USER MOD reduce.3.24.130724 H: found=0, std=0, add=490, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 491 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 NoAdj-H: A 203 HIS HE2 : A 203 HIS NE2 : A 301 ZNZN :(H bumps) USER MOD NoAdj-H: A 209 HIS HD1 : A 209 HIS ND1 : A 301 ZNZN :(H bumps) USER MOD Single : A 168 SER OG : rot 27:sc= 0.0842 USER MOD Single : A 169 THR OG1 : rot 180:sc= 0 USER MOD Single : A 170 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 175 HIS : no HD1:sc=-0.00668 X(o=-0.0067,f=0) USER MOD Single : A 176 GLN : amide:sc= 0.881 K(o=0.88,f=-0.018) USER MOD Single : A 177 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 180 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 188 SER OG : rot 180:sc= 0 USER MOD Single : A 191 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 195 ASN : amide:sc= 0.917 K(o=0.92,f=-0.053) USER MOD Single : A 199 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 201 GLN : amide:sc= 0 X(o=0,f=-0.036) USER MOD Single : A 202 GLN : amide:sc=-0.00763 X(o=-0.0076,f=-0.43) USER MOD Single : A 204 TYR OH : rot -11:sc= 0.285 USER MOD Single : A 207 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 208 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 211 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 212 GLN : amide:sc= 0.718 K(o=0.72,f=0) USER MOD Single : A 214 THR OG1 : rot 73:sc= 0.115 USER MOD Single : A 215 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.000866) USER MOD Single : A 217 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 219 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 222 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 168 -12.864 7.322 -29.182 1.00 0.00 N ATOM 2 CA SER A 168 -11.700 6.428 -29.267 1.00 0.00 C ATOM 3 C SER A 168 -10.567 6.784 -28.286 1.00 0.00 C ATOM 4 O SER A 168 -9.544 6.096 -28.241 1.00 0.00 O ATOM 5 CB SER A 168 -11.159 6.402 -30.706 1.00 0.00 C ATOM 6 OG SER A 168 -12.178 6.017 -31.621 1.00 0.00 O ATOM 0 HA SER A 168 -12.055 5.439 -28.977 1.00 0.00 H new ATOM 0 HB2 SER A 168 -10.777 7.387 -30.974 1.00 0.00 H new ATOM 0 HB3 SER A 168 -10.322 5.707 -30.772 1.00 0.00 H new ATOM 0 HG SER A 168 -13.055 6.257 -31.254 1.00 0.00 H new ATOM 12 N THR A 169 -10.736 7.847 -27.490 1.00 0.00 N ATOM 13 CA THR A 169 -9.749 8.316 -26.490 1.00 0.00 C ATOM 14 C THR A 169 -9.539 7.306 -25.348 1.00 0.00 C ATOM 15 O THR A 169 -8.418 7.179 -24.849 1.00 0.00 O ATOM 16 CB THR A 169 -10.166 9.687 -25.918 1.00 0.00 C ATOM 17 OG1 THR A 169 -10.278 10.640 -26.960 1.00 0.00 O ATOM 18 CG2 THR A 169 -9.159 10.279 -24.928 1.00 0.00 C ATOM 0 H THR A 169 -11.578 8.422 -27.518 1.00 0.00 H new ATOM 0 HA THR A 169 -8.797 8.416 -27.011 1.00 0.00 H new ATOM 0 HB THR A 169 -11.110 9.497 -25.407 1.00 0.00 H new ATOM 0 HG1 THR A 169 -10.545 11.505 -26.585 1.00 0.00 H new ATOM 0 HG21 THR A 169 -9.523 11.242 -24.571 1.00 0.00 H new ATOM 0 HG22 THR A 169 -9.038 9.601 -24.083 1.00 0.00 H new ATOM 0 HG23 THR A 169 -8.198 10.416 -25.424 1.00 0.00 H new ATOM 26 N LYS A 170 -10.604 6.569 -24.977 1.00 0.00 N ATOM 27 CA LYS A 170 -10.684 5.529 -23.923 1.00 0.00 C ATOM 28 C LYS A 170 -10.472 6.059 -22.490 1.00 0.00 C ATOM 29 O LYS A 170 -9.777 7.049 -22.255 1.00 0.00 O ATOM 30 CB LYS A 170 -9.742 4.358 -24.293 1.00 0.00 C ATOM 31 CG LYS A 170 -9.926 3.090 -23.442 1.00 0.00 C ATOM 32 CD LYS A 170 -9.048 1.945 -23.971 1.00 0.00 C ATOM 33 CE LYS A 170 -9.128 0.693 -23.088 1.00 0.00 C ATOM 34 NZ LYS A 170 -10.466 0.066 -23.130 1.00 0.00 N ATOM 0 H LYS A 170 -11.504 6.692 -25.441 1.00 0.00 H new ATOM 0 HA LYS A 170 -11.709 5.160 -23.896 1.00 0.00 H new ATOM 0 HB2 LYS A 170 -9.898 4.101 -25.341 1.00 0.00 H new ATOM 0 HB3 LYS A 170 -8.710 4.696 -24.198 1.00 0.00 H new ATOM 0 HG2 LYS A 170 -9.668 3.302 -22.404 1.00 0.00 H new ATOM 0 HG3 LYS A 170 -10.973 2.787 -23.455 1.00 0.00 H new ATOM 0 HD2 LYS A 170 -9.357 1.692 -24.985 1.00 0.00 H new ATOM 0 HD3 LYS A 170 -8.013 2.281 -24.028 1.00 0.00 H new ATOM 0 HE2 LYS A 170 -8.380 -0.029 -23.415 1.00 0.00 H new ATOM 0 HE3 LYS A 170 -8.885 0.960 -22.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 -10.474 -0.776 -22.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 -11.178 0.745 -22.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 -10.688 -0.213 -24.107 1.00 0.00 H new ATOM 48 N VAL A 171 -11.069 5.375 -21.509 1.00 0.00 N ATOM 49 CA VAL A 171 -10.939 5.675 -20.069 1.00 0.00 C ATOM 50 C VAL A 171 -9.663 4.994 -19.551 1.00 0.00 C ATOM 51 O VAL A 171 -9.698 3.916 -18.956 1.00 0.00 O ATOM 52 CB VAL A 171 -12.204 5.273 -19.275 1.00 0.00 C ATOM 53 CG1 VAL A 171 -12.119 5.741 -17.815 1.00 0.00 C ATOM 54 CG2 VAL A 171 -13.466 5.910 -19.876 1.00 0.00 C ATOM 0 H VAL A 171 -11.674 4.575 -21.694 1.00 0.00 H new ATOM 0 HA VAL A 171 -10.850 6.751 -19.921 1.00 0.00 H new ATOM 0 HB VAL A 171 -12.261 4.186 -19.326 1.00 0.00 H new ATOM 0 HG11 VAL A 171 -13.023 5.443 -17.284 1.00 0.00 H new ATOM 0 HG12 VAL A 171 -11.251 5.286 -17.337 1.00 0.00 H new ATOM 0 HG13 VAL A 171 -12.022 6.826 -17.786 1.00 0.00 H new ATOM 0 HG21 VAL A 171 -14.338 5.608 -19.295 1.00 0.00 H new ATOM 0 HG22 VAL A 171 -13.372 6.996 -19.852 1.00 0.00 H new ATOM 0 HG23 VAL A 171 -13.585 5.579 -20.908 1.00 0.00 H new ATOM 64 N GLU A 172 -8.511 5.591 -19.862 1.00 0.00 N ATOM 65 CA GLU A 172 -7.176 5.074 -19.525 1.00 0.00 C ATOM 66 C GLU A 172 -6.991 4.820 -18.014 1.00 0.00 C ATOM 67 O GLU A 172 -7.094 5.740 -17.196 1.00 0.00 O ATOM 68 CB GLU A 172 -6.090 6.035 -20.044 1.00 0.00 C ATOM 69 CG GLU A 172 -6.074 6.140 -21.576 1.00 0.00 C ATOM 70 CD GLU A 172 -4.943 7.061 -22.052 1.00 0.00 C ATOM 71 OE1 GLU A 172 -5.147 8.300 -22.048 1.00 0.00 O ATOM 72 OE2 GLU A 172 -3.865 6.532 -22.416 1.00 0.00 O ATOM 0 H GLU A 172 -8.476 6.474 -20.371 1.00 0.00 H new ATOM 0 HA GLU A 172 -7.077 4.107 -20.018 1.00 0.00 H new ATOM 0 HB2 GLU A 172 -6.253 7.025 -19.618 1.00 0.00 H new ATOM 0 HB3 GLU A 172 -5.114 5.695 -19.697 1.00 0.00 H new ATOM 0 HG2 GLU A 172 -5.948 5.148 -22.011 1.00 0.00 H new ATOM 0 HG3 GLU A 172 -7.032 6.523 -21.928 1.00 0.00 H new ATOM 79 N ALA A 173 -6.699 3.565 -17.653 1.00 0.00 N ATOM 80 CA ALA A 173 -6.460 3.113 -16.274 1.00 0.00 C ATOM 81 C ALA A 173 -5.523 1.887 -16.208 1.00 0.00 C ATOM 82 O ALA A 173 -4.623 1.848 -15.367 1.00 0.00 O ATOM 83 CB ALA A 173 -7.815 2.797 -15.622 1.00 0.00 C ATOM 0 H ALA A 173 -6.620 2.810 -18.334 1.00 0.00 H new ATOM 0 HA ALA A 173 -5.955 3.912 -15.731 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -7.656 2.460 -14.598 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -8.434 3.694 -15.617 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -8.317 2.013 -16.188 1.00 0.00 H new ATOM 89 N LEU A 174 -5.716 0.903 -17.105 1.00 0.00 N ATOM 90 CA LEU A 174 -4.919 -0.334 -17.253 1.00 0.00 C ATOM 91 C LEU A 174 -4.739 -1.155 -15.947 1.00 0.00 C ATOM 92 O LEU A 174 -3.793 -1.935 -15.828 1.00 0.00 O ATOM 93 CB LEU A 174 -3.570 0.001 -17.951 1.00 0.00 C ATOM 94 CG LEU A 174 -3.575 0.405 -19.442 1.00 0.00 C ATOM 95 CD1 LEU A 174 -4.126 -0.705 -20.338 1.00 0.00 C ATOM 96 CD2 LEU A 174 -4.328 1.699 -19.759 1.00 0.00 C ATOM 0 H LEU A 174 -6.474 0.950 -17.786 1.00 0.00 H new ATOM 0 HA LEU A 174 -5.492 -1.009 -17.888 1.00 0.00 H new ATOM 0 HB2 LEU A 174 -3.104 0.813 -17.392 1.00 0.00 H new ATOM 0 HB3 LEU A 174 -2.922 -0.870 -17.849 1.00 0.00 H new ATOM 0 HG LEU A 174 -2.521 0.581 -19.656 1.00 0.00 H new ATOM 0 HD11 LEU A 174 -4.110 -0.376 -21.377 1.00 0.00 H new ATOM 0 HD12 LEU A 174 -3.510 -1.598 -20.231 1.00 0.00 H new ATOM 0 HD13 LEU A 174 -5.151 -0.934 -20.046 1.00 0.00 H new ATOM 0 HD21 LEU A 174 -4.275 1.898 -20.829 1.00 0.00 H new ATOM 0 HD22 LEU A 174 -5.371 1.595 -19.460 1.00 0.00 H new ATOM 0 HD23 LEU A 174 -3.875 2.527 -19.213 1.00 0.00 H new ATOM 108 N HIS A 175 -5.630 -0.993 -14.960 1.00 0.00 N ATOM 109 CA HIS A 175 -5.591 -1.645 -13.636 1.00 0.00 C ATOM 110 C HIS A 175 -5.654 -3.188 -13.694 1.00 0.00 C ATOM 111 O HIS A 175 -6.732 -3.783 -13.757 1.00 0.00 O ATOM 112 CB HIS A 175 -6.696 -1.023 -12.761 1.00 0.00 C ATOM 113 CG HIS A 175 -6.584 -1.318 -11.284 1.00 0.00 C ATOM 114 ND1 HIS A 175 -7.635 -1.649 -10.448 1.00 0.00 N ATOM 115 CD2 HIS A 175 -5.469 -1.163 -10.504 1.00 0.00 C ATOM 116 CE1 HIS A 175 -7.171 -1.690 -9.184 1.00 0.00 C ATOM 117 NE2 HIS A 175 -5.852 -1.413 -9.200 1.00 0.00 N ATOM 0 H HIS A 175 -6.436 -0.377 -15.063 1.00 0.00 H new ATOM 0 HA HIS A 175 -4.619 -1.455 -13.182 1.00 0.00 H new ATOM 0 HB2 HIS A 175 -6.685 0.058 -12.902 1.00 0.00 H new ATOM 0 HB3 HIS A 175 -7.663 -1.380 -13.115 1.00 0.00 H new ATOM 0 HD2 HIS A 175 -4.479 -0.896 -10.843 1.00 0.00 H new ATOM 0 HE1 HIS A 175 -7.758 -1.908 -8.304 1.00 0.00 H new ATOM 0 HE2 HIS A 175 -5.239 -1.391 -8.385 1.00 0.00 H new ATOM 126 N GLN A 176 -4.489 -3.845 -13.667 1.00 0.00 N ATOM 127 CA GLN A 176 -4.320 -5.310 -13.749 1.00 0.00 C ATOM 128 C GLN A 176 -4.825 -6.115 -12.525 1.00 0.00 C ATOM 129 O GLN A 176 -4.689 -7.340 -12.504 1.00 0.00 O ATOM 130 CB GLN A 176 -2.838 -5.648 -14.031 1.00 0.00 C ATOM 131 CG GLN A 176 -2.255 -5.035 -15.317 1.00 0.00 C ATOM 132 CD GLN A 176 -3.034 -5.416 -16.577 1.00 0.00 C ATOM 133 OE1 GLN A 176 -3.001 -6.545 -17.050 1.00 0.00 O ATOM 134 NE2 GLN A 176 -3.748 -4.488 -17.175 1.00 0.00 N ATOM 0 H GLN A 176 -3.598 -3.355 -13.584 1.00 0.00 H new ATOM 0 HA GLN A 176 -4.963 -5.625 -14.571 1.00 0.00 H new ATOM 0 HB2 GLN A 176 -2.239 -5.312 -13.185 1.00 0.00 H new ATOM 0 HB3 GLN A 176 -2.734 -6.732 -14.085 1.00 0.00 H new ATOM 0 HG2 GLN A 176 -2.243 -3.949 -15.220 1.00 0.00 H new ATOM 0 HG3 GLN A 176 -1.219 -5.357 -15.427 1.00 0.00 H new ATOM 0 HE21 GLN A 176 -3.783 -3.544 -16.790 1.00 0.00 H new ATOM 0 HE22 GLN A 176 -4.267 -4.712 -18.024 1.00 0.00 H new ATOM 143 N ASN A 177 -5.403 -5.468 -11.501 1.00 0.00 N ATOM 144 CA ASN A 177 -5.926 -6.118 -10.286 1.00 0.00 C ATOM 145 C ASN A 177 -6.941 -7.250 -10.572 1.00 0.00 C ATOM 146 O ASN A 177 -6.955 -8.260 -9.863 1.00 0.00 O ATOM 147 CB ASN A 177 -6.535 -5.022 -9.394 1.00 0.00 C ATOM 148 CG ASN A 177 -7.135 -5.569 -8.108 1.00 0.00 C ATOM 149 OD1 ASN A 177 -8.333 -5.790 -8.000 1.00 0.00 O ATOM 150 ND2 ASN A 177 -6.332 -5.798 -7.093 1.00 0.00 N ATOM 0 H ASN A 177 -5.523 -4.455 -11.493 1.00 0.00 H new ATOM 0 HA ASN A 177 -5.101 -6.617 -9.778 1.00 0.00 H new ATOM 0 HB2 ASN A 177 -5.764 -4.292 -9.147 1.00 0.00 H new ATOM 0 HB3 ASN A 177 -7.307 -4.494 -9.953 1.00 0.00 H new ATOM 0 HD21 ASN A 177 -6.708 -6.160 -6.217 1.00 0.00 H new ATOM 0 HD22 ASN A 177 -5.333 -5.614 -7.182 1.00 0.00 H new ATOM 157 N ARG A 178 -7.755 -7.094 -11.627 1.00 0.00 N ATOM 158 CA ARG A 178 -8.738 -8.094 -12.097 1.00 0.00 C ATOM 159 C ARG A 178 -8.947 -8.115 -13.617 1.00 0.00 C ATOM 160 O ARG A 178 -9.350 -9.143 -14.159 1.00 0.00 O ATOM 161 CB ARG A 178 -10.076 -7.936 -11.347 1.00 0.00 C ATOM 162 CG ARG A 178 -10.811 -6.609 -11.613 1.00 0.00 C ATOM 163 CD ARG A 178 -12.152 -6.544 -10.868 1.00 0.00 C ATOM 164 NE ARG A 178 -13.121 -7.528 -11.390 1.00 0.00 N ATOM 165 CZ ARG A 178 -14.288 -7.843 -10.851 1.00 0.00 C ATOM 166 NH1 ARG A 178 -14.737 -7.282 -9.757 1.00 0.00 N ATOM 167 NH2 ARG A 178 -15.046 -8.747 -11.410 1.00 0.00 N ATOM 0 H ARG A 178 -7.751 -6.247 -12.195 1.00 0.00 H new ATOM 0 HA ARG A 178 -8.307 -9.067 -11.860 1.00 0.00 H new ATOM 0 HB2 ARG A 178 -10.732 -8.761 -11.625 1.00 0.00 H new ATOM 0 HB3 ARG A 178 -9.889 -8.024 -10.277 1.00 0.00 H new ATOM 0 HG2 ARG A 178 -10.181 -5.775 -11.302 1.00 0.00 H new ATOM 0 HG3 ARG A 178 -10.983 -6.497 -12.683 1.00 0.00 H new ATOM 0 HD2 ARG A 178 -11.986 -6.726 -9.806 1.00 0.00 H new ATOM 0 HD3 ARG A 178 -12.569 -5.541 -10.958 1.00 0.00 H new ATOM 0 HE ARG A 178 -12.866 -8.013 -12.251 1.00 0.00 H new ATOM 0 HH11 ARG A 178 -14.181 -6.570 -9.284 1.00 0.00 H new ATOM 0 HH12 ARG A 178 -15.643 -7.557 -9.378 1.00 0.00 H new ATOM 0 HH21 ARG A 178 -14.739 -9.212 -12.264 1.00 0.00 H new ATOM 0 HH22 ARG A 178 -15.945 -8.988 -10.993 1.00 0.00 H new ATOM 181 N GLU A 179 -8.662 -7.012 -14.314 1.00 0.00 N ATOM 182 CA GLU A 179 -8.778 -6.921 -15.776 1.00 0.00 C ATOM 183 C GLU A 179 -7.526 -7.497 -16.464 1.00 0.00 C ATOM 184 O GLU A 179 -6.398 -7.253 -16.026 1.00 0.00 O ATOM 185 CB GLU A 179 -8.960 -5.454 -16.204 1.00 0.00 C ATOM 186 CG GLU A 179 -10.244 -4.821 -15.647 1.00 0.00 C ATOM 187 CD GLU A 179 -10.412 -3.384 -16.156 1.00 0.00 C ATOM 188 OE1 GLU A 179 -9.895 -2.455 -15.488 1.00 0.00 O ATOM 189 OE2 GLU A 179 -11.057 -3.207 -17.218 1.00 0.00 O ATOM 0 H GLU A 179 -8.341 -6.148 -13.877 1.00 0.00 H new ATOM 0 HA GLU A 179 -9.648 -7.503 -16.080 1.00 0.00 H new ATOM 0 HB2 GLU A 179 -8.100 -4.874 -15.868 1.00 0.00 H new ATOM 0 HB3 GLU A 179 -8.977 -5.398 -17.292 1.00 0.00 H new ATOM 0 HG2 GLU A 179 -11.106 -5.419 -15.942 1.00 0.00 H new ATOM 0 HG3 GLU A 179 -10.212 -4.824 -14.557 1.00 0.00 H new ATOM 196 N MET A 180 -7.717 -8.236 -17.562 1.00 0.00 N ATOM 197 CA MET A 180 -6.619 -8.793 -18.369 1.00 0.00 C ATOM 198 C MET A 180 -5.992 -7.717 -19.274 1.00 0.00 C ATOM 199 O MET A 180 -6.609 -6.681 -19.545 1.00 0.00 O ATOM 200 CB MET A 180 -7.144 -9.955 -19.233 1.00 0.00 C ATOM 201 CG MET A 180 -7.626 -11.153 -18.404 1.00 0.00 C ATOM 202 SD MET A 180 -6.338 -11.963 -17.413 1.00 0.00 S ATOM 203 CE MET A 180 -7.336 -13.256 -16.625 1.00 0.00 C ATOM 0 H MET A 180 -8.643 -8.468 -17.921 1.00 0.00 H new ATOM 0 HA MET A 180 -5.850 -9.159 -17.689 1.00 0.00 H new ATOM 0 HB2 MET A 180 -7.965 -9.596 -19.853 1.00 0.00 H new ATOM 0 HB3 MET A 180 -6.354 -10.283 -19.909 1.00 0.00 H new ATOM 0 HG2 MET A 180 -8.421 -10.819 -17.737 1.00 0.00 H new ATOM 0 HG3 MET A 180 -8.064 -11.890 -19.077 1.00 0.00 H new ATOM 0 HE1 MET A 180 -6.703 -13.858 -15.973 1.00 0.00 H new ATOM 0 HE2 MET A 180 -8.129 -12.795 -16.036 1.00 0.00 H new ATOM 0 HE3 MET A 180 -7.777 -13.893 -17.392 1.00 0.00 H new ATOM 213 N ILE A 181 -4.778 -7.966 -19.779 1.00 0.00 N ATOM 214 CA ILE A 181 -4.096 -7.059 -20.716 1.00 0.00 C ATOM 215 C ILE A 181 -4.913 -6.924 -22.016 1.00 0.00 C ATOM 216 O ILE A 181 -5.452 -7.903 -22.534 1.00 0.00 O ATOM 217 CB ILE A 181 -2.631 -7.503 -20.943 1.00 0.00 C ATOM 218 CG1 ILE A 181 -1.782 -6.455 -21.696 1.00 0.00 C ATOM 219 CG2 ILE A 181 -2.519 -8.853 -21.674 1.00 0.00 C ATOM 220 CD1 ILE A 181 -1.673 -5.100 -20.984 1.00 0.00 C ATOM 0 H ILE A 181 -4.239 -8.801 -19.551 1.00 0.00 H new ATOM 0 HA ILE A 181 -4.039 -6.060 -20.283 1.00 0.00 H new ATOM 0 HB ILE A 181 -2.230 -7.612 -19.935 1.00 0.00 H new ATOM 0 HG12 ILE A 181 -0.779 -6.856 -21.844 1.00 0.00 H new ATOM 0 HG13 ILE A 181 -2.212 -6.299 -22.685 1.00 0.00 H new ATOM 0 HG21 ILE A 181 -1.468 -9.110 -21.804 1.00 0.00 H new ATOM 0 HG22 ILE A 181 -3.012 -9.627 -21.086 1.00 0.00 H new ATOM 0 HG23 ILE A 181 -2.998 -8.779 -22.651 1.00 0.00 H new ATOM 0 HD11 ILE A 181 -1.060 -4.424 -21.580 1.00 0.00 H new ATOM 0 HD12 ILE A 181 -2.668 -4.673 -20.859 1.00 0.00 H new ATOM 0 HD13 ILE A 181 -1.213 -5.239 -20.006 1.00 0.00 H new ATOM 232 N ASP A 182 -5.041 -5.699 -22.524 1.00 0.00 N ATOM 233 CA ASP A 182 -5.876 -5.338 -23.679 1.00 0.00 C ATOM 234 C ASP A 182 -5.110 -4.498 -24.722 1.00 0.00 C ATOM 235 O ASP A 182 -5.324 -3.286 -24.832 1.00 0.00 O ATOM 236 CB ASP A 182 -7.180 -4.683 -23.173 1.00 0.00 C ATOM 237 CG ASP A 182 -7.010 -3.330 -22.456 1.00 0.00 C ATOM 238 OD1 ASP A 182 -6.142 -3.227 -21.556 1.00 0.00 O ATOM 239 OD2 ASP A 182 -7.786 -2.397 -22.775 1.00 0.00 O ATOM 0 H ASP A 182 -4.549 -4.897 -22.130 1.00 0.00 H new ATOM 0 HA ASP A 182 -6.151 -6.241 -24.225 1.00 0.00 H new ATOM 0 HB2 ASP A 182 -7.848 -4.542 -24.023 1.00 0.00 H new ATOM 0 HB3 ASP A 182 -7.673 -5.376 -22.491 1.00 0.00 H new ATOM 244 N PRO A 183 -4.195 -5.121 -25.491 1.00 0.00 N ATOM 245 CA PRO A 183 -3.420 -4.426 -26.514 1.00 0.00 C ATOM 246 C PRO A 183 -4.288 -4.071 -27.731 1.00 0.00 C ATOM 247 O PRO A 183 -5.221 -4.794 -28.091 1.00 0.00 O ATOM 248 CB PRO A 183 -2.300 -5.402 -26.894 1.00 0.00 C ATOM 249 CG PRO A 183 -2.931 -6.775 -26.667 1.00 0.00 C ATOM 250 CD PRO A 183 -3.851 -6.540 -25.469 1.00 0.00 C ATOM 0 HA PRO A 183 -3.027 -3.477 -26.149 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -1.987 -5.270 -27.930 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -1.415 -5.259 -26.273 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -3.487 -7.113 -27.542 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -2.178 -7.534 -26.455 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -4.746 -7.158 -25.538 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -3.352 -6.805 -24.537 1.00 0.00 H new ATOM 258 N ASP A 184 -3.948 -2.973 -28.407 1.00 0.00 N ATOM 259 CA ASP A 184 -4.604 -2.575 -29.658 1.00 0.00 C ATOM 260 C ASP A 184 -4.032 -3.429 -30.804 1.00 0.00 C ATOM 261 O ASP A 184 -2.813 -3.623 -30.884 1.00 0.00 O ATOM 262 CB ASP A 184 -4.381 -1.079 -29.917 1.00 0.00 C ATOM 263 CG ASP A 184 -4.993 -0.211 -28.813 1.00 0.00 C ATOM 264 OD1 ASP A 184 -6.235 -0.272 -28.643 1.00 0.00 O ATOM 265 OD2 ASP A 184 -4.224 0.512 -28.137 1.00 0.00 O ATOM 0 H ASP A 184 -3.212 -2.334 -28.106 1.00 0.00 H new ATOM 0 HA ASP A 184 -5.679 -2.741 -29.590 1.00 0.00 H new ATOM 0 HB2 ASP A 184 -3.312 -0.878 -29.986 1.00 0.00 H new ATOM 0 HB3 ASP A 184 -4.819 -0.807 -30.877 1.00 0.00 H new ATOM 270 N LYS A 185 -4.890 -3.955 -31.687 1.00 0.00 N ATOM 271 CA LYS A 185 -4.506 -4.848 -32.791 1.00 0.00 C ATOM 272 C LYS A 185 -5.235 -4.484 -34.088 1.00 0.00 C ATOM 273 O LYS A 185 -6.242 -3.776 -34.067 1.00 0.00 O ATOM 274 CB LYS A 185 -4.802 -6.301 -32.367 1.00 0.00 C ATOM 275 CG LYS A 185 -3.899 -6.882 -31.265 1.00 0.00 C ATOM 276 CD LYS A 185 -2.441 -7.057 -31.710 1.00 0.00 C ATOM 277 CE LYS A 185 -1.630 -7.720 -30.594 1.00 0.00 C ATOM 278 NZ LYS A 185 -0.224 -7.918 -31.003 1.00 0.00 N ATOM 0 H LYS A 185 -5.892 -3.769 -31.654 1.00 0.00 H new ATOM 0 HA LYS A 185 -3.441 -4.736 -32.996 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -5.836 -6.355 -32.027 1.00 0.00 H new ATOM 0 HB3 LYS A 185 -4.722 -6.938 -33.248 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -3.931 -6.226 -30.395 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -4.295 -7.848 -30.951 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -2.398 -7.666 -32.613 1.00 0.00 H new ATOM 0 HD3 LYS A 185 -2.009 -6.088 -31.958 1.00 0.00 H new ATOM 0 HE2 LYS A 185 -1.667 -7.102 -29.697 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -2.076 -8.681 -30.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 0.303 -8.369 -30.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 -0.190 -8.527 -31.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 0.206 -6.997 -31.224 1.00 0.00 H new ATOM 292 N PHE A 186 -4.725 -4.975 -35.215 1.00 0.00 N ATOM 293 CA PHE A 186 -5.256 -4.714 -36.556 1.00 0.00 C ATOM 294 C PHE A 186 -5.074 -5.924 -37.489 1.00 0.00 C ATOM 295 O PHE A 186 -4.131 -6.705 -37.331 1.00 0.00 O ATOM 296 CB PHE A 186 -4.538 -3.469 -37.118 1.00 0.00 C ATOM 297 CG PHE A 186 -4.857 -3.119 -38.563 1.00 0.00 C ATOM 298 CD1 PHE A 186 -6.106 -2.565 -38.898 1.00 0.00 C ATOM 299 CD2 PHE A 186 -3.911 -3.359 -39.579 1.00 0.00 C ATOM 300 CE1 PHE A 186 -6.428 -2.290 -40.239 1.00 0.00 C ATOM 301 CE2 PHE A 186 -4.218 -3.051 -40.917 1.00 0.00 C ATOM 302 CZ PHE A 186 -5.480 -2.527 -41.249 1.00 0.00 C ATOM 0 H PHE A 186 -3.907 -5.584 -35.224 1.00 0.00 H new ATOM 0 HA PHE A 186 -6.329 -4.535 -36.493 1.00 0.00 H new ATOM 0 HB2 PHE A 186 -4.791 -2.613 -36.492 1.00 0.00 H new ATOM 0 HB3 PHE A 186 -3.462 -3.622 -37.030 1.00 0.00 H new ATOM 0 HD1 PHE A 186 -6.823 -2.349 -38.120 1.00 0.00 H new ATOM 0 HD2 PHE A 186 -2.948 -3.780 -39.330 1.00 0.00 H new ATOM 0 HE1 PHE A 186 -7.402 -1.897 -40.492 1.00 0.00 H new ATOM 0 HE2 PHE A 186 -3.483 -3.217 -41.691 1.00 0.00 H new ATOM 0 HZ PHE A 186 -5.720 -2.307 -42.279 1.00 0.00 H new ATOM 312 N CYS A 187 -5.965 -6.052 -38.473 1.00 0.00 N ATOM 313 CA CYS A 187 -5.967 -7.083 -39.506 1.00 0.00 C ATOM 314 C CYS A 187 -5.861 -6.416 -40.888 1.00 0.00 C ATOM 315 O CYS A 187 -6.779 -5.726 -41.345 1.00 0.00 O ATOM 316 CB CYS A 187 -7.238 -7.935 -39.376 1.00 0.00 C ATOM 317 SG CYS A 187 -7.184 -9.288 -40.589 1.00 0.00 S ATOM 0 H CYS A 187 -6.746 -5.403 -38.574 1.00 0.00 H new ATOM 0 HA CYS A 187 -5.110 -7.745 -39.386 1.00 0.00 H new ATOM 0 HB2 CYS A 187 -7.316 -8.339 -38.367 1.00 0.00 H new ATOM 0 HB3 CYS A 187 -8.121 -7.318 -39.542 1.00 0.00 H new ATOM 322 N SER A 188 -4.719 -6.606 -41.552 1.00 0.00 N ATOM 323 CA SER A 188 -4.441 -6.057 -42.886 1.00 0.00 C ATOM 324 C SER A 188 -5.152 -6.806 -44.022 1.00 0.00 C ATOM 325 O SER A 188 -5.243 -6.281 -45.135 1.00 0.00 O ATOM 326 CB SER A 188 -2.928 -6.052 -43.139 1.00 0.00 C ATOM 327 OG SER A 188 -2.386 -7.359 -43.000 1.00 0.00 O ATOM 0 H SER A 188 -3.947 -7.155 -41.174 1.00 0.00 H new ATOM 0 HA SER A 188 -4.836 -5.041 -42.890 1.00 0.00 H new ATOM 0 HB2 SER A 188 -2.724 -5.674 -44.141 1.00 0.00 H new ATOM 0 HB3 SER A 188 -2.440 -5.375 -42.438 1.00 0.00 H new ATOM 0 HG SER A 188 -1.421 -7.332 -43.167 1.00 0.00 H new ATOM 333 N LEU A 189 -5.680 -8.008 -43.760 1.00 0.00 N ATOM 334 CA LEU A 189 -6.404 -8.821 -44.743 1.00 0.00 C ATOM 335 C LEU A 189 -7.897 -8.444 -44.814 1.00 0.00 C ATOM 336 O LEU A 189 -8.503 -8.546 -45.886 1.00 0.00 O ATOM 337 CB LEU A 189 -6.244 -10.318 -44.411 1.00 0.00 C ATOM 338 CG LEU A 189 -4.796 -10.816 -44.229 1.00 0.00 C ATOM 339 CD1 LEU A 189 -4.801 -12.312 -43.913 1.00 0.00 C ATOM 340 CD2 LEU A 189 -3.929 -10.607 -45.474 1.00 0.00 C ATOM 0 H LEU A 189 -5.615 -8.450 -42.843 1.00 0.00 H new ATOM 0 HA LEU A 189 -5.971 -8.620 -45.723 1.00 0.00 H new ATOM 0 HB2 LEU A 189 -6.798 -10.529 -43.496 1.00 0.00 H new ATOM 0 HB3 LEU A 189 -6.710 -10.899 -45.207 1.00 0.00 H new ATOM 0 HG LEU A 189 -4.372 -10.231 -43.413 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -3.776 -12.660 -43.785 1.00 0.00 H new ATOM 0 HD12 LEU A 189 -5.361 -12.488 -42.995 1.00 0.00 H new ATOM 0 HD13 LEU A 189 -5.269 -12.856 -44.734 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -2.922 -10.978 -45.283 1.00 0.00 H new ATOM 0 HD22 LEU A 189 -4.362 -11.150 -46.314 1.00 0.00 H new ATOM 0 HD23 LEU A 189 -3.885 -9.544 -45.713 1.00 0.00 H new ATOM 352 N CYS A 190 -8.467 -8.000 -43.689 1.00 0.00 N ATOM 353 CA CYS A 190 -9.881 -7.650 -43.515 1.00 0.00 C ATOM 354 C CYS A 190 -10.130 -6.149 -43.234 1.00 0.00 C ATOM 355 O CYS A 190 -11.289 -5.722 -43.177 1.00 0.00 O ATOM 356 CB CYS A 190 -10.430 -8.495 -42.348 1.00 0.00 C ATOM 357 SG CYS A 190 -10.143 -10.284 -42.561 1.00 0.00 S ATOM 0 H CYS A 190 -7.928 -7.868 -42.833 1.00 0.00 H new ATOM 0 HA CYS A 190 -10.393 -7.860 -44.454 1.00 0.00 H new ATOM 0 HB2 CYS A 190 -9.964 -8.167 -41.419 1.00 0.00 H new ATOM 0 HB3 CYS A 190 -11.500 -8.314 -42.249 1.00 0.00 H new ATOM 362 N HIS A 191 -9.069 -5.350 -43.038 1.00 0.00 N ATOM 363 CA HIS A 191 -9.119 -3.923 -42.674 1.00 0.00 C ATOM 364 C HIS A 191 -10.012 -3.691 -41.437 1.00 0.00 C ATOM 365 O HIS A 191 -11.004 -2.956 -41.477 1.00 0.00 O ATOM 366 CB HIS A 191 -9.456 -3.063 -43.907 1.00 0.00 C ATOM 367 CG HIS A 191 -9.129 -1.603 -43.714 1.00 0.00 C ATOM 368 ND1 HIS A 191 -7.889 -1.020 -43.902 1.00 0.00 N ATOM 369 CD2 HIS A 191 -9.992 -0.620 -43.313 1.00 0.00 C ATOM 370 CE1 HIS A 191 -7.995 0.293 -43.619 1.00 0.00 C ATOM 371 NE2 HIS A 191 -9.267 0.555 -43.258 1.00 0.00 N ATOM 0 H HIS A 191 -8.113 -5.694 -43.132 1.00 0.00 H new ATOM 0 HA HIS A 191 -8.132 -3.587 -42.356 1.00 0.00 H new ATOM 0 HB2 HIS A 191 -8.907 -3.442 -44.769 1.00 0.00 H new ATOM 0 HB3 HIS A 191 -10.517 -3.165 -44.135 1.00 0.00 H new ATOM 0 HD2 HIS A 191 -11.040 -0.740 -43.083 1.00 0.00 H new ATOM 0 HE1 HIS A 191 -7.194 1.015 -43.672 1.00 0.00 H new ATOM 0 HE2 HIS A 191 -9.633 1.468 -42.989 1.00 0.00 H new ATOM 380 N ALA A 192 -9.660 -4.363 -40.338 1.00 0.00 N ATOM 381 CA ALA A 192 -10.387 -4.364 -39.063 1.00 0.00 C ATOM 382 C ALA A 192 -9.449 -4.085 -37.873 1.00 0.00 C ATOM 383 O ALA A 192 -8.274 -4.444 -37.914 1.00 0.00 O ATOM 384 CB ALA A 192 -11.089 -5.723 -38.924 1.00 0.00 C ATOM 0 H ALA A 192 -8.824 -4.947 -40.310 1.00 0.00 H new ATOM 0 HA ALA A 192 -11.125 -3.562 -39.056 1.00 0.00 H new ATOM 0 HB1 ALA A 192 -11.639 -5.754 -37.983 1.00 0.00 H new ATOM 0 HB2 ALA A 192 -11.782 -5.861 -39.754 1.00 0.00 H new ATOM 0 HB3 ALA A 192 -10.345 -6.520 -38.936 1.00 0.00 H new ATOM 390 N THR A 193 -9.969 -3.455 -36.814 1.00 0.00 N ATOM 391 CA THR A 193 -9.220 -3.044 -35.605 1.00 0.00 C ATOM 392 C THR A 193 -9.843 -3.648 -34.342 1.00 0.00 C ATOM 393 O THR A 193 -11.066 -3.805 -34.270 1.00 0.00 O ATOM 394 CB THR A 193 -9.213 -1.506 -35.487 1.00 0.00 C ATOM 395 OG1 THR A 193 -8.757 -0.905 -36.684 1.00 0.00 O ATOM 396 CG2 THR A 193 -8.327 -0.961 -34.364 1.00 0.00 C ATOM 0 H THR A 193 -10.957 -3.205 -36.766 1.00 0.00 H new ATOM 0 HA THR A 193 -8.198 -3.410 -35.700 1.00 0.00 H new ATOM 0 HB THR A 193 -10.251 -1.256 -35.268 1.00 0.00 H new ATOM 0 HG1 THR A 193 -8.764 0.070 -36.584 1.00 0.00 H new ATOM 0 HG21 THR A 193 -8.382 0.128 -34.353 1.00 0.00 H new ATOM 0 HG22 THR A 193 -8.672 -1.351 -33.406 1.00 0.00 H new ATOM 0 HG23 THR A 193 -7.295 -1.271 -34.531 1.00 0.00 H new ATOM 404 N PHE A 194 -9.019 -3.971 -33.338 1.00 0.00 N ATOM 405 CA PHE A 194 -9.441 -4.600 -32.079 1.00 0.00 C ATOM 406 C PHE A 194 -8.773 -3.908 -30.885 1.00 0.00 C ATOM 407 O PHE A 194 -7.662 -3.385 -31.009 1.00 0.00 O ATOM 408 CB PHE A 194 -9.109 -6.108 -32.116 1.00 0.00 C ATOM 409 CG PHE A 194 -9.228 -6.736 -33.496 1.00 0.00 C ATOM 410 CD1 PHE A 194 -10.495 -6.925 -34.079 1.00 0.00 C ATOM 411 CD2 PHE A 194 -8.070 -6.985 -34.258 1.00 0.00 C ATOM 412 CE1 PHE A 194 -10.599 -7.311 -35.426 1.00 0.00 C ATOM 413 CE2 PHE A 194 -8.173 -7.382 -35.600 1.00 0.00 C ATOM 414 CZ PHE A 194 -9.438 -7.531 -36.187 1.00 0.00 C ATOM 0 H PHE A 194 -8.015 -3.798 -33.379 1.00 0.00 H new ATOM 0 HA PHE A 194 -10.519 -4.489 -31.962 1.00 0.00 H new ATOM 0 HB2 PHE A 194 -8.093 -6.255 -31.748 1.00 0.00 H new ATOM 0 HB3 PHE A 194 -9.775 -6.633 -31.431 1.00 0.00 H new ATOM 0 HD1 PHE A 194 -11.388 -6.773 -33.491 1.00 0.00 H new ATOM 0 HD2 PHE A 194 -7.096 -6.870 -33.806 1.00 0.00 H new ATOM 0 HE1 PHE A 194 -11.572 -7.439 -35.877 1.00 0.00 H new ATOM 0 HE2 PHE A 194 -7.281 -7.572 -36.179 1.00 0.00 H new ATOM 0 HZ PHE A 194 -9.520 -7.815 -37.226 1.00 0.00 H new ATOM 424 N ASN A 195 -9.445 -3.890 -29.731 1.00 0.00 N ATOM 425 CA ASN A 195 -8.979 -3.197 -28.518 1.00 0.00 C ATOM 426 C ASN A 195 -9.098 -4.059 -27.239 1.00 0.00 C ATOM 427 O ASN A 195 -9.064 -3.535 -26.127 1.00 0.00 O ATOM 428 CB ASN A 195 -9.751 -1.866 -28.384 1.00 0.00 C ATOM 429 CG ASN A 195 -9.801 -1.034 -29.657 1.00 0.00 C ATOM 430 OD1 ASN A 195 -10.773 -1.048 -30.400 1.00 0.00 O ATOM 431 ND2 ASN A 195 -8.767 -0.286 -29.963 1.00 0.00 N ATOM 0 H ASN A 195 -10.341 -4.362 -29.607 1.00 0.00 H new ATOM 0 HA ASN A 195 -7.913 -2.999 -28.625 1.00 0.00 H new ATOM 0 HB2 ASN A 195 -10.771 -2.083 -28.066 1.00 0.00 H new ATOM 0 HB3 ASN A 195 -9.291 -1.272 -27.595 1.00 0.00 H new ATOM 0 HD21 ASN A 195 -8.779 0.277 -30.814 1.00 0.00 H new ATOM 0 HD22 ASN A 195 -7.952 -0.267 -29.350 1.00 0.00 H new ATOM 438 N ASP A 196 -9.244 -5.380 -27.384 1.00 0.00 N ATOM 439 CA ASP A 196 -9.373 -6.364 -26.299 1.00 0.00 C ATOM 440 C ASP A 196 -8.721 -7.702 -26.709 1.00 0.00 C ATOM 441 O ASP A 196 -8.622 -7.986 -27.909 1.00 0.00 O ATOM 442 CB ASP A 196 -10.863 -6.554 -25.959 1.00 0.00 C ATOM 443 CG ASP A 196 -11.412 -5.413 -25.097 1.00 0.00 C ATOM 444 OD1 ASP A 196 -11.050 -5.370 -23.897 1.00 0.00 O ATOM 445 OD2 ASP A 196 -12.212 -4.604 -25.625 1.00 0.00 O ATOM 0 H ASP A 196 -9.277 -5.816 -28.306 1.00 0.00 H new ATOM 0 HA ASP A 196 -8.855 -6.000 -25.412 1.00 0.00 H new ATOM 0 HB2 ASP A 196 -11.439 -6.618 -26.882 1.00 0.00 H new ATOM 0 HB3 ASP A 196 -10.996 -7.500 -25.434 1.00 0.00 H new ATOM 450 N PRO A 197 -8.277 -8.540 -25.747 1.00 0.00 N ATOM 451 CA PRO A 197 -7.573 -9.788 -26.053 1.00 0.00 C ATOM 452 C PRO A 197 -8.442 -10.801 -26.799 1.00 0.00 C ATOM 453 O PRO A 197 -8.042 -11.359 -27.821 1.00 0.00 O ATOM 454 CB PRO A 197 -7.131 -10.362 -24.696 1.00 0.00 C ATOM 455 CG PRO A 197 -8.039 -9.687 -23.669 1.00 0.00 C ATOM 456 CD PRO A 197 -8.374 -8.342 -24.305 1.00 0.00 C ATOM 0 HA PRO A 197 -6.733 -9.585 -26.718 1.00 0.00 H new ATOM 0 HB2 PRO A 197 -7.243 -11.446 -24.670 1.00 0.00 H new ATOM 0 HB3 PRO A 197 -6.081 -10.145 -24.498 1.00 0.00 H new ATOM 0 HG2 PRO A 197 -8.937 -10.275 -23.482 1.00 0.00 H new ATOM 0 HG3 PRO A 197 -7.535 -9.562 -22.711 1.00 0.00 H new ATOM 0 HD2 PRO A 197 -9.375 -8.016 -24.023 1.00 0.00 H new ATOM 0 HD3 PRO A 197 -7.682 -7.570 -23.970 1.00 0.00 H new ATOM 464 N VAL A 198 -9.649 -11.036 -26.281 1.00 0.00 N ATOM 465 CA VAL A 198 -10.605 -11.996 -26.843 1.00 0.00 C ATOM 466 C VAL A 198 -11.174 -11.480 -28.164 1.00 0.00 C ATOM 467 O VAL A 198 -11.341 -12.264 -29.090 1.00 0.00 O ATOM 468 CB VAL A 198 -11.688 -12.335 -25.801 1.00 0.00 C ATOM 469 CG1 VAL A 198 -12.733 -13.322 -26.335 1.00 0.00 C ATOM 470 CG2 VAL A 198 -11.026 -12.971 -24.565 1.00 0.00 C ATOM 0 H VAL A 198 -9.996 -10.559 -25.449 1.00 0.00 H new ATOM 0 HA VAL A 198 -10.093 -12.929 -27.079 1.00 0.00 H new ATOM 0 HB VAL A 198 -12.192 -11.401 -25.553 1.00 0.00 H new ATOM 0 HG11 VAL A 198 -13.471 -13.525 -25.559 1.00 0.00 H new ATOM 0 HG12 VAL A 198 -13.229 -12.891 -27.205 1.00 0.00 H new ATOM 0 HG13 VAL A 198 -12.242 -14.252 -26.621 1.00 0.00 H new ATOM 0 HG21 VAL A 198 -11.790 -13.212 -23.826 1.00 0.00 H new ATOM 0 HG22 VAL A 198 -10.506 -13.883 -24.859 1.00 0.00 H new ATOM 0 HG23 VAL A 198 -10.312 -12.270 -24.133 1.00 0.00 H new ATOM 480 N MET A 199 -11.394 -10.167 -28.306 1.00 0.00 N ATOM 481 CA MET A 199 -11.845 -9.549 -29.564 1.00 0.00 C ATOM 482 C MET A 199 -10.831 -9.800 -30.693 1.00 0.00 C ATOM 483 O MET A 199 -11.211 -10.232 -31.783 1.00 0.00 O ATOM 484 CB MET A 199 -12.048 -8.045 -29.321 1.00 0.00 C ATOM 485 CG MET A 199 -12.637 -7.290 -30.515 1.00 0.00 C ATOM 486 SD MET A 199 -12.652 -5.494 -30.256 1.00 0.00 S ATOM 487 CE MET A 199 -13.504 -4.963 -31.767 1.00 0.00 C ATOM 0 H MET A 199 -11.264 -9.497 -27.548 1.00 0.00 H new ATOM 0 HA MET A 199 -12.788 -9.996 -29.879 1.00 0.00 H new ATOM 0 HB2 MET A 199 -12.706 -7.913 -28.462 1.00 0.00 H new ATOM 0 HB3 MET A 199 -11.089 -7.598 -29.060 1.00 0.00 H new ATOM 0 HG2 MET A 199 -12.058 -7.521 -31.409 1.00 0.00 H new ATOM 0 HG3 MET A 199 -13.654 -7.637 -30.695 1.00 0.00 H new ATOM 0 HE1 MET A 199 -13.598 -3.877 -31.769 1.00 0.00 H new ATOM 0 HE2 MET A 199 -12.931 -5.279 -32.638 1.00 0.00 H new ATOM 0 HE3 MET A 199 -14.496 -5.413 -31.803 1.00 0.00 H new ATOM 497 N ALA A 200 -9.539 -9.588 -30.414 1.00 0.00 N ATOM 498 CA ALA A 200 -8.454 -9.865 -31.353 1.00 0.00 C ATOM 499 C ALA A 200 -8.409 -11.359 -31.718 1.00 0.00 C ATOM 500 O ALA A 200 -8.444 -11.725 -32.895 1.00 0.00 O ATOM 501 CB ALA A 200 -7.131 -9.430 -30.706 1.00 0.00 C ATOM 0 H ALA A 200 -9.218 -9.216 -29.520 1.00 0.00 H new ATOM 0 HA ALA A 200 -8.620 -9.309 -32.276 1.00 0.00 H new ATOM 0 HB1 ALA A 200 -6.308 -9.629 -31.392 1.00 0.00 H new ATOM 0 HB2 ALA A 200 -7.168 -8.364 -30.483 1.00 0.00 H new ATOM 0 HB3 ALA A 200 -6.977 -9.988 -29.783 1.00 0.00 H new ATOM 507 N GLN A 201 -8.358 -12.228 -30.701 1.00 0.00 N ATOM 508 CA GLN A 201 -8.284 -13.677 -30.877 1.00 0.00 C ATOM 509 C GLN A 201 -9.474 -14.249 -31.672 1.00 0.00 C ATOM 510 O GLN A 201 -9.278 -15.082 -32.559 1.00 0.00 O ATOM 511 CB GLN A 201 -8.158 -14.338 -29.493 1.00 0.00 C ATOM 512 CG GLN A 201 -7.887 -15.849 -29.578 1.00 0.00 C ATOM 513 CD GLN A 201 -7.669 -16.483 -28.202 1.00 0.00 C ATOM 514 OE1 GLN A 201 -8.369 -16.213 -27.234 1.00 0.00 O ATOM 515 NE2 GLN A 201 -6.691 -17.354 -28.054 1.00 0.00 N ATOM 0 H GLN A 201 -8.367 -11.938 -29.723 1.00 0.00 H new ATOM 0 HA GLN A 201 -7.402 -13.904 -31.477 1.00 0.00 H new ATOM 0 HB2 GLN A 201 -7.351 -13.859 -28.939 1.00 0.00 H new ATOM 0 HB3 GLN A 201 -9.076 -14.169 -28.930 1.00 0.00 H new ATOM 0 HG2 GLN A 201 -8.727 -16.338 -30.071 1.00 0.00 H new ATOM 0 HG3 GLN A 201 -7.008 -16.023 -30.198 1.00 0.00 H new ATOM 0 HE21 GLN A 201 -6.096 -17.593 -28.848 1.00 0.00 H new ATOM 0 HE22 GLN A 201 -6.529 -17.789 -27.146 1.00 0.00 H new ATOM 524 N GLN A 202 -10.699 -13.790 -31.385 1.00 0.00 N ATOM 525 CA GLN A 202 -11.926 -14.213 -32.068 1.00 0.00 C ATOM 526 C GLN A 202 -11.908 -13.838 -33.553 1.00 0.00 C ATOM 527 O GLN A 202 -12.318 -14.647 -34.387 1.00 0.00 O ATOM 528 CB GLN A 202 -13.162 -13.602 -31.378 1.00 0.00 C ATOM 529 CG GLN A 202 -13.544 -14.327 -30.072 1.00 0.00 C ATOM 530 CD GLN A 202 -14.160 -15.717 -30.264 1.00 0.00 C ATOM 531 OE1 GLN A 202 -14.400 -16.203 -31.363 1.00 0.00 O ATOM 532 NE2 GLN A 202 -14.447 -16.421 -29.189 1.00 0.00 N ATOM 0 H GLN A 202 -10.867 -13.098 -30.654 1.00 0.00 H new ATOM 0 HA GLN A 202 -11.981 -15.300 -32.002 1.00 0.00 H new ATOM 0 HB2 GLN A 202 -12.967 -12.552 -31.160 1.00 0.00 H new ATOM 0 HB3 GLN A 202 -14.007 -13.634 -32.065 1.00 0.00 H new ATOM 0 HG2 GLN A 202 -12.652 -14.423 -29.452 1.00 0.00 H new ATOM 0 HG3 GLN A 202 -14.250 -13.705 -29.521 1.00 0.00 H new ATOM 0 HE21 GLN A 202 -14.257 -16.038 -28.263 1.00 0.00 H new ATOM 0 HE22 GLN A 202 -14.860 -17.349 -29.282 1.00 0.00 H new ATOM 541 N HIS A 203 -11.403 -12.648 -33.907 1.00 0.00 N ATOM 542 CA HIS A 203 -11.299 -12.250 -35.313 1.00 0.00 C ATOM 543 C HIS A 203 -10.369 -13.202 -36.080 1.00 0.00 C ATOM 544 O HIS A 203 -10.783 -13.792 -37.076 1.00 0.00 O ATOM 545 CB HIS A 203 -10.828 -10.793 -35.453 1.00 0.00 C ATOM 546 CG HIS A 203 -10.849 -10.345 -36.897 1.00 0.00 C ATOM 547 ND1 HIS A 203 -11.910 -9.753 -37.549 1.00 0.00 N ATOM 548 CD2 HIS A 203 -9.864 -10.540 -37.833 1.00 0.00 C ATOM 549 CE1 HIS A 203 -11.585 -9.626 -38.849 1.00 0.00 C ATOM 550 NE2 HIS A 203 -10.354 -10.114 -39.074 1.00 0.00 N ATOM 0 H HIS A 203 -11.064 -11.951 -33.244 1.00 0.00 H new ATOM 0 HA HIS A 203 -12.295 -12.316 -35.751 1.00 0.00 H new ATOM 0 HB2 HIS A 203 -11.470 -10.142 -34.859 1.00 0.00 H new ATOM 0 HB3 HIS A 203 -9.818 -10.695 -35.054 1.00 0.00 H new ATOM 0 HD1 HIS A 203 -12.789 -9.462 -37.121 1.00 0.00 H new ATOM 0 HD2 HIS A 203 -8.883 -10.950 -37.645 1.00 0.00 H new ATOM 0 HE1 HIS A 203 -12.224 -9.193 -39.604 1.00 0.00 H new ATOM 558 N TYR A 204 -9.137 -13.396 -35.597 1.00 0.00 N ATOM 559 CA TYR A 204 -8.111 -14.240 -36.227 1.00 0.00 C ATOM 560 C TYR A 204 -8.445 -15.742 -36.392 1.00 0.00 C ATOM 561 O TYR A 204 -7.646 -16.478 -36.978 1.00 0.00 O ATOM 562 CB TYR A 204 -6.777 -14.048 -35.483 1.00 0.00 C ATOM 563 CG TYR A 204 -6.253 -12.619 -35.415 1.00 0.00 C ATOM 564 CD1 TYR A 204 -6.341 -11.765 -36.535 1.00 0.00 C ATOM 565 CD2 TYR A 204 -5.644 -12.151 -34.232 1.00 0.00 C ATOM 566 CE1 TYR A 204 -5.850 -10.450 -36.469 1.00 0.00 C ATOM 567 CE2 TYR A 204 -5.140 -10.837 -34.166 1.00 0.00 C ATOM 568 CZ TYR A 204 -5.236 -9.983 -35.286 1.00 0.00 C ATOM 569 OH TYR A 204 -4.708 -8.731 -35.219 1.00 0.00 O ATOM 0 H TYR A 204 -8.815 -12.959 -34.733 1.00 0.00 H new ATOM 0 HA TYR A 204 -8.051 -13.892 -37.258 1.00 0.00 H new ATOM 0 HB2 TYR A 204 -6.894 -14.420 -34.465 1.00 0.00 H new ATOM 0 HB3 TYR A 204 -6.022 -14.669 -35.965 1.00 0.00 H new ATOM 0 HD1 TYR A 204 -6.789 -12.125 -37.450 1.00 0.00 H new ATOM 0 HD2 TYR A 204 -5.564 -12.802 -33.374 1.00 0.00 H new ATOM 0 HE1 TYR A 204 -5.942 -9.796 -37.324 1.00 0.00 H new ATOM 0 HE2 TYR A 204 -4.679 -10.482 -33.256 1.00 0.00 H new ATOM 0 HH TYR A 204 -4.675 -8.341 -36.118 1.00 0.00 H new ATOM 579 N VAL A 205 -9.603 -16.215 -35.913 1.00 0.00 N ATOM 580 CA VAL A 205 -10.053 -17.620 -36.022 1.00 0.00 C ATOM 581 C VAL A 205 -11.504 -17.762 -36.529 1.00 0.00 C ATOM 582 O VAL A 205 -11.993 -18.878 -36.710 1.00 0.00 O ATOM 583 CB VAL A 205 -9.797 -18.340 -34.676 1.00 0.00 C ATOM 584 CG1 VAL A 205 -10.850 -18.020 -33.608 1.00 0.00 C ATOM 585 CG2 VAL A 205 -9.665 -19.860 -34.820 1.00 0.00 C ATOM 0 H VAL A 205 -10.274 -15.621 -35.426 1.00 0.00 H new ATOM 0 HA VAL A 205 -9.462 -18.113 -36.794 1.00 0.00 H new ATOM 0 HB VAL A 205 -8.839 -17.942 -34.342 1.00 0.00 H new ATOM 0 HG11 VAL A 205 -10.612 -18.557 -32.690 1.00 0.00 H new ATOM 0 HG12 VAL A 205 -10.854 -16.948 -33.411 1.00 0.00 H new ATOM 0 HG13 VAL A 205 -11.834 -18.328 -33.963 1.00 0.00 H new ATOM 0 HG21 VAL A 205 -9.487 -20.304 -33.841 1.00 0.00 H new ATOM 0 HG22 VAL A 205 -10.584 -20.267 -35.241 1.00 0.00 H new ATOM 0 HG23 VAL A 205 -8.830 -20.092 -35.481 1.00 0.00 H new ATOM 595 N GLY A 206 -12.204 -16.651 -36.790 1.00 0.00 N ATOM 596 CA GLY A 206 -13.593 -16.650 -37.265 1.00 0.00 C ATOM 597 C GLY A 206 -13.749 -16.910 -38.769 1.00 0.00 C ATOM 598 O GLY A 206 -12.841 -16.655 -39.566 1.00 0.00 O ATOM 0 H GLY A 206 -11.816 -15.715 -36.676 1.00 0.00 H new ATOM 0 HA2 GLY A 206 -14.152 -17.409 -36.718 1.00 0.00 H new ATOM 0 HA3 GLY A 206 -14.045 -15.687 -37.026 1.00 0.00 H new ATOM 602 N LYS A 207 -14.933 -17.394 -39.175 1.00 0.00 N ATOM 603 CA LYS A 207 -15.284 -17.702 -40.578 1.00 0.00 C ATOM 604 C LYS A 207 -15.049 -16.516 -41.521 1.00 0.00 C ATOM 605 O LYS A 207 -14.477 -16.689 -42.597 1.00 0.00 O ATOM 606 CB LYS A 207 -16.741 -18.199 -40.626 1.00 0.00 C ATOM 607 CG LYS A 207 -17.177 -18.653 -42.029 1.00 0.00 C ATOM 608 CD LYS A 207 -18.619 -19.176 -42.008 1.00 0.00 C ATOM 609 CE LYS A 207 -19.055 -19.590 -43.417 1.00 0.00 C ATOM 610 NZ LYS A 207 -20.449 -20.081 -43.420 1.00 0.00 N ATOM 0 H LYS A 207 -15.694 -17.588 -38.524 1.00 0.00 H new ATOM 0 HA LYS A 207 -14.621 -18.488 -40.939 1.00 0.00 H new ATOM 0 HB2 LYS A 207 -16.859 -19.029 -39.929 1.00 0.00 H new ATOM 0 HB3 LYS A 207 -17.402 -17.402 -40.287 1.00 0.00 H new ATOM 0 HG2 LYS A 207 -17.098 -17.820 -42.727 1.00 0.00 H new ATOM 0 HG3 LYS A 207 -16.507 -19.434 -42.388 1.00 0.00 H new ATOM 0 HD2 LYS A 207 -18.694 -20.028 -41.332 1.00 0.00 H new ATOM 0 HD3 LYS A 207 -19.287 -18.405 -41.625 1.00 0.00 H new ATOM 0 HE2 LYS A 207 -18.964 -18.740 -44.094 1.00 0.00 H new ATOM 0 HE3 LYS A 207 -18.391 -20.369 -43.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 -20.719 -20.355 -44.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 -20.528 -20.906 -42.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 -21.083 -19.328 -43.084 1.00 0.00 H new ATOM 624 N LYS A 208 -15.447 -15.307 -41.107 1.00 0.00 N ATOM 625 CA LYS A 208 -15.268 -14.061 -41.878 1.00 0.00 C ATOM 626 C LYS A 208 -13.802 -13.728 -42.185 1.00 0.00 C ATOM 627 O LYS A 208 -13.525 -13.202 -43.261 1.00 0.00 O ATOM 628 CB LYS A 208 -16.002 -12.894 -41.189 1.00 0.00 C ATOM 629 CG LYS A 208 -15.473 -12.540 -39.787 1.00 0.00 C ATOM 630 CD LYS A 208 -16.302 -11.409 -39.166 1.00 0.00 C ATOM 631 CE LYS A 208 -15.801 -11.103 -37.752 1.00 0.00 C ATOM 632 NZ LYS A 208 -16.571 -9.997 -37.142 1.00 0.00 N ATOM 0 H LYS A 208 -15.911 -15.160 -40.211 1.00 0.00 H new ATOM 0 HA LYS A 208 -15.723 -14.226 -42.855 1.00 0.00 H new ATOM 0 HB2 LYS A 208 -15.929 -12.011 -41.824 1.00 0.00 H new ATOM 0 HB3 LYS A 208 -17.060 -13.144 -41.111 1.00 0.00 H new ATOM 0 HG2 LYS A 208 -15.511 -13.420 -39.145 1.00 0.00 H new ATOM 0 HG3 LYS A 208 -14.428 -12.238 -39.853 1.00 0.00 H new ATOM 0 HD2 LYS A 208 -16.233 -10.515 -39.786 1.00 0.00 H new ATOM 0 HD3 LYS A 208 -17.354 -11.694 -39.134 1.00 0.00 H new ATOM 0 HE2 LYS A 208 -15.886 -11.995 -37.132 1.00 0.00 H new ATOM 0 HE3 LYS A 208 -14.744 -10.839 -37.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 208 -16.211 -9.810 -36.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 208 -16.469 -9.141 -37.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 208 -17.575 -10.261 -37.089 1.00 0.00 H new ATOM 646 N HIS A 209 -12.869 -14.066 -41.288 1.00 0.00 N ATOM 647 CA HIS A 209 -11.427 -13.858 -41.490 1.00 0.00 C ATOM 648 C HIS A 209 -10.884 -14.867 -42.505 1.00 0.00 C ATOM 649 O HIS A 209 -10.187 -14.490 -43.445 1.00 0.00 O ATOM 650 CB HIS A 209 -10.712 -13.948 -40.135 1.00 0.00 C ATOM 651 CG HIS A 209 -9.210 -13.763 -40.178 1.00 0.00 C ATOM 652 ND1 HIS A 209 -8.536 -12.554 -40.383 1.00 0.00 N ATOM 653 CD2 HIS A 209 -8.286 -14.734 -39.914 1.00 0.00 C ATOM 654 CE1 HIS A 209 -7.227 -12.834 -40.275 1.00 0.00 C ATOM 655 NE2 HIS A 209 -7.046 -14.139 -40.000 1.00 0.00 N ATOM 0 H HIS A 209 -13.094 -14.496 -40.391 1.00 0.00 H new ATOM 0 HA HIS A 209 -11.243 -12.866 -41.902 1.00 0.00 H new ATOM 0 HB2 HIS A 209 -11.135 -13.195 -39.470 1.00 0.00 H new ATOM 0 HB3 HIS A 209 -10.928 -14.921 -39.693 1.00 0.00 H new ATOM 0 HD2 HIS A 209 -8.488 -15.769 -39.682 1.00 0.00 H new ATOM 0 HE1 HIS A 209 -6.431 -12.113 -40.392 1.00 0.00 H new ATOM 0 HE2 HIS A 209 -6.148 -14.606 -39.877 1.00 0.00 H new ATOM 663 N ARG A 210 -11.268 -16.147 -42.381 1.00 0.00 N ATOM 664 CA ARG A 210 -10.910 -17.215 -43.337 1.00 0.00 C ATOM 665 C ARG A 210 -11.405 -16.886 -44.750 1.00 0.00 C ATOM 666 O ARG A 210 -10.623 -16.925 -45.699 1.00 0.00 O ATOM 667 CB ARG A 210 -11.475 -18.569 -42.853 1.00 0.00 C ATOM 668 CG ARG A 210 -10.564 -19.388 -41.918 1.00 0.00 C ATOM 669 CD ARG A 210 -9.989 -18.634 -40.709 1.00 0.00 C ATOM 670 NE ARG A 210 -8.813 -17.824 -41.082 1.00 0.00 N ATOM 671 CZ ARG A 210 -7.550 -18.217 -41.123 1.00 0.00 C ATOM 672 NH1 ARG A 210 -7.167 -19.420 -40.783 1.00 0.00 N ATOM 673 NH2 ARG A 210 -6.626 -17.387 -41.521 1.00 0.00 N ATOM 0 H ARG A 210 -11.843 -16.477 -41.606 1.00 0.00 H new ATOM 0 HA ARG A 210 -9.823 -17.286 -43.382 1.00 0.00 H new ATOM 0 HB2 ARG A 210 -12.417 -18.383 -42.338 1.00 0.00 H new ATOM 0 HB3 ARG A 210 -11.705 -19.177 -43.728 1.00 0.00 H new ATOM 0 HG2 ARG A 210 -11.129 -20.245 -41.552 1.00 0.00 H new ATOM 0 HG3 ARG A 210 -9.734 -19.781 -42.505 1.00 0.00 H new ATOM 0 HD2 ARG A 210 -10.757 -17.987 -40.284 1.00 0.00 H new ATOM 0 HD3 ARG A 210 -9.709 -19.348 -39.934 1.00 0.00 H new ATOM 0 HE ARG A 210 -8.994 -16.853 -41.337 1.00 0.00 H new ATOM 0 HH11 ARG A 210 -7.855 -20.104 -40.469 1.00 0.00 H new ATOM 0 HH12 ARG A 210 -6.180 -19.674 -40.832 1.00 0.00 H new ATOM 0 HH21 ARG A 210 -6.878 -16.439 -41.799 1.00 0.00 H new ATOM 0 HH22 ARG A 210 -5.651 -17.686 -41.554 1.00 0.00 H new ATOM 687 N LYS A 211 -12.688 -16.531 -44.892 1.00 0.00 N ATOM 688 CA LYS A 211 -13.313 -16.196 -46.184 1.00 0.00 C ATOM 689 C LYS A 211 -12.651 -14.995 -46.873 1.00 0.00 C ATOM 690 O LYS A 211 -12.301 -15.080 -48.051 1.00 0.00 O ATOM 691 CB LYS A 211 -14.827 -15.985 -45.976 1.00 0.00 C ATOM 692 CG LYS A 211 -15.664 -16.277 -47.233 1.00 0.00 C ATOM 693 CD LYS A 211 -15.779 -17.787 -47.508 1.00 0.00 C ATOM 694 CE LYS A 211 -16.696 -18.056 -48.703 1.00 0.00 C ATOM 695 NZ LYS A 211 -16.845 -19.508 -48.938 1.00 0.00 N ATOM 0 H LYS A 211 -13.332 -16.467 -44.104 1.00 0.00 H new ATOM 0 HA LYS A 211 -13.161 -17.033 -46.865 1.00 0.00 H new ATOM 0 HB2 LYS A 211 -15.168 -16.628 -45.165 1.00 0.00 H new ATOM 0 HB3 LYS A 211 -15.003 -14.956 -45.663 1.00 0.00 H new ATOM 0 HG2 LYS A 211 -16.661 -15.853 -47.112 1.00 0.00 H new ATOM 0 HG3 LYS A 211 -15.211 -15.785 -48.093 1.00 0.00 H new ATOM 0 HD2 LYS A 211 -14.790 -18.202 -47.703 1.00 0.00 H new ATOM 0 HD3 LYS A 211 -16.168 -18.293 -46.625 1.00 0.00 H new ATOM 0 HE2 LYS A 211 -17.674 -17.610 -48.523 1.00 0.00 H new ATOM 0 HE3 LYS A 211 -16.288 -17.579 -49.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 211 -17.471 -19.665 -49.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 211 -15.913 -19.926 -49.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 211 -17.256 -19.956 -48.094 1.00 0.00 H new ATOM 709 N GLN A 212 -12.441 -13.894 -46.146 1.00 0.00 N ATOM 710 CA GLN A 212 -11.792 -12.691 -46.688 1.00 0.00 C ATOM 711 C GLN A 212 -10.300 -12.914 -46.985 1.00 0.00 C ATOM 712 O GLN A 212 -9.808 -12.404 -47.991 1.00 0.00 O ATOM 713 CB GLN A 212 -12.016 -11.496 -45.753 1.00 0.00 C ATOM 714 CG GLN A 212 -13.481 -11.028 -45.805 1.00 0.00 C ATOM 715 CD GLN A 212 -13.783 -9.944 -44.774 1.00 0.00 C ATOM 716 OE1 GLN A 212 -13.951 -8.771 -45.086 1.00 0.00 O ATOM 717 NE2 GLN A 212 -13.890 -10.305 -43.515 1.00 0.00 N ATOM 0 H GLN A 212 -12.714 -13.809 -45.167 1.00 0.00 H new ATOM 0 HA GLN A 212 -12.260 -12.466 -47.647 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -11.754 -11.773 -44.732 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -11.357 -10.676 -46.039 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -13.703 -10.649 -46.802 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -14.138 -11.881 -45.635 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -13.751 -11.280 -43.251 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -14.112 -9.610 -42.802 1.00 0.00 H new ATOM 726 N GLU A 213 -9.589 -13.718 -46.184 1.00 0.00 N ATOM 727 CA GLU A 213 -8.194 -14.094 -46.455 1.00 0.00 C ATOM 728 C GLU A 213 -8.107 -14.825 -47.802 1.00 0.00 C ATOM 729 O GLU A 213 -7.310 -14.434 -48.654 1.00 0.00 O ATOM 730 CB GLU A 213 -7.634 -14.930 -45.287 1.00 0.00 C ATOM 731 CG GLU A 213 -6.219 -15.492 -45.506 1.00 0.00 C ATOM 732 CD GLU A 213 -6.224 -16.894 -46.136 1.00 0.00 C ATOM 733 OE1 GLU A 213 -6.585 -17.858 -45.420 1.00 0.00 O ATOM 734 OE2 GLU A 213 -5.845 -17.011 -47.325 1.00 0.00 O ATOM 0 H GLU A 213 -9.965 -14.127 -45.328 1.00 0.00 H new ATOM 0 HA GLU A 213 -7.574 -13.201 -46.531 1.00 0.00 H new ATOM 0 HB2 GLU A 213 -7.628 -14.312 -44.389 1.00 0.00 H new ATOM 0 HB3 GLU A 213 -8.313 -15.761 -45.097 1.00 0.00 H new ATOM 0 HG2 GLU A 213 -5.659 -14.812 -46.148 1.00 0.00 H new ATOM 0 HG3 GLU A 213 -5.697 -15.530 -44.550 1.00 0.00 H new ATOM 741 N THR A 214 -8.959 -15.834 -48.036 1.00 0.00 N ATOM 742 CA THR A 214 -9.016 -16.556 -49.320 1.00 0.00 C ATOM 743 C THR A 214 -9.346 -15.608 -50.478 1.00 0.00 C ATOM 744 O THR A 214 -8.690 -15.673 -51.519 1.00 0.00 O ATOM 745 CB THR A 214 -10.038 -17.707 -49.273 1.00 0.00 C ATOM 746 OG1 THR A 214 -9.718 -18.613 -48.237 1.00 0.00 O ATOM 747 CG2 THR A 214 -10.087 -18.525 -50.566 1.00 0.00 C ATOM 0 H THR A 214 -9.627 -16.173 -47.344 1.00 0.00 H new ATOM 0 HA THR A 214 -8.027 -16.981 -49.492 1.00 0.00 H new ATOM 0 HB THR A 214 -11.003 -17.226 -49.113 1.00 0.00 H new ATOM 0 HG1 THR A 214 -9.933 -18.209 -47.371 1.00 0.00 H new ATOM 0 HG21 THR A 214 -10.827 -19.319 -50.466 1.00 0.00 H new ATOM 0 HG22 THR A 214 -10.362 -17.876 -51.397 1.00 0.00 H new ATOM 0 HG23 THR A 214 -9.107 -18.963 -50.757 1.00 0.00 H new ATOM 755 N LYS A 215 -10.320 -14.699 -50.306 1.00 0.00 N ATOM 756 CA LYS A 215 -10.706 -13.707 -51.327 1.00 0.00 C ATOM 757 C LYS A 215 -9.534 -12.796 -51.716 1.00 0.00 C ATOM 758 O LYS A 215 -9.234 -12.662 -52.902 1.00 0.00 O ATOM 759 CB LYS A 215 -11.917 -12.901 -50.821 1.00 0.00 C ATOM 760 CG LYS A 215 -12.471 -11.945 -51.891 1.00 0.00 C ATOM 761 CD LYS A 215 -13.723 -11.181 -51.424 1.00 0.00 C ATOM 762 CE LYS A 215 -13.496 -10.276 -50.203 1.00 0.00 C ATOM 763 NZ LYS A 215 -12.518 -9.201 -50.482 1.00 0.00 N ATOM 0 H LYS A 215 -10.867 -14.630 -49.448 1.00 0.00 H new ATOM 0 HA LYS A 215 -10.990 -14.234 -52.238 1.00 0.00 H new ATOM 0 HB2 LYS A 215 -12.703 -13.588 -50.509 1.00 0.00 H new ATOM 0 HB3 LYS A 215 -11.627 -12.328 -49.940 1.00 0.00 H new ATOM 0 HG2 LYS A 215 -11.697 -11.229 -52.167 1.00 0.00 H new ATOM 0 HG3 LYS A 215 -12.713 -12.514 -52.789 1.00 0.00 H new ATOM 0 HD2 LYS A 215 -14.091 -10.571 -52.249 1.00 0.00 H new ATOM 0 HD3 LYS A 215 -14.506 -11.901 -51.186 1.00 0.00 H new ATOM 0 HE2 LYS A 215 -14.444 -9.833 -49.899 1.00 0.00 H new ATOM 0 HE3 LYS A 215 -13.143 -10.879 -49.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 215 -12.408 -8.604 -49.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 215 -11.600 -9.623 -50.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 215 -12.858 -8.620 -51.275 1.00 0.00 H new ATOM 777 N LEU A 216 -8.849 -12.198 -50.737 1.00 0.00 N ATOM 778 CA LEU A 216 -7.696 -11.324 -50.978 1.00 0.00 C ATOM 779 C LEU A 216 -6.509 -12.097 -51.577 1.00 0.00 C ATOM 780 O LEU A 216 -5.878 -11.613 -52.518 1.00 0.00 O ATOM 781 CB LEU A 216 -7.318 -10.604 -49.671 1.00 0.00 C ATOM 782 CG LEU A 216 -6.157 -9.598 -49.821 1.00 0.00 C ATOM 783 CD1 LEU A 216 -6.456 -8.480 -50.824 1.00 0.00 C ATOM 784 CD2 LEU A 216 -5.867 -8.952 -48.470 1.00 0.00 C ATOM 0 H LEU A 216 -9.080 -12.307 -49.749 1.00 0.00 H new ATOM 0 HA LEU A 216 -7.971 -10.574 -51.720 1.00 0.00 H new ATOM 0 HB2 LEU A 216 -8.194 -10.078 -49.292 1.00 0.00 H new ATOM 0 HB3 LEU A 216 -7.045 -11.349 -48.924 1.00 0.00 H new ATOM 0 HG LEU A 216 -5.302 -10.164 -50.191 1.00 0.00 H new ATOM 0 HD11 LEU A 216 -5.601 -7.806 -50.884 1.00 0.00 H new ATOM 0 HD12 LEU A 216 -6.646 -8.913 -51.806 1.00 0.00 H new ATOM 0 HD13 LEU A 216 -7.334 -7.923 -50.497 1.00 0.00 H new ATOM 0 HD21 LEU A 216 -5.047 -8.241 -48.575 1.00 0.00 H new ATOM 0 HD22 LEU A 216 -6.757 -8.430 -48.118 1.00 0.00 H new ATOM 0 HD23 LEU A 216 -5.590 -9.722 -47.750 1.00 0.00 H new ATOM 796 N LYS A 217 -6.227 -13.310 -51.079 1.00 0.00 N ATOM 797 CA LYS A 217 -5.169 -14.189 -51.604 1.00 0.00 C ATOM 798 C LYS A 217 -5.412 -14.497 -53.083 1.00 0.00 C ATOM 799 O LYS A 217 -4.507 -14.324 -53.896 1.00 0.00 O ATOM 800 CB LYS A 217 -5.092 -15.460 -50.741 1.00 0.00 C ATOM 801 CG LYS A 217 -3.981 -16.422 -51.196 1.00 0.00 C ATOM 802 CD LYS A 217 -3.807 -17.614 -50.242 1.00 0.00 C ATOM 803 CE LYS A 217 -5.059 -18.497 -50.178 1.00 0.00 C ATOM 804 NZ LYS A 217 -4.859 -19.639 -49.263 1.00 0.00 N ATOM 0 H LYS A 217 -6.733 -13.714 -50.291 1.00 0.00 H new ATOM 0 HA LYS A 217 -4.203 -13.687 -51.547 1.00 0.00 H new ATOM 0 HB2 LYS A 217 -4.920 -15.179 -49.702 1.00 0.00 H new ATOM 0 HB3 LYS A 217 -6.051 -15.977 -50.777 1.00 0.00 H new ATOM 0 HG2 LYS A 217 -4.211 -16.791 -52.195 1.00 0.00 H new ATOM 0 HG3 LYS A 217 -3.040 -15.877 -51.267 1.00 0.00 H new ATOM 0 HD2 LYS A 217 -2.958 -18.215 -50.567 1.00 0.00 H new ATOM 0 HD3 LYS A 217 -3.574 -17.246 -49.243 1.00 0.00 H new ATOM 0 HE2 LYS A 217 -5.910 -17.903 -49.843 1.00 0.00 H new ATOM 0 HE3 LYS A 217 -5.300 -18.864 -51.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 217 -5.721 -20.220 -49.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 217 -4.062 -20.217 -49.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 217 -4.653 -19.286 -48.307 1.00 0.00 H new ATOM 818 N LEU A 218 -6.638 -14.891 -53.443 1.00 0.00 N ATOM 819 CA LEU A 218 -7.040 -15.153 -54.828 1.00 0.00 C ATOM 820 C LEU A 218 -6.907 -13.890 -55.694 1.00 0.00 C ATOM 821 O LEU A 218 -6.341 -13.959 -56.782 1.00 0.00 O ATOM 822 CB LEU A 218 -8.476 -15.711 -54.835 1.00 0.00 C ATOM 823 CG LEU A 218 -9.041 -16.019 -56.236 1.00 0.00 C ATOM 824 CD1 LEU A 218 -8.227 -17.081 -56.979 1.00 0.00 C ATOM 825 CD2 LEU A 218 -10.479 -16.522 -56.107 1.00 0.00 C ATOM 0 H LEU A 218 -7.390 -15.039 -52.770 1.00 0.00 H new ATOM 0 HA LEU A 218 -6.375 -15.896 -55.267 1.00 0.00 H new ATOM 0 HB2 LEU A 218 -8.499 -16.624 -54.240 1.00 0.00 H new ATOM 0 HB3 LEU A 218 -9.133 -14.993 -54.343 1.00 0.00 H new ATOM 0 HG LEU A 218 -8.993 -15.092 -56.808 1.00 0.00 H new ATOM 0 HD11 LEU A 218 -8.669 -17.259 -57.959 1.00 0.00 H new ATOM 0 HD12 LEU A 218 -7.201 -16.733 -57.101 1.00 0.00 H new ATOM 0 HD13 LEU A 218 -8.230 -18.008 -56.406 1.00 0.00 H new ATOM 0 HD21 LEU A 218 -10.879 -16.740 -57.097 1.00 0.00 H new ATOM 0 HD22 LEU A 218 -10.494 -17.429 -55.502 1.00 0.00 H new ATOM 0 HD23 LEU A 218 -11.091 -15.757 -55.629 1.00 0.00 H new ATOM 837 N MET A 219 -7.384 -12.737 -55.211 1.00 0.00 N ATOM 838 CA MET A 219 -7.287 -11.450 -55.916 1.00 0.00 C ATOM 839 C MET A 219 -5.827 -11.076 -56.234 1.00 0.00 C ATOM 840 O MET A 219 -5.524 -10.683 -57.361 1.00 0.00 O ATOM 841 CB MET A 219 -7.982 -10.366 -55.074 1.00 0.00 C ATOM 842 CG MET A 219 -8.003 -8.995 -55.758 1.00 0.00 C ATOM 843 SD MET A 219 -8.843 -7.717 -54.783 1.00 0.00 S ATOM 844 CE MET A 219 -8.579 -6.289 -55.869 1.00 0.00 C ATOM 0 H MET A 219 -7.854 -12.669 -54.308 1.00 0.00 H new ATOM 0 HA MET A 219 -7.792 -11.535 -56.878 1.00 0.00 H new ATOM 0 HB2 MET A 219 -9.006 -10.677 -54.865 1.00 0.00 H new ATOM 0 HB3 MET A 219 -7.474 -10.279 -54.114 1.00 0.00 H new ATOM 0 HG2 MET A 219 -6.978 -8.678 -55.952 1.00 0.00 H new ATOM 0 HG3 MET A 219 -8.497 -9.087 -56.725 1.00 0.00 H new ATOM 0 HE1 MET A 219 -9.034 -5.404 -55.424 1.00 0.00 H new ATOM 0 HE2 MET A 219 -7.509 -6.122 -55.997 1.00 0.00 H new ATOM 0 HE3 MET A 219 -9.035 -6.481 -56.840 1.00 0.00 H new ATOM 854 N ALA A 220 -4.914 -11.224 -55.269 1.00 0.00 N ATOM 855 CA ALA A 220 -3.490 -10.940 -55.450 1.00 0.00 C ATOM 856 C ALA A 220 -2.799 -11.957 -56.385 1.00 0.00 C ATOM 857 O ALA A 220 -2.057 -11.567 -57.291 1.00 0.00 O ATOM 858 CB ALA A 220 -2.830 -10.915 -54.065 1.00 0.00 C ATOM 0 H ALA A 220 -5.147 -11.548 -54.330 1.00 0.00 H new ATOM 0 HA ALA A 220 -3.379 -9.971 -55.938 1.00 0.00 H new ATOM 0 HB1 ALA A 220 -1.766 -10.705 -54.173 1.00 0.00 H new ATOM 0 HB2 ALA A 220 -3.293 -10.139 -53.455 1.00 0.00 H new ATOM 0 HB3 ALA A 220 -2.961 -11.883 -53.582 1.00 0.00 H new ATOM 864 N ARG A 221 -3.051 -13.259 -56.183 1.00 0.00 N ATOM 865 CA ARG A 221 -2.481 -14.373 -56.964 1.00 0.00 C ATOM 866 C ARG A 221 -2.918 -14.361 -58.432 1.00 0.00 C ATOM 867 O ARG A 221 -2.077 -14.445 -59.327 1.00 0.00 O ATOM 868 CB ARG A 221 -2.871 -15.686 -56.259 1.00 0.00 C ATOM 869 CG ARG A 221 -2.267 -16.948 -56.893 1.00 0.00 C ATOM 870 CD ARG A 221 -2.670 -18.177 -56.069 1.00 0.00 C ATOM 871 NE ARG A 221 -2.135 -19.421 -56.648 1.00 0.00 N ATOM 872 CZ ARG A 221 -2.314 -20.640 -56.165 1.00 0.00 C ATOM 873 NH1 ARG A 221 -3.005 -20.876 -55.079 1.00 0.00 N ATOM 874 NH2 ARG A 221 -1.792 -21.672 -56.771 1.00 0.00 N ATOM 0 H ARG A 221 -3.679 -13.579 -55.446 1.00 0.00 H new ATOM 0 HA ARG A 221 -1.397 -14.268 -56.998 1.00 0.00 H new ATOM 0 HB2 ARG A 221 -2.558 -15.632 -55.216 1.00 0.00 H new ATOM 0 HB3 ARG A 221 -3.957 -15.777 -56.261 1.00 0.00 H new ATOM 0 HG2 ARG A 221 -2.616 -17.055 -57.920 1.00 0.00 H new ATOM 0 HG3 ARG A 221 -1.181 -16.864 -56.933 1.00 0.00 H new ATOM 0 HD2 ARG A 221 -2.306 -18.065 -55.048 1.00 0.00 H new ATOM 0 HD3 ARG A 221 -3.757 -18.239 -56.015 1.00 0.00 H new ATOM 0 HE ARG A 221 -1.577 -19.335 -57.497 1.00 0.00 H new ATOM 0 HH11 ARG A 221 -3.432 -20.103 -54.568 1.00 0.00 H new ATOM 0 HH12 ARG A 221 -3.117 -21.833 -54.743 1.00 0.00 H new ATOM 0 HH21 ARG A 221 -1.243 -21.541 -57.621 1.00 0.00 H new ATOM 0 HH22 ARG A 221 -1.933 -22.609 -56.395 1.00 0.00 H new ATOM 888 N TYR A 222 -4.222 -14.237 -58.685 1.00 0.00 N ATOM 889 CA TYR A 222 -4.806 -14.211 -60.033 1.00 0.00 C ATOM 890 C TYR A 222 -4.633 -12.852 -60.741 1.00 0.00 C ATOM 891 O TYR A 222 -4.729 -12.771 -61.965 1.00 0.00 O ATOM 892 CB TYR A 222 -6.286 -14.622 -59.950 1.00 0.00 C ATOM 893 CG TYR A 222 -6.804 -15.309 -61.200 1.00 0.00 C ATOM 894 CD1 TYR A 222 -6.682 -16.708 -61.323 1.00 0.00 C ATOM 895 CD2 TYR A 222 -7.395 -14.563 -62.239 1.00 0.00 C ATOM 896 CE1 TYR A 222 -7.145 -17.361 -62.481 1.00 0.00 C ATOM 897 CE2 TYR A 222 -7.856 -15.212 -63.402 1.00 0.00 C ATOM 898 CZ TYR A 222 -7.732 -16.615 -63.526 1.00 0.00 C ATOM 899 OH TYR A 222 -8.172 -17.254 -64.646 1.00 0.00 O ATOM 0 H TYR A 222 -4.919 -14.150 -57.945 1.00 0.00 H new ATOM 0 HA TYR A 222 -4.262 -14.928 -60.649 1.00 0.00 H new ATOM 0 HB2 TYR A 222 -6.421 -15.289 -59.098 1.00 0.00 H new ATOM 0 HB3 TYR A 222 -6.889 -13.735 -59.758 1.00 0.00 H new ATOM 0 HD1 TYR A 222 -6.232 -17.281 -60.526 1.00 0.00 H new ATOM 0 HD2 TYR A 222 -7.495 -13.492 -62.144 1.00 0.00 H new ATOM 0 HE1 TYR A 222 -7.051 -18.433 -62.570 1.00 0.00 H new ATOM 0 HE2 TYR A 222 -8.304 -14.637 -64.199 1.00 0.00 H new ATOM 0 HH TYR A 222 -8.551 -16.599 -65.269 1.00 0.00 H new ATOM 909 N GLY A 223 -4.343 -11.781 -59.989 1.00 0.00 N ATOM 910 CA GLY A 223 -4.123 -10.417 -60.494 1.00 0.00 C ATOM 911 C GLY A 223 -2.916 -10.248 -61.432 1.00 0.00 C ATOM 912 O GLY A 223 -2.792 -9.210 -62.086 1.00 0.00 O ATOM 0 H GLY A 223 -4.252 -11.842 -58.975 1.00 0.00 H new ATOM 0 HA2 GLY A 223 -5.020 -10.094 -61.022 1.00 0.00 H new ATOM 0 HA3 GLY A 223 -3.996 -9.748 -59.642 1.00 0.00 H new ATOM 916 N ARG A 224 -2.042 -11.261 -61.536 1.00 0.00 N ATOM 917 CA ARG A 224 -0.849 -11.334 -62.410 1.00 0.00 C ATOM 918 C ARG A 224 -1.218 -11.567 -63.893 1.00 0.00 C ATOM 919 O ARG A 224 -0.665 -12.437 -64.566 1.00 0.00 O ATOM 920 CB ARG A 224 0.112 -12.412 -61.862 1.00 0.00 C ATOM 921 CG ARG A 224 0.590 -12.113 -60.428 1.00 0.00 C ATOM 922 CD ARG A 224 1.592 -13.159 -59.920 1.00 0.00 C ATOM 923 NE ARG A 224 2.877 -13.092 -60.642 1.00 0.00 N ATOM 924 CZ ARG A 224 3.931 -13.864 -60.434 1.00 0.00 C ATOM 925 NH1 ARG A 224 3.946 -14.811 -59.531 1.00 0.00 N ATOM 926 NH2 ARG A 224 5.017 -13.697 -61.139 1.00 0.00 N ATOM 0 H ARG A 224 -2.152 -12.108 -60.978 1.00 0.00 H new ATOM 0 HA ARG A 224 -0.340 -10.370 -62.393 1.00 0.00 H new ATOM 0 HB2 ARG A 224 -0.388 -13.380 -61.879 1.00 0.00 H new ATOM 0 HB3 ARG A 224 0.978 -12.489 -62.520 1.00 0.00 H new ATOM 0 HG2 ARG A 224 1.052 -11.126 -60.399 1.00 0.00 H new ATOM 0 HG3 ARG A 224 -0.270 -12.082 -59.759 1.00 0.00 H new ATOM 0 HD2 ARG A 224 1.767 -13.006 -58.855 1.00 0.00 H new ATOM 0 HD3 ARG A 224 1.164 -14.155 -60.033 1.00 0.00 H new ATOM 0 HE ARG A 224 2.961 -12.383 -61.371 1.00 0.00 H new ATOM 0 HH11 ARG A 224 3.122 -14.978 -58.953 1.00 0.00 H new ATOM 0 HH12 ARG A 224 4.781 -15.382 -59.405 1.00 0.00 H new ATOM 0 HH21 ARG A 224 5.055 -12.969 -61.853 1.00 0.00 H new ATOM 0 HH22 ARG A 224 5.828 -14.294 -60.976 1.00 0.00 H new ATOM 940 N LEU A 225 -2.188 -10.799 -64.396 1.00 0.00 N ATOM 941 CA LEU A 225 -2.748 -10.856 -65.756 1.00 0.00 C ATOM 942 C LEU A 225 -1.804 -10.354 -66.875 1.00 0.00 C ATOM 943 O LEU A 225 -2.158 -10.438 -68.054 1.00 0.00 O ATOM 944 CB LEU A 225 -4.072 -10.060 -65.771 1.00 0.00 C ATOM 945 CG LEU A 225 -5.171 -10.579 -64.819 1.00 0.00 C ATOM 946 CD1 LEU A 225 -6.387 -9.654 -64.885 1.00 0.00 C ATOM 947 CD2 LEU A 225 -5.631 -11.996 -65.171 1.00 0.00 C ATOM 0 H LEU A 225 -2.633 -10.075 -63.832 1.00 0.00 H new ATOM 0 HA LEU A 225 -2.908 -11.910 -65.985 1.00 0.00 H new ATOM 0 HB2 LEU A 225 -3.855 -9.023 -65.516 1.00 0.00 H new ATOM 0 HB3 LEU A 225 -4.466 -10.062 -66.787 1.00 0.00 H new ATOM 0 HG LEU A 225 -4.739 -10.596 -63.818 1.00 0.00 H new ATOM 0 HD11 LEU A 225 -7.161 -10.022 -64.212 1.00 0.00 H new ATOM 0 HD12 LEU A 225 -6.095 -8.647 -64.586 1.00 0.00 H new ATOM 0 HD13 LEU A 225 -6.772 -9.632 -65.904 1.00 0.00 H new ATOM 0 HD21 LEU A 225 -6.404 -12.312 -64.471 1.00 0.00 H new ATOM 0 HD22 LEU A 225 -6.033 -12.007 -66.184 1.00 0.00 H new ATOM 0 HD23 LEU A 225 -4.784 -12.679 -65.109 1.00 0.00 H new ATOM 959 N ALA A 226 -0.616 -9.843 -66.533 1.00 0.00 N ATOM 960 CA ALA A 226 0.389 -9.327 -67.468 1.00 0.00 C ATOM 961 C ALA A 226 1.826 -9.703 -67.045 1.00 0.00 C ATOM 962 O ALA A 226 2.078 -10.069 -65.893 1.00 0.00 O ATOM 963 CB ALA A 226 0.213 -7.804 -67.568 1.00 0.00 C ATOM 0 H ALA A 226 -0.317 -9.775 -65.560 1.00 0.00 H new ATOM 0 HA ALA A 226 0.238 -9.784 -68.446 1.00 0.00 H new ATOM 0 HB1 ALA A 226 0.951 -7.397 -68.259 1.00 0.00 H new ATOM 0 HB2 ALA A 226 -0.789 -7.577 -67.932 1.00 0.00 H new ATOM 0 HB3 ALA A 226 0.352 -7.356 -66.584 1.00 0.00 H new ATOM 969 N ASP A 227 2.774 -9.604 -67.984 1.00 0.00 N ATOM 970 CA ASP A 227 4.195 -9.932 -67.787 1.00 0.00 C ATOM 971 C ASP A 227 5.104 -9.029 -68.636 1.00 0.00 C ATOM 972 O ASP A 227 6.171 -8.593 -68.182 1.00 0.00 O ATOM 973 CB ASP A 227 4.416 -11.413 -68.140 1.00 0.00 C ATOM 974 CG ASP A 227 5.865 -11.857 -67.903 1.00 0.00 C ATOM 975 OD1 ASP A 227 6.231 -12.065 -66.721 1.00 0.00 O ATOM 976 OD2 ASP A 227 6.609 -11.990 -68.905 1.00 0.00 O ATOM 0 H ASP A 227 2.570 -9.284 -68.931 1.00 0.00 H new ATOM 0 HA ASP A 227 4.458 -9.758 -66.743 1.00 0.00 H new ATOM 0 HB2 ASP A 227 3.746 -12.031 -67.542 1.00 0.00 H new ATOM 0 HB3 ASP A 227 4.154 -11.578 -69.185 1.00 0.00 H new TER 981 ASP A 227 HETATM 982 ZN ZN A 301 -9.056 -10.569 -40.618 1.00 0.00 ZN