USER MOD reduce.3.24.130724 H: found=0, std=0, add=554, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 555 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 200 MET CE :methyl -118:sc= -0.692 (180deg=-2.3!) USER MOD Set 1.2: A 229 CYS SG : rot 180:sc= -0.311 USER MOD Set 2.1: A 184 THR OG1 : rot 180:sc= 0.133 USER MOD Set 2.2: A 187 THR OG1 : rot 98:sc= 0.135 USER MOD Set 3.1: A 168 LYS NZ :NH3+ -127:sc= 0.201 (180deg=0) USER MOD Set 3.2: A 228 HIS : no HD1:sc= -0.369 K(o=-0.17,f=-1.5) USER MOD Single : A 164 ASN :FLIP amide:sc= -0.0844 F(o=-0.65,f=-0.084) USER MOD Single : A 171 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 173 THR OG1 : rot 180:sc= -0.387 USER MOD Single : A 189 LYS NZ :NH3+ 132:sc= 0.154 (180deg=-4.41!) USER MOD Single : A 190 SER OG : rot 77:sc= 0.3 USER MOD Single : A 191 LYS NZ :NH3+ -152:sc= -0.154 (180deg=-0.651) USER MOD Single : A 192 TYR OH : rot 145:sc= -1.17! USER MOD Single : A 196 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 198 SER OG : rot 180:sc= 0 USER MOD Single : A 199 GLN : amide:sc= -0.0837 K(o=-0.084,f=-1.3) USER MOD Single : A 201 LYS NZ :NH3+ -122:sc=-0.000784 (180deg=-0.95) USER MOD Single : A 204 TYR OH : rot 59:sc= 1.09 USER MOD Single : A 205 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 210 GLN : amide:sc= -1.51 X(o=-1.5,f=-1.2) USER MOD Single : A 215 THR OG1 : rot 180:sc= 0 USER MOD Single : A 217 SER OG : rot 180:sc= 0 USER MOD Single : A 218 SER OG : rot 180:sc= 0 USER MOD Single : A 220 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 222 THR OG1 : rot 180:sc= 0 USER MOD Single : A 223 ASN : amide:sc= -0.754 K(o=-0.75,f=-2.6) USER MOD Single : A 224 ASN : amide:sc=-0.00852 X(o=-0.0085,f=-0.011) USER MOD Single : A 225 CYS SG : rot -170:sc= -0.573 USER MOD Single : A 230 HIS :FLIP no HD1:sc= -1.1 F(o=-1.7,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 162 0.830 -15.885 3.775 1.00 0.00 N ATOM 60 CA GLY A 162 1.210 -14.735 2.975 1.00 0.00 C ATOM 61 C GLY A 162 2.411 -14.005 3.542 1.00 0.00 C ATOM 62 O GLY A 162 2.986 -14.429 4.545 1.00 0.00 O ATOM 0 HA2 GLY A 162 1.433 -15.061 1.959 1.00 0.00 H new ATOM 0 HA3 GLY A 162 0.367 -14.047 2.911 1.00 0.00 H new ATOM 66 N ILE A 163 2.792 -12.906 2.900 1.00 0.00 N ATOM 67 CA ILE A 163 3.933 -12.117 3.347 1.00 0.00 C ATOM 68 C ILE A 163 3.481 -10.793 3.954 1.00 0.00 C ATOM 69 O ILE A 163 2.523 -10.179 3.486 1.00 0.00 O ATOM 70 CB ILE A 163 4.908 -11.832 2.190 1.00 0.00 C ATOM 71 CG1 ILE A 163 4.145 -11.331 0.962 1.00 0.00 C ATOM 72 CG2 ILE A 163 5.707 -13.081 1.850 1.00 0.00 C ATOM 73 CD1 ILE A 163 5.035 -11.043 -0.227 1.00 0.00 C ATOM 0 H ILE A 163 2.327 -12.542 2.068 1.00 0.00 H new ATOM 0 HA ILE A 163 4.446 -12.706 4.107 1.00 0.00 H new ATOM 0 HB ILE A 163 5.603 -11.054 2.505 1.00 0.00 H new ATOM 0 HG12 ILE A 163 3.402 -12.076 0.677 1.00 0.00 H new ATOM 0 HG13 ILE A 163 3.602 -10.424 1.227 1.00 0.00 H new ATOM 0 HG21 ILE A 163 6.392 -12.863 1.030 1.00 0.00 H new ATOM 0 HG22 ILE A 163 6.276 -13.398 2.724 1.00 0.00 H new ATOM 0 HG23 ILE A 163 5.026 -13.878 1.552 1.00 0.00 H new ATOM 0 HD11 ILE A 163 4.426 -10.692 -1.060 1.00 0.00 H new ATOM 0 HD12 ILE A 163 5.762 -10.276 0.040 1.00 0.00 H new ATOM 0 HD13 ILE A 163 5.559 -11.953 -0.518 1.00 0.00 H new ATOM 85 N ASN A 164 4.179 -10.359 4.998 1.00 0.00 N ATOM 86 CA ASN A 164 3.850 -9.106 5.669 1.00 0.00 C ATOM 87 C ASN A 164 4.541 -7.928 4.990 1.00 0.00 C ATOM 88 O ASN A 164 5.688 -8.033 4.554 1.00 0.00 O ATOM 89 CB ASN A 164 4.258 -9.170 7.143 1.00 0.00 C ATOM 90 CG ASN A 164 3.461 -10.201 7.919 1.00 0.00 C ATOM 91 OD1 ASN A 164 2.541 -9.731 8.754 1.00 0.00 O flip ATOM 92 ND2 ASN A 164 3.669 -11.405 7.769 1.00 0.00 N flip ATOM 0 H ASN A 164 4.975 -10.856 5.398 1.00 0.00 H new ATOM 0 HA ASN A 164 2.772 -8.960 5.603 1.00 0.00 H new ATOM 0 HB2 ASN A 164 5.320 -9.407 7.213 1.00 0.00 H new ATOM 0 HB3 ASN A 164 4.119 -8.189 7.598 1.00 0.00 H new ATOM 0 HD21 ASN A 164 4.386 -11.721 7.116 1.00 0.00 H new ATOM 0 HD22 ASN A 164 3.124 -12.086 8.297 1.00 0.00 H new ATOM 99 N VAL A 165 3.836 -6.804 4.904 1.00 0.00 N ATOM 100 CA VAL A 165 4.381 -5.605 4.280 1.00 0.00 C ATOM 101 C VAL A 165 4.106 -4.369 5.130 1.00 0.00 C ATOM 102 O VAL A 165 3.008 -4.200 5.661 1.00 0.00 O ATOM 103 CB VAL A 165 3.792 -5.387 2.873 1.00 0.00 C ATOM 104 CG1 VAL A 165 4.522 -4.261 2.157 1.00 0.00 C ATOM 105 CG2 VAL A 165 3.856 -6.674 2.065 1.00 0.00 C ATOM 0 H VAL A 165 2.886 -6.699 5.259 1.00 0.00 H new ATOM 0 HA VAL A 165 5.458 -5.754 4.197 1.00 0.00 H new ATOM 0 HB VAL A 165 2.745 -5.101 2.976 1.00 0.00 H new ATOM 0 HG11 VAL A 165 4.092 -4.122 1.165 1.00 0.00 H new ATOM 0 HG12 VAL A 165 4.420 -3.339 2.730 1.00 0.00 H new ATOM 0 HG13 VAL A 165 5.578 -4.514 2.063 1.00 0.00 H new ATOM 0 HG21 VAL A 165 3.436 -6.503 1.074 1.00 0.00 H new ATOM 0 HG22 VAL A 165 4.894 -6.992 1.969 1.00 0.00 H new ATOM 0 HG23 VAL A 165 3.284 -7.451 2.572 1.00 0.00 H new ATOM 115 N ARG A 166 5.111 -3.509 5.255 1.00 0.00 N ATOM 116 CA ARG A 166 4.979 -2.288 6.042 1.00 0.00 C ATOM 117 C ARG A 166 4.766 -1.078 5.137 1.00 0.00 C ATOM 118 O ARG A 166 5.674 -0.663 4.415 1.00 0.00 O ATOM 119 CB ARG A 166 6.221 -2.078 6.910 1.00 0.00 C ATOM 120 CG ARG A 166 6.621 -3.308 7.709 1.00 0.00 C ATOM 121 CD ARG A 166 7.663 -2.971 8.764 1.00 0.00 C ATOM 122 NE ARG A 166 7.208 -1.915 9.665 1.00 0.00 N ATOM 123 CZ ARG A 166 8.025 -1.202 10.433 1.00 0.00 C ATOM 124 NH1 ARG A 166 9.331 -1.431 10.409 1.00 0.00 N ATOM 125 NH2 ARG A 166 7.536 -0.258 11.226 1.00 0.00 N ATOM 0 H ARG A 166 6.026 -3.635 4.822 1.00 0.00 H new ATOM 0 HA ARG A 166 4.107 -2.394 6.688 1.00 0.00 H new ATOM 0 HB2 ARG A 166 7.054 -1.783 6.272 1.00 0.00 H new ATOM 0 HB3 ARG A 166 6.038 -1.252 7.598 1.00 0.00 H new ATOM 0 HG2 ARG A 166 5.740 -3.734 8.189 1.00 0.00 H new ATOM 0 HG3 ARG A 166 7.016 -4.068 7.035 1.00 0.00 H new ATOM 0 HD2 ARG A 166 7.896 -3.865 9.342 1.00 0.00 H new ATOM 0 HD3 ARG A 166 8.586 -2.658 8.275 1.00 0.00 H new ATOM 0 HE ARG A 166 6.209 -1.714 9.707 1.00 0.00 H new ATOM 0 HH11 ARG A 166 9.711 -2.156 9.800 1.00 0.00 H new ATOM 0 HH12 ARG A 166 9.956 -0.882 11.000 1.00 0.00 H new ATOM 0 HH21 ARG A 166 6.532 -0.079 11.247 1.00 0.00 H new ATOM 0 HH22 ARG A 166 8.164 0.289 11.815 1.00 0.00 H new ATOM 139 N LEU A 167 3.563 -0.517 5.181 1.00 0.00 N ATOM 140 CA LEU A 167 3.231 0.645 4.364 1.00 0.00 C ATOM 141 C LEU A 167 3.654 1.936 5.057 1.00 0.00 C ATOM 142 O LEU A 167 3.052 2.348 6.049 1.00 0.00 O ATOM 143 CB LEU A 167 1.729 0.677 4.075 1.00 0.00 C ATOM 144 CG LEU A 167 1.177 -0.492 3.259 1.00 0.00 C ATOM 145 CD1 LEU A 167 -0.327 -0.613 3.449 1.00 0.00 C ATOM 146 CD2 LEU A 167 1.519 -0.323 1.786 1.00 0.00 C ATOM 0 H LEU A 167 2.801 -0.848 5.773 1.00 0.00 H new ATOM 0 HA LEU A 167 3.775 0.564 3.423 1.00 0.00 H new ATOM 0 HB2 LEU A 167 1.197 0.713 5.026 1.00 0.00 H new ATOM 0 HB3 LEU A 167 1.501 1.603 3.547 1.00 0.00 H new ATOM 0 HG LEU A 167 1.642 -1.411 3.616 1.00 0.00 H new ATOM 0 HD11 LEU A 167 -0.702 -1.450 2.861 1.00 0.00 H new ATOM 0 HD12 LEU A 167 -0.548 -0.782 4.503 1.00 0.00 H new ATOM 0 HD13 LEU A 167 -0.810 0.307 3.120 1.00 0.00 H new ATOM 0 HD21 LEU A 167 1.118 -1.164 1.221 1.00 0.00 H new ATOM 0 HD22 LEU A 167 1.082 0.604 1.415 1.00 0.00 H new ATOM 0 HD23 LEU A 167 2.602 -0.288 1.666 1.00 0.00 H new ATOM 158 N LYS A 168 4.694 2.572 4.528 1.00 0.00 N ATOM 159 CA LYS A 168 5.197 3.819 5.092 1.00 0.00 C ATOM 160 C LYS A 168 4.669 5.020 4.315 1.00 0.00 C ATOM 161 O LYS A 168 4.726 5.051 3.086 1.00 0.00 O ATOM 162 CB LYS A 168 6.728 3.825 5.083 1.00 0.00 C ATOM 163 CG LYS A 168 7.337 4.829 6.046 1.00 0.00 C ATOM 164 CD LYS A 168 7.389 6.222 5.441 1.00 0.00 C ATOM 165 CE LYS A 168 8.695 6.460 4.699 1.00 0.00 C ATOM 166 NZ LYS A 168 8.524 7.410 3.565 1.00 0.00 N ATOM 0 H LYS A 168 5.205 2.244 3.709 1.00 0.00 H new ATOM 0 HA LYS A 168 4.845 3.892 6.121 1.00 0.00 H new ATOM 0 HB2 LYS A 168 7.089 2.828 5.335 1.00 0.00 H new ATOM 0 HB3 LYS A 168 7.076 4.045 4.074 1.00 0.00 H new ATOM 0 HG2 LYS A 168 6.753 4.853 6.966 1.00 0.00 H new ATOM 0 HG3 LYS A 168 8.344 4.511 6.316 1.00 0.00 H new ATOM 0 HD2 LYS A 168 6.551 6.354 4.756 1.00 0.00 H new ATOM 0 HD3 LYS A 168 7.276 6.966 6.229 1.00 0.00 H new ATOM 0 HE2 LYS A 168 9.440 6.852 5.392 1.00 0.00 H new ATOM 0 HE3 LYS A 168 9.077 5.511 4.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 168 8.895 6.981 2.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 168 7.514 7.625 3.442 1.00 0.00 H new ATOM 0 HZ3 LYS A 168 9.043 8.288 3.767 1.00 0.00 H new ATOM 180 N PHE A 169 4.156 6.009 5.040 1.00 0.00 N ATOM 181 CA PHE A 169 3.617 7.213 4.419 1.00 0.00 C ATOM 182 C PHE A 169 4.544 8.404 4.647 1.00 0.00 C ATOM 183 O PHE A 169 5.447 8.351 5.483 1.00 0.00 O ATOM 184 CB PHE A 169 2.226 7.521 4.975 1.00 0.00 C ATOM 185 CG PHE A 169 1.307 6.333 4.984 1.00 0.00 C ATOM 186 CD1 PHE A 169 1.485 5.310 5.903 1.00 0.00 C ATOM 187 CD2 PHE A 169 0.266 6.238 4.075 1.00 0.00 C ATOM 188 CE1 PHE A 169 0.641 4.215 5.913 1.00 0.00 C ATOM 189 CE2 PHE A 169 -0.581 5.146 4.080 1.00 0.00 C ATOM 190 CZ PHE A 169 -0.393 4.133 5.001 1.00 0.00 C ATOM 0 H PHE A 169 4.102 6.000 6.059 1.00 0.00 H new ATOM 0 HA PHE A 169 3.540 7.035 3.346 1.00 0.00 H new ATOM 0 HB2 PHE A 169 2.326 7.901 5.992 1.00 0.00 H new ATOM 0 HB3 PHE A 169 1.774 8.315 4.381 1.00 0.00 H new ATOM 0 HD1 PHE A 169 2.292 5.369 6.619 1.00 0.00 H new ATOM 0 HD2 PHE A 169 0.114 7.027 3.353 1.00 0.00 H new ATOM 0 HE1 PHE A 169 0.790 3.424 6.633 1.00 0.00 H new ATOM 0 HE2 PHE A 169 -1.388 5.084 3.365 1.00 0.00 H new ATOM 0 HZ PHE A 169 -1.054 3.279 5.008 1.00 0.00 H new ATOM 200 N LEU A 170 4.314 9.476 3.898 1.00 0.00 N ATOM 201 CA LEU A 170 5.127 10.681 4.018 1.00 0.00 C ATOM 202 C LEU A 170 4.867 11.385 5.346 1.00 0.00 C ATOM 203 O LEU A 170 5.494 12.397 5.657 1.00 0.00 O ATOM 204 CB LEU A 170 4.836 11.634 2.858 1.00 0.00 C ATOM 205 CG LEU A 170 5.607 11.372 1.563 1.00 0.00 C ATOM 206 CD1 LEU A 170 5.031 12.197 0.423 1.00 0.00 C ATOM 207 CD2 LEU A 170 7.085 11.678 1.752 1.00 0.00 C ATOM 0 H LEU A 170 3.571 9.536 3.201 1.00 0.00 H new ATOM 0 HA LEU A 170 6.176 10.386 3.984 1.00 0.00 H new ATOM 0 HB2 LEU A 170 3.769 11.590 2.637 1.00 0.00 H new ATOM 0 HB3 LEU A 170 5.052 12.651 3.186 1.00 0.00 H new ATOM 0 HG LEU A 170 5.505 10.317 1.308 1.00 0.00 H new ATOM 0 HD11 LEU A 170 5.592 11.998 -0.490 1.00 0.00 H new ATOM 0 HD12 LEU A 170 3.985 11.929 0.272 1.00 0.00 H new ATOM 0 HD13 LEU A 170 5.102 13.257 0.669 1.00 0.00 H new ATOM 0 HD21 LEU A 170 7.618 11.486 0.821 1.00 0.00 H new ATOM 0 HD22 LEU A 170 7.207 12.725 2.031 1.00 0.00 H new ATOM 0 HD23 LEU A 170 7.490 11.043 2.540 1.00 0.00 H new ATOM 219 N ASN A 171 3.940 10.839 6.127 1.00 0.00 N ATOM 220 CA ASN A 171 3.599 11.414 7.423 1.00 0.00 C ATOM 221 C ASN A 171 4.461 10.812 8.529 1.00 0.00 C ATOM 222 O ASN A 171 4.163 10.963 9.714 1.00 0.00 O ATOM 223 CB ASN A 171 2.118 11.182 7.733 1.00 0.00 C ATOM 224 CG ASN A 171 1.224 11.491 6.548 1.00 0.00 C ATOM 225 OD1 ASN A 171 1.256 12.595 6.004 1.00 0.00 O ATOM 226 ND2 ASN A 171 0.422 10.515 6.141 1.00 0.00 N ATOM 0 H ASN A 171 3.412 10.000 5.885 1.00 0.00 H new ATOM 0 HA ASN A 171 3.791 12.486 7.379 1.00 0.00 H new ATOM 0 HB2 ASN A 171 1.971 10.145 8.035 1.00 0.00 H new ATOM 0 HB3 ASN A 171 1.825 11.805 8.578 1.00 0.00 H new ATOM 0 HD21 ASN A 171 -0.201 10.664 5.347 1.00 0.00 H new ATOM 0 HD22 ASN A 171 0.429 9.615 6.622 1.00 0.00 H new ATOM 233 N ASP A 172 5.531 10.132 8.133 1.00 0.00 N ATOM 234 CA ASP A 172 6.439 9.509 9.090 1.00 0.00 C ATOM 235 C ASP A 172 5.731 8.408 9.873 1.00 0.00 C ATOM 236 O ASP A 172 6.086 8.116 11.015 1.00 0.00 O ATOM 237 CB ASP A 172 6.997 10.558 10.053 1.00 0.00 C ATOM 238 CG ASP A 172 8.302 10.123 10.690 1.00 0.00 C ATOM 239 OD1 ASP A 172 8.552 8.901 10.756 1.00 0.00 O ATOM 240 OD2 ASP A 172 9.074 11.005 11.121 1.00 0.00 O ATOM 0 H ASP A 172 5.791 9.998 7.156 1.00 0.00 H new ATOM 0 HA ASP A 172 7.263 9.062 8.534 1.00 0.00 H new ATOM 0 HB2 ASP A 172 7.152 11.494 9.516 1.00 0.00 H new ATOM 0 HB3 ASP A 172 6.263 10.757 10.834 1.00 0.00 H new ATOM 245 N THR A 173 4.725 7.800 9.252 1.00 0.00 N ATOM 246 CA THR A 173 3.965 6.733 9.890 1.00 0.00 C ATOM 247 C THR A 173 4.117 5.420 9.131 1.00 0.00 C ATOM 248 O THR A 173 4.731 5.376 8.066 1.00 0.00 O ATOM 249 CB THR A 173 2.469 7.088 9.986 1.00 0.00 C ATOM 250 OG1 THR A 173 1.752 6.021 10.617 1.00 0.00 O ATOM 251 CG2 THR A 173 1.886 7.351 8.606 1.00 0.00 C ATOM 0 H THR A 173 4.418 8.029 8.307 1.00 0.00 H new ATOM 0 HA THR A 173 4.368 6.616 10.896 1.00 0.00 H new ATOM 0 HB THR A 173 2.371 7.994 10.583 1.00 0.00 H new ATOM 0 HG1 THR A 173 0.802 6.255 10.676 1.00 0.00 H new ATOM 0 HG21 THR A 173 0.829 7.600 8.699 1.00 0.00 H new ATOM 0 HG22 THR A 173 2.415 8.183 8.140 1.00 0.00 H new ATOM 0 HG23 THR A 173 1.996 6.460 7.989 1.00 0.00 H new ATOM 259 N GLU A 174 3.552 4.352 9.686 1.00 0.00 N ATOM 260 CA GLU A 174 3.625 3.037 9.059 1.00 0.00 C ATOM 261 C GLU A 174 2.372 2.220 9.361 1.00 0.00 C ATOM 262 O GLU A 174 1.772 2.356 10.427 1.00 0.00 O ATOM 263 CB GLU A 174 4.866 2.285 9.544 1.00 0.00 C ATOM 264 CG GLU A 174 6.172 2.991 9.217 1.00 0.00 C ATOM 265 CD GLU A 174 6.536 4.048 10.241 1.00 0.00 C ATOM 266 OE1 GLU A 174 6.787 3.682 11.408 1.00 0.00 O ATOM 267 OE2 GLU A 174 6.571 5.241 9.874 1.00 0.00 O ATOM 0 H GLU A 174 3.039 4.371 10.568 1.00 0.00 H new ATOM 0 HA GLU A 174 3.694 3.180 7.981 1.00 0.00 H new ATOM 0 HB2 GLU A 174 4.798 2.146 10.623 1.00 0.00 H new ATOM 0 HB3 GLU A 174 4.877 1.292 9.095 1.00 0.00 H new ATOM 0 HG2 GLU A 174 6.974 2.255 9.159 1.00 0.00 H new ATOM 0 HG3 GLU A 174 6.094 3.455 8.234 1.00 0.00 H new ATOM 274 N GLU A 175 1.983 1.372 8.414 1.00 0.00 N ATOM 275 CA GLU A 175 0.801 0.534 8.578 1.00 0.00 C ATOM 276 C GLU A 175 1.061 -0.879 8.064 1.00 0.00 C ATOM 277 O GLU A 175 1.526 -1.068 6.939 1.00 0.00 O ATOM 278 CB GLU A 175 -0.391 1.146 7.839 1.00 0.00 C ATOM 279 CG GLU A 175 -1.728 0.543 8.236 1.00 0.00 C ATOM 280 CD GLU A 175 -2.890 1.484 7.987 1.00 0.00 C ATOM 281 OE1 GLU A 175 -3.065 2.435 8.777 1.00 0.00 O ATOM 282 OE2 GLU A 175 -3.625 1.269 7.000 1.00 0.00 O ATOM 0 H GLU A 175 2.469 1.247 7.526 1.00 0.00 H new ATOM 0 HA GLU A 175 0.570 0.479 9.642 1.00 0.00 H new ATOM 0 HB2 GLU A 175 -0.415 2.219 8.031 1.00 0.00 H new ATOM 0 HB3 GLU A 175 -0.248 1.017 6.766 1.00 0.00 H new ATOM 0 HG2 GLU A 175 -1.886 -0.379 7.677 1.00 0.00 H new ATOM 0 HG3 GLU A 175 -1.702 0.275 9.292 1.00 0.00 H new ATOM 289 N LEU A 176 0.756 -1.869 8.896 1.00 0.00 N ATOM 290 CA LEU A 176 0.957 -3.267 8.527 1.00 0.00 C ATOM 291 C LEU A 176 -0.139 -3.742 7.579 1.00 0.00 C ATOM 292 O LEU A 176 -1.326 -3.538 7.833 1.00 0.00 O ATOM 293 CB LEU A 176 0.980 -4.146 9.779 1.00 0.00 C ATOM 294 CG LEU A 176 1.566 -5.547 9.603 1.00 0.00 C ATOM 295 CD1 LEU A 176 0.653 -6.404 8.740 1.00 0.00 C ATOM 296 CD2 LEU A 176 2.960 -5.471 8.996 1.00 0.00 C ATOM 0 H LEU A 176 0.369 -1.730 9.830 1.00 0.00 H new ATOM 0 HA LEU A 176 1.916 -3.349 8.015 1.00 0.00 H new ATOM 0 HB2 LEU A 176 1.550 -3.629 10.551 1.00 0.00 H new ATOM 0 HB3 LEU A 176 -0.041 -4.244 10.149 1.00 0.00 H new ATOM 0 HG LEU A 176 1.644 -6.012 10.586 1.00 0.00 H new ATOM 0 HD11 LEU A 176 1.087 -7.397 8.626 1.00 0.00 H new ATOM 0 HD12 LEU A 176 -0.324 -6.487 9.215 1.00 0.00 H new ATOM 0 HD13 LEU A 176 0.541 -5.942 7.759 1.00 0.00 H new ATOM 0 HD21 LEU A 176 3.361 -6.478 8.878 1.00 0.00 H new ATOM 0 HD22 LEU A 176 2.907 -4.985 8.022 1.00 0.00 H new ATOM 0 HD23 LEU A 176 3.612 -4.895 9.653 1.00 0.00 H new ATOM 308 N ALA A 177 0.267 -4.378 6.485 1.00 0.00 N ATOM 309 CA ALA A 177 -0.680 -4.887 5.500 1.00 0.00 C ATOM 310 C ALA A 177 -0.227 -6.233 4.947 1.00 0.00 C ATOM 311 O ALA A 177 0.931 -6.400 4.561 1.00 0.00 O ATOM 312 CB ALA A 177 -0.857 -3.882 4.371 1.00 0.00 C ATOM 0 H ALA A 177 1.246 -4.553 6.258 1.00 0.00 H new ATOM 0 HA ALA A 177 -1.640 -5.033 5.996 1.00 0.00 H new ATOM 0 HB1 ALA A 177 -1.566 -4.274 3.642 1.00 0.00 H new ATOM 0 HB2 ALA A 177 -1.234 -2.943 4.776 1.00 0.00 H new ATOM 0 HB3 ALA A 177 0.103 -3.708 3.885 1.00 0.00 H new ATOM 318 N VAL A 178 -1.146 -7.193 4.911 1.00 0.00 N ATOM 319 CA VAL A 178 -0.840 -8.525 4.404 1.00 0.00 C ATOM 320 C VAL A 178 -0.918 -8.566 2.882 1.00 0.00 C ATOM 321 O VAL A 178 -1.957 -8.263 2.296 1.00 0.00 O ATOM 322 CB VAL A 178 -1.801 -9.580 4.985 1.00 0.00 C ATOM 323 CG1 VAL A 178 -1.528 -10.946 4.373 1.00 0.00 C ATOM 324 CG2 VAL A 178 -1.681 -9.633 6.500 1.00 0.00 C ATOM 0 H VAL A 178 -2.108 -7.073 5.227 1.00 0.00 H new ATOM 0 HA VAL A 178 0.177 -8.757 4.718 1.00 0.00 H new ATOM 0 HB VAL A 178 -2.822 -9.293 4.734 1.00 0.00 H new ATOM 0 HG11 VAL A 178 -2.216 -11.678 4.795 1.00 0.00 H new ATOM 0 HG12 VAL A 178 -1.669 -10.896 3.293 1.00 0.00 H new ATOM 0 HG13 VAL A 178 -0.502 -11.244 4.591 1.00 0.00 H new ATOM 0 HG21 VAL A 178 -2.367 -10.383 6.893 1.00 0.00 H new ATOM 0 HG22 VAL A 178 -0.659 -9.895 6.775 1.00 0.00 H new ATOM 0 HG23 VAL A 178 -1.931 -8.658 6.919 1.00 0.00 H new ATOM 334 N ALA A 179 0.187 -8.943 2.249 1.00 0.00 N ATOM 335 CA ALA A 179 0.244 -9.025 0.794 1.00 0.00 C ATOM 336 C ALA A 179 0.805 -10.369 0.342 1.00 0.00 C ATOM 337 O ALA A 179 1.499 -11.049 1.099 1.00 0.00 O ATOM 338 CB ALA A 179 1.080 -7.885 0.233 1.00 0.00 C ATOM 0 H ALA A 179 1.055 -9.197 2.720 1.00 0.00 H new ATOM 0 HA ALA A 179 -0.772 -8.938 0.410 1.00 0.00 H new ATOM 0 HB1 ALA A 179 1.114 -7.959 -0.854 1.00 0.00 H new ATOM 0 HB2 ALA A 179 0.634 -6.932 0.518 1.00 0.00 H new ATOM 0 HB3 ALA A 179 2.092 -7.946 0.632 1.00 0.00 H new ATOM 344 N ARG A 180 0.501 -10.746 -0.895 1.00 0.00 N ATOM 345 CA ARG A 180 0.974 -12.010 -1.447 1.00 0.00 C ATOM 346 C ARG A 180 1.889 -11.771 -2.645 1.00 0.00 C ATOM 347 O ARG A 180 1.782 -10.767 -3.349 1.00 0.00 O ATOM 348 CB ARG A 180 -0.210 -12.885 -1.862 1.00 0.00 C ATOM 349 CG ARG A 180 -1.142 -13.233 -0.713 1.00 0.00 C ATOM 350 CD ARG A 180 -1.880 -14.538 -0.969 1.00 0.00 C ATOM 351 NE ARG A 180 -3.076 -14.339 -1.782 1.00 0.00 N ATOM 352 CZ ARG A 180 -3.777 -15.335 -2.314 1.00 0.00 C ATOM 353 NH1 ARG A 180 -3.402 -16.592 -2.120 1.00 0.00 N ATOM 354 NH2 ARG A 180 -4.855 -15.074 -3.043 1.00 0.00 N ATOM 0 H ARG A 180 -0.071 -10.194 -1.534 1.00 0.00 H new ATOM 0 HA ARG A 180 1.544 -12.525 -0.674 1.00 0.00 H new ATOM 0 HB2 ARG A 180 -0.778 -12.369 -2.636 1.00 0.00 H new ATOM 0 HB3 ARG A 180 0.168 -13.807 -2.304 1.00 0.00 H new ATOM 0 HG2 ARG A 180 -0.568 -13.313 0.210 1.00 0.00 H new ATOM 0 HG3 ARG A 180 -1.863 -12.428 -0.571 1.00 0.00 H new ATOM 0 HD2 ARG A 180 -1.213 -15.239 -1.471 1.00 0.00 H new ATOM 0 HD3 ARG A 180 -2.160 -14.989 -0.017 1.00 0.00 H new ATOM 0 HE ARG A 180 -3.391 -13.384 -1.951 1.00 0.00 H new ATOM 0 HH11 ARG A 180 -2.574 -16.797 -1.561 1.00 0.00 H new ATOM 0 HH12 ARG A 180 -3.942 -17.354 -2.530 1.00 0.00 H new ATOM 0 HH21 ARG A 180 -5.146 -14.108 -3.195 1.00 0.00 H new ATOM 0 HH22 ARG A 180 -5.392 -15.839 -3.451 1.00 0.00 H new ATOM 368 N PRO A 181 2.811 -12.716 -2.883 1.00 0.00 N ATOM 369 CA PRO A 181 3.762 -12.632 -3.996 1.00 0.00 C ATOM 370 C PRO A 181 3.086 -12.811 -5.351 1.00 0.00 C ATOM 371 O PRO A 181 3.736 -12.735 -6.393 1.00 0.00 O ATOM 372 CB PRO A 181 4.729 -13.786 -3.724 1.00 0.00 C ATOM 373 CG PRO A 181 3.940 -14.761 -2.920 1.00 0.00 C ATOM 374 CD PRO A 181 2.995 -13.940 -2.086 1.00 0.00 C ATOM 0 HA PRO A 181 4.245 -11.656 -4.047 1.00 0.00 H new ATOM 0 HB2 PRO A 181 5.082 -14.233 -4.653 1.00 0.00 H new ATOM 0 HB3 PRO A 181 5.609 -13.445 -3.179 1.00 0.00 H new ATOM 0 HG2 PRO A 181 3.394 -15.448 -3.566 1.00 0.00 H new ATOM 0 HG3 PRO A 181 4.592 -15.366 -2.290 1.00 0.00 H new ATOM 0 HD2 PRO A 181 2.050 -14.458 -1.922 1.00 0.00 H new ATOM 0 HD3 PRO A 181 3.413 -13.721 -1.104 1.00 0.00 H new ATOM 382 N GLU A 182 1.778 -13.048 -5.328 1.00 0.00 N ATOM 383 CA GLU A 182 1.015 -13.238 -6.557 1.00 0.00 C ATOM 384 C GLU A 182 0.112 -12.038 -6.827 1.00 0.00 C ATOM 385 O GLU A 182 -0.124 -11.673 -7.979 1.00 0.00 O ATOM 386 CB GLU A 182 0.174 -14.513 -6.469 1.00 0.00 C ATOM 387 CG GLU A 182 1.000 -15.775 -6.282 1.00 0.00 C ATOM 388 CD GLU A 182 1.673 -16.227 -7.563 1.00 0.00 C ATOM 389 OE1 GLU A 182 0.977 -16.328 -8.595 1.00 0.00 O ATOM 390 OE2 GLU A 182 2.896 -16.479 -7.535 1.00 0.00 O ATOM 0 H GLU A 182 1.225 -13.113 -4.473 1.00 0.00 H new ATOM 0 HA GLU A 182 1.721 -13.333 -7.382 1.00 0.00 H new ATOM 0 HB2 GLU A 182 -0.526 -14.420 -5.638 1.00 0.00 H new ATOM 0 HB3 GLU A 182 -0.421 -14.609 -7.377 1.00 0.00 H new ATOM 0 HG2 GLU A 182 1.759 -15.598 -5.520 1.00 0.00 H new ATOM 0 HG3 GLU A 182 0.357 -16.574 -5.912 1.00 0.00 H new ATOM 397 N ASP A 183 -0.389 -11.429 -5.759 1.00 0.00 N ATOM 398 CA ASP A 183 -1.266 -10.270 -5.880 1.00 0.00 C ATOM 399 C ASP A 183 -0.610 -9.178 -6.719 1.00 0.00 C ATOM 400 O ASP A 183 0.583 -9.242 -7.019 1.00 0.00 O ATOM 401 CB ASP A 183 -1.619 -9.724 -4.495 1.00 0.00 C ATOM 402 CG ASP A 183 -2.870 -10.362 -3.923 1.00 0.00 C ATOM 403 OD1 ASP A 183 -2.755 -11.440 -3.302 1.00 0.00 O ATOM 404 OD2 ASP A 183 -3.964 -9.785 -4.097 1.00 0.00 O ATOM 0 H ASP A 183 -0.203 -11.718 -4.799 1.00 0.00 H new ATOM 0 HA ASP A 183 -2.181 -10.588 -6.381 1.00 0.00 H new ATOM 0 HB2 ASP A 183 -0.784 -9.896 -3.816 1.00 0.00 H new ATOM 0 HB3 ASP A 183 -1.761 -8.645 -4.558 1.00 0.00 H new ATOM 409 N THR A 184 -1.397 -8.175 -7.095 1.00 0.00 N ATOM 410 CA THR A 184 -0.894 -7.070 -7.902 1.00 0.00 C ATOM 411 C THR A 184 -0.836 -5.780 -7.091 1.00 0.00 C ATOM 412 O THR A 184 -1.485 -5.659 -6.052 1.00 0.00 O ATOM 413 CB THR A 184 -1.769 -6.841 -9.149 1.00 0.00 C ATOM 414 OG1 THR A 184 -3.138 -6.678 -8.763 1.00 0.00 O ATOM 415 CG2 THR A 184 -1.645 -8.007 -10.118 1.00 0.00 C ATOM 0 H THR A 184 -2.386 -8.105 -6.854 1.00 0.00 H new ATOM 0 HA THR A 184 0.113 -7.342 -8.219 1.00 0.00 H new ATOM 0 HB THR A 184 -1.423 -5.936 -9.648 1.00 0.00 H new ATOM 0 HG1 THR A 184 -3.688 -6.531 -9.561 1.00 0.00 H new ATOM 0 HG21 THR A 184 -2.272 -7.823 -10.991 1.00 0.00 H new ATOM 0 HG22 THR A 184 -0.606 -8.110 -10.432 1.00 0.00 H new ATOM 0 HG23 THR A 184 -1.968 -8.925 -9.626 1.00 0.00 H new ATOM 423 N VAL A 185 -0.056 -4.818 -7.574 1.00 0.00 N ATOM 424 CA VAL A 185 0.085 -3.536 -6.895 1.00 0.00 C ATOM 425 C VAL A 185 -1.237 -2.776 -6.876 1.00 0.00 C ATOM 426 O VAL A 185 -1.625 -2.211 -5.854 1.00 0.00 O ATOM 427 CB VAL A 185 1.158 -2.660 -7.567 1.00 0.00 C ATOM 428 CG1 VAL A 185 1.180 -1.271 -6.947 1.00 0.00 C ATOM 429 CG2 VAL A 185 2.525 -3.320 -7.465 1.00 0.00 C ATOM 0 H VAL A 185 0.488 -4.903 -8.433 1.00 0.00 H new ATOM 0 HA VAL A 185 0.392 -3.752 -5.872 1.00 0.00 H new ATOM 0 HB VAL A 185 0.908 -2.556 -8.623 1.00 0.00 H new ATOM 0 HG11 VAL A 185 1.945 -0.667 -7.435 1.00 0.00 H new ATOM 0 HG12 VAL A 185 0.206 -0.799 -7.078 1.00 0.00 H new ATOM 0 HG13 VAL A 185 1.405 -1.351 -5.883 1.00 0.00 H new ATOM 0 HG21 VAL A 185 3.271 -2.687 -7.945 1.00 0.00 H new ATOM 0 HG22 VAL A 185 2.786 -3.456 -6.415 1.00 0.00 H new ATOM 0 HG23 VAL A 185 2.499 -4.290 -7.961 1.00 0.00 H new ATOM 439 N GLY A 186 -1.924 -2.766 -8.014 1.00 0.00 N ATOM 440 CA GLY A 186 -3.196 -2.073 -8.106 1.00 0.00 C ATOM 441 C GLY A 186 -4.214 -2.594 -7.111 1.00 0.00 C ATOM 442 O GLY A 186 -5.029 -1.833 -6.589 1.00 0.00 O ATOM 0 H GLY A 186 -1.623 -3.225 -8.874 1.00 0.00 H new ATOM 0 HA2 GLY A 186 -3.039 -1.008 -7.936 1.00 0.00 H new ATOM 0 HA3 GLY A 186 -3.592 -2.180 -9.116 1.00 0.00 H new ATOM 446 N THR A 187 -4.170 -3.896 -6.848 1.00 0.00 N ATOM 447 CA THR A 187 -5.097 -4.519 -5.912 1.00 0.00 C ATOM 448 C THR A 187 -4.769 -4.132 -4.474 1.00 0.00 C ATOM 449 O THR A 187 -5.662 -3.818 -3.686 1.00 0.00 O ATOM 450 CB THR A 187 -5.074 -6.054 -6.036 1.00 0.00 C ATOM 451 OG1 THR A 187 -5.801 -6.462 -7.200 1.00 0.00 O ATOM 452 CG2 THR A 187 -5.677 -6.706 -4.801 1.00 0.00 C ATOM 0 H THR A 187 -3.501 -4.540 -7.271 1.00 0.00 H new ATOM 0 HA THR A 187 -6.093 -4.156 -6.165 1.00 0.00 H new ATOM 0 HB THR A 187 -4.036 -6.374 -6.126 1.00 0.00 H new ATOM 0 HG1 THR A 187 -5.176 -6.620 -7.938 1.00 0.00 H new ATOM 0 HG21 THR A 187 -5.650 -7.790 -4.912 1.00 0.00 H new ATOM 0 HG22 THR A 187 -5.104 -6.417 -3.920 1.00 0.00 H new ATOM 0 HG23 THR A 187 -6.710 -6.379 -4.685 1.00 0.00 H new ATOM 460 N LEU A 188 -3.484 -4.155 -4.138 1.00 0.00 N ATOM 461 CA LEU A 188 -3.038 -3.805 -2.794 1.00 0.00 C ATOM 462 C LEU A 188 -3.535 -2.418 -2.400 1.00 0.00 C ATOM 463 O LEU A 188 -4.064 -2.224 -1.305 1.00 0.00 O ATOM 464 CB LEU A 188 -1.511 -3.855 -2.713 1.00 0.00 C ATOM 465 CG LEU A 188 -0.918 -3.986 -1.310 1.00 0.00 C ATOM 466 CD1 LEU A 188 -1.231 -5.353 -0.723 1.00 0.00 C ATOM 467 CD2 LEU A 188 0.585 -3.749 -1.342 1.00 0.00 C ATOM 0 H LEU A 188 -2.732 -4.412 -4.778 1.00 0.00 H new ATOM 0 HA LEU A 188 -3.456 -4.532 -2.098 1.00 0.00 H new ATOM 0 HB2 LEU A 188 -1.163 -4.696 -3.313 1.00 0.00 H new ATOM 0 HB3 LEU A 188 -1.113 -2.950 -3.171 1.00 0.00 H new ATOM 0 HG LEU A 188 -1.372 -3.227 -0.673 1.00 0.00 H new ATOM 0 HD11 LEU A 188 -0.801 -5.427 0.276 1.00 0.00 H new ATOM 0 HD12 LEU A 188 -2.311 -5.485 -0.663 1.00 0.00 H new ATOM 0 HD13 LEU A 188 -0.806 -6.129 -1.360 1.00 0.00 H new ATOM 0 HD21 LEU A 188 0.990 -3.846 -0.335 1.00 0.00 H new ATOM 0 HD22 LEU A 188 1.055 -4.484 -1.995 1.00 0.00 H new ATOM 0 HD23 LEU A 188 0.787 -2.747 -1.719 1.00 0.00 H new ATOM 479 N LYS A 189 -3.363 -1.456 -3.299 1.00 0.00 N ATOM 480 CA LYS A 189 -3.796 -0.086 -3.048 1.00 0.00 C ATOM 481 C LYS A 189 -5.302 -0.027 -2.812 1.00 0.00 C ATOM 482 O LYS A 189 -5.767 0.609 -1.866 1.00 0.00 O ATOM 483 CB LYS A 189 -3.418 0.815 -4.226 1.00 0.00 C ATOM 484 CG LYS A 189 -1.927 0.847 -4.513 1.00 0.00 C ATOM 485 CD LYS A 189 -1.646 1.140 -5.977 1.00 0.00 C ATOM 486 CE LYS A 189 -1.505 2.633 -6.229 1.00 0.00 C ATOM 487 NZ LYS A 189 -0.106 3.100 -6.021 1.00 0.00 N ATOM 0 H LYS A 189 -2.926 -1.599 -4.210 1.00 0.00 H new ATOM 0 HA LYS A 189 -3.290 0.270 -2.150 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -3.944 0.473 -5.117 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -3.762 1.829 -4.022 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -1.452 1.606 -3.892 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -1.483 -0.111 -4.241 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -0.732 0.630 -6.282 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -2.454 0.741 -6.591 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -1.816 2.860 -7.249 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -2.173 3.179 -5.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 0.187 3.688 -6.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -0.053 3.660 -5.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 0.527 2.278 -5.944 1.00 0.00 H new ATOM 501 N SER A 190 -6.059 -0.694 -3.677 1.00 0.00 N ATOM 502 CA SER A 190 -7.513 -0.715 -3.564 1.00 0.00 C ATOM 503 C SER A 190 -7.952 -1.542 -2.359 1.00 0.00 C ATOM 504 O SER A 190 -9.012 -1.304 -1.780 1.00 0.00 O ATOM 505 CB SER A 190 -8.137 -1.282 -4.840 1.00 0.00 C ATOM 506 OG SER A 190 -9.551 -1.196 -4.798 1.00 0.00 O ATOM 0 H SER A 190 -5.690 -1.227 -4.464 1.00 0.00 H new ATOM 0 HA SER A 190 -7.857 0.310 -3.425 1.00 0.00 H new ATOM 0 HB2 SER A 190 -7.762 -0.736 -5.706 1.00 0.00 H new ATOM 0 HB3 SER A 190 -7.836 -2.322 -4.964 1.00 0.00 H new ATOM 0 HG SER A 190 -9.828 -0.275 -4.985 1.00 0.00 H new ATOM 512 N LYS A 191 -7.128 -2.515 -1.986 1.00 0.00 N ATOM 513 CA LYS A 191 -7.428 -3.379 -0.850 1.00 0.00 C ATOM 514 C LYS A 191 -7.417 -2.586 0.454 1.00 0.00 C ATOM 515 O LYS A 191 -8.334 -2.699 1.268 1.00 0.00 O ATOM 516 CB LYS A 191 -6.416 -4.523 -0.771 1.00 0.00 C ATOM 517 CG LYS A 191 -6.958 -5.770 -0.093 1.00 0.00 C ATOM 518 CD LYS A 191 -6.614 -5.794 1.387 1.00 0.00 C ATOM 519 CE LYS A 191 -5.328 -6.564 1.647 1.00 0.00 C ATOM 520 NZ LYS A 191 -5.457 -8.001 1.278 1.00 0.00 N ATOM 0 H LYS A 191 -6.246 -2.725 -2.454 1.00 0.00 H new ATOM 0 HA LYS A 191 -8.425 -3.794 -0.995 1.00 0.00 H new ATOM 0 HB2 LYS A 191 -6.092 -4.780 -1.779 1.00 0.00 H new ATOM 0 HB3 LYS A 191 -5.534 -4.180 -0.230 1.00 0.00 H new ATOM 0 HG2 LYS A 191 -8.040 -5.811 -0.217 1.00 0.00 H new ATOM 0 HG3 LYS A 191 -6.548 -6.656 -0.577 1.00 0.00 H new ATOM 0 HD2 LYS A 191 -6.509 -4.773 1.754 1.00 0.00 H new ATOM 0 HD3 LYS A 191 -7.432 -6.250 1.945 1.00 0.00 H new ATOM 0 HE2 LYS A 191 -4.514 -6.115 1.078 1.00 0.00 H new ATOM 0 HE3 LYS A 191 -5.063 -6.482 2.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 191 -4.812 -8.569 1.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 191 -6.436 -8.314 1.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 191 -5.213 -8.125 0.275 1.00 0.00 H new ATOM 534 N TYR A 192 -6.376 -1.784 0.644 1.00 0.00 N ATOM 535 CA TYR A 192 -6.245 -0.973 1.849 1.00 0.00 C ATOM 536 C TYR A 192 -6.683 0.465 1.588 1.00 0.00 C ATOM 537 O TYR A 192 -7.401 1.063 2.389 1.00 0.00 O ATOM 538 CB TYR A 192 -4.800 -0.996 2.350 1.00 0.00 C ATOM 539 CG TYR A 192 -4.272 -2.388 2.612 1.00 0.00 C ATOM 540 CD1 TYR A 192 -4.769 -3.155 3.659 1.00 0.00 C ATOM 541 CD2 TYR A 192 -3.275 -2.936 1.815 1.00 0.00 C ATOM 542 CE1 TYR A 192 -4.289 -4.427 3.903 1.00 0.00 C ATOM 543 CE2 TYR A 192 -2.790 -4.207 2.050 1.00 0.00 C ATOM 544 CZ TYR A 192 -3.299 -4.949 3.095 1.00 0.00 C ATOM 545 OH TYR A 192 -2.818 -6.216 3.334 1.00 0.00 O ATOM 0 H TYR A 192 -5.610 -1.678 -0.021 1.00 0.00 H new ATOM 0 HA TYR A 192 -6.894 -1.398 2.615 1.00 0.00 H new ATOM 0 HB2 TYR A 192 -4.161 -0.507 1.614 1.00 0.00 H new ATOM 0 HB3 TYR A 192 -4.733 -0.412 3.268 1.00 0.00 H new ATOM 0 HD1 TYR A 192 -5.544 -2.750 4.293 1.00 0.00 H new ATOM 0 HD2 TYR A 192 -2.872 -2.357 0.997 1.00 0.00 H new ATOM 0 HE1 TYR A 192 -4.686 -5.010 4.721 1.00 0.00 H new ATOM 0 HE2 TYR A 192 -2.016 -4.618 1.419 1.00 0.00 H new ATOM 0 HH TYR A 192 -2.600 -6.649 2.482 1.00 0.00 H new ATOM 555 N PHE A 193 -6.244 1.014 0.460 1.00 0.00 N ATOM 556 CA PHE A 193 -6.589 2.382 0.091 1.00 0.00 C ATOM 557 C PHE A 193 -7.508 2.402 -1.127 1.00 0.00 C ATOM 558 O PHE A 193 -7.073 2.596 -2.262 1.00 0.00 O ATOM 559 CB PHE A 193 -5.322 3.190 -0.199 1.00 0.00 C ATOM 560 CG PHE A 193 -4.202 2.912 0.762 1.00 0.00 C ATOM 561 CD1 PHE A 193 -4.392 3.051 2.128 1.00 0.00 C ATOM 562 CD2 PHE A 193 -2.958 2.513 0.300 1.00 0.00 C ATOM 563 CE1 PHE A 193 -3.363 2.797 3.015 1.00 0.00 C ATOM 564 CE2 PHE A 193 -1.926 2.256 1.182 1.00 0.00 C ATOM 565 CZ PHE A 193 -2.128 2.399 2.541 1.00 0.00 C ATOM 0 H PHE A 193 -5.649 0.533 -0.214 1.00 0.00 H new ATOM 0 HA PHE A 193 -7.117 2.835 0.930 1.00 0.00 H new ATOM 0 HB2 PHE A 193 -4.984 2.970 -1.212 1.00 0.00 H new ATOM 0 HB3 PHE A 193 -5.563 4.253 -0.167 1.00 0.00 H new ATOM 0 HD1 PHE A 193 -5.356 3.362 2.504 1.00 0.00 H new ATOM 0 HD2 PHE A 193 -2.793 2.402 -0.762 1.00 0.00 H new ATOM 0 HE1 PHE A 193 -3.524 2.909 4.077 1.00 0.00 H new ATOM 0 HE2 PHE A 193 -0.962 1.943 0.809 1.00 0.00 H new ATOM 0 HZ PHE A 193 -1.322 2.200 3.232 1.00 0.00 H new ATOM 575 N PRO A 194 -8.812 2.195 -0.887 1.00 0.00 N ATOM 576 CA PRO A 194 -9.820 2.184 -1.951 1.00 0.00 C ATOM 577 C PRO A 194 -10.049 3.569 -2.547 1.00 0.00 C ATOM 578 O PRO A 194 -10.253 4.542 -1.822 1.00 0.00 O ATOM 579 CB PRO A 194 -11.083 1.694 -1.238 1.00 0.00 C ATOM 580 CG PRO A 194 -10.880 2.066 0.190 1.00 0.00 C ATOM 581 CD PRO A 194 -9.402 1.956 0.441 1.00 0.00 C ATOM 0 HA PRO A 194 -9.518 1.559 -2.791 1.00 0.00 H new ATOM 0 HB2 PRO A 194 -11.977 2.166 -1.647 1.00 0.00 H new ATOM 0 HB3 PRO A 194 -11.210 0.617 -1.353 1.00 0.00 H new ATOM 0 HG2 PRO A 194 -11.234 3.078 0.384 1.00 0.00 H new ATOM 0 HG3 PRO A 194 -11.438 1.401 0.849 1.00 0.00 H new ATOM 0 HD2 PRO A 194 -9.062 2.692 1.170 1.00 0.00 H new ATOM 0 HD3 PRO A 194 -9.132 0.974 0.830 1.00 0.00 H new ATOM 589 N GLY A 195 -10.014 3.650 -3.874 1.00 0.00 N ATOM 590 CA GLY A 195 -10.220 4.921 -4.545 1.00 0.00 C ATOM 591 C GLY A 195 -9.007 5.826 -4.457 1.00 0.00 C ATOM 592 O GLY A 195 -8.613 6.443 -5.446 1.00 0.00 O ATOM 0 H GLY A 195 -9.847 2.859 -4.496 1.00 0.00 H new ATOM 0 HA2 GLY A 195 -10.460 4.741 -5.593 1.00 0.00 H new ATOM 0 HA3 GLY A 195 -11.079 5.426 -4.104 1.00 0.00 H new ATOM 596 N GLN A 196 -8.416 5.907 -3.269 1.00 0.00 N ATOM 597 CA GLN A 196 -7.242 6.745 -3.056 1.00 0.00 C ATOM 598 C GLN A 196 -6.067 6.262 -3.900 1.00 0.00 C ATOM 599 O GLN A 196 -5.024 6.912 -3.957 1.00 0.00 O ATOM 600 CB GLN A 196 -6.854 6.750 -1.576 1.00 0.00 C ATOM 601 CG GLN A 196 -7.834 7.505 -0.693 1.00 0.00 C ATOM 602 CD GLN A 196 -7.290 7.756 0.700 1.00 0.00 C ATOM 603 OE1 GLN A 196 -7.320 6.873 1.558 1.00 0.00 O ATOM 604 NE2 GLN A 196 -6.790 8.963 0.932 1.00 0.00 N ATOM 0 H GLN A 196 -8.731 5.403 -2.440 1.00 0.00 H new ATOM 0 HA GLN A 196 -7.492 7.761 -3.362 1.00 0.00 H new ATOM 0 HB2 GLN A 196 -6.780 5.721 -1.225 1.00 0.00 H new ATOM 0 HB3 GLN A 196 -5.865 7.195 -1.470 1.00 0.00 H new ATOM 0 HG2 GLN A 196 -8.079 8.459 -1.161 1.00 0.00 H new ATOM 0 HG3 GLN A 196 -8.762 6.938 -0.620 1.00 0.00 H new ATOM 0 HE21 GLN A 196 -6.786 9.664 0.191 1.00 0.00 H new ATOM 0 HE22 GLN A 196 -6.410 9.190 1.851 1.00 0.00 H new ATOM 613 N GLU A 197 -6.245 5.119 -4.554 1.00 0.00 N ATOM 614 CA GLU A 197 -5.199 4.549 -5.395 1.00 0.00 C ATOM 615 C GLU A 197 -4.643 5.596 -6.356 1.00 0.00 C ATOM 616 O GLU A 197 -3.555 5.432 -6.908 1.00 0.00 O ATOM 617 CB GLU A 197 -5.740 3.354 -6.182 1.00 0.00 C ATOM 618 CG GLU A 197 -6.404 2.301 -5.310 1.00 0.00 C ATOM 619 CD GLU A 197 -7.530 1.579 -6.024 1.00 0.00 C ATOM 620 OE1 GLU A 197 -7.351 1.222 -7.207 1.00 0.00 O ATOM 621 OE2 GLU A 197 -8.590 1.369 -5.398 1.00 0.00 O ATOM 0 H GLU A 197 -7.103 4.569 -4.518 1.00 0.00 H new ATOM 0 HA GLU A 197 -4.391 4.211 -4.746 1.00 0.00 H new ATOM 0 HB2 GLU A 197 -6.460 3.711 -6.918 1.00 0.00 H new ATOM 0 HB3 GLU A 197 -4.921 2.893 -6.734 1.00 0.00 H new ATOM 0 HG2 GLU A 197 -5.656 1.575 -4.991 1.00 0.00 H new ATOM 0 HG3 GLU A 197 -6.794 2.774 -4.409 1.00 0.00 H new ATOM 628 N SER A 198 -5.399 6.672 -6.552 1.00 0.00 N ATOM 629 CA SER A 198 -4.985 7.744 -7.450 1.00 0.00 C ATOM 630 C SER A 198 -3.789 8.500 -6.878 1.00 0.00 C ATOM 631 O SER A 198 -2.815 8.763 -7.582 1.00 0.00 O ATOM 632 CB SER A 198 -6.146 8.711 -7.692 1.00 0.00 C ATOM 633 OG SER A 198 -5.757 9.768 -8.552 1.00 0.00 O ATOM 0 H SER A 198 -6.301 6.824 -6.101 1.00 0.00 H new ATOM 0 HA SER A 198 -4.690 7.297 -8.399 1.00 0.00 H new ATOM 0 HB2 SER A 198 -6.987 8.173 -8.129 1.00 0.00 H new ATOM 0 HB3 SER A 198 -6.488 9.119 -6.741 1.00 0.00 H new ATOM 0 HG SER A 198 -6.516 10.372 -8.693 1.00 0.00 H new ATOM 639 N GLN A 199 -3.873 8.845 -5.597 1.00 0.00 N ATOM 640 CA GLN A 199 -2.798 9.571 -4.931 1.00 0.00 C ATOM 641 C GLN A 199 -1.826 8.608 -4.257 1.00 0.00 C ATOM 642 O GLN A 199 -0.610 8.749 -4.383 1.00 0.00 O ATOM 643 CB GLN A 199 -3.374 10.540 -3.897 1.00 0.00 C ATOM 644 CG GLN A 199 -4.273 11.608 -4.498 1.00 0.00 C ATOM 645 CD GLN A 199 -5.335 12.089 -3.530 1.00 0.00 C ATOM 646 OE1 GLN A 199 -5.307 11.758 -2.344 1.00 0.00 O ATOM 647 NE2 GLN A 199 -6.280 12.877 -4.030 1.00 0.00 N ATOM 0 H GLN A 199 -4.673 8.634 -5.001 1.00 0.00 H new ATOM 0 HA GLN A 199 -2.254 10.138 -5.686 1.00 0.00 H new ATOM 0 HB2 GLN A 199 -3.941 9.974 -3.157 1.00 0.00 H new ATOM 0 HB3 GLN A 199 -2.553 11.024 -3.368 1.00 0.00 H new ATOM 0 HG2 GLN A 199 -3.664 12.455 -4.813 1.00 0.00 H new ATOM 0 HG3 GLN A 199 -4.754 11.211 -5.392 1.00 0.00 H new ATOM 0 HE21 GLN A 199 -6.265 13.127 -5.019 1.00 0.00 H new ATOM 0 HE22 GLN A 199 -7.020 13.233 -3.425 1.00 0.00 H new ATOM 656 N MET A 200 -2.371 7.629 -3.542 1.00 0.00 N ATOM 657 CA MET A 200 -1.551 6.642 -2.849 1.00 0.00 C ATOM 658 C MET A 200 -0.601 5.947 -3.819 1.00 0.00 C ATOM 659 O MET A 200 -0.904 4.874 -4.340 1.00 0.00 O ATOM 660 CB MET A 200 -2.439 5.606 -2.157 1.00 0.00 C ATOM 661 CG MET A 200 -2.990 6.074 -0.820 1.00 0.00 C ATOM 662 SD MET A 200 -3.454 7.816 -0.831 1.00 0.00 S ATOM 663 CE MET A 200 -1.987 8.562 -0.124 1.00 0.00 C ATOM 0 H MET A 200 -3.376 7.498 -3.427 1.00 0.00 H new ATOM 0 HA MET A 200 -0.958 7.162 -2.097 1.00 0.00 H new ATOM 0 HB2 MET A 200 -3.270 5.354 -2.815 1.00 0.00 H new ATOM 0 HB3 MET A 200 -1.865 4.692 -2.004 1.00 0.00 H new ATOM 0 HG2 MET A 200 -3.860 5.472 -0.559 1.00 0.00 H new ATOM 0 HG3 MET A 200 -2.243 5.906 -0.045 1.00 0.00 H new ATOM 0 HE1 MET A 200 -2.246 9.060 0.810 1.00 0.00 H new ATOM 0 HE2 MET A 200 -1.244 7.789 0.071 1.00 0.00 H new ATOM 0 HE3 MET A 200 -1.577 9.291 -0.823 1.00 0.00 H new ATOM 673 N LYS A 201 0.550 6.567 -4.058 1.00 0.00 N ATOM 674 CA LYS A 201 1.547 6.008 -4.964 1.00 0.00 C ATOM 675 C LYS A 201 2.600 5.218 -4.195 1.00 0.00 C ATOM 676 O LYS A 201 3.255 5.748 -3.296 1.00 0.00 O ATOM 677 CB LYS A 201 2.217 7.125 -5.768 1.00 0.00 C ATOM 678 CG LYS A 201 1.514 7.439 -7.077 1.00 0.00 C ATOM 679 CD LYS A 201 2.350 8.355 -7.953 1.00 0.00 C ATOM 680 CE LYS A 201 2.117 9.819 -7.612 1.00 0.00 C ATOM 681 NZ LYS A 201 2.984 10.272 -6.489 1.00 0.00 N ATOM 0 H LYS A 201 0.816 7.457 -3.637 1.00 0.00 H new ATOM 0 HA LYS A 201 1.039 5.329 -5.649 1.00 0.00 H new ATOM 0 HB2 LYS A 201 2.253 8.028 -5.159 1.00 0.00 H new ATOM 0 HB3 LYS A 201 3.248 6.841 -5.978 1.00 0.00 H new ATOM 0 HG2 LYS A 201 1.307 6.512 -7.612 1.00 0.00 H new ATOM 0 HG3 LYS A 201 0.552 7.909 -6.871 1.00 0.00 H new ATOM 0 HD2 LYS A 201 3.406 8.115 -7.828 1.00 0.00 H new ATOM 0 HD3 LYS A 201 2.105 8.181 -9.001 1.00 0.00 H new ATOM 0 HE2 LYS A 201 2.312 10.432 -8.492 1.00 0.00 H new ATOM 0 HE3 LYS A 201 1.071 9.968 -7.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 201 2.390 10.632 -5.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 201 3.553 9.472 -6.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 201 3.616 11.028 -6.821 1.00 0.00 H new ATOM 695 N LEU A 202 2.760 3.949 -4.553 1.00 0.00 N ATOM 696 CA LEU A 202 3.736 3.085 -3.897 1.00 0.00 C ATOM 697 C LEU A 202 5.062 3.092 -4.650 1.00 0.00 C ATOM 698 O LEU A 202 5.089 3.054 -5.881 1.00 0.00 O ATOM 699 CB LEU A 202 3.199 1.656 -3.801 1.00 0.00 C ATOM 700 CG LEU A 202 1.756 1.513 -3.314 1.00 0.00 C ATOM 701 CD1 LEU A 202 1.471 0.076 -2.904 1.00 0.00 C ATOM 702 CD2 LEU A 202 1.487 2.463 -2.157 1.00 0.00 C ATOM 0 H LEU A 202 2.226 3.495 -5.294 1.00 0.00 H new ATOM 0 HA LEU A 202 3.908 3.470 -2.892 1.00 0.00 H new ATOM 0 HB2 LEU A 202 3.277 1.193 -4.785 1.00 0.00 H new ATOM 0 HB3 LEU A 202 3.846 1.090 -3.130 1.00 0.00 H new ATOM 0 HG LEU A 202 1.088 1.774 -4.135 1.00 0.00 H new ATOM 0 HD11 LEU A 202 0.440 -0.007 -2.560 1.00 0.00 H new ATOM 0 HD12 LEU A 202 1.623 -0.583 -3.759 1.00 0.00 H new ATOM 0 HD13 LEU A 202 2.146 -0.213 -2.099 1.00 0.00 H new ATOM 0 HD21 LEU A 202 0.456 2.347 -1.824 1.00 0.00 H new ATOM 0 HD22 LEU A 202 2.163 2.233 -1.333 1.00 0.00 H new ATOM 0 HD23 LEU A 202 1.650 3.490 -2.484 1.00 0.00 H new ATOM 714 N ILE A 203 6.160 3.140 -3.903 1.00 0.00 N ATOM 715 CA ILE A 203 7.490 3.148 -4.501 1.00 0.00 C ATOM 716 C ILE A 203 8.385 2.089 -3.866 1.00 0.00 C ATOM 717 O ILE A 203 8.597 2.087 -2.653 1.00 0.00 O ATOM 718 CB ILE A 203 8.163 4.526 -4.357 1.00 0.00 C ATOM 719 CG1 ILE A 203 7.344 5.596 -5.081 1.00 0.00 C ATOM 720 CG2 ILE A 203 9.583 4.481 -4.900 1.00 0.00 C ATOM 721 CD1 ILE A 203 7.519 6.984 -4.505 1.00 0.00 C ATOM 0 H ILE A 203 6.155 3.174 -2.884 1.00 0.00 H new ATOM 0 HA ILE A 203 7.361 2.924 -5.560 1.00 0.00 H new ATOM 0 HB ILE A 203 8.207 4.783 -3.299 1.00 0.00 H new ATOM 0 HG12 ILE A 203 7.628 5.610 -6.133 1.00 0.00 H new ATOM 0 HG13 ILE A 203 6.289 5.325 -5.039 1.00 0.00 H new ATOM 0 HG21 ILE A 203 10.045 5.462 -4.791 1.00 0.00 H new ATOM 0 HG22 ILE A 203 10.162 3.743 -4.344 1.00 0.00 H new ATOM 0 HG23 ILE A 203 9.561 4.205 -5.954 1.00 0.00 H new ATOM 0 HD11 ILE A 203 6.909 7.691 -5.068 1.00 0.00 H new ATOM 0 HD12 ILE A 203 7.207 6.987 -3.461 1.00 0.00 H new ATOM 0 HD13 ILE A 203 8.567 7.276 -4.571 1.00 0.00 H new ATOM 733 N TYR A 204 8.908 1.192 -4.693 1.00 0.00 N ATOM 734 CA TYR A 204 9.780 0.126 -4.213 1.00 0.00 C ATOM 735 C TYR A 204 11.186 0.272 -4.788 1.00 0.00 C ATOM 736 O TYR A 204 11.372 0.276 -6.004 1.00 0.00 O ATOM 737 CB TYR A 204 9.203 -1.241 -4.585 1.00 0.00 C ATOM 738 CG TYR A 204 10.061 -2.402 -4.137 1.00 0.00 C ATOM 739 CD1 TYR A 204 9.963 -2.906 -2.846 1.00 0.00 C ATOM 740 CD2 TYR A 204 10.969 -2.997 -5.005 1.00 0.00 C ATOM 741 CE1 TYR A 204 10.745 -3.967 -2.432 1.00 0.00 C ATOM 742 CE2 TYR A 204 11.754 -4.059 -4.600 1.00 0.00 C ATOM 743 CZ TYR A 204 11.639 -4.540 -3.313 1.00 0.00 C ATOM 744 OH TYR A 204 12.419 -5.598 -2.904 1.00 0.00 O ATOM 0 H TYR A 204 8.744 1.181 -5.700 1.00 0.00 H new ATOM 0 HA TYR A 204 9.841 0.203 -3.127 1.00 0.00 H new ATOM 0 HB2 TYR A 204 8.212 -1.340 -4.142 1.00 0.00 H new ATOM 0 HB3 TYR A 204 9.076 -1.290 -5.666 1.00 0.00 H new ATOM 0 HD1 TYR A 204 9.263 -2.461 -2.154 1.00 0.00 H new ATOM 0 HD2 TYR A 204 11.062 -2.622 -6.014 1.00 0.00 H new ATOM 0 HE1 TYR A 204 10.657 -4.346 -1.424 1.00 0.00 H new ATOM 0 HE2 TYR A 204 12.454 -4.510 -5.288 1.00 0.00 H new ATOM 0 HH TYR A 204 11.843 -6.336 -2.613 1.00 0.00 H new ATOM 754 N GLN A 205 12.171 0.390 -3.903 1.00 0.00 N ATOM 755 CA GLN A 205 13.560 0.535 -4.323 1.00 0.00 C ATOM 756 C GLN A 205 13.723 1.727 -5.260 1.00 0.00 C ATOM 757 O GLN A 205 14.352 1.620 -6.312 1.00 0.00 O ATOM 758 CB GLN A 205 14.043 -0.742 -5.012 1.00 0.00 C ATOM 759 CG GLN A 205 13.945 -1.981 -4.137 1.00 0.00 C ATOM 760 CD GLN A 205 15.213 -2.238 -3.346 1.00 0.00 C ATOM 761 OE1 GLN A 205 15.819 -1.314 -2.803 1.00 0.00 O ATOM 762 NE2 GLN A 205 15.622 -3.500 -3.277 1.00 0.00 N ATOM 0 H GLN A 205 12.033 0.388 -2.892 1.00 0.00 H new ATOM 0 HA GLN A 205 14.166 0.710 -3.434 1.00 0.00 H new ATOM 0 HB2 GLN A 205 13.457 -0.900 -5.918 1.00 0.00 H new ATOM 0 HB3 GLN A 205 15.079 -0.608 -5.322 1.00 0.00 H new ATOM 0 HG2 GLN A 205 13.108 -1.869 -3.448 1.00 0.00 H new ATOM 0 HG3 GLN A 205 13.730 -2.847 -4.763 1.00 0.00 H new ATOM 0 HE21 GLN A 205 15.089 -4.235 -3.742 1.00 0.00 H new ATOM 0 HE22 GLN A 205 16.469 -3.734 -2.759 1.00 0.00 H new ATOM 771 N GLY A 206 13.152 2.863 -4.871 1.00 0.00 N ATOM 772 CA GLY A 206 13.246 4.058 -5.689 1.00 0.00 C ATOM 773 C GLY A 206 12.487 3.928 -6.995 1.00 0.00 C ATOM 774 O GLY A 206 12.622 4.768 -7.885 1.00 0.00 O ATOM 0 H GLY A 206 12.626 2.977 -4.004 1.00 0.00 H new ATOM 0 HA2 GLY A 206 12.857 4.909 -5.130 1.00 0.00 H new ATOM 0 HA3 GLY A 206 14.294 4.268 -5.901 1.00 0.00 H new ATOM 778 N ARG A 207 11.688 2.873 -7.110 1.00 0.00 N ATOM 779 CA ARG A 207 10.907 2.635 -8.318 1.00 0.00 C ATOM 780 C ARG A 207 9.417 2.826 -8.049 1.00 0.00 C ATOM 781 O ARG A 207 8.888 2.337 -7.050 1.00 0.00 O ATOM 782 CB ARG A 207 11.163 1.222 -8.846 1.00 0.00 C ATOM 783 CG ARG A 207 10.855 1.060 -10.326 1.00 0.00 C ATOM 784 CD ARG A 207 11.295 -0.302 -10.840 1.00 0.00 C ATOM 785 NE ARG A 207 12.739 -0.367 -11.052 1.00 0.00 N ATOM 786 CZ ARG A 207 13.603 -0.741 -10.116 1.00 0.00 C ATOM 787 NH1 ARG A 207 13.172 -1.082 -8.909 1.00 0.00 N ATOM 788 NH2 ARG A 207 14.902 -0.774 -10.385 1.00 0.00 N ATOM 0 H ARG A 207 11.564 2.169 -6.382 1.00 0.00 H new ATOM 0 HA ARG A 207 11.219 3.359 -9.070 1.00 0.00 H new ATOM 0 HB2 ARG A 207 12.207 0.961 -8.670 1.00 0.00 H new ATOM 0 HB3 ARG A 207 10.558 0.516 -8.278 1.00 0.00 H new ATOM 0 HG2 ARG A 207 9.785 1.185 -10.492 1.00 0.00 H new ATOM 0 HG3 ARG A 207 11.359 1.844 -10.892 1.00 0.00 H new ATOM 0 HD2 ARG A 207 10.998 -1.072 -10.127 1.00 0.00 H new ATOM 0 HD3 ARG A 207 10.781 -0.519 -11.776 1.00 0.00 H new ATOM 0 HE ARG A 207 13.103 -0.111 -11.970 1.00 0.00 H new ATOM 0 HH11 ARG A 207 12.174 -1.057 -8.698 1.00 0.00 H new ATOM 0 HH12 ARG A 207 13.838 -1.369 -8.192 1.00 0.00 H new ATOM 0 HH21 ARG A 207 15.238 -0.512 -11.312 1.00 0.00 H new ATOM 0 HH22 ARG A 207 15.565 -1.062 -9.665 1.00 0.00 H new ATOM 802 N LEU A 208 8.747 3.541 -8.946 1.00 0.00 N ATOM 803 CA LEU A 208 7.318 3.799 -8.806 1.00 0.00 C ATOM 804 C LEU A 208 6.499 2.609 -9.296 1.00 0.00 C ATOM 805 O LEU A 208 6.650 2.165 -10.436 1.00 0.00 O ATOM 806 CB LEU A 208 6.927 5.056 -9.584 1.00 0.00 C ATOM 807 CG LEU A 208 5.506 5.573 -9.356 1.00 0.00 C ATOM 808 CD1 LEU A 208 5.253 5.804 -7.874 1.00 0.00 C ATOM 809 CD2 LEU A 208 5.270 6.853 -10.144 1.00 0.00 C ATOM 0 H LEU A 208 9.170 3.952 -9.778 1.00 0.00 H new ATOM 0 HA LEU A 208 7.104 3.953 -7.748 1.00 0.00 H new ATOM 0 HB2 LEU A 208 7.627 5.851 -9.326 1.00 0.00 H new ATOM 0 HB3 LEU A 208 7.052 4.854 -10.648 1.00 0.00 H new ATOM 0 HG LEU A 208 4.805 4.817 -9.710 1.00 0.00 H new ATOM 0 HD11 LEU A 208 4.237 6.172 -7.731 1.00 0.00 H new ATOM 0 HD12 LEU A 208 5.379 4.866 -7.333 1.00 0.00 H new ATOM 0 HD13 LEU A 208 5.962 6.540 -7.494 1.00 0.00 H new ATOM 0 HD21 LEU A 208 4.254 7.206 -9.969 1.00 0.00 H new ATOM 0 HD22 LEU A 208 5.979 7.615 -9.821 1.00 0.00 H new ATOM 0 HD23 LEU A 208 5.408 6.656 -11.207 1.00 0.00 H new ATOM 821 N LEU A 209 5.631 2.097 -8.431 1.00 0.00 N ATOM 822 CA LEU A 209 4.786 0.960 -8.777 1.00 0.00 C ATOM 823 C LEU A 209 3.606 1.399 -9.638 1.00 0.00 C ATOM 824 O LEU A 209 2.469 0.993 -9.403 1.00 0.00 O ATOM 825 CB LEU A 209 4.277 0.273 -7.508 1.00 0.00 C ATOM 826 CG LEU A 209 5.324 -0.001 -6.428 1.00 0.00 C ATOM 827 CD1 LEU A 209 4.829 -1.067 -5.463 1.00 0.00 C ATOM 828 CD2 LEU A 209 6.644 -0.422 -7.058 1.00 0.00 C ATOM 0 H LEU A 209 5.494 2.451 -7.484 1.00 0.00 H new ATOM 0 HA LEU A 209 5.387 0.254 -9.350 1.00 0.00 H new ATOM 0 HB2 LEU A 209 3.490 0.891 -7.075 1.00 0.00 H new ATOM 0 HB3 LEU A 209 3.819 -0.675 -7.791 1.00 0.00 H new ATOM 0 HG LEU A 209 5.489 0.919 -5.868 1.00 0.00 H new ATOM 0 HD11 LEU A 209 5.587 -1.249 -4.701 1.00 0.00 H new ATOM 0 HD12 LEU A 209 3.910 -0.727 -4.986 1.00 0.00 H new ATOM 0 HD13 LEU A 209 4.635 -1.990 -6.009 1.00 0.00 H new ATOM 0 HD21 LEU A 209 7.377 -0.613 -6.274 1.00 0.00 H new ATOM 0 HD22 LEU A 209 6.495 -1.329 -7.644 1.00 0.00 H new ATOM 0 HD23 LEU A 209 7.007 0.374 -7.708 1.00 0.00 H new ATOM 840 N GLN A 210 3.887 2.230 -10.637 1.00 0.00 N ATOM 841 CA GLN A 210 2.849 2.723 -11.535 1.00 0.00 C ATOM 842 C GLN A 210 1.958 1.582 -12.015 1.00 0.00 C ATOM 843 O GLN A 210 0.815 1.447 -11.578 1.00 0.00 O ATOM 844 CB GLN A 210 3.478 3.435 -12.734 1.00 0.00 C ATOM 845 CG GLN A 210 4.144 4.754 -12.377 1.00 0.00 C ATOM 846 CD GLN A 210 4.431 5.610 -13.594 1.00 0.00 C ATOM 847 OE1 GLN A 210 3.645 5.648 -14.541 1.00 0.00 O ATOM 848 NE2 GLN A 210 5.563 6.304 -13.576 1.00 0.00 N ATOM 0 H GLN A 210 4.824 2.576 -10.845 1.00 0.00 H new ATOM 0 HA GLN A 210 2.233 3.433 -10.983 1.00 0.00 H new ATOM 0 HB2 GLN A 210 4.217 2.776 -13.191 1.00 0.00 H new ATOM 0 HB3 GLN A 210 2.707 3.618 -13.483 1.00 0.00 H new ATOM 0 HG2 GLN A 210 3.502 5.307 -11.692 1.00 0.00 H new ATOM 0 HG3 GLN A 210 5.077 4.555 -11.849 1.00 0.00 H new ATOM 0 HE21 GLN A 210 6.186 6.243 -12.770 1.00 0.00 H new ATOM 0 HE22 GLN A 210 5.810 6.898 -14.368 1.00 0.00 H new ATOM 857 N ASP A 211 2.489 0.763 -12.917 1.00 0.00 N ATOM 858 CA ASP A 211 1.742 -0.367 -13.457 1.00 0.00 C ATOM 859 C ASP A 211 1.108 -1.184 -12.337 1.00 0.00 C ATOM 860 O ASP A 211 1.780 -1.921 -11.615 1.00 0.00 O ATOM 861 CB ASP A 211 2.659 -1.256 -14.298 1.00 0.00 C ATOM 862 CG ASP A 211 3.368 -0.485 -15.394 1.00 0.00 C ATOM 863 OD1 ASP A 211 2.771 -0.312 -16.477 1.00 0.00 O ATOM 864 OD2 ASP A 211 4.519 -0.057 -15.170 1.00 0.00 O ATOM 0 H ASP A 211 3.434 0.861 -13.289 1.00 0.00 H new ATOM 0 HA ASP A 211 0.947 0.024 -14.091 1.00 0.00 H new ATOM 0 HB2 ASP A 211 3.400 -1.725 -13.650 1.00 0.00 H new ATOM 0 HB3 ASP A 211 2.072 -2.059 -14.744 1.00 0.00 H new ATOM 869 N PRO A 212 -0.218 -1.052 -12.185 1.00 0.00 N ATOM 870 CA PRO A 212 -0.973 -1.770 -11.153 1.00 0.00 C ATOM 871 C PRO A 212 -1.056 -3.267 -11.432 1.00 0.00 C ATOM 872 O PRO A 212 -1.675 -4.015 -10.676 1.00 0.00 O ATOM 873 CB PRO A 212 -2.364 -1.135 -11.224 1.00 0.00 C ATOM 874 CG PRO A 212 -2.472 -0.614 -12.616 1.00 0.00 C ATOM 875 CD PRO A 212 -1.084 -0.191 -13.009 1.00 0.00 C ATOM 0 HA PRO A 212 -0.502 -1.689 -10.173 1.00 0.00 H new ATOM 0 HB2 PRO A 212 -3.144 -1.866 -11.013 1.00 0.00 H new ATOM 0 HB3 PRO A 212 -2.472 -0.334 -10.492 1.00 0.00 H new ATOM 0 HG2 PRO A 212 -2.852 -1.381 -13.291 1.00 0.00 H new ATOM 0 HG3 PRO A 212 -3.165 0.226 -12.666 1.00 0.00 H new ATOM 0 HD2 PRO A 212 -0.904 -0.342 -14.073 1.00 0.00 H new ATOM 0 HD3 PRO A 212 -0.913 0.866 -12.803 1.00 0.00 H new ATOM 883 N ALA A 213 -0.428 -3.696 -12.522 1.00 0.00 N ATOM 884 CA ALA A 213 -0.429 -5.105 -12.899 1.00 0.00 C ATOM 885 C ALA A 213 0.952 -5.724 -12.712 1.00 0.00 C ATOM 886 O ALA A 213 1.342 -6.628 -13.451 1.00 0.00 O ATOM 887 CB ALA A 213 -0.891 -5.265 -14.339 1.00 0.00 C ATOM 0 H ALA A 213 0.088 -3.089 -13.159 1.00 0.00 H new ATOM 0 HA ALA A 213 -1.125 -5.631 -12.245 1.00 0.00 H new ATOM 0 HB1 ALA A 213 -0.887 -6.321 -14.607 1.00 0.00 H new ATOM 0 HB2 ALA A 213 -1.901 -4.868 -14.443 1.00 0.00 H new ATOM 0 HB3 ALA A 213 -0.217 -4.720 -15.000 1.00 0.00 H new ATOM 893 N ARG A 214 1.687 -5.231 -11.721 1.00 0.00 N ATOM 894 CA ARG A 214 3.026 -5.735 -11.439 1.00 0.00 C ATOM 895 C ARG A 214 3.022 -6.625 -10.200 1.00 0.00 C ATOM 896 O ARG A 214 2.997 -6.136 -9.070 1.00 0.00 O ATOM 897 CB ARG A 214 4.001 -4.572 -11.242 1.00 0.00 C ATOM 898 CG ARG A 214 4.517 -3.983 -12.545 1.00 0.00 C ATOM 899 CD ARG A 214 5.508 -4.914 -13.224 1.00 0.00 C ATOM 900 NE ARG A 214 5.450 -4.807 -14.680 1.00 0.00 N ATOM 901 CZ ARG A 214 6.152 -3.923 -15.380 1.00 0.00 C ATOM 902 NH1 ARG A 214 6.960 -3.073 -14.761 1.00 0.00 N ATOM 903 NH2 ARG A 214 6.046 -3.888 -16.702 1.00 0.00 N ATOM 0 H ARG A 214 1.378 -4.483 -11.100 1.00 0.00 H new ATOM 0 HA ARG A 214 3.350 -6.331 -12.292 1.00 0.00 H new ATOM 0 HB2 ARG A 214 3.507 -3.788 -10.669 1.00 0.00 H new ATOM 0 HB3 ARG A 214 4.848 -4.915 -10.648 1.00 0.00 H new ATOM 0 HG2 ARG A 214 3.679 -3.790 -13.215 1.00 0.00 H new ATOM 0 HG3 ARG A 214 4.994 -3.023 -12.348 1.00 0.00 H new ATOM 0 HD2 ARG A 214 6.517 -4.681 -12.883 1.00 0.00 H new ATOM 0 HD3 ARG A 214 5.301 -5.942 -12.927 1.00 0.00 H new ATOM 0 HE ARG A 214 4.837 -5.446 -15.186 1.00 0.00 H new ATOM 0 HH11 ARG A 214 7.044 -3.097 -13.745 1.00 0.00 H new ATOM 0 HH12 ARG A 214 7.498 -2.395 -15.301 1.00 0.00 H new ATOM 0 HH21 ARG A 214 5.425 -4.540 -17.181 1.00 0.00 H new ATOM 0 HH22 ARG A 214 6.585 -3.209 -17.239 1.00 0.00 H new ATOM 917 N THR A 215 3.047 -7.936 -10.419 1.00 0.00 N ATOM 918 CA THR A 215 3.044 -8.895 -9.321 1.00 0.00 C ATOM 919 C THR A 215 4.091 -8.534 -8.274 1.00 0.00 C ATOM 920 O THR A 215 5.190 -8.087 -8.607 1.00 0.00 O ATOM 921 CB THR A 215 3.311 -10.326 -9.825 1.00 0.00 C ATOM 922 OG1 THR A 215 4.518 -10.358 -10.594 1.00 0.00 O ATOM 923 CG2 THR A 215 2.151 -10.827 -10.672 1.00 0.00 C ATOM 0 H THR A 215 3.070 -8.358 -11.347 1.00 0.00 H new ATOM 0 HA THR A 215 2.053 -8.856 -8.869 1.00 0.00 H new ATOM 0 HB THR A 215 3.416 -10.978 -8.958 1.00 0.00 H new ATOM 0 HG1 THR A 215 4.681 -11.272 -10.909 1.00 0.00 H new ATOM 0 HG21 THR A 215 2.363 -11.839 -11.016 1.00 0.00 H new ATOM 0 HG22 THR A 215 1.239 -10.830 -10.075 1.00 0.00 H new ATOM 0 HG23 THR A 215 2.019 -10.171 -11.533 1.00 0.00 H new ATOM 931 N LEU A 216 3.745 -8.730 -7.006 1.00 0.00 N ATOM 932 CA LEU A 216 4.656 -8.426 -5.908 1.00 0.00 C ATOM 933 C LEU A 216 5.933 -9.254 -6.014 1.00 0.00 C ATOM 934 O LEU A 216 7.022 -8.778 -5.692 1.00 0.00 O ATOM 935 CB LEU A 216 3.974 -8.690 -4.565 1.00 0.00 C ATOM 936 CG LEU A 216 2.486 -8.346 -4.489 1.00 0.00 C ATOM 937 CD1 LEU A 216 2.067 -8.103 -3.047 1.00 0.00 C ATOM 938 CD2 LEU A 216 2.175 -7.129 -5.349 1.00 0.00 C ATOM 0 H LEU A 216 2.840 -9.098 -6.713 1.00 0.00 H new ATOM 0 HA LEU A 216 4.923 -7.371 -5.972 1.00 0.00 H new ATOM 0 HB2 LEU A 216 4.096 -9.745 -4.320 1.00 0.00 H new ATOM 0 HB3 LEU A 216 4.498 -8.122 -3.796 1.00 0.00 H new ATOM 0 HG LEU A 216 1.917 -9.193 -4.873 1.00 0.00 H new ATOM 0 HD11 LEU A 216 1.005 -7.860 -3.013 1.00 0.00 H new ATOM 0 HD12 LEU A 216 2.253 -9.001 -2.458 1.00 0.00 H new ATOM 0 HD13 LEU A 216 2.643 -7.274 -2.636 1.00 0.00 H new ATOM 0 HD21 LEU A 216 1.112 -6.899 -5.283 1.00 0.00 H new ATOM 0 HD22 LEU A 216 2.754 -6.276 -4.995 1.00 0.00 H new ATOM 0 HD23 LEU A 216 2.437 -7.340 -6.386 1.00 0.00 H new ATOM 950 N SER A 217 5.791 -10.494 -6.471 1.00 0.00 N ATOM 951 CA SER A 217 6.933 -11.389 -6.618 1.00 0.00 C ATOM 952 C SER A 217 7.955 -10.810 -7.592 1.00 0.00 C ATOM 953 O SER A 217 9.162 -10.885 -7.360 1.00 0.00 O ATOM 954 CB SER A 217 6.471 -12.764 -7.104 1.00 0.00 C ATOM 955 OG SER A 217 7.575 -13.578 -7.459 1.00 0.00 O ATOM 0 H SER A 217 4.897 -10.902 -6.746 1.00 0.00 H new ATOM 0 HA SER A 217 7.407 -11.497 -5.642 1.00 0.00 H new ATOM 0 HB2 SER A 217 5.891 -13.254 -6.322 1.00 0.00 H new ATOM 0 HB3 SER A 217 5.811 -12.646 -7.963 1.00 0.00 H new ATOM 0 HG SER A 217 7.253 -14.451 -7.765 1.00 0.00 H new ATOM 961 N SER A 218 7.462 -10.233 -8.683 1.00 0.00 N ATOM 962 CA SER A 218 8.332 -9.644 -9.695 1.00 0.00 C ATOM 963 C SER A 218 8.986 -8.368 -9.173 1.00 0.00 C ATOM 964 O SER A 218 10.101 -8.023 -9.566 1.00 0.00 O ATOM 965 CB SER A 218 7.537 -9.340 -10.966 1.00 0.00 C ATOM 966 OG SER A 218 8.385 -8.864 -11.997 1.00 0.00 O ATOM 0 H SER A 218 6.466 -10.161 -8.889 1.00 0.00 H new ATOM 0 HA SER A 218 9.116 -10.364 -9.929 1.00 0.00 H new ATOM 0 HB2 SER A 218 7.023 -10.241 -11.301 1.00 0.00 H new ATOM 0 HB3 SER A 218 6.770 -8.597 -10.750 1.00 0.00 H new ATOM 0 HG SER A 218 7.853 -8.679 -12.799 1.00 0.00 H new ATOM 972 N LEU A 219 8.284 -7.671 -8.286 1.00 0.00 N ATOM 973 CA LEU A 219 8.795 -6.433 -7.709 1.00 0.00 C ATOM 974 C LEU A 219 9.758 -6.723 -6.562 1.00 0.00 C ATOM 975 O LEU A 219 10.227 -5.808 -5.886 1.00 0.00 O ATOM 976 CB LEU A 219 7.639 -5.564 -7.212 1.00 0.00 C ATOM 977 CG LEU A 219 6.633 -5.114 -8.273 1.00 0.00 C ATOM 978 CD1 LEU A 219 5.350 -4.625 -7.619 1.00 0.00 C ATOM 979 CD2 LEU A 219 7.234 -4.025 -9.150 1.00 0.00 C ATOM 0 H LEU A 219 7.360 -7.942 -7.951 1.00 0.00 H new ATOM 0 HA LEU A 219 9.337 -5.896 -8.487 1.00 0.00 H new ATOM 0 HB2 LEU A 219 7.101 -6.116 -6.441 1.00 0.00 H new ATOM 0 HB3 LEU A 219 8.056 -4.677 -6.736 1.00 0.00 H new ATOM 0 HG LEU A 219 6.392 -5.970 -8.904 1.00 0.00 H new ATOM 0 HD11 LEU A 219 4.646 -4.309 -8.389 1.00 0.00 H new ATOM 0 HD12 LEU A 219 4.909 -5.432 -7.034 1.00 0.00 H new ATOM 0 HD13 LEU A 219 5.573 -3.783 -6.964 1.00 0.00 H new ATOM 0 HD21 LEU A 219 6.504 -3.717 -9.899 1.00 0.00 H new ATOM 0 HD22 LEU A 219 7.504 -3.168 -8.533 1.00 0.00 H new ATOM 0 HD23 LEU A 219 8.125 -4.409 -9.647 1.00 0.00 H new ATOM 991 N ASN A 220 10.049 -8.002 -6.350 1.00 0.00 N ATOM 992 CA ASN A 220 10.957 -8.413 -5.286 1.00 0.00 C ATOM 993 C ASN A 220 10.408 -8.016 -3.919 1.00 0.00 C ATOM 994 O ASN A 220 11.168 -7.711 -2.998 1.00 0.00 O ATOM 995 CB ASN A 220 12.338 -7.786 -5.495 1.00 0.00 C ATOM 996 CG ASN A 220 13.094 -8.424 -6.645 1.00 0.00 C ATOM 997 OD1 ASN A 220 13.692 -9.489 -6.494 1.00 0.00 O ATOM 998 ND2 ASN A 220 13.069 -7.772 -7.802 1.00 0.00 N ATOM 0 H ASN A 220 9.669 -8.772 -6.901 1.00 0.00 H new ATOM 0 HA ASN A 220 11.049 -9.499 -5.320 1.00 0.00 H new ATOM 0 HB2 ASN A 220 12.225 -6.719 -5.686 1.00 0.00 H new ATOM 0 HB3 ASN A 220 12.922 -7.886 -4.580 1.00 0.00 H new ATOM 0 HD21 ASN A 220 13.559 -8.152 -8.612 1.00 0.00 H new ATOM 0 HD22 ASN A 220 12.560 -6.892 -7.880 1.00 0.00 H new ATOM 1005 N ILE A 221 9.086 -8.022 -3.794 1.00 0.00 N ATOM 1006 CA ILE A 221 8.436 -7.665 -2.539 1.00 0.00 C ATOM 1007 C ILE A 221 8.321 -8.873 -1.616 1.00 0.00 C ATOM 1008 O ILE A 221 7.351 -9.630 -1.682 1.00 0.00 O ATOM 1009 CB ILE A 221 7.031 -7.081 -2.779 1.00 0.00 C ATOM 1010 CG1 ILE A 221 7.133 -5.638 -3.276 1.00 0.00 C ATOM 1011 CG2 ILE A 221 6.203 -7.151 -1.505 1.00 0.00 C ATOM 1012 CD1 ILE A 221 5.815 -5.068 -3.754 1.00 0.00 C ATOM 0 H ILE A 221 8.443 -8.270 -4.546 1.00 0.00 H new ATOM 0 HA ILE A 221 9.060 -6.907 -2.065 1.00 0.00 H new ATOM 0 HB ILE A 221 6.533 -7.675 -3.545 1.00 0.00 H new ATOM 0 HG12 ILE A 221 7.520 -5.012 -2.472 1.00 0.00 H new ATOM 0 HG13 ILE A 221 7.856 -5.593 -4.091 1.00 0.00 H new ATOM 0 HG21 ILE A 221 5.213 -6.735 -1.691 1.00 0.00 H new ATOM 0 HG22 ILE A 221 6.106 -8.190 -1.191 1.00 0.00 H new ATOM 0 HG23 ILE A 221 6.696 -6.579 -0.719 1.00 0.00 H new ATOM 0 HD11 ILE A 221 5.963 -4.042 -4.092 1.00 0.00 H new ATOM 0 HD12 ILE A 221 5.436 -5.671 -4.580 1.00 0.00 H new ATOM 0 HD13 ILE A 221 5.095 -5.080 -2.936 1.00 0.00 H new ATOM 1024 N THR A 222 9.317 -9.049 -0.753 1.00 0.00 N ATOM 1025 CA THR A 222 9.328 -10.164 0.185 1.00 0.00 C ATOM 1026 C THR A 222 8.948 -9.706 1.588 1.00 0.00 C ATOM 1027 O THR A 222 9.023 -8.520 1.906 1.00 0.00 O ATOM 1028 CB THR A 222 10.710 -10.842 0.235 1.00 0.00 C ATOM 1029 OG1 THR A 222 11.700 -9.905 0.673 1.00 0.00 O ATOM 1030 CG2 THR A 222 11.093 -11.392 -1.131 1.00 0.00 C ATOM 0 H THR A 222 10.127 -8.433 -0.685 1.00 0.00 H new ATOM 0 HA THR A 222 8.591 -10.884 -0.171 1.00 0.00 H new ATOM 0 HB THR A 222 10.658 -11.671 0.941 1.00 0.00 H new ATOM 0 HG1 THR A 222 12.575 -10.344 0.704 1.00 0.00 H new ATOM 0 HG21 THR A 222 12.073 -11.866 -1.071 1.00 0.00 H new ATOM 0 HG22 THR A 222 10.353 -12.127 -1.448 1.00 0.00 H new ATOM 0 HG23 THR A 222 11.128 -10.577 -1.854 1.00 0.00 H new ATOM 1038 N ASN A 223 8.540 -10.655 2.425 1.00 0.00 N ATOM 1039 CA ASN A 223 8.148 -10.348 3.796 1.00 0.00 C ATOM 1040 C ASN A 223 9.187 -9.458 4.472 1.00 0.00 C ATOM 1041 O ASN A 223 10.376 -9.530 4.165 1.00 0.00 O ATOM 1042 CB ASN A 223 7.967 -11.639 4.598 1.00 0.00 C ATOM 1043 CG ASN A 223 8.108 -11.416 6.091 1.00 0.00 C ATOM 1044 OD1 ASN A 223 7.402 -10.596 6.677 1.00 0.00 O ATOM 1045 ND2 ASN A 223 9.024 -12.149 6.714 1.00 0.00 N ATOM 0 H ASN A 223 8.472 -11.642 2.178 1.00 0.00 H new ATOM 0 HA ASN A 223 7.200 -9.811 3.765 1.00 0.00 H new ATOM 0 HB2 ASN A 223 6.984 -12.060 4.387 1.00 0.00 H new ATOM 0 HB3 ASN A 223 8.704 -12.373 4.272 1.00 0.00 H new ATOM 0 HD21 ASN A 223 9.164 -12.044 7.719 1.00 0.00 H new ATOM 0 HD22 ASN A 223 9.587 -12.817 6.188 1.00 0.00 H new ATOM 1052 N ASN A 224 8.728 -8.619 5.396 1.00 0.00 N ATOM 1053 CA ASN A 224 9.617 -7.715 6.116 1.00 0.00 C ATOM 1054 C ASN A 224 10.093 -6.584 5.210 1.00 0.00 C ATOM 1055 O ASN A 224 11.215 -6.095 5.347 1.00 0.00 O ATOM 1056 CB ASN A 224 10.820 -8.482 6.669 1.00 0.00 C ATOM 1057 CG ASN A 224 11.428 -7.806 7.883 1.00 0.00 C ATOM 1058 OD1 ASN A 224 10.801 -7.724 8.940 1.00 0.00 O ATOM 1059 ND2 ASN A 224 12.654 -7.320 7.737 1.00 0.00 N ATOM 0 H ASN A 224 7.746 -8.547 5.663 1.00 0.00 H new ATOM 0 HA ASN A 224 9.059 -7.281 6.946 1.00 0.00 H new ATOM 0 HB2 ASN A 224 10.512 -9.493 6.936 1.00 0.00 H new ATOM 0 HB3 ASN A 224 11.577 -8.575 5.891 1.00 0.00 H new ATOM 0 HD21 ASN A 224 13.115 -6.856 8.519 1.00 0.00 H new ATOM 0 HD22 ASN A 224 13.135 -7.411 6.842 1.00 0.00 H new ATOM 1066 N CYS A 225 9.233 -6.173 4.285 1.00 0.00 N ATOM 1067 CA CYS A 225 9.565 -5.099 3.355 1.00 0.00 C ATOM 1068 C CYS A 225 8.690 -3.875 3.603 1.00 0.00 C ATOM 1069 O CYS A 225 7.519 -3.998 3.964 1.00 0.00 O ATOM 1070 CB CYS A 225 9.398 -5.576 1.912 1.00 0.00 C ATOM 1071 SG CYS A 225 9.175 -4.240 0.714 1.00 0.00 S ATOM 0 H CYS A 225 8.301 -6.567 4.159 1.00 0.00 H new ATOM 0 HA CYS A 225 10.605 -4.819 3.519 1.00 0.00 H new ATOM 0 HB2 CYS A 225 10.274 -6.160 1.630 1.00 0.00 H new ATOM 0 HB3 CYS A 225 8.539 -6.245 1.859 1.00 0.00 H new ATOM 0 HG CYS A 225 8.835 -4.741 -0.436 1.00 0.00 H new ATOM 1077 N VAL A 226 9.266 -2.693 3.409 1.00 0.00 N ATOM 1078 CA VAL A 226 8.540 -1.445 3.612 1.00 0.00 C ATOM 1079 C VAL A 226 8.280 -0.738 2.287 1.00 0.00 C ATOM 1080 O VAL A 226 9.191 -0.563 1.476 1.00 0.00 O ATOM 1081 CB VAL A 226 9.309 -0.493 4.547 1.00 0.00 C ATOM 1082 CG1 VAL A 226 10.351 0.294 3.768 1.00 0.00 C ATOM 1083 CG2 VAL A 226 8.347 0.443 5.263 1.00 0.00 C ATOM 0 H VAL A 226 10.234 -2.573 3.111 1.00 0.00 H new ATOM 0 HA VAL A 226 7.588 -1.705 4.074 1.00 0.00 H new ATOM 0 HB VAL A 226 9.826 -1.089 5.299 1.00 0.00 H new ATOM 0 HG11 VAL A 226 10.884 0.961 4.445 1.00 0.00 H new ATOM 0 HG12 VAL A 226 11.058 -0.396 3.307 1.00 0.00 H new ATOM 0 HG13 VAL A 226 9.859 0.881 2.993 1.00 0.00 H new ATOM 0 HG21 VAL A 226 8.908 1.108 5.919 1.00 0.00 H new ATOM 0 HG22 VAL A 226 7.800 1.034 4.528 1.00 0.00 H new ATOM 0 HG23 VAL A 226 7.643 -0.142 5.855 1.00 0.00 H new ATOM 1093 N ILE A 227 7.033 -0.333 2.073 1.00 0.00 N ATOM 1094 CA ILE A 227 6.654 0.357 0.846 1.00 0.00 C ATOM 1095 C ILE A 227 6.299 1.814 1.122 1.00 0.00 C ATOM 1096 O ILE A 227 5.449 2.108 1.963 1.00 0.00 O ATOM 1097 CB ILE A 227 5.459 -0.330 0.159 1.00 0.00 C ATOM 1098 CG1 ILE A 227 5.825 -1.762 -0.237 1.00 0.00 C ATOM 1099 CG2 ILE A 227 5.019 0.466 -1.060 1.00 0.00 C ATOM 1100 CD1 ILE A 227 4.848 -2.390 -1.206 1.00 0.00 C ATOM 0 H ILE A 227 6.268 -0.471 2.733 1.00 0.00 H new ATOM 0 HA ILE A 227 7.517 0.315 0.181 1.00 0.00 H new ATOM 0 HB ILE A 227 4.627 -0.368 0.863 1.00 0.00 H new ATOM 0 HG12 ILE A 227 6.819 -1.764 -0.684 1.00 0.00 H new ATOM 0 HG13 ILE A 227 5.878 -2.376 0.662 1.00 0.00 H new ATOM 0 HG21 ILE A 227 4.174 -0.033 -1.534 1.00 0.00 H new ATOM 0 HG22 ILE A 227 4.723 1.469 -0.752 1.00 0.00 H new ATOM 0 HG23 ILE A 227 5.845 0.533 -1.768 1.00 0.00 H new ATOM 0 HD11 ILE A 227 5.171 -3.404 -1.442 1.00 0.00 H new ATOM 0 HD12 ILE A 227 3.856 -2.421 -0.754 1.00 0.00 H new ATOM 0 HD13 ILE A 227 4.812 -1.799 -2.121 1.00 0.00 H new ATOM 1112 N HIS A 228 6.954 2.723 0.406 1.00 0.00 N ATOM 1113 CA HIS A 228 6.705 4.150 0.572 1.00 0.00 C ATOM 1114 C HIS A 228 5.459 4.578 -0.198 1.00 0.00 C ATOM 1115 O HIS A 228 5.278 4.210 -1.359 1.00 0.00 O ATOM 1116 CB HIS A 228 7.913 4.959 0.098 1.00 0.00 C ATOM 1117 CG HIS A 228 9.209 4.505 0.696 1.00 0.00 C ATOM 1118 ND1 HIS A 228 9.943 5.273 1.575 1.00 0.00 N ATOM 1119 CD2 HIS A 228 9.901 3.352 0.538 1.00 0.00 C ATOM 1120 CE1 HIS A 228 11.031 4.614 1.930 1.00 0.00 C ATOM 1121 NE2 HIS A 228 11.029 3.445 1.315 1.00 0.00 N ATOM 0 H HIS A 228 7.660 2.496 -0.294 1.00 0.00 H new ATOM 0 HA HIS A 228 6.540 4.343 1.632 1.00 0.00 H new ATOM 0 HB2 HIS A 228 7.981 4.893 -0.988 1.00 0.00 H new ATOM 0 HB3 HIS A 228 7.756 6.009 0.345 1.00 0.00 H new ATOM 0 HD2 HIS A 228 9.618 2.515 -0.083 1.00 0.00 H new ATOM 0 HE1 HIS A 228 11.793 4.970 2.608 1.00 0.00 H new ATOM 0 HE2 HIS A 228 11.749 2.728 1.403 1.00 0.00 H new ATOM 1130 N CYS A 229 4.602 5.354 0.457 1.00 0.00 N ATOM 1131 CA CYS A 229 3.372 5.830 -0.166 1.00 0.00 C ATOM 1132 C CYS A 229 3.398 7.346 -0.332 1.00 0.00 C ATOM 1133 O CYS A 229 3.669 8.081 0.618 1.00 0.00 O ATOM 1134 CB CYS A 229 2.160 5.418 0.671 1.00 0.00 C ATOM 1135 SG CYS A 229 0.660 5.127 -0.296 1.00 0.00 S ATOM 0 H CYS A 229 4.736 5.667 1.419 1.00 0.00 H new ATOM 0 HA CYS A 229 3.295 5.376 -1.154 1.00 0.00 H new ATOM 0 HB2 CYS A 229 2.405 4.511 1.224 1.00 0.00 H new ATOM 0 HB3 CYS A 229 1.959 6.196 1.408 1.00 0.00 H new ATOM 0 HG CYS A 229 -0.309 4.782 0.499 1.00 0.00 H new ATOM 1141 N HIS A 230 3.117 7.808 -1.547 1.00 0.00 N ATOM 1142 CA HIS A 230 3.109 9.237 -1.838 1.00 0.00 C ATOM 1143 C HIS A 230 1.685 9.784 -1.837 1.00 0.00 C ATOM 1144 O HIS A 230 0.804 9.251 -2.512 1.00 0.00 O ATOM 1145 CB HIS A 230 3.770 9.507 -3.190 1.00 0.00 C ATOM 1146 CG HIS A 230 5.252 9.709 -3.103 1.00 0.00 C ATOM 1147 ND1 HIS A 230 6.202 9.014 -2.436 1.00 0.00 N flip ATOM 1148 CD2 HIS A 230 5.911 10.731 -3.752 1.00 0.00 C flip ATOM 1149 CE1 HIS A 230 7.407 9.621 -2.693 1.00 0.00 C flip ATOM 1150 NE2 HIS A 230 7.204 10.655 -3.490 1.00 0.00 N flip ATOM 0 H HIS A 230 2.892 7.214 -2.345 1.00 0.00 H new ATOM 0 HA HIS A 230 3.675 9.745 -1.057 1.00 0.00 H new ATOM 0 HB2 HIS A 230 3.564 8.671 -3.859 1.00 0.00 H new ATOM 0 HB3 HIS A 230 3.317 10.392 -3.636 1.00 0.00 H new ATOM 0 HD2 HIS A 230 5.444 11.477 -4.377 1.00 0.00 H new ATOM 0 HE1 HIS A 230 8.365 9.305 -2.307 1.00 0.00 H new ATOM 0 HE2 HIS A 230 7.923 11.287 -3.843 1.00 0.00 H new