USER MOD reduce.3.24.130724 H: found=0, std=0, add=490, rem=0, adj=10 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 Set 1.1: A 211 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.021) USER MOD Set 1.2: A 212 GLN : amide:sc= -0.153 K(o=-0.15,f=-1.6) USER MOD Single : A 168 SER OG : rot -30:sc= 0.0683 USER MOD Single : A 169 THR OG1 : rot 91:sc= 0.0117 USER MOD Single : A 170 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 175 HIS : no HD1:sc= -2.09! C(o=-2.1!,f=-1.8!) USER MOD Single : A 176 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 177 ASN : amide:sc= -0.0117 X(o=-0.012,f=-0.012) 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=-0.0024) USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 195 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 199 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 201 GLN : amide:sc= -0.0722 X(o=-0.072,f=-0.1) USER MOD Single : A 202 GLN : amide:sc= -0.0867 X(o=-0.087,f=-0.097) USER MOD Single : A 204 TYR OH : rot -6:sc= 0.34 USER MOD Single : A 207 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 208 LYS NZ :NH3+ -140:sc= -0.0182 (180deg=-1.13) USER MOD Single : A 214 THR OG1 : rot 81:sc= 0.0425 USER MOD Single : A 215 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 217 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0747) 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 -12.753 -10.644 -14.952 1.00 0.00 N ATOM 2 CA SER A 168 -12.099 -9.946 -13.835 1.00 0.00 C ATOM 3 C SER A 168 -11.112 -10.817 -13.037 1.00 0.00 C ATOM 4 O SER A 168 -10.403 -10.310 -12.164 1.00 0.00 O ATOM 5 CB SER A 168 -13.160 -9.345 -12.902 1.00 0.00 C ATOM 6 OG SER A 168 -14.022 -10.353 -12.389 1.00 0.00 O ATOM 0 HA SER A 168 -11.496 -9.155 -14.282 1.00 0.00 H new ATOM 0 HB2 SER A 168 -12.671 -8.826 -12.077 1.00 0.00 H new ATOM 0 HB3 SER A 168 -13.746 -8.602 -13.443 1.00 0.00 H new ATOM 0 HG SER A 168 -14.096 -11.082 -13.040 1.00 0.00 H new ATOM 12 N THR A 169 -11.031 -12.119 -13.340 1.00 0.00 N ATOM 13 CA THR A 169 -10.156 -13.122 -12.690 1.00 0.00 C ATOM 14 C THR A 169 -8.671 -12.722 -12.649 1.00 0.00 C ATOM 15 O THR A 169 -7.943 -13.122 -11.740 1.00 0.00 O ATOM 16 CB THR A 169 -10.307 -14.492 -13.386 1.00 0.00 C ATOM 17 OG1 THR A 169 -11.674 -14.767 -13.636 1.00 0.00 O ATOM 18 CG2 THR A 169 -9.771 -15.658 -12.553 1.00 0.00 C ATOM 0 H THR A 169 -11.599 -12.529 -14.081 1.00 0.00 H new ATOM 0 HA THR A 169 -10.488 -13.182 -11.654 1.00 0.00 H new ATOM 0 HB THR A 169 -9.727 -14.415 -14.305 1.00 0.00 H new ATOM 0 HG1 THR A 169 -11.918 -14.432 -14.524 1.00 0.00 H new ATOM 0 HG21 THR A 169 -9.908 -16.590 -13.101 1.00 0.00 H new ATOM 0 HG22 THR A 169 -8.710 -15.506 -12.355 1.00 0.00 H new ATOM 0 HG23 THR A 169 -10.312 -15.709 -11.608 1.00 0.00 H new ATOM 26 N LYS A 170 -8.218 -11.898 -13.606 1.00 0.00 N ATOM 27 CA LYS A 170 -6.844 -11.362 -13.697 1.00 0.00 C ATOM 28 C LYS A 170 -6.480 -10.324 -12.614 1.00 0.00 C ATOM 29 O LYS A 170 -5.306 -9.974 -12.494 1.00 0.00 O ATOM 30 CB LYS A 170 -6.608 -10.803 -15.115 1.00 0.00 C ATOM 31 CG LYS A 170 -7.471 -9.570 -15.449 1.00 0.00 C ATOM 32 CD LYS A 170 -7.184 -8.995 -16.845 1.00 0.00 C ATOM 33 CE LYS A 170 -7.557 -9.969 -17.970 1.00 0.00 C ATOM 34 NZ LYS A 170 -7.327 -9.361 -19.298 1.00 0.00 N ATOM 0 H LYS A 170 -8.816 -11.573 -14.366 1.00 0.00 H new ATOM 0 HA LYS A 170 -6.171 -12.198 -13.503 1.00 0.00 H new ATOM 0 HB2 LYS A 170 -5.556 -10.538 -15.221 1.00 0.00 H new ATOM 0 HB3 LYS A 170 -6.814 -11.587 -15.844 1.00 0.00 H new ATOM 0 HG2 LYS A 170 -8.524 -9.843 -15.384 1.00 0.00 H new ATOM 0 HG3 LYS A 170 -7.295 -8.797 -14.701 1.00 0.00 H new ATOM 0 HD2 LYS A 170 -7.740 -8.067 -16.973 1.00 0.00 H new ATOM 0 HD3 LYS A 170 -6.126 -8.745 -16.921 1.00 0.00 H new ATOM 0 HE2 LYS A 170 -6.967 -10.881 -17.877 1.00 0.00 H new ATOM 0 HE3 LYS A 170 -8.604 -10.256 -17.874 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 -7.587 -10.041 -20.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 -7.909 -8.504 -19.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 -6.323 -9.110 -19.395 1.00 0.00 H new ATOM 48 N VAL A 171 -7.462 -9.839 -11.841 1.00 0.00 N ATOM 49 CA VAL A 171 -7.331 -8.825 -10.771 1.00 0.00 C ATOM 50 C VAL A 171 -6.610 -7.555 -11.257 1.00 0.00 C ATOM 51 O VAL A 171 -5.453 -7.288 -10.927 1.00 0.00 O ATOM 52 CB VAL A 171 -6.750 -9.404 -9.459 1.00 0.00 C ATOM 53 CG1 VAL A 171 -6.928 -8.421 -8.291 1.00 0.00 C ATOM 54 CG2 VAL A 171 -7.451 -10.707 -9.043 1.00 0.00 C ATOM 0 H VAL A 171 -8.425 -10.158 -11.947 1.00 0.00 H new ATOM 0 HA VAL A 171 -8.343 -8.511 -10.515 1.00 0.00 H new ATOM 0 HB VAL A 171 -5.695 -9.589 -9.662 1.00 0.00 H new ATOM 0 HG11 VAL A 171 -6.510 -8.856 -7.383 1.00 0.00 H new ATOM 0 HG12 VAL A 171 -6.411 -7.489 -8.518 1.00 0.00 H new ATOM 0 HG13 VAL A 171 -7.989 -8.221 -8.142 1.00 0.00 H new ATOM 0 HG21 VAL A 171 -7.011 -11.077 -8.117 1.00 0.00 H new ATOM 0 HG22 VAL A 171 -8.513 -10.516 -8.889 1.00 0.00 H new ATOM 0 HG23 VAL A 171 -7.327 -11.453 -9.828 1.00 0.00 H new ATOM 64 N GLU A 172 -7.307 -6.773 -12.087 1.00 0.00 N ATOM 65 CA GLU A 172 -6.809 -5.509 -12.658 1.00 0.00 C ATOM 66 C GLU A 172 -6.464 -4.452 -11.582 1.00 0.00 C ATOM 67 O GLU A 172 -6.966 -4.494 -10.453 1.00 0.00 O ATOM 68 CB GLU A 172 -7.845 -4.927 -13.638 1.00 0.00 C ATOM 69 CG GLU A 172 -8.134 -5.853 -14.828 1.00 0.00 C ATOM 70 CD GLU A 172 -9.073 -5.180 -15.838 1.00 0.00 C ATOM 71 OE1 GLU A 172 -10.307 -5.232 -15.619 1.00 0.00 O ATOM 72 OE2 GLU A 172 -8.560 -4.617 -16.835 1.00 0.00 O ATOM 0 H GLU A 172 -8.254 -7.002 -12.390 1.00 0.00 H new ATOM 0 HA GLU A 172 -5.884 -5.748 -13.183 1.00 0.00 H new ATOM 0 HB2 GLU A 172 -8.774 -4.733 -13.102 1.00 0.00 H new ATOM 0 HB3 GLU A 172 -7.485 -3.968 -14.010 1.00 0.00 H new ATOM 0 HG2 GLU A 172 -7.199 -6.121 -15.319 1.00 0.00 H new ATOM 0 HG3 GLU A 172 -8.583 -6.780 -14.471 1.00 0.00 H new ATOM 79 N ALA A 173 -5.615 -3.482 -11.941 1.00 0.00 N ATOM 80 CA ALA A 173 -5.192 -2.386 -11.062 1.00 0.00 C ATOM 81 C ALA A 173 -6.358 -1.478 -10.603 1.00 0.00 C ATOM 82 O ALA A 173 -7.397 -1.377 -11.266 1.00 0.00 O ATOM 83 CB ALA A 173 -4.113 -1.575 -11.793 1.00 0.00 C ATOM 0 H ALA A 173 -5.195 -3.436 -12.869 1.00 0.00 H new ATOM 0 HA ALA A 173 -4.793 -2.820 -10.145 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -3.783 -0.753 -11.158 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -3.265 -2.221 -12.021 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -4.524 -1.175 -12.720 1.00 0.00 H new ATOM 89 N LEU A 174 -6.169 -0.789 -9.471 1.00 0.00 N ATOM 90 CA LEU A 174 -7.147 0.146 -8.896 1.00 0.00 C ATOM 91 C LEU A 174 -7.328 1.400 -9.773 1.00 0.00 C ATOM 92 O LEU A 174 -6.360 1.906 -10.351 1.00 0.00 O ATOM 93 CB LEU A 174 -6.699 0.564 -7.481 1.00 0.00 C ATOM 94 CG LEU A 174 -6.545 -0.580 -6.460 1.00 0.00 C ATOM 95 CD1 LEU A 174 -6.054 -0.007 -5.130 1.00 0.00 C ATOM 96 CD2 LEU A 174 -7.857 -1.325 -6.207 1.00 0.00 C ATOM 0 H LEU A 174 -5.316 -0.867 -8.917 1.00 0.00 H new ATOM 0 HA LEU A 174 -8.107 -0.368 -8.847 1.00 0.00 H new ATOM 0 HB2 LEU A 174 -5.745 1.084 -7.562 1.00 0.00 H new ATOM 0 HB3 LEU A 174 -7.421 1.281 -7.089 1.00 0.00 H new ATOM 0 HG LEU A 174 -5.830 -1.288 -6.879 1.00 0.00 H new ATOM 0 HD11 LEU A 174 -5.944 -0.813 -4.405 1.00 0.00 H new ATOM 0 HD12 LEU A 174 -5.091 0.482 -5.278 1.00 0.00 H new ATOM 0 HD13 LEU A 174 -6.777 0.719 -4.758 1.00 0.00 H new ATOM 0 HD21 LEU A 174 -7.690 -2.120 -5.480 1.00 0.00 H new ATOM 0 HD22 LEU A 174 -8.601 -0.630 -5.819 1.00 0.00 H new ATOM 0 HD23 LEU A 174 -8.216 -1.757 -7.141 1.00 0.00 H new ATOM 108 N HIS A 175 -8.562 1.925 -9.820 1.00 0.00 N ATOM 109 CA HIS A 175 -8.969 3.119 -10.588 1.00 0.00 C ATOM 110 C HIS A 175 -8.585 3.052 -12.089 1.00 0.00 C ATOM 111 O HIS A 175 -8.288 1.977 -12.616 1.00 0.00 O ATOM 112 CB HIS A 175 -8.478 4.376 -9.833 1.00 0.00 C ATOM 113 CG HIS A 175 -9.153 5.661 -10.250 1.00 0.00 C ATOM 114 ND1 HIS A 175 -10.513 5.912 -10.216 1.00 0.00 N ATOM 115 CD2 HIS A 175 -8.538 6.767 -10.770 1.00 0.00 C ATOM 116 CE1 HIS A 175 -10.722 7.148 -10.709 1.00 0.00 C ATOM 117 NE2 HIS A 175 -9.534 7.683 -11.053 1.00 0.00 N ATOM 0 H HIS A 175 -9.339 1.514 -9.303 1.00 0.00 H new ATOM 0 HA HIS A 175 -10.057 3.169 -10.640 1.00 0.00 H new ATOM 0 HB2 HIS A 175 -8.636 4.228 -8.765 1.00 0.00 H new ATOM 0 HB3 HIS A 175 -7.404 4.479 -9.985 1.00 0.00 H new ATOM 0 HD2 HIS A 175 -7.478 6.899 -10.929 1.00 0.00 H new ATOM 0 HE1 HIS A 175 -11.683 7.630 -10.812 1.00 0.00 H new ATOM 0 HE2 HIS A 175 -9.393 8.610 -11.455 1.00 0.00 H new ATOM 126 N GLN A 176 -8.637 4.181 -12.802 1.00 0.00 N ATOM 127 CA GLN A 176 -8.344 4.295 -14.238 1.00 0.00 C ATOM 128 C GLN A 176 -7.520 5.562 -14.519 1.00 0.00 C ATOM 129 O GLN A 176 -7.884 6.659 -14.088 1.00 0.00 O ATOM 130 CB GLN A 176 -9.662 4.304 -15.039 1.00 0.00 C ATOM 131 CG GLN A 176 -10.406 2.959 -14.935 1.00 0.00 C ATOM 132 CD GLN A 176 -11.688 2.869 -15.762 1.00 0.00 C ATOM 133 OE1 GLN A 176 -12.117 3.790 -16.446 1.00 0.00 O ATOM 134 NE2 GLN A 176 -12.366 1.740 -15.715 1.00 0.00 N ATOM 0 H GLN A 176 -8.893 5.074 -12.382 1.00 0.00 H new ATOM 0 HA GLN A 176 -7.752 3.435 -14.552 1.00 0.00 H new ATOM 0 HB2 GLN A 176 -10.305 5.104 -14.672 1.00 0.00 H new ATOM 0 HB3 GLN A 176 -9.449 4.521 -16.086 1.00 0.00 H new ATOM 0 HG2 GLN A 176 -9.732 2.162 -15.248 1.00 0.00 H new ATOM 0 HG3 GLN A 176 -10.652 2.776 -13.889 1.00 0.00 H new ATOM 0 HE21 GLN A 176 -12.023 0.963 -15.151 1.00 0.00 H new ATOM 0 HE22 GLN A 176 -13.233 1.644 -16.243 1.00 0.00 H new ATOM 143 N ASN A 177 -6.408 5.408 -15.248 1.00 0.00 N ATOM 144 CA ASN A 177 -5.479 6.488 -15.618 1.00 0.00 C ATOM 145 C ASN A 177 -4.926 6.271 -17.041 1.00 0.00 C ATOM 146 O ASN A 177 -5.211 7.064 -17.941 1.00 0.00 O ATOM 147 CB ASN A 177 -4.345 6.561 -14.570 1.00 0.00 C ATOM 148 CG ASN A 177 -4.808 7.078 -13.216 1.00 0.00 C ATOM 149 OD1 ASN A 177 -5.117 6.324 -12.302 1.00 0.00 O ATOM 150 ND2 ASN A 177 -4.863 8.379 -13.036 1.00 0.00 N ATOM 0 H ASN A 177 -6.119 4.499 -15.609 1.00 0.00 H new ATOM 0 HA ASN A 177 -6.010 7.440 -15.626 1.00 0.00 H new ATOM 0 HB2 ASN A 177 -3.912 5.569 -14.443 1.00 0.00 H new ATOM 0 HB3 ASN A 177 -3.553 7.208 -14.947 1.00 0.00 H new ATOM 0 HD21 ASN A 177 -5.162 8.757 -12.137 1.00 0.00 H new ATOM 0 HD22 ASN A 177 -4.606 9.010 -13.795 1.00 0.00 H new ATOM 157 N ARG A 178 -4.173 5.180 -17.253 1.00 0.00 N ATOM 158 CA ARG A 178 -3.605 4.745 -18.546 1.00 0.00 C ATOM 159 C ARG A 178 -3.624 3.216 -18.626 1.00 0.00 C ATOM 160 O ARG A 178 -3.092 2.532 -17.752 1.00 0.00 O ATOM 161 CB ARG A 178 -2.166 5.269 -18.755 1.00 0.00 C ATOM 162 CG ARG A 178 -2.085 6.737 -19.208 1.00 0.00 C ATOM 163 CD ARG A 178 -1.875 7.729 -18.055 1.00 0.00 C ATOM 164 NE ARG A 178 -2.029 9.124 -18.511 1.00 0.00 N ATOM 165 CZ ARG A 178 -1.132 9.858 -19.151 1.00 0.00 C ATOM 166 NH1 ARG A 178 0.068 9.423 -19.441 1.00 0.00 N ATOM 167 NH2 ARG A 178 -1.428 11.072 -19.528 1.00 0.00 N ATOM 0 H ARG A 178 -3.930 4.544 -16.493 1.00 0.00 H new ATOM 0 HA ARG A 178 -4.222 5.167 -19.340 1.00 0.00 H new ATOM 0 HB2 ARG A 178 -1.613 5.158 -17.822 1.00 0.00 H new ATOM 0 HB3 ARG A 178 -1.669 4.644 -19.497 1.00 0.00 H new ATOM 0 HG2 ARG A 178 -1.267 6.843 -19.920 1.00 0.00 H new ATOM 0 HG3 ARG A 178 -3.003 6.996 -19.736 1.00 0.00 H new ATOM 0 HD2 ARG A 178 -2.592 7.523 -17.260 1.00 0.00 H new ATOM 0 HD3 ARG A 178 -0.881 7.591 -17.631 1.00 0.00 H new ATOM 0 HE ARG A 178 -2.924 9.571 -18.311 1.00 0.00 H new ATOM 0 HH11 ARG A 178 0.347 8.480 -19.172 1.00 0.00 H new ATOM 0 HH12 ARG A 178 0.724 10.027 -19.936 1.00 0.00 H new ATOM 0 HH21 ARG A 178 -2.352 11.457 -19.330 1.00 0.00 H new ATOM 0 HH22 ARG A 178 -0.736 11.636 -20.021 1.00 0.00 H new ATOM 181 N GLU A 179 -4.256 2.696 -19.673 1.00 0.00 N ATOM 182 CA GLU A 179 -4.449 1.267 -19.970 1.00 0.00 C ATOM 183 C GLU A 179 -4.853 1.074 -21.449 1.00 0.00 C ATOM 184 O GLU A 179 -5.018 2.057 -22.180 1.00 0.00 O ATOM 185 CB GLU A 179 -5.512 0.680 -19.014 1.00 0.00 C ATOM 186 CG GLU A 179 -6.898 1.341 -19.122 1.00 0.00 C ATOM 187 CD GLU A 179 -7.791 0.939 -17.943 1.00 0.00 C ATOM 188 OE1 GLU A 179 -7.682 1.600 -16.882 1.00 0.00 O ATOM 189 OE2 GLU A 179 -8.583 -0.022 -18.096 1.00 0.00 O ATOM 0 H GLU A 179 -4.676 3.292 -20.386 1.00 0.00 H new ATOM 0 HA GLU A 179 -3.512 0.733 -19.813 1.00 0.00 H new ATOM 0 HB2 GLU A 179 -5.615 -0.386 -19.215 1.00 0.00 H new ATOM 0 HB3 GLU A 179 -5.155 0.778 -17.989 1.00 0.00 H new ATOM 0 HG2 GLU A 179 -6.787 2.425 -19.146 1.00 0.00 H new ATOM 0 HG3 GLU A 179 -7.373 1.048 -20.059 1.00 0.00 H new ATOM 196 N MET A 180 -5.023 -0.175 -21.903 1.00 0.00 N ATOM 197 CA MET A 180 -5.453 -0.476 -23.280 1.00 0.00 C ATOM 198 C MET A 180 -6.817 0.164 -23.619 1.00 0.00 C ATOM 199 O MET A 180 -7.682 0.315 -22.751 1.00 0.00 O ATOM 200 CB MET A 180 -5.438 -1.993 -23.541 1.00 0.00 C ATOM 201 CG MET A 180 -6.438 -2.802 -22.703 1.00 0.00 C ATOM 202 SD MET A 180 -6.341 -4.588 -23.008 1.00 0.00 S ATOM 203 CE MET A 180 -7.692 -5.158 -21.941 1.00 0.00 C ATOM 0 H MET A 180 -4.868 -1.004 -21.330 1.00 0.00 H new ATOM 0 HA MET A 180 -4.731 -0.020 -23.957 1.00 0.00 H new ATOM 0 HB2 MET A 180 -5.646 -2.168 -24.597 1.00 0.00 H new ATOM 0 HB3 MET A 180 -4.434 -2.371 -23.347 1.00 0.00 H new ATOM 0 HG2 MET A 180 -6.256 -2.610 -21.646 1.00 0.00 H new ATOM 0 HG3 MET A 180 -7.449 -2.457 -22.921 1.00 0.00 H new ATOM 0 HE1 MET A 180 -7.775 -6.243 -22.007 1.00 0.00 H new ATOM 0 HE2 MET A 180 -7.487 -4.872 -20.910 1.00 0.00 H new ATOM 0 HE3 MET A 180 -8.628 -4.702 -22.264 1.00 0.00 H new ATOM 213 N ILE A 181 -7.011 0.529 -24.889 1.00 0.00 N ATOM 214 CA ILE A 181 -8.216 1.203 -25.408 1.00 0.00 C ATOM 215 C ILE A 181 -8.986 0.305 -26.393 1.00 0.00 C ATOM 216 O ILE A 181 -8.426 -0.625 -26.971 1.00 0.00 O ATOM 217 CB ILE A 181 -7.818 2.598 -25.957 1.00 0.00 C ATOM 218 CG1 ILE A 181 -9.056 3.475 -26.250 1.00 0.00 C ATOM 219 CG2 ILE A 181 -6.861 2.504 -27.163 1.00 0.00 C ATOM 220 CD1 ILE A 181 -8.730 4.958 -26.469 1.00 0.00 C ATOM 0 H ILE A 181 -6.313 0.360 -25.613 1.00 0.00 H new ATOM 0 HA ILE A 181 -8.933 1.379 -24.606 1.00 0.00 H new ATOM 0 HB ILE A 181 -7.259 3.100 -25.167 1.00 0.00 H new ATOM 0 HG12 ILE A 181 -9.561 3.089 -27.136 1.00 0.00 H new ATOM 0 HG13 ILE A 181 -9.757 3.386 -25.420 1.00 0.00 H new ATOM 0 HG21 ILE A 181 -6.613 3.507 -27.510 1.00 0.00 H new ATOM 0 HG22 ILE A 181 -5.949 1.987 -26.864 1.00 0.00 H new ATOM 0 HG23 ILE A 181 -7.344 1.951 -27.969 1.00 0.00 H new ATOM 0 HD11 ILE A 181 -9.650 5.507 -26.669 1.00 0.00 H new ATOM 0 HD12 ILE A 181 -8.254 5.362 -25.576 1.00 0.00 H new ATOM 0 HD13 ILE A 181 -8.054 5.060 -27.318 1.00 0.00 H new ATOM 232 N ASP A 182 -10.288 0.560 -26.554 1.00 0.00 N ATOM 233 CA ASP A 182 -11.241 -0.247 -27.336 1.00 0.00 C ATOM 234 C ASP A 182 -11.943 0.492 -28.507 1.00 0.00 C ATOM 235 O ASP A 182 -13.176 0.567 -28.542 1.00 0.00 O ATOM 236 CB ASP A 182 -12.230 -0.895 -26.339 1.00 0.00 C ATOM 237 CG ASP A 182 -13.209 0.083 -25.661 1.00 0.00 C ATOM 238 OD1 ASP A 182 -12.772 1.186 -25.250 1.00 0.00 O ATOM 239 OD2 ASP A 182 -14.398 -0.289 -25.509 1.00 0.00 O ATOM 0 H ASP A 182 -10.731 1.372 -26.124 1.00 0.00 H new ATOM 0 HA ASP A 182 -10.678 -1.013 -27.869 1.00 0.00 H new ATOM 0 HB2 ASP A 182 -12.807 -1.655 -26.866 1.00 0.00 H new ATOM 0 HB3 ASP A 182 -11.658 -1.407 -25.565 1.00 0.00 H new ATOM 244 N PRO A 183 -11.196 1.047 -29.484 1.00 0.00 N ATOM 245 CA PRO A 183 -11.769 1.720 -30.651 1.00 0.00 C ATOM 246 C PRO A 183 -12.312 0.707 -31.677 1.00 0.00 C ATOM 247 O PRO A 183 -12.003 -0.487 -31.631 1.00 0.00 O ATOM 248 CB PRO A 183 -10.602 2.518 -31.244 1.00 0.00 C ATOM 249 CG PRO A 183 -9.400 1.620 -30.956 1.00 0.00 C ATOM 250 CD PRO A 183 -9.743 1.033 -29.588 1.00 0.00 C ATOM 0 HA PRO A 183 -12.615 2.351 -30.381 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -10.731 2.691 -32.312 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -10.499 3.496 -30.773 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -9.283 0.844 -31.712 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -8.468 2.185 -30.933 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -9.357 0.018 -29.494 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -9.291 1.621 -28.789 1.00 0.00 H new ATOM 258 N ASP A 184 -13.087 1.190 -32.652 1.00 0.00 N ATOM 259 CA ASP A 184 -13.578 0.361 -33.759 1.00 0.00 C ATOM 260 C ASP A 184 -12.416 0.027 -34.722 1.00 0.00 C ATOM 261 O ASP A 184 -11.637 0.912 -35.095 1.00 0.00 O ATOM 262 CB ASP A 184 -14.711 1.098 -34.491 1.00 0.00 C ATOM 263 CG ASP A 184 -15.349 0.231 -35.585 1.00 0.00 C ATOM 264 OD1 ASP A 184 -14.839 0.267 -36.730 1.00 0.00 O ATOM 265 OD2 ASP A 184 -16.350 -0.461 -35.283 1.00 0.00 O ATOM 0 H ASP A 184 -13.391 2.162 -32.697 1.00 0.00 H new ATOM 0 HA ASP A 184 -13.973 -0.577 -33.368 1.00 0.00 H new ATOM 0 HB2 ASP A 184 -15.475 1.394 -33.772 1.00 0.00 H new ATOM 0 HB3 ASP A 184 -14.320 2.013 -34.936 1.00 0.00 H new ATOM 270 N LYS A 185 -12.307 -1.239 -35.139 1.00 0.00 N ATOM 271 CA LYS A 185 -11.285 -1.759 -36.060 1.00 0.00 C ATOM 272 C LYS A 185 -11.941 -2.641 -37.127 1.00 0.00 C ATOM 273 O LYS A 185 -13.067 -3.107 -36.947 1.00 0.00 O ATOM 274 CB LYS A 185 -10.223 -2.535 -35.257 1.00 0.00 C ATOM 275 CG LYS A 185 -9.322 -1.683 -34.347 1.00 0.00 C ATOM 276 CD LYS A 185 -8.395 -0.744 -35.133 1.00 0.00 C ATOM 277 CE LYS A 185 -7.450 -0.014 -34.175 1.00 0.00 C ATOM 278 NZ LYS A 185 -6.529 0.878 -34.911 1.00 0.00 N ATOM 0 H LYS A 185 -12.956 -1.963 -34.831 1.00 0.00 H new ATOM 0 HA LYS A 185 -10.791 -0.933 -36.573 1.00 0.00 H new ATOM 0 HB2 LYS A 185 -10.730 -3.278 -34.642 1.00 0.00 H new ATOM 0 HB3 LYS A 185 -9.590 -3.079 -35.958 1.00 0.00 H new ATOM 0 HG2 LYS A 185 -9.946 -1.092 -33.677 1.00 0.00 H new ATOM 0 HG3 LYS A 185 -8.719 -2.342 -33.722 1.00 0.00 H new ATOM 0 HD2 LYS A 185 -7.818 -1.315 -35.860 1.00 0.00 H new ATOM 0 HD3 LYS A 185 -8.987 -0.021 -35.693 1.00 0.00 H new ATOM 0 HE2 LYS A 185 -8.031 0.568 -33.460 1.00 0.00 H new ATOM 0 HE3 LYS A 185 -6.876 -0.741 -33.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 -5.900 1.360 -34.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 -5.959 0.317 -35.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 -7.079 1.586 -35.438 1.00 0.00 H new ATOM 292 N PHE A 186 -11.245 -2.866 -38.240 1.00 0.00 N ATOM 293 CA PHE A 186 -11.763 -3.617 -39.390 1.00 0.00 C ATOM 294 C PHE A 186 -10.666 -4.374 -40.162 1.00 0.00 C ATOM 295 O PHE A 186 -9.490 -3.997 -40.124 1.00 0.00 O ATOM 296 CB PHE A 186 -12.476 -2.598 -40.305 1.00 0.00 C ATOM 297 CG PHE A 186 -13.088 -3.148 -41.583 1.00 0.00 C ATOM 298 CD1 PHE A 186 -14.187 -4.023 -41.516 1.00 0.00 C ATOM 299 CD2 PHE A 186 -12.571 -2.780 -42.841 1.00 0.00 C ATOM 300 CE1 PHE A 186 -14.736 -4.570 -42.689 1.00 0.00 C ATOM 301 CE2 PHE A 186 -13.150 -3.291 -44.018 1.00 0.00 C ATOM 302 CZ PHE A 186 -14.222 -4.197 -43.943 1.00 0.00 C ATOM 0 H PHE A 186 -10.292 -2.528 -38.374 1.00 0.00 H new ATOM 0 HA PHE A 186 -12.448 -4.389 -39.038 1.00 0.00 H new ATOM 0 HB2 PHE A 186 -13.265 -2.115 -39.729 1.00 0.00 H new ATOM 0 HB3 PHE A 186 -11.760 -1.822 -40.576 1.00 0.00 H new ATOM 0 HD1 PHE A 186 -14.612 -4.277 -40.556 1.00 0.00 H new ATOM 0 HD2 PHE A 186 -11.730 -2.105 -42.902 1.00 0.00 H new ATOM 0 HE1 PHE A 186 -15.551 -5.276 -42.627 1.00 0.00 H new ATOM 0 HE2 PHE A 186 -12.769 -2.986 -44.982 1.00 0.00 H new ATOM 0 HZ PHE A 186 -14.650 -4.606 -44.847 1.00 0.00 H new ATOM 312 N CYS A 187 -11.074 -5.419 -40.886 1.00 0.00 N ATOM 313 CA CYS A 187 -10.258 -6.253 -41.765 1.00 0.00 C ATOM 314 C CYS A 187 -10.969 -6.349 -43.129 1.00 0.00 C ATOM 315 O CYS A 187 -12.049 -6.940 -43.253 1.00 0.00 O ATOM 316 CB CYS A 187 -10.036 -7.627 -41.114 1.00 0.00 C ATOM 317 SG CYS A 187 -8.848 -8.592 -42.099 1.00 0.00 S ATOM 0 H CYS A 187 -12.047 -5.723 -40.871 1.00 0.00 H new ATOM 0 HA CYS A 187 -9.271 -5.818 -41.923 1.00 0.00 H new ATOM 0 HB2 CYS A 187 -9.663 -7.502 -40.098 1.00 0.00 H new ATOM 0 HB3 CYS A 187 -10.983 -8.163 -41.042 1.00 0.00 H new ATOM 322 N SER A 188 -10.391 -5.709 -44.150 1.00 0.00 N ATOM 323 CA SER A 188 -10.955 -5.623 -45.504 1.00 0.00 C ATOM 324 C SER A 188 -10.877 -6.913 -46.329 1.00 0.00 C ATOM 325 O SER A 188 -11.659 -7.070 -47.270 1.00 0.00 O ATOM 326 CB SER A 188 -10.299 -4.469 -46.272 1.00 0.00 C ATOM 327 OG SER A 188 -8.886 -4.603 -46.291 1.00 0.00 O ATOM 0 H SER A 188 -9.498 -5.225 -44.058 1.00 0.00 H new ATOM 0 HA SER A 188 -12.020 -5.441 -45.359 1.00 0.00 H new ATOM 0 HB2 SER A 188 -10.679 -4.446 -47.294 1.00 0.00 H new ATOM 0 HB3 SER A 188 -10.571 -3.520 -45.810 1.00 0.00 H new ATOM 0 HG SER A 188 -8.493 -3.855 -46.788 1.00 0.00 H new ATOM 333 N LEU A 189 -9.984 -7.853 -45.993 1.00 0.00 N ATOM 334 CA LEU A 189 -9.875 -9.139 -46.695 1.00 0.00 C ATOM 335 C LEU A 189 -10.930 -10.127 -46.163 1.00 0.00 C ATOM 336 O LEU A 189 -11.585 -10.816 -46.950 1.00 0.00 O ATOM 337 CB LEU A 189 -8.457 -9.729 -46.557 1.00 0.00 C ATOM 338 CG LEU A 189 -7.378 -9.050 -47.426 1.00 0.00 C ATOM 339 CD1 LEU A 189 -6.918 -7.690 -46.895 1.00 0.00 C ATOM 340 CD2 LEU A 189 -6.143 -9.947 -47.509 1.00 0.00 C ATOM 0 H LEU A 189 -9.318 -7.744 -45.228 1.00 0.00 H new ATOM 0 HA LEU A 189 -10.061 -8.966 -47.755 1.00 0.00 H new ATOM 0 HB2 LEU A 189 -8.154 -9.664 -45.512 1.00 0.00 H new ATOM 0 HB3 LEU A 189 -8.494 -10.788 -46.813 1.00 0.00 H new ATOM 0 HG LEU A 189 -7.843 -8.893 -48.399 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -6.160 -7.277 -47.560 1.00 0.00 H new ATOM 0 HD12 LEU A 189 -7.769 -7.011 -46.849 1.00 0.00 H new ATOM 0 HD13 LEU A 189 -6.497 -7.812 -45.897 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -5.383 -9.464 -48.124 1.00 0.00 H new ATOM 0 HD22 LEU A 189 -5.747 -10.115 -46.507 1.00 0.00 H new ATOM 0 HD23 LEU A 189 -6.417 -10.903 -47.955 1.00 0.00 H new ATOM 352 N CYS A 190 -11.102 -10.176 -44.839 1.00 0.00 N ATOM 353 CA CYS A 190 -12.043 -11.036 -44.122 1.00 0.00 C ATOM 354 C CYS A 190 -13.462 -10.440 -43.996 1.00 0.00 C ATOM 355 O CYS A 190 -14.393 -11.159 -43.619 1.00 0.00 O ATOM 356 CB CYS A 190 -11.464 -11.264 -42.714 1.00 0.00 C ATOM 357 SG CYS A 190 -9.819 -12.041 -42.777 1.00 0.00 S ATOM 0 H CYS A 190 -10.560 -9.586 -44.208 1.00 0.00 H new ATOM 0 HA CYS A 190 -12.156 -11.960 -44.688 1.00 0.00 H new ATOM 0 HB2 CYS A 190 -11.396 -10.310 -42.190 1.00 0.00 H new ATOM 0 HB3 CYS A 190 -12.142 -11.895 -42.140 1.00 0.00 H new ATOM 362 N HIS A 191 -13.631 -9.138 -44.277 1.00 0.00 N ATOM 363 CA HIS A 191 -14.887 -8.382 -44.124 1.00 0.00 C ATOM 364 C HIS A 191 -15.444 -8.526 -42.693 1.00 0.00 C ATOM 365 O HIS A 191 -16.606 -8.888 -42.488 1.00 0.00 O ATOM 366 CB HIS A 191 -15.882 -8.748 -45.244 1.00 0.00 C ATOM 367 CG HIS A 191 -15.316 -8.570 -46.633 1.00 0.00 C ATOM 368 ND1 HIS A 191 -14.571 -9.504 -47.330 1.00 0.00 N ATOM 369 CD2 HIS A 191 -15.421 -7.454 -47.417 1.00 0.00 C ATOM 370 CE1 HIS A 191 -14.220 -8.963 -48.512 1.00 0.00 C ATOM 371 NE2 HIS A 191 -14.734 -7.719 -48.587 1.00 0.00 N ATOM 0 H HIS A 191 -12.868 -8.560 -44.630 1.00 0.00 H new ATOM 0 HA HIS A 191 -14.692 -7.317 -44.247 1.00 0.00 H new ATOM 0 HB2 HIS A 191 -16.194 -9.785 -45.117 1.00 0.00 H new ATOM 0 HB3 HIS A 191 -16.775 -8.131 -45.142 1.00 0.00 H new ATOM 0 HD2 HIS A 191 -15.941 -6.541 -47.169 1.00 0.00 H new ATOM 0 HE1 HIS A 191 -13.625 -9.446 -49.274 1.00 0.00 H new ATOM 0 HE2 HIS A 191 -14.633 -7.080 -49.375 1.00 0.00 H new ATOM 380 N ALA A 192 -14.582 -8.267 -41.704 1.00 0.00 N ATOM 381 CA ALA A 192 -14.848 -8.420 -40.270 1.00 0.00 C ATOM 382 C ALA A 192 -14.538 -7.134 -39.482 1.00 0.00 C ATOM 383 O ALA A 192 -13.575 -6.431 -39.790 1.00 0.00 O ATOM 384 CB ALA A 192 -14.007 -9.602 -39.763 1.00 0.00 C ATOM 0 H ALA A 192 -13.637 -7.930 -41.890 1.00 0.00 H new ATOM 0 HA ALA A 192 -15.909 -8.614 -40.115 1.00 0.00 H new ATOM 0 HB1 ALA A 192 -14.183 -9.743 -38.696 1.00 0.00 H new ATOM 0 HB2 ALA A 192 -14.291 -10.507 -40.300 1.00 0.00 H new ATOM 0 HB3 ALA A 192 -12.950 -9.396 -39.933 1.00 0.00 H new ATOM 390 N THR A 193 -15.350 -6.841 -38.461 1.00 0.00 N ATOM 391 CA THR A 193 -15.270 -5.634 -37.608 1.00 0.00 C ATOM 392 C THR A 193 -15.042 -6.018 -36.141 1.00 0.00 C ATOM 393 O THR A 193 -15.535 -7.054 -35.686 1.00 0.00 O ATOM 394 CB THR A 193 -16.574 -4.817 -37.728 1.00 0.00 C ATOM 395 OG1 THR A 193 -16.929 -4.606 -39.082 1.00 0.00 O ATOM 396 CG2 THR A 193 -16.512 -3.435 -37.075 1.00 0.00 C ATOM 0 H THR A 193 -16.115 -7.459 -38.189 1.00 0.00 H new ATOM 0 HA THR A 193 -14.428 -5.032 -37.948 1.00 0.00 H new ATOM 0 HB THR A 193 -17.311 -5.425 -37.203 1.00 0.00 H new ATOM 0 HG1 THR A 193 -17.759 -4.087 -39.125 1.00 0.00 H new ATOM 0 HG21 THR A 193 -17.468 -2.928 -37.205 1.00 0.00 H new ATOM 0 HG22 THR A 193 -16.301 -3.544 -36.011 1.00 0.00 H new ATOM 0 HG23 THR A 193 -15.723 -2.847 -37.543 1.00 0.00 H new ATOM 404 N PHE A 194 -14.313 -5.185 -35.389 1.00 0.00 N ATOM 405 CA PHE A 194 -13.952 -5.420 -33.983 1.00 0.00 C ATOM 406 C PHE A 194 -14.126 -4.138 -33.155 1.00 0.00 C ATOM 407 O PHE A 194 -13.999 -3.034 -33.687 1.00 0.00 O ATOM 408 CB PHE A 194 -12.497 -5.938 -33.900 1.00 0.00 C ATOM 409 CG PHE A 194 -12.051 -6.766 -35.097 1.00 0.00 C ATOM 410 CD1 PHE A 194 -12.513 -8.085 -35.259 1.00 0.00 C ATOM 411 CD2 PHE A 194 -11.285 -6.167 -36.117 1.00 0.00 C ATOM 412 CE1 PHE A 194 -12.253 -8.780 -36.452 1.00 0.00 C ATOM 413 CE2 PHE A 194 -11.020 -6.864 -37.307 1.00 0.00 C ATOM 414 CZ PHE A 194 -11.518 -8.164 -37.479 1.00 0.00 C ATOM 0 H PHE A 194 -13.947 -4.304 -35.750 1.00 0.00 H new ATOM 0 HA PHE A 194 -14.619 -6.175 -33.567 1.00 0.00 H new ATOM 0 HB2 PHE A 194 -11.827 -5.085 -33.795 1.00 0.00 H new ATOM 0 HB3 PHE A 194 -12.390 -6.540 -32.998 1.00 0.00 H new ATOM 0 HD1 PHE A 194 -13.068 -8.564 -34.466 1.00 0.00 H new ATOM 0 HD2 PHE A 194 -10.900 -5.167 -35.983 1.00 0.00 H new ATOM 0 HE1 PHE A 194 -12.618 -9.788 -36.580 1.00 0.00 H new ATOM 0 HE2 PHE A 194 -10.435 -6.401 -38.087 1.00 0.00 H new ATOM 0 HZ PHE A 194 -11.336 -8.693 -38.403 1.00 0.00 H new ATOM 424 N ASN A 195 -14.411 -4.274 -31.857 1.00 0.00 N ATOM 425 CA ASN A 195 -14.635 -3.151 -30.929 1.00 0.00 C ATOM 426 C ASN A 195 -13.978 -3.375 -29.547 1.00 0.00 C ATOM 427 O ASN A 195 -14.418 -2.834 -28.534 1.00 0.00 O ATOM 428 CB ASN A 195 -16.151 -2.857 -30.867 1.00 0.00 C ATOM 429 CG ASN A 195 -16.590 -1.978 -32.026 1.00 0.00 C ATOM 430 OD1 ASN A 195 -16.364 -0.777 -32.033 1.00 0.00 O ATOM 431 ND2 ASN A 195 -17.238 -2.525 -33.030 1.00 0.00 N ATOM 0 H ASN A 195 -14.495 -5.186 -31.408 1.00 0.00 H new ATOM 0 HA ASN A 195 -14.133 -2.261 -31.307 1.00 0.00 H new ATOM 0 HB2 ASN A 195 -16.707 -3.794 -30.888 1.00 0.00 H new ATOM 0 HB3 ASN A 195 -16.390 -2.366 -29.924 1.00 0.00 H new ATOM 0 HD21 ASN A 195 -17.550 -1.948 -33.811 1.00 0.00 H new ATOM 0 HD22 ASN A 195 -17.429 -3.527 -33.028 1.00 0.00 H new ATOM 438 N ASP A 196 -12.901 -4.164 -29.502 1.00 0.00 N ATOM 439 CA ASP A 196 -12.091 -4.453 -28.311 1.00 0.00 C ATOM 440 C ASP A 196 -10.625 -4.694 -28.729 1.00 0.00 C ATOM 441 O ASP A 196 -10.389 -5.210 -29.829 1.00 0.00 O ATOM 442 CB ASP A 196 -12.652 -5.674 -27.561 1.00 0.00 C ATOM 443 CG ASP A 196 -13.868 -5.323 -26.697 1.00 0.00 C ATOM 444 OD1 ASP A 196 -13.666 -4.637 -25.667 1.00 0.00 O ATOM 445 OD2 ASP A 196 -14.989 -5.766 -27.045 1.00 0.00 O ATOM 0 H ASP A 196 -12.552 -4.642 -30.333 1.00 0.00 H new ATOM 0 HA ASP A 196 -12.130 -3.598 -27.636 1.00 0.00 H new ATOM 0 HB2 ASP A 196 -12.932 -6.442 -28.282 1.00 0.00 H new ATOM 0 HB3 ASP A 196 -11.872 -6.099 -26.929 1.00 0.00 H new ATOM 450 N PRO A 197 -9.631 -4.348 -27.884 1.00 0.00 N ATOM 451 CA PRO A 197 -8.212 -4.490 -28.224 1.00 0.00 C ATOM 452 C PRO A 197 -7.817 -5.940 -28.498 1.00 0.00 C ATOM 453 O PRO A 197 -7.196 -6.254 -29.514 1.00 0.00 O ATOM 454 CB PRO A 197 -7.426 -3.942 -27.021 1.00 0.00 C ATOM 455 CG PRO A 197 -8.435 -3.876 -25.874 1.00 0.00 C ATOM 456 CD PRO A 197 -9.789 -3.760 -26.561 1.00 0.00 C ATOM 0 HA PRO A 197 -7.994 -3.944 -29.142 1.00 0.00 H new ATOM 0 HB2 PRO A 197 -6.588 -4.592 -26.770 1.00 0.00 H new ATOM 0 HB3 PRO A 197 -7.012 -2.957 -27.238 1.00 0.00 H new ATOM 0 HG2 PRO A 197 -8.383 -4.767 -25.248 1.00 0.00 H new ATOM 0 HG3 PRO A 197 -8.244 -3.020 -25.227 1.00 0.00 H new ATOM 0 HD2 PRO A 197 -10.559 -4.283 -25.993 1.00 0.00 H new ATOM 0 HD3 PRO A 197 -10.099 -2.718 -26.634 1.00 0.00 H new ATOM 464 N VAL A 198 -8.193 -6.831 -27.581 1.00 0.00 N ATOM 465 CA VAL A 198 -7.885 -8.262 -27.657 1.00 0.00 C ATOM 466 C VAL A 198 -8.635 -8.913 -28.819 1.00 0.00 C ATOM 467 O VAL A 198 -8.044 -9.709 -29.538 1.00 0.00 O ATOM 468 CB VAL A 198 -8.163 -8.932 -26.298 1.00 0.00 C ATOM 469 CG1 VAL A 198 -7.864 -10.435 -26.315 1.00 0.00 C ATOM 470 CG2 VAL A 198 -7.282 -8.284 -25.214 1.00 0.00 C ATOM 0 H VAL A 198 -8.728 -6.577 -26.751 1.00 0.00 H new ATOM 0 HA VAL A 198 -6.824 -8.401 -27.866 1.00 0.00 H new ATOM 0 HB VAL A 198 -9.223 -8.792 -26.086 1.00 0.00 H new ATOM 0 HG11 VAL A 198 -8.076 -10.859 -25.334 1.00 0.00 H new ATOM 0 HG12 VAL A 198 -8.489 -10.922 -27.064 1.00 0.00 H new ATOM 0 HG13 VAL A 198 -6.814 -10.594 -26.560 1.00 0.00 H new ATOM 0 HG21 VAL A 198 -7.479 -8.759 -24.253 1.00 0.00 H new ATOM 0 HG22 VAL A 198 -6.231 -8.414 -25.474 1.00 0.00 H new ATOM 0 HG23 VAL A 198 -7.511 -7.220 -25.147 1.00 0.00 H new ATOM 480 N MET A 199 -9.894 -8.536 -29.073 1.00 0.00 N ATOM 481 CA MET A 199 -10.678 -9.038 -30.215 1.00 0.00 C ATOM 482 C MET A 199 -9.998 -8.697 -31.551 1.00 0.00 C ATOM 483 O MET A 199 -9.831 -9.575 -32.400 1.00 0.00 O ATOM 484 CB MET A 199 -12.088 -8.430 -30.144 1.00 0.00 C ATOM 485 CG MET A 199 -13.059 -8.953 -31.206 1.00 0.00 C ATOM 486 SD MET A 199 -14.631 -8.042 -31.210 1.00 0.00 S ATOM 487 CE MET A 199 -15.553 -8.992 -32.450 1.00 0.00 C ATOM 0 H MET A 199 -10.403 -7.871 -28.491 1.00 0.00 H new ATOM 0 HA MET A 199 -10.743 -10.125 -30.161 1.00 0.00 H new ATOM 0 HB2 MET A 199 -12.507 -8.629 -29.157 1.00 0.00 H new ATOM 0 HB3 MET A 199 -12.009 -7.347 -30.244 1.00 0.00 H new ATOM 0 HG2 MET A 199 -12.595 -8.876 -32.189 1.00 0.00 H new ATOM 0 HG3 MET A 199 -13.255 -10.010 -31.027 1.00 0.00 H new ATOM 0 HE1 MET A 199 -16.547 -8.561 -32.573 1.00 0.00 H new ATOM 0 HE2 MET A 199 -15.023 -8.959 -33.402 1.00 0.00 H new ATOM 0 HE3 MET A 199 -15.645 -10.027 -32.121 1.00 0.00 H new ATOM 497 N ALA A 200 -9.564 -7.442 -31.718 1.00 0.00 N ATOM 498 CA ALA A 200 -8.844 -6.991 -32.907 1.00 0.00 C ATOM 499 C ALA A 200 -7.528 -7.763 -33.087 1.00 0.00 C ATOM 500 O ALA A 200 -7.294 -8.375 -34.133 1.00 0.00 O ATOM 501 CB ALA A 200 -8.568 -5.487 -32.773 1.00 0.00 C ATOM 0 H ALA A 200 -9.706 -6.708 -31.024 1.00 0.00 H new ATOM 0 HA ALA A 200 -9.456 -7.181 -33.789 1.00 0.00 H new ATOM 0 HB1 ALA A 200 -8.031 -5.136 -33.654 1.00 0.00 H new ATOM 0 HB2 ALA A 200 -9.513 -4.950 -32.686 1.00 0.00 H new ATOM 0 HB3 ALA A 200 -7.964 -5.306 -31.884 1.00 0.00 H new ATOM 507 N GLN A 201 -6.675 -7.761 -32.055 1.00 0.00 N ATOM 508 CA GLN A 201 -5.376 -8.431 -32.099 1.00 0.00 C ATOM 509 C GLN A 201 -5.491 -9.945 -32.343 1.00 0.00 C ATOM 510 O GLN A 201 -4.730 -10.487 -33.145 1.00 0.00 O ATOM 511 CB GLN A 201 -4.580 -8.142 -30.815 1.00 0.00 C ATOM 512 CG GLN A 201 -4.091 -6.686 -30.713 1.00 0.00 C ATOM 513 CD GLN A 201 -3.041 -6.342 -31.769 1.00 0.00 C ATOM 514 OE1 GLN A 201 -3.337 -5.825 -32.838 1.00 0.00 O ATOM 515 NE2 GLN A 201 -1.777 -6.618 -31.522 1.00 0.00 N ATOM 0 H GLN A 201 -6.869 -7.295 -31.169 1.00 0.00 H new ATOM 0 HA GLN A 201 -4.837 -8.022 -32.953 1.00 0.00 H new ATOM 0 HB2 GLN A 201 -5.204 -8.369 -29.951 1.00 0.00 H new ATOM 0 HB3 GLN A 201 -3.720 -8.810 -30.772 1.00 0.00 H new ATOM 0 HG2 GLN A 201 -4.942 -6.013 -30.819 1.00 0.00 H new ATOM 0 HG3 GLN A 201 -3.672 -6.516 -29.721 1.00 0.00 H new ATOM 0 HE21 GLN A 201 -1.513 -7.049 -30.636 1.00 0.00 H new ATOM 0 HE22 GLN A 201 -1.062 -6.401 -32.217 1.00 0.00 H new ATOM 524 N GLN A 202 -6.450 -10.626 -31.700 1.00 0.00 N ATOM 525 CA GLN A 202 -6.695 -12.061 -31.883 1.00 0.00 C ATOM 526 C GLN A 202 -7.126 -12.377 -33.319 1.00 0.00 C ATOM 527 O GLN A 202 -6.649 -13.361 -33.886 1.00 0.00 O ATOM 528 CB GLN A 202 -7.750 -12.570 -30.882 1.00 0.00 C ATOM 529 CG GLN A 202 -7.192 -12.744 -29.458 1.00 0.00 C ATOM 530 CD GLN A 202 -6.221 -13.918 -29.344 1.00 0.00 C ATOM 531 OE1 GLN A 202 -5.008 -13.771 -29.418 1.00 0.00 O ATOM 532 NE2 GLN A 202 -6.707 -15.130 -29.164 1.00 0.00 N ATOM 0 H GLN A 202 -7.084 -10.189 -31.031 1.00 0.00 H new ATOM 0 HA GLN A 202 -5.756 -12.580 -31.692 1.00 0.00 H new ATOM 0 HB2 GLN A 202 -8.586 -11.871 -30.856 1.00 0.00 H new ATOM 0 HB3 GLN A 202 -8.144 -13.524 -31.231 1.00 0.00 H new ATOM 0 HG2 GLN A 202 -6.684 -11.828 -29.157 1.00 0.00 H new ATOM 0 HG3 GLN A 202 -8.019 -12.893 -28.764 1.00 0.00 H new ATOM 0 HE21 GLN A 202 -7.715 -15.271 -29.100 1.00 0.00 H new ATOM 0 HE22 GLN A 202 -6.075 -15.927 -29.089 1.00 0.00 H new ATOM 541 N HIS A 203 -7.975 -11.543 -33.936 1.00 0.00 N ATOM 542 CA HIS A 203 -8.370 -11.747 -35.332 1.00 0.00 C ATOM 543 C HIS A 203 -7.142 -11.701 -36.255 1.00 0.00 C ATOM 544 O HIS A 203 -6.912 -12.644 -37.010 1.00 0.00 O ATOM 545 CB HIS A 203 -9.430 -10.727 -35.777 1.00 0.00 C ATOM 546 CG HIS A 203 -9.789 -10.920 -37.233 1.00 0.00 C ATOM 547 ND1 HIS A 203 -10.667 -11.853 -37.743 1.00 0.00 N ATOM 548 CD2 HIS A 203 -9.150 -10.345 -38.303 1.00 0.00 C ATOM 549 CE1 HIS A 203 -10.527 -11.867 -39.082 1.00 0.00 C ATOM 550 NE2 HIS A 203 -9.602 -10.972 -39.468 1.00 0.00 N ATOM 0 H HIS A 203 -8.397 -10.727 -33.492 1.00 0.00 H new ATOM 0 HA HIS A 203 -8.820 -12.737 -35.407 1.00 0.00 H new ATOM 0 HB2 HIS A 203 -10.323 -10.833 -35.161 1.00 0.00 H new ATOM 0 HB3 HIS A 203 -9.054 -9.716 -35.622 1.00 0.00 H new ATOM 0 HD1 HIS A 203 -11.310 -12.431 -37.201 1.00 0.00 H new ATOM 0 HD2 HIS A 203 -8.424 -9.547 -38.254 1.00 0.00 H new ATOM 0 HE1 HIS A 203 -11.081 -12.508 -39.752 1.00 0.00 H new ATOM 558 N TYR A 204 -6.327 -10.641 -36.168 1.00 0.00 N ATOM 559 CA TYR A 204 -5.132 -10.439 -37.001 1.00 0.00 C ATOM 560 C TYR A 204 -4.044 -11.537 -36.921 1.00 0.00 C ATOM 561 O TYR A 204 -3.113 -11.515 -37.730 1.00 0.00 O ATOM 562 CB TYR A 204 -4.533 -9.049 -36.713 1.00 0.00 C ATOM 563 CG TYR A 204 -5.450 -7.856 -36.958 1.00 0.00 C ATOM 564 CD1 TYR A 204 -6.260 -7.792 -38.112 1.00 0.00 C ATOM 565 CD2 TYR A 204 -5.463 -6.781 -36.044 1.00 0.00 C ATOM 566 CE1 TYR A 204 -7.102 -6.686 -38.333 1.00 0.00 C ATOM 567 CE2 TYR A 204 -6.300 -5.669 -36.264 1.00 0.00 C ATOM 568 CZ TYR A 204 -7.124 -5.617 -37.410 1.00 0.00 C ATOM 569 OH TYR A 204 -7.910 -4.527 -37.626 1.00 0.00 O ATOM 0 H TYR A 204 -6.483 -9.884 -35.503 1.00 0.00 H new ATOM 0 HA TYR A 204 -5.488 -10.510 -38.029 1.00 0.00 H new ATOM 0 HB2 TYR A 204 -4.210 -9.024 -35.672 1.00 0.00 H new ATOM 0 HB3 TYR A 204 -3.641 -8.927 -37.327 1.00 0.00 H new ATOM 0 HD1 TYR A 204 -6.234 -8.598 -38.831 1.00 0.00 H new ATOM 0 HD2 TYR A 204 -4.828 -6.811 -35.171 1.00 0.00 H new ATOM 0 HE1 TYR A 204 -7.732 -6.655 -39.210 1.00 0.00 H new ATOM 0 HE2 TYR A 204 -6.311 -4.855 -35.555 1.00 0.00 H new ATOM 0 HH TYR A 204 -8.329 -4.596 -38.509 1.00 0.00 H new ATOM 579 N VAL A 205 -4.141 -12.502 -35.993 1.00 0.00 N ATOM 580 CA VAL A 205 -3.179 -13.618 -35.842 1.00 0.00 C ATOM 581 C VAL A 205 -3.824 -15.013 -35.831 1.00 0.00 C ATOM 582 O VAL A 205 -3.102 -16.012 -35.860 1.00 0.00 O ATOM 583 CB VAL A 205 -2.273 -13.440 -34.602 1.00 0.00 C ATOM 584 CG1 VAL A 205 -1.539 -12.093 -34.613 1.00 0.00 C ATOM 585 CG2 VAL A 205 -3.030 -13.587 -33.276 1.00 0.00 C ATOM 0 H VAL A 205 -4.900 -12.534 -35.313 1.00 0.00 H new ATOM 0 HA VAL A 205 -2.565 -13.568 -36.741 1.00 0.00 H new ATOM 0 HB VAL A 205 -1.545 -14.248 -34.669 1.00 0.00 H new ATOM 0 HG11 VAL A 205 -0.915 -12.012 -33.723 1.00 0.00 H new ATOM 0 HG12 VAL A 205 -0.913 -12.027 -35.503 1.00 0.00 H new ATOM 0 HG13 VAL A 205 -2.267 -11.282 -34.621 1.00 0.00 H new ATOM 0 HG21 VAL A 205 -2.338 -13.451 -32.445 1.00 0.00 H new ATOM 0 HG22 VAL A 205 -3.816 -12.834 -33.220 1.00 0.00 H new ATOM 0 HG23 VAL A 205 -3.475 -14.581 -33.219 1.00 0.00 H new ATOM 595 N GLY A 206 -5.157 -15.114 -35.802 1.00 0.00 N ATOM 596 CA GLY A 206 -5.883 -16.389 -35.765 1.00 0.00 C ATOM 597 C GLY A 206 -5.941 -17.125 -37.110 1.00 0.00 C ATOM 598 O GLY A 206 -5.829 -16.519 -38.179 1.00 0.00 O ATOM 0 H GLY A 206 -5.772 -14.300 -35.804 1.00 0.00 H new ATOM 0 HA2 GLY A 206 -5.412 -17.040 -35.029 1.00 0.00 H new ATOM 0 HA3 GLY A 206 -6.901 -16.204 -35.422 1.00 0.00 H new ATOM 602 N LYS A 207 -6.144 -18.450 -37.059 1.00 0.00 N ATOM 603 CA LYS A 207 -6.223 -19.350 -38.232 1.00 0.00 C ATOM 604 C LYS A 207 -7.212 -18.892 -39.315 1.00 0.00 C ATOM 605 O LYS A 207 -6.925 -19.025 -40.506 1.00 0.00 O ATOM 606 CB LYS A 207 -6.480 -20.800 -37.771 1.00 0.00 C ATOM 607 CG LYS A 207 -7.851 -21.031 -37.104 1.00 0.00 C ATOM 608 CD LYS A 207 -8.034 -22.465 -36.585 1.00 0.00 C ATOM 609 CE LYS A 207 -7.107 -22.781 -35.404 1.00 0.00 C ATOM 610 NZ LYS A 207 -7.356 -24.140 -34.879 1.00 0.00 N ATOM 0 H LYS A 207 -6.262 -18.946 -36.175 1.00 0.00 H new ATOM 0 HA LYS A 207 -5.253 -19.307 -38.727 1.00 0.00 H new ATOM 0 HB2 LYS A 207 -6.395 -21.461 -38.633 1.00 0.00 H new ATOM 0 HB3 LYS A 207 -5.697 -21.088 -37.070 1.00 0.00 H new ATOM 0 HG2 LYS A 207 -7.967 -20.333 -36.275 1.00 0.00 H new ATOM 0 HG3 LYS A 207 -8.640 -20.807 -37.822 1.00 0.00 H new ATOM 0 HD2 LYS A 207 -9.070 -22.608 -36.279 1.00 0.00 H new ATOM 0 HD3 LYS A 207 -7.840 -23.169 -37.394 1.00 0.00 H new ATOM 0 HE2 LYS A 207 -6.068 -22.695 -35.721 1.00 0.00 H new ATOM 0 HE3 LYS A 207 -7.260 -22.048 -34.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 207 -6.715 -24.327 -34.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 207 -8.342 -24.212 -34.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 207 -7.186 -24.839 -35.630 1.00 0.00 H new ATOM 624 N LYS A 208 -8.347 -18.309 -38.909 1.00 0.00 N ATOM 625 CA LYS A 208 -9.389 -17.783 -39.810 1.00 0.00 C ATOM 626 C LYS A 208 -8.868 -16.652 -40.703 1.00 0.00 C ATOM 627 O LYS A 208 -9.157 -16.648 -41.898 1.00 0.00 O ATOM 628 CB LYS A 208 -10.612 -17.317 -38.999 1.00 0.00 C ATOM 629 CG LYS A 208 -11.330 -18.488 -38.305 1.00 0.00 C ATOM 630 CD LYS A 208 -12.501 -18.073 -37.397 1.00 0.00 C ATOM 631 CE LYS A 208 -13.719 -17.499 -38.137 1.00 0.00 C ATOM 632 NZ LYS A 208 -13.571 -16.059 -38.441 1.00 0.00 N ATOM 0 H LYS A 208 -8.575 -18.185 -37.922 1.00 0.00 H new ATOM 0 HA LYS A 208 -9.689 -18.597 -40.470 1.00 0.00 H new ATOM 0 HB2 LYS A 208 -10.294 -16.592 -38.249 1.00 0.00 H new ATOM 0 HB3 LYS A 208 -11.311 -16.805 -39.661 1.00 0.00 H new ATOM 0 HG2 LYS A 208 -11.703 -19.172 -39.068 1.00 0.00 H new ATOM 0 HG3 LYS A 208 -10.604 -19.041 -37.709 1.00 0.00 H new ATOM 0 HD2 LYS A 208 -12.820 -18.941 -36.820 1.00 0.00 H new ATOM 0 HD3 LYS A 208 -12.144 -17.330 -36.684 1.00 0.00 H new ATOM 0 HE2 LYS A 208 -13.868 -18.050 -39.066 1.00 0.00 H new ATOM 0 HE3 LYS A 208 -14.612 -17.649 -37.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 208 -14.480 -15.577 -38.288 1.00 0.00 H new ATOM 0 HZ2 LYS A 208 -12.850 -15.645 -37.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 208 -13.280 -15.942 -39.432 1.00 0.00 H new ATOM 646 N HIS A 209 -8.053 -15.742 -40.159 1.00 0.00 N ATOM 647 CA HIS A 209 -7.447 -14.649 -40.929 1.00 0.00 C ATOM 648 C HIS A 209 -6.433 -15.195 -41.932 1.00 0.00 C ATOM 649 O HIS A 209 -6.406 -14.755 -43.077 1.00 0.00 O ATOM 650 CB HIS A 209 -6.811 -13.632 -39.976 1.00 0.00 C ATOM 651 CG HIS A 209 -6.128 -12.467 -40.661 1.00 0.00 C ATOM 652 ND1 HIS A 209 -6.766 -11.341 -41.198 1.00 0.00 N ATOM 653 CD2 HIS A 209 -4.779 -12.328 -40.827 1.00 0.00 C ATOM 654 CE1 HIS A 209 -5.788 -10.559 -41.681 1.00 0.00 C ATOM 655 NE2 HIS A 209 -4.584 -11.126 -41.473 1.00 0.00 N ATOM 0 H HIS A 209 -7.794 -15.742 -39.172 1.00 0.00 H new ATOM 0 HA HIS A 209 -8.223 -14.139 -41.499 1.00 0.00 H new ATOM 0 HB2 HIS A 209 -7.583 -13.244 -39.312 1.00 0.00 H new ATOM 0 HB3 HIS A 209 -6.082 -14.147 -39.350 1.00 0.00 H new ATOM 0 HD2 HIS A 209 -4.015 -13.024 -40.513 1.00 0.00 H new ATOM 0 HE1 HIS A 209 -5.944 -9.608 -42.168 1.00 0.00 H new ATOM 0 HE2 HIS A 209 -3.683 -10.734 -41.746 1.00 0.00 H new ATOM 663 N ARG A 210 -5.632 -16.201 -41.541 1.00 0.00 N ATOM 664 CA ARG A 210 -4.650 -16.833 -42.443 1.00 0.00 C ATOM 665 C ARG A 210 -5.360 -17.472 -43.645 1.00 0.00 C ATOM 666 O ARG A 210 -4.995 -17.216 -44.793 1.00 0.00 O ATOM 667 CB ARG A 210 -3.768 -17.869 -41.715 1.00 0.00 C ATOM 668 CG ARG A 210 -3.258 -17.513 -40.306 1.00 0.00 C ATOM 669 CD ARG A 210 -2.785 -16.069 -40.103 1.00 0.00 C ATOM 670 NE ARG A 210 -2.158 -15.920 -38.777 1.00 0.00 N ATOM 671 CZ ARG A 210 -0.907 -15.587 -38.503 1.00 0.00 C ATOM 672 NH1 ARG A 210 -0.028 -15.269 -39.417 1.00 0.00 N ATOM 673 NH2 ARG A 210 -0.510 -15.574 -37.261 1.00 0.00 N ATOM 0 H ARG A 210 -5.645 -16.597 -40.601 1.00 0.00 H new ATOM 0 HA ARG A 210 -3.986 -16.046 -42.801 1.00 0.00 H new ATOM 0 HB2 ARG A 210 -4.333 -18.798 -41.642 1.00 0.00 H new ATOM 0 HB3 ARG A 210 -2.901 -18.072 -42.344 1.00 0.00 H new ATOM 0 HG2 ARG A 210 -4.056 -17.716 -39.591 1.00 0.00 H new ATOM 0 HG3 ARG A 210 -2.433 -18.182 -40.061 1.00 0.00 H new ATOM 0 HD2 ARG A 210 -2.073 -15.799 -40.883 1.00 0.00 H new ATOM 0 HD3 ARG A 210 -3.630 -15.386 -40.193 1.00 0.00 H new ATOM 0 HE ARG A 210 -2.762 -16.095 -37.974 1.00 0.00 H new ATOM 0 HH11 ARG A 210 -0.293 -15.269 -40.402 1.00 0.00 H new ATOM 0 HH12 ARG A 210 0.923 -15.021 -39.145 1.00 0.00 H new ATOM 0 HH21 ARG A 210 -1.161 -15.819 -36.515 1.00 0.00 H new ATOM 0 HH22 ARG A 210 0.452 -15.319 -37.036 1.00 0.00 H new ATOM 687 N LYS A 211 -6.412 -18.258 -43.376 1.00 0.00 N ATOM 688 CA LYS A 211 -7.259 -18.921 -44.382 1.00 0.00 C ATOM 689 C LYS A 211 -7.897 -17.918 -45.348 1.00 0.00 C ATOM 690 O LYS A 211 -7.728 -18.043 -46.562 1.00 0.00 O ATOM 691 CB LYS A 211 -8.315 -19.769 -43.645 1.00 0.00 C ATOM 692 CG LYS A 211 -9.349 -20.413 -44.583 1.00 0.00 C ATOM 693 CD LYS A 211 -10.315 -21.312 -43.797 1.00 0.00 C ATOM 694 CE LYS A 211 -11.437 -21.855 -44.691 1.00 0.00 C ATOM 695 NZ LYS A 211 -12.422 -20.804 -45.034 1.00 0.00 N ATOM 0 H LYS A 211 -6.708 -18.457 -42.420 1.00 0.00 H new ATOM 0 HA LYS A 211 -6.643 -19.571 -45.003 1.00 0.00 H new ATOM 0 HB2 LYS A 211 -7.810 -20.553 -43.081 1.00 0.00 H new ATOM 0 HB3 LYS A 211 -8.834 -19.140 -42.922 1.00 0.00 H new ATOM 0 HG2 LYS A 211 -9.910 -19.635 -45.102 1.00 0.00 H new ATOM 0 HG3 LYS A 211 -8.838 -21.000 -45.346 1.00 0.00 H new ATOM 0 HD2 LYS A 211 -9.763 -22.144 -43.359 1.00 0.00 H new ATOM 0 HD3 LYS A 211 -10.748 -20.747 -42.972 1.00 0.00 H new ATOM 0 HE2 LYS A 211 -11.008 -22.264 -45.606 1.00 0.00 H new ATOM 0 HE3 LYS A 211 -11.943 -22.675 -44.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 211 -13.217 -21.229 -45.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 211 -12.775 -20.361 -44.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 211 -11.967 -20.082 -45.629 1.00 0.00 H new ATOM 709 N GLN A 212 -8.616 -16.923 -44.826 1.00 0.00 N ATOM 710 CA GLN A 212 -9.296 -15.918 -45.648 1.00 0.00 C ATOM 711 C GLN A 212 -8.326 -14.996 -46.403 1.00 0.00 C ATOM 712 O GLN A 212 -8.610 -14.647 -47.548 1.00 0.00 O ATOM 713 CB GLN A 212 -10.292 -15.122 -44.794 1.00 0.00 C ATOM 714 CG GLN A 212 -11.466 -15.966 -44.266 1.00 0.00 C ATOM 715 CD GLN A 212 -12.317 -16.572 -45.379 1.00 0.00 C ATOM 716 OE1 GLN A 212 -12.119 -17.702 -45.804 1.00 0.00 O ATOM 717 NE2 GLN A 212 -13.288 -15.852 -45.901 1.00 0.00 N ATOM 0 H GLN A 212 -8.744 -16.790 -43.823 1.00 0.00 H new ATOM 0 HA GLN A 212 -9.847 -16.453 -46.421 1.00 0.00 H new ATOM 0 HB2 GLN A 212 -9.762 -14.683 -43.949 1.00 0.00 H new ATOM 0 HB3 GLN A 212 -10.687 -14.297 -45.386 1.00 0.00 H new ATOM 0 HG2 GLN A 212 -11.076 -16.767 -43.638 1.00 0.00 H new ATOM 0 HG3 GLN A 212 -12.097 -15.343 -43.632 1.00 0.00 H new ATOM 0 HE21 GLN A 212 -13.465 -14.908 -45.557 1.00 0.00 H new ATOM 0 HE22 GLN A 212 -13.863 -16.238 -46.650 1.00 0.00 H new ATOM 726 N GLU A 213 -7.167 -14.644 -45.835 1.00 0.00 N ATOM 727 CA GLU A 213 -6.140 -13.857 -46.532 1.00 0.00 C ATOM 728 C GLU A 213 -5.643 -14.622 -47.766 1.00 0.00 C ATOM 729 O GLU A 213 -5.648 -14.073 -48.868 1.00 0.00 O ATOM 730 CB GLU A 213 -4.995 -13.497 -45.566 1.00 0.00 C ATOM 731 CG GLU A 213 -3.830 -12.718 -46.201 1.00 0.00 C ATOM 732 CD GLU A 213 -2.727 -13.631 -46.759 1.00 0.00 C ATOM 733 OE1 GLU A 213 -2.022 -14.269 -45.939 1.00 0.00 O ATOM 734 OE2 GLU A 213 -2.563 -13.674 -48.001 1.00 0.00 O ATOM 0 H GLU A 213 -6.913 -14.896 -44.880 1.00 0.00 H new ATOM 0 HA GLU A 213 -6.572 -12.919 -46.880 1.00 0.00 H new ATOM 0 HB2 GLU A 213 -5.404 -12.906 -44.746 1.00 0.00 H new ATOM 0 HB3 GLU A 213 -4.603 -14.417 -45.132 1.00 0.00 H new ATOM 0 HG2 GLU A 213 -4.216 -12.091 -47.005 1.00 0.00 H new ATOM 0 HG3 GLU A 213 -3.398 -12.050 -45.455 1.00 0.00 H new ATOM 741 N THR A 214 -5.278 -15.902 -47.606 1.00 0.00 N ATOM 742 CA THR A 214 -4.857 -16.765 -48.723 1.00 0.00 C ATOM 743 C THR A 214 -5.975 -16.909 -49.760 1.00 0.00 C ATOM 744 O THR A 214 -5.709 -16.788 -50.956 1.00 0.00 O ATOM 745 CB THR A 214 -4.405 -18.145 -48.214 1.00 0.00 C ATOM 746 OG1 THR A 214 -3.269 -17.985 -47.391 1.00 0.00 O ATOM 747 CG2 THR A 214 -3.995 -19.102 -49.337 1.00 0.00 C ATOM 0 H THR A 214 -5.266 -16.370 -46.700 1.00 0.00 H new ATOM 0 HA THR A 214 -4.006 -16.288 -49.209 1.00 0.00 H new ATOM 0 HB THR A 214 -5.260 -18.568 -47.686 1.00 0.00 H new ATOM 0 HG1 THR A 214 -3.552 -17.716 -46.492 1.00 0.00 H new ATOM 0 HG21 THR A 214 -3.688 -20.056 -48.908 1.00 0.00 H new ATOM 0 HG22 THR A 214 -4.840 -19.261 -50.006 1.00 0.00 H new ATOM 0 HG23 THR A 214 -3.165 -18.672 -49.897 1.00 0.00 H new ATOM 755 N LYS A 215 -7.231 -17.117 -49.332 1.00 0.00 N ATOM 756 CA LYS A 215 -8.396 -17.226 -50.230 1.00 0.00 C ATOM 757 C LYS A 215 -8.588 -15.955 -51.068 1.00 0.00 C ATOM 758 O LYS A 215 -8.729 -16.042 -52.288 1.00 0.00 O ATOM 759 CB LYS A 215 -9.645 -17.562 -49.396 1.00 0.00 C ATOM 760 CG LYS A 215 -10.870 -17.879 -50.271 1.00 0.00 C ATOM 761 CD LYS A 215 -12.139 -18.148 -49.444 1.00 0.00 C ATOM 762 CE LYS A 215 -12.028 -19.336 -48.477 1.00 0.00 C ATOM 763 NZ LYS A 215 -11.821 -20.614 -49.190 1.00 0.00 N ATOM 0 H LYS A 215 -7.470 -17.215 -48.345 1.00 0.00 H new ATOM 0 HA LYS A 215 -8.223 -18.032 -50.943 1.00 0.00 H new ATOM 0 HB2 LYS A 215 -9.430 -18.416 -48.754 1.00 0.00 H new ATOM 0 HB3 LYS A 215 -9.878 -16.722 -48.741 1.00 0.00 H new ATOM 0 HG2 LYS A 215 -11.053 -17.045 -50.948 1.00 0.00 H new ATOM 0 HG3 LYS A 215 -10.653 -18.750 -50.890 1.00 0.00 H new ATOM 0 HD2 LYS A 215 -12.382 -17.252 -48.873 1.00 0.00 H new ATOM 0 HD3 LYS A 215 -12.971 -18.327 -50.126 1.00 0.00 H new ATOM 0 HE2 LYS A 215 -11.200 -19.167 -47.789 1.00 0.00 H new ATOM 0 HE3 LYS A 215 -12.935 -19.399 -47.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 215 -11.752 -21.389 -48.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 215 -12.623 -20.789 -49.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 215 -10.942 -20.564 -49.744 1.00 0.00 H new ATOM 777 N LEU A 216 -8.554 -14.781 -50.433 1.00 0.00 N ATOM 778 CA LEU A 216 -8.684 -13.477 -51.093 1.00 0.00 C ATOM 779 C LEU A 216 -7.518 -13.238 -52.066 1.00 0.00 C ATOM 780 O LEU A 216 -7.750 -12.884 -53.222 1.00 0.00 O ATOM 781 CB LEU A 216 -8.801 -12.392 -49.999 1.00 0.00 C ATOM 782 CG LEU A 216 -9.145 -10.953 -50.435 1.00 0.00 C ATOM 783 CD1 LEU A 216 -7.985 -10.207 -51.099 1.00 0.00 C ATOM 784 CD2 LEU A 216 -10.366 -10.885 -51.354 1.00 0.00 C ATOM 0 H LEU A 216 -8.433 -14.708 -49.423 1.00 0.00 H new ATOM 0 HA LEU A 216 -9.585 -13.441 -51.706 1.00 0.00 H new ATOM 0 HB2 LEU A 216 -9.562 -12.716 -49.289 1.00 0.00 H new ATOM 0 HB3 LEU A 216 -7.854 -12.359 -49.460 1.00 0.00 H new ATOM 0 HG LEU A 216 -9.373 -10.451 -49.495 1.00 0.00 H new ATOM 0 HD11 LEU A 216 -8.309 -9.204 -51.376 1.00 0.00 H new ATOM 0 HD12 LEU A 216 -7.149 -10.140 -50.402 1.00 0.00 H new ATOM 0 HD13 LEU A 216 -7.670 -10.746 -51.993 1.00 0.00 H new ATOM 0 HD21 LEU A 216 -10.559 -9.847 -51.627 1.00 0.00 H new ATOM 0 HD22 LEU A 216 -10.176 -11.468 -52.255 1.00 0.00 H new ATOM 0 HD23 LEU A 216 -11.235 -11.291 -50.836 1.00 0.00 H new ATOM 796 N LYS A 217 -6.273 -13.479 -51.631 1.00 0.00 N ATOM 797 CA LYS A 217 -5.065 -13.345 -52.464 1.00 0.00 C ATOM 798 C LYS A 217 -5.138 -14.235 -53.709 1.00 0.00 C ATOM 799 O LYS A 217 -4.884 -13.758 -54.815 1.00 0.00 O ATOM 800 CB LYS A 217 -3.826 -13.646 -51.598 1.00 0.00 C ATOM 801 CG LYS A 217 -2.476 -13.521 -52.325 1.00 0.00 C ATOM 802 CD LYS A 217 -2.207 -12.109 -52.872 1.00 0.00 C ATOM 803 CE LYS A 217 -0.816 -11.994 -53.509 1.00 0.00 C ATOM 804 NZ LYS A 217 0.264 -12.096 -52.503 1.00 0.00 N ATOM 0 H LYS A 217 -6.072 -13.777 -50.676 1.00 0.00 H new ATOM 0 HA LYS A 217 -4.990 -12.323 -52.835 1.00 0.00 H new ATOM 0 HB2 LYS A 217 -3.825 -12.968 -50.744 1.00 0.00 H new ATOM 0 HB3 LYS A 217 -3.916 -14.658 -51.202 1.00 0.00 H new ATOM 0 HG2 LYS A 217 -1.675 -13.796 -51.639 1.00 0.00 H new ATOM 0 HG3 LYS A 217 -2.448 -14.234 -53.149 1.00 0.00 H new ATOM 0 HD2 LYS A 217 -2.966 -11.856 -53.612 1.00 0.00 H new ATOM 0 HD3 LYS A 217 -2.296 -11.384 -52.063 1.00 0.00 H new ATOM 0 HE2 LYS A 217 -0.693 -12.780 -54.254 1.00 0.00 H new ATOM 0 HE3 LYS A 217 -0.735 -11.042 -54.033 1.00 0.00 H new ATOM 0 HZ1 LYS A 217 1.173 -11.846 -52.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 217 0.069 -11.444 -51.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 217 0.311 -13.070 -52.141 1.00 0.00 H new ATOM 818 N LEU A 218 -5.531 -15.502 -53.543 1.00 0.00 N ATOM 819 CA LEU A 218 -5.722 -16.457 -54.639 1.00 0.00 C ATOM 820 C LEU A 218 -6.806 -15.952 -55.600 1.00 0.00 C ATOM 821 O LEU A 218 -6.558 -15.878 -56.800 1.00 0.00 O ATOM 822 CB LEU A 218 -6.033 -17.845 -54.040 1.00 0.00 C ATOM 823 CG LEU A 218 -6.071 -19.021 -55.041 1.00 0.00 C ATOM 824 CD1 LEU A 218 -5.932 -20.336 -54.270 1.00 0.00 C ATOM 825 CD2 LEU A 218 -7.369 -19.117 -55.850 1.00 0.00 C ATOM 0 H LEU A 218 -5.729 -15.900 -52.625 1.00 0.00 H new ATOM 0 HA LEU A 218 -4.814 -16.552 -55.234 1.00 0.00 H new ATOM 0 HB2 LEU A 218 -5.285 -18.066 -53.278 1.00 0.00 H new ATOM 0 HB3 LEU A 218 -6.997 -17.793 -53.534 1.00 0.00 H new ATOM 0 HG LEU A 218 -5.253 -18.842 -55.739 1.00 0.00 H new ATOM 0 HD11 LEU A 218 -5.958 -21.172 -54.969 1.00 0.00 H new ATOM 0 HD12 LEU A 218 -4.985 -20.343 -53.731 1.00 0.00 H new ATOM 0 HD13 LEU A 218 -6.754 -20.431 -53.561 1.00 0.00 H new ATOM 0 HD21 LEU A 218 -7.313 -19.969 -56.528 1.00 0.00 H new ATOM 0 HD22 LEU A 218 -8.212 -19.248 -55.171 1.00 0.00 H new ATOM 0 HD23 LEU A 218 -7.507 -18.202 -56.427 1.00 0.00 H new ATOM 837 N MET A 219 -7.978 -15.558 -55.090 1.00 0.00 N ATOM 838 CA MET A 219 -9.084 -15.021 -55.895 1.00 0.00 C ATOM 839 C MET A 219 -8.659 -13.792 -56.721 1.00 0.00 C ATOM 840 O MET A 219 -8.964 -13.717 -57.912 1.00 0.00 O ATOM 841 CB MET A 219 -10.270 -14.703 -54.969 1.00 0.00 C ATOM 842 CG MET A 219 -11.513 -14.240 -55.735 1.00 0.00 C ATOM 843 SD MET A 219 -12.938 -13.901 -54.666 1.00 0.00 S ATOM 844 CE MET A 219 -14.133 -13.367 -55.922 1.00 0.00 C ATOM 0 H MET A 219 -8.189 -15.603 -54.093 1.00 0.00 H new ATOM 0 HA MET A 219 -9.388 -15.776 -56.620 1.00 0.00 H new ATOM 0 HB2 MET A 219 -10.518 -15.590 -54.386 1.00 0.00 H new ATOM 0 HB3 MET A 219 -9.975 -13.928 -54.261 1.00 0.00 H new ATOM 0 HG2 MET A 219 -11.269 -13.339 -56.297 1.00 0.00 H new ATOM 0 HG3 MET A 219 -11.788 -15.005 -56.462 1.00 0.00 H new ATOM 0 HE1 MET A 219 -15.078 -13.116 -55.441 1.00 0.00 H new ATOM 0 HE2 MET A 219 -13.746 -12.491 -56.443 1.00 0.00 H new ATOM 0 HE3 MET A 219 -14.293 -14.173 -56.638 1.00 0.00 H new ATOM 854 N ALA A 220 -7.928 -12.849 -56.117 1.00 0.00 N ATOM 855 CA ALA A 220 -7.424 -11.653 -56.793 1.00 0.00 C ATOM 856 C ALA A 220 -6.406 -11.996 -57.901 1.00 0.00 C ATOM 857 O ALA A 220 -6.511 -11.490 -59.022 1.00 0.00 O ATOM 858 CB ALA A 220 -6.816 -10.722 -55.735 1.00 0.00 C ATOM 0 H ALA A 220 -7.667 -12.897 -55.132 1.00 0.00 H new ATOM 0 HA ALA A 220 -8.250 -11.150 -57.296 1.00 0.00 H new ATOM 0 HB1 ALA A 220 -6.434 -9.823 -56.218 1.00 0.00 H new ATOM 0 HB2 ALA A 220 -7.582 -10.447 -55.010 1.00 0.00 H new ATOM 0 HB3 ALA A 220 -6.000 -11.235 -55.225 1.00 0.00 H new ATOM 864 N ARG A 221 -5.440 -12.881 -57.608 1.00 0.00 N ATOM 865 CA ARG A 221 -4.405 -13.349 -58.549 1.00 0.00 C ATOM 866 C ARG A 221 -4.997 -14.136 -59.726 1.00 0.00 C ATOM 867 O ARG A 221 -4.659 -13.874 -60.879 1.00 0.00 O ATOM 868 CB ARG A 221 -3.387 -14.185 -57.752 1.00 0.00 C ATOM 869 CG ARG A 221 -2.222 -14.714 -58.607 1.00 0.00 C ATOM 870 CD ARG A 221 -1.162 -15.436 -57.760 1.00 0.00 C ATOM 871 NE ARG A 221 -1.711 -16.566 -56.982 1.00 0.00 N ATOM 872 CZ ARG A 221 -1.996 -17.780 -57.428 1.00 0.00 C ATOM 873 NH1 ARG A 221 -1.856 -18.130 -58.680 1.00 0.00 N ATOM 874 NH2 ARG A 221 -2.437 -18.691 -56.604 1.00 0.00 N ATOM 0 H ARG A 221 -5.353 -13.304 -56.684 1.00 0.00 H new ATOM 0 HA ARG A 221 -3.909 -12.490 -59.001 1.00 0.00 H new ATOM 0 HB2 ARG A 221 -2.985 -13.577 -56.941 1.00 0.00 H new ATOM 0 HB3 ARG A 221 -3.902 -15.029 -57.293 1.00 0.00 H new ATOM 0 HG2 ARG A 221 -2.609 -15.398 -59.362 1.00 0.00 H new ATOM 0 HG3 ARG A 221 -1.757 -13.883 -59.138 1.00 0.00 H new ATOM 0 HD2 ARG A 221 -0.372 -15.804 -58.414 1.00 0.00 H new ATOM 0 HD3 ARG A 221 -0.703 -14.721 -57.077 1.00 0.00 H new ATOM 0 HE ARG A 221 -1.890 -16.392 -55.993 1.00 0.00 H new ATOM 0 HH11 ARG A 221 -1.513 -17.455 -59.363 1.00 0.00 H new ATOM 0 HH12 ARG A 221 -2.090 -19.079 -58.974 1.00 0.00 H new ATOM 0 HH21 ARG A 221 -2.562 -18.468 -55.617 1.00 0.00 H new ATOM 0 HH22 ARG A 221 -2.657 -19.626 -56.947 1.00 0.00 H new ATOM 888 N TYR A 222 -5.891 -15.082 -59.437 1.00 0.00 N ATOM 889 CA TYR A 222 -6.575 -15.939 -60.415 1.00 0.00 C ATOM 890 C TYR A 222 -7.612 -15.182 -61.273 1.00 0.00 C ATOM 891 O TYR A 222 -7.982 -15.639 -62.356 1.00 0.00 O ATOM 892 CB TYR A 222 -7.226 -17.101 -59.648 1.00 0.00 C ATOM 893 CG TYR A 222 -7.698 -18.258 -60.509 1.00 0.00 C ATOM 894 CD1 TYR A 222 -6.767 -19.212 -60.965 1.00 0.00 C ATOM 895 CD2 TYR A 222 -9.063 -18.396 -60.833 1.00 0.00 C ATOM 896 CE1 TYR A 222 -7.197 -20.302 -61.746 1.00 0.00 C ATOM 897 CE2 TYR A 222 -9.496 -19.484 -61.617 1.00 0.00 C ATOM 898 CZ TYR A 222 -8.563 -20.440 -62.077 1.00 0.00 C ATOM 899 OH TYR A 222 -8.971 -21.497 -62.833 1.00 0.00 O ATOM 0 H TYR A 222 -6.172 -15.283 -58.477 1.00 0.00 H new ATOM 0 HA TYR A 222 -5.838 -16.310 -61.128 1.00 0.00 H new ATOM 0 HB2 TYR A 222 -6.510 -17.480 -58.918 1.00 0.00 H new ATOM 0 HB3 TYR A 222 -8.078 -16.714 -59.088 1.00 0.00 H new ATOM 0 HD1 TYR A 222 -5.722 -19.107 -60.715 1.00 0.00 H new ATOM 0 HD2 TYR A 222 -9.778 -17.667 -60.480 1.00 0.00 H new ATOM 0 HE1 TYR A 222 -6.481 -21.033 -62.092 1.00 0.00 H new ATOM 0 HE2 TYR A 222 -10.542 -19.587 -61.866 1.00 0.00 H new ATOM 0 HH TYR A 222 -9.940 -21.446 -62.970 1.00 0.00 H new ATOM 909 N GLY A 223 -8.070 -14.010 -60.813 1.00 0.00 N ATOM 910 CA GLY A 223 -9.048 -13.147 -61.492 1.00 0.00 C ATOM 911 C GLY A 223 -8.568 -12.484 -62.796 1.00 0.00 C ATOM 912 O GLY A 223 -9.362 -11.809 -63.457 1.00 0.00 O ATOM 0 H GLY A 223 -7.758 -13.621 -59.923 1.00 0.00 H new ATOM 0 HA2 GLY A 223 -9.935 -13.740 -61.714 1.00 0.00 H new ATOM 0 HA3 GLY A 223 -9.354 -12.363 -60.800 1.00 0.00 H new ATOM 916 N ARG A 224 -7.297 -12.672 -63.182 1.00 0.00 N ATOM 917 CA ARG A 224 -6.676 -12.140 -64.410 1.00 0.00 C ATOM 918 C ARG A 224 -5.666 -13.124 -65.018 1.00 0.00 C ATOM 919 O ARG A 224 -5.182 -14.030 -64.337 1.00 0.00 O ATOM 920 CB ARG A 224 -6.035 -10.766 -64.117 1.00 0.00 C ATOM 921 CG ARG A 224 -4.846 -10.821 -63.139 1.00 0.00 C ATOM 922 CD ARG A 224 -4.293 -9.414 -62.882 1.00 0.00 C ATOM 923 NE ARG A 224 -3.090 -9.453 -62.028 1.00 0.00 N ATOM 924 CZ ARG A 224 -1.837 -9.604 -62.432 1.00 0.00 C ATOM 925 NH1 ARG A 224 -1.508 -9.744 -63.691 1.00 0.00 N ATOM 926 NH2 ARG A 224 -0.865 -9.618 -61.562 1.00 0.00 N ATOM 0 H ARG A 224 -6.644 -13.222 -62.625 1.00 0.00 H new ATOM 0 HA ARG A 224 -7.456 -12.006 -65.159 1.00 0.00 H new ATOM 0 HB2 ARG A 224 -5.699 -10.327 -65.056 1.00 0.00 H new ATOM 0 HB3 ARG A 224 -6.797 -10.102 -63.709 1.00 0.00 H new ATOM 0 HG2 ARG A 224 -5.163 -11.271 -62.198 1.00 0.00 H new ATOM 0 HG3 ARG A 224 -4.061 -11.457 -63.548 1.00 0.00 H new ATOM 0 HD2 ARG A 224 -4.051 -8.938 -63.832 1.00 0.00 H new ATOM 0 HD3 ARG A 224 -5.059 -8.802 -62.405 1.00 0.00 H new ATOM 0 HE ARG A 224 -3.238 -9.354 -61.024 1.00 0.00 H new ATOM 0 HH11 ARG A 224 -2.231 -9.740 -64.411 1.00 0.00 H new ATOM 0 HH12 ARG A 224 -0.529 -9.857 -63.953 1.00 0.00 H new ATOM 0 HH21 ARG A 224 -1.069 -9.513 -60.568 1.00 0.00 H new ATOM 0 HH22 ARG A 224 0.099 -9.734 -61.876 1.00 0.00 H new ATOM 940 N LEU A 225 -5.339 -12.931 -66.298 1.00 0.00 N ATOM 941 CA LEU A 225 -4.385 -13.749 -67.060 1.00 0.00 C ATOM 942 C LEU A 225 -3.709 -12.875 -68.135 1.00 0.00 C ATOM 943 O LEU A 225 -4.319 -12.543 -69.154 1.00 0.00 O ATOM 944 CB LEU A 225 -5.127 -14.976 -67.642 1.00 0.00 C ATOM 945 CG LEU A 225 -4.229 -16.170 -68.023 1.00 0.00 C ATOM 946 CD1 LEU A 225 -5.108 -17.347 -68.450 1.00 0.00 C ATOM 947 CD2 LEU A 225 -3.254 -15.880 -69.167 1.00 0.00 C ATOM 0 H LEU A 225 -5.743 -12.177 -66.853 1.00 0.00 H new ATOM 0 HA LEU A 225 -3.589 -14.130 -66.420 1.00 0.00 H new ATOM 0 HB2 LEU A 225 -5.863 -15.314 -66.913 1.00 0.00 H new ATOM 0 HB3 LEU A 225 -5.678 -14.660 -68.528 1.00 0.00 H new ATOM 0 HG LEU A 225 -3.637 -16.392 -67.135 1.00 0.00 H new ATOM 0 HD11 LEU A 225 -4.477 -18.193 -68.720 1.00 0.00 H new ATOM 0 HD12 LEU A 225 -5.762 -17.631 -67.625 1.00 0.00 H new ATOM 0 HD13 LEU A 225 -5.713 -17.057 -69.309 1.00 0.00 H new ATOM 0 HD21 LEU A 225 -2.660 -16.770 -69.373 1.00 0.00 H new ATOM 0 HD22 LEU A 225 -3.813 -15.602 -70.060 1.00 0.00 H new ATOM 0 HD23 LEU A 225 -2.594 -15.061 -68.883 1.00 0.00 H new ATOM 959 N ALA A 226 -2.459 -12.473 -67.881 1.00 0.00 N ATOM 960 CA ALA A 226 -1.666 -11.598 -68.760 1.00 0.00 C ATOM 961 C ALA A 226 -0.164 -11.974 -68.844 1.00 0.00 C ATOM 962 O ALA A 226 0.642 -11.202 -69.371 1.00 0.00 O ATOM 963 CB ALA A 226 -1.873 -10.152 -68.279 1.00 0.00 C ATOM 0 H ALA A 226 -1.956 -12.752 -67.039 1.00 0.00 H new ATOM 0 HA ALA A 226 -2.019 -11.722 -69.784 1.00 0.00 H new ATOM 0 HB1 ALA A 226 -1.298 -9.473 -68.909 1.00 0.00 H new ATOM 0 HB2 ALA A 226 -2.931 -9.896 -68.340 1.00 0.00 H new ATOM 0 HB3 ALA A 226 -1.537 -10.060 -67.246 1.00 0.00 H new ATOM 969 N ASP A 227 0.231 -13.147 -68.331 1.00 0.00 N ATOM 970 CA ASP A 227 1.621 -13.635 -68.324 1.00 0.00 C ATOM 971 C ASP A 227 1.683 -15.169 -68.418 1.00 0.00 C ATOM 972 O ASP A 227 2.530 -15.728 -69.128 1.00 0.00 O ATOM 973 CB ASP A 227 2.319 -13.140 -67.046 1.00 0.00 C ATOM 974 CG ASP A 227 3.801 -13.535 -67.007 1.00 0.00 C ATOM 975 OD1 ASP A 227 4.601 -12.886 -67.723 1.00 0.00 O ATOM 976 OD2 ASP A 227 4.135 -14.487 -66.261 1.00 0.00 O ATOM 0 H ASP A 227 -0.422 -13.801 -67.898 1.00 0.00 H new ATOM 0 HA ASP A 227 2.136 -13.241 -69.200 1.00 0.00 H new ATOM 0 HB2 ASP A 227 2.232 -12.055 -66.983 1.00 0.00 H new ATOM 0 HB3 ASP A 227 1.812 -13.552 -66.174 1.00 0.00 H new TER 981 ASP A 227 HETATM 982 ZN ZN A 301 -8.736 -10.721 -41.326 1.00 0.00 ZN