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 -102:sc= 0.931 USER MOD Set 1.2: A 86 HIS : no HE2:sc= -0.91 K(o=0.021,f=-1.1!) USER MOD Single : A 12 TYR OH : rot 165:sc= -0.429 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.154 K(o=-0.15,f=-2.3!) USER MOD Single : A 19 ASN :FLIP amide:sc= -0.0627 F(o=-1.2,f=-0.063) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot -27:sc= 1.24 USER MOD Single : A 32 SER OG : rot 120:sc= -0.6 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc=-0.00492 K(o=-0.0049,f=-1.3!) USER MOD Single : A 64 SER OG : rot -158:sc= -0.399 USER MOD Single : A 71 ASN : amide:sc= -8.2! C(o=-8.2!,f=-14!) USER MOD Single : A 73 ASN : amide:sc= -0.123 K(o=-0.12,f=-1.7) USER MOD Single : A 76 LYS NZ :NH3+ -166:sc= -0.909 (180deg=-1.44) USER MOD Single : A 83 LYS NZ :NH3+ -154:sc= -0.0643 (180deg=-0.44) 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=-0.00534 (180deg=-0.00534) USER MOD Single : B 317 SER OG : rot 180:sc= 0 USER MOD Single : B 323 HIS : no HD1:sc= -1.24 K(o=-1.2,f=-2.2) USER MOD Single : B 325 SER OG : rot 180:sc= 0 USER MOD Single : B 331 LYS NZ :NH3+ 143:sc= -3.25! (180deg=-5.84!) USER MOD Single : B 335 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 336 GLN : amide:sc= -0.216 X(o=-0.22,f=-0.33) USER MOD Single : B 337 ASN : amide:sc= -0.0558 K(o=-0.056,f=-1.8!) USER MOD ----------------------------------------------------------------- ATOM 142 N ALA A 11 -0.675 -15.826 -2.996 1.00 0.00 N ATOM 143 CA ALA A 11 0.060 -16.527 -1.949 1.00 0.00 C ATOM 144 C ALA A 11 -0.740 -16.534 -0.649 1.00 0.00 C ATOM 145 O ALA A 11 -1.453 -15.581 -0.345 1.00 0.00 O ATOM 146 CB ALA A 11 1.413 -15.851 -1.714 1.00 0.00 C ATOM 0 HA ALA A 11 0.221 -17.556 -2.271 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.954 -16.382 -0.931 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.995 -15.872 -2.635 1.00 0.00 H new ATOM 0 HB3 ALA A 11 1.255 -14.817 -1.409 1.00 0.00 H new ATOM 152 N TYR A 12 -0.613 -17.620 0.117 1.00 0.00 N ATOM 153 CA TYR A 12 -1.319 -17.755 1.397 1.00 0.00 C ATOM 154 C TYR A 12 -0.352 -18.197 2.497 1.00 0.00 C ATOM 155 O TYR A 12 0.626 -18.898 2.236 1.00 0.00 O ATOM 156 CB TYR A 12 -2.474 -18.767 1.262 1.00 0.00 C ATOM 157 CG TYR A 12 -3.683 -18.097 0.641 1.00 0.00 C ATOM 158 CD1 TYR A 12 -3.816 -18.017 -0.750 1.00 0.00 C ATOM 159 CD2 TYR A 12 -4.671 -17.548 1.469 1.00 0.00 C ATOM 160 CE1 TYR A 12 -4.935 -17.389 -1.312 1.00 0.00 C ATOM 161 CE2 TYR A 12 -5.788 -16.922 0.909 1.00 0.00 C ATOM 162 CZ TYR A 12 -5.921 -16.841 -0.482 1.00 0.00 C ATOM 163 OH TYR A 12 -7.023 -16.224 -1.036 1.00 0.00 O ATOM 0 H TYR A 12 -0.028 -18.420 -0.125 1.00 0.00 H new ATOM 0 HA TYR A 12 -1.733 -16.784 1.671 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -2.159 -19.610 0.647 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -2.734 -19.167 2.242 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -3.056 -18.440 -1.390 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -4.569 -17.609 2.542 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -5.037 -17.327 -2.385 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -6.549 -16.501 1.550 1.00 0.00 H new ATOM 0 HH TYR A 12 -7.715 -16.115 -0.351 1.00 0.00 H new ATOM 173 N ILE A 13 -0.629 -17.776 3.733 1.00 0.00 N ATOM 174 CA ILE A 13 0.225 -18.137 4.872 1.00 0.00 C ATOM 175 C ILE A 13 -0.536 -19.095 5.784 1.00 0.00 C ATOM 176 O ILE A 13 -1.589 -18.754 6.321 1.00 0.00 O ATOM 177 CB ILE A 13 0.634 -16.871 5.664 1.00 0.00 C ATOM 178 CG1 ILE A 13 0.720 -15.681 4.703 1.00 0.00 C ATOM 179 CG2 ILE A 13 2.010 -17.080 6.325 1.00 0.00 C ATOM 180 CD1 ILE A 13 1.196 -14.441 5.462 1.00 0.00 C ATOM 0 H ILE A 13 -1.429 -17.190 3.972 1.00 0.00 H new ATOM 0 HA ILE A 13 1.130 -18.620 4.502 1.00 0.00 H new ATOM 0 HB ILE A 13 -0.111 -16.679 6.436 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.408 -15.908 3.889 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.255 -15.493 4.254 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.287 -16.183 6.879 1.00 0.00 H new ATOM 0 HG22 ILE A 13 1.960 -17.928 7.008 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.757 -17.277 5.556 1.00 0.00 H new ATOM 0 HD11 ILE A 13 1.256 -13.596 4.776 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.491 -14.211 6.261 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.180 -14.632 5.890 1.00 0.00 H new ATOM 192 N TYR A 14 0.003 -20.291 5.956 1.00 0.00 N ATOM 193 CA TYR A 14 -0.635 -21.284 6.809 1.00 0.00 C ATOM 194 C TYR A 14 -0.213 -21.069 8.254 1.00 0.00 C ATOM 195 O TYR A 14 0.967 -21.177 8.585 1.00 0.00 O ATOM 196 CB TYR A 14 -0.234 -22.689 6.357 1.00 0.00 C ATOM 197 CG TYR A 14 -0.804 -23.714 7.310 1.00 0.00 C ATOM 198 CD1 TYR A 14 -2.134 -24.130 7.181 1.00 0.00 C ATOM 199 CD2 TYR A 14 -0.001 -24.244 8.327 1.00 0.00 C ATOM 200 CE1 TYR A 14 -2.661 -25.077 8.067 1.00 0.00 C ATOM 201 CE2 TYR A 14 -0.527 -25.192 9.214 1.00 0.00 C ATOM 202 CZ TYR A 14 -1.858 -25.607 9.084 1.00 0.00 C ATOM 203 OH TYR A 14 -2.377 -26.541 9.958 1.00 0.00 O ATOM 0 H TYR A 14 0.873 -20.597 5.521 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.717 -21.178 6.733 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -0.600 -22.875 5.347 1.00 0.00 H new ATOM 0 HB3 TYR A 14 0.852 -22.774 6.323 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -2.754 -23.720 6.397 1.00 0.00 H new ATOM 0 HD2 TYR A 14 1.025 -23.922 8.428 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -3.687 -25.399 7.966 1.00 0.00 H new ATOM 0 HE2 TYR A 14 0.093 -25.602 9.997 1.00 0.00 H new ATOM 0 HH TYR A 14 -1.687 -26.806 10.601 1.00 0.00 H new ATOM 213 N ILE A 15 -1.187 -20.765 9.115 1.00 0.00 N ATOM 214 CA ILE A 15 -0.911 -20.532 10.534 1.00 0.00 C ATOM 215 C ILE A 15 -1.565 -21.616 11.371 1.00 0.00 C ATOM 216 O ILE A 15 -2.749 -21.892 11.214 1.00 0.00 O ATOM 217 CB ILE A 15 -1.452 -19.168 10.962 1.00 0.00 C ATOM 218 CG1 ILE A 15 -0.788 -18.082 10.116 1.00 0.00 C ATOM 219 CG2 ILE A 15 -1.121 -18.935 12.437 1.00 0.00 C ATOM 220 CD1 ILE A 15 -1.509 -16.754 10.346 1.00 0.00 C ATOM 0 H ILE A 15 -2.169 -20.675 8.856 1.00 0.00 H new ATOM 0 HA ILE A 15 0.168 -20.553 10.687 1.00 0.00 H new ATOM 0 HB ILE A 15 -2.532 -19.136 10.821 1.00 0.00 H new ATOM 0 HG12 ILE A 15 0.265 -17.989 10.383 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -0.826 -18.352 9.061 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -1.505 -17.963 12.747 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -1.582 -19.717 13.041 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -0.040 -18.959 12.576 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.039 -15.976 9.745 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.555 -16.853 10.057 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.448 -16.484 11.400 1.00 0.00 H new ATOM 232 N GLY A 16 -0.785 -22.235 12.253 1.00 0.00 N ATOM 233 CA GLY A 16 -1.302 -23.302 13.114 1.00 0.00 C ATOM 234 C GLY A 16 -0.699 -23.220 14.507 1.00 0.00 C ATOM 235 O GLY A 16 0.208 -22.423 14.756 1.00 0.00 O ATOM 0 H GLY A 16 0.202 -22.020 12.392 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.388 -23.227 13.179 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -1.075 -24.272 12.672 1.00 0.00 H new ATOM 239 N ASN A 17 -1.210 -24.049 15.412 1.00 0.00 N ATOM 240 CA ASN A 17 -0.718 -24.068 16.788 1.00 0.00 C ATOM 241 C ASN A 17 -1.016 -22.745 17.488 1.00 0.00 C ATOM 242 O ASN A 17 -0.210 -22.251 18.276 1.00 0.00 O ATOM 243 CB ASN A 17 0.800 -24.317 16.790 1.00 0.00 C ATOM 244 CG ASN A 17 1.246 -24.859 18.147 1.00 0.00 C ATOM 245 OD1 ASN A 17 0.494 -24.794 19.119 1.00 0.00 O ATOM 246 ND2 ASN A 17 2.431 -25.394 18.270 1.00 0.00 N ATOM 0 H ASN A 17 -1.960 -24.713 15.221 1.00 0.00 H new ATOM 0 HA ASN A 17 -1.226 -24.869 17.325 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.060 -25.026 16.004 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.328 -23.389 16.570 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.735 -25.759 19.173 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.053 -25.447 17.463 1.00 0.00 H new ATOM 253 N LEU A 18 -2.185 -22.175 17.200 1.00 0.00 N ATOM 254 CA LEU A 18 -2.591 -20.907 17.810 1.00 0.00 C ATOM 255 C LEU A 18 -3.594 -21.163 18.931 1.00 0.00 C ATOM 256 O LEU A 18 -4.364 -22.121 18.881 1.00 0.00 O ATOM 257 CB LEU A 18 -3.220 -19.996 16.746 1.00 0.00 C ATOM 258 CG LEU A 18 -4.458 -20.693 16.090 1.00 0.00 C ATOM 259 CD1 LEU A 18 -5.758 -20.105 16.655 1.00 0.00 C ATOM 260 CD2 LEU A 18 -4.439 -20.482 14.567 1.00 0.00 C ATOM 0 H LEU A 18 -2.866 -22.568 16.551 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.712 -20.417 18.227 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.524 -19.053 17.200 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.482 -19.757 15.981 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.410 -21.759 16.314 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.612 -20.598 16.191 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -5.790 -20.262 17.733 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -5.796 -19.037 16.443 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -5.305 -20.971 14.121 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -4.472 -19.415 14.347 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.527 -20.910 14.152 1.00 0.00 H new ATOM 272 N ASN A 19 -3.580 -20.301 19.943 1.00 0.00 N ATOM 273 CA ASN A 19 -4.492 -20.455 21.066 1.00 0.00 C ATOM 274 C ASN A 19 -5.922 -20.146 20.634 1.00 0.00 C ATOM 275 O ASN A 19 -6.166 -19.205 19.878 1.00 0.00 O ATOM 276 CB ASN A 19 -4.072 -19.520 22.200 1.00 0.00 C ATOM 277 CG ASN A 19 -2.658 -19.859 22.664 1.00 0.00 C ATOM 278 OD1 ASN A 19 -2.417 -21.024 23.197 1.00 0.00 O flip ATOM 279 ND2 ASN A 19 -1.752 -19.035 22.541 1.00 0.00 N flip ATOM 0 H ASN A 19 -2.954 -19.498 20.007 1.00 0.00 H new ATOM 0 HA ASN A 19 -4.452 -21.486 21.417 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -4.114 -18.485 21.862 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -4.768 -19.611 23.034 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -1.944 -18.124 22.123 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -0.809 -19.263 22.857 1.00 0.00 H new ATOM 286 N ARG A 20 -6.864 -20.945 21.120 1.00 0.00 N ATOM 287 CA ARG A 20 -8.270 -20.752 20.778 1.00 0.00 C ATOM 288 C ARG A 20 -8.801 -19.485 21.431 1.00 0.00 C ATOM 289 O ARG A 20 -9.836 -18.953 21.030 1.00 0.00 O ATOM 290 CB ARG A 20 -9.096 -21.966 21.235 1.00 0.00 C ATOM 291 CG ARG A 20 -8.670 -23.241 20.448 1.00 0.00 C ATOM 292 CD ARG A 20 -7.717 -24.094 21.296 1.00 0.00 C ATOM 293 NE ARG A 20 -7.110 -25.144 20.485 1.00 0.00 N ATOM 294 CZ ARG A 20 -7.767 -26.267 20.210 1.00 0.00 C ATOM 295 NH1 ARG A 20 -8.978 -26.444 20.664 1.00 0.00 N ATOM 296 NH2 ARG A 20 -7.201 -27.193 19.487 1.00 0.00 N ATOM 0 H ARG A 20 -6.683 -21.728 21.748 1.00 0.00 H new ATOM 0 HA ARG A 20 -8.357 -20.652 19.696 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -8.956 -22.127 22.304 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -10.157 -21.772 21.078 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -9.552 -23.824 20.181 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -8.182 -22.956 19.516 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -6.939 -23.463 21.725 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -8.262 -24.539 22.129 1.00 0.00 H new ATOM 0 HE ARG A 20 -6.165 -25.014 20.123 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -9.421 -25.721 21.230 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -9.481 -27.306 20.452 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -6.254 -27.056 19.133 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -7.705 -28.054 19.276 1.00 0.00 H new ATOM 310 N GLU A 21 -8.085 -19.006 22.439 1.00 0.00 N ATOM 311 CA GLU A 21 -8.491 -17.799 23.144 1.00 0.00 C ATOM 312 C GLU A 21 -8.433 -16.595 22.206 1.00 0.00 C ATOM 313 O GLU A 21 -9.117 -15.594 22.423 1.00 0.00 O ATOM 314 CB GLU A 21 -7.571 -17.558 24.341 1.00 0.00 C ATOM 315 CG GLU A 21 -7.750 -18.688 25.357 1.00 0.00 C ATOM 316 CD GLU A 21 -6.798 -18.490 26.531 1.00 0.00 C ATOM 317 OE1 GLU A 21 -5.700 -18.010 26.303 1.00 0.00 O ATOM 318 OE2 GLU A 21 -7.183 -18.816 27.642 1.00 0.00 O ATOM 0 H GLU A 21 -7.225 -19.432 22.785 1.00 0.00 H new ATOM 0 HA GLU A 21 -9.515 -17.929 23.496 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.533 -17.511 24.012 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.802 -16.598 24.804 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -8.780 -18.708 25.713 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.558 -19.650 24.881 1.00 0.00 H new ATOM 325 N LEU A 22 -7.602 -16.694 21.167 1.00 0.00 N ATOM 326 CA LEU A 22 -7.452 -15.599 20.207 1.00 0.00 C ATOM 327 C LEU A 22 -8.521 -15.694 19.124 1.00 0.00 C ATOM 328 O LEU A 22 -8.835 -16.782 18.641 1.00 0.00 O ATOM 329 CB LEU A 22 -6.068 -15.669 19.553 1.00 0.00 C ATOM 330 CG LEU A 22 -4.988 -15.760 20.637 1.00 0.00 C ATOM 331 CD1 LEU A 22 -3.618 -15.948 19.980 1.00 0.00 C ATOM 332 CD2 LEU A 22 -4.974 -14.480 21.480 1.00 0.00 C ATOM 0 H LEU A 22 -7.027 -17.513 20.970 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.562 -14.654 20.739 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -6.010 -16.536 18.895 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -5.902 -14.787 18.934 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.208 -16.610 21.283 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -2.850 -16.013 20.751 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -3.619 -16.866 19.392 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -3.407 -15.100 19.329 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -4.203 -14.557 22.246 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -4.764 -13.624 20.839 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -5.946 -14.347 21.956 1.00 0.00 H new ATOM 344 N THR A 23 -9.078 -14.544 18.744 1.00 0.00 N ATOM 345 CA THR A 23 -10.118 -14.497 17.712 1.00 0.00 C ATOM 346 C THR A 23 -9.551 -13.940 16.411 1.00 0.00 C ATOM 347 O THR A 23 -8.346 -13.716 16.294 1.00 0.00 O ATOM 348 CB THR A 23 -11.283 -13.618 18.179 1.00 0.00 C ATOM 349 OG1 THR A 23 -10.853 -12.268 18.263 1.00 0.00 O ATOM 350 CG2 THR A 23 -11.767 -14.089 19.554 1.00 0.00 C ATOM 0 H THR A 23 -8.829 -13.635 19.133 1.00 0.00 H new ATOM 0 HA THR A 23 -10.477 -15.511 17.538 1.00 0.00 H new ATOM 0 HB THR A 23 -12.102 -13.695 17.464 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.598 -11.705 18.560 1.00 0.00 H new ATOM 0 HG21 THR A 23 -12.595 -13.462 19.883 1.00 0.00 H new ATOM 0 HG22 THR A 23 -12.100 -15.125 19.487 1.00 0.00 H new ATOM 0 HG23 THR A 23 -10.950 -14.016 20.272 1.00 0.00 H new ATOM 358 N GLU A 24 -10.425 -13.718 15.435 1.00 0.00 N ATOM 359 CA GLU A 24 -9.991 -13.186 14.149 1.00 0.00 C ATOM 360 C GLU A 24 -9.355 -11.813 14.328 1.00 0.00 C ATOM 361 O GLU A 24 -8.338 -11.504 13.709 1.00 0.00 O ATOM 362 CB GLU A 24 -11.189 -13.075 13.204 1.00 0.00 C ATOM 363 CG GLU A 24 -11.630 -14.473 12.773 1.00 0.00 C ATOM 364 CD GLU A 24 -12.935 -14.392 11.989 1.00 0.00 C ATOM 365 OE1 GLU A 24 -13.582 -13.360 12.060 1.00 0.00 O ATOM 366 OE2 GLU A 24 -13.266 -15.361 11.326 1.00 0.00 O ATOM 0 H GLU A 24 -11.427 -13.896 15.508 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.252 -13.864 13.723 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -12.011 -12.560 13.701 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.922 -12.481 12.330 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -10.856 -14.934 12.159 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.762 -15.108 13.649 1.00 0.00 H new ATOM 373 N GLY A 25 -9.958 -10.996 15.181 1.00 0.00 N ATOM 374 CA GLY A 25 -9.436 -9.660 15.441 1.00 0.00 C ATOM 375 C GLY A 25 -8.052 -9.732 16.078 1.00 0.00 C ATOM 376 O GLY A 25 -7.160 -8.952 15.742 1.00 0.00 O ATOM 0 H GLY A 25 -10.803 -11.232 15.702 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.383 -9.098 14.509 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -10.117 -9.121 16.100 1.00 0.00 H new ATOM 380 N ASP A 26 -7.883 -10.671 17.008 1.00 0.00 N ATOM 381 CA ASP A 26 -6.603 -10.829 17.692 1.00 0.00 C ATOM 382 C ASP A 26 -5.504 -11.210 16.704 1.00 0.00 C ATOM 383 O ASP A 26 -4.393 -10.684 16.763 1.00 0.00 O ATOM 384 CB ASP A 26 -6.719 -11.916 18.761 1.00 0.00 C ATOM 385 CG ASP A 26 -7.579 -11.421 19.919 1.00 0.00 C ATOM 386 OD1 ASP A 26 -7.852 -10.233 19.962 1.00 0.00 O ATOM 387 OD2 ASP A 26 -7.960 -12.238 20.740 1.00 0.00 O ATOM 0 H ASP A 26 -8.608 -11.326 17.302 1.00 0.00 H new ATOM 0 HA ASP A 26 -6.344 -9.878 18.157 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -7.158 -12.816 18.330 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -5.728 -12.188 19.124 1.00 0.00 H new ATOM 392 N ILE A 27 -5.824 -12.124 15.791 1.00 0.00 N ATOM 393 CA ILE A 27 -4.856 -12.560 14.791 1.00 0.00 C ATOM 394 C ILE A 27 -4.456 -11.389 13.906 1.00 0.00 C ATOM 395 O ILE A 27 -3.277 -11.198 13.610 1.00 0.00 O ATOM 396 CB ILE A 27 -5.442 -13.682 13.932 1.00 0.00 C ATOM 397 CG1 ILE A 27 -5.609 -14.943 14.788 1.00 0.00 C ATOM 398 CG2 ILE A 27 -4.509 -13.985 12.748 1.00 0.00 C ATOM 399 CD1 ILE A 27 -6.416 -15.989 14.011 1.00 0.00 C ATOM 0 H ILE A 27 -6.737 -12.573 15.724 1.00 0.00 H new ATOM 0 HA ILE A 27 -3.973 -12.938 15.307 1.00 0.00 H new ATOM 0 HB ILE A 27 -6.412 -13.367 13.547 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -4.632 -15.347 15.053 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -6.116 -14.697 15.721 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -4.936 -14.785 12.144 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.395 -13.090 12.137 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.534 -14.295 13.123 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -6.534 -16.885 14.621 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -7.398 -15.584 13.768 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -5.891 -16.244 13.090 1.00 0.00 H new ATOM 411 N LEU A 28 -5.446 -10.606 13.484 1.00 0.00 N ATOM 412 CA LEU A 28 -5.174 -9.464 12.629 1.00 0.00 C ATOM 413 C LEU A 28 -4.181 -8.528 13.301 1.00 0.00 C ATOM 414 O LEU A 28 -3.201 -8.127 12.682 1.00 0.00 O ATOM 415 CB LEU A 28 -6.490 -8.703 12.335 1.00 0.00 C ATOM 416 CG LEU A 28 -7.281 -9.396 11.201 1.00 0.00 C ATOM 417 CD1 LEU A 28 -8.765 -9.032 11.300 1.00 0.00 C ATOM 418 CD2 LEU A 28 -6.759 -8.915 9.835 1.00 0.00 C ATOM 0 H LEU A 28 -6.429 -10.742 13.719 1.00 0.00 H new ATOM 0 HA LEU A 28 -4.746 -9.821 11.692 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.100 -8.660 13.237 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.266 -7.674 12.053 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.153 -10.474 11.298 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -9.315 -9.524 10.498 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.157 -9.360 12.263 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.881 -7.952 11.210 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.319 -9.405 9.038 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -6.886 -7.835 9.756 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.702 -9.163 9.742 1.00 0.00 H new ATOM 430 N THR A 29 -4.423 -8.205 14.567 1.00 0.00 N ATOM 431 CA THR A 29 -3.527 -7.320 15.304 1.00 0.00 C ATOM 432 C THR A 29 -2.125 -7.907 15.403 1.00 0.00 C ATOM 433 O THR A 29 -1.132 -7.198 15.235 1.00 0.00 O ATOM 434 CB THR A 29 -4.070 -7.069 16.717 1.00 0.00 C ATOM 435 OG1 THR A 29 -5.323 -6.405 16.628 1.00 0.00 O ATOM 436 CG2 THR A 29 -3.077 -6.206 17.514 1.00 0.00 C ATOM 0 H THR A 29 -5.225 -8.539 15.101 1.00 0.00 H new ATOM 0 HA THR A 29 -3.473 -6.378 14.757 1.00 0.00 H new ATOM 0 HB THR A 29 -4.200 -8.022 17.230 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.358 -5.882 15.800 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.469 -6.032 18.516 1.00 0.00 H new ATOM 0 HG22 THR A 29 -2.120 -6.723 17.584 1.00 0.00 H new ATOM 0 HG23 THR A 29 -2.937 -5.251 17.008 1.00 0.00 H new ATOM 444 N VAL A 30 -2.046 -9.200 15.689 1.00 0.00 N ATOM 445 CA VAL A 30 -0.753 -9.858 15.820 1.00 0.00 C ATOM 446 C VAL A 30 0.034 -9.779 14.509 1.00 0.00 C ATOM 447 O VAL A 30 1.218 -9.440 14.502 1.00 0.00 O ATOM 448 CB VAL A 30 -0.969 -11.331 16.212 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.363 -12.088 16.140 1.00 0.00 C ATOM 450 CG2 VAL A 30 -1.532 -11.410 17.637 1.00 0.00 C ATOM 0 H VAL A 30 -2.852 -9.808 15.833 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.178 -9.350 16.594 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.678 -11.786 15.520 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.205 -13.130 16.418 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.755 -12.039 15.124 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.077 -11.634 16.826 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.684 -12.454 17.911 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.829 -10.951 18.332 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.484 -10.881 17.682 1.00 0.00 H new ATOM 460 N PHE A 31 -0.632 -10.096 13.408 1.00 0.00 N ATOM 461 CA PHE A 31 -0.007 -10.063 12.084 1.00 0.00 C ATOM 462 C PHE A 31 -0.067 -8.659 11.471 1.00 0.00 C ATOM 463 O PHE A 31 0.589 -8.389 10.463 1.00 0.00 O ATOM 464 CB PHE A 31 -0.696 -11.075 11.158 1.00 0.00 C ATOM 465 CG PHE A 31 -0.261 -12.482 11.520 1.00 0.00 C ATOM 466 CD1 PHE A 31 -0.717 -13.070 12.704 1.00 0.00 C ATOM 467 CD2 PHE A 31 0.604 -13.192 10.676 1.00 0.00 C ATOM 468 CE1 PHE A 31 -0.311 -14.366 13.046 1.00 0.00 C ATOM 469 CE2 PHE A 31 1.010 -14.488 11.018 1.00 0.00 C ATOM 470 CZ PHE A 31 0.551 -15.074 12.203 1.00 0.00 C ATOM 0 H PHE A 31 -1.611 -10.381 13.401 1.00 0.00 H new ATOM 0 HA PHE A 31 1.043 -10.332 12.198 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -1.779 -10.985 11.247 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.443 -10.862 10.119 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.383 -12.524 13.356 1.00 0.00 H new ATOM 0 HD2 PHE A 31 0.958 -12.739 9.761 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -0.664 -14.819 13.961 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.677 -15.035 10.368 1.00 0.00 H new ATOM 0 HZ PHE A 31 0.863 -16.074 12.467 1.00 0.00 H new ATOM 480 N SER A 32 -0.885 -7.783 12.056 1.00 0.00 N ATOM 481 CA SER A 32 -1.047 -6.431 11.519 1.00 0.00 C ATOM 482 C SER A 32 0.289 -5.747 11.202 1.00 0.00 C ATOM 483 O SER A 32 0.523 -5.325 10.061 1.00 0.00 O ATOM 484 CB SER A 32 -1.807 -5.563 12.520 1.00 0.00 C ATOM 485 OG SER A 32 -1.784 -4.214 12.082 1.00 0.00 O ATOM 0 H SER A 32 -1.438 -7.981 12.890 1.00 0.00 H new ATOM 0 HA SER A 32 -1.601 -6.535 10.586 1.00 0.00 H new ATOM 0 HB2 SER A 32 -2.836 -5.910 12.612 1.00 0.00 H new ATOM 0 HB3 SER A 32 -1.353 -5.645 13.508 1.00 0.00 H new ATOM 0 HG SER A 32 -2.702 -3.900 11.941 1.00 0.00 H new ATOM 491 N GLU A 33 1.161 -5.651 12.201 1.00 0.00 N ATOM 492 CA GLU A 33 2.477 -5.026 12.021 1.00 0.00 C ATOM 493 C GLU A 33 3.371 -5.868 11.122 1.00 0.00 C ATOM 494 O GLU A 33 4.305 -5.358 10.502 1.00 0.00 O ATOM 495 CB GLU A 33 3.156 -4.810 13.388 1.00 0.00 C ATOM 496 CG GLU A 33 4.586 -4.279 13.192 1.00 0.00 C ATOM 497 CD GLU A 33 4.564 -2.994 12.376 1.00 0.00 C ATOM 498 OE1 GLU A 33 3.582 -2.276 12.467 1.00 0.00 O ATOM 499 OE2 GLU A 33 5.522 -2.750 11.662 1.00 0.00 O ATOM 0 H GLU A 33 0.985 -5.996 13.145 1.00 0.00 H new ATOM 0 HA GLU A 33 2.326 -4.060 11.539 1.00 0.00 H new ATOM 0 HB2 GLU A 33 2.576 -4.104 13.983 1.00 0.00 H new ATOM 0 HB3 GLU A 33 3.181 -5.748 13.942 1.00 0.00 H new ATOM 0 HG2 GLU A 33 5.049 -4.095 14.161 1.00 0.00 H new ATOM 0 HG3 GLU A 33 5.194 -5.029 12.686 1.00 0.00 H new ATOM 506 N TYR A 34 3.101 -7.160 11.081 1.00 0.00 N ATOM 507 CA TYR A 34 3.884 -8.106 10.287 1.00 0.00 C ATOM 508 C TYR A 34 3.234 -8.384 8.938 1.00 0.00 C ATOM 509 O TYR A 34 3.288 -9.511 8.448 1.00 0.00 O ATOM 510 CB TYR A 34 4.101 -9.407 11.059 1.00 0.00 C ATOM 511 CG TYR A 34 4.981 -9.135 12.260 1.00 0.00 C ATOM 512 CD1 TYR A 34 6.317 -8.752 12.075 1.00 0.00 C ATOM 513 CD2 TYR A 34 4.466 -9.267 13.557 1.00 0.00 C ATOM 514 CE1 TYR A 34 7.134 -8.498 13.184 1.00 0.00 C ATOM 515 CE2 TYR A 34 5.284 -9.014 14.664 1.00 0.00 C ATOM 516 CZ TYR A 34 6.617 -8.630 14.479 1.00 0.00 C ATOM 517 OH TYR A 34 7.423 -8.382 15.571 1.00 0.00 O ATOM 0 H TYR A 34 2.333 -7.590 11.596 1.00 0.00 H new ATOM 0 HA TYR A 34 4.854 -7.648 10.095 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.143 -9.817 11.381 1.00 0.00 H new ATOM 0 HB3 TYR A 34 4.566 -10.153 10.414 1.00 0.00 H new ATOM 0 HD1 TYR A 34 6.716 -8.653 11.077 1.00 0.00 H new ATOM 0 HD2 TYR A 34 3.438 -9.564 13.702 1.00 0.00 H new ATOM 0 HE1 TYR A 34 8.162 -8.200 13.041 1.00 0.00 H new ATOM 0 HE2 TYR A 34 4.886 -9.115 15.663 1.00 0.00 H new ATOM 0 HH TYR A 34 6.909 -8.518 16.394 1.00 0.00 H new ATOM 527 N GLY A 35 2.592 -7.369 8.340 1.00 0.00 N ATOM 528 CA GLY A 35 1.918 -7.596 7.059 1.00 0.00 C ATOM 529 C GLY A 35 0.419 -7.788 7.231 1.00 0.00 C ATOM 530 O GLY A 35 -0.098 -8.890 7.053 1.00 0.00 O ATOM 0 H GLY A 35 2.527 -6.420 8.707 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.102 -6.749 6.397 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.343 -8.476 6.576 1.00 0.00 H new ATOM 534 N VAL A 36 -0.271 -6.713 7.624 1.00 0.00 N ATOM 535 CA VAL A 36 -1.702 -6.808 7.875 1.00 0.00 C ATOM 536 C VAL A 36 -2.454 -7.302 6.616 1.00 0.00 C ATOM 537 O VAL A 36 -2.409 -6.674 5.561 1.00 0.00 O ATOM 538 CB VAL A 36 -2.247 -5.408 8.238 1.00 0.00 C ATOM 539 CG1 VAL A 36 -2.216 -4.482 7.007 1.00 0.00 C ATOM 540 CG2 VAL A 36 -3.692 -5.544 8.742 1.00 0.00 C ATOM 0 H VAL A 36 0.132 -5.788 7.771 1.00 0.00 H new ATOM 0 HA VAL A 36 -1.858 -7.515 8.690 1.00 0.00 H new ATOM 0 HB VAL A 36 -1.620 -4.974 9.017 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -2.603 -3.500 7.280 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.190 -4.382 6.653 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -2.833 -4.908 6.216 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -4.082 -4.559 9.000 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -4.310 -5.986 7.960 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -3.711 -6.184 9.624 1.00 0.00 H new ATOM 550 N PRO A 37 -3.134 -8.444 6.720 1.00 0.00 N ATOM 551 CA PRO A 37 -3.884 -9.052 5.581 1.00 0.00 C ATOM 552 C PRO A 37 -5.176 -8.309 5.276 1.00 0.00 C ATOM 553 O PRO A 37 -5.712 -7.593 6.121 1.00 0.00 O ATOM 554 CB PRO A 37 -4.164 -10.490 6.052 1.00 0.00 C ATOM 555 CG PRO A 37 -4.211 -10.403 7.542 1.00 0.00 C ATOM 556 CD PRO A 37 -3.270 -9.276 7.939 1.00 0.00 C ATOM 0 HA PRO A 37 -3.317 -9.010 4.651 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -5.106 -10.862 5.648 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -3.383 -11.174 5.720 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -5.225 -10.201 7.887 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -3.902 -11.345 7.995 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -3.675 -8.697 8.769 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.304 -9.664 8.262 1.00 0.00 H new ATOM 564 N VAL A 38 -5.674 -8.490 4.059 1.00 0.00 N ATOM 565 CA VAL A 38 -6.911 -7.838 3.644 1.00 0.00 C ATOM 566 C VAL A 38 -8.106 -8.745 3.928 1.00 0.00 C ATOM 567 O VAL A 38 -9.247 -8.285 3.956 1.00 0.00 O ATOM 568 CB VAL A 38 -6.852 -7.511 2.150 1.00 0.00 C ATOM 569 CG1 VAL A 38 -5.827 -6.400 1.910 1.00 0.00 C ATOM 570 CG2 VAL A 38 -6.433 -8.759 1.365 1.00 0.00 C ATOM 0 H VAL A 38 -5.244 -9.079 3.346 1.00 0.00 H new ATOM 0 HA VAL A 38 -7.027 -6.913 4.209 1.00 0.00 H new ATOM 0 HB VAL A 38 -7.836 -7.182 1.816 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -5.785 -6.167 0.846 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -6.120 -5.509 2.465 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -4.845 -6.732 2.248 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -6.392 -8.523 0.302 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -5.450 -9.088 1.702 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -7.159 -9.555 1.532 1.00 0.00 H new ATOM 580 N ASP A 39 -7.832 -10.032 4.150 1.00 0.00 N ATOM 581 CA ASP A 39 -8.893 -10.993 4.442 1.00 0.00 C ATOM 582 C ASP A 39 -8.304 -12.350 4.830 1.00 0.00 C ATOM 583 O ASP A 39 -7.330 -12.801 4.238 1.00 0.00 O ATOM 584 CB ASP A 39 -9.800 -11.155 3.219 1.00 0.00 C ATOM 585 CG ASP A 39 -11.025 -11.986 3.586 1.00 0.00 C ATOM 586 OD1 ASP A 39 -10.992 -12.629 4.622 1.00 0.00 O ATOM 587 OD2 ASP A 39 -11.978 -11.966 2.824 1.00 0.00 O ATOM 0 H ASP A 39 -6.892 -10.429 4.133 1.00 0.00 H new ATOM 0 HA ASP A 39 -9.478 -10.615 5.281 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -10.110 -10.176 2.854 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -9.251 -11.638 2.410 1.00 0.00 H new ATOM 592 N VAL A 40 -8.903 -13.005 5.828 1.00 0.00 N ATOM 593 CA VAL A 40 -8.421 -14.321 6.278 1.00 0.00 C ATOM 594 C VAL A 40 -9.584 -15.312 6.332 1.00 0.00 C ATOM 595 O VAL A 40 -10.727 -14.923 6.575 1.00 0.00 O ATOM 596 CB VAL A 40 -7.779 -14.201 7.668 1.00 0.00 C ATOM 597 CG1 VAL A 40 -6.734 -13.083 7.658 1.00 0.00 C ATOM 598 CG2 VAL A 40 -8.848 -13.885 8.706 1.00 0.00 C ATOM 0 H VAL A 40 -9.714 -12.654 6.337 1.00 0.00 H new ATOM 0 HA VAL A 40 -7.674 -14.682 5.571 1.00 0.00 H new ATOM 0 HB VAL A 40 -7.299 -15.146 7.921 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -6.280 -13.000 8.646 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -5.963 -13.312 6.922 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -7.214 -12.139 7.399 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.386 -13.801 9.690 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.335 -12.943 8.452 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -9.589 -14.684 8.720 1.00 0.00 H new ATOM 608 N ILE A 41 -9.289 -16.594 6.101 1.00 0.00 N ATOM 609 CA ILE A 41 -10.323 -17.642 6.122 1.00 0.00 C ATOM 610 C ILE A 41 -10.113 -18.592 7.297 1.00 0.00 C ATOM 611 O ILE A 41 -9.036 -19.165 7.460 1.00 0.00 O ATOM 612 CB ILE A 41 -10.277 -18.438 4.814 1.00 0.00 C ATOM 613 CG1 ILE A 41 -10.592 -17.505 3.641 1.00 0.00 C ATOM 614 CG2 ILE A 41 -11.312 -19.566 4.863 1.00 0.00 C ATOM 615 CD1 ILE A 41 -10.239 -18.202 2.326 1.00 0.00 C ATOM 0 H ILE A 41 -8.349 -16.934 5.898 1.00 0.00 H new ATOM 0 HA ILE A 41 -11.295 -17.161 6.231 1.00 0.00 H new ATOM 0 HB ILE A 41 -9.283 -18.866 4.683 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -11.648 -17.236 3.650 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -10.026 -16.578 3.737 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -11.278 -20.132 3.932 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -11.088 -20.229 5.699 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -12.307 -19.141 4.994 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -10.463 -17.538 1.491 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -9.177 -18.449 2.319 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -10.825 -19.116 2.230 1.00 0.00 H new ATOM 627 N LEU A 42 -11.157 -18.761 8.116 1.00 0.00 N ATOM 628 CA LEU A 42 -11.081 -19.655 9.281 1.00 0.00 C ATOM 629 C LEU A 42 -11.954 -20.892 9.057 1.00 0.00 C ATOM 630 O LEU A 42 -13.175 -20.841 9.211 1.00 0.00 O ATOM 631 CB LEU A 42 -11.546 -18.903 10.555 1.00 0.00 C ATOM 632 CG LEU A 42 -10.348 -18.230 11.248 1.00 0.00 C ATOM 633 CD1 LEU A 42 -9.806 -17.099 10.366 1.00 0.00 C ATOM 634 CD2 LEU A 42 -10.791 -17.658 12.597 1.00 0.00 C ATOM 0 H LEU A 42 -12.057 -18.296 7.997 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.047 -19.974 9.412 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -12.290 -18.152 10.290 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -12.027 -19.600 11.241 1.00 0.00 H new ATOM 0 HG LEU A 42 -9.564 -18.970 11.406 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -8.958 -16.626 10.861 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -9.485 -17.507 9.408 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -10.589 -16.359 10.201 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -9.942 -17.182 13.087 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.579 -16.921 12.439 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -11.169 -18.463 13.227 1.00 0.00 H new ATOM 646 N SER A 43 -11.318 -22.003 8.702 1.00 0.00 N ATOM 647 CA SER A 43 -12.044 -23.248 8.471 1.00 0.00 C ATOM 648 C SER A 43 -12.559 -23.817 9.789 1.00 0.00 C ATOM 649 O SER A 43 -11.836 -23.845 10.786 1.00 0.00 O ATOM 650 CB SER A 43 -11.127 -24.267 7.797 1.00 0.00 C ATOM 651 OG SER A 43 -11.801 -25.515 7.701 1.00 0.00 O ATOM 0 H SER A 43 -10.309 -22.068 8.569 1.00 0.00 H new ATOM 0 HA SER A 43 -12.894 -23.039 7.821 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.843 -23.917 6.805 1.00 0.00 H new ATOM 0 HB3 SER A 43 -10.207 -24.381 8.371 1.00 0.00 H new ATOM 0 HG SER A 43 -11.216 -26.170 7.267 1.00 0.00 H new ATOM 657 N ARG A 44 -13.813 -24.275 9.792 1.00 0.00 N ATOM 658 CA ARG A 44 -14.420 -24.850 11.000 1.00 0.00 C ATOM 659 C ARG A 44 -15.154 -26.146 10.671 1.00 0.00 C ATOM 660 O ARG A 44 -15.784 -26.267 9.619 1.00 0.00 O ATOM 661 CB ARG A 44 -15.398 -23.849 11.618 1.00 0.00 C ATOM 662 CG ARG A 44 -14.630 -22.614 12.094 1.00 0.00 C ATOM 663 CD ARG A 44 -15.563 -21.716 12.908 1.00 0.00 C ATOM 664 NE ARG A 44 -14.845 -20.533 13.375 1.00 0.00 N ATOM 665 CZ ARG A 44 -14.727 -19.448 12.613 1.00 0.00 C ATOM 666 NH1 ARG A 44 -15.260 -19.427 11.422 1.00 0.00 N ATOM 667 NH2 ARG A 44 -14.079 -18.405 13.055 1.00 0.00 N ATOM 0 H ARG A 44 -14.427 -24.260 8.978 1.00 0.00 H new ATOM 0 HA ARG A 44 -13.625 -25.070 11.713 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -16.152 -23.562 10.886 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -15.925 -24.308 12.455 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -13.776 -22.915 12.701 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -14.235 -22.066 11.239 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -16.415 -21.416 12.297 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -15.960 -22.269 13.759 1.00 0.00 H new ATOM 0 HE ARG A 44 -14.425 -20.538 14.305 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -15.767 -20.242 11.076 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -15.170 -18.596 10.838 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -13.662 -18.420 13.986 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -13.990 -17.574 12.470 1.00 0.00 H new ATOM 786 N GLY A 53 -7.618 -24.101 15.496 1.00 0.00 N ATOM 787 CA GLY A 53 -6.203 -24.398 15.704 1.00 0.00 C ATOM 788 C GLY A 53 -5.390 -24.086 14.454 1.00 0.00 C ATOM 789 O GLY A 53 -4.157 -24.219 14.454 1.00 0.00 O ATOM 0 HA2 GLY A 53 -5.825 -23.814 16.543 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -6.083 -25.449 15.967 1.00 0.00 H new ATOM 793 N PHE A 54 -6.088 -23.669 13.389 1.00 0.00 N ATOM 794 CA PHE A 54 -5.432 -23.330 12.128 1.00 0.00 C ATOM 795 C PHE A 54 -6.273 -22.341 11.312 1.00 0.00 C ATOM 796 O PHE A 54 -7.500 -22.325 11.412 1.00 0.00 O ATOM 797 CB PHE A 54 -5.184 -24.605 11.313 1.00 0.00 C ATOM 798 CG PHE A 54 -6.403 -25.494 11.391 1.00 0.00 C ATOM 799 CD1 PHE A 54 -7.507 -25.254 10.565 1.00 0.00 C ATOM 800 CD2 PHE A 54 -6.426 -26.561 12.299 1.00 0.00 C ATOM 801 CE1 PHE A 54 -8.634 -26.081 10.646 1.00 0.00 C ATOM 802 CE2 PHE A 54 -7.553 -27.388 12.379 1.00 0.00 C ATOM 803 CZ PHE A 54 -8.657 -27.147 11.554 1.00 0.00 C ATOM 0 H PHE A 54 -7.102 -23.560 13.379 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.479 -22.853 12.357 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -4.971 -24.351 10.275 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -4.311 -25.132 11.698 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -7.490 -24.431 9.865 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -5.574 -26.745 12.937 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -9.486 -25.897 10.008 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -7.570 -28.212 13.077 1.00 0.00 H new ATOM 0 HZ PHE A 54 -9.527 -27.783 11.617 1.00 0.00 H new ATOM 813 N ALA A 55 -5.598 -21.522 10.501 1.00 0.00 N ATOM 814 CA ALA A 55 -6.288 -20.533 9.668 1.00 0.00 C ATOM 815 C ALA A 55 -5.418 -20.128 8.477 1.00 0.00 C ATOM 816 O ALA A 55 -4.211 -20.381 8.464 1.00 0.00 O ATOM 817 CB ALA A 55 -6.629 -19.297 10.500 1.00 0.00 C ATOM 0 H ALA A 55 -4.583 -21.523 10.403 1.00 0.00 H new ATOM 0 HA ALA A 55 -7.207 -20.982 9.292 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -7.142 -18.567 9.874 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.277 -19.583 11.328 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.712 -18.858 10.892 1.00 0.00 H new ATOM 823 N TYR A 56 -6.036 -19.497 7.468 1.00 0.00 N ATOM 824 CA TYR A 56 -5.303 -19.062 6.267 1.00 0.00 C ATOM 825 C TYR A 56 -5.208 -17.536 6.221 1.00 0.00 C ATOM 826 O TYR A 56 -6.195 -16.834 6.445 1.00 0.00 O ATOM 827 CB TYR A 56 -6.026 -19.551 5.014 1.00 0.00 C ATOM 828 CG TYR A 56 -6.145 -21.057 5.053 1.00 0.00 C ATOM 829 CD1 TYR A 56 -5.037 -21.860 4.756 1.00 0.00 C ATOM 830 CD2 TYR A 56 -7.367 -21.651 5.390 1.00 0.00 C ATOM 831 CE1 TYR A 56 -5.153 -23.256 4.797 1.00 0.00 C ATOM 832 CE2 TYR A 56 -7.484 -23.044 5.431 1.00 0.00 C ATOM 833 CZ TYR A 56 -6.377 -23.847 5.134 1.00 0.00 C ATOM 834 OH TYR A 56 -6.492 -25.222 5.175 1.00 0.00 O ATOM 0 H TYR A 56 -7.032 -19.277 7.457 1.00 0.00 H new ATOM 0 HA TYR A 56 -4.299 -19.484 6.306 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -7.016 -19.099 4.954 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -5.480 -19.242 4.123 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -4.093 -21.404 4.495 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -8.222 -21.032 5.619 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -4.299 -23.876 4.569 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -8.428 -23.500 5.692 1.00 0.00 H new ATOM 0 HH TYR A 56 -7.407 -25.466 5.427 1.00 0.00 H new ATOM 844 N LEU A 57 -4.011 -17.024 5.926 1.00 0.00 N ATOM 845 CA LEU A 57 -3.781 -15.570 5.852 1.00 0.00 C ATOM 846 C LEU A 57 -3.532 -15.129 4.404 1.00 0.00 C ATOM 847 O LEU A 57 -2.924 -15.861 3.625 1.00 0.00 O ATOM 848 CB LEU A 57 -2.561 -15.177 6.726 1.00 0.00 C ATOM 849 CG LEU A 57 -2.846 -13.866 7.488 1.00 0.00 C ATOM 850 CD1 LEU A 57 -3.601 -14.179 8.784 1.00 0.00 C ATOM 851 CD2 LEU A 57 -1.531 -13.152 7.820 1.00 0.00 C ATOM 0 H LEU A 57 -3.184 -17.589 5.734 1.00 0.00 H new ATOM 0 HA LEU A 57 -4.674 -15.068 6.224 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.340 -15.976 7.434 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.679 -15.055 6.097 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.454 -13.216 6.859 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -3.802 -13.252 9.321 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.544 -14.672 8.546 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -2.996 -14.836 9.408 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.744 -12.228 8.358 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.912 -13.799 8.442 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.000 -12.920 6.897 1.00 0.00 H new ATOM 863 N LYS A 58 -4.002 -13.921 4.057 1.00 0.00 N ATOM 864 CA LYS A 58 -3.811 -13.386 2.702 1.00 0.00 C ATOM 865 C LYS A 58 -3.268 -11.948 2.739 1.00 0.00 C ATOM 866 O LYS A 58 -3.994 -11.011 3.077 1.00 0.00 O ATOM 867 CB LYS A 58 -5.144 -13.412 1.949 1.00 0.00 C ATOM 868 CG LYS A 58 -4.947 -12.912 0.512 1.00 0.00 C ATOM 869 CD LYS A 58 -6.270 -13.009 -0.249 1.00 0.00 C ATOM 870 CE LYS A 58 -6.072 -12.504 -1.681 1.00 0.00 C ATOM 871 NZ LYS A 58 -7.361 -12.602 -2.424 1.00 0.00 N ATOM 0 H LYS A 58 -4.511 -13.303 4.689 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.080 -14.011 2.189 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.545 -14.426 1.938 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -5.873 -12.786 2.463 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.595 -11.880 0.520 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -4.183 -13.506 0.011 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -6.620 -14.041 -0.261 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -7.036 -12.418 0.254 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -5.724 -11.471 -1.669 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -5.305 -13.093 -2.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -7.228 -12.259 -3.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -7.675 -13.593 -2.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -8.081 -12.022 -1.948 1.00 0.00 H new ATOM 885 N TYR A 59 -1.993 -11.778 2.371 1.00 0.00 N ATOM 886 CA TYR A 59 -1.365 -10.444 2.344 1.00 0.00 C ATOM 887 C TYR A 59 -1.188 -9.995 0.895 1.00 0.00 C ATOM 888 O TYR A 59 -1.132 -10.822 -0.016 1.00 0.00 O ATOM 889 CB TYR A 59 -0.005 -10.461 3.058 1.00 0.00 C ATOM 890 CG TYR A 59 0.474 -9.035 3.284 1.00 0.00 C ATOM 891 CD1 TYR A 59 -0.135 -8.237 4.260 1.00 0.00 C ATOM 892 CD2 TYR A 59 1.523 -8.514 2.516 1.00 0.00 C ATOM 893 CE1 TYR A 59 0.311 -6.921 4.466 1.00 0.00 C ATOM 894 CE2 TYR A 59 1.965 -7.202 2.724 1.00 0.00 C ATOM 895 CZ TYR A 59 1.358 -6.406 3.697 1.00 0.00 C ATOM 896 OH TYR A 59 1.791 -5.113 3.902 1.00 0.00 O ATOM 0 H TYR A 59 -1.376 -12.540 2.089 1.00 0.00 H new ATOM 0 HA TYR A 59 -2.014 -9.743 2.869 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -0.091 -10.981 4.012 1.00 0.00 H new ATOM 0 HB3 TYR A 59 0.723 -11.009 2.460 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -0.946 -8.632 4.853 1.00 0.00 H new ATOM 0 HD2 TYR A 59 1.993 -9.127 1.761 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -0.156 -6.306 5.221 1.00 0.00 H new ATOM 0 HE2 TYR A 59 2.776 -6.805 2.131 1.00 0.00 H new ATOM 0 HH TYR A 59 2.526 -4.913 3.286 1.00 0.00 H new ATOM 906 N GLU A 60 -1.119 -8.684 0.682 1.00 0.00 N ATOM 907 CA GLU A 60 -0.967 -8.146 -0.668 1.00 0.00 C ATOM 908 C GLU A 60 0.326 -8.632 -1.330 1.00 0.00 C ATOM 909 O GLU A 60 0.332 -8.978 -2.511 1.00 0.00 O ATOM 910 CB GLU A 60 -0.955 -6.617 -0.612 1.00 0.00 C ATOM 911 CG GLU A 60 -2.344 -6.102 -0.231 1.00 0.00 C ATOM 912 CD GLU A 60 -3.317 -6.330 -1.384 1.00 0.00 C ATOM 913 OE1 GLU A 60 -2.854 -6.610 -2.476 1.00 0.00 O ATOM 914 OE2 GLU A 60 -4.511 -6.219 -1.157 1.00 0.00 O ATOM 0 H GLU A 60 -1.165 -7.980 1.418 1.00 0.00 H new ATOM 0 HA GLU A 60 -1.809 -8.499 -1.263 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -0.218 -6.276 0.116 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -0.659 -6.211 -1.579 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -2.699 -6.615 0.663 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -2.294 -5.040 0.010 1.00 0.00 H new ATOM 921 N ASP A 61 1.418 -8.653 -0.566 1.00 0.00 N ATOM 922 CA ASP A 61 2.723 -9.098 -1.091 1.00 0.00 C ATOM 923 C ASP A 61 3.111 -10.466 -0.530 1.00 0.00 C ATOM 924 O ASP A 61 2.647 -10.876 0.530 1.00 0.00 O ATOM 925 CB ASP A 61 3.802 -8.079 -0.718 1.00 0.00 C ATOM 926 CG ASP A 61 3.472 -6.723 -1.331 1.00 0.00 C ATOM 927 OD1 ASP A 61 2.768 -6.700 -2.327 1.00 0.00 O ATOM 928 OD2 ASP A 61 3.924 -5.726 -0.792 1.00 0.00 O ATOM 0 H ASP A 61 1.433 -8.370 0.414 1.00 0.00 H new ATOM 0 HA ASP A 61 2.640 -9.179 -2.175 1.00 0.00 H new ATOM 0 HB2 ASP A 61 3.871 -7.990 0.366 1.00 0.00 H new ATOM 0 HB3 ASP A 61 4.775 -8.421 -1.072 1.00 0.00 H new ATOM 933 N GLN A 62 3.968 -11.177 -1.255 1.00 0.00 N ATOM 934 CA GLN A 62 4.421 -12.496 -0.819 1.00 0.00 C ATOM 935 C GLN A 62 5.622 -12.362 0.120 1.00 0.00 C ATOM 936 O GLN A 62 5.921 -13.268 0.896 1.00 0.00 O ATOM 937 CB GLN A 62 4.791 -13.354 -2.029 1.00 0.00 C ATOM 938 CG GLN A 62 5.080 -14.784 -1.569 1.00 0.00 C ATOM 939 CD GLN A 62 5.348 -15.677 -2.776 1.00 0.00 C ATOM 940 OE1 GLN A 62 4.848 -15.410 -3.868 1.00 0.00 O ATOM 941 NE2 GLN A 62 6.114 -16.725 -2.644 1.00 0.00 N ATOM 0 H GLN A 62 4.362 -10.866 -2.143 1.00 0.00 H new ATOM 0 HA GLN A 62 3.609 -12.982 -0.279 1.00 0.00 H new ATOM 0 HB2 GLN A 62 3.977 -13.351 -2.753 1.00 0.00 H new ATOM 0 HB3 GLN A 62 5.665 -12.938 -2.530 1.00 0.00 H new ATOM 0 HG2 GLN A 62 5.942 -14.793 -0.902 1.00 0.00 H new ATOM 0 HG3 GLN A 62 4.233 -15.170 -1.002 1.00 0.00 H new ATOM 0 HE21 GLN A 62 6.527 -16.944 -1.737 1.00 0.00 H new ATOM 0 HE22 GLN A 62 6.300 -17.325 -3.447 1.00 0.00 H new ATOM 950 N ARG A 63 6.315 -11.228 0.034 1.00 0.00 N ATOM 951 CA ARG A 63 7.487 -10.989 0.871 1.00 0.00 C ATOM 952 C ARG A 63 7.092 -10.868 2.339 1.00 0.00 C ATOM 953 O ARG A 63 7.885 -11.165 3.231 1.00 0.00 O ATOM 954 CB ARG A 63 8.201 -9.712 0.423 1.00 0.00 C ATOM 955 CG ARG A 63 8.839 -9.937 -0.948 1.00 0.00 C ATOM 956 CD ARG A 63 9.406 -8.616 -1.472 1.00 0.00 C ATOM 957 NE ARG A 63 8.324 -7.692 -1.786 1.00 0.00 N ATOM 958 CZ ARG A 63 8.576 -6.452 -2.196 1.00 0.00 C ATOM 959 NH1 ARG A 63 9.809 -6.044 -2.319 1.00 0.00 N ATOM 960 NH2 ARG A 63 7.590 -5.643 -2.473 1.00 0.00 N ATOM 0 H ARG A 63 6.086 -10.465 -0.603 1.00 0.00 H new ATOM 0 HA ARG A 63 8.161 -11.839 0.762 1.00 0.00 H new ATOM 0 HB2 ARG A 63 7.493 -8.885 0.375 1.00 0.00 H new ATOM 0 HB3 ARG A 63 8.965 -9.436 1.150 1.00 0.00 H new ATOM 0 HG2 ARG A 63 9.632 -10.681 -0.874 1.00 0.00 H new ATOM 0 HG3 ARG A 63 8.098 -10.329 -1.645 1.00 0.00 H new ATOM 0 HD2 ARG A 63 10.066 -8.174 -0.726 1.00 0.00 H new ATOM 0 HD3 ARG A 63 10.008 -8.798 -2.362 1.00 0.00 H new ATOM 0 HE ARG A 63 7.357 -8.001 -1.690 1.00 0.00 H new ATOM 0 HH11 ARG A 63 10.579 -6.676 -2.101 1.00 0.00 H new ATOM 0 HH12 ARG A 63 10.003 -5.093 -2.633 1.00 0.00 H new ATOM 0 HH21 ARG A 63 6.626 -5.962 -2.375 1.00 0.00 H new ATOM 0 HH22 ARG A 63 7.783 -4.692 -2.787 1.00 0.00 H new ATOM 974 N SER A 64 5.863 -10.425 2.582 1.00 0.00 N ATOM 975 CA SER A 64 5.373 -10.263 3.947 1.00 0.00 C ATOM 976 C SER A 64 5.355 -11.601 4.681 1.00 0.00 C ATOM 977 O SER A 64 5.375 -11.643 5.913 1.00 0.00 O ATOM 978 CB SER A 64 3.963 -9.676 3.926 1.00 0.00 C ATOM 979 OG SER A 64 3.091 -10.576 3.253 1.00 0.00 O ATOM 0 H SER A 64 5.191 -10.173 1.857 1.00 0.00 H new ATOM 0 HA SER A 64 6.046 -9.585 4.473 1.00 0.00 H new ATOM 0 HB2 SER A 64 3.613 -9.504 4.944 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.966 -8.709 3.423 1.00 0.00 H new ATOM 0 HG SER A 64 2.304 -10.089 2.931 1.00 0.00 H new ATOM 985 N THR A 65 5.312 -12.688 3.922 1.00 0.00 N ATOM 986 CA THR A 65 5.286 -14.016 4.519 1.00 0.00 C ATOM 987 C THR A 65 6.581 -14.287 5.276 1.00 0.00 C ATOM 988 O THR A 65 6.574 -14.914 6.330 1.00 0.00 O ATOM 989 CB THR A 65 5.101 -15.072 3.423 1.00 0.00 C ATOM 990 OG1 THR A 65 6.186 -14.992 2.509 1.00 0.00 O ATOM 991 CG2 THR A 65 3.782 -14.822 2.670 1.00 0.00 C ATOM 0 H THR A 65 5.295 -12.677 2.902 1.00 0.00 H new ATOM 0 HA THR A 65 4.453 -14.067 5.220 1.00 0.00 H new ATOM 0 HB THR A 65 5.071 -16.062 3.878 1.00 0.00 H new ATOM 0 HG1 THR A 65 5.896 -14.527 1.697 1.00 0.00 H new ATOM 0 HG21 THR A 65 3.658 -15.576 1.893 1.00 0.00 H new ATOM 0 HG22 THR A 65 2.947 -14.880 3.369 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.805 -13.832 2.214 1.00 0.00 H new ATOM 999 N ILE A 66 7.686 -13.800 4.733 1.00 0.00 N ATOM 1000 CA ILE A 66 8.987 -13.992 5.363 1.00 0.00 C ATOM 1001 C ILE A 66 9.012 -13.315 6.728 1.00 0.00 C ATOM 1002 O ILE A 66 9.546 -13.861 7.694 1.00 0.00 O ATOM 1003 CB ILE A 66 10.089 -13.402 4.478 1.00 0.00 C ATOM 1004 CG1 ILE A 66 10.165 -14.193 3.172 1.00 0.00 C ATOM 1005 CG2 ILE A 66 11.434 -13.505 5.203 1.00 0.00 C ATOM 1006 CD1 ILE A 66 11.055 -13.446 2.175 1.00 0.00 C ATOM 0 H ILE A 66 7.710 -13.271 3.861 1.00 0.00 H new ATOM 0 HA ILE A 66 9.161 -15.061 5.490 1.00 0.00 H new ATOM 0 HB ILE A 66 9.864 -12.357 4.266 1.00 0.00 H new ATOM 0 HG12 ILE A 66 10.567 -15.189 3.360 1.00 0.00 H new ATOM 0 HG13 ILE A 66 9.166 -14.326 2.756 1.00 0.00 H new ATOM 0 HG21 ILE A 66 12.219 -13.085 4.574 1.00 0.00 H new ATOM 0 HG22 ILE A 66 11.385 -12.951 6.141 1.00 0.00 H new ATOM 0 HG23 ILE A 66 11.656 -14.552 5.411 1.00 0.00 H new ATOM 0 HD11 ILE A 66 11.110 -14.009 1.243 1.00 0.00 H new ATOM 0 HD12 ILE A 66 10.634 -12.460 1.979 1.00 0.00 H new ATOM 0 HD13 ILE A 66 12.056 -13.336 2.592 1.00 0.00 H new ATOM 1018 N LEU A 67 8.446 -12.117 6.794 1.00 0.00 N ATOM 1019 CA LEU A 67 8.421 -11.370 8.044 1.00 0.00 C ATOM 1020 C LEU A 67 7.643 -12.116 9.126 1.00 0.00 C ATOM 1021 O LEU A 67 8.206 -12.493 10.153 1.00 0.00 O ATOM 1022 CB LEU A 67 7.767 -10.003 7.813 1.00 0.00 C ATOM 1023 CG LEU A 67 8.772 -9.054 7.136 1.00 0.00 C ATOM 1024 CD1 LEU A 67 8.034 -7.801 6.645 1.00 0.00 C ATOM 1025 CD2 LEU A 67 9.893 -8.654 8.144 1.00 0.00 C ATOM 0 H LEU A 67 8.002 -11.646 6.006 1.00 0.00 H new ATOM 0 HA LEU A 67 9.450 -11.247 8.381 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.880 -10.114 7.189 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.438 -9.582 8.763 1.00 0.00 H new ATOM 0 HG LEU A 67 9.232 -9.560 6.287 1.00 0.00 H new ATOM 0 HD11 LEU A 67 8.743 -7.126 6.165 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.265 -8.089 5.929 1.00 0.00 H new ATOM 0 HD13 LEU A 67 7.570 -7.297 7.492 1.00 0.00 H new ATOM 0 HD21 LEU A 67 10.599 -7.983 7.655 1.00 0.00 H new ATOM 0 HD22 LEU A 67 9.448 -8.151 9.002 1.00 0.00 H new ATOM 0 HD23 LEU A 67 10.417 -9.549 8.480 1.00 0.00 H new ATOM 1037 N ALA A 68 6.355 -12.328 8.886 1.00 0.00 N ATOM 1038 CA ALA A 68 5.513 -13.016 9.857 1.00 0.00 C ATOM 1039 C ALA A 68 6.184 -14.292 10.339 1.00 0.00 C ATOM 1040 O ALA A 68 6.067 -14.652 11.509 1.00 0.00 O ATOM 1041 CB ALA A 68 4.164 -13.363 9.227 1.00 0.00 C ATOM 0 H ALA A 68 5.874 -12.036 8.035 1.00 0.00 H new ATOM 0 HA ALA A 68 5.360 -12.352 10.708 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.542 -13.877 9.960 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.666 -12.448 8.906 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.321 -14.012 8.366 1.00 0.00 H new ATOM 1047 N VAL A 69 6.885 -14.973 9.442 1.00 0.00 N ATOM 1048 CA VAL A 69 7.555 -16.203 9.818 1.00 0.00 C ATOM 1049 C VAL A 69 8.728 -15.924 10.751 1.00 0.00 C ATOM 1050 O VAL A 69 8.682 -16.254 11.926 1.00 0.00 O ATOM 1051 CB VAL A 69 8.069 -16.914 8.548 1.00 0.00 C ATOM 1052 CG1 VAL A 69 8.921 -18.134 8.940 1.00 0.00 C ATOM 1053 CG2 VAL A 69 6.877 -17.375 7.683 1.00 0.00 C ATOM 0 H VAL A 69 7.002 -14.698 8.467 1.00 0.00 H new ATOM 0 HA VAL A 69 6.841 -16.839 10.342 1.00 0.00 H new ATOM 0 HB VAL A 69 8.680 -16.216 7.976 1.00 0.00 H new ATOM 0 HG11 VAL A 69 9.281 -18.631 8.039 1.00 0.00 H new ATOM 0 HG12 VAL A 69 9.772 -17.807 9.538 1.00 0.00 H new ATOM 0 HG13 VAL A 69 8.315 -18.829 9.521 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.248 -17.876 6.789 1.00 0.00 H new ATOM 0 HG22 VAL A 69 6.258 -18.066 8.255 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.281 -16.509 7.393 1.00 0.00 H new ATOM 1063 N ASP A 70 9.764 -15.292 10.226 1.00 0.00 N ATOM 1064 CA ASP A 70 10.946 -14.985 11.021 1.00 0.00 C ATOM 1065 C ASP A 70 10.609 -14.114 12.225 1.00 0.00 C ATOM 1066 O ASP A 70 11.426 -13.967 13.135 1.00 0.00 O ATOM 1067 CB ASP A 70 11.992 -14.282 10.152 1.00 0.00 C ATOM 1068 CG ASP A 70 12.587 -15.265 9.150 1.00 0.00 C ATOM 1069 OD1 ASP A 70 12.361 -16.454 9.309 1.00 0.00 O ATOM 1070 OD2 ASP A 70 13.256 -14.816 8.233 1.00 0.00 O ATOM 0 H ASP A 70 9.813 -14.981 9.256 1.00 0.00 H new ATOM 0 HA ASP A 70 11.347 -15.928 11.392 1.00 0.00 H new ATOM 0 HB2 ASP A 70 11.535 -13.445 9.624 1.00 0.00 H new ATOM 0 HB3 ASP A 70 12.781 -13.870 10.781 1.00 0.00 H new ATOM 1075 N ASN A 71 9.419 -13.520 12.221 1.00 0.00 N ATOM 1076 CA ASN A 71 9.001 -12.658 13.328 1.00 0.00 C ATOM 1077 C ASN A 71 8.247 -13.425 14.420 1.00 0.00 C ATOM 1078 O ASN A 71 8.533 -13.269 15.601 1.00 0.00 O ATOM 1079 CB ASN A 71 8.099 -11.544 12.796 1.00 0.00 C ATOM 1080 CG ASN A 71 8.897 -10.605 11.897 1.00 0.00 C ATOM 1081 OD1 ASN A 71 8.456 -10.263 10.800 1.00 0.00 O ATOM 1082 ND2 ASN A 71 10.058 -10.166 12.300 1.00 0.00 N ATOM 0 H ASN A 71 8.732 -13.616 11.473 1.00 0.00 H new ATOM 0 HA ASN A 71 9.907 -12.248 13.774 1.00 0.00 H new ATOM 0 HB2 ASN A 71 7.268 -11.975 12.238 1.00 0.00 H new ATOM 0 HB3 ASN A 71 7.669 -10.985 13.628 1.00 0.00 H new ATOM 0 HD21 ASN A 71 10.600 -9.539 11.706 1.00 0.00 H new ATOM 0 HD22 ASN A 71 10.423 -10.450 13.209 1.00 0.00 H new ATOM 1089 N LEU A 72 7.271 -14.237 14.025 1.00 0.00 N ATOM 1090 CA LEU A 72 6.473 -15.005 14.993 1.00 0.00 C ATOM 1091 C LEU A 72 6.917 -16.476 15.079 1.00 0.00 C ATOM 1092 O LEU A 72 6.343 -17.258 15.837 1.00 0.00 O ATOM 1093 CB LEU A 72 5.006 -14.916 14.585 1.00 0.00 C ATOM 1094 CG LEU A 72 4.592 -13.433 14.469 1.00 0.00 C ATOM 1095 CD1 LEU A 72 3.123 -13.357 14.052 1.00 0.00 C ATOM 1096 CD2 LEU A 72 4.784 -12.705 15.823 1.00 0.00 C ATOM 0 H LEU A 72 7.010 -14.384 13.050 1.00 0.00 H new ATOM 0 HA LEU A 72 6.622 -14.577 15.984 1.00 0.00 H new ATOM 0 HB2 LEU A 72 4.851 -15.423 13.633 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.382 -15.422 15.321 1.00 0.00 H new ATOM 0 HG LEU A 72 5.220 -12.946 13.722 1.00 0.00 H new ATOM 0 HD11 LEU A 72 2.822 -12.313 13.968 1.00 0.00 H new ATOM 0 HD12 LEU A 72 2.992 -13.851 13.089 1.00 0.00 H new ATOM 0 HD13 LEU A 72 2.506 -13.853 14.801 1.00 0.00 H new ATOM 0 HD21 LEU A 72 4.487 -11.661 15.720 1.00 0.00 H new ATOM 0 HD22 LEU A 72 4.169 -13.184 16.584 1.00 0.00 H new ATOM 0 HD23 LEU A 72 5.832 -12.756 16.118 1.00 0.00 H new ATOM 1108 N ASN A 73 7.940 -16.843 14.310 1.00 0.00 N ATOM 1109 CA ASN A 73 8.453 -18.223 14.327 1.00 0.00 C ATOM 1110 C ASN A 73 9.368 -18.427 15.529 1.00 0.00 C ATOM 1111 O ASN A 73 10.424 -17.803 15.629 1.00 0.00 O ATOM 1112 CB ASN A 73 9.230 -18.528 13.042 1.00 0.00 C ATOM 1113 CG ASN A 73 9.813 -19.936 13.083 1.00 0.00 C ATOM 1114 OD1 ASN A 73 9.344 -20.790 13.838 1.00 0.00 O ATOM 1115 ND2 ASN A 73 10.820 -20.230 12.308 1.00 0.00 N ATOM 0 H ASN A 73 8.430 -16.216 13.672 1.00 0.00 H new ATOM 0 HA ASN A 73 7.602 -18.901 14.396 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.570 -18.428 12.180 1.00 0.00 H new ATOM 0 HB3 ASN A 73 10.032 -17.801 12.915 1.00 0.00 H new ATOM 0 HD21 ASN A 73 11.221 -21.168 12.326 1.00 0.00 H new ATOM 0 HD22 ASN A 73 11.207 -19.522 11.684 1.00 0.00 H new ATOM 1122 N GLY A 74 8.957 -19.301 16.444 1.00 0.00 N ATOM 1123 CA GLY A 74 9.750 -19.578 17.641 1.00 0.00 C ATOM 1124 C GLY A 74 9.338 -18.662 18.789 1.00 0.00 C ATOM 1125 O GLY A 74 9.765 -18.848 19.929 1.00 0.00 O ATOM 0 H GLY A 74 8.085 -19.827 16.382 1.00 0.00 H new ATOM 0 HA2 GLY A 74 9.619 -20.619 17.936 1.00 0.00 H new ATOM 0 HA3 GLY A 74 10.809 -19.439 17.421 1.00 0.00 H new ATOM 1129 N PHE A 75 8.505 -17.671 18.482 1.00 0.00 N ATOM 1130 CA PHE A 75 8.047 -16.737 19.505 1.00 0.00 C ATOM 1131 C PHE A 75 6.948 -17.380 20.336 1.00 0.00 C ATOM 1132 O PHE A 75 5.884 -17.708 19.822 1.00 0.00 O ATOM 1133 CB PHE A 75 7.515 -15.455 18.844 1.00 0.00 C ATOM 1134 CG PHE A 75 7.125 -14.452 19.908 1.00 0.00 C ATOM 1135 CD1 PHE A 75 8.117 -13.809 20.660 1.00 0.00 C ATOM 1136 CD2 PHE A 75 5.775 -14.165 20.145 1.00 0.00 C ATOM 1137 CE1 PHE A 75 7.759 -12.882 21.645 1.00 0.00 C ATOM 1138 CE2 PHE A 75 5.417 -13.237 21.131 1.00 0.00 C ATOM 1139 CZ PHE A 75 6.408 -12.595 21.880 1.00 0.00 C ATOM 0 H PHE A 75 8.138 -17.496 17.547 1.00 0.00 H new ATOM 0 HA PHE A 75 8.885 -16.483 20.154 1.00 0.00 H new ATOM 0 HB2 PHE A 75 8.277 -15.029 18.191 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.654 -15.688 18.218 1.00 0.00 H new ATOM 0 HD1 PHE A 75 9.159 -14.029 20.479 1.00 0.00 H new ATOM 0 HD2 PHE A 75 5.009 -14.660 19.567 1.00 0.00 H new ATOM 0 HE1 PHE A 75 8.525 -12.387 22.224 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.375 -13.017 21.313 1.00 0.00 H new ATOM 0 HZ PHE A 75 6.132 -11.878 22.639 1.00 0.00 H new ATOM 1149 N LYS A 76 7.214 -17.555 21.626 1.00 0.00 N ATOM 1150 CA LYS A 76 6.235 -18.161 22.513 1.00 0.00 C ATOM 1151 C LYS A 76 5.167 -17.150 22.884 1.00 0.00 C ATOM 1152 O LYS A 76 5.429 -16.200 23.624 1.00 0.00 O ATOM 1153 CB LYS A 76 6.927 -18.664 23.782 1.00 0.00 C ATOM 1154 CG LYS A 76 8.208 -19.435 23.411 1.00 0.00 C ATOM 1155 CD LYS A 76 8.587 -20.424 24.544 1.00 0.00 C ATOM 1156 CE LYS A 76 7.984 -21.806 24.257 1.00 0.00 C ATOM 1157 NZ LYS A 76 6.497 -21.713 24.284 1.00 0.00 N ATOM 0 H LYS A 76 8.090 -17.288 22.075 1.00 0.00 H new ATOM 0 HA LYS A 76 5.767 -19.000 21.998 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.173 -17.823 24.430 1.00 0.00 H new ATOM 0 HB3 LYS A 76 6.252 -19.311 24.342 1.00 0.00 H new ATOM 0 HG2 LYS A 76 8.056 -19.980 22.479 1.00 0.00 H new ATOM 0 HG3 LYS A 76 9.026 -18.735 23.241 1.00 0.00 H new ATOM 0 HD2 LYS A 76 9.671 -20.501 24.624 1.00 0.00 H new ATOM 0 HD3 LYS A 76 8.223 -20.051 25.501 1.00 0.00 H new ATOM 0 HE2 LYS A 76 8.319 -22.166 23.284 1.00 0.00 H new ATOM 0 HE3 LYS A 76 8.328 -22.526 24.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 6.090 -22.669 24.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 6.198 -21.171 25.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 6.163 -21.234 23.423 1.00 0.00 H new ATOM 1171 N ILE A 77 3.952 -17.354 22.365 1.00 0.00 N ATOM 1172 CA ILE A 77 2.841 -16.442 22.648 1.00 0.00 C ATOM 1173 C ILE A 77 1.690 -17.206 23.305 1.00 0.00 C ATOM 1174 O ILE A 77 1.253 -18.242 22.805 1.00 0.00 O ATOM 1175 CB ILE A 77 2.368 -15.775 21.324 1.00 0.00 C ATOM 1176 CG1 ILE A 77 1.685 -14.437 21.621 1.00 0.00 C ATOM 1177 CG2 ILE A 77 1.366 -16.685 20.589 1.00 0.00 C ATOM 1178 CD1 ILE A 77 1.499 -13.650 20.314 1.00 0.00 C ATOM 0 H ILE A 77 3.715 -18.135 21.753 1.00 0.00 H new ATOM 0 HA ILE A 77 3.175 -15.665 23.336 1.00 0.00 H new ATOM 0 HB ILE A 77 3.244 -15.614 20.696 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.718 -14.608 22.095 1.00 0.00 H new ATOM 0 HG13 ILE A 77 2.286 -13.859 22.323 1.00 0.00 H new ATOM 0 HG21 ILE A 77 1.046 -16.203 19.665 1.00 0.00 H new ATOM 0 HG22 ILE A 77 1.843 -17.637 20.355 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.499 -16.861 21.226 1.00 0.00 H new ATOM 0 HD11 ILE A 77 1.013 -12.698 20.528 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.472 -13.466 19.859 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.880 -14.227 19.627 1.00 0.00 H new ATOM 1190 N GLY A 78 1.203 -16.688 24.419 1.00 0.00 N ATOM 1191 CA GLY A 78 0.100 -17.330 25.117 1.00 0.00 C ATOM 1192 C GLY A 78 0.555 -18.635 25.756 1.00 0.00 C ATOM 1193 O GLY A 78 -0.264 -19.469 26.136 1.00 0.00 O ATOM 0 H GLY A 78 1.548 -15.834 24.857 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -0.291 -16.661 25.883 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -0.714 -17.525 24.419 1.00 0.00 H new ATOM 1197 N GLY A 79 1.873 -18.808 25.867 1.00 0.00 N ATOM 1198 CA GLY A 79 2.432 -20.023 26.457 1.00 0.00 C ATOM 1199 C GLY A 79 2.631 -21.110 25.399 1.00 0.00 C ATOM 1200 O GLY A 79 3.118 -22.199 25.707 1.00 0.00 O ATOM 0 H GLY A 79 2.568 -18.128 25.559 1.00 0.00 H new ATOM 0 HA2 GLY A 79 3.386 -19.794 26.931 1.00 0.00 H new ATOM 0 HA3 GLY A 79 1.767 -20.390 27.239 1.00 0.00 H new ATOM 1204 N ARG A 80 2.250 -20.812 24.148 1.00 0.00 N ATOM 1205 CA ARG A 80 2.391 -21.776 23.045 1.00 0.00 C ATOM 1206 C ARG A 80 3.107 -21.137 21.854 1.00 0.00 C ATOM 1207 O ARG A 80 2.989 -19.934 21.615 1.00 0.00 O ATOM 1208 CB ARG A 80 0.999 -22.269 22.608 1.00 0.00 C ATOM 1209 CG ARG A 80 0.294 -22.990 23.778 1.00 0.00 C ATOM 1210 CD ARG A 80 0.716 -24.468 23.826 1.00 0.00 C ATOM 1211 NE ARG A 80 0.091 -25.201 22.732 1.00 0.00 N ATOM 1212 CZ ARG A 80 0.387 -26.476 22.501 1.00 0.00 C ATOM 1213 NH1 ARG A 80 1.251 -27.094 23.260 1.00 0.00 N ATOM 1214 NH2 ARG A 80 -0.187 -27.111 21.516 1.00 0.00 N ATOM 0 H ARG A 80 1.844 -19.917 23.875 1.00 0.00 H new ATOM 0 HA ARG A 80 2.986 -22.619 23.396 1.00 0.00 H new ATOM 0 HB2 ARG A 80 0.395 -21.425 22.275 1.00 0.00 H new ATOM 0 HB3 ARG A 80 1.095 -22.946 21.760 1.00 0.00 H new ATOM 0 HG2 ARG A 80 0.546 -22.502 24.720 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -0.787 -22.917 23.661 1.00 0.00 H new ATOM 0 HD2 ARG A 80 1.801 -24.547 23.755 1.00 0.00 H new ATOM 0 HD3 ARG A 80 0.426 -24.907 24.781 1.00 0.00 H new ATOM 0 HE ARG A 80 -0.585 -24.727 22.133 1.00 0.00 H new ATOM 0 HH11 ARG A 80 1.699 -26.598 24.031 1.00 0.00 H new ATOM 0 HH12 ARG A 80 1.478 -28.072 23.082 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -0.863 -26.629 20.923 1.00 0.00 H new ATOM 0 HH22 ARG A 80 0.040 -28.089 21.339 1.00 0.00 H new ATOM 1228 N ALA A 81 3.857 -21.952 21.112 1.00 0.00 N ATOM 1229 CA ALA A 81 4.598 -21.462 19.946 1.00 0.00 C ATOM 1230 C ALA A 81 3.717 -21.473 18.696 1.00 0.00 C ATOM 1231 O ALA A 81 2.797 -22.284 18.583 1.00 0.00 O ATOM 1232 CB ALA A 81 5.833 -22.333 19.711 1.00 0.00 C ATOM 0 H ALA A 81 3.968 -22.949 21.295 1.00 0.00 H new ATOM 0 HA ALA A 81 4.907 -20.436 20.144 1.00 0.00 H new ATOM 0 HB1 ALA A 81 6.379 -21.963 18.843 1.00 0.00 H new ATOM 0 HB2 ALA A 81 6.478 -22.294 20.589 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.523 -23.363 19.533 1.00 0.00 H new ATOM 1238 N LEU A 82 4.003 -20.563 17.761 1.00 0.00 N ATOM 1239 CA LEU A 82 3.234 -20.470 16.515 1.00 0.00 C ATOM 1240 C LEU A 82 3.890 -21.285 15.423 1.00 0.00 C ATOM 1241 O LEU A 82 5.102 -21.498 15.440 1.00 0.00 O ATOM 1242 CB LEU A 82 3.135 -19.016 16.040 1.00 0.00 C ATOM 1243 CG LEU A 82 2.524 -18.131 17.152 1.00 0.00 C ATOM 1244 CD1 LEU A 82 3.630 -17.610 18.086 1.00 0.00 C ATOM 1245 CD2 LEU A 82 1.787 -16.942 16.522 1.00 0.00 C ATOM 0 H LEU A 82 4.758 -19.882 17.842 1.00 0.00 H new ATOM 0 HA LEU A 82 2.236 -20.857 16.719 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.124 -18.645 15.772 1.00 0.00 H new ATOM 0 HB3 LEU A 82 2.520 -18.960 15.142 1.00 0.00 H new ATOM 0 HG LEU A 82 1.822 -18.731 17.731 1.00 0.00 H new ATOM 0 HD11 LEU A 82 3.186 -16.989 18.864 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.146 -18.453 18.545 1.00 0.00 H new ATOM 0 HD13 LEU A 82 4.343 -17.018 17.511 1.00 0.00 H new ATOM 0 HD21 LEU A 82 1.358 -16.321 17.309 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.488 -16.350 15.934 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.990 -17.309 15.875 1.00 0.00 H new ATOM 1257 N LYS A 83 3.088 -21.731 14.462 1.00 0.00 N ATOM 1258 CA LYS A 83 3.609 -22.515 13.343 1.00 0.00 C ATOM 1259 C LYS A 83 3.263 -21.823 12.039 1.00 0.00 C ATOM 1260 O LYS A 83 2.136 -21.914 11.553 1.00 0.00 O ATOM 1261 CB LYS A 83 3.006 -23.918 13.363 1.00 0.00 C ATOM 1262 CG LYS A 83 3.451 -24.693 12.105 1.00 0.00 C ATOM 1263 CD LYS A 83 3.373 -26.210 12.363 1.00 0.00 C ATOM 1264 CE LYS A 83 4.674 -26.691 13.022 1.00 0.00 C ATOM 1265 NZ LYS A 83 5.776 -26.668 12.018 1.00 0.00 N ATOM 0 H LYS A 83 2.082 -21.566 14.433 1.00 0.00 H new ATOM 0 HA LYS A 83 4.692 -22.597 13.433 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.324 -24.448 14.260 1.00 0.00 H new ATOM 0 HB3 LYS A 83 1.918 -23.856 13.398 1.00 0.00 H new ATOM 0 HG2 LYS A 83 2.815 -24.427 11.260 1.00 0.00 H new ATOM 0 HG3 LYS A 83 4.470 -24.414 11.838 1.00 0.00 H new ATOM 0 HD2 LYS A 83 2.523 -26.436 13.007 1.00 0.00 H new ATOM 0 HD3 LYS A 83 3.212 -26.740 11.424 1.00 0.00 H new ATOM 0 HE2 LYS A 83 4.924 -26.051 13.868 1.00 0.00 H new ATOM 0 HE3 LYS A 83 4.545 -27.700 13.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 6.501 -27.365 12.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 5.395 -26.904 11.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 6.201 -25.719 11.991 1.00 0.00 H new ATOM 1279 N ILE A 84 4.243 -21.120 11.477 1.00 0.00 N ATOM 1280 CA ILE A 84 4.040 -20.392 10.219 1.00 0.00 C ATOM 1281 C ILE A 84 4.631 -21.195 9.057 1.00 0.00 C ATOM 1282 O ILE A 84 5.762 -21.674 9.127 1.00 0.00 O ATOM 1283 CB ILE A 84 4.711 -18.992 10.283 1.00 0.00 C ATOM 1284 CG1 ILE A 84 4.555 -18.378 11.695 1.00 0.00 C ATOM 1285 CG2 ILE A 84 4.048 -18.051 9.256 1.00 0.00 C ATOM 1286 CD1 ILE A 84 3.077 -18.130 12.025 1.00 0.00 C ATOM 0 H ILE A 84 5.182 -21.037 11.867 1.00 0.00 H new ATOM 0 HA ILE A 84 2.970 -20.258 10.063 1.00 0.00 H new ATOM 0 HB ILE A 84 5.771 -19.108 10.057 1.00 0.00 H new ATOM 0 HG12 ILE A 84 4.990 -19.048 12.437 1.00 0.00 H new ATOM 0 HG13 ILE A 84 5.106 -17.439 11.751 1.00 0.00 H new ATOM 0 HG21 ILE A 84 4.521 -17.070 9.303 1.00 0.00 H new ATOM 0 HG22 ILE A 84 4.168 -18.464 8.254 1.00 0.00 H new ATOM 0 HG23 ILE A 84 2.987 -17.954 9.484 1.00 0.00 H new ATOM 0 HD11 ILE A 84 2.994 -17.698 13.022 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.652 -17.441 11.295 1.00 0.00 H new ATOM 0 HD13 ILE A 84 2.533 -19.074 11.992 1.00 0.00 H new ATOM 1298 N ASP A 85 3.853 -21.342 7.991 1.00 0.00 N ATOM 1299 CA ASP A 85 4.308 -22.093 6.816 1.00 0.00 C ATOM 1300 C ASP A 85 3.647 -21.543 5.557 1.00 0.00 C ATOM 1301 O ASP A 85 2.488 -21.130 5.579 1.00 0.00 O ATOM 1302 CB ASP A 85 3.973 -23.583 6.974 1.00 0.00 C ATOM 1303 CG ASP A 85 4.810 -24.418 6.008 1.00 0.00 C ATOM 1304 OD1 ASP A 85 5.598 -23.836 5.281 1.00 0.00 O ATOM 1305 OD2 ASP A 85 4.651 -25.628 6.010 1.00 0.00 O ATOM 0 H ASP A 85 2.912 -20.957 7.911 1.00 0.00 H new ATOM 0 HA ASP A 85 5.389 -21.983 6.728 1.00 0.00 H new ATOM 0 HB2 ASP A 85 4.165 -23.899 7.999 1.00 0.00 H new ATOM 0 HB3 ASP A 85 2.913 -23.747 6.783 1.00 0.00 H new ATOM 1310 N HIS A 86 4.393 -21.535 4.460 1.00 0.00 N ATOM 1311 CA HIS A 86 3.867 -21.027 3.201 1.00 0.00 C ATOM 1312 C HIS A 86 2.958 -22.060 2.543 1.00 0.00 C ATOM 1313 O HIS A 86 3.244 -23.258 2.565 1.00 0.00 O ATOM 1314 CB HIS A 86 5.021 -20.684 2.256 1.00 0.00 C ATOM 1315 CG HIS A 86 5.829 -19.559 2.841 1.00 0.00 C ATOM 1316 ND1 HIS A 86 7.000 -19.106 2.256 1.00 0.00 N ATOM 1317 CD2 HIS A 86 5.653 -18.792 3.967 1.00 0.00 C ATOM 1318 CE1 HIS A 86 7.479 -18.109 3.022 1.00 0.00 C ATOM 1319 NE2 HIS A 86 6.696 -17.878 4.078 1.00 0.00 N ATOM 0 H HIS A 86 5.355 -21.871 4.416 1.00 0.00 H new ATOM 0 HA HIS A 86 3.285 -20.129 3.407 1.00 0.00 H new ATOM 0 HB2 HIS A 86 5.653 -21.559 2.103 1.00 0.00 H new ATOM 0 HB3 HIS A 86 4.632 -20.397 1.279 1.00 0.00 H new ATOM 0 HD1 HIS A 86 7.423 -19.464 1.399 1.00 0.00 H new ATOM 0 HD2 HIS A 86 4.830 -18.884 4.660 1.00 0.00 H new ATOM 0 HE1 HIS A 86 8.386 -17.563 2.809 1.00 0.00 H new ATOM 1328 N THR A 87 1.863 -21.593 1.947 1.00 0.00 N ATOM 1329 CA THR A 87 0.923 -22.493 1.277 1.00 0.00 C ATOM 1330 C THR A 87 0.292 -21.793 0.080 1.00 0.00 C ATOM 1331 O THR A 87 0.017 -20.593 0.124 1.00 0.00 O ATOM 1332 CB THR A 87 -0.176 -22.937 2.260 1.00 0.00 C ATOM 1333 OG1 THR A 87 -0.933 -23.989 1.677 1.00 0.00 O ATOM 1334 CG2 THR A 87 -1.111 -21.761 2.578 1.00 0.00 C ATOM 0 H THR A 87 1.605 -20.607 1.913 1.00 0.00 H new ATOM 0 HA THR A 87 1.466 -23.372 0.930 1.00 0.00 H new ATOM 0 HB THR A 87 0.293 -23.281 3.182 1.00 0.00 H new ATOM 0 HG1 THR A 87 -1.632 -24.274 2.302 1.00 0.00 H new ATOM 0 HG21 THR A 87 -1.883 -22.088 3.274 1.00 0.00 H new ATOM 0 HG22 THR A 87 -0.537 -20.951 3.028 1.00 0.00 H new ATOM 0 HG23 THR A 87 -1.577 -21.408 1.658 1.00 0.00 H new ATOM 1342 N PHE A 88 0.056 -22.551 -0.989 1.00 0.00 N ATOM 1343 CA PHE A 88 -0.548 -21.997 -2.198 1.00 0.00 C ATOM 1344 C PHE A 88 -2.041 -22.268 -2.204 1.00 0.00 C ATOM 1345 O PHE A 88 -2.703 -22.146 -3.235 1.00 0.00 O ATOM 1346 CB PHE A 88 0.088 -22.613 -3.448 1.00 0.00 C ATOM 1347 CG PHE A 88 1.529 -22.168 -3.552 1.00 0.00 C ATOM 1348 CD1 PHE A 88 1.828 -20.836 -3.867 1.00 0.00 C ATOM 1349 CD2 PHE A 88 2.569 -23.084 -3.334 1.00 0.00 C ATOM 1350 CE1 PHE A 88 3.162 -20.422 -3.964 1.00 0.00 C ATOM 1351 CE2 PHE A 88 3.901 -22.669 -3.431 1.00 0.00 C ATOM 1352 CZ PHE A 88 4.198 -21.338 -3.746 1.00 0.00 C ATOM 0 H PHE A 88 0.273 -23.546 -1.042 1.00 0.00 H new ATOM 0 HA PHE A 88 -0.374 -20.921 -2.207 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.035 -23.701 -3.398 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -0.463 -22.308 -4.337 1.00 0.00 H new ATOM 0 HD1 PHE A 88 1.029 -20.129 -4.035 1.00 0.00 H new ATOM 0 HD2 PHE A 88 2.341 -24.111 -3.091 1.00 0.00 H new ATOM 0 HE1 PHE A 88 3.392 -19.395 -4.207 1.00 0.00 H new ATOM 0 HE2 PHE A 88 4.700 -23.375 -3.263 1.00 0.00 H new ATOM 0 HZ PHE A 88 5.227 -21.018 -3.821 1.00 0.00 H new ATOM 1362 N TYR A 89 -2.570 -22.631 -1.041 1.00 0.00 N ATOM 1363 CA TYR A 89 -3.990 -22.912 -0.923 1.00 0.00 C ATOM 1364 C TYR A 89 -4.801 -21.774 -1.542 1.00 0.00 C ATOM 1365 O TYR A 89 -4.580 -20.601 -1.242 1.00 0.00 O ATOM 1366 CB TYR A 89 -4.365 -23.087 0.560 1.00 0.00 C ATOM 1367 CG TYR A 89 -5.870 -23.077 0.718 1.00 0.00 C ATOM 1368 CD1 TYR A 89 -6.632 -24.168 0.284 1.00 0.00 C ATOM 1369 CD2 TYR A 89 -6.503 -21.962 1.279 1.00 0.00 C ATOM 1370 CE1 TYR A 89 -8.026 -24.146 0.415 1.00 0.00 C ATOM 1371 CE2 TYR A 89 -7.896 -21.936 1.409 1.00 0.00 C ATOM 1372 CZ TYR A 89 -8.658 -23.029 0.977 1.00 0.00 C ATOM 1373 OH TYR A 89 -10.032 -23.005 1.103 1.00 0.00 O ATOM 0 H TYR A 89 -2.040 -22.736 -0.176 1.00 0.00 H new ATOM 0 HA TYR A 89 -4.218 -23.835 -1.457 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -3.958 -24.025 0.938 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -3.924 -22.285 1.152 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -6.144 -25.027 -0.152 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -5.915 -21.120 1.612 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -8.613 -24.989 0.083 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -8.383 -21.075 1.842 1.00 0.00 H new ATOM 0 HH TYR A 89 -10.308 -22.159 1.513 1.00 0.00 H new ATOM 2031 N PHE B 311 13.028 -5.430 6.154 1.00 0.00 N ATOM 2032 CA PHE B 311 11.872 -4.783 5.563 1.00 0.00 C ATOM 2033 C PHE B 311 11.511 -3.534 6.353 1.00 0.00 C ATOM 2034 O PHE B 311 12.274 -3.081 7.206 1.00 0.00 O ATOM 2035 CB PHE B 311 10.686 -5.747 5.564 1.00 0.00 C ATOM 2036 CG PHE B 311 11.116 -7.100 5.025 1.00 0.00 C ATOM 2037 CD1 PHE B 311 11.824 -7.992 5.846 1.00 0.00 C ATOM 2038 CD2 PHE B 311 10.820 -7.462 3.702 1.00 0.00 C ATOM 2039 CE1 PHE B 311 12.221 -9.237 5.354 1.00 0.00 C ATOM 2040 CE2 PHE B 311 11.220 -8.711 3.211 1.00 0.00 C ATOM 2041 CZ PHE B 311 11.921 -9.598 4.038 1.00 0.00 C ATOM 0 HA PHE B 311 12.111 -4.500 4.538 1.00 0.00 H new ATOM 0 HB2 PHE B 311 10.297 -5.857 6.576 1.00 0.00 H new ATOM 0 HB3 PHE B 311 9.878 -5.343 4.954 1.00 0.00 H new ATOM 0 HD1 PHE B 311 12.063 -7.714 6.862 1.00 0.00 H new ATOM 0 HD2 PHE B 311 10.283 -6.777 3.062 1.00 0.00 H new ATOM 0 HE1 PHE B 311 12.761 -9.922 5.991 1.00 0.00 H new ATOM 0 HE2 PHE B 311 10.988 -8.991 2.194 1.00 0.00 H new ATOM 0 HZ PHE B 311 12.230 -10.561 3.658 1.00 0.00 H new ATOM 2051 N ALA B 312 10.344 -2.980 6.060 1.00 0.00 N ATOM 2052 CA ALA B 312 9.885 -1.778 6.748 1.00 0.00 C ATOM 2053 C ALA B 312 8.377 -1.618 6.594 1.00 0.00 C ATOM 2054 O ALA B 312 7.889 -0.534 6.274 1.00 0.00 O ATOM 2055 CB ALA B 312 10.595 -0.550 6.178 1.00 0.00 C ATOM 0 H ALA B 312 9.700 -3.339 5.356 1.00 0.00 H new ATOM 0 HA ALA B 312 10.121 -1.873 7.808 1.00 0.00 H new ATOM 0 HB1 ALA B 312 10.248 0.344 6.696 1.00 0.00 H new ATOM 0 HB2 ALA B 312 11.671 -0.655 6.317 1.00 0.00 H new ATOM 0 HB3 ALA B 312 10.373 -0.462 5.114 1.00 0.00 H new ATOM 2061 N ILE B 313 7.643 -2.705 6.821 1.00 0.00 N ATOM 2062 CA ILE B 313 6.190 -2.672 6.693 1.00 0.00 C ATOM 2063 C ILE B 313 5.589 -1.714 7.721 1.00 0.00 C ATOM 2064 O ILE B 313 5.888 -1.796 8.913 1.00 0.00 O ATOM 2065 CB ILE B 313 5.617 -4.073 6.910 1.00 0.00 C ATOM 2066 CG1 ILE B 313 6.400 -5.087 6.050 1.00 0.00 C ATOM 2067 CG2 ILE B 313 4.140 -4.089 6.506 1.00 0.00 C ATOM 2068 CD1 ILE B 313 6.376 -4.684 4.568 1.00 0.00 C ATOM 0 H ILE B 313 8.027 -3.611 7.092 1.00 0.00 H new ATOM 0 HA ILE B 313 5.937 -2.326 5.691 1.00 0.00 H new ATOM 0 HB ILE B 313 5.707 -4.345 7.962 1.00 0.00 H new ATOM 0 HG12 ILE B 313 7.431 -5.145 6.398 1.00 0.00 H new ATOM 0 HG13 ILE B 313 5.967 -6.080 6.168 1.00 0.00 H new ATOM 0 HG21 ILE B 313 3.731 -5.088 6.661 1.00 0.00 H new ATOM 0 HG22 ILE B 313 3.588 -3.373 7.115 1.00 0.00 H new ATOM 0 HG23 ILE B 313 4.048 -3.818 5.454 1.00 0.00 H new ATOM 0 HD11 ILE B 313 6.935 -5.415 3.983 1.00 0.00 H new ATOM 0 HD12 ILE B 313 5.345 -4.650 4.217 1.00 0.00 H new ATOM 0 HD13 ILE B 313 6.832 -3.701 4.451 1.00 0.00 H new ATOM 2080 N MET B 314 4.744 -0.801 7.250 1.00 0.00 N ATOM 2081 CA MET B 314 4.107 0.176 8.136 1.00 0.00 C ATOM 2082 C MET B 314 2.940 -0.449 8.917 1.00 0.00 C ATOM 2083 O MET B 314 2.285 -1.366 8.423 1.00 0.00 O ATOM 2084 CB MET B 314 3.604 1.370 7.314 1.00 0.00 C ATOM 2085 CG MET B 314 4.794 2.199 6.829 1.00 0.00 C ATOM 2086 SD MET B 314 5.740 1.246 5.617 1.00 0.00 S ATOM 2087 CE MET B 314 7.161 2.359 5.525 1.00 0.00 C ATOM 0 H MET B 314 4.484 -0.715 6.267 1.00 0.00 H new ATOM 0 HA MET B 314 4.851 0.513 8.858 1.00 0.00 H new ATOM 0 HB2 MET B 314 3.022 1.018 6.462 1.00 0.00 H new ATOM 0 HB3 MET B 314 2.941 1.988 7.920 1.00 0.00 H new ATOM 0 HG2 MET B 314 4.444 3.130 6.383 1.00 0.00 H new ATOM 0 HG3 MET B 314 5.430 2.469 7.672 1.00 0.00 H new ATOM 0 HE1 MET B 314 7.890 1.961 4.819 1.00 0.00 H new ATOM 0 HE2 MET B 314 6.832 3.343 5.190 1.00 0.00 H new ATOM 0 HE3 MET B 314 7.620 2.446 6.510 1.00 0.00 H new ATOM 2097 N PRO B 315 2.661 0.041 10.114 1.00 0.00 N ATOM 2098 CA PRO B 315 1.537 -0.479 10.963 1.00 0.00 C ATOM 2099 C PRO B 315 0.166 -0.163 10.355 1.00 0.00 C ATOM 2100 O PRO B 315 0.039 0.732 9.520 1.00 0.00 O ATOM 2101 CB PRO B 315 1.726 0.249 12.313 1.00 0.00 C ATOM 2102 CG PRO B 315 2.496 1.489 11.985 1.00 0.00 C ATOM 2103 CD PRO B 315 3.390 1.134 10.800 1.00 0.00 C ATOM 0 HA PRO B 315 1.562 -1.565 11.057 1.00 0.00 H new ATOM 0 HB2 PRO B 315 0.765 0.491 12.768 1.00 0.00 H new ATOM 0 HB3 PRO B 315 2.268 -0.374 13.024 1.00 0.00 H new ATOM 0 HG2 PRO B 315 1.824 2.309 11.734 1.00 0.00 H new ATOM 0 HG3 PRO B 315 3.091 1.815 12.838 1.00 0.00 H new ATOM 0 HD2 PRO B 315 3.538 1.990 10.141 1.00 0.00 H new ATOM 0 HD3 PRO B 315 4.378 0.810 11.128 1.00 0.00 H new ATOM 2111 N GLY B 316 -0.856 -0.910 10.784 1.00 0.00 N ATOM 2112 CA GLY B 316 -2.223 -0.711 10.282 1.00 0.00 C ATOM 2113 C GLY B 316 -3.181 -0.377 11.424 1.00 0.00 C ATOM 2114 O GLY B 316 -2.841 -0.524 12.597 1.00 0.00 O ATOM 0 H GLY B 316 -0.766 -1.655 11.475 1.00 0.00 H new ATOM 0 HA2 GLY B 316 -2.231 0.095 9.548 1.00 0.00 H new ATOM 0 HA3 GLY B 316 -2.561 -1.612 9.770 1.00 0.00 H new ATOM 2118 N SER B 317 -4.378 0.072 11.071 1.00 0.00 N ATOM 2119 CA SER B 317 -5.378 0.423 12.077 1.00 0.00 C ATOM 2120 C SER B 317 -5.782 -0.804 12.893 1.00 0.00 C ATOM 2121 O SER B 317 -6.133 -0.696 14.071 1.00 0.00 O ATOM 2122 CB SER B 317 -6.609 1.019 11.394 1.00 0.00 C ATOM 2123 OG SER B 317 -7.188 0.045 10.537 1.00 0.00 O ATOM 0 H SER B 317 -4.681 0.202 10.106 1.00 0.00 H new ATOM 0 HA SER B 317 -4.944 1.159 12.754 1.00 0.00 H new ATOM 0 HB2 SER B 317 -7.334 1.340 12.142 1.00 0.00 H new ATOM 0 HB3 SER B 317 -6.329 1.903 10.822 1.00 0.00 H new ATOM 0 HG SER B 317 -7.979 0.423 10.099 1.00 0.00 H new ATOM 2129 N ARG B 318 -5.723 -1.971 12.263 1.00 0.00 N ATOM 2130 CA ARG B 318 -6.084 -3.213 12.936 1.00 0.00 C ATOM 2131 C ARG B 318 -5.066 -3.549 14.016 1.00 0.00 C ATOM 2132 O ARG B 318 -5.322 -4.383 14.885 1.00 0.00 O ATOM 2133 CB ARG B 318 -6.164 -4.363 11.912 1.00 0.00 C ATOM 2134 CG ARG B 318 -7.397 -4.202 10.998 1.00 0.00 C ATOM 2135 CD ARG B 318 -8.663 -4.712 11.709 1.00 0.00 C ATOM 2136 NE ARG B 318 -9.810 -4.665 10.805 1.00 0.00 N ATOM 2137 CZ ARG B 318 -10.523 -3.552 10.649 1.00 0.00 C ATOM 2138 NH1 ARG B 318 -10.195 -2.471 11.304 1.00 0.00 N ATOM 2139 NH2 ARG B 318 -11.548 -3.541 9.842 1.00 0.00 N ATOM 0 H ARG B 318 -5.430 -2.084 11.292 1.00 0.00 H new ATOM 0 HA ARG B 318 -7.059 -3.084 13.405 1.00 0.00 H new ATOM 0 HB2 ARG B 318 -5.258 -4.380 11.307 1.00 0.00 H new ATOM 0 HB3 ARG B 318 -6.216 -5.318 12.435 1.00 0.00 H new ATOM 0 HG2 ARG B 318 -7.522 -3.154 10.727 1.00 0.00 H new ATOM 0 HG3 ARG B 318 -7.245 -4.755 10.071 1.00 0.00 H new ATOM 0 HD2 ARG B 318 -8.507 -5.734 12.055 1.00 0.00 H new ATOM 0 HD3 ARG B 318 -8.862 -4.104 12.591 1.00 0.00 H new ATOM 0 HE ARG B 318 -10.069 -5.502 10.283 1.00 0.00 H new ATOM 0 HH11 ARG B 318 -9.393 -2.480 11.934 1.00 0.00 H new ATOM 0 HH12 ARG B 318 -10.741 -1.617 11.185 1.00 0.00 H new ATOM 0 HH21 ARG B 318 -11.803 -4.386 9.330 1.00 0.00 H new ATOM 0 HH22 ARG B 318 -12.094 -2.688 9.723 1.00 0.00 H new ATOM 2153 N TRP B 319 -3.910 -2.895 13.955 1.00 0.00 N ATOM 2154 CA TRP B 319 -2.856 -3.135 14.926 1.00 0.00 C ATOM 2155 C TRP B 319 -3.318 -2.793 16.341 1.00 0.00 C ATOM 2156 O TRP B 319 -2.799 -3.310 17.325 1.00 0.00 O ATOM 2157 CB TRP B 319 -1.610 -2.308 14.584 1.00 0.00 C ATOM 2158 CG TRP B 319 -0.496 -2.657 15.522 1.00 0.00 C ATOM 2159 CD1 TRP B 319 -0.247 -3.889 16.018 1.00 0.00 C ATOM 2160 CD2 TRP B 319 0.520 -1.785 16.084 1.00 0.00 C ATOM 2161 NE1 TRP B 319 0.845 -3.830 16.848 1.00 0.00 N ATOM 2162 CE2 TRP B 319 1.352 -2.559 16.923 1.00 0.00 C ATOM 2163 CE3 TRP B 319 0.798 -0.417 15.952 1.00 0.00 C ATOM 2164 CZ2 TRP B 319 2.419 -2.005 17.602 1.00 0.00 C ATOM 2165 CZ3 TRP B 319 1.880 0.155 16.638 1.00 0.00 C ATOM 2166 CH2 TRP B 319 2.691 -0.637 17.466 1.00 0.00 C ATOM 0 H TRP B 319 -3.683 -2.198 13.245 1.00 0.00 H new ATOM 0 HA TRP B 319 -2.609 -4.196 14.886 1.00 0.00 H new ATOM 0 HB2 TRP B 319 -1.305 -2.501 13.555 1.00 0.00 H new ATOM 0 HB3 TRP B 319 -1.838 -1.244 14.655 1.00 0.00 H new ATOM 0 HD1 TRP B 319 -0.817 -4.779 15.797 1.00 0.00 H new ATOM 0 HE1 TRP B 319 1.231 -4.632 17.347 1.00 0.00 H new ATOM 0 HE3 TRP B 319 0.176 0.199 15.319 1.00 0.00 H new ATOM 0 HZ2 TRP B 319 3.040 -2.622 18.234 1.00 0.00 H new ATOM 0 HZ3 TRP B 319 2.090 1.209 16.529 1.00 0.00 H new ATOM 0 HH2 TRP B 319 3.521 -0.194 17.996 1.00 0.00 H new ATOM 2177 N ASP B 320 -4.281 -1.905 16.428 1.00 0.00 N ATOM 2178 CA ASP B 320 -4.816 -1.482 17.723 1.00 0.00 C ATOM 2179 C ASP B 320 -3.701 -0.937 18.622 1.00 0.00 C ATOM 2180 O ASP B 320 -3.943 -0.573 19.773 1.00 0.00 O ATOM 2181 CB ASP B 320 -5.511 -2.677 18.408 1.00 0.00 C ATOM 2182 CG ASP B 320 -6.934 -2.842 17.879 1.00 0.00 C ATOM 2183 OD1 ASP B 320 -7.090 -3.448 16.831 1.00 0.00 O ATOM 2184 OD2 ASP B 320 -7.847 -2.354 18.525 1.00 0.00 O ATOM 0 H ASP B 320 -4.717 -1.455 15.623 1.00 0.00 H new ATOM 0 HA ASP B 320 -5.540 -0.684 17.559 1.00 0.00 H new ATOM 0 HB2 ASP B 320 -4.942 -3.589 18.228 1.00 0.00 H new ATOM 0 HB3 ASP B 320 -5.533 -2.523 19.487 1.00 0.00 H new ATOM 2189 N GLY B 321 -2.486 -0.879 18.089 1.00 0.00 N ATOM 2190 CA GLY B 321 -1.349 -0.372 18.854 1.00 0.00 C ATOM 2191 C GLY B 321 -0.924 -1.357 19.940 1.00 0.00 C ATOM 2192 O GLY B 321 -0.238 -0.983 20.893 1.00 0.00 O ATOM 0 H GLY B 321 -2.262 -1.174 17.139 1.00 0.00 H new ATOM 0 HA2 GLY B 321 -0.511 -0.185 18.182 1.00 0.00 H new ATOM 0 HA3 GLY B 321 -1.612 0.583 19.309 1.00 0.00 H new ATOM 2196 N VAL B 322 -1.330 -2.613 19.789 1.00 0.00 N ATOM 2197 CA VAL B 322 -0.983 -3.647 20.762 1.00 0.00 C ATOM 2198 C VAL B 322 0.509 -3.968 20.693 1.00 0.00 C ATOM 2199 O VAL B 322 1.112 -3.936 19.621 1.00 0.00 O ATOM 2200 CB VAL B 322 -1.794 -4.916 20.498 1.00 0.00 C ATOM 2201 CG1 VAL B 322 -1.310 -6.042 21.419 1.00 0.00 C ATOM 2202 CG2 VAL B 322 -3.275 -4.637 20.772 1.00 0.00 C ATOM 0 H VAL B 322 -1.897 -2.940 19.007 1.00 0.00 H new ATOM 0 HA VAL B 322 -1.218 -3.272 21.758 1.00 0.00 H new ATOM 0 HB VAL B 322 -1.662 -5.219 19.459 1.00 0.00 H new ATOM 0 HG11 VAL B 322 -1.891 -6.944 21.227 1.00 0.00 H new ATOM 0 HG12 VAL B 322 -0.256 -6.242 21.227 1.00 0.00 H new ATOM 0 HG13 VAL B 322 -1.439 -5.742 22.459 1.00 0.00 H new ATOM 0 HG21 VAL B 322 -3.856 -5.540 20.585 1.00 0.00 H new ATOM 0 HG22 VAL B 322 -3.402 -4.333 21.811 1.00 0.00 H new ATOM 0 HG23 VAL B 322 -3.622 -3.839 20.116 1.00 0.00 H new ATOM 2212 N HIS B 323 1.097 -4.271 21.843 1.00 0.00 N ATOM 2213 CA HIS B 323 2.517 -4.593 21.898 1.00 0.00 C ATOM 2214 C HIS B 323 2.803 -5.937 21.225 1.00 0.00 C ATOM 2215 O HIS B 323 2.070 -6.908 21.411 1.00 0.00 O ATOM 2216 CB HIS B 323 2.975 -4.649 23.357 1.00 0.00 C ATOM 2217 CG HIS B 323 2.056 -5.553 24.132 1.00 0.00 C ATOM 2218 ND1 HIS B 323 2.187 -6.933 24.119 1.00 0.00 N ATOM 2219 CD2 HIS B 323 0.986 -5.285 24.950 1.00 0.00 C ATOM 2220 CE1 HIS B 323 1.218 -7.439 24.905 1.00 0.00 C ATOM 2221 NE2 HIS B 323 0.458 -6.478 25.436 1.00 0.00 N ATOM 0 H HIS B 323 0.618 -4.301 22.743 1.00 0.00 H new ATOM 0 HA HIS B 323 3.064 -3.815 21.365 1.00 0.00 H new ATOM 0 HB2 HIS B 323 3.999 -5.017 23.415 1.00 0.00 H new ATOM 0 HB3 HIS B 323 2.971 -3.649 23.790 1.00 0.00 H new ATOM 0 HD2 HIS B 323 0.611 -4.299 25.181 1.00 0.00 H new ATOM 0 HE1 HIS B 323 1.073 -8.494 25.084 1.00 0.00 H new ATOM 0 HE2 HIS B 323 -0.338 -6.593 26.063 1.00 0.00 H new ATOM 2230 N ARG B 324 3.879 -5.985 20.439 1.00 0.00 N ATOM 2231 CA ARG B 324 4.272 -7.210 19.729 1.00 0.00 C ATOM 2232 C ARG B 324 5.787 -7.388 19.801 1.00 0.00 C ATOM 2233 O ARG B 324 6.540 -6.417 19.796 1.00 0.00 O ATOM 2234 CB ARG B 324 3.801 -7.153 18.255 1.00 0.00 C ATOM 2235 CG ARG B 324 3.811 -5.697 17.738 1.00 0.00 C ATOM 2236 CD ARG B 324 5.247 -5.143 17.722 1.00 0.00 C ATOM 2237 NE ARG B 324 5.395 -4.136 16.677 1.00 0.00 N ATOM 2238 CZ ARG B 324 6.583 -3.613 16.395 1.00 0.00 C ATOM 2239 NH1 ARG B 324 7.638 -3.999 17.060 1.00 0.00 N ATOM 2240 NH2 ARG B 324 6.697 -2.716 15.454 1.00 0.00 N ATOM 0 H ARG B 324 4.497 -5.190 20.276 1.00 0.00 H new ATOM 0 HA ARG B 324 3.795 -8.065 20.207 1.00 0.00 H new ATOM 0 HB2 ARG B 324 4.452 -7.769 17.635 1.00 0.00 H new ATOM 0 HB3 ARG B 324 2.796 -7.567 18.172 1.00 0.00 H new ATOM 0 HG2 ARG B 324 3.388 -5.658 16.734 1.00 0.00 H new ATOM 0 HG3 ARG B 324 3.181 -5.074 18.374 1.00 0.00 H new ATOM 0 HD2 ARG B 324 5.485 -4.707 18.692 1.00 0.00 H new ATOM 0 HD3 ARG B 324 5.955 -5.955 17.555 1.00 0.00 H new ATOM 0 HE ARG B 324 4.574 -3.829 16.155 1.00 0.00 H new ATOM 0 HH11 ARG B 324 7.549 -4.701 17.795 1.00 0.00 H new ATOM 0 HH12 ARG B 324 8.551 -3.599 16.845 1.00 0.00 H new ATOM 0 HH21 ARG B 324 5.873 -2.415 14.934 1.00 0.00 H new ATOM 0 HH22 ARG B 324 7.610 -2.316 15.239 1.00 0.00 H new ATOM 2254 N SER B 325 6.234 -8.641 19.868 1.00 0.00 N ATOM 2255 CA SER B 325 7.668 -8.933 19.936 1.00 0.00 C ATOM 2256 C SER B 325 8.020 -10.065 18.991 1.00 0.00 C ATOM 2257 O SER B 325 7.266 -11.028 18.853 1.00 0.00 O ATOM 2258 CB SER B 325 8.062 -9.319 21.361 1.00 0.00 C ATOM 2259 OG SER B 325 7.764 -8.240 22.239 1.00 0.00 O ATOM 0 H SER B 325 5.632 -9.464 19.877 1.00 0.00 H new ATOM 0 HA SER B 325 8.215 -8.037 19.642 1.00 0.00 H new ATOM 0 HB2 SER B 325 7.522 -10.214 21.670 1.00 0.00 H new ATOM 0 HB3 SER B 325 9.125 -9.556 21.405 1.00 0.00 H new ATOM 0 HG SER B 325 8.014 -8.485 23.154 1.00 0.00 H new ATOM 2286 N PHE B 328 14.216 -11.736 21.330 1.00 0.00 N ATOM 2287 CA PHE B 328 15.107 -10.970 22.196 1.00 0.00 C ATOM 2288 C PHE B 328 15.974 -10.028 21.356 1.00 0.00 C ATOM 2289 O PHE B 328 16.483 -9.036 21.860 1.00 0.00 O ATOM 2290 CB PHE B 328 16.001 -11.927 23.049 1.00 0.00 C ATOM 2291 CG PHE B 328 15.792 -13.364 22.615 1.00 0.00 C ATOM 2292 CD1 PHE B 328 16.418 -13.845 21.457 1.00 0.00 C ATOM 2293 CD2 PHE B 328 14.963 -14.208 23.364 1.00 0.00 C ATOM 2294 CE1 PHE B 328 16.211 -15.170 21.049 1.00 0.00 C ATOM 2295 CE2 PHE B 328 14.760 -15.532 22.958 1.00 0.00 C ATOM 2296 CZ PHE B 328 15.384 -16.012 21.800 1.00 0.00 C ATOM 0 HA PHE B 328 14.503 -10.372 22.879 1.00 0.00 H new ATOM 0 HB2 PHE B 328 17.050 -11.654 22.935 1.00 0.00 H new ATOM 0 HB3 PHE B 328 15.756 -11.819 24.106 1.00 0.00 H new ATOM 0 HD1 PHE B 328 17.059 -13.195 20.880 1.00 0.00 H new ATOM 0 HD2 PHE B 328 14.480 -13.837 24.256 1.00 0.00 H new ATOM 0 HE1 PHE B 328 16.690 -15.541 20.155 1.00 0.00 H new ATOM 0 HE2 PHE B 328 14.122 -16.183 23.538 1.00 0.00 H new ATOM 0 HZ PHE B 328 15.227 -17.033 21.486 1.00 0.00 H new ATOM 2306 N GLU B 329 16.137 -10.357 20.078 1.00 0.00 N ATOM 2307 CA GLU B 329 16.960 -9.549 19.177 1.00 0.00 C ATOM 2308 C GLU B 329 16.492 -8.096 19.173 1.00 0.00 C ATOM 2309 O GLU B 329 17.243 -7.192 18.805 1.00 0.00 O ATOM 2310 CB GLU B 329 16.879 -10.106 17.750 1.00 0.00 C ATOM 2311 CG GLU B 329 17.440 -11.533 17.715 1.00 0.00 C ATOM 2312 CD GLU B 329 18.908 -11.544 18.133 1.00 0.00 C ATOM 2313 OE1 GLU B 329 19.644 -10.694 17.660 1.00 0.00 O ATOM 2314 OE2 GLU B 329 19.272 -12.396 18.927 1.00 0.00 O ATOM 0 H GLU B 329 15.712 -11.175 19.641 1.00 0.00 H new ATOM 0 HA GLU B 329 17.990 -9.590 19.531 1.00 0.00 H new ATOM 0 HB2 GLU B 329 15.844 -10.104 17.408 1.00 0.00 H new ATOM 0 HB3 GLU B 329 17.441 -9.468 17.069 1.00 0.00 H new ATOM 0 HG2 GLU B 329 16.862 -12.173 18.381 1.00 0.00 H new ATOM 0 HG3 GLU B 329 17.339 -11.945 16.711 1.00 0.00 H new ATOM 2321 N GLU B 330 15.250 -7.876 19.578 1.00 0.00 N ATOM 2322 CA GLU B 330 14.699 -6.528 19.618 1.00 0.00 C ATOM 2323 C GLU B 330 15.548 -5.623 20.514 1.00 0.00 C ATOM 2324 O GLU B 330 15.479 -4.400 20.412 1.00 0.00 O ATOM 2325 CB GLU B 330 13.257 -6.575 20.138 1.00 0.00 C ATOM 2326 CG GLU B 330 13.256 -6.975 21.618 1.00 0.00 C ATOM 2327 CD GLU B 330 11.831 -7.270 22.078 1.00 0.00 C ATOM 2328 OE1 GLU B 330 10.937 -7.217 21.250 1.00 0.00 O ATOM 2329 OE2 GLU B 330 11.657 -7.544 23.254 1.00 0.00 O ATOM 0 H GLU B 330 14.608 -8.608 19.882 1.00 0.00 H new ATOM 0 HA GLU B 330 14.707 -6.118 18.608 1.00 0.00 H new ATOM 0 HB2 GLU B 330 12.783 -5.601 20.014 1.00 0.00 H new ATOM 0 HB3 GLU B 330 12.674 -7.290 19.557 1.00 0.00 H new ATOM 0 HG2 GLU B 330 13.884 -7.854 21.766 1.00 0.00 H new ATOM 0 HG3 GLU B 330 13.683 -6.173 22.220 1.00 0.00 H new ATOM 2336 N LYS B 331 16.337 -6.234 21.394 1.00 0.00 N ATOM 2337 CA LYS B 331 17.188 -5.466 22.309 1.00 0.00 C ATOM 2338 C LYS B 331 18.175 -4.579 21.540 1.00 0.00 C ATOM 2339 O LYS B 331 18.148 -3.353 21.667 1.00 0.00 O ATOM 2340 CB LYS B 331 17.969 -6.424 23.231 1.00 0.00 C ATOM 2341 CG LYS B 331 18.805 -7.412 22.391 1.00 0.00 C ATOM 2342 CD LYS B 331 19.053 -8.710 23.174 1.00 0.00 C ATOM 2343 CE LYS B 331 19.941 -8.412 24.385 1.00 0.00 C ATOM 2344 NZ LYS B 331 19.145 -7.695 25.420 1.00 0.00 N ATOM 0 H LYS B 331 16.407 -7.246 21.496 1.00 0.00 H new ATOM 0 HA LYS B 331 16.542 -4.823 22.907 1.00 0.00 H new ATOM 0 HB2 LYS B 331 18.623 -5.853 23.890 1.00 0.00 H new ATOM 0 HB3 LYS B 331 17.275 -6.973 23.867 1.00 0.00 H new ATOM 0 HG2 LYS B 331 18.285 -7.636 21.459 1.00 0.00 H new ATOM 0 HG3 LYS B 331 19.757 -6.955 22.123 1.00 0.00 H new ATOM 0 HD2 LYS B 331 18.105 -9.137 23.501 1.00 0.00 H new ATOM 0 HD3 LYS B 331 19.531 -9.449 22.532 1.00 0.00 H new ATOM 0 HE2 LYS B 331 20.339 -9.340 24.795 1.00 0.00 H new ATOM 0 HE3 LYS B 331 20.795 -7.806 24.083 1.00 0.00 H new ATOM 0 HZ1 LYS B 331 19.435 -8.016 26.366 1.00 0.00 H new ATOM 0 HZ2 LYS B 331 19.309 -6.671 25.337 1.00 0.00 H new ATOM 0 HZ3 LYS B 331 18.134 -7.896 25.281 1.00 0.00 H new ATOM 2358 N TRP B 332 19.047 -5.204 20.746 1.00 0.00 N ATOM 2359 CA TRP B 332 20.037 -4.463 19.966 1.00 0.00 C ATOM 2360 C TRP B 332 19.380 -3.743 18.804 1.00 0.00 C ATOM 2361 O TRP B 332 19.899 -2.750 18.299 1.00 0.00 O ATOM 2362 CB TRP B 332 21.126 -5.414 19.446 1.00 0.00 C ATOM 2363 CG TRP B 332 20.531 -6.413 18.492 1.00 0.00 C ATOM 2364 CD1 TRP B 332 19.974 -7.588 18.854 1.00 0.00 C ATOM 2365 CD2 TRP B 332 20.449 -6.358 17.032 1.00 0.00 C ATOM 2366 NE1 TRP B 332 19.534 -8.248 17.721 1.00 0.00 N ATOM 2367 CE2 TRP B 332 19.808 -7.532 16.573 1.00 0.00 C ATOM 2368 CE3 TRP B 332 20.853 -5.411 16.069 1.00 0.00 C ATOM 2369 CZ2 TRP B 332 19.571 -7.758 15.213 1.00 0.00 C ATOM 2370 CZ3 TRP B 332 20.626 -5.639 14.704 1.00 0.00 C ATOM 2371 CH2 TRP B 332 19.988 -6.811 14.275 1.00 0.00 C ATOM 0 H TRP B 332 19.087 -6.216 20.627 1.00 0.00 H new ATOM 0 HA TRP B 332 20.496 -3.720 20.618 1.00 0.00 H new ATOM 0 HB2 TRP B 332 21.908 -4.844 18.945 1.00 0.00 H new ATOM 0 HB3 TRP B 332 21.595 -5.933 20.282 1.00 0.00 H new ATOM 0 HD1 TRP B 332 19.886 -7.954 19.866 1.00 0.00 H new ATOM 0 HE1 TRP B 332 19.064 -9.153 17.732 1.00 0.00 H new ATOM 0 HE3 TRP B 332 21.342 -4.501 16.385 1.00 0.00 H new ATOM 0 HZ2 TRP B 332 19.069 -8.658 14.891 1.00 0.00 H new ATOM 0 HZ3 TRP B 332 20.945 -4.906 13.978 1.00 0.00 H new ATOM 0 HH2 TRP B 332 19.819 -6.981 13.222 1.00 0.00 H new ATOM 2382 N PHE B 333 18.237 -4.255 18.379 1.00 0.00 N ATOM 2383 CA PHE B 333 17.531 -3.655 17.261 1.00 0.00 C ATOM 2384 C PHE B 333 17.001 -2.278 17.663 1.00 0.00 C ATOM 2385 O PHE B 333 17.153 -1.300 16.930 1.00 0.00 O ATOM 2386 CB PHE B 333 16.366 -4.575 16.833 1.00 0.00 C ATOM 2387 CG PHE B 333 16.119 -4.441 15.344 1.00 0.00 C ATOM 2388 CD1 PHE B 333 17.125 -4.814 14.449 1.00 0.00 C ATOM 2389 CD2 PHE B 333 14.901 -3.944 14.864 1.00 0.00 C ATOM 2390 CE1 PHE B 333 16.921 -4.698 13.075 1.00 0.00 C ATOM 2391 CE2 PHE B 333 14.694 -3.827 13.483 1.00 0.00 C ATOM 2392 CZ PHE B 333 15.703 -4.203 12.586 1.00 0.00 C ATOM 0 H PHE B 333 17.784 -5.074 18.785 1.00 0.00 H new ATOM 0 HA PHE B 333 18.214 -3.535 16.420 1.00 0.00 H new ATOM 0 HB2 PHE B 333 16.600 -5.611 17.079 1.00 0.00 H new ATOM 0 HB3 PHE B 333 15.463 -4.313 17.385 1.00 0.00 H new ATOM 0 HD1 PHE B 333 18.064 -5.194 14.823 1.00 0.00 H new ATOM 0 HD2 PHE B 333 14.124 -3.652 15.555 1.00 0.00 H new ATOM 0 HE1 PHE B 333 17.701 -4.989 12.387 1.00 0.00 H new ATOM 0 HE2 PHE B 333 13.755 -3.446 13.109 1.00 0.00 H new ATOM 0 HZ PHE B 333 15.543 -4.112 11.522 1.00 0.00 H new ATOM 2402 N ALA B 334 16.378 -2.214 18.836 1.00 0.00 N ATOM 2403 CA ALA B 334 15.832 -0.961 19.337 1.00 0.00 C ATOM 2404 C ALA B 334 16.952 0.027 19.649 1.00 0.00 C ATOM 2405 O ALA B 334 16.825 1.226 19.412 1.00 0.00 O ATOM 2406 CB ALA B 334 14.996 -1.211 20.592 1.00 0.00 C ATOM 0 H ALA B 334 16.240 -3.013 19.454 1.00 0.00 H new ATOM 0 HA ALA B 334 15.194 -0.533 18.564 1.00 0.00 H new ATOM 0 HB1 ALA B 334 14.594 -0.265 20.956 1.00 0.00 H new ATOM 0 HB2 ALA B 334 14.175 -1.887 20.353 1.00 0.00 H new ATOM 0 HB3 ALA B 334 15.622 -1.659 21.363 1.00 0.00 H new ATOM 2412 N LYS B 335 18.049 -0.488 20.198 1.00 0.00 N ATOM 2413 CA LYS B 335 19.179 0.364 20.554 1.00 0.00 C ATOM 2414 C LYS B 335 19.730 1.067 19.315 1.00 0.00 C ATOM 2415 O LYS B 335 20.035 2.262 19.356 1.00 0.00 O ATOM 2416 CB LYS B 335 20.278 -0.490 21.203 1.00 0.00 C ATOM 2417 CG LYS B 335 19.820 -0.991 22.590 1.00 0.00 C ATOM 2418 CD LYS B 335 20.069 0.087 23.660 1.00 0.00 C ATOM 2419 CE LYS B 335 19.721 -0.468 25.042 1.00 0.00 C ATOM 2420 NZ LYS B 335 19.966 0.582 26.070 1.00 0.00 N ATOM 0 H LYS B 335 18.179 -1.479 20.404 1.00 0.00 H new ATOM 0 HA LYS B 335 18.842 1.123 21.260 1.00 0.00 H new ATOM 0 HB2 LYS B 335 20.514 -1.339 20.562 1.00 0.00 H new ATOM 0 HB3 LYS B 335 21.191 0.096 21.304 1.00 0.00 H new ATOM 0 HG2 LYS B 335 18.760 -1.245 22.560 1.00 0.00 H new ATOM 0 HG3 LYS B 335 20.359 -1.902 22.851 1.00 0.00 H new ATOM 0 HD2 LYS B 335 21.112 0.402 23.636 1.00 0.00 H new ATOM 0 HD3 LYS B 335 19.464 0.969 23.449 1.00 0.00 H new ATOM 0 HE2 LYS B 335 18.678 -0.782 25.068 1.00 0.00 H new ATOM 0 HE3 LYS B 335 20.325 -1.350 25.255 1.00 0.00 H new ATOM 0 HZ1 LYS B 335 19.730 0.208 27.011 1.00 0.00 H new ATOM 0 HZ2 LYS B 335 20.968 0.861 26.049 1.00 0.00 H new ATOM 0 HZ3 LYS B 335 19.371 1.411 25.868 1.00 0.00 H new ATOM 2434 N GLN B 336 19.839 0.331 18.212 1.00 0.00 N ATOM 2435 CA GLN B 336 20.339 0.912 16.971 1.00 0.00 C ATOM 2436 C GLN B 336 19.403 2.012 16.488 1.00 0.00 C ATOM 2437 O GLN B 336 19.849 3.070 16.044 1.00 0.00 O ATOM 2438 CB GLN B 336 20.457 -0.176 15.900 1.00 0.00 C ATOM 2439 CG GLN B 336 21.632 -1.103 16.227 1.00 0.00 C ATOM 2440 CD GLN B 336 22.948 -0.358 16.039 1.00 0.00 C ATOM 2441 OE1 GLN B 336 23.197 0.201 14.969 1.00 0.00 O ATOM 2442 NE2 GLN B 336 23.812 -0.313 17.015 1.00 0.00 N ATOM 0 H GLN B 336 19.591 -0.657 18.152 1.00 0.00 H new ATOM 0 HA GLN B 336 21.323 1.344 17.156 1.00 0.00 H new ATOM 0 HB2 GLN B 336 19.532 -0.751 15.849 1.00 0.00 H new ATOM 0 HB3 GLN B 336 20.603 0.280 14.921 1.00 0.00 H new ATOM 0 HG2 GLN B 336 21.550 -1.460 17.253 1.00 0.00 H new ATOM 0 HG3 GLN B 336 21.605 -1.980 15.581 1.00 0.00 H new ATOM 0 HE21 GLN B 336 23.606 -0.776 17.900 1.00 0.00 H new ATOM 0 HE22 GLN B 336 24.694 0.185 16.893 1.00 0.00 H new ATOM 2451 N ASN B 337 18.102 1.756 16.583 1.00 0.00 N ATOM 2452 CA ASN B 337 17.107 2.734 16.163 1.00 0.00 C ATOM 2453 C ASN B 337 17.045 3.889 17.159 1.00 0.00 C ATOM 2454 O ASN B 337 16.693 5.013 16.801 1.00 0.00 O ATOM 2455 CB ASN B 337 15.734 2.072 16.047 1.00 0.00 C ATOM 2456 CG ASN B 337 15.705 1.144 14.836 1.00 0.00 C ATOM 2457 OD1 ASN B 337 16.485 1.318 13.901 1.00 0.00 O ATOM 2458 ND2 ASN B 337 14.851 0.158 14.801 1.00 0.00 N ATOM 0 H ASN B 337 17.715 0.885 16.945 1.00 0.00 H new ATOM 0 HA ASN B 337 17.396 3.126 15.188 1.00 0.00 H new ATOM 0 HB2 ASN B 337 15.515 1.508 16.954 1.00 0.00 H new ATOM 0 HB3 ASN B 337 14.960 2.834 15.951 1.00 0.00 H new ATOM 0 HD21 ASN B 337 14.830 -0.470 13.997 1.00 0.00 H new ATOM 0 HD22 ASN B 337 14.205 0.015 15.577 1.00 0.00 H new ATOM 2465 N GLU B 338 17.383 3.596 18.412 1.00 0.00 N ATOM 2466 CA GLU B 338 17.361 4.610 19.458 1.00 0.00 C ATOM 2467 C GLU B 338 18.363 5.717 19.152 1.00 0.00 C ATOM 2468 O GLU B 338 18.083 6.896 19.361 1.00 0.00 O ATOM 2469 CB GLU B 338 17.690 3.978 20.814 1.00 0.00 C ATOM 2470 CG GLU B 338 17.577 5.038 21.914 1.00 0.00 C ATOM 2471 CD GLU B 338 17.800 4.398 23.280 1.00 0.00 C ATOM 2472 OE1 GLU B 338 18.067 3.208 23.320 1.00 0.00 O ATOM 2473 OE2 GLU B 338 17.701 5.108 24.266 1.00 0.00 O ATOM 0 H GLU B 338 17.674 2.670 18.725 1.00 0.00 H new ATOM 0 HA GLU B 338 16.361 5.041 19.496 1.00 0.00 H new ATOM 0 HB2 GLU B 338 17.007 3.153 21.018 1.00 0.00 H new ATOM 0 HB3 GLU B 338 18.697 3.561 20.798 1.00 0.00 H new ATOM 0 HG2 GLU B 338 18.312 5.826 21.748 1.00 0.00 H new ATOM 0 HG3 GLU B 338 16.594 5.507 21.879 1.00 0.00 H new