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 36 LYS NZ :NH3+ -163:sc= 0 (180deg=0) USER MOD Set 1.2: A 39 MET CE :methyl -166:sc=-0.00248 (180deg=-0.215) USER MOD Single : A 1 GLY N :NH3+ 135:sc= 0.0133 (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 51:sc= 0.641 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN : amide:sc= -0.274 K(o=-0.27,f=-2.6!) USER MOD Single : A 17 ASN : amide:sc= -1.46 K(o=-1.5,f=-0.31) USER MOD Single : A 18 THR OG1 : rot 113:sc= -0.349 USER MOD Single : A 20 TYR OH : rot 180:sc= -2.17! 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 USER MOD Single : A 35 SER OG : rot 180:sc= 0.0939 USER MOD Single : A 40 HIS : no HD1:sc= -4.98! C(o=-5!,f=-4.8!) USER MOD Single : A 54 SER OG : rot 180:sc= 0.00196 USER MOD Single : A 59 ASN : amide:sc= -5.22! C(o=-5.2!,f=-11!) USER MOD Single : A 60 CYS SG : rot -35:sc= 0.0166 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= -0.461 USER MOD Single : A 74 ASN : amide:sc= -0.0348 X(o=-0.035,f=-0.19) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= -0.0268 X(o=-0.027,f=-0.19) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 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 14.017 4.692 -15.387 1.00 0.00 N ATOM 2 CA GLY A 1 13.317 5.507 -14.409 1.00 0.00 C ATOM 3 C GLY A 1 13.117 6.933 -14.927 1.00 0.00 C ATOM 4 O GLY A 1 14.016 7.507 -15.540 1.00 0.00 O ATOM 0 H1 GLY A 1 14.760 4.141 -14.912 1.00 0.00 H new ATOM 0 H2 GLY A 1 13.344 4.044 -15.844 1.00 0.00 H new ATOM 0 H3 GLY A 1 14.449 5.307 -16.106 1.00 0.00 H new ATOM 0 HA2 GLY A 1 12.349 5.059 -14.183 1.00 0.00 H new ATOM 0 HA3 GLY A 1 13.883 5.530 -13.478 1.00 0.00 H new ATOM 8 N SER A 2 11.932 7.463 -14.661 1.00 0.00 N ATOM 9 CA SER A 2 11.602 8.811 -15.092 1.00 0.00 C ATOM 10 C SER A 2 11.665 8.903 -16.618 1.00 0.00 C ATOM 11 O SER A 2 12.719 8.681 -17.214 1.00 0.00 O ATOM 12 CB SER A 2 12.543 9.838 -14.460 1.00 0.00 C ATOM 13 OG SER A 2 11.990 10.414 -13.280 1.00 0.00 O ATOM 0 H SER A 2 11.189 6.984 -14.153 1.00 0.00 H new ATOM 0 HA SER A 2 10.588 9.036 -14.762 1.00 0.00 H new ATOM 0 HB2 SER A 2 13.492 9.360 -14.219 1.00 0.00 H new ATOM 0 HB3 SER A 2 12.757 10.626 -15.182 1.00 0.00 H new ATOM 0 HG SER A 2 12.622 11.063 -12.906 1.00 0.00 H new ATOM 19 N SER A 3 10.524 9.229 -17.208 1.00 0.00 N ATOM 20 CA SER A 3 10.437 9.352 -18.653 1.00 0.00 C ATOM 21 C SER A 3 9.101 9.988 -19.044 1.00 0.00 C ATOM 22 O SER A 3 9.073 11.048 -19.667 1.00 0.00 O ATOM 23 CB SER A 3 10.595 7.990 -19.332 1.00 0.00 C ATOM 24 OG SER A 3 10.692 8.109 -20.749 1.00 0.00 O ATOM 0 H SER A 3 9.652 9.412 -16.711 1.00 0.00 H new ATOM 0 HA SER A 3 11.251 9.993 -18.992 1.00 0.00 H new ATOM 0 HB2 SER A 3 11.487 7.494 -18.948 1.00 0.00 H new ATOM 0 HB3 SER A 3 9.744 7.357 -19.078 1.00 0.00 H new ATOM 0 HG SER A 3 10.794 7.219 -21.146 1.00 0.00 H new ATOM 30 N GLY A 4 8.027 9.314 -18.661 1.00 0.00 N ATOM 31 CA GLY A 4 6.691 9.800 -18.964 1.00 0.00 C ATOM 32 C GLY A 4 6.232 10.824 -17.924 1.00 0.00 C ATOM 33 O GLY A 4 7.026 11.279 -17.102 1.00 0.00 O ATOM 0 H GLY A 4 8.054 8.435 -18.144 1.00 0.00 H new ATOM 0 HA2 GLY A 4 6.681 10.253 -19.955 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.993 8.963 -18.989 1.00 0.00 H new ATOM 37 N SER A 5 4.951 11.157 -17.995 1.00 0.00 N ATOM 38 CA SER A 5 4.376 12.119 -17.070 1.00 0.00 C ATOM 39 C SER A 5 4.340 11.531 -15.658 1.00 0.00 C ATOM 40 O SER A 5 5.092 11.960 -14.783 1.00 0.00 O ATOM 41 CB SER A 5 2.970 12.533 -17.509 1.00 0.00 C ATOM 42 OG SER A 5 2.695 13.897 -17.203 1.00 0.00 O ATOM 0 H SER A 5 4.296 10.778 -18.678 1.00 0.00 H new ATOM 0 HA SER A 5 5.004 13.010 -17.069 1.00 0.00 H new ATOM 0 HB2 SER A 5 2.864 12.374 -18.582 1.00 0.00 H new ATOM 0 HB3 SER A 5 2.235 11.896 -17.018 1.00 0.00 H new ATOM 0 HG SER A 5 1.789 14.123 -17.500 1.00 0.00 H new ATOM 48 N SER A 6 3.459 10.558 -15.479 1.00 0.00 N ATOM 49 CA SER A 6 3.315 9.907 -14.188 1.00 0.00 C ATOM 50 C SER A 6 4.410 8.854 -14.009 1.00 0.00 C ATOM 51 O SER A 6 4.141 7.655 -14.076 1.00 0.00 O ATOM 52 CB SER A 6 1.933 9.265 -14.047 1.00 0.00 C ATOM 53 OG SER A 6 1.702 8.270 -15.040 1.00 0.00 O ATOM 0 H SER A 6 2.838 10.205 -16.207 1.00 0.00 H new ATOM 0 HA SER A 6 3.416 10.663 -13.409 1.00 0.00 H new ATOM 0 HB2 SER A 6 1.841 8.818 -13.057 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.166 10.036 -14.121 1.00 0.00 H new ATOM 0 HG SER A 6 2.453 7.640 -15.053 1.00 0.00 H new ATOM 59 N GLY A 7 5.622 9.339 -13.783 1.00 0.00 N ATOM 60 CA GLY A 7 6.759 8.455 -13.593 1.00 0.00 C ATOM 61 C GLY A 7 6.656 7.708 -12.262 1.00 0.00 C ATOM 62 O GLY A 7 7.479 6.842 -11.967 1.00 0.00 O ATOM 0 H GLY A 7 5.841 10.334 -13.727 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.808 7.739 -14.413 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.682 9.034 -13.619 1.00 0.00 H new ATOM 66 N LEU A 8 5.640 8.070 -11.494 1.00 0.00 N ATOM 67 CA LEU A 8 5.418 7.445 -10.201 1.00 0.00 C ATOM 68 C LEU A 8 5.144 5.953 -10.401 1.00 0.00 C ATOM 69 O LEU A 8 5.720 5.114 -9.710 1.00 0.00 O ATOM 70 CB LEU A 8 4.315 8.176 -9.434 1.00 0.00 C ATOM 71 CG LEU A 8 4.411 9.703 -9.413 1.00 0.00 C ATOM 72 CD1 LEU A 8 3.176 10.321 -8.755 1.00 0.00 C ATOM 73 CD2 LEU A 8 5.708 10.162 -8.745 1.00 0.00 C ATOM 0 H LEU A 8 4.960 8.789 -11.742 1.00 0.00 H new ATOM 0 HA LEU A 8 6.311 7.525 -9.581 1.00 0.00 H new ATOM 0 HB2 LEU A 8 3.354 7.898 -9.867 1.00 0.00 H new ATOM 0 HB3 LEU A 8 4.317 7.818 -8.405 1.00 0.00 H new ATOM 0 HG LEU A 8 4.438 10.058 -10.443 1.00 0.00 H new ATOM 0 HD11 LEU A 8 3.270 11.407 -8.753 1.00 0.00 H new ATOM 0 HD12 LEU A 8 2.285 10.035 -9.313 1.00 0.00 H new ATOM 0 HD13 LEU A 8 3.092 9.962 -7.729 1.00 0.00 H new ATOM 0 HD21 LEU A 8 5.751 11.251 -8.743 1.00 0.00 H new ATOM 0 HD22 LEU A 8 5.738 9.796 -7.719 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.561 9.766 -9.296 1.00 0.00 H new ATOM 85 N ARG A 9 4.264 5.668 -11.349 1.00 0.00 N ATOM 86 CA ARG A 9 3.906 4.292 -11.649 1.00 0.00 C ATOM 87 C ARG A 9 5.136 3.389 -11.544 1.00 0.00 C ATOM 88 O ARG A 9 5.148 2.438 -10.763 1.00 0.00 O ATOM 89 CB ARG A 9 3.311 4.171 -13.054 1.00 0.00 C ATOM 90 CG ARG A 9 2.074 5.059 -13.204 1.00 0.00 C ATOM 91 CD ARG A 9 1.171 4.556 -14.332 1.00 0.00 C ATOM 92 NE ARG A 9 1.521 5.235 -15.600 1.00 0.00 N ATOM 93 CZ ARG A 9 2.491 4.825 -16.429 1.00 0.00 C ATOM 94 NH1 ARG A 9 3.213 3.737 -16.129 1.00 0.00 N ATOM 95 NH2 ARG A 9 2.738 5.502 -17.558 1.00 0.00 N ATOM 0 H ARG A 9 3.788 6.367 -11.920 1.00 0.00 H new ATOM 0 HA ARG A 9 3.157 3.978 -10.922 1.00 0.00 H new ATOM 0 HB2 ARG A 9 4.058 4.454 -13.795 1.00 0.00 H new ATOM 0 HB3 ARG A 9 3.044 3.133 -13.252 1.00 0.00 H new ATOM 0 HG2 ARG A 9 1.517 5.074 -12.267 1.00 0.00 H new ATOM 0 HG3 ARG A 9 2.381 6.085 -13.409 1.00 0.00 H new ATOM 0 HD2 ARG A 9 1.282 3.478 -14.445 1.00 0.00 H new ATOM 0 HD3 ARG A 9 0.126 4.745 -14.085 1.00 0.00 H new ATOM 0 HE ARG A 9 0.991 6.067 -15.859 1.00 0.00 H new ATOM 0 HH11 ARG A 9 3.024 3.221 -15.270 1.00 0.00 H new ATOM 0 HH12 ARG A 9 3.951 3.425 -16.760 1.00 0.00 H new ATOM 0 HH21 ARG A 9 2.188 6.330 -17.787 1.00 0.00 H new ATOM 0 HH22 ARG A 9 3.476 5.190 -18.189 1.00 0.00 H new ATOM 109 N LYS A 10 6.141 3.717 -12.342 1.00 0.00 N ATOM 110 CA LYS A 10 7.373 2.947 -12.349 1.00 0.00 C ATOM 111 C LYS A 10 7.934 2.877 -10.927 1.00 0.00 C ATOM 112 O LYS A 10 8.280 1.800 -10.445 1.00 0.00 O ATOM 113 CB LYS A 10 8.358 3.520 -13.370 1.00 0.00 C ATOM 114 CG LYS A 10 7.718 3.611 -14.757 1.00 0.00 C ATOM 115 CD LYS A 10 8.781 3.806 -15.840 1.00 0.00 C ATOM 116 CE LYS A 10 8.154 3.783 -17.235 1.00 0.00 C ATOM 117 NZ LYS A 10 9.183 3.509 -18.262 1.00 0.00 N ATOM 0 H LYS A 10 6.127 4.506 -12.989 1.00 0.00 H new ATOM 0 HA LYS A 10 7.179 1.923 -12.667 1.00 0.00 H new ATOM 0 HB2 LYS A 10 8.684 4.510 -13.050 1.00 0.00 H new ATOM 0 HB3 LYS A 10 9.247 2.891 -13.416 1.00 0.00 H new ATOM 0 HG2 LYS A 10 7.150 2.703 -14.959 1.00 0.00 H new ATOM 0 HG3 LYS A 10 7.012 4.441 -14.782 1.00 0.00 H new ATOM 0 HD2 LYS A 10 9.294 4.755 -15.684 1.00 0.00 H new ATOM 0 HD3 LYS A 10 9.533 3.020 -15.762 1.00 0.00 H new ATOM 0 HE2 LYS A 10 7.377 3.020 -17.278 1.00 0.00 H new ATOM 0 HE3 LYS A 10 7.673 4.740 -17.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 8.740 3.497 -19.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 9.910 4.252 -18.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 9.623 2.585 -18.075 1.00 0.00 H new ATOM 131 N GLN A 11 8.005 4.039 -10.295 1.00 0.00 N ATOM 132 CA GLN A 11 8.517 4.124 -8.938 1.00 0.00 C ATOM 133 C GLN A 11 7.714 3.211 -8.010 1.00 0.00 C ATOM 134 O GLN A 11 8.284 2.375 -7.310 1.00 0.00 O ATOM 135 CB GLN A 11 8.501 5.568 -8.435 1.00 0.00 C ATOM 136 CG GLN A 11 9.050 6.525 -9.495 1.00 0.00 C ATOM 137 CD GLN A 11 10.096 7.467 -8.896 1.00 0.00 C ATOM 138 OE1 GLN A 11 10.636 7.237 -7.826 1.00 0.00 O ATOM 139 NE2 GLN A 11 10.351 8.538 -9.642 1.00 0.00 N ATOM 0 H GLN A 11 7.716 4.930 -10.698 1.00 0.00 H new ATOM 0 HA GLN A 11 9.554 3.787 -8.940 1.00 0.00 H new ATOM 0 HB2 GLN A 11 7.482 5.855 -8.174 1.00 0.00 H new ATOM 0 HB3 GLN A 11 9.097 5.647 -7.526 1.00 0.00 H new ATOM 0 HG2 GLN A 11 9.494 5.954 -10.310 1.00 0.00 H new ATOM 0 HG3 GLN A 11 8.233 7.107 -9.922 1.00 0.00 H new ATOM 0 HE21 GLN A 11 9.863 8.670 -10.528 1.00 0.00 H new ATOM 0 HE22 GLN A 11 11.034 9.227 -9.328 1.00 0.00 H new ATOM 148 N VAL A 12 6.403 3.401 -8.034 1.00 0.00 N ATOM 149 CA VAL A 12 5.516 2.605 -7.203 1.00 0.00 C ATOM 150 C VAL A 12 5.823 1.121 -7.412 1.00 0.00 C ATOM 151 O VAL A 12 6.198 0.423 -6.471 1.00 0.00 O ATOM 152 CB VAL A 12 4.058 2.962 -7.504 1.00 0.00 C ATOM 153 CG1 VAL A 12 3.101 2.067 -6.713 1.00 0.00 C ATOM 154 CG2 VAL A 12 3.786 4.441 -7.221 1.00 0.00 C ATOM 0 H VAL A 12 5.934 4.095 -8.616 1.00 0.00 H new ATOM 0 HA VAL A 12 5.680 2.825 -6.148 1.00 0.00 H new ATOM 0 HB VAL A 12 3.882 2.786 -8.565 1.00 0.00 H new ATOM 0 HG11 VAL A 12 2.072 2.341 -6.945 1.00 0.00 H new ATOM 0 HG12 VAL A 12 3.269 1.025 -6.985 1.00 0.00 H new ATOM 0 HG13 VAL A 12 3.280 2.197 -5.646 1.00 0.00 H new ATOM 0 HG21 VAL A 12 2.743 4.668 -7.443 1.00 0.00 H new ATOM 0 HG22 VAL A 12 3.988 4.654 -6.171 1.00 0.00 H new ATOM 0 HG23 VAL A 12 4.433 5.056 -7.847 1.00 0.00 H new ATOM 164 N GLU A 13 5.654 0.683 -8.651 1.00 0.00 N ATOM 165 CA GLU A 13 5.909 -0.705 -8.995 1.00 0.00 C ATOM 166 C GLU A 13 7.137 -1.222 -8.243 1.00 0.00 C ATOM 167 O GLU A 13 7.083 -2.274 -7.609 1.00 0.00 O ATOM 168 CB GLU A 13 6.081 -0.873 -10.506 1.00 0.00 C ATOM 169 CG GLU A 13 4.821 -0.430 -11.254 1.00 0.00 C ATOM 170 CD GLU A 13 4.361 -1.507 -12.239 1.00 0.00 C ATOM 171 OE1 GLU A 13 4.996 -1.605 -13.311 1.00 0.00 O ATOM 172 OE2 GLU A 13 3.385 -2.209 -11.897 1.00 0.00 O ATOM 0 H GLU A 13 5.344 1.265 -9.429 1.00 0.00 H new ATOM 0 HA GLU A 13 5.046 -1.298 -8.692 1.00 0.00 H new ATOM 0 HB2 GLU A 13 6.935 -0.287 -10.846 1.00 0.00 H new ATOM 0 HB3 GLU A 13 6.298 -1.916 -10.737 1.00 0.00 H new ATOM 0 HG2 GLU A 13 4.024 -0.221 -10.540 1.00 0.00 H new ATOM 0 HG3 GLU A 13 5.020 0.498 -11.791 1.00 0.00 H new ATOM 179 N LEU A 14 8.214 -0.457 -8.339 1.00 0.00 N ATOM 180 CA LEU A 14 9.454 -0.825 -7.675 1.00 0.00 C ATOM 181 C LEU A 14 9.203 -0.954 -6.171 1.00 0.00 C ATOM 182 O LEU A 14 9.621 -1.930 -5.550 1.00 0.00 O ATOM 183 CB LEU A 14 10.565 0.165 -8.030 1.00 0.00 C ATOM 184 CG LEU A 14 11.965 -0.187 -7.521 1.00 0.00 C ATOM 185 CD1 LEU A 14 12.379 -1.587 -7.977 1.00 0.00 C ATOM 186 CD2 LEU A 14 12.983 0.877 -7.936 1.00 0.00 C ATOM 0 H LEU A 14 8.254 0.415 -8.866 1.00 0.00 H new ATOM 0 HA LEU A 14 9.800 -1.797 -8.025 1.00 0.00 H new ATOM 0 HB2 LEU A 14 10.608 0.259 -9.115 1.00 0.00 H new ATOM 0 HB3 LEU A 14 10.292 1.144 -7.636 1.00 0.00 H new ATOM 0 HG LEU A 14 11.939 -0.199 -6.431 1.00 0.00 H new ATOM 0 HD11 LEU A 14 13.377 -1.812 -7.602 1.00 0.00 H new ATOM 0 HD12 LEU A 14 11.672 -2.320 -7.589 1.00 0.00 H new ATOM 0 HD13 LEU A 14 12.383 -1.629 -9.066 1.00 0.00 H new ATOM 0 HD21 LEU A 14 13.969 0.603 -7.562 1.00 0.00 H new ATOM 0 HD22 LEU A 14 13.014 0.946 -9.023 1.00 0.00 H new ATOM 0 HD23 LEU A 14 12.692 1.841 -7.519 1.00 0.00 H new ATOM 198 N LEU A 15 8.522 0.045 -5.629 1.00 0.00 N ATOM 199 CA LEU A 15 8.211 0.055 -4.210 1.00 0.00 C ATOM 200 C LEU A 15 7.485 -1.240 -3.842 1.00 0.00 C ATOM 201 O LEU A 15 7.977 -2.024 -3.032 1.00 0.00 O ATOM 202 CB LEU A 15 7.435 1.321 -3.840 1.00 0.00 C ATOM 203 CG LEU A 15 6.815 1.344 -2.442 1.00 0.00 C ATOM 204 CD1 LEU A 15 7.889 1.195 -1.363 1.00 0.00 C ATOM 205 CD2 LEU A 15 5.968 2.601 -2.238 1.00 0.00 C ATOM 0 H LEU A 15 8.177 0.853 -6.147 1.00 0.00 H new ATOM 0 HA LEU A 15 9.127 0.086 -3.620 1.00 0.00 H new ATOM 0 HB2 LEU A 15 8.107 2.175 -3.932 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.639 1.462 -4.571 1.00 0.00 H new ATOM 0 HG LEU A 15 6.147 0.488 -2.351 1.00 0.00 H new ATOM 0 HD11 LEU A 15 7.421 1.215 -0.379 1.00 0.00 H new ATOM 0 HD12 LEU A 15 8.411 0.248 -1.498 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.601 2.016 -1.443 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.539 2.592 -1.236 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.594 3.485 -2.357 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.166 2.623 -2.976 1.00 0.00 H new ATOM 217 N PHE A 16 6.325 -1.425 -4.456 1.00 0.00 N ATOM 218 CA PHE A 16 5.526 -2.612 -4.203 1.00 0.00 C ATOM 219 C PHE A 16 6.334 -3.884 -4.467 1.00 0.00 C ATOM 220 O PHE A 16 6.482 -4.725 -3.581 1.00 0.00 O ATOM 221 CB PHE A 16 4.340 -2.567 -5.168 1.00 0.00 C ATOM 222 CG PHE A 16 3.302 -1.495 -4.829 1.00 0.00 C ATOM 223 CD1 PHE A 16 3.531 -0.625 -3.809 1.00 0.00 C ATOM 224 CD2 PHE A 16 2.149 -1.413 -5.546 1.00 0.00 C ATOM 225 CE1 PHE A 16 2.568 0.370 -3.494 1.00 0.00 C ATOM 226 CE2 PHE A 16 1.186 -0.418 -5.231 1.00 0.00 C ATOM 227 CZ PHE A 16 1.416 0.452 -4.212 1.00 0.00 C ATOM 0 H PHE A 16 5.920 -0.773 -5.128 1.00 0.00 H new ATOM 0 HA PHE A 16 5.204 -2.628 -3.162 1.00 0.00 H new ATOM 0 HB2 PHE A 16 4.712 -2.391 -6.177 1.00 0.00 H new ATOM 0 HB3 PHE A 16 3.852 -3.542 -5.174 1.00 0.00 H new ATOM 0 HD1 PHE A 16 4.446 -0.691 -3.238 1.00 0.00 H new ATOM 0 HD2 PHE A 16 1.966 -2.105 -6.355 1.00 0.00 H new ATOM 0 HE1 PHE A 16 2.750 1.061 -2.685 1.00 0.00 H new ATOM 0 HE2 PHE A 16 0.271 -0.352 -5.801 1.00 0.00 H new ATOM 0 HZ PHE A 16 0.683 1.209 -3.973 1.00 0.00 H new ATOM 237 N ASN A 17 6.836 -3.985 -5.689 1.00 0.00 N ATOM 238 CA ASN A 17 7.626 -5.140 -6.081 1.00 0.00 C ATOM 239 C ASN A 17 8.746 -5.357 -5.060 1.00 0.00 C ATOM 240 O ASN A 17 8.966 -6.478 -4.604 1.00 0.00 O ATOM 241 CB ASN A 17 8.271 -4.927 -7.452 1.00 0.00 C ATOM 242 CG ASN A 17 7.256 -5.146 -8.575 1.00 0.00 C ATOM 243 OD1 ASN A 17 6.239 -4.479 -8.666 1.00 0.00 O ATOM 244 ND2 ASN A 17 7.587 -6.116 -9.422 1.00 0.00 N ATOM 0 H ASN A 17 6.711 -3.286 -6.421 1.00 0.00 H new ATOM 0 HA ASN A 17 6.962 -6.003 -6.125 1.00 0.00 H new ATOM 0 HB2 ASN A 17 8.676 -3.917 -7.515 1.00 0.00 H new ATOM 0 HB3 ASN A 17 9.108 -5.614 -7.575 1.00 0.00 H new ATOM 0 HD21 ASN A 17 6.974 -6.340 -10.206 1.00 0.00 H new ATOM 0 HD22 ASN A 17 8.454 -6.636 -9.288 1.00 0.00 H new ATOM 251 N THR A 18 9.423 -4.267 -4.732 1.00 0.00 N ATOM 252 CA THR A 18 10.514 -4.323 -3.774 1.00 0.00 C ATOM 253 C THR A 18 10.008 -4.820 -2.419 1.00 0.00 C ATOM 254 O THR A 18 10.507 -5.813 -1.892 1.00 0.00 O ATOM 255 CB THR A 18 11.161 -2.938 -3.712 1.00 0.00 C ATOM 256 OG1 THR A 18 11.785 -2.788 -4.984 1.00 0.00 O ATOM 257 CG2 THR A 18 12.323 -2.879 -2.718 1.00 0.00 C ATOM 0 H THR A 18 9.237 -3.339 -5.113 1.00 0.00 H new ATOM 0 HA THR A 18 11.276 -5.039 -4.083 1.00 0.00 H new ATOM 0 HB THR A 18 10.409 -2.199 -3.436 1.00 0.00 H new ATOM 0 HG1 THR A 18 11.333 -2.079 -5.488 1.00 0.00 H new ATOM 0 HG21 THR A 18 12.747 -1.875 -2.713 1.00 0.00 H new ATOM 0 HG22 THR A 18 11.961 -3.125 -1.720 1.00 0.00 H new ATOM 0 HG23 THR A 18 13.090 -3.595 -3.012 1.00 0.00 H new ATOM 265 N ARG A 19 9.024 -4.106 -1.893 1.00 0.00 N ATOM 266 CA ARG A 19 8.445 -4.461 -0.608 1.00 0.00 C ATOM 267 C ARG A 19 8.098 -5.951 -0.577 1.00 0.00 C ATOM 268 O ARG A 19 8.386 -6.639 0.401 1.00 0.00 O ATOM 269 CB ARG A 19 7.182 -3.644 -0.328 1.00 0.00 C ATOM 270 CG ARG A 19 7.523 -2.172 -0.092 1.00 0.00 C ATOM 271 CD ARG A 19 8.139 -1.967 1.294 1.00 0.00 C ATOM 272 NE ARG A 19 9.166 -0.903 1.239 1.00 0.00 N ATOM 273 CZ ARG A 19 9.962 -0.574 2.266 1.00 0.00 C ATOM 274 NH1 ARG A 19 9.854 -1.224 3.433 1.00 0.00 N ATOM 275 NH2 ARG A 19 10.866 0.406 2.126 1.00 0.00 N ATOM 0 H ARG A 19 8.613 -3.283 -2.333 1.00 0.00 H new ATOM 0 HA ARG A 19 9.184 -4.240 0.162 1.00 0.00 H new ATOM 0 HB2 ARG A 19 6.494 -3.731 -1.169 1.00 0.00 H new ATOM 0 HB3 ARG A 19 6.670 -4.047 0.546 1.00 0.00 H new ATOM 0 HG2 ARG A 19 8.219 -1.829 -0.858 1.00 0.00 H new ATOM 0 HG3 ARG A 19 6.622 -1.567 -0.186 1.00 0.00 H new ATOM 0 HD2 ARG A 19 7.362 -1.698 2.010 1.00 0.00 H new ATOM 0 HD3 ARG A 19 8.586 -2.898 1.644 1.00 0.00 H new ATOM 0 HE ARG A 19 9.275 -0.388 0.365 1.00 0.00 H new ATOM 0 HH11 ARG A 19 9.166 -1.969 3.540 1.00 0.00 H new ATOM 0 HH12 ARG A 19 10.460 -0.973 4.214 1.00 0.00 H new ATOM 0 HH21 ARG A 19 10.948 0.901 1.238 1.00 0.00 H new ATOM 0 HH22 ARG A 19 11.472 0.656 2.907 1.00 0.00 H new ATOM 289 N TYR A 20 7.483 -6.406 -1.659 1.00 0.00 N ATOM 290 CA TYR A 20 7.094 -7.801 -1.768 1.00 0.00 C ATOM 291 C TYR A 20 8.279 -8.725 -1.483 1.00 0.00 C ATOM 292 O TYR A 20 8.147 -9.702 -0.747 1.00 0.00 O ATOM 293 CB TYR A 20 6.642 -8.002 -3.216 1.00 0.00 C ATOM 294 CG TYR A 20 5.918 -9.326 -3.464 1.00 0.00 C ATOM 295 CD1 TYR A 20 4.787 -9.640 -2.738 1.00 0.00 C ATOM 296 CD2 TYR A 20 6.395 -10.206 -4.414 1.00 0.00 C ATOM 297 CE1 TYR A 20 4.105 -10.887 -2.972 1.00 0.00 C ATOM 298 CE2 TYR A 20 5.712 -11.452 -4.648 1.00 0.00 C ATOM 299 CZ TYR A 20 4.601 -11.731 -3.915 1.00 0.00 C ATOM 300 OH TYR A 20 3.957 -12.908 -4.136 1.00 0.00 O ATOM 0 H TYR A 20 7.245 -5.832 -2.468 1.00 0.00 H new ATOM 0 HA TYR A 20 6.310 -8.037 -1.049 1.00 0.00 H new ATOM 0 HB2 TYR A 20 5.982 -7.181 -3.497 1.00 0.00 H new ATOM 0 HB3 TYR A 20 7.513 -7.949 -3.869 1.00 0.00 H new ATOM 0 HD1 TYR A 20 4.414 -8.951 -1.995 1.00 0.00 H new ATOM 0 HD2 TYR A 20 7.280 -9.960 -4.982 1.00 0.00 H new ATOM 0 HE1 TYR A 20 3.219 -11.146 -2.411 1.00 0.00 H new ATOM 0 HE2 TYR A 20 6.074 -12.149 -5.389 1.00 0.00 H new ATOM 0 HH TYR A 20 4.423 -13.409 -4.838 1.00 0.00 H new ATOM 310 N ALA A 21 9.411 -8.384 -2.082 1.00 0.00 N ATOM 311 CA ALA A 21 10.620 -9.171 -1.902 1.00 0.00 C ATOM 312 C ALA A 21 10.815 -9.464 -0.413 1.00 0.00 C ATOM 313 O ALA A 21 11.030 -10.612 -0.025 1.00 0.00 O ATOM 314 CB ALA A 21 11.809 -8.427 -2.511 1.00 0.00 C ATOM 0 H ALA A 21 9.517 -7.574 -2.692 1.00 0.00 H new ATOM 0 HA ALA A 21 10.536 -10.128 -2.418 1.00 0.00 H new ATOM 0 HB1 ALA A 21 12.715 -9.017 -2.376 1.00 0.00 H new ATOM 0 HB2 ALA A 21 11.633 -8.270 -3.575 1.00 0.00 H new ATOM 0 HB3 ALA A 21 11.927 -7.463 -2.017 1.00 0.00 H new ATOM 320 N LYS A 22 10.734 -8.407 0.381 1.00 0.00 N ATOM 321 CA LYS A 22 10.900 -8.536 1.819 1.00 0.00 C ATOM 322 C LYS A 22 9.841 -9.495 2.366 1.00 0.00 C ATOM 323 O LYS A 22 10.062 -10.158 3.378 1.00 0.00 O ATOM 324 CB LYS A 22 10.886 -7.159 2.486 1.00 0.00 C ATOM 325 CG LYS A 22 11.368 -7.247 3.935 1.00 0.00 C ATOM 326 CD LYS A 22 11.493 -5.855 4.557 1.00 0.00 C ATOM 327 CE LYS A 22 11.657 -5.945 6.076 1.00 0.00 C ATOM 328 NZ LYS A 22 13.061 -6.252 6.429 1.00 0.00 N ATOM 0 H LYS A 22 10.556 -7.457 0.056 1.00 0.00 H new ATOM 0 HA LYS A 22 11.873 -8.968 2.053 1.00 0.00 H new ATOM 0 HB2 LYS A 22 11.524 -6.474 1.928 1.00 0.00 H new ATOM 0 HB3 LYS A 22 9.877 -6.748 2.459 1.00 0.00 H new ATOM 0 HG2 LYS A 22 10.671 -7.848 4.518 1.00 0.00 H new ATOM 0 HG3 LYS A 22 12.333 -7.753 3.971 1.00 0.00 H new ATOM 0 HD2 LYS A 22 12.349 -5.336 4.126 1.00 0.00 H new ATOM 0 HD3 LYS A 22 10.608 -5.265 4.318 1.00 0.00 H new ATOM 0 HE2 LYS A 22 11.358 -5.003 6.536 1.00 0.00 H new ATOM 0 HE3 LYS A 22 10.999 -6.717 6.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 13.154 -6.309 7.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 13.334 -7.162 6.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 13.682 -5.501 6.067 1.00 0.00 H new ATOM 342 N ALA A 23 8.713 -9.538 1.672 1.00 0.00 N ATOM 343 CA ALA A 23 7.618 -10.404 2.076 1.00 0.00 C ATOM 344 C ALA A 23 7.962 -11.852 1.718 1.00 0.00 C ATOM 345 O ALA A 23 7.300 -12.782 2.177 1.00 0.00 O ATOM 346 CB ALA A 23 6.322 -9.932 1.413 1.00 0.00 C ATOM 0 H ALA A 23 8.534 -8.987 0.832 1.00 0.00 H new ATOM 0 HA ALA A 23 7.468 -10.356 3.155 1.00 0.00 H new ATOM 0 HB1 ALA A 23 5.501 -10.582 1.716 1.00 0.00 H new ATOM 0 HB2 ALA A 23 6.108 -8.909 1.721 1.00 0.00 H new ATOM 0 HB3 ALA A 23 6.433 -9.969 0.329 1.00 0.00 H new ATOM 352 N ILE A 24 8.996 -11.997 0.903 1.00 0.00 N ATOM 353 CA ILE A 24 9.435 -13.316 0.479 1.00 0.00 C ATOM 354 C ILE A 24 10.891 -13.524 0.901 1.00 0.00 C ATOM 355 O ILE A 24 11.466 -14.583 0.657 1.00 0.00 O ATOM 356 CB ILE A 24 9.196 -13.504 -1.020 1.00 0.00 C ATOM 357 CG1 ILE A 24 9.761 -12.326 -1.817 1.00 0.00 C ATOM 358 CG2 ILE A 24 7.713 -13.737 -1.315 1.00 0.00 C ATOM 359 CD1 ILE A 24 9.642 -12.575 -3.322 1.00 0.00 C ATOM 0 H ILE A 24 9.543 -11.223 0.525 1.00 0.00 H new ATOM 0 HA ILE A 24 8.846 -14.090 0.971 1.00 0.00 H new ATOM 0 HB ILE A 24 9.732 -14.397 -1.341 1.00 0.00 H new ATOM 0 HG12 ILE A 24 9.227 -11.414 -1.552 1.00 0.00 H new ATOM 0 HG13 ILE A 24 10.807 -12.171 -1.552 1.00 0.00 H new ATOM 0 HG21 ILE A 24 7.572 -13.867 -2.388 1.00 0.00 H new ATOM 0 HG22 ILE A 24 7.374 -14.632 -0.793 1.00 0.00 H new ATOM 0 HG23 ILE A 24 7.135 -12.878 -0.975 1.00 0.00 H new ATOM 0 HD11 ILE A 24 10.051 -11.723 -3.865 1.00 0.00 H new ATOM 0 HD12 ILE A 24 10.198 -13.475 -3.587 1.00 0.00 H new ATOM 0 HD13 ILE A 24 8.593 -12.705 -3.587 1.00 0.00 H new ATOM 371 N GLY A 25 11.445 -12.496 1.527 1.00 0.00 N ATOM 372 CA GLY A 25 12.823 -12.552 1.985 1.00 0.00 C ATOM 373 C GLY A 25 13.796 -12.343 0.823 1.00 0.00 C ATOM 374 O GLY A 25 14.924 -12.831 0.857 1.00 0.00 O ATOM 0 H GLY A 25 10.964 -11.619 1.728 1.00 0.00 H new ATOM 0 HA2 GLY A 25 12.989 -11.788 2.745 1.00 0.00 H new ATOM 0 HA3 GLY A 25 13.015 -13.516 2.456 1.00 0.00 H new ATOM 378 N ILE A 26 13.323 -11.616 -0.179 1.00 0.00 N ATOM 379 CA ILE A 26 14.138 -11.335 -1.349 1.00 0.00 C ATOM 380 C ILE A 26 14.728 -9.929 -1.230 1.00 0.00 C ATOM 381 O ILE A 26 14.130 -9.052 -0.609 1.00 0.00 O ATOM 382 CB ILE A 26 13.329 -11.556 -2.630 1.00 0.00 C ATOM 383 CG1 ILE A 26 13.087 -13.047 -2.875 1.00 0.00 C ATOM 384 CG2 ILE A 26 14.002 -10.880 -3.826 1.00 0.00 C ATOM 385 CD1 ILE A 26 12.982 -13.346 -4.372 1.00 0.00 C ATOM 0 H ILE A 26 12.386 -11.213 -0.205 1.00 0.00 H new ATOM 0 HA ILE A 26 14.977 -12.029 -1.404 1.00 0.00 H new ATOM 0 HB ILE A 26 12.353 -11.088 -2.503 1.00 0.00 H new ATOM 0 HG12 ILE A 26 13.901 -13.627 -2.441 1.00 0.00 H new ATOM 0 HG13 ILE A 26 12.171 -13.358 -2.373 1.00 0.00 H new ATOM 0 HG21 ILE A 26 13.407 -11.052 -4.723 1.00 0.00 H new ATOM 0 HG22 ILE A 26 14.080 -9.808 -3.642 1.00 0.00 H new ATOM 0 HG23 ILE A 26 14.999 -11.297 -3.966 1.00 0.00 H new ATOM 0 HD11 ILE A 26 12.810 -14.412 -4.519 1.00 0.00 H new ATOM 0 HD12 ILE A 26 12.152 -12.783 -4.798 1.00 0.00 H new ATOM 0 HD13 ILE A 26 13.909 -13.056 -4.867 1.00 0.00 H new ATOM 397 N SER A 27 15.895 -9.759 -1.834 1.00 0.00 N ATOM 398 CA SER A 27 16.573 -8.474 -1.803 1.00 0.00 C ATOM 399 C SER A 27 16.118 -7.613 -2.983 1.00 0.00 C ATOM 400 O SER A 27 15.937 -6.405 -2.841 1.00 0.00 O ATOM 401 CB SER A 27 18.092 -8.652 -1.831 1.00 0.00 C ATOM 402 OG SER A 27 18.688 -8.359 -0.570 1.00 0.00 O ATOM 0 H SER A 27 16.388 -10.489 -2.348 1.00 0.00 H new ATOM 0 HA SER A 27 16.310 -7.971 -0.872 1.00 0.00 H new ATOM 0 HB2 SER A 27 18.332 -9.677 -2.116 1.00 0.00 H new ATOM 0 HB3 SER A 27 18.519 -8.001 -2.594 1.00 0.00 H new ATOM 0 HG SER A 27 19.658 -8.486 -0.629 1.00 0.00 H new ATOM 408 N GLU A 28 15.946 -8.269 -4.121 1.00 0.00 N ATOM 409 CA GLU A 28 15.516 -7.579 -5.325 1.00 0.00 C ATOM 410 C GLU A 28 13.988 -7.503 -5.376 1.00 0.00 C ATOM 411 O GLU A 28 13.303 -8.198 -4.627 1.00 0.00 O ATOM 412 CB GLU A 28 16.073 -8.260 -6.577 1.00 0.00 C ATOM 413 CG GLU A 28 15.122 -9.349 -7.077 1.00 0.00 C ATOM 414 CD GLU A 28 15.900 -10.545 -7.630 1.00 0.00 C ATOM 415 OE1 GLU A 28 16.499 -10.380 -8.715 1.00 0.00 O ATOM 416 OE2 GLU A 28 15.879 -11.597 -6.956 1.00 0.00 O ATOM 0 H GLU A 28 16.097 -9.271 -4.235 1.00 0.00 H new ATOM 0 HA GLU A 28 15.911 -6.563 -5.298 1.00 0.00 H new ATOM 0 HB2 GLU A 28 16.227 -7.518 -7.361 1.00 0.00 H new ATOM 0 HB3 GLU A 28 17.047 -8.696 -6.355 1.00 0.00 H new ATOM 0 HG2 GLU A 28 14.477 -9.676 -6.261 1.00 0.00 H new ATOM 0 HG3 GLU A 28 14.473 -8.942 -7.853 1.00 0.00 H new ATOM 423 N PRO A 29 13.486 -6.631 -6.291 1.00 0.00 N ATOM 424 CA PRO A 29 12.053 -6.456 -6.449 1.00 0.00 C ATOM 425 C PRO A 29 11.434 -7.643 -7.190 1.00 0.00 C ATOM 426 O PRO A 29 12.008 -8.146 -8.154 1.00 0.00 O ATOM 427 CB PRO A 29 11.898 -5.142 -7.198 1.00 0.00 C ATOM 428 CG PRO A 29 13.249 -4.865 -7.837 1.00 0.00 C ATOM 429 CD PRO A 29 14.267 -5.792 -7.195 1.00 0.00 C ATOM 0 HA PRO A 29 11.526 -6.421 -5.496 1.00 0.00 H new ATOM 0 HB2 PRO A 29 11.116 -5.213 -7.954 1.00 0.00 H new ATOM 0 HB3 PRO A 29 11.614 -4.337 -6.520 1.00 0.00 H new ATOM 0 HG2 PRO A 29 13.204 -5.034 -8.913 1.00 0.00 H new ATOM 0 HG3 PRO A 29 13.535 -3.824 -7.689 1.00 0.00 H new ATOM 0 HD2 PRO A 29 14.784 -6.392 -7.944 1.00 0.00 H new ATOM 0 HD3 PRO A 29 15.029 -5.230 -6.655 1.00 0.00 H new ATOM 437 N VAL A 30 10.269 -8.056 -6.711 1.00 0.00 N ATOM 438 CA VAL A 30 9.566 -9.174 -7.315 1.00 0.00 C ATOM 439 C VAL A 30 8.146 -8.739 -7.684 1.00 0.00 C ATOM 440 O VAL A 30 7.678 -7.694 -7.237 1.00 0.00 O ATOM 441 CB VAL A 30 9.596 -10.381 -6.375 1.00 0.00 C ATOM 442 CG1 VAL A 30 8.661 -11.486 -6.871 1.00 0.00 C ATOM 443 CG2 VAL A 30 11.023 -10.907 -6.203 1.00 0.00 C ATOM 0 H VAL A 30 9.795 -7.636 -5.911 1.00 0.00 H new ATOM 0 HA VAL A 30 10.061 -9.483 -8.236 1.00 0.00 H new ATOM 0 HB VAL A 30 9.239 -10.054 -5.398 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.701 -12.332 -6.185 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.641 -11.105 -6.918 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.974 -11.809 -7.864 1.00 0.00 H new ATOM 0 HG21 VAL A 30 11.016 -11.765 -5.530 1.00 0.00 H new ATOM 0 HG22 VAL A 30 11.419 -11.210 -7.173 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.652 -10.122 -5.783 1.00 0.00 H new ATOM 453 N LYS A 31 7.501 -9.564 -8.496 1.00 0.00 N ATOM 454 CA LYS A 31 6.144 -9.277 -8.929 1.00 0.00 C ATOM 455 C LYS A 31 5.203 -9.349 -7.726 1.00 0.00 C ATOM 456 O LYS A 31 5.425 -10.134 -6.805 1.00 0.00 O ATOM 457 CB LYS A 31 5.743 -10.202 -10.080 1.00 0.00 C ATOM 458 CG LYS A 31 6.575 -9.914 -11.332 1.00 0.00 C ATOM 459 CD LYS A 31 5.963 -10.584 -12.563 1.00 0.00 C ATOM 460 CE LYS A 31 6.886 -11.676 -13.108 1.00 0.00 C ATOM 461 NZ LYS A 31 6.318 -13.016 -12.839 1.00 0.00 N ATOM 0 H LYS A 31 7.893 -10.430 -8.865 1.00 0.00 H new ATOM 0 HA LYS A 31 6.077 -8.264 -9.326 1.00 0.00 H new ATOM 0 HB2 LYS A 31 5.879 -11.241 -9.780 1.00 0.00 H new ATOM 0 HB3 LYS A 31 4.684 -10.071 -10.305 1.00 0.00 H new ATOM 0 HG2 LYS A 31 6.637 -8.838 -11.492 1.00 0.00 H new ATOM 0 HG3 LYS A 31 7.594 -10.273 -11.187 1.00 0.00 H new ATOM 0 HD2 LYS A 31 4.996 -11.016 -12.304 1.00 0.00 H new ATOM 0 HD3 LYS A 31 5.782 -9.837 -13.336 1.00 0.00 H new ATOM 0 HE2 LYS A 31 7.024 -11.542 -14.181 1.00 0.00 H new ATOM 0 HE3 LYS A 31 7.870 -11.592 -12.647 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 6.957 -13.746 -13.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 6.209 -13.147 -11.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 5.389 -13.098 -13.299 1.00 0.00 H new ATOM 475 N VAL A 32 4.170 -8.520 -7.772 1.00 0.00 N ATOM 476 CA VAL A 32 3.194 -8.479 -6.696 1.00 0.00 C ATOM 477 C VAL A 32 1.859 -9.026 -7.205 1.00 0.00 C ATOM 478 O VAL A 32 1.237 -8.435 -8.086 1.00 0.00 O ATOM 479 CB VAL A 32 3.086 -7.058 -6.141 1.00 0.00 C ATOM 480 CG1 VAL A 32 1.730 -6.834 -5.469 1.00 0.00 C ATOM 481 CG2 VAL A 32 4.233 -6.758 -5.175 1.00 0.00 C ATOM 0 H VAL A 32 3.988 -7.871 -8.538 1.00 0.00 H new ATOM 0 HA VAL A 32 3.511 -9.113 -5.868 1.00 0.00 H new ATOM 0 HB VAL A 32 3.164 -6.364 -6.978 1.00 0.00 H new ATOM 0 HG11 VAL A 32 1.679 -5.816 -5.083 1.00 0.00 H new ATOM 0 HG12 VAL A 32 0.933 -6.986 -6.197 1.00 0.00 H new ATOM 0 HG13 VAL A 32 1.610 -7.540 -4.647 1.00 0.00 H new ATOM 0 HG21 VAL A 32 4.132 -5.741 -4.795 1.00 0.00 H new ATOM 0 HG22 VAL A 32 4.201 -7.461 -4.343 1.00 0.00 H new ATOM 0 HG23 VAL A 32 5.184 -6.857 -5.698 1.00 0.00 H new ATOM 491 N PRO A 33 1.447 -10.179 -6.612 1.00 0.00 N ATOM 492 CA PRO A 33 0.196 -10.812 -6.996 1.00 0.00 C ATOM 493 C PRO A 33 -1.002 -10.050 -6.426 1.00 0.00 C ATOM 494 O PRO A 33 -1.724 -10.569 -5.576 1.00 0.00 O ATOM 495 CB PRO A 33 0.299 -12.235 -6.472 1.00 0.00 C ATOM 496 CG PRO A 33 1.393 -12.213 -5.418 1.00 0.00 C ATOM 497 CD PRO A 33 2.157 -10.907 -5.566 1.00 0.00 C ATOM 0 HA PRO A 33 0.036 -10.809 -8.074 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -0.648 -12.563 -6.045 1.00 0.00 H new ATOM 0 HB3 PRO A 33 0.544 -12.930 -7.275 1.00 0.00 H new ATOM 0 HG2 PRO A 33 0.963 -12.293 -4.420 1.00 0.00 H new ATOM 0 HG3 PRO A 33 2.063 -13.064 -5.545 1.00 0.00 H new ATOM 0 HD2 PRO A 33 2.168 -10.347 -4.631 1.00 0.00 H new ATOM 0 HD3 PRO A 33 3.196 -11.085 -5.843 1.00 0.00 H new ATOM 505 N TYR A 34 -1.175 -8.832 -6.917 1.00 0.00 N ATOM 506 CA TYR A 34 -2.273 -7.993 -6.467 1.00 0.00 C ATOM 507 C TYR A 34 -3.521 -8.831 -6.180 1.00 0.00 C ATOM 508 O TYR A 34 -4.053 -8.799 -5.072 1.00 0.00 O ATOM 509 CB TYR A 34 -2.571 -7.033 -7.620 1.00 0.00 C ATOM 510 CG TYR A 34 -1.447 -6.035 -7.905 1.00 0.00 C ATOM 511 CD1 TYR A 34 -0.708 -5.513 -6.864 1.00 0.00 C ATOM 512 CD2 TYR A 34 -1.174 -5.657 -9.204 1.00 0.00 C ATOM 513 CE1 TYR A 34 0.350 -4.573 -7.132 1.00 0.00 C ATOM 514 CE2 TYR A 34 -0.116 -4.717 -9.472 1.00 0.00 C ATOM 515 CZ TYR A 34 0.594 -4.221 -8.423 1.00 0.00 C ATOM 516 OH TYR A 34 1.592 -3.334 -8.676 1.00 0.00 O ATOM 0 H TYR A 34 -0.574 -8.406 -7.622 1.00 0.00 H new ATOM 0 HA TYR A 34 -2.006 -7.471 -5.548 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -2.765 -7.614 -8.522 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -3.484 -6.482 -7.394 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -0.923 -5.809 -5.848 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -1.753 -6.066 -10.019 1.00 0.00 H new ATOM 0 HE1 TYR A 34 0.936 -4.157 -6.326 1.00 0.00 H new ATOM 0 HE2 TYR A 34 0.109 -4.413 -10.484 1.00 0.00 H new ATOM 0 HH TYR A 34 1.653 -3.177 -9.641 1.00 0.00 H new ATOM 526 N SER A 35 -3.952 -9.560 -7.199 1.00 0.00 N ATOM 527 CA SER A 35 -5.127 -10.405 -7.071 1.00 0.00 C ATOM 528 C SER A 35 -5.099 -11.140 -5.729 1.00 0.00 C ATOM 529 O SER A 35 -6.042 -11.043 -4.945 1.00 0.00 O ATOM 530 CB SER A 35 -5.213 -11.407 -8.224 1.00 0.00 C ATOM 531 OG SER A 35 -4.566 -10.926 -9.399 1.00 0.00 O ATOM 0 H SER A 35 -3.508 -9.583 -8.117 1.00 0.00 H new ATOM 0 HA SER A 35 -6.012 -9.770 -7.111 1.00 0.00 H new ATOM 0 HB2 SER A 35 -4.758 -12.350 -7.920 1.00 0.00 H new ATOM 0 HB3 SER A 35 -6.260 -11.615 -8.446 1.00 0.00 H new ATOM 0 HG SER A 35 -4.642 -11.595 -10.111 1.00 0.00 H new ATOM 537 N LYS A 36 -4.009 -11.859 -5.507 1.00 0.00 N ATOM 538 CA LYS A 36 -3.846 -12.610 -4.274 1.00 0.00 C ATOM 539 C LYS A 36 -4.177 -11.707 -3.084 1.00 0.00 C ATOM 540 O LYS A 36 -4.842 -12.134 -2.142 1.00 0.00 O ATOM 541 CB LYS A 36 -2.449 -13.231 -4.205 1.00 0.00 C ATOM 542 CG LYS A 36 -2.222 -14.200 -5.367 1.00 0.00 C ATOM 543 CD LYS A 36 -3.022 -15.490 -5.169 1.00 0.00 C ATOM 544 CE LYS A 36 -3.142 -16.267 -6.481 1.00 0.00 C ATOM 545 NZ LYS A 36 -4.542 -16.693 -6.705 1.00 0.00 N ATOM 0 H LYS A 36 -3.230 -11.938 -6.160 1.00 0.00 H new ATOM 0 HA LYS A 36 -4.543 -13.447 -4.243 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.695 -12.444 -4.231 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.328 -13.758 -3.258 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -2.516 -13.726 -6.303 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -1.161 -14.435 -5.448 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -2.536 -16.112 -4.417 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -4.016 -15.251 -4.791 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -2.808 -15.645 -7.311 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -2.490 -17.140 -6.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -4.565 -17.445 -7.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -4.942 -17.052 -5.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -5.103 -15.882 -7.035 1.00 0.00 H new ATOM 559 N PHE A 37 -3.697 -10.474 -3.166 1.00 0.00 N ATOM 560 CA PHE A 37 -3.933 -9.507 -2.108 1.00 0.00 C ATOM 561 C PHE A 37 -5.345 -8.925 -2.203 1.00 0.00 C ATOM 562 O PHE A 37 -5.886 -8.434 -1.213 1.00 0.00 O ATOM 563 CB PHE A 37 -2.916 -8.380 -2.297 1.00 0.00 C ATOM 564 CG PHE A 37 -1.512 -8.718 -1.790 1.00 0.00 C ATOM 565 CD1 PHE A 37 -0.728 -9.583 -2.487 1.00 0.00 C ATOM 566 CD2 PHE A 37 -1.049 -8.153 -0.643 1.00 0.00 C ATOM 567 CE1 PHE A 37 0.575 -9.896 -2.017 1.00 0.00 C ATOM 568 CE2 PHE A 37 0.254 -8.466 -0.173 1.00 0.00 C ATOM 569 CZ PHE A 37 1.038 -9.331 -0.870 1.00 0.00 C ATOM 0 H PHE A 37 -3.146 -10.123 -3.949 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.831 -9.988 -1.135 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -2.858 -8.130 -3.356 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -3.274 -7.490 -1.779 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.096 -10.032 -3.398 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -1.672 -7.466 -0.089 1.00 0.00 H new ATOM 0 HE1 PHE A 37 1.198 -10.583 -2.571 1.00 0.00 H new ATOM 0 HE2 PHE A 37 0.622 -8.017 0.738 1.00 0.00 H new ATOM 0 HZ PHE A 37 2.029 -9.569 -0.513 1.00 0.00 H new ATOM 579 N LEU A 38 -5.902 -9.000 -3.402 1.00 0.00 N ATOM 580 CA LEU A 38 -7.241 -8.486 -3.639 1.00 0.00 C ATOM 581 C LEU A 38 -8.268 -9.495 -3.121 1.00 0.00 C ATOM 582 O LEU A 38 -9.099 -9.162 -2.278 1.00 0.00 O ATOM 583 CB LEU A 38 -7.423 -8.125 -5.115 1.00 0.00 C ATOM 584 CG LEU A 38 -6.558 -6.976 -5.636 1.00 0.00 C ATOM 585 CD1 LEU A 38 -6.762 -6.774 -7.139 1.00 0.00 C ATOM 586 CD2 LEU A 38 -6.815 -5.693 -4.844 1.00 0.00 C ATOM 0 H LEU A 38 -5.451 -9.409 -4.220 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.397 -7.559 -3.087 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.214 -9.011 -5.714 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -8.470 -7.869 -5.280 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.511 -7.241 -5.486 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.136 -5.951 -7.484 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -6.488 -7.686 -7.669 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -7.808 -6.541 -7.336 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.187 -4.892 -5.235 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.864 -5.411 -4.938 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -6.577 -5.860 -3.793 1.00 0.00 H new ATOM 598 N MET A 39 -8.178 -10.707 -3.649 1.00 0.00 N ATOM 599 CA MET A 39 -9.089 -11.766 -3.250 1.00 0.00 C ATOM 600 C MET A 39 -8.844 -12.184 -1.799 1.00 0.00 C ATOM 601 O MET A 39 -9.731 -12.733 -1.149 1.00 0.00 O ATOM 602 CB MET A 39 -8.900 -12.975 -4.169 1.00 0.00 C ATOM 603 CG MET A 39 -9.093 -12.584 -5.636 1.00 0.00 C ATOM 604 SD MET A 39 -9.084 -14.044 -6.662 1.00 0.00 S ATOM 605 CE MET A 39 -7.343 -14.436 -6.630 1.00 0.00 C ATOM 0 H MET A 39 -7.488 -10.979 -4.350 1.00 0.00 H new ATOM 0 HA MET A 39 -10.109 -11.391 -3.332 1.00 0.00 H new ATOM 0 HB2 MET A 39 -7.902 -13.391 -4.028 1.00 0.00 H new ATOM 0 HB3 MET A 39 -9.612 -13.755 -3.900 1.00 0.00 H new ATOM 0 HG2 MET A 39 -10.035 -12.050 -5.758 1.00 0.00 H new ATOM 0 HG3 MET A 39 -8.299 -11.905 -5.948 1.00 0.00 H new ATOM 0 HE1 MET A 39 -7.120 -15.164 -7.410 1.00 0.00 H new ATOM 0 HE2 MET A 39 -6.763 -13.530 -6.802 1.00 0.00 H new ATOM 0 HE3 MET A 39 -7.082 -14.854 -5.658 1.00 0.00 H new ATOM 615 N HIS A 40 -7.634 -11.908 -1.334 1.00 0.00 N ATOM 616 CA HIS A 40 -7.260 -12.248 0.028 1.00 0.00 C ATOM 617 C HIS A 40 -6.645 -11.026 0.712 1.00 0.00 C ATOM 618 O HIS A 40 -5.446 -11.003 0.989 1.00 0.00 O ATOM 619 CB HIS A 40 -6.336 -13.468 0.049 1.00 0.00 C ATOM 620 CG HIS A 40 -6.800 -14.605 -0.829 1.00 0.00 C ATOM 621 ND1 HIS A 40 -7.689 -15.573 -0.394 1.00 0.00 N ATOM 622 CD2 HIS A 40 -6.490 -14.919 -2.119 1.00 0.00 C ATOM 623 CE1 HIS A 40 -7.897 -16.426 -1.387 1.00 0.00 C ATOM 624 NE2 HIS A 40 -7.153 -16.019 -2.455 1.00 0.00 N ATOM 0 H HIS A 40 -6.900 -11.453 -1.877 1.00 0.00 H new ATOM 0 HA HIS A 40 -8.149 -12.528 0.594 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -5.339 -13.161 -0.268 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -6.248 -13.827 1.074 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -5.819 -14.366 -2.759 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -8.542 -17.291 -1.356 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -7.113 -16.483 -3.362 1.00 0.00 H new ATOM 632 N PRO A 41 -7.515 -10.014 0.971 1.00 0.00 N ATOM 633 CA PRO A 41 -7.070 -8.791 1.618 1.00 0.00 C ATOM 634 C PRO A 41 -6.832 -9.016 3.112 1.00 0.00 C ATOM 635 O PRO A 41 -6.196 -8.197 3.774 1.00 0.00 O ATOM 636 CB PRO A 41 -8.165 -7.776 1.337 1.00 0.00 C ATOM 637 CG PRO A 41 -9.392 -8.584 0.947 1.00 0.00 C ATOM 638 CD PRO A 41 -8.941 -10.006 0.657 1.00 0.00 C ATOM 0 HA PRO A 41 -6.112 -8.438 1.237 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -8.364 -7.163 2.216 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -7.873 -7.098 0.535 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -10.127 -8.573 1.751 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -9.872 -8.150 0.070 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -9.485 -10.726 1.268 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -9.119 -10.273 -0.385 1.00 0.00 H new ATOM 646 N GLU A 42 -7.355 -10.131 3.601 1.00 0.00 N ATOM 647 CA GLU A 42 -7.208 -10.474 5.005 1.00 0.00 C ATOM 648 C GLU A 42 -5.903 -11.241 5.230 1.00 0.00 C ATOM 649 O GLU A 42 -5.224 -11.036 6.235 1.00 0.00 O ATOM 650 CB GLU A 42 -8.410 -11.280 5.501 1.00 0.00 C ATOM 651 CG GLU A 42 -9.450 -10.367 6.154 1.00 0.00 C ATOM 652 CD GLU A 42 -9.833 -10.879 7.544 1.00 0.00 C ATOM 653 OE1 GLU A 42 -10.154 -12.083 7.637 1.00 0.00 O ATOM 654 OE2 GLU A 42 -9.796 -10.053 8.483 1.00 0.00 O ATOM 0 H GLU A 42 -7.881 -10.809 3.049 1.00 0.00 H new ATOM 0 HA GLU A 42 -7.168 -9.550 5.583 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -8.863 -11.815 4.666 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -8.078 -12.031 6.218 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -9.053 -9.355 6.232 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -10.338 -10.313 5.525 1.00 0.00 H new ATOM 661 N GLU A 43 -5.592 -12.108 4.278 1.00 0.00 N ATOM 662 CA GLU A 43 -4.381 -12.907 4.359 1.00 0.00 C ATOM 663 C GLU A 43 -3.182 -12.107 3.845 1.00 0.00 C ATOM 664 O GLU A 43 -2.180 -11.964 4.544 1.00 0.00 O ATOM 665 CB GLU A 43 -4.536 -14.219 3.588 1.00 0.00 C ATOM 666 CG GLU A 43 -5.605 -15.107 4.228 1.00 0.00 C ATOM 667 CD GLU A 43 -6.989 -14.466 4.117 1.00 0.00 C ATOM 668 OE1 GLU A 43 -7.534 -14.483 2.992 1.00 0.00 O ATOM 669 OE2 GLU A 43 -7.472 -13.974 5.159 1.00 0.00 O ATOM 0 H GLU A 43 -6.158 -12.275 3.446 1.00 0.00 H new ATOM 0 HA GLU A 43 -4.204 -13.158 5.405 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -4.805 -14.007 2.553 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -3.583 -14.748 3.567 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -5.612 -16.082 3.741 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -5.362 -15.276 5.277 1.00 0.00 H new ATOM 676 N LEU A 44 -3.325 -11.606 2.626 1.00 0.00 N ATOM 677 CA LEU A 44 -2.266 -10.825 2.010 1.00 0.00 C ATOM 678 C LEU A 44 -2.722 -9.370 1.880 1.00 0.00 C ATOM 679 O LEU A 44 -3.694 -9.080 1.185 1.00 0.00 O ATOM 680 CB LEU A 44 -1.837 -11.455 0.683 1.00 0.00 C ATOM 681 CG LEU A 44 -1.973 -12.976 0.589 1.00 0.00 C ATOM 682 CD1 LEU A 44 -1.909 -13.443 -0.866 1.00 0.00 C ATOM 683 CD2 LEU A 44 -0.928 -13.675 1.462 1.00 0.00 C ATOM 0 H LEU A 44 -4.158 -11.726 2.049 1.00 0.00 H new ATOM 0 HA LEU A 44 -1.376 -10.827 2.639 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.427 -11.007 -0.117 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.796 -11.191 0.498 1.00 0.00 H new ATOM 0 HG LEU A 44 -2.954 -13.256 0.974 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -2.008 -14.528 -0.905 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.720 -12.984 -1.431 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.953 -13.150 -1.300 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -1.047 -14.755 1.377 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.071 -13.392 1.130 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -1.063 -13.376 2.501 1.00 0.00 H new ATOM 695 N PHE A 45 -1.997 -8.494 2.560 1.00 0.00 N ATOM 696 CA PHE A 45 -2.314 -7.076 2.530 1.00 0.00 C ATOM 697 C PHE A 45 -1.051 -6.228 2.686 1.00 0.00 C ATOM 698 O PHE A 45 0.048 -6.763 2.823 1.00 0.00 O ATOM 699 CB PHE A 45 -3.248 -6.801 3.711 1.00 0.00 C ATOM 700 CG PHE A 45 -2.672 -7.212 5.068 1.00 0.00 C ATOM 701 CD1 PHE A 45 -1.773 -6.409 5.696 1.00 0.00 C ATOM 702 CD2 PHE A 45 -3.059 -8.381 5.645 1.00 0.00 C ATOM 703 CE1 PHE A 45 -1.238 -6.790 6.955 1.00 0.00 C ATOM 704 CE2 PHE A 45 -2.525 -8.762 6.904 1.00 0.00 C ATOM 705 CZ PHE A 45 -1.626 -7.959 7.533 1.00 0.00 C ATOM 0 H PHE A 45 -1.191 -8.739 3.135 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.776 -6.819 1.577 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -3.483 -5.737 3.735 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -4.186 -7.332 3.550 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.465 -5.481 5.237 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.773 -9.020 5.145 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -0.523 -6.152 7.454 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.833 -9.690 7.362 1.00 0.00 H new ATOM 0 HZ PHE A 45 -1.220 -8.249 8.491 1.00 0.00 H new ATOM 715 N VAL A 46 -1.249 -4.918 2.659 1.00 0.00 N ATOM 716 CA VAL A 46 -0.139 -3.990 2.796 1.00 0.00 C ATOM 717 C VAL A 46 -0.404 -3.054 3.977 1.00 0.00 C ATOM 718 O VAL A 46 -1.534 -2.615 4.183 1.00 0.00 O ATOM 719 CB VAL A 46 0.084 -3.243 1.479 1.00 0.00 C ATOM 720 CG1 VAL A 46 1.157 -2.164 1.636 1.00 0.00 C ATOM 721 CG2 VAL A 46 0.442 -4.213 0.352 1.00 0.00 C ATOM 0 H VAL A 46 -2.162 -4.477 2.544 1.00 0.00 H new ATOM 0 HA VAL A 46 0.784 -4.528 3.009 1.00 0.00 H new ATOM 0 HB VAL A 46 -0.850 -2.750 1.211 1.00 0.00 H new ATOM 0 HG11 VAL A 46 1.296 -1.648 0.686 1.00 0.00 H new ATOM 0 HG12 VAL A 46 0.844 -1.447 2.395 1.00 0.00 H new ATOM 0 HG13 VAL A 46 2.096 -2.626 1.939 1.00 0.00 H new ATOM 0 HG21 VAL A 46 0.595 -3.656 -0.572 1.00 0.00 H new ATOM 0 HG22 VAL A 46 1.356 -4.748 0.609 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -0.370 -4.927 0.215 1.00 0.00 H new ATOM 731 N VAL A 47 0.656 -2.777 4.721 1.00 0.00 N ATOM 732 CA VAL A 47 0.552 -1.902 5.876 1.00 0.00 C ATOM 733 C VAL A 47 1.527 -0.734 5.715 1.00 0.00 C ATOM 734 O VAL A 47 2.584 -0.883 5.104 1.00 0.00 O ATOM 735 CB VAL A 47 0.783 -2.701 7.161 1.00 0.00 C ATOM 736 CG1 VAL A 47 -0.457 -3.517 7.529 1.00 0.00 C ATOM 737 CG2 VAL A 47 2.014 -3.600 7.033 1.00 0.00 C ATOM 0 H VAL A 47 1.592 -3.143 4.546 1.00 0.00 H new ATOM 0 HA VAL A 47 -0.451 -1.481 5.947 1.00 0.00 H new ATOM 0 HB VAL A 47 0.969 -1.992 7.968 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -0.266 -4.075 8.446 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -1.302 -2.846 7.682 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.688 -4.212 6.722 1.00 0.00 H new ATOM 0 HG21 VAL A 47 2.156 -4.157 7.959 1.00 0.00 H new ATOM 0 HG22 VAL A 47 1.870 -4.298 6.208 1.00 0.00 H new ATOM 0 HG23 VAL A 47 2.894 -2.987 6.840 1.00 0.00 H new ATOM 747 N GLY A 48 1.137 0.402 6.274 1.00 0.00 N ATOM 748 CA GLY A 48 1.963 1.595 6.200 1.00 0.00 C ATOM 749 C GLY A 48 1.409 2.583 5.171 1.00 0.00 C ATOM 750 O GLY A 48 1.614 3.790 5.291 1.00 0.00 O ATOM 0 H GLY A 48 0.260 0.522 6.780 1.00 0.00 H new ATOM 0 HA2 GLY A 48 2.008 2.072 7.179 1.00 0.00 H new ATOM 0 HA3 GLY A 48 2.983 1.319 5.932 1.00 0.00 H new ATOM 754 N LEU A 49 0.719 2.033 4.183 1.00 0.00 N ATOM 755 CA LEU A 49 0.134 2.851 3.134 1.00 0.00 C ATOM 756 C LEU A 49 -0.455 4.121 3.752 1.00 0.00 C ATOM 757 O LEU A 49 -0.816 4.134 4.927 1.00 0.00 O ATOM 758 CB LEU A 49 -0.875 2.038 2.321 1.00 0.00 C ATOM 759 CG LEU A 49 -0.291 1.154 1.217 1.00 0.00 C ATOM 760 CD1 LEU A 49 -1.295 0.085 0.782 1.00 0.00 C ATOM 761 CD2 LEU A 49 0.195 1.998 0.038 1.00 0.00 C ATOM 0 H LEU A 49 0.552 1.031 4.087 1.00 0.00 H new ATOM 0 HA LEU A 49 0.900 3.166 2.425 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -1.438 1.404 3.007 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.587 2.728 1.868 1.00 0.00 H new ATOM 0 HG LEU A 49 0.578 0.634 1.620 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.855 -0.529 -0.003 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.549 -0.544 1.635 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.197 0.566 0.404 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.605 1.345 -0.732 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.641 2.564 -0.373 1.00 0.00 H new ATOM 0 HD23 LEU A 49 0.968 2.688 0.378 1.00 0.00 H new ATOM 773 N PRO A 50 -0.536 5.186 2.909 1.00 0.00 N ATOM 774 CA PRO A 50 -1.074 6.458 3.361 1.00 0.00 C ATOM 775 C PRO A 50 -2.598 6.395 3.483 1.00 0.00 C ATOM 776 O PRO A 50 -3.207 5.371 3.179 1.00 0.00 O ATOM 777 CB PRO A 50 -0.602 7.472 2.332 1.00 0.00 C ATOM 778 CG PRO A 50 -0.213 6.668 1.102 1.00 0.00 C ATOM 779 CD PRO A 50 -0.117 5.207 1.511 1.00 0.00 C ATOM 0 HA PRO A 50 -0.728 6.732 4.358 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.391 8.187 2.098 1.00 0.00 H new ATOM 0 HB3 PRO A 50 0.246 8.045 2.708 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -0.954 6.795 0.313 1.00 0.00 H new ATOM 0 HG3 PRO A 50 0.740 7.016 0.704 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -0.761 4.580 0.895 1.00 0.00 H new ATOM 0 HD3 PRO A 50 0.899 4.829 1.396 1.00 0.00 H new ATOM 787 N GLU A 51 -3.170 7.504 3.929 1.00 0.00 N ATOM 788 CA GLU A 51 -4.611 7.588 4.095 1.00 0.00 C ATOM 789 C GLU A 51 -5.295 7.729 2.733 1.00 0.00 C ATOM 790 O GLU A 51 -4.799 8.433 1.855 1.00 0.00 O ATOM 791 CB GLU A 51 -4.990 8.746 5.020 1.00 0.00 C ATOM 792 CG GLU A 51 -5.881 8.263 6.166 1.00 0.00 C ATOM 793 CD GLU A 51 -6.411 9.443 6.983 1.00 0.00 C ATOM 794 OE1 GLU A 51 -7.243 10.192 6.427 1.00 0.00 O ATOM 795 OE2 GLU A 51 -5.972 9.570 8.147 1.00 0.00 O ATOM 0 H GLU A 51 -2.662 8.352 4.180 1.00 0.00 H new ATOM 0 HA GLU A 51 -4.957 6.665 4.561 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -4.087 9.203 5.425 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -5.510 9.516 4.450 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -6.717 7.689 5.765 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -5.316 7.593 6.813 1.00 0.00 H new ATOM 802 N GLY A 52 -6.423 7.047 2.600 1.00 0.00 N ATOM 803 CA GLY A 52 -7.180 7.087 1.361 1.00 0.00 C ATOM 804 C GLY A 52 -6.423 6.384 0.233 1.00 0.00 C ATOM 805 O GLY A 52 -6.570 6.741 -0.935 1.00 0.00 O ATOM 0 H GLY A 52 -6.831 6.463 3.330 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.149 6.609 1.507 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -7.375 8.123 1.083 1.00 0.00 H new ATOM 809 N ILE A 53 -5.627 5.398 0.622 1.00 0.00 N ATOM 810 CA ILE A 53 -4.846 4.642 -0.343 1.00 0.00 C ATOM 811 C ILE A 53 -4.709 3.197 0.140 1.00 0.00 C ATOM 812 O ILE A 53 -4.539 2.950 1.333 1.00 0.00 O ATOM 813 CB ILE A 53 -3.506 5.333 -0.606 1.00 0.00 C ATOM 814 CG1 ILE A 53 -3.711 6.802 -0.980 1.00 0.00 C ATOM 815 CG2 ILE A 53 -2.700 4.579 -1.664 1.00 0.00 C ATOM 816 CD1 ILE A 53 -2.404 7.431 -1.467 1.00 0.00 C ATOM 0 H ILE A 53 -5.506 5.105 1.592 1.00 0.00 H new ATOM 0 HA ILE A 53 -5.356 4.610 -1.306 1.00 0.00 H new ATOM 0 HB ILE A 53 -2.924 5.314 0.316 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -4.469 6.880 -1.759 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -4.084 7.352 -0.116 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.752 5.091 -1.832 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.508 3.563 -1.319 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -3.265 4.545 -2.596 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -2.577 8.475 -1.726 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -1.656 7.373 -0.677 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -2.047 6.893 -2.345 1.00 0.00 H new ATOM 828 N SER A 54 -4.788 2.279 -0.812 1.00 0.00 N ATOM 829 CA SER A 54 -4.675 0.865 -0.499 1.00 0.00 C ATOM 830 C SER A 54 -3.741 0.181 -1.500 1.00 0.00 C ATOM 831 O SER A 54 -2.829 0.810 -2.034 1.00 0.00 O ATOM 832 CB SER A 54 -6.047 0.188 -0.505 1.00 0.00 C ATOM 833 OG SER A 54 -6.128 -0.862 0.455 1.00 0.00 O ATOM 0 H SER A 54 -4.929 2.487 -1.801 1.00 0.00 H new ATOM 0 HA SER A 54 -4.257 0.769 0.503 1.00 0.00 H new ATOM 0 HB2 SER A 54 -6.818 0.930 -0.297 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.249 -0.212 -1.498 1.00 0.00 H new ATOM 0 HG SER A 54 -7.019 -1.268 0.421 1.00 0.00 H new ATOM 839 N LEU A 55 -4.000 -1.099 -1.723 1.00 0.00 N ATOM 840 CA LEU A 55 -3.194 -1.876 -2.650 1.00 0.00 C ATOM 841 C LEU A 55 -3.960 -2.049 -3.963 1.00 0.00 C ATOM 842 O LEU A 55 -4.968 -2.752 -4.010 1.00 0.00 O ATOM 843 CB LEU A 55 -2.765 -3.197 -2.010 1.00 0.00 C ATOM 844 CG LEU A 55 -1.737 -4.019 -2.791 1.00 0.00 C ATOM 845 CD1 LEU A 55 -0.450 -3.222 -3.010 1.00 0.00 C ATOM 846 CD2 LEU A 55 -1.472 -5.360 -2.105 1.00 0.00 C ATOM 0 H LEU A 55 -4.757 -1.618 -1.278 1.00 0.00 H new ATOM 0 HA LEU A 55 -2.270 -1.348 -2.886 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -2.355 -2.983 -1.023 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -3.653 -3.811 -1.860 1.00 0.00 H new ATOM 0 HG LEU A 55 -2.151 -4.238 -3.775 1.00 0.00 H new ATOM 0 HD11 LEU A 55 0.264 -3.829 -3.567 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -0.674 -2.316 -3.574 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -0.021 -2.952 -2.045 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -0.738 -5.924 -2.680 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -1.088 -5.185 -1.100 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -2.400 -5.928 -2.045 1.00 0.00 H new ATOM 858 N ARG A 56 -3.451 -1.396 -4.998 1.00 0.00 N ATOM 859 CA ARG A 56 -4.075 -1.470 -6.309 1.00 0.00 C ATOM 860 C ARG A 56 -3.081 -1.048 -7.393 1.00 0.00 C ATOM 861 O ARG A 56 -2.016 -0.512 -7.090 1.00 0.00 O ATOM 862 CB ARG A 56 -5.310 -0.571 -6.382 1.00 0.00 C ATOM 863 CG ARG A 56 -6.521 -1.249 -5.738 1.00 0.00 C ATOM 864 CD ARG A 56 -7.820 -0.820 -6.423 1.00 0.00 C ATOM 865 NE ARG A 56 -8.892 -1.798 -6.135 1.00 0.00 N ATOM 866 CZ ARG A 56 -8.938 -3.036 -6.646 1.00 0.00 C ATOM 867 NH1 ARG A 56 -7.972 -3.454 -7.476 1.00 0.00 N ATOM 868 NH2 ARG A 56 -9.949 -3.855 -6.329 1.00 0.00 N ATOM 0 H ARG A 56 -2.615 -0.814 -4.956 1.00 0.00 H new ATOM 0 HA ARG A 56 -4.381 -2.503 -6.473 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -5.107 0.374 -5.878 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -5.532 -0.335 -7.423 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -6.413 -2.332 -5.802 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.563 -0.995 -4.679 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -8.116 0.169 -6.073 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -7.665 -0.744 -7.499 1.00 0.00 H new ATOM 0 HE ARG A 56 -9.644 -1.512 -5.508 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -7.202 -2.830 -7.718 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -8.006 -4.396 -7.865 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -10.685 -3.537 -5.698 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -9.983 -4.797 -6.718 1.00 0.00 H new ATOM 882 N ARG A 57 -3.465 -1.306 -8.635 1.00 0.00 N ATOM 883 CA ARG A 57 -2.621 -0.961 -9.766 1.00 0.00 C ATOM 884 C ARG A 57 -2.104 0.473 -9.624 1.00 0.00 C ATOM 885 O ARG A 57 -2.871 1.386 -9.326 1.00 0.00 O ATOM 886 CB ARG A 57 -3.386 -1.091 -11.084 1.00 0.00 C ATOM 887 CG ARG A 57 -2.878 -2.283 -11.898 1.00 0.00 C ATOM 888 CD ARG A 57 -3.922 -2.734 -12.921 1.00 0.00 C ATOM 889 NE ARG A 57 -3.390 -3.855 -13.727 1.00 0.00 N ATOM 890 CZ ARG A 57 -3.884 -4.227 -14.915 1.00 0.00 C ATOM 891 NH1 ARG A 57 -4.925 -3.569 -15.444 1.00 0.00 N ATOM 892 NH2 ARG A 57 -3.338 -5.257 -15.576 1.00 0.00 N ATOM 0 H ARG A 57 -4.349 -1.750 -8.882 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.781 -1.655 -9.777 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -4.450 -1.212 -10.881 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -3.275 -0.175 -11.665 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -1.955 -2.011 -12.411 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -2.639 -3.109 -11.229 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -4.834 -3.043 -12.410 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.188 -1.901 -13.572 1.00 0.00 H new ATOM 0 HE ARG A 57 -2.597 -4.377 -13.354 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -5.341 -2.785 -14.942 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -5.301 -3.852 -16.349 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -2.546 -5.758 -15.174 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -3.715 -5.540 -16.481 1.00 0.00 H new ATOM 906 N PRO A 58 -0.772 0.628 -9.850 1.00 0.00 N ATOM 907 CA PRO A 58 -0.143 1.935 -9.751 1.00 0.00 C ATOM 908 C PRO A 58 -0.486 2.802 -10.964 1.00 0.00 C ATOM 909 O PRO A 58 0.407 3.277 -11.664 1.00 0.00 O ATOM 910 CB PRO A 58 1.344 1.647 -9.627 1.00 0.00 C ATOM 911 CG PRO A 58 1.537 0.225 -10.127 1.00 0.00 C ATOM 912 CD PRO A 58 0.168 -0.431 -10.206 1.00 0.00 C ATOM 0 HA PRO A 58 -0.497 2.509 -8.894 1.00 0.00 H new ATOM 0 HB2 PRO A 58 1.929 2.352 -10.218 1.00 0.00 H new ATOM 0 HB3 PRO A 58 1.676 1.746 -8.594 1.00 0.00 H new ATOM 0 HG2 PRO A 58 2.017 0.226 -11.106 1.00 0.00 H new ATOM 0 HG3 PRO A 58 2.189 -0.331 -9.453 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -0.029 -0.816 -11.207 1.00 0.00 H new ATOM 0 HD3 PRO A 58 0.093 -1.274 -9.520 1.00 0.00 H new ATOM 920 N ASN A 59 -1.782 2.982 -11.175 1.00 0.00 N ATOM 921 CA ASN A 59 -2.253 3.783 -12.292 1.00 0.00 C ATOM 922 C ASN A 59 -3.657 4.306 -11.981 1.00 0.00 C ATOM 923 O ASN A 59 -3.952 5.478 -12.212 1.00 0.00 O ATOM 924 CB ASN A 59 -2.332 2.951 -13.573 1.00 0.00 C ATOM 925 CG ASN A 59 -2.933 1.572 -13.295 1.00 0.00 C ATOM 926 OD1 ASN A 59 -4.077 1.434 -12.895 1.00 0.00 O ATOM 927 ND2 ASN A 59 -2.100 0.562 -13.529 1.00 0.00 N ATOM 0 H ASN A 59 -2.520 2.587 -10.592 1.00 0.00 H new ATOM 0 HA ASN A 59 -1.551 4.604 -12.438 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -2.938 3.473 -14.313 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -1.335 2.838 -14.000 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -2.407 -0.398 -13.374 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -1.154 0.748 -13.863 1.00 0.00 H new ATOM 934 N CYS A 60 -4.486 3.412 -11.462 1.00 0.00 N ATOM 935 CA CYS A 60 -5.851 3.769 -11.117 1.00 0.00 C ATOM 936 C CYS A 60 -5.808 4.906 -10.095 1.00 0.00 C ATOM 937 O CYS A 60 -6.801 5.603 -9.894 1.00 0.00 O ATOM 938 CB CYS A 60 -6.637 2.563 -10.596 1.00 0.00 C ATOM 939 SG CYS A 60 -8.429 2.934 -10.602 1.00 0.00 S ATOM 0 H CYS A 60 -4.238 2.441 -11.272 1.00 0.00 H new ATOM 0 HA CYS A 60 -6.378 4.105 -12.010 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -6.436 1.691 -11.218 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -6.312 2.316 -9.585 1.00 0.00 H new ATOM 0 HG CYS A 60 -8.613 4.189 -10.316 1.00 0.00 H new ATOM 945 N PHE A 61 -4.646 5.059 -9.476 1.00 0.00 N ATOM 946 CA PHE A 61 -4.460 6.099 -8.480 1.00 0.00 C ATOM 947 C PHE A 61 -4.096 7.431 -9.140 1.00 0.00 C ATOM 948 O PHE A 61 -3.874 7.489 -10.348 1.00 0.00 O ATOM 949 CB PHE A 61 -3.303 5.657 -7.581 1.00 0.00 C ATOM 950 CG PHE A 61 -3.648 4.490 -6.653 1.00 0.00 C ATOM 951 CD1 PHE A 61 -4.333 4.719 -5.500 1.00 0.00 C ATOM 952 CD2 PHE A 61 -3.271 3.226 -6.980 1.00 0.00 C ATOM 953 CE1 PHE A 61 -4.653 3.636 -4.638 1.00 0.00 C ATOM 954 CE2 PHE A 61 -3.591 2.143 -6.119 1.00 0.00 C ATOM 955 CZ PHE A 61 -4.275 2.371 -4.966 1.00 0.00 C ATOM 0 H PHE A 61 -3.824 4.479 -9.646 1.00 0.00 H new ATOM 0 HA PHE A 61 -5.382 6.242 -7.916 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -2.458 5.372 -8.207 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.981 6.505 -6.977 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -4.633 5.723 -5.240 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -2.728 3.045 -7.896 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -5.196 3.817 -3.722 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -3.291 1.139 -6.380 1.00 0.00 H new ATOM 0 HZ PHE A 61 -4.518 1.548 -4.311 1.00 0.00 H new ATOM 965 N GLY A 62 -4.046 8.469 -8.317 1.00 0.00 N ATOM 966 CA GLY A 62 -3.713 9.796 -8.805 1.00 0.00 C ATOM 967 C GLY A 62 -2.282 10.178 -8.423 1.00 0.00 C ATOM 968 O GLY A 62 -1.752 9.694 -7.424 1.00 0.00 O ATOM 0 H GLY A 62 -4.231 8.417 -7.315 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -3.824 9.827 -9.889 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -4.410 10.525 -8.392 1.00 0.00 H new ATOM 972 N ILE A 63 -1.696 11.042 -9.239 1.00 0.00 N ATOM 973 CA ILE A 63 -0.336 11.494 -8.999 1.00 0.00 C ATOM 974 C ILE A 63 -0.136 11.721 -7.500 1.00 0.00 C ATOM 975 O ILE A 63 0.744 11.116 -6.888 1.00 0.00 O ATOM 976 CB ILE A 63 -0.021 12.722 -9.855 1.00 0.00 C ATOM 977 CG1 ILE A 63 0.352 12.315 -11.282 1.00 0.00 C ATOM 978 CG2 ILE A 63 1.063 13.582 -9.202 1.00 0.00 C ATOM 979 CD1 ILE A 63 -0.820 12.538 -12.240 1.00 0.00 C ATOM 0 H ILE A 63 -2.138 11.441 -10.067 1.00 0.00 H new ATOM 0 HA ILE A 63 0.379 10.730 -9.304 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.921 13.333 -9.920 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.214 12.893 -11.615 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.646 11.266 -11.300 1.00 0.00 H new ATOM 0 HG21 ILE A 63 1.268 14.448 -9.831 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.721 13.917 -8.223 1.00 0.00 H new ATOM 0 HG23 ILE A 63 1.973 12.994 -9.086 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -0.528 12.241 -13.247 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -1.672 11.940 -11.918 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -1.096 13.593 -12.238 1.00 0.00 H new ATOM 991 N ALA A 64 -0.967 12.595 -6.950 1.00 0.00 N ATOM 992 CA ALA A 64 -0.892 12.910 -5.534 1.00 0.00 C ATOM 993 C ALA A 64 -0.812 11.610 -4.730 1.00 0.00 C ATOM 994 O ALA A 64 0.004 11.490 -3.818 1.00 0.00 O ATOM 995 CB ALA A 64 -2.096 13.767 -5.137 1.00 0.00 C ATOM 0 H ALA A 64 -1.696 13.095 -7.460 1.00 0.00 H new ATOM 0 HA ALA A 64 0.006 13.488 -5.317 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -2.040 14.003 -4.074 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -2.091 14.691 -5.715 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -3.016 13.218 -5.338 1.00 0.00 H new ATOM 1001 N LYS A 65 -1.670 10.670 -5.098 1.00 0.00 N ATOM 1002 CA LYS A 65 -1.707 9.384 -4.423 1.00 0.00 C ATOM 1003 C LYS A 65 -0.374 8.663 -4.637 1.00 0.00 C ATOM 1004 O LYS A 65 0.341 8.375 -3.678 1.00 0.00 O ATOM 1005 CB LYS A 65 -2.924 8.575 -4.877 1.00 0.00 C ATOM 1006 CG LYS A 65 -4.224 9.314 -4.555 1.00 0.00 C ATOM 1007 CD LYS A 65 -5.386 8.333 -4.388 1.00 0.00 C ATOM 1008 CE LYS A 65 -6.409 8.860 -3.380 1.00 0.00 C ATOM 1009 NZ LYS A 65 -7.784 8.699 -3.905 1.00 0.00 N ATOM 0 H LYS A 65 -2.345 10.773 -5.855 1.00 0.00 H new ATOM 0 HA LYS A 65 -1.828 9.521 -3.348 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -2.863 8.390 -5.949 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -2.923 7.602 -4.385 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -4.099 9.895 -3.641 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -4.452 10.021 -5.353 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -5.870 8.170 -5.351 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -5.006 7.367 -4.055 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -6.308 8.324 -2.437 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -6.214 9.912 -3.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -8.466 9.062 -3.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -7.881 9.231 -4.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -7.972 7.692 -4.082 1.00 0.00 H new ATOM 1023 N LEU A 66 -0.081 8.391 -5.900 1.00 0.00 N ATOM 1024 CA LEU A 66 1.152 7.709 -6.252 1.00 0.00 C ATOM 1025 C LEU A 66 2.292 8.243 -5.382 1.00 0.00 C ATOM 1026 O LEU A 66 3.014 7.470 -4.754 1.00 0.00 O ATOM 1027 CB LEU A 66 1.420 7.825 -7.754 1.00 0.00 C ATOM 1028 CG LEU A 66 0.471 7.045 -8.666 1.00 0.00 C ATOM 1029 CD1 LEU A 66 0.656 7.455 -10.129 1.00 0.00 C ATOM 1030 CD2 LEU A 66 0.636 5.537 -8.468 1.00 0.00 C ATOM 0 H LEU A 66 -0.677 8.631 -6.692 1.00 0.00 H new ATOM 0 HA LEU A 66 1.067 6.642 -6.048 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.375 8.878 -8.031 1.00 0.00 H new ATOM 0 HB3 LEU A 66 2.438 7.488 -7.949 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.553 7.296 -8.388 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -0.030 6.886 -10.756 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.449 8.520 -10.238 1.00 0.00 H new ATOM 0 HD13 LEU A 66 1.682 7.252 -10.437 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.050 5.006 -9.128 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.661 5.249 -8.702 1.00 0.00 H new ATOM 0 HD23 LEU A 66 0.415 5.280 -7.432 1.00 0.00 H new ATOM 1042 N ARG A 67 2.417 9.562 -5.371 1.00 0.00 N ATOM 1043 CA ARG A 67 3.457 10.209 -4.588 1.00 0.00 C ATOM 1044 C ARG A 67 3.396 9.737 -3.134 1.00 0.00 C ATOM 1045 O ARG A 67 4.362 9.178 -2.618 1.00 0.00 O ATOM 1046 CB ARG A 67 3.311 11.731 -4.631 1.00 0.00 C ATOM 1047 CG ARG A 67 3.571 12.268 -6.040 1.00 0.00 C ATOM 1048 CD ARG A 67 3.418 13.790 -6.083 1.00 0.00 C ATOM 1049 NE ARG A 67 4.133 14.337 -7.258 1.00 0.00 N ATOM 1050 CZ ARG A 67 3.862 15.524 -7.817 1.00 0.00 C ATOM 1051 NH1 ARG A 67 2.890 16.296 -7.312 1.00 0.00 N ATOM 1052 NH2 ARG A 67 4.563 15.939 -8.881 1.00 0.00 N ATOM 0 H ARG A 67 1.816 10.200 -5.892 1.00 0.00 H new ATOM 0 HA ARG A 67 4.419 9.936 -5.022 1.00 0.00 H new ATOM 0 HB2 ARG A 67 2.308 12.013 -4.310 1.00 0.00 H new ATOM 0 HB3 ARG A 67 4.010 12.187 -3.930 1.00 0.00 H new ATOM 0 HG2 ARG A 67 4.576 11.991 -6.359 1.00 0.00 H new ATOM 0 HG3 ARG A 67 2.875 11.809 -6.742 1.00 0.00 H new ATOM 0 HD2 ARG A 67 2.362 14.056 -6.133 1.00 0.00 H new ATOM 0 HD3 ARG A 67 3.815 14.230 -5.168 1.00 0.00 H new ATOM 0 HE ARG A 67 4.879 13.775 -7.668 1.00 0.00 H new ATOM 0 HH11 ARG A 67 2.357 15.980 -6.502 1.00 0.00 H new ATOM 0 HH12 ARG A 67 2.684 17.200 -7.737 1.00 0.00 H new ATOM 0 HH21 ARG A 67 5.303 15.351 -9.265 1.00 0.00 H new ATOM 0 HH22 ARG A 67 4.357 16.843 -9.307 1.00 0.00 H new ATOM 1066 N LYS A 68 2.251 9.981 -2.514 1.00 0.00 N ATOM 1067 CA LYS A 68 2.052 9.589 -1.129 1.00 0.00 C ATOM 1068 C LYS A 68 2.683 8.215 -0.897 1.00 0.00 C ATOM 1069 O LYS A 68 3.623 8.084 -0.115 1.00 0.00 O ATOM 1070 CB LYS A 68 0.568 9.654 -0.762 1.00 0.00 C ATOM 1071 CG LYS A 68 0.345 10.540 0.465 1.00 0.00 C ATOM 1072 CD LYS A 68 -0.810 11.517 0.234 1.00 0.00 C ATOM 1073 CE LYS A 68 -0.901 12.538 1.370 1.00 0.00 C ATOM 1074 NZ LYS A 68 -0.239 13.804 0.983 1.00 0.00 N ATOM 0 H LYS A 68 1.452 10.445 -2.945 1.00 0.00 H new ATOM 0 HA LYS A 68 2.553 10.288 -0.459 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -0.002 10.044 -1.605 1.00 0.00 H new ATOM 0 HB3 LYS A 68 0.195 8.650 -0.562 1.00 0.00 H new ATOM 0 HG2 LYS A 68 0.131 9.917 1.334 1.00 0.00 H new ATOM 0 HG3 LYS A 68 1.256 11.095 0.688 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -0.669 12.035 -0.715 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -1.748 10.966 0.160 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -1.946 12.727 1.614 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -0.432 12.135 2.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -0.310 14.486 1.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 0.763 13.622 0.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -0.704 14.195 0.139 1.00 0.00 H new ATOM 1088 N ILE A 69 2.140 7.225 -1.591 1.00 0.00 N ATOM 1089 CA ILE A 69 2.638 5.865 -1.470 1.00 0.00 C ATOM 1090 C ILE A 69 4.167 5.891 -1.397 1.00 0.00 C ATOM 1091 O ILE A 69 4.755 5.382 -0.444 1.00 0.00 O ATOM 1092 CB ILE A 69 2.091 4.992 -2.600 1.00 0.00 C ATOM 1093 CG1 ILE A 69 0.599 4.715 -2.407 1.00 0.00 C ATOM 1094 CG2 ILE A 69 2.901 3.701 -2.737 1.00 0.00 C ATOM 1095 CD1 ILE A 69 -0.044 4.237 -3.710 1.00 0.00 C ATOM 0 H ILE A 69 1.360 7.338 -2.239 1.00 0.00 H new ATOM 0 HA ILE A 69 2.282 5.409 -0.546 1.00 0.00 H new ATOM 0 HB ILE A 69 2.198 5.540 -3.536 1.00 0.00 H new ATOM 0 HG12 ILE A 69 0.463 3.960 -1.632 1.00 0.00 H new ATOM 0 HG13 ILE A 69 0.099 5.620 -2.062 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.491 3.099 -3.548 1.00 0.00 H new ATOM 0 HG22 ILE A 69 3.940 3.945 -2.956 1.00 0.00 H new ATOM 0 HG23 ILE A 69 2.849 3.138 -1.805 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -1.105 4.047 -3.544 1.00 0.00 H new ATOM 0 HD12 ILE A 69 0.072 5.004 -4.476 1.00 0.00 H new ATOM 0 HD13 ILE A 69 0.441 3.318 -4.040 1.00 0.00 H new ATOM 1107 N LEU A 70 4.765 6.490 -2.416 1.00 0.00 N ATOM 1108 CA LEU A 70 6.214 6.589 -2.480 1.00 0.00 C ATOM 1109 C LEU A 70 6.731 7.261 -1.207 1.00 0.00 C ATOM 1110 O LEU A 70 7.735 6.834 -0.639 1.00 0.00 O ATOM 1111 CB LEU A 70 6.646 7.294 -3.767 1.00 0.00 C ATOM 1112 CG LEU A 70 6.429 6.513 -5.065 1.00 0.00 C ATOM 1113 CD1 LEU A 70 6.649 7.408 -6.286 1.00 0.00 C ATOM 1114 CD2 LEU A 70 7.307 5.261 -5.106 1.00 0.00 C ATOM 0 H LEU A 70 4.273 6.912 -3.204 1.00 0.00 H new ATOM 0 HA LEU A 70 6.663 5.597 -2.522 1.00 0.00 H new ATOM 0 HB2 LEU A 70 6.106 8.238 -3.840 1.00 0.00 H new ATOM 0 HB3 LEU A 70 7.705 7.538 -3.686 1.00 0.00 H new ATOM 0 HG LEU A 70 5.392 6.179 -5.093 1.00 0.00 H new ATOM 0 HD11 LEU A 70 6.489 6.829 -7.195 1.00 0.00 H new ATOM 0 HD12 LEU A 70 5.947 8.241 -6.258 1.00 0.00 H new ATOM 0 HD13 LEU A 70 7.669 7.793 -6.276 1.00 0.00 H new ATOM 0 HD21 LEU A 70 7.133 4.725 -6.039 1.00 0.00 H new ATOM 0 HD22 LEU A 70 8.356 5.550 -5.044 1.00 0.00 H new ATOM 0 HD23 LEU A 70 7.059 4.615 -4.264 1.00 0.00 H new ATOM 1126 N GLU A 71 6.022 8.302 -0.796 1.00 0.00 N ATOM 1127 CA GLU A 71 6.397 9.038 0.400 1.00 0.00 C ATOM 1128 C GLU A 71 6.150 8.186 1.647 1.00 0.00 C ATOM 1129 O GLU A 71 6.656 8.496 2.724 1.00 0.00 O ATOM 1130 CB GLU A 71 5.642 10.366 0.485 1.00 0.00 C ATOM 1131 CG GLU A 71 5.766 11.152 -0.821 1.00 0.00 C ATOM 1132 CD GLU A 71 5.883 12.653 -0.550 1.00 0.00 C ATOM 1133 OE1 GLU A 71 7.035 13.114 -0.395 1.00 0.00 O ATOM 1134 OE2 GLU A 71 4.819 13.306 -0.502 1.00 0.00 O ATOM 0 H GLU A 71 5.190 8.653 -1.270 1.00 0.00 H new ATOM 0 HA GLU A 71 7.462 9.266 0.345 1.00 0.00 H new ATOM 0 HB2 GLU A 71 4.591 10.177 0.701 1.00 0.00 H new ATOM 0 HB3 GLU A 71 6.036 10.960 1.310 1.00 0.00 H new ATOM 0 HG2 GLU A 71 6.641 10.810 -1.374 1.00 0.00 H new ATOM 0 HG3 GLU A 71 4.896 10.959 -1.449 1.00 0.00 H new ATOM 1141 N ALA A 72 5.373 7.130 1.458 1.00 0.00 N ATOM 1142 CA ALA A 72 5.053 6.231 2.554 1.00 0.00 C ATOM 1143 C ALA A 72 5.663 4.856 2.275 1.00 0.00 C ATOM 1144 O ALA A 72 5.148 3.839 2.737 1.00 0.00 O ATOM 1145 CB ALA A 72 3.535 6.169 2.738 1.00 0.00 C ATOM 0 H ALA A 72 4.956 6.877 0.563 1.00 0.00 H new ATOM 0 HA ALA A 72 5.480 6.598 3.488 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.295 5.495 3.560 1.00 0.00 H new ATOM 0 HB2 ALA A 72 3.155 7.165 2.963 1.00 0.00 H new ATOM 0 HB3 ALA A 72 3.072 5.803 1.822 1.00 0.00 H new ATOM 1151 N SER A 73 6.752 4.869 1.520 1.00 0.00 N ATOM 1152 CA SER A 73 7.437 3.636 1.174 1.00 0.00 C ATOM 1153 C SER A 73 8.034 2.998 2.430 1.00 0.00 C ATOM 1154 O SER A 73 7.588 1.937 2.864 1.00 0.00 O ATOM 1155 CB SER A 73 8.532 3.887 0.135 1.00 0.00 C ATOM 1156 OG SER A 73 9.766 3.276 0.501 1.00 0.00 O ATOM 0 H SER A 73 7.177 5.714 1.138 1.00 0.00 H new ATOM 0 HA SER A 73 6.709 2.952 0.738 1.00 0.00 H new ATOM 0 HB2 SER A 73 8.209 3.501 -0.832 1.00 0.00 H new ATOM 0 HB3 SER A 73 8.680 4.960 0.017 1.00 0.00 H new ATOM 0 HG SER A 73 10.438 3.458 -0.188 1.00 0.00 H new ATOM 1162 N ASN A 74 9.033 3.673 2.980 1.00 0.00 N ATOM 1163 CA ASN A 74 9.695 3.185 4.178 1.00 0.00 C ATOM 1164 C ASN A 74 8.647 2.635 5.147 1.00 0.00 C ATOM 1165 O ASN A 74 8.886 1.637 5.824 1.00 0.00 O ATOM 1166 CB ASN A 74 10.450 4.311 4.887 1.00 0.00 C ATOM 1167 CG ASN A 74 11.937 4.287 4.527 1.00 0.00 C ATOM 1168 OD1 ASN A 74 12.606 3.270 4.611 1.00 0.00 O ATOM 1169 ND2 ASN A 74 12.415 5.460 4.122 1.00 0.00 N ATOM 0 H ASN A 74 9.400 4.553 2.618 1.00 0.00 H new ATOM 0 HA ASN A 74 10.400 2.409 3.881 1.00 0.00 H new ATOM 0 HB2 ASN A 74 10.020 5.273 4.608 1.00 0.00 H new ATOM 0 HB3 ASN A 74 10.332 4.210 5.966 1.00 0.00 H new ATOM 0 HD21 ASN A 74 13.397 5.547 3.859 1.00 0.00 H new ATOM 0 HD22 ASN A 74 11.800 6.272 4.075 1.00 0.00 H new ATOM 1176 N SER A 75 7.508 3.311 5.182 1.00 0.00 N ATOM 1177 CA SER A 75 6.422 2.902 6.057 1.00 0.00 C ATOM 1178 C SER A 75 5.724 1.667 5.483 1.00 0.00 C ATOM 1179 O SER A 75 5.507 0.687 6.193 1.00 0.00 O ATOM 1180 CB SER A 75 5.415 4.038 6.252 1.00 0.00 C ATOM 1181 OG SER A 75 5.683 4.791 7.432 1.00 0.00 O ATOM 0 H SER A 75 7.314 4.139 4.619 1.00 0.00 H new ATOM 0 HA SER A 75 6.843 2.654 7.031 1.00 0.00 H new ATOM 0 HB2 SER A 75 5.442 4.699 5.386 1.00 0.00 H new ATOM 0 HB3 SER A 75 4.408 3.625 6.306 1.00 0.00 H new ATOM 0 HG SER A 75 5.020 5.507 7.520 1.00 0.00 H new ATOM 1187 N ILE A 76 5.392 1.756 4.203 1.00 0.00 N ATOM 1188 CA ILE A 76 4.723 0.658 3.527 1.00 0.00 C ATOM 1189 C ILE A 76 5.436 -0.654 3.864 1.00 0.00 C ATOM 1190 O ILE A 76 6.626 -0.655 4.175 1.00 0.00 O ATOM 1191 CB ILE A 76 4.624 0.935 2.025 1.00 0.00 C ATOM 1192 CG1 ILE A 76 3.365 1.741 1.698 1.00 0.00 C ATOM 1193 CG2 ILE A 76 4.696 -0.365 1.222 1.00 0.00 C ATOM 1194 CD1 ILE A 76 3.300 2.076 0.207 1.00 0.00 C ATOM 0 H ILE A 76 5.574 2.571 3.617 1.00 0.00 H new ATOM 0 HA ILE A 76 3.696 0.563 3.880 1.00 0.00 H new ATOM 0 HB ILE A 76 5.481 1.542 1.733 1.00 0.00 H new ATOM 0 HG12 ILE A 76 2.480 1.173 1.986 1.00 0.00 H new ATOM 0 HG13 ILE A 76 3.356 2.661 2.282 1.00 0.00 H new ATOM 0 HG21 ILE A 76 4.623 -0.140 0.158 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.643 -0.865 1.423 1.00 0.00 H new ATOM 0 HG23 ILE A 76 3.873 -1.018 1.512 1.00 0.00 H new ATOM 0 HD11 ILE A 76 2.396 2.649 0.002 1.00 0.00 H new ATOM 0 HD12 ILE A 76 4.174 2.665 -0.072 1.00 0.00 H new ATOM 0 HD13 ILE A 76 3.284 1.153 -0.373 1.00 0.00 H new ATOM 1206 N GLN A 77 4.677 -1.738 3.791 1.00 0.00 N ATOM 1207 CA GLN A 77 5.221 -3.053 4.085 1.00 0.00 C ATOM 1208 C GLN A 77 4.215 -4.141 3.704 1.00 0.00 C ATOM 1209 O GLN A 77 3.069 -4.114 4.148 1.00 0.00 O ATOM 1210 CB GLN A 77 5.619 -3.165 5.558 1.00 0.00 C ATOM 1211 CG GLN A 77 6.551 -4.356 5.786 1.00 0.00 C ATOM 1212 CD GLN A 77 7.391 -4.162 7.050 1.00 0.00 C ATOM 1213 OE1 GLN A 77 8.021 -3.138 7.256 1.00 0.00 O ATOM 1214 NE2 GLN A 77 7.365 -5.199 7.882 1.00 0.00 N ATOM 0 H GLN A 77 3.690 -1.732 3.533 1.00 0.00 H new ATOM 0 HA GLN A 77 6.122 -3.194 3.488 1.00 0.00 H new ATOM 0 HB2 GLN A 77 6.113 -2.247 5.876 1.00 0.00 H new ATOM 0 HB3 GLN A 77 4.725 -3.275 6.172 1.00 0.00 H new ATOM 0 HG2 GLN A 77 5.964 -5.270 5.872 1.00 0.00 H new ATOM 0 HG3 GLN A 77 7.207 -4.479 4.924 1.00 0.00 H new ATOM 0 HE21 GLN A 77 6.816 -6.027 7.648 1.00 0.00 H new ATOM 0 HE22 GLN A 77 7.894 -5.167 8.754 1.00 0.00 H new ATOM 1223 N PHE A 78 4.682 -5.072 2.886 1.00 0.00 N ATOM 1224 CA PHE A 78 3.837 -6.168 2.440 1.00 0.00 C ATOM 1225 C PHE A 78 3.838 -7.310 3.458 1.00 0.00 C ATOM 1226 O PHE A 78 4.767 -8.116 3.491 1.00 0.00 O ATOM 1227 CB PHE A 78 4.422 -6.675 1.121 1.00 0.00 C ATOM 1228 CG PHE A 78 4.004 -5.856 -0.102 1.00 0.00 C ATOM 1229 CD1 PHE A 78 4.214 -4.512 -0.125 1.00 0.00 C ATOM 1230 CD2 PHE A 78 3.422 -6.471 -1.166 1.00 0.00 C ATOM 1231 CE1 PHE A 78 3.825 -3.752 -1.259 1.00 0.00 C ATOM 1232 CE2 PHE A 78 3.033 -5.711 -2.301 1.00 0.00 C ATOM 1233 CZ PHE A 78 3.243 -4.367 -2.323 1.00 0.00 C ATOM 0 H PHE A 78 5.634 -5.091 2.520 1.00 0.00 H new ATOM 0 HA PHE A 78 2.810 -5.823 2.323 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.510 -6.672 1.193 1.00 0.00 H new ATOM 0 HB3 PHE A 78 4.115 -7.711 0.974 1.00 0.00 H new ATOM 0 HD1 PHE A 78 4.677 -4.023 0.720 1.00 0.00 H new ATOM 0 HD2 PHE A 78 3.255 -7.538 -1.148 1.00 0.00 H new ATOM 0 HE1 PHE A 78 3.991 -2.685 -1.277 1.00 0.00 H new ATOM 0 HE2 PHE A 78 2.571 -6.200 -3.146 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.947 -3.788 -3.186 1.00 0.00 H new ATOM 1243 N VAL A 79 2.786 -7.343 4.263 1.00 0.00 N ATOM 1244 CA VAL A 79 2.654 -8.374 5.279 1.00 0.00 C ATOM 1245 C VAL A 79 2.004 -9.613 4.661 1.00 0.00 C ATOM 1246 O VAL A 79 0.964 -9.514 4.010 1.00 0.00 O ATOM 1247 CB VAL A 79 1.879 -7.828 6.480 1.00 0.00 C ATOM 1248 CG1 VAL A 79 1.569 -8.940 7.483 1.00 0.00 C ATOM 1249 CG2 VAL A 79 2.640 -6.682 7.149 1.00 0.00 C ATOM 0 H VAL A 79 2.018 -6.673 4.232 1.00 0.00 H new ATOM 0 HA VAL A 79 3.634 -8.673 5.650 1.00 0.00 H new ATOM 0 HB VAL A 79 0.931 -7.432 6.115 1.00 0.00 H new ATOM 0 HG11 VAL A 79 1.018 -8.525 8.327 1.00 0.00 H new ATOM 0 HG12 VAL A 79 0.967 -9.709 6.999 1.00 0.00 H new ATOM 0 HG13 VAL A 79 2.501 -9.379 7.839 1.00 0.00 H new ATOM 0 HG21 VAL A 79 2.067 -6.312 7.999 1.00 0.00 H new ATOM 0 HG22 VAL A 79 3.610 -7.041 7.493 1.00 0.00 H new ATOM 0 HG23 VAL A 79 2.786 -5.875 6.432 1.00 0.00 H new ATOM 1259 N ILE A 80 2.642 -10.752 4.885 1.00 0.00 N ATOM 1260 CA ILE A 80 2.139 -12.009 4.359 1.00 0.00 C ATOM 1261 C ILE A 80 1.583 -12.852 5.508 1.00 0.00 C ATOM 1262 O ILE A 80 2.243 -13.026 6.531 1.00 0.00 O ATOM 1263 CB ILE A 80 3.221 -12.719 3.542 1.00 0.00 C ATOM 1264 CG1 ILE A 80 3.994 -11.724 2.674 1.00 0.00 C ATOM 1265 CG2 ILE A 80 2.623 -13.859 2.715 1.00 0.00 C ATOM 1266 CD1 ILE A 80 3.103 -11.154 1.568 1.00 0.00 C ATOM 0 H ILE A 80 3.504 -10.831 5.424 1.00 0.00 H new ATOM 0 HA ILE A 80 1.316 -11.830 3.667 1.00 0.00 H new ATOM 0 HB ILE A 80 3.936 -13.164 4.234 1.00 0.00 H new ATOM 0 HG12 ILE A 80 4.373 -10.912 3.295 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.859 -12.218 2.231 1.00 0.00 H new ATOM 0 HG21 ILE A 80 3.413 -14.347 2.144 1.00 0.00 H new ATOM 0 HG22 ILE A 80 2.155 -14.584 3.380 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.875 -13.459 2.031 1.00 0.00 H new ATOM 0 HD11 ILE A 80 3.677 -10.450 0.966 1.00 0.00 H new ATOM 0 HD12 ILE A 80 2.745 -11.966 0.935 1.00 0.00 H new ATOM 0 HD13 ILE A 80 2.252 -10.640 2.015 1.00 0.00 H new ATOM 1278 N LYS A 81 0.374 -13.354 5.300 1.00 0.00 N ATOM 1279 CA LYS A 81 -0.278 -14.175 6.306 1.00 0.00 C ATOM 1280 C LYS A 81 -0.441 -15.598 5.769 1.00 0.00 C ATOM 1281 O LYS A 81 -0.288 -16.567 6.511 1.00 0.00 O ATOM 1282 CB LYS A 81 -1.592 -13.532 6.753 1.00 0.00 C ATOM 1283 CG LYS A 81 -1.393 -12.052 7.085 1.00 0.00 C ATOM 1284 CD LYS A 81 -1.297 -11.838 8.597 1.00 0.00 C ATOM 1285 CE LYS A 81 -2.631 -11.349 9.167 1.00 0.00 C ATOM 1286 NZ LYS A 81 -2.995 -12.127 10.373 1.00 0.00 N ATOM 0 H LYS A 81 -0.171 -13.208 4.450 1.00 0.00 H new ATOM 0 HA LYS A 81 0.339 -14.241 7.202 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -2.338 -13.634 5.965 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -1.978 -14.056 7.627 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -0.486 -11.686 6.604 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -2.223 -11.471 6.684 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -1.010 -12.771 9.083 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -0.515 -11.111 8.816 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -2.560 -10.290 9.417 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -3.413 -11.447 8.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -3.902 -11.783 10.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -3.082 -13.133 10.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -2.256 -12.012 11.096 1.00 0.00 H new ATOM 1300 N ARG A 82 -0.751 -15.679 4.483 1.00 0.00 N ATOM 1301 CA ARG A 82 -0.937 -16.968 3.838 1.00 0.00 C ATOM 1302 C ARG A 82 -0.362 -16.940 2.420 1.00 0.00 C ATOM 1303 O ARG A 82 -1.040 -16.532 1.479 1.00 0.00 O ATOM 1304 CB ARG A 82 -2.419 -17.342 3.772 1.00 0.00 C ATOM 1305 CG ARG A 82 -3.027 -17.422 5.174 1.00 0.00 C ATOM 1306 CD ARG A 82 -4.396 -18.104 5.139 1.00 0.00 C ATOM 1307 NE ARG A 82 -4.239 -19.565 5.314 1.00 0.00 N ATOM 1308 CZ ARG A 82 -5.244 -20.446 5.217 1.00 0.00 C ATOM 1309 NH1 ARG A 82 -6.485 -20.018 4.947 1.00 0.00 N ATOM 1310 NH2 ARG A 82 -5.009 -21.753 5.390 1.00 0.00 N ATOM 0 H ARG A 82 -0.878 -14.873 3.871 1.00 0.00 H new ATOM 0 HA ARG A 82 -0.411 -17.715 4.433 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -2.958 -16.603 3.179 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.534 -18.301 3.267 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -2.358 -17.975 5.834 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -3.127 -16.419 5.589 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -5.032 -17.701 5.927 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -4.892 -17.894 4.191 1.00 0.00 H new ATOM 0 HE ARG A 82 -3.307 -19.924 5.522 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -6.664 -19.022 4.816 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -7.251 -20.688 4.873 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -4.064 -22.078 5.596 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -5.775 -22.423 5.316 1.00 0.00 H new ATOM 1324 N PRO A 83 0.917 -17.391 2.309 1.00 0.00 N ATOM 1325 CA PRO A 83 1.591 -17.421 1.023 1.00 0.00 C ATOM 1326 C PRO A 83 1.073 -18.573 0.159 1.00 0.00 C ATOM 1327 O PRO A 83 1.273 -18.583 -1.054 1.00 0.00 O ATOM 1328 CB PRO A 83 3.069 -17.545 1.355 1.00 0.00 C ATOM 1329 CG PRO A 83 3.132 -18.047 2.789 1.00 0.00 C ATOM 1330 CD PRO A 83 1.751 -17.881 3.402 1.00 0.00 C ATOM 0 HA PRO A 83 1.404 -16.526 0.430 1.00 0.00 H new ATOM 0 HB2 PRO A 83 3.565 -18.238 0.676 1.00 0.00 H new ATOM 0 HB3 PRO A 83 3.574 -16.584 1.255 1.00 0.00 H new ATOM 0 HG2 PRO A 83 3.438 -19.093 2.814 1.00 0.00 H new ATOM 0 HG3 PRO A 83 3.872 -17.485 3.358 1.00 0.00 H new ATOM 0 HD2 PRO A 83 1.375 -18.826 3.794 1.00 0.00 H new ATOM 0 HD3 PRO A 83 1.769 -17.176 4.233 1.00 0.00 H new ATOM 1338 N GLU A 84 0.418 -19.517 0.819 1.00 0.00 N ATOM 1339 CA GLU A 84 -0.130 -20.671 0.128 1.00 0.00 C ATOM 1340 C GLU A 84 -1.141 -20.225 -0.931 1.00 0.00 C ATOM 1341 O GLU A 84 -1.418 -20.959 -1.878 1.00 0.00 O ATOM 1342 CB GLU A 84 -0.766 -21.651 1.115 1.00 0.00 C ATOM 1343 CG GLU A 84 -2.042 -21.065 1.724 1.00 0.00 C ATOM 1344 CD GLU A 84 -2.793 -22.118 2.542 1.00 0.00 C ATOM 1345 OE1 GLU A 84 -2.106 -23.005 3.092 1.00 0.00 O ATOM 1346 OE2 GLU A 84 -4.037 -22.012 2.597 1.00 0.00 O ATOM 0 H GLU A 84 0.255 -19.506 1.826 1.00 0.00 H new ATOM 0 HA GLU A 84 0.686 -21.191 -0.373 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -0.998 -22.586 0.606 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -0.056 -21.887 1.907 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -1.789 -20.217 2.361 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.687 -20.687 0.931 1.00 0.00 H new ATOM 1353 N LEU A 85 -1.665 -19.024 -0.734 1.00 0.00 N ATOM 1354 CA LEU A 85 -2.640 -18.471 -1.659 1.00 0.00 C ATOM 1355 C LEU A 85 -1.942 -18.109 -2.972 1.00 0.00 C ATOM 1356 O LEU A 85 -2.440 -18.424 -4.051 1.00 0.00 O ATOM 1357 CB LEU A 85 -3.386 -17.301 -1.016 1.00 0.00 C ATOM 1358 CG LEU A 85 -4.220 -17.636 0.222 1.00 0.00 C ATOM 1359 CD1 LEU A 85 -4.754 -16.365 0.885 1.00 0.00 C ATOM 1360 CD2 LEU A 85 -5.343 -18.617 -0.124 1.00 0.00 C ATOM 0 H LEU A 85 -1.433 -18.418 0.053 1.00 0.00 H new ATOM 0 HA LEU A 85 -3.403 -19.212 -1.897 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.657 -16.538 -0.743 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -4.044 -16.860 -1.765 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.572 -18.129 0.947 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -5.343 -16.632 1.762 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -3.918 -15.734 1.188 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -5.381 -15.822 0.178 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -5.921 -18.839 0.773 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -5.995 -18.173 -0.876 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -4.913 -19.539 -0.516 1.00 0.00 H new ATOM 1372 N LEU A 86 -0.799 -17.452 -2.835 1.00 0.00 N ATOM 1373 CA LEU A 86 -0.027 -17.044 -3.997 1.00 0.00 C ATOM 1374 C LEU A 86 -0.015 -18.180 -5.021 1.00 0.00 C ATOM 1375 O LEU A 86 -0.491 -18.014 -6.143 1.00 0.00 O ATOM 1376 CB LEU A 86 1.369 -16.580 -3.577 1.00 0.00 C ATOM 1377 CG LEU A 86 1.418 -15.469 -2.526 1.00 0.00 C ATOM 1378 CD1 LEU A 86 2.862 -15.058 -2.230 1.00 0.00 C ATOM 1379 CD2 LEU A 86 0.558 -14.276 -2.948 1.00 0.00 C ATOM 0 H LEU A 86 -0.389 -17.192 -1.938 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.492 -16.184 -4.480 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.916 -17.441 -3.193 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.899 -16.236 -4.465 1.00 0.00 H new ATOM 0 HG LEU A 86 0.997 -15.857 -1.599 1.00 0.00 H new ATOM 0 HD11 LEU A 86 2.869 -14.267 -1.480 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.416 -15.919 -1.855 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.332 -14.695 -3.144 1.00 0.00 H new ATOM 0 HD21 LEU A 86 0.611 -13.501 -2.183 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.926 -13.878 -3.894 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.477 -14.598 -3.068 1.00 0.00 H new ATOM 1391 N THR A 87 0.533 -19.310 -4.598 1.00 0.00 N ATOM 1392 CA THR A 87 0.614 -20.473 -5.465 1.00 0.00 C ATOM 1393 C THR A 87 -0.679 -21.288 -5.384 1.00 0.00 C ATOM 1394 O THR A 87 -0.748 -22.279 -4.659 1.00 0.00 O ATOM 1395 CB THR A 87 1.860 -21.270 -5.073 1.00 0.00 C ATOM 1396 OG1 THR A 87 1.786 -22.446 -5.873 1.00 0.00 O ATOM 1397 CG2 THR A 87 1.793 -21.792 -3.636 1.00 0.00 C ATOM 0 H THR A 87 0.925 -19.445 -3.666 1.00 0.00 H new ATOM 0 HA THR A 87 0.714 -20.181 -6.510 1.00 0.00 H new ATOM 0 HB THR A 87 2.744 -20.643 -5.191 1.00 0.00 H new ATOM 0 HG1 THR A 87 2.558 -23.020 -5.683 1.00 0.00 H new ATOM 0 HG21 THR A 87 2.701 -22.350 -3.409 1.00 0.00 H new ATOM 0 HG22 THR A 87 1.702 -20.952 -2.948 1.00 0.00 H new ATOM 0 HG23 THR A 87 0.928 -22.446 -3.527 1.00 0.00 H new ATOM 1405 N GLU A 88 -1.671 -20.841 -6.140 1.00 0.00 N ATOM 1406 CA GLU A 88 -2.957 -21.516 -6.163 1.00 0.00 C ATOM 1407 C GLU A 88 -3.073 -22.395 -7.410 1.00 0.00 C ATOM 1408 O GLU A 88 -3.326 -23.594 -7.307 1.00 0.00 O ATOM 1409 CB GLU A 88 -4.107 -20.508 -6.095 1.00 0.00 C ATOM 1410 CG GLU A 88 -4.971 -20.747 -4.855 1.00 0.00 C ATOM 1411 CD GLU A 88 -5.898 -19.557 -4.596 1.00 0.00 C ATOM 1412 OE1 GLU A 88 -6.829 -19.376 -5.410 1.00 0.00 O ATOM 1413 OE2 GLU A 88 -5.654 -18.856 -3.590 1.00 0.00 O ATOM 0 H GLU A 88 -1.610 -20.019 -6.741 1.00 0.00 H new ATOM 0 HA GLU A 88 -3.025 -22.156 -5.283 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -3.707 -19.494 -6.074 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -4.721 -20.590 -6.992 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -5.564 -21.652 -4.989 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -4.332 -20.910 -3.988 1.00 0.00 H new ATOM 1420 N GLY A 89 -2.881 -21.764 -8.560 1.00 0.00 N ATOM 1421 CA GLY A 89 -2.960 -22.475 -9.825 1.00 0.00 C ATOM 1422 C GLY A 89 -3.127 -21.499 -10.992 1.00 0.00 C ATOM 1423 O GLY A 89 -3.352 -20.308 -10.782 1.00 0.00 O ATOM 0 H GLY A 89 -2.671 -20.769 -8.642 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -2.058 -23.069 -9.969 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -3.800 -23.170 -9.804 1.00 0.00 H new ATOM 1427 N VAL A 90 -3.011 -22.040 -12.195 1.00 0.00 N ATOM 1428 CA VAL A 90 -3.146 -21.232 -13.395 1.00 0.00 C ATOM 1429 C VAL A 90 -3.184 -22.149 -14.620 1.00 0.00 C ATOM 1430 O VAL A 90 -2.629 -23.246 -14.596 1.00 0.00 O ATOM 1431 CB VAL A 90 -2.021 -20.197 -13.458 1.00 0.00 C ATOM 1432 CG1 VAL A 90 -0.675 -20.866 -13.745 1.00 0.00 C ATOM 1433 CG2 VAL A 90 -2.329 -19.116 -14.497 1.00 0.00 C ATOM 0 H VAL A 90 -2.825 -23.028 -12.365 1.00 0.00 H new ATOM 0 HA VAL A 90 -4.082 -20.674 -13.377 1.00 0.00 H new ATOM 0 HB VAL A 90 -1.954 -19.715 -12.483 1.00 0.00 H new ATOM 0 HG11 VAL A 90 0.107 -20.108 -13.785 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -0.448 -21.581 -12.954 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -0.724 -21.387 -14.701 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -1.514 -18.393 -14.522 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -2.437 -19.576 -15.479 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -3.256 -18.609 -14.230 1.00 0.00 H new ATOM 1443 N LYS A 91 -3.845 -21.664 -15.661 1.00 0.00 N ATOM 1444 CA LYS A 91 -3.963 -22.426 -16.893 1.00 0.00 C ATOM 1445 C LYS A 91 -2.942 -21.908 -17.908 1.00 0.00 C ATOM 1446 O LYS A 91 -2.401 -20.815 -17.747 1.00 0.00 O ATOM 1447 CB LYS A 91 -5.405 -22.399 -17.403 1.00 0.00 C ATOM 1448 CG LYS A 91 -5.688 -23.598 -18.310 1.00 0.00 C ATOM 1449 CD LYS A 91 -5.916 -23.151 -19.756 1.00 0.00 C ATOM 1450 CE LYS A 91 -5.353 -24.176 -20.742 1.00 0.00 C ATOM 1451 NZ LYS A 91 -6.298 -25.301 -20.917 1.00 0.00 N ATOM 0 H LYS A 91 -4.304 -20.753 -15.677 1.00 0.00 H new ATOM 0 HA LYS A 91 -3.731 -23.476 -16.715 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -6.094 -22.407 -16.558 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -5.584 -21.474 -17.951 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -4.851 -24.295 -18.269 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -6.566 -24.133 -17.948 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -6.983 -23.017 -19.935 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -5.441 -22.184 -19.921 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -5.165 -23.699 -21.704 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -4.396 -24.551 -20.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -5.900 -25.987 -21.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -6.457 -25.766 -20.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -7.202 -24.941 -21.284 1.00 0.00 H new ATOM 1465 N GLU A 92 -2.709 -22.717 -18.931 1.00 0.00 N ATOM 1466 CA GLU A 92 -1.763 -22.355 -19.972 1.00 0.00 C ATOM 1467 C GLU A 92 -2.100 -23.084 -21.274 1.00 0.00 C ATOM 1468 O GLU A 92 -1.668 -24.216 -21.485 1.00 0.00 O ATOM 1469 CB GLU A 92 -0.327 -22.650 -19.534 1.00 0.00 C ATOM 1470 CG GLU A 92 0.680 -21.942 -20.443 1.00 0.00 C ATOM 1471 CD GLU A 92 1.662 -22.943 -21.056 1.00 0.00 C ATOM 1472 OE1 GLU A 92 1.229 -23.676 -21.971 1.00 0.00 O ATOM 1473 OE2 GLU A 92 2.824 -22.951 -20.596 1.00 0.00 O ATOM 0 H GLU A 92 -3.160 -23.623 -19.061 1.00 0.00 H new ATOM 0 HA GLU A 92 -1.841 -21.282 -20.149 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -0.183 -22.325 -18.504 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -0.150 -23.725 -19.557 1.00 0.00 H new ATOM 0 HG2 GLU A 92 0.151 -21.414 -21.236 1.00 0.00 H new ATOM 0 HG3 GLU A 92 1.228 -21.193 -19.871 1.00 0.00 H new ATOM 1480 N PRO A 93 -2.890 -22.388 -22.135 1.00 0.00 N ATOM 1481 CA PRO A 93 -3.290 -22.957 -23.410 1.00 0.00 C ATOM 1482 C PRO A 93 -2.129 -22.940 -24.407 1.00 0.00 C ATOM 1483 O PRO A 93 -1.411 -21.947 -24.511 1.00 0.00 O ATOM 1484 CB PRO A 93 -4.473 -22.117 -23.862 1.00 0.00 C ATOM 1485 CG PRO A 93 -4.400 -20.828 -23.059 1.00 0.00 C ATOM 1486 CD PRO A 93 -3.421 -21.045 -21.917 1.00 0.00 C ATOM 0 HA PRO A 93 -3.571 -24.007 -23.332 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -4.422 -21.914 -24.932 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -5.413 -22.637 -23.681 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -4.072 -20.003 -23.691 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -5.384 -20.563 -22.673 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -2.627 -20.298 -21.929 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -3.917 -20.967 -20.950 1.00 0.00 H new ATOM 1494 N SER A 94 -1.982 -24.051 -25.113 1.00 0.00 N ATOM 1495 CA SER A 94 -0.920 -24.176 -26.098 1.00 0.00 C ATOM 1496 C SER A 94 -1.366 -25.099 -27.233 1.00 0.00 C ATOM 1497 O SER A 94 -1.205 -24.768 -28.407 1.00 0.00 O ATOM 1498 CB SER A 94 0.365 -24.704 -25.458 1.00 0.00 C ATOM 1499 OG SER A 94 1.372 -24.976 -26.429 1.00 0.00 O ATOM 0 H SER A 94 -2.580 -24.873 -25.023 1.00 0.00 H new ATOM 0 HA SER A 94 -0.711 -23.186 -26.504 1.00 0.00 H new ATOM 0 HB2 SER A 94 0.740 -23.973 -24.742 1.00 0.00 H new ATOM 0 HB3 SER A 94 0.145 -25.614 -24.900 1.00 0.00 H new ATOM 0 HG SER A 94 2.177 -25.310 -25.981 1.00 0.00 H new ATOM 1505 N GLY A 95 -1.918 -26.239 -26.844 1.00 0.00 N ATOM 1506 CA GLY A 95 -2.388 -27.213 -27.815 1.00 0.00 C ATOM 1507 C GLY A 95 -2.843 -28.500 -27.124 1.00 0.00 C ATOM 1508 O GLY A 95 -2.417 -28.794 -26.009 1.00 0.00 O ATOM 0 H GLY A 95 -2.050 -26.510 -25.870 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -3.214 -26.792 -28.387 1.00 0.00 H new ATOM 0 HA3 GLY A 95 -1.591 -27.439 -28.524 1.00 0.00 H new ATOM 1512 N PRO A 96 -3.726 -29.253 -27.835 1.00 0.00 N ATOM 1513 CA PRO A 96 -4.243 -30.501 -27.302 1.00 0.00 C ATOM 1514 C PRO A 96 -3.188 -31.607 -27.375 1.00 0.00 C ATOM 1515 O PRO A 96 -3.048 -32.269 -28.402 1.00 0.00 O ATOM 1516 CB PRO A 96 -5.478 -30.803 -28.135 1.00 0.00 C ATOM 1517 CG PRO A 96 -5.344 -29.965 -29.397 1.00 0.00 C ATOM 1518 CD PRO A 96 -4.252 -28.935 -29.159 1.00 0.00 C ATOM 0 HA PRO A 96 -4.499 -30.433 -26.245 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -5.537 -31.865 -28.375 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -6.388 -30.548 -27.591 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -5.094 -30.596 -30.250 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -6.288 -29.473 -29.631 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -3.474 -28.999 -29.920 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -4.650 -27.921 -29.194 1.00 0.00 H new ATOM 1526 N SER A 97 -2.474 -31.774 -26.271 1.00 0.00 N ATOM 1527 CA SER A 97 -1.437 -32.788 -26.197 1.00 0.00 C ATOM 1528 C SER A 97 -1.709 -33.730 -25.023 1.00 0.00 C ATOM 1529 O SER A 97 -2.412 -33.367 -24.081 1.00 0.00 O ATOM 1530 CB SER A 97 -0.053 -32.151 -26.057 1.00 0.00 C ATOM 1531 OG SER A 97 0.988 -33.124 -26.090 1.00 0.00 O ATOM 0 H SER A 97 -2.594 -31.224 -25.421 1.00 0.00 H new ATOM 0 HA SER A 97 -1.452 -33.360 -27.124 1.00 0.00 H new ATOM 0 HB2 SER A 97 0.098 -31.431 -26.861 1.00 0.00 H new ATOM 0 HB3 SER A 97 -0.002 -31.597 -25.120 1.00 0.00 H new ATOM 0 HG SER A 97 1.856 -32.678 -26.000 1.00 0.00 H new ATOM 1537 N SER A 98 -1.137 -34.922 -25.116 1.00 0.00 N ATOM 1538 CA SER A 98 -1.309 -35.918 -24.073 1.00 0.00 C ATOM 1539 C SER A 98 0.019 -36.155 -23.351 1.00 0.00 C ATOM 1540 O SER A 98 1.043 -36.392 -23.989 1.00 0.00 O ATOM 1541 CB SER A 98 -1.841 -37.232 -24.649 1.00 0.00 C ATOM 1542 OG SER A 98 -0.887 -37.869 -25.495 1.00 0.00 O ATOM 0 H SER A 98 -0.554 -35.220 -25.898 1.00 0.00 H new ATOM 0 HA SER A 98 -2.042 -35.542 -23.359 1.00 0.00 H new ATOM 0 HB2 SER A 98 -2.108 -37.904 -23.833 1.00 0.00 H new ATOM 0 HB3 SER A 98 -2.753 -37.038 -25.213 1.00 0.00 H new ATOM 0 HG SER A 98 -1.264 -38.705 -25.841 1.00 0.00 H new ATOM 1548 N GLY A 99 -0.042 -36.081 -22.029 1.00 0.00 N ATOM 1549 CA GLY A 99 1.143 -36.284 -21.213 1.00 0.00 C ATOM 1550 C GLY A 99 1.206 -35.264 -20.075 1.00 0.00 C ATOM 1551 O GLY A 99 0.642 -34.175 -20.180 1.00 0.00 O ATOM 0 H GLY A 99 -0.893 -35.883 -21.503 1.00 0.00 H new ATOM 0 HA2 GLY A 99 1.137 -37.293 -20.802 1.00 0.00 H new ATOM 0 HA3 GLY A 99 2.035 -36.198 -21.833 1.00 0.00 H new TER 1555 GLY A 99