USER MOD reduce.3.24.130724 H: found=0, std=0, add=490, rem=0, adj=12 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 35:sc= 0.0937 USER MOD Single : A 169 THR OG1 : rot 180:sc= 0 USER MOD Single : A 170 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0215) USER MOD Single : A 175 HIS : no HE2:sc= -0.353 K(o=-0.35,f=-1.3) USER MOD Single : A 176 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 177 ASN : amide:sc= 0.035 K(o=0.035,f=-1.9!) 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= -0.0673 X(o=-0.067,f=-0.067) USER MOD Single : A 199 MET CE :methyl -176:sc= 0 (180deg=-0.03) USER MOD Single : A 201 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 202 GLN : amide:sc= -0.156 X(o=-0.16,f=-0.16) USER MOD Single : A 204 TYR OH : rot 60:sc= 0.00463 USER MOD Single : A 207 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 208 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0106) USER MOD Single : A 211 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 212 GLN : amide:sc=-0.00394 K(o=-0.0039,f=-1.1) USER MOD Single : A 214 THR OG1 : rot -70:sc= 0.0585 USER MOD Single : A 215 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 217 LYS NZ :NH3+ -165:sc= 0.533 (180deg=0.411) 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 -4.966 12.896 -9.669 1.00 0.00 N ATOM 2 CA SER A 168 -5.420 11.506 -9.830 1.00 0.00 C ATOM 3 C SER A 168 -5.106 10.904 -11.214 1.00 0.00 C ATOM 4 O SER A 168 -5.439 9.745 -11.479 1.00 0.00 O ATOM 5 CB SER A 168 -6.929 11.412 -9.554 1.00 0.00 C ATOM 6 OG SER A 168 -7.257 11.935 -8.271 1.00 0.00 O ATOM 0 HA SER A 168 -4.860 10.917 -9.104 1.00 0.00 H new ATOM 0 HB2 SER A 168 -7.475 11.959 -10.322 1.00 0.00 H new ATOM 0 HB3 SER A 168 -7.248 10.371 -9.617 1.00 0.00 H new ATOM 0 HG SER A 168 -6.675 12.698 -8.070 1.00 0.00 H new ATOM 12 N THR A 169 -4.472 11.672 -12.105 1.00 0.00 N ATOM 13 CA THR A 169 -4.083 11.252 -13.466 1.00 0.00 C ATOM 14 C THR A 169 -2.972 10.188 -13.473 1.00 0.00 C ATOM 15 O THR A 169 -2.186 10.068 -12.526 1.00 0.00 O ATOM 16 CB THR A 169 -3.638 12.462 -14.311 1.00 0.00 C ATOM 17 OG1 THR A 169 -2.641 13.211 -13.643 1.00 0.00 O ATOM 18 CG2 THR A 169 -4.805 13.407 -14.604 1.00 0.00 C ATOM 0 H THR A 169 -4.204 12.634 -11.898 1.00 0.00 H new ATOM 0 HA THR A 169 -4.973 10.802 -13.906 1.00 0.00 H new ATOM 0 HB THR A 169 -3.248 12.054 -15.244 1.00 0.00 H new ATOM 0 HG1 THR A 169 -2.375 13.972 -14.201 1.00 0.00 H new ATOM 0 HG21 THR A 169 -4.452 14.247 -15.202 1.00 0.00 H new ATOM 0 HG22 THR A 169 -5.578 12.871 -15.154 1.00 0.00 H new ATOM 0 HG23 THR A 169 -5.218 13.777 -13.666 1.00 0.00 H new ATOM 26 N LYS A 170 -2.897 9.410 -14.564 1.00 0.00 N ATOM 27 CA LYS A 170 -1.909 8.333 -14.786 1.00 0.00 C ATOM 28 C LYS A 170 -1.554 8.223 -16.277 1.00 0.00 C ATOM 29 O LYS A 170 -1.905 7.257 -16.954 1.00 0.00 O ATOM 30 CB LYS A 170 -2.425 7.018 -14.163 1.00 0.00 C ATOM 31 CG LYS A 170 -1.324 5.944 -14.076 1.00 0.00 C ATOM 32 CD LYS A 170 -1.805 4.638 -13.420 1.00 0.00 C ATOM 33 CE LYS A 170 -2.241 4.790 -11.955 1.00 0.00 C ATOM 34 NZ LYS A 170 -1.121 5.209 -11.085 1.00 0.00 N ATOM 0 H LYS A 170 -3.544 9.514 -15.346 1.00 0.00 H new ATOM 0 HA LYS A 170 -0.973 8.569 -14.280 1.00 0.00 H new ATOM 0 HB2 LYS A 170 -2.814 7.219 -13.165 1.00 0.00 H new ATOM 0 HB3 LYS A 170 -3.255 6.637 -14.758 1.00 0.00 H new ATOM 0 HG2 LYS A 170 -0.957 5.726 -15.079 1.00 0.00 H new ATOM 0 HG3 LYS A 170 -0.482 6.340 -13.508 1.00 0.00 H new ATOM 0 HD2 LYS A 170 -2.641 4.242 -13.996 1.00 0.00 H new ATOM 0 HD3 LYS A 170 -1.003 3.901 -13.474 1.00 0.00 H new ATOM 0 HE2 LYS A 170 -3.045 5.523 -11.890 1.00 0.00 H new ATOM 0 HE3 LYS A 170 -2.644 3.843 -11.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 -1.445 5.251 -10.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 -0.343 4.523 -11.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 -0.786 6.148 -11.379 1.00 0.00 H new ATOM 48 N VAL A 171 -0.873 9.251 -16.792 1.00 0.00 N ATOM 49 CA VAL A 171 -0.448 9.390 -18.207 1.00 0.00 C ATOM 50 C VAL A 171 0.336 8.169 -18.726 1.00 0.00 C ATOM 51 O VAL A 171 0.246 7.829 -19.905 1.00 0.00 O ATOM 52 CB VAL A 171 0.357 10.697 -18.401 1.00 0.00 C ATOM 53 CG1 VAL A 171 0.755 10.948 -19.862 1.00 0.00 C ATOM 54 CG2 VAL A 171 -0.453 11.923 -17.945 1.00 0.00 C ATOM 0 H VAL A 171 -0.587 10.046 -16.220 1.00 0.00 H new ATOM 0 HA VAL A 171 -1.356 9.440 -18.808 1.00 0.00 H new ATOM 0 HB VAL A 171 1.255 10.565 -17.797 1.00 0.00 H new ATOM 0 HG11 VAL A 171 1.317 11.879 -19.931 1.00 0.00 H new ATOM 0 HG12 VAL A 171 1.374 10.124 -20.217 1.00 0.00 H new ATOM 0 HG13 VAL A 171 -0.142 11.019 -20.477 1.00 0.00 H new ATOM 0 HG21 VAL A 171 0.139 12.826 -18.094 1.00 0.00 H new ATOM 0 HG22 VAL A 171 -1.371 11.991 -18.529 1.00 0.00 H new ATOM 0 HG23 VAL A 171 -0.702 11.822 -16.889 1.00 0.00 H new ATOM 64 N GLU A 172 1.072 7.475 -17.849 1.00 0.00 N ATOM 65 CA GLU A 172 1.831 6.254 -18.174 1.00 0.00 C ATOM 66 C GLU A 172 0.938 5.086 -18.661 1.00 0.00 C ATOM 67 O GLU A 172 1.401 4.239 -19.427 1.00 0.00 O ATOM 68 CB GLU A 172 2.644 5.850 -16.930 1.00 0.00 C ATOM 69 CG GLU A 172 3.692 4.762 -17.203 1.00 0.00 C ATOM 70 CD GLU A 172 4.530 4.476 -15.951 1.00 0.00 C ATOM 71 OE1 GLU A 172 4.101 3.620 -15.139 1.00 0.00 O ATOM 72 OE2 GLU A 172 5.601 5.112 -15.797 1.00 0.00 O ATOM 0 H GLU A 172 1.160 7.750 -16.871 1.00 0.00 H new ATOM 0 HA GLU A 172 2.492 6.475 -19.012 1.00 0.00 H new ATOM 0 HB2 GLU A 172 3.145 6.733 -16.532 1.00 0.00 H new ATOM 0 HB3 GLU A 172 1.960 5.497 -16.159 1.00 0.00 H new ATOM 0 HG2 GLU A 172 3.195 3.848 -17.529 1.00 0.00 H new ATOM 0 HG3 GLU A 172 4.345 5.077 -18.017 1.00 0.00 H new ATOM 79 N ALA A 173 -0.341 5.059 -18.254 1.00 0.00 N ATOM 80 CA ALA A 173 -1.363 4.065 -18.615 1.00 0.00 C ATOM 81 C ALA A 173 -0.915 2.581 -18.526 1.00 0.00 C ATOM 82 O ALA A 173 -1.340 1.739 -19.323 1.00 0.00 O ATOM 83 CB ALA A 173 -1.957 4.462 -19.977 1.00 0.00 C ATOM 0 H ALA A 173 -0.711 5.773 -17.627 1.00 0.00 H new ATOM 0 HA ALA A 173 -2.143 4.093 -17.854 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -2.719 3.738 -20.267 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -2.407 5.452 -19.903 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -1.167 4.477 -20.728 1.00 0.00 H new ATOM 89 N LEU A 174 -0.040 2.256 -17.563 1.00 0.00 N ATOM 90 CA LEU A 174 0.520 0.917 -17.331 1.00 0.00 C ATOM 91 C LEU A 174 -0.583 -0.112 -16.994 1.00 0.00 C ATOM 92 O LEU A 174 -1.114 -0.123 -15.879 1.00 0.00 O ATOM 93 CB LEU A 174 1.604 1.033 -16.232 1.00 0.00 C ATOM 94 CG LEU A 174 2.660 -0.088 -16.144 1.00 0.00 C ATOM 95 CD1 LEU A 174 2.078 -1.482 -15.902 1.00 0.00 C ATOM 96 CD2 LEU A 174 3.543 -0.144 -17.392 1.00 0.00 C ATOM 0 H LEU A 174 0.310 2.946 -16.899 1.00 0.00 H new ATOM 0 HA LEU A 174 0.986 0.539 -18.241 1.00 0.00 H new ATOM 0 HB2 LEU A 174 2.129 1.977 -16.377 1.00 0.00 H new ATOM 0 HB3 LEU A 174 1.099 1.094 -15.268 1.00 0.00 H new ATOM 0 HG LEU A 174 3.255 0.182 -15.272 1.00 0.00 H new ATOM 0 HD11 LEU A 174 2.887 -2.211 -15.853 1.00 0.00 H new ATOM 0 HD12 LEU A 174 1.527 -1.488 -14.961 1.00 0.00 H new ATOM 0 HD13 LEU A 174 1.404 -1.742 -16.719 1.00 0.00 H new ATOM 0 HD21 LEU A 174 4.272 -0.948 -17.286 1.00 0.00 H new ATOM 0 HD22 LEU A 174 2.923 -0.330 -18.269 1.00 0.00 H new ATOM 0 HD23 LEU A 174 4.065 0.806 -17.511 1.00 0.00 H new ATOM 108 N HIS A 175 -0.938 -0.969 -17.961 1.00 0.00 N ATOM 109 CA HIS A 175 -1.969 -2.017 -17.837 1.00 0.00 C ATOM 110 C HIS A 175 -1.733 -3.183 -18.821 1.00 0.00 C ATOM 111 O HIS A 175 -0.898 -3.076 -19.724 1.00 0.00 O ATOM 112 CB HIS A 175 -3.355 -1.369 -18.038 1.00 0.00 C ATOM 113 CG HIS A 175 -4.499 -2.226 -17.557 1.00 0.00 C ATOM 114 ND1 HIS A 175 -4.653 -2.724 -16.276 1.00 0.00 N ATOM 115 CD2 HIS A 175 -5.559 -2.664 -18.303 1.00 0.00 C ATOM 116 CE1 HIS A 175 -5.782 -3.456 -16.243 1.00 0.00 C ATOM 117 NE2 HIS A 175 -6.348 -3.430 -17.466 1.00 0.00 N ATOM 0 H HIS A 175 -0.503 -0.954 -18.883 1.00 0.00 H new ATOM 0 HA HIS A 175 -1.915 -2.456 -16.841 1.00 0.00 H new ATOM 0 HB2 HIS A 175 -3.380 -0.415 -17.511 1.00 0.00 H new ATOM 0 HB3 HIS A 175 -3.495 -1.152 -19.097 1.00 0.00 H new ATOM 0 HD1 HIS A 175 -4.020 -2.564 -15.492 1.00 0.00 H new ATOM 0 HD2 HIS A 175 -5.744 -2.452 -19.346 1.00 0.00 H new ATOM 0 HE1 HIS A 175 -6.170 -3.977 -15.380 1.00 0.00 H new ATOM 126 N GLN A 176 -2.467 -4.290 -18.657 1.00 0.00 N ATOM 127 CA GLN A 176 -2.392 -5.513 -19.480 1.00 0.00 C ATOM 128 C GLN A 176 -3.788 -6.130 -19.726 1.00 0.00 C ATOM 129 O GLN A 176 -4.792 -5.683 -19.171 1.00 0.00 O ATOM 130 CB GLN A 176 -1.465 -6.548 -18.804 1.00 0.00 C ATOM 131 CG GLN A 176 -0.007 -6.078 -18.643 1.00 0.00 C ATOM 132 CD GLN A 176 0.928 -7.158 -18.089 1.00 0.00 C ATOM 133 OE1 GLN A 176 0.634 -8.348 -18.055 1.00 0.00 O ATOM 134 NE2 GLN A 176 2.103 -6.787 -17.625 1.00 0.00 N ATOM 0 H GLN A 176 -3.162 -4.366 -17.915 1.00 0.00 H new ATOM 0 HA GLN A 176 -1.981 -5.234 -20.450 1.00 0.00 H new ATOM 0 HB2 GLN A 176 -1.867 -6.792 -17.821 1.00 0.00 H new ATOM 0 HB3 GLN A 176 -1.476 -7.467 -19.390 1.00 0.00 H new ATOM 0 HG2 GLN A 176 0.368 -5.746 -19.611 1.00 0.00 H new ATOM 0 HG3 GLN A 176 0.016 -5.214 -17.979 1.00 0.00 H new ATOM 0 HE21 GLN A 176 2.371 -5.803 -17.642 1.00 0.00 H new ATOM 0 HE22 GLN A 176 2.746 -7.484 -17.248 1.00 0.00 H new ATOM 143 N ASN A 177 -3.862 -7.185 -20.544 1.00 0.00 N ATOM 144 CA ASN A 177 -5.092 -7.903 -20.916 1.00 0.00 C ATOM 145 C ASN A 177 -5.538 -8.997 -19.909 1.00 0.00 C ATOM 146 O ASN A 177 -6.051 -10.047 -20.308 1.00 0.00 O ATOM 147 CB ASN A 177 -4.938 -8.422 -22.363 1.00 0.00 C ATOM 148 CG ASN A 177 -3.949 -9.571 -22.532 1.00 0.00 C ATOM 149 OD1 ASN A 177 -2.983 -9.727 -21.796 1.00 0.00 O ATOM 150 ND2 ASN A 177 -4.146 -10.408 -23.526 1.00 0.00 N ATOM 0 H ASN A 177 -3.032 -7.581 -20.985 1.00 0.00 H new ATOM 0 HA ASN A 177 -5.920 -7.196 -20.871 1.00 0.00 H new ATOM 0 HB2 ASN A 177 -5.914 -8.747 -22.723 1.00 0.00 H new ATOM 0 HB3 ASN A 177 -4.623 -7.594 -22.999 1.00 0.00 H new ATOM 0 HD21 ASN A 177 -3.497 -11.180 -23.679 1.00 0.00 H new ATOM 0 HD22 ASN A 177 -4.948 -10.286 -24.144 1.00 0.00 H new ATOM 157 N ARG A 178 -5.355 -8.768 -18.596 1.00 0.00 N ATOM 158 CA ARG A 178 -5.763 -9.693 -17.509 1.00 0.00 C ATOM 159 C ARG A 178 -7.292 -9.883 -17.404 1.00 0.00 C ATOM 160 O ARG A 178 -7.767 -10.846 -16.804 1.00 0.00 O ATOM 161 CB ARG A 178 -5.149 -9.202 -16.181 1.00 0.00 C ATOM 162 CG ARG A 178 -5.218 -10.252 -15.054 1.00 0.00 C ATOM 163 CD ARG A 178 -4.444 -9.828 -13.800 1.00 0.00 C ATOM 164 NE ARG A 178 -5.074 -8.680 -13.118 1.00 0.00 N ATOM 165 CZ ARG A 178 -4.683 -8.149 -11.971 1.00 0.00 C ATOM 166 NH1 ARG A 178 -3.649 -8.592 -11.303 1.00 0.00 N ATOM 167 NH2 ARG A 178 -5.336 -7.141 -11.457 1.00 0.00 N ATOM 0 H ARG A 178 -4.911 -7.919 -18.248 1.00 0.00 H new ATOM 0 HA ARG A 178 -5.378 -10.685 -17.747 1.00 0.00 H new ATOM 0 HB2 ARG A 178 -4.108 -8.927 -16.349 1.00 0.00 H new ATOM 0 HB3 ARG A 178 -5.669 -8.299 -15.860 1.00 0.00 H new ATOM 0 HG2 ARG A 178 -6.261 -10.427 -14.790 1.00 0.00 H new ATOM 0 HG3 ARG A 178 -4.819 -11.198 -15.420 1.00 0.00 H new ATOM 0 HD2 ARG A 178 -4.384 -10.670 -13.110 1.00 0.00 H new ATOM 0 HD3 ARG A 178 -3.422 -9.568 -14.076 1.00 0.00 H new ATOM 0 HE ARG A 178 -5.884 -8.258 -13.572 1.00 0.00 H new ATOM 0 HH11 ARG A 178 -3.108 -9.378 -11.663 1.00 0.00 H new ATOM 0 HH12 ARG A 178 -3.384 -8.151 -10.422 1.00 0.00 H new ATOM 0 HH21 ARG A 178 -6.150 -6.761 -11.940 1.00 0.00 H new ATOM 0 HH22 ARG A 178 -5.032 -6.734 -10.573 1.00 0.00 H new ATOM 181 N GLU A 179 -8.058 -8.986 -18.021 1.00 0.00 N ATOM 182 CA GLU A 179 -9.526 -8.970 -18.100 1.00 0.00 C ATOM 183 C GLU A 179 -9.965 -8.731 -19.565 1.00 0.00 C ATOM 184 O GLU A 179 -9.121 -8.537 -20.445 1.00 0.00 O ATOM 185 CB GLU A 179 -10.039 -7.894 -17.118 1.00 0.00 C ATOM 186 CG GLU A 179 -11.521 -8.027 -16.736 1.00 0.00 C ATOM 187 CD GLU A 179 -11.891 -7.043 -15.618 1.00 0.00 C ATOM 188 OE1 GLU A 179 -12.220 -5.876 -15.945 1.00 0.00 O ATOM 189 OE2 GLU A 179 -11.848 -7.451 -14.432 1.00 0.00 O ATOM 0 H GLU A 179 -7.646 -8.194 -18.515 1.00 0.00 H new ATOM 0 HA GLU A 179 -9.961 -9.926 -17.808 1.00 0.00 H new ATOM 0 HB2 GLU A 179 -9.439 -7.935 -16.209 1.00 0.00 H new ATOM 0 HB3 GLU A 179 -9.879 -6.911 -17.561 1.00 0.00 H new ATOM 0 HG2 GLU A 179 -12.144 -7.840 -17.611 1.00 0.00 H new ATOM 0 HG3 GLU A 179 -11.726 -9.047 -16.410 1.00 0.00 H new ATOM 196 N MET A 180 -11.271 -8.745 -19.855 1.00 0.00 N ATOM 197 CA MET A 180 -11.856 -8.534 -21.193 1.00 0.00 C ATOM 198 C MET A 180 -11.761 -7.073 -21.699 1.00 0.00 C ATOM 199 O MET A 180 -12.768 -6.443 -22.035 1.00 0.00 O ATOM 200 CB MET A 180 -13.300 -9.075 -21.230 1.00 0.00 C ATOM 201 CG MET A 180 -13.348 -10.600 -21.075 1.00 0.00 C ATOM 202 SD MET A 180 -15.011 -11.299 -21.272 1.00 0.00 S ATOM 203 CE MET A 180 -14.608 -13.065 -21.171 1.00 0.00 C ATOM 0 H MET A 180 -11.980 -8.909 -19.140 1.00 0.00 H new ATOM 0 HA MET A 180 -11.250 -9.103 -21.898 1.00 0.00 H new ATOM 0 HB2 MET A 180 -13.881 -8.611 -20.433 1.00 0.00 H new ATOM 0 HB3 MET A 180 -13.769 -8.792 -22.172 1.00 0.00 H new ATOM 0 HG2 MET A 180 -12.683 -11.053 -21.811 1.00 0.00 H new ATOM 0 HG3 MET A 180 -12.964 -10.869 -20.091 1.00 0.00 H new ATOM 0 HE1 MET A 180 -15.520 -13.653 -21.273 1.00 0.00 H new ATOM 0 HE2 MET A 180 -13.916 -13.327 -21.971 1.00 0.00 H new ATOM 0 HE3 MET A 180 -14.145 -13.278 -20.207 1.00 0.00 H new ATOM 213 N ILE A 181 -10.542 -6.526 -21.762 1.00 0.00 N ATOM 214 CA ILE A 181 -10.241 -5.189 -22.298 1.00 0.00 C ATOM 215 C ILE A 181 -10.603 -5.167 -23.796 1.00 0.00 C ATOM 216 O ILE A 181 -10.487 -6.177 -24.491 1.00 0.00 O ATOM 217 CB ILE A 181 -8.762 -4.811 -22.031 1.00 0.00 C ATOM 218 CG1 ILE A 181 -8.338 -4.987 -20.550 1.00 0.00 C ATOM 219 CG2 ILE A 181 -8.465 -3.364 -22.468 1.00 0.00 C ATOM 220 CD1 ILE A 181 -9.213 -4.264 -19.514 1.00 0.00 C ATOM 0 H ILE A 181 -9.710 -7.015 -21.432 1.00 0.00 H new ATOM 0 HA ILE A 181 -10.840 -4.432 -21.791 1.00 0.00 H new ATOM 0 HB ILE A 181 -8.177 -5.509 -22.630 1.00 0.00 H new ATOM 0 HG12 ILE A 181 -8.336 -6.052 -20.316 1.00 0.00 H new ATOM 0 HG13 ILE A 181 -7.312 -4.635 -20.441 1.00 0.00 H new ATOM 0 HG21 ILE A 181 -7.419 -3.131 -22.267 1.00 0.00 H new ATOM 0 HG22 ILE A 181 -8.662 -3.258 -23.535 1.00 0.00 H new ATOM 0 HG23 ILE A 181 -9.103 -2.678 -21.912 1.00 0.00 H new ATOM 0 HD11 ILE A 181 -8.826 -4.456 -18.513 1.00 0.00 H new ATOM 0 HD12 ILE A 181 -9.198 -3.192 -19.710 1.00 0.00 H new ATOM 0 HD13 ILE A 181 -10.237 -4.631 -19.583 1.00 0.00 H new ATOM 232 N ASP A 182 -11.075 -4.023 -24.291 1.00 0.00 N ATOM 233 CA ASP A 182 -11.622 -3.836 -25.643 1.00 0.00 C ATOM 234 C ASP A 182 -10.846 -2.847 -26.550 1.00 0.00 C ATOM 235 O ASP A 182 -11.376 -1.791 -26.914 1.00 0.00 O ATOM 236 CB ASP A 182 -13.121 -3.497 -25.494 1.00 0.00 C ATOM 237 CG ASP A 182 -13.428 -2.125 -24.863 1.00 0.00 C ATOM 238 OD1 ASP A 182 -12.799 -1.781 -23.832 1.00 0.00 O ATOM 239 OD2 ASP A 182 -14.329 -1.425 -25.385 1.00 0.00 O ATOM 0 H ASP A 182 -11.089 -3.164 -23.742 1.00 0.00 H new ATOM 0 HA ASP A 182 -11.497 -4.769 -26.193 1.00 0.00 H new ATOM 0 HB2 ASP A 182 -13.585 -3.537 -26.480 1.00 0.00 H new ATOM 0 HB3 ASP A 182 -13.593 -4.271 -24.888 1.00 0.00 H new ATOM 244 N PRO A 183 -9.596 -3.163 -26.944 1.00 0.00 N ATOM 245 CA PRO A 183 -8.815 -2.329 -27.858 1.00 0.00 C ATOM 246 C PRO A 183 -9.329 -2.457 -29.306 1.00 0.00 C ATOM 247 O PRO A 183 -9.996 -3.431 -29.669 1.00 0.00 O ATOM 248 CB PRO A 183 -7.381 -2.857 -27.738 1.00 0.00 C ATOM 249 CG PRO A 183 -7.584 -4.347 -27.466 1.00 0.00 C ATOM 250 CD PRO A 183 -8.849 -4.370 -26.608 1.00 0.00 C ATOM 0 HA PRO A 183 -8.888 -1.271 -27.607 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -6.811 -2.688 -28.652 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -6.838 -2.369 -26.928 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -7.712 -4.912 -28.389 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -6.733 -4.781 -26.942 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -9.441 -5.262 -26.812 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -8.599 -4.389 -25.547 1.00 0.00 H new ATOM 258 N ASP A 184 -8.984 -1.493 -30.162 1.00 0.00 N ATOM 259 CA ASP A 184 -9.320 -1.541 -31.592 1.00 0.00 C ATOM 260 C ASP A 184 -8.429 -2.564 -32.331 1.00 0.00 C ATOM 261 O ASP A 184 -7.230 -2.663 -32.051 1.00 0.00 O ATOM 262 CB ASP A 184 -9.201 -0.143 -32.220 1.00 0.00 C ATOM 263 CG ASP A 184 -7.759 0.381 -32.287 1.00 0.00 C ATOM 264 OD1 ASP A 184 -7.239 0.802 -31.226 1.00 0.00 O ATOM 265 OD2 ASP A 184 -7.185 0.382 -33.403 1.00 0.00 O ATOM 0 H ASP A 184 -8.466 -0.659 -29.888 1.00 0.00 H new ATOM 0 HA ASP A 184 -10.355 -1.869 -31.693 1.00 0.00 H new ATOM 0 HB2 ASP A 184 -9.616 -0.170 -33.228 1.00 0.00 H new ATOM 0 HB3 ASP A 184 -9.807 0.557 -31.645 1.00 0.00 H new ATOM 270 N LYS A 185 -9.000 -3.315 -33.282 1.00 0.00 N ATOM 271 CA LYS A 185 -8.319 -4.343 -34.088 1.00 0.00 C ATOM 272 C LYS A 185 -8.781 -4.282 -35.549 1.00 0.00 C ATOM 273 O LYS A 185 -9.829 -3.705 -35.842 1.00 0.00 O ATOM 274 CB LYS A 185 -8.607 -5.727 -33.474 1.00 0.00 C ATOM 275 CG LYS A 185 -7.976 -6.001 -32.098 1.00 0.00 C ATOM 276 CD LYS A 185 -6.442 -6.051 -32.132 1.00 0.00 C ATOM 277 CE LYS A 185 -5.897 -6.372 -30.737 1.00 0.00 C ATOM 278 NZ LYS A 185 -4.421 -6.440 -30.744 1.00 0.00 N ATOM 0 H LYS A 185 -9.987 -3.221 -33.522 1.00 0.00 H new ATOM 0 HA LYS A 185 -7.244 -4.162 -34.080 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -9.687 -5.845 -33.386 1.00 0.00 H new ATOM 0 HB3 LYS A 185 -8.258 -6.490 -34.170 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -8.292 -5.225 -31.400 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -8.355 -6.948 -31.714 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -6.110 -6.807 -32.844 1.00 0.00 H new ATOM 0 HD3 LYS A 185 -6.046 -5.095 -32.475 1.00 0.00 H new ATOM 0 HE2 LYS A 185 -6.225 -5.609 -30.031 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -6.306 -7.322 -30.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 -4.079 -6.659 -29.787 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 -4.111 -7.184 -31.401 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 -4.033 -5.525 -31.050 1.00 0.00 H new ATOM 292 N PHE A 186 -8.009 -4.870 -36.465 1.00 0.00 N ATOM 293 CA PHE A 186 -8.287 -4.845 -37.908 1.00 0.00 C ATOM 294 C PHE A 186 -7.805 -6.109 -38.647 1.00 0.00 C ATOM 295 O PHE A 186 -6.734 -6.648 -38.350 1.00 0.00 O ATOM 296 CB PHE A 186 -7.611 -3.589 -38.493 1.00 0.00 C ATOM 297 CG PHE A 186 -7.679 -3.454 -40.005 1.00 0.00 C ATOM 298 CD1 PHE A 186 -8.885 -3.085 -40.628 1.00 0.00 C ATOM 299 CD2 PHE A 186 -6.539 -3.710 -40.793 1.00 0.00 C ATOM 300 CE1 PHE A 186 -8.968 -3.014 -42.030 1.00 0.00 C ATOM 301 CE2 PHE A 186 -6.611 -3.600 -42.194 1.00 0.00 C ATOM 302 CZ PHE A 186 -7.827 -3.263 -42.813 1.00 0.00 C ATOM 0 H PHE A 186 -7.161 -5.384 -36.225 1.00 0.00 H new ATOM 0 HA PHE A 186 -9.368 -4.819 -38.049 1.00 0.00 H new ATOM 0 HB2 PHE A 186 -8.072 -2.708 -38.046 1.00 0.00 H new ATOM 0 HB3 PHE A 186 -6.563 -3.588 -38.192 1.00 0.00 H new ATOM 0 HD1 PHE A 186 -9.752 -2.855 -40.026 1.00 0.00 H new ATOM 0 HD2 PHE A 186 -5.609 -3.991 -40.321 1.00 0.00 H new ATOM 0 HE1 PHE A 186 -9.907 -2.769 -42.505 1.00 0.00 H new ATOM 0 HE2 PHE A 186 -5.731 -3.775 -42.795 1.00 0.00 H new ATOM 0 HZ PHE A 186 -7.885 -3.195 -43.889 1.00 0.00 H new ATOM 312 N CYS A 187 -8.584 -6.528 -39.648 1.00 0.00 N ATOM 313 CA CYS A 187 -8.338 -7.647 -40.555 1.00 0.00 C ATOM 314 C CYS A 187 -8.059 -7.093 -41.964 1.00 0.00 C ATOM 315 O CYS A 187 -8.934 -6.502 -42.606 1.00 0.00 O ATOM 316 CB CYS A 187 -9.563 -8.576 -40.549 1.00 0.00 C ATOM 317 SG CYS A 187 -9.298 -9.997 -41.655 1.00 0.00 S ATOM 0 H CYS A 187 -9.465 -6.059 -39.859 1.00 0.00 H new ATOM 0 HA CYS A 187 -7.471 -8.224 -40.233 1.00 0.00 H new ATOM 0 HB2 CYS A 187 -9.753 -8.928 -39.535 1.00 0.00 H new ATOM 0 HB3 CYS A 187 -10.447 -8.022 -40.865 1.00 0.00 H new ATOM 322 N SER A 188 -6.821 -7.261 -42.438 1.00 0.00 N ATOM 323 CA SER A 188 -6.388 -6.786 -43.761 1.00 0.00 C ATOM 324 C SER A 188 -6.939 -7.638 -44.916 1.00 0.00 C ATOM 325 O SER A 188 -7.146 -7.130 -46.022 1.00 0.00 O ATOM 326 CB SER A 188 -4.855 -6.753 -43.803 1.00 0.00 C ATOM 327 OG SER A 188 -4.387 -6.032 -44.931 1.00 0.00 O ATOM 0 H SER A 188 -6.084 -7.733 -41.913 1.00 0.00 H new ATOM 0 HA SER A 188 -6.794 -5.784 -43.902 1.00 0.00 H new ATOM 0 HB2 SER A 188 -4.474 -6.294 -42.891 1.00 0.00 H new ATOM 0 HB3 SER A 188 -4.468 -7.771 -43.833 1.00 0.00 H new ATOM 0 HG SER A 188 -3.407 -6.026 -44.932 1.00 0.00 H new ATOM 333 N LEU A 189 -7.218 -8.924 -44.669 1.00 0.00 N ATOM 334 CA LEU A 189 -7.763 -9.856 -45.661 1.00 0.00 C ATOM 335 C LEU A 189 -9.219 -9.491 -46.006 1.00 0.00 C ATOM 336 O LEU A 189 -9.560 -9.360 -47.186 1.00 0.00 O ATOM 337 CB LEU A 189 -7.684 -11.304 -45.129 1.00 0.00 C ATOM 338 CG LEU A 189 -6.302 -11.987 -45.068 1.00 0.00 C ATOM 339 CD1 LEU A 189 -5.693 -12.185 -46.458 1.00 0.00 C ATOM 340 CD2 LEU A 189 -5.269 -11.273 -44.194 1.00 0.00 C ATOM 0 H LEU A 189 -7.068 -9.353 -43.756 1.00 0.00 H new ATOM 0 HA LEU A 189 -7.167 -9.782 -46.570 1.00 0.00 H new ATOM 0 HB2 LEU A 189 -8.103 -11.312 -44.123 1.00 0.00 H new ATOM 0 HB3 LEU A 189 -8.333 -11.922 -45.750 1.00 0.00 H new ATOM 0 HG LEU A 189 -6.521 -12.949 -44.604 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -4.721 -12.669 -46.364 1.00 0.00 H new ATOM 0 HD12 LEU A 189 -6.353 -12.811 -47.059 1.00 0.00 H new ATOM 0 HD13 LEU A 189 -5.570 -11.217 -46.943 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -4.331 -11.827 -44.214 1.00 0.00 H new ATOM 0 HD22 LEU A 189 -5.104 -10.265 -44.576 1.00 0.00 H new ATOM 0 HD23 LEU A 189 -5.636 -11.217 -43.169 1.00 0.00 H new ATOM 352 N CYS A 190 -10.064 -9.315 -44.987 1.00 0.00 N ATOM 353 CA CYS A 190 -11.484 -8.984 -45.109 1.00 0.00 C ATOM 354 C CYS A 190 -11.778 -7.468 -45.138 1.00 0.00 C ATOM 355 O CYS A 190 -12.924 -7.075 -45.385 1.00 0.00 O ATOM 356 CB CYS A 190 -12.209 -9.616 -43.906 1.00 0.00 C ATOM 357 SG CYS A 190 -11.956 -11.416 -43.820 1.00 0.00 S ATOM 0 H CYS A 190 -9.765 -9.403 -44.016 1.00 0.00 H new ATOM 0 HA CYS A 190 -11.834 -9.374 -46.065 1.00 0.00 H new ATOM 0 HB2 CYS A 190 -11.851 -9.156 -42.985 1.00 0.00 H new ATOM 0 HB3 CYS A 190 -13.276 -9.403 -43.974 1.00 0.00 H new ATOM 362 N HIS A 191 -10.779 -6.617 -44.852 1.00 0.00 N ATOM 363 CA HIS A 191 -10.919 -5.158 -44.705 1.00 0.00 C ATOM 364 C HIS A 191 -12.028 -4.831 -43.682 1.00 0.00 C ATOM 365 O HIS A 191 -13.003 -4.133 -43.976 1.00 0.00 O ATOM 366 CB HIS A 191 -11.054 -4.481 -46.082 1.00 0.00 C ATOM 367 CG HIS A 191 -10.775 -2.999 -46.042 1.00 0.00 C ATOM 368 ND1 HIS A 191 -9.530 -2.408 -46.157 1.00 0.00 N ATOM 369 CD2 HIS A 191 -11.695 -2.000 -45.878 1.00 0.00 C ATOM 370 CE1 HIS A 191 -9.689 -1.074 -46.063 1.00 0.00 C ATOM 371 NE2 HIS A 191 -10.999 -0.806 -45.892 1.00 0.00 N ATOM 0 H HIS A 191 -9.820 -6.936 -44.712 1.00 0.00 H new ATOM 0 HA HIS A 191 -10.012 -4.725 -44.283 1.00 0.00 H new ATOM 0 HB2 HIS A 191 -10.367 -4.955 -46.783 1.00 0.00 H new ATOM 0 HB3 HIS A 191 -12.062 -4.645 -46.464 1.00 0.00 H new ATOM 0 HD2 HIS A 191 -12.762 -2.121 -45.760 1.00 0.00 H new ATOM 0 HE1 HIS A 191 -8.898 -0.340 -46.116 1.00 0.00 H new ATOM 0 HE2 HIS A 191 -11.408 0.123 -45.790 1.00 0.00 H new ATOM 380 N ALA A 192 -11.884 -5.395 -42.479 1.00 0.00 N ATOM 381 CA ALA A 192 -12.845 -5.326 -41.372 1.00 0.00 C ATOM 382 C ALA A 192 -12.194 -4.799 -40.080 1.00 0.00 C ATOM 383 O ALA A 192 -11.029 -5.086 -39.813 1.00 0.00 O ATOM 384 CB ALA A 192 -13.432 -6.734 -41.170 1.00 0.00 C ATOM 0 H ALA A 192 -11.055 -5.938 -42.238 1.00 0.00 H new ATOM 0 HA ALA A 192 -13.638 -4.620 -41.618 1.00 0.00 H new ATOM 0 HB1 ALA A 192 -14.152 -6.714 -40.352 1.00 0.00 H new ATOM 0 HB2 ALA A 192 -13.931 -7.055 -42.084 1.00 0.00 H new ATOM 0 HB3 ALA A 192 -12.630 -7.432 -40.931 1.00 0.00 H new ATOM 390 N THR A 193 -12.946 -4.046 -39.271 1.00 0.00 N ATOM 391 CA THR A 193 -12.476 -3.423 -38.012 1.00 0.00 C ATOM 392 C THR A 193 -13.309 -3.910 -36.823 1.00 0.00 C ATOM 393 O THR A 193 -14.515 -4.133 -36.963 1.00 0.00 O ATOM 394 CB THR A 193 -12.551 -1.885 -38.111 1.00 0.00 C ATOM 395 OG1 THR A 193 -11.925 -1.424 -39.292 1.00 0.00 O ATOM 396 CG2 THR A 193 -11.856 -1.158 -36.958 1.00 0.00 C ATOM 0 H THR A 193 -13.925 -3.843 -39.472 1.00 0.00 H new ATOM 0 HA THR A 193 -11.438 -3.717 -37.855 1.00 0.00 H new ATOM 0 HB THR A 193 -13.618 -1.664 -38.091 1.00 0.00 H new ATOM 0 HG1 THR A 193 -11.986 -0.447 -39.334 1.00 0.00 H new ATOM 0 HG21 THR A 193 -11.951 -0.081 -37.097 1.00 0.00 H new ATOM 0 HG22 THR A 193 -12.321 -1.444 -36.015 1.00 0.00 H new ATOM 0 HG23 THR A 193 -10.801 -1.430 -36.940 1.00 0.00 H new ATOM 404 N PHE A 194 -12.683 -4.062 -35.650 1.00 0.00 N ATOM 405 CA PHE A 194 -13.314 -4.564 -34.421 1.00 0.00 C ATOM 406 C PHE A 194 -12.963 -3.676 -33.223 1.00 0.00 C ATOM 407 O PHE A 194 -11.905 -3.042 -33.201 1.00 0.00 O ATOM 408 CB PHE A 194 -12.877 -6.023 -34.162 1.00 0.00 C ATOM 409 CG PHE A 194 -12.674 -6.848 -35.420 1.00 0.00 C ATOM 410 CD1 PHE A 194 -13.775 -7.175 -36.233 1.00 0.00 C ATOM 411 CD2 PHE A 194 -11.371 -7.171 -35.847 1.00 0.00 C ATOM 412 CE1 PHE A 194 -13.569 -7.778 -37.485 1.00 0.00 C ATOM 413 CE2 PHE A 194 -11.166 -7.784 -37.092 1.00 0.00 C ATOM 414 CZ PHE A 194 -12.264 -8.072 -37.918 1.00 0.00 C ATOM 0 H PHE A 194 -11.697 -3.833 -35.525 1.00 0.00 H new ATOM 0 HA PHE A 194 -14.396 -4.537 -34.551 1.00 0.00 H new ATOM 0 HB2 PHE A 194 -11.948 -6.016 -33.593 1.00 0.00 H new ATOM 0 HB3 PHE A 194 -13.628 -6.510 -33.540 1.00 0.00 H new ATOM 0 HD1 PHE A 194 -14.778 -6.962 -35.895 1.00 0.00 H new ATOM 0 HD2 PHE A 194 -10.526 -6.946 -35.213 1.00 0.00 H new ATOM 0 HE1 PHE A 194 -14.413 -8.016 -38.115 1.00 0.00 H new ATOM 0 HE2 PHE A 194 -10.166 -8.034 -37.414 1.00 0.00 H new ATOM 0 HZ PHE A 194 -12.106 -8.520 -38.888 1.00 0.00 H new ATOM 424 N ASN A 195 -13.844 -3.637 -32.221 1.00 0.00 N ATOM 425 CA ASN A 195 -13.696 -2.814 -31.011 1.00 0.00 C ATOM 426 C ASN A 195 -14.095 -3.580 -29.729 1.00 0.00 C ATOM 427 O ASN A 195 -14.519 -2.980 -28.743 1.00 0.00 O ATOM 428 CB ASN A 195 -14.490 -1.505 -31.203 1.00 0.00 C ATOM 429 CG ASN A 195 -13.965 -0.646 -32.343 1.00 0.00 C ATOM 430 OD1 ASN A 195 -14.433 -0.709 -33.473 1.00 0.00 O ATOM 431 ND2 ASN A 195 -12.985 0.193 -32.087 1.00 0.00 N ATOM 0 H ASN A 195 -14.702 -4.189 -32.225 1.00 0.00 H new ATOM 0 HA ASN A 195 -12.644 -2.565 -30.869 1.00 0.00 H new ATOM 0 HB2 ASN A 195 -15.536 -1.747 -31.391 1.00 0.00 H new ATOM 0 HB3 ASN A 195 -14.457 -0.929 -30.278 1.00 0.00 H new ATOM 0 HD21 ASN A 195 -12.617 0.789 -32.829 1.00 0.00 H new ATOM 0 HD22 ASN A 195 -12.593 0.248 -31.147 1.00 0.00 H new ATOM 438 N ASP A 196 -13.963 -4.910 -29.736 1.00 0.00 N ATOM 439 CA ASP A 196 -14.241 -5.820 -28.615 1.00 0.00 C ATOM 440 C ASP A 196 -13.309 -7.049 -28.698 1.00 0.00 C ATOM 441 O ASP A 196 -12.939 -7.453 -29.807 1.00 0.00 O ATOM 442 CB ASP A 196 -15.717 -6.254 -28.631 1.00 0.00 C ATOM 443 CG ASP A 196 -16.656 -5.172 -28.088 1.00 0.00 C ATOM 444 OD1 ASP A 196 -16.620 -4.940 -26.856 1.00 0.00 O ATOM 445 OD2 ASP A 196 -17.431 -4.604 -28.894 1.00 0.00 O ATOM 0 H ASP A 196 -13.643 -5.409 -30.566 1.00 0.00 H new ATOM 0 HA ASP A 196 -14.051 -5.299 -27.677 1.00 0.00 H new ATOM 0 HB2 ASP A 196 -16.007 -6.503 -29.652 1.00 0.00 H new ATOM 0 HB3 ASP A 196 -15.832 -7.161 -28.037 1.00 0.00 H new ATOM 450 N PRO A 197 -12.922 -7.662 -27.559 1.00 0.00 N ATOM 451 CA PRO A 197 -11.980 -8.784 -27.551 1.00 0.00 C ATOM 452 C PRO A 197 -12.533 -10.032 -28.238 1.00 0.00 C ATOM 453 O PRO A 197 -11.877 -10.648 -29.079 1.00 0.00 O ATOM 454 CB PRO A 197 -11.695 -9.083 -26.070 1.00 0.00 C ATOM 455 CG PRO A 197 -12.856 -8.448 -25.305 1.00 0.00 C ATOM 456 CD PRO A 197 -13.317 -7.305 -26.202 1.00 0.00 C ATOM 0 HA PRO A 197 -11.082 -8.515 -28.108 1.00 0.00 H new ATOM 0 HB2 PRO A 197 -11.643 -10.156 -25.887 1.00 0.00 H new ATOM 0 HB3 PRO A 197 -10.740 -8.660 -25.759 1.00 0.00 H new ATOM 0 HG2 PRO A 197 -13.658 -9.166 -25.131 1.00 0.00 H new ATOM 0 HG3 PRO A 197 -12.537 -8.084 -24.328 1.00 0.00 H new ATOM 0 HD2 PRO A 197 -14.396 -7.170 -26.135 1.00 0.00 H new ATOM 0 HD3 PRO A 197 -12.858 -6.364 -25.899 1.00 0.00 H new ATOM 464 N VAL A 198 -13.760 -10.406 -27.871 1.00 0.00 N ATOM 465 CA VAL A 198 -14.444 -11.593 -28.393 1.00 0.00 C ATOM 466 C VAL A 198 -14.828 -11.393 -29.859 1.00 0.00 C ATOM 467 O VAL A 198 -14.710 -12.330 -30.639 1.00 0.00 O ATOM 468 CB VAL A 198 -15.636 -11.957 -27.488 1.00 0.00 C ATOM 469 CG1 VAL A 198 -16.405 -13.185 -27.990 1.00 0.00 C ATOM 470 CG2 VAL A 198 -15.125 -12.268 -26.069 1.00 0.00 C ATOM 0 H VAL A 198 -14.316 -9.885 -27.192 1.00 0.00 H new ATOM 0 HA VAL A 198 -13.767 -12.447 -28.374 1.00 0.00 H new ATOM 0 HB VAL A 198 -16.311 -11.101 -27.495 1.00 0.00 H new ATOM 0 HG11 VAL A 198 -17.234 -13.396 -27.315 1.00 0.00 H new ATOM 0 HG12 VAL A 198 -16.792 -12.988 -28.990 1.00 0.00 H new ATOM 0 HG13 VAL A 198 -15.736 -14.045 -28.023 1.00 0.00 H new ATOM 0 HG21 VAL A 198 -15.967 -12.526 -25.427 1.00 0.00 H new ATOM 0 HG22 VAL A 198 -14.429 -13.106 -26.108 1.00 0.00 H new ATOM 0 HG23 VAL A 198 -14.616 -11.393 -25.666 1.00 0.00 H new ATOM 480 N MET A 199 -15.200 -10.175 -30.274 1.00 0.00 N ATOM 481 CA MET A 199 -15.489 -9.855 -31.681 1.00 0.00 C ATOM 482 C MET A 199 -14.250 -10.093 -32.557 1.00 0.00 C ATOM 483 O MET A 199 -14.343 -10.772 -33.581 1.00 0.00 O ATOM 484 CB MET A 199 -15.957 -8.394 -31.776 1.00 0.00 C ATOM 485 CG MET A 199 -16.370 -7.964 -33.189 1.00 0.00 C ATOM 486 SD MET A 199 -16.666 -6.180 -33.368 1.00 0.00 S ATOM 487 CE MET A 199 -18.144 -5.968 -32.337 1.00 0.00 C ATOM 0 H MET A 199 -15.310 -9.381 -29.643 1.00 0.00 H new ATOM 0 HA MET A 199 -16.280 -10.509 -32.048 1.00 0.00 H new ATOM 0 HB2 MET A 199 -16.801 -8.249 -31.101 1.00 0.00 H new ATOM 0 HB3 MET A 199 -15.155 -7.743 -31.428 1.00 0.00 H new ATOM 0 HG2 MET A 199 -15.591 -8.264 -33.890 1.00 0.00 H new ATOM 0 HG3 MET A 199 -17.276 -8.501 -33.470 1.00 0.00 H new ATOM 0 HE1 MET A 199 -18.489 -4.936 -32.404 1.00 0.00 H new ATOM 0 HE2 MET A 199 -18.930 -6.637 -32.686 1.00 0.00 H new ATOM 0 HE3 MET A 199 -17.901 -6.203 -31.301 1.00 0.00 H new ATOM 497 N ALA A 200 -13.086 -9.588 -32.130 1.00 0.00 N ATOM 498 CA ALA A 200 -11.816 -9.809 -32.819 1.00 0.00 C ATOM 499 C ALA A 200 -11.491 -11.310 -32.902 1.00 0.00 C ATOM 500 O ALA A 200 -11.266 -11.846 -33.988 1.00 0.00 O ATOM 501 CB ALA A 200 -10.706 -9.063 -32.066 1.00 0.00 C ATOM 0 H ALA A 200 -13.002 -9.012 -31.292 1.00 0.00 H new ATOM 0 HA ALA A 200 -11.890 -9.429 -33.838 1.00 0.00 H new ATOM 0 HB1 ALA A 200 -9.753 -9.221 -32.572 1.00 0.00 H new ATOM 0 HB2 ALA A 200 -10.933 -7.997 -32.045 1.00 0.00 H new ATOM 0 HB3 ALA A 200 -10.642 -9.440 -31.045 1.00 0.00 H new ATOM 507 N GLN A 201 -11.498 -11.993 -31.751 1.00 0.00 N ATOM 508 CA GLN A 201 -11.191 -13.419 -31.658 1.00 0.00 C ATOM 509 C GLN A 201 -12.110 -14.283 -32.542 1.00 0.00 C ATOM 510 O GLN A 201 -11.626 -15.149 -33.270 1.00 0.00 O ATOM 511 CB GLN A 201 -11.253 -13.850 -30.182 1.00 0.00 C ATOM 512 CG GLN A 201 -10.789 -15.302 -29.969 1.00 0.00 C ATOM 513 CD GLN A 201 -10.777 -15.727 -28.499 1.00 0.00 C ATOM 514 OE1 GLN A 201 -11.449 -15.171 -27.638 1.00 0.00 O ATOM 515 NE2 GLN A 201 -10.012 -16.741 -28.147 1.00 0.00 N ATOM 0 H GLN A 201 -11.719 -11.565 -30.852 1.00 0.00 H new ATOM 0 HA GLN A 201 -10.183 -13.579 -32.041 1.00 0.00 H new ATOM 0 HB2 GLN A 201 -10.631 -13.183 -29.586 1.00 0.00 H new ATOM 0 HB3 GLN A 201 -12.275 -13.742 -29.819 1.00 0.00 H new ATOM 0 HG2 GLN A 201 -11.444 -15.971 -30.527 1.00 0.00 H new ATOM 0 HG3 GLN A 201 -9.787 -15.420 -30.382 1.00 0.00 H new ATOM 0 HE21 GLN A 201 -9.444 -17.219 -28.847 1.00 0.00 H new ATOM 0 HE22 GLN A 201 -9.988 -17.048 -27.175 1.00 0.00 H new ATOM 524 N GLN A 202 -13.426 -14.035 -32.507 1.00 0.00 N ATOM 525 CA GLN A 202 -14.425 -14.749 -33.307 1.00 0.00 C ATOM 526 C GLN A 202 -14.243 -14.502 -34.809 1.00 0.00 C ATOM 527 O GLN A 202 -14.350 -15.448 -35.592 1.00 0.00 O ATOM 528 CB GLN A 202 -15.846 -14.349 -32.868 1.00 0.00 C ATOM 529 CG GLN A 202 -16.254 -14.994 -31.530 1.00 0.00 C ATOM 530 CD GLN A 202 -16.407 -16.514 -31.620 1.00 0.00 C ATOM 531 OE1 GLN A 202 -17.131 -17.052 -32.448 1.00 0.00 O ATOM 532 NE2 GLN A 202 -15.733 -17.271 -30.778 1.00 0.00 N ATOM 0 H GLN A 202 -13.833 -13.316 -31.908 1.00 0.00 H new ATOM 0 HA GLN A 202 -14.281 -15.815 -33.132 1.00 0.00 H new ATOM 0 HB2 GLN A 202 -15.903 -13.264 -32.777 1.00 0.00 H new ATOM 0 HB3 GLN A 202 -16.557 -14.642 -33.640 1.00 0.00 H new ATOM 0 HG2 GLN A 202 -15.506 -14.754 -30.774 1.00 0.00 H new ATOM 0 HG3 GLN A 202 -17.196 -14.559 -31.196 1.00 0.00 H new ATOM 0 HE21 GLN A 202 -15.125 -16.842 -30.081 1.00 0.00 H new ATOM 0 HE22 GLN A 202 -15.820 -18.286 -30.823 1.00 0.00 H new ATOM 541 N HIS A 203 -13.931 -13.267 -35.224 1.00 0.00 N ATOM 542 CA HIS A 203 -13.698 -12.962 -36.638 1.00 0.00 C ATOM 543 C HIS A 203 -12.572 -13.836 -37.212 1.00 0.00 C ATOM 544 O HIS A 203 -12.765 -14.497 -38.230 1.00 0.00 O ATOM 545 CB HIS A 203 -13.390 -11.469 -36.846 1.00 0.00 C ATOM 546 CG HIS A 203 -13.276 -11.130 -38.314 1.00 0.00 C ATOM 547 ND1 HIS A 203 -14.301 -10.704 -39.132 1.00 0.00 N ATOM 548 CD2 HIS A 203 -12.172 -11.295 -39.113 1.00 0.00 C ATOM 549 CE1 HIS A 203 -13.834 -10.646 -40.393 1.00 0.00 C ATOM 550 NE2 HIS A 203 -12.545 -11.022 -40.433 1.00 0.00 N ATOM 0 H HIS A 203 -13.835 -12.466 -34.600 1.00 0.00 H new ATOM 0 HA HIS A 203 -14.616 -13.191 -37.179 1.00 0.00 H new ATOM 0 HB2 HIS A 203 -14.177 -10.867 -36.392 1.00 0.00 H new ATOM 0 HB3 HIS A 203 -12.460 -11.213 -36.338 1.00 0.00 H new ATOM 0 HD1 HIS A 203 -15.249 -10.473 -38.833 1.00 0.00 H new ATOM 0 HD2 HIS A 203 -11.186 -11.585 -38.780 1.00 0.00 H new ATOM 0 HE1 HIS A 203 -14.414 -10.340 -41.251 1.00 0.00 H new ATOM 558 N TYR A 204 -11.417 -13.886 -36.541 1.00 0.00 N ATOM 559 CA TYR A 204 -10.244 -14.654 -36.978 1.00 0.00 C ATOM 560 C TYR A 204 -10.418 -16.189 -37.044 1.00 0.00 C ATOM 561 O TYR A 204 -9.507 -16.871 -37.520 1.00 0.00 O ATOM 562 CB TYR A 204 -9.036 -14.273 -36.102 1.00 0.00 C ATOM 563 CG TYR A 204 -8.706 -12.786 -36.045 1.00 0.00 C ATOM 564 CD1 TYR A 204 -8.771 -11.992 -37.209 1.00 0.00 C ATOM 565 CD2 TYR A 204 -8.326 -12.195 -34.821 1.00 0.00 C ATOM 566 CE1 TYR A 204 -8.506 -10.613 -37.142 1.00 0.00 C ATOM 567 CE2 TYR A 204 -8.036 -10.818 -34.756 1.00 0.00 C ATOM 568 CZ TYR A 204 -8.136 -10.020 -35.916 1.00 0.00 C ATOM 569 OH TYR A 204 -7.864 -8.688 -35.856 1.00 0.00 O ATOM 0 H TYR A 204 -11.267 -13.386 -35.665 1.00 0.00 H new ATOM 0 HA TYR A 204 -10.084 -14.373 -38.019 1.00 0.00 H new ATOM 0 HB2 TYR A 204 -9.221 -14.625 -35.087 1.00 0.00 H new ATOM 0 HB3 TYR A 204 -8.160 -14.807 -36.470 1.00 0.00 H new ATOM 0 HD1 TYR A 204 -9.025 -12.445 -38.156 1.00 0.00 H new ATOM 0 HD2 TYR A 204 -8.257 -12.801 -33.930 1.00 0.00 H new ATOM 0 HE1 TYR A 204 -8.586 -10.006 -38.031 1.00 0.00 H new ATOM 0 HE2 TYR A 204 -7.737 -10.373 -33.819 1.00 0.00 H new ATOM 0 HH TYR A 204 -8.656 -8.180 -36.128 1.00 0.00 H new ATOM 579 N VAL A 205 -11.555 -16.751 -36.602 1.00 0.00 N ATOM 580 CA VAL A 205 -11.830 -18.208 -36.631 1.00 0.00 C ATOM 581 C VAL A 205 -13.147 -18.598 -37.319 1.00 0.00 C ATOM 582 O VAL A 205 -13.369 -19.785 -37.570 1.00 0.00 O ATOM 583 CB VAL A 205 -11.745 -18.847 -35.227 1.00 0.00 C ATOM 584 CG1 VAL A 205 -10.378 -18.609 -34.573 1.00 0.00 C ATOM 585 CG2 VAL A 205 -12.842 -18.358 -34.274 1.00 0.00 C ATOM 0 H VAL A 205 -12.322 -16.205 -36.209 1.00 0.00 H new ATOM 0 HA VAL A 205 -11.032 -18.615 -37.252 1.00 0.00 H new ATOM 0 HB VAL A 205 -11.890 -19.914 -35.394 1.00 0.00 H new ATOM 0 HG11 VAL A 205 -10.360 -19.074 -33.588 1.00 0.00 H new ATOM 0 HG12 VAL A 205 -9.596 -19.046 -35.195 1.00 0.00 H new ATOM 0 HG13 VAL A 205 -10.205 -17.538 -34.471 1.00 0.00 H new ATOM 0 HG21 VAL A 205 -12.726 -18.845 -33.306 1.00 0.00 H new ATOM 0 HG22 VAL A 205 -12.761 -17.278 -34.150 1.00 0.00 H new ATOM 0 HG23 VAL A 205 -13.820 -18.603 -34.688 1.00 0.00 H new ATOM 595 N GLY A 206 -14.018 -17.638 -37.652 1.00 0.00 N ATOM 596 CA GLY A 206 -15.291 -17.897 -38.336 1.00 0.00 C ATOM 597 C GLY A 206 -15.101 -18.304 -39.802 1.00 0.00 C ATOM 598 O GLY A 206 -14.195 -17.811 -40.480 1.00 0.00 O ATOM 0 H GLY A 206 -13.858 -16.651 -37.453 1.00 0.00 H new ATOM 0 HA2 GLY A 206 -15.827 -18.687 -37.810 1.00 0.00 H new ATOM 0 HA3 GLY A 206 -15.913 -17.003 -38.289 1.00 0.00 H new ATOM 602 N LYS A 207 -15.957 -19.197 -40.320 1.00 0.00 N ATOM 603 CA LYS A 207 -15.877 -19.716 -41.704 1.00 0.00 C ATOM 604 C LYS A 207 -15.818 -18.622 -42.779 1.00 0.00 C ATOM 605 O LYS A 207 -15.070 -18.762 -43.746 1.00 0.00 O ATOM 606 CB LYS A 207 -17.018 -20.723 -41.938 1.00 0.00 C ATOM 607 CG LYS A 207 -16.873 -21.467 -43.278 1.00 0.00 C ATOM 608 CD LYS A 207 -17.797 -22.692 -43.388 1.00 0.00 C ATOM 609 CE LYS A 207 -19.291 -22.378 -43.237 1.00 0.00 C ATOM 610 NZ LYS A 207 -19.789 -21.518 -44.332 1.00 0.00 N ATOM 0 H LYS A 207 -16.735 -19.587 -39.788 1.00 0.00 H new ATOM 0 HA LYS A 207 -14.923 -20.232 -41.808 1.00 0.00 H new ATOM 0 HB2 LYS A 207 -17.034 -21.446 -41.123 1.00 0.00 H new ATOM 0 HB3 LYS A 207 -17.973 -20.198 -41.918 1.00 0.00 H new ATOM 0 HG2 LYS A 207 -17.092 -20.779 -44.095 1.00 0.00 H new ATOM 0 HG3 LYS A 207 -15.838 -21.787 -43.399 1.00 0.00 H new ATOM 0 HD2 LYS A 207 -17.635 -23.168 -44.355 1.00 0.00 H new ATOM 0 HD3 LYS A 207 -17.512 -23.416 -42.625 1.00 0.00 H new ATOM 0 HE2 LYS A 207 -19.857 -23.309 -43.221 1.00 0.00 H new ATOM 0 HE3 LYS A 207 -19.463 -21.884 -42.281 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 -20.802 -21.330 -44.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 -19.267 -20.619 -44.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 -19.649 -22.000 -45.243 1.00 0.00 H new ATOM 624 N LYS A 208 -16.541 -17.508 -42.600 1.00 0.00 N ATOM 625 CA LYS A 208 -16.508 -16.364 -43.534 1.00 0.00 C ATOM 626 C LYS A 208 -15.105 -15.750 -43.674 1.00 0.00 C ATOM 627 O LYS A 208 -14.706 -15.404 -44.785 1.00 0.00 O ATOM 628 CB LYS A 208 -17.596 -15.335 -43.179 1.00 0.00 C ATOM 629 CG LYS A 208 -17.376 -14.571 -41.863 1.00 0.00 C ATOM 630 CD LYS A 208 -18.605 -13.701 -41.551 1.00 0.00 C ATOM 631 CE LYS A 208 -18.421 -12.854 -40.288 1.00 0.00 C ATOM 632 NZ LYS A 208 -17.441 -11.767 -40.495 1.00 0.00 N ATOM 0 H LYS A 208 -17.166 -17.370 -41.806 1.00 0.00 H new ATOM 0 HA LYS A 208 -16.744 -16.742 -44.529 1.00 0.00 H new ATOM 0 HB2 LYS A 208 -17.668 -14.612 -43.992 1.00 0.00 H new ATOM 0 HB3 LYS A 208 -18.555 -15.850 -43.125 1.00 0.00 H new ATOM 0 HG2 LYS A 208 -17.201 -15.274 -41.049 1.00 0.00 H new ATOM 0 HG3 LYS A 208 -16.487 -13.945 -41.940 1.00 0.00 H new ATOM 0 HD2 LYS A 208 -18.806 -13.045 -42.398 1.00 0.00 H new ATOM 0 HD3 LYS A 208 -19.478 -14.342 -41.430 1.00 0.00 H new ATOM 0 HE2 LYS A 208 -19.380 -12.428 -39.993 1.00 0.00 H new ATOM 0 HE3 LYS A 208 -18.090 -13.491 -39.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 208 -17.394 -11.175 -39.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 208 -16.504 -12.176 -40.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 208 -17.735 -11.184 -41.304 1.00 0.00 H new ATOM 646 N HIS A 209 -14.324 -15.694 -42.588 1.00 0.00 N ATOM 647 CA HIS A 209 -12.928 -15.233 -42.631 1.00 0.00 C ATOM 648 C HIS A 209 -12.064 -16.223 -43.411 1.00 0.00 C ATOM 649 O HIS A 209 -11.288 -15.801 -44.261 1.00 0.00 O ATOM 650 CB HIS A 209 -12.373 -15.012 -41.219 1.00 0.00 C ATOM 651 CG HIS A 209 -10.902 -14.652 -41.193 1.00 0.00 C ATOM 652 ND1 HIS A 209 -10.365 -13.377 -41.407 1.00 0.00 N ATOM 653 CD2 HIS A 209 -9.874 -15.535 -41.010 1.00 0.00 C ATOM 654 CE1 HIS A 209 -9.031 -13.527 -41.365 1.00 0.00 C ATOM 655 NE2 HIS A 209 -8.707 -14.811 -41.128 1.00 0.00 N ATOM 0 H HIS A 209 -14.639 -15.966 -41.657 1.00 0.00 H new ATOM 0 HA HIS A 209 -12.902 -14.273 -43.147 1.00 0.00 H new ATOM 0 HB2 HIS A 209 -12.941 -14.218 -40.735 1.00 0.00 H new ATOM 0 HB3 HIS A 209 -12.527 -15.917 -40.632 1.00 0.00 H new ATOM 0 HD2 HIS A 209 -9.960 -16.593 -40.812 1.00 0.00 H new ATOM 0 HE1 HIS A 209 -8.318 -12.728 -41.502 1.00 0.00 H new ATOM 0 HE2 HIS A 209 -7.761 -15.184 -41.049 1.00 0.00 H new ATOM 663 N ARG A 210 -12.228 -17.542 -43.200 1.00 0.00 N ATOM 664 CA ARG A 210 -11.492 -18.570 -43.970 1.00 0.00 C ATOM 665 C ARG A 210 -11.760 -18.414 -45.474 1.00 0.00 C ATOM 666 O ARG A 210 -10.812 -18.382 -46.258 1.00 0.00 O ATOM 667 CB ARG A 210 -11.834 -20.001 -43.502 1.00 0.00 C ATOM 668 CG ARG A 210 -11.130 -20.461 -42.213 1.00 0.00 C ATOM 669 CD ARG A 210 -11.575 -19.703 -40.956 1.00 0.00 C ATOM 670 NE ARG A 210 -11.104 -20.345 -39.715 1.00 0.00 N ATOM 671 CZ ARG A 210 -9.878 -20.337 -39.219 1.00 0.00 C ATOM 672 NH1 ARG A 210 -8.872 -19.748 -39.810 1.00 0.00 N ATOM 673 NH2 ARG A 210 -9.634 -20.941 -38.088 1.00 0.00 N ATOM 0 H ARG A 210 -12.865 -17.925 -42.501 1.00 0.00 H new ATOM 0 HA ARG A 210 -10.429 -18.414 -43.784 1.00 0.00 H new ATOM 0 HB2 ARG A 210 -12.911 -20.068 -43.351 1.00 0.00 H new ATOM 0 HB3 ARG A 210 -11.581 -20.697 -44.302 1.00 0.00 H new ATOM 0 HG2 ARG A 210 -11.317 -21.525 -42.069 1.00 0.00 H new ATOM 0 HG3 ARG A 210 -10.054 -20.340 -42.336 1.00 0.00 H new ATOM 0 HD2 ARG A 210 -11.198 -18.681 -40.999 1.00 0.00 H new ATOM 0 HD3 ARG A 210 -12.663 -19.641 -40.939 1.00 0.00 H new ATOM 0 HE ARG A 210 -11.805 -20.854 -39.177 1.00 0.00 H new ATOM 0 HH11 ARG A 210 -9.013 -19.265 -40.697 1.00 0.00 H new ATOM 0 HH12 ARG A 210 -7.945 -19.772 -39.384 1.00 0.00 H new ATOM 0 HH21 ARG A 210 -10.387 -21.416 -37.591 1.00 0.00 H new ATOM 0 HH22 ARG A 210 -8.690 -20.938 -37.701 1.00 0.00 H new ATOM 687 N LYS A 211 -13.033 -18.263 -45.867 1.00 0.00 N ATOM 688 CA LYS A 211 -13.464 -18.054 -47.264 1.00 0.00 C ATOM 689 C LYS A 211 -12.863 -16.789 -47.890 1.00 0.00 C ATOM 690 O LYS A 211 -12.343 -16.850 -49.003 1.00 0.00 O ATOM 691 CB LYS A 211 -15.003 -18.006 -47.337 1.00 0.00 C ATOM 692 CG LYS A 211 -15.695 -19.365 -47.122 1.00 0.00 C ATOM 693 CD LYS A 211 -15.438 -20.411 -48.220 1.00 0.00 C ATOM 694 CE LYS A 211 -15.906 -19.933 -49.601 1.00 0.00 C ATOM 695 NZ LYS A 211 -15.712 -20.981 -50.625 1.00 0.00 N ATOM 0 H LYS A 211 -13.813 -18.283 -45.210 1.00 0.00 H new ATOM 0 HA LYS A 211 -13.092 -18.899 -47.844 1.00 0.00 H new ATOM 0 HB2 LYS A 211 -15.368 -17.304 -46.587 1.00 0.00 H new ATOM 0 HB3 LYS A 211 -15.296 -17.613 -48.311 1.00 0.00 H new ATOM 0 HG2 LYS A 211 -15.366 -19.775 -46.167 1.00 0.00 H new ATOM 0 HG3 LYS A 211 -16.770 -19.199 -47.044 1.00 0.00 H new ATOM 0 HD2 LYS A 211 -14.373 -20.639 -48.259 1.00 0.00 H new ATOM 0 HD3 LYS A 211 -15.954 -21.337 -47.965 1.00 0.00 H new ATOM 0 HE2 LYS A 211 -16.959 -19.657 -49.555 1.00 0.00 H new ATOM 0 HE3 LYS A 211 -15.354 -19.037 -49.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 211 -16.037 -20.629 -51.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 211 -14.703 -21.226 -50.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 211 -16.259 -21.826 -50.365 1.00 0.00 H new ATOM 709 N GLN A 212 -12.909 -15.648 -47.199 1.00 0.00 N ATOM 710 CA GLN A 212 -12.344 -14.397 -47.722 1.00 0.00 C ATOM 711 C GLN A 212 -10.807 -14.385 -47.693 1.00 0.00 C ATOM 712 O GLN A 212 -10.191 -13.837 -48.607 1.00 0.00 O ATOM 713 CB GLN A 212 -12.942 -13.187 -46.986 1.00 0.00 C ATOM 714 CG GLN A 212 -14.202 -12.629 -47.670 1.00 0.00 C ATOM 715 CD GLN A 212 -15.344 -13.635 -47.820 1.00 0.00 C ATOM 716 OE1 GLN A 212 -15.405 -14.414 -48.763 1.00 0.00 O ATOM 717 NE2 GLN A 212 -16.307 -13.645 -46.923 1.00 0.00 N ATOM 0 H GLN A 212 -13.332 -15.562 -46.275 1.00 0.00 H new ATOM 0 HA GLN A 212 -12.623 -14.327 -48.773 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -13.188 -13.476 -45.964 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -12.191 -12.400 -46.923 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -14.562 -11.774 -47.098 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -13.929 -12.259 -48.658 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -16.273 -13.003 -46.131 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -17.087 -14.295 -47.020 1.00 0.00 H new ATOM 726 N GLU A 213 -10.171 -15.020 -46.707 1.00 0.00 N ATOM 727 CA GLU A 213 -8.713 -15.151 -46.618 1.00 0.00 C ATOM 728 C GLU A 213 -8.169 -15.922 -47.827 1.00 0.00 C ATOM 729 O GLU A 213 -7.255 -15.435 -48.494 1.00 0.00 O ATOM 730 CB GLU A 213 -8.338 -15.823 -45.286 1.00 0.00 C ATOM 731 CG GLU A 213 -6.837 -16.080 -45.114 1.00 0.00 C ATOM 732 CD GLU A 213 -6.547 -16.608 -43.703 1.00 0.00 C ATOM 733 OE1 GLU A 213 -6.310 -15.775 -42.795 1.00 0.00 O ATOM 734 OE2 GLU A 213 -6.571 -17.850 -43.523 1.00 0.00 O ATOM 0 H GLU A 213 -10.663 -15.466 -45.933 1.00 0.00 H new ATOM 0 HA GLU A 213 -8.253 -14.163 -46.638 1.00 0.00 H new ATOM 0 HB2 GLU A 213 -8.684 -15.195 -44.465 1.00 0.00 H new ATOM 0 HB3 GLU A 213 -8.869 -16.772 -45.208 1.00 0.00 H new ATOM 0 HG2 GLU A 213 -6.497 -16.801 -45.857 1.00 0.00 H new ATOM 0 HG3 GLU A 213 -6.281 -15.159 -45.287 1.00 0.00 H new ATOM 741 N THR A 214 -8.750 -17.083 -48.163 1.00 0.00 N ATOM 742 CA THR A 214 -8.335 -17.848 -49.352 1.00 0.00 C ATOM 743 C THR A 214 -8.668 -17.102 -50.645 1.00 0.00 C ATOM 744 O THR A 214 -7.839 -17.096 -51.555 1.00 0.00 O ATOM 745 CB THR A 214 -8.923 -19.267 -49.400 1.00 0.00 C ATOM 746 OG1 THR A 214 -10.331 -19.246 -49.339 1.00 0.00 O ATOM 747 CG2 THR A 214 -8.408 -20.133 -48.249 1.00 0.00 C ATOM 0 H THR A 214 -9.507 -17.513 -47.631 1.00 0.00 H new ATOM 0 HA THR A 214 -7.253 -17.950 -49.267 1.00 0.00 H new ATOM 0 HB THR A 214 -8.602 -19.694 -50.350 1.00 0.00 H new ATOM 0 HG1 THR A 214 -10.616 -18.978 -48.440 1.00 0.00 H new ATOM 0 HG21 THR A 214 -8.847 -21.128 -48.318 1.00 0.00 H new ATOM 0 HG22 THR A 214 -7.322 -20.210 -48.309 1.00 0.00 H new ATOM 0 HG23 THR A 214 -8.687 -19.679 -47.298 1.00 0.00 H new ATOM 755 N LYS A 215 -9.824 -16.422 -50.734 1.00 0.00 N ATOM 756 CA LYS A 215 -10.215 -15.613 -51.905 1.00 0.00 C ATOM 757 C LYS A 215 -9.188 -14.508 -52.186 1.00 0.00 C ATOM 758 O LYS A 215 -8.688 -14.401 -53.306 1.00 0.00 O ATOM 759 CB LYS A 215 -11.624 -15.041 -51.666 1.00 0.00 C ATOM 760 CG LYS A 215 -12.198 -14.272 -52.868 1.00 0.00 C ATOM 761 CD LYS A 215 -13.518 -13.559 -52.525 1.00 0.00 C ATOM 762 CE LYS A 215 -14.630 -14.481 -52.001 1.00 0.00 C ATOM 763 NZ LYS A 215 -15.053 -15.467 -53.019 1.00 0.00 N ATOM 0 H LYS A 215 -10.521 -16.417 -49.989 1.00 0.00 H new ATOM 0 HA LYS A 215 -10.237 -16.244 -52.794 1.00 0.00 H new ATOM 0 HB2 LYS A 215 -12.299 -15.859 -51.415 1.00 0.00 H new ATOM 0 HB3 LYS A 215 -11.594 -14.376 -50.803 1.00 0.00 H new ATOM 0 HG2 LYS A 215 -11.468 -13.538 -53.209 1.00 0.00 H new ATOM 0 HG3 LYS A 215 -12.364 -14.964 -53.694 1.00 0.00 H new ATOM 0 HD2 LYS A 215 -13.317 -12.793 -51.776 1.00 0.00 H new ATOM 0 HD3 LYS A 215 -13.880 -13.046 -53.416 1.00 0.00 H new ATOM 0 HE2 LYS A 215 -14.279 -15.005 -51.112 1.00 0.00 H new ATOM 0 HE3 LYS A 215 -15.488 -13.880 -51.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 215 -15.804 -16.070 -52.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 215 -15.412 -14.968 -53.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 215 -14.241 -16.057 -53.289 1.00 0.00 H new ATOM 777 N LEU A 216 -8.844 -13.716 -51.166 1.00 0.00 N ATOM 778 CA LEU A 216 -7.860 -12.634 -51.250 1.00 0.00 C ATOM 779 C LEU A 216 -6.466 -13.190 -51.579 1.00 0.00 C ATOM 780 O LEU A 216 -5.824 -12.711 -52.514 1.00 0.00 O ATOM 781 CB LEU A 216 -7.900 -11.841 -49.925 1.00 0.00 C ATOM 782 CG LEU A 216 -7.172 -10.481 -49.863 1.00 0.00 C ATOM 783 CD1 LEU A 216 -5.649 -10.566 -49.978 1.00 0.00 C ATOM 784 CD2 LEU A 216 -7.686 -9.498 -50.917 1.00 0.00 C ATOM 0 H LEU A 216 -9.253 -13.812 -50.236 1.00 0.00 H new ATOM 0 HA LEU A 216 -8.104 -11.952 -52.064 1.00 0.00 H new ATOM 0 HB2 LEU A 216 -8.946 -11.670 -49.672 1.00 0.00 H new ATOM 0 HB3 LEU A 216 -7.483 -12.477 -49.144 1.00 0.00 H new ATOM 0 HG LEU A 216 -7.406 -10.115 -48.863 1.00 0.00 H new ATOM 0 HD11 LEU A 216 -5.224 -9.564 -49.924 1.00 0.00 H new ATOM 0 HD12 LEU A 216 -5.256 -11.171 -49.161 1.00 0.00 H new ATOM 0 HD13 LEU A 216 -5.381 -11.024 -50.930 1.00 0.00 H new ATOM 0 HD21 LEU A 216 -7.143 -8.557 -50.832 1.00 0.00 H new ATOM 0 HD22 LEU A 216 -7.533 -9.917 -51.911 1.00 0.00 H new ATOM 0 HD23 LEU A 216 -8.749 -9.318 -50.759 1.00 0.00 H new ATOM 796 N LYS A 217 -6.007 -14.226 -50.860 1.00 0.00 N ATOM 797 CA LYS A 217 -4.702 -14.868 -51.098 1.00 0.00 C ATOM 798 C LYS A 217 -4.569 -15.379 -52.535 1.00 0.00 C ATOM 799 O LYS A 217 -3.554 -15.109 -53.171 1.00 0.00 O ATOM 800 CB LYS A 217 -4.483 -15.986 -50.060 1.00 0.00 C ATOM 801 CG LYS A 217 -3.128 -16.718 -50.133 1.00 0.00 C ATOM 802 CD LYS A 217 -1.949 -16.013 -49.436 1.00 0.00 C ATOM 803 CE LYS A 217 -1.498 -14.672 -50.033 1.00 0.00 C ATOM 804 NZ LYS A 217 -1.073 -14.801 -51.444 1.00 0.00 N ATOM 0 H LYS A 217 -6.532 -14.645 -50.093 1.00 0.00 H new ATOM 0 HA LYS A 217 -3.917 -14.122 -50.974 1.00 0.00 H new ATOM 0 HB2 LYS A 217 -4.588 -15.556 -49.064 1.00 0.00 H new ATOM 0 HB3 LYS A 217 -5.278 -16.722 -50.175 1.00 0.00 H new ATOM 0 HG2 LYS A 217 -3.247 -17.708 -49.693 1.00 0.00 H new ATOM 0 HG3 LYS A 217 -2.871 -16.864 -51.182 1.00 0.00 H new ATOM 0 HD2 LYS A 217 -2.220 -15.848 -48.393 1.00 0.00 H new ATOM 0 HD3 LYS A 217 -1.096 -16.692 -49.440 1.00 0.00 H new ATOM 0 HE2 LYS A 217 -2.315 -13.954 -49.966 1.00 0.00 H new ATOM 0 HE3 LYS A 217 -0.673 -14.273 -49.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 217 -0.546 -13.950 -51.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 217 -0.462 -15.636 -51.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 217 -1.911 -14.907 -52.051 1.00 0.00 H new ATOM 818 N LEU A 218 -5.582 -16.068 -53.063 1.00 0.00 N ATOM 819 CA LEU A 218 -5.601 -16.576 -54.440 1.00 0.00 C ATOM 820 C LEU A 218 -5.573 -15.418 -55.454 1.00 0.00 C ATOM 821 O LEU A 218 -4.774 -15.435 -56.392 1.00 0.00 O ATOM 822 CB LEU A 218 -6.831 -17.498 -54.586 1.00 0.00 C ATOM 823 CG LEU A 218 -6.933 -18.391 -55.837 1.00 0.00 C ATOM 824 CD1 LEU A 218 -7.317 -17.634 -57.109 1.00 0.00 C ATOM 825 CD2 LEU A 218 -5.653 -19.190 -56.082 1.00 0.00 C ATOM 0 H LEU A 218 -6.427 -16.294 -52.539 1.00 0.00 H new ATOM 0 HA LEU A 218 -4.707 -17.161 -54.656 1.00 0.00 H new ATOM 0 HB2 LEU A 218 -6.865 -18.147 -53.711 1.00 0.00 H new ATOM 0 HB3 LEU A 218 -7.722 -16.871 -54.552 1.00 0.00 H new ATOM 0 HG LEU A 218 -7.747 -19.080 -55.612 1.00 0.00 H new ATOM 0 HD11 LEU A 218 -7.368 -18.331 -57.946 1.00 0.00 H new ATOM 0 HD12 LEU A 218 -8.289 -17.160 -56.971 1.00 0.00 H new ATOM 0 HD13 LEU A 218 -6.568 -16.871 -57.318 1.00 0.00 H new ATOM 0 HD21 LEU A 218 -5.773 -19.804 -56.974 1.00 0.00 H new ATOM 0 HD22 LEU A 218 -4.817 -18.504 -56.223 1.00 0.00 H new ATOM 0 HD23 LEU A 218 -5.455 -19.832 -55.224 1.00 0.00 H new ATOM 837 N MET A 219 -6.389 -14.378 -55.240 1.00 0.00 N ATOM 838 CA MET A 219 -6.412 -13.178 -56.087 1.00 0.00 C ATOM 839 C MET A 219 -5.035 -12.488 -56.128 1.00 0.00 C ATOM 840 O MET A 219 -4.576 -12.088 -57.198 1.00 0.00 O ATOM 841 CB MET A 219 -7.516 -12.227 -55.593 1.00 0.00 C ATOM 842 CG MET A 219 -7.736 -11.019 -56.511 1.00 0.00 C ATOM 843 SD MET A 219 -8.306 -11.427 -58.186 1.00 0.00 S ATOM 844 CE MET A 219 -8.474 -9.753 -58.861 1.00 0.00 C ATOM 0 H MET A 219 -7.056 -14.345 -54.469 1.00 0.00 H new ATOM 0 HA MET A 219 -6.638 -13.471 -57.112 1.00 0.00 H new ATOM 0 HB2 MET A 219 -8.450 -12.782 -55.505 1.00 0.00 H new ATOM 0 HB3 MET A 219 -7.260 -11.873 -54.594 1.00 0.00 H new ATOM 0 HG2 MET A 219 -8.465 -10.356 -56.046 1.00 0.00 H new ATOM 0 HG3 MET A 219 -6.802 -10.463 -56.586 1.00 0.00 H new ATOM 0 HE1 MET A 219 -8.819 -9.810 -59.893 1.00 0.00 H new ATOM 0 HE2 MET A 219 -9.196 -9.192 -58.268 1.00 0.00 H new ATOM 0 HE3 MET A 219 -7.508 -9.249 -58.828 1.00 0.00 H new ATOM 854 N ALA A 220 -4.349 -12.385 -54.983 1.00 0.00 N ATOM 855 CA ALA A 220 -3.003 -11.817 -54.879 1.00 0.00 C ATOM 856 C ALA A 220 -1.938 -12.715 -55.547 1.00 0.00 C ATOM 857 O ALA A 220 -1.070 -12.214 -56.266 1.00 0.00 O ATOM 858 CB ALA A 220 -2.692 -11.583 -53.395 1.00 0.00 C ATOM 0 H ALA A 220 -4.722 -12.700 -54.088 1.00 0.00 H new ATOM 0 HA ALA A 220 -2.972 -10.870 -55.417 1.00 0.00 H new ATOM 0 HB1 ALA A 220 -1.693 -11.160 -53.295 1.00 0.00 H new ATOM 0 HB2 ALA A 220 -3.423 -10.892 -52.975 1.00 0.00 H new ATOM 0 HB3 ALA A 220 -2.740 -12.531 -52.859 1.00 0.00 H new ATOM 864 N ARG A 221 -2.020 -14.042 -55.351 1.00 0.00 N ATOM 865 CA ARG A 221 -1.120 -15.062 -55.931 1.00 0.00 C ATOM 866 C ARG A 221 -1.065 -15.001 -57.463 1.00 0.00 C ATOM 867 O ARG A 221 -0.002 -15.214 -58.047 1.00 0.00 O ATOM 868 CB ARG A 221 -1.577 -16.449 -55.437 1.00 0.00 C ATOM 869 CG ARG A 221 -0.641 -17.605 -55.827 1.00 0.00 C ATOM 870 CD ARG A 221 -1.223 -18.960 -55.396 1.00 0.00 C ATOM 871 NE ARG A 221 -1.353 -19.070 -53.930 1.00 0.00 N ATOM 872 CZ ARG A 221 -2.133 -19.912 -53.272 1.00 0.00 C ATOM 873 NH1 ARG A 221 -2.901 -20.783 -53.874 1.00 0.00 N ATOM 874 NH2 ARG A 221 -2.157 -19.901 -51.967 1.00 0.00 N ATOM 0 H ARG A 221 -2.743 -14.453 -54.761 1.00 0.00 H new ATOM 0 HA ARG A 221 -0.102 -14.863 -55.596 1.00 0.00 H new ATOM 0 HB2 ARG A 221 -1.668 -16.422 -54.351 1.00 0.00 H new ATOM 0 HB3 ARG A 221 -2.571 -16.653 -55.835 1.00 0.00 H new ATOM 0 HG2 ARG A 221 -0.483 -17.601 -56.905 1.00 0.00 H new ATOM 0 HG3 ARG A 221 0.334 -17.460 -55.361 1.00 0.00 H new ATOM 0 HD2 ARG A 221 -2.201 -19.097 -55.857 1.00 0.00 H new ATOM 0 HD3 ARG A 221 -0.583 -19.762 -55.763 1.00 0.00 H new ATOM 0 HE ARG A 221 -0.786 -18.434 -53.369 1.00 0.00 H new ATOM 0 HH11 ARG A 221 -2.915 -20.833 -54.893 1.00 0.00 H new ATOM 0 HH12 ARG A 221 -3.486 -21.413 -53.325 1.00 0.00 H new ATOM 0 HH21 ARG A 221 -1.573 -19.242 -51.452 1.00 0.00 H new ATOM 0 HH22 ARG A 221 -2.759 -20.551 -51.463 1.00 0.00 H new ATOM 888 N TYR A 222 -2.192 -14.678 -58.101 1.00 0.00 N ATOM 889 CA TYR A 222 -2.341 -14.539 -59.558 1.00 0.00 C ATOM 890 C TYR A 222 -2.525 -13.066 -59.997 1.00 0.00 C ATOM 891 O TYR A 222 -3.005 -12.792 -61.101 1.00 0.00 O ATOM 892 CB TYR A 222 -3.491 -15.445 -60.040 1.00 0.00 C ATOM 893 CG TYR A 222 -3.399 -16.933 -59.715 1.00 0.00 C ATOM 894 CD1 TYR A 222 -2.158 -17.592 -59.567 1.00 0.00 C ATOM 895 CD2 TYR A 222 -4.591 -17.677 -59.612 1.00 0.00 C ATOM 896 CE1 TYR A 222 -2.113 -18.970 -59.278 1.00 0.00 C ATOM 897 CE2 TYR A 222 -4.550 -19.058 -59.341 1.00 0.00 C ATOM 898 CZ TYR A 222 -3.311 -19.708 -59.160 1.00 0.00 C ATOM 899 OH TYR A 222 -3.279 -21.041 -58.885 1.00 0.00 O ATOM 0 H TYR A 222 -3.062 -14.498 -57.600 1.00 0.00 H new ATOM 0 HA TYR A 222 -1.417 -14.865 -60.035 1.00 0.00 H new ATOM 0 HB2 TYR A 222 -4.420 -15.065 -59.615 1.00 0.00 H new ATOM 0 HB3 TYR A 222 -3.570 -15.341 -61.122 1.00 0.00 H new ATOM 0 HD1 TYR A 222 -1.239 -17.036 -59.676 1.00 0.00 H new ATOM 0 HD2 TYR A 222 -5.543 -17.184 -59.742 1.00 0.00 H new ATOM 0 HE1 TYR A 222 -1.161 -19.463 -59.147 1.00 0.00 H new ATOM 0 HE2 TYR A 222 -5.469 -19.621 -59.272 1.00 0.00 H new ATOM 0 HH TYR A 222 -4.195 -21.387 -58.838 1.00 0.00 H new ATOM 909 N GLY A 223 -2.137 -12.113 -59.140 1.00 0.00 N ATOM 910 CA GLY A 223 -2.222 -10.664 -59.360 1.00 0.00 C ATOM 911 C GLY A 223 -0.849 -9.994 -59.504 1.00 0.00 C ATOM 912 O GLY A 223 0.179 -10.663 -59.651 1.00 0.00 O ATOM 0 H GLY A 223 -1.736 -12.343 -58.231 1.00 0.00 H new ATOM 0 HA2 GLY A 223 -2.809 -10.473 -60.259 1.00 0.00 H new ATOM 0 HA3 GLY A 223 -2.757 -10.207 -58.527 1.00 0.00 H new ATOM 916 N ARG A 224 -0.831 -8.654 -59.484 1.00 0.00 N ATOM 917 CA ARG A 224 0.389 -7.830 -59.610 1.00 0.00 C ATOM 918 C ARG A 224 1.400 -8.063 -58.472 1.00 0.00 C ATOM 919 O ARG A 224 1.012 -8.254 -57.318 1.00 0.00 O ATOM 920 CB ARG A 224 0.004 -6.340 -59.735 1.00 0.00 C ATOM 921 CG ARG A 224 -0.643 -5.741 -58.471 1.00 0.00 C ATOM 922 CD ARG A 224 -1.108 -4.301 -58.711 1.00 0.00 C ATOM 923 NE ARG A 224 -1.709 -3.730 -57.491 1.00 0.00 N ATOM 924 CZ ARG A 224 -2.336 -2.569 -57.396 1.00 0.00 C ATOM 925 NH1 ARG A 224 -2.499 -1.766 -58.416 1.00 0.00 N ATOM 926 NH2 ARG A 224 -2.825 -2.180 -56.249 1.00 0.00 N ATOM 0 H ARG A 224 -1.679 -8.097 -59.378 1.00 0.00 H new ATOM 0 HA ARG A 224 0.901 -8.143 -60.520 1.00 0.00 H new ATOM 0 HB2 ARG A 224 0.898 -5.766 -59.978 1.00 0.00 H new ATOM 0 HB3 ARG A 224 -0.686 -6.225 -60.571 1.00 0.00 H new ATOM 0 HG2 ARG A 224 -1.492 -6.354 -58.170 1.00 0.00 H new ATOM 0 HG3 ARG A 224 0.073 -5.762 -57.649 1.00 0.00 H new ATOM 0 HD2 ARG A 224 -0.262 -3.689 -59.025 1.00 0.00 H new ATOM 0 HD3 ARG A 224 -1.835 -4.280 -59.523 1.00 0.00 H new ATOM 0 HE ARG A 224 -1.634 -4.284 -56.638 1.00 0.00 H new ATOM 0 HH11 ARG A 224 -2.135 -2.026 -59.333 1.00 0.00 H new ATOM 0 HH12 ARG A 224 -2.990 -0.880 -58.294 1.00 0.00 H new ATOM 0 HH21 ARG A 224 -2.724 -2.772 -55.424 1.00 0.00 H new ATOM 0 HH22 ARG A 224 -3.308 -1.284 -56.178 1.00 0.00 H new ATOM 940 N LEU A 225 2.694 -8.001 -58.804 1.00 0.00 N ATOM 941 CA LEU A 225 3.828 -8.160 -57.870 1.00 0.00 C ATOM 942 C LEU A 225 4.697 -6.888 -57.745 1.00 0.00 C ATOM 943 O LEU A 225 5.437 -6.762 -56.769 1.00 0.00 O ATOM 944 CB LEU A 225 4.695 -9.368 -58.304 1.00 0.00 C ATOM 945 CG LEU A 225 4.390 -10.691 -57.574 1.00 0.00 C ATOM 946 CD1 LEU A 225 3.004 -11.254 -57.884 1.00 0.00 C ATOM 947 CD2 LEU A 225 5.421 -11.747 -57.979 1.00 0.00 C ATOM 0 H LEU A 225 2.998 -7.833 -59.763 1.00 0.00 H new ATOM 0 HA LEU A 225 3.406 -8.339 -56.881 1.00 0.00 H new ATOM 0 HB2 LEU A 225 4.563 -9.524 -59.375 1.00 0.00 H new ATOM 0 HB3 LEU A 225 5.744 -9.118 -58.145 1.00 0.00 H new ATOM 0 HG LEU A 225 4.430 -10.464 -56.509 1.00 0.00 H new ATOM 0 HD11 LEU A 225 2.859 -12.185 -57.336 1.00 0.00 H new ATOM 0 HD12 LEU A 225 2.243 -10.534 -57.584 1.00 0.00 H new ATOM 0 HD13 LEU A 225 2.920 -11.446 -58.954 1.00 0.00 H new ATOM 0 HD21 LEU A 225 5.206 -12.683 -57.463 1.00 0.00 H new ATOM 0 HD22 LEU A 225 5.374 -11.907 -59.056 1.00 0.00 H new ATOM 0 HD23 LEU A 225 6.419 -11.404 -57.707 1.00 0.00 H new ATOM 959 N ALA A 226 4.598 -5.956 -58.704 1.00 0.00 N ATOM 960 CA ALA A 226 5.296 -4.662 -58.839 1.00 0.00 C ATOM 961 C ALA A 226 6.849 -4.661 -58.870 1.00 0.00 C ATOM 962 O ALA A 226 7.439 -3.796 -59.522 1.00 0.00 O ATOM 963 CB ALA A 226 4.738 -3.685 -57.794 1.00 0.00 C ATOM 0 H ALA A 226 3.961 -6.102 -59.487 1.00 0.00 H new ATOM 0 HA ALA A 226 5.075 -4.338 -59.856 1.00 0.00 H new ATOM 0 HB1 ALA A 226 5.247 -2.725 -57.885 1.00 0.00 H new ATOM 0 HB2 ALA A 226 3.670 -3.546 -57.960 1.00 0.00 H new ATOM 0 HB3 ALA A 226 4.901 -4.089 -56.795 1.00 0.00 H new ATOM 969 N ASP A 227 7.524 -5.599 -58.201 1.00 0.00 N ATOM 970 CA ASP A 227 8.989 -5.720 -58.137 1.00 0.00 C ATOM 971 C ASP A 227 9.417 -7.180 -57.918 1.00 0.00 C ATOM 972 O ASP A 227 10.409 -7.645 -58.497 1.00 0.00 O ATOM 973 CB ASP A 227 9.520 -4.826 -57.004 1.00 0.00 C ATOM 974 CG ASP A 227 11.052 -4.843 -56.923 1.00 0.00 C ATOM 975 OD1 ASP A 227 11.694 -4.207 -57.794 1.00 0.00 O ATOM 976 OD2 ASP A 227 11.584 -5.491 -55.990 1.00 0.00 O ATOM 0 H ASP A 227 7.049 -6.326 -57.666 1.00 0.00 H new ATOM 0 HA ASP A 227 9.412 -5.394 -59.087 1.00 0.00 H new ATOM 0 HB2 ASP A 227 9.177 -3.803 -57.160 1.00 0.00 H new ATOM 0 HB3 ASP A 227 9.104 -5.161 -56.054 1.00 0.00 H new TER 981 ASP A 227 HETATM 982 ZN ZN A 301 -11.035 -11.456 -41.774 1.00 0.00 ZN