USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 771 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 65 THR OG1 : rot -105:sc= 0.932 USER MOD Set 1.2: A 86 HIS : no HD1:sc= -0.231 X(o=0.7,f=0.78) USER MOD Single : A 12 TYR OH : rot 165:sc= -0.415 USER MOD Single : A 14 TYR OH : rot -60:sc= 0.778 USER MOD Single : A 17 ASN :FLIP amide:sc= -1.41! C(o=-2!,f=-1.4!) USER MOD Single : A 19 ASN : amide:sc= -0.283 K(o=-0.28,f=-1.2!) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0.0164 USER MOD Single : A 29 THR OG1 : rot 72:sc= 0.533 USER MOD Single : A 32 SER OG : rot -100:sc= -1.39 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 74:sc= 0.207 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ -162:sc= -0.0327 (180deg=-0.412) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -0.162 K(o=-0.16,f=-3!) USER MOD Single : A 64 SER OG : rot 170:sc= 0.0024 USER MOD Single : A 71 ASN : amide:sc= -3.88! C(o=-3.9!,f=-8!) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 LYS NZ :NH3+ -160:sc= -0.0595 (180deg=-0.416) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : B 314 MET CE :methyl 180:sc= -0.0283 (180deg=-0.0283) USER MOD Single : B 317 SER OG : rot 180:sc= 0 USER MOD Single : B 323 HIS : no HD1:sc= -0.101 K(o=-0.1,f=-2.4!) USER MOD Single : B 325 SER OG : rot 180:sc= 0 USER MOD Single : B 331 LYS NZ :NH3+ 160:sc= -0.0538 (180deg=-0.583) USER MOD Single : B 335 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0702) USER MOD Single : B 336 GLN : amide:sc= -0.218 X(o=-0.22,f=-0.25) USER MOD Single : B 337 ASN : amide:sc= -0.76 X(o=-0.76,f=-1.1!) USER MOD ----------------------------------------------------------------- ATOM 142 N ALA A 11 -0.362 -16.450 -2.799 1.00 0.00 N ATOM 143 CA ALA A 11 0.176 -17.347 -1.783 1.00 0.00 C ATOM 144 C ALA A 11 -0.534 -17.134 -0.449 1.00 0.00 C ATOM 145 O ALA A 11 -0.989 -16.030 -0.149 1.00 0.00 O ATOM 146 CB ALA A 11 1.675 -17.100 -1.610 1.00 0.00 C ATOM 0 HA ALA A 11 0.012 -18.374 -2.109 1.00 0.00 H new ATOM 0 HB1 ALA A 11 2.069 -17.774 -0.849 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.185 -17.282 -2.556 1.00 0.00 H new ATOM 0 HB3 ALA A 11 1.840 -16.068 -1.301 1.00 0.00 H new ATOM 152 N TYR A 12 -0.629 -18.198 0.351 1.00 0.00 N ATOM 153 CA TYR A 12 -1.286 -18.122 1.663 1.00 0.00 C ATOM 154 C TYR A 12 -0.325 -18.538 2.771 1.00 0.00 C ATOM 155 O TYR A 12 0.558 -19.370 2.563 1.00 0.00 O ATOM 156 CB TYR A 12 -2.524 -19.031 1.684 1.00 0.00 C ATOM 157 CG TYR A 12 -3.653 -18.376 0.924 1.00 0.00 C ATOM 158 CD1 TYR A 12 -3.661 -18.395 -0.474 1.00 0.00 C ATOM 159 CD2 TYR A 12 -4.688 -17.744 1.623 1.00 0.00 C ATOM 160 CE1 TYR A 12 -4.706 -17.782 -1.175 1.00 0.00 C ATOM 161 CE2 TYR A 12 -5.732 -17.132 0.924 1.00 0.00 C ATOM 162 CZ TYR A 12 -5.742 -17.150 -0.476 1.00 0.00 C ATOM 163 OH TYR A 12 -6.772 -16.545 -1.167 1.00 0.00 O ATOM 0 H TYR A 12 -0.262 -19.120 0.117 1.00 0.00 H new ATOM 0 HA TYR A 12 -1.592 -17.090 1.835 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -2.285 -19.996 1.238 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -2.829 -19.222 2.713 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -2.862 -18.882 -1.013 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -4.680 -17.729 2.703 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -4.713 -17.796 -2.255 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -6.531 -16.645 1.464 1.00 0.00 H new ATOM 0 HH TYR A 12 -7.517 -16.368 -0.555 1.00 0.00 H new ATOM 173 N ILE A 13 -0.501 -17.952 3.955 1.00 0.00 N ATOM 174 CA ILE A 13 0.362 -18.272 5.094 1.00 0.00 C ATOM 175 C ILE A 13 -0.350 -19.262 6.016 1.00 0.00 C ATOM 176 O ILE A 13 -1.370 -18.933 6.624 1.00 0.00 O ATOM 177 CB ILE A 13 0.715 -16.987 5.875 1.00 0.00 C ATOM 178 CG1 ILE A 13 0.811 -15.811 4.901 1.00 0.00 C ATOM 179 CG2 ILE A 13 2.065 -17.163 6.588 1.00 0.00 C ATOM 180 CD1 ILE A 13 1.269 -14.563 5.654 1.00 0.00 C ATOM 0 H ILE A 13 -1.225 -17.260 4.151 1.00 0.00 H new ATOM 0 HA ILE A 13 1.284 -18.721 4.725 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.062 -16.793 6.615 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.513 -16.044 4.101 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.157 -15.632 4.434 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.308 -16.253 7.137 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.003 -18.000 7.283 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.843 -17.360 5.851 1.00 0.00 H new ATOM 0 HD11 ILE A 13 1.338 -13.725 4.961 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.550 -14.327 6.439 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.246 -14.746 6.100 1.00 0.00 H new ATOM 192 N TYR A 14 0.195 -20.470 6.114 1.00 0.00 N ATOM 193 CA TYR A 14 -0.398 -21.499 6.963 1.00 0.00 C ATOM 194 C TYR A 14 -0.091 -21.228 8.426 1.00 0.00 C ATOM 195 O TYR A 14 1.073 -21.167 8.824 1.00 0.00 O ATOM 196 CB TYR A 14 0.150 -22.872 6.578 1.00 0.00 C ATOM 197 CG TYR A 14 -0.608 -23.950 7.321 1.00 0.00 C ATOM 198 CD1 TYR A 14 -1.955 -24.183 7.024 1.00 0.00 C ATOM 199 CD2 TYR A 14 0.033 -24.713 8.306 1.00 0.00 C ATOM 200 CE1 TYR A 14 -2.661 -25.180 7.708 1.00 0.00 C ATOM 201 CE2 TYR A 14 -0.673 -25.710 8.989 1.00 0.00 C ATOM 202 CZ TYR A 14 -2.019 -25.944 8.691 1.00 0.00 C ATOM 203 OH TYR A 14 -2.715 -26.926 9.363 1.00 0.00 O ATOM 0 H TYR A 14 1.039 -20.760 5.621 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.478 -21.482 6.818 1.00 0.00 H new ATOM 0 HB2 TYR A 14 0.056 -23.023 5.503 1.00 0.00 H new ATOM 0 HB3 TYR A 14 1.212 -22.930 6.817 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -2.451 -23.594 6.267 1.00 0.00 H new ATOM 0 HD2 TYR A 14 1.072 -24.532 8.538 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -3.701 -25.360 7.478 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -0.178 -26.299 9.747 1.00 0.00 H new ATOM 0 HH TYR A 14 -3.474 -26.524 9.835 1.00 0.00 H new ATOM 213 N ILE A 15 -1.141 -21.070 9.231 1.00 0.00 N ATOM 214 CA ILE A 15 -0.971 -20.808 10.661 1.00 0.00 C ATOM 215 C ILE A 15 -1.563 -21.951 11.479 1.00 0.00 C ATOM 216 O ILE A 15 -2.754 -22.250 11.375 1.00 0.00 O ATOM 217 CB ILE A 15 -1.655 -19.493 11.034 1.00 0.00 C ATOM 218 CG1 ILE A 15 -1.044 -18.351 10.215 1.00 0.00 C ATOM 219 CG2 ILE A 15 -1.452 -19.218 12.524 1.00 0.00 C ATOM 220 CD1 ILE A 15 -1.874 -17.079 10.407 1.00 0.00 C ATOM 0 H ILE A 15 -2.112 -21.118 8.921 1.00 0.00 H new ATOM 0 HA ILE A 15 0.094 -20.732 10.881 1.00 0.00 H new ATOM 0 HB ILE A 15 -2.722 -19.564 10.820 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -0.015 -18.176 10.528 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -1.015 -18.622 9.160 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -1.940 -18.280 12.791 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -1.886 -20.031 13.106 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -0.386 -19.146 12.739 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.438 -16.268 9.824 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.896 -17.257 10.072 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.880 -16.804 11.462 1.00 0.00 H new ATOM 232 N GLY A 16 -0.724 -22.590 12.296 1.00 0.00 N ATOM 233 CA GLY A 16 -1.176 -23.707 13.128 1.00 0.00 C ATOM 234 C GLY A 16 -0.514 -23.672 14.503 1.00 0.00 C ATOM 235 O GLY A 16 0.280 -22.780 14.795 1.00 0.00 O ATOM 0 H GLY A 16 0.263 -22.356 12.399 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.259 -23.665 13.241 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -0.944 -24.650 12.633 1.00 0.00 H new ATOM 239 N ASN A 17 -0.846 -24.650 15.344 1.00 0.00 N ATOM 240 CA ASN A 17 -0.281 -24.723 16.688 1.00 0.00 C ATOM 241 C ASN A 17 -0.707 -23.516 17.525 1.00 0.00 C ATOM 242 O ASN A 17 -0.049 -23.163 18.503 1.00 0.00 O ATOM 243 CB ASN A 17 1.248 -24.778 16.601 1.00 0.00 C ATOM 244 CG ASN A 17 1.831 -25.322 17.903 1.00 0.00 C ATOM 245 OD1 ASN A 17 2.865 -26.119 17.862 1.00 0.00 O flip ATOM 246 ND2 ASN A 17 1.332 -25.016 18.984 1.00 0.00 N flip ATOM 0 H ASN A 17 -1.501 -25.399 15.119 1.00 0.00 H new ATOM 0 HA ASN A 17 -0.654 -25.626 17.171 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.549 -25.411 15.767 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.644 -23.782 16.405 1.00 0.00 H new ATOM 0 HD21 ASN A 17 0.525 -24.394 19.015 1.00 0.00 H new ATOM 0 HD22 ASN A 17 1.725 -25.385 19.850 1.00 0.00 H new ATOM 253 N LEU A 18 -1.816 -22.889 17.138 1.00 0.00 N ATOM 254 CA LEU A 18 -2.334 -21.718 17.859 1.00 0.00 C ATOM 255 C LEU A 18 -3.514 -22.124 18.743 1.00 0.00 C ATOM 256 O LEU A 18 -4.244 -23.062 18.423 1.00 0.00 O ATOM 257 CB LEU A 18 -2.772 -20.613 16.852 1.00 0.00 C ATOM 258 CG LEU A 18 -4.138 -20.968 16.201 1.00 0.00 C ATOM 259 CD1 LEU A 18 -4.604 -19.823 15.295 1.00 0.00 C ATOM 260 CD2 LEU A 18 -3.999 -22.253 15.368 1.00 0.00 C ATOM 0 H LEU A 18 -2.375 -23.168 16.332 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.541 -21.318 18.492 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -2.848 -19.655 17.367 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.014 -20.500 16.077 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.873 -21.123 16.990 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -5.562 -20.083 14.844 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -4.715 -18.914 15.886 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -3.866 -19.657 14.510 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.959 -22.498 14.914 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -3.256 -22.101 14.586 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.684 -23.073 16.014 1.00 0.00 H new ATOM 272 N ASN A 19 -3.706 -21.401 19.839 1.00 0.00 N ATOM 273 CA ASN A 19 -4.813 -21.692 20.743 1.00 0.00 C ATOM 274 C ASN A 19 -6.132 -21.231 20.119 1.00 0.00 C ATOM 275 O ASN A 19 -6.220 -20.132 19.575 1.00 0.00 O ATOM 276 CB ASN A 19 -4.590 -20.979 22.097 1.00 0.00 C ATOM 277 CG ASN A 19 -5.215 -21.789 23.235 1.00 0.00 C ATOM 278 OD1 ASN A 19 -5.143 -23.019 23.231 1.00 0.00 O ATOM 279 ND2 ASN A 19 -5.826 -21.175 24.209 1.00 0.00 N ATOM 0 H ASN A 19 -3.118 -20.617 20.122 1.00 0.00 H new ATOM 0 HA ASN A 19 -4.859 -22.768 20.913 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -3.523 -20.851 22.277 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -5.030 -19.982 22.067 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -6.245 -21.713 24.968 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -5.886 -20.157 24.212 1.00 0.00 H new ATOM 286 N ARG A 20 -7.152 -22.077 20.207 1.00 0.00 N ATOM 287 CA ARG A 20 -8.460 -21.745 19.652 1.00 0.00 C ATOM 288 C ARG A 20 -9.025 -20.497 20.319 1.00 0.00 C ATOM 289 O ARG A 20 -9.937 -19.858 19.795 1.00 0.00 O ATOM 290 CB ARG A 20 -9.423 -22.919 19.846 1.00 0.00 C ATOM 291 CG ARG A 20 -9.690 -23.118 21.339 1.00 0.00 C ATOM 292 CD ARG A 20 -10.420 -24.445 21.553 1.00 0.00 C ATOM 293 NE ARG A 20 -9.581 -25.558 21.123 1.00 0.00 N ATOM 294 CZ ARG A 20 -10.107 -26.742 20.829 1.00 0.00 C ATOM 295 NH1 ARG A 20 -11.396 -26.924 20.920 1.00 0.00 N ATOM 296 NH2 ARG A 20 -9.335 -27.723 20.447 1.00 0.00 N ATOM 0 H ARG A 20 -7.100 -22.992 20.654 1.00 0.00 H new ATOM 0 HA ARG A 20 -8.343 -21.547 18.586 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -10.359 -22.726 19.321 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -8.998 -23.827 19.418 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -8.750 -23.114 21.891 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -10.290 -22.294 21.725 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -10.678 -24.560 22.606 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -11.355 -24.448 20.993 1.00 0.00 H new ATOM 0 HE ARG A 20 -8.573 -25.425 21.047 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -12.000 -26.157 21.217 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -11.800 -27.833 20.694 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -8.328 -27.581 20.374 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -9.739 -28.632 20.221 1.00 0.00 H new ATOM 310 N GLU A 21 -8.478 -20.159 21.479 1.00 0.00 N ATOM 311 CA GLU A 21 -8.936 -18.984 22.210 1.00 0.00 C ATOM 312 C GLU A 21 -8.680 -17.719 21.393 1.00 0.00 C ATOM 313 O GLU A 21 -9.433 -16.749 21.483 1.00 0.00 O ATOM 314 CB GLU A 21 -8.209 -18.887 23.561 1.00 0.00 C ATOM 315 CG GLU A 21 -8.788 -17.728 24.385 1.00 0.00 C ATOM 316 CD GLU A 21 -10.252 -18.003 24.720 1.00 0.00 C ATOM 317 OE1 GLU A 21 -10.641 -19.158 24.673 1.00 0.00 O ATOM 318 OE2 GLU A 21 -10.962 -17.056 25.014 1.00 0.00 O ATOM 0 H GLU A 21 -7.724 -20.676 21.931 1.00 0.00 H new ATOM 0 HA GLU A 21 -10.007 -19.080 22.387 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -8.316 -19.823 24.109 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.142 -18.732 23.399 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -8.214 -17.602 25.303 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.704 -16.796 23.826 1.00 0.00 H new ATOM 325 N LEU A 22 -7.609 -17.733 20.602 1.00 0.00 N ATOM 326 CA LEU A 22 -7.261 -16.575 19.781 1.00 0.00 C ATOM 327 C LEU A 22 -8.385 -16.266 18.797 1.00 0.00 C ATOM 328 O LEU A 22 -8.787 -17.117 18.004 1.00 0.00 O ATOM 329 CB LEU A 22 -5.947 -16.848 19.009 1.00 0.00 C ATOM 330 CG LEU A 22 -4.724 -16.551 19.904 1.00 0.00 C ATOM 331 CD1 LEU A 22 -4.516 -17.702 20.880 1.00 0.00 C ATOM 332 CD2 LEU A 22 -3.472 -16.387 19.037 1.00 0.00 C ATOM 0 H LEU A 22 -6.973 -18.525 20.512 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.119 -15.714 20.435 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -5.921 -17.887 18.680 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -5.909 -16.228 18.113 1.00 0.00 H new ATOM 0 HG LEU A 22 -4.902 -15.629 20.458 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -3.653 -17.492 21.512 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -5.403 -17.815 21.504 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -4.343 -18.624 20.324 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -2.613 -16.178 19.674 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -3.294 -17.306 18.478 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -3.617 -15.561 18.341 1.00 0.00 H new ATOM 344 N THR A 23 -8.887 -15.038 18.852 1.00 0.00 N ATOM 345 CA THR A 23 -9.966 -14.614 17.959 1.00 0.00 C ATOM 346 C THR A 23 -9.397 -14.051 16.660 1.00 0.00 C ATOM 347 O THR A 23 -8.187 -13.850 16.539 1.00 0.00 O ATOM 348 CB THR A 23 -10.829 -13.551 18.643 1.00 0.00 C ATOM 349 OG1 THR A 23 -10.039 -12.399 18.902 1.00 0.00 O ATOM 350 CG2 THR A 23 -11.377 -14.105 19.958 1.00 0.00 C ATOM 0 H THR A 23 -8.568 -14.319 19.501 1.00 0.00 H new ATOM 0 HA THR A 23 -10.580 -15.484 17.728 1.00 0.00 H new ATOM 0 HB THR A 23 -11.661 -13.282 17.992 1.00 0.00 H new ATOM 0 HG1 THR A 23 -10.590 -11.716 19.338 1.00 0.00 H new ATOM 0 HG21 THR A 23 -11.991 -13.347 20.444 1.00 0.00 H new ATOM 0 HG22 THR A 23 -11.983 -14.989 19.756 1.00 0.00 H new ATOM 0 HG23 THR A 23 -10.548 -14.375 20.613 1.00 0.00 H new ATOM 358 N GLU A 24 -10.276 -13.801 15.691 1.00 0.00 N ATOM 359 CA GLU A 24 -9.847 -13.260 14.406 1.00 0.00 C ATOM 360 C GLU A 24 -9.209 -11.891 14.599 1.00 0.00 C ATOM 361 O GLU A 24 -8.207 -11.568 13.961 1.00 0.00 O ATOM 362 CB GLU A 24 -11.046 -13.137 13.466 1.00 0.00 C ATOM 363 CG GLU A 24 -11.519 -14.533 13.056 1.00 0.00 C ATOM 364 CD GLU A 24 -12.755 -14.427 12.169 1.00 0.00 C ATOM 365 OE1 GLU A 24 -13.270 -13.329 12.034 1.00 0.00 O ATOM 366 OE2 GLU A 24 -13.169 -15.445 11.639 1.00 0.00 O ATOM 0 H GLU A 24 -11.280 -13.963 15.771 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.113 -13.937 13.969 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -11.855 -12.598 13.960 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.771 -12.561 12.583 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -10.723 -15.054 12.523 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.748 -15.123 13.943 1.00 0.00 H new ATOM 373 N GLY A 25 -9.796 -11.091 15.480 1.00 0.00 N ATOM 374 CA GLY A 25 -9.272 -9.760 15.755 1.00 0.00 C ATOM 375 C GLY A 25 -7.877 -9.843 16.360 1.00 0.00 C ATOM 376 O GLY A 25 -6.996 -9.049 16.026 1.00 0.00 O ATOM 0 H GLY A 25 -10.630 -11.339 16.013 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.240 -9.179 14.833 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -9.939 -9.236 16.439 1.00 0.00 H new ATOM 380 N ASP A 26 -7.683 -10.808 17.251 1.00 0.00 N ATOM 381 CA ASP A 26 -6.392 -10.983 17.901 1.00 0.00 C ATOM 382 C ASP A 26 -5.307 -11.277 16.870 1.00 0.00 C ATOM 383 O ASP A 26 -4.227 -10.687 16.908 1.00 0.00 O ATOM 384 CB ASP A 26 -6.464 -12.134 18.907 1.00 0.00 C ATOM 385 CG ASP A 26 -5.131 -12.275 19.635 1.00 0.00 C ATOM 386 OD1 ASP A 26 -4.175 -11.651 19.206 1.00 0.00 O ATOM 387 OD2 ASP A 26 -5.087 -13.006 20.612 1.00 0.00 O ATOM 0 H ASP A 26 -8.398 -11.476 17.538 1.00 0.00 H new ATOM 0 HA ASP A 26 -6.143 -10.059 18.422 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -7.263 -11.950 19.626 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -6.706 -13.063 18.392 1.00 0.00 H new ATOM 392 N ILE A 27 -5.601 -12.190 15.950 1.00 0.00 N ATOM 393 CA ILE A 27 -4.643 -12.551 14.912 1.00 0.00 C ATOM 394 C ILE A 27 -4.358 -11.350 14.016 1.00 0.00 C ATOM 395 O ILE A 27 -3.211 -11.089 13.660 1.00 0.00 O ATOM 396 CB ILE A 27 -5.186 -13.711 14.070 1.00 0.00 C ATOM 397 CG1 ILE A 27 -5.244 -14.979 14.927 1.00 0.00 C ATOM 398 CG2 ILE A 27 -4.266 -13.958 12.865 1.00 0.00 C ATOM 399 CD1 ILE A 27 -6.042 -16.059 14.190 1.00 0.00 C ATOM 0 H ILE A 27 -6.489 -12.690 15.902 1.00 0.00 H new ATOM 0 HA ILE A 27 -3.715 -12.864 15.390 1.00 0.00 H new ATOM 0 HB ILE A 27 -6.185 -13.458 13.716 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -4.235 -15.336 15.136 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -5.710 -14.760 15.888 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -4.658 -14.784 12.271 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.221 -13.059 12.251 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.265 -14.207 13.217 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -6.083 -16.961 14.800 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -7.054 -15.700 14.004 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -5.557 -16.285 13.240 1.00 0.00 H new ATOM 411 N LEU A 28 -5.412 -10.624 13.654 1.00 0.00 N ATOM 412 CA LEU A 28 -5.258 -9.462 12.791 1.00 0.00 C ATOM 413 C LEU A 28 -4.293 -8.465 13.420 1.00 0.00 C ATOM 414 O LEU A 28 -3.436 -7.919 12.733 1.00 0.00 O ATOM 415 CB LEU A 28 -6.631 -8.791 12.566 1.00 0.00 C ATOM 416 CG LEU A 28 -7.426 -9.550 11.474 1.00 0.00 C ATOM 417 CD1 LEU A 28 -8.931 -9.332 11.679 1.00 0.00 C ATOM 418 CD2 LEU A 28 -7.031 -9.020 10.079 1.00 0.00 C ATOM 0 H LEU A 28 -6.371 -10.818 13.942 1.00 0.00 H new ATOM 0 HA LEU A 28 -4.855 -9.786 11.831 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.197 -8.782 13.498 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.491 -7.752 12.268 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.195 -10.613 11.545 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -9.485 -9.868 10.908 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.222 -9.705 12.661 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -9.157 -8.268 11.614 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.592 -9.556 9.314 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.258 -7.956 10.016 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.964 -9.173 9.920 1.00 0.00 H new ATOM 430 N THR A 29 -4.434 -8.241 14.723 1.00 0.00 N ATOM 431 CA THR A 29 -3.566 -7.306 15.431 1.00 0.00 C ATOM 432 C THR A 29 -2.118 -7.785 15.386 1.00 0.00 C ATOM 433 O THR A 29 -1.194 -6.990 15.236 1.00 0.00 O ATOM 434 CB THR A 29 -4.011 -7.173 16.893 1.00 0.00 C ATOM 435 OG1 THR A 29 -5.361 -6.731 16.933 1.00 0.00 O ATOM 436 CG2 THR A 29 -3.123 -6.152 17.610 1.00 0.00 C ATOM 0 H THR A 29 -5.138 -8.692 15.308 1.00 0.00 H new ATOM 0 HA THR A 29 -3.638 -6.335 14.941 1.00 0.00 H new ATOM 0 HB THR A 29 -3.924 -8.140 17.389 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.952 -7.457 16.641 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.441 -6.059 18.648 1.00 0.00 H new ATOM 0 HG22 THR A 29 -2.086 -6.485 17.576 1.00 0.00 H new ATOM 0 HG23 THR A 29 -3.210 -5.184 17.116 1.00 0.00 H new ATOM 444 N VAL A 30 -1.929 -9.090 15.534 1.00 0.00 N ATOM 445 CA VAL A 30 -0.585 -9.657 15.520 1.00 0.00 C ATOM 446 C VAL A 30 0.089 -9.466 14.162 1.00 0.00 C ATOM 447 O VAL A 30 1.236 -9.030 14.083 1.00 0.00 O ATOM 448 CB VAL A 30 -0.659 -11.156 15.843 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.733 -11.781 15.695 1.00 0.00 C ATOM 450 CG2 VAL A 30 -1.163 -11.351 17.280 1.00 0.00 C ATOM 0 H VAL A 30 -2.679 -9.769 15.664 1.00 0.00 H new ATOM 0 HA VAL A 30 0.009 -9.137 16.272 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.349 -11.641 15.152 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.680 -12.845 15.924 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.085 -11.647 14.672 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.425 -11.295 16.383 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.214 -12.416 17.506 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.478 -10.865 17.975 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.155 -10.910 17.381 1.00 0.00 H new ATOM 460 N PHE A 31 -0.633 -9.794 13.098 1.00 0.00 N ATOM 461 CA PHE A 31 -0.104 -9.668 11.739 1.00 0.00 C ATOM 462 C PHE A 31 -0.242 -8.238 11.202 1.00 0.00 C ATOM 463 O PHE A 31 0.344 -7.890 10.178 1.00 0.00 O ATOM 464 CB PHE A 31 -0.832 -10.648 10.806 1.00 0.00 C ATOM 465 CG PHE A 31 -0.320 -12.054 11.038 1.00 0.00 C ATOM 466 CD1 PHE A 31 -0.776 -12.798 12.134 1.00 0.00 C ATOM 467 CD2 PHE A 31 0.612 -12.611 10.156 1.00 0.00 C ATOM 468 CE1 PHE A 31 -0.300 -14.095 12.347 1.00 0.00 C ATOM 469 CE2 PHE A 31 1.087 -13.910 10.369 1.00 0.00 C ATOM 470 CZ PHE A 31 0.631 -14.652 11.464 1.00 0.00 C ATOM 0 H PHE A 31 -1.588 -10.150 13.146 1.00 0.00 H new ATOM 0 HA PHE A 31 0.959 -9.908 11.772 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -1.906 -10.608 10.988 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.674 -10.360 9.767 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.496 -12.369 12.815 1.00 0.00 H new ATOM 0 HD2 PHE A 31 0.965 -12.039 9.311 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -0.651 -14.667 13.193 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.806 -14.340 9.688 1.00 0.00 H new ATOM 0 HZ PHE A 31 0.998 -15.655 11.627 1.00 0.00 H new ATOM 480 N SER A 32 -1.039 -7.424 11.884 1.00 0.00 N ATOM 481 CA SER A 32 -1.270 -6.049 11.436 1.00 0.00 C ATOM 482 C SER A 32 0.027 -5.339 11.018 1.00 0.00 C ATOM 483 O SER A 32 0.168 -4.909 9.869 1.00 0.00 O ATOM 484 CB SER A 32 -1.919 -5.240 12.558 1.00 0.00 C ATOM 485 OG SER A 32 -1.042 -5.210 13.675 1.00 0.00 O ATOM 0 H SER A 32 -1.532 -7.684 12.738 1.00 0.00 H new ATOM 0 HA SER A 32 -1.924 -6.109 10.566 1.00 0.00 H new ATOM 0 HB2 SER A 32 -2.129 -4.226 12.218 1.00 0.00 H new ATOM 0 HB3 SER A 32 -2.873 -5.686 12.840 1.00 0.00 H new ATOM 0 HG SER A 32 -1.336 -5.867 14.340 1.00 0.00 H new ATOM 491 N GLU A 33 0.973 -5.230 11.946 1.00 0.00 N ATOM 492 CA GLU A 33 2.251 -4.568 11.663 1.00 0.00 C ATOM 493 C GLU A 33 3.151 -5.414 10.766 1.00 0.00 C ATOM 494 O GLU A 33 3.989 -4.894 10.029 1.00 0.00 O ATOM 495 CB GLU A 33 2.982 -4.278 12.977 1.00 0.00 C ATOM 496 CG GLU A 33 3.312 -5.599 13.682 1.00 0.00 C ATOM 497 CD GLU A 33 3.933 -5.321 15.045 1.00 0.00 C ATOM 498 OE1 GLU A 33 3.259 -4.733 15.872 1.00 0.00 O ATOM 499 OE2 GLU A 33 5.075 -5.704 15.245 1.00 0.00 O ATOM 0 H GLU A 33 0.884 -5.588 12.897 1.00 0.00 H new ATOM 0 HA GLU A 33 2.029 -3.640 11.136 1.00 0.00 H new ATOM 0 HB2 GLU A 33 3.897 -3.720 12.781 1.00 0.00 H new ATOM 0 HB3 GLU A 33 2.361 -3.655 13.621 1.00 0.00 H new ATOM 0 HG2 GLU A 33 2.406 -6.194 13.800 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.000 -6.184 13.072 1.00 0.00 H new ATOM 506 N TYR A 34 2.973 -6.724 10.834 1.00 0.00 N ATOM 507 CA TYR A 34 3.772 -7.659 10.044 1.00 0.00 C ATOM 508 C TYR A 34 3.087 -7.993 8.723 1.00 0.00 C ATOM 509 O TYR A 34 3.162 -9.127 8.254 1.00 0.00 O ATOM 510 CB TYR A 34 4.042 -8.938 10.841 1.00 0.00 C ATOM 511 CG TYR A 34 4.987 -8.633 11.985 1.00 0.00 C ATOM 512 CD1 TYR A 34 6.307 -8.250 11.718 1.00 0.00 C ATOM 513 CD2 TYR A 34 4.543 -8.739 13.311 1.00 0.00 C ATOM 514 CE1 TYR A 34 7.183 -7.968 12.775 1.00 0.00 C ATOM 515 CE2 TYR A 34 5.418 -8.459 14.366 1.00 0.00 C ATOM 516 CZ TYR A 34 6.738 -8.073 14.098 1.00 0.00 C ATOM 517 OH TYR A 34 7.599 -7.794 15.139 1.00 0.00 O ATOM 0 H TYR A 34 2.278 -7.170 11.432 1.00 0.00 H new ATOM 0 HA TYR A 34 4.723 -7.177 9.818 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.106 -9.343 11.227 1.00 0.00 H new ATOM 0 HB3 TYR A 34 4.475 -9.699 10.191 1.00 0.00 H new ATOM 0 HD1 TYR A 34 6.650 -8.172 10.697 1.00 0.00 H new ATOM 0 HD2 TYR A 34 3.526 -9.037 13.518 1.00 0.00 H new ATOM 0 HE1 TYR A 34 8.200 -7.670 12.569 1.00 0.00 H new ATOM 0 HE2 TYR A 34 5.076 -8.540 15.387 1.00 0.00 H new ATOM 0 HH TYR A 34 7.131 -7.914 15.992 1.00 0.00 H new ATOM 527 N GLY A 35 2.397 -7.005 8.135 1.00 0.00 N ATOM 528 CA GLY A 35 1.687 -7.255 6.878 1.00 0.00 C ATOM 529 C GLY A 35 0.203 -7.497 7.113 1.00 0.00 C ATOM 530 O GLY A 35 -0.281 -8.620 6.969 1.00 0.00 O ATOM 0 H GLY A 35 2.317 -6.055 8.497 1.00 0.00 H new ATOM 0 HA2 GLY A 35 1.816 -6.403 6.210 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.123 -8.120 6.379 1.00 0.00 H new ATOM 534 N VAL A 36 -0.515 -6.441 7.500 1.00 0.00 N ATOM 535 CA VAL A 36 -1.934 -6.576 7.797 1.00 0.00 C ATOM 536 C VAL A 36 -2.691 -7.177 6.593 1.00 0.00 C ATOM 537 O VAL A 36 -2.671 -6.625 5.493 1.00 0.00 O ATOM 538 CB VAL A 36 -2.526 -5.187 8.110 1.00 0.00 C ATOM 539 CG1 VAL A 36 -2.549 -4.319 6.840 1.00 0.00 C ATOM 540 CG2 VAL A 36 -3.955 -5.355 8.643 1.00 0.00 C ATOM 0 H VAL A 36 -0.141 -5.499 7.613 1.00 0.00 H new ATOM 0 HA VAL A 36 -2.044 -7.240 8.655 1.00 0.00 H new ATOM 0 HB VAL A 36 -1.907 -4.696 8.860 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -2.969 -3.341 7.075 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.533 -4.197 6.465 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -3.161 -4.803 6.079 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -4.378 -4.375 8.866 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -4.568 -5.852 7.891 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -3.936 -5.957 9.551 1.00 0.00 H new ATOM 550 N PRO A 37 -3.343 -8.325 6.790 1.00 0.00 N ATOM 551 CA PRO A 37 -4.092 -9.035 5.712 1.00 0.00 C ATOM 552 C PRO A 37 -5.427 -8.371 5.392 1.00 0.00 C ATOM 553 O PRO A 37 -5.983 -7.646 6.216 1.00 0.00 O ATOM 554 CB PRO A 37 -4.296 -10.447 6.275 1.00 0.00 C ATOM 555 CG PRO A 37 -4.315 -10.278 7.759 1.00 0.00 C ATOM 556 CD PRO A 37 -3.441 -9.061 8.073 1.00 0.00 C ATOM 0 HA PRO A 37 -3.548 -9.025 4.767 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -5.228 -10.883 5.916 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -3.492 -11.115 5.965 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -5.333 -10.127 8.119 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -3.931 -11.169 8.255 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -3.889 -8.442 8.851 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.457 -9.363 8.432 1.00 0.00 H new ATOM 564 N VAL A 38 -5.935 -8.628 4.193 1.00 0.00 N ATOM 565 CA VAL A 38 -7.210 -8.058 3.772 1.00 0.00 C ATOM 566 C VAL A 38 -8.347 -9.030 4.072 1.00 0.00 C ATOM 567 O VAL A 38 -9.519 -8.655 4.051 1.00 0.00 O ATOM 568 CB VAL A 38 -7.182 -7.748 2.272 1.00 0.00 C ATOM 569 CG1 VAL A 38 -6.057 -6.754 1.975 1.00 0.00 C ATOM 570 CG2 VAL A 38 -6.940 -9.038 1.486 1.00 0.00 C ATOM 0 H VAL A 38 -5.487 -9.224 3.497 1.00 0.00 H new ATOM 0 HA VAL A 38 -7.375 -7.133 4.325 1.00 0.00 H new ATOM 0 HB VAL A 38 -8.138 -7.315 1.976 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -6.038 -6.534 0.908 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -6.229 -5.833 2.532 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -5.102 -7.186 2.274 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -6.920 -8.816 0.419 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -5.986 -9.472 1.784 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -7.742 -9.747 1.694 1.00 0.00 H new ATOM 580 N ASP A 39 -7.989 -10.282 4.350 1.00 0.00 N ATOM 581 CA ASP A 39 -8.986 -11.302 4.654 1.00 0.00 C ATOM 582 C ASP A 39 -8.335 -12.509 5.327 1.00 0.00 C ATOM 583 O ASP A 39 -7.269 -12.963 4.909 1.00 0.00 O ATOM 584 CB ASP A 39 -9.682 -11.749 3.367 1.00 0.00 C ATOM 585 CG ASP A 39 -10.856 -12.664 3.699 1.00 0.00 C ATOM 586 OD1 ASP A 39 -10.990 -13.026 4.857 1.00 0.00 O ATOM 587 OD2 ASP A 39 -11.604 -12.989 2.792 1.00 0.00 O ATOM 0 H ASP A 39 -7.024 -10.611 4.371 1.00 0.00 H new ATOM 0 HA ASP A 39 -9.720 -10.873 5.336 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -10.034 -10.879 2.813 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -8.974 -12.271 2.724 1.00 0.00 H new ATOM 592 N VAL A 40 -8.980 -13.031 6.373 1.00 0.00 N ATOM 593 CA VAL A 40 -8.455 -14.194 7.103 1.00 0.00 C ATOM 594 C VAL A 40 -9.510 -15.294 7.185 1.00 0.00 C ATOM 595 O VAL A 40 -10.655 -15.038 7.558 1.00 0.00 O ATOM 596 CB VAL A 40 -8.026 -13.777 8.511 1.00 0.00 C ATOM 597 CG1 VAL A 40 -7.489 -14.995 9.261 1.00 0.00 C ATOM 598 CG2 VAL A 40 -6.930 -12.713 8.418 1.00 0.00 C ATOM 0 H VAL A 40 -9.863 -12.671 6.735 1.00 0.00 H new ATOM 0 HA VAL A 40 -7.590 -14.581 6.565 1.00 0.00 H new ATOM 0 HB VAL A 40 -8.884 -13.369 9.045 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -7.183 -14.699 10.264 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.269 -15.754 9.329 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -6.631 -15.403 8.726 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -6.625 -12.416 9.421 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -6.072 -13.120 7.883 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.312 -11.843 7.883 1.00 0.00 H new ATOM 608 N ILE A 41 -9.123 -16.526 6.832 1.00 0.00 N ATOM 609 CA ILE A 41 -10.057 -17.661 6.864 1.00 0.00 C ATOM 610 C ILE A 41 -9.724 -18.612 8.013 1.00 0.00 C ATOM 611 O ILE A 41 -8.591 -19.078 8.137 1.00 0.00 O ATOM 612 CB ILE A 41 -9.982 -18.429 5.541 1.00 0.00 C ATOM 613 CG1 ILE A 41 -10.248 -17.468 4.380 1.00 0.00 C ATOM 614 CG2 ILE A 41 -11.040 -19.536 5.532 1.00 0.00 C ATOM 615 CD1 ILE A 41 -10.000 -18.189 3.055 1.00 0.00 C ATOM 0 H ILE A 41 -8.180 -16.762 6.524 1.00 0.00 H new ATOM 0 HA ILE A 41 -11.063 -17.269 7.013 1.00 0.00 H new ATOM 0 HB ILE A 41 -8.991 -18.870 5.433 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -11.275 -17.105 4.422 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -9.598 -16.596 4.459 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -10.987 -20.083 4.590 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -10.857 -20.221 6.360 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -12.030 -19.094 5.639 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -10.189 -17.505 2.228 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -8.966 -18.530 3.014 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -10.668 -19.047 2.977 1.00 0.00 H new ATOM 627 N LEU A 42 -10.720 -18.900 8.854 1.00 0.00 N ATOM 628 CA LEU A 42 -10.527 -19.807 9.996 1.00 0.00 C ATOM 629 C LEU A 42 -11.231 -21.139 9.738 1.00 0.00 C ATOM 630 O LEU A 42 -12.315 -21.177 9.155 1.00 0.00 O ATOM 631 CB LEU A 42 -11.077 -19.161 11.297 1.00 0.00 C ATOM 632 CG LEU A 42 -9.936 -18.500 12.085 1.00 0.00 C ATOM 633 CD1 LEU A 42 -9.359 -17.345 11.270 1.00 0.00 C ATOM 634 CD2 LEU A 42 -10.467 -17.968 13.416 1.00 0.00 C ATOM 0 H LEU A 42 -11.664 -18.523 8.770 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.459 -19.989 10.117 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -11.836 -18.419 11.050 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -11.561 -19.920 11.912 1.00 0.00 H new ATOM 0 HG LEU A 42 -9.157 -19.238 12.278 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -8.549 -16.875 11.828 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -8.975 -17.724 10.323 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -10.140 -16.610 11.076 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -9.654 -17.500 13.971 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.249 -17.232 13.228 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.878 -18.792 13.999 1.00 0.00 H new ATOM 646 N SER A 43 -10.608 -22.225 10.181 1.00 0.00 N ATOM 647 CA SER A 43 -11.180 -23.552 10.003 1.00 0.00 C ATOM 648 C SER A 43 -12.549 -23.636 10.672 1.00 0.00 C ATOM 649 O SER A 43 -12.838 -22.892 11.610 1.00 0.00 O ATOM 650 CB SER A 43 -10.252 -24.607 10.597 1.00 0.00 C ATOM 651 OG SER A 43 -9.007 -24.577 9.913 1.00 0.00 O ATOM 0 H SER A 43 -9.710 -22.212 10.664 1.00 0.00 H new ATOM 0 HA SER A 43 -11.297 -23.737 8.935 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.101 -24.418 11.660 1.00 0.00 H new ATOM 0 HB3 SER A 43 -10.704 -25.595 10.510 1.00 0.00 H new ATOM 0 HG SER A 43 -8.503 -23.783 10.186 1.00 0.00 H new ATOM 657 N ARG A 44 -13.396 -24.547 10.185 1.00 0.00 N ATOM 658 CA ARG A 44 -14.745 -24.715 10.738 1.00 0.00 C ATOM 659 C ARG A 44 -14.830 -25.985 11.584 1.00 0.00 C ATOM 660 O ARG A 44 -13.927 -26.822 11.558 1.00 0.00 O ATOM 661 CB ARG A 44 -15.767 -24.792 9.603 1.00 0.00 C ATOM 662 CG ARG A 44 -15.884 -23.425 8.927 1.00 0.00 C ATOM 663 CD ARG A 44 -16.814 -23.529 7.717 1.00 0.00 C ATOM 664 NE ARG A 44 -16.962 -22.226 7.080 1.00 0.00 N ATOM 665 CZ ARG A 44 -17.670 -22.083 5.965 1.00 0.00 C ATOM 666 NH1 ARG A 44 -18.247 -23.120 5.420 1.00 0.00 N ATOM 667 NH2 ARG A 44 -17.791 -20.906 5.414 1.00 0.00 N ATOM 0 H ARG A 44 -13.175 -25.177 9.414 1.00 0.00 H new ATOM 0 HA ARG A 44 -14.964 -23.856 11.372 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -15.462 -25.544 8.875 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -16.737 -25.101 9.993 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -16.271 -22.691 9.634 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -14.900 -23.078 8.613 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -16.413 -24.248 7.002 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -17.789 -23.901 8.030 1.00 0.00 H new ATOM 0 HE ARG A 44 -16.514 -21.410 7.498 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -18.154 -24.040 5.850 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -18.791 -23.010 4.564 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -17.342 -20.095 5.839 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -18.335 -20.797 4.558 1.00 0.00 H new ATOM 786 N GLY A 53 -8.323 -25.585 14.678 1.00 0.00 N ATOM 787 CA GLY A 53 -6.961 -25.303 15.138 1.00 0.00 C ATOM 788 C GLY A 53 -6.059 -24.902 13.976 1.00 0.00 C ATOM 789 O GLY A 53 -4.838 -25.040 14.050 1.00 0.00 O ATOM 0 HA2 GLY A 53 -6.983 -24.503 15.878 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -6.552 -26.184 15.633 1.00 0.00 H new ATOM 793 N PHE A 54 -6.666 -24.410 12.894 1.00 0.00 N ATOM 794 CA PHE A 54 -5.899 -23.994 11.716 1.00 0.00 C ATOM 795 C PHE A 54 -6.535 -22.769 11.067 1.00 0.00 C ATOM 796 O PHE A 54 -7.739 -22.542 11.196 1.00 0.00 O ATOM 797 CB PHE A 54 -5.848 -25.138 10.706 1.00 0.00 C ATOM 798 CG PHE A 54 -5.657 -26.436 11.442 1.00 0.00 C ATOM 799 CD1 PHE A 54 -4.368 -26.890 11.742 1.00 0.00 C ATOM 800 CD2 PHE A 54 -6.773 -27.189 11.819 1.00 0.00 C ATOM 801 CE1 PHE A 54 -4.196 -28.098 12.424 1.00 0.00 C ATOM 802 CE2 PHE A 54 -6.601 -28.396 12.499 1.00 0.00 C ATOM 803 CZ PHE A 54 -5.312 -28.853 12.802 1.00 0.00 C ATOM 0 H PHE A 54 -7.675 -24.290 12.808 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.888 -23.738 12.032 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -6.769 -25.168 10.124 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -5.031 -24.981 10.001 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -3.507 -26.308 11.447 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -7.767 -26.837 11.584 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -3.202 -28.449 12.659 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -7.462 -28.978 12.792 1.00 0.00 H new ATOM 0 HZ PHE A 54 -5.180 -29.787 13.327 1.00 0.00 H new ATOM 813 N ALA A 55 -5.721 -21.982 10.368 1.00 0.00 N ATOM 814 CA ALA A 55 -6.216 -20.782 9.701 1.00 0.00 C ATOM 815 C ALA A 55 -5.310 -20.403 8.530 1.00 0.00 C ATOM 816 O ALA A 55 -4.179 -20.883 8.428 1.00 0.00 O ATOM 817 CB ALA A 55 -6.274 -19.624 10.697 1.00 0.00 C ATOM 0 H ALA A 55 -4.722 -22.152 10.249 1.00 0.00 H new ATOM 0 HA ALA A 55 -7.216 -20.987 9.318 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -6.644 -18.730 10.195 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -6.944 -19.883 11.517 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.276 -19.432 11.090 1.00 0.00 H new ATOM 823 N TYR A 56 -5.811 -19.540 7.643 1.00 0.00 N ATOM 824 CA TYR A 56 -5.032 -19.100 6.477 1.00 0.00 C ATOM 825 C TYR A 56 -4.987 -17.573 6.422 1.00 0.00 C ATOM 826 O TYR A 56 -5.978 -16.905 6.717 1.00 0.00 O ATOM 827 CB TYR A 56 -5.659 -19.640 5.190 1.00 0.00 C ATOM 828 CG TYR A 56 -5.699 -21.150 5.242 1.00 0.00 C ATOM 829 CD1 TYR A 56 -6.805 -21.798 5.805 1.00 0.00 C ATOM 830 CD2 TYR A 56 -4.634 -21.902 4.732 1.00 0.00 C ATOM 831 CE1 TYR A 56 -6.847 -23.195 5.858 1.00 0.00 C ATOM 832 CE2 TYR A 56 -4.676 -23.300 4.784 1.00 0.00 C ATOM 833 CZ TYR A 56 -5.781 -23.947 5.347 1.00 0.00 C ATOM 834 OH TYR A 56 -5.822 -25.325 5.400 1.00 0.00 O ATOM 0 H TYR A 56 -6.744 -19.133 7.706 1.00 0.00 H new ATOM 0 HA TYR A 56 -4.017 -19.486 6.570 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -6.667 -19.243 5.070 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -5.082 -19.311 4.326 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -7.627 -21.218 6.199 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -3.780 -21.403 4.298 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -7.701 -23.694 6.293 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -3.855 -23.880 4.389 1.00 0.00 H new ATOM 0 HH TYR A 56 -5.005 -25.692 5.002 1.00 0.00 H new ATOM 844 N LEU A 57 -3.832 -17.023 6.041 1.00 0.00 N ATOM 845 CA LEU A 57 -3.669 -15.562 5.955 1.00 0.00 C ATOM 846 C LEU A 57 -3.483 -15.116 4.500 1.00 0.00 C ATOM 847 O LEU A 57 -2.793 -15.782 3.729 1.00 0.00 O ATOM 848 CB LEU A 57 -2.445 -15.115 6.791 1.00 0.00 C ATOM 849 CG LEU A 57 -2.763 -13.793 7.532 1.00 0.00 C ATOM 850 CD1 LEU A 57 -3.473 -14.104 8.856 1.00 0.00 C ATOM 851 CD2 LEU A 57 -1.466 -13.029 7.808 1.00 0.00 C ATOM 0 H LEU A 57 -3.001 -17.557 5.788 1.00 0.00 H new ATOM 0 HA LEU A 57 -4.572 -15.097 6.350 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.183 -15.891 7.511 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.581 -14.978 6.141 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.413 -13.179 6.909 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -3.696 -13.173 9.377 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.401 -14.639 8.654 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -2.827 -14.722 9.479 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.695 -12.100 8.329 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.809 -13.640 8.427 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.969 -12.803 6.865 1.00 0.00 H new ATOM 863 N LYS A 58 -4.102 -13.983 4.132 1.00 0.00 N ATOM 864 CA LYS A 58 -3.987 -13.452 2.767 1.00 0.00 C ATOM 865 C LYS A 58 -3.614 -11.966 2.779 1.00 0.00 C ATOM 866 O LYS A 58 -4.432 -11.120 3.142 1.00 0.00 O ATOM 867 CB LYS A 58 -5.313 -13.634 2.030 1.00 0.00 C ATOM 868 CG LYS A 58 -5.177 -13.134 0.586 1.00 0.00 C ATOM 869 CD LYS A 58 -6.489 -13.371 -0.165 1.00 0.00 C ATOM 870 CE LYS A 58 -6.335 -12.914 -1.618 1.00 0.00 C ATOM 871 NZ LYS A 58 -6.103 -11.442 -1.655 1.00 0.00 N ATOM 0 H LYS A 58 -4.682 -13.422 4.756 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.197 -14.002 2.256 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.601 -14.685 2.035 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -6.103 -13.084 2.542 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.929 -12.073 0.580 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -4.361 -13.655 0.086 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -6.754 -14.428 -0.131 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -7.300 -12.823 0.316 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -5.502 -13.436 -2.088 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -7.230 -13.166 -2.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -6.300 -11.083 -2.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -6.734 -10.974 -0.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -5.113 -11.240 -1.407 1.00 0.00 H new ATOM 885 N TYR A 59 -2.379 -11.648 2.373 1.00 0.00 N ATOM 886 CA TYR A 59 -1.911 -10.252 2.321 1.00 0.00 C ATOM 887 C TYR A 59 -1.629 -9.843 0.878 1.00 0.00 C ATOM 888 O TYR A 59 -1.410 -10.691 0.014 1.00 0.00 O ATOM 889 CB TYR A 59 -0.647 -10.051 3.179 1.00 0.00 C ATOM 890 CG TYR A 59 -0.200 -8.581 3.144 1.00 0.00 C ATOM 891 CD1 TYR A 59 -1.132 -7.536 3.313 1.00 0.00 C ATOM 892 CD2 TYR A 59 1.152 -8.271 2.945 1.00 0.00 C ATOM 893 CE1 TYR A 59 -0.719 -6.205 3.276 1.00 0.00 C ATOM 894 CE2 TYR A 59 1.565 -6.927 2.917 1.00 0.00 C ATOM 895 CZ TYR A 59 0.629 -5.897 3.080 1.00 0.00 C ATOM 896 OH TYR A 59 1.037 -4.579 3.045 1.00 0.00 O ATOM 0 H TYR A 59 -1.685 -12.334 2.076 1.00 0.00 H new ATOM 0 HA TYR A 59 -2.701 -9.621 2.727 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -0.847 -10.352 4.207 1.00 0.00 H new ATOM 0 HB3 TYR A 59 0.155 -10.690 2.810 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -2.174 -7.769 3.472 1.00 0.00 H new ATOM 0 HD2 TYR A 59 1.875 -9.062 2.813 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -1.442 -5.412 3.399 1.00 0.00 H new ATOM 0 HE2 TYR A 59 2.608 -6.688 2.769 1.00 0.00 H new ATOM 0 HH TYR A 59 2.006 -4.540 2.902 1.00 0.00 H new ATOM 906 N GLU A 60 -1.639 -8.541 0.623 1.00 0.00 N ATOM 907 CA GLU A 60 -1.392 -8.038 -0.726 1.00 0.00 C ATOM 908 C GLU A 60 -0.013 -8.464 -1.239 1.00 0.00 C ATOM 909 O GLU A 60 0.127 -8.884 -2.388 1.00 0.00 O ATOM 910 CB GLU A 60 -1.474 -6.511 -0.732 1.00 0.00 C ATOM 911 CG GLU A 60 -2.926 -6.076 -0.523 1.00 0.00 C ATOM 912 CD GLU A 60 -3.035 -4.558 -0.624 1.00 0.00 C ATOM 913 OE1 GLU A 60 -2.011 -3.922 -0.817 1.00 0.00 O ATOM 914 OE2 GLU A 60 -4.139 -4.054 -0.507 1.00 0.00 O ATOM 0 H GLU A 60 -1.813 -7.819 1.323 1.00 0.00 H new ATOM 0 HA GLU A 60 -2.153 -8.460 -1.382 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -0.843 -6.099 0.056 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -1.099 -6.120 -1.678 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -3.566 -6.545 -1.270 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -3.278 -6.410 0.453 1.00 0.00 H new ATOM 921 N ASP A 61 1.003 -8.361 -0.382 1.00 0.00 N ATOM 922 CA ASP A 61 2.372 -8.741 -0.767 1.00 0.00 C ATOM 923 C ASP A 61 2.750 -10.097 -0.178 1.00 0.00 C ATOM 924 O ASP A 61 2.359 -10.430 0.940 1.00 0.00 O ATOM 925 CB ASP A 61 3.358 -7.685 -0.272 1.00 0.00 C ATOM 926 CG ASP A 61 2.993 -6.321 -0.850 1.00 0.00 C ATOM 927 OD1 ASP A 61 2.703 -6.257 -2.033 1.00 0.00 O ATOM 928 OD2 ASP A 61 3.007 -5.360 -0.098 1.00 0.00 O ATOM 0 H ASP A 61 0.911 -8.022 0.575 1.00 0.00 H new ATOM 0 HA ASP A 61 2.413 -8.809 -1.854 1.00 0.00 H new ATOM 0 HB2 ASP A 61 3.343 -7.644 0.817 1.00 0.00 H new ATOM 0 HB3 ASP A 61 4.372 -7.955 -0.567 1.00 0.00 H new ATOM 933 N GLN A 62 3.510 -10.881 -0.940 1.00 0.00 N ATOM 934 CA GLN A 62 3.938 -12.201 -0.479 1.00 0.00 C ATOM 935 C GLN A 62 5.249 -12.093 0.301 1.00 0.00 C ATOM 936 O GLN A 62 5.668 -13.034 0.971 1.00 0.00 O ATOM 937 CB GLN A 62 4.130 -13.134 -1.676 1.00 0.00 C ATOM 938 CG GLN A 62 2.814 -13.250 -2.446 1.00 0.00 C ATOM 939 CD GLN A 62 3.022 -14.076 -3.711 1.00 0.00 C ATOM 940 OE1 GLN A 62 3.110 -15.302 -3.648 1.00 0.00 O ATOM 941 NE2 GLN A 62 3.109 -13.473 -4.865 1.00 0.00 N ATOM 0 H GLN A 62 3.840 -10.629 -1.872 1.00 0.00 H new ATOM 0 HA GLN A 62 3.168 -12.607 0.177 1.00 0.00 H new ATOM 0 HB2 GLN A 62 4.913 -12.749 -2.329 1.00 0.00 H new ATOM 0 HB3 GLN A 62 4.453 -14.118 -1.336 1.00 0.00 H new ATOM 0 HG2 GLN A 62 2.055 -13.716 -1.818 1.00 0.00 H new ATOM 0 HG3 GLN A 62 2.446 -12.257 -2.706 1.00 0.00 H new ATOM 0 HE21 GLN A 62 3.036 -12.457 -4.916 1.00 0.00 H new ATOM 0 HE22 GLN A 62 3.250 -14.018 -5.716 1.00 0.00 H new ATOM 950 N ARG A 63 5.892 -10.938 0.204 1.00 0.00 N ATOM 951 CA ARG A 63 7.159 -10.720 0.893 1.00 0.00 C ATOM 952 C ARG A 63 6.954 -10.681 2.404 1.00 0.00 C ATOM 953 O ARG A 63 7.838 -11.056 3.171 1.00 0.00 O ATOM 954 CB ARG A 63 7.785 -9.399 0.418 1.00 0.00 C ATOM 955 CG ARG A 63 8.047 -9.455 -1.104 1.00 0.00 C ATOM 956 CD ARG A 63 9.380 -10.164 -1.387 1.00 0.00 C ATOM 957 NE ARG A 63 9.623 -10.238 -2.823 1.00 0.00 N ATOM 958 CZ ARG A 63 10.078 -9.188 -3.499 1.00 0.00 C ATOM 959 NH1 ARG A 63 10.309 -8.063 -2.878 1.00 0.00 N ATOM 960 NH2 ARG A 63 10.290 -9.281 -4.783 1.00 0.00 N ATOM 0 H ARG A 63 5.561 -10.142 -0.341 1.00 0.00 H new ATOM 0 HA ARG A 63 7.829 -11.547 0.658 1.00 0.00 H new ATOM 0 HB2 ARG A 63 7.120 -8.568 0.650 1.00 0.00 H new ATOM 0 HB3 ARG A 63 8.719 -9.218 0.950 1.00 0.00 H new ATOM 0 HG2 ARG A 63 7.233 -9.983 -1.601 1.00 0.00 H new ATOM 0 HG3 ARG A 63 8.070 -8.445 -1.514 1.00 0.00 H new ATOM 0 HD2 ARG A 63 10.195 -9.627 -0.901 1.00 0.00 H new ATOM 0 HD3 ARG A 63 9.362 -11.168 -0.963 1.00 0.00 H new ATOM 0 HE ARG A 63 9.441 -11.111 -3.317 1.00 0.00 H new ATOM 0 HH11 ARG A 63 10.140 -7.990 -1.875 1.00 0.00 H new ATOM 0 HH12 ARG A 63 10.658 -7.257 -3.396 1.00 0.00 H new ATOM 0 HH21 ARG A 63 10.107 -10.159 -5.268 1.00 0.00 H new ATOM 0 HH22 ARG A 63 10.639 -8.475 -5.302 1.00 0.00 H new ATOM 974 N SER A 64 5.780 -10.220 2.824 1.00 0.00 N ATOM 975 CA SER A 64 5.474 -10.124 4.247 1.00 0.00 C ATOM 976 C SER A 64 5.486 -11.499 4.901 1.00 0.00 C ATOM 977 O SER A 64 5.670 -11.615 6.114 1.00 0.00 O ATOM 978 CB SER A 64 4.101 -9.498 4.445 1.00 0.00 C ATOM 979 OG SER A 64 3.100 -10.475 4.188 1.00 0.00 O ATOM 0 H SER A 64 5.031 -9.909 2.205 1.00 0.00 H new ATOM 0 HA SER A 64 6.239 -9.501 4.712 1.00 0.00 H new ATOM 0 HB2 SER A 64 4.004 -9.120 5.463 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.976 -8.647 3.775 1.00 0.00 H new ATOM 0 HG SER A 64 2.226 -10.130 4.467 1.00 0.00 H new ATOM 985 N THR A 65 5.289 -12.537 4.093 1.00 0.00 N ATOM 986 CA THR A 65 5.271 -13.895 4.615 1.00 0.00 C ATOM 987 C THR A 65 6.613 -14.238 5.249 1.00 0.00 C ATOM 988 O THR A 65 6.672 -14.920 6.267 1.00 0.00 O ATOM 989 CB THR A 65 4.972 -14.880 3.485 1.00 0.00 C ATOM 990 OG1 THR A 65 6.014 -14.817 2.520 1.00 0.00 O ATOM 991 CG2 THR A 65 3.641 -14.517 2.823 1.00 0.00 C ATOM 0 H THR A 65 5.141 -12.463 3.086 1.00 0.00 H new ATOM 0 HA THR A 65 4.493 -13.966 5.375 1.00 0.00 H new ATOM 0 HB THR A 65 4.908 -15.890 3.891 1.00 0.00 H new ATOM 0 HG1 THR A 65 5.699 -14.330 1.730 1.00 0.00 H new ATOM 0 HG21 THR A 65 3.431 -15.221 2.018 1.00 0.00 H new ATOM 0 HG22 THR A 65 2.842 -14.563 3.563 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.701 -13.508 2.416 1.00 0.00 H new ATOM 999 N ILE A 66 7.687 -13.759 4.642 1.00 0.00 N ATOM 1000 CA ILE A 66 9.024 -14.017 5.160 1.00 0.00 C ATOM 1001 C ILE A 66 9.216 -13.336 6.512 1.00 0.00 C ATOM 1002 O ILE A 66 9.749 -13.931 7.454 1.00 0.00 O ATOM 1003 CB ILE A 66 10.078 -13.505 4.170 1.00 0.00 C ATOM 1004 CG1 ILE A 66 10.029 -14.348 2.895 1.00 0.00 C ATOM 1005 CG2 ILE A 66 11.472 -13.615 4.798 1.00 0.00 C ATOM 1006 CD1 ILE A 66 10.861 -13.674 1.803 1.00 0.00 C ATOM 0 H ILE A 66 7.661 -13.192 3.794 1.00 0.00 H new ATOM 0 HA ILE A 66 9.142 -15.093 5.289 1.00 0.00 H new ATOM 0 HB ILE A 66 9.871 -12.462 3.929 1.00 0.00 H new ATOM 0 HG12 ILE A 66 10.413 -15.349 3.093 1.00 0.00 H new ATOM 0 HG13 ILE A 66 8.997 -14.463 2.562 1.00 0.00 H new ATOM 0 HG21 ILE A 66 12.219 -13.251 4.092 1.00 0.00 H new ATOM 0 HG22 ILE A 66 11.510 -13.016 5.708 1.00 0.00 H new ATOM 0 HG23 ILE A 66 11.680 -14.657 5.041 1.00 0.00 H new ATOM 0 HD11 ILE A 66 10.825 -14.276 0.895 1.00 0.00 H new ATOM 0 HD12 ILE A 66 10.457 -12.683 1.598 1.00 0.00 H new ATOM 0 HD13 ILE A 66 11.894 -13.583 2.137 1.00 0.00 H new ATOM 1018 N LEU A 67 8.788 -12.082 6.596 1.00 0.00 N ATOM 1019 CA LEU A 67 8.930 -11.331 7.834 1.00 0.00 C ATOM 1020 C LEU A 67 8.105 -11.940 8.962 1.00 0.00 C ATOM 1021 O LEU A 67 8.632 -12.244 10.027 1.00 0.00 O ATOM 1022 CB LEU A 67 8.470 -9.878 7.613 1.00 0.00 C ATOM 1023 CG LEU A 67 9.601 -9.055 6.953 1.00 0.00 C ATOM 1024 CD1 LEU A 67 9.006 -7.788 6.287 1.00 0.00 C ATOM 1025 CD2 LEU A 67 10.652 -8.649 8.038 1.00 0.00 C ATOM 0 H LEU A 67 8.346 -11.571 5.832 1.00 0.00 H new ATOM 0 HA LEU A 67 9.982 -11.362 8.119 1.00 0.00 H new ATOM 0 HB2 LEU A 67 7.582 -9.862 6.981 1.00 0.00 H new ATOM 0 HB3 LEU A 67 8.191 -9.428 8.566 1.00 0.00 H new ATOM 0 HG LEU A 67 10.091 -9.658 6.189 1.00 0.00 H new ATOM 0 HD11 LEU A 67 9.806 -7.211 5.823 1.00 0.00 H new ATOM 0 HD12 LEU A 67 8.283 -8.082 5.526 1.00 0.00 H new ATOM 0 HD13 LEU A 67 8.510 -7.179 7.043 1.00 0.00 H new ATOM 0 HD21 LEU A 67 11.449 -8.069 7.573 1.00 0.00 H new ATOM 0 HD22 LEU A 67 10.167 -8.048 8.807 1.00 0.00 H new ATOM 0 HD23 LEU A 67 11.073 -9.547 8.491 1.00 0.00 H new ATOM 1037 N ALA A 68 6.816 -12.134 8.709 1.00 0.00 N ATOM 1038 CA ALA A 68 5.925 -12.689 9.723 1.00 0.00 C ATOM 1039 C ALA A 68 6.451 -14.016 10.234 1.00 0.00 C ATOM 1040 O ALA A 68 6.345 -14.316 11.422 1.00 0.00 O ATOM 1041 CB ALA A 68 4.529 -12.889 9.136 1.00 0.00 C ATOM 0 H ALA A 68 6.367 -11.918 7.819 1.00 0.00 H new ATOM 0 HA ALA A 68 5.876 -11.987 10.555 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.870 -13.303 9.899 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.136 -11.930 8.798 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.584 -13.576 8.292 1.00 0.00 H new ATOM 1047 N VAL A 69 7.019 -14.801 9.337 1.00 0.00 N ATOM 1048 CA VAL A 69 7.549 -16.089 9.731 1.00 0.00 C ATOM 1049 C VAL A 69 8.657 -15.936 10.771 1.00 0.00 C ATOM 1050 O VAL A 69 8.472 -16.271 11.928 1.00 0.00 O ATOM 1051 CB VAL A 69 8.109 -16.812 8.488 1.00 0.00 C ATOM 1052 CG1 VAL A 69 8.918 -18.047 8.923 1.00 0.00 C ATOM 1053 CG2 VAL A 69 6.943 -17.260 7.574 1.00 0.00 C ATOM 0 H VAL A 69 7.123 -14.573 8.348 1.00 0.00 H new ATOM 0 HA VAL A 69 6.742 -16.672 10.174 1.00 0.00 H new ATOM 0 HB VAL A 69 8.758 -16.127 7.941 1.00 0.00 H new ATOM 0 HG11 VAL A 69 9.311 -18.554 8.041 1.00 0.00 H new ATOM 0 HG12 VAL A 69 9.745 -17.734 9.561 1.00 0.00 H new ATOM 0 HG13 VAL A 69 8.272 -18.729 9.476 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.343 -17.770 6.698 1.00 0.00 H new ATOM 0 HG22 VAL A 69 6.291 -17.939 8.123 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.373 -16.387 7.257 1.00 0.00 H new ATOM 1063 N ASP A 70 9.793 -15.408 10.355 1.00 0.00 N ATOM 1064 CA ASP A 70 10.926 -15.234 11.265 1.00 0.00 C ATOM 1065 C ASP A 70 10.578 -14.341 12.462 1.00 0.00 C ATOM 1066 O ASP A 70 11.100 -14.522 13.562 1.00 0.00 O ATOM 1067 CB ASP A 70 12.108 -14.629 10.506 1.00 0.00 C ATOM 1068 CG ASP A 70 13.359 -14.659 11.377 1.00 0.00 C ATOM 1069 OD1 ASP A 70 13.221 -14.871 12.571 1.00 0.00 O ATOM 1070 OD2 ASP A 70 14.437 -14.472 10.838 1.00 0.00 O ATOM 0 H ASP A 70 9.962 -15.092 9.400 1.00 0.00 H new ATOM 0 HA ASP A 70 11.188 -16.219 11.652 1.00 0.00 H new ATOM 0 HB2 ASP A 70 12.283 -15.186 9.585 1.00 0.00 H new ATOM 0 HB3 ASP A 70 11.879 -13.603 10.219 1.00 0.00 H new ATOM 1075 N ASN A 71 9.708 -13.365 12.238 1.00 0.00 N ATOM 1076 CA ASN A 71 9.312 -12.442 13.305 1.00 0.00 C ATOM 1077 C ASN A 71 8.487 -13.117 14.418 1.00 0.00 C ATOM 1078 O ASN A 71 8.663 -12.825 15.600 1.00 0.00 O ATOM 1079 CB ASN A 71 8.482 -11.297 12.712 1.00 0.00 C ATOM 1080 CG ASN A 71 9.373 -10.378 11.880 1.00 0.00 C ATOM 1081 OD1 ASN A 71 9.050 -10.064 10.735 1.00 0.00 O ATOM 1082 ND2 ASN A 71 10.485 -9.925 12.392 1.00 0.00 N ATOM 0 H ASN A 71 9.264 -13.189 11.337 1.00 0.00 H new ATOM 0 HA ASN A 71 10.235 -12.074 13.754 1.00 0.00 H new ATOM 0 HB2 ASN A 71 7.683 -11.701 12.091 1.00 0.00 H new ATOM 0 HB3 ASN A 71 8.008 -10.729 13.512 1.00 0.00 H new ATOM 0 HD21 ASN A 71 11.086 -9.311 11.843 1.00 0.00 H new ATOM 0 HD22 ASN A 71 10.753 -10.185 13.341 1.00 0.00 H new ATOM 1089 N LEU A 72 7.579 -14.020 14.033 1.00 0.00 N ATOM 1090 CA LEU A 72 6.711 -14.715 15.009 1.00 0.00 C ATOM 1091 C LEU A 72 7.108 -16.191 15.205 1.00 0.00 C ATOM 1092 O LEU A 72 6.634 -16.860 16.122 1.00 0.00 O ATOM 1093 CB LEU A 72 5.263 -14.625 14.519 1.00 0.00 C ATOM 1094 CG LEU A 72 4.864 -13.142 14.334 1.00 0.00 C ATOM 1095 CD1 LEU A 72 3.421 -13.070 13.830 1.00 0.00 C ATOM 1096 CD2 LEU A 72 4.979 -12.381 15.679 1.00 0.00 C ATOM 0 H LEU A 72 7.421 -14.290 13.062 1.00 0.00 H new ATOM 0 HA LEU A 72 6.826 -14.227 15.977 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.155 -15.161 13.576 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.596 -15.104 15.236 1.00 0.00 H new ATOM 0 HG LEU A 72 5.535 -12.680 13.611 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.133 -12.027 13.698 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.342 -13.592 12.876 1.00 0.00 H new ATOM 0 HD13 LEU A 72 2.758 -13.540 14.557 1.00 0.00 H new ATOM 0 HD21 LEU A 72 4.695 -11.339 15.533 1.00 0.00 H new ATOM 0 HD22 LEU A 72 4.316 -12.838 16.414 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.007 -12.430 16.038 1.00 0.00 H new ATOM 1108 N ASN A 73 7.980 -16.693 14.345 1.00 0.00 N ATOM 1109 CA ASN A 73 8.433 -18.091 14.435 1.00 0.00 C ATOM 1110 C ASN A 73 9.326 -18.287 15.652 1.00 0.00 C ATOM 1111 O ASN A 73 10.364 -17.638 15.783 1.00 0.00 O ATOM 1112 CB ASN A 73 9.200 -18.484 13.170 1.00 0.00 C ATOM 1113 CG ASN A 73 9.767 -19.894 13.302 1.00 0.00 C ATOM 1114 OD1 ASN A 73 9.028 -20.844 13.551 1.00 0.00 O ATOM 1115 ND2 ASN A 73 11.048 -20.084 13.144 1.00 0.00 N ATOM 0 H ASN A 73 8.392 -16.164 13.577 1.00 0.00 H new ATOM 0 HA ASN A 73 7.553 -18.727 14.534 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.538 -18.432 12.306 1.00 0.00 H new ATOM 0 HB3 ASN A 73 10.010 -17.776 12.994 1.00 0.00 H new ATOM 0 HD21 ASN A 73 11.438 -21.023 13.227 1.00 0.00 H new ATOM 0 HD22 ASN A 73 11.659 -19.294 12.937 1.00 0.00 H new ATOM 1122 N GLY A 74 8.919 -19.190 16.541 1.00 0.00 N ATOM 1123 CA GLY A 74 9.691 -19.465 17.747 1.00 0.00 C ATOM 1124 C GLY A 74 9.340 -18.476 18.854 1.00 0.00 C ATOM 1125 O GLY A 74 9.935 -18.503 19.931 1.00 0.00 O ATOM 0 H GLY A 74 8.065 -19.740 16.449 1.00 0.00 H new ATOM 0 HA2 GLY A 74 9.494 -20.482 18.086 1.00 0.00 H new ATOM 0 HA3 GLY A 74 10.756 -19.404 17.524 1.00 0.00 H new ATOM 1129 N PHE A 75 8.367 -17.601 18.586 1.00 0.00 N ATOM 1130 CA PHE A 75 7.944 -16.604 19.571 1.00 0.00 C ATOM 1131 C PHE A 75 6.762 -17.120 20.378 1.00 0.00 C ATOM 1132 O PHE A 75 5.698 -17.405 19.827 1.00 0.00 O ATOM 1133 CB PHE A 75 7.552 -15.302 18.868 1.00 0.00 C ATOM 1134 CG PHE A 75 7.114 -14.284 19.895 1.00 0.00 C ATOM 1135 CD1 PHE A 75 8.064 -13.664 20.715 1.00 0.00 C ATOM 1136 CD2 PHE A 75 5.757 -13.959 20.028 1.00 0.00 C ATOM 1137 CE1 PHE A 75 7.658 -12.721 21.667 1.00 0.00 C ATOM 1138 CE2 PHE A 75 5.351 -13.017 20.980 1.00 0.00 C ATOM 1139 CZ PHE A 75 6.302 -12.397 21.800 1.00 0.00 C ATOM 0 H PHE A 75 7.861 -17.563 17.701 1.00 0.00 H new ATOM 0 HA PHE A 75 8.779 -16.414 20.246 1.00 0.00 H new ATOM 0 HB2 PHE A 75 8.396 -14.917 18.297 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.746 -15.488 18.159 1.00 0.00 H new ATOM 0 HD1 PHE A 75 9.110 -13.913 20.613 1.00 0.00 H new ATOM 0 HD2 PHE A 75 5.024 -14.436 19.395 1.00 0.00 H new ATOM 0 HE1 PHE A 75 8.391 -12.243 22.299 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.305 -12.768 21.082 1.00 0.00 H new ATOM 0 HZ PHE A 75 5.990 -11.669 22.535 1.00 0.00 H new ATOM 1149 N LYS A 76 6.953 -17.236 21.688 1.00 0.00 N ATOM 1150 CA LYS A 76 5.893 -17.719 22.559 1.00 0.00 C ATOM 1151 C LYS A 76 4.764 -16.696 22.616 1.00 0.00 C ATOM 1152 O LYS A 76 4.974 -15.544 22.998 1.00 0.00 O ATOM 1153 CB LYS A 76 6.453 -17.975 23.976 1.00 0.00 C ATOM 1154 CG LYS A 76 6.986 -19.413 24.078 1.00 0.00 C ATOM 1155 CD LYS A 76 8.094 -19.625 23.040 1.00 0.00 C ATOM 1156 CE LYS A 76 8.689 -21.024 23.206 1.00 0.00 C ATOM 1157 NZ LYS A 76 9.437 -21.094 24.493 1.00 0.00 N ATOM 0 H LYS A 76 7.824 -17.004 22.165 1.00 0.00 H new ATOM 0 HA LYS A 76 5.501 -18.655 22.161 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.252 -17.266 24.194 1.00 0.00 H new ATOM 0 HB3 LYS A 76 5.672 -17.814 24.719 1.00 0.00 H new ATOM 0 HG2 LYS A 76 7.372 -19.598 25.080 1.00 0.00 H new ATOM 0 HG3 LYS A 76 6.177 -20.124 23.912 1.00 0.00 H new ATOM 0 HD2 LYS A 76 7.692 -19.507 22.034 1.00 0.00 H new ATOM 0 HD3 LYS A 76 8.871 -18.871 23.163 1.00 0.00 H new ATOM 0 HE2 LYS A 76 7.897 -21.772 23.192 1.00 0.00 H new ATOM 0 HE3 LYS A 76 9.355 -21.249 22.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 10.108 -21.888 24.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 9.958 -20.206 24.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 8.768 -21.236 25.276 1.00 0.00 H new ATOM 1171 N ILE A 77 3.563 -17.124 22.241 1.00 0.00 N ATOM 1172 CA ILE A 77 2.406 -16.232 22.258 1.00 0.00 C ATOM 1173 C ILE A 77 1.157 -16.984 22.727 1.00 0.00 C ATOM 1174 O ILE A 77 0.826 -18.044 22.198 1.00 0.00 O ATOM 1175 CB ILE A 77 2.177 -15.655 20.843 1.00 0.00 C ATOM 1176 CG1 ILE A 77 1.270 -14.419 20.927 1.00 0.00 C ATOM 1177 CG2 ILE A 77 1.508 -16.712 19.953 1.00 0.00 C ATOM 1178 CD1 ILE A 77 1.331 -13.637 19.607 1.00 0.00 C ATOM 0 H ILE A 77 3.365 -18.073 21.924 1.00 0.00 H new ATOM 0 HA ILE A 77 2.599 -15.416 22.954 1.00 0.00 H new ATOM 0 HB ILE A 77 3.139 -15.374 20.415 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.244 -14.723 21.133 1.00 0.00 H new ATOM 0 HG13 ILE A 77 1.585 -13.781 21.753 1.00 0.00 H new ATOM 0 HG21 ILE A 77 1.349 -16.300 18.956 1.00 0.00 H new ATOM 0 HG22 ILE A 77 2.151 -17.590 19.885 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.549 -16.997 20.385 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.685 -12.761 19.673 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.357 -13.319 19.420 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.994 -14.275 18.790 1.00 0.00 H new ATOM 1190 N GLY A 78 0.469 -16.426 23.716 1.00 0.00 N ATOM 1191 CA GLY A 78 -0.743 -17.051 24.235 1.00 0.00 C ATOM 1192 C GLY A 78 -0.414 -18.294 25.057 1.00 0.00 C ATOM 1193 O GLY A 78 -1.286 -19.120 25.324 1.00 0.00 O ATOM 0 H GLY A 78 0.726 -15.550 24.172 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -1.288 -16.337 24.853 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.399 -17.322 23.407 1.00 0.00 H new ATOM 1197 N GLY A 79 0.851 -18.423 25.456 1.00 0.00 N ATOM 1198 CA GLY A 79 1.286 -19.575 26.248 1.00 0.00 C ATOM 1199 C GLY A 79 1.790 -20.698 25.346 1.00 0.00 C ATOM 1200 O GLY A 79 2.339 -21.692 25.823 1.00 0.00 O ATOM 0 H GLY A 79 1.588 -17.750 25.246 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.077 -19.272 26.934 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.457 -19.937 26.857 1.00 0.00 H new ATOM 1204 N ARG A 80 1.606 -20.536 24.036 1.00 0.00 N ATOM 1205 CA ARG A 80 2.049 -21.541 23.066 1.00 0.00 C ATOM 1206 C ARG A 80 2.710 -20.874 21.867 1.00 0.00 C ATOM 1207 O ARG A 80 2.501 -19.691 21.610 1.00 0.00 O ATOM 1208 CB ARG A 80 0.862 -22.375 22.595 1.00 0.00 C ATOM 1209 CG ARG A 80 0.400 -23.283 23.731 1.00 0.00 C ATOM 1210 CD ARG A 80 -0.901 -23.971 23.329 1.00 0.00 C ATOM 1211 NE ARG A 80 -1.324 -24.903 24.373 1.00 0.00 N ATOM 1212 CZ ARG A 80 -0.892 -26.162 24.390 1.00 0.00 C ATOM 1213 NH1 ARG A 80 -0.077 -26.584 23.461 1.00 0.00 N ATOM 1214 NH2 ARG A 80 -1.282 -26.974 25.334 1.00 0.00 N ATOM 0 H ARG A 80 1.154 -19.721 23.621 1.00 0.00 H new ATOM 0 HA ARG A 80 2.776 -22.190 23.554 1.00 0.00 H new ATOM 0 HB2 ARG A 80 0.047 -21.723 22.281 1.00 0.00 H new ATOM 0 HB3 ARG A 80 1.144 -22.973 21.728 1.00 0.00 H new ATOM 0 HG2 ARG A 80 1.165 -24.027 23.951 1.00 0.00 H new ATOM 0 HG3 ARG A 80 0.251 -22.700 24.640 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -1.678 -23.225 23.161 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -0.763 -24.505 22.389 1.00 0.00 H new ATOM 0 HE ARG A 80 -1.962 -24.583 25.102 1.00 0.00 H new ATOM 0 HH11 ARG A 80 0.228 -25.949 22.723 1.00 0.00 H new ATOM 0 HH12 ARG A 80 0.255 -27.549 23.473 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -1.918 -26.644 26.060 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -0.950 -27.939 25.346 1.00 0.00 H new ATOM 1228 N ALA A 81 3.514 -21.644 21.135 1.00 0.00 N ATOM 1229 CA ALA A 81 4.206 -21.116 19.959 1.00 0.00 C ATOM 1230 C ALA A 81 3.457 -21.494 18.684 1.00 0.00 C ATOM 1231 O ALA A 81 3.130 -22.661 18.466 1.00 0.00 O ATOM 1232 CB ALA A 81 5.631 -21.668 19.898 1.00 0.00 C ATOM 0 H ALA A 81 3.702 -22.627 21.333 1.00 0.00 H new ATOM 0 HA ALA A 81 4.242 -20.030 20.039 1.00 0.00 H new ATOM 0 HB1 ALA A 81 6.138 -21.269 19.019 1.00 0.00 H new ATOM 0 HB2 ALA A 81 6.174 -21.373 20.796 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.597 -22.756 19.835 1.00 0.00 H new ATOM 1238 N LEU A 82 3.190 -20.500 17.842 1.00 0.00 N ATOM 1239 CA LEU A 82 2.477 -20.726 16.583 1.00 0.00 C ATOM 1240 C LEU A 82 3.459 -21.165 15.488 1.00 0.00 C ATOM 1241 O LEU A 82 4.649 -20.859 15.549 1.00 0.00 O ATOM 1242 CB LEU A 82 1.733 -19.437 16.145 1.00 0.00 C ATOM 1243 CG LEU A 82 2.484 -18.197 16.659 1.00 0.00 C ATOM 1244 CD1 LEU A 82 3.927 -18.216 16.142 1.00 0.00 C ATOM 1245 CD2 LEU A 82 1.784 -16.929 16.160 1.00 0.00 C ATOM 0 H LEU A 82 3.456 -19.529 18.006 1.00 0.00 H new ATOM 0 HA LEU A 82 1.744 -21.518 16.737 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.657 -19.402 15.058 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.715 -19.444 16.535 1.00 0.00 H new ATOM 0 HG LEU A 82 2.488 -18.207 17.749 1.00 0.00 H new ATOM 0 HD11 LEU A 82 4.456 -17.336 16.508 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.429 -19.116 16.498 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.923 -18.210 15.052 1.00 0.00 H new ATOM 0 HD21 LEU A 82 2.317 -16.051 16.525 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.777 -16.922 15.070 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.759 -16.910 16.529 1.00 0.00 H new ATOM 1257 N LYS A 83 2.951 -21.883 14.482 1.00 0.00 N ATOM 1258 CA LYS A 83 3.795 -22.355 13.374 1.00 0.00 C ATOM 1259 C LYS A 83 3.429 -21.632 12.080 1.00 0.00 C ATOM 1260 O LYS A 83 2.280 -21.678 11.639 1.00 0.00 O ATOM 1261 CB LYS A 83 3.623 -23.874 13.182 1.00 0.00 C ATOM 1262 CG LYS A 83 4.656 -24.412 12.162 1.00 0.00 C ATOM 1263 CD LYS A 83 6.052 -24.483 12.808 1.00 0.00 C ATOM 1264 CE LYS A 83 6.994 -25.301 11.922 1.00 0.00 C ATOM 1265 NZ LYS A 83 8.338 -25.372 12.562 1.00 0.00 N ATOM 0 H LYS A 83 1.969 -22.150 14.409 1.00 0.00 H new ATOM 0 HA LYS A 83 4.835 -22.140 13.620 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.747 -24.384 14.137 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.613 -24.090 12.834 1.00 0.00 H new ATOM 0 HG2 LYS A 83 4.356 -25.401 11.817 1.00 0.00 H new ATOM 0 HG3 LYS A 83 4.685 -23.764 11.286 1.00 0.00 H new ATOM 0 HD2 LYS A 83 6.450 -23.478 12.946 1.00 0.00 H new ATOM 0 HD3 LYS A 83 5.982 -24.937 13.796 1.00 0.00 H new ATOM 0 HE2 LYS A 83 6.595 -26.305 11.777 1.00 0.00 H new ATOM 0 HE3 LYS A 83 7.072 -24.844 10.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 8.980 -25.928 11.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 8.718 -24.411 12.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 8.255 -25.827 13.494 1.00 0.00 H new ATOM 1279 N ILE A 84 4.419 -20.963 11.473 1.00 0.00 N ATOM 1280 CA ILE A 84 4.194 -20.220 10.225 1.00 0.00 C ATOM 1281 C ILE A 84 4.828 -20.968 9.046 1.00 0.00 C ATOM 1282 O ILE A 84 6.040 -21.173 9.008 1.00 0.00 O ATOM 1283 CB ILE A 84 4.802 -18.791 10.330 1.00 0.00 C ATOM 1284 CG1 ILE A 84 4.599 -18.214 11.771 1.00 0.00 C ATOM 1285 CG2 ILE A 84 4.111 -17.864 9.305 1.00 0.00 C ATOM 1286 CD1 ILE A 84 3.147 -17.765 11.971 1.00 0.00 C ATOM 0 H ILE A 84 5.376 -20.921 11.822 1.00 0.00 H new ATOM 0 HA ILE A 84 3.120 -20.136 10.059 1.00 0.00 H new ATOM 0 HB ILE A 84 5.870 -18.847 10.121 1.00 0.00 H new ATOM 0 HG12 ILE A 84 4.857 -18.971 12.512 1.00 0.00 H new ATOM 0 HG13 ILE A 84 5.271 -17.371 11.929 1.00 0.00 H new ATOM 0 HG21 ILE A 84 4.535 -16.862 9.376 1.00 0.00 H new ATOM 0 HG22 ILE A 84 4.267 -18.253 8.299 1.00 0.00 H new ATOM 0 HG23 ILE A 84 3.042 -17.821 9.515 1.00 0.00 H new ATOM 0 HD11 ILE A 84 3.025 -17.367 12.978 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.902 -16.992 11.243 1.00 0.00 H new ATOM 0 HD13 ILE A 84 2.481 -18.617 11.834 1.00 0.00 H new ATOM 1298 N ASP A 85 3.999 -21.376 8.087 1.00 0.00 N ATOM 1299 CA ASP A 85 4.488 -22.100 6.905 1.00 0.00 C ATOM 1300 C ASP A 85 3.727 -21.669 5.651 1.00 0.00 C ATOM 1301 O ASP A 85 2.533 -21.381 5.708 1.00 0.00 O ATOM 1302 CB ASP A 85 4.327 -23.607 7.116 1.00 0.00 C ATOM 1303 CG ASP A 85 5.113 -24.052 8.345 1.00 0.00 C ATOM 1304 OD1 ASP A 85 6.263 -23.663 8.460 1.00 0.00 O ATOM 1305 OD2 ASP A 85 4.553 -24.776 9.152 1.00 0.00 O ATOM 0 H ASP A 85 2.991 -21.221 8.100 1.00 0.00 H new ATOM 0 HA ASP A 85 5.543 -21.863 6.768 1.00 0.00 H new ATOM 0 HB2 ASP A 85 3.273 -23.854 7.240 1.00 0.00 H new ATOM 0 HB3 ASP A 85 4.679 -24.145 6.236 1.00 0.00 H new ATOM 1310 N HIS A 86 4.427 -21.624 4.519 1.00 0.00 N ATOM 1311 CA HIS A 86 3.801 -21.221 3.261 1.00 0.00 C ATOM 1312 C HIS A 86 2.929 -22.345 2.704 1.00 0.00 C ATOM 1313 O HIS A 86 3.266 -23.523 2.832 1.00 0.00 O ATOM 1314 CB HIS A 86 4.884 -20.865 2.237 1.00 0.00 C ATOM 1315 CG HIS A 86 5.883 -19.931 2.863 1.00 0.00 C ATOM 1316 ND1 HIS A 86 5.726 -18.555 2.846 1.00 0.00 N ATOM 1317 CD2 HIS A 86 7.059 -20.165 3.534 1.00 0.00 C ATOM 1318 CE1 HIS A 86 6.782 -18.018 3.485 1.00 0.00 C ATOM 1319 NE2 HIS A 86 7.625 -18.955 3.926 1.00 0.00 N ATOM 0 H HIS A 86 5.417 -21.859 4.446 1.00 0.00 H new ATOM 0 HA HIS A 86 3.172 -20.352 3.453 1.00 0.00 H new ATOM 0 HB2 HIS A 86 5.384 -21.770 1.892 1.00 0.00 H new ATOM 0 HB3 HIS A 86 4.432 -20.397 1.362 1.00 0.00 H new ATOM 0 HD2 HIS A 86 7.481 -21.140 3.728 1.00 0.00 H new ATOM 0 HE1 HIS A 86 6.930 -16.957 3.624 1.00 0.00 H new ATOM 0 HE2 HIS A 86 8.495 -18.815 4.439 1.00 0.00 H new ATOM 1328 N THR A 87 1.807 -21.975 2.083 1.00 0.00 N ATOM 1329 CA THR A 87 0.895 -22.964 1.504 1.00 0.00 C ATOM 1330 C THR A 87 0.111 -22.362 0.341 1.00 0.00 C ATOM 1331 O THR A 87 -0.255 -21.187 0.370 1.00 0.00 O ATOM 1332 CB THR A 87 -0.085 -23.465 2.574 1.00 0.00 C ATOM 1333 OG1 THR A 87 -0.887 -24.503 2.032 1.00 0.00 O ATOM 1334 CG2 THR A 87 -0.985 -22.310 3.036 1.00 0.00 C ATOM 0 H THR A 87 1.510 -21.006 1.969 1.00 0.00 H new ATOM 0 HA THR A 87 1.490 -23.799 1.133 1.00 0.00 H new ATOM 0 HB THR A 87 0.477 -23.846 3.427 1.00 0.00 H new ATOM 0 HG1 THR A 87 -1.512 -24.824 2.715 1.00 0.00 H new ATOM 0 HG21 THR A 87 -1.679 -22.671 3.795 1.00 0.00 H new ATOM 0 HG22 THR A 87 -0.369 -21.514 3.456 1.00 0.00 H new ATOM 0 HG23 THR A 87 -1.547 -21.924 2.185 1.00 0.00 H new ATOM 1342 N PHE A 88 -0.149 -23.176 -0.682 1.00 0.00 N ATOM 1343 CA PHE A 88 -0.896 -22.714 -1.850 1.00 0.00 C ATOM 1344 C PHE A 88 -2.393 -22.906 -1.632 1.00 0.00 C ATOM 1345 O PHE A 88 -3.177 -22.873 -2.579 1.00 0.00 O ATOM 1346 CB PHE A 88 -0.457 -23.488 -3.095 1.00 0.00 C ATOM 1347 CG PHE A 88 -0.713 -24.961 -2.891 1.00 0.00 C ATOM 1348 CD1 PHE A 88 0.262 -25.763 -2.287 1.00 0.00 C ATOM 1349 CD2 PHE A 88 -1.926 -25.525 -3.305 1.00 0.00 C ATOM 1350 CE1 PHE A 88 0.025 -27.130 -2.096 1.00 0.00 C ATOM 1351 CE2 PHE A 88 -2.163 -26.891 -3.115 1.00 0.00 C ATOM 1352 CZ PHE A 88 -1.187 -27.694 -2.511 1.00 0.00 C ATOM 0 H PHE A 88 0.145 -24.152 -0.725 1.00 0.00 H new ATOM 0 HA PHE A 88 -0.690 -21.653 -1.994 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -1.003 -23.131 -3.969 1.00 0.00 H new ATOM 0 HB3 PHE A 88 0.602 -23.316 -3.288 1.00 0.00 H new ATOM 0 HD1 PHE A 88 1.197 -25.328 -1.968 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -2.678 -24.906 -3.771 1.00 0.00 H new ATOM 0 HE1 PHE A 88 0.777 -27.749 -1.629 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -3.099 -27.326 -3.434 1.00 0.00 H new ATOM 0 HZ PHE A 88 -1.370 -28.748 -2.365 1.00 0.00 H new ATOM 1362 N TYR A 89 -2.779 -23.108 -0.378 1.00 0.00 N ATOM 1363 CA TYR A 89 -4.185 -23.309 -0.053 1.00 0.00 C ATOM 1364 C TYR A 89 -5.046 -22.234 -0.716 1.00 0.00 C ATOM 1365 O TYR A 89 -4.884 -21.043 -0.451 1.00 0.00 O ATOM 1366 CB TYR A 89 -4.376 -23.263 1.470 1.00 0.00 C ATOM 1367 CG TYR A 89 -5.851 -23.241 1.801 1.00 0.00 C ATOM 1368 CD1 TYR A 89 -6.635 -24.378 1.585 1.00 0.00 C ATOM 1369 CD2 TYR A 89 -6.434 -22.076 2.316 1.00 0.00 C ATOM 1370 CE1 TYR A 89 -8.003 -24.354 1.883 1.00 0.00 C ATOM 1371 CE2 TYR A 89 -7.801 -22.051 2.615 1.00 0.00 C ATOM 1372 CZ TYR A 89 -8.586 -23.190 2.398 1.00 0.00 C ATOM 1373 OH TYR A 89 -9.934 -23.165 2.692 1.00 0.00 O ATOM 0 H TYR A 89 -2.147 -23.137 0.422 1.00 0.00 H new ATOM 0 HA TYR A 89 -4.495 -24.284 -0.428 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -3.903 -24.130 1.931 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -3.889 -22.379 1.880 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -6.185 -25.276 1.188 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -5.829 -21.197 2.482 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -8.608 -25.233 1.716 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -8.250 -21.153 3.013 1.00 0.00 H new ATOM 0 HH TYR A 89 -10.176 -22.282 3.042 1.00 0.00 H new ATOM 2031 N PHE B 311 13.011 -5.258 4.887 1.00 0.00 N ATOM 2032 CA PHE B 311 11.718 -4.645 4.618 1.00 0.00 C ATOM 2033 C PHE B 311 11.120 -4.113 5.915 1.00 0.00 C ATOM 2034 O PHE B 311 10.692 -4.884 6.773 1.00 0.00 O ATOM 2035 CB PHE B 311 10.741 -5.677 3.957 1.00 0.00 C ATOM 2036 CG PHE B 311 11.405 -7.048 3.847 1.00 0.00 C ATOM 2037 CD1 PHE B 311 11.883 -7.689 4.998 1.00 0.00 C ATOM 2038 CD2 PHE B 311 11.548 -7.667 2.597 1.00 0.00 C ATOM 2039 CE1 PHE B 311 12.503 -8.940 4.901 1.00 0.00 C ATOM 2040 CE2 PHE B 311 12.168 -8.918 2.501 1.00 0.00 C ATOM 2041 CZ PHE B 311 12.646 -9.555 3.655 1.00 0.00 C ATOM 0 HA PHE B 311 11.863 -3.818 3.923 1.00 0.00 H new ATOM 0 HB2 PHE B 311 9.829 -5.754 4.549 1.00 0.00 H new ATOM 0 HB3 PHE B 311 10.449 -5.327 2.967 1.00 0.00 H new ATOM 0 HD1 PHE B 311 11.773 -7.216 5.963 1.00 0.00 H new ATOM 0 HD2 PHE B 311 11.179 -7.178 1.707 1.00 0.00 H new ATOM 0 HE1 PHE B 311 12.871 -9.430 5.790 1.00 0.00 H new ATOM 0 HE2 PHE B 311 12.278 -9.393 1.537 1.00 0.00 H new ATOM 0 HZ PHE B 311 13.124 -10.520 3.581 1.00 0.00 H new ATOM 2051 N ALA B 312 11.091 -2.794 6.050 1.00 0.00 N ATOM 2052 CA ALA B 312 10.535 -2.173 7.245 1.00 0.00 C ATOM 2053 C ALA B 312 9.050 -1.898 7.054 1.00 0.00 C ATOM 2054 O ALA B 312 8.648 -0.771 6.762 1.00 0.00 O ATOM 2055 CB ALA B 312 11.266 -0.863 7.544 1.00 0.00 C ATOM 0 H ALA B 312 11.443 -2.138 5.353 1.00 0.00 H new ATOM 0 HA ALA B 312 10.665 -2.856 8.084 1.00 0.00 H new ATOM 0 HB1 ALA B 312 10.843 -0.406 8.439 1.00 0.00 H new ATOM 0 HB2 ALA B 312 12.325 -1.066 7.706 1.00 0.00 H new ATOM 0 HB3 ALA B 312 11.152 -0.182 6.701 1.00 0.00 H new ATOM 2061 N ILE B 313 8.238 -2.936 7.219 1.00 0.00 N ATOM 2062 CA ILE B 313 6.793 -2.792 7.056 1.00 0.00 C ATOM 2063 C ILE B 313 6.238 -1.788 8.064 1.00 0.00 C ATOM 2064 O ILE B 313 6.469 -1.906 9.266 1.00 0.00 O ATOM 2065 CB ILE B 313 6.112 -4.146 7.261 1.00 0.00 C ATOM 2066 CG1 ILE B 313 6.827 -5.211 6.406 1.00 0.00 C ATOM 2067 CG2 ILE B 313 4.642 -4.050 6.836 1.00 0.00 C ATOM 2068 CD1 ILE B 313 6.845 -4.791 4.925 1.00 0.00 C ATOM 0 H ILE B 313 8.549 -3.876 7.463 1.00 0.00 H new ATOM 0 HA ILE B 313 6.592 -2.429 6.048 1.00 0.00 H new ATOM 0 HB ILE B 313 6.166 -4.426 8.313 1.00 0.00 H new ATOM 0 HG12 ILE B 313 7.848 -5.348 6.764 1.00 0.00 H new ATOM 0 HG13 ILE B 313 6.321 -6.171 6.512 1.00 0.00 H new ATOM 0 HG21 ILE B 313 4.157 -5.015 6.982 1.00 0.00 H new ATOM 0 HG22 ILE B 313 4.137 -3.295 7.439 1.00 0.00 H new ATOM 0 HG23 ILE B 313 4.585 -3.771 5.784 1.00 0.00 H new ATOM 0 HD11 ILE B 313 7.354 -5.555 4.336 1.00 0.00 H new ATOM 0 HD12 ILE B 313 5.822 -4.678 4.566 1.00 0.00 H new ATOM 0 HD13 ILE B 313 7.372 -3.843 4.822 1.00 0.00 H new ATOM 2080 N MET B 314 5.506 -0.798 7.560 1.00 0.00 N ATOM 2081 CA MET B 314 4.922 0.224 8.422 1.00 0.00 C ATOM 2082 C MET B 314 3.709 -0.326 9.193 1.00 0.00 C ATOM 2083 O MET B 314 3.004 -1.205 8.696 1.00 0.00 O ATOM 2084 CB MET B 314 4.493 1.431 7.581 1.00 0.00 C ATOM 2085 CG MET B 314 5.732 2.174 7.083 1.00 0.00 C ATOM 2086 SD MET B 314 6.657 1.114 5.946 1.00 0.00 S ATOM 2087 CE MET B 314 8.165 2.111 5.884 1.00 0.00 C ATOM 0 H MET B 314 5.304 -0.682 6.567 1.00 0.00 H new ATOM 0 HA MET B 314 5.678 0.530 9.145 1.00 0.00 H new ATOM 0 HB2 MET B 314 3.889 1.102 6.735 1.00 0.00 H new ATOM 0 HB3 MET B 314 3.870 2.099 8.176 1.00 0.00 H new ATOM 0 HG2 MET B 314 5.439 3.095 6.580 1.00 0.00 H new ATOM 0 HG3 MET B 314 6.362 2.458 7.926 1.00 0.00 H new ATOM 0 HE1 MET B 314 8.890 1.633 5.225 1.00 0.00 H new ATOM 0 HE2 MET B 314 7.929 3.105 5.504 1.00 0.00 H new ATOM 0 HE3 MET B 314 8.586 2.196 6.886 1.00 0.00 H new ATOM 2097 N PRO B 315 3.450 0.181 10.386 1.00 0.00 N ATOM 2098 CA PRO B 315 2.292 -0.266 11.227 1.00 0.00 C ATOM 2099 C PRO B 315 0.949 0.161 10.630 1.00 0.00 C ATOM 2100 O PRO B 315 0.878 1.128 9.871 1.00 0.00 O ATOM 2101 CB PRO B 315 2.541 0.421 12.581 1.00 0.00 C ATOM 2102 CG PRO B 315 3.379 1.619 12.265 1.00 0.00 C ATOM 2103 CD PRO B 315 4.241 1.227 11.061 1.00 0.00 C ATOM 0 HA PRO B 315 2.232 -1.352 11.302 1.00 0.00 H new ATOM 0 HB2 PRO B 315 1.603 0.711 13.054 1.00 0.00 H new ATOM 0 HB3 PRO B 315 3.054 -0.247 13.273 1.00 0.00 H new ATOM 0 HG2 PRO B 315 2.754 2.482 12.033 1.00 0.00 H new ATOM 0 HG3 PRO B 315 4.001 1.895 13.116 1.00 0.00 H new ATOM 0 HD2 PRO B 315 4.421 2.078 10.404 1.00 0.00 H new ATOM 0 HD3 PRO B 315 5.216 0.852 11.372 1.00 0.00 H new ATOM 2111 N GLY B 316 -0.118 -0.568 10.978 1.00 0.00 N ATOM 2112 CA GLY B 316 -1.462 -0.256 10.471 1.00 0.00 C ATOM 2113 C GLY B 316 -2.395 0.150 11.611 1.00 0.00 C ATOM 2114 O GLY B 316 -2.126 -0.125 12.774 1.00 0.00 O ATOM 0 H GLY B 316 -0.079 -1.372 11.604 1.00 0.00 H new ATOM 0 HA2 GLY B 316 -1.401 0.551 9.741 1.00 0.00 H new ATOM 0 HA3 GLY B 316 -1.870 -1.124 9.953 1.00 0.00 H new ATOM 2118 N SER B 317 -3.493 0.807 11.265 1.00 0.00 N ATOM 2119 CA SER B 317 -4.461 1.245 12.267 1.00 0.00 C ATOM 2120 C SER B 317 -5.062 0.049 13.010 1.00 0.00 C ATOM 2121 O SER B 317 -5.232 0.080 14.228 1.00 0.00 O ATOM 2122 CB SER B 317 -5.580 2.040 11.597 1.00 0.00 C ATOM 2123 OG SER B 317 -6.522 2.447 12.580 1.00 0.00 O ATOM 0 H SER B 317 -3.737 1.049 10.305 1.00 0.00 H new ATOM 0 HA SER B 317 -3.940 1.876 12.987 1.00 0.00 H new ATOM 0 HB2 SER B 317 -5.168 2.912 11.089 1.00 0.00 H new ATOM 0 HB3 SER B 317 -6.070 1.431 10.838 1.00 0.00 H new ATOM 0 HG SER B 317 -7.240 2.959 12.153 1.00 0.00 H new ATOM 2129 N ARG B 318 -5.383 -1.005 12.265 1.00 0.00 N ATOM 2130 CA ARG B 318 -5.971 -2.206 12.859 1.00 0.00 C ATOM 2131 C ARG B 318 -5.011 -2.853 13.861 1.00 0.00 C ATOM 2132 O ARG B 318 -5.356 -3.832 14.523 1.00 0.00 O ATOM 2133 CB ARG B 318 -6.337 -3.207 11.766 1.00 0.00 C ATOM 2134 CG ARG B 318 -7.087 -4.400 12.386 1.00 0.00 C ATOM 2135 CD ARG B 318 -7.997 -5.030 11.342 1.00 0.00 C ATOM 2136 NE ARG B 318 -9.080 -4.114 11.003 1.00 0.00 N ATOM 2137 CZ ARG B 318 -10.121 -3.952 11.814 1.00 0.00 C ATOM 2138 NH1 ARG B 318 -10.184 -4.616 12.935 1.00 0.00 N ATOM 2139 NH2 ARG B 318 -11.079 -3.126 11.489 1.00 0.00 N ATOM 0 H ARG B 318 -5.248 -1.054 11.255 1.00 0.00 H new ATOM 0 HA ARG B 318 -6.874 -1.911 13.394 1.00 0.00 H new ATOM 0 HB2 ARG B 318 -6.960 -2.726 11.012 1.00 0.00 H new ATOM 0 HB3 ARG B 318 -5.436 -3.554 11.261 1.00 0.00 H new ATOM 0 HG2 ARG B 318 -6.375 -5.138 12.755 1.00 0.00 H new ATOM 0 HG3 ARG B 318 -7.674 -4.068 13.242 1.00 0.00 H new ATOM 0 HD2 ARG B 318 -7.423 -5.274 10.448 1.00 0.00 H new ATOM 0 HD3 ARG B 318 -8.407 -5.965 11.723 1.00 0.00 H new ATOM 0 HE ARG B 318 -9.038 -3.589 10.129 1.00 0.00 H new ATOM 0 HH11 ARG B 318 -9.435 -5.259 13.189 1.00 0.00 H new ATOM 0 HH12 ARG B 318 -10.983 -4.492 13.557 1.00 0.00 H new ATOM 0 HH21 ARG B 318 -11.028 -2.605 10.613 1.00 0.00 H new ATOM 0 HH22 ARG B 318 -11.878 -3.001 12.111 1.00 0.00 H new ATOM 2153 N TRP B 319 -3.805 -2.304 13.961 1.00 0.00 N ATOM 2154 CA TRP B 319 -2.803 -2.836 14.883 1.00 0.00 C ATOM 2155 C TRP B 319 -3.217 -2.601 16.338 1.00 0.00 C ATOM 2156 O TRP B 319 -2.557 -3.055 17.271 1.00 0.00 O ATOM 2157 CB TRP B 319 -1.441 -2.183 14.628 1.00 0.00 C ATOM 2158 CG TRP B 319 -0.405 -2.771 15.548 1.00 0.00 C ATOM 2159 CD1 TRP B 319 -0.453 -4.010 16.099 1.00 0.00 C ATOM 2160 CD2 TRP B 319 0.825 -2.162 16.038 1.00 0.00 C ATOM 2161 NE1 TRP B 319 0.660 -4.199 16.887 1.00 0.00 N ATOM 2162 CE2 TRP B 319 1.479 -3.089 16.882 1.00 0.00 C ATOM 2163 CE3 TRP B 319 1.431 -0.909 15.832 1.00 0.00 C ATOM 2164 CZ2 TRP B 319 2.686 -2.787 17.502 1.00 0.00 C ATOM 2165 CZ3 TRP B 319 2.651 -0.602 16.453 1.00 0.00 C ATOM 2166 CH2 TRP B 319 3.278 -1.539 17.286 1.00 0.00 C ATOM 0 H TRP B 319 -3.497 -1.496 13.420 1.00 0.00 H new ATOM 0 HA TRP B 319 -2.727 -3.909 14.709 1.00 0.00 H new ATOM 0 HB2 TRP B 319 -1.145 -2.335 13.590 1.00 0.00 H new ATOM 0 HB3 TRP B 319 -1.510 -1.107 14.786 1.00 0.00 H new ATOM 0 HD1 TRP B 319 -1.240 -4.733 15.944 1.00 0.00 H new ATOM 0 HE1 TRP B 319 0.855 -5.053 17.409 1.00 0.00 H new ATOM 0 HE3 TRP B 319 0.955 -0.180 15.193 1.00 0.00 H new ATOM 0 HZ2 TRP B 319 3.163 -3.511 18.146 1.00 0.00 H new ATOM 0 HZ3 TRP B 319 3.110 0.362 16.288 1.00 0.00 H new ATOM 0 HH2 TRP B 319 4.218 -1.297 17.760 1.00 0.00 H new ATOM 2177 N ASP B 320 -4.305 -1.874 16.527 1.00 0.00 N ATOM 2178 CA ASP B 320 -4.799 -1.578 17.874 1.00 0.00 C ATOM 2179 C ASP B 320 -3.703 -0.943 18.733 1.00 0.00 C ATOM 2180 O ASP B 320 -3.910 -0.657 19.912 1.00 0.00 O ATOM 2181 CB ASP B 320 -5.284 -2.865 18.542 1.00 0.00 C ATOM 2182 CG ASP B 320 -6.582 -3.334 17.891 1.00 0.00 C ATOM 2183 OD1 ASP B 320 -7.161 -2.561 17.145 1.00 0.00 O ATOM 2184 OD2 ASP B 320 -6.979 -4.458 18.149 1.00 0.00 O ATOM 0 H ASP B 320 -4.865 -1.477 15.773 1.00 0.00 H new ATOM 0 HA ASP B 320 -5.625 -0.872 17.786 1.00 0.00 H new ATOM 0 HB2 ASP B 320 -4.522 -3.640 18.453 1.00 0.00 H new ATOM 0 HB3 ASP B 320 -5.443 -2.694 19.607 1.00 0.00 H new ATOM 2189 N GLY B 321 -2.536 -0.727 18.135 1.00 0.00 N ATOM 2190 CA GLY B 321 -1.420 -0.126 18.855 1.00 0.00 C ATOM 2191 C GLY B 321 -0.870 -1.084 19.913 1.00 0.00 C ATOM 2192 O GLY B 321 -0.196 -0.663 20.852 1.00 0.00 O ATOM 0 H GLY B 321 -2.339 -0.957 17.161 1.00 0.00 H new ATOM 0 HA2 GLY B 321 -0.630 0.138 18.153 1.00 0.00 H new ATOM 0 HA3 GLY B 321 -1.746 0.799 19.331 1.00 0.00 H new ATOM 2196 N VAL B 322 -1.166 -2.375 19.757 1.00 0.00 N ATOM 2197 CA VAL B 322 -0.703 -3.384 20.710 1.00 0.00 C ATOM 2198 C VAL B 322 0.746 -3.764 20.427 1.00 0.00 C ATOM 2199 O VAL B 322 1.116 -4.019 19.285 1.00 0.00 O ATOM 2200 CB VAL B 322 -1.584 -4.630 20.626 1.00 0.00 C ATOM 2201 CG1 VAL B 322 -1.052 -5.699 21.582 1.00 0.00 C ATOM 2202 CG2 VAL B 322 -3.018 -4.265 21.017 1.00 0.00 C ATOM 0 H VAL B 322 -1.721 -2.745 18.985 1.00 0.00 H new ATOM 0 HA VAL B 322 -0.768 -2.962 21.713 1.00 0.00 H new ATOM 0 HB VAL B 322 -1.570 -5.017 19.607 1.00 0.00 H new ATOM 0 HG11 VAL B 322 -1.681 -6.587 21.521 1.00 0.00 H new ATOM 0 HG12 VAL B 322 -0.030 -5.959 21.305 1.00 0.00 H new ATOM 0 HG13 VAL B 322 -1.065 -5.314 22.602 1.00 0.00 H new ATOM 0 HG21 VAL B 322 -3.648 -5.152 20.958 1.00 0.00 H new ATOM 0 HG22 VAL B 322 -3.030 -3.879 22.036 1.00 0.00 H new ATOM 0 HG23 VAL B 322 -3.398 -3.504 20.336 1.00 0.00 H new ATOM 2212 N HIS B 323 1.562 -3.801 21.473 1.00 0.00 N ATOM 2213 CA HIS B 323 2.970 -4.149 21.316 1.00 0.00 C ATOM 2214 C HIS B 323 3.132 -5.621 20.941 1.00 0.00 C ATOM 2215 O HIS B 323 2.570 -6.503 21.590 1.00 0.00 O ATOM 2216 CB HIS B 323 3.720 -3.870 22.621 1.00 0.00 C ATOM 2217 CG HIS B 323 3.114 -4.688 23.730 1.00 0.00 C ATOM 2218 ND1 HIS B 323 1.954 -4.301 24.382 1.00 0.00 N ATOM 2219 CD2 HIS B 323 3.495 -5.871 24.312 1.00 0.00 C ATOM 2220 CE1 HIS B 323 1.680 -5.236 25.311 1.00 0.00 C ATOM 2221 NE2 HIS B 323 2.588 -6.216 25.310 1.00 0.00 N ATOM 0 H HIS B 323 1.278 -3.597 22.431 1.00 0.00 H new ATOM 0 HA HIS B 323 3.385 -3.539 20.513 1.00 0.00 H new ATOM 0 HB2 HIS B 323 4.775 -4.117 22.507 1.00 0.00 H new ATOM 0 HB3 HIS B 323 3.666 -2.809 22.865 1.00 0.00 H new ATOM 0 HD2 HIS B 323 4.366 -6.447 24.037 1.00 0.00 H new ATOM 0 HE1 HIS B 323 0.830 -5.198 25.976 1.00 0.00 H new ATOM 0 HE2 HIS B 323 2.612 -7.040 25.911 1.00 0.00 H new ATOM 2230 N ARG B 324 3.908 -5.885 19.887 1.00 0.00 N ATOM 2231 CA ARG B 324 4.140 -7.264 19.431 1.00 0.00 C ATOM 2232 C ARG B 324 5.634 -7.528 19.324 1.00 0.00 C ATOM 2233 O ARG B 324 6.307 -6.999 18.438 1.00 0.00 O ATOM 2234 CB ARG B 324 3.466 -7.486 18.070 1.00 0.00 C ATOM 2235 CG ARG B 324 1.966 -7.136 18.161 1.00 0.00 C ATOM 2236 CD ARG B 324 1.206 -8.256 18.891 1.00 0.00 C ATOM 2237 NE ARG B 324 -0.233 -8.046 18.791 1.00 0.00 N ATOM 2238 CZ ARG B 324 -1.091 -8.890 19.357 1.00 0.00 C ATOM 2239 NH1 ARG B 324 -0.650 -9.924 20.015 1.00 0.00 N ATOM 2240 NH2 ARG B 324 -2.375 -8.681 19.251 1.00 0.00 N ATOM 0 H ARG B 324 4.384 -5.171 19.335 1.00 0.00 H new ATOM 0 HA ARG B 324 3.709 -7.956 20.154 1.00 0.00 H new ATOM 0 HB2 ARG B 324 3.947 -6.868 17.312 1.00 0.00 H new ATOM 0 HB3 ARG B 324 3.588 -8.524 17.760 1.00 0.00 H new ATOM 0 HG2 ARG B 324 1.836 -6.192 18.691 1.00 0.00 H new ATOM 0 HG3 ARG B 324 1.555 -6.999 17.161 1.00 0.00 H new ATOM 0 HD2 ARG B 324 1.469 -9.222 18.461 1.00 0.00 H new ATOM 0 HD3 ARG B 324 1.504 -8.282 19.939 1.00 0.00 H new ATOM 0 HE ARG B 324 -0.588 -7.239 18.279 1.00 0.00 H new ATOM 0 HH11 ARG B 324 0.354 -10.087 20.096 1.00 0.00 H new ATOM 0 HH12 ARG B 324 -1.308 -10.571 20.449 1.00 0.00 H new ATOM 0 HH21 ARG B 324 -2.719 -7.871 18.735 1.00 0.00 H new ATOM 0 HH22 ARG B 324 -3.034 -9.327 19.684 1.00 0.00 H new ATOM 2254 N SER B 325 6.150 -8.352 20.231 1.00 0.00 N ATOM 2255 CA SER B 325 7.570 -8.681 20.233 1.00 0.00 C ATOM 2256 C SER B 325 7.860 -9.810 19.264 1.00 0.00 C ATOM 2257 O SER B 325 7.131 -10.802 19.218 1.00 0.00 O ATOM 2258 CB SER B 325 8.012 -9.088 21.637 1.00 0.00 C ATOM 2259 OG SER B 325 9.368 -9.512 21.598 1.00 0.00 O ATOM 0 H SER B 325 5.609 -8.801 20.970 1.00 0.00 H new ATOM 0 HA SER B 325 8.125 -7.797 19.919 1.00 0.00 H new ATOM 0 HB2 SER B 325 7.901 -8.248 22.323 1.00 0.00 H new ATOM 0 HB3 SER B 325 7.378 -9.892 22.012 1.00 0.00 H new ATOM 0 HG SER B 325 9.655 -9.773 22.498 1.00 0.00 H new ATOM 2286 N PHE B 328 14.560 -10.460 20.526 1.00 0.00 N ATOM 2287 CA PHE B 328 15.363 -9.549 21.332 1.00 0.00 C ATOM 2288 C PHE B 328 16.265 -8.697 20.448 1.00 0.00 C ATOM 2289 O PHE B 328 16.680 -7.609 20.835 1.00 0.00 O ATOM 2290 CB PHE B 328 16.216 -10.343 22.323 1.00 0.00 C ATOM 2291 CG PHE B 328 17.154 -11.251 21.563 1.00 0.00 C ATOM 2292 CD1 PHE B 328 16.749 -12.546 21.221 1.00 0.00 C ATOM 2293 CD2 PHE B 328 18.427 -10.798 21.200 1.00 0.00 C ATOM 2294 CE1 PHE B 328 17.617 -13.389 20.518 1.00 0.00 C ATOM 2295 CE2 PHE B 328 19.296 -11.640 20.498 1.00 0.00 C ATOM 2296 CZ PHE B 328 18.891 -12.936 20.156 1.00 0.00 C ATOM 0 HA PHE B 328 14.688 -8.890 21.879 1.00 0.00 H new ATOM 0 HB2 PHE B 328 16.785 -9.663 22.957 1.00 0.00 H new ATOM 0 HB3 PHE B 328 15.576 -10.931 22.981 1.00 0.00 H new ATOM 0 HD1 PHE B 328 15.766 -12.895 21.500 1.00 0.00 H new ATOM 0 HD2 PHE B 328 18.739 -9.798 21.462 1.00 0.00 H new ATOM 0 HE1 PHE B 328 17.304 -14.389 20.255 1.00 0.00 H new ATOM 0 HE2 PHE B 328 20.279 -11.290 20.220 1.00 0.00 H new ATOM 0 HZ PHE B 328 19.561 -13.586 19.613 1.00 0.00 H new ATOM 2306 N GLU B 329 16.563 -9.201 19.257 1.00 0.00 N ATOM 2307 CA GLU B 329 17.420 -8.479 18.319 1.00 0.00 C ATOM 2308 C GLU B 329 16.774 -7.160 17.893 1.00 0.00 C ATOM 2309 O GLU B 329 17.452 -6.251 17.414 1.00 0.00 O ATOM 2310 CB GLU B 329 17.689 -9.348 17.084 1.00 0.00 C ATOM 2311 CG GLU B 329 16.381 -9.572 16.319 1.00 0.00 C ATOM 2312 CD GLU B 329 16.598 -10.587 15.202 1.00 0.00 C ATOM 2313 OE1 GLU B 329 17.721 -11.039 15.047 1.00 0.00 O ATOM 2314 OE2 GLU B 329 15.637 -10.901 14.518 1.00 0.00 O ATOM 0 H GLU B 329 16.227 -10.102 18.917 1.00 0.00 H new ATOM 0 HA GLU B 329 18.362 -8.255 18.819 1.00 0.00 H new ATOM 0 HB2 GLU B 329 18.421 -8.863 16.438 1.00 0.00 H new ATOM 0 HB3 GLU B 329 18.114 -10.305 17.386 1.00 0.00 H new ATOM 0 HG2 GLU B 329 15.608 -9.928 17.000 1.00 0.00 H new ATOM 0 HG3 GLU B 329 16.028 -8.629 15.901 1.00 0.00 H new ATOM 2321 N GLU B 330 15.458 -7.066 18.061 1.00 0.00 N ATOM 2322 CA GLU B 330 14.727 -5.859 17.681 1.00 0.00 C ATOM 2323 C GLU B 330 15.308 -4.629 18.380 1.00 0.00 C ATOM 2324 O GLU B 330 15.235 -3.509 17.860 1.00 0.00 O ATOM 2325 CB GLU B 330 13.249 -6.005 18.049 1.00 0.00 C ATOM 2326 CG GLU B 330 12.448 -4.870 17.409 1.00 0.00 C ATOM 2327 CD GLU B 330 10.960 -5.061 17.686 1.00 0.00 C ATOM 2328 OE1 GLU B 330 10.580 -5.000 18.843 1.00 0.00 O ATOM 2329 OE2 GLU B 330 10.224 -5.266 16.735 1.00 0.00 O ATOM 0 H GLU B 330 14.878 -7.806 18.455 1.00 0.00 H new ATOM 0 HA GLU B 330 14.824 -5.727 16.603 1.00 0.00 H new ATOM 0 HB2 GLU B 330 12.872 -6.968 17.706 1.00 0.00 H new ATOM 0 HB3 GLU B 330 13.129 -5.983 19.132 1.00 0.00 H new ATOM 0 HG2 GLU B 330 12.780 -3.911 17.806 1.00 0.00 H new ATOM 0 HG3 GLU B 330 12.626 -4.849 16.334 1.00 0.00 H new ATOM 2336 N LYS B 331 15.878 -4.840 19.562 1.00 0.00 N ATOM 2337 CA LYS B 331 16.460 -3.741 20.325 1.00 0.00 C ATOM 2338 C LYS B 331 17.477 -2.988 19.479 1.00 0.00 C ATOM 2339 O LYS B 331 17.699 -1.792 19.673 1.00 0.00 O ATOM 2340 CB LYS B 331 17.147 -4.287 21.587 1.00 0.00 C ATOM 2341 CG LYS B 331 18.402 -5.084 21.201 1.00 0.00 C ATOM 2342 CD LYS B 331 18.998 -5.745 22.446 1.00 0.00 C ATOM 2343 CE LYS B 331 20.235 -6.554 22.049 1.00 0.00 C ATOM 2344 NZ LYS B 331 21.267 -5.639 21.483 1.00 0.00 N ATOM 0 H LYS B 331 15.949 -5.754 20.010 1.00 0.00 H new ATOM 0 HA LYS B 331 15.662 -3.057 20.612 1.00 0.00 H new ATOM 0 HB2 LYS B 331 17.418 -3.464 22.248 1.00 0.00 H new ATOM 0 HB3 LYS B 331 16.457 -4.925 22.139 1.00 0.00 H new ATOM 0 HG2 LYS B 331 18.149 -5.843 20.461 1.00 0.00 H new ATOM 0 HG3 LYS B 331 19.137 -4.423 20.741 1.00 0.00 H new ATOM 0 HD2 LYS B 331 19.267 -4.986 23.181 1.00 0.00 H new ATOM 0 HD3 LYS B 331 18.260 -6.395 22.915 1.00 0.00 H new ATOM 0 HE2 LYS B 331 20.635 -7.077 22.918 1.00 0.00 H new ATOM 0 HE3 LYS B 331 19.966 -7.314 21.315 1.00 0.00 H new ATOM 0 HZ1 LYS B 331 22.200 -6.097 21.528 1.00 0.00 H new ATOM 0 HZ2 LYS B 331 21.034 -5.424 20.492 1.00 0.00 H new ATOM 0 HZ3 LYS B 331 21.288 -4.757 22.033 1.00 0.00 H new ATOM 2358 N TRP B 332 18.096 -3.698 18.544 1.00 0.00 N ATOM 2359 CA TRP B 332 19.095 -3.093 17.679 1.00 0.00 C ATOM 2360 C TRP B 332 18.473 -1.963 16.870 1.00 0.00 C ATOM 2361 O TRP B 332 19.048 -0.880 16.758 1.00 0.00 O ATOM 2362 CB TRP B 332 19.681 -4.145 16.739 1.00 0.00 C ATOM 2363 CG TRP B 332 20.776 -3.531 15.934 1.00 0.00 C ATOM 2364 CD1 TRP B 332 22.043 -3.349 16.367 1.00 0.00 C ATOM 2365 CD2 TRP B 332 20.733 -3.026 14.568 1.00 0.00 C ATOM 2366 NE1 TRP B 332 22.781 -2.760 15.357 1.00 0.00 N ATOM 2367 CE2 TRP B 332 22.017 -2.541 14.227 1.00 0.00 C ATOM 2368 CE3 TRP B 332 19.714 -2.941 13.602 1.00 0.00 C ATOM 2369 CZ2 TRP B 332 22.281 -1.990 12.972 1.00 0.00 C ATOM 2370 CZ3 TRP B 332 19.978 -2.387 12.338 1.00 0.00 C ATOM 2371 CH2 TRP B 332 21.258 -1.913 12.024 1.00 0.00 C ATOM 0 H TRP B 332 17.924 -4.688 18.368 1.00 0.00 H new ATOM 0 HA TRP B 332 19.894 -2.686 18.298 1.00 0.00 H new ATOM 0 HB2 TRP B 332 20.065 -4.989 17.313 1.00 0.00 H new ATOM 0 HB3 TRP B 332 18.904 -4.534 16.081 1.00 0.00 H new ATOM 0 HD1 TRP B 332 22.418 -3.620 17.343 1.00 0.00 H new ATOM 0 HE1 TRP B 332 23.768 -2.517 15.436 1.00 0.00 H new ATOM 0 HE3 TRP B 332 18.723 -3.304 13.833 1.00 0.00 H new ATOM 0 HZ2 TRP B 332 23.270 -1.626 12.735 1.00 0.00 H new ATOM 0 HZ3 TRP B 332 19.189 -2.326 11.604 1.00 0.00 H new ATOM 0 HH2 TRP B 332 21.454 -1.489 11.050 1.00 0.00 H new ATOM 2382 N PHE B 333 17.295 -2.227 16.304 1.00 0.00 N ATOM 2383 CA PHE B 333 16.601 -1.224 15.508 1.00 0.00 C ATOM 2384 C PHE B 333 16.217 -0.035 16.377 1.00 0.00 C ATOM 2385 O PHE B 333 16.297 1.112 15.941 1.00 0.00 O ATOM 2386 CB PHE B 333 15.337 -1.828 14.877 1.00 0.00 C ATOM 2387 CG PHE B 333 15.717 -2.666 13.676 1.00 0.00 C ATOM 2388 CD1 PHE B 333 15.998 -2.044 12.453 1.00 0.00 C ATOM 2389 CD2 PHE B 333 15.790 -4.059 13.786 1.00 0.00 C ATOM 2390 CE1 PHE B 333 16.353 -2.815 11.341 1.00 0.00 C ATOM 2391 CE2 PHE B 333 16.144 -4.830 12.674 1.00 0.00 C ATOM 2392 CZ PHE B 333 16.426 -4.208 11.451 1.00 0.00 C ATOM 0 H PHE B 333 16.808 -3.120 16.383 1.00 0.00 H new ATOM 0 HA PHE B 333 17.271 -0.888 14.717 1.00 0.00 H new ATOM 0 HB2 PHE B 333 14.811 -2.441 15.609 1.00 0.00 H new ATOM 0 HB3 PHE B 333 14.654 -1.034 14.577 1.00 0.00 H new ATOM 0 HD1 PHE B 333 15.941 -0.969 12.368 1.00 0.00 H new ATOM 0 HD2 PHE B 333 15.573 -4.539 14.729 1.00 0.00 H new ATOM 0 HE1 PHE B 333 16.571 -2.335 10.398 1.00 0.00 H new ATOM 0 HE2 PHE B 333 16.200 -5.905 12.758 1.00 0.00 H new ATOM 0 HZ PHE B 333 16.700 -4.804 10.593 1.00 0.00 H new ATOM 2402 N ALA B 334 15.796 -0.321 17.607 1.00 0.00 N ATOM 2403 CA ALA B 334 15.397 0.740 18.525 1.00 0.00 C ATOM 2404 C ALA B 334 16.557 1.693 18.782 1.00 0.00 C ATOM 2405 O ALA B 334 16.377 2.909 18.825 1.00 0.00 O ATOM 2406 CB ALA B 334 14.931 0.135 19.851 1.00 0.00 C ATOM 0 H ALA B 334 15.723 -1.265 17.986 1.00 0.00 H new ATOM 0 HA ALA B 334 14.578 1.297 18.070 1.00 0.00 H new ATOM 0 HB1 ALA B 334 14.635 0.934 20.531 1.00 0.00 H new ATOM 0 HB2 ALA B 334 14.081 -0.523 19.672 1.00 0.00 H new ATOM 0 HB3 ALA B 334 15.745 -0.437 20.296 1.00 0.00 H new ATOM 2412 N LYS B 335 17.750 1.133 18.951 1.00 0.00 N ATOM 2413 CA LYS B 335 18.933 1.948 19.198 1.00 0.00 C ATOM 2414 C LYS B 335 19.216 2.863 18.004 1.00 0.00 C ATOM 2415 O LYS B 335 19.449 4.060 18.170 1.00 0.00 O ATOM 2416 CB LYS B 335 20.160 1.031 19.472 1.00 0.00 C ATOM 2417 CG LYS B 335 20.429 0.925 20.995 1.00 0.00 C ATOM 2418 CD LYS B 335 21.255 2.136 21.456 1.00 0.00 C ATOM 2419 CE LYS B 335 21.631 1.975 22.929 1.00 0.00 C ATOM 2420 NZ LYS B 335 20.420 2.167 23.776 1.00 0.00 N ATOM 0 H LYS B 335 17.923 0.128 18.922 1.00 0.00 H new ATOM 0 HA LYS B 335 18.750 2.571 20.073 1.00 0.00 H new ATOM 0 HB2 LYS B 335 19.979 0.039 19.059 1.00 0.00 H new ATOM 0 HB3 LYS B 335 21.040 1.431 18.968 1.00 0.00 H new ATOM 0 HG2 LYS B 335 19.486 0.886 21.540 1.00 0.00 H new ATOM 0 HG3 LYS B 335 20.963 0.001 21.217 1.00 0.00 H new ATOM 0 HD2 LYS B 335 22.156 2.226 20.849 1.00 0.00 H new ATOM 0 HD3 LYS B 335 20.683 3.053 21.315 1.00 0.00 H new ATOM 0 HE2 LYS B 335 22.055 0.986 23.101 1.00 0.00 H new ATOM 0 HE3 LYS B 335 22.397 2.701 23.201 1.00 0.00 H new ATOM 0 HZ1 LYS B 335 20.701 2.227 24.775 1.00 0.00 H new ATOM 0 HZ2 LYS B 335 19.938 3.046 23.499 1.00 0.00 H new ATOM 0 HZ3 LYS B 335 19.774 1.362 23.646 1.00 0.00 H new ATOM 2434 N GLN B 336 19.195 2.286 16.806 1.00 0.00 N ATOM 2435 CA GLN B 336 19.462 3.057 15.596 1.00 0.00 C ATOM 2436 C GLN B 336 18.413 4.148 15.407 1.00 0.00 C ATOM 2437 O GLN B 336 18.742 5.282 15.064 1.00 0.00 O ATOM 2438 CB GLN B 336 19.458 2.127 14.377 1.00 0.00 C ATOM 2439 CG GLN B 336 20.705 1.233 14.403 1.00 0.00 C ATOM 2440 CD GLN B 336 21.960 2.079 14.198 1.00 0.00 C ATOM 2441 OE1 GLN B 336 22.704 2.325 15.147 1.00 0.00 O ATOM 2442 NE2 GLN B 336 22.238 2.539 13.009 1.00 0.00 N ATOM 0 H GLN B 336 18.998 1.298 16.647 1.00 0.00 H new ATOM 0 HA GLN B 336 20.440 3.527 15.697 1.00 0.00 H new ATOM 0 HB2 GLN B 336 18.558 1.512 14.380 1.00 0.00 H new ATOM 0 HB3 GLN B 336 19.439 2.715 13.459 1.00 0.00 H new ATOM 0 HG2 GLN B 336 20.764 0.705 15.355 1.00 0.00 H new ATOM 0 HG3 GLN B 336 20.636 0.476 13.622 1.00 0.00 H new ATOM 0 HE21 GLN B 336 21.619 2.333 12.225 1.00 0.00 H new ATOM 0 HE22 GLN B 336 23.074 3.105 12.864 1.00 0.00 H new ATOM 2451 N ASN B 337 17.153 3.800 15.637 1.00 0.00 N ATOM 2452 CA ASN B 337 16.066 4.759 15.494 1.00 0.00 C ATOM 2453 C ASN B 337 16.187 5.877 16.524 1.00 0.00 C ATOM 2454 O ASN B 337 15.897 7.038 16.233 1.00 0.00 O ATOM 2455 CB ASN B 337 14.719 4.053 15.660 1.00 0.00 C ATOM 2456 CG ASN B 337 14.448 3.155 14.458 1.00 0.00 C ATOM 2457 OD1 ASN B 337 14.314 1.941 14.606 1.00 0.00 O ATOM 2458 ND2 ASN B 337 14.358 3.684 13.269 1.00 0.00 N ATOM 0 H ASN B 337 16.860 2.865 15.922 1.00 0.00 H new ATOM 0 HA ASN B 337 16.128 5.196 14.497 1.00 0.00 H new ATOM 0 HB2 ASN B 337 14.721 3.460 16.574 1.00 0.00 H new ATOM 0 HB3 ASN B 337 13.923 4.791 15.760 1.00 0.00 H new ATOM 0 HD21 ASN B 337 14.176 3.091 12.459 1.00 0.00 H new ATOM 0 HD22 ASN B 337 14.469 4.691 13.149 1.00 0.00 H new ATOM 2465 N GLU B 338 16.615 5.518 17.730 1.00 0.00 N ATOM 2466 CA GLU B 338 16.760 6.499 18.799 1.00 0.00 C ATOM 2467 C GLU B 338 17.743 7.597 18.396 1.00 0.00 C ATOM 2468 O GLU B 338 17.499 8.777 18.643 1.00 0.00 O ATOM 2469 CB GLU B 338 17.259 5.814 20.078 1.00 0.00 C ATOM 2470 CG GLU B 338 17.232 6.814 21.249 1.00 0.00 C ATOM 2471 CD GLU B 338 18.461 7.719 21.201 1.00 0.00 C ATOM 2472 OE1 GLU B 338 19.501 7.250 20.769 1.00 0.00 O ATOM 2473 OE2 GLU B 338 18.346 8.868 21.594 1.00 0.00 O ATOM 0 H GLU B 338 16.865 4.564 17.990 1.00 0.00 H new ATOM 0 HA GLU B 338 15.784 6.949 18.982 1.00 0.00 H new ATOM 0 HB2 GLU B 338 16.632 4.953 20.309 1.00 0.00 H new ATOM 0 HB3 GLU B 338 18.272 5.440 19.930 1.00 0.00 H new ATOM 0 HG2 GLU B 338 16.326 7.417 21.200 1.00 0.00 H new ATOM 0 HG3 GLU B 338 17.206 6.275 22.196 1.00 0.00 H new