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 -107:sc= 0.609 USER MOD Set 1.2: A 86 HIS : no HE2:sc= -2.41! C(o=-1.8!,f=-3!) USER MOD Set 2.1: A 34 TYR OH : rot 136:sc= 1.08 USER MOD Set 2.2: A 71 ASN :FLIP amide:sc= -3.64! C(o=-7.6!,f=-2.6!) USER MOD Single : A 12 TYR OH : rot 180:sc= -0.0168 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -1.61 K(o=-1.6,f=-5.8!) USER MOD Single : A 19 ASN : amide:sc= 0.0122 K(o=0.012,f=-1.4) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 78:sc= 0.0923 USER MOD Single : A 32 SER OG : rot 90:sc= 0 USER MOD Single : A 43 SER OG : rot 153:sc= -0.0382! 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= 0.344 K(o=0.34,f=-7.6!) USER MOD Single : A 64 SER OG : rot -116:sc= 0.258 USER MOD Single : A 73 ASN : amide:sc= -1.26! C(o=-1.3!,f=-4.1!) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 160:sc= 0.109 (180deg=-0.289) USER MOD Single : A 87 THR OG1 : rot 124:sc= -2.3 USER MOD Single : A 89 TYR OH : rot 62:sc= 0.805 USER MOD Single : B 314 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 317 SER OG : rot 180:sc= 0 USER MOD Single : B 323 HIS :FLIP no HD1:sc= 0.0858 F(o=-0.87,f=0.086) USER MOD Single : B 325 SER OG : rot 180:sc= 0 USER MOD Single : B 331 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 335 LYS NZ :NH3+ -150:sc= -0.229 (180deg=-1.06) USER MOD Single : B 336 GLN : amide:sc= -0.2 X(o=-0.2,f=-0.32) USER MOD Single : B 337 ASN : amide:sc=-0.00311 X(o=-0.0031,f=-0.21) USER MOD ----------------------------------------------------------------- ATOM 142 N ALA A 11 -0.987 -15.532 -2.727 1.00 0.00 N ATOM 143 CA ALA A 11 -0.369 -15.254 -1.436 1.00 0.00 C ATOM 144 C ALA A 11 -1.220 -15.818 -0.300 1.00 0.00 C ATOM 145 O ALA A 11 -2.389 -15.465 -0.153 1.00 0.00 O ATOM 146 CB ALA A 11 -0.208 -13.745 -1.252 1.00 0.00 C ATOM 0 HA ALA A 11 0.610 -15.732 -1.412 1.00 0.00 H new ATOM 0 HB1 ALA A 11 0.254 -13.544 -0.286 1.00 0.00 H new ATOM 0 HB2 ALA A 11 0.423 -13.347 -2.046 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -1.187 -13.267 -1.293 1.00 0.00 H new ATOM 152 N TYR A 12 -0.623 -16.695 0.501 1.00 0.00 N ATOM 153 CA TYR A 12 -1.332 -17.301 1.623 1.00 0.00 C ATOM 154 C TYR A 12 -0.341 -17.824 2.669 1.00 0.00 C ATOM 155 O TYR A 12 0.665 -18.454 2.322 1.00 0.00 O ATOM 156 CB TYR A 12 -2.225 -18.451 1.121 1.00 0.00 C ATOM 157 CG TYR A 12 -3.579 -17.917 0.711 1.00 0.00 C ATOM 158 CD1 TYR A 12 -4.553 -17.666 1.686 1.00 0.00 C ATOM 159 CD2 TYR A 12 -3.859 -17.671 -0.637 1.00 0.00 C ATOM 160 CE1 TYR A 12 -5.806 -17.167 1.311 1.00 0.00 C ATOM 161 CE2 TYR A 12 -5.113 -17.173 -1.012 1.00 0.00 C ATOM 162 CZ TYR A 12 -6.084 -16.919 -0.036 1.00 0.00 C ATOM 163 OH TYR A 12 -7.321 -16.429 -0.407 1.00 0.00 O ATOM 0 H TYR A 12 0.344 -17.001 0.395 1.00 0.00 H new ATOM 0 HA TYR A 12 -1.957 -16.540 2.090 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -1.750 -18.948 0.275 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -2.343 -19.199 1.905 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -4.337 -17.857 2.727 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -3.108 -17.865 -1.389 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -6.557 -16.974 2.062 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -5.331 -16.985 -2.053 1.00 0.00 H new ATOM 0 HH TYR A 12 -7.348 -16.312 -1.380 1.00 0.00 H new ATOM 173 N ILE A 13 -0.630 -17.563 3.951 1.00 0.00 N ATOM 174 CA ILE A 13 0.244 -18.005 5.046 1.00 0.00 C ATOM 175 C ILE A 13 -0.515 -18.969 5.974 1.00 0.00 C ATOM 176 O ILE A 13 -1.625 -18.674 6.416 1.00 0.00 O ATOM 177 CB ILE A 13 0.754 -16.778 5.860 1.00 0.00 C ATOM 178 CG1 ILE A 13 0.638 -15.501 5.011 1.00 0.00 C ATOM 179 CG2 ILE A 13 2.228 -16.987 6.248 1.00 0.00 C ATOM 180 CD1 ILE A 13 1.067 -14.283 5.837 1.00 0.00 C ATOM 0 H ILE A 13 -1.458 -17.051 4.254 1.00 0.00 H new ATOM 0 HA ILE A 13 1.101 -18.525 4.618 1.00 0.00 H new ATOM 0 HB ILE A 13 0.147 -16.676 6.759 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.263 -15.587 4.122 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.389 -15.375 4.667 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.580 -16.126 6.817 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.320 -17.887 6.857 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.830 -17.096 5.346 1.00 0.00 H new ATOM 0 HD11 ILE A 13 0.982 -13.383 5.229 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.423 -14.192 6.712 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.101 -14.407 6.159 1.00 0.00 H new ATOM 192 N TYR A 14 0.091 -20.116 6.267 1.00 0.00 N ATOM 193 CA TYR A 14 -0.535 -21.111 7.148 1.00 0.00 C ATOM 194 C TYR A 14 -0.186 -20.838 8.609 1.00 0.00 C ATOM 195 O TYR A 14 0.987 -20.697 8.957 1.00 0.00 O ATOM 196 CB TYR A 14 -0.066 -22.521 6.768 1.00 0.00 C ATOM 197 CG TYR A 14 -0.543 -23.521 7.805 1.00 0.00 C ATOM 198 CD1 TYR A 14 -1.869 -23.967 7.793 1.00 0.00 C ATOM 199 CD2 TYR A 14 0.346 -23.996 8.776 1.00 0.00 C ATOM 200 CE1 TYR A 14 -2.307 -24.888 8.753 1.00 0.00 C ATOM 201 CE2 TYR A 14 -0.091 -24.916 9.737 1.00 0.00 C ATOM 202 CZ TYR A 14 -1.417 -25.362 9.724 1.00 0.00 C ATOM 203 OH TYR A 14 -1.847 -26.270 10.670 1.00 0.00 O ATOM 0 H TYR A 14 1.009 -20.383 5.912 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.616 -21.040 7.025 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -0.454 -22.790 5.785 1.00 0.00 H new ATOM 0 HB3 TYR A 14 1.022 -22.546 6.699 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -2.555 -23.601 7.043 1.00 0.00 H new ATOM 0 HD2 TYR A 14 1.370 -23.653 8.784 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -3.331 -25.232 8.744 1.00 0.00 H new ATOM 0 HE2 TYR A 14 0.595 -25.281 10.487 1.00 0.00 H new ATOM 0 HH TYR A 14 -1.104 -26.496 11.268 1.00 0.00 H new ATOM 213 N ILE A 15 -1.212 -20.765 9.463 1.00 0.00 N ATOM 214 CA ILE A 15 -1.001 -20.520 10.893 1.00 0.00 C ATOM 215 C ILE A 15 -1.583 -21.667 11.714 1.00 0.00 C ATOM 216 O ILE A 15 -2.801 -21.810 11.819 1.00 0.00 O ATOM 217 CB ILE A 15 -1.663 -19.202 11.304 1.00 0.00 C ATOM 218 CG1 ILE A 15 -1.035 -18.050 10.515 1.00 0.00 C ATOM 219 CG2 ILE A 15 -1.450 -18.969 12.802 1.00 0.00 C ATOM 220 CD1 ILE A 15 -1.880 -16.787 10.692 1.00 0.00 C ATOM 0 H ILE A 15 -2.190 -20.871 9.192 1.00 0.00 H new ATOM 0 HA ILE A 15 0.071 -20.455 11.082 1.00 0.00 H new ATOM 0 HB ILE A 15 -2.731 -19.250 11.092 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -0.017 -17.871 10.862 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -0.970 -18.312 9.459 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -1.921 -18.031 13.095 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -1.895 -19.790 13.365 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -0.382 -18.920 13.014 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.432 -15.968 10.130 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.890 -16.970 10.324 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.921 -16.522 11.749 1.00 0.00 H new ATOM 232 N GLY A 16 -0.706 -22.485 12.301 1.00 0.00 N ATOM 233 CA GLY A 16 -1.146 -23.628 13.115 1.00 0.00 C ATOM 234 C GLY A 16 -0.637 -23.512 14.545 1.00 0.00 C ATOM 235 O GLY A 16 0.136 -22.609 14.866 1.00 0.00 O ATOM 0 H GLY A 16 0.306 -22.381 12.231 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.235 -23.679 13.117 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -0.784 -24.555 12.671 1.00 0.00 H new ATOM 239 N ASN A 17 -1.072 -24.435 15.402 1.00 0.00 N ATOM 240 CA ASN A 17 -0.656 -24.427 16.798 1.00 0.00 C ATOM 241 C ASN A 17 -1.016 -23.097 17.456 1.00 0.00 C ATOM 242 O ASN A 17 -0.241 -22.554 18.244 1.00 0.00 O ATOM 243 CB ASN A 17 0.854 -24.656 16.892 1.00 0.00 C ATOM 244 CG ASN A 17 1.247 -24.971 18.330 1.00 0.00 C ATOM 245 OD1 ASN A 17 0.464 -24.743 19.253 1.00 0.00 O ATOM 246 ND2 ASN A 17 2.420 -25.484 18.579 1.00 0.00 N ATOM 0 H ASN A 17 -1.708 -25.192 15.153 1.00 0.00 H new ATOM 0 HA ASN A 17 -1.178 -25.229 17.320 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.146 -25.478 16.238 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.386 -23.770 16.547 1.00 0.00 H new ATOM 0 HD21 ASN A 17 2.690 -25.697 19.539 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.067 -25.672 17.813 1.00 0.00 H new ATOM 253 N LEU A 18 -2.200 -22.573 17.128 1.00 0.00 N ATOM 254 CA LEU A 18 -2.658 -21.301 17.700 1.00 0.00 C ATOM 255 C LEU A 18 -3.710 -21.551 18.777 1.00 0.00 C ATOM 256 O LEU A 18 -4.397 -22.574 18.763 1.00 0.00 O ATOM 257 CB LEU A 18 -3.251 -20.412 16.596 1.00 0.00 C ATOM 258 CG LEU A 18 -4.576 -21.035 16.063 1.00 0.00 C ATOM 259 CD1 LEU A 18 -5.780 -20.267 16.623 1.00 0.00 C ATOM 260 CD2 LEU A 18 -4.607 -20.961 14.529 1.00 0.00 C ATOM 0 H LEU A 18 -2.855 -23.004 16.475 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.804 -20.795 18.150 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.441 -19.412 16.986 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.536 -20.305 15.780 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.626 -22.076 16.383 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.702 -20.710 16.245 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -5.771 -20.321 17.712 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -5.724 -19.224 16.311 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -5.536 -21.398 14.162 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -4.547 -19.919 14.214 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.760 -21.513 14.121 1.00 0.00 H new ATOM 272 N ASN A 19 -3.836 -20.610 19.705 1.00 0.00 N ATOM 273 CA ASN A 19 -4.814 -20.740 20.782 1.00 0.00 C ATOM 274 C ASN A 19 -6.204 -20.331 20.290 1.00 0.00 C ATOM 275 O ASN A 19 -6.379 -19.252 19.724 1.00 0.00 O ATOM 276 CB ASN A 19 -4.395 -19.859 21.975 1.00 0.00 C ATOM 277 CG ASN A 19 -3.432 -20.621 22.885 1.00 0.00 C ATOM 278 OD1 ASN A 19 -2.441 -21.179 22.412 1.00 0.00 O ATOM 279 ND2 ASN A 19 -3.669 -20.680 24.166 1.00 0.00 N ATOM 0 H ASN A 19 -3.280 -19.756 19.735 1.00 0.00 H new ATOM 0 HA ASN A 19 -4.851 -21.781 21.102 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -3.920 -18.947 21.613 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -5.277 -19.556 22.540 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -3.033 -21.189 24.779 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -4.491 -20.217 24.555 1.00 0.00 H new ATOM 286 N ARG A 20 -7.187 -21.198 20.517 1.00 0.00 N ATOM 287 CA ARG A 20 -8.557 -20.917 20.095 1.00 0.00 C ATOM 288 C ARG A 20 -9.084 -19.661 20.781 1.00 0.00 C ATOM 289 O ARG A 20 -10.010 -19.015 20.291 1.00 0.00 O ATOM 290 CB ARG A 20 -9.463 -22.107 20.430 1.00 0.00 C ATOM 291 CG ARG A 20 -9.515 -22.302 21.949 1.00 0.00 C ATOM 292 CD ARG A 20 -10.304 -23.571 22.276 1.00 0.00 C ATOM 293 NE ARG A 20 -9.602 -24.745 21.772 1.00 0.00 N ATOM 294 CZ ARG A 20 -8.558 -25.252 22.419 1.00 0.00 C ATOM 295 NH1 ARG A 20 -8.142 -24.695 23.525 1.00 0.00 N ATOM 296 NH2 ARG A 20 -7.946 -26.304 21.948 1.00 0.00 N ATOM 0 H ARG A 20 -7.063 -22.095 20.987 1.00 0.00 H new ATOM 0 HA ARG A 20 -8.558 -20.754 19.017 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -10.466 -21.934 20.041 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -9.086 -23.010 19.950 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -8.505 -22.376 22.351 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -9.984 -21.438 22.421 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -10.441 -23.655 23.354 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -11.298 -23.514 21.832 1.00 0.00 H new ATOM 0 HE ARG A 20 -9.918 -25.185 20.908 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -8.619 -23.871 23.892 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -7.341 -25.084 24.022 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -8.269 -26.737 21.083 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -7.145 -26.693 22.445 1.00 0.00 H new ATOM 310 N GLU A 21 -8.484 -19.321 21.915 1.00 0.00 N ATOM 311 CA GLU A 21 -8.899 -18.139 22.661 1.00 0.00 C ATOM 312 C GLU A 21 -8.707 -16.885 21.819 1.00 0.00 C ATOM 313 O GLU A 21 -9.411 -15.891 21.999 1.00 0.00 O ATOM 314 CB GLU A 21 -8.083 -18.021 23.950 1.00 0.00 C ATOM 315 CG GLU A 21 -8.502 -19.124 24.923 1.00 0.00 C ATOM 316 CD GLU A 21 -7.634 -19.072 26.176 1.00 0.00 C ATOM 317 OE1 GLU A 21 -6.700 -18.287 26.193 1.00 0.00 O ATOM 318 OE2 GLU A 21 -7.915 -19.817 27.100 1.00 0.00 O ATOM 0 H GLU A 21 -7.715 -19.842 22.336 1.00 0.00 H new ATOM 0 HA GLU A 21 -9.955 -18.240 22.910 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.019 -18.102 23.728 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.240 -17.042 24.404 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -9.551 -19.003 25.192 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.406 -20.098 24.444 1.00 0.00 H new ATOM 325 N LEU A 22 -7.751 -16.935 20.899 1.00 0.00 N ATOM 326 CA LEU A 22 -7.476 -15.795 20.035 1.00 0.00 C ATOM 327 C LEU A 22 -8.518 -15.710 18.919 1.00 0.00 C ATOM 328 O LEU A 22 -8.776 -16.689 18.219 1.00 0.00 O ATOM 329 CB LEU A 22 -6.071 -15.929 19.426 1.00 0.00 C ATOM 330 CG LEU A 22 -5.024 -15.425 20.426 1.00 0.00 C ATOM 331 CD1 LEU A 22 -5.199 -16.154 21.764 1.00 0.00 C ATOM 332 CD2 LEU A 22 -3.621 -15.695 19.876 1.00 0.00 C ATOM 0 H LEU A 22 -7.157 -17.747 20.733 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.525 -14.884 20.631 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -5.873 -16.970 19.171 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -6.009 -15.356 18.501 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.154 -14.354 20.578 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -4.454 -15.795 22.474 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.197 -15.960 22.156 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -5.070 -17.226 21.614 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -2.876 -15.337 20.587 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -3.490 -16.766 19.723 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -3.496 -15.175 18.926 1.00 0.00 H new ATOM 344 N THR A 23 -9.112 -14.530 18.756 1.00 0.00 N ATOM 345 CA THR A 23 -10.123 -14.321 17.718 1.00 0.00 C ATOM 346 C THR A 23 -9.491 -13.716 16.470 1.00 0.00 C ATOM 347 O THR A 23 -8.280 -13.502 16.419 1.00 0.00 O ATOM 348 CB THR A 23 -11.224 -13.393 18.237 1.00 0.00 C ATOM 349 OG1 THR A 23 -10.669 -12.118 18.526 1.00 0.00 O ATOM 350 CG2 THR A 23 -11.836 -13.984 19.507 1.00 0.00 C ATOM 0 H THR A 23 -8.913 -13.707 19.325 1.00 0.00 H new ATOM 0 HA THR A 23 -10.556 -15.287 17.461 1.00 0.00 H new ATOM 0 HB THR A 23 -11.999 -13.289 17.478 1.00 0.00 H new ATOM 0 HG1 THR A 23 -11.373 -11.522 18.857 1.00 0.00 H new ATOM 0 HG21 THR A 23 -12.620 -13.322 19.875 1.00 0.00 H new ATOM 0 HG22 THR A 23 -12.262 -14.962 19.284 1.00 0.00 H new ATOM 0 HG23 THR A 23 -11.063 -14.090 20.268 1.00 0.00 H new ATOM 358 N GLU A 24 -10.320 -13.446 15.467 1.00 0.00 N ATOM 359 CA GLU A 24 -9.826 -12.876 14.221 1.00 0.00 C ATOM 360 C GLU A 24 -9.200 -11.510 14.473 1.00 0.00 C ATOM 361 O GLU A 24 -8.144 -11.191 13.925 1.00 0.00 O ATOM 362 CB GLU A 24 -10.986 -12.732 13.226 1.00 0.00 C ATOM 363 CG GLU A 24 -11.528 -14.129 12.848 1.00 0.00 C ATOM 364 CD GLU A 24 -12.612 -14.561 13.839 1.00 0.00 C ATOM 365 OE1 GLU A 24 -12.764 -13.894 14.849 1.00 0.00 O ATOM 366 OE2 GLU A 24 -13.274 -15.552 13.575 1.00 0.00 O ATOM 0 H GLU A 24 -11.326 -13.611 15.492 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.067 -13.540 13.808 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -11.781 -12.130 13.665 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.647 -12.209 12.332 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -11.936 -14.108 11.838 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -10.715 -14.855 12.848 1.00 0.00 H new ATOM 373 N GLY A 25 -9.852 -10.710 15.307 1.00 0.00 N ATOM 374 CA GLY A 25 -9.346 -9.380 15.625 1.00 0.00 C ATOM 375 C GLY A 25 -7.980 -9.460 16.290 1.00 0.00 C ATOM 376 O GLY A 25 -7.081 -8.676 15.982 1.00 0.00 O ATOM 0 H GLY A 25 -10.726 -10.956 15.773 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.276 -8.786 14.714 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -10.046 -8.869 16.286 1.00 0.00 H new ATOM 380 N ASP A 26 -7.830 -10.411 17.204 1.00 0.00 N ATOM 381 CA ASP A 26 -6.566 -10.582 17.909 1.00 0.00 C ATOM 382 C ASP A 26 -5.455 -10.973 16.938 1.00 0.00 C ATOM 383 O ASP A 26 -4.366 -10.403 16.966 1.00 0.00 O ATOM 384 CB ASP A 26 -6.712 -11.663 18.982 1.00 0.00 C ATOM 385 CG ASP A 26 -5.469 -11.688 19.866 1.00 0.00 C ATOM 386 OD1 ASP A 26 -4.419 -11.292 19.391 1.00 0.00 O ATOM 387 OD2 ASP A 26 -5.588 -12.105 21.006 1.00 0.00 O ATOM 0 H ASP A 26 -8.561 -11.070 17.473 1.00 0.00 H new ATOM 0 HA ASP A 26 -6.303 -9.634 18.378 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -7.596 -11.468 19.589 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -6.855 -12.636 18.513 1.00 0.00 H new ATOM 392 N ILE A 27 -5.741 -11.948 16.078 1.00 0.00 N ATOM 393 CA ILE A 27 -4.759 -12.409 15.103 1.00 0.00 C ATOM 394 C ILE A 27 -4.382 -11.282 14.148 1.00 0.00 C ATOM 395 O ILE A 27 -3.211 -11.091 13.831 1.00 0.00 O ATOM 396 CB ILE A 27 -5.317 -13.590 14.303 1.00 0.00 C ATOM 397 CG1 ILE A 27 -5.463 -14.804 15.224 1.00 0.00 C ATOM 398 CG2 ILE A 27 -4.362 -13.939 13.149 1.00 0.00 C ATOM 399 CD1 ILE A 27 -6.249 -15.902 14.503 1.00 0.00 C ATOM 0 H ILE A 27 -6.639 -12.430 16.037 1.00 0.00 H new ATOM 0 HA ILE A 27 -3.869 -12.729 15.644 1.00 0.00 H new ATOM 0 HB ILE A 27 -6.290 -13.318 13.894 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -4.480 -15.176 15.512 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -5.977 -14.518 16.142 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -4.765 -14.780 12.585 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.257 -13.077 12.490 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.386 -14.208 13.553 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -6.353 -16.766 15.159 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -7.238 -15.527 14.238 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -5.717 -16.196 13.598 1.00 0.00 H new ATOM 411 N LEU A 28 -5.383 -10.540 13.695 1.00 0.00 N ATOM 412 CA LEU A 28 -5.136 -9.448 12.766 1.00 0.00 C ATOM 413 C LEU A 28 -4.120 -8.473 13.350 1.00 0.00 C ATOM 414 O LEU A 28 -3.185 -8.072 12.664 1.00 0.00 O ATOM 415 CB LEU A 28 -6.460 -8.708 12.473 1.00 0.00 C ATOM 416 CG LEU A 28 -7.331 -9.534 11.495 1.00 0.00 C ATOM 417 CD1 LEU A 28 -8.809 -9.145 11.648 1.00 0.00 C ATOM 418 CD2 LEU A 28 -6.892 -9.252 10.045 1.00 0.00 C ATOM 0 H LEU A 28 -6.361 -10.672 13.952 1.00 0.00 H new ATOM 0 HA LEU A 28 -4.735 -9.858 11.839 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.004 -8.540 13.402 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.250 -7.728 12.045 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.206 -10.592 11.724 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -9.413 -9.732 10.956 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.133 -9.342 12.670 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.931 -8.085 11.427 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.507 -9.835 9.359 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.013 -8.191 9.828 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.846 -9.531 9.921 1.00 0.00 H new ATOM 430 N THR A 29 -4.297 -8.107 14.615 1.00 0.00 N ATOM 431 CA THR A 29 -3.378 -7.180 15.277 1.00 0.00 C ATOM 432 C THR A 29 -1.970 -7.765 15.357 1.00 0.00 C ATOM 433 O THR A 29 -0.980 -7.062 15.157 1.00 0.00 O ATOM 434 CB THR A 29 -3.871 -6.864 16.692 1.00 0.00 C ATOM 435 OG1 THR A 29 -5.133 -6.217 16.613 1.00 0.00 O ATOM 436 CG2 THR A 29 -2.860 -5.950 17.402 1.00 0.00 C ATOM 0 H THR A 29 -5.064 -8.435 15.203 1.00 0.00 H new ATOM 0 HA THR A 29 -3.347 -6.265 14.685 1.00 0.00 H new ATOM 0 HB THR A 29 -3.971 -7.789 17.259 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.831 -6.882 16.434 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.215 -5.728 18.408 1.00 0.00 H new ATOM 0 HG22 THR A 29 -1.894 -6.452 17.460 1.00 0.00 H new ATOM 0 HG23 THR A 29 -2.753 -5.021 16.842 1.00 0.00 H new ATOM 444 N VAL A 30 -1.887 -9.054 15.655 1.00 0.00 N ATOM 445 CA VAL A 30 -0.591 -9.715 15.770 1.00 0.00 C ATOM 446 C VAL A 30 0.189 -9.633 14.459 1.00 0.00 C ATOM 447 O VAL A 30 1.365 -9.270 14.447 1.00 0.00 O ATOM 448 CB VAL A 30 -0.796 -11.189 16.147 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.542 -11.934 16.069 1.00 0.00 C ATOM 450 CG2 VAL A 30 -1.350 -11.279 17.574 1.00 0.00 C ATOM 0 H VAL A 30 -2.691 -9.659 15.820 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.018 -9.206 16.545 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.502 -11.644 15.453 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.392 -12.980 16.337 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.934 -11.872 15.054 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.252 -11.480 16.760 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.496 -12.325 17.842 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.645 -10.821 18.268 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.304 -10.754 17.628 1.00 0.00 H new ATOM 460 N PHE A 31 -0.470 -9.975 13.357 1.00 0.00 N ATOM 461 CA PHE A 31 0.169 -9.942 12.039 1.00 0.00 C ATOM 462 C PHE A 31 0.062 -8.554 11.401 1.00 0.00 C ATOM 463 O PHE A 31 0.748 -8.255 10.425 1.00 0.00 O ATOM 464 CB PHE A 31 -0.480 -10.988 11.124 1.00 0.00 C ATOM 465 CG PHE A 31 -0.073 -12.380 11.565 1.00 0.00 C ATOM 466 CD1 PHE A 31 -0.715 -12.985 12.653 1.00 0.00 C ATOM 467 CD2 PHE A 31 0.946 -13.062 10.887 1.00 0.00 C ATOM 468 CE1 PHE A 31 -0.341 -14.270 13.063 1.00 0.00 C ATOM 469 CE2 PHE A 31 1.319 -14.349 11.299 1.00 0.00 C ATOM 470 CZ PHE A 31 0.676 -14.951 12.385 1.00 0.00 C ATOM 0 H PHE A 31 -1.444 -10.278 13.346 1.00 0.00 H new ATOM 0 HA PHE A 31 1.227 -10.172 12.168 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -1.565 -10.889 11.156 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.175 -10.820 10.091 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.500 -12.459 13.176 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.443 -12.597 10.049 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -0.837 -14.735 13.902 1.00 0.00 H new ATOM 0 HE2 PHE A 31 2.104 -14.876 10.777 1.00 0.00 H new ATOM 0 HZ PHE A 31 0.965 -15.943 12.701 1.00 0.00 H new ATOM 480 N SER A 32 -0.815 -7.714 11.949 1.00 0.00 N ATOM 481 CA SER A 32 -1.021 -6.373 11.399 1.00 0.00 C ATOM 482 C SER A 32 0.296 -5.641 11.136 1.00 0.00 C ATOM 483 O SER A 32 0.582 -5.231 10.003 1.00 0.00 O ATOM 484 CB SER A 32 -1.857 -5.533 12.365 1.00 0.00 C ATOM 485 OG SER A 32 -1.816 -4.169 11.970 1.00 0.00 O ATOM 0 H SER A 32 -1.388 -7.933 12.763 1.00 0.00 H new ATOM 0 HA SER A 32 -1.539 -6.500 10.448 1.00 0.00 H new ATOM 0 HB2 SER A 32 -2.887 -5.889 12.374 1.00 0.00 H new ATOM 0 HB3 SER A 32 -1.474 -5.640 13.380 1.00 0.00 H new ATOM 0 HG SER A 32 -2.550 -3.987 11.347 1.00 0.00 H new ATOM 491 N GLU A 33 1.101 -5.490 12.181 1.00 0.00 N ATOM 492 CA GLU A 33 2.385 -4.804 12.059 1.00 0.00 C ATOM 493 C GLU A 33 3.354 -5.586 11.185 1.00 0.00 C ATOM 494 O GLU A 33 4.405 -5.079 10.795 1.00 0.00 O ATOM 495 CB GLU A 33 2.995 -4.594 13.447 1.00 0.00 C ATOM 496 CG GLU A 33 3.153 -5.947 14.144 1.00 0.00 C ATOM 497 CD GLU A 33 3.795 -5.757 15.514 1.00 0.00 C ATOM 498 OE1 GLU A 33 4.207 -4.646 15.805 1.00 0.00 O ATOM 499 OE2 GLU A 33 3.864 -6.725 16.253 1.00 0.00 O ATOM 0 H GLU A 33 0.890 -5.831 13.119 1.00 0.00 H new ATOM 0 HA GLU A 33 2.206 -3.839 11.585 1.00 0.00 H new ATOM 0 HB2 GLU A 33 3.964 -4.102 13.360 1.00 0.00 H new ATOM 0 HB3 GLU A 33 2.358 -3.939 14.041 1.00 0.00 H new ATOM 0 HG2 GLU A 33 2.179 -6.425 14.253 1.00 0.00 H new ATOM 0 HG3 GLU A 33 3.767 -6.610 13.534 1.00 0.00 H new ATOM 506 N TYR A 34 2.999 -6.829 10.886 1.00 0.00 N ATOM 507 CA TYR A 34 3.841 -7.700 10.066 1.00 0.00 C ATOM 508 C TYR A 34 3.163 -8.020 8.739 1.00 0.00 C ATOM 509 O TYR A 34 3.320 -9.121 8.211 1.00 0.00 O ATOM 510 CB TYR A 34 4.171 -8.992 10.828 1.00 0.00 C ATOM 511 CG TYR A 34 4.690 -8.650 12.214 1.00 0.00 C ATOM 512 CD1 TYR A 34 5.770 -7.767 12.369 1.00 0.00 C ATOM 513 CD2 TYR A 34 4.086 -9.221 13.345 1.00 0.00 C ATOM 514 CE1 TYR A 34 6.240 -7.450 13.648 1.00 0.00 C ATOM 515 CE2 TYR A 34 4.561 -8.907 14.624 1.00 0.00 C ATOM 516 CZ TYR A 34 5.635 -8.020 14.776 1.00 0.00 C ATOM 517 OH TYR A 34 6.102 -7.708 16.037 1.00 0.00 O ATOM 0 H TYR A 34 2.130 -7.261 11.199 1.00 0.00 H new ATOM 0 HA TYR A 34 4.771 -7.174 9.851 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.281 -9.617 10.906 1.00 0.00 H new ATOM 0 HB3 TYR A 34 4.918 -9.568 10.281 1.00 0.00 H new ATOM 0 HD1 TYR A 34 6.239 -7.331 11.499 1.00 0.00 H new ATOM 0 HD2 TYR A 34 3.256 -9.902 13.229 1.00 0.00 H new ATOM 0 HE1 TYR A 34 7.068 -6.767 13.766 1.00 0.00 H new ATOM 0 HE2 TYR A 34 4.099 -9.349 15.494 1.00 0.00 H new ATOM 0 HH TYR A 34 5.344 -7.530 16.632 1.00 0.00 H new ATOM 527 N GLY A 35 2.395 -7.059 8.206 1.00 0.00 N ATOM 528 CA GLY A 35 1.690 -7.296 6.944 1.00 0.00 C ATOM 529 C GLY A 35 0.220 -7.615 7.174 1.00 0.00 C ATOM 530 O GLY A 35 -0.212 -8.754 6.997 1.00 0.00 O ATOM 0 H GLY A 35 2.250 -6.137 8.617 1.00 0.00 H new ATOM 0 HA2 GLY A 35 1.776 -6.415 6.308 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.163 -8.121 6.412 1.00 0.00 H new ATOM 534 N VAL A 36 -0.543 -6.602 7.590 1.00 0.00 N ATOM 535 CA VAL A 36 -1.955 -6.805 7.878 1.00 0.00 C ATOM 536 C VAL A 36 -2.684 -7.375 6.646 1.00 0.00 C ATOM 537 O VAL A 36 -2.663 -6.784 5.569 1.00 0.00 O ATOM 538 CB VAL A 36 -2.601 -5.455 8.263 1.00 0.00 C ATOM 539 CG1 VAL A 36 -2.781 -4.574 7.016 1.00 0.00 C ATOM 540 CG2 VAL A 36 -3.968 -5.717 8.907 1.00 0.00 C ATOM 0 H VAL A 36 -0.209 -5.649 7.732 1.00 0.00 H new ATOM 0 HA VAL A 36 -2.042 -7.513 8.702 1.00 0.00 H new ATOM 0 HB VAL A 36 -1.951 -4.936 8.968 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.237 -3.626 7.303 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.809 -4.386 6.560 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -3.425 -5.084 6.300 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -4.429 -4.768 9.181 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -4.610 -6.241 8.198 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -3.838 -6.329 9.800 1.00 0.00 H new ATOM 550 N PRO A 37 -3.320 -8.532 6.799 1.00 0.00 N ATOM 551 CA PRO A 37 -4.043 -9.213 5.690 1.00 0.00 C ATOM 552 C PRO A 37 -5.354 -8.530 5.350 1.00 0.00 C ATOM 553 O PRO A 37 -5.913 -7.789 6.160 1.00 0.00 O ATOM 554 CB PRO A 37 -4.285 -10.628 6.221 1.00 0.00 C ATOM 555 CG PRO A 37 -4.350 -10.475 7.703 1.00 0.00 C ATOM 556 CD PRO A 37 -3.421 -9.310 8.054 1.00 0.00 C ATOM 0 HA PRO A 37 -3.470 -9.195 4.763 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -5.211 -11.045 5.826 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -3.481 -11.303 5.928 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -5.370 -10.271 8.029 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -4.033 -11.390 8.203 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -3.829 -8.706 8.865 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.444 -9.665 8.382 1.00 0.00 H new ATOM 564 N VAL A 38 -5.841 -8.780 4.146 1.00 0.00 N ATOM 565 CA VAL A 38 -7.093 -8.192 3.705 1.00 0.00 C ATOM 566 C VAL A 38 -8.230 -9.191 3.875 1.00 0.00 C ATOM 567 O VAL A 38 -9.402 -8.829 3.782 1.00 0.00 O ATOM 568 CB VAL A 38 -6.985 -7.775 2.237 1.00 0.00 C ATOM 569 CG1 VAL A 38 -5.998 -6.612 2.105 1.00 0.00 C ATOM 570 CG2 VAL A 38 -6.484 -8.960 1.404 1.00 0.00 C ATOM 0 H VAL A 38 -5.390 -9.384 3.459 1.00 0.00 H new ATOM 0 HA VAL A 38 -7.301 -7.311 4.313 1.00 0.00 H new ATOM 0 HB VAL A 38 -7.966 -7.463 1.878 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -5.922 -6.316 1.059 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -6.350 -5.767 2.696 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -5.018 -6.924 2.466 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -6.407 -8.663 0.358 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -5.504 -9.271 1.766 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -7.184 -9.790 1.495 1.00 0.00 H new ATOM 580 N ASP A 39 -7.874 -10.451 4.124 1.00 0.00 N ATOM 581 CA ASP A 39 -8.874 -11.496 4.308 1.00 0.00 C ATOM 582 C ASP A 39 -8.278 -12.691 5.056 1.00 0.00 C ATOM 583 O ASP A 39 -7.182 -13.158 4.733 1.00 0.00 O ATOM 584 CB ASP A 39 -9.398 -11.953 2.944 1.00 0.00 C ATOM 585 CG ASP A 39 -10.580 -12.900 3.132 1.00 0.00 C ATOM 586 OD1 ASP A 39 -10.934 -13.155 4.271 1.00 0.00 O ATOM 587 OD2 ASP A 39 -11.111 -13.356 2.134 1.00 0.00 O ATOM 0 H ASP A 39 -6.908 -10.769 4.202 1.00 0.00 H new ATOM 0 HA ASP A 39 -9.695 -11.090 4.900 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -9.703 -11.089 2.354 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -8.605 -12.454 2.389 1.00 0.00 H new ATOM 592 N VAL A 40 -9.004 -13.187 6.058 1.00 0.00 N ATOM 593 CA VAL A 40 -8.534 -14.337 6.844 1.00 0.00 C ATOM 594 C VAL A 40 -9.607 -15.426 6.866 1.00 0.00 C ATOM 595 O VAL A 40 -10.761 -15.163 7.201 1.00 0.00 O ATOM 596 CB VAL A 40 -8.203 -13.895 8.276 1.00 0.00 C ATOM 597 CG1 VAL A 40 -7.577 -15.058 9.039 1.00 0.00 C ATOM 598 CG2 VAL A 40 -7.219 -12.724 8.237 1.00 0.00 C ATOM 0 H VAL A 40 -9.911 -12.818 6.346 1.00 0.00 H new ATOM 0 HA VAL A 40 -7.632 -14.738 6.382 1.00 0.00 H new ATOM 0 HB VAL A 40 -9.119 -13.583 8.777 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -7.343 -14.742 10.056 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.278 -15.892 9.071 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -6.662 -15.372 8.537 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -6.985 -12.411 9.255 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -6.304 -13.035 7.733 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.666 -11.891 7.695 1.00 0.00 H new ATOM 608 N ILE A 41 -9.219 -16.652 6.503 1.00 0.00 N ATOM 609 CA ILE A 41 -10.167 -17.772 6.472 1.00 0.00 C ATOM 610 C ILE A 41 -10.141 -18.539 7.793 1.00 0.00 C ATOM 611 O ILE A 41 -9.101 -19.069 8.198 1.00 0.00 O ATOM 612 CB ILE A 41 -9.809 -18.726 5.328 1.00 0.00 C ATOM 613 CG1 ILE A 41 -9.748 -17.947 4.009 1.00 0.00 C ATOM 614 CG2 ILE A 41 -10.878 -19.816 5.217 1.00 0.00 C ATOM 615 CD1 ILE A 41 -9.170 -18.844 2.907 1.00 0.00 C ATOM 0 H ILE A 41 -8.267 -16.894 6.229 1.00 0.00 H new ATOM 0 HA ILE A 41 -11.168 -17.368 6.317 1.00 0.00 H new ATOM 0 HB ILE A 41 -8.839 -19.181 5.530 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -10.745 -17.607 3.729 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -9.130 -17.057 4.129 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -10.623 -20.494 4.403 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -10.927 -20.374 6.152 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -11.846 -19.357 5.017 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -9.128 -18.288 1.970 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -8.165 -19.162 3.186 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -9.806 -19.720 2.780 1.00 0.00 H new ATOM 627 N LEU A 42 -11.295 -18.596 8.465 1.00 0.00 N ATOM 628 CA LEU A 42 -11.397 -19.306 9.746 1.00 0.00 C ATOM 629 C LEU A 42 -12.022 -20.680 9.532 1.00 0.00 C ATOM 630 O LEU A 42 -13.244 -20.813 9.457 1.00 0.00 O ATOM 631 CB LEU A 42 -12.253 -18.486 10.739 1.00 0.00 C ATOM 632 CG LEU A 42 -11.374 -17.423 11.446 1.00 0.00 C ATOM 633 CD1 LEU A 42 -10.396 -18.108 12.438 1.00 0.00 C ATOM 634 CD2 LEU A 42 -10.576 -16.645 10.388 1.00 0.00 C ATOM 0 H LEU A 42 -12.163 -18.165 8.149 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.397 -19.432 10.161 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -13.072 -17.999 10.210 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -12.702 -19.149 11.479 1.00 0.00 H new ATOM 0 HG LEU A 42 -12.015 -16.739 12.003 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.785 -17.350 12.928 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.964 -18.657 13.189 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -9.751 -18.799 11.895 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -9.955 -15.895 10.879 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -9.941 -17.334 9.832 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -11.265 -16.153 9.702 1.00 0.00 H new ATOM 646 N SER A 43 -11.175 -21.697 9.438 1.00 0.00 N ATOM 647 CA SER A 43 -11.653 -23.055 9.238 1.00 0.00 C ATOM 648 C SER A 43 -12.215 -23.626 10.536 1.00 0.00 C ATOM 649 O SER A 43 -11.830 -23.205 11.627 1.00 0.00 O ATOM 650 CB SER A 43 -10.512 -23.937 8.738 1.00 0.00 C ATOM 651 OG SER A 43 -9.546 -24.081 9.770 1.00 0.00 O ATOM 0 H SER A 43 -10.161 -21.607 9.497 1.00 0.00 H new ATOM 0 HA SER A 43 -12.450 -23.035 8.494 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.894 -24.914 8.442 1.00 0.00 H new ATOM 0 HB3 SER A 43 -10.054 -23.493 7.854 1.00 0.00 H new ATOM 0 HG SER A 43 -9.073 -24.932 9.658 1.00 0.00 H new ATOM 657 N ARG A 44 -13.121 -24.592 10.411 1.00 0.00 N ATOM 658 CA ARG A 44 -13.725 -25.223 11.581 1.00 0.00 C ATOM 659 C ARG A 44 -14.212 -26.627 11.241 1.00 0.00 C ATOM 660 O ARG A 44 -14.666 -26.884 10.126 1.00 0.00 O ATOM 661 CB ARG A 44 -14.895 -24.372 12.083 1.00 0.00 C ATOM 662 CG ARG A 44 -15.921 -24.197 10.960 1.00 0.00 C ATOM 663 CD ARG A 44 -17.103 -23.372 11.471 1.00 0.00 C ATOM 664 NE ARG A 44 -18.076 -23.169 10.402 1.00 0.00 N ATOM 665 CZ ARG A 44 -17.939 -22.178 9.526 1.00 0.00 C ATOM 666 NH1 ARG A 44 -16.920 -21.366 9.616 1.00 0.00 N ATOM 667 NH2 ARG A 44 -18.821 -22.016 8.578 1.00 0.00 N ATOM 0 H ARG A 44 -13.452 -24.953 9.516 1.00 0.00 H new ATOM 0 HA ARG A 44 -12.971 -25.298 12.365 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -15.362 -24.849 12.945 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -14.534 -23.398 12.415 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -15.460 -23.701 10.106 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -16.267 -25.171 10.614 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -17.576 -23.882 12.311 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -16.751 -22.409 11.840 1.00 0.00 H new ATOM 0 HE ARG A 44 -18.875 -23.798 10.326 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -16.231 -21.493 10.357 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -16.813 -20.605 8.945 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -19.617 -22.650 8.508 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -18.714 -21.255 7.907 1.00 0.00 H new ATOM 786 N GLY A 53 -7.396 -25.417 15.741 1.00 0.00 N ATOM 787 CA GLY A 53 -6.389 -24.400 16.062 1.00 0.00 C ATOM 788 C GLY A 53 -5.520 -24.069 14.849 1.00 0.00 C ATOM 789 O GLY A 53 -4.303 -23.911 14.973 1.00 0.00 O ATOM 0 HA2 GLY A 53 -6.884 -23.495 16.414 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -5.758 -24.756 16.877 1.00 0.00 H new ATOM 793 N PHE A 54 -6.150 -23.972 13.676 1.00 0.00 N ATOM 794 CA PHE A 54 -5.419 -23.656 12.445 1.00 0.00 C ATOM 795 C PHE A 54 -6.251 -22.737 11.546 1.00 0.00 C ATOM 796 O PHE A 54 -7.481 -22.804 11.544 1.00 0.00 O ATOM 797 CB PHE A 54 -5.085 -24.955 11.697 1.00 0.00 C ATOM 798 CG PHE A 54 -6.342 -25.512 11.060 1.00 0.00 C ATOM 799 CD1 PHE A 54 -7.352 -26.048 11.864 1.00 0.00 C ATOM 800 CD2 PHE A 54 -6.490 -25.493 9.668 1.00 0.00 C ATOM 801 CE1 PHE A 54 -8.515 -26.564 11.277 1.00 0.00 C ATOM 802 CE2 PHE A 54 -7.651 -26.009 9.081 1.00 0.00 C ATOM 803 CZ PHE A 54 -8.664 -26.543 9.885 1.00 0.00 C ATOM 0 H PHE A 54 -7.154 -24.106 13.552 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.496 -23.139 12.708 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -4.332 -24.763 10.933 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -4.660 -25.685 12.386 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -7.236 -26.064 12.938 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -5.708 -25.080 9.047 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -9.296 -26.978 11.898 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -7.765 -25.995 8.007 1.00 0.00 H new ATOM 0 HZ PHE A 54 -9.561 -26.939 9.432 1.00 0.00 H new ATOM 813 N ALA A 55 -5.573 -21.885 10.782 1.00 0.00 N ATOM 814 CA ALA A 55 -6.259 -20.959 9.880 1.00 0.00 C ATOM 815 C ALA A 55 -5.318 -20.490 8.773 1.00 0.00 C ATOM 816 O ALA A 55 -4.105 -20.689 8.853 1.00 0.00 O ATOM 817 CB ALA A 55 -6.779 -19.751 10.661 1.00 0.00 C ATOM 0 H ALA A 55 -4.556 -21.815 10.768 1.00 0.00 H new ATOM 0 HA ALA A 55 -7.100 -21.483 9.426 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -7.288 -19.069 9.980 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.478 -20.087 11.427 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.943 -19.236 11.133 1.00 0.00 H new ATOM 823 N TYR A 56 -5.883 -19.865 7.734 1.00 0.00 N ATOM 824 CA TYR A 56 -5.073 -19.371 6.610 1.00 0.00 C ATOM 825 C TYR A 56 -5.095 -17.843 6.561 1.00 0.00 C ATOM 826 O TYR A 56 -6.148 -17.222 6.716 1.00 0.00 O ATOM 827 CB TYR A 56 -5.615 -19.929 5.293 1.00 0.00 C ATOM 828 CG TYR A 56 -5.540 -21.437 5.316 1.00 0.00 C ATOM 829 CD1 TYR A 56 -4.359 -22.086 4.935 1.00 0.00 C ATOM 830 CD2 TYR A 56 -6.653 -22.186 5.718 1.00 0.00 C ATOM 831 CE1 TYR A 56 -4.292 -23.484 4.956 1.00 0.00 C ATOM 832 CE2 TYR A 56 -6.584 -23.584 5.739 1.00 0.00 C ATOM 833 CZ TYR A 56 -5.405 -24.233 5.358 1.00 0.00 C ATOM 834 OH TYR A 56 -5.337 -25.611 5.379 1.00 0.00 O ATOM 0 H TYR A 56 -6.884 -19.690 7.646 1.00 0.00 H new ATOM 0 HA TYR A 56 -4.045 -19.705 6.754 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -6.646 -19.608 5.147 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -5.038 -19.538 4.455 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -3.501 -21.508 4.625 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -7.564 -21.685 6.012 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -3.382 -23.985 4.662 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -7.442 -24.162 6.050 1.00 0.00 H new ATOM 0 HH TYR A 56 -6.194 -25.976 5.683 1.00 0.00 H new ATOM 844 N LEU A 57 -3.927 -17.240 6.345 1.00 0.00 N ATOM 845 CA LEU A 57 -3.823 -15.776 6.278 1.00 0.00 C ATOM 846 C LEU A 57 -3.615 -15.326 4.827 1.00 0.00 C ATOM 847 O LEU A 57 -2.788 -15.891 4.120 1.00 0.00 O ATOM 848 CB LEU A 57 -2.647 -15.285 7.158 1.00 0.00 C ATOM 849 CG LEU A 57 -3.001 -13.926 7.805 1.00 0.00 C ATOM 850 CD1 LEU A 57 -3.763 -14.164 9.124 1.00 0.00 C ATOM 851 CD2 LEU A 57 -1.718 -13.131 8.088 1.00 0.00 C ATOM 0 H LEU A 57 -3.044 -17.734 6.214 1.00 0.00 H new ATOM 0 HA LEU A 57 -4.750 -15.342 6.652 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.430 -16.020 7.933 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.746 -15.185 6.553 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.630 -13.357 7.120 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.012 -13.205 9.579 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.680 -14.717 8.920 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.137 -14.738 9.807 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.975 -12.175 8.544 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.082 -13.697 8.768 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.185 -12.956 7.153 1.00 0.00 H new ATOM 863 N LYS A 58 -4.370 -14.306 4.391 1.00 0.00 N ATOM 864 CA LYS A 58 -4.250 -13.798 3.014 1.00 0.00 C ATOM 865 C LYS A 58 -3.720 -12.363 2.999 1.00 0.00 C ATOM 866 O LYS A 58 -4.421 -11.430 3.391 1.00 0.00 O ATOM 867 CB LYS A 58 -5.628 -13.842 2.317 1.00 0.00 C ATOM 868 CG LYS A 58 -5.454 -13.878 0.777 1.00 0.00 C ATOM 869 CD LYS A 58 -5.051 -12.486 0.259 1.00 0.00 C ATOM 870 CE LYS A 58 -5.319 -12.392 -1.246 1.00 0.00 C ATOM 871 NZ LYS A 58 -4.961 -11.028 -1.729 1.00 0.00 N ATOM 0 H LYS A 58 -5.062 -13.821 4.963 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.544 -14.434 2.480 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -6.182 -14.721 2.647 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -6.215 -12.969 2.603 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.693 -14.610 0.506 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -6.384 -14.195 0.305 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -5.613 -11.715 0.786 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -3.995 -12.305 0.461 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -4.735 -13.143 -1.778 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -6.369 -12.599 -1.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -5.143 -10.963 -2.751 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -5.537 -10.321 -1.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -3.954 -10.848 -1.544 1.00 0.00 H new ATOM 885 N TYR A 59 -2.478 -12.189 2.531 1.00 0.00 N ATOM 886 CA TYR A 59 -1.863 -10.857 2.444 1.00 0.00 C ATOM 887 C TYR A 59 -1.710 -10.443 0.977 1.00 0.00 C ATOM 888 O TYR A 59 -1.930 -11.244 0.068 1.00 0.00 O ATOM 889 CB TYR A 59 -0.500 -10.847 3.145 1.00 0.00 C ATOM 890 CG TYR A 59 0.039 -9.433 3.185 1.00 0.00 C ATOM 891 CD1 TYR A 59 -0.437 -8.522 4.133 1.00 0.00 C ATOM 892 CD2 TYR A 59 1.011 -9.035 2.270 1.00 0.00 C ATOM 893 CE1 TYR A 59 0.064 -7.215 4.165 1.00 0.00 C ATOM 894 CE2 TYR A 59 1.514 -7.728 2.298 1.00 0.00 C ATOM 895 CZ TYR A 59 1.038 -6.818 3.246 1.00 0.00 C ATOM 896 OH TYR A 59 1.532 -5.529 3.276 1.00 0.00 O ATOM 0 H TYR A 59 -1.880 -12.950 2.208 1.00 0.00 H new ATOM 0 HA TYR A 59 -2.513 -10.140 2.946 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -0.597 -11.239 4.157 1.00 0.00 H new ATOM 0 HB3 TYR A 59 0.197 -11.498 2.617 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -1.193 -8.827 4.842 1.00 0.00 H new ATOM 0 HD2 TYR A 59 1.378 -9.737 1.536 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -0.303 -6.514 4.900 1.00 0.00 H new ATOM 0 HE2 TYR A 59 2.269 -7.424 1.588 1.00 0.00 H new ATOM 0 HH TYR A 59 2.203 -5.419 2.570 1.00 0.00 H new ATOM 906 N GLU A 60 -1.342 -9.184 0.749 1.00 0.00 N ATOM 907 CA GLU A 60 -1.188 -8.678 -0.618 1.00 0.00 C ATOM 908 C GLU A 60 0.051 -9.264 -1.310 1.00 0.00 C ATOM 909 O GLU A 60 -0.053 -9.878 -2.372 1.00 0.00 O ATOM 910 CB GLU A 60 -1.068 -7.152 -0.582 1.00 0.00 C ATOM 911 CG GLU A 60 -1.283 -6.584 -1.988 1.00 0.00 C ATOM 912 CD GLU A 60 -2.739 -6.764 -2.408 1.00 0.00 C ATOM 913 OE1 GLU A 60 -3.558 -7.007 -1.538 1.00 0.00 O ATOM 914 OE2 GLU A 60 -3.012 -6.659 -3.591 1.00 0.00 O ATOM 0 H GLU A 60 -1.146 -8.501 1.481 1.00 0.00 H new ATOM 0 HA GLU A 60 -2.067 -8.982 -1.187 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -1.804 -6.736 0.105 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -0.085 -6.864 -0.209 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -1.019 -5.527 -2.006 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -0.627 -7.089 -2.697 1.00 0.00 H new ATOM 921 N ASP A 61 1.221 -9.081 -0.701 1.00 0.00 N ATOM 922 CA ASP A 61 2.479 -9.598 -1.272 1.00 0.00 C ATOM 923 C ASP A 61 3.020 -10.758 -0.437 1.00 0.00 C ATOM 924 O ASP A 61 3.270 -10.614 0.758 1.00 0.00 O ATOM 925 CB ASP A 61 3.520 -8.479 -1.320 1.00 0.00 C ATOM 926 CG ASP A 61 2.952 -7.271 -2.058 1.00 0.00 C ATOM 927 OD1 ASP A 61 2.360 -7.465 -3.106 1.00 0.00 O ATOM 928 OD2 ASP A 61 3.116 -6.169 -1.561 1.00 0.00 O ATOM 0 H ASP A 61 1.332 -8.583 0.182 1.00 0.00 H new ATOM 0 HA ASP A 61 2.276 -9.959 -2.280 1.00 0.00 H new ATOM 0 HB2 ASP A 61 3.808 -8.195 -0.308 1.00 0.00 H new ATOM 0 HB3 ASP A 61 4.422 -8.831 -1.821 1.00 0.00 H new ATOM 933 N GLN A 62 3.205 -11.908 -1.079 1.00 0.00 N ATOM 934 CA GLN A 62 3.716 -13.085 -0.386 1.00 0.00 C ATOM 935 C GLN A 62 5.082 -12.799 0.239 1.00 0.00 C ATOM 936 O GLN A 62 5.568 -13.550 1.080 1.00 0.00 O ATOM 937 CB GLN A 62 3.824 -14.262 -1.371 1.00 0.00 C ATOM 938 CG GLN A 62 4.721 -13.867 -2.570 1.00 0.00 C ATOM 939 CD GLN A 62 3.874 -13.238 -3.676 1.00 0.00 C ATOM 940 OE1 GLN A 62 2.740 -12.831 -3.430 1.00 0.00 O ATOM 941 NE2 GLN A 62 4.361 -13.131 -4.882 1.00 0.00 N ATOM 0 H GLN A 62 3.010 -12.049 -2.070 1.00 0.00 H new ATOM 0 HA GLN A 62 3.022 -13.344 0.414 1.00 0.00 H new ATOM 0 HB2 GLN A 62 4.241 -15.133 -0.866 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.832 -14.543 -1.725 1.00 0.00 H new ATOM 0 HG2 GLN A 62 5.488 -13.164 -2.244 1.00 0.00 H new ATOM 0 HG3 GLN A 62 5.238 -14.747 -2.953 1.00 0.00 H new ATOM 0 HE21 GLN A 62 5.302 -13.469 -5.084 1.00 0.00 H new ATOM 0 HE22 GLN A 62 3.801 -12.709 -5.623 1.00 0.00 H new ATOM 950 N ARG A 63 5.697 -11.708 -0.188 1.00 0.00 N ATOM 951 CA ARG A 63 7.004 -11.333 0.334 1.00 0.00 C ATOM 952 C ARG A 63 6.893 -10.881 1.788 1.00 0.00 C ATOM 953 O ARG A 63 7.855 -10.974 2.551 1.00 0.00 O ATOM 954 CB ARG A 63 7.595 -10.205 -0.516 1.00 0.00 C ATOM 955 CG ARG A 63 7.966 -10.747 -1.898 1.00 0.00 C ATOM 956 CD ARG A 63 8.425 -9.596 -2.792 1.00 0.00 C ATOM 957 NE ARG A 63 7.293 -8.738 -3.128 1.00 0.00 N ATOM 958 CZ ARG A 63 6.444 -9.070 -4.094 1.00 0.00 C ATOM 959 NH1 ARG A 63 6.613 -10.181 -4.758 1.00 0.00 N ATOM 960 NH2 ARG A 63 5.438 -8.287 -4.377 1.00 0.00 N ATOM 0 H ARG A 63 5.318 -11.071 -0.888 1.00 0.00 H new ATOM 0 HA ARG A 63 7.659 -12.203 0.290 1.00 0.00 H new ATOM 0 HB2 ARG A 63 6.874 -9.393 -0.614 1.00 0.00 H new ATOM 0 HB3 ARG A 63 8.477 -9.791 -0.027 1.00 0.00 H new ATOM 0 HG2 ARG A 63 8.759 -11.490 -1.808 1.00 0.00 H new ATOM 0 HG3 ARG A 63 7.108 -11.249 -2.346 1.00 0.00 H new ATOM 0 HD2 ARG A 63 9.193 -9.014 -2.283 1.00 0.00 H new ATOM 0 HD3 ARG A 63 8.875 -9.990 -3.703 1.00 0.00 H new ATOM 0 HE ARG A 63 7.152 -7.869 -2.613 1.00 0.00 H new ATOM 0 HH11 ARG A 63 7.397 -10.794 -4.535 1.00 0.00 H new ATOM 0 HH12 ARG A 63 5.961 -10.436 -5.500 1.00 0.00 H new ATOM 0 HH21 ARG A 63 5.304 -7.420 -3.856 1.00 0.00 H new ATOM 0 HH22 ARG A 63 4.786 -8.542 -5.119 1.00 0.00 H new ATOM 974 N SER A 64 5.714 -10.389 2.166 1.00 0.00 N ATOM 975 CA SER A 64 5.486 -9.919 3.530 1.00 0.00 C ATOM 976 C SER A 64 5.520 -11.078 4.522 1.00 0.00 C ATOM 977 O SER A 64 5.692 -10.873 5.723 1.00 0.00 O ATOM 978 CB SER A 64 4.134 -9.215 3.625 1.00 0.00 C ATOM 979 OG SER A 64 3.096 -10.154 3.381 1.00 0.00 O ATOM 0 H SER A 64 4.906 -10.306 1.549 1.00 0.00 H new ATOM 0 HA SER A 64 6.283 -9.219 3.780 1.00 0.00 H new ATOM 0 HB2 SER A 64 4.012 -8.769 4.612 1.00 0.00 H new ATOM 0 HB3 SER A 64 4.083 -8.403 2.900 1.00 0.00 H new ATOM 0 HG SER A 64 2.610 -9.901 2.568 1.00 0.00 H new ATOM 985 N THR A 65 5.347 -12.292 4.015 1.00 0.00 N ATOM 986 CA THR A 65 5.350 -13.472 4.873 1.00 0.00 C ATOM 987 C THR A 65 6.680 -13.607 5.596 1.00 0.00 C ATOM 988 O THR A 65 6.751 -14.175 6.683 1.00 0.00 O ATOM 989 CB THR A 65 5.097 -14.723 4.030 1.00 0.00 C ATOM 990 OG1 THR A 65 6.103 -14.827 3.034 1.00 0.00 O ATOM 991 CG2 THR A 65 3.723 -14.625 3.365 1.00 0.00 C ATOM 0 H THR A 65 5.204 -12.486 3.024 1.00 0.00 H new ATOM 0 HA THR A 65 4.559 -13.363 5.615 1.00 0.00 H new ATOM 0 HB THR A 65 5.123 -15.606 4.669 1.00 0.00 H new ATOM 0 HG1 THR A 65 5.721 -14.608 2.159 1.00 0.00 H new ATOM 0 HG21 THR A 65 3.545 -15.517 2.765 1.00 0.00 H new ATOM 0 HG22 THR A 65 2.953 -14.544 4.132 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.691 -13.744 2.724 1.00 0.00 H new ATOM 999 N ILE A 66 7.729 -13.078 4.990 1.00 0.00 N ATOM 1000 CA ILE A 66 9.056 -13.149 5.584 1.00 0.00 C ATOM 1001 C ILE A 66 9.067 -12.456 6.946 1.00 0.00 C ATOM 1002 O ILE A 66 9.714 -12.926 7.882 1.00 0.00 O ATOM 1003 CB ILE A 66 10.078 -12.481 4.659 1.00 0.00 C ATOM 1004 CG1 ILE A 66 10.200 -13.294 3.367 1.00 0.00 C ATOM 1005 CG2 ILE A 66 11.442 -12.431 5.353 1.00 0.00 C ATOM 1006 CD1 ILE A 66 10.979 -12.485 2.327 1.00 0.00 C ATOM 0 H ILE A 66 7.690 -12.597 4.092 1.00 0.00 H new ATOM 0 HA ILE A 66 9.321 -14.198 5.719 1.00 0.00 H new ATOM 0 HB ILE A 66 9.749 -11.468 4.428 1.00 0.00 H new ATOM 0 HG12 ILE A 66 10.709 -14.237 3.565 1.00 0.00 H new ATOM 0 HG13 ILE A 66 9.209 -13.540 2.985 1.00 0.00 H new ATOM 0 HG21 ILE A 66 12.168 -11.956 4.694 1.00 0.00 H new ATOM 0 HG22 ILE A 66 11.360 -11.857 6.276 1.00 0.00 H new ATOM 0 HG23 ILE A 66 11.770 -13.444 5.584 1.00 0.00 H new ATOM 0 HD11 ILE A 66 11.066 -13.063 1.407 1.00 0.00 H new ATOM 0 HD12 ILE A 66 10.452 -11.553 2.121 1.00 0.00 H new ATOM 0 HD13 ILE A 66 11.974 -12.262 2.711 1.00 0.00 H new ATOM 1018 N LEU A 67 8.355 -11.335 7.044 1.00 0.00 N ATOM 1019 CA LEU A 67 8.304 -10.583 8.295 1.00 0.00 C ATOM 1020 C LEU A 67 7.763 -11.438 9.441 1.00 0.00 C ATOM 1021 O LEU A 67 8.466 -11.707 10.410 1.00 0.00 O ATOM 1022 CB LEU A 67 7.400 -9.342 8.121 1.00 0.00 C ATOM 1023 CG LEU A 67 8.196 -8.191 7.460 1.00 0.00 C ATOM 1024 CD1 LEU A 67 7.229 -7.213 6.783 1.00 0.00 C ATOM 1025 CD2 LEU A 67 9.007 -7.433 8.528 1.00 0.00 C ATOM 0 H LEU A 67 7.811 -10.931 6.281 1.00 0.00 H new ATOM 0 HA LEU A 67 9.321 -10.278 8.542 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.536 -9.596 7.507 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.019 -9.021 9.091 1.00 0.00 H new ATOM 0 HG LEU A 67 8.873 -8.614 6.717 1.00 0.00 H new ATOM 0 HD11 LEU A 67 7.794 -6.405 6.319 1.00 0.00 H new ATOM 0 HD12 LEU A 67 6.655 -7.739 6.020 1.00 0.00 H new ATOM 0 HD13 LEU A 67 6.549 -6.799 7.528 1.00 0.00 H new ATOM 0 HD21 LEU A 67 9.565 -6.624 8.055 1.00 0.00 H new ATOM 0 HD22 LEU A 67 8.329 -7.018 9.274 1.00 0.00 H new ATOM 0 HD23 LEU A 67 9.702 -8.119 9.012 1.00 0.00 H new ATOM 1037 N ALA A 68 6.511 -11.863 9.321 1.00 0.00 N ATOM 1038 CA ALA A 68 5.884 -12.672 10.362 1.00 0.00 C ATOM 1039 C ALA A 68 6.608 -13.997 10.569 1.00 0.00 C ATOM 1040 O ALA A 68 6.759 -14.464 11.690 1.00 0.00 O ATOM 1041 CB ALA A 68 4.428 -12.959 9.993 1.00 0.00 C ATOM 0 H ALA A 68 5.912 -11.663 8.520 1.00 0.00 H new ATOM 0 HA ALA A 68 5.938 -12.102 11.290 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.967 -13.563 10.774 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.886 -12.019 9.894 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.392 -13.500 9.047 1.00 0.00 H new ATOM 1047 N VAL A 69 7.051 -14.598 9.480 1.00 0.00 N ATOM 1048 CA VAL A 69 7.721 -15.887 9.573 1.00 0.00 C ATOM 1049 C VAL A 69 8.899 -15.869 10.553 1.00 0.00 C ATOM 1050 O VAL A 69 8.964 -16.689 11.459 1.00 0.00 O ATOM 1051 CB VAL A 69 8.237 -16.294 8.176 1.00 0.00 C ATOM 1052 CG1 VAL A 69 9.226 -17.469 8.304 1.00 0.00 C ATOM 1053 CG2 VAL A 69 7.050 -16.727 7.285 1.00 0.00 C ATOM 0 H VAL A 69 6.963 -14.224 8.535 1.00 0.00 H new ATOM 0 HA VAL A 69 6.992 -16.606 9.947 1.00 0.00 H new ATOM 0 HB VAL A 69 8.742 -15.440 7.725 1.00 0.00 H new ATOM 0 HG11 VAL A 69 9.586 -17.751 7.315 1.00 0.00 H new ATOM 0 HG12 VAL A 69 10.070 -17.168 8.925 1.00 0.00 H new ATOM 0 HG13 VAL A 69 8.723 -18.320 8.763 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.420 -17.013 6.300 1.00 0.00 H new ATOM 0 HG22 VAL A 69 6.542 -17.576 7.743 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.350 -15.898 7.183 1.00 0.00 H new ATOM 1063 N ASP A 70 9.821 -14.933 10.367 1.00 0.00 N ATOM 1064 CA ASP A 70 11.006 -14.846 11.226 1.00 0.00 C ATOM 1065 C ASP A 70 10.765 -13.997 12.476 1.00 0.00 C ATOM 1066 O ASP A 70 11.588 -13.976 13.391 1.00 0.00 O ATOM 1067 CB ASP A 70 12.164 -14.249 10.423 1.00 0.00 C ATOM 1068 CG ASP A 70 11.813 -12.834 9.979 1.00 0.00 C ATOM 1069 OD1 ASP A 70 10.747 -12.368 10.342 1.00 0.00 O ATOM 1070 OD2 ASP A 70 12.617 -12.237 9.281 1.00 0.00 O ATOM 0 H ASP A 70 9.776 -14.225 9.634 1.00 0.00 H new ATOM 0 HA ASP A 70 11.244 -15.856 11.561 1.00 0.00 H new ATOM 0 HB2 ASP A 70 13.069 -14.235 11.030 1.00 0.00 H new ATOM 0 HB3 ASP A 70 12.373 -14.871 9.553 1.00 0.00 H new ATOM 1075 N ASN A 71 9.642 -13.284 12.500 1.00 0.00 N ATOM 1076 CA ASN A 71 9.317 -12.411 13.634 1.00 0.00 C ATOM 1077 C ASN A 71 8.434 -13.110 14.676 1.00 0.00 C ATOM 1078 O ASN A 71 8.556 -12.858 15.870 1.00 0.00 O ATOM 1079 CB ASN A 71 8.588 -11.174 13.121 1.00 0.00 C ATOM 1080 CG ASN A 71 8.336 -10.200 14.264 1.00 0.00 C ATOM 1081 OD1 ASN A 71 7.159 -10.157 14.821 1.00 0.00 O flip ATOM 1082 ND2 ASN A 71 9.239 -9.465 14.666 1.00 0.00 N flip ATOM 0 H ASN A 71 8.944 -13.290 11.756 1.00 0.00 H new ATOM 0 HA ASN A 71 10.255 -12.141 14.119 1.00 0.00 H new ATOM 0 HB2 ASN A 71 9.180 -10.690 12.345 1.00 0.00 H new ATOM 0 HB3 ASN A 71 7.641 -11.464 12.665 1.00 0.00 H new ATOM 0 HD21 ASN A 71 10.159 -9.501 14.228 1.00 0.00 H new ATOM 0 HD22 ASN A 71 9.066 -8.820 15.437 1.00 0.00 H new ATOM 1089 N LEU A 72 7.536 -13.986 14.218 1.00 0.00 N ATOM 1090 CA LEU A 72 6.626 -14.700 15.131 1.00 0.00 C ATOM 1091 C LEU A 72 7.148 -16.106 15.456 1.00 0.00 C ATOM 1092 O LEU A 72 6.864 -16.650 16.522 1.00 0.00 O ATOM 1093 CB LEU A 72 5.219 -14.791 14.488 1.00 0.00 C ATOM 1094 CG LEU A 72 4.330 -13.614 14.975 1.00 0.00 C ATOM 1095 CD1 LEU A 72 4.035 -13.759 16.494 1.00 0.00 C ATOM 1096 CD2 LEU A 72 5.060 -12.275 14.708 1.00 0.00 C ATOM 0 H LEU A 72 7.416 -14.219 13.232 1.00 0.00 H new ATOM 0 HA LEU A 72 6.569 -14.143 16.066 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.305 -14.766 13.402 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.753 -15.741 14.749 1.00 0.00 H new ATOM 0 HG LEU A 72 3.385 -13.629 14.431 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.411 -12.928 16.824 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.514 -14.699 16.675 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.973 -13.751 17.049 1.00 0.00 H new ATOM 0 HD21 LEU A 72 4.438 -11.447 15.049 1.00 0.00 H new ATOM 0 HD22 LEU A 72 6.007 -12.263 15.247 1.00 0.00 H new ATOM 0 HD23 LEU A 72 5.249 -12.171 13.640 1.00 0.00 H new ATOM 1108 N ASN A 73 7.912 -16.689 14.531 1.00 0.00 N ATOM 1109 CA ASN A 73 8.463 -18.027 14.742 1.00 0.00 C ATOM 1110 C ASN A 73 9.423 -18.029 15.924 1.00 0.00 C ATOM 1111 O ASN A 73 10.325 -17.194 16.005 1.00 0.00 O ATOM 1112 CB ASN A 73 9.199 -18.496 13.486 1.00 0.00 C ATOM 1113 CG ASN A 73 9.824 -19.865 13.720 1.00 0.00 C ATOM 1114 OD1 ASN A 73 10.654 -20.025 14.615 1.00 0.00 O ATOM 1115 ND2 ASN A 73 9.478 -20.870 12.963 1.00 0.00 N ATOM 0 H ASN A 73 8.161 -16.261 13.639 1.00 0.00 H new ATOM 0 HA ASN A 73 7.639 -18.708 14.954 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.506 -18.544 12.646 1.00 0.00 H new ATOM 0 HB3 ASN A 73 9.973 -17.776 13.220 1.00 0.00 H new ATOM 0 HD21 ASN A 73 9.895 -21.789 13.113 1.00 0.00 H new ATOM 0 HD22 ASN A 73 8.790 -20.737 12.222 1.00 0.00 H new ATOM 1122 N GLY A 74 9.228 -18.972 16.840 1.00 0.00 N ATOM 1123 CA GLY A 74 10.085 -19.073 18.019 1.00 0.00 C ATOM 1124 C GLY A 74 9.500 -18.286 19.188 1.00 0.00 C ATOM 1125 O GLY A 74 10.108 -18.203 20.255 1.00 0.00 O ATOM 0 H GLY A 74 8.489 -19.674 16.791 1.00 0.00 H new ATOM 0 HA2 GLY A 74 10.200 -20.120 18.301 1.00 0.00 H new ATOM 0 HA3 GLY A 74 11.080 -18.696 17.783 1.00 0.00 H new ATOM 1129 N PHE A 75 8.315 -17.709 18.983 1.00 0.00 N ATOM 1130 CA PHE A 75 7.650 -16.932 20.033 1.00 0.00 C ATOM 1131 C PHE A 75 6.470 -17.716 20.597 1.00 0.00 C ATOM 1132 O PHE A 75 5.588 -18.148 19.857 1.00 0.00 O ATOM 1133 CB PHE A 75 7.168 -15.584 19.480 1.00 0.00 C ATOM 1134 CG PHE A 75 6.541 -14.760 20.593 1.00 0.00 C ATOM 1135 CD1 PHE A 75 7.274 -14.470 21.757 1.00 0.00 C ATOM 1136 CD2 PHE A 75 5.228 -14.288 20.464 1.00 0.00 C ATOM 1137 CE1 PHE A 75 6.694 -13.715 22.782 1.00 0.00 C ATOM 1138 CE2 PHE A 75 4.652 -13.530 21.492 1.00 0.00 C ATOM 1139 CZ PHE A 75 5.383 -13.247 22.650 1.00 0.00 C ATOM 0 H PHE A 75 7.798 -17.764 18.106 1.00 0.00 H new ATOM 0 HA PHE A 75 8.367 -16.744 20.832 1.00 0.00 H new ATOM 0 HB2 PHE A 75 8.005 -15.041 19.042 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.442 -15.747 18.684 1.00 0.00 H new ATOM 0 HD1 PHE A 75 8.287 -14.831 21.860 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.660 -14.508 19.572 1.00 0.00 H new ATOM 0 HE1 PHE A 75 7.259 -13.494 23.675 1.00 0.00 H new ATOM 0 HE2 PHE A 75 3.641 -13.163 21.390 1.00 0.00 H new ATOM 0 HZ PHE A 75 4.935 -12.667 23.443 1.00 0.00 H new ATOM 1149 N LYS A 76 6.461 -17.900 21.913 1.00 0.00 N ATOM 1150 CA LYS A 76 5.389 -18.642 22.566 1.00 0.00 C ATOM 1151 C LYS A 76 4.220 -17.726 22.932 1.00 0.00 C ATOM 1152 O LYS A 76 4.420 -16.660 23.515 1.00 0.00 O ATOM 1153 CB LYS A 76 5.931 -19.313 23.823 1.00 0.00 C ATOM 1154 CG LYS A 76 4.890 -20.294 24.369 1.00 0.00 C ATOM 1155 CD LYS A 76 5.470 -21.045 25.579 1.00 0.00 C ATOM 1156 CE LYS A 76 6.354 -22.207 25.100 1.00 0.00 C ATOM 1157 NZ LYS A 76 6.824 -22.997 26.275 1.00 0.00 N ATOM 0 H LYS A 76 7.180 -17.548 22.545 1.00 0.00 H new ATOM 0 HA LYS A 76 5.020 -19.396 21.870 1.00 0.00 H new ATOM 0 HB2 LYS A 76 6.858 -19.839 23.596 1.00 0.00 H new ATOM 0 HB3 LYS A 76 6.168 -18.561 24.576 1.00 0.00 H new ATOM 0 HG2 LYS A 76 3.988 -19.757 24.661 1.00 0.00 H new ATOM 0 HG3 LYS A 76 4.602 -21.003 23.593 1.00 0.00 H new ATOM 0 HD2 LYS A 76 6.055 -20.362 26.195 1.00 0.00 H new ATOM 0 HD3 LYS A 76 4.662 -21.425 26.203 1.00 0.00 H new ATOM 0 HE2 LYS A 76 5.793 -22.847 24.420 1.00 0.00 H new ATOM 0 HE3 LYS A 76 7.208 -21.822 24.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 7.422 -23.783 25.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.375 -22.383 26.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 6.003 -23.377 26.789 1.00 0.00 H new ATOM 1171 N ILE A 77 2.999 -18.147 22.585 1.00 0.00 N ATOM 1172 CA ILE A 77 1.792 -17.364 22.888 1.00 0.00 C ATOM 1173 C ILE A 77 0.716 -18.248 23.526 1.00 0.00 C ATOM 1174 O ILE A 77 0.343 -19.284 22.975 1.00 0.00 O ATOM 1175 CB ILE A 77 1.239 -16.713 21.606 1.00 0.00 C ATOM 1176 CG1 ILE A 77 2.158 -15.563 21.169 1.00 0.00 C ATOM 1177 CG2 ILE A 77 -0.174 -16.167 21.863 1.00 0.00 C ATOM 1178 CD1 ILE A 77 1.769 -15.079 19.759 1.00 0.00 C ATOM 0 H ILE A 77 2.819 -19.023 22.095 1.00 0.00 H new ATOM 0 HA ILE A 77 2.066 -16.582 23.596 1.00 0.00 H new ATOM 0 HB ILE A 77 1.197 -17.465 20.818 1.00 0.00 H new ATOM 0 HG12 ILE A 77 2.084 -14.739 21.878 1.00 0.00 H new ATOM 0 HG13 ILE A 77 3.196 -15.895 21.174 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.558 -15.708 20.952 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.831 -16.984 22.163 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.137 -15.421 22.657 1.00 0.00 H new ATOM 0 HD11 ILE A 77 2.427 -14.263 19.460 1.00 0.00 H new ATOM 0 HD12 ILE A 77 1.867 -15.903 19.052 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.737 -14.728 19.767 1.00 0.00 H new ATOM 1190 N GLY A 78 0.220 -17.829 24.686 1.00 0.00 N ATOM 1191 CA GLY A 78 -0.820 -18.585 25.379 1.00 0.00 C ATOM 1192 C GLY A 78 -0.299 -19.943 25.830 1.00 0.00 C ATOM 1193 O GLY A 78 -1.069 -20.887 26.008 1.00 0.00 O ATOM 0 H GLY A 78 0.517 -16.978 25.163 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -1.170 -18.021 26.243 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.677 -18.721 24.719 1.00 0.00 H new ATOM 1197 N GLY A 79 1.014 -20.039 26.012 1.00 0.00 N ATOM 1198 CA GLY A 79 1.630 -21.292 26.442 1.00 0.00 C ATOM 1199 C GLY A 79 2.000 -22.157 25.245 1.00 0.00 C ATOM 1200 O GLY A 79 2.701 -23.160 25.385 1.00 0.00 O ATOM 0 H GLY A 79 1.669 -19.271 25.870 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.522 -21.079 27.031 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.942 -21.836 27.090 1.00 0.00 H new ATOM 1204 N ARG A 80 1.526 -21.765 24.060 1.00 0.00 N ATOM 1205 CA ARG A 80 1.810 -22.516 22.835 1.00 0.00 C ATOM 1206 C ARG A 80 2.424 -21.597 21.775 1.00 0.00 C ATOM 1207 O ARG A 80 2.091 -20.417 21.694 1.00 0.00 O ATOM 1208 CB ARG A 80 0.503 -23.156 22.293 1.00 0.00 C ATOM 1209 CG ARG A 80 0.520 -24.680 22.540 1.00 0.00 C ATOM 1210 CD ARG A 80 0.565 -24.970 24.057 1.00 0.00 C ATOM 1211 NE ARG A 80 1.891 -25.438 24.443 1.00 0.00 N ATOM 1212 CZ ARG A 80 2.170 -25.749 25.704 1.00 0.00 C ATOM 1213 NH1 ARG A 80 1.248 -25.640 26.622 1.00 0.00 N ATOM 1214 NH2 ARG A 80 3.365 -26.164 26.025 1.00 0.00 N ATOM 0 H ARG A 80 0.947 -20.937 23.923 1.00 0.00 H new ATOM 0 HA ARG A 80 2.525 -23.306 23.066 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -0.361 -22.709 22.784 1.00 0.00 H new ATOM 0 HB3 ARG A 80 0.404 -22.953 21.227 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -0.366 -25.138 22.100 1.00 0.00 H new ATOM 0 HG3 ARG A 80 1.386 -25.126 22.050 1.00 0.00 H new ATOM 0 HD2 ARG A 80 0.314 -24.068 24.614 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -0.182 -25.721 24.313 1.00 0.00 H new ATOM 0 HE ARG A 80 2.617 -25.528 23.732 1.00 0.00 H new ATOM 0 HH11 ARG A 80 0.314 -25.316 26.371 1.00 0.00 H new ATOM 0 HH12 ARG A 80 1.462 -25.879 27.590 1.00 0.00 H new ATOM 0 HH21 ARG A 80 4.085 -26.250 25.308 1.00 0.00 H new ATOM 0 HH22 ARG A 80 3.579 -26.403 26.993 1.00 0.00 H new ATOM 1228 N ALA A 81 3.320 -22.151 20.962 1.00 0.00 N ATOM 1229 CA ALA A 81 3.971 -21.374 19.906 1.00 0.00 C ATOM 1230 C ALA A 81 3.305 -21.633 18.559 1.00 0.00 C ATOM 1231 O ALA A 81 3.165 -22.780 18.138 1.00 0.00 O ATOM 1232 CB ALA A 81 5.454 -21.745 19.822 1.00 0.00 C ATOM 0 H ALA A 81 3.611 -23.127 21.012 1.00 0.00 H new ATOM 0 HA ALA A 81 3.873 -20.316 20.149 1.00 0.00 H new ATOM 0 HB1 ALA A 81 5.931 -21.162 19.034 1.00 0.00 H new ATOM 0 HB2 ALA A 81 5.937 -21.530 20.775 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.551 -22.807 19.597 1.00 0.00 H new ATOM 1238 N LEU A 82 2.900 -20.554 17.889 1.00 0.00 N ATOM 1239 CA LEU A 82 2.251 -20.662 16.585 1.00 0.00 C ATOM 1240 C LEU A 82 3.282 -21.041 15.520 1.00 0.00 C ATOM 1241 O LEU A 82 4.461 -20.708 15.638 1.00 0.00 O ATOM 1242 CB LEU A 82 1.560 -19.323 16.207 1.00 0.00 C ATOM 1243 CG LEU A 82 2.279 -18.146 16.890 1.00 0.00 C ATOM 1244 CD1 LEU A 82 3.758 -18.129 16.469 1.00 0.00 C ATOM 1245 CD2 LEU A 82 1.615 -16.827 16.477 1.00 0.00 C ATOM 0 H LEU A 82 3.010 -19.598 18.228 1.00 0.00 H new ATOM 0 HA LEU A 82 1.490 -21.440 16.638 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.575 -19.190 15.125 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.514 -19.346 16.511 1.00 0.00 H new ATOM 0 HG LEU A 82 2.212 -18.263 17.972 1.00 0.00 H new ATOM 0 HD11 LEU A 82 4.265 -17.295 16.954 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.232 -19.064 16.767 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.827 -18.016 15.387 1.00 0.00 H new ATOM 0 HD21 LEU A 82 2.126 -15.995 16.962 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.678 -16.711 15.395 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.568 -16.836 16.780 1.00 0.00 H new ATOM 1257 N LYS A 83 2.830 -21.739 14.475 1.00 0.00 N ATOM 1258 CA LYS A 83 3.726 -22.159 13.391 1.00 0.00 C ATOM 1259 C LYS A 83 3.415 -21.401 12.103 1.00 0.00 C ATOM 1260 O LYS A 83 2.280 -21.420 11.621 1.00 0.00 O ATOM 1261 CB LYS A 83 3.576 -23.667 13.140 1.00 0.00 C ATOM 1262 CG LYS A 83 4.751 -24.177 12.279 1.00 0.00 C ATOM 1263 CD LYS A 83 5.935 -24.557 13.182 1.00 0.00 C ATOM 1264 CE LYS A 83 7.071 -25.132 12.334 1.00 0.00 C ATOM 1265 NZ LYS A 83 7.584 -24.081 11.411 1.00 0.00 N ATOM 0 H LYS A 83 1.858 -22.024 14.355 1.00 0.00 H new ATOM 0 HA LYS A 83 4.749 -21.936 13.692 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.551 -24.202 14.090 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.631 -23.868 12.636 1.00 0.00 H new ATOM 0 HG2 LYS A 83 4.436 -25.041 11.694 1.00 0.00 H new ATOM 0 HG3 LYS A 83 5.055 -23.407 11.571 1.00 0.00 H new ATOM 0 HD2 LYS A 83 6.284 -23.680 13.727 1.00 0.00 H new ATOM 0 HD3 LYS A 83 5.617 -25.289 13.925 1.00 0.00 H new ATOM 0 HE2 LYS A 83 7.875 -25.489 12.978 1.00 0.00 H new ATOM 0 HE3 LYS A 83 6.715 -25.990 11.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 8.539 -24.338 11.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 6.951 -24.001 10.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 7.621 -23.169 11.909 1.00 0.00 H new ATOM 1279 N ILE A 84 4.428 -20.729 11.548 1.00 0.00 N ATOM 1280 CA ILE A 84 4.248 -19.959 10.310 1.00 0.00 C ATOM 1281 C ILE A 84 4.865 -20.711 9.132 1.00 0.00 C ATOM 1282 O ILE A 84 6.081 -20.881 9.062 1.00 0.00 O ATOM 1283 CB ILE A 84 4.912 -18.569 10.443 1.00 0.00 C ATOM 1284 CG1 ILE A 84 4.718 -18.028 11.883 1.00 0.00 C ATOM 1285 CG2 ILE A 84 4.267 -17.594 9.440 1.00 0.00 C ATOM 1286 CD1 ILE A 84 3.224 -17.857 12.191 1.00 0.00 C ATOM 0 H ILE A 84 5.373 -20.701 11.931 1.00 0.00 H new ATOM 0 HA ILE A 84 3.180 -19.828 10.134 1.00 0.00 H new ATOM 0 HB ILE A 84 5.978 -18.660 10.233 1.00 0.00 H new ATOM 0 HG12 ILE A 84 5.168 -18.714 12.600 1.00 0.00 H new ATOM 0 HG13 ILE A 84 5.230 -17.072 11.992 1.00 0.00 H new ATOM 0 HG21 ILE A 84 4.735 -16.614 9.533 1.00 0.00 H new ATOM 0 HG22 ILE A 84 4.408 -17.969 8.426 1.00 0.00 H new ATOM 0 HG23 ILE A 84 3.201 -17.509 9.650 1.00 0.00 H new ATOM 0 HD11 ILE A 84 3.103 -17.477 13.205 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.785 -17.153 11.484 1.00 0.00 H new ATOM 0 HD13 ILE A 84 2.722 -18.820 12.102 1.00 0.00 H new ATOM 1298 N ASP A 85 4.019 -21.162 8.207 1.00 0.00 N ATOM 1299 CA ASP A 85 4.495 -21.896 7.028 1.00 0.00 C ATOM 1300 C ASP A 85 3.877 -21.324 5.756 1.00 0.00 C ATOM 1301 O ASP A 85 2.718 -20.908 5.749 1.00 0.00 O ATOM 1302 CB ASP A 85 4.132 -23.375 7.151 1.00 0.00 C ATOM 1303 CG ASP A 85 4.767 -23.967 8.404 1.00 0.00 C ATOM 1304 OD1 ASP A 85 5.844 -23.522 8.766 1.00 0.00 O ATOM 1305 OD2 ASP A 85 4.165 -24.856 8.984 1.00 0.00 O ATOM 0 H ASP A 85 3.008 -21.035 8.247 1.00 0.00 H new ATOM 0 HA ASP A 85 5.579 -21.792 6.972 1.00 0.00 H new ATOM 0 HB2 ASP A 85 3.049 -23.489 7.194 1.00 0.00 H new ATOM 0 HB3 ASP A 85 4.475 -23.916 6.269 1.00 0.00 H new ATOM 1310 N HIS A 86 4.655 -21.307 4.682 1.00 0.00 N ATOM 1311 CA HIS A 86 4.172 -20.786 3.410 1.00 0.00 C ATOM 1312 C HIS A 86 3.209 -21.777 2.761 1.00 0.00 C ATOM 1313 O HIS A 86 3.391 -22.989 2.866 1.00 0.00 O ATOM 1314 CB HIS A 86 5.353 -20.532 2.471 1.00 0.00 C ATOM 1315 CG HIS A 86 6.208 -19.427 3.027 1.00 0.00 C ATOM 1316 ND1 HIS A 86 6.492 -18.276 2.310 1.00 0.00 N ATOM 1317 CD2 HIS A 86 6.848 -19.285 4.235 1.00 0.00 C ATOM 1318 CE1 HIS A 86 7.274 -17.500 3.083 1.00 0.00 C ATOM 1319 NE2 HIS A 86 7.520 -18.066 4.267 1.00 0.00 N ATOM 0 H HIS A 86 5.617 -21.646 4.665 1.00 0.00 H new ATOM 0 HA HIS A 86 3.646 -19.850 3.595 1.00 0.00 H new ATOM 0 HB2 HIS A 86 5.943 -21.441 2.358 1.00 0.00 H new ATOM 0 HB3 HIS A 86 4.991 -20.262 1.479 1.00 0.00 H new ATOM 0 HD1 HIS A 86 6.168 -18.057 1.368 1.00 0.00 H new ATOM 0 HD2 HIS A 86 6.832 -20.008 5.037 1.00 0.00 H new ATOM 0 HE1 HIS A 86 7.656 -16.536 2.782 1.00 0.00 H new ATOM 1328 N THR A 87 2.181 -21.256 2.084 1.00 0.00 N ATOM 1329 CA THR A 87 1.192 -22.116 1.417 1.00 0.00 C ATOM 1330 C THR A 87 1.212 -21.874 -0.090 1.00 0.00 C ATOM 1331 O THR A 87 1.942 -21.011 -0.578 1.00 0.00 O ATOM 1332 CB THR A 87 -0.209 -21.826 1.960 1.00 0.00 C ATOM 1333 OG1 THR A 87 -0.778 -20.751 1.235 1.00 0.00 O ATOM 1334 CG2 THR A 87 -0.122 -21.450 3.440 1.00 0.00 C ATOM 0 H THR A 87 2.011 -20.255 1.982 1.00 0.00 H new ATOM 0 HA THR A 87 1.448 -23.156 1.616 1.00 0.00 H new ATOM 0 HB THR A 87 -0.831 -22.715 1.850 1.00 0.00 H new ATOM 0 HG1 THR A 87 -1.634 -21.033 0.851 1.00 0.00 H new ATOM 0 HG21 THR A 87 -1.122 -21.244 3.823 1.00 0.00 H new ATOM 0 HG22 THR A 87 0.318 -22.275 4.000 1.00 0.00 H new ATOM 0 HG23 THR A 87 0.500 -20.562 3.554 1.00 0.00 H new ATOM 1342 N PHE A 88 0.409 -22.642 -0.820 1.00 0.00 N ATOM 1343 CA PHE A 88 0.343 -22.502 -2.271 1.00 0.00 C ATOM 1344 C PHE A 88 -0.956 -23.100 -2.811 1.00 0.00 C ATOM 1345 O PHE A 88 -0.996 -23.611 -3.929 1.00 0.00 O ATOM 1346 CB PHE A 88 1.544 -23.199 -2.916 1.00 0.00 C ATOM 1347 CG PHE A 88 1.559 -22.913 -4.402 1.00 0.00 C ATOM 1348 CD1 PHE A 88 1.947 -21.650 -4.867 1.00 0.00 C ATOM 1349 CD2 PHE A 88 1.185 -23.909 -5.312 1.00 0.00 C ATOM 1350 CE1 PHE A 88 1.960 -21.385 -6.241 1.00 0.00 C ATOM 1351 CE2 PHE A 88 1.198 -23.643 -6.686 1.00 0.00 C ATOM 1352 CZ PHE A 88 1.585 -22.382 -7.151 1.00 0.00 C ATOM 0 H PHE A 88 -0.201 -23.363 -0.434 1.00 0.00 H new ATOM 0 HA PHE A 88 0.366 -21.441 -2.519 1.00 0.00 H new ATOM 0 HB2 PHE A 88 2.469 -22.849 -2.459 1.00 0.00 H new ATOM 0 HB3 PHE A 88 1.490 -24.274 -2.743 1.00 0.00 H new ATOM 0 HD1 PHE A 88 2.236 -20.881 -4.166 1.00 0.00 H new ATOM 0 HD2 PHE A 88 0.886 -24.883 -4.954 1.00 0.00 H new ATOM 0 HE1 PHE A 88 2.259 -20.411 -6.600 1.00 0.00 H new ATOM 0 HE2 PHE A 88 0.909 -24.412 -7.387 1.00 0.00 H new ATOM 0 HZ PHE A 88 1.595 -22.177 -8.211 1.00 0.00 H new ATOM 1362 N TYR A 89 -2.022 -23.035 -2.011 1.00 0.00 N ATOM 1363 CA TYR A 89 -3.320 -23.577 -2.426 1.00 0.00 C ATOM 1364 C TYR A 89 -4.202 -22.466 -2.997 1.00 0.00 C ATOM 1365 O TYR A 89 -4.320 -21.394 -2.405 1.00 0.00 O ATOM 1366 CB TYR A 89 -4.024 -24.236 -1.223 1.00 0.00 C ATOM 1367 CG TYR A 89 -4.676 -23.175 -0.357 1.00 0.00 C ATOM 1368 CD1 TYR A 89 -3.926 -22.499 0.611 1.00 0.00 C ATOM 1369 CD2 TYR A 89 -6.030 -22.865 -0.533 1.00 0.00 C ATOM 1370 CE1 TYR A 89 -4.528 -21.513 1.402 1.00 0.00 C ATOM 1371 CE2 TYR A 89 -6.633 -21.880 0.258 1.00 0.00 C ATOM 1372 CZ TYR A 89 -5.881 -21.205 1.226 1.00 0.00 C ATOM 1373 OH TYR A 89 -6.475 -20.234 2.005 1.00 0.00 O ATOM 0 H TYR A 89 -2.015 -22.617 -1.081 1.00 0.00 H new ATOM 0 HA TYR A 89 -3.154 -24.327 -3.199 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -4.776 -24.943 -1.574 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -3.302 -24.804 -0.635 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -2.882 -22.738 0.748 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -6.610 -23.387 -1.280 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -3.948 -20.990 2.148 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -7.677 -21.641 0.121 1.00 0.00 H new ATOM 0 HH TYR A 89 -6.041 -19.371 1.840 1.00 0.00 H new ATOM 2031 N PHE B 311 12.079 -3.997 6.376 1.00 0.00 N ATOM 2032 CA PHE B 311 11.079 -3.864 5.315 1.00 0.00 C ATOM 2033 C PHE B 311 10.486 -2.459 5.303 1.00 0.00 C ATOM 2034 O PHE B 311 10.467 -1.772 6.324 1.00 0.00 O ATOM 2035 CB PHE B 311 9.962 -4.888 5.519 1.00 0.00 C ATOM 2036 CG PHE B 311 10.489 -6.271 5.228 1.00 0.00 C ATOM 2037 CD1 PHE B 311 11.203 -6.969 6.209 1.00 0.00 C ATOM 2038 CD2 PHE B 311 10.266 -6.857 3.976 1.00 0.00 C ATOM 2039 CE1 PHE B 311 11.693 -8.252 5.939 1.00 0.00 C ATOM 2040 CE2 PHE B 311 10.755 -8.140 3.707 1.00 0.00 C ATOM 2041 CZ PHE B 311 11.469 -8.838 4.690 1.00 0.00 C ATOM 0 HA PHE B 311 11.570 -4.045 4.359 1.00 0.00 H new ATOM 0 HB2 PHE B 311 9.590 -4.837 6.542 1.00 0.00 H new ATOM 0 HB3 PHE B 311 9.122 -4.662 4.862 1.00 0.00 H new ATOM 0 HD1 PHE B 311 11.376 -6.517 7.175 1.00 0.00 H new ATOM 0 HD2 PHE B 311 9.717 -6.319 3.218 1.00 0.00 H new ATOM 0 HE1 PHE B 311 12.244 -8.789 6.696 1.00 0.00 H new ATOM 0 HE2 PHE B 311 10.582 -8.592 2.742 1.00 0.00 H new ATOM 0 HZ PHE B 311 11.846 -9.829 4.483 1.00 0.00 H new ATOM 2051 N ALA B 312 10.000 -2.035 4.142 1.00 0.00 N ATOM 2052 CA ALA B 312 9.403 -0.707 4.005 1.00 0.00 C ATOM 2053 C ALA B 312 7.902 -0.764 4.281 1.00 0.00 C ATOM 2054 O ALA B 312 7.139 0.064 3.783 1.00 0.00 O ATOM 2055 CB ALA B 312 9.647 -0.168 2.595 1.00 0.00 C ATOM 0 H ALA B 312 10.006 -2.587 3.284 1.00 0.00 H new ATOM 0 HA ALA B 312 9.869 -0.042 4.732 1.00 0.00 H new ATOM 0 HB1 ALA B 312 9.199 0.821 2.501 1.00 0.00 H new ATOM 0 HB2 ALA B 312 10.719 -0.100 2.412 1.00 0.00 H new ATOM 0 HB3 ALA B 312 9.197 -0.841 1.865 1.00 0.00 H new ATOM 2061 N ILE B 313 7.481 -1.749 5.074 1.00 0.00 N ATOM 2062 CA ILE B 313 6.060 -1.900 5.408 1.00 0.00 C ATOM 2063 C ILE B 313 5.748 -1.262 6.759 1.00 0.00 C ATOM 2064 O ILE B 313 6.272 -1.680 7.790 1.00 0.00 O ATOM 2065 CB ILE B 313 5.695 -3.387 5.449 1.00 0.00 C ATOM 2066 CG1 ILE B 313 5.864 -3.999 4.052 1.00 0.00 C ATOM 2067 CG2 ILE B 313 4.240 -3.545 5.902 1.00 0.00 C ATOM 2068 CD1 ILE B 313 5.782 -5.531 4.139 1.00 0.00 C ATOM 0 H ILE B 313 8.093 -2.448 5.494 1.00 0.00 H new ATOM 0 HA ILE B 313 5.471 -1.396 4.641 1.00 0.00 H new ATOM 0 HB ILE B 313 6.353 -3.900 6.151 1.00 0.00 H new ATOM 0 HG12 ILE B 313 5.089 -3.622 3.384 1.00 0.00 H new ATOM 0 HG13 ILE B 313 6.823 -3.701 3.628 1.00 0.00 H new ATOM 0 HG21 ILE B 313 3.981 -4.603 5.931 1.00 0.00 H new ATOM 0 HG22 ILE B 313 4.120 -3.115 6.896 1.00 0.00 H new ATOM 0 HG23 ILE B 313 3.583 -3.030 5.202 1.00 0.00 H new ATOM 0 HD11 ILE B 313 5.903 -5.959 3.144 1.00 0.00 H new ATOM 0 HD12 ILE B 313 6.573 -5.901 4.792 1.00 0.00 H new ATOM 0 HD13 ILE B 313 4.812 -5.821 4.543 1.00 0.00 H new ATOM 2080 N MET B 314 4.884 -0.242 6.747 1.00 0.00 N ATOM 2081 CA MET B 314 4.506 0.449 7.983 1.00 0.00 C ATOM 2082 C MET B 314 3.232 -0.166 8.589 1.00 0.00 C ATOM 2083 O MET B 314 2.354 -0.622 7.858 1.00 0.00 O ATOM 2084 CB MET B 314 4.271 1.937 7.698 1.00 0.00 C ATOM 2085 CG MET B 314 5.562 2.570 7.170 1.00 0.00 C ATOM 2086 SD MET B 314 6.819 2.560 8.474 1.00 0.00 S ATOM 2087 CE MET B 314 8.169 3.260 7.495 1.00 0.00 C ATOM 0 H MET B 314 4.437 0.120 5.905 1.00 0.00 H new ATOM 0 HA MET B 314 5.320 0.337 8.699 1.00 0.00 H new ATOM 0 HB2 MET B 314 3.471 2.056 6.967 1.00 0.00 H new ATOM 0 HB3 MET B 314 3.950 2.445 8.607 1.00 0.00 H new ATOM 0 HG2 MET B 314 5.921 2.019 6.301 1.00 0.00 H new ATOM 0 HG3 MET B 314 5.371 3.592 6.843 1.00 0.00 H new ATOM 0 HE1 MET B 314 9.062 3.345 8.114 1.00 0.00 H new ATOM 0 HE2 MET B 314 8.377 2.610 6.645 1.00 0.00 H new ATOM 0 HE3 MET B 314 7.883 4.248 7.134 1.00 0.00 H new ATOM 2097 N PRO B 315 3.116 -0.179 9.906 1.00 0.00 N ATOM 2098 CA PRO B 315 1.920 -0.747 10.610 1.00 0.00 C ATOM 2099 C PRO B 315 0.663 0.101 10.391 1.00 0.00 C ATOM 2100 O PRO B 315 0.720 1.330 10.421 1.00 0.00 O ATOM 2101 CB PRO B 315 2.339 -0.745 12.091 1.00 0.00 C ATOM 2102 CG PRO B 315 3.389 0.314 12.205 1.00 0.00 C ATOM 2103 CD PRO B 315 4.112 0.342 10.858 1.00 0.00 C ATOM 0 HA PRO B 315 1.656 -1.737 10.239 1.00 0.00 H new ATOM 0 HB2 PRO B 315 1.490 -0.528 12.739 1.00 0.00 H new ATOM 0 HB3 PRO B 315 2.728 -1.718 12.391 1.00 0.00 H new ATOM 0 HG2 PRO B 315 2.942 1.283 12.428 1.00 0.00 H new ATOM 0 HG3 PRO B 315 4.083 0.089 13.015 1.00 0.00 H new ATOM 0 HD2 PRO B 315 4.425 1.352 10.594 1.00 0.00 H new ATOM 0 HD3 PRO B 315 5.010 -0.276 10.874 1.00 0.00 H new ATOM 2111 N GLY B 316 -0.472 -0.566 10.176 1.00 0.00 N ATOM 2112 CA GLY B 316 -1.738 0.136 9.957 1.00 0.00 C ATOM 2113 C GLY B 316 -2.453 0.407 11.277 1.00 0.00 C ATOM 2114 O GLY B 316 -1.993 -0.015 12.338 1.00 0.00 O ATOM 0 H GLY B 316 -0.541 -1.583 10.149 1.00 0.00 H new ATOM 0 HA2 GLY B 316 -1.550 1.078 9.442 1.00 0.00 H new ATOM 0 HA3 GLY B 316 -2.380 -0.460 9.308 1.00 0.00 H new ATOM 2118 N SER B 317 -3.581 1.108 11.203 1.00 0.00 N ATOM 2119 CA SER B 317 -4.352 1.425 12.402 1.00 0.00 C ATOM 2120 C SER B 317 -4.888 0.150 13.046 1.00 0.00 C ATOM 2121 O SER B 317 -5.173 0.120 14.243 1.00 0.00 O ATOM 2122 CB SER B 317 -5.520 2.345 12.044 1.00 0.00 C ATOM 2123 OG SER B 317 -6.422 1.647 11.193 1.00 0.00 O ATOM 0 H SER B 317 -3.979 1.465 10.334 1.00 0.00 H new ATOM 0 HA SER B 317 -3.695 1.930 13.110 1.00 0.00 H new ATOM 0 HB2 SER B 317 -6.033 2.670 12.949 1.00 0.00 H new ATOM 0 HB3 SER B 317 -5.152 3.242 11.546 1.00 0.00 H new ATOM 0 HG SER B 317 -7.173 2.232 10.962 1.00 0.00 H new ATOM 2129 N ARG B 318 -5.022 -0.902 12.244 1.00 0.00 N ATOM 2130 CA ARG B 318 -5.522 -2.176 12.746 1.00 0.00 C ATOM 2131 C ARG B 318 -4.565 -2.754 13.783 1.00 0.00 C ATOM 2132 O ARG B 318 -4.934 -3.633 14.562 1.00 0.00 O ATOM 2133 CB ARG B 318 -5.699 -3.176 11.589 1.00 0.00 C ATOM 2134 CG ARG B 318 -6.696 -4.294 11.999 1.00 0.00 C ATOM 2135 CD ARG B 318 -8.142 -3.868 11.671 1.00 0.00 C ATOM 2136 NE ARG B 318 -8.632 -2.932 12.676 1.00 0.00 N ATOM 2137 CZ ARG B 318 -9.759 -2.251 12.492 1.00 0.00 C ATOM 2138 NH1 ARG B 318 -10.452 -2.417 11.398 1.00 0.00 N ATOM 2139 NH2 ARG B 318 -10.174 -1.417 13.406 1.00 0.00 N ATOM 0 H ARG B 318 -4.793 -0.898 11.250 1.00 0.00 H new ATOM 0 HA ARG B 318 -6.490 -2.001 13.216 1.00 0.00 H new ATOM 0 HB2 ARG B 318 -6.066 -2.658 10.703 1.00 0.00 H new ATOM 0 HB3 ARG B 318 -4.736 -3.615 11.326 1.00 0.00 H new ATOM 0 HG2 ARG B 318 -6.454 -5.218 11.473 1.00 0.00 H new ATOM 0 HG3 ARG B 318 -6.603 -4.500 13.065 1.00 0.00 H new ATOM 0 HD2 ARG B 318 -8.178 -3.405 10.685 1.00 0.00 H new ATOM 0 HD3 ARG B 318 -8.788 -4.745 11.635 1.00 0.00 H new ATOM 0 HE ARG B 318 -8.100 -2.797 13.536 1.00 0.00 H new ATOM 0 HH11 ARG B 318 -10.129 -3.070 10.684 1.00 0.00 H new ATOM 0 HH12 ARG B 318 -11.316 -1.894 11.258 1.00 0.00 H new ATOM 0 HH21 ARG B 318 -9.634 -1.288 14.261 1.00 0.00 H new ATOM 0 HH22 ARG B 318 -11.039 -0.895 13.265 1.00 0.00 H new ATOM 2153 N TRP B 319 -3.336 -2.256 13.783 1.00 0.00 N ATOM 2154 CA TRP B 319 -2.330 -2.732 14.722 1.00 0.00 C ATOM 2155 C TRP B 319 -2.784 -2.503 16.170 1.00 0.00 C ATOM 2156 O TRP B 319 -2.285 -3.132 17.098 1.00 0.00 O ATOM 2157 CB TRP B 319 -1.002 -2.009 14.464 1.00 0.00 C ATOM 2158 CG TRP B 319 -0.053 -2.313 15.570 1.00 0.00 C ATOM 2159 CD1 TRP B 319 0.108 -3.526 16.137 1.00 0.00 C ATOM 2160 CD2 TRP B 319 0.855 -1.415 16.261 1.00 0.00 C ATOM 2161 NE1 TRP B 319 1.057 -3.431 17.133 1.00 0.00 N ATOM 2162 CE2 TRP B 319 1.546 -2.149 17.247 1.00 0.00 C ATOM 2163 CE3 TRP B 319 1.142 -0.047 16.125 1.00 0.00 C ATOM 2164 CZ2 TRP B 319 2.487 -1.556 18.076 1.00 0.00 C ATOM 2165 CZ3 TRP B 319 2.096 0.560 16.956 1.00 0.00 C ATOM 2166 CH2 TRP B 319 2.768 -0.191 17.931 1.00 0.00 C ATOM 0 H TRP B 319 -3.013 -1.527 13.147 1.00 0.00 H new ATOM 0 HA TRP B 319 -2.193 -3.803 14.574 1.00 0.00 H new ATOM 0 HB2 TRP B 319 -0.581 -2.327 13.510 1.00 0.00 H new ATOM 0 HB3 TRP B 319 -1.167 -0.934 14.397 1.00 0.00 H new ATOM 0 HD1 TRP B 319 -0.420 -4.425 15.857 1.00 0.00 H new ATOM 0 HE1 TRP B 319 1.359 -4.213 17.713 1.00 0.00 H new ATOM 0 HE3 TRP B 319 0.627 0.540 15.379 1.00 0.00 H new ATOM 0 HZ2 TRP B 319 2.998 -2.141 18.826 1.00 0.00 H new ATOM 0 HZ3 TRP B 319 2.314 1.612 16.844 1.00 0.00 H new ATOM 0 HH2 TRP B 319 3.500 0.282 18.569 1.00 0.00 H new ATOM 2177 N ASP B 320 -3.717 -1.594 16.355 1.00 0.00 N ATOM 2178 CA ASP B 320 -4.231 -1.285 17.695 1.00 0.00 C ATOM 2179 C ASP B 320 -3.136 -0.687 18.592 1.00 0.00 C ATOM 2180 O ASP B 320 -3.424 0.080 19.510 1.00 0.00 O ATOM 2181 CB ASP B 320 -4.779 -2.562 18.342 1.00 0.00 C ATOM 2182 CG ASP B 320 -5.735 -2.211 19.481 1.00 0.00 C ATOM 2183 OD1 ASP B 320 -5.938 -1.030 19.715 1.00 0.00 O ATOM 2184 OD2 ASP B 320 -6.249 -3.126 20.102 1.00 0.00 O ATOM 0 H ASP B 320 -4.142 -1.051 15.603 1.00 0.00 H new ATOM 0 HA ASP B 320 -5.026 -0.547 17.590 1.00 0.00 H new ATOM 0 HB2 ASP B 320 -5.298 -3.163 17.595 1.00 0.00 H new ATOM 0 HB3 ASP B 320 -3.956 -3.167 18.722 1.00 0.00 H new ATOM 2189 N GLY B 321 -1.875 -1.038 18.319 1.00 0.00 N ATOM 2190 CA GLY B 321 -0.744 -0.533 19.107 1.00 0.00 C ATOM 2191 C GLY B 321 -0.121 -1.643 19.954 1.00 0.00 C ATOM 2192 O GLY B 321 0.710 -1.379 20.823 1.00 0.00 O ATOM 0 H GLY B 321 -1.612 -1.668 17.561 1.00 0.00 H new ATOM 0 HA2 GLY B 321 0.010 -0.115 18.440 1.00 0.00 H new ATOM 0 HA3 GLY B 321 -1.081 0.276 19.754 1.00 0.00 H new ATOM 2196 N VAL B 322 -0.525 -2.889 19.697 1.00 0.00 N ATOM 2197 CA VAL B 322 0.006 -4.035 20.449 1.00 0.00 C ATOM 2198 C VAL B 322 0.922 -4.879 19.565 1.00 0.00 C ATOM 2199 O VAL B 322 0.483 -5.443 18.561 1.00 0.00 O ATOM 2200 CB VAL B 322 -1.149 -4.900 20.960 1.00 0.00 C ATOM 2201 CG1 VAL B 322 -0.591 -6.061 21.787 1.00 0.00 C ATOM 2202 CG2 VAL B 322 -2.075 -4.048 21.835 1.00 0.00 C ATOM 0 H VAL B 322 -1.211 -3.132 18.982 1.00 0.00 H new ATOM 0 HA VAL B 322 0.582 -3.658 21.294 1.00 0.00 H new ATOM 0 HB VAL B 322 -1.710 -5.295 20.113 1.00 0.00 H new ATOM 0 HG11 VAL B 322 -1.413 -6.677 22.151 1.00 0.00 H new ATOM 0 HG12 VAL B 322 0.068 -6.667 21.165 1.00 0.00 H new ATOM 0 HG13 VAL B 322 -0.030 -5.667 22.635 1.00 0.00 H new ATOM 0 HG21 VAL B 322 -2.898 -4.663 22.200 1.00 0.00 H new ATOM 0 HG22 VAL B 322 -1.514 -3.653 22.682 1.00 0.00 H new ATOM 0 HG23 VAL B 322 -2.473 -3.221 21.246 1.00 0.00 H new ATOM 2212 N HIS B 323 2.204 -4.965 19.938 1.00 0.00 N ATOM 2213 CA HIS B 323 3.185 -5.750 19.171 1.00 0.00 C ATOM 2214 C HIS B 323 3.658 -6.952 19.973 1.00 0.00 C ATOM 2215 O HIS B 323 3.750 -6.894 21.199 1.00 0.00 O ATOM 2216 CB HIS B 323 4.391 -4.883 18.806 1.00 0.00 C ATOM 2217 CG HIS B 323 5.076 -4.418 20.064 1.00 0.00 C ATOM 2218 ND1 HIS B 323 4.726 -3.482 21.005 1.00 0.00 N flip ATOM 2219 CD2 HIS B 323 6.288 -4.942 20.483 1.00 0.00 C flip ATOM 2220 CE1 HIS B 323 5.705 -3.424 21.993 1.00 0.00 C flip ATOM 2221 NE2 HIS B 323 6.623 -4.323 21.629 1.00 0.00 N flip ATOM 0 H HIS B 323 2.588 -4.504 20.763 1.00 0.00 H new ATOM 0 HA HIS B 323 2.698 -6.098 18.260 1.00 0.00 H new ATOM 0 HB2 HIS B 323 5.087 -5.451 18.189 1.00 0.00 H new ATOM 0 HB3 HIS B 323 4.070 -4.025 18.216 1.00 0.00 H new ATOM 0 HD2 HIS B 323 6.860 -5.708 19.981 1.00 0.00 H new ATOM 0 HE1 HIS B 323 5.719 -2.789 22.866 1.00 0.00 H new ATOM 0 HE2 HIS B 323 7.475 -4.517 22.156 1.00 0.00 H new ATOM 2230 N ARG B 324 3.958 -8.042 19.276 1.00 0.00 N ATOM 2231 CA ARG B 324 4.428 -9.260 19.938 1.00 0.00 C ATOM 2232 C ARG B 324 5.952 -9.344 19.863 1.00 0.00 C ATOM 2233 O ARG B 324 6.538 -9.233 18.786 1.00 0.00 O ATOM 2234 CB ARG B 324 3.807 -10.492 19.273 1.00 0.00 C ATOM 2235 CG ARG B 324 2.294 -10.286 19.099 1.00 0.00 C ATOM 2236 CD ARG B 324 1.668 -9.874 20.437 1.00 0.00 C ATOM 2237 NE ARG B 324 2.188 -10.711 21.512 1.00 0.00 N ATOM 2238 CZ ARG B 324 2.026 -10.372 22.786 1.00 0.00 C ATOM 2239 NH1 ARG B 324 1.388 -9.275 23.093 1.00 0.00 N ATOM 2240 NH2 ARG B 324 2.505 -11.134 23.731 1.00 0.00 N ATOM 0 H ARG B 324 3.886 -8.111 18.261 1.00 0.00 H new ATOM 0 HA ARG B 324 4.125 -9.229 20.985 1.00 0.00 H new ATOM 0 HB2 ARG B 324 4.273 -10.666 18.303 1.00 0.00 H new ATOM 0 HB3 ARG B 324 3.995 -11.377 19.880 1.00 0.00 H new ATOM 0 HG2 ARG B 324 2.106 -9.519 18.348 1.00 0.00 H new ATOM 0 HG3 ARG B 324 1.832 -11.205 18.739 1.00 0.00 H new ATOM 0 HD2 ARG B 324 1.887 -8.826 20.643 1.00 0.00 H new ATOM 0 HD3 ARG B 324 0.583 -9.968 20.384 1.00 0.00 H new ATOM 0 HE ARG B 324 2.685 -11.572 21.282 1.00 0.00 H new ATOM 0 HH11 ARG B 324 1.014 -8.679 22.355 1.00 0.00 H new ATOM 0 HH12 ARG B 324 1.263 -9.014 24.071 1.00 0.00 H new ATOM 0 HH21 ARG B 324 3.004 -11.991 23.492 1.00 0.00 H new ATOM 0 HH22 ARG B 324 2.380 -10.873 24.709 1.00 0.00 H new ATOM 2254 N SER B 325 6.588 -9.540 21.013 1.00 0.00 N ATOM 2255 CA SER B 325 8.044 -9.635 21.068 1.00 0.00 C ATOM 2256 C SER B 325 8.503 -11.041 20.707 1.00 0.00 C ATOM 2257 O SER B 325 7.841 -12.020 21.040 1.00 0.00 O ATOM 2258 CB SER B 325 8.538 -9.280 22.470 1.00 0.00 C ATOM 2259 OG SER B 325 9.946 -9.469 22.533 1.00 0.00 O ATOM 0 H SER B 325 6.122 -9.636 21.915 1.00 0.00 H new ATOM 0 HA SER B 325 8.462 -8.932 20.347 1.00 0.00 H new ATOM 0 HB2 SER B 325 8.287 -8.246 22.706 1.00 0.00 H new ATOM 0 HB3 SER B 325 8.042 -9.905 23.212 1.00 0.00 H new ATOM 0 HG SER B 325 10.267 -9.241 23.430 1.00 0.00 H new ATOM 2286 N PHE B 328 15.168 -11.516 20.105 1.00 0.00 N ATOM 2287 CA PHE B 328 15.819 -10.597 21.028 1.00 0.00 C ATOM 2288 C PHE B 328 16.847 -9.744 20.296 1.00 0.00 C ATOM 2289 O PHE B 328 17.203 -8.660 20.752 1.00 0.00 O ATOM 2290 CB PHE B 328 16.501 -11.379 22.152 1.00 0.00 C ATOM 2291 CG PHE B 328 17.574 -12.269 21.567 1.00 0.00 C ATOM 2292 CD1 PHE B 328 17.256 -13.568 21.156 1.00 0.00 C ATOM 2293 CD2 PHE B 328 18.884 -11.794 21.438 1.00 0.00 C ATOM 2294 CE1 PHE B 328 18.248 -14.393 20.614 1.00 0.00 C ATOM 2295 CE2 PHE B 328 19.876 -12.619 20.895 1.00 0.00 C ATOM 2296 CZ PHE B 328 19.559 -13.918 20.484 1.00 0.00 C ATOM 0 HA PHE B 328 15.060 -9.941 21.455 1.00 0.00 H new ATOM 0 HB2 PHE B 328 16.939 -10.691 22.875 1.00 0.00 H new ATOM 0 HB3 PHE B 328 15.767 -11.980 22.688 1.00 0.00 H new ATOM 0 HD1 PHE B 328 16.245 -13.934 21.257 1.00 0.00 H new ATOM 0 HD2 PHE B 328 19.129 -10.792 21.757 1.00 0.00 H new ATOM 0 HE1 PHE B 328 18.003 -15.396 20.296 1.00 0.00 H new ATOM 0 HE2 PHE B 328 20.887 -12.252 20.793 1.00 0.00 H new ATOM 0 HZ PHE B 328 20.325 -14.554 20.067 1.00 0.00 H new ATOM 2306 N GLU B 329 17.321 -10.242 19.160 1.00 0.00 N ATOM 2307 CA GLU B 329 18.313 -9.520 18.371 1.00 0.00 C ATOM 2308 C GLU B 329 17.833 -8.103 18.070 1.00 0.00 C ATOM 2309 O GLU B 329 18.634 -7.218 17.768 1.00 0.00 O ATOM 2310 CB GLU B 329 18.583 -10.262 17.060 1.00 0.00 C ATOM 2311 CG GLU B 329 17.298 -10.323 16.234 1.00 0.00 C ATOM 2312 CD GLU B 329 17.499 -11.226 15.023 1.00 0.00 C ATOM 2313 OE1 GLU B 329 17.264 -12.417 15.151 1.00 0.00 O ATOM 2314 OE2 GLU B 329 17.885 -10.717 13.984 1.00 0.00 O ATOM 0 H GLU B 329 17.036 -11.139 18.766 1.00 0.00 H new ATOM 0 HA GLU B 329 19.235 -9.462 18.949 1.00 0.00 H new ATOM 0 HB2 GLU B 329 19.366 -9.754 16.497 1.00 0.00 H new ATOM 0 HB3 GLU B 329 18.943 -11.270 17.268 1.00 0.00 H new ATOM 0 HG2 GLU B 329 16.479 -10.700 16.847 1.00 0.00 H new ATOM 0 HG3 GLU B 329 17.017 -9.321 15.908 1.00 0.00 H new ATOM 2321 N GLU B 330 16.522 -7.894 18.155 1.00 0.00 N ATOM 2322 CA GLU B 330 15.947 -6.578 17.891 1.00 0.00 C ATOM 2323 C GLU B 330 16.656 -5.505 18.717 1.00 0.00 C ATOM 2324 O GLU B 330 16.570 -4.314 18.414 1.00 0.00 O ATOM 2325 CB GLU B 330 14.453 -6.585 18.226 1.00 0.00 C ATOM 2326 CG GLU B 330 14.262 -6.876 19.718 1.00 0.00 C ATOM 2327 CD GLU B 330 12.775 -6.995 20.040 1.00 0.00 C ATOM 2328 OE1 GLU B 330 11.976 -6.766 19.148 1.00 0.00 O ATOM 2329 OE2 GLU B 330 12.461 -7.311 21.175 1.00 0.00 O ATOM 0 H GLU B 330 15.842 -8.613 18.403 1.00 0.00 H new ATOM 0 HA GLU B 330 16.080 -6.349 16.834 1.00 0.00 H new ATOM 0 HB2 GLU B 330 14.009 -5.622 17.973 1.00 0.00 H new ATOM 0 HB3 GLU B 330 13.940 -7.339 17.629 1.00 0.00 H new ATOM 0 HG2 GLU B 330 14.776 -7.799 19.986 1.00 0.00 H new ATOM 0 HG3 GLU B 330 14.709 -6.079 20.313 1.00 0.00 H new ATOM 2336 N LYS B 331 17.348 -5.934 19.766 1.00 0.00 N ATOM 2337 CA LYS B 331 18.063 -4.999 20.632 1.00 0.00 C ATOM 2338 C LYS B 331 19.008 -4.114 19.816 1.00 0.00 C ATOM 2339 O LYS B 331 19.306 -2.985 20.206 1.00 0.00 O ATOM 2340 CB LYS B 331 18.867 -5.777 21.688 1.00 0.00 C ATOM 2341 CG LYS B 331 19.825 -6.766 21.001 1.00 0.00 C ATOM 2342 CD LYS B 331 20.884 -7.254 22.000 1.00 0.00 C ATOM 2343 CE LYS B 331 20.205 -7.984 23.163 1.00 0.00 C ATOM 2344 NZ LYS B 331 21.236 -8.663 23.999 1.00 0.00 N ATOM 0 H LYS B 331 17.430 -6.914 20.037 1.00 0.00 H new ATOM 0 HA LYS B 331 17.331 -4.361 21.126 1.00 0.00 H new ATOM 0 HB2 LYS B 331 19.433 -5.083 22.310 1.00 0.00 H new ATOM 0 HB3 LYS B 331 18.188 -6.316 22.349 1.00 0.00 H new ATOM 0 HG2 LYS B 331 19.265 -7.615 20.609 1.00 0.00 H new ATOM 0 HG3 LYS B 331 20.309 -6.285 20.151 1.00 0.00 H new ATOM 0 HD2 LYS B 331 21.587 -7.921 21.501 1.00 0.00 H new ATOM 0 HD3 LYS B 331 21.459 -6.408 22.376 1.00 0.00 H new ATOM 0 HE2 LYS B 331 19.640 -7.276 23.769 1.00 0.00 H new ATOM 0 HE3 LYS B 331 19.493 -8.716 22.780 1.00 0.00 H new ATOM 0 HZ1 LYS B 331 20.773 -9.158 24.788 1.00 0.00 H new ATOM 0 HZ2 LYS B 331 21.757 -9.350 23.418 1.00 0.00 H new ATOM 0 HZ3 LYS B 331 21.899 -7.955 24.376 1.00 0.00 H new ATOM 2358 N TRP B 332 19.479 -4.636 18.686 1.00 0.00 N ATOM 2359 CA TRP B 332 20.402 -3.888 17.837 1.00 0.00 C ATOM 2360 C TRP B 332 19.734 -2.616 17.322 1.00 0.00 C ATOM 2361 O TRP B 332 20.286 -1.520 17.436 1.00 0.00 O ATOM 2362 CB TRP B 332 20.836 -4.760 16.652 1.00 0.00 C ATOM 2363 CG TRP B 332 22.068 -4.179 16.029 1.00 0.00 C ATOM 2364 CD1 TRP B 332 23.319 -4.320 16.521 1.00 0.00 C ATOM 2365 CD2 TRP B 332 22.192 -3.378 14.816 1.00 0.00 C ATOM 2366 NE1 TRP B 332 24.205 -3.657 15.692 1.00 0.00 N ATOM 2367 CE2 TRP B 332 23.559 -3.061 14.627 1.00 0.00 C ATOM 2368 CE3 TRP B 332 21.265 -2.902 13.873 1.00 0.00 C ATOM 2369 CZ2 TRP B 332 23.987 -2.296 13.541 1.00 0.00 C ATOM 2370 CZ3 TRP B 332 21.693 -2.133 12.778 1.00 0.00 C ATOM 2371 CH2 TRP B 332 23.052 -1.831 12.613 1.00 0.00 C ATOM 0 H TRP B 332 19.240 -5.565 18.340 1.00 0.00 H new ATOM 0 HA TRP B 332 21.278 -3.613 18.425 1.00 0.00 H new ATOM 0 HB2 TRP B 332 21.031 -5.778 16.988 1.00 0.00 H new ATOM 0 HB3 TRP B 332 20.035 -4.816 15.915 1.00 0.00 H new ATOM 0 HD1 TRP B 332 23.584 -4.863 17.417 1.00 0.00 H new ATOM 0 HE1 TRP B 332 25.212 -3.613 15.848 1.00 0.00 H new ATOM 0 HE3 TRP B 332 20.216 -3.129 13.991 1.00 0.00 H new ATOM 0 HZ2 TRP B 332 25.035 -2.065 13.419 1.00 0.00 H new ATOM 0 HZ3 TRP B 332 20.971 -1.773 12.060 1.00 0.00 H new ATOM 0 HH2 TRP B 332 23.376 -1.239 11.769 1.00 0.00 H new ATOM 2382 N PHE B 333 18.539 -2.768 16.761 1.00 0.00 N ATOM 2383 CA PHE B 333 17.799 -1.626 16.242 1.00 0.00 C ATOM 2384 C PHE B 333 17.411 -0.691 17.384 1.00 0.00 C ATOM 2385 O PHE B 333 17.433 0.531 17.232 1.00 0.00 O ATOM 2386 CB PHE B 333 16.540 -2.106 15.497 1.00 0.00 C ATOM 2387 CG PHE B 333 16.897 -2.490 14.076 1.00 0.00 C ATOM 2388 CD1 PHE B 333 17.072 -1.493 13.108 1.00 0.00 C ATOM 2389 CD2 PHE B 333 17.055 -3.838 13.727 1.00 0.00 C ATOM 2390 CE1 PHE B 333 17.405 -1.840 11.793 1.00 0.00 C ATOM 2391 CE2 PHE B 333 17.389 -4.186 12.412 1.00 0.00 C ATOM 2392 CZ PHE B 333 17.563 -3.188 11.445 1.00 0.00 C ATOM 0 H PHE B 333 18.066 -3.665 16.655 1.00 0.00 H new ATOM 0 HA PHE B 333 18.434 -1.082 15.543 1.00 0.00 H new ATOM 0 HB2 PHE B 333 16.104 -2.960 16.015 1.00 0.00 H new ATOM 0 HB3 PHE B 333 15.787 -1.318 15.492 1.00 0.00 H new ATOM 0 HD1 PHE B 333 16.950 -0.454 13.377 1.00 0.00 H new ATOM 0 HD2 PHE B 333 16.919 -4.608 14.472 1.00 0.00 H new ATOM 0 HE1 PHE B 333 17.540 -1.070 11.048 1.00 0.00 H new ATOM 0 HE2 PHE B 333 17.512 -5.225 12.144 1.00 0.00 H new ATOM 0 HZ PHE B 333 17.819 -3.457 10.431 1.00 0.00 H new ATOM 2402 N ALA B 334 17.051 -1.274 18.523 1.00 0.00 N ATOM 2403 CA ALA B 334 16.661 -0.482 19.682 1.00 0.00 C ATOM 2404 C ALA B 334 17.818 0.400 20.134 1.00 0.00 C ATOM 2405 O ALA B 334 17.622 1.560 20.494 1.00 0.00 O ATOM 2406 CB ALA B 334 16.239 -1.404 20.828 1.00 0.00 C ATOM 0 H ALA B 334 17.021 -2.283 18.667 1.00 0.00 H new ATOM 0 HA ALA B 334 15.820 0.153 19.402 1.00 0.00 H new ATOM 0 HB1 ALA B 334 15.949 -0.803 21.690 1.00 0.00 H new ATOM 0 HB2 ALA B 334 15.394 -2.015 20.511 1.00 0.00 H new ATOM 0 HB3 ALA B 334 17.073 -2.051 21.100 1.00 0.00 H new ATOM 2412 N LYS B 335 19.026 -0.157 20.114 1.00 0.00 N ATOM 2413 CA LYS B 335 20.207 0.592 20.524 1.00 0.00 C ATOM 2414 C LYS B 335 20.405 1.796 19.610 1.00 0.00 C ATOM 2415 O LYS B 335 20.706 2.896 20.076 1.00 0.00 O ATOM 2416 CB LYS B 335 21.457 -0.308 20.478 1.00 0.00 C ATOM 2417 CG LYS B 335 22.691 0.457 21.010 1.00 0.00 C ATOM 2418 CD LYS B 335 22.557 0.679 22.527 1.00 0.00 C ATOM 2419 CE LYS B 335 23.922 1.026 23.125 1.00 0.00 C ATOM 2420 NZ LYS B 335 24.854 -0.120 22.927 1.00 0.00 N ATOM 0 H LYS B 335 19.211 -1.116 19.821 1.00 0.00 H new ATOM 0 HA LYS B 335 20.060 0.938 21.547 1.00 0.00 H new ATOM 0 HB2 LYS B 335 21.290 -1.204 21.076 1.00 0.00 H new ATOM 0 HB3 LYS B 335 21.638 -0.637 19.455 1.00 0.00 H new ATOM 0 HG2 LYS B 335 23.599 -0.106 20.795 1.00 0.00 H new ATOM 0 HG3 LYS B 335 22.783 1.416 20.500 1.00 0.00 H new ATOM 0 HD2 LYS B 335 21.849 1.484 22.724 1.00 0.00 H new ATOM 0 HD3 LYS B 335 22.160 -0.219 23.001 1.00 0.00 H new ATOM 0 HE2 LYS B 335 24.323 1.921 22.650 1.00 0.00 H new ATOM 0 HE3 LYS B 335 23.820 1.247 24.187 1.00 0.00 H new ATOM 0 HZ1 LYS B 335 25.547 -0.142 23.702 1.00 0.00 H new ATOM 0 HZ2 LYS B 335 24.314 -1.009 22.919 1.00 0.00 H new ATOM 0 HZ3 LYS B 335 25.352 -0.010 22.021 1.00 0.00 H new ATOM 2434 N GLN B 336 20.239 1.582 18.309 1.00 0.00 N ATOM 2435 CA GLN B 336 20.413 2.662 17.344 1.00 0.00 C ATOM 2436 C GLN B 336 19.400 3.774 17.599 1.00 0.00 C ATOM 2437 O GLN B 336 19.736 4.957 17.542 1.00 0.00 O ATOM 2438 CB GLN B 336 20.226 2.119 15.924 1.00 0.00 C ATOM 2439 CG GLN B 336 21.391 1.189 15.574 1.00 0.00 C ATOM 2440 CD GLN B 336 22.681 1.991 15.440 1.00 0.00 C ATOM 2441 OE1 GLN B 336 23.499 2.012 16.359 1.00 0.00 O ATOM 2442 NE2 GLN B 336 22.914 2.653 14.339 1.00 0.00 N ATOM 0 H GLN B 336 19.987 0.681 17.902 1.00 0.00 H new ATOM 0 HA GLN B 336 21.418 3.068 17.453 1.00 0.00 H new ATOM 0 HB2 GLN B 336 19.282 1.579 15.851 1.00 0.00 H new ATOM 0 HB3 GLN B 336 20.178 2.943 15.212 1.00 0.00 H new ATOM 0 HG2 GLN B 336 21.505 0.429 16.347 1.00 0.00 H new ATOM 0 HG3 GLN B 336 21.181 0.665 14.641 1.00 0.00 H new ATOM 0 HE21 GLN B 336 22.234 2.634 13.579 1.00 0.00 H new ATOM 0 HE22 GLN B 336 23.776 3.189 14.239 1.00 0.00 H new ATOM 2451 N ASN B 337 18.161 3.387 17.880 1.00 0.00 N ATOM 2452 CA ASN B 337 17.112 4.363 18.150 1.00 0.00 C ATOM 2453 C ASN B 337 17.335 5.042 19.500 1.00 0.00 C ATOM 2454 O ASN B 337 17.175 6.255 19.632 1.00 0.00 O ATOM 2455 CB ASN B 337 15.746 3.673 18.145 1.00 0.00 C ATOM 2456 CG ASN B 337 14.649 4.685 18.460 1.00 0.00 C ATOM 2457 OD1 ASN B 337 14.300 4.878 19.626 1.00 0.00 O ATOM 2458 ND2 ASN B 337 14.080 5.342 17.487 1.00 0.00 N ATOM 0 H ASN B 337 17.860 2.414 17.927 1.00 0.00 H new ATOM 0 HA ASN B 337 17.142 5.122 17.369 1.00 0.00 H new ATOM 0 HB2 ASN B 337 15.563 3.217 17.172 1.00 0.00 H new ATOM 0 HB3 ASN B 337 15.733 2.869 18.881 1.00 0.00 H new ATOM 0 HD21 ASN B 337 13.344 6.018 17.690 1.00 0.00 H new ATOM 0 HD22 ASN B 337 14.371 5.180 16.523 1.00 0.00 H new ATOM 2465 N GLU B 338 17.708 4.249 20.499 1.00 0.00 N ATOM 2466 CA GLU B 338 17.949 4.775 21.837 1.00 0.00 C ATOM 2467 C GLU B 338 19.261 5.558 21.878 1.00 0.00 C ATOM 2468 O GLU B 338 19.534 6.275 22.840 1.00 0.00 O ATOM 2469 CB GLU B 338 17.996 3.628 22.853 1.00 0.00 C ATOM 2470 CG GLU B 338 17.937 4.198 24.273 1.00 0.00 C ATOM 2471 CD GLU B 338 17.867 3.063 25.290 1.00 0.00 C ATOM 2472 OE1 GLU B 338 17.778 1.921 24.869 1.00 0.00 O ATOM 2473 OE2 GLU B 338 17.904 3.352 26.474 1.00 0.00 O ATOM 0 H GLU B 338 17.850 3.243 20.408 1.00 0.00 H new ATOM 0 HA GLU B 338 17.132 5.449 22.095 1.00 0.00 H new ATOM 0 HB2 GLU B 338 17.160 2.948 22.688 1.00 0.00 H new ATOM 0 HB3 GLU B 338 18.910 3.048 22.720 1.00 0.00 H new ATOM 0 HG2 GLU B 338 18.816 4.814 24.463 1.00 0.00 H new ATOM 0 HG3 GLU B 338 17.066 4.845 24.378 1.00 0.00 H new