USER MOD reduce.3.24.130724 H: found=0, std=0, add=882, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 884 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 59 HIS : no HE2:sc= -4.03! C(o=-4!,f=-11!) USER MOD Set 1.2: A 118 THR OG1 : rot 134:sc= 0.0122 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl -149:sc= 0 (180deg=-0.666) USER MOD Single : A 20 ASN : amide:sc= -1.29 K(o=-1.3,f=-4.6!) USER MOD Single : A 23 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.231) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 170:sc= -0.108 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 MET CE :methyl 165:sc= -0.314 (180deg=-0.584) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 116:sc= -4.13! USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 151:sc= 1.46 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 100:sc= -0.032 USER MOD Single : A 63 SER OG : rot -100:sc= -0.502 USER MOD Single : A 75 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 77 LYS NZ :NH3+ 137:sc= -5.4! (180deg=-7.92!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 TYR OH : rot 180:sc= -0.0137 USER MOD Single : A 88 ASN : amide:sc= -0.0316 K(o=-0.032,f=-0.91) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot -130:sc= -1.39 USER MOD Single : A 92 THR OG1 : rot -70:sc= -6.99! USER MOD Single : A 93 TYR OH : rot 165:sc= 0 USER MOD Single : A 96 GLN :FLIP amide:sc= -1.34 F(o=-5.7!,f=-1.3) USER MOD Single : A 97 LYS NZ :NH3+ 163:sc= -0.0265 (180deg=-0.329) USER MOD Single : A 101 THR OG1 : rot 120:sc= -1.49 USER MOD Single : A 102 HIS : no HD1:sc= -0.0602 X(o=-0.06,f=0) USER MOD Single : A 107 THR OG1 : rot -131:sc= -2.4! USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ -142:sc= -0.044 (180deg=-1.49!) USER MOD Single : A 120 THR OG1 : rot -22:sc= 0.481! USER MOD Single : A 121 THR OG1 : rot -16:sc= -1! USER MOD Single : A 135 TYR OH : rot 30:sc= -0.497 USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 THR OG1 : rot 180:sc= -0.405 USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 146 SER OG : rot 180:sc= -0.76 USER MOD Single : A 147 LYS NZ :NH3+ 166:sc=-0.00558 (180deg=-0.168) USER MOD ----------------------------------------------------------------- ATOM 140 N LYS A 11 27.613 -8.520 7.550 1.00 0.00 N ATOM 141 CA LYS A 11 28.276 -7.224 7.500 1.00 0.00 C ATOM 142 C LYS A 11 27.300 -6.118 7.890 1.00 0.00 C ATOM 143 O LYS A 11 26.192 -6.035 7.358 1.00 0.00 O ATOM 144 CB LYS A 11 28.821 -6.967 6.091 1.00 0.00 C ATOM 145 CG LYS A 11 29.857 -5.835 6.119 1.00 0.00 C ATOM 146 CD LYS A 11 31.196 -6.366 6.643 1.00 0.00 C ATOM 147 CE LYS A 11 32.275 -5.295 6.475 1.00 0.00 C ATOM 148 NZ LYS A 11 33.533 -5.761 7.123 1.00 0.00 N ATOM 0 HA LYS A 11 29.106 -7.227 8.207 1.00 0.00 H new ATOM 0 HB2 LYS A 11 29.276 -7.876 5.698 1.00 0.00 H new ATOM 0 HB3 LYS A 11 28.003 -6.704 5.420 1.00 0.00 H new ATOM 0 HG2 LYS A 11 29.986 -5.423 5.118 1.00 0.00 H new ATOM 0 HG3 LYS A 11 29.504 -5.023 6.755 1.00 0.00 H new ATOM 0 HD2 LYS A 11 31.103 -6.641 7.694 1.00 0.00 H new ATOM 0 HD3 LYS A 11 31.478 -7.269 6.101 1.00 0.00 H new ATOM 0 HE2 LYS A 11 32.448 -5.099 5.417 1.00 0.00 H new ATOM 0 HE3 LYS A 11 31.947 -4.357 6.923 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 34.270 -5.036 7.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 33.361 -5.927 8.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 33.847 -6.646 6.675 1.00 0.00 H new ATOM 162 N GLU A 12 27.724 -5.274 8.826 1.00 0.00 N ATOM 163 CA GLU A 12 26.889 -4.173 9.291 1.00 0.00 C ATOM 164 C GLU A 12 26.664 -3.176 8.158 1.00 0.00 C ATOM 165 O GLU A 12 27.546 -2.962 7.325 1.00 0.00 O ATOM 166 CB GLU A 12 27.574 -3.465 10.465 1.00 0.00 C ATOM 167 CG GLU A 12 27.712 -4.436 11.642 1.00 0.00 C ATOM 168 CD GLU A 12 28.938 -5.326 11.452 1.00 0.00 C ATOM 169 OE1 GLU A 12 29.563 -5.228 10.408 1.00 0.00 O ATOM 170 OE2 GLU A 12 29.210 -6.121 12.337 1.00 0.00 O ATOM 0 H GLU A 12 28.638 -5.331 9.276 1.00 0.00 H new ATOM 0 HA GLU A 12 25.928 -4.570 9.617 1.00 0.00 H new ATOM 0 HB2 GLU A 12 28.557 -3.104 10.162 1.00 0.00 H new ATOM 0 HB3 GLU A 12 26.993 -2.593 10.766 1.00 0.00 H new ATOM 0 HG2 GLU A 12 27.800 -3.878 12.574 1.00 0.00 H new ATOM 0 HG3 GLU A 12 26.816 -5.051 11.722 1.00 0.00 H new ATOM 177 N GLY A 13 25.485 -2.569 8.129 1.00 0.00 N ATOM 178 CA GLY A 13 25.164 -1.598 7.090 1.00 0.00 C ATOM 179 C GLY A 13 24.570 -2.279 5.871 1.00 0.00 C ATOM 180 O GLY A 13 24.411 -1.663 4.817 1.00 0.00 O ATOM 0 H GLY A 13 24.740 -2.729 8.807 1.00 0.00 H new ATOM 0 HA2 GLY A 13 24.459 -0.863 7.480 1.00 0.00 H new ATOM 0 HA3 GLY A 13 26.065 -1.055 6.804 1.00 0.00 H new ATOM 184 N GLU A 14 24.236 -3.552 6.013 1.00 0.00 N ATOM 185 CA GLU A 14 23.658 -4.292 4.917 1.00 0.00 C ATOM 186 C GLU A 14 22.278 -4.790 5.296 1.00 0.00 C ATOM 187 O GLU A 14 22.070 -5.287 6.402 1.00 0.00 O ATOM 188 CB GLU A 14 24.547 -5.479 4.565 1.00 0.00 C ATOM 189 CG GLU A 14 25.945 -4.971 4.226 1.00 0.00 C ATOM 190 CD GLU A 14 26.577 -5.855 3.158 1.00 0.00 C ATOM 191 OE1 GLU A 14 25.895 -6.160 2.195 1.00 0.00 O ATOM 192 OE2 GLU A 14 27.732 -6.210 3.316 1.00 0.00 O ATOM 0 H GLU A 14 24.357 -4.086 6.873 1.00 0.00 H new ATOM 0 HA GLU A 14 23.577 -3.632 4.053 1.00 0.00 H new ATOM 0 HB2 GLU A 14 24.593 -6.176 5.402 1.00 0.00 H new ATOM 0 HB3 GLU A 14 24.129 -6.024 3.719 1.00 0.00 H new ATOM 0 HG2 GLU A 14 25.891 -3.942 3.872 1.00 0.00 H new ATOM 0 HG3 GLU A 14 26.567 -4.968 5.121 1.00 0.00 H new ATOM 199 N LYS A 15 21.340 -4.652 4.378 1.00 0.00 N ATOM 200 CA LYS A 15 19.980 -5.096 4.634 1.00 0.00 C ATOM 201 C LYS A 15 19.971 -6.590 4.927 1.00 0.00 C ATOM 202 O LYS A 15 20.353 -7.400 4.082 1.00 0.00 O ATOM 203 CB LYS A 15 19.099 -4.802 3.413 1.00 0.00 C ATOM 204 CG LYS A 15 17.626 -4.652 3.846 1.00 0.00 C ATOM 205 CD LYS A 15 16.708 -5.672 3.146 1.00 0.00 C ATOM 206 CE LYS A 15 15.906 -4.970 2.050 1.00 0.00 C ATOM 207 NZ LYS A 15 15.013 -5.958 1.383 1.00 0.00 N ATOM 0 H LYS A 15 21.491 -4.241 3.457 1.00 0.00 H new ATOM 0 HA LYS A 15 19.586 -4.560 5.497 1.00 0.00 H new ATOM 0 HB2 LYS A 15 19.437 -3.889 2.922 1.00 0.00 H new ATOM 0 HB3 LYS A 15 19.192 -5.608 2.685 1.00 0.00 H new ATOM 0 HG2 LYS A 15 17.552 -4.780 4.926 1.00 0.00 H new ATOM 0 HG3 LYS A 15 17.283 -3.642 3.620 1.00 0.00 H new ATOM 0 HD2 LYS A 15 17.303 -6.478 2.716 1.00 0.00 H new ATOM 0 HD3 LYS A 15 16.033 -6.127 3.871 1.00 0.00 H new ATOM 0 HE2 LYS A 15 15.315 -4.160 2.478 1.00 0.00 H new ATOM 0 HE3 LYS A 15 16.581 -4.522 1.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 14.466 -5.483 0.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 15.587 -6.716 0.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 14.361 -6.365 2.084 1.00 0.00 H new ATOM 221 N VAL A 16 19.542 -6.949 6.131 1.00 0.00 N ATOM 222 CA VAL A 16 19.497 -8.351 6.523 1.00 0.00 C ATOM 223 C VAL A 16 18.068 -8.798 6.811 1.00 0.00 C ATOM 224 O VAL A 16 17.654 -9.881 6.400 1.00 0.00 O ATOM 225 CB VAL A 16 20.352 -8.565 7.766 1.00 0.00 C ATOM 226 CG1 VAL A 16 21.825 -8.403 7.400 1.00 0.00 C ATOM 227 CG2 VAL A 16 19.964 -7.533 8.823 1.00 0.00 C ATOM 0 H VAL A 16 19.223 -6.295 6.846 1.00 0.00 H new ATOM 0 HA VAL A 16 19.885 -8.946 5.696 1.00 0.00 H new ATOM 0 HB VAL A 16 20.189 -9.568 8.161 1.00 0.00 H new ATOM 0 HG11 VAL A 16 22.439 -8.556 8.287 1.00 0.00 H new ATOM 0 HG12 VAL A 16 22.094 -9.138 6.641 1.00 0.00 H new ATOM 0 HG13 VAL A 16 21.995 -7.400 7.009 1.00 0.00 H new ATOM 0 HG21 VAL A 16 20.572 -7.680 9.716 1.00 0.00 H new ATOM 0 HG22 VAL A 16 20.132 -6.530 8.431 1.00 0.00 H new ATOM 0 HG23 VAL A 16 18.911 -7.651 9.078 1.00 0.00 H new ATOM 237 N ALA A 17 17.321 -7.965 7.531 1.00 0.00 N ATOM 238 CA ALA A 17 15.942 -8.296 7.877 1.00 0.00 C ATOM 239 C ALA A 17 15.006 -7.149 7.518 1.00 0.00 C ATOM 240 O ALA A 17 15.440 -6.014 7.329 1.00 0.00 O ATOM 241 CB ALA A 17 15.833 -8.594 9.374 1.00 0.00 C ATOM 0 H ALA A 17 17.644 -7.064 7.883 1.00 0.00 H new ATOM 0 HA ALA A 17 15.651 -9.179 7.308 1.00 0.00 H new ATOM 0 HB1 ALA A 17 14.800 -8.840 9.622 1.00 0.00 H new ATOM 0 HB2 ALA A 17 16.477 -9.437 9.625 1.00 0.00 H new ATOM 0 HB3 ALA A 17 16.144 -7.718 9.943 1.00 0.00 H new ATOM 247 N MET A 18 13.718 -7.453 7.423 1.00 0.00 N ATOM 248 CA MET A 18 12.732 -6.438 7.087 1.00 0.00 C ATOM 249 C MET A 18 11.624 -6.403 8.134 1.00 0.00 C ATOM 250 O MET A 18 11.069 -7.441 8.497 1.00 0.00 O ATOM 251 CB MET A 18 12.128 -6.731 5.713 1.00 0.00 C ATOM 252 CG MET A 18 11.249 -5.557 5.280 1.00 0.00 C ATOM 253 SD MET A 18 10.524 -5.912 3.660 1.00 0.00 S ATOM 254 CE MET A 18 9.788 -4.282 3.377 1.00 0.00 C ATOM 0 H MET A 18 13.335 -8.387 7.573 1.00 0.00 H new ATOM 0 HA MET A 18 13.229 -5.468 7.066 1.00 0.00 H new ATOM 0 HB2 MET A 18 12.921 -6.894 4.983 1.00 0.00 H new ATOM 0 HB3 MET A 18 11.537 -7.646 5.752 1.00 0.00 H new ATOM 0 HG2 MET A 18 10.461 -5.389 6.014 1.00 0.00 H new ATOM 0 HG3 MET A 18 11.841 -4.643 5.233 1.00 0.00 H new ATOM 0 HE1 MET A 18 8.884 -4.390 2.778 1.00 0.00 H new ATOM 0 HE2 MET A 18 9.537 -3.825 4.334 1.00 0.00 H new ATOM 0 HE3 MET A 18 10.500 -3.648 2.848 1.00 0.00 H new ATOM 264 N LEU A 19 11.309 -5.206 8.613 1.00 0.00 N ATOM 265 CA LEU A 19 10.263 -5.046 9.618 1.00 0.00 C ATOM 266 C LEU A 19 8.938 -4.688 8.957 1.00 0.00 C ATOM 267 O LEU A 19 8.839 -3.697 8.233 1.00 0.00 O ATOM 268 CB LEU A 19 10.647 -3.933 10.593 1.00 0.00 C ATOM 269 CG LEU A 19 9.464 -3.617 11.516 1.00 0.00 C ATOM 270 CD1 LEU A 19 9.111 -4.847 12.350 1.00 0.00 C ATOM 271 CD2 LEU A 19 9.837 -2.463 12.451 1.00 0.00 C ATOM 0 H LEU A 19 11.759 -4.337 8.325 1.00 0.00 H new ATOM 0 HA LEU A 19 10.155 -5.989 10.154 1.00 0.00 H new ATOM 0 HB2 LEU A 19 11.510 -4.238 11.185 1.00 0.00 H new ATOM 0 HB3 LEU A 19 10.938 -3.039 10.042 1.00 0.00 H new ATOM 0 HG LEU A 19 8.605 -3.334 10.908 1.00 0.00 H new ATOM 0 HD11 LEU A 19 8.270 -4.615 13.003 1.00 0.00 H new ATOM 0 HD12 LEU A 19 8.840 -5.670 11.688 1.00 0.00 H new ATOM 0 HD13 LEU A 19 9.971 -5.136 12.955 1.00 0.00 H new ATOM 0 HD21 LEU A 19 8.995 -2.239 13.107 1.00 0.00 H new ATOM 0 HD22 LEU A 19 10.700 -2.747 13.053 1.00 0.00 H new ATOM 0 HD23 LEU A 19 10.081 -1.580 11.860 1.00 0.00 H new ATOM 283 N ASN A 20 7.918 -5.495 9.216 1.00 0.00 N ATOM 284 CA ASN A 20 6.601 -5.242 8.644 1.00 0.00 C ATOM 285 C ASN A 20 5.566 -5.046 9.743 1.00 0.00 C ATOM 286 O ASN A 20 5.435 -5.870 10.649 1.00 0.00 O ATOM 287 CB ASN A 20 6.187 -6.411 7.750 1.00 0.00 C ATOM 288 CG ASN A 20 5.090 -5.980 6.781 1.00 0.00 C ATOM 289 OD1 ASN A 20 4.960 -4.796 6.474 1.00 0.00 O ATOM 290 ND2 ASN A 20 4.293 -6.881 6.275 1.00 0.00 N ATOM 0 H ASN A 20 7.974 -6.321 9.811 1.00 0.00 H new ATOM 0 HA ASN A 20 6.654 -4.331 8.048 1.00 0.00 H new ATOM 0 HB2 ASN A 20 7.051 -6.774 7.193 1.00 0.00 H new ATOM 0 HB3 ASN A 20 5.833 -7.239 8.364 1.00 0.00 H new ATOM 0 HD21 ASN A 20 3.559 -6.604 5.623 1.00 0.00 H new ATOM 0 HD22 ASN A 20 4.404 -7.862 6.532 1.00 0.00 H new ATOM 297 N ILE A 21 4.826 -3.949 9.652 1.00 0.00 N ATOM 298 CA ILE A 21 3.797 -3.649 10.637 1.00 0.00 C ATOM 299 C ILE A 21 2.404 -3.876 10.037 1.00 0.00 C ATOM 300 O ILE A 21 2.015 -3.189 9.090 1.00 0.00 O ATOM 301 CB ILE A 21 3.933 -2.203 11.106 1.00 0.00 C ATOM 302 CG1 ILE A 21 5.408 -1.792 11.048 1.00 0.00 C ATOM 303 CG2 ILE A 21 3.432 -2.097 12.546 1.00 0.00 C ATOM 304 CD1 ILE A 21 5.541 -0.312 11.394 1.00 0.00 C ATOM 0 H ILE A 21 4.919 -3.256 8.910 1.00 0.00 H new ATOM 0 HA ILE A 21 3.923 -4.315 11.491 1.00 0.00 H new ATOM 0 HB ILE A 21 3.346 -1.547 10.464 1.00 0.00 H new ATOM 0 HG12 ILE A 21 5.991 -2.393 11.746 1.00 0.00 H new ATOM 0 HG13 ILE A 21 5.810 -1.981 10.052 1.00 0.00 H new ATOM 0 HG21 ILE A 21 3.526 -1.067 12.889 1.00 0.00 H new ATOM 0 HG22 ILE A 21 2.386 -2.401 12.591 1.00 0.00 H new ATOM 0 HG23 ILE A 21 4.026 -2.748 13.187 1.00 0.00 H new ATOM 0 HD11 ILE A 21 6.591 -0.021 11.352 1.00 0.00 H new ATOM 0 HD12 ILE A 21 4.972 0.281 10.679 1.00 0.00 H new ATOM 0 HD13 ILE A 21 5.156 -0.137 12.399 1.00 0.00 H new ATOM 316 N PRO A 22 1.661 -4.824 10.560 1.00 0.00 N ATOM 317 CA PRO A 22 0.291 -5.156 10.061 1.00 0.00 C ATOM 318 C PRO A 22 -0.765 -4.161 10.543 1.00 0.00 C ATOM 319 O PRO A 22 -1.554 -3.646 9.754 1.00 0.00 O ATOM 320 CB PRO A 22 0.027 -6.550 10.643 1.00 0.00 C ATOM 321 CG PRO A 22 0.866 -6.637 11.879 1.00 0.00 C ATOM 322 CD PRO A 22 2.046 -5.680 11.690 1.00 0.00 C ATOM 0 HA PRO A 22 0.235 -5.118 8.973 1.00 0.00 H new ATOM 0 HB2 PRO A 22 -1.029 -6.683 10.876 1.00 0.00 H new ATOM 0 HB3 PRO A 22 0.297 -7.330 9.931 1.00 0.00 H new ATOM 0 HG2 PRO A 22 0.285 -6.363 12.759 1.00 0.00 H new ATOM 0 HG3 PRO A 22 1.218 -7.657 12.035 1.00 0.00 H new ATOM 0 HD2 PRO A 22 2.225 -5.091 12.589 1.00 0.00 H new ATOM 0 HD3 PRO A 22 2.966 -6.224 11.478 1.00 0.00 H new ATOM 330 N LYS A 23 -0.772 -3.904 11.843 1.00 0.00 N ATOM 331 CA LYS A 23 -1.734 -2.985 12.431 1.00 0.00 C ATOM 332 C LYS A 23 -1.547 -1.574 11.887 1.00 0.00 C ATOM 333 O LYS A 23 -2.518 -0.846 11.678 1.00 0.00 O ATOM 334 CB LYS A 23 -1.589 -2.987 13.954 1.00 0.00 C ATOM 335 CG LYS A 23 -2.861 -2.411 14.584 1.00 0.00 C ATOM 336 CD LYS A 23 -3.530 -3.466 15.473 1.00 0.00 C ATOM 337 CE LYS A 23 -5.019 -3.142 15.619 1.00 0.00 C ATOM 338 NZ LYS A 23 -5.676 -4.193 16.449 1.00 0.00 N ATOM 0 H LYS A 23 -0.122 -4.319 12.510 1.00 0.00 H new ATOM 0 HA LYS A 23 -2.737 -3.319 12.164 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -1.419 -4.002 14.313 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -0.723 -2.395 14.249 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -2.617 -1.528 15.174 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -3.551 -2.091 13.803 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -3.404 -4.457 15.037 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -3.054 -3.486 16.453 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -5.146 -2.164 16.084 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -5.489 -3.092 14.637 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -6.487 -3.781 16.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -6.006 -4.965 15.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -4.994 -4.568 17.139 1.00 0.00 H new ATOM 352 N LEU A 24 -0.299 -1.189 11.665 1.00 0.00 N ATOM 353 CA LEU A 24 -0.006 0.138 11.151 1.00 0.00 C ATOM 354 C LEU A 24 0.182 0.092 9.644 1.00 0.00 C ATOM 355 O LEU A 24 0.529 1.095 9.017 1.00 0.00 O ATOM 356 CB LEU A 24 1.254 0.685 11.822 1.00 0.00 C ATOM 357 CG LEU A 24 0.945 1.073 13.277 1.00 0.00 C ATOM 358 CD1 LEU A 24 -0.214 2.065 13.315 1.00 0.00 C ATOM 359 CD2 LEU A 24 0.544 -0.165 14.078 1.00 0.00 C ATOM 0 H LEU A 24 0.521 -1.773 11.832 1.00 0.00 H new ATOM 0 HA LEU A 24 -0.845 0.797 11.375 1.00 0.00 H new ATOM 0 HB2 LEU A 24 2.045 -0.065 11.796 1.00 0.00 H new ATOM 0 HB3 LEU A 24 1.620 1.554 11.275 1.00 0.00 H new ATOM 0 HG LEU A 24 1.839 1.522 13.710 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -0.428 2.336 14.349 1.00 0.00 H new ATOM 0 HD12 LEU A 24 0.055 2.960 12.754 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -1.098 1.609 12.869 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.327 0.122 15.107 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.343 -0.615 13.632 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.361 -0.886 14.067 1.00 0.00 H new ATOM 371 N LYS A 25 -0.064 -1.072 9.063 1.00 0.00 N ATOM 372 CA LYS A 25 0.066 -1.225 7.626 1.00 0.00 C ATOM 373 C LYS A 25 1.291 -0.474 7.119 1.00 0.00 C ATOM 374 O LYS A 25 1.194 0.351 6.211 1.00 0.00 O ATOM 375 CB LYS A 25 -1.194 -0.678 6.966 1.00 0.00 C ATOM 376 CG LYS A 25 -2.330 -1.684 7.146 1.00 0.00 C ATOM 377 CD LYS A 25 -3.558 -0.960 7.693 1.00 0.00 C ATOM 378 CE LYS A 25 -4.598 -1.984 8.145 1.00 0.00 C ATOM 379 NZ LYS A 25 -5.856 -1.278 8.520 1.00 0.00 N ATOM 0 H LYS A 25 -0.352 -1.915 9.560 1.00 0.00 H new ATOM 0 HA LYS A 25 0.190 -2.279 7.379 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -1.466 0.279 7.410 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -1.015 -0.498 5.906 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -2.567 -2.158 6.193 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -2.025 -2.476 7.830 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -3.274 -0.322 8.530 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -3.981 -0.311 6.927 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -4.793 -2.698 7.345 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -4.220 -2.553 8.995 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -6.566 -1.973 8.828 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -5.663 -0.613 9.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -6.219 -0.754 7.698 1.00 0.00 H new ATOM 393 N LYS A 26 2.442 -0.769 7.714 1.00 0.00 N ATOM 394 CA LYS A 26 3.687 -0.120 7.315 1.00 0.00 C ATOM 395 C LYS A 26 4.824 -1.127 7.224 1.00 0.00 C ATOM 396 O LYS A 26 4.757 -2.207 7.807 1.00 0.00 O ATOM 397 CB LYS A 26 4.070 0.980 8.298 1.00 0.00 C ATOM 398 CG LYS A 26 3.669 2.336 7.718 1.00 0.00 C ATOM 399 CD LYS A 26 3.976 3.436 8.728 1.00 0.00 C ATOM 400 CE LYS A 26 3.057 3.285 9.936 1.00 0.00 C ATOM 401 NZ LYS A 26 3.016 4.569 10.689 1.00 0.00 N ATOM 0 H LYS A 26 2.539 -1.448 8.469 1.00 0.00 H new ATOM 0 HA LYS A 26 3.520 0.321 6.332 1.00 0.00 H new ATOM 0 HB2 LYS A 26 3.572 0.819 9.254 1.00 0.00 H new ATOM 0 HB3 LYS A 26 5.143 0.956 8.489 1.00 0.00 H new ATOM 0 HG2 LYS A 26 4.210 2.520 6.790 1.00 0.00 H new ATOM 0 HG3 LYS A 26 2.607 2.339 7.474 1.00 0.00 H new ATOM 0 HD2 LYS A 26 5.019 3.377 9.041 1.00 0.00 H new ATOM 0 HD3 LYS A 26 3.835 4.415 8.270 1.00 0.00 H new ATOM 0 HE2 LYS A 26 2.054 3.009 9.611 1.00 0.00 H new ATOM 0 HE3 LYS A 26 3.415 2.483 10.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 2.390 4.468 11.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 3.974 4.814 11.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 2.655 5.323 10.070 1.00 0.00 H new ATOM 415 N LYS A 27 5.867 -0.766 6.486 1.00 0.00 N ATOM 416 CA LYS A 27 7.014 -1.651 6.324 1.00 0.00 C ATOM 417 C LYS A 27 8.320 -0.873 6.421 1.00 0.00 C ATOM 418 O LYS A 27 8.364 0.325 6.141 1.00 0.00 O ATOM 419 CB LYS A 27 6.955 -2.349 4.972 1.00 0.00 C ATOM 420 CG LYS A 27 5.508 -2.402 4.489 1.00 0.00 C ATOM 421 CD LYS A 27 5.461 -2.959 3.066 1.00 0.00 C ATOM 422 CE LYS A 27 6.224 -2.013 2.141 1.00 0.00 C ATOM 423 NZ LYS A 27 5.742 -2.178 0.741 1.00 0.00 N ATOM 0 H LYS A 27 5.943 0.125 5.995 1.00 0.00 H new ATOM 0 HA LYS A 27 6.978 -2.391 7.124 1.00 0.00 H new ATOM 0 HB2 LYS A 27 7.572 -1.816 4.248 1.00 0.00 H new ATOM 0 HB3 LYS A 27 7.359 -3.358 5.054 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.915 -3.028 5.155 1.00 0.00 H new ATOM 0 HG3 LYS A 27 5.069 -1.405 4.514 1.00 0.00 H new ATOM 0 HD2 LYS A 27 5.904 -3.955 3.036 1.00 0.00 H new ATOM 0 HD3 LYS A 27 4.428 -3.059 2.734 1.00 0.00 H new ATOM 0 HE2 LYS A 27 6.084 -0.982 2.464 1.00 0.00 H new ATOM 0 HE3 LYS A 27 7.293 -2.221 2.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 6.264 -1.532 0.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 5.898 -3.159 0.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 4.727 -1.958 0.695 1.00 0.00 H new ATOM 437 N PHE A 28 9.382 -1.566 6.811 1.00 0.00 N ATOM 438 CA PHE A 28 10.691 -0.933 6.928 1.00 0.00 C ATOM 439 C PHE A 28 11.810 -1.958 6.760 1.00 0.00 C ATOM 440 O PHE A 28 11.643 -3.134 7.084 1.00 0.00 O ATOM 441 CB PHE A 28 10.820 -0.242 8.285 1.00 0.00 C ATOM 442 CG PHE A 28 9.818 0.884 8.367 1.00 0.00 C ATOM 443 CD1 PHE A 28 10.000 2.038 7.596 1.00 0.00 C ATOM 444 CD2 PHE A 28 8.706 0.775 9.212 1.00 0.00 C ATOM 445 CE1 PHE A 28 9.071 3.083 7.669 1.00 0.00 C ATOM 446 CE2 PHE A 28 7.778 1.819 9.285 1.00 0.00 C ATOM 447 CZ PHE A 28 7.960 2.974 8.513 1.00 0.00 C ATOM 0 H PHE A 28 9.365 -2.557 7.050 1.00 0.00 H new ATOM 0 HA PHE A 28 10.782 -0.191 6.135 1.00 0.00 H new ATOM 0 HB2 PHE A 28 10.647 -0.958 9.089 1.00 0.00 H new ATOM 0 HB3 PHE A 28 11.831 0.145 8.415 1.00 0.00 H new ATOM 0 HD1 PHE A 28 10.857 2.122 6.945 1.00 0.00 H new ATOM 0 HD2 PHE A 28 8.565 -0.115 9.807 1.00 0.00 H new ATOM 0 HE1 PHE A 28 9.212 3.973 7.074 1.00 0.00 H new ATOM 0 HE2 PHE A 28 6.921 1.735 9.937 1.00 0.00 H new ATOM 0 HZ PHE A 28 7.243 3.780 8.569 1.00 0.00 H new ATOM 457 N SER A 29 12.952 -1.507 6.252 1.00 0.00 N ATOM 458 CA SER A 29 14.086 -2.401 6.048 1.00 0.00 C ATOM 459 C SER A 29 15.096 -2.252 7.182 1.00 0.00 C ATOM 460 O SER A 29 15.646 -1.172 7.395 1.00 0.00 O ATOM 461 CB SER A 29 14.767 -2.087 4.719 1.00 0.00 C ATOM 462 OG SER A 29 13.927 -2.500 3.651 1.00 0.00 O ATOM 0 H SER A 29 13.116 -0.539 5.977 1.00 0.00 H new ATOM 0 HA SER A 29 13.716 -3.426 6.034 1.00 0.00 H new ATOM 0 HB2 SER A 29 14.970 -1.019 4.645 1.00 0.00 H new ATOM 0 HB3 SER A 29 15.728 -2.599 4.660 1.00 0.00 H new ATOM 0 HG SER A 29 14.282 -2.158 2.804 1.00 0.00 H new ATOM 468 N ILE A 30 15.334 -3.343 7.903 1.00 0.00 N ATOM 469 CA ILE A 30 16.281 -3.316 9.013 1.00 0.00 C ATOM 470 C ILE A 30 17.668 -3.738 8.545 1.00 0.00 C ATOM 471 O ILE A 30 17.853 -4.836 8.018 1.00 0.00 O ATOM 472 CB ILE A 30 15.809 -4.247 10.131 1.00 0.00 C ATOM 473 CG1 ILE A 30 14.793 -3.518 11.014 1.00 0.00 C ATOM 474 CG2 ILE A 30 17.005 -4.668 10.990 1.00 0.00 C ATOM 475 CD1 ILE A 30 13.580 -3.110 10.178 1.00 0.00 C ATOM 0 H ILE A 30 14.890 -4.247 7.742 1.00 0.00 H new ATOM 0 HA ILE A 30 16.334 -2.296 9.393 1.00 0.00 H new ATOM 0 HB ILE A 30 15.346 -5.129 9.688 1.00 0.00 H new ATOM 0 HG12 ILE A 30 14.480 -4.164 11.834 1.00 0.00 H new ATOM 0 HG13 ILE A 30 15.252 -2.636 11.460 1.00 0.00 H new ATOM 0 HG21 ILE A 30 16.666 -5.331 11.786 1.00 0.00 H new ATOM 0 HG22 ILE A 30 17.733 -5.189 10.369 1.00 0.00 H new ATOM 0 HG23 ILE A 30 17.468 -3.784 11.428 1.00 0.00 H new ATOM 0 HD11 ILE A 30 12.860 -2.592 10.811 1.00 0.00 H new ATOM 0 HD12 ILE A 30 13.899 -2.448 9.373 1.00 0.00 H new ATOM 0 HD13 ILE A 30 13.115 -4.000 9.753 1.00 0.00 H new ATOM 487 N TYR A 31 18.641 -2.855 8.745 1.00 0.00 N ATOM 488 CA TYR A 31 20.016 -3.142 8.344 1.00 0.00 C ATOM 489 C TYR A 31 20.832 -3.638 9.531 1.00 0.00 C ATOM 490 O TYR A 31 20.674 -3.153 10.650 1.00 0.00 O ATOM 491 CB TYR A 31 20.665 -1.884 7.765 1.00 0.00 C ATOM 492 CG TYR A 31 20.163 -1.664 6.359 1.00 0.00 C ATOM 493 CD1 TYR A 31 18.825 -1.319 6.137 1.00 0.00 C ATOM 494 CD2 TYR A 31 21.039 -1.807 5.275 1.00 0.00 C ATOM 495 CE1 TYR A 31 18.362 -1.117 4.830 1.00 0.00 C ATOM 496 CE2 TYR A 31 20.576 -1.605 3.970 1.00 0.00 C ATOM 497 CZ TYR A 31 19.238 -1.260 3.747 1.00 0.00 C ATOM 498 OH TYR A 31 18.782 -1.061 2.461 1.00 0.00 O ATOM 0 H TYR A 31 18.506 -1.942 9.179 1.00 0.00 H new ATOM 0 HA TYR A 31 19.995 -3.923 7.584 1.00 0.00 H new ATOM 0 HB2 TYR A 31 20.429 -1.020 8.387 1.00 0.00 H new ATOM 0 HB3 TYR A 31 21.750 -1.989 7.764 1.00 0.00 H new ATOM 0 HD1 TYR A 31 18.150 -1.209 6.973 1.00 0.00 H new ATOM 0 HD2 TYR A 31 22.072 -2.073 5.447 1.00 0.00 H new ATOM 0 HE1 TYR A 31 17.330 -0.851 4.658 1.00 0.00 H new ATOM 0 HE2 TYR A 31 21.251 -1.715 3.135 1.00 0.00 H new ATOM 0 HH TYR A 31 19.518 -1.199 1.828 1.00 0.00 H new ATOM 508 N TRP A 32 21.699 -4.615 9.279 1.00 0.00 N ATOM 509 CA TRP A 32 22.527 -5.175 10.338 1.00 0.00 C ATOM 510 C TRP A 32 23.420 -4.101 10.952 1.00 0.00 C ATOM 511 O TRP A 32 24.095 -3.357 10.243 1.00 0.00 O ATOM 512 CB TRP A 32 23.387 -6.320 9.779 1.00 0.00 C ATOM 513 CG TRP A 32 24.248 -6.889 10.865 1.00 0.00 C ATOM 514 CD1 TRP A 32 25.597 -6.986 10.820 1.00 0.00 C ATOM 515 CD2 TRP A 32 23.846 -7.439 12.152 1.00 0.00 C ATOM 516 NE1 TRP A 32 26.047 -7.552 12.000 1.00 0.00 N ATOM 517 CE2 TRP A 32 25.005 -7.846 12.853 1.00 0.00 C ATOM 518 CE3 TRP A 32 22.600 -7.619 12.773 1.00 0.00 C ATOM 519 CZ2 TRP A 32 24.929 -8.409 14.125 1.00 0.00 C ATOM 520 CZ3 TRP A 32 22.520 -8.184 14.056 1.00 0.00 C ATOM 521 CH2 TRP A 32 23.684 -8.576 14.730 1.00 0.00 C ATOM 0 H TRP A 32 21.844 -5.031 8.359 1.00 0.00 H new ATOM 0 HA TRP A 32 21.874 -5.565 11.119 1.00 0.00 H new ATOM 0 HB2 TRP A 32 22.746 -7.099 9.365 1.00 0.00 H new ATOM 0 HB3 TRP A 32 24.010 -5.953 8.963 1.00 0.00 H new ATOM 0 HD1 TRP A 32 26.221 -6.672 9.996 1.00 0.00 H new ATOM 0 HE1 TRP A 32 27.029 -7.730 12.212 1.00 0.00 H new ATOM 0 HE3 TRP A 32 21.697 -7.321 12.261 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 25.828 -8.714 14.639 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 21.557 -8.317 14.525 1.00 0.00 H new ATOM 0 HH2 TRP A 32 23.617 -9.007 15.718 1.00 0.00 H new ATOM 532 N GLY A 33 23.403 -4.031 12.280 1.00 0.00 N ATOM 533 CA GLY A 33 24.202 -3.050 13.003 1.00 0.00 C ATOM 534 C GLY A 33 23.399 -1.800 13.294 1.00 0.00 C ATOM 535 O GLY A 33 22.427 -1.493 12.605 1.00 0.00 O ATOM 0 H GLY A 33 22.845 -4.642 12.876 1.00 0.00 H new ATOM 0 HA2 GLY A 33 24.557 -3.484 13.938 1.00 0.00 H new ATOM 0 HA3 GLY A 33 25.084 -2.791 12.417 1.00 0.00 H new ATOM 539 N ALA A 34 23.818 -1.073 14.316 1.00 0.00 N ATOM 540 CA ALA A 34 23.134 0.150 14.677 1.00 0.00 C ATOM 541 C ALA A 34 24.129 1.198 15.163 1.00 0.00 C ATOM 542 O ALA A 34 24.271 1.419 16.364 1.00 0.00 O ATOM 543 CB ALA A 34 22.102 -0.126 15.771 1.00 0.00 C ATOM 0 H ALA A 34 24.619 -1.307 14.902 1.00 0.00 H new ATOM 0 HA ALA A 34 22.626 0.532 13.791 1.00 0.00 H new ATOM 0 HB1 ALA A 34 21.594 0.802 16.034 1.00 0.00 H new ATOM 0 HB2 ALA A 34 21.372 -0.849 15.408 1.00 0.00 H new ATOM 0 HB3 ALA A 34 22.604 -0.527 16.652 1.00 0.00 H new ATOM 683 N GLY A 44 17.996 0.266 12.226 1.00 0.00 N ATOM 684 CA GLY A 44 19.103 -0.681 12.200 1.00 0.00 C ATOM 685 C GLY A 44 18.994 -1.685 13.340 1.00 0.00 C ATOM 686 O GLY A 44 18.381 -1.407 14.372 1.00 0.00 O ATOM 0 HA2 GLY A 44 19.112 -1.209 11.246 1.00 0.00 H new ATOM 0 HA3 GLY A 44 20.048 -0.143 12.275 1.00 0.00 H new ATOM 690 N MET A 45 19.597 -2.852 13.147 1.00 0.00 N ATOM 691 CA MET A 45 19.568 -3.891 14.166 1.00 0.00 C ATOM 692 C MET A 45 20.836 -3.833 15.001 1.00 0.00 C ATOM 693 O MET A 45 21.943 -3.834 14.464 1.00 0.00 O ATOM 694 CB MET A 45 19.464 -5.266 13.515 1.00 0.00 C ATOM 695 CG MET A 45 18.928 -6.277 14.531 1.00 0.00 C ATOM 696 SD MET A 45 17.259 -6.792 14.050 1.00 0.00 S ATOM 697 CE MET A 45 17.731 -7.796 12.620 1.00 0.00 C ATOM 0 H MET A 45 20.108 -3.100 12.300 1.00 0.00 H new ATOM 0 HA MET A 45 18.700 -3.726 14.804 1.00 0.00 H new ATOM 0 HB2 MET A 45 18.803 -5.220 12.649 1.00 0.00 H new ATOM 0 HB3 MET A 45 20.442 -5.583 13.153 1.00 0.00 H new ATOM 0 HG2 MET A 45 19.587 -7.144 14.580 1.00 0.00 H new ATOM 0 HG3 MET A 45 18.910 -5.833 15.526 1.00 0.00 H new ATOM 0 HE1 MET A 45 16.892 -8.425 12.324 1.00 0.00 H new ATOM 0 HE2 MET A 45 18.004 -7.143 11.791 1.00 0.00 H new ATOM 0 HE3 MET A 45 18.582 -8.425 12.882 1.00 0.00 H new ATOM 707 N PHE A 46 20.669 -3.781 16.313 1.00 0.00 N ATOM 708 CA PHE A 46 21.813 -3.719 17.210 1.00 0.00 C ATOM 709 C PHE A 46 22.644 -4.992 17.108 1.00 0.00 C ATOM 710 O PHE A 46 22.105 -6.089 16.964 1.00 0.00 O ATOM 711 CB PHE A 46 21.341 -3.552 18.649 1.00 0.00 C ATOM 712 CG PHE A 46 22.388 -2.828 19.456 1.00 0.00 C ATOM 713 CD1 PHE A 46 22.517 -1.436 19.363 1.00 0.00 C ATOM 714 CD2 PHE A 46 23.222 -3.553 20.310 1.00 0.00 C ATOM 715 CE1 PHE A 46 23.487 -0.773 20.126 1.00 0.00 C ATOM 716 CE2 PHE A 46 24.189 -2.892 21.073 1.00 0.00 C ATOM 717 CZ PHE A 46 24.323 -1.501 20.982 1.00 0.00 C ATOM 0 H PHE A 46 19.761 -3.780 16.778 1.00 0.00 H new ATOM 0 HA PHE A 46 22.425 -2.865 16.920 1.00 0.00 H new ATOM 0 HB2 PHE A 46 20.404 -2.995 18.671 1.00 0.00 H new ATOM 0 HB3 PHE A 46 21.141 -4.528 19.090 1.00 0.00 H new ATOM 0 HD1 PHE A 46 21.870 -0.875 18.705 1.00 0.00 H new ATOM 0 HD2 PHE A 46 23.120 -4.626 20.381 1.00 0.00 H new ATOM 0 HE1 PHE A 46 23.590 0.300 20.054 1.00 0.00 H new ATOM 0 HE2 PHE A 46 24.833 -3.454 21.733 1.00 0.00 H new ATOM 0 HZ PHE A 46 25.070 -0.990 21.571 1.00 0.00 H new ATOM 727 N VAL A 47 23.959 -4.837 17.185 1.00 0.00 N ATOM 728 CA VAL A 47 24.858 -5.980 17.103 1.00 0.00 C ATOM 729 C VAL A 47 25.769 -6.040 18.326 1.00 0.00 C ATOM 730 O VAL A 47 26.460 -5.073 18.648 1.00 0.00 O ATOM 731 CB VAL A 47 25.706 -5.869 15.836 1.00 0.00 C ATOM 732 CG1 VAL A 47 26.234 -4.444 15.701 1.00 0.00 C ATOM 733 CG2 VAL A 47 26.893 -6.826 15.921 1.00 0.00 C ATOM 0 H VAL A 47 24.424 -3.937 17.303 1.00 0.00 H new ATOM 0 HA VAL A 47 24.262 -6.892 17.071 1.00 0.00 H new ATOM 0 HB VAL A 47 25.090 -6.123 14.974 1.00 0.00 H new ATOM 0 HG11 VAL A 47 26.839 -4.364 14.798 1.00 0.00 H new ATOM 0 HG12 VAL A 47 25.396 -3.750 15.639 1.00 0.00 H new ATOM 0 HG13 VAL A 47 26.845 -4.199 16.570 1.00 0.00 H new ATOM 0 HG21 VAL A 47 27.493 -6.742 15.015 1.00 0.00 H new ATOM 0 HG22 VAL A 47 27.505 -6.571 16.787 1.00 0.00 H new ATOM 0 HG23 VAL A 47 26.529 -7.849 16.022 1.00 0.00 H new ATOM 743 N SER A 48 25.769 -7.186 19.000 1.00 0.00 N ATOM 744 CA SER A 48 26.602 -7.367 20.182 1.00 0.00 C ATOM 745 C SER A 48 26.765 -8.851 20.490 1.00 0.00 C ATOM 746 O SER A 48 26.087 -9.694 19.903 1.00 0.00 O ATOM 747 CB SER A 48 25.976 -6.659 21.384 1.00 0.00 C ATOM 748 OG SER A 48 26.996 -5.999 22.123 1.00 0.00 O ATOM 0 H SER A 48 25.205 -7.998 18.749 1.00 0.00 H new ATOM 0 HA SER A 48 27.582 -6.934 19.983 1.00 0.00 H new ATOM 0 HB2 SER A 48 25.230 -5.939 21.049 1.00 0.00 H new ATOM 0 HB3 SER A 48 25.460 -7.380 22.018 1.00 0.00 H new ATOM 0 HG SER A 48 26.598 -5.542 22.894 1.00 0.00 H new ATOM 754 N ASP A 49 27.666 -9.165 21.413 1.00 0.00 N ATOM 755 CA ASP A 49 27.906 -10.554 21.787 1.00 0.00 C ATOM 756 C ASP A 49 26.636 -11.171 22.361 1.00 0.00 C ATOM 757 O ASP A 49 26.323 -12.331 22.096 1.00 0.00 O ATOM 758 CB ASP A 49 29.030 -10.626 22.824 1.00 0.00 C ATOM 759 CG ASP A 49 29.533 -12.060 22.954 1.00 0.00 C ATOM 760 OD1 ASP A 49 29.211 -12.861 22.092 1.00 0.00 O ATOM 761 OD2 ASP A 49 30.235 -12.335 23.913 1.00 0.00 O ATOM 0 H ASP A 49 28.238 -8.484 21.913 1.00 0.00 H new ATOM 0 HA ASP A 49 28.200 -11.112 20.898 1.00 0.00 H new ATOM 0 HB2 ASP A 49 29.849 -9.970 22.529 1.00 0.00 H new ATOM 0 HB3 ASP A 49 28.668 -10.270 23.789 1.00 0.00 H new ATOM 766 N VAL A 50 25.903 -10.386 23.145 1.00 0.00 N ATOM 767 CA VAL A 50 24.664 -10.870 23.743 1.00 0.00 C ATOM 768 C VAL A 50 23.496 -10.701 22.779 1.00 0.00 C ATOM 769 O VAL A 50 22.551 -11.490 22.792 1.00 0.00 O ATOM 770 CB VAL A 50 24.370 -10.106 25.031 1.00 0.00 C ATOM 771 CG1 VAL A 50 25.589 -10.157 25.949 1.00 0.00 C ATOM 772 CG2 VAL A 50 24.053 -8.652 24.693 1.00 0.00 C ATOM 0 H VAL A 50 26.142 -9.422 23.379 1.00 0.00 H new ATOM 0 HA VAL A 50 24.787 -11.930 23.966 1.00 0.00 H new ATOM 0 HB VAL A 50 23.518 -10.561 25.536 1.00 0.00 H new ATOM 0 HG11 VAL A 50 25.376 -9.611 26.868 1.00 0.00 H new ATOM 0 HG12 VAL A 50 25.820 -11.195 26.189 1.00 0.00 H new ATOM 0 HG13 VAL A 50 26.442 -9.702 25.446 1.00 0.00 H new ATOM 0 HG21 VAL A 50 23.842 -8.103 25.611 1.00 0.00 H new ATOM 0 HG22 VAL A 50 24.907 -8.201 24.188 1.00 0.00 H new ATOM 0 HG23 VAL A 50 23.182 -8.612 24.038 1.00 0.00 H new ATOM 782 N THR A 51 23.558 -9.662 21.952 1.00 0.00 N ATOM 783 CA THR A 51 22.489 -9.401 20.996 1.00 0.00 C ATOM 784 C THR A 51 22.666 -10.255 19.746 1.00 0.00 C ATOM 785 O THR A 51 23.777 -10.672 19.421 1.00 0.00 O ATOM 786 CB THR A 51 22.490 -7.921 20.606 1.00 0.00 C ATOM 787 OG1 THR A 51 23.697 -7.616 19.922 1.00 0.00 O ATOM 788 CG2 THR A 51 22.381 -7.056 21.863 1.00 0.00 C ATOM 0 H THR A 51 24.328 -8.994 21.924 1.00 0.00 H new ATOM 0 HA THR A 51 21.538 -9.656 21.465 1.00 0.00 H new ATOM 0 HB THR A 51 21.640 -7.717 19.955 1.00 0.00 H new ATOM 0 HG1 THR A 51 23.493 -7.353 19.000 1.00 0.00 H new ATOM 0 HG21 THR A 51 22.382 -6.003 21.581 1.00 0.00 H new ATOM 0 HG22 THR A 51 21.454 -7.291 22.387 1.00 0.00 H new ATOM 0 HG23 THR A 51 23.229 -7.257 22.518 1.00 0.00 H new ATOM 796 N THR A 52 21.564 -10.508 19.047 1.00 0.00 N ATOM 797 CA THR A 52 21.610 -11.309 17.829 1.00 0.00 C ATOM 798 C THR A 52 20.383 -11.033 16.965 1.00 0.00 C ATOM 799 O THR A 52 19.445 -10.363 17.397 1.00 0.00 O ATOM 800 CB THR A 52 21.673 -12.798 18.174 1.00 0.00 C ATOM 801 OG1 THR A 52 22.363 -13.490 17.143 1.00 0.00 O ATOM 802 CG2 THR A 52 20.257 -13.357 18.296 1.00 0.00 C ATOM 0 H THR A 52 20.635 -10.173 19.301 1.00 0.00 H new ATOM 0 HA THR A 52 22.506 -11.035 17.272 1.00 0.00 H new ATOM 0 HB THR A 52 22.197 -12.929 19.121 1.00 0.00 H new ATOM 0 HG1 THR A 52 22.407 -14.444 17.362 1.00 0.00 H new ATOM 0 HG21 THR A 52 20.305 -14.418 18.542 1.00 0.00 H new ATOM 0 HG22 THR A 52 19.723 -12.826 19.084 1.00 0.00 H new ATOM 0 HG23 THR A 52 19.732 -13.227 17.350 1.00 0.00 H new ATOM 810 N THR A 53 20.395 -11.555 15.745 1.00 0.00 N ATOM 811 CA THR A 53 19.274 -11.359 14.834 1.00 0.00 C ATOM 812 C THR A 53 18.219 -12.443 15.038 1.00 0.00 C ATOM 813 O THR A 53 18.531 -13.552 15.472 1.00 0.00 O ATOM 814 CB THR A 53 19.769 -11.389 13.390 1.00 0.00 C ATOM 815 OG1 THR A 53 19.351 -12.601 12.775 1.00 0.00 O ATOM 816 CG2 THR A 53 21.297 -11.303 13.373 1.00 0.00 C ATOM 0 H THR A 53 21.161 -12.112 15.366 1.00 0.00 H new ATOM 0 HA THR A 53 18.823 -10.389 15.044 1.00 0.00 H new ATOM 0 HB THR A 53 19.355 -10.542 12.843 1.00 0.00 H new ATOM 0 HG1 THR A 53 19.242 -12.458 11.812 1.00 0.00 H new ATOM 0 HG21 THR A 53 21.651 -11.324 12.342 1.00 0.00 H new ATOM 0 HG22 THR A 53 21.614 -10.374 13.847 1.00 0.00 H new ATOM 0 HG23 THR A 53 21.715 -12.149 13.918 1.00 0.00 H new ATOM 824 N PRO A 54 16.984 -12.140 14.736 1.00 0.00 N ATOM 825 CA PRO A 54 15.855 -13.105 14.892 1.00 0.00 C ATOM 826 C PRO A 54 15.847 -14.175 13.802 1.00 0.00 C ATOM 827 O PRO A 54 15.130 -14.059 12.806 1.00 0.00 O ATOM 828 CB PRO A 54 14.615 -12.216 14.804 1.00 0.00 C ATOM 829 CG PRO A 54 15.026 -11.045 13.974 1.00 0.00 C ATOM 830 CD PRO A 54 16.525 -10.841 14.215 1.00 0.00 C ATOM 0 HA PRO A 54 15.920 -13.666 15.824 1.00 0.00 H new ATOM 0 HB2 PRO A 54 13.781 -12.749 14.347 1.00 0.00 H new ATOM 0 HB3 PRO A 54 14.287 -11.900 15.794 1.00 0.00 H new ATOM 0 HG2 PRO A 54 14.825 -11.229 12.919 1.00 0.00 H new ATOM 0 HG3 PRO A 54 14.464 -10.155 14.255 1.00 0.00 H new ATOM 0 HD2 PRO A 54 17.044 -10.575 13.294 1.00 0.00 H new ATOM 0 HD3 PRO A 54 16.709 -10.038 14.929 1.00 0.00 H new ATOM 838 N SER A 55 16.646 -15.218 13.998 1.00 0.00 N ATOM 839 CA SER A 55 16.720 -16.303 13.029 1.00 0.00 C ATOM 840 C SER A 55 16.266 -17.614 13.651 1.00 0.00 C ATOM 841 O SER A 55 16.225 -18.650 12.986 1.00 0.00 O ATOM 842 CB SER A 55 18.149 -16.439 12.520 1.00 0.00 C ATOM 843 OG SER A 55 19.050 -16.321 13.614 1.00 0.00 O ATOM 0 H SER A 55 17.247 -15.334 14.814 1.00 0.00 H new ATOM 0 HA SER A 55 16.057 -16.070 12.196 1.00 0.00 H new ATOM 0 HB2 SER A 55 18.282 -17.402 12.027 1.00 0.00 H new ATOM 0 HB3 SER A 55 18.358 -15.669 11.777 1.00 0.00 H new ATOM 0 HG SER A 55 19.971 -16.410 13.290 1.00 0.00 H new ATOM 849 N GLY A 56 15.922 -17.560 14.928 1.00 0.00 N ATOM 850 CA GLY A 56 15.465 -18.747 15.634 1.00 0.00 C ATOM 851 C GLY A 56 15.856 -18.700 17.108 1.00 0.00 C ATOM 852 O GLY A 56 16.924 -19.178 17.489 1.00 0.00 O ATOM 0 H GLY A 56 15.950 -16.712 15.494 1.00 0.00 H new ATOM 0 HA2 GLY A 56 14.382 -18.831 15.545 1.00 0.00 H new ATOM 0 HA3 GLY A 56 15.893 -19.636 15.170 1.00 0.00 H new ATOM 856 N GLY A 57 14.985 -18.125 17.934 1.00 0.00 N ATOM 857 CA GLY A 57 15.255 -18.028 19.366 1.00 0.00 C ATOM 858 C GLY A 57 16.531 -17.232 19.627 1.00 0.00 C ATOM 859 O GLY A 57 17.624 -17.795 19.683 1.00 0.00 O ATOM 0 H GLY A 57 14.095 -17.723 17.640 1.00 0.00 H new ATOM 0 HA2 GLY A 57 14.414 -17.549 19.867 1.00 0.00 H new ATOM 0 HA3 GLY A 57 15.352 -19.027 19.790 1.00 0.00 H new ATOM 863 N GLY A 58 16.384 -15.919 19.784 1.00 0.00 N ATOM 864 CA GLY A 58 17.522 -15.050 20.034 1.00 0.00 C ATOM 865 C GLY A 58 17.051 -13.685 20.514 1.00 0.00 C ATOM 866 O GLY A 58 15.887 -13.325 20.348 1.00 0.00 O ATOM 0 H GLY A 58 15.486 -15.437 19.742 1.00 0.00 H new ATOM 0 HA2 GLY A 58 18.174 -15.501 20.782 1.00 0.00 H new ATOM 0 HA3 GLY A 58 18.110 -14.939 19.123 1.00 0.00 H new ATOM 870 N HIS A 59 17.967 -12.926 21.096 1.00 0.00 N ATOM 871 CA HIS A 59 17.649 -11.588 21.586 1.00 0.00 C ATOM 872 C HIS A 59 17.828 -10.578 20.463 1.00 0.00 C ATOM 873 O HIS A 59 18.953 -10.250 20.087 1.00 0.00 O ATOM 874 CB HIS A 59 18.587 -11.210 22.729 1.00 0.00 C ATOM 875 CG HIS A 59 18.057 -9.993 23.452 1.00 0.00 C ATOM 876 ND1 HIS A 59 18.869 -9.188 24.242 1.00 0.00 N ATOM 877 CD2 HIS A 59 16.809 -9.419 23.499 1.00 0.00 C ATOM 878 CE1 HIS A 59 18.108 -8.184 24.723 1.00 0.00 C ATOM 879 NE2 HIS A 59 16.844 -8.278 24.299 1.00 0.00 N ATOM 0 H HIS A 59 18.936 -13.211 21.242 1.00 0.00 H new ATOM 0 HA HIS A 59 16.618 -11.583 21.939 1.00 0.00 H new ATOM 0 HB2 HIS A 59 18.681 -12.044 23.424 1.00 0.00 H new ATOM 0 HB3 HIS A 59 19.584 -11.006 22.340 1.00 0.00 H new ATOM 0 HD1 HIS A 59 19.862 -9.331 24.425 1.00 0.00 H new ATOM 0 HD2 HIS A 59 15.933 -9.795 22.992 1.00 0.00 H new ATOM 0 HE1 HIS A 59 18.474 -7.401 25.370 1.00 0.00 H new ATOM 887 N THR A 60 16.722 -10.090 19.930 1.00 0.00 N ATOM 888 CA THR A 60 16.778 -9.121 18.847 1.00 0.00 C ATOM 889 C THR A 60 16.536 -7.715 19.381 1.00 0.00 C ATOM 890 O THR A 60 15.514 -7.450 20.011 1.00 0.00 O ATOM 891 CB THR A 60 15.719 -9.461 17.802 1.00 0.00 C ATOM 892 OG1 THR A 60 15.985 -10.745 17.256 1.00 0.00 O ATOM 893 CG2 THR A 60 15.740 -8.418 16.690 1.00 0.00 C ATOM 0 H THR A 60 15.780 -10.346 20.226 1.00 0.00 H new ATOM 0 HA THR A 60 17.767 -9.159 18.391 1.00 0.00 H new ATOM 0 HB THR A 60 14.736 -9.464 18.273 1.00 0.00 H new ATOM 0 HG1 THR A 60 15.404 -11.409 17.683 1.00 0.00 H new ATOM 0 HG21 THR A 60 14.983 -8.664 15.946 1.00 0.00 H new ATOM 0 HG22 THR A 60 15.530 -7.434 17.110 1.00 0.00 H new ATOM 0 HG23 THR A 60 16.723 -8.409 16.218 1.00 0.00 H new ATOM 901 N VAL A 61 17.476 -6.815 19.119 1.00 0.00 N ATOM 902 CA VAL A 61 17.348 -5.439 19.577 1.00 0.00 C ATOM 903 C VAL A 61 17.300 -4.493 18.384 1.00 0.00 C ATOM 904 O VAL A 61 18.138 -4.559 17.485 1.00 0.00 O ATOM 905 CB VAL A 61 18.536 -5.079 20.474 1.00 0.00 C ATOM 906 CG1 VAL A 61 18.547 -3.577 20.761 1.00 0.00 C ATOM 907 CG2 VAL A 61 18.447 -5.842 21.797 1.00 0.00 C ATOM 0 H VAL A 61 18.329 -7.012 18.596 1.00 0.00 H new ATOM 0 HA VAL A 61 16.424 -5.340 20.146 1.00 0.00 H new ATOM 0 HB VAL A 61 19.454 -5.355 19.956 1.00 0.00 H new ATOM 0 HG11 VAL A 61 19.396 -3.335 21.400 1.00 0.00 H new ATOM 0 HG12 VAL A 61 18.630 -3.028 19.823 1.00 0.00 H new ATOM 0 HG13 VAL A 61 17.622 -3.296 21.265 1.00 0.00 H new ATOM 0 HG21 VAL A 61 19.297 -5.578 22.427 1.00 0.00 H new ATOM 0 HG22 VAL A 61 17.521 -5.578 22.308 1.00 0.00 H new ATOM 0 HG23 VAL A 61 18.460 -6.914 21.600 1.00 0.00 H new ATOM 917 N LEU A 62 16.306 -3.618 18.392 1.00 0.00 N ATOM 918 CA LEU A 62 16.118 -2.651 17.323 1.00 0.00 C ATOM 919 C LEU A 62 16.305 -1.234 17.836 1.00 0.00 C ATOM 920 O LEU A 62 15.975 -0.919 18.980 1.00 0.00 O ATOM 921 CB LEU A 62 14.715 -2.791 16.731 1.00 0.00 C ATOM 922 CG LEU A 62 14.685 -3.907 15.686 1.00 0.00 C ATOM 923 CD1 LEU A 62 15.260 -3.379 14.374 1.00 0.00 C ATOM 924 CD2 LEU A 62 15.514 -5.105 16.151 1.00 0.00 C ATOM 0 H LEU A 62 15.611 -3.559 19.136 1.00 0.00 H new ATOM 0 HA LEU A 62 16.864 -2.849 16.553 1.00 0.00 H new ATOM 0 HB2 LEU A 62 13.999 -3.007 17.524 1.00 0.00 H new ATOM 0 HB3 LEU A 62 14.410 -1.849 16.275 1.00 0.00 H new ATOM 0 HG LEU A 62 13.653 -4.228 15.545 1.00 0.00 H new ATOM 0 HD11 LEU A 62 15.242 -4.170 13.624 1.00 0.00 H new ATOM 0 HD12 LEU A 62 14.662 -2.536 14.027 1.00 0.00 H new ATOM 0 HD13 LEU A 62 16.288 -3.053 14.532 1.00 0.00 H new ATOM 0 HD21 LEU A 62 15.479 -5.888 15.393 1.00 0.00 H new ATOM 0 HD22 LEU A 62 16.547 -4.795 16.305 1.00 0.00 H new ATOM 0 HD23 LEU A 62 15.107 -5.488 17.087 1.00 0.00 H new ATOM 936 N SER A 63 16.834 -0.380 16.974 1.00 0.00 N ATOM 937 CA SER A 63 17.066 1.007 17.335 1.00 0.00 C ATOM 938 C SER A 63 16.682 1.939 16.200 1.00 0.00 C ATOM 939 O SER A 63 16.758 1.582 15.016 1.00 0.00 O ATOM 940 CB SER A 63 18.537 1.217 17.663 1.00 0.00 C ATOM 941 OG SER A 63 19.330 0.647 16.629 1.00 0.00 O ATOM 0 H SER A 63 17.110 -0.623 16.023 1.00 0.00 H new ATOM 0 HA SER A 63 16.449 1.233 18.205 1.00 0.00 H new ATOM 0 HB2 SER A 63 18.753 2.281 17.759 1.00 0.00 H new ATOM 0 HB3 SER A 63 18.779 0.755 18.620 1.00 0.00 H new ATOM 0 HG SER A 63 19.660 -0.230 16.916 1.00 0.00 H new ATOM 947 N GLY A 64 16.278 3.141 16.582 1.00 0.00 N ATOM 948 CA GLY A 64 15.883 4.152 15.616 1.00 0.00 C ATOM 949 C GLY A 64 16.583 5.479 15.900 1.00 0.00 C ATOM 950 O GLY A 64 16.578 5.966 17.038 1.00 0.00 O ATOM 0 H GLY A 64 16.215 3.439 17.555 1.00 0.00 H new ATOM 0 HA2 GLY A 64 16.129 3.815 14.609 1.00 0.00 H new ATOM 0 HA3 GLY A 64 14.802 4.291 15.650 1.00 0.00 H new ATOM 1102 N GLY A 74 -0.564 3.441 17.735 1.00 0.00 N ATOM 1103 CA GLY A 74 -0.792 2.040 17.404 1.00 0.00 C ATOM 1104 C GLY A 74 0.428 1.194 17.750 1.00 0.00 C ATOM 1105 O GLY A 74 0.303 0.013 18.067 1.00 0.00 O ATOM 0 HA2 GLY A 74 -1.662 1.671 17.947 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -1.016 1.945 16.342 1.00 0.00 H new ATOM 1109 N GLN A 75 1.609 1.801 17.683 1.00 0.00 N ATOM 1110 CA GLN A 75 2.838 1.075 17.996 1.00 0.00 C ATOM 1111 C GLN A 75 2.895 0.697 19.475 1.00 0.00 C ATOM 1112 O GLN A 75 3.335 -0.399 19.824 1.00 0.00 O ATOM 1113 CB GLN A 75 4.057 1.928 17.654 1.00 0.00 C ATOM 1114 CG GLN A 75 4.110 2.153 16.144 1.00 0.00 C ATOM 1115 CD GLN A 75 5.274 3.071 15.792 1.00 0.00 C ATOM 1116 OE1 GLN A 75 5.476 4.098 16.438 1.00 0.00 O ATOM 1117 NE2 GLN A 75 6.056 2.759 14.795 1.00 0.00 N ATOM 0 H GLN A 75 1.742 2.777 17.420 1.00 0.00 H new ATOM 0 HA GLN A 75 2.844 0.164 17.398 1.00 0.00 H new ATOM 0 HB2 GLN A 75 4.003 2.885 18.174 1.00 0.00 H new ATOM 0 HB3 GLN A 75 4.968 1.433 17.991 1.00 0.00 H new ATOM 0 HG2 GLN A 75 4.221 1.198 15.630 1.00 0.00 H new ATOM 0 HG3 GLN A 75 3.173 2.593 15.801 1.00 0.00 H new ATOM 0 HE21 GLN A 75 5.886 1.907 14.261 1.00 0.00 H new ATOM 0 HE22 GLN A 75 6.837 3.367 14.550 1.00 0.00 H new ATOM 1126 N LEU A 76 2.465 1.613 20.343 1.00 0.00 N ATOM 1127 CA LEU A 76 2.492 1.364 21.781 1.00 0.00 C ATOM 1128 C LEU A 76 1.189 0.731 22.255 1.00 0.00 C ATOM 1129 O LEU A 76 0.273 1.425 22.698 1.00 0.00 O ATOM 1130 CB LEU A 76 2.705 2.674 22.533 1.00 0.00 C ATOM 1131 CG LEU A 76 3.781 3.503 21.831 1.00 0.00 C ATOM 1132 CD1 LEU A 76 4.302 4.583 22.780 1.00 0.00 C ATOM 1133 CD2 LEU A 76 4.936 2.602 21.394 1.00 0.00 C ATOM 0 H LEU A 76 2.097 2.526 20.077 1.00 0.00 H new ATOM 0 HA LEU A 76 3.313 0.677 21.984 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.771 3.235 22.577 1.00 0.00 H new ATOM 0 HB3 LEU A 76 3.003 2.470 23.561 1.00 0.00 H new ATOM 0 HG LEU A 76 3.345 3.975 20.950 1.00 0.00 H new ATOM 0 HD11 LEU A 76 5.069 5.171 22.276 1.00 0.00 H new ATOM 0 HD12 LEU A 76 3.480 5.235 23.076 1.00 0.00 H new ATOM 0 HD13 LEU A 76 4.729 4.113 23.666 1.00 0.00 H new ATOM 0 HD21 LEU A 76 5.697 3.202 20.895 1.00 0.00 H new ATOM 0 HD22 LEU A 76 5.371 2.118 22.269 1.00 0.00 H new ATOM 0 HD23 LEU A 76 4.565 1.842 20.706 1.00 0.00 H new ATOM 1145 N LYS A 77 1.124 -0.588 22.167 1.00 0.00 N ATOM 1146 CA LYS A 77 -0.058 -1.328 22.596 1.00 0.00 C ATOM 1147 C LYS A 77 0.167 -2.825 22.403 1.00 0.00 C ATOM 1148 O LYS A 77 0.981 -3.229 21.579 1.00 0.00 O ATOM 1149 CB LYS A 77 -1.282 -0.878 21.806 1.00 0.00 C ATOM 1150 CG LYS A 77 -1.173 -1.380 20.373 1.00 0.00 C ATOM 1151 CD LYS A 77 -2.384 -0.895 19.584 1.00 0.00 C ATOM 1152 CE LYS A 77 -2.376 -1.545 18.205 1.00 0.00 C ATOM 1153 NZ LYS A 77 -3.661 -1.247 17.517 1.00 0.00 N ATOM 0 H LYS A 77 1.877 -1.172 21.802 1.00 0.00 H new ATOM 0 HA LYS A 77 -0.232 -1.127 23.653 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -2.190 -1.264 22.270 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -1.356 0.209 21.817 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -0.254 -1.014 19.915 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -1.125 -2.469 20.358 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -3.303 -1.148 20.113 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -2.360 0.190 19.488 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -1.539 -1.169 17.617 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -2.241 -2.623 18.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -3.474 -0.996 16.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -4.276 -2.085 17.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -4.133 -0.451 17.992 1.00 0.00 H new ATOM 1167 N GLU A 78 -0.557 -3.633 23.176 1.00 0.00 N ATOM 1168 CA GLU A 78 -0.442 -5.091 23.111 1.00 0.00 C ATOM 1169 C GLU A 78 -1.232 -5.640 21.939 1.00 0.00 C ATOM 1170 O GLU A 78 -1.098 -6.807 21.570 1.00 0.00 O ATOM 1171 CB GLU A 78 -0.937 -5.720 24.417 1.00 0.00 C ATOM 1172 CG GLU A 78 0.000 -5.335 25.570 1.00 0.00 C ATOM 1173 CD GLU A 78 -0.513 -5.933 26.878 1.00 0.00 C ATOM 1174 OE1 GLU A 78 -1.503 -6.645 26.834 1.00 0.00 O ATOM 1175 OE2 GLU A 78 0.092 -5.671 27.905 1.00 0.00 O ATOM 0 H GLU A 78 -1.236 -3.300 23.861 1.00 0.00 H new ATOM 0 HA GLU A 78 0.609 -5.345 22.970 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -1.951 -5.382 24.632 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -0.977 -6.805 24.316 1.00 0.00 H new ATOM 0 HG2 GLU A 78 1.009 -5.695 25.366 1.00 0.00 H new ATOM 0 HG3 GLU A 78 0.060 -4.250 25.655 1.00 0.00 H new ATOM 1182 N LYS A 79 -2.052 -4.791 21.353 1.00 0.00 N ATOM 1183 CA LYS A 79 -2.855 -5.194 20.217 1.00 0.00 C ATOM 1184 C LYS A 79 -2.005 -5.172 18.948 1.00 0.00 C ATOM 1185 O LYS A 79 -2.391 -5.735 17.925 1.00 0.00 O ATOM 1186 CB LYS A 79 -4.045 -4.252 20.070 1.00 0.00 C ATOM 1187 CG LYS A 79 -4.793 -4.193 21.393 1.00 0.00 C ATOM 1188 CD LYS A 79 -5.434 -5.549 21.668 1.00 0.00 C ATOM 1189 CE LYS A 79 -6.514 -5.377 22.728 1.00 0.00 C ATOM 1190 NZ LYS A 79 -6.837 -6.697 23.335 1.00 0.00 N ATOM 0 H LYS A 79 -2.179 -3.822 21.643 1.00 0.00 H new ATOM 0 HA LYS A 79 -3.223 -6.208 20.376 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -3.705 -3.257 19.785 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -4.707 -4.602 19.278 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -4.109 -3.931 22.200 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -5.557 -3.417 21.358 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -5.865 -5.955 20.753 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -4.681 -6.260 22.008 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -6.174 -4.685 23.499 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -7.409 -4.942 22.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -7.575 -6.575 24.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -7.179 -7.344 22.596 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -5.983 -7.095 23.775 1.00 0.00 H new ATOM 1204 N ASP A 80 -0.844 -4.511 19.020 1.00 0.00 N ATOM 1205 CA ASP A 80 0.040 -4.422 17.854 1.00 0.00 C ATOM 1206 C ASP A 80 0.823 -5.724 17.664 1.00 0.00 C ATOM 1207 O ASP A 80 1.003 -6.493 18.609 1.00 0.00 O ATOM 1208 CB ASP A 80 1.010 -3.251 18.015 1.00 0.00 C ATOM 1209 CG ASP A 80 1.658 -2.913 16.674 1.00 0.00 C ATOM 1210 OD1 ASP A 80 0.953 -2.438 15.800 1.00 0.00 O ATOM 1211 OD2 ASP A 80 2.852 -3.131 16.544 1.00 0.00 O ATOM 0 H ASP A 80 -0.500 -4.039 19.856 1.00 0.00 H new ATOM 0 HA ASP A 80 -0.577 -4.257 16.971 1.00 0.00 H new ATOM 0 HB2 ASP A 80 0.479 -2.380 18.400 1.00 0.00 H new ATOM 0 HB3 ASP A 80 1.779 -3.504 18.745 1.00 0.00 H new ATOM 1216 N THR A 81 1.291 -5.962 16.437 1.00 0.00 N ATOM 1217 CA THR A 81 2.051 -7.164 16.132 1.00 0.00 C ATOM 1218 C THR A 81 3.131 -6.854 15.120 1.00 0.00 C ATOM 1219 O THR A 81 2.844 -6.442 14.007 1.00 0.00 O ATOM 1220 CB THR A 81 1.131 -8.246 15.582 1.00 0.00 C ATOM 1221 OG1 THR A 81 -0.080 -7.657 15.133 1.00 0.00 O ATOM 1222 CG2 THR A 81 0.833 -9.260 16.679 1.00 0.00 C ATOM 0 H THR A 81 1.154 -5.336 15.643 1.00 0.00 H new ATOM 0 HA THR A 81 2.513 -7.524 17.051 1.00 0.00 H new ATOM 0 HB THR A 81 1.617 -8.749 14.746 1.00 0.00 H new ATOM 0 HG1 THR A 81 -0.671 -8.354 14.778 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.175 -10.036 16.288 1.00 0.00 H new ATOM 0 HG22 THR A 81 1.765 -9.712 17.019 1.00 0.00 H new ATOM 0 HG23 THR A 81 0.346 -8.759 17.516 1.00 0.00 H new ATOM 1230 N LEU A 82 4.370 -7.048 15.515 1.00 0.00 N ATOM 1231 CA LEU A 82 5.481 -6.764 14.628 1.00 0.00 C ATOM 1232 C LEU A 82 5.937 -8.028 13.916 1.00 0.00 C ATOM 1233 O LEU A 82 6.073 -9.080 14.534 1.00 0.00 O ATOM 1234 CB LEU A 82 6.636 -6.203 15.442 1.00 0.00 C ATOM 1235 CG LEU A 82 6.151 -5.032 16.299 1.00 0.00 C ATOM 1236 CD1 LEU A 82 7.345 -4.383 17.006 1.00 0.00 C ATOM 1237 CD2 LEU A 82 5.455 -3.995 15.414 1.00 0.00 C ATOM 0 H LEU A 82 4.634 -7.398 16.436 1.00 0.00 H new ATOM 0 HA LEU A 82 5.158 -6.039 13.880 1.00 0.00 H new ATOM 0 HB2 LEU A 82 7.055 -6.982 16.079 1.00 0.00 H new ATOM 0 HB3 LEU A 82 7.434 -5.872 14.777 1.00 0.00 H new ATOM 0 HG LEU A 82 5.445 -5.401 17.043 1.00 0.00 H new ATOM 0 HD11 LEU A 82 6.997 -3.549 17.616 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.835 -5.119 17.643 1.00 0.00 H new ATOM 0 HD13 LEU A 82 8.054 -4.018 16.263 1.00 0.00 H new ATOM 0 HD21 LEU A 82 5.112 -3.163 16.029 1.00 0.00 H new ATOM 0 HD22 LEU A 82 6.156 -3.627 14.665 1.00 0.00 H new ATOM 0 HD23 LEU A 82 4.601 -4.455 14.917 1.00 0.00 H new ATOM 1249 N VAL A 83 6.169 -7.930 12.615 1.00 0.00 N ATOM 1250 CA VAL A 83 6.605 -9.090 11.855 1.00 0.00 C ATOM 1251 C VAL A 83 7.981 -8.843 11.250 1.00 0.00 C ATOM 1252 O VAL A 83 8.202 -7.846 10.566 1.00 0.00 O ATOM 1253 CB VAL A 83 5.600 -9.369 10.748 1.00 0.00 C ATOM 1254 CG1 VAL A 83 5.690 -10.836 10.319 1.00 0.00 C ATOM 1255 CG2 VAL A 83 4.183 -9.051 11.247 1.00 0.00 C ATOM 0 H VAL A 83 6.065 -7.073 12.071 1.00 0.00 H new ATOM 0 HA VAL A 83 6.669 -9.950 12.522 1.00 0.00 H new ATOM 0 HB VAL A 83 5.826 -8.738 9.889 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.967 -11.028 9.526 1.00 0.00 H new ATOM 0 HG12 VAL A 83 6.695 -11.047 9.953 1.00 0.00 H new ATOM 0 HG13 VAL A 83 5.472 -11.479 11.172 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.464 -9.251 10.453 1.00 0.00 H new ATOM 0 HG22 VAL A 83 3.953 -9.675 12.111 1.00 0.00 H new ATOM 0 HG23 VAL A 83 4.125 -8.001 11.532 1.00 0.00 H new ATOM 1265 N LEU A 84 8.908 -9.754 11.520 1.00 0.00 N ATOM 1266 CA LEU A 84 10.267 -9.625 11.013 1.00 0.00 C ATOM 1267 C LEU A 84 10.587 -10.706 9.992 1.00 0.00 C ATOM 1268 O LEU A 84 10.300 -11.880 10.211 1.00 0.00 O ATOM 1269 CB LEU A 84 11.248 -9.754 12.166 1.00 0.00 C ATOM 1270 CG LEU A 84 11.387 -8.411 12.867 1.00 0.00 C ATOM 1271 CD1 LEU A 84 12.150 -7.433 11.971 1.00 0.00 C ATOM 1272 CD2 LEU A 84 9.998 -7.858 13.173 1.00 0.00 C ATOM 0 H LEU A 84 8.744 -10.587 12.085 1.00 0.00 H new ATOM 0 HA LEU A 84 10.352 -8.650 10.533 1.00 0.00 H new ATOM 0 HB2 LEU A 84 10.900 -10.510 12.870 1.00 0.00 H new ATOM 0 HB3 LEU A 84 12.218 -10.085 11.796 1.00 0.00 H new ATOM 0 HG LEU A 84 11.940 -8.542 13.797 1.00 0.00 H new ATOM 0 HD11 LEU A 84 12.246 -6.473 12.479 1.00 0.00 H new ATOM 0 HD12 LEU A 84 13.142 -7.832 11.759 1.00 0.00 H new ATOM 0 HD13 LEU A 84 11.606 -7.296 11.036 1.00 0.00 H new ATOM 0 HD21 LEU A 84 10.092 -6.895 13.676 1.00 0.00 H new ATOM 0 HD22 LEU A 84 9.445 -7.729 12.243 1.00 0.00 H new ATOM 0 HD23 LEU A 84 9.464 -8.554 13.820 1.00 0.00 H new ATOM 1284 N GLU A 85 11.199 -10.303 8.888 1.00 0.00 N ATOM 1285 CA GLU A 85 11.574 -11.256 7.847 1.00 0.00 C ATOM 1286 C GLU A 85 13.084 -11.487 7.834 1.00 0.00 C ATOM 1287 O GLU A 85 13.870 -10.543 7.735 1.00 0.00 O ATOM 1288 CB GLU A 85 11.123 -10.742 6.477 1.00 0.00 C ATOM 1289 CG GLU A 85 9.740 -11.301 6.112 1.00 0.00 C ATOM 1290 CD GLU A 85 8.798 -10.156 5.741 1.00 0.00 C ATOM 1291 OE1 GLU A 85 8.689 -9.227 6.525 1.00 0.00 O ATOM 1292 OE2 GLU A 85 8.196 -10.229 4.684 1.00 0.00 O ATOM 0 H GLU A 85 11.446 -9.334 8.688 1.00 0.00 H new ATOM 0 HA GLU A 85 11.079 -12.203 8.062 1.00 0.00 H new ATOM 0 HB2 GLU A 85 11.089 -9.653 6.486 1.00 0.00 H new ATOM 0 HB3 GLU A 85 11.849 -11.032 5.718 1.00 0.00 H new ATOM 0 HG2 GLU A 85 9.828 -11.996 5.277 1.00 0.00 H new ATOM 0 HG3 GLU A 85 9.331 -11.862 6.952 1.00 0.00 H new ATOM 1299 N TYR A 86 13.474 -12.754 7.942 1.00 0.00 N ATOM 1300 CA TYR A 86 14.888 -13.117 7.950 1.00 0.00 C ATOM 1301 C TYR A 86 15.113 -14.494 7.317 1.00 0.00 C ATOM 1302 O TYR A 86 14.420 -15.449 7.641 1.00 0.00 O ATOM 1303 CB TYR A 86 15.393 -13.140 9.394 1.00 0.00 C ATOM 1304 CG TYR A 86 16.850 -12.755 9.420 1.00 0.00 C ATOM 1305 CD1 TYR A 86 17.790 -13.504 8.702 1.00 0.00 C ATOM 1306 CD2 TYR A 86 17.255 -11.636 10.149 1.00 0.00 C ATOM 1307 CE1 TYR A 86 19.139 -13.130 8.717 1.00 0.00 C ATOM 1308 CE2 TYR A 86 18.603 -11.257 10.161 1.00 0.00 C ATOM 1309 CZ TYR A 86 19.546 -12.005 9.445 1.00 0.00 C ATOM 1310 OH TYR A 86 20.875 -11.632 9.454 1.00 0.00 O ATOM 0 H TYR A 86 12.834 -13.544 8.025 1.00 0.00 H new ATOM 0 HA TYR A 86 15.435 -12.377 7.366 1.00 0.00 H new ATOM 0 HB2 TYR A 86 14.812 -12.450 10.005 1.00 0.00 H new ATOM 0 HB3 TYR A 86 15.260 -14.134 9.822 1.00 0.00 H new ATOM 0 HD1 TYR A 86 17.475 -14.369 8.137 1.00 0.00 H new ATOM 0 HD2 TYR A 86 16.528 -11.062 10.704 1.00 0.00 H new ATOM 0 HE1 TYR A 86 19.866 -13.709 8.167 1.00 0.00 H new ATOM 0 HE2 TYR A 86 18.915 -10.389 10.722 1.00 0.00 H new ATOM 0 HH TYR A 86 20.986 -10.830 10.006 1.00 0.00 H new ATOM 1320 N ASP A 87 16.100 -14.593 6.429 1.00 0.00 N ATOM 1321 CA ASP A 87 16.419 -15.869 5.788 1.00 0.00 C ATOM 1322 C ASP A 87 15.190 -16.517 5.167 1.00 0.00 C ATOM 1323 O ASP A 87 14.895 -17.685 5.422 1.00 0.00 O ATOM 1324 CB ASP A 87 17.038 -16.824 6.813 1.00 0.00 C ATOM 1325 CG ASP A 87 18.536 -16.563 6.922 1.00 0.00 C ATOM 1326 OD1 ASP A 87 18.985 -15.573 6.369 1.00 0.00 O ATOM 1327 OD2 ASP A 87 19.214 -17.360 7.550 1.00 0.00 O ATOM 0 H ASP A 87 16.689 -13.813 6.138 1.00 0.00 H new ATOM 0 HA ASP A 87 17.130 -15.666 4.987 1.00 0.00 H new ATOM 0 HB2 ASP A 87 16.564 -16.686 7.785 1.00 0.00 H new ATOM 0 HB3 ASP A 87 16.860 -17.857 6.515 1.00 0.00 H new ATOM 1332 N ASN A 88 14.477 -15.755 4.348 1.00 0.00 N ATOM 1333 CA ASN A 88 13.285 -16.265 3.688 1.00 0.00 C ATOM 1334 C ASN A 88 12.306 -16.798 4.718 1.00 0.00 C ATOM 1335 O ASN A 88 11.491 -17.673 4.424 1.00 0.00 O ATOM 1336 CB ASN A 88 13.665 -17.387 2.720 1.00 0.00 C ATOM 1337 CG ASN A 88 14.417 -16.815 1.523 1.00 0.00 C ATOM 1338 OD1 ASN A 88 14.066 -15.746 1.022 1.00 0.00 O ATOM 1339 ND2 ASN A 88 15.439 -17.463 1.035 1.00 0.00 N ATOM 0 H ASN A 88 14.703 -14.785 4.126 1.00 0.00 H new ATOM 0 HA ASN A 88 12.816 -15.451 3.134 1.00 0.00 H new ATOM 0 HB2 ASN A 88 14.285 -18.124 3.231 1.00 0.00 H new ATOM 0 HB3 ASN A 88 12.768 -17.905 2.382 1.00 0.00 H new ATOM 0 HD21 ASN A 88 15.949 -17.084 0.237 1.00 0.00 H new ATOM 0 HD22 ASN A 88 15.728 -18.348 1.452 1.00 0.00 H new ATOM 1346 N LYS A 89 12.378 -16.252 5.922 1.00 0.00 N ATOM 1347 CA LYS A 89 11.477 -16.672 6.981 1.00 0.00 C ATOM 1348 C LYS A 89 10.831 -15.457 7.628 1.00 0.00 C ATOM 1349 O LYS A 89 11.481 -14.429 7.824 1.00 0.00 O ATOM 1350 CB LYS A 89 12.223 -17.488 8.036 1.00 0.00 C ATOM 1351 CG LYS A 89 12.691 -18.810 7.428 1.00 0.00 C ATOM 1352 CD LYS A 89 14.002 -19.242 8.073 1.00 0.00 C ATOM 1353 CE LYS A 89 13.788 -19.474 9.570 1.00 0.00 C ATOM 1354 NZ LYS A 89 15.005 -20.103 10.155 1.00 0.00 N ATOM 0 H LYS A 89 13.043 -15.526 6.187 1.00 0.00 H new ATOM 0 HA LYS A 89 10.702 -17.300 6.542 1.00 0.00 H new ATOM 0 HB2 LYS A 89 13.079 -16.924 8.408 1.00 0.00 H new ATOM 0 HB3 LYS A 89 11.572 -17.679 8.889 1.00 0.00 H new ATOM 0 HG2 LYS A 89 11.932 -19.578 7.577 1.00 0.00 H new ATOM 0 HG3 LYS A 89 12.824 -18.698 6.352 1.00 0.00 H new ATOM 0 HD2 LYS A 89 14.367 -20.155 7.602 1.00 0.00 H new ATOM 0 HD3 LYS A 89 14.764 -18.478 7.919 1.00 0.00 H new ATOM 0 HE2 LYS A 89 13.579 -18.528 10.069 1.00 0.00 H new ATOM 0 HE3 LYS A 89 12.922 -20.116 9.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 14.859 -20.261 11.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 15.185 -21.014 9.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 15.822 -19.475 10.016 1.00 0.00 H new ATOM 1368 N THR A 90 9.552 -15.573 7.957 1.00 0.00 N ATOM 1369 CA THR A 90 8.837 -14.464 8.578 1.00 0.00 C ATOM 1370 C THR A 90 8.523 -14.784 10.033 1.00 0.00 C ATOM 1371 O THR A 90 7.916 -15.808 10.337 1.00 0.00 O ATOM 1372 CB THR A 90 7.524 -14.198 7.825 1.00 0.00 C ATOM 1373 OG1 THR A 90 7.669 -14.599 6.472 1.00 0.00 O ATOM 1374 CG2 THR A 90 7.158 -12.712 7.868 1.00 0.00 C ATOM 0 H THR A 90 8.993 -16.413 7.807 1.00 0.00 H new ATOM 0 HA THR A 90 9.471 -13.578 8.534 1.00 0.00 H new ATOM 0 HB THR A 90 6.730 -14.768 8.307 1.00 0.00 H new ATOM 0 HG1 THR A 90 6.832 -14.432 5.990 1.00 0.00 H new ATOM 0 HG21 THR A 90 6.225 -12.551 7.328 1.00 0.00 H new ATOM 0 HG22 THR A 90 7.036 -12.397 8.904 1.00 0.00 H new ATOM 0 HG23 THR A 90 7.952 -12.128 7.402 1.00 0.00 H new ATOM 1382 N TYR A 91 8.942 -13.894 10.921 1.00 0.00 N ATOM 1383 CA TYR A 91 8.707 -14.062 12.350 1.00 0.00 C ATOM 1384 C TYR A 91 7.589 -13.135 12.811 1.00 0.00 C ATOM 1385 O TYR A 91 7.556 -11.961 12.444 1.00 0.00 O ATOM 1386 CB TYR A 91 9.981 -13.732 13.116 1.00 0.00 C ATOM 1387 CG TYR A 91 10.982 -14.831 12.894 1.00 0.00 C ATOM 1388 CD1 TYR A 91 11.507 -15.033 11.617 1.00 0.00 C ATOM 1389 CD2 TYR A 91 11.385 -15.648 13.958 1.00 0.00 C ATOM 1390 CE1 TYR A 91 12.434 -16.052 11.396 1.00 0.00 C ATOM 1391 CE2 TYR A 91 12.317 -16.670 13.738 1.00 0.00 C ATOM 1392 CZ TYR A 91 12.842 -16.871 12.454 1.00 0.00 C ATOM 1393 OH TYR A 91 13.761 -17.877 12.235 1.00 0.00 O ATOM 0 H TYR A 91 9.449 -13.043 10.676 1.00 0.00 H new ATOM 0 HA TYR A 91 8.417 -15.095 12.542 1.00 0.00 H new ATOM 0 HB2 TYR A 91 10.387 -12.778 12.779 1.00 0.00 H new ATOM 0 HB3 TYR A 91 9.765 -13.628 14.179 1.00 0.00 H new ATOM 0 HD1 TYR A 91 11.196 -14.400 10.799 1.00 0.00 H new ATOM 0 HD2 TYR A 91 10.978 -15.490 14.946 1.00 0.00 H new ATOM 0 HE1 TYR A 91 12.837 -16.209 10.406 1.00 0.00 H new ATOM 0 HE2 TYR A 91 12.630 -17.302 14.556 1.00 0.00 H new ATOM 0 HH TYR A 91 13.424 -18.716 12.613 1.00 0.00 H new ATOM 1403 N THR A 92 6.676 -13.667 13.615 1.00 0.00 N ATOM 1404 CA THR A 92 5.557 -12.877 14.117 1.00 0.00 C ATOM 1405 C THR A 92 5.785 -12.462 15.571 1.00 0.00 C ATOM 1406 O THR A 92 5.812 -13.301 16.466 1.00 0.00 O ATOM 1407 CB THR A 92 4.265 -13.698 14.018 1.00 0.00 C ATOM 1408 OG1 THR A 92 4.587 -15.051 13.738 1.00 0.00 O ATOM 1409 CG2 THR A 92 3.376 -13.146 12.905 1.00 0.00 C ATOM 0 H THR A 92 6.687 -14.636 13.932 1.00 0.00 H new ATOM 0 HA THR A 92 5.474 -11.975 13.510 1.00 0.00 H new ATOM 0 HB THR A 92 3.729 -13.635 14.965 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.927 -15.124 12.822 1.00 0.00 H new ATOM 0 HG21 THR A 92 2.462 -13.736 12.843 1.00 0.00 H new ATOM 0 HG22 THR A 92 3.124 -12.108 13.122 1.00 0.00 H new ATOM 0 HG23 THR A 92 3.907 -13.200 11.955 1.00 0.00 H new ATOM 1417 N TYR A 93 5.942 -11.158 15.791 1.00 0.00 N ATOM 1418 CA TYR A 93 6.156 -10.628 17.134 1.00 0.00 C ATOM 1419 C TYR A 93 4.953 -9.811 17.588 1.00 0.00 C ATOM 1420 O TYR A 93 4.292 -9.160 16.780 1.00 0.00 O ATOM 1421 CB TYR A 93 7.402 -9.743 17.153 1.00 0.00 C ATOM 1422 CG TYR A 93 8.626 -10.600 17.014 1.00 0.00 C ATOM 1423 CD1 TYR A 93 9.202 -11.167 18.148 1.00 0.00 C ATOM 1424 CD2 TYR A 93 9.185 -10.822 15.753 1.00 0.00 C ATOM 1425 CE1 TYR A 93 10.339 -11.964 18.031 1.00 0.00 C ATOM 1426 CE2 TYR A 93 10.324 -11.619 15.629 1.00 0.00 C ATOM 1427 CZ TYR A 93 10.904 -12.193 16.770 1.00 0.00 C ATOM 1428 OH TYR A 93 12.031 -12.981 16.651 1.00 0.00 O ATOM 0 H TYR A 93 5.925 -10.450 15.057 1.00 0.00 H new ATOM 0 HA TYR A 93 6.291 -11.468 17.815 1.00 0.00 H new ATOM 0 HB2 TYR A 93 7.359 -9.018 16.340 1.00 0.00 H new ATOM 0 HB3 TYR A 93 7.445 -9.177 18.083 1.00 0.00 H new ATOM 0 HD1 TYR A 93 8.767 -10.989 19.120 1.00 0.00 H new ATOM 0 HD2 TYR A 93 8.737 -10.378 14.876 1.00 0.00 H new ATOM 0 HE1 TYR A 93 10.784 -12.404 18.911 1.00 0.00 H new ATOM 0 HE2 TYR A 93 10.758 -11.794 14.656 1.00 0.00 H new ATOM 0 HH TYR A 93 12.155 -13.235 15.713 1.00 0.00 H new ATOM 1438 N GLU A 94 4.681 -9.844 18.887 1.00 0.00 N ATOM 1439 CA GLU A 94 3.560 -9.097 19.438 1.00 0.00 C ATOM 1440 C GLU A 94 4.018 -8.237 20.598 1.00 0.00 C ATOM 1441 O GLU A 94 4.908 -8.623 21.360 1.00 0.00 O ATOM 1442 CB GLU A 94 2.455 -10.051 19.894 1.00 0.00 C ATOM 1443 CG GLU A 94 2.921 -10.823 21.128 1.00 0.00 C ATOM 1444 CD GLU A 94 1.790 -11.693 21.674 1.00 0.00 C ATOM 1445 OE1 GLU A 94 0.650 -11.263 21.606 1.00 0.00 O ATOM 1446 OE2 GLU A 94 2.083 -12.776 22.155 1.00 0.00 O ATOM 0 H GLU A 94 5.217 -10.376 19.573 1.00 0.00 H new ATOM 0 HA GLU A 94 3.161 -8.449 18.658 1.00 0.00 H new ATOM 0 HB2 GLU A 94 1.549 -9.491 20.124 1.00 0.00 H new ATOM 0 HB3 GLU A 94 2.206 -10.745 19.091 1.00 0.00 H new ATOM 0 HG2 GLU A 94 3.777 -11.448 20.872 1.00 0.00 H new ATOM 0 HG3 GLU A 94 3.254 -10.125 21.896 1.00 0.00 H new ATOM 1453 N ILE A 95 3.418 -7.065 20.737 1.00 0.00 N ATOM 1454 CA ILE A 95 3.809 -6.185 21.816 1.00 0.00 C ATOM 1455 C ILE A 95 3.427 -6.790 23.154 1.00 0.00 C ATOM 1456 O ILE A 95 2.253 -7.047 23.423 1.00 0.00 O ATOM 1457 CB ILE A 95 3.108 -4.849 21.652 1.00 0.00 C ATOM 1458 CG1 ILE A 95 3.777 -4.051 20.542 1.00 0.00 C ATOM 1459 CG2 ILE A 95 3.170 -4.055 22.955 1.00 0.00 C ATOM 1460 CD1 ILE A 95 5.136 -3.529 21.005 1.00 0.00 C ATOM 0 H ILE A 95 2.678 -6.711 20.131 1.00 0.00 H new ATOM 0 HA ILE A 95 4.890 -6.046 21.786 1.00 0.00 H new ATOM 0 HB ILE A 95 2.064 -5.031 21.395 1.00 0.00 H new ATOM 0 HG12 ILE A 95 3.903 -4.678 19.660 1.00 0.00 H new ATOM 0 HG13 ILE A 95 3.140 -3.216 20.251 1.00 0.00 H new ATOM 0 HG21 ILE A 95 2.663 -3.099 22.823 1.00 0.00 H new ATOM 0 HG22 ILE A 95 2.680 -4.619 23.748 1.00 0.00 H new ATOM 0 HG23 ILE A 95 4.211 -3.880 23.225 1.00 0.00 H new ATOM 0 HD11 ILE A 95 5.601 -2.961 20.200 1.00 0.00 H new ATOM 0 HD12 ILE A 95 5.001 -2.884 21.873 1.00 0.00 H new ATOM 0 HD13 ILE A 95 5.777 -4.369 21.273 1.00 0.00 H new ATOM 1472 N GLN A 96 4.432 -7.002 23.985 1.00 0.00 N ATOM 1473 CA GLN A 96 4.214 -7.569 25.310 1.00 0.00 C ATOM 1474 C GLN A 96 4.079 -6.466 26.349 1.00 0.00 C ATOM 1475 O GLN A 96 3.047 -6.340 27.006 1.00 0.00 O ATOM 1476 CB GLN A 96 5.381 -8.476 25.696 1.00 0.00 C ATOM 1477 CG GLN A 96 5.378 -9.719 24.810 1.00 0.00 C ATOM 1478 CD GLN A 96 4.171 -10.597 25.142 1.00 0.00 C ATOM 1479 OE1 GLN A 96 3.471 -11.128 24.175 1.00 0.00 O flip ATOM 1480 NE2 GLN A 96 3.863 -10.812 26.314 1.00 0.00 N flip ATOM 0 H GLN A 96 5.406 -6.792 23.769 1.00 0.00 H new ATOM 0 HA GLN A 96 3.292 -8.150 25.280 1.00 0.00 H new ATOM 0 HB2 GLN A 96 6.324 -7.940 25.585 1.00 0.00 H new ATOM 0 HB3 GLN A 96 5.300 -8.764 26.744 1.00 0.00 H new ATOM 0 HG2 GLN A 96 5.348 -9.427 23.760 1.00 0.00 H new ATOM 0 HG3 GLN A 96 6.299 -10.283 24.957 1.00 0.00 H new ATOM 0 HE21 GLN A 96 4.409 -10.398 27.069 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.061 -11.405 26.530 1.00 0.00 H new ATOM 1489 N LYS A 97 5.131 -5.668 26.499 1.00 0.00 N ATOM 1490 CA LYS A 97 5.112 -4.583 27.468 1.00 0.00 C ATOM 1491 C LYS A 97 5.964 -3.421 26.986 1.00 0.00 C ATOM 1492 O LYS A 97 7.031 -3.610 26.390 1.00 0.00 O ATOM 1493 CB LYS A 97 5.618 -5.077 28.827 1.00 0.00 C ATOM 1494 CG LYS A 97 5.612 -3.917 29.828 1.00 0.00 C ATOM 1495 CD LYS A 97 6.047 -4.427 31.203 1.00 0.00 C ATOM 1496 CE LYS A 97 6.037 -3.270 32.205 1.00 0.00 C ATOM 1497 NZ LYS A 97 4.635 -2.822 32.435 1.00 0.00 N ATOM 0 H LYS A 97 5.998 -5.752 25.968 1.00 0.00 H new ATOM 0 HA LYS A 97 4.084 -4.238 27.577 1.00 0.00 H new ATOM 0 HB2 LYS A 97 4.986 -5.887 29.190 1.00 0.00 H new ATOM 0 HB3 LYS A 97 6.626 -5.480 28.727 1.00 0.00 H new ATOM 0 HG2 LYS A 97 6.285 -3.129 29.491 1.00 0.00 H new ATOM 0 HG3 LYS A 97 4.615 -3.480 29.889 1.00 0.00 H new ATOM 0 HD2 LYS A 97 5.376 -5.218 31.538 1.00 0.00 H new ATOM 0 HD3 LYS A 97 7.045 -4.861 31.142 1.00 0.00 H new ATOM 0 HE2 LYS A 97 6.488 -3.586 33.146 1.00 0.00 H new ATOM 0 HE3 LYS A 97 6.637 -2.442 31.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 4.591 -2.253 33.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 4.317 -2.248 31.628 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 4.017 -3.653 32.533 1.00 0.00 H new ATOM 1511 N ILE A 98 5.480 -2.215 27.230 1.00 0.00 N ATOM 1512 CA ILE A 98 6.202 -1.032 26.799 1.00 0.00 C ATOM 1513 C ILE A 98 6.622 -0.186 27.989 1.00 0.00 C ATOM 1514 O ILE A 98 5.846 0.022 28.923 1.00 0.00 O ATOM 1515 CB ILE A 98 5.336 -0.185 25.862 1.00 0.00 C ATOM 1516 CG1 ILE A 98 4.520 -1.097 24.937 1.00 0.00 C ATOM 1517 CG2 ILE A 98 6.237 0.723 25.020 1.00 0.00 C ATOM 1518 CD1 ILE A 98 5.450 -2.039 24.185 1.00 0.00 C ATOM 0 H ILE A 98 4.603 -2.031 27.717 1.00 0.00 H new ATOM 0 HA ILE A 98 7.093 -1.366 26.268 1.00 0.00 H new ATOM 0 HB ILE A 98 4.654 0.424 26.456 1.00 0.00 H new ATOM 0 HG12 ILE A 98 3.801 -1.672 25.521 1.00 0.00 H new ATOM 0 HG13 ILE A 98 3.949 -0.495 24.230 1.00 0.00 H new ATOM 0 HG21 ILE A 98 5.623 1.327 24.352 1.00 0.00 H new ATOM 0 HG22 ILE A 98 6.810 1.377 25.677 1.00 0.00 H new ATOM 0 HG23 ILE A 98 6.921 0.112 24.431 1.00 0.00 H new ATOM 0 HD11 ILE A 98 4.863 -2.683 23.530 1.00 0.00 H new ATOM 0 HD12 ILE A 98 6.152 -1.457 23.588 1.00 0.00 H new ATOM 0 HD13 ILE A 98 6.001 -2.652 24.898 1.00 0.00 H new ATOM 1530 N TRP A 99 7.856 0.300 27.957 1.00 0.00 N ATOM 1531 CA TRP A 99 8.351 1.121 29.049 1.00 0.00 C ATOM 1532 C TRP A 99 9.466 2.057 28.582 1.00 0.00 C ATOM 1533 O TRP A 99 9.854 2.043 27.414 1.00 0.00 O ATOM 1534 CB TRP A 99 8.863 0.228 30.167 1.00 0.00 C ATOM 1535 CG TRP A 99 10.161 -0.365 29.750 1.00 0.00 C ATOM 1536 CD1 TRP A 99 11.353 0.259 29.828 1.00 0.00 C ATOM 1537 CD2 TRP A 99 10.418 -1.677 29.178 1.00 0.00 C ATOM 1538 NE1 TRP A 99 12.333 -0.592 29.360 1.00 0.00 N ATOM 1539 CE2 TRP A 99 11.806 -1.801 28.946 1.00 0.00 C ATOM 1540 CE3 TRP A 99 9.588 -2.762 28.849 1.00 0.00 C ATOM 1541 CZ2 TRP A 99 12.356 -2.963 28.407 1.00 0.00 C ATOM 1542 CZ3 TRP A 99 10.136 -3.934 28.304 1.00 0.00 C ATOM 1543 CH2 TRP A 99 11.519 -4.035 28.085 1.00 0.00 C ATOM 0 H TRP A 99 8.521 0.143 27.200 1.00 0.00 H new ATOM 0 HA TRP A 99 7.527 1.735 29.414 1.00 0.00 H new ATOM 0 HB2 TRP A 99 8.989 0.805 31.083 1.00 0.00 H new ATOM 0 HB3 TRP A 99 8.140 -0.559 30.382 1.00 0.00 H new ATOM 0 HD1 TRP A 99 11.515 1.261 30.197 1.00 0.00 H new ATOM 0 HE1 TRP A 99 13.325 -0.358 29.324 1.00 0.00 H new ATOM 0 HE3 TRP A 99 8.523 -2.694 29.016 1.00 0.00 H new ATOM 0 HZ2 TRP A 99 13.421 -3.034 28.240 1.00 0.00 H new ATOM 0 HZ3 TRP A 99 9.490 -4.762 28.052 1.00 0.00 H new ATOM 0 HH2 TRP A 99 11.936 -4.940 27.668 1.00 0.00 H new ATOM 1554 N ILE A 100 9.978 2.872 29.505 1.00 0.00 N ATOM 1555 CA ILE A 100 11.048 3.813 29.179 1.00 0.00 C ATOM 1556 C ILE A 100 12.206 3.672 30.160 1.00 0.00 C ATOM 1557 O ILE A 100 12.000 3.613 31.371 1.00 0.00 O ATOM 1558 CB ILE A 100 10.522 5.247 29.218 1.00 0.00 C ATOM 1559 CG1 ILE A 100 9.115 5.271 28.637 1.00 0.00 C ATOM 1560 CG2 ILE A 100 11.429 6.142 28.375 1.00 0.00 C ATOM 1561 CD1 ILE A 100 8.116 4.839 29.705 1.00 0.00 C ATOM 0 H ILE A 100 9.671 2.899 30.477 1.00 0.00 H new ATOM 0 HA ILE A 100 11.404 3.585 28.174 1.00 0.00 H new ATOM 0 HB ILE A 100 10.507 5.608 30.246 1.00 0.00 H new ATOM 0 HG12 ILE A 100 8.874 6.273 28.282 1.00 0.00 H new ATOM 0 HG13 ILE A 100 9.054 4.605 27.776 1.00 0.00 H new ATOM 0 HG21 ILE A 100 11.056 7.166 28.401 1.00 0.00 H new ATOM 0 HG22 ILE A 100 12.442 6.115 28.776 1.00 0.00 H new ATOM 0 HG23 ILE A 100 11.437 5.785 27.345 1.00 0.00 H new ATOM 0 HD11 ILE A 100 7.109 4.856 29.289 1.00 0.00 H new ATOM 0 HD12 ILE A 100 8.354 3.829 30.038 1.00 0.00 H new ATOM 0 HD13 ILE A 100 8.171 5.523 30.552 1.00 0.00 H new ATOM 1573 N THR A 101 13.423 3.619 29.635 1.00 0.00 N ATOM 1574 CA THR A 101 14.594 3.484 30.488 1.00 0.00 C ATOM 1575 C THR A 101 15.775 4.258 29.907 1.00 0.00 C ATOM 1576 O THR A 101 15.795 4.579 28.719 1.00 0.00 O ATOM 1577 CB THR A 101 14.967 2.007 30.636 1.00 0.00 C ATOM 1578 OG1 THR A 101 16.142 1.895 31.426 1.00 0.00 O ATOM 1579 CG2 THR A 101 15.221 1.398 29.255 1.00 0.00 C ATOM 0 H THR A 101 13.623 3.667 28.636 1.00 0.00 H new ATOM 0 HA THR A 101 14.355 3.896 31.468 1.00 0.00 H new ATOM 0 HB THR A 101 14.148 1.474 31.120 1.00 0.00 H new ATOM 0 HG1 THR A 101 15.949 1.364 32.227 1.00 0.00 H new ATOM 0 HG21 THR A 101 15.486 0.346 29.364 1.00 0.00 H new ATOM 0 HG22 THR A 101 14.320 1.484 28.648 1.00 0.00 H new ATOM 0 HG23 THR A 101 16.038 1.930 28.768 1.00 0.00 H new ATOM 1587 N HIS A 102 16.756 4.556 30.754 1.00 0.00 N ATOM 1588 CA HIS A 102 17.932 5.294 30.309 1.00 0.00 C ATOM 1589 C HIS A 102 18.677 4.508 29.236 1.00 0.00 C ATOM 1590 O HIS A 102 18.635 3.278 29.212 1.00 0.00 O ATOM 1591 CB HIS A 102 18.867 5.560 31.490 1.00 0.00 C ATOM 1592 CG HIS A 102 18.246 6.578 32.406 1.00 0.00 C ATOM 1593 ND1 HIS A 102 18.839 6.957 33.601 1.00 0.00 N ATOM 1594 CD2 HIS A 102 17.085 7.305 32.317 1.00 0.00 C ATOM 1595 CE1 HIS A 102 18.040 7.874 34.178 1.00 0.00 C ATOM 1596 NE2 HIS A 102 16.957 8.122 33.436 1.00 0.00 N ATOM 0 H HIS A 102 16.760 4.301 31.742 1.00 0.00 H new ATOM 0 HA HIS A 102 17.603 6.245 29.890 1.00 0.00 H new ATOM 0 HB2 HIS A 102 19.055 4.634 32.033 1.00 0.00 H new ATOM 0 HB3 HIS A 102 19.831 5.920 31.130 1.00 0.00 H new ATOM 0 HD2 HIS A 102 16.378 7.251 31.502 1.00 0.00 H new ATOM 0 HE1 HIS A 102 18.249 8.351 35.124 1.00 0.00 H new ATOM 0 HE2 HIS A 102 16.199 8.771 33.645 1.00 0.00 H new ATOM 1604 N ALA A 103 19.350 5.228 28.349 1.00 0.00 N ATOM 1605 CA ALA A 103 20.098 4.598 27.269 1.00 0.00 C ATOM 1606 C ALA A 103 21.222 3.727 27.828 1.00 0.00 C ATOM 1607 O ALA A 103 21.915 3.034 27.083 1.00 0.00 O ATOM 1608 CB ALA A 103 20.675 5.677 26.352 1.00 0.00 C ATOM 0 H ALA A 103 19.394 6.247 28.356 1.00 0.00 H new ATOM 0 HA ALA A 103 19.424 3.959 26.698 1.00 0.00 H new ATOM 0 HB1 ALA A 103 21.235 5.206 25.544 1.00 0.00 H new ATOM 0 HB2 ALA A 103 19.863 6.271 25.933 1.00 0.00 H new ATOM 0 HB3 ALA A 103 21.339 6.324 26.925 1.00 0.00 H new ATOM 1614 N ASP A 104 21.391 3.771 29.146 1.00 0.00 N ATOM 1615 CA ASP A 104 22.430 2.985 29.809 1.00 0.00 C ATOM 1616 C ASP A 104 21.843 1.710 30.418 1.00 0.00 C ATOM 1617 O ASP A 104 22.491 1.043 31.225 1.00 0.00 O ATOM 1618 CB ASP A 104 23.098 3.822 30.900 1.00 0.00 C ATOM 1619 CG ASP A 104 22.166 3.968 32.099 1.00 0.00 C ATOM 1620 OD1 ASP A 104 21.595 2.970 32.507 1.00 0.00 O ATOM 1621 OD2 ASP A 104 22.039 5.076 32.595 1.00 0.00 O ATOM 0 H ASP A 104 20.825 4.340 29.775 1.00 0.00 H new ATOM 0 HA ASP A 104 23.174 2.700 29.065 1.00 0.00 H new ATOM 0 HB2 ASP A 104 24.030 3.350 31.211 1.00 0.00 H new ATOM 0 HB3 ASP A 104 23.354 4.806 30.508 1.00 0.00 H new ATOM 1626 N ASP A 105 20.613 1.381 30.027 1.00 0.00 N ATOM 1627 CA ASP A 105 19.944 0.187 30.539 1.00 0.00 C ATOM 1628 C ASP A 105 20.389 -1.047 29.760 1.00 0.00 C ATOM 1629 O ASP A 105 19.864 -1.340 28.686 1.00 0.00 O ATOM 1630 CB ASP A 105 18.432 0.353 30.410 1.00 0.00 C ATOM 1631 CG ASP A 105 17.723 -0.622 31.340 1.00 0.00 C ATOM 1632 OD1 ASP A 105 18.215 -0.823 32.438 1.00 0.00 O ATOM 1633 OD2 ASP A 105 16.700 -1.153 30.944 1.00 0.00 O ATOM 0 H ASP A 105 20.062 1.922 29.361 1.00 0.00 H new ATOM 0 HA ASP A 105 20.211 0.057 31.588 1.00 0.00 H new ATOM 0 HB2 ASP A 105 18.147 1.376 30.656 1.00 0.00 H new ATOM 0 HB3 ASP A 105 18.124 0.175 29.380 1.00 0.00 H new ATOM 1638 N ARG A 106 21.362 -1.765 30.311 1.00 0.00 N ATOM 1639 CA ARG A 106 21.882 -2.967 29.666 1.00 0.00 C ATOM 1640 C ARG A 106 20.818 -4.058 29.628 1.00 0.00 C ATOM 1641 O ARG A 106 20.915 -5.015 28.850 1.00 0.00 O ATOM 1642 CB ARG A 106 23.107 -3.480 30.432 1.00 0.00 C ATOM 1643 CG ARG A 106 22.867 -3.341 31.937 1.00 0.00 C ATOM 1644 CD ARG A 106 23.825 -4.261 32.698 1.00 0.00 C ATOM 1645 NE ARG A 106 23.437 -5.654 32.503 1.00 0.00 N ATOM 1646 CZ ARG A 106 24.239 -6.650 32.863 1.00 0.00 C ATOM 1647 NH1 ARG A 106 25.402 -6.394 33.397 1.00 0.00 N ATOM 1648 NH2 ARG A 106 23.861 -7.887 32.683 1.00 0.00 N ATOM 0 H ARG A 106 21.806 -1.537 31.201 1.00 0.00 H new ATOM 0 HA ARG A 106 22.166 -2.714 28.645 1.00 0.00 H new ATOM 0 HB2 ARG A 106 23.296 -4.523 30.179 1.00 0.00 H new ATOM 0 HB3 ARG A 106 23.993 -2.915 30.141 1.00 0.00 H new ATOM 0 HG2 ARG A 106 23.019 -2.307 32.245 1.00 0.00 H new ATOM 0 HG3 ARG A 106 21.835 -3.597 32.176 1.00 0.00 H new ATOM 0 HD2 ARG A 106 24.846 -4.107 32.348 1.00 0.00 H new ATOM 0 HD3 ARG A 106 23.811 -4.016 33.760 1.00 0.00 H new ATOM 0 HE ARG A 106 22.533 -5.867 32.082 1.00 0.00 H new ATOM 0 HH11 ARG A 106 25.697 -5.428 33.539 1.00 0.00 H new ATOM 0 HH12 ARG A 106 26.016 -7.160 33.673 1.00 0.00 H new ATOM 0 HH21 ARG A 106 22.952 -8.087 32.267 1.00 0.00 H new ATOM 0 HH22 ARG A 106 24.475 -8.653 32.959 1.00 0.00 H new ATOM 1662 N THR A 107 19.807 -3.900 30.476 1.00 0.00 N ATOM 1663 CA THR A 107 18.720 -4.867 30.559 1.00 0.00 C ATOM 1664 C THR A 107 18.029 -5.014 29.217 1.00 0.00 C ATOM 1665 O THR A 107 17.296 -5.973 28.988 1.00 0.00 O ATOM 1666 CB THR A 107 17.697 -4.406 31.597 1.00 0.00 C ATOM 1667 OG1 THR A 107 16.920 -3.346 31.057 1.00 0.00 O ATOM 1668 CG2 THR A 107 18.420 -3.916 32.854 1.00 0.00 C ATOM 0 H THR A 107 19.718 -3.111 31.116 1.00 0.00 H new ATOM 0 HA THR A 107 19.140 -5.830 30.850 1.00 0.00 H new ATOM 0 HB THR A 107 17.047 -5.242 31.857 1.00 0.00 H new ATOM 0 HG1 THR A 107 16.882 -2.608 31.700 1.00 0.00 H new ATOM 0 HG21 THR A 107 17.687 -3.588 33.591 1.00 0.00 H new ATOM 0 HG22 THR A 107 19.016 -4.728 33.271 1.00 0.00 H new ATOM 0 HG23 THR A 107 19.073 -3.082 32.596 1.00 0.00 H new ATOM 1676 N VAL A 108 18.262 -4.057 28.338 1.00 0.00 N ATOM 1677 CA VAL A 108 17.657 -4.091 27.020 1.00 0.00 C ATOM 1678 C VAL A 108 18.658 -4.598 25.989 1.00 0.00 C ATOM 1679 O VAL A 108 18.283 -4.954 24.872 1.00 0.00 O ATOM 1680 CB VAL A 108 17.180 -2.691 26.638 1.00 0.00 C ATOM 1681 CG1 VAL A 108 16.342 -2.760 25.361 1.00 0.00 C ATOM 1682 CG2 VAL A 108 16.336 -2.120 27.782 1.00 0.00 C ATOM 0 H VAL A 108 18.862 -3.251 28.511 1.00 0.00 H new ATOM 0 HA VAL A 108 16.805 -4.770 27.040 1.00 0.00 H new ATOM 0 HB VAL A 108 18.041 -2.046 26.461 1.00 0.00 H new ATOM 0 HG11 VAL A 108 16.004 -1.759 25.093 1.00 0.00 H new ATOM 0 HG12 VAL A 108 16.946 -3.168 24.551 1.00 0.00 H new ATOM 0 HG13 VAL A 108 15.477 -3.402 25.528 1.00 0.00 H new ATOM 0 HG21 VAL A 108 15.992 -1.120 27.516 1.00 0.00 H new ATOM 0 HG22 VAL A 108 15.475 -2.766 27.957 1.00 0.00 H new ATOM 0 HG23 VAL A 108 16.940 -2.067 28.688 1.00 0.00 H new ATOM 1692 N ILE A 109 19.934 -4.630 26.369 1.00 0.00 N ATOM 1693 CA ILE A 109 20.973 -5.097 25.458 1.00 0.00 C ATOM 1694 C ILE A 109 21.649 -6.346 25.999 1.00 0.00 C ATOM 1695 O ILE A 109 22.784 -6.646 25.645 1.00 0.00 O ATOM 1696 CB ILE A 109 22.008 -4.004 25.242 1.00 0.00 C ATOM 1697 CG1 ILE A 109 21.297 -2.750 24.726 1.00 0.00 C ATOM 1698 CG2 ILE A 109 23.048 -4.476 24.222 1.00 0.00 C ATOM 1699 CD1 ILE A 109 20.611 -3.042 23.388 1.00 0.00 C ATOM 0 H ILE A 109 20.269 -4.342 27.289 1.00 0.00 H new ATOM 0 HA ILE A 109 20.504 -5.344 24.506 1.00 0.00 H new ATOM 0 HB ILE A 109 22.515 -3.777 26.180 1.00 0.00 H new ATOM 0 HG12 ILE A 109 20.559 -2.415 25.455 1.00 0.00 H new ATOM 0 HG13 ILE A 109 22.016 -1.940 24.605 1.00 0.00 H new ATOM 0 HG21 ILE A 109 23.789 -3.692 24.068 1.00 0.00 H new ATOM 0 HG22 ILE A 109 23.542 -5.374 24.594 1.00 0.00 H new ATOM 0 HG23 ILE A 109 22.555 -4.699 23.276 1.00 0.00 H new ATOM 0 HD11 ILE A 109 20.109 -2.142 23.032 1.00 0.00 H new ATOM 0 HD12 ILE A 109 21.357 -3.354 22.657 1.00 0.00 H new ATOM 0 HD13 ILE A 109 19.878 -3.838 23.521 1.00 0.00 H new ATOM 1711 N ILE A 110 20.940 -7.064 26.861 1.00 0.00 N ATOM 1712 CA ILE A 110 21.464 -8.291 27.452 1.00 0.00 C ATOM 1713 C ILE A 110 21.249 -9.481 26.517 1.00 0.00 C ATOM 1714 O ILE A 110 20.999 -9.310 25.324 1.00 0.00 O ATOM 1715 CB ILE A 110 20.783 -8.571 28.797 1.00 0.00 C ATOM 1716 CG1 ILE A 110 19.481 -7.776 28.919 1.00 0.00 C ATOM 1717 CG2 ILE A 110 21.721 -8.149 29.919 1.00 0.00 C ATOM 1718 CD1 ILE A 110 18.450 -8.292 27.918 1.00 0.00 C ATOM 0 H ILE A 110 19.999 -6.818 27.167 1.00 0.00 H new ATOM 0 HA ILE A 110 22.534 -8.155 27.610 1.00 0.00 H new ATOM 0 HB ILE A 110 20.555 -9.635 28.863 1.00 0.00 H new ATOM 0 HG12 ILE A 110 19.088 -7.861 29.932 1.00 0.00 H new ATOM 0 HG13 ILE A 110 19.674 -6.718 28.740 1.00 0.00 H new ATOM 0 HG21 ILE A 110 21.248 -8.343 30.881 1.00 0.00 H new ATOM 0 HG22 ILE A 110 22.649 -8.716 29.850 1.00 0.00 H new ATOM 0 HG23 ILE A 110 21.939 -7.085 29.830 1.00 0.00 H new ATOM 0 HD11 ILE A 110 17.529 -7.718 28.016 1.00 0.00 H new ATOM 0 HD12 ILE A 110 18.840 -8.183 26.906 1.00 0.00 H new ATOM 0 HD13 ILE A 110 18.245 -9.344 28.117 1.00 0.00 H new ATOM 1730 N LYS A 111 21.351 -10.686 27.072 1.00 0.00 N ATOM 1731 CA LYS A 111 21.171 -11.903 26.286 1.00 0.00 C ATOM 1732 C LYS A 111 19.825 -12.552 26.611 1.00 0.00 C ATOM 1733 O LYS A 111 19.459 -12.678 27.779 1.00 0.00 O ATOM 1734 CB LYS A 111 22.289 -12.905 26.593 1.00 0.00 C ATOM 1735 CG LYS A 111 22.287 -13.992 25.521 1.00 0.00 C ATOM 1736 CD LYS A 111 23.233 -15.122 25.928 1.00 0.00 C ATOM 1737 CE LYS A 111 24.683 -14.656 25.779 1.00 0.00 C ATOM 1738 NZ LYS A 111 25.588 -15.840 25.806 1.00 0.00 N ATOM 0 H LYS A 111 21.556 -10.845 28.058 1.00 0.00 H new ATOM 0 HA LYS A 111 21.201 -11.632 25.231 1.00 0.00 H new ATOM 0 HB2 LYS A 111 23.254 -12.398 26.614 1.00 0.00 H new ATOM 0 HB3 LYS A 111 22.139 -13.347 27.578 1.00 0.00 H new ATOM 0 HG2 LYS A 111 21.278 -14.381 25.386 1.00 0.00 H new ATOM 0 HG3 LYS A 111 22.597 -13.572 24.564 1.00 0.00 H new ATOM 0 HD2 LYS A 111 23.040 -15.418 26.959 1.00 0.00 H new ATOM 0 HD3 LYS A 111 23.057 -15.999 25.306 1.00 0.00 H new ATOM 0 HE2 LYS A 111 24.807 -14.111 24.843 1.00 0.00 H new ATOM 0 HE3 LYS A 111 24.941 -13.969 26.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 26.574 -15.526 25.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 25.476 -16.342 26.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 25.346 -16.480 25.022 1.00 0.00 H new ATOM 1752 N LYS A 112 19.095 -12.963 25.577 1.00 0.00 N ATOM 1753 CA LYS A 112 17.796 -13.597 25.785 1.00 0.00 C ATOM 1754 C LYS A 112 17.839 -15.038 25.306 1.00 0.00 C ATOM 1755 O LYS A 112 18.209 -15.312 24.165 1.00 0.00 O ATOM 1756 CB LYS A 112 16.715 -12.847 25.007 1.00 0.00 C ATOM 1757 CG LYS A 112 15.426 -12.794 25.826 1.00 0.00 C ATOM 1758 CD LYS A 112 15.649 -11.874 27.029 1.00 0.00 C ATOM 1759 CE LYS A 112 14.650 -10.716 26.997 1.00 0.00 C ATOM 1760 NZ LYS A 112 13.305 -11.201 27.415 1.00 0.00 N ATOM 0 H LYS A 112 19.375 -12.871 24.601 1.00 0.00 H new ATOM 0 HA LYS A 112 17.564 -13.571 26.850 1.00 0.00 H new ATOM 0 HB2 LYS A 112 17.054 -11.836 24.780 1.00 0.00 H new ATOM 0 HB3 LYS A 112 16.530 -13.343 24.054 1.00 0.00 H new ATOM 0 HG2 LYS A 112 14.604 -12.424 25.214 1.00 0.00 H new ATOM 0 HG3 LYS A 112 15.149 -13.794 26.161 1.00 0.00 H new ATOM 0 HD2 LYS A 112 15.534 -12.438 27.954 1.00 0.00 H new ATOM 0 HD3 LYS A 112 16.668 -11.486 27.016 1.00 0.00 H new ATOM 0 HE2 LYS A 112 14.982 -9.918 27.661 1.00 0.00 H new ATOM 0 HE3 LYS A 112 14.599 -10.294 25.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 12.574 -10.732 26.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 13.248 -12.230 27.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 13.153 -10.980 28.420 1.00 0.00 H new ATOM 1774 N GLU A 113 17.454 -15.957 26.178 1.00 0.00 N ATOM 1775 CA GLU A 113 17.450 -17.364 25.816 1.00 0.00 C ATOM 1776 C GLU A 113 16.236 -17.679 24.955 1.00 0.00 C ATOM 1777 O GLU A 113 15.882 -18.843 24.768 1.00 0.00 O ATOM 1778 CB GLU A 113 17.429 -18.226 27.075 1.00 0.00 C ATOM 1779 CG GLU A 113 18.712 -17.993 27.871 1.00 0.00 C ATOM 1780 CD GLU A 113 18.567 -16.744 28.733 1.00 0.00 C ATOM 1781 OE1 GLU A 113 17.558 -16.071 28.597 1.00 0.00 O ATOM 1782 OE2 GLU A 113 19.475 -16.465 29.497 1.00 0.00 O ATOM 0 H GLU A 113 17.144 -15.757 27.129 1.00 0.00 H new ATOM 0 HA GLU A 113 18.354 -17.584 25.248 1.00 0.00 H new ATOM 0 HB2 GLU A 113 16.560 -17.978 27.684 1.00 0.00 H new ATOM 0 HB3 GLU A 113 17.340 -19.279 26.807 1.00 0.00 H new ATOM 0 HG2 GLU A 113 18.922 -18.858 28.500 1.00 0.00 H new ATOM 0 HG3 GLU A 113 19.557 -17.881 27.191 1.00 0.00 H new ATOM 1789 N GLU A 114 15.597 -16.634 24.431 1.00 0.00 N ATOM 1790 CA GLU A 114 14.418 -16.830 23.594 1.00 0.00 C ATOM 1791 C GLU A 114 14.329 -15.752 22.514 1.00 0.00 C ATOM 1792 O GLU A 114 15.084 -14.779 22.528 1.00 0.00 O ATOM 1793 CB GLU A 114 13.153 -16.794 24.458 1.00 0.00 C ATOM 1794 CG GLU A 114 13.542 -16.614 25.927 1.00 0.00 C ATOM 1795 CD GLU A 114 12.295 -16.378 26.775 1.00 0.00 C ATOM 1796 OE1 GLU A 114 11.245 -16.148 26.199 1.00 0.00 O ATOM 1797 OE2 GLU A 114 12.410 -16.431 27.989 1.00 0.00 O ATOM 0 H GLU A 114 15.870 -15.661 24.568 1.00 0.00 H new ATOM 0 HA GLU A 114 14.503 -17.802 23.109 1.00 0.00 H new ATOM 0 HB2 GLU A 114 12.506 -15.977 24.140 1.00 0.00 H new ATOM 0 HB3 GLU A 114 12.587 -17.717 24.331 1.00 0.00 H new ATOM 0 HG2 GLU A 114 14.071 -17.499 26.282 1.00 0.00 H new ATOM 0 HG3 GLU A 114 14.226 -15.771 26.030 1.00 0.00 H new ATOM 1804 N PRO A 115 13.420 -15.916 21.589 1.00 0.00 N ATOM 1805 CA PRO A 115 13.204 -14.953 20.475 1.00 0.00 C ATOM 1806 C PRO A 115 12.380 -13.753 20.913 1.00 0.00 C ATOM 1807 O PRO A 115 11.147 -13.754 20.838 1.00 0.00 O ATOM 1808 CB PRO A 115 12.466 -15.766 19.426 1.00 0.00 C ATOM 1809 CG PRO A 115 11.761 -16.838 20.183 1.00 0.00 C ATOM 1810 CD PRO A 115 12.497 -17.048 21.507 1.00 0.00 C ATOM 0 HA PRO A 115 14.142 -14.536 20.108 1.00 0.00 H new ATOM 0 HB2 PRO A 115 11.760 -15.146 18.873 1.00 0.00 H new ATOM 0 HB3 PRO A 115 13.158 -16.189 18.698 1.00 0.00 H new ATOM 0 HG2 PRO A 115 10.724 -16.556 20.365 1.00 0.00 H new ATOM 0 HG3 PRO A 115 11.744 -17.763 19.606 1.00 0.00 H new ATOM 0 HD2 PRO A 115 11.805 -17.060 22.349 1.00 0.00 H new ATOM 0 HD3 PRO A 115 13.031 -17.998 21.520 1.00 0.00 H new ATOM 1818 N ILE A 116 13.089 -12.739 21.369 1.00 0.00 N ATOM 1819 CA ILE A 116 12.463 -11.510 21.835 1.00 0.00 C ATOM 1820 C ILE A 116 12.962 -10.315 21.036 1.00 0.00 C ATOM 1821 O ILE A 116 14.164 -10.158 20.818 1.00 0.00 O ATOM 1822 CB ILE A 116 12.775 -11.294 23.313 1.00 0.00 C ATOM 1823 CG1 ILE A 116 12.249 -12.486 24.115 1.00 0.00 C ATOM 1824 CG2 ILE A 116 12.104 -10.007 23.796 1.00 0.00 C ATOM 1825 CD1 ILE A 116 10.736 -12.628 23.908 1.00 0.00 C ATOM 0 H ILE A 116 14.107 -12.740 21.428 1.00 0.00 H new ATOM 0 HA ILE A 116 11.386 -11.603 21.697 1.00 0.00 H new ATOM 0 HB ILE A 116 13.852 -11.207 23.453 1.00 0.00 H new ATOM 0 HG12 ILE A 116 12.755 -13.399 23.800 1.00 0.00 H new ATOM 0 HG13 ILE A 116 12.469 -12.348 25.174 1.00 0.00 H new ATOM 0 HG21 ILE A 116 12.328 -9.854 24.852 1.00 0.00 H new ATOM 0 HG22 ILE A 116 12.480 -9.162 23.219 1.00 0.00 H new ATOM 0 HG23 ILE A 116 11.025 -10.087 23.662 1.00 0.00 H new ATOM 0 HD11 ILE A 116 10.368 -13.479 24.482 1.00 0.00 H new ATOM 0 HD12 ILE A 116 10.236 -11.720 24.245 1.00 0.00 H new ATOM 0 HD13 ILE A 116 10.527 -12.787 22.850 1.00 0.00 H new ATOM 1837 N LEU A 117 12.029 -9.474 20.608 1.00 0.00 N ATOM 1838 CA LEU A 117 12.376 -8.290 19.834 1.00 0.00 C ATOM 1839 C LEU A 117 12.222 -7.039 20.679 1.00 0.00 C ATOM 1840 O LEU A 117 11.158 -6.771 21.237 1.00 0.00 O ATOM 1841 CB LEU A 117 11.486 -8.193 18.595 1.00 0.00 C ATOM 1842 CG LEU A 117 11.797 -6.909 17.810 1.00 0.00 C ATOM 1843 CD1 LEU A 117 11.188 -7.021 16.409 1.00 0.00 C ATOM 1844 CD2 LEU A 117 11.192 -5.695 18.529 1.00 0.00 C ATOM 0 H LEU A 117 11.031 -9.589 20.783 1.00 0.00 H new ATOM 0 HA LEU A 117 13.417 -8.375 19.521 1.00 0.00 H new ATOM 0 HB2 LEU A 117 11.643 -9.063 17.958 1.00 0.00 H new ATOM 0 HB3 LEU A 117 10.437 -8.200 18.892 1.00 0.00 H new ATOM 0 HG LEU A 117 12.877 -6.781 17.740 1.00 0.00 H new ATOM 0 HD11 LEU A 117 11.404 -6.114 15.845 1.00 0.00 H new ATOM 0 HD12 LEU A 117 11.617 -7.880 15.893 1.00 0.00 H new ATOM 0 HD13 LEU A 117 10.109 -7.149 16.491 1.00 0.00 H new ATOM 0 HD21 LEU A 117 11.417 -4.789 17.966 1.00 0.00 H new ATOM 0 HD22 LEU A 117 10.111 -5.817 18.603 1.00 0.00 H new ATOM 0 HD23 LEU A 117 11.617 -5.615 19.529 1.00 0.00 H new ATOM 1856 N THR A 118 13.302 -6.284 20.769 1.00 0.00 N ATOM 1857 CA THR A 118 13.295 -5.054 21.549 1.00 0.00 C ATOM 1858 C THR A 118 13.601 -3.857 20.655 1.00 0.00 C ATOM 1859 O THR A 118 14.596 -3.853 19.944 1.00 0.00 O ATOM 1860 CB THR A 118 14.342 -5.138 22.658 1.00 0.00 C ATOM 1861 OG1 THR A 118 14.139 -6.324 23.416 1.00 0.00 O ATOM 1862 CG2 THR A 118 14.200 -3.925 23.568 1.00 0.00 C ATOM 0 H THR A 118 14.191 -6.497 20.316 1.00 0.00 H new ATOM 0 HA THR A 118 12.306 -4.927 21.988 1.00 0.00 H new ATOM 0 HB THR A 118 15.340 -5.157 22.220 1.00 0.00 H new ATOM 0 HG1 THR A 118 14.998 -6.776 23.552 1.00 0.00 H new ATOM 0 HG21 THR A 118 14.944 -3.977 24.363 1.00 0.00 H new ATOM 0 HG22 THR A 118 14.352 -3.015 22.988 1.00 0.00 H new ATOM 0 HG23 THR A 118 13.202 -3.913 24.006 1.00 0.00 H new ATOM 1870 N LEU A 119 12.742 -2.843 20.688 1.00 0.00 N ATOM 1871 CA LEU A 119 12.951 -1.655 19.863 1.00 0.00 C ATOM 1872 C LEU A 119 13.078 -0.402 20.719 1.00 0.00 C ATOM 1873 O LEU A 119 12.194 -0.099 21.514 1.00 0.00 O ATOM 1874 CB LEU A 119 11.774 -1.479 18.909 1.00 0.00 C ATOM 1875 CG LEU A 119 12.092 -0.396 17.877 1.00 0.00 C ATOM 1876 CD1 LEU A 119 11.001 -0.404 16.820 1.00 0.00 C ATOM 1877 CD2 LEU A 119 12.115 0.986 18.537 1.00 0.00 C ATOM 0 H LEU A 119 11.904 -2.818 21.269 1.00 0.00 H new ATOM 0 HA LEU A 119 13.877 -1.795 19.305 1.00 0.00 H new ATOM 0 HB2 LEU A 119 11.560 -2.421 18.405 1.00 0.00 H new ATOM 0 HB3 LEU A 119 10.879 -1.207 19.469 1.00 0.00 H new ATOM 0 HG LEU A 119 13.069 -0.598 17.438 1.00 0.00 H new ATOM 0 HD11 LEU A 119 11.211 0.363 16.074 1.00 0.00 H new ATOM 0 HD12 LEU A 119 10.969 -1.381 16.337 1.00 0.00 H new ATOM 0 HD13 LEU A 119 10.038 -0.200 17.289 1.00 0.00 H new ATOM 0 HD21 LEU A 119 12.343 1.744 17.787 1.00 0.00 H new ATOM 0 HD22 LEU A 119 11.141 1.194 18.979 1.00 0.00 H new ATOM 0 HD23 LEU A 119 12.878 1.005 19.315 1.00 0.00 H new ATOM 1889 N THR A 120 14.170 0.332 20.534 1.00 0.00 N ATOM 1890 CA THR A 120 14.383 1.561 21.285 1.00 0.00 C ATOM 1891 C THR A 120 14.247 2.775 20.366 1.00 0.00 C ATOM 1892 O THR A 120 14.890 2.850 19.316 1.00 0.00 O ATOM 1893 CB THR A 120 15.762 1.548 21.934 1.00 0.00 C ATOM 1894 OG1 THR A 120 16.689 2.225 21.094 1.00 0.00 O ATOM 1895 CG2 THR A 120 16.216 0.105 22.143 1.00 0.00 C ATOM 0 H THR A 120 14.914 0.099 19.877 1.00 0.00 H new ATOM 0 HA THR A 120 13.626 1.627 22.066 1.00 0.00 H new ATOM 0 HB THR A 120 15.713 2.053 22.899 1.00 0.00 H new ATOM 0 HG1 THR A 120 16.351 2.234 20.174 1.00 0.00 H new ATOM 0 HG21 THR A 120 17.202 0.097 22.607 1.00 0.00 H new ATOM 0 HG22 THR A 120 15.506 -0.410 22.791 1.00 0.00 H new ATOM 0 HG23 THR A 120 16.264 -0.404 21.181 1.00 0.00 H new ATOM 1903 N THR A 121 13.390 3.715 20.762 1.00 0.00 N ATOM 1904 CA THR A 121 13.153 4.913 19.961 1.00 0.00 C ATOM 1905 C THR A 121 13.894 6.124 20.530 1.00 0.00 C ATOM 1906 O THR A 121 13.796 6.419 21.727 1.00 0.00 O ATOM 1907 CB THR A 121 11.650 5.216 19.931 1.00 0.00 C ATOM 1908 OG1 THR A 121 11.314 6.047 21.032 1.00 0.00 O ATOM 1909 CG2 THR A 121 10.855 3.913 20.019 1.00 0.00 C ATOM 0 H THR A 121 12.852 3.670 21.627 1.00 0.00 H new ATOM 0 HA THR A 121 13.526 4.724 18.954 1.00 0.00 H new ATOM 0 HB THR A 121 11.406 5.724 18.998 1.00 0.00 H new ATOM 0 HG1 THR A 121 12.038 6.024 21.692 1.00 0.00 H new ATOM 0 HG21 THR A 121 9.788 4.136 19.997 1.00 0.00 H new ATOM 0 HG22 THR A 121 11.110 3.274 19.174 1.00 0.00 H new ATOM 0 HG23 THR A 121 11.100 3.400 20.949 1.00 0.00 H new ATOM 2078 N ASP A 133 16.233 9.841 28.277 1.00 0.00 N ATOM 2079 CA ASP A 133 15.389 8.665 28.423 1.00 0.00 C ATOM 2080 C ASP A 133 14.935 8.173 27.054 1.00 0.00 C ATOM 2081 O ASP A 133 14.350 8.927 26.274 1.00 0.00 O ATOM 2082 CB ASP A 133 14.174 8.988 29.296 1.00 0.00 C ATOM 2083 CG ASP A 133 13.568 10.321 28.871 1.00 0.00 C ATOM 2084 OD1 ASP A 133 14.121 10.943 27.980 1.00 0.00 O ATOM 2085 OD2 ASP A 133 12.563 10.702 29.448 1.00 0.00 O ATOM 0 HA ASP A 133 15.967 7.878 28.907 1.00 0.00 H new ATOM 0 HB2 ASP A 133 13.431 8.196 29.207 1.00 0.00 H new ATOM 0 HB3 ASP A 133 14.470 9.031 30.344 1.00 0.00 H new ATOM 2090 N ARG A 134 15.212 6.908 26.767 1.00 0.00 N ATOM 2091 CA ARG A 134 14.835 6.326 25.486 1.00 0.00 C ATOM 2092 C ARG A 134 13.611 5.432 25.630 1.00 0.00 C ATOM 2093 O ARG A 134 13.474 4.700 26.612 1.00 0.00 O ATOM 2094 CB ARG A 134 16.003 5.520 24.911 1.00 0.00 C ATOM 2095 CG ARG A 134 16.948 6.461 24.163 1.00 0.00 C ATOM 2096 CD ARG A 134 18.152 5.666 23.662 1.00 0.00 C ATOM 2097 NE ARG A 134 18.725 6.302 22.482 1.00 0.00 N ATOM 2098 CZ ARG A 134 19.673 7.230 22.571 1.00 0.00 C ATOM 2099 NH1 ARG A 134 20.124 7.599 23.740 1.00 0.00 N ATOM 2100 NH2 ARG A 134 20.151 7.768 21.484 1.00 0.00 N ATOM 0 H ARG A 134 15.693 6.269 27.399 1.00 0.00 H new ATOM 0 HA ARG A 134 14.587 7.139 24.804 1.00 0.00 H new ATOM 0 HB2 ARG A 134 16.538 5.011 25.713 1.00 0.00 H new ATOM 0 HB3 ARG A 134 15.630 4.749 24.237 1.00 0.00 H new ATOM 0 HG2 ARG A 134 16.429 6.926 23.325 1.00 0.00 H new ATOM 0 HG3 ARG A 134 17.276 7.266 24.821 1.00 0.00 H new ATOM 0 HD2 ARG A 134 18.904 5.599 24.448 1.00 0.00 H new ATOM 0 HD3 ARG A 134 17.849 4.647 23.423 1.00 0.00 H new ATOM 0 HE ARG A 134 18.388 6.027 21.559 1.00 0.00 H new ATOM 0 HH11 ARG A 134 19.749 7.175 24.588 1.00 0.00 H new ATOM 0 HH12 ARG A 134 20.851 8.311 23.804 1.00 0.00 H new ATOM 0 HH21 ARG A 134 19.798 7.476 20.573 1.00 0.00 H new ATOM 0 HH22 ARG A 134 20.878 8.480 21.545 1.00 0.00 H new ATOM 2114 N TYR A 135 12.723 5.500 24.642 1.00 0.00 N ATOM 2115 CA TYR A 135 11.509 4.689 24.673 1.00 0.00 C ATOM 2116 C TYR A 135 11.807 3.302 24.112 1.00 0.00 C ATOM 2117 O TYR A 135 12.389 3.174 23.035 1.00 0.00 O ATOM 2118 CB TYR A 135 10.414 5.363 23.851 1.00 0.00 C ATOM 2119 CG TYR A 135 9.072 4.923 24.367 1.00 0.00 C ATOM 2120 CD1 TYR A 135 8.596 5.419 25.584 1.00 0.00 C ATOM 2121 CD2 TYR A 135 8.309 4.015 23.633 1.00 0.00 C ATOM 2122 CE1 TYR A 135 7.351 5.001 26.070 1.00 0.00 C ATOM 2123 CE2 TYR A 135 7.065 3.599 24.112 1.00 0.00 C ATOM 2124 CZ TYR A 135 6.584 4.091 25.332 1.00 0.00 C ATOM 2125 OH TYR A 135 5.358 3.674 25.807 1.00 0.00 O ATOM 0 H TYR A 135 12.818 6.099 23.822 1.00 0.00 H new ATOM 0 HA TYR A 135 11.166 4.591 25.703 1.00 0.00 H new ATOM 0 HB2 TYR A 135 10.506 6.447 23.919 1.00 0.00 H new ATOM 0 HB3 TYR A 135 10.517 5.099 22.798 1.00 0.00 H new ATOM 0 HD1 TYR A 135 9.188 6.124 26.149 1.00 0.00 H new ATOM 0 HD2 TYR A 135 8.681 3.633 22.693 1.00 0.00 H new ATOM 0 HE1 TYR A 135 6.983 5.380 27.012 1.00 0.00 H new ATOM 0 HE2 TYR A 135 6.474 2.898 23.542 1.00 0.00 H new ATOM 0 HH TYR A 135 4.957 4.386 26.348 1.00 0.00 H new ATOM 2135 N ILE A 136 11.434 2.265 24.854 1.00 0.00 N ATOM 2136 CA ILE A 136 11.709 0.900 24.418 1.00 0.00 C ATOM 2137 C ILE A 136 10.453 0.053 24.315 1.00 0.00 C ATOM 2138 O ILE A 136 9.666 -0.044 25.258 1.00 0.00 O ATOM 2139 CB ILE A 136 12.710 0.245 25.382 1.00 0.00 C ATOM 2140 CG1 ILE A 136 14.139 0.581 24.955 1.00 0.00 C ATOM 2141 CG2 ILE A 136 12.543 -1.268 25.354 1.00 0.00 C ATOM 2142 CD1 ILE A 136 14.912 1.111 26.156 1.00 0.00 C ATOM 0 H ILE A 136 10.947 2.340 25.747 1.00 0.00 H new ATOM 0 HA ILE A 136 12.134 0.957 23.416 1.00 0.00 H new ATOM 0 HB ILE A 136 12.522 0.623 26.387 1.00 0.00 H new ATOM 0 HG12 ILE A 136 14.629 -0.307 24.555 1.00 0.00 H new ATOM 0 HG13 ILE A 136 14.127 1.325 24.158 1.00 0.00 H new ATOM 0 HG21 ILE A 136 13.256 -1.726 26.040 1.00 0.00 H new ATOM 0 HG22 ILE A 136 11.529 -1.528 25.658 1.00 0.00 H new ATOM 0 HG23 ILE A 136 12.724 -1.635 24.344 1.00 0.00 H new ATOM 0 HD11 ILE A 136 15.932 1.352 25.855 1.00 0.00 H new ATOM 0 HD12 ILE A 136 14.424 2.009 26.535 1.00 0.00 H new ATOM 0 HD13 ILE A 136 14.934 0.352 26.938 1.00 0.00 H new ATOM 2154 N ILE A 137 10.289 -0.575 23.152 1.00 0.00 N ATOM 2155 CA ILE A 137 9.146 -1.437 22.915 1.00 0.00 C ATOM 2156 C ILE A 137 9.567 -2.903 22.934 1.00 0.00 C ATOM 2157 O ILE A 137 10.326 -3.355 22.075 1.00 0.00 O ATOM 2158 CB ILE A 137 8.501 -1.102 21.570 1.00 0.00 C ATOM 2159 CG1 ILE A 137 7.471 0.007 21.767 1.00 0.00 C ATOM 2160 CG2 ILE A 137 7.806 -2.340 21.014 1.00 0.00 C ATOM 2161 CD1 ILE A 137 8.192 1.331 22.012 1.00 0.00 C ATOM 0 H ILE A 137 10.934 -0.500 22.365 1.00 0.00 H new ATOM 0 HA ILE A 137 8.420 -1.270 23.711 1.00 0.00 H new ATOM 0 HB ILE A 137 9.270 -0.772 20.871 1.00 0.00 H new ATOM 0 HG12 ILE A 137 6.832 0.085 20.887 1.00 0.00 H new ATOM 0 HG13 ILE A 137 6.823 -0.229 22.611 1.00 0.00 H new ATOM 0 HG21 ILE A 137 7.347 -2.100 20.055 1.00 0.00 H new ATOM 0 HG22 ILE A 137 8.537 -3.137 20.877 1.00 0.00 H new ATOM 0 HG23 ILE A 137 7.037 -2.670 21.712 1.00 0.00 H new ATOM 0 HD11 ILE A 137 7.458 2.124 22.153 1.00 0.00 H new ATOM 0 HD12 ILE A 137 8.812 1.248 22.904 1.00 0.00 H new ATOM 0 HD13 ILE A 137 8.821 1.567 21.154 1.00 0.00 H new ATOM 2173 N GLU A 138 9.061 -3.635 23.918 1.00 0.00 N ATOM 2174 CA GLU A 138 9.379 -5.053 24.046 1.00 0.00 C ATOM 2175 C GLU A 138 8.314 -5.910 23.366 1.00 0.00 C ATOM 2176 O GLU A 138 7.119 -5.642 23.482 1.00 0.00 O ATOM 2177 CB GLU A 138 9.477 -5.439 25.525 1.00 0.00 C ATOM 2178 CG GLU A 138 9.753 -6.940 25.641 1.00 0.00 C ATOM 2179 CD GLU A 138 10.636 -7.216 26.853 1.00 0.00 C ATOM 2180 OE1 GLU A 138 11.846 -7.143 26.707 1.00 0.00 O ATOM 2181 OE2 GLU A 138 10.092 -7.496 27.908 1.00 0.00 O ATOM 0 H GLU A 138 8.432 -3.274 24.636 1.00 0.00 H new ATOM 0 HA GLU A 138 10.338 -5.232 23.559 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.274 -4.873 26.008 1.00 0.00 H new ATOM 0 HB3 GLU A 138 8.550 -5.188 26.040 1.00 0.00 H new ATOM 0 HG2 GLU A 138 8.813 -7.485 25.734 1.00 0.00 H new ATOM 0 HG3 GLU A 138 10.242 -7.299 24.735 1.00 0.00 H new ATOM 2188 N ALA A 139 8.758 -6.942 22.654 1.00 0.00 N ATOM 2189 CA ALA A 139 7.835 -7.836 21.958 1.00 0.00 C ATOM 2190 C ALA A 139 8.397 -9.253 21.893 1.00 0.00 C ATOM 2191 O ALA A 139 9.607 -9.447 21.819 1.00 0.00 O ATOM 2192 CB ALA A 139 7.577 -7.321 20.541 1.00 0.00 C ATOM 0 H ALA A 139 9.744 -7.180 22.544 1.00 0.00 H new ATOM 0 HA ALA A 139 6.898 -7.858 22.514 1.00 0.00 H new ATOM 0 HB1 ALA A 139 6.888 -7.993 20.029 1.00 0.00 H new ATOM 0 HB2 ALA A 139 7.141 -6.323 20.590 1.00 0.00 H new ATOM 0 HB3 ALA A 139 8.518 -7.279 19.992 1.00 0.00 H new ATOM 2198 N LYS A 140 7.511 -10.246 21.917 1.00 0.00 N ATOM 2199 CA LYS A 140 7.953 -11.640 21.862 1.00 0.00 C ATOM 2200 C LYS A 140 7.455 -12.316 20.596 1.00 0.00 C ATOM 2201 O LYS A 140 6.508 -11.849 19.965 1.00 0.00 O ATOM 2202 CB LYS A 140 7.430 -12.411 23.068 1.00 0.00 C ATOM 2203 CG LYS A 140 5.956 -12.760 22.859 1.00 0.00 C ATOM 2204 CD LYS A 140 5.444 -13.477 24.104 1.00 0.00 C ATOM 2205 CE LYS A 140 5.691 -14.981 23.968 1.00 0.00 C ATOM 2206 NZ LYS A 140 5.037 -15.696 25.101 1.00 0.00 N ATOM 0 H LYS A 140 6.501 -10.117 21.973 1.00 0.00 H new ATOM 0 HA LYS A 140 9.043 -11.642 21.867 1.00 0.00 H new ATOM 0 HB2 LYS A 140 8.012 -13.321 23.210 1.00 0.00 H new ATOM 0 HB3 LYS A 140 7.547 -11.814 23.972 1.00 0.00 H new ATOM 0 HG2 LYS A 140 5.375 -11.856 22.678 1.00 0.00 H new ATOM 0 HG3 LYS A 140 5.839 -13.396 21.981 1.00 0.00 H new ATOM 0 HD2 LYS A 140 5.950 -13.094 24.990 1.00 0.00 H new ATOM 0 HD3 LYS A 140 4.379 -13.283 24.236 1.00 0.00 H new ATOM 0 HE2 LYS A 140 5.294 -15.341 23.019 1.00 0.00 H new ATOM 0 HE3 LYS A 140 6.762 -15.186 23.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 5.204 -16.718 25.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 5.436 -15.359 26.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 4.014 -15.510 25.085 1.00 0.00 H new ATOM 2220 N LEU A 141 8.096 -13.419 20.225 1.00 0.00 N ATOM 2221 CA LEU A 141 7.696 -14.140 19.026 1.00 0.00 C ATOM 2222 C LEU A 141 6.440 -14.964 19.283 1.00 0.00 C ATOM 2223 O LEU A 141 6.411 -15.812 20.174 1.00 0.00 O ATOM 2224 CB LEU A 141 8.818 -15.078 18.588 1.00 0.00 C ATOM 2225 CG LEU A 141 8.428 -15.781 17.286 1.00 0.00 C ATOM 2226 CD1 LEU A 141 8.637 -14.825 16.111 1.00 0.00 C ATOM 2227 CD2 LEU A 141 9.297 -17.029 17.093 1.00 0.00 C ATOM 0 H LEU A 141 8.883 -13.827 20.730 1.00 0.00 H new ATOM 0 HA LEU A 141 7.490 -13.409 18.244 1.00 0.00 H new ATOM 0 HB2 LEU A 141 9.740 -14.515 18.446 1.00 0.00 H new ATOM 0 HB3 LEU A 141 9.012 -15.816 19.366 1.00 0.00 H new ATOM 0 HG LEU A 141 7.380 -16.077 17.334 1.00 0.00 H new ATOM 0 HD11 LEU A 141 8.360 -15.324 15.182 1.00 0.00 H new ATOM 0 HD12 LEU A 141 8.016 -13.940 16.247 1.00 0.00 H new ATOM 0 HD13 LEU A 141 9.685 -14.529 16.065 1.00 0.00 H new ATOM 0 HD21 LEU A 141 9.017 -17.527 16.165 1.00 0.00 H new ATOM 0 HD22 LEU A 141 10.346 -16.738 17.046 1.00 0.00 H new ATOM 0 HD23 LEU A 141 9.146 -17.710 17.930 1.00 0.00 H new ATOM 2239 N THR A 142 5.409 -14.713 18.486 1.00 0.00 N ATOM 2240 CA THR A 142 4.155 -15.440 18.618 1.00 0.00 C ATOM 2241 C THR A 142 4.082 -16.564 17.588 1.00 0.00 C ATOM 2242 O THR A 142 3.619 -17.665 17.887 1.00 0.00 O ATOM 2243 CB THR A 142 2.976 -14.490 18.415 1.00 0.00 C ATOM 2244 OG1 THR A 142 2.728 -14.335 17.025 1.00 0.00 O ATOM 2245 CG2 THR A 142 3.303 -13.132 19.031 1.00 0.00 C ATOM 0 H THR A 142 5.417 -14.013 17.744 1.00 0.00 H new ATOM 0 HA THR A 142 4.108 -15.869 19.619 1.00 0.00 H new ATOM 0 HB THR A 142 2.090 -14.902 18.898 1.00 0.00 H new ATOM 0 HG1 THR A 142 1.971 -13.727 16.894 1.00 0.00 H new ATOM 0 HG21 THR A 142 2.462 -12.455 18.886 1.00 0.00 H new ATOM 0 HG22 THR A 142 3.492 -13.252 20.098 1.00 0.00 H new ATOM 0 HG23 THR A 142 4.189 -12.718 18.550 1.00 0.00 H new ATOM 2253 N GLY A 143 4.544 -16.282 16.372 1.00 0.00 N ATOM 2254 CA GLY A 143 4.523 -17.283 15.311 1.00 0.00 C ATOM 2255 C GLY A 143 5.736 -17.136 14.400 1.00 0.00 C ATOM 2256 O GLY A 143 6.402 -16.101 14.400 1.00 0.00 O ATOM 0 H GLY A 143 4.933 -15.379 16.100 1.00 0.00 H new ATOM 0 HA2 GLY A 143 4.510 -18.282 15.748 1.00 0.00 H new ATOM 0 HA3 GLY A 143 3.609 -17.179 14.726 1.00 0.00 H new ATOM 2260 N SER A 144 6.020 -18.176 13.625 1.00 0.00 N ATOM 2261 CA SER A 144 7.154 -18.146 12.711 1.00 0.00 C ATOM 2262 C SER A 144 6.783 -18.793 11.381 1.00 0.00 C ATOM 2263 O SER A 144 6.039 -19.773 11.341 1.00 0.00 O ATOM 2264 CB SER A 144 8.344 -18.879 13.329 1.00 0.00 C ATOM 2265 OG SER A 144 8.170 -20.280 13.164 1.00 0.00 O ATOM 0 H SER A 144 5.485 -19.044 13.611 1.00 0.00 H new ATOM 0 HA SER A 144 7.427 -17.106 12.532 1.00 0.00 H new ATOM 0 HB2 SER A 144 9.271 -18.558 12.853 1.00 0.00 H new ATOM 0 HB3 SER A 144 8.427 -18.633 14.388 1.00 0.00 H new ATOM 0 HG SER A 144 8.933 -20.753 13.558 1.00 0.00 H new ATOM 2271 N TYR A 145 7.299 -18.230 10.297 1.00 0.00 N ATOM 2272 CA TYR A 145 7.011 -18.748 8.966 1.00 0.00 C ATOM 2273 C TYR A 145 8.306 -18.951 8.183 1.00 0.00 C ATOM 2274 O TYR A 145 9.228 -18.139 8.273 1.00 0.00 O ATOM 2275 CB TYR A 145 6.116 -17.756 8.225 1.00 0.00 C ATOM 2276 CG TYR A 145 4.844 -17.537 9.013 1.00 0.00 C ATOM 2277 CD1 TYR A 145 4.831 -16.628 10.082 1.00 0.00 C ATOM 2278 CD2 TYR A 145 3.677 -18.232 8.675 1.00 0.00 C ATOM 2279 CE1 TYR A 145 3.655 -16.420 10.809 1.00 0.00 C ATOM 2280 CE2 TYR A 145 2.499 -18.022 9.405 1.00 0.00 C ATOM 2281 CZ TYR A 145 2.489 -17.116 10.472 1.00 0.00 C ATOM 2282 OH TYR A 145 1.331 -16.906 11.190 1.00 0.00 O ATOM 0 H TYR A 145 7.916 -17.418 10.312 1.00 0.00 H new ATOM 0 HA TYR A 145 6.504 -19.709 9.059 1.00 0.00 H new ATOM 0 HB2 TYR A 145 6.639 -16.810 8.089 1.00 0.00 H new ATOM 0 HB3 TYR A 145 5.880 -18.136 7.231 1.00 0.00 H new ATOM 0 HD1 TYR A 145 5.730 -16.089 10.343 1.00 0.00 H new ATOM 0 HD2 TYR A 145 3.684 -18.930 7.851 1.00 0.00 H new ATOM 0 HE1 TYR A 145 3.647 -15.721 11.632 1.00 0.00 H new ATOM 0 HE2 TYR A 145 1.599 -18.559 9.144 1.00 0.00 H new ATOM 0 HH TYR A 145 0.614 -17.466 10.826 1.00 0.00 H new ATOM 2292 N SER A 146 8.368 -20.031 7.414 1.00 0.00 N ATOM 2293 CA SER A 146 9.555 -20.322 6.619 1.00 0.00 C ATOM 2294 C SER A 146 9.153 -20.792 5.227 1.00 0.00 C ATOM 2295 O SER A 146 8.172 -21.518 5.066 1.00 0.00 O ATOM 2296 CB SER A 146 10.388 -21.404 7.302 1.00 0.00 C ATOM 2297 OG SER A 146 11.620 -21.558 6.608 1.00 0.00 O ATOM 0 H SER A 146 7.617 -20.715 7.324 1.00 0.00 H new ATOM 0 HA SER A 146 10.148 -19.412 6.531 1.00 0.00 H new ATOM 0 HB2 SER A 146 10.574 -21.134 8.341 1.00 0.00 H new ATOM 0 HB3 SER A 146 9.842 -22.348 7.311 1.00 0.00 H new ATOM 0 HG SER A 146 12.158 -22.251 7.045 1.00 0.00 H new ATOM 2303 N LYS A 147 9.916 -20.370 4.228 1.00 0.00 N ATOM 2304 CA LYS A 147 9.632 -20.753 2.850 1.00 0.00 C ATOM 2305 C LYS A 147 10.921 -20.817 2.038 1.00 0.00 C ATOM 2306 O LYS A 147 11.395 -19.767 1.634 1.00 0.00 O ATOM 2307 CB LYS A 147 8.677 -19.740 2.211 1.00 0.00 C ATOM 2308 CG LYS A 147 8.073 -20.343 0.940 1.00 0.00 C ATOM 2309 CD LYS A 147 6.844 -21.177 1.306 1.00 0.00 C ATOM 2310 CE LYS A 147 6.255 -21.805 0.041 1.00 0.00 C ATOM 2311 NZ LYS A 147 7.144 -22.905 -0.428 1.00 0.00 N ATOM 2312 OXT LYS A 147 11.414 -21.913 1.831 1.00 0.00 O ATOM 0 H LYS A 147 10.731 -19.767 4.343 1.00 0.00 H new ATOM 0 HA LYS A 147 9.166 -21.739 2.855 1.00 0.00 H new ATOM 0 HB2 LYS A 147 7.886 -19.476 2.913 1.00 0.00 H new ATOM 0 HB3 LYS A 147 9.211 -18.820 1.972 1.00 0.00 H new ATOM 0 HG2 LYS A 147 7.794 -19.550 0.245 1.00 0.00 H new ATOM 0 HG3 LYS A 147 8.811 -20.966 0.434 1.00 0.00 H new ATOM 0 HD2 LYS A 147 7.119 -21.956 2.017 1.00 0.00 H new ATOM 0 HD3 LYS A 147 6.098 -20.549 1.794 1.00 0.00 H new ATOM 0 HE2 LYS A 147 5.257 -22.192 0.245 1.00 0.00 H new ATOM 0 HE3 LYS A 147 6.151 -21.050 -0.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 147 6.641 -23.481 -1.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 147 7.999 -22.500 -0.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 147 7.413 -23.502 0.380 1.00 0.00 H new