 0 HB THR A 18 10.492 -2.110 -3.382 1.00 0.00 H new ATOM 0 HG1 THR A 18 11.310 -2.186 -5.509 1.00 0.00 H new ATOM 0 HG21 THR A 18 12.826 -1.798 -2.641 1.00 0.00 H new ATOM 0 HG22 THR A 18 12.023 -3.036 -1.646 1.00 0.00 H new ATOM 0 HG23 THR A 18 13.160 -3.522 -2.926 1.00 0.00 H new ATOM 265 N ARG A 19 9.006 -4.092 -1.888 1.00 0.00 N ATOM 266 CA ARG A 19 8.414 -4.451 -0.611 1.00 0.00 C ATOM 267 C ARG A 19 8.075 -5.942 -0.583 1.00 0.00 C ATOM 268 O ARG A 19 8.367 -6.631 0.394 1.00 0.00 O ATOM 269 CB ARG A 19 7.143 -3.641 -0.346 1.00 0.00 C ATOM 270 CG ARG A 19 7.471 -2.164 -0.119 1.00 0.00 C ATOM 271 CD ARG A 19 8.070 -1.944 1.272 1.00 0.00 C ATOM 272 NE ARG A 19 8.829 -0.674 1.300 1.00 0.00 N ATOM 273 CZ ARG A 19 10.094 -0.544 0.876 1.00 0.00 C ATOM 274 NH1 ARG A 19 10.748 -1.606 0.387 1.00 0.00 N ATOM 275 NH2 ARG A 19 10.703 0.648 0.939 1.00 0.00 N ATOM 0 H ARG A 19 8.534 -3.332 -2.379 1.00 0.00 H new ATOM 0 HA ARG A 19 9.144 -4.226 0.167 1.00 0.00 H new ATOM 0 HB2 ARG A 19 6.462 -3.740 -1.191 1.00 0.00 H new ATOM 0 HB3 ARG A 19 6.628 -4.041 0.527 1.00 0.00 H new ATOM 0 HG2 ARG A 19 8.173 -1.822 -0.880 1.00 0.00 H new ATOM 0 HG3 ARG A 19 6.566 -1.566 -0.228 1.00 0.00 H new ATOM 0 HD2 ARG A 19 7.277 -1.920 2.019 1.00 0.00 H new ATOM 0 HD3 ARG A 19 8.726 -2.775 1.530 1.00 0.00 H new ATOM 0 HE ARG A 19 8.360 0.155 1.665 1.00 0.00 H new ATOM 0 HH11 ARG A 19 10.283 -2.513 0.337 1.00 0.00 H new ATOM 0 HH12 ARG A 19 11.711 -1.508 0.064 1.00 0.00 H new ATOM 0 HH21 ARG A 19 10.204 1.457 1.310 1.00 0.00 H new ATOM 0 HH22 ARG A 19 11.666 0.747 0.616 1.00 0.00 H new ATOM 289 N TYR A 20 7.464 -6.398 -1.667 1.00 0.00 N ATOM 290 CA TYR A 20 7.082 -7.796 -1.779 1.00 0.00 C ATOM 291 C TYR A 20 8.274 -8.714 -1.499 1.00 0.00 C ATOM 292 O TYR A 20 8.147 -9.696 -0.770 1.00 0.00 O ATOM 293 CB TYR A 20 6.629 -7.994 -3.227 1.00 0.00 C ATOM 294 CG TYR A 20 5.954 -9.342 -3.488 1.00 0.00 C ATOM 295 CD1 TYR A 20 4.853 -9.717 -2.745 1.00 0.00 C ATOM 296 CD2 TYR A 20 6.445 -10.182 -4.467 1.00 0.00 C ATOM 297 CE1 TYR A 20 4.217 -10.986 -2.992 1.00 0.00 C ATOM 298 CE2 TYR A 20 5.809 -11.450 -4.713 1.00 0.00 C ATOM 299 CZ TYR A 20 4.726 -11.790 -3.963 1.00 0.00 C ATOM 300 OH TYR A 20 4.126 -12.987 -4.195 1.00 0.00 O ATOM 0 H TYR A 20 7.224 -5.824 -2.475 1.00 0.00 H new ATOM 0 HA TYR A 20 6.300 -8.040 -1.059 1.00 0.00 H new ATOM 0 HB2 TYR A 20 5.937 -7.195 -3.493 1.00 0.00 H new ATOM 0 HB3 TYR A 20 7.494 -7.899 -3.884 1.00 0.00 H new ATOM 0 HD1 TYR A 20 4.469 -9.060 -1.979 1.00 0.00 H new ATOM 0 HD2 TYR A 20 7.306 -9.888 -5.049 1.00 0.00 H new ATOM 0 HE1 TYR A 20 3.355 -11.292 -2.418 1.00 0.00 H new ATOM 0 HE2 TYR A 20 6.183 -12.116 -5.476 1.00 0.00 H new ATOM 0 HH TYR A 20 4.596 -13.454 -4.917 1.00 0.00 H new ATOM 310 N ALA A 21 9.404 -8.361 -2.094 1.00 0.00 N ATOM 311 CA ALA A 21 10.617 -9.141 -1.917 1.00 0.00 C ATOM 312 C ALA A 21 10.838 -9.402 -0.426 1.00 0.00 C ATOM 313 O ALA A 21 11.074 -10.539 -0.020 1.00 0.00 O ATOM 314 CB ALA A 21 11.795 -8.406 -2.562 1.00 0.00 C ATOM 0 H ALA A 21 9.505 -7.546 -2.699 1.00 0.00 H new ATOM 0 HA ALA A 21 10.527 -10.109 -2.410 1.00 0.00 H new ATOM 0 HB1 ALA A 21 12.705 -8.991 -2.429 1.00 0.00 H new ATOM 0 HB2 ALA A 21 11.602 -8.272 -3.626 1.00 0.00 H new ATOM 0 HB3 ALA A 21 11.918 -7.431 -2.090 1.00 0.00 H new ATOM 320 N LYS A 22 10.755 -8.330 0.348 1.00 0.00 N ATOM 321 CA LYS A 22 10.943 -8.429 1.786 1.00 0.00 C ATOM 322 C LYS A 22 9.925 -9.416 2.362 1.00 0.00 C ATOM 323 O LYS A 22 10.195 -10.077 3.364 1.00 0.00 O ATOM 324 CB LYS A 22 10.889 -7.043 2.430 1.00 0.00 C ATOM 325 CG LYS A 22 11.404 -7.087 3.870 1.00 0.00 C ATOM 326 CD LYS A 22 11.447 -5.684 4.480 1.00 0.00 C ATOM 327 CE LYS A 22 11.333 -5.746 6.005 1.00 0.00 C ATOM 328 NZ LYS A 22 12.665 -5.948 6.616 1.00 0.00 N ATOM 0 H LYS A 22 10.560 -7.389 0.007 1.00 0.00 H new ATOM 0 HA LYS A 22 11.933 -8.822 2.015 1.00 0.00 H new ATOM 0 HB2 LYS A 22 11.488 -6.344 1.847 1.00 0.00 H new ATOM 0 HB3 LYS A 22 9.864 -6.672 2.418 1.00 0.00 H new ATOM 0 HG2 LYS A 22 10.760 -7.729 4.471 1.00 0.00 H new ATOM 0 HG3 LYS A 22 12.401 -7.527 3.890 1.00 0.00 H new ATOM 0 HD2 LYS A 22 12.378 -5.191 4.201 1.00 0.00 H new ATOM 0 HD3 LYS A 22 10.633 -5.082 4.075 1.00 0.00 H new ATOM 0 HE2 LYS A 22 10.890 -4.823 6.380 1.00 0.00 H new ATOM 0 HE3 LYS A 22 10.667 -6.559 6.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 12.570 -5.988 7.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 13.073 -6.840 6.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 13.290 -5.158 6.356 1.00 0.00 H new ATOM 342 N ALA A 23 8.777 -9.483 1.705 1.00 0.00 N ATOM 343 CA ALA A 23 7.717 -10.377 2.140 1.00 0.00 C ATOM 344 C ALA A 23 8.100 -11.819 1.796 1.00 0.00 C ATOM 345 O ALA A 23 7.512 -12.763 2.322 1.00 0.00 O ATOM 346 CB ALA A 23 6.396 -9.955 1.494 1.00 0.00 C ATOM 0 H ALA A 23 8.557 -8.933 0.875 1.00 0.00 H new ATOM 0 HA ALA A 23 7.585 -10.319 3.220 1.00 0.00 H new ATOM 0 HB1 ALA A 23 5.601 -10.625 1.820 1.00 0.00 H new ATOM 0 HB2 ALA A 23 6.155 -8.935 1.792 1.00 0.00 H new ATOM 0 HB3 ALA A 23 6.490 -10.004 0.409 1.00 0.00 H new ATOM 352 N ILE A 24 9.083 -11.943 0.917 1.00 0.00 N ATOM 353 CA ILE A 24 9.550 -13.253 0.497 1.00 0.00 C ATOM 354 C ILE A 24 11.029 -13.402 0.859 1.00 0.00 C ATOM 355 O ILE A 24 11.676 -14.369 0.460 1.00 0.00 O ATOM 356 CB ILE A 24 9.254 -13.478 -0.987 1.00 0.00 C ATOM 357 CG1 ILE A 24 9.780 -12.316 -1.833 1.00 0.00 C ATOM 358 CG2 ILE A 24 7.762 -13.724 -1.217 1.00 0.00 C ATOM 359 CD1 ILE A 24 9.736 -12.659 -3.323 1.00 0.00 C ATOM 0 H ILE A 24 9.569 -11.158 0.484 1.00 0.00 H new ATOM 0 HA ILE A 24 9.011 -14.038 1.027 1.00 0.00 H new ATOM 0 HB ILE A 24 9.782 -14.376 -1.308 1.00 0.00 H new ATOM 0 HG12 ILE A 24 9.183 -11.424 -1.644 1.00 0.00 H new ATOM 0 HG13 ILE A 24 10.804 -12.082 -1.540 1.00 0.00 H new ATOM 0 HG21 ILE A 24 7.579 -13.881 -2.280 1.00 0.00 H new ATOM 0 HG22 ILE A 24 7.449 -14.607 -0.660 1.00 0.00 H new ATOM 0 HG23 ILE A 24 7.194 -12.859 -0.875 1.00 0.00 H new ATOM 0 HD11 ILE A 24 10.115 -11.817 -3.902 1.00 0.00 H new ATOM 0 HD12 ILE A 24 10.354 -13.537 -3.513 1.00 0.00 H new ATOM 0 HD13 ILE A 24 8.708 -12.868 -3.618 1.00 0.00 H new ATOM 371 N GLY A 25 11.523 -12.428 1.610 1.00 0.00 N ATOM 372 CA GLY A 25 12.914 -12.439 2.030 1.00 0.00 C ATOM 373 C GLY A 25 13.849 -12.253 0.833 1.00 0.00 C ATOM 374 O GLY A 25 14.953 -12.795 0.814 1.00 0.00 O ATOM 0 H GLY A 25 10.985 -11.626 1.938 1.00 0.00 H new ATOM 0 HA2 GLY A 25 13.085 -11.644 2.756 1.00 0.00 H new ATOM 0 HA3 GLY A 25 13.140 -13.381 2.529 1.00 0.00 H new ATOM 378 N ILE A 26 13.373 -11.485 -0.136 1.00 0.00 N ATOM 379 CA ILE A 26 14.152 -11.222 -1.333 1.00 0.00 C ATOM 380 C ILE A 26 14.689 -9.790 -1.283 1.00 0.00 C ATOM 381 O ILE A 26 14.011 -8.886 -0.796 1.00 0.00 O ATOM 382 CB ILE A 26 13.329 -11.526 -2.587 1.00 0.00 C ATOM 383 CG1 ILE A 26 13.103 -13.031 -2.742 1.00 0.00 C ATOM 384 CG2 ILE A 26 13.975 -10.912 -3.830 1.00 0.00 C ATOM 385 CD1 ILE A 26 12.961 -13.415 -4.217 1.00 0.00 C ATOM 0 H ILE A 26 12.457 -11.036 -0.116 1.00 0.00 H new ATOM 0 HA ILE A 26 15.015 -11.886 -1.378 1.00 0.00 H new ATOM 0 HB ILE A 26 12.349 -11.063 -2.473 1.00 0.00 H new ATOM 0 HG12 ILE A 26 13.937 -13.575 -2.300 1.00 0.00 H new ATOM 0 HG13 ILE A 26 12.206 -13.326 -2.198 1.00 0.00 H new ATOM 0 HG21 ILE A 26 13.370 -11.143 -4.707 1.00 0.00 H new ATOM 0 HG22 ILE A 26 14.041 -9.831 -3.709 1.00 0.00 H new ATOM 0 HG23 ILE A 26 14.976 -11.324 -3.961 1.00 0.00 H new ATOM 0 HD11 ILE A 26 12.801 -14.490 -4.299 1.00 0.00 H new ATOM 0 HD12 ILE A 26 12.111 -12.888 -4.650 1.00 0.00 H new ATOM 0 HD13 ILE A 26 13.870 -13.141 -4.753 1.00 0.00 H new ATOM 397 N SER A 27 15.901 -9.628 -1.792 1.00 0.00 N ATOM 398 CA SER A 27 16.536 -8.321 -1.811 1.00 0.00 C ATOM 399 C SER A 27 16.081 -7.536 -3.042 1.00 0.00 C ATOM 400 O SER A 27 15.874 -6.325 -2.970 1.00 0.00 O ATOM 401 CB SER A 27 18.061 -8.449 -1.796 1.00 0.00 C ATOM 402 OG SER A 27 18.632 -7.893 -0.615 1.00 0.00 O ATOM 0 H SER A 27 16.460 -10.380 -2.194 1.00 0.00 H new ATOM 0 HA SER A 27 16.235 -7.782 -0.913 1.00 0.00 H new ATOM 0 HB2 SER A 27 18.337 -9.501 -1.872 1.00 0.00 H new ATOM 0 HB3 SER A 27 18.476 -7.947 -2.670 1.00 0.00 H new ATOM 0 HG SER A 27 19.606 -7.996 -0.643 1.00 0.00 H new ATOM 408 N GLU A 28 15.940 -8.256 -4.145 1.00 0.00 N ATOM 409 CA GLU A 28 15.514 -7.642 -5.391 1.00 0.00 C ATOM 410 C GLU A 28 13.989 -7.522 -5.429 1.00 0.00 C ATOM 411 O GLU A 28 13.289 -8.220 -4.697 1.00 0.00 O ATOM 412 CB GLU A 28 16.032 -8.430 -6.596 1.00 0.00 C ATOM 413 CG GLU A 28 15.308 -9.772 -6.726 1.00 0.00 C ATOM 414 CD GLU A 28 15.400 -10.308 -8.156 1.00 0.00 C ATOM 415 OE1 GLU A 28 15.171 -9.498 -9.081 1.00 0.00 O ATOM 416 OE2 GLU A 28 15.696 -11.514 -8.292 1.00 0.00 O ATOM 0 H GLU A 28 16.113 -9.260 -4.202 1.00 0.00 H new ATOM 0 HA GLU A 28 15.940 -6.640 -5.444 1.00 0.00 H new ATOM 0 HB2 GLU A 28 15.889 -7.846 -7.505 1.00 0.00 H new ATOM 0 HB3 GLU A 28 17.104 -8.600 -6.491 1.00 0.00 H new ATOM 0 HG2 GLU A 28 15.744 -10.493 -6.035 1.00 0.00 H new ATOM 0 HG3 GLU A 28 14.262 -9.654 -6.445 1.00 0.00 H new ATOM 423 N PRO A 29 13.506 -6.607 -6.312 1.00 0.00 N ATOM 424 CA PRO A 29 12.077 -6.387 -6.455 1.00 0.00 C ATOM 425 C PRO A 29 11.420 -7.531 -7.229 1.00 0.00 C ATOM 426 O PRO A 29 11.934 -7.964 -8.259 1.00 0.00 O ATOM 427 CB PRO A 29 11.955 -5.046 -7.161 1.00 0.00 C ATOM 428 CG PRO A 29 13.309 -4.786 -7.800 1.00 0.00 C ATOM 429 CD PRO A 29 14.305 -5.762 -7.195 1.00 0.00 C ATOM 0 HA PRO A 29 11.557 -6.368 -5.497 1.00 0.00 H new ATOM 0 HB2 PRO A 29 11.167 -5.071 -7.913 1.00 0.00 H new ATOM 0 HB3 PRO A 29 11.698 -4.256 -6.456 1.00 0.00 H new ATOM 0 HG2 PRO A 29 13.253 -4.918 -8.880 1.00 0.00 H new ATOM 0 HG3 PRO A 29 13.625 -3.758 -7.621 1.00 0.00 H new ATOM 0 HD2 PRO A 29 14.800 -6.352 -7.966 1.00 0.00 H new ATOM 0 HD3 PRO A 29 15.086 -5.239 -6.643 1.00 0.00 H new ATOM 437 N VAL A 30 10.294 -7.990 -6.702 1.00 0.00 N ATOM 438 CA VAL A 30 9.562 -9.076 -7.330 1.00 0.00 C ATOM 439 C VAL A 30 8.144 -8.605 -7.661 1.00 0.00 C ATOM 440 O VAL A 30 7.701 -7.567 -7.171 1.00 0.00 O ATOM 441 CB VAL A 30 9.586 -10.313 -6.430 1.00 0.00 C ATOM 442 CG1 VAL A 30 8.617 -11.382 -6.940 1.00 0.00 C ATOM 443 CG2 VAL A 30 11.004 -10.873 -6.305 1.00 0.00 C ATOM 0 H VAL A 30 9.871 -7.629 -5.847 1.00 0.00 H new ATOM 0 HA VAL A 30 10.037 -9.364 -8.268 1.00 0.00 H new ATOM 0 HB VAL A 30 9.257 -10.010 -5.436 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.654 -12.250 -6.282 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.604 -10.979 -6.952 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.902 -11.679 -7.949 1.00 0.00 H new ATOM 0 HG21 VAL A 30 10.993 -11.752 -5.660 1.00 0.00 H new ATOM 0 HG22 VAL A 30 11.373 -11.152 -7.292 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.658 -10.115 -5.874 1.00 0.00 H new ATOM 453 N LYS A 31 7.472 -9.391 -8.489 1.00 0.00 N ATOM 454 CA LYS A 31 6.113 -9.068 -8.890 1.00 0.00 C ATOM 455 C LYS A 31 5.182 -9.210 -7.685 1.00 0.00 C ATOM 456 O LYS A 31 5.439 -10.013 -6.789 1.00 0.00 O ATOM 457 CB LYS A 31 5.695 -9.914 -10.094 1.00 0.00 C ATOM 458 CG LYS A 31 6.495 -9.529 -11.340 1.00 0.00 C ATOM 459 CD LYS A 31 5.956 -10.244 -12.581 1.00 0.00 C ATOM 460 CE LYS A 31 6.911 -11.349 -13.035 1.00 0.00 C ATOM 461 NZ LYS A 31 6.714 -11.646 -14.472 1.00 0.00 N ATOM 0 H LYS A 31 7.843 -10.251 -8.893 1.00 0.00 H new ATOM 0 HA LYS A 31 6.050 -8.031 -9.221 1.00 0.00 H new ATOM 0 HB2 LYS A 31 5.848 -10.970 -9.871 1.00 0.00 H new ATOM 0 HB3 LYS A 31 4.630 -9.779 -10.285 1.00 0.00 H new ATOM 0 HG2 LYS A 31 6.447 -8.450 -11.488 1.00 0.00 H new ATOM 0 HG3 LYS A 31 7.545 -9.785 -11.196 1.00 0.00 H new ATOM 0 HD2 LYS A 31 4.977 -10.671 -12.363 1.00 0.00 H new ATOM 0 HD3 LYS A 31 5.817 -9.525 -13.388 1.00 0.00 H new ATOM 0 HE2 LYS A 31 7.942 -11.042 -12.859 1.00 0.00 H new ATOM 0 HE3 LYS A 31 6.741 -12.250 -12.445 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 7.370 -12.398 -14.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 5.735 -11.959 -14.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 6.898 -10.789 -15.032 1.00 0.00 H new ATOM 475 N VAL A 32 4.119 -8.419 -7.702 1.00 0.00 N ATOM 476 CA VAL A 32 3.149 -8.446 -6.621 1.00 0.00 C ATOM 477 C VAL A 32 1.828 -9.018 -7.142 1.00 0.00 C ATOM 478 O VAL A 32 1.209 -8.444 -8.036 1.00 0.00 O ATOM 479 CB VAL A 32 2.998 -7.049 -6.017 1.00 0.00 C ATOM 480 CG1 VAL A 32 1.636 -6.889 -5.338 1.00 0.00 C ATOM 481 CG2 VAL A 32 4.137 -6.748 -5.040 1.00 0.00 C ATOM 0 H VAL A 32 3.908 -7.755 -8.448 1.00 0.00 H new ATOM 0 HA VAL A 32 3.492 -9.097 -5.817 1.00 0.00 H new ATOM 0 HB VAL A 32 3.054 -6.325 -6.830 1.00 0.00 H new ATOM 0 HG11 VAL A 32 1.555 -5.887 -4.917 1.00 0.00 H new ATOM 0 HG12 VAL A 32 0.844 -7.040 -6.071 1.00 0.00 H new ATOM 0 HG13 VAL A 32 1.538 -7.626 -4.541 1.00 0.00 H new ATOM 0 HG21 VAL A 32 4.006 -5.749 -4.625 1.00 0.00 H new ATOM 0 HG22 VAL A 32 4.127 -7.480 -4.233 1.00 0.00 H new ATOM 0 HG23 VAL A 32 5.090 -6.800 -5.566 1.00 0.00 H new ATOM 491 N PRO A 33 1.426 -10.172 -6.545 1.00 0.00 N ATOM 492 CA PRO A 33 0.191 -10.827 -6.939 1.00 0.00 C ATOM 493 C PRO A 33 -1.026 -10.078 -6.391 1.00 0.00 C ATOM 494 O PRO A 33 -1.732 -10.586 -5.521 1.00 0.00 O ATOM 495 CB PRO A 33 0.308 -12.244 -6.401 1.00 0.00 C ATOM 496 CG PRO A 33 1.388 -12.196 -5.332 1.00 0.00 C ATOM 497 CD PRO A 33 2.134 -10.880 -5.482 1.00 0.00 C ATOM 0 HA PRO A 33 0.046 -10.836 -8.019 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -0.640 -12.583 -5.983 1.00 0.00 H new ATOM 0 HB3 PRO A 33 0.574 -12.942 -7.194 1.00 0.00 H new ATOM 0 HG2 PRO A 33 0.946 -12.273 -4.339 1.00 0.00 H new ATOM 0 HG3 PRO A 33 2.072 -13.037 -5.442 1.00 0.00 H new ATOM 0 HD2 PRO A 33 2.124 -10.311 -4.552 1.00 0.00 H new ATOM 0 HD3 PRO A 33 3.179 -11.045 -5.744 1.00 0.00 H new ATOM 505 N TYR A 34 -1.235 -8.883 -6.924 1.00 0.00 N ATOM 506 CA TYR A 34 -2.354 -8.060 -6.500 1.00 0.00 C ATOM 507 C TYR A 34 -3.585 -8.918 -6.202 1.00 0.00 C ATOM 508 O TYR A 34 -4.107 -8.897 -5.089 1.00 0.00 O ATOM 509 CB TYR A 34 -2.666 -7.133 -7.676 1.00 0.00 C ATOM 510 CG TYR A 34 -1.552 -6.133 -7.993 1.00 0.00 C ATOM 511 CD1 TYR A 34 -0.845 -5.539 -6.967 1.00 0.00 C ATOM 512 CD2 TYR A 34 -1.254 -5.825 -9.305 1.00 0.00 C ATOM 513 CE1 TYR A 34 0.203 -4.598 -7.265 1.00 0.00 C ATOM 514 CE2 TYR A 34 -0.205 -4.884 -9.603 1.00 0.00 C ATOM 515 CZ TYR A 34 0.471 -4.317 -8.568 1.00 0.00 C ATOM 516 OH TYR A 34 1.462 -3.428 -8.849 1.00 0.00 O ATOM 0 H TYR A 34 -0.648 -8.465 -7.646 1.00 0.00 H new ATOM 0 HA TYR A 34 -2.104 -7.513 -5.591 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -2.859 -7.739 -8.561 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -3.582 -6.584 -7.459 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -1.078 -5.780 -5.940 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -1.807 -6.289 -10.108 1.00 0.00 H new ATOM 0 HE1 TYR A 34 0.764 -4.126 -6.472 1.00 0.00 H new ATOM 0 HE2 TYR A 34 0.039 -4.634 -10.625 1.00 0.00 H new ATOM 0 HH TYR A 34 1.543 -3.325 -9.820 1.00 0.00 H new ATOM 526 N SER A 35 -4.013 -9.655 -7.217 1.00 0.00 N ATOM 527 CA SER A 35 -5.172 -10.519 -7.079 1.00 0.00 C ATOM 528 C SER A 35 -5.137 -11.229 -5.724 1.00 0.00 C ATOM 529 O SER A 35 -6.078 -11.124 -4.939 1.00 0.00 O ATOM 530 CB SER A 35 -5.235 -11.543 -8.213 1.00 0.00 C ATOM 531 OG SER A 35 -4.707 -11.024 -9.431 1.00 0.00 O ATOM 0 H SER A 35 -3.577 -9.671 -8.139 1.00 0.00 H new ATOM 0 HA SER A 35 -6.068 -9.900 -7.135 1.00 0.00 H new ATOM 0 HB2 SER A 35 -4.678 -12.435 -7.927 1.00 0.00 H new ATOM 0 HB3 SER A 35 -6.270 -11.849 -8.368 1.00 0.00 H new ATOM 0 HG SER A 35 -4.764 -11.709 -10.130 1.00 0.00 H new ATOM 537 N LYS A 36 -4.041 -11.936 -5.491 1.00 0.00 N ATOM 538 CA LYS A 36 -3.870 -12.663 -4.244 1.00 0.00 C ATOM 539 C LYS A 36 -4.227 -11.747 -3.072 1.00 0.00 C ATOM 540 O LYS A 36 -4.908 -12.166 -2.137 1.00 0.00 O ATOM 541 CB LYS A 36 -2.462 -13.254 -4.157 1.00 0.00 C ATOM 542 CG LYS A 36 -2.209 -14.240 -5.299 1.00 0.00 C ATOM 543 CD LYS A 36 -3.018 -15.524 -5.105 1.00 0.00 C ATOM 544 CE LYS A 36 -3.456 -16.105 -6.451 1.00 0.00 C ATOM 545 NZ LYS A 36 -2.539 -17.189 -6.869 1.00 0.00 N ATOM 0 H LYS A 36 -3.262 -12.021 -6.144 1.00 0.00 H new ATOM 0 HA LYS A 36 -4.550 -13.514 -4.202 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.724 -12.452 -4.194 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.335 -13.760 -3.200 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -2.476 -13.778 -6.249 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -1.147 -14.479 -5.349 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -2.419 -16.258 -4.566 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -3.895 -15.316 -4.492 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -4.473 -16.490 -6.374 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -3.469 -15.319 -7.206 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -3.092 -17.985 -7.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -1.895 -16.834 -7.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -1.985 -17.511 -6.049 1.00 0.00 H new ATOM 559 N PHE A 37 -3.751 -10.514 -3.160 1.00 0.00 N ATOM 560 CA PHE A 37 -4.011 -9.535 -2.117 1.00 0.00 C ATOM 561 C PHE A 37 -5.429 -8.975 -2.233 1.00 0.00 C ATOM 562 O PHE A 37 -5.988 -8.482 -1.255 1.00 0.00 O ATOM 563 CB PHE A 37 -3.007 -8.397 -2.313 1.00 0.00 C ATOM 564 CG PHE A 37 -1.601 -8.711 -1.799 1.00 0.00 C ATOM 565 CD1 PHE A 37 -0.794 -9.554 -2.497 1.00 0.00 C ATOM 566 CD2 PHE A 37 -1.158 -8.147 -0.643 1.00 0.00 C ATOM 567 CE1 PHE A 37 0.511 -9.846 -2.019 1.00 0.00 C ATOM 568 CE2 PHE A 37 0.147 -8.439 -0.166 1.00 0.00 C ATOM 569 CZ PHE A 37 0.954 -9.282 -0.864 1.00 0.00 C ATOM 0 H PHE A 37 -3.187 -10.170 -3.937 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.913 -10.000 -1.136 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -2.949 -8.156 -3.375 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -3.378 -7.507 -1.804 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.146 -10.001 -3.415 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -1.799 -7.477 -0.088 1.00 0.00 H new ATOM 0 HE1 PHE A 37 1.152 -10.516 -2.573 1.00 0.00 H new ATOM 0 HE2 PHE A 37 0.499 -7.991 0.752 1.00 0.00 H new ATOM 0 HZ PHE A 37 1.947 -9.503 -0.501 1.00 0.00 H new ATOM 579 N LEU A 38 -5.972 -9.069 -3.438 1.00 0.00 N ATOM 580 CA LEU A 38 -7.315 -8.577 -3.695 1.00 0.00 C ATOM 581 C LEU A 38 -8.333 -9.595 -3.177 1.00 0.00 C ATOM 582 O LEU A 38 -9.174 -9.267 -2.341 1.00 0.00 O ATOM 583 CB LEU A 38 -7.486 -8.235 -5.176 1.00 0.00 C ATOM 584 CG LEU A 38 -6.609 -7.100 -5.708 1.00 0.00 C ATOM 585 CD1 LEU A 38 -6.716 -6.991 -7.231 1.00 0.00 C ATOM 586 CD2 LEU A 38 -6.944 -5.777 -5.015 1.00 0.00 C ATOM 0 H LEU A 38 -5.506 -9.479 -4.248 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.490 -7.647 -3.155 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.281 -9.131 -5.761 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -8.530 -7.973 -5.350 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.570 -7.333 -5.474 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.083 -6.177 -7.583 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -6.391 -7.926 -7.686 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -7.751 -6.792 -7.510 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.306 -4.987 -5.412 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.989 -5.526 -5.197 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -6.776 -5.875 -3.943 1.00 0.00 H new ATOM 598 N MET A 39 -8.225 -10.809 -3.695 1.00 0.00 N ATOM 599 CA MET A 39 -9.126 -11.877 -3.296 1.00 0.00 C ATOM 600 C MET A 39 -8.879 -12.288 -1.843 1.00 0.00 C ATOM 601 O MET A 39 -9.765 -12.837 -1.190 1.00 0.00 O ATOM 602 CB MET A 39 -8.922 -13.087 -4.210 1.00 0.00 C ATOM 603 CG MET A 39 -9.083 -12.696 -5.681 1.00 0.00 C ATOM 604 SD MET A 39 -9.019 -14.153 -6.710 1.00 0.00 S ATOM 605 CE MET A 39 -7.271 -14.508 -6.637 1.00 0.00 C ATOM 0 H MET A 39 -7.527 -11.077 -4.388 1.00 0.00 H new ATOM 0 HA MET A 39 -10.150 -11.514 -3.383 1.00 0.00 H new ATOM 0 HB2 MET A 39 -7.929 -13.506 -4.048 1.00 0.00 H new ATOM 0 HB3 MET A 39 -9.642 -13.865 -3.956 1.00 0.00 H new ATOM 0 HG2 MET A 39 -10.032 -12.179 -5.827 1.00 0.00 H new ATOM 0 HG3 MET A 39 -8.294 -12.002 -5.970 1.00 0.00 H new ATOM 0 HE1 MET A 39 -7.013 -15.229 -7.413 1.00 0.00 H new ATOM 0 HE2 MET A 39 -6.706 -13.589 -6.794 1.00 0.00 H new ATOM 0 HE3 MET A 39 -7.025 -14.923 -5.660 1.00 0.00 H new ATOM 615 N HIS A 40 -7.671 -12.005 -1.379 1.00 0.00 N ATOM 616 CA HIS A 40 -7.296 -12.338 -0.015 1.00 0.00 C ATOM 617 C HIS A 40 -6.676 -11.114 0.661 1.00 0.00 C ATOM 618 O HIS A 40 -5.478 -11.094 0.940 1.00 0.00 O ATOM 619 CB HIS A 40 -6.376 -13.560 0.013 1.00 0.00 C ATOM 620 CG HIS A 40 -6.795 -14.666 -0.926 1.00 0.00 C ATOM 621 ND1 HIS A 40 -7.681 -15.664 -0.561 1.00 0.00 N ATOM 622 CD2 HIS A 40 -6.440 -14.920 -2.219 1.00 0.00 C ATOM 623 CE1 HIS A 40 -7.845 -16.476 -1.595 1.00 0.00 C ATOM 624 NE2 HIS A 40 -7.075 -16.014 -2.621 1.00 0.00 N ATOM 0 H HIS A 40 -6.939 -11.549 -1.923 1.00 0.00 H new ATOM 0 HA HIS A 40 -8.185 -12.612 0.553 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -5.364 -13.246 -0.241 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -6.342 -13.953 1.029 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -5.758 -14.331 -2.814 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -8.478 -17.351 -1.621 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -6.999 -16.439 -3.545 1.00 0.00 H new ATOM 632 N PRO A 41 -7.542 -10.095 0.911 1.00 0.00 N ATOM 633 CA PRO A 41 -7.092 -8.869 1.548 1.00 0.00 C ATOM 634 C PRO A 41 -6.858 -9.084 3.045 1.00 0.00 C ATOM 635 O PRO A 41 -6.159 -8.301 3.686 1.00 0.00 O ATOM 636 CB PRO A 41 -8.182 -7.851 1.257 1.00 0.00 C ATOM 637 CG PRO A 41 -9.412 -8.656 0.871 1.00 0.00 C ATOM 638 CD PRO A 41 -8.967 -10.083 0.594 1.00 0.00 C ATOM 0 HA PRO A 41 -6.132 -8.524 1.165 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -8.380 -7.230 2.131 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -7.885 -7.181 0.450 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -10.149 -8.635 1.674 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -9.888 -8.227 -0.011 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -9.516 -10.796 1.210 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -9.144 -10.358 -0.446 1.00 0.00 H new ATOM 646 N GLU A 42 -7.458 -10.148 3.558 1.00 0.00 N ATOM 647 CA GLU A 42 -7.324 -10.476 4.968 1.00 0.00 C ATOM 648 C GLU A 42 -6.035 -11.263 5.209 1.00 0.00 C ATOM 649 O GLU A 42 -5.361 -11.064 6.219 1.00 0.00 O ATOM 650 CB GLU A 42 -8.543 -11.252 5.469 1.00 0.00 C ATOM 651 CG GLU A 42 -9.574 -10.310 6.093 1.00 0.00 C ATOM 652 CD GLU A 42 -10.000 -10.804 7.477 1.00 0.00 C ATOM 653 OE1 GLU A 42 -10.453 -11.966 7.551 1.00 0.00 O ATOM 654 OE2 GLU A 42 -9.864 -10.007 8.431 1.00 0.00 O ATOM 0 H GLU A 42 -8.038 -10.794 3.023 1.00 0.00 H new ATOM 0 HA GLU A 42 -7.270 -9.546 5.534 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -8.997 -11.797 4.641 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -8.230 -11.993 6.205 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -9.154 -9.307 6.174 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -10.447 -10.238 5.444 1.00 0.00 H new ATOM 661 N GLU A 43 -5.730 -12.142 4.266 1.00 0.00 N ATOM 662 CA GLU A 43 -4.534 -12.961 4.363 1.00 0.00 C ATOM 663 C GLU A 43 -3.317 -12.185 3.856 1.00 0.00 C ATOM 664 O GLU A 43 -2.308 -12.081 4.552 1.00 0.00 O ATOM 665 CB GLU A 43 -4.705 -14.275 3.598 1.00 0.00 C ATOM 666 CG GLU A 43 -5.623 -15.236 4.357 1.00 0.00 C ATOM 667 CD GLU A 43 -7.049 -14.687 4.432 1.00 0.00 C ATOM 668 OE1 GLU A 43 -7.749 -14.783 3.401 1.00 0.00 O ATOM 669 OE2 GLU A 43 -7.407 -14.184 5.519 1.00 0.00 O ATOM 0 H GLU A 43 -6.291 -12.305 3.430 1.00 0.00 H new ATOM 0 HA GLU A 43 -4.371 -13.209 5.412 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -5.120 -14.074 2.610 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -3.731 -14.741 3.446 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -5.629 -16.207 3.861 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -5.237 -15.394 5.364 1.00 0.00 H new ATOM 676 N LEU A 44 -3.451 -11.661 2.647 1.00 0.00 N ATOM 677 CA LEU A 44 -2.375 -10.898 2.038 1.00 0.00 C ATOM 678 C LEU A 44 -2.795 -9.431 1.927 1.00 0.00 C ATOM 679 O LEU A 44 -3.780 -9.112 1.261 1.00 0.00 O ATOM 680 CB LEU A 44 -1.964 -11.523 0.703 1.00 0.00 C ATOM 681 CG LEU A 44 -2.074 -13.046 0.613 1.00 0.00 C ATOM 682 CD1 LEU A 44 -2.011 -13.515 -0.842 1.00 0.00 C ATOM 683 CD2 LEU A 44 -1.012 -13.724 1.481 1.00 0.00 C ATOM 0 H LEU A 44 -4.289 -11.750 2.072 1.00 0.00 H new ATOM 0 HA LEU A 44 -1.484 -10.928 2.665 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.579 -11.087 -0.084 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.932 -11.240 0.495 1.00 0.00 H new ATOM 0 HG LEU A 44 -3.047 -13.343 1.005 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -2.091 -14.601 -0.878 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.834 -13.072 -1.403 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.063 -13.207 -1.283 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -1.112 -14.806 1.399 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.020 -13.425 1.143 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -1.146 -13.425 2.520 1.00 0.00 H new ATOM 695 N PHE A 45 -2.028 -8.577 2.588 1.00 0.00 N ATOM 696 CA PHE A 45 -2.309 -7.151 2.572 1.00 0.00 C ATOM 697 C PHE A 45 -1.021 -6.338 2.718 1.00 0.00 C ATOM 698 O PHE A 45 0.069 -6.903 2.800 1.00 0.00 O ATOM 699 CB PHE A 45 -3.219 -6.861 3.767 1.00 0.00 C ATOM 700 CG PHE A 45 -2.625 -7.269 5.116 1.00 0.00 C ATOM 701 CD1 PHE A 45 -1.747 -6.446 5.750 1.00 0.00 C ATOM 702 CD2 PHE A 45 -2.973 -8.456 5.682 1.00 0.00 C ATOM 703 CE1 PHE A 45 -1.195 -6.825 7.002 1.00 0.00 C ATOM 704 CE2 PHE A 45 -2.421 -8.835 6.934 1.00 0.00 C ATOM 705 CZ PHE A 45 -1.544 -8.011 7.568 1.00 0.00 C ATOM 0 H PHE A 45 -1.212 -8.845 3.138 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.777 -6.874 1.628 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -3.444 -5.795 3.789 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -4.165 -7.384 3.625 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.470 -5.504 5.301 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.669 -9.110 5.179 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -0.498 -6.171 7.505 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.697 -9.778 7.383 1.00 0.00 H new ATOM 0 HZ PHE A 45 -1.125 -8.299 8.521 1.00 0.00 H new ATOM 715 N VAL A 46 -1.189 -5.024 2.746 1.00 0.00 N ATOM 716 CA VAL A 46 -0.054 -4.127 2.881 1.00 0.00 C ATOM 717 C VAL A 46 -0.319 -3.143 4.022 1.00 0.00 C ATOM 718 O VAL A 46 -1.432 -2.639 4.166 1.00 0.00 O ATOM 719 CB VAL A 46 0.225 -3.432 1.546 1.00 0.00 C ATOM 720 CG1 VAL A 46 1.303 -2.358 1.702 1.00 0.00 C ATOM 721 CG2 VAL A 46 0.615 -4.448 0.471 1.00 0.00 C ATOM 0 H VAL A 46 -2.094 -4.559 2.677 1.00 0.00 H new ATOM 0 HA VAL A 46 0.846 -4.686 3.137 1.00 0.00 H new ATOM 0 HB VAL A 46 -0.693 -2.940 1.225 1.00 0.00 H new ATOM 0 HG11 VAL A 46 1.482 -1.880 0.739 1.00 0.00 H new ATOM 0 HG12 VAL A 46 0.970 -1.610 2.422 1.00 0.00 H new ATOM 0 HG13 VAL A 46 2.226 -2.817 2.056 1.00 0.00 H new ATOM 0 HG21 VAL A 46 0.808 -3.929 -0.468 1.00 0.00 H new ATOM 0 HG22 VAL A 46 1.514 -4.980 0.782 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -0.198 -5.160 0.331 1.00 0.00 H new ATOM 731 N VAL A 47 0.722 -2.901 4.806 1.00 0.00 N ATOM 732 CA VAL A 47 0.615 -1.987 5.930 1.00 0.00 C ATOM 733 C VAL A 47 1.584 -0.820 5.727 1.00 0.00 C ATOM 734 O VAL A 47 2.584 -0.955 5.023 1.00 0.00 O ATOM 735 CB VAL A 47 0.852 -2.740 7.241 1.00 0.00 C ATOM 736 CG1 VAL A 47 -0.292 -3.714 7.527 1.00 0.00 C ATOM 737 CG2 VAL A 47 2.198 -3.466 7.220 1.00 0.00 C ATOM 0 H VAL A 47 1.643 -3.322 4.685 1.00 0.00 H new ATOM 0 HA VAL A 47 -0.390 -1.569 5.988 1.00 0.00 H new ATOM 0 HB VAL A 47 0.879 -2.008 8.048 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -0.099 -4.236 8.464 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -1.229 -3.162 7.605 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.364 -4.439 6.716 1.00 0.00 H new ATOM 0 HG21 VAL A 47 2.342 -3.993 8.163 1.00 0.00 H new ATOM 0 HG22 VAL A 47 2.212 -4.182 6.398 1.00 0.00 H new ATOM 0 HG23 VAL A 47 3.000 -2.741 7.084 1.00 0.00 H new ATOM 747 N GLY A 48 1.254 0.298 6.357 1.00 0.00 N ATOM 748 CA GLY A 48 2.083 1.487 6.254 1.00 0.00 C ATOM 749 C GLY A 48 1.507 2.470 5.233 1.00 0.00 C ATOM 750 O GLY A 48 1.786 3.667 5.293 1.00 0.00 O ATOM 0 H GLY A 48 0.424 0.406 6.940 1.00 0.00 H new ATOM 0 HA2 GLY A 48 2.155 1.970 7.229 1.00 0.00 H new ATOM 0 HA3 GLY A 48 3.095 1.205 5.962 1.00 0.00 H new ATOM 754 N LEU A 49 0.716 1.929 4.319 1.00 0.00 N ATOM 755 CA LEU A 49 0.098 2.743 3.286 1.00 0.00 C ATOM 756 C LEU A 49 -0.467 4.017 3.918 1.00 0.00 C ATOM 757 O LEU A 49 -0.801 4.032 5.101 1.00 0.00 O ATOM 758 CB LEU A 49 -0.939 1.929 2.510 1.00 0.00 C ATOM 759 CG LEU A 49 -0.389 1.003 1.423 1.00 0.00 C ATOM 760 CD1 LEU A 49 -1.437 -0.027 0.998 1.00 0.00 C ATOM 761 CD2 LEU A 49 0.140 1.808 0.234 1.00 0.00 C ATOM 0 H LEU A 49 0.488 0.936 4.272 1.00 0.00 H new ATOM 0 HA LEU A 49 0.840 3.053 2.550 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -1.504 1.326 3.221 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.643 2.621 2.048 1.00 0.00 H new ATOM 0 HG LEU A 49 0.454 0.451 1.839 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -1.020 -0.672 0.225 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.724 -0.631 1.859 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.315 0.487 0.607 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.525 1.126 -0.524 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.668 2.404 -0.190 1.00 0.00 H new ATOM 0 HD23 LEU A 49 0.940 2.468 0.569 1.00 0.00 H new ATOM 773 N PRO A 50 -0.559 5.083 3.078 1.00 0.00 N ATOM 774 CA PRO A 50 -1.078 6.359 3.541 1.00 0.00 C ATOM 775 C PRO A 50 -2.599 6.307 3.698 1.00 0.00 C ATOM 776 O PRO A 50 -3.213 5.263 3.485 1.00 0.00 O ATOM 777 CB PRO A 50 -0.622 7.370 2.502 1.00 0.00 C ATOM 778 CG PRO A 50 -0.267 6.563 1.263 1.00 0.00 C ATOM 779 CD PRO A 50 -0.172 5.102 1.670 1.00 0.00 C ATOM 0 HA PRO A 50 -0.708 6.630 4.530 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.411 8.091 2.286 1.00 0.00 H new ATOM 0 HB3 PRO A 50 0.238 7.936 2.859 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -1.025 6.696 0.491 1.00 0.00 H new ATOM 0 HG3 PRO A 50 0.679 6.905 0.843 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -0.835 4.480 1.069 1.00 0.00 H new ATOM 0 HD3 PRO A 50 0.839 4.717 1.532 1.00 0.00 H new ATOM 787 N GLU A 51 -3.162 7.447 4.070 1.00 0.00 N ATOM 788 CA GLU A 51 -4.599 7.546 4.258 1.00 0.00 C ATOM 789 C GLU A 51 -5.305 7.667 2.906 1.00 0.00 C ATOM 790 O GLU A 51 -4.809 8.336 2.001 1.00 0.00 O ATOM 791 CB GLU A 51 -4.954 8.723 5.169 1.00 0.00 C ATOM 792 CG GLU A 51 -6.000 8.315 6.209 1.00 0.00 C ATOM 793 CD GLU A 51 -5.339 7.971 7.545 1.00 0.00 C ATOM 794 OE1 GLU A 51 -4.302 7.274 7.503 1.00 0.00 O ATOM 795 OE2 GLU A 51 -5.885 8.413 8.579 1.00 0.00 O ATOM 0 H GLU A 51 -2.648 8.310 4.246 1.00 0.00 H new ATOM 0 HA GLU A 51 -4.945 6.635 4.746 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -4.056 9.082 5.672 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -5.335 9.550 4.569 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -6.713 9.127 6.350 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -6.563 7.455 5.846 1.00 0.00 H new ATOM 802 N GLY A 52 -6.451 7.009 2.811 1.00 0.00 N ATOM 803 CA GLY A 52 -7.229 7.035 1.584 1.00 0.00 C ATOM 804 C GLY A 52 -6.485 6.330 0.448 1.00 0.00 C ATOM 805 O GLY A 52 -6.652 6.681 -0.719 1.00 0.00 O ATOM 0 H GLY A 52 -6.859 6.455 3.564 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.191 6.550 1.749 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -7.436 8.067 1.302 1.00 0.00 H new ATOM 809 N ILE A 53 -5.680 5.350 0.829 1.00 0.00 N ATOM 810 CA ILE A 53 -4.910 4.593 -0.144 1.00 0.00 C ATOM 811 C ILE A 53 -4.766 3.148 0.339 1.00 0.00 C ATOM 812 O ILE A 53 -4.596 2.902 1.532 1.00 0.00 O ATOM 813 CB ILE A 53 -3.573 5.284 -0.423 1.00 0.00 C ATOM 814 CG1 ILE A 53 -3.781 6.758 -0.773 1.00 0.00 C ATOM 815 CG2 ILE A 53 -2.789 4.542 -1.508 1.00 0.00 C ATOM 816 CD1 ILE A 53 -2.478 7.395 -1.259 1.00 0.00 C ATOM 0 H ILE A 53 -5.544 5.062 1.798 1.00 0.00 H new ATOM 0 HA ILE A 53 -5.432 4.560 -1.100 1.00 0.00 H new ATOM 0 HB ILE A 53 -2.974 5.251 0.487 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -4.544 6.848 -1.546 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -4.148 7.295 0.102 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.843 5.053 -1.687 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.593 3.521 -1.181 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -3.372 4.523 -2.429 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -2.654 8.443 -1.501 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -1.724 7.325 -0.475 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -2.126 6.871 -2.148 1.00 0.00 H new ATOM 828 N SER A 54 -4.840 2.230 -0.614 1.00 0.00 N ATOM 829 CA SER A 54 -4.720 0.816 -0.301 1.00 0.00 C ATOM 830 C SER A 54 -3.785 0.136 -1.303 1.00 0.00 C ATOM 831 O SER A 54 -2.874 0.768 -1.835 1.00 0.00 O ATOM 832 CB SER A 54 -6.089 0.133 -0.305 1.00 0.00 C ATOM 833 OG SER A 54 -6.174 -0.899 0.674 1.00 0.00 O ATOM 0 H SER A 54 -4.981 2.438 -1.603 1.00 0.00 H new ATOM 0 HA SER A 54 -4.300 0.722 0.700 1.00 0.00 H new ATOM 0 HB2 SER A 54 -6.865 0.875 -0.118 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.282 -0.287 -1.292 1.00 0.00 H new ATOM 0 HG SER A 54 -7.063 -1.309 0.641 1.00 0.00 H new ATOM 839 N LEU A 55 -4.043 -1.144 -1.530 1.00 0.00 N ATOM 840 CA LEU A 55 -3.236 -1.917 -2.459 1.00 0.00 C ATOM 841 C LEU A 55 -4.009 -2.105 -3.765 1.00 0.00 C ATOM 842 O LEU A 55 -5.029 -2.793 -3.794 1.00 0.00 O ATOM 843 CB LEU A 55 -2.788 -3.230 -1.815 1.00 0.00 C ATOM 844 CG LEU A 55 -1.706 -4.010 -2.564 1.00 0.00 C ATOM 845 CD1 LEU A 55 -0.380 -3.246 -2.564 1.00 0.00 C ATOM 846 CD2 LEU A 55 -1.554 -5.422 -1.995 1.00 0.00 C ATOM 0 H LEU A 55 -4.800 -1.665 -1.087 1.00 0.00 H new ATOM 0 HA LEU A 55 -2.320 -1.381 -2.705 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -2.422 -3.013 -0.811 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -3.661 -3.874 -1.704 1.00 0.00 H new ATOM 0 HG LEU A 55 -2.018 -4.114 -3.603 1.00 0.00 H new ATOM 0 HD11 LEU A 55 0.372 -3.822 -3.103 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -0.516 -2.281 -3.052 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -0.050 -3.090 -1.537 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -0.779 -5.955 -2.546 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -1.276 -5.362 -0.943 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -2.499 -5.957 -2.091 1.00 0.00 H new ATOM 858 N ARG A 56 -3.495 -1.482 -4.816 1.00 0.00 N ATOM 859 CA ARG A 56 -4.124 -1.573 -6.122 1.00 0.00 C ATOM 860 C ARG A 56 -3.129 -1.189 -7.219 1.00 0.00 C ATOM 861 O ARG A 56 -2.064 -0.644 -6.932 1.00 0.00 O ATOM 862 CB ARG A 56 -5.347 -0.657 -6.209 1.00 0.00 C ATOM 863 CG ARG A 56 -6.580 -1.329 -5.603 1.00 0.00 C ATOM 864 CD ARG A 56 -7.842 -0.973 -6.391 1.00 0.00 C ATOM 865 NE ARG A 56 -8.905 -1.967 -6.121 1.00 0.00 N ATOM 866 CZ ARG A 56 -9.733 -1.915 -5.068 1.00 0.00 C ATOM 867 NH1 ARG A 56 -9.625 -0.917 -4.181 1.00 0.00 N ATOM 868 NH2 ARG A 56 -10.668 -2.860 -4.904 1.00 0.00 N ATOM 0 H ARG A 56 -2.650 -0.912 -4.789 1.00 0.00 H new ATOM 0 HA ARG A 56 -4.446 -2.605 -6.264 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -5.144 0.277 -5.686 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -5.542 -0.403 -7.251 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -6.443 -2.410 -5.598 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.695 -1.017 -4.565 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -8.185 0.023 -6.113 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -7.619 -0.947 -7.458 1.00 0.00 H new ATOM 0 HE ARG A 56 -9.014 -2.740 -6.777 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -8.913 -0.197 -4.307 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -10.255 -0.877 -3.380 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -10.750 -3.619 -5.580 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -11.298 -2.820 -4.103 1.00 0.00 H new ATOM 882 N ARG A 57 -3.511 -1.489 -8.451 1.00 0.00 N ATOM 883 CA ARG A 57 -2.665 -1.182 -9.592 1.00 0.00 C ATOM 884 C ARG A 57 -2.146 0.254 -9.497 1.00 0.00 C ATOM 885 O ARG A 57 -2.912 1.179 -9.231 1.00 0.00 O ATOM 886 CB ARG A 57 -3.429 -1.355 -10.907 1.00 0.00 C ATOM 887 CG ARG A 57 -2.780 -2.429 -11.781 1.00 0.00 C ATOM 888 CD ARG A 57 -3.682 -2.795 -12.961 1.00 0.00 C ATOM 889 NE ARG A 57 -2.895 -3.488 -14.005 1.00 0.00 N ATOM 890 CZ ARG A 57 -2.420 -4.735 -13.884 1.00 0.00 C ATOM 891 NH1 ARG A 57 -2.650 -5.434 -12.763 1.00 0.00 N ATOM 892 NH2 ARG A 57 -1.716 -5.284 -14.882 1.00 0.00 N ATOM 0 H ARG A 57 -4.395 -1.941 -8.685 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.825 -1.877 -9.579 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -4.463 -1.628 -10.698 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -3.452 -0.408 -11.446 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -1.819 -2.070 -12.151 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -2.580 -3.318 -11.183 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -4.496 -3.436 -12.622 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.137 -1.895 -13.374 1.00 0.00 H new ATOM 0 HE ARG A 57 -2.702 -2.985 -14.871 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -3.186 -5.016 -12.003 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -2.288 -6.383 -12.671 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -1.541 -4.753 -15.735 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -1.355 -6.233 -14.789 1.00 0.00 H new ATOM 906 N PRO A 58 -0.813 0.400 -9.726 1.00 0.00 N ATOM 907 CA PRO A 58 -0.182 1.708 -9.669 1.00 0.00 C ATOM 908 C PRO A 58 -0.522 2.535 -10.911 1.00 0.00 C ATOM 909 O PRO A 58 0.365 2.886 -11.688 1.00 0.00 O ATOM 910 CB PRO A 58 1.304 1.422 -9.533 1.00 0.00 C ATOM 911 CG PRO A 58 1.495 -0.017 -9.986 1.00 0.00 C ATOM 912 CD PRO A 58 0.125 -0.673 -10.045 1.00 0.00 C ATOM 0 HA PRO A 58 -0.536 2.310 -8.832 1.00 0.00 H new ATOM 0 HB2 PRO A 58 1.891 2.106 -10.146 1.00 0.00 H new ATOM 0 HB3 PRO A 58 1.634 1.554 -8.503 1.00 0.00 H new ATOM 0 HG2 PRO A 58 1.976 -0.049 -10.964 1.00 0.00 H new ATOM 0 HG3 PRO A 58 2.145 -0.552 -9.294 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -0.072 -1.091 -11.032 1.00 0.00 H new ATOM 0 HD3 PRO A 58 0.047 -1.493 -9.331 1.00 0.00 H new ATOM 920 N ASN A 59 -1.807 2.821 -11.059 1.00 0.00 N ATOM 921 CA ASN A 59 -2.274 3.600 -12.193 1.00 0.00 C ATOM 922 C ASN A 59 -3.667 4.153 -11.887 1.00 0.00 C ATOM 923 O ASN A 59 -3.951 5.318 -12.160 1.00 0.00 O ATOM 924 CB ASN A 59 -2.373 2.736 -13.451 1.00 0.00 C ATOM 925 CG ASN A 59 -2.714 1.287 -13.096 1.00 0.00 C ATOM 926 OD1 ASN A 59 -1.883 0.521 -12.638 1.00 0.00 O ATOM 927 ND2 ASN A 59 -3.981 0.956 -13.332 1.00 0.00 N ATOM 0 H ASN A 59 -2.539 2.527 -10.413 1.00 0.00 H new ATOM 0 HA ASN A 59 -1.561 4.406 -12.365 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -3.137 3.141 -14.115 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -1.428 2.768 -13.994 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -4.308 0.012 -13.128 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -4.625 1.647 -13.717 1.00 0.00 H new ATOM 934 N CYS A 60 -4.501 3.290 -11.325 1.00 0.00 N ATOM 935 CA CYS A 60 -5.858 3.677 -10.980 1.00 0.00 C ATOM 936 C CYS A 60 -5.789 4.851 -10.001 1.00 0.00 C ATOM 937 O CYS A 60 -6.744 5.615 -9.874 1.00 0.00 O ATOM 938 CB CYS A 60 -6.653 2.502 -10.406 1.00 0.00 C ATOM 939 SG CYS A 60 -6.853 1.201 -11.677 1.00 0.00 S ATOM 0 H CYS A 60 -4.263 2.324 -11.100 1.00 0.00 H new ATOM 0 HA CYS A 60 -6.390 3.986 -11.880 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -6.139 2.095 -9.535 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -7.631 2.845 -10.068 1.00 0.00 H new ATOM 0 HG CYS A 60 -7.527 0.207 -11.179 1.00 0.00 H new ATOM 945 N PHE A 61 -4.648 4.957 -9.335 1.00 0.00 N ATOM 946 CA PHE A 61 -4.442 6.025 -8.372 1.00 0.00 C ATOM 947 C PHE A 61 -4.102 7.341 -9.076 1.00 0.00 C ATOM 948 O PHE A 61 -4.000 7.385 -10.301 1.00 0.00 O ATOM 949 CB PHE A 61 -3.260 5.612 -7.492 1.00 0.00 C ATOM 950 CG PHE A 61 -3.561 4.440 -6.555 1.00 0.00 C ATOM 951 CD1 PHE A 61 -3.353 3.164 -6.975 1.00 0.00 C ATOM 952 CD2 PHE A 61 -4.037 4.676 -5.303 1.00 0.00 C ATOM 953 CE1 PHE A 61 -3.632 2.076 -6.105 1.00 0.00 C ATOM 954 CE2 PHE A 61 -4.316 3.589 -4.434 1.00 0.00 C ATOM 955 CZ PHE A 61 -4.108 2.312 -4.853 1.00 0.00 C ATOM 0 H PHE A 61 -3.858 4.321 -9.443 1.00 0.00 H new ATOM 0 HA PHE A 61 -5.350 6.180 -7.789 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -2.419 5.345 -8.132 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.947 6.469 -6.896 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -2.976 2.977 -7.970 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -4.203 5.690 -4.970 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -3.466 1.062 -6.438 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -4.694 3.776 -3.440 1.00 0.00 H new ATOM 0 HZ PHE A 61 -4.321 1.485 -4.192 1.00 0.00 H new ATOM 965 N GLY A 62 -3.938 8.380 -8.271 1.00 0.00 N ATOM 966 CA GLY A 62 -3.613 9.693 -8.802 1.00 0.00 C ATOM 967 C GLY A 62 -2.175 10.084 -8.455 1.00 0.00 C ATOM 968 O GLY A 62 -1.619 9.607 -7.467 1.00 0.00 O ATOM 0 H GLY A 62 -4.024 8.340 -7.255 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -3.743 9.694 -9.884 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -4.303 10.434 -8.398 1.00 0.00 H new ATOM 972 N ILE A 63 -1.613 10.947 -9.289 1.00 0.00 N ATOM 973 CA ILE A 63 -0.250 11.407 -9.083 1.00 0.00 C ATOM 974 C ILE A 63 -0.029 11.684 -7.595 1.00 0.00 C ATOM 975 O ILE A 63 0.869 11.111 -6.979 1.00 0.00 O ATOM 976 CB ILE A 63 0.053 12.606 -9.984 1.00 0.00 C ATOM 977 CG1 ILE A 63 0.436 12.151 -11.393 1.00 0.00 C ATOM 978 CG2 ILE A 63 1.124 13.504 -9.360 1.00 0.00 C ATOM 979 CD1 ILE A 63 -0.616 12.588 -12.415 1.00 0.00 C ATOM 0 H ILE A 63 -2.077 11.340 -10.108 1.00 0.00 H new ATOM 0 HA ILE A 63 0.461 10.633 -9.372 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.855 13.203 -10.075 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.406 12.569 -11.663 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.539 11.066 -11.413 1.00 0.00 H new ATOM 0 HG21 ILE A 63 1.321 14.349 -10.020 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.774 13.872 -8.395 1.00 0.00 H new ATOM 0 HG23 ILE A 63 2.041 12.932 -9.219 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -0.320 12.252 -13.409 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -1.579 12.149 -12.156 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -0.699 13.675 -12.409 1.00 0.00 H new ATOM 991 N ALA A 64 -0.863 12.563 -7.059 1.00 0.00 N ATOM 992 CA ALA A 64 -0.770 12.923 -5.654 1.00 0.00 C ATOM 993 C ALA A 64 -0.653 11.651 -4.813 1.00 0.00 C ATOM 994 O ALA A 64 0.235 11.541 -3.968 1.00 0.00 O ATOM 995 CB ALA A 64 -1.982 13.772 -5.263 1.00 0.00 C ATOM 0 H ALA A 64 -1.606 13.037 -7.572 1.00 0.00 H new ATOM 0 HA ALA A 64 0.121 13.523 -5.470 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -1.912 14.042 -4.209 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -2.003 14.678 -5.869 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -2.895 13.202 -5.432 1.00 0.00 H new ATOM 1001 N LYS A 65 -1.561 10.722 -5.073 1.00 0.00 N ATOM 1002 CA LYS A 65 -1.570 9.462 -4.350 1.00 0.00 C ATOM 1003 C LYS A 65 -0.247 8.732 -4.588 1.00 0.00 C ATOM 1004 O LYS A 65 0.493 8.456 -3.645 1.00 0.00 O ATOM 1005 CB LYS A 65 -2.804 8.638 -4.725 1.00 0.00 C ATOM 1006 CG LYS A 65 -4.091 9.392 -4.385 1.00 0.00 C ATOM 1007 CD LYS A 65 -5.324 8.550 -4.717 1.00 0.00 C ATOM 1008 CE LYS A 65 -6.388 8.682 -3.626 1.00 0.00 C ATOM 1009 NZ LYS A 65 -7.745 8.587 -4.211 1.00 0.00 N ATOM 0 H LYS A 65 -2.296 10.817 -5.774 1.00 0.00 H new ATOM 0 HA LYS A 65 -1.647 9.639 -3.277 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -2.783 8.409 -5.791 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -2.785 7.686 -4.194 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -4.097 9.650 -3.326 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -4.126 10.329 -4.941 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -5.738 8.867 -5.674 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -5.036 7.504 -4.825 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -6.252 7.899 -2.880 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -6.273 9.636 -3.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -8.455 8.679 -3.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -7.878 9.349 -4.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -7.856 7.666 -4.682 1.00 0.00 H new ATOM 1023 N LEU A 66 0.011 8.440 -5.855 1.00 0.00 N ATOM 1024 CA LEU A 66 1.232 7.747 -6.230 1.00 0.00 C ATOM 1025 C LEU A 66 2.394 8.281 -5.390 1.00 0.00 C ATOM 1026 O LEU A 66 3.168 7.506 -4.831 1.00 0.00 O ATOM 1027 CB LEU A 66 1.464 7.850 -7.738 1.00 0.00 C ATOM 1028 CG LEU A 66 0.481 7.080 -8.623 1.00 0.00 C ATOM 1029 CD1 LEU A 66 0.634 7.482 -10.091 1.00 0.00 C ATOM 1030 CD2 LEU A 66 0.630 5.570 -8.423 1.00 0.00 C ATOM 0 H LEU A 66 -0.605 8.671 -6.635 1.00 0.00 H new ATOM 0 HA LEU A 66 1.147 6.681 -6.016 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.428 8.902 -8.020 1.00 0.00 H new ATOM 0 HB3 LEU A 66 2.472 7.496 -7.955 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.532 7.346 -8.321 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.076 6.920 -10.698 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.439 8.549 -10.198 1.00 0.00 H new ATOM 0 HD13 LEU A 66 1.649 7.264 -10.424 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.080 5.046 -9.063 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.644 5.267 -8.682 1.00 0.00 H new ATOM 0 HD23 LEU A 66 0.432 5.320 -7.381 1.00 0.00 H new ATOM 1042 N ARG A 67 2.480 9.602 -5.329 1.00 0.00 N ATOM 1043 CA ARG A 67 3.535 10.248 -4.567 1.00 0.00 C ATOM 1044 C ARG A 67 3.460 9.831 -3.097 1.00 0.00 C ATOM 1045 O ARG A 67 4.422 9.292 -2.552 1.00 0.00 O ATOM 1046 CB ARG A 67 3.429 11.772 -4.663 1.00 0.00 C ATOM 1047 CG ARG A 67 3.830 12.262 -6.056 1.00 0.00 C ATOM 1048 CD ARG A 67 4.215 13.743 -6.026 1.00 0.00 C ATOM 1049 NE ARG A 67 5.572 13.924 -6.587 1.00 0.00 N ATOM 1050 CZ ARG A 67 6.238 15.087 -6.582 1.00 0.00 C ATOM 1051 NH1 ARG A 67 5.676 16.179 -6.044 1.00 0.00 N ATOM 1052 NH2 ARG A 67 7.466 15.159 -7.113 1.00 0.00 N ATOM 0 H ARG A 67 1.837 10.242 -5.795 1.00 0.00 H new ATOM 0 HA ARG A 67 4.489 9.933 -4.989 1.00 0.00 H new ATOM 0 HB2 ARG A 67 2.408 12.084 -4.444 1.00 0.00 H new ATOM 0 HB3 ARG A 67 4.071 12.233 -3.912 1.00 0.00 H new ATOM 0 HG2 ARG A 67 4.669 11.672 -6.426 1.00 0.00 H new ATOM 0 HG3 ARG A 67 3.003 12.111 -6.750 1.00 0.00 H new ATOM 0 HD2 ARG A 67 3.495 14.326 -6.599 1.00 0.00 H new ATOM 0 HD3 ARG A 67 4.183 14.115 -5.002 1.00 0.00 H new ATOM 0 HE ARG A 67 6.029 13.113 -7.004 1.00 0.00 H new ATOM 0 HH11 ARG A 67 4.742 16.125 -5.639 1.00 0.00 H new ATOM 0 HH12 ARG A 67 6.183 17.064 -6.040 1.00 0.00 H new ATOM 0 HH21 ARG A 67 7.895 14.328 -7.521 1.00 0.00 H new ATOM 0 HH22 ARG A 67 7.972 16.044 -7.109 1.00 0.00 H new ATOM 1066 N LYS A 68 2.309 10.095 -2.497 1.00 0.00 N ATOM 1067 CA LYS A 68 2.097 9.754 -1.101 1.00 0.00 C ATOM 1068 C LYS A 68 2.706 8.379 -0.818 1.00 0.00 C ATOM 1069 O LYS A 68 3.624 8.257 -0.009 1.00 0.00 O ATOM 1070 CB LYS A 68 0.612 9.854 -0.745 1.00 0.00 C ATOM 1071 CG LYS A 68 0.384 10.875 0.371 1.00 0.00 C ATOM 1072 CD LYS A 68 -0.193 12.178 -0.187 1.00 0.00 C ATOM 1073 CE LYS A 68 -1.470 12.574 0.556 1.00 0.00 C ATOM 1074 NZ LYS A 68 -2.344 13.392 -0.315 1.00 0.00 N ATOM 0 H LYS A 68 1.513 10.541 -2.952 1.00 0.00 H new ATOM 0 HA LYS A 68 2.606 10.468 -0.453 1.00 0.00 H new ATOM 0 HB2 LYS A 68 0.041 10.141 -1.628 1.00 0.00 H new ATOM 0 HB3 LYS A 68 0.243 8.878 -0.431 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -0.297 10.461 1.114 1.00 0.00 H new ATOM 0 HG3 LYS A 68 1.326 11.079 0.880 1.00 0.00 H new ATOM 0 HD2 LYS A 68 0.546 12.975 -0.098 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -0.408 12.060 -1.249 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -2.003 11.679 0.878 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -1.215 13.135 1.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -3.206 13.652 0.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -1.839 14.255 -0.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -2.602 12.844 -1.161 1.00 0.00 H new ATOM 1088 N ILE A 69 2.169 7.378 -1.501 1.00 0.00 N ATOM 1089 CA ILE A 69 2.649 6.017 -1.334 1.00 0.00 C ATOM 1090 C ILE A 69 4.178 6.012 -1.360 1.00 0.00 C ATOM 1091 O ILE A 69 4.816 5.472 -0.458 1.00 0.00 O ATOM 1092 CB ILE A 69 2.013 5.093 -2.375 1.00 0.00 C ATOM 1093 CG1 ILE A 69 0.514 4.926 -2.118 1.00 0.00 C ATOM 1094 CG2 ILE A 69 2.739 3.747 -2.430 1.00 0.00 C ATOM 1095 CD1 ILE A 69 -0.188 4.327 -3.338 1.00 0.00 C ATOM 0 H ILE A 69 1.407 7.483 -2.171 1.00 0.00 H new ATOM 0 HA ILE A 69 2.346 5.623 -0.364 1.00 0.00 H new ATOM 0 HB ILE A 69 2.121 5.557 -3.355 1.00 0.00 H new ATOM 0 HG12 ILE A 69 0.359 4.282 -1.252 1.00 0.00 H new ATOM 0 HG13 ILE A 69 0.072 5.893 -1.878 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.267 3.109 -3.178 1.00 0.00 H new ATOM 0 HG22 ILE A 69 3.783 3.908 -2.697 1.00 0.00 H new ATOM 0 HG23 ILE A 69 2.684 3.264 -1.454 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -1.252 4.219 -3.129 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -0.052 4.986 -4.196 1.00 0.00 H new ATOM 0 HD13 ILE A 69 0.239 3.349 -3.560 1.00 0.00 H new ATOM 1107 N LEU A 70 4.722 6.620 -2.404 1.00 0.00 N ATOM 1108 CA LEU A 70 6.165 6.693 -2.559 1.00 0.00 C ATOM 1109 C LEU A 70 6.774 7.357 -1.322 1.00 0.00 C ATOM 1110 O LEU A 70 7.832 6.943 -0.849 1.00 0.00 O ATOM 1111 CB LEU A 70 6.528 7.390 -3.872 1.00 0.00 C ATOM 1112 CG LEU A 70 6.298 6.578 -5.148 1.00 0.00 C ATOM 1113 CD1 LEU A 70 6.443 7.457 -6.391 1.00 0.00 C ATOM 1114 CD2 LEU A 70 7.221 5.359 -5.197 1.00 0.00 C ATOM 0 H LEU A 70 4.190 7.067 -3.151 1.00 0.00 H new ATOM 0 HA LEU A 70 6.592 5.692 -2.627 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.951 8.312 -3.943 1.00 0.00 H new ATOM 0 HB3 LEU A 70 7.579 7.675 -3.831 1.00 0.00 H new ATOM 0 HG LEU A 70 5.274 6.205 -5.135 1.00 0.00 H new ATOM 0 HD11 LEU A 70 6.275 6.855 -7.284 1.00 0.00 H new ATOM 0 HD12 LEU A 70 5.711 8.264 -6.354 1.00 0.00 H new ATOM 0 HD13 LEU A 70 7.447 7.880 -6.423 1.00 0.00 H new ATOM 0 HD21 LEU A 70 7.037 4.800 -6.114 1.00 0.00 H new ATOM 0 HD22 LEU A 70 8.260 5.688 -5.175 1.00 0.00 H new ATOM 0 HD23 LEU A 70 7.025 4.719 -4.336 1.00 0.00 H new ATOM 1126 N GLU A 71 6.080 8.374 -0.834 1.00 0.00 N ATOM 1127 CA GLU A 71 6.540 9.099 0.339 1.00 0.00 C ATOM 1128 C GLU A 71 6.405 8.226 1.588 1.00 0.00 C ATOM 1129 O GLU A 71 7.116 8.430 2.571 1.00 0.00 O ATOM 1130 CB GLU A 71 5.776 10.415 0.504 1.00 0.00 C ATOM 1131 CG GLU A 71 5.868 11.265 -0.764 1.00 0.00 C ATOM 1132 CD GLU A 71 6.090 12.740 -0.421 1.00 0.00 C ATOM 1133 OE1 GLU A 71 7.228 13.064 -0.019 1.00 0.00 O ATOM 1134 OE2 GLU A 71 5.115 13.509 -0.568 1.00 0.00 O ATOM 0 H GLU A 71 5.203 8.714 -1.229 1.00 0.00 H new ATOM 0 HA GLU A 71 7.593 9.343 0.202 1.00 0.00 H new ATOM 0 HB2 GLU A 71 4.731 10.207 0.731 1.00 0.00 H new ATOM 0 HB3 GLU A 71 6.181 10.971 1.349 1.00 0.00 H new ATOM 0 HG2 GLU A 71 6.686 10.906 -1.388 1.00 0.00 H new ATOM 0 HG3 GLU A 71 4.952 11.157 -1.346 1.00 0.00 H new ATOM 1141 N ALA A 72 5.488 7.273 1.510 1.00 0.00 N ATOM 1142 CA ALA A 72 5.252 6.369 2.622 1.00 0.00 C ATOM 1143 C ALA A 72 5.787 4.980 2.268 1.00 0.00 C ATOM 1144 O ALA A 72 5.258 3.971 2.729 1.00 0.00 O ATOM 1145 CB ALA A 72 3.758 6.350 2.956 1.00 0.00 C ATOM 0 H ALA A 72 4.900 7.107 0.693 1.00 0.00 H new ATOM 0 HA ALA A 72 5.782 6.709 3.512 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.580 5.672 3.790 1.00 0.00 H new ATOM 0 HB2 ALA A 72 3.433 7.354 3.229 1.00 0.00 H new ATOM 0 HB3 ALA A 72 3.195 6.011 2.086 1.00 0.00 H new ATOM 1151 N SER A 73 6.831 4.974 1.451 1.00 0.00 N ATOM 1152 CA SER A 73 7.444 3.726 1.030 1.00 0.00 C ATOM 1153 C SER A 73 8.023 2.993 2.241 1.00 0.00 C ATOM 1154 O SER A 73 7.579 1.896 2.577 1.00 0.00 O ATOM 1155 CB SER A 73 8.536 3.974 -0.013 1.00 0.00 C ATOM 1156 OG SER A 73 9.756 3.321 0.327 1.00 0.00 O ATOM 0 H SER A 73 7.267 5.814 1.070 1.00 0.00 H new ATOM 0 HA SER A 73 6.675 3.104 0.571 1.00 0.00 H new ATOM 0 HB2 SER A 73 8.195 3.621 -0.986 1.00 0.00 H new ATOM 0 HB3 SER A 73 8.712 5.046 -0.106 1.00 0.00 H new ATOM 0 HG SER A 73 10.427 3.502 -0.364 1.00 0.00 H new ATOM 1162 N ASN A 74 9.005 3.627 2.863 1.00 0.00 N ATOM 1163 CA ASN A 74 9.650 3.049 4.030 1.00 0.00 C ATOM 1164 C ASN A 74 8.581 2.507 4.981 1.00 0.00 C ATOM 1165 O ASN A 74 8.719 1.407 5.514 1.00 0.00 O ATOM 1166 CB ASN A 74 10.467 4.098 4.786 1.00 0.00 C ATOM 1167 CG ASN A 74 11.935 4.062 4.358 1.00 0.00 C ATOM 1168 OD1 ASN A 74 12.793 3.522 5.037 1.00 0.00 O ATOM 1169 ND2 ASN A 74 12.176 4.666 3.198 1.00 0.00 N ATOM 0 H ASN A 74 9.371 4.536 2.581 1.00 0.00 H new ATOM 0 HA ASN A 74 10.313 2.254 3.689 1.00 0.00 H new ATOM 0 HB2 ASN A 74 10.054 5.089 4.599 1.00 0.00 H new ATOM 0 HB3 ASN A 74 10.393 3.918 5.859 1.00 0.00 H new ATOM 0 HD21 ASN A 74 13.125 4.697 2.827 1.00 0.00 H new ATOM 0 HD22 ASN A 74 11.411 5.099 2.680 1.00 0.00 H new ATOM 1176 N SER A 75 7.539 3.304 5.166 1.00 0.00 N ATOM 1177 CA SER A 75 6.448 2.919 6.043 1.00 0.00 C ATOM 1178 C SER A 75 5.729 1.693 5.477 1.00 0.00 C ATOM 1179 O SER A 75 5.490 0.722 6.194 1.00 0.00 O ATOM 1180 CB SER A 75 5.460 4.072 6.234 1.00 0.00 C ATOM 1181 OG SER A 75 5.725 4.810 7.424 1.00 0.00 O ATOM 0 H SER A 75 7.428 4.216 4.723 1.00 0.00 H new ATOM 0 HA SER A 75 6.866 2.670 7.018 1.00 0.00 H new ATOM 0 HB2 SER A 75 5.511 4.740 5.374 1.00 0.00 H new ATOM 0 HB3 SER A 75 4.445 3.677 6.271 1.00 0.00 H new ATOM 0 HG SER A 75 5.074 5.538 7.509 1.00 0.00 H new ATOM 1187 N ILE A 76 5.404 1.777 4.195 1.00 0.00 N ATOM 1188 CA ILE A 76 4.717 0.686 3.524 1.00 0.00 C ATOM 1189 C ILE A 76 5.397 -0.637 3.883 1.00 0.00 C ATOM 1190 O ILE A 76 6.576 -0.658 4.232 1.00 0.00 O ATOM 1191 CB ILE A 76 4.638 0.948 2.019 1.00 0.00 C ATOM 1192 CG1 ILE A 76 3.442 1.840 1.679 1.00 0.00 C ATOM 1193 CG2 ILE A 76 4.616 -0.365 1.234 1.00 0.00 C ATOM 1194 CD1 ILE A 76 3.420 2.183 0.188 1.00 0.00 C ATOM 0 H ILE A 76 5.604 2.583 3.603 1.00 0.00 H new ATOM 0 HA ILE A 76 3.685 0.618 3.867 1.00 0.00 H new ATOM 0 HB ILE A 76 5.537 1.487 1.719 1.00 0.00 H new ATOM 0 HG12 ILE A 76 2.517 1.333 1.953 1.00 0.00 H new ATOM 0 HG13 ILE A 76 3.489 2.757 2.266 1.00 0.00 H new ATOM 0 HG21 ILE A 76 4.560 -0.150 0.167 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.525 -0.929 1.443 1.00 0.00 H new ATOM 0 HG23 ILE A 76 3.748 -0.953 1.532 1.00 0.00 H new ATOM 0 HD11 ILE A 76 2.560 2.818 -0.027 1.00 0.00 H new ATOM 0 HD12 ILE A 76 4.336 2.711 -0.077 1.00 0.00 H new ATOM 0 HD13 ILE A 76 3.348 1.265 -0.395 1.00 0.00 H new ATOM 1206 N GLN A 77 4.624 -1.708 3.786 1.00 0.00 N ATOM 1207 CA GLN A 77 5.136 -3.032 4.096 1.00 0.00 C ATOM 1208 C GLN A 77 4.127 -4.103 3.678 1.00 0.00 C ATOM 1209 O GLN A 77 2.952 -4.025 4.030 1.00 0.00 O ATOM 1210 CB GLN A 77 5.479 -3.152 5.582 1.00 0.00 C ATOM 1211 CG GLN A 77 6.492 -4.274 5.822 1.00 0.00 C ATOM 1212 CD GLN A 77 7.135 -4.146 7.205 1.00 0.00 C ATOM 1213 OE1 GLN A 77 6.587 -4.562 8.213 1.00 0.00 O ATOM 1214 NE2 GLN A 77 8.323 -3.549 7.196 1.00 0.00 N ATOM 0 H GLN A 77 3.646 -1.686 3.497 1.00 0.00 H new ATOM 0 HA GLN A 77 6.055 -3.187 3.531 1.00 0.00 H new ATOM 0 HB2 GLN A 77 5.885 -2.207 5.943 1.00 0.00 H new ATOM 0 HB3 GLN A 77 4.572 -3.348 6.154 1.00 0.00 H new ATOM 0 HG2 GLN A 77 5.996 -5.241 5.736 1.00 0.00 H new ATOM 0 HG3 GLN A 77 7.264 -4.242 5.054 1.00 0.00 H new ATOM 0 HE21 GLN A 77 8.724 -3.225 6.316 1.00 0.00 H new ATOM 0 HE22 GLN A 77 8.833 -3.415 8.069 1.00 0.00 H new ATOM 1223 N PHE A 78 4.624 -5.079 2.932 1.00 0.00 N ATOM 1224 CA PHE A 78 3.781 -6.165 2.461 1.00 0.00 C ATOM 1225 C PHE A 78 3.773 -7.325 3.459 1.00 0.00 C ATOM 1226 O PHE A 78 4.689 -8.146 3.469 1.00 0.00 O ATOM 1227 CB PHE A 78 4.374 -6.651 1.137 1.00 0.00 C ATOM 1228 CG PHE A 78 3.941 -5.829 -0.078 1.00 0.00 C ATOM 1229 CD1 PHE A 78 4.159 -4.487 -0.104 1.00 0.00 C ATOM 1230 CD2 PHE A 78 3.337 -6.440 -1.132 1.00 0.00 C ATOM 1231 CE1 PHE A 78 3.756 -3.724 -1.232 1.00 0.00 C ATOM 1232 CE2 PHE A 78 2.934 -5.677 -2.260 1.00 0.00 C ATOM 1233 CZ PHE A 78 3.152 -4.335 -2.286 1.00 0.00 C ATOM 0 H PHE A 78 5.600 -5.140 2.642 1.00 0.00 H new ATOM 0 HA PHE A 78 2.755 -5.815 2.343 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.461 -6.630 1.208 1.00 0.00 H new ATOM 0 HB3 PHE A 78 4.085 -7.690 0.981 1.00 0.00 H new ATOM 0 HD1 PHE A 78 4.639 -4.001 0.733 1.00 0.00 H new ATOM 0 HD2 PHE A 78 3.164 -7.506 -1.111 1.00 0.00 H new ATOM 0 HE1 PHE A 78 3.929 -2.658 -1.253 1.00 0.00 H new ATOM 0 HE2 PHE A 78 2.454 -6.163 -3.097 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.845 -3.755 -3.144 1.00 0.00 H new ATOM 1243 N VAL A 79 2.729 -7.355 4.274 1.00 0.00 N ATOM 1244 CA VAL A 79 2.590 -8.401 5.274 1.00 0.00 C ATOM 1245 C VAL A 79 1.948 -9.632 4.631 1.00 0.00 C ATOM 1246 O VAL A 79 0.942 -9.519 3.933 1.00 0.00 O ATOM 1247 CB VAL A 79 1.803 -7.875 6.475 1.00 0.00 C ATOM 1248 CG1 VAL A 79 1.472 -9.005 7.452 1.00 0.00 C ATOM 1249 CG2 VAL A 79 2.563 -6.748 7.178 1.00 0.00 C ATOM 0 H VAL A 79 1.971 -6.672 4.263 1.00 0.00 H new ATOM 0 HA VAL A 79 3.568 -8.703 5.650 1.00 0.00 H new ATOM 0 HB VAL A 79 0.863 -7.466 6.105 1.00 0.00 H new ATOM 0 HG11 VAL A 79 0.912 -8.603 8.297 1.00 0.00 H new ATOM 0 HG12 VAL A 79 0.872 -9.760 6.945 1.00 0.00 H new ATOM 0 HG13 VAL A 79 2.396 -9.458 7.811 1.00 0.00 H new ATOM 0 HG21 VAL A 79 1.981 -6.392 8.028 1.00 0.00 H new ATOM 0 HG22 VAL A 79 3.526 -7.121 7.528 1.00 0.00 H new ATOM 0 HG23 VAL A 79 2.724 -5.927 6.479 1.00 0.00 H new ATOM 1259 N ILE A 80 2.557 -10.780 4.890 1.00 0.00 N ATOM 1260 CA ILE A 80 2.057 -12.031 4.346 1.00 0.00 C ATOM 1261 C ILE A 80 1.534 -12.906 5.487 1.00 0.00 C ATOM 1262 O ILE A 80 2.220 -13.102 6.489 1.00 0.00 O ATOM 1263 CB ILE A 80 3.130 -12.711 3.493 1.00 0.00 C ATOM 1264 CG1 ILE A 80 3.877 -11.688 2.635 1.00 0.00 C ATOM 1265 CG2 ILE A 80 2.528 -13.836 2.649 1.00 0.00 C ATOM 1266 CD1 ILE A 80 2.947 -11.059 1.596 1.00 0.00 C ATOM 0 H ILE A 80 3.392 -10.870 5.469 1.00 0.00 H new ATOM 0 HA ILE A 80 1.218 -11.846 3.675 1.00 0.00 H new ATOM 0 HB ILE A 80 3.861 -13.166 4.162 1.00 0.00 H new ATOM 0 HG12 ILE A 80 4.295 -10.909 3.273 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.715 -12.172 2.133 1.00 0.00 H new ATOM 0 HG21 ILE A 80 3.312 -14.303 2.052 1.00 0.00 H new ATOM 0 HG22 ILE A 80 2.078 -14.582 3.304 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.764 -13.426 1.988 1.00 0.00 H new ATOM 0 HD11 ILE A 80 3.504 -10.336 1.000 1.00 0.00 H new ATOM 0 HD12 ILE A 80 2.550 -11.837 0.944 1.00 0.00 H new ATOM 0 HD13 ILE A 80 2.124 -10.555 2.102 1.00 0.00 H new ATOM 1278 N LYS A 81 0.322 -13.408 5.298 1.00 0.00 N ATOM 1279 CA LYS A 81 -0.301 -14.257 6.298 1.00 0.00 C ATOM 1280 C LYS A 81 -0.440 -15.676 5.743 1.00 0.00 C ATOM 1281 O LYS A 81 -0.143 -16.649 6.434 1.00 0.00 O ATOM 1282 CB LYS A 81 -1.624 -13.648 6.769 1.00 0.00 C ATOM 1283 CG LYS A 81 -1.456 -12.166 7.107 1.00 0.00 C ATOM 1284 CD LYS A 81 -1.060 -11.979 8.573 1.00 0.00 C ATOM 1285 CE LYS A 81 -2.265 -11.564 9.418 1.00 0.00 C ATOM 1286 NZ LYS A 81 -3.416 -12.456 9.153 1.00 0.00 N ATOM 0 H LYS A 81 -0.245 -13.242 4.466 1.00 0.00 H new ATOM 0 HA LYS A 81 0.327 -14.323 7.186 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -2.379 -13.764 5.991 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -1.984 -14.186 7.646 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -0.695 -11.726 6.462 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -2.387 -11.636 6.908 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -0.641 -12.907 8.962 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -0.280 -11.221 8.649 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -2.005 -11.601 10.476 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -2.537 -10.533 9.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -4.159 -12.283 9.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -3.792 -12.265 8.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -3.107 -13.447 9.210 1.00 0.00 H new ATOM 1300 N ARG A 82 -0.893 -15.748 4.499 1.00 0.00 N ATOM 1301 CA ARG A 82 -1.075 -17.031 3.843 1.00 0.00 C ATOM 1302 C ARG A 82 -0.490 -16.992 2.430 1.00 0.00 C ATOM 1303 O ARG A 82 -1.169 -16.597 1.483 1.00 0.00 O ATOM 1304 CB ARG A 82 -2.556 -17.404 3.764 1.00 0.00 C ATOM 1305 CG ARG A 82 -3.152 -17.582 5.162 1.00 0.00 C ATOM 1306 CD ARG A 82 -4.536 -18.232 5.090 1.00 0.00 C ATOM 1307 NE ARG A 82 -4.458 -19.640 5.538 1.00 0.00 N ATOM 1308 CZ ARG A 82 -5.432 -20.542 5.354 1.00 0.00 C ATOM 1309 NH1 ARG A 82 -6.564 -20.188 4.730 1.00 0.00 N ATOM 1310 NH2 ARG A 82 -5.274 -21.797 5.795 1.00 0.00 N ATOM 0 H ARG A 82 -1.139 -14.939 3.929 1.00 0.00 H new ATOM 0 HA ARG A 82 -0.554 -17.783 4.435 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -3.102 -16.628 3.228 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.673 -18.326 3.195 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -2.488 -18.198 5.768 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -3.227 -16.613 5.655 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -5.238 -17.681 5.715 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -4.915 -18.187 4.069 1.00 0.00 H new ATOM 0 HE ARG A 82 -3.610 -19.943 6.017 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -6.684 -19.232 4.395 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -7.305 -20.875 4.590 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -4.413 -22.066 6.271 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -6.015 -22.484 5.655 1.00 0.00 H new ATOM 1324 N PRO A 83 0.798 -17.419 2.329 1.00 0.00 N ATOM 1325 CA PRO A 83 1.482 -17.437 1.047 1.00 0.00 C ATOM 1326 C PRO A 83 0.992 -18.598 0.180 1.00 0.00 C ATOM 1327 O PRO A 83 1.246 -18.630 -1.023 1.00 0.00 O ATOM 1328 CB PRO A 83 2.959 -17.533 1.391 1.00 0.00 C ATOM 1329 CG PRO A 83 3.021 -18.033 2.825 1.00 0.00 C ATOM 1330 CD PRO A 83 1.633 -17.894 3.428 1.00 0.00 C ATOM 0 HA PRO A 83 1.283 -16.546 0.451 1.00 0.00 H new ATOM 0 HB2 PRO A 83 3.474 -18.217 0.716 1.00 0.00 H new ATOM 0 HB3 PRO A 83 3.446 -16.563 1.294 1.00 0.00 H new ATOM 0 HG2 PRO A 83 3.347 -19.073 2.853 1.00 0.00 H new ATOM 0 HG3 PRO A 83 3.746 -17.456 3.399 1.00 0.00 H new ATOM 0 HD2 PRO A 83 1.273 -18.847 3.816 1.00 0.00 H new ATOM 0 HD3 PRO A 83 1.631 -17.190 4.260 1.00 0.00 H new ATOM 1338 N GLU A 84 0.299 -19.525 0.825 1.00 0.00 N ATOM 1339 CA GLU A 84 -0.228 -20.686 0.128 1.00 0.00 C ATOM 1340 C GLU A 84 -1.192 -20.249 -0.977 1.00 0.00 C ATOM 1341 O GLU A 84 -1.428 -20.992 -1.928 1.00 0.00 O ATOM 1342 CB GLU A 84 -0.911 -21.648 1.103 1.00 0.00 C ATOM 1343 CG GLU A 84 -2.184 -21.029 1.682 1.00 0.00 C ATOM 1344 CD GLU A 84 -2.963 -22.051 2.512 1.00 0.00 C ATOM 1345 OE1 GLU A 84 -2.362 -22.576 3.474 1.00 0.00 O ATOM 1346 OE2 GLU A 84 -4.141 -22.285 2.165 1.00 0.00 O ATOM 0 H GLU A 84 0.090 -19.496 1.823 1.00 0.00 H new ATOM 0 HA GLU A 84 0.605 -21.218 -0.332 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -1.155 -22.578 0.590 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -0.225 -21.900 1.911 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -1.925 -20.172 2.304 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.813 -20.658 0.873 1.00 0.00 H new ATOM 1353 N LEU A 85 -1.722 -19.046 -0.814 1.00 0.00 N ATOM 1354 CA LEU A 85 -2.655 -18.502 -1.785 1.00 0.00 C ATOM 1355 C LEU A 85 -1.905 -18.173 -3.078 1.00 0.00 C ATOM 1356 O LEU A 85 -2.371 -18.495 -4.170 1.00 0.00 O ATOM 1357 CB LEU A 85 -3.411 -17.310 -1.194 1.00 0.00 C ATOM 1358 CG LEU A 85 -4.267 -17.605 0.040 1.00 0.00 C ATOM 1359 CD1 LEU A 85 -4.763 -16.310 0.685 1.00 0.00 C ATOM 1360 CD2 LEU A 85 -5.419 -18.551 -0.305 1.00 0.00 C ATOM 0 H LEU A 85 -1.523 -18.433 -0.024 1.00 0.00 H new ATOM 0 HA LEU A 85 -3.416 -19.241 -2.035 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.687 -16.538 -0.933 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -4.056 -16.894 -1.968 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.643 -18.113 0.775 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -5.369 -16.548 1.559 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -3.909 -15.705 0.989 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -5.365 -15.753 -0.033 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -6.011 -18.744 0.589 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -6.050 -18.093 -1.067 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -5.017 -19.491 -0.684 1.00 0.00 H new ATOM 1372 N LEU A 86 -0.755 -17.536 -2.911 1.00 0.00 N ATOM 1373 CA LEU A 86 0.064 -17.160 -4.051 1.00 0.00 C ATOM 1374 C LEU A 86 0.170 -18.347 -5.011 1.00 0.00 C ATOM 1375 O LEU A 86 -0.539 -18.403 -6.015 1.00 0.00 O ATOM 1376 CB LEU A 86 1.419 -16.625 -3.583 1.00 0.00 C ATOM 1377 CG LEU A 86 1.375 -15.488 -2.560 1.00 0.00 C ATOM 1378 CD1 LEU A 86 2.786 -15.043 -2.174 1.00 0.00 C ATOM 1379 CD2 LEU A 86 0.526 -14.323 -3.072 1.00 0.00 C ATOM 0 H LEU A 86 -0.371 -17.271 -2.004 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.402 -16.344 -4.603 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.985 -17.452 -3.153 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.972 -16.280 -4.456 1.00 0.00 H new ATOM 0 HG LEU A 86 0.897 -15.861 -1.654 1.00 0.00 H new ATOM 0 HD11 LEU A 86 2.726 -14.234 -1.446 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.326 -15.884 -1.739 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.313 -14.694 -3.062 1.00 0.00 H new ATOM 0 HD21 LEU A 86 0.511 -13.528 -2.326 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.953 -13.942 -4.000 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.492 -14.668 -3.255 1.00 0.00 H new ATOM 1391 N THR A 87 1.061 -19.266 -4.669 1.00 0.00 N ATOM 1392 CA THR A 87 1.268 -20.449 -5.488 1.00 0.00 C ATOM 1393 C THR A 87 1.136 -20.099 -6.971 1.00 0.00 C ATOM 1394 O THR A 87 0.270 -20.631 -7.663 1.00 0.00 O ATOM 1395 CB THR A 87 0.281 -21.523 -5.026 1.00 0.00 C ATOM 1396 OG1 THR A 87 -0.986 -20.872 -5.069 1.00 0.00 O ATOM 1397 CG2 THR A 87 0.462 -21.889 -3.552 1.00 0.00 C ATOM 0 H THR A 87 1.648 -19.216 -3.836 1.00 0.00 H new ATOM 0 HA THR A 87 2.277 -20.843 -5.368 1.00 0.00 H new ATOM 0 HB THR A 87 0.403 -22.416 -5.639 1.00 0.00 H new ATOM 0 HG1 THR A 87 -1.071 -20.377 -5.910 1.00 0.00 H new ATOM 0 HG21 THR A 87 -0.263 -22.655 -3.276 1.00 0.00 H new ATOM 0 HG22 THR A 87 1.471 -22.270 -3.393 1.00 0.00 H new ATOM 0 HG23 THR A 87 0.307 -21.004 -2.936 1.00 0.00 H new ATOM 1405 N GLU A 88 2.009 -19.207 -7.416 1.00 0.00 N ATOM 1406 CA GLU A 88 2.001 -18.781 -8.805 1.00 0.00 C ATOM 1407 C GLU A 88 2.538 -19.895 -9.706 1.00 0.00 C ATOM 1408 O GLU A 88 3.122 -20.863 -9.221 1.00 0.00 O ATOM 1409 CB GLU A 88 2.806 -17.492 -8.988 1.00 0.00 C ATOM 1410 CG GLU A 88 1.891 -16.322 -9.357 1.00 0.00 C ATOM 1411 CD GLU A 88 2.561 -14.983 -9.043 1.00 0.00 C ATOM 1412 OE1 GLU A 88 3.100 -14.867 -7.921 1.00 0.00 O ATOM 1413 OE2 GLU A 88 2.519 -14.105 -9.932 1.00 0.00 O ATOM 0 H GLU A 88 2.726 -18.768 -6.839 1.00 0.00 H new ATOM 0 HA GLU A 88 0.971 -18.572 -9.094 1.00 0.00 H new ATOM 0 HB2 GLU A 88 3.344 -17.262 -8.069 1.00 0.00 H new ATOM 0 HB3 GLU A 88 3.554 -17.634 -9.768 1.00 0.00 H new ATOM 0 HG2 GLU A 88 1.644 -16.369 -10.418 1.00 0.00 H new ATOM 0 HG3 GLU A 88 0.953 -16.401 -8.807 1.00 0.00 H new ATOM 1420 N GLY A 89 2.321 -19.721 -11.001 1.00 0.00 N ATOM 1421 CA GLY A 89 2.776 -20.700 -11.974 1.00 0.00 C ATOM 1422 C GLY A 89 2.913 -20.071 -13.362 1.00 0.00 C ATOM 1423 O GLY A 89 2.030 -19.337 -13.804 1.00 0.00 O ATOM 0 H GLY A 89 1.836 -18.917 -11.399 1.00 0.00 H new ATOM 0 HA2 GLY A 89 3.736 -21.111 -11.661 1.00 0.00 H new ATOM 0 HA3 GLY A 89 2.072 -21.531 -12.015 1.00 0.00 H new ATOM 1427 N VAL A 90 4.025 -20.382 -14.010 1.00 0.00 N ATOM 1428 CA VAL A 90 4.289 -19.856 -15.339 1.00 0.00 C ATOM 1429 C VAL A 90 3.269 -20.434 -16.323 1.00 0.00 C ATOM 1430 O VAL A 90 3.006 -21.636 -16.315 1.00 0.00 O ATOM 1431 CB VAL A 90 5.737 -20.147 -15.739 1.00 0.00 C ATOM 1432 CG1 VAL A 90 5.970 -21.651 -15.899 1.00 0.00 C ATOM 1433 CG2 VAL A 90 6.114 -19.395 -17.017 1.00 0.00 C ATOM 0 H VAL A 90 4.754 -20.992 -13.640 1.00 0.00 H new ATOM 0 HA VAL A 90 4.174 -18.772 -15.351 1.00 0.00 H new ATOM 0 HB VAL A 90 6.384 -19.791 -14.937 1.00 0.00 H new ATOM 0 HG11 VAL A 90 7.007 -21.830 -16.184 1.00 0.00 H new ATOM 0 HG12 VAL A 90 5.761 -22.154 -14.955 1.00 0.00 H new ATOM 0 HG13 VAL A 90 5.309 -22.041 -16.673 1.00 0.00 H new ATOM 0 HG21 VAL A 90 7.148 -19.619 -17.279 1.00 0.00 H new ATOM 0 HG22 VAL A 90 5.458 -19.707 -17.830 1.00 0.00 H new ATOM 0 HG23 VAL A 90 6.005 -18.323 -16.854 1.00 0.00 H new ATOM 1443 N LYS A 91 2.723 -19.552 -17.146 1.00 0.00 N ATOM 1444 CA LYS A 91 1.739 -19.959 -18.134 1.00 0.00 C ATOM 1445 C LYS A 91 2.079 -19.320 -19.482 1.00 0.00 C ATOM 1446 O LYS A 91 2.767 -18.301 -19.533 1.00 0.00 O ATOM 1447 CB LYS A 91 0.325 -19.642 -17.643 1.00 0.00 C ATOM 1448 CG LYS A 91 -0.627 -20.807 -17.925 1.00 0.00 C ATOM 1449 CD LYS A 91 -1.985 -20.579 -17.256 1.00 0.00 C ATOM 1450 CE LYS A 91 -3.127 -20.779 -18.253 1.00 0.00 C ATOM 1451 NZ LYS A 91 -4.135 -21.715 -17.707 1.00 0.00 N ATOM 0 H LYS A 91 2.943 -18.556 -17.149 1.00 0.00 H new ATOM 0 HA LYS A 91 1.768 -21.039 -18.277 1.00 0.00 H new ATOM 0 HB2 LYS A 91 0.345 -19.435 -16.573 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -0.041 -18.741 -18.135 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -0.762 -20.919 -19.001 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -0.189 -21.736 -17.560 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -2.103 -21.268 -16.420 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -2.028 -19.570 -16.846 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -3.595 -19.820 -18.475 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -2.733 -21.167 -19.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -4.903 -21.839 -18.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -3.688 -22.635 -17.517 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -4.523 -21.330 -16.822 1.00 0.00 H new ATOM 1465 N GLU A 92 1.582 -19.944 -20.539 1.00 0.00 N ATOM 1466 CA GLU A 92 1.826 -19.448 -21.883 1.00 0.00 C ATOM 1467 C GLU A 92 0.935 -20.181 -22.889 1.00 0.00 C ATOM 1468 O GLU A 92 1.308 -21.235 -23.401 1.00 0.00 O ATOM 1469 CB GLU A 92 3.303 -19.584 -22.259 1.00 0.00 C ATOM 1470 CG GLU A 92 3.578 -18.971 -23.634 1.00 0.00 C ATOM 1471 CD GLU A 92 4.951 -19.396 -24.158 1.00 0.00 C ATOM 1472 OE1 GLU A 92 5.927 -19.225 -23.397 1.00 0.00 O ATOM 1473 OE2 GLU A 92 4.993 -19.881 -25.309 1.00 0.00 O ATOM 0 H GLU A 92 1.012 -20.788 -20.493 1.00 0.00 H new ATOM 0 HA GLU A 92 1.575 -18.388 -21.909 1.00 0.00 H new ATOM 0 HB2 GLU A 92 3.920 -19.092 -21.507 1.00 0.00 H new ATOM 0 HB3 GLU A 92 3.585 -20.637 -22.263 1.00 0.00 H new ATOM 0 HG2 GLU A 92 2.804 -19.282 -24.336 1.00 0.00 H new ATOM 0 HG3 GLU A 92 3.530 -17.884 -23.568 1.00 0.00 H new ATOM 1480 N PRO A 93 -0.257 -19.578 -23.147 1.00 0.00 N ATOM 1481 CA PRO A 93 -1.204 -20.162 -24.082 1.00 0.00 C ATOM 1482 C PRO A 93 -0.746 -19.955 -25.527 1.00 0.00 C ATOM 1483 O PRO A 93 -0.272 -18.877 -25.883 1.00 0.00 O ATOM 1484 CB PRO A 93 -2.528 -19.483 -23.775 1.00 0.00 C ATOM 1485 CG PRO A 93 -2.181 -18.219 -23.004 1.00 0.00 C ATOM 1486 CD PRO A 93 -0.732 -18.329 -22.558 1.00 0.00 C ATOM 0 HA PRO A 93 -1.291 -21.243 -23.973 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -3.067 -19.245 -24.692 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -3.174 -20.135 -23.186 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -2.322 -17.339 -23.631 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -2.838 -18.105 -22.142 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -0.145 -17.479 -22.906 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -0.653 -18.348 -21.471 1.00 0.00 H new ATOM 1494 N SER A 94 -0.904 -21.004 -26.320 1.00 0.00 N ATOM 1495 CA SER A 94 -0.514 -20.951 -27.718 1.00 0.00 C ATOM 1496 C SER A 94 -1.137 -22.122 -28.481 1.00 0.00 C ATOM 1497 O SER A 94 -1.327 -23.201 -27.922 1.00 0.00 O ATOM 1498 CB SER A 94 1.009 -20.972 -27.866 1.00 0.00 C ATOM 1499 OG SER A 94 1.468 -20.005 -28.806 1.00 0.00 O ATOM 0 H SER A 94 -1.297 -21.896 -26.021 1.00 0.00 H new ATOM 0 HA SER A 94 -0.881 -20.015 -28.139 1.00 0.00 H new ATOM 0 HB2 SER A 94 1.470 -20.782 -26.897 1.00 0.00 H new ATOM 0 HB3 SER A 94 1.329 -21.965 -28.182 1.00 0.00 H new ATOM 0 HG SER A 94 2.445 -20.049 -28.870 1.00 0.00 H new ATOM 1505 N GLY A 95 -1.439 -21.869 -29.746 1.00 0.00 N ATOM 1506 CA GLY A 95 -2.037 -22.889 -30.591 1.00 0.00 C ATOM 1507 C GLY A 95 -1.303 -22.991 -31.930 1.00 0.00 C ATOM 1508 O GLY A 95 -0.208 -22.452 -32.085 1.00 0.00 O ATOM 0 H GLY A 95 -1.281 -20.973 -30.206 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -2.007 -23.852 -30.081 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -3.087 -22.653 -30.765 1.00 0.00 H new ATOM 1512 N PRO A 96 -1.952 -23.706 -32.887 1.00 0.00 N ATOM 1513 CA PRO A 96 -1.373 -23.886 -34.208 1.00 0.00 C ATOM 1514 C PRO A 96 -1.488 -22.605 -35.037 1.00 0.00 C ATOM 1515 O PRO A 96 -0.584 -22.273 -35.802 1.00 0.00 O ATOM 1516 CB PRO A 96 -2.132 -25.056 -34.814 1.00 0.00 C ATOM 1517 CG PRO A 96 -3.411 -25.187 -34.004 1.00 0.00 C ATOM 1518 CD PRO A 96 -3.249 -24.359 -32.740 1.00 0.00 C ATOM 0 HA PRO A 96 -0.304 -24.097 -34.173 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -2.353 -24.876 -35.866 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -1.543 -25.972 -34.764 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -4.266 -24.838 -34.582 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -3.600 -26.231 -33.755 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -4.051 -23.628 -32.640 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -3.277 -24.987 -31.849 1.00 0.00 H new ATOM 1526 N SER A 97 -2.608 -21.920 -34.856 1.00 0.00 N ATOM 1527 CA SER A 97 -2.853 -20.683 -35.578 1.00 0.00 C ATOM 1528 C SER A 97 -2.916 -20.958 -37.081 1.00 0.00 C ATOM 1529 O SER A 97 -2.170 -21.790 -37.596 1.00 0.00 O ATOM 1530 CB SER A 97 -1.772 -19.644 -35.273 1.00 0.00 C ATOM 1531 OG SER A 97 -2.098 -18.853 -34.133 1.00 0.00 O ATOM 0 H SER A 97 -3.355 -22.198 -34.220 1.00 0.00 H new ATOM 0 HA SER A 97 -3.810 -20.279 -35.249 1.00 0.00 H new ATOM 0 HB2 SER A 97 -0.821 -20.149 -35.104 1.00 0.00 H new ATOM 0 HB3 SER A 97 -1.639 -18.995 -36.138 1.00 0.00 H new ATOM 0 HG SER A 97 -1.383 -18.203 -33.970 1.00 0.00 H new ATOM 1537 N SER A 98 -3.813 -20.243 -37.744 1.00 0.00 N ATOM 1538 CA SER A 98 -3.983 -20.399 -39.179 1.00 0.00 C ATOM 1539 C SER A 98 -4.254 -19.039 -39.825 1.00 0.00 C ATOM 1540 O SER A 98 -5.362 -18.512 -39.729 1.00 0.00 O ATOM 1541 CB SER A 98 -5.120 -21.373 -39.496 1.00 0.00 C ATOM 1542 OG SER A 98 -4.755 -22.309 -40.506 1.00 0.00 O ATOM 0 H SER A 98 -4.430 -19.554 -37.314 1.00 0.00 H new ATOM 0 HA SER A 98 -3.062 -20.812 -39.590 1.00 0.00 H new ATOM 0 HB2 SER A 98 -5.401 -21.909 -38.590 1.00 0.00 H new ATOM 0 HB3 SER A 98 -5.997 -20.813 -39.821 1.00 0.00 H new ATOM 0 HG SER A 98 -5.507 -22.914 -40.678 1.00 0.00 H new ATOM 1548 N GLY A 99 -3.224 -18.510 -40.468 1.00 0.00 N ATOM 1549 CA GLY A 99 -3.337 -17.221 -41.130 1.00 0.00 C ATOM 1550 C GLY A 99 -2.074 -16.905 -41.934 1.00 0.00 C ATOM 1551 O GLY A 99 -0.996 -17.411 -41.627 1.00 0.00 O ATOM 0 H GLY A 99 -2.307 -18.950 -40.545 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -4.203 -17.223 -41.792 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -3.505 -16.440 -40.388 1.00 0.00 H new TER 1555 GLY A 99