USER MOD reduce.3.24.130724 H: found=0, std=0, add=1068, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 1062 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 74 ASN : amide:sc= 1.92 K(o=3.4,f=-0.57) USER MOD Set 1.2: A 117 SER OG : rot -113:sc= 1.39 USER MOD Set 1.3: A 118 THR OG1 : rot 180:sc= 0.0393 USER MOD Set 2.1: A 36 GLN : amide:sc= -2.17! C(o=-2.2!,f=-2.2!) USER MOD Set 2.2: A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 24 SER OG : rot 180:sc= 0.194 USER MOD Single : A 30 THR OG1 : rot -43:sc= 0.0544 USER MOD Single : A 32 ASN : amide:sc= -1.08 K(o=-1.1,f=-0.18) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= -0.398 K(o=-0.4,f=-3) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 GLN : amide:sc= -0.409 X(o=-0.41,f=0) USER MOD Single : A 59 THR OG1 : rot 160:sc= 0.508 USER MOD Single : A 64 LYS NZ :NH3+ 164:sc= 0.499 (180deg=0.38) USER MOD Single : A 66 THR OG1 : rot -160:sc= 0.0121 USER MOD Single : A 70 ASN : amide:sc= -0.437 K(o=-0.44,f=-1.2) USER MOD Single : A 79 GLN : amide:sc= 0.549 K(o=0.55,f=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= -0.327 USER MOD Single : A 92 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 HIS : no HD1:sc= -0.0975 K(o=-0.097,f=-0.68) USER MOD Single : A 101 SER OG : rot 67:sc= 0.674 USER MOD Single : A 102 MET CE :methyl -179:sc= 0 (180deg=-0.00268) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0.0244 USER MOD Single : A 112 SER OG : rot 180:sc= 0.014 USER MOD Single : A 113 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 115 SER OG : rot 68:sc= 0.305 USER MOD Single : A 116 MET CE :methyl -174:sc= 0 (180deg=-0.0651) USER MOD Single : A 122 THR OG1 : rot 105:sc= 0.0158 USER MOD Single : A 123 THR OG1 : rot 91:sc= 0.0323 USER MOD Single : A 124 HIS : no HD1:sc= -0.0471 X(o=-0.047,f=-0.0053) USER MOD Single : A 133 HIS : no HD1:sc= -0.0121 X(o=-0.012,f=0) USER MOD Single : A 134 HIS : no HE2:sc= 1.13 K(o=1.1,f=-3.5!) USER MOD Single : A 135 SER OG : rot 180:sc=0.000631 USER MOD Single : A 137 SER OG : rot 180:sc= 0.0265 USER MOD Single : A 140 THR OG1 : rot -33:sc= 0.127 USER MOD Single : A 156 SER OG : rot 180:sc= 0.032 USER MOD Single : A 157 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 158 HIS : no HD1:sc= -0.0758 X(o=-0.076,f=-0.066) USER MOD Single : A 160 THR OG1 : rot 43:sc= 0.0571 USER MOD ----------------------------------------------------------------- ATOM 138 N SER A 24 16.174 5.250 -7.531 1.00 0.00 N ATOM 139 CA SER A 24 15.437 5.690 -6.326 1.00 0.00 C ATOM 140 C SER A 24 13.977 6.102 -6.649 1.00 0.00 C ATOM 141 O SER A 24 13.392 5.632 -7.630 1.00 0.00 O ATOM 142 CB SER A 24 16.224 6.789 -5.574 1.00 0.00 C ATOM 143 OG SER A 24 15.809 6.906 -4.216 1.00 0.00 O ATOM 0 HA SER A 24 15.355 4.837 -5.652 1.00 0.00 H new ATOM 0 HB2 SER A 24 17.289 6.561 -5.610 1.00 0.00 H new ATOM 0 HB3 SER A 24 16.085 7.745 -6.079 1.00 0.00 H new ATOM 0 HG SER A 24 16.330 7.609 -3.774 1.00 0.00 H new ATOM 149 N GLY A 25 13.381 6.965 -5.813 1.00 0.00 N ATOM 150 CA GLY A 25 12.069 7.585 -6.016 1.00 0.00 C ATOM 151 C GLY A 25 12.186 8.824 -6.913 1.00 0.00 C ATOM 152 O GLY A 25 12.429 8.701 -8.110 1.00 0.00 O ATOM 0 H GLY A 25 13.821 7.260 -4.941 1.00 0.00 H new ATOM 0 HA2 GLY A 25 11.388 6.865 -6.469 1.00 0.00 H new ATOM 0 HA3 GLY A 25 11.642 7.866 -5.054 1.00 0.00 H new ATOM 156 N VAL A 26 11.997 10.012 -6.334 1.00 0.00 N ATOM 157 CA VAL A 26 12.068 11.302 -7.055 1.00 0.00 C ATOM 158 C VAL A 26 13.487 11.594 -7.583 1.00 0.00 C ATOM 159 O VAL A 26 14.466 11.478 -6.847 1.00 0.00 O ATOM 160 CB VAL A 26 11.570 12.492 -6.201 1.00 0.00 C ATOM 161 CG1 VAL A 26 10.073 12.340 -5.892 1.00 0.00 C ATOM 162 CG2 VAL A 26 12.333 12.693 -4.877 1.00 0.00 C ATOM 0 H VAL A 26 11.788 10.115 -5.341 1.00 0.00 H new ATOM 0 HA VAL A 26 11.396 11.196 -7.906 1.00 0.00 H new ATOM 0 HB VAL A 26 11.759 13.376 -6.810 1.00 0.00 H new ATOM 0 HG11 VAL A 26 9.738 13.185 -5.291 1.00 0.00 H new ATOM 0 HG12 VAL A 26 9.510 12.313 -6.825 1.00 0.00 H new ATOM 0 HG13 VAL A 26 9.907 11.414 -5.341 1.00 0.00 H new ATOM 0 HG21 VAL A 26 11.917 13.548 -4.344 1.00 0.00 H new ATOM 0 HG22 VAL A 26 12.235 11.799 -4.261 1.00 0.00 H new ATOM 0 HG23 VAL A 26 13.387 12.874 -5.088 1.00 0.00 H new ATOM 172 N ASP A 27 13.589 12.007 -8.848 1.00 0.00 N ATOM 173 CA ASP A 27 14.866 12.403 -9.479 1.00 0.00 C ATOM 174 C ASP A 27 15.253 13.875 -9.200 1.00 0.00 C ATOM 175 O ASP A 27 16.439 14.206 -9.156 1.00 0.00 O ATOM 176 CB ASP A 27 14.765 12.150 -10.989 1.00 0.00 C ATOM 177 CG ASP A 27 16.096 12.362 -11.708 1.00 0.00 C ATOM 178 OD1 ASP A 27 16.192 13.323 -12.512 1.00 0.00 O ATOM 179 OD2 ASP A 27 17.042 11.556 -11.502 1.00 0.00 O1- ATOM 0 H ASP A 27 12.787 12.079 -9.474 1.00 0.00 H new ATOM 0 HA ASP A 27 15.659 11.798 -9.039 1.00 0.00 H new ATOM 0 HB2 ASP A 27 14.421 11.130 -11.161 1.00 0.00 H new ATOM 0 HB3 ASP A 27 14.015 12.815 -11.416 1.00 0.00 H new ATOM 184 N LEU A 28 14.249 14.739 -8.990 1.00 0.00 N ATOM 185 CA LEU A 28 14.398 16.200 -8.834 1.00 0.00 C ATOM 186 C LEU A 28 13.746 16.786 -7.557 1.00 0.00 C ATOM 187 O LEU A 28 13.726 18.006 -7.377 1.00 0.00 O ATOM 188 CB LEU A 28 13.887 16.870 -10.129 1.00 0.00 C ATOM 189 CG LEU A 28 12.359 16.748 -10.352 1.00 0.00 C ATOM 190 CD1 LEU A 28 11.655 18.105 -10.209 1.00 0.00 C ATOM 191 CD2 LEU A 28 12.049 16.160 -11.736 1.00 0.00 C ATOM 0 H LEU A 28 13.278 14.434 -8.921 1.00 0.00 H new ATOM 0 HA LEU A 28 15.455 16.420 -8.686 1.00 0.00 H new ATOM 0 HB2 LEU A 28 14.156 17.926 -10.108 1.00 0.00 H new ATOM 0 HB3 LEU A 28 14.403 16.427 -10.981 1.00 0.00 H new ATOM 0 HG LEU A 28 11.981 16.076 -9.582 1.00 0.00 H new ATOM 0 HD11 LEU A 28 10.585 17.979 -10.372 1.00 0.00 H new ATOM 0 HD12 LEU A 28 11.825 18.499 -9.207 1.00 0.00 H new ATOM 0 HD13 LEU A 28 12.055 18.802 -10.946 1.00 0.00 H new ATOM 0 HD21 LEU A 28 10.969 16.085 -11.866 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.464 16.808 -12.508 1.00 0.00 H new ATOM 0 HD23 LEU A 28 12.494 15.168 -11.818 1.00 0.00 H new ATOM 203 N GLY A 29 13.198 15.930 -6.682 1.00 0.00 N ATOM 204 CA GLY A 29 12.608 16.313 -5.383 1.00 0.00 C ATOM 205 C GLY A 29 11.079 16.381 -5.387 1.00 0.00 C ATOM 206 O GLY A 29 10.448 15.796 -4.505 1.00 0.00 O ATOM 0 H GLY A 29 13.150 14.927 -6.859 1.00 0.00 H new ATOM 0 HA2 GLY A 29 12.927 15.597 -4.626 1.00 0.00 H new ATOM 0 HA3 GLY A 29 13.003 17.285 -5.089 1.00 0.00 H new ATOM 210 N THR A 30 10.478 17.052 -6.386 1.00 0.00 N ATOM 211 CA THR A 30 9.013 17.255 -6.501 1.00 0.00 C ATOM 212 C THR A 30 8.355 16.462 -7.640 1.00 0.00 C ATOM 213 O THR A 30 7.178 16.648 -7.939 1.00 0.00 O ATOM 214 CB THR A 30 8.702 18.764 -6.504 1.00 0.00 C ATOM 215 OG1 THR A 30 7.388 18.963 -6.032 1.00 0.00 O ATOM 216 CG2 THR A 30 8.867 19.451 -7.861 1.00 0.00 C ATOM 0 H THR A 30 11.001 17.478 -7.151 1.00 0.00 H new ATOM 0 HA THR A 30 8.540 16.823 -5.619 1.00 0.00 H new ATOM 0 HB THR A 30 9.441 19.227 -5.850 1.00 0.00 H new ATOM 0 HG1 THR A 30 6.791 18.299 -6.436 1.00 0.00 H new ATOM 0 HG21 THR A 30 8.626 20.510 -7.764 1.00 0.00 H new ATOM 0 HG22 THR A 30 9.897 19.342 -8.201 1.00 0.00 H new ATOM 0 HG23 THR A 30 8.195 18.991 -8.586 1.00 0.00 H new ATOM 224 N GLU A 31 9.080 15.521 -8.259 1.00 0.00 N ATOM 225 CA GLU A 31 8.557 14.640 -9.320 1.00 0.00 C ATOM 226 C GLU A 31 7.326 13.825 -8.871 1.00 0.00 C ATOM 227 O GLU A 31 6.455 13.506 -9.681 1.00 0.00 O ATOM 228 CB GLU A 31 9.689 13.713 -9.789 1.00 0.00 C ATOM 229 CG GLU A 31 9.311 12.837 -10.994 1.00 0.00 C ATOM 230 CD GLU A 31 10.509 12.081 -11.534 1.00 0.00 C ATOM 231 OE1 GLU A 31 10.549 11.848 -12.770 1.00 0.00 O ATOM 232 OE2 GLU A 31 11.391 11.687 -10.736 1.00 0.00 O1- ATOM 0 H GLU A 31 10.060 15.345 -8.036 1.00 0.00 H new ATOM 0 HA GLU A 31 8.214 15.265 -10.145 1.00 0.00 H new ATOM 0 HB2 GLU A 31 10.558 14.318 -10.049 1.00 0.00 H new ATOM 0 HB3 GLU A 31 9.985 13.069 -8.961 1.00 0.00 H new ATOM 0 HG2 GLU A 31 8.536 12.129 -10.701 1.00 0.00 H new ATOM 0 HG3 GLU A 31 8.890 13.463 -11.781 1.00 0.00 H new ATOM 239 N ASN A 32 7.202 13.541 -7.567 1.00 0.00 N ATOM 240 CA ASN A 32 6.024 12.888 -6.995 1.00 0.00 C ATOM 241 C ASN A 32 4.727 13.699 -7.209 1.00 0.00 C ATOM 242 O ASN A 32 3.657 13.111 -7.358 1.00 0.00 O ATOM 243 CB ASN A 32 6.269 12.587 -5.504 1.00 0.00 C ATOM 244 CG ASN A 32 6.259 13.825 -4.609 1.00 0.00 C ATOM 245 OD1 ASN A 32 5.207 14.314 -4.217 1.00 0.00 O ATOM 246 ND2 ASN A 32 7.410 14.376 -4.268 1.00 0.00 N ATOM 0 H ASN A 32 7.922 13.760 -6.879 1.00 0.00 H new ATOM 0 HA ASN A 32 5.873 11.948 -7.526 1.00 0.00 H new ATOM 0 HB2 ASN A 32 5.505 11.892 -5.154 1.00 0.00 H new ATOM 0 HB3 ASN A 32 7.230 12.083 -5.399 1.00 0.00 H new ATOM 0 HD21 ASN A 32 7.422 15.208 -3.678 1.00 0.00 H new ATOM 0 HD22 ASN A 32 8.287 13.969 -4.594 1.00 0.00 H new ATOM 253 N LEU A 33 4.810 15.035 -7.263 1.00 0.00 N ATOM 254 CA LEU A 33 3.655 15.936 -7.319 1.00 0.00 C ATOM 255 C LEU A 33 2.929 15.888 -8.672 1.00 0.00 C ATOM 256 O LEU A 33 1.726 16.138 -8.725 1.00 0.00 O ATOM 257 CB LEU A 33 4.149 17.363 -7.003 1.00 0.00 C ATOM 258 CG LEU A 33 3.033 18.351 -6.602 1.00 0.00 C ATOM 259 CD1 LEU A 33 2.534 18.085 -5.172 1.00 0.00 C ATOM 260 CD2 LEU A 33 3.557 19.791 -6.706 1.00 0.00 C ATOM 0 H LEU A 33 5.703 15.529 -7.269 1.00 0.00 H new ATOM 0 HA LEU A 33 2.920 15.613 -6.582 1.00 0.00 H new ATOM 0 HB2 LEU A 33 4.879 17.311 -6.195 1.00 0.00 H new ATOM 0 HB3 LEU A 33 4.669 17.756 -7.877 1.00 0.00 H new ATOM 0 HG LEU A 33 2.195 18.210 -7.285 1.00 0.00 H new ATOM 0 HD11 LEU A 33 1.749 18.798 -4.922 1.00 0.00 H new ATOM 0 HD12 LEU A 33 2.138 17.072 -5.108 1.00 0.00 H new ATOM 0 HD13 LEU A 33 3.362 18.196 -4.471 1.00 0.00 H new ATOM 0 HD21 LEU A 33 2.767 20.487 -6.422 1.00 0.00 H new ATOM 0 HD22 LEU A 33 4.409 19.917 -6.038 1.00 0.00 H new ATOM 0 HD23 LEU A 33 3.867 19.992 -7.731 1.00 0.00 H new ATOM 272 N TYR A 34 3.634 15.525 -9.752 1.00 0.00 N ATOM 273 CA TYR A 34 3.150 15.567 -11.145 1.00 0.00 C ATOM 274 C TYR A 34 1.832 14.786 -11.367 1.00 0.00 C ATOM 275 O TYR A 34 1.055 15.128 -12.262 1.00 0.00 O ATOM 276 CB TYR A 34 4.239 14.993 -12.073 1.00 0.00 C ATOM 277 CG TYR A 34 5.463 15.837 -12.419 1.00 0.00 C ATOM 278 CD1 TYR A 34 6.099 16.681 -11.481 1.00 0.00 C ATOM 279 CD2 TYR A 34 6.018 15.708 -13.711 1.00 0.00 C ATOM 280 CE1 TYR A 34 7.265 17.389 -11.833 1.00 0.00 C ATOM 281 CE2 TYR A 34 7.183 16.410 -14.068 1.00 0.00 C ATOM 282 CZ TYR A 34 7.812 17.255 -13.129 1.00 0.00 C ATOM 283 OH TYR A 34 8.942 17.930 -13.480 1.00 0.00 O ATOM 0 H TYR A 34 4.592 15.181 -9.681 1.00 0.00 H new ATOM 0 HA TYR A 34 2.939 16.611 -11.374 1.00 0.00 H new ATOM 0 HB2 TYR A 34 4.599 14.069 -11.620 1.00 0.00 H new ATOM 0 HB3 TYR A 34 3.756 14.721 -13.011 1.00 0.00 H new ATOM 0 HD1 TYR A 34 5.688 16.784 -10.487 1.00 0.00 H new ATOM 0 HD2 TYR A 34 5.542 15.062 -14.434 1.00 0.00 H new ATOM 0 HE1 TYR A 34 7.742 18.035 -11.111 1.00 0.00 H new ATOM 0 HE2 TYR A 34 7.596 16.303 -15.060 1.00 0.00 H new ATOM 0 HH TYR A 34 9.175 17.718 -14.408 1.00 0.00 H new ATOM 293 N PHE A 35 1.574 13.763 -10.542 1.00 0.00 N ATOM 294 CA PHE A 35 0.325 12.988 -10.507 1.00 0.00 C ATOM 295 C PHE A 35 -0.077 12.652 -9.051 1.00 0.00 C ATOM 296 O PHE A 35 -0.649 11.595 -8.792 1.00 0.00 O ATOM 297 CB PHE A 35 0.469 11.752 -11.427 1.00 0.00 C ATOM 298 CG PHE A 35 -0.749 11.336 -12.244 1.00 0.00 C ATOM 299 CD1 PHE A 35 -2.052 11.350 -11.703 1.00 0.00 C ATOM 300 CD2 PHE A 35 -0.562 10.886 -13.567 1.00 0.00 C ATOM 301 CE1 PHE A 35 -3.148 10.923 -12.475 1.00 0.00 C ATOM 302 CE2 PHE A 35 -1.658 10.463 -14.341 1.00 0.00 C ATOM 303 CZ PHE A 35 -2.952 10.481 -13.795 1.00 0.00 C ATOM 0 H PHE A 35 2.254 13.440 -9.854 1.00 0.00 H new ATOM 0 HA PHE A 35 -0.502 13.580 -10.898 1.00 0.00 H new ATOM 0 HB2 PHE A 35 1.289 11.942 -12.119 1.00 0.00 H new ATOM 0 HB3 PHE A 35 0.764 10.905 -10.808 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -2.209 11.691 -10.690 1.00 0.00 H new ATOM 0 HD2 PHE A 35 0.431 10.866 -13.990 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -4.142 10.935 -12.053 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -1.504 10.124 -15.355 1.00 0.00 H new ATOM 0 HZ PHE A 35 -3.794 10.156 -14.388 1.00 0.00 H new ATOM 313 N GLN A 36 0.243 13.529 -8.087 1.00 0.00 N ATOM 314 CA GLN A 36 -0.189 13.424 -6.680 1.00 0.00 C ATOM 315 C GLN A 36 0.357 12.131 -6.014 1.00 0.00 C ATOM 316 O GLN A 36 1.378 11.591 -6.444 1.00 0.00 O ATOM 317 CB GLN A 36 -1.733 13.598 -6.648 1.00 0.00 C ATOM 318 CG GLN A 36 -2.299 14.399 -5.457 1.00 0.00 C ATOM 319 CD GLN A 36 -2.569 13.564 -4.215 1.00 0.00 C ATOM 320 OE1 GLN A 36 -3.285 12.577 -4.250 1.00 0.00 O ATOM 321 NE2 GLN A 36 -1.972 13.869 -3.088 1.00 0.00 N ATOM 0 H GLN A 36 0.822 14.350 -8.265 1.00 0.00 H new ATOM 0 HA GLN A 36 0.237 14.216 -6.065 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -2.043 14.089 -7.570 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -2.190 12.609 -6.645 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -1.597 15.193 -5.202 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -3.227 14.881 -5.766 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -1.369 14.690 -3.036 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -2.111 13.285 -2.263 1.00 0.00 H new ATOM 330 N SER A 37 -0.303 11.571 -4.994 1.00 0.00 N ATOM 331 CA SER A 37 0.103 10.295 -4.378 1.00 0.00 C ATOM 332 C SER A 37 0.138 9.129 -5.383 1.00 0.00 C ATOM 333 O SER A 37 0.880 8.167 -5.171 1.00 0.00 O ATOM 334 CB SER A 37 -0.842 9.939 -3.220 1.00 0.00 C ATOM 335 OG SER A 37 -0.768 10.935 -2.224 1.00 0.00 O ATOM 0 H SER A 37 -1.133 11.986 -4.570 1.00 0.00 H new ATOM 0 HA SER A 37 1.118 10.439 -4.007 1.00 0.00 H new ATOM 0 HB2 SER A 37 -1.865 9.852 -3.586 1.00 0.00 H new ATOM 0 HB3 SER A 37 -0.570 8.970 -2.800 1.00 0.00 H new ATOM 0 HG SER A 37 -1.373 10.707 -1.487 1.00 0.00 H new ATOM 341 N MET A 38 -0.595 9.237 -6.505 1.00 0.00 N ATOM 342 CA MET A 38 -0.554 8.297 -7.630 1.00 0.00 C ATOM 343 C MET A 38 0.855 8.201 -8.226 1.00 0.00 C ATOM 344 O MET A 38 1.356 7.089 -8.369 1.00 0.00 O ATOM 345 CB MET A 38 -1.588 8.699 -8.700 1.00 0.00 C ATOM 346 CG MET A 38 -2.454 7.524 -9.163 1.00 0.00 C ATOM 347 SD MET A 38 -3.650 6.952 -7.925 1.00 0.00 S ATOM 348 CE MET A 38 -4.830 6.145 -9.037 1.00 0.00 C ATOM 0 H MET A 38 -1.250 10.004 -6.655 1.00 0.00 H new ATOM 0 HA MET A 38 -0.814 7.306 -7.257 1.00 0.00 H new ATOM 0 HB2 MET A 38 -2.231 9.483 -8.300 1.00 0.00 H new ATOM 0 HB3 MET A 38 -1.068 9.122 -9.560 1.00 0.00 H new ATOM 0 HG2 MET A 38 -2.992 7.817 -10.065 1.00 0.00 H new ATOM 0 HG3 MET A 38 -1.804 6.693 -9.436 1.00 0.00 H new ATOM 0 HE1 MET A 38 -5.650 5.725 -8.455 1.00 0.00 H new ATOM 0 HE2 MET A 38 -5.224 6.876 -9.743 1.00 0.00 H new ATOM 0 HE3 MET A 38 -4.328 5.347 -9.584 1.00 0.00 H new ATOM 358 N ARG A 39 1.546 9.317 -8.513 1.00 0.00 N ATOM 359 CA ARG A 39 2.950 9.232 -8.956 1.00 0.00 C ATOM 360 C ARG A 39 3.888 8.857 -7.813 1.00 0.00 C ATOM 361 O ARG A 39 4.814 8.086 -8.051 1.00 0.00 O ATOM 362 CB ARG A 39 3.472 10.497 -9.663 1.00 0.00 C ATOM 363 CG ARG A 39 3.816 10.196 -11.136 1.00 0.00 C ATOM 364 CD ARG A 39 4.908 11.130 -11.675 1.00 0.00 C ATOM 365 NE ARG A 39 4.782 11.403 -13.122 1.00 0.00 N ATOM 366 CZ ARG A 39 4.864 10.542 -14.134 1.00 0.00 C ATOM 367 NH1 ARG A 39 5.012 9.246 -13.955 1.00 0.00 N1+ ATOM 368 NH2 ARG A 39 4.793 10.989 -15.369 1.00 0.00 N ATOM 0 H ARG A 39 1.170 10.263 -8.449 1.00 0.00 H new ATOM 0 HA ARG A 39 2.948 8.435 -9.700 1.00 0.00 H new ATOM 0 HB2 ARG A 39 2.719 11.284 -9.614 1.00 0.00 H new ATOM 0 HB3 ARG A 39 4.357 10.869 -9.147 1.00 0.00 H new ATOM 0 HG2 ARG A 39 4.147 9.161 -11.227 1.00 0.00 H new ATOM 0 HG3 ARG A 39 2.918 10.298 -11.746 1.00 0.00 H new ATOM 0 HD2 ARG A 39 4.871 12.073 -11.130 1.00 0.00 H new ATOM 0 HD3 ARG A 39 5.884 10.687 -11.480 1.00 0.00 H new ATOM 0 HE ARG A 39 4.610 12.375 -13.378 1.00 0.00 H new ATOM 0 HH11 ARG A 39 5.068 8.865 -13.011 1.00 0.00 H new ATOM 0 HH12 ARG A 39 5.070 8.623 -14.761 1.00 0.00 H new ATOM 0 HH21 ARG A 39 4.676 11.987 -15.544 1.00 0.00 H new ATOM 0 HH22 ARG A 39 4.855 10.338 -16.151 1.00 0.00 H new ATOM 382 N ALA A 40 3.657 9.346 -6.589 1.00 0.00 N ATOM 383 CA ALA A 40 4.500 9.013 -5.435 1.00 0.00 C ATOM 384 C ALA A 40 4.688 7.491 -5.294 1.00 0.00 C ATOM 385 O ALA A 40 5.818 7.011 -5.243 1.00 0.00 O ATOM 386 CB ALA A 40 3.895 9.641 -4.169 1.00 0.00 C ATOM 0 H ALA A 40 2.887 9.979 -6.371 1.00 0.00 H new ATOM 0 HA ALA A 40 5.496 9.429 -5.587 1.00 0.00 H new ATOM 0 HB1 ALA A 40 4.518 9.397 -3.308 1.00 0.00 H new ATOM 0 HB2 ALA A 40 3.848 10.724 -4.287 1.00 0.00 H new ATOM 0 HB3 ALA A 40 2.890 9.249 -4.013 1.00 0.00 H new ATOM 392 N GLN A 41 3.591 6.730 -5.321 1.00 0.00 N ATOM 393 CA GLN A 41 3.616 5.269 -5.191 1.00 0.00 C ATOM 394 C GLN A 41 4.079 4.537 -6.466 1.00 0.00 C ATOM 395 O GLN A 41 4.829 3.565 -6.359 1.00 0.00 O ATOM 396 CB GLN A 41 2.236 4.806 -4.704 1.00 0.00 C ATOM 397 CG GLN A 41 1.124 4.911 -5.765 1.00 0.00 C ATOM 398 CD GLN A 41 -0.297 4.889 -5.207 1.00 0.00 C ATOM 399 OE1 GLN A 41 -0.550 5.082 -4.028 1.00 0.00 O ATOM 400 NE2 GLN A 41 -1.287 4.633 -6.035 1.00 0.00 N ATOM 0 H GLN A 41 2.652 7.113 -5.435 1.00 0.00 H new ATOM 0 HA GLN A 41 4.373 4.999 -4.455 1.00 0.00 H new ATOM 0 HB2 GLN A 41 2.309 3.770 -4.372 1.00 0.00 H new ATOM 0 HB3 GLN A 41 1.951 5.400 -3.836 1.00 0.00 H new ATOM 0 HG2 GLN A 41 1.264 5.834 -6.328 1.00 0.00 H new ATOM 0 HG3 GLN A 41 1.235 4.087 -6.470 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -1.096 4.469 -7.023 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -2.246 4.599 -5.688 1.00 0.00 H new ATOM 409 N LEU A 42 3.688 5.004 -7.665 1.00 0.00 N ATOM 410 CA LEU A 42 4.119 4.407 -8.939 1.00 0.00 C ATOM 411 C LEU A 42 5.631 4.537 -9.140 1.00 0.00 C ATOM 412 O LEU A 42 6.274 3.590 -9.588 1.00 0.00 O ATOM 413 CB LEU A 42 3.362 5.060 -10.120 1.00 0.00 C ATOM 414 CG LEU A 42 2.116 4.311 -10.641 1.00 0.00 C ATOM 415 CD1 LEU A 42 2.527 3.041 -11.404 1.00 0.00 C ATOM 416 CD2 LEU A 42 1.093 3.953 -9.552 1.00 0.00 C ATOM 0 H LEU A 42 3.066 5.804 -7.777 1.00 0.00 H new ATOM 0 HA LEU A 42 3.880 3.344 -8.906 1.00 0.00 H new ATOM 0 HB2 LEU A 42 3.056 6.061 -9.817 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.060 5.178 -10.949 1.00 0.00 H new ATOM 0 HG LEU A 42 1.618 5.011 -11.312 1.00 0.00 H new ATOM 0 HD11 LEU A 42 1.635 2.528 -11.763 1.00 0.00 H new ATOM 0 HD12 LEU A 42 3.155 3.313 -12.252 1.00 0.00 H new ATOM 0 HD13 LEU A 42 3.083 2.380 -10.738 1.00 0.00 H new ATOM 0 HD21 LEU A 42 0.250 3.430 -10.003 1.00 0.00 H new ATOM 0 HD22 LEU A 42 1.563 3.310 -8.808 1.00 0.00 H new ATOM 0 HD23 LEU A 42 0.739 4.865 -9.071 1.00 0.00 H new ATOM 428 N ILE A 43 6.213 5.687 -8.798 1.00 0.00 N ATOM 429 CA ILE A 43 7.658 5.926 -8.922 1.00 0.00 C ATOM 430 C ILE A 43 8.437 5.201 -7.813 1.00 0.00 C ATOM 431 O ILE A 43 9.408 4.517 -8.136 1.00 0.00 O ATOM 432 CB ILE A 43 7.930 7.449 -9.001 1.00 0.00 C ATOM 433 CG1 ILE A 43 7.264 8.117 -10.233 1.00 0.00 C ATOM 434 CG2 ILE A 43 9.435 7.756 -9.014 1.00 0.00 C ATOM 435 CD1 ILE A 43 7.581 7.492 -11.600 1.00 0.00 C ATOM 0 H ILE A 43 5.697 6.484 -8.426 1.00 0.00 H new ATOM 0 HA ILE A 43 8.029 5.496 -9.853 1.00 0.00 H new ATOM 0 HB ILE A 43 7.481 7.871 -8.102 1.00 0.00 H new ATOM 0 HG12 ILE A 43 6.184 8.098 -10.090 1.00 0.00 H new ATOM 0 HG13 ILE A 43 7.564 9.165 -10.258 1.00 0.00 H new ATOM 0 HG21 ILE A 43 9.586 8.834 -9.070 1.00 0.00 H new ATOM 0 HG22 ILE A 43 9.892 7.372 -8.102 1.00 0.00 H new ATOM 0 HG23 ILE A 43 9.896 7.280 -9.879 1.00 0.00 H new ATOM 0 HD11 ILE A 43 7.059 8.044 -12.382 1.00 0.00 H new ATOM 0 HD12 ILE A 43 8.655 7.536 -11.780 1.00 0.00 H new ATOM 0 HD13 ILE A 43 7.254 6.452 -11.609 1.00 0.00 H new ATOM 447 N GLU A 44 7.985 5.267 -6.553 1.00 0.00 N ATOM 448 CA GLU A 44 8.660 4.671 -5.382 1.00 0.00 C ATOM 449 C GLU A 44 9.048 3.193 -5.570 1.00 0.00 C ATOM 450 O GLU A 44 10.134 2.802 -5.141 1.00 0.00 O ATOM 451 CB GLU A 44 7.762 4.837 -4.139 1.00 0.00 C ATOM 452 CG GLU A 44 8.229 4.145 -2.847 1.00 0.00 C ATOM 453 CD GLU A 44 9.592 4.625 -2.324 1.00 0.00 C ATOM 454 OE1 GLU A 44 10.271 3.826 -1.637 1.00 0.00 O ATOM 455 OE2 GLU A 44 9.966 5.804 -2.532 1.00 0.00 O1- ATOM 0 H GLU A 44 7.119 5.747 -6.309 1.00 0.00 H new ATOM 0 HA GLU A 44 9.600 5.207 -5.252 1.00 0.00 H new ATOM 0 HB2 GLU A 44 7.658 5.903 -3.935 1.00 0.00 H new ATOM 0 HB3 GLU A 44 6.769 4.462 -4.385 1.00 0.00 H new ATOM 0 HG2 GLU A 44 7.479 4.306 -2.072 1.00 0.00 H new ATOM 0 HG3 GLU A 44 8.279 3.071 -3.023 1.00 0.00 H new ATOM 462 N ARG A 45 8.195 2.379 -6.211 1.00 0.00 N ATOM 463 CA ARG A 45 8.506 0.976 -6.538 1.00 0.00 C ATOM 464 C ARG A 45 8.833 0.770 -8.026 1.00 0.00 C ATOM 465 O ARG A 45 9.778 0.049 -8.348 1.00 0.00 O ATOM 466 CB ARG A 45 7.344 0.085 -6.063 1.00 0.00 C ATOM 467 CG ARG A 45 7.607 -1.429 -6.160 1.00 0.00 C ATOM 468 CD ARG A 45 8.763 -1.925 -5.273 1.00 0.00 C ATOM 469 NE ARG A 45 8.997 -3.369 -5.476 1.00 0.00 N ATOM 470 CZ ARG A 45 10.170 -3.986 -5.519 1.00 0.00 C ATOM 471 NH1 ARG A 45 11.275 -3.431 -5.081 1.00 0.00 N1+ ATOM 472 NH2 ARG A 45 10.244 -5.191 -6.030 1.00 0.00 N ATOM 0 H ARG A 45 7.268 2.674 -6.518 1.00 0.00 H new ATOM 0 HA ARG A 45 9.415 0.687 -6.010 1.00 0.00 H new ATOM 0 HB2 ARG A 45 7.115 0.334 -5.027 1.00 0.00 H new ATOM 0 HB3 ARG A 45 6.458 0.324 -6.652 1.00 0.00 H new ATOM 0 HG2 ARG A 45 6.697 -1.963 -5.885 1.00 0.00 H new ATOM 0 HG3 ARG A 45 7.825 -1.683 -7.197 1.00 0.00 H new ATOM 0 HD2 ARG A 45 9.671 -1.369 -5.506 1.00 0.00 H new ATOM 0 HD3 ARG A 45 8.532 -1.733 -4.225 1.00 0.00 H new ATOM 0 HE ARG A 45 8.169 -3.953 -5.596 1.00 0.00 H new ATOM 0 HH11 ARG A 45 11.252 -2.490 -4.689 1.00 0.00 H new ATOM 0 HH12 ARG A 45 12.157 -3.941 -5.133 1.00 0.00 H new ATOM 0 HH21 ARG A 45 9.404 -5.645 -6.390 1.00 0.00 H new ATOM 0 HH22 ARG A 45 11.141 -5.675 -6.068 1.00 0.00 H new ATOM 486 N GLY A 46 8.115 1.423 -8.946 1.00 0.00 N ATOM 487 CA GLY A 46 8.253 1.196 -10.393 1.00 0.00 C ATOM 488 C GLY A 46 9.537 1.759 -11.000 1.00 0.00 C ATOM 489 O GLY A 46 10.036 1.193 -11.972 1.00 0.00 O ATOM 0 H GLY A 46 7.417 2.128 -8.709 1.00 0.00 H new ATOM 0 HA2 GLY A 46 8.214 0.124 -10.586 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.399 1.643 -10.902 1.00 0.00 H new ATOM 493 N GLN A 47 10.103 2.832 -10.435 1.00 0.00 N ATOM 494 CA GLN A 47 11.419 3.354 -10.828 1.00 0.00 C ATOM 495 C GLN A 47 12.553 2.736 -9.987 1.00 0.00 C ATOM 496 O GLN A 47 13.672 2.623 -10.483 1.00 0.00 O ATOM 497 CB GLN A 47 11.394 4.895 -10.783 1.00 0.00 C ATOM 498 CG GLN A 47 12.586 5.504 -11.544 1.00 0.00 C ATOM 499 CD GLN A 47 12.579 7.032 -11.629 1.00 0.00 C ATOM 500 OE1 GLN A 47 13.523 7.708 -11.243 1.00 0.00 O ATOM 501 NE2 GLN A 47 11.555 7.645 -12.183 1.00 0.00 N ATOM 0 H GLN A 47 9.659 3.366 -9.688 1.00 0.00 H new ATOM 0 HA GLN A 47 11.634 3.058 -11.855 1.00 0.00 H new ATOM 0 HB2 GLN A 47 10.462 5.257 -11.216 1.00 0.00 H new ATOM 0 HB3 GLN A 47 11.415 5.230 -9.746 1.00 0.00 H new ATOM 0 HG2 GLN A 47 13.509 5.185 -11.060 1.00 0.00 H new ATOM 0 HG3 GLN A 47 12.599 5.098 -12.555 1.00 0.00 H new ATOM 0 HE21 GLN A 47 10.755 7.105 -12.513 1.00 0.00 H new ATOM 0 HE22 GLN A 47 11.561 8.660 -12.282 1.00 0.00 H new ATOM 510 N LEU A 48 12.271 2.245 -8.770 1.00 0.00 N ATOM 511 CA LEU A 48 13.224 1.448 -7.984 1.00 0.00 C ATOM 512 C LEU A 48 13.574 0.117 -8.675 1.00 0.00 C ATOM 513 O LEU A 48 14.740 -0.280 -8.678 1.00 0.00 O ATOM 514 CB LEU A 48 12.625 1.243 -6.577 1.00 0.00 C ATOM 515 CG LEU A 48 13.435 0.344 -5.621 1.00 0.00 C ATOM 516 CD1 LEU A 48 14.834 0.916 -5.324 1.00 0.00 C ATOM 517 CD2 LEU A 48 12.661 0.178 -4.306 1.00 0.00 C ATOM 0 H LEU A 48 11.375 2.390 -8.304 1.00 0.00 H new ATOM 0 HA LEU A 48 14.171 1.981 -7.900 1.00 0.00 H new ATOM 0 HB2 LEU A 48 12.504 2.220 -6.110 1.00 0.00 H new ATOM 0 HB3 LEU A 48 11.628 0.817 -6.687 1.00 0.00 H new ATOM 0 HG LEU A 48 13.573 -0.620 -6.111 1.00 0.00 H new ATOM 0 HD11 LEU A 48 15.364 0.247 -4.647 1.00 0.00 H new ATOM 0 HD12 LEU A 48 15.394 1.009 -6.254 1.00 0.00 H new ATOM 0 HD13 LEU A 48 14.735 1.898 -4.860 1.00 0.00 H new ATOM 0 HD21 LEU A 48 13.230 -0.457 -3.627 1.00 0.00 H new ATOM 0 HD22 LEU A 48 12.509 1.155 -3.848 1.00 0.00 H new ATOM 0 HD23 LEU A 48 11.694 -0.282 -4.509 1.00 0.00 H new ATOM 529 N ILE A 49 12.584 -0.566 -9.265 1.00 0.00 N ATOM 530 CA ILE A 49 12.803 -1.805 -10.046 1.00 0.00 C ATOM 531 C ILE A 49 13.443 -1.513 -11.412 1.00 0.00 C ATOM 532 O ILE A 49 14.382 -2.199 -11.817 1.00 0.00 O ATOM 533 CB ILE A 49 11.481 -2.576 -10.217 1.00 0.00 C ATOM 534 CG1 ILE A 49 10.905 -3.046 -8.864 1.00 0.00 C ATOM 535 CG2 ILE A 49 11.683 -3.806 -11.135 1.00 0.00 C ATOM 536 CD1 ILE A 49 9.426 -3.417 -8.988 1.00 0.00 C ATOM 0 H ILE A 49 11.606 -0.280 -9.218 1.00 0.00 H new ATOM 0 HA ILE A 49 13.501 -2.428 -9.487 1.00 0.00 H new ATOM 0 HB ILE A 49 10.771 -1.886 -10.672 1.00 0.00 H new ATOM 0 HG12 ILE A 49 11.469 -3.907 -8.506 1.00 0.00 H new ATOM 0 HG13 ILE A 49 11.023 -2.256 -8.122 1.00 0.00 H new ATOM 0 HG21 ILE A 49 10.738 -4.338 -11.244 1.00 0.00 H new ATOM 0 HG22 ILE A 49 12.028 -3.476 -12.115 1.00 0.00 H new ATOM 0 HG23 ILE A 49 12.425 -4.471 -10.694 1.00 0.00 H new ATOM 0 HD11 ILE A 49 9.050 -3.744 -8.018 1.00 0.00 H new ATOM 0 HD12 ILE A 49 8.860 -2.548 -9.322 1.00 0.00 H new ATOM 0 HD13 ILE A 49 9.313 -4.224 -9.712 1.00 0.00 H new ATOM 548 N ALA A 50 12.937 -0.501 -12.124 1.00 0.00 N ATOM 549 CA ALA A 50 13.278 -0.228 -13.522 1.00 0.00 C ATOM 550 C ALA A 50 13.072 1.259 -13.874 1.00 0.00 C ATOM 551 O ALA A 50 13.930 2.087 -13.568 1.00 0.00 O ATOM 552 CB ALA A 50 12.503 -1.212 -14.425 1.00 0.00 C ATOM 0 H ALA A 50 12.267 0.163 -11.737 1.00 0.00 H new ATOM 0 HA ALA A 50 14.340 -0.400 -13.695 1.00 0.00 H new ATOM 0 HB1 ALA A 50 12.749 -1.018 -15.469 1.00 0.00 H new ATOM 0 HB2 ALA A 50 12.780 -2.235 -14.171 1.00 0.00 H new ATOM 0 HB3 ALA A 50 11.432 -1.078 -14.274 1.00 0.00 H new ATOM 558 N GLU A 51 11.949 1.611 -14.511 1.00 0.00 N ATOM 559 CA GLU A 51 11.607 2.974 -14.945 1.00 0.00 C ATOM 560 C GLU A 51 10.109 3.053 -15.295 1.00 0.00 C ATOM 561 O GLU A 51 9.717 2.805 -16.433 1.00 0.00 O ATOM 562 CB GLU A 51 12.525 3.442 -16.107 1.00 0.00 C ATOM 563 CG GLU A 51 13.411 4.634 -15.718 1.00 0.00 C ATOM 564 CD GLU A 51 14.257 5.094 -16.912 1.00 0.00 C ATOM 565 OE1 GLU A 51 13.804 5.983 -17.676 1.00 0.00 O ATOM 566 OE2 GLU A 51 15.389 4.580 -17.097 1.00 0.00 O1- ATOM 0 H GLU A 51 11.226 0.931 -14.748 1.00 0.00 H new ATOM 0 HA GLU A 51 11.787 3.667 -14.123 1.00 0.00 H new ATOM 0 HB2 GLU A 51 13.157 2.612 -16.422 1.00 0.00 H new ATOM 0 HB3 GLU A 51 11.909 3.716 -16.963 1.00 0.00 H new ATOM 0 HG2 GLU A 51 12.788 5.458 -15.369 1.00 0.00 H new ATOM 0 HG3 GLU A 51 14.063 4.354 -14.891 1.00 0.00 H new ATOM 573 N GLN A 52 9.273 3.394 -14.298 1.00 0.00 N ATOM 574 CA GLN A 52 7.803 3.562 -14.373 1.00 0.00 C ATOM 575 C GLN A 52 7.033 2.481 -15.174 1.00 0.00 C ATOM 576 O GLN A 52 6.012 2.769 -15.806 1.00 0.00 O ATOM 577 CB GLN A 52 7.427 5.026 -14.706 1.00 0.00 C ATOM 578 CG GLN A 52 7.730 5.515 -16.139 1.00 0.00 C ATOM 579 CD GLN A 52 8.751 6.657 -16.187 1.00 0.00 C ATOM 580 OE1 GLN A 52 8.470 7.760 -16.643 1.00 0.00 O ATOM 581 NE2 GLN A 52 9.962 6.454 -15.704 1.00 0.00 N ATOM 0 H GLN A 52 9.624 3.572 -13.357 1.00 0.00 H new ATOM 0 HA GLN A 52 7.430 3.363 -13.368 1.00 0.00 H new ATOM 0 HB2 GLN A 52 6.360 5.153 -14.523 1.00 0.00 H new ATOM 0 HB3 GLN A 52 7.950 5.678 -14.007 1.00 0.00 H new ATOM 0 HG2 GLN A 52 8.103 4.678 -16.730 1.00 0.00 H new ATOM 0 HG3 GLN A 52 6.803 5.846 -16.606 1.00 0.00 H new ATOM 0 HE21 GLN A 52 10.212 5.542 -15.321 1.00 0.00 H new ATOM 0 HE22 GLN A 52 10.648 7.209 -15.714 1.00 0.00 H new ATOM 590 N LEU A 53 7.536 1.235 -15.151 1.00 0.00 N ATOM 591 CA LEU A 53 7.044 0.105 -15.956 1.00 0.00 C ATOM 592 C LEU A 53 6.651 -1.119 -15.121 1.00 0.00 C ATOM 593 O LEU A 53 5.653 -1.775 -15.427 1.00 0.00 O ATOM 594 CB LEU A 53 8.139 -0.275 -16.977 1.00 0.00 C ATOM 595 CG LEU A 53 7.873 0.311 -18.377 1.00 0.00 C ATOM 596 CD1 LEU A 53 9.142 0.247 -19.227 1.00 0.00 C ATOM 597 CD2 LEU A 53 6.751 -0.464 -19.102 1.00 0.00 C ATOM 0 H LEU A 53 8.321 0.979 -14.552 1.00 0.00 H new ATOM 0 HA LEU A 53 6.130 0.427 -16.456 1.00 0.00 H new ATOM 0 HB2 LEU A 53 9.105 0.079 -16.617 1.00 0.00 H new ATOM 0 HB3 LEU A 53 8.203 -1.361 -17.048 1.00 0.00 H new ATOM 0 HG LEU A 53 7.563 1.348 -18.246 1.00 0.00 H new ATOM 0 HD11 LEU A 53 8.940 0.664 -20.214 1.00 0.00 H new ATOM 0 HD12 LEU A 53 9.932 0.822 -18.745 1.00 0.00 H new ATOM 0 HD13 LEU A 53 9.459 -0.791 -19.330 1.00 0.00 H new ATOM 0 HD21 LEU A 53 6.585 -0.028 -20.087 1.00 0.00 H new ATOM 0 HD22 LEU A 53 7.043 -1.508 -19.212 1.00 0.00 H new ATOM 0 HD23 LEU A 53 5.832 -0.403 -18.519 1.00 0.00 H new ATOM 609 N ALA A 54 7.399 -1.421 -14.055 1.00 0.00 N ATOM 610 CA ALA A 54 7.060 -2.488 -13.115 1.00 0.00 C ATOM 611 C ALA A 54 5.771 -2.144 -12.324 1.00 0.00 C ATOM 612 O ALA A 54 5.499 -0.957 -12.095 1.00 0.00 O ATOM 613 CB ALA A 54 8.267 -2.725 -12.198 1.00 0.00 C ATOM 0 H ALA A 54 8.261 -0.928 -13.821 1.00 0.00 H new ATOM 0 HA ALA A 54 6.843 -3.411 -13.653 1.00 0.00 H new ATOM 0 HB1 ALA A 54 8.034 -3.519 -11.488 1.00 0.00 H new ATOM 0 HB2 ALA A 54 9.129 -3.017 -12.799 1.00 0.00 H new ATOM 0 HB3 ALA A 54 8.497 -1.808 -11.655 1.00 0.00 H new ATOM 619 N PRO A 55 4.974 -3.146 -11.901 1.00 0.00 N ATOM 620 CA PRO A 55 3.675 -2.921 -11.267 1.00 0.00 C ATOM 621 C PRO A 55 3.804 -2.240 -9.898 1.00 0.00 C ATOM 622 O PRO A 55 4.818 -2.368 -9.213 1.00 0.00 O ATOM 623 CB PRO A 55 3.012 -4.300 -11.167 1.00 0.00 C ATOM 624 CG PRO A 55 4.188 -5.276 -11.190 1.00 0.00 C ATOM 625 CD PRO A 55 5.209 -4.571 -12.078 1.00 0.00 C ATOM 0 HA PRO A 55 3.067 -2.235 -11.857 1.00 0.00 H new ATOM 0 HB2 PRO A 55 2.430 -4.398 -10.251 1.00 0.00 H new ATOM 0 HB3 PRO A 55 2.330 -4.477 -11.999 1.00 0.00 H new ATOM 0 HG2 PRO A 55 4.581 -5.456 -10.189 1.00 0.00 H new ATOM 0 HG3 PRO A 55 3.900 -6.244 -11.599 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.226 -4.838 -11.791 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.085 -4.861 -13.121 1.00 0.00 H new ATOM 633 N LEU A 56 2.746 -1.530 -9.491 1.00 0.00 N ATOM 634 CA LEU A 56 2.674 -0.866 -8.186 1.00 0.00 C ATOM 635 C LEU A 56 2.357 -1.838 -7.039 1.00 0.00 C ATOM 636 O LEU A 56 2.912 -1.686 -5.952 1.00 0.00 O ATOM 637 CB LEU A 56 1.691 0.325 -8.237 1.00 0.00 C ATOM 638 CG LEU A 56 0.218 0.022 -8.616 1.00 0.00 C ATOM 639 CD1 LEU A 56 -0.735 0.969 -7.869 1.00 0.00 C ATOM 640 CD2 LEU A 56 -0.028 0.156 -10.131 1.00 0.00 C ATOM 0 H LEU A 56 1.911 -1.400 -10.062 1.00 0.00 H new ATOM 0 HA LEU A 56 3.666 -0.472 -7.965 1.00 0.00 H new ATOM 0 HB2 LEU A 56 1.694 0.806 -7.259 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.079 1.051 -8.951 1.00 0.00 H new ATOM 0 HG LEU A 56 0.022 -1.010 -8.325 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -1.764 0.743 -8.147 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.611 0.836 -6.794 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.506 2.001 -8.136 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -1.072 -0.065 -10.351 1.00 0.00 H new ATOM 0 HD22 LEU A 56 0.202 1.173 -10.448 1.00 0.00 H new ATOM 0 HD23 LEU A 56 0.612 -0.545 -10.667 1.00 0.00 H new ATOM 652 N ALA A 57 1.480 -2.823 -7.276 1.00 0.00 N ATOM 653 CA ALA A 57 0.975 -3.739 -6.253 1.00 0.00 C ATOM 654 C ALA A 57 1.542 -5.155 -6.368 1.00 0.00 C ATOM 655 O ALA A 57 2.026 -5.675 -5.371 1.00 0.00 O ATOM 656 CB ALA A 57 -0.559 -3.751 -6.320 1.00 0.00 C ATOM 0 H ALA A 57 1.096 -3.006 -8.203 1.00 0.00 H new ATOM 0 HA ALA A 57 1.311 -3.374 -5.282 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -0.951 -4.430 -5.563 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -0.939 -2.746 -6.138 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -0.877 -4.086 -7.307 1.00 0.00 H new ATOM 662 N ALA A 58 1.505 -5.785 -7.547 1.00 0.00 N ATOM 663 CA ALA A 58 1.786 -7.223 -7.696 1.00 0.00 C ATOM 664 C ALA A 58 3.171 -7.645 -7.159 1.00 0.00 C ATOM 665 O ALA A 58 3.255 -8.563 -6.338 1.00 0.00 O ATOM 666 CB ALA A 58 1.593 -7.602 -9.173 1.00 0.00 C ATOM 0 H ALA A 58 1.280 -5.317 -8.425 1.00 0.00 H new ATOM 0 HA ALA A 58 1.082 -7.777 -7.075 1.00 0.00 H new ATOM 0 HB1 ALA A 58 1.797 -8.665 -9.306 1.00 0.00 H new ATOM 0 HB2 ALA A 58 0.567 -7.389 -9.472 1.00 0.00 H new ATOM 0 HB3 ALA A 58 2.279 -7.022 -9.790 1.00 0.00 H new ATOM 672 N THR A 59 4.237 -6.944 -7.576 1.00 0.00 N ATOM 673 CA THR A 59 5.619 -7.128 -7.084 1.00 0.00 C ATOM 674 C THR A 59 5.735 -6.815 -5.597 1.00 0.00 C ATOM 675 O THR A 59 6.303 -7.603 -4.845 1.00 0.00 O ATOM 676 CB THR A 59 6.612 -6.306 -7.925 1.00 0.00 C ATOM 677 OG1 THR A 59 7.915 -6.483 -7.410 1.00 0.00 O ATOM 678 CG2 THR A 59 6.332 -4.803 -7.931 1.00 0.00 C ATOM 0 H THR A 59 4.164 -6.213 -8.284 1.00 0.00 H new ATOM 0 HA THR A 59 5.879 -8.180 -7.202 1.00 0.00 H new ATOM 0 HB THR A 59 6.506 -6.671 -8.947 1.00 0.00 H new ATOM 0 HG1 THR A 59 8.573 -6.244 -8.096 1.00 0.00 H new ATOM 0 HG21 THR A 59 7.076 -4.297 -8.546 1.00 0.00 H new ATOM 0 HG22 THR A 59 5.338 -4.620 -8.340 1.00 0.00 H new ATOM 0 HG23 THR A 59 6.382 -4.420 -6.912 1.00 0.00 H new ATOM 686 N ALA A 60 5.159 -5.692 -5.161 1.00 0.00 N ATOM 687 CA ALA A 60 5.240 -5.207 -3.788 1.00 0.00 C ATOM 688 C ALA A 60 4.519 -6.128 -2.793 1.00 0.00 C ATOM 689 O ALA A 60 5.004 -6.325 -1.684 1.00 0.00 O ATOM 690 CB ALA A 60 4.676 -3.786 -3.765 1.00 0.00 C ATOM 0 H ALA A 60 4.612 -5.083 -5.770 1.00 0.00 H new ATOM 0 HA ALA A 60 6.281 -5.204 -3.464 1.00 0.00 H new ATOM 0 HB1 ALA A 60 4.722 -3.393 -2.749 1.00 0.00 H new ATOM 0 HB2 ALA A 60 5.264 -3.150 -4.427 1.00 0.00 H new ATOM 0 HB3 ALA A 60 3.639 -3.800 -4.102 1.00 0.00 H new ATOM 696 N LEU A 61 3.393 -6.723 -3.187 1.00 0.00 N ATOM 697 CA LEU A 61 2.603 -7.664 -2.391 1.00 0.00 C ATOM 698 C LEU A 61 3.312 -9.021 -2.309 1.00 0.00 C ATOM 699 O LEU A 61 3.428 -9.578 -1.217 1.00 0.00 O ATOM 700 CB LEU A 61 1.194 -7.727 -3.026 1.00 0.00 C ATOM 701 CG LEU A 61 0.058 -8.421 -2.243 1.00 0.00 C ATOM 702 CD1 LEU A 61 0.182 -9.951 -2.205 1.00 0.00 C ATOM 703 CD2 LEU A 61 -0.094 -7.857 -0.824 1.00 0.00 C ATOM 0 H LEU A 61 2.989 -6.556 -4.108 1.00 0.00 H new ATOM 0 HA LEU A 61 2.498 -7.339 -1.356 1.00 0.00 H new ATOM 0 HB2 LEU A 61 0.878 -6.704 -3.230 1.00 0.00 H new ATOM 0 HB3 LEU A 61 1.287 -8.230 -3.988 1.00 0.00 H new ATOM 0 HG LEU A 61 -0.849 -8.194 -2.803 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -0.650 -10.369 -1.638 1.00 0.00 H new ATOM 0 HD12 LEU A 61 0.162 -10.343 -3.222 1.00 0.00 H new ATOM 0 HD13 LEU A 61 1.122 -10.228 -1.728 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -0.904 -8.375 -0.311 1.00 0.00 H new ATOM 0 HD22 LEU A 61 0.835 -8.002 -0.273 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -0.321 -6.792 -0.878 1.00 0.00 H new ATOM 715 N ALA A 62 3.861 -9.510 -3.429 1.00 0.00 N ATOM 716 CA ALA A 62 4.641 -10.750 -3.491 1.00 0.00 C ATOM 717 C ALA A 62 5.875 -10.739 -2.563 1.00 0.00 C ATOM 718 O ALA A 62 6.183 -11.768 -1.955 1.00 0.00 O ATOM 719 CB ALA A 62 5.035 -10.996 -4.954 1.00 0.00 C ATOM 0 H ALA A 62 3.773 -9.045 -4.333 1.00 0.00 H new ATOM 0 HA ALA A 62 4.022 -11.569 -3.125 1.00 0.00 H new ATOM 0 HB1 ALA A 62 5.617 -11.915 -5.024 1.00 0.00 H new ATOM 0 HB2 ALA A 62 4.135 -11.089 -5.562 1.00 0.00 H new ATOM 0 HB3 ALA A 62 5.633 -10.159 -5.315 1.00 0.00 H new ATOM 725 N ARG A 63 6.543 -9.583 -2.416 1.00 0.00 N ATOM 726 CA ARG A 63 7.663 -9.378 -1.475 1.00 0.00 C ATOM 727 C ARG A 63 7.257 -8.755 -0.122 1.00 0.00 C ATOM 728 O ARG A 63 8.111 -8.549 0.740 1.00 0.00 O ATOM 729 CB ARG A 63 8.764 -8.553 -2.158 1.00 0.00 C ATOM 730 CG ARG A 63 8.418 -7.062 -2.250 1.00 0.00 C ATOM 731 CD ARG A 63 9.495 -6.259 -2.977 1.00 0.00 C ATOM 732 NE ARG A 63 10.706 -6.148 -2.148 1.00 0.00 N ATOM 733 CZ ARG A 63 11.891 -6.706 -2.336 1.00 0.00 C ATOM 734 NH1 ARG A 63 12.171 -7.433 -3.396 1.00 0.00 N1+ ATOM 735 NH2 ARG A 63 12.821 -6.536 -1.425 1.00 0.00 N ATOM 0 H ARG A 63 6.318 -8.748 -2.956 1.00 0.00 H new ATOM 0 HA ARG A 63 8.039 -10.369 -1.221 1.00 0.00 H new ATOM 0 HB2 ARG A 63 9.696 -8.672 -1.606 1.00 0.00 H new ATOM 0 HB3 ARG A 63 8.936 -8.944 -3.161 1.00 0.00 H new ATOM 0 HG2 ARG A 63 7.467 -6.944 -2.770 1.00 0.00 H new ATOM 0 HG3 ARG A 63 8.284 -6.660 -1.246 1.00 0.00 H new ATOM 0 HD2 ARG A 63 9.739 -6.741 -3.924 1.00 0.00 H new ATOM 0 HD3 ARG A 63 9.117 -5.264 -3.214 1.00 0.00 H new ATOM 0 HE ARG A 63 10.620 -5.562 -1.317 1.00 0.00 H new ATOM 0 HH11 ARG A 63 11.461 -7.585 -4.113 1.00 0.00 H new ATOM 0 HH12 ARG A 63 13.098 -7.845 -3.501 1.00 0.00 H new ATOM 0 HH21 ARG A 63 12.623 -5.982 -0.592 1.00 0.00 H new ATOM 0 HH22 ARG A 63 13.741 -6.958 -1.551 1.00 0.00 H new ATOM 749 N LYS A 64 5.977 -8.408 0.058 1.00 0.00 N ATOM 750 CA LYS A 64 5.385 -7.866 1.296 1.00 0.00 C ATOM 751 C LYS A 64 5.928 -6.469 1.712 1.00 0.00 C ATOM 752 O LYS A 64 6.103 -6.183 2.897 1.00 0.00 O ATOM 753 CB LYS A 64 5.490 -8.945 2.402 1.00 0.00 C ATOM 754 CG LYS A 64 4.245 -9.057 3.294 1.00 0.00 C ATOM 755 CD LYS A 64 2.988 -9.629 2.610 1.00 0.00 C ATOM 756 CE LYS A 64 3.264 -10.978 1.927 1.00 0.00 C ATOM 757 NZ LYS A 64 2.014 -11.704 1.587 1.00 0.00 N1+ ATOM 0 H LYS A 64 5.289 -8.500 -0.689 1.00 0.00 H new ATOM 0 HA LYS A 64 4.332 -7.652 1.113 1.00 0.00 H new ATOM 0 HB2 LYS A 64 5.676 -9.912 1.934 1.00 0.00 H new ATOM 0 HB3 LYS A 64 6.353 -8.723 3.029 1.00 0.00 H new ATOM 0 HG2 LYS A 64 4.489 -9.685 4.151 1.00 0.00 H new ATOM 0 HG3 LYS A 64 4.007 -8.067 3.682 1.00 0.00 H new ATOM 0 HD2 LYS A 64 2.198 -9.753 3.350 1.00 0.00 H new ATOM 0 HD3 LYS A 64 2.623 -8.917 1.870 1.00 0.00 H new ATOM 0 HE2 LYS A 64 3.843 -10.811 1.019 1.00 0.00 H new ATOM 0 HE3 LYS A 64 3.874 -11.598 2.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 2.225 -12.457 0.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 1.611 -12.123 2.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 1.329 -11.041 1.171 1.00 0.00 H new ATOM 771 N ASP A 65 6.226 -5.591 0.746 1.00 0.00 N ATOM 772 CA ASP A 65 6.862 -4.276 0.951 1.00 0.00 C ATOM 773 C ASP A 65 5.868 -3.185 1.404 1.00 0.00 C ATOM 774 O ASP A 65 5.490 -2.285 0.646 1.00 0.00 O ATOM 775 CB ASP A 65 7.705 -3.871 -0.285 1.00 0.00 C ATOM 776 CG ASP A 65 9.188 -3.667 0.106 1.00 0.00 C ATOM 777 OD1 ASP A 65 9.933 -4.679 0.103 1.00 0.00 O ATOM 778 OD2 ASP A 65 9.569 -2.511 0.409 1.00 0.00 O1- ATOM 0 H ASP A 65 6.025 -5.780 -0.236 1.00 0.00 H new ATOM 0 HA ASP A 65 7.553 -4.376 1.788 1.00 0.00 H new ATOM 0 HB2 ASP A 65 7.629 -4.642 -1.052 1.00 0.00 H new ATOM 0 HB3 ASP A 65 7.308 -2.952 -0.717 1.00 0.00 H new ATOM 783 N THR A 66 5.475 -3.245 2.683 1.00 0.00 N ATOM 784 CA THR A 66 4.571 -2.292 3.361 1.00 0.00 C ATOM 785 C THR A 66 4.935 -0.823 3.156 1.00 0.00 C ATOM 786 O THR A 66 4.039 0.011 3.154 1.00 0.00 O ATOM 787 CB THR A 66 4.470 -2.638 4.848 1.00 0.00 C ATOM 788 OG1 THR A 66 4.138 -4.002 4.933 1.00 0.00 O ATOM 789 CG2 THR A 66 3.360 -1.855 5.546 1.00 0.00 C ATOM 0 H THR A 66 5.789 -3.990 3.305 1.00 0.00 H new ATOM 0 HA THR A 66 3.595 -2.405 2.889 1.00 0.00 H new ATOM 0 HB THR A 66 5.418 -2.394 5.328 1.00 0.00 H new ATOM 0 HG1 THR A 66 3.758 -4.192 5.816 1.00 0.00 H new ATOM 0 HG21 THR A 66 3.326 -2.133 6.599 1.00 0.00 H new ATOM 0 HG22 THR A 66 3.558 -0.787 5.459 1.00 0.00 H new ATOM 0 HG23 THR A 66 2.403 -2.086 5.078 1.00 0.00 H new ATOM 797 N ALA A 67 6.204 -0.490 2.899 1.00 0.00 N ATOM 798 CA ALA A 67 6.643 0.872 2.575 1.00 0.00 C ATOM 799 C ALA A 67 5.854 1.499 1.407 1.00 0.00 C ATOM 800 O ALA A 67 5.415 2.644 1.518 1.00 0.00 O ATOM 801 CB ALA A 67 8.147 0.831 2.274 1.00 0.00 C ATOM 0 H ALA A 67 6.966 -1.168 2.910 1.00 0.00 H new ATOM 0 HA ALA A 67 6.444 1.514 3.433 1.00 0.00 H new ATOM 0 HB1 ALA A 67 8.497 1.834 2.030 1.00 0.00 H new ATOM 0 HB2 ALA A 67 8.683 0.463 3.149 1.00 0.00 H new ATOM 0 HB3 ALA A 67 8.331 0.167 1.429 1.00 0.00 H new ATOM 807 N VAL A 68 5.641 0.747 0.321 1.00 0.00 N ATOM 808 CA VAL A 68 4.794 1.166 -0.818 1.00 0.00 C ATOM 809 C VAL A 68 3.363 0.620 -0.700 1.00 0.00 C ATOM 810 O VAL A 68 2.425 1.304 -1.116 1.00 0.00 O ATOM 811 CB VAL A 68 5.439 0.816 -2.183 1.00 0.00 C ATOM 812 CG1 VAL A 68 5.763 -0.678 -2.315 1.00 0.00 C ATOM 813 CG2 VAL A 68 4.568 1.272 -3.367 1.00 0.00 C ATOM 0 H VAL A 68 6.052 -0.179 0.200 1.00 0.00 H new ATOM 0 HA VAL A 68 4.722 2.253 -0.775 1.00 0.00 H new ATOM 0 HB VAL A 68 6.379 1.367 -2.214 1.00 0.00 H new ATOM 0 HG11 VAL A 68 6.213 -0.868 -3.290 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.461 -0.970 -1.530 1.00 0.00 H new ATOM 0 HG13 VAL A 68 4.846 -1.259 -2.219 1.00 0.00 H new ATOM 0 HG21 VAL A 68 5.059 1.006 -4.303 1.00 0.00 H new ATOM 0 HG22 VAL A 68 3.596 0.781 -3.314 1.00 0.00 H new ATOM 0 HG23 VAL A 68 4.431 2.352 -3.323 1.00 0.00 H new ATOM 823 N LEU A 69 3.165 -0.555 -0.074 1.00 0.00 N ATOM 824 CA LEU A 69 1.830 -1.121 0.152 1.00 0.00 C ATOM 825 C LEU A 69 0.942 -0.170 0.976 1.00 0.00 C ATOM 826 O LEU A 69 -0.235 -0.017 0.667 1.00 0.00 O ATOM 827 CB LEU A 69 1.922 -2.543 0.754 1.00 0.00 C ATOM 828 CG LEU A 69 1.417 -3.695 -0.146 1.00 0.00 C ATOM 829 CD1 LEU A 69 -0.056 -3.577 -0.587 1.00 0.00 C ATOM 830 CD2 LEU A 69 2.332 -3.838 -1.365 1.00 0.00 C ATOM 0 H LEU A 69 3.924 -1.133 0.286 1.00 0.00 H new ATOM 0 HA LEU A 69 1.337 -1.226 -0.815 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.962 -2.740 1.012 1.00 0.00 H new ATOM 0 HB3 LEU A 69 1.354 -2.560 1.684 1.00 0.00 H new ATOM 0 HG LEU A 69 1.455 -4.593 0.471 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.318 -4.430 -1.214 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -0.699 -3.563 0.293 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.194 -2.655 -1.152 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.973 -4.651 -1.996 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.329 -2.908 -1.934 1.00 0.00 H new ATOM 0 HD23 LEU A 69 3.347 -4.057 -1.034 1.00 0.00 H new ATOM 842 N ASN A 70 1.528 0.568 1.925 1.00 0.00 N ATOM 843 CA ASN A 70 0.913 1.690 2.644 1.00 0.00 C ATOM 844 C ASN A 70 0.242 2.704 1.700 1.00 0.00 C ATOM 845 O ASN A 70 -0.957 2.961 1.817 1.00 0.00 O ATOM 846 CB ASN A 70 2.008 2.354 3.507 1.00 0.00 C ATOM 847 CG ASN A 70 1.588 3.684 4.130 1.00 0.00 C ATOM 848 OD1 ASN A 70 1.057 3.732 5.224 1.00 0.00 O ATOM 849 ND2 ASN A 70 1.806 4.802 3.459 1.00 0.00 N ATOM 0 H ASN A 70 2.486 0.392 2.227 1.00 0.00 H new ATOM 0 HA ASN A 70 0.109 1.313 3.276 1.00 0.00 H new ATOM 0 HB2 ASN A 70 2.295 1.667 4.303 1.00 0.00 H new ATOM 0 HB3 ASN A 70 2.893 2.516 2.891 1.00 0.00 H new ATOM 0 HD21 ASN A 70 1.530 5.699 3.859 1.00 0.00 H new ATOM 0 HD22 ASN A 70 2.251 4.768 2.542 1.00 0.00 H new ATOM 856 N ARG A 71 1.008 3.279 0.762 1.00 0.00 N ATOM 857 CA ARG A 71 0.527 4.331 -0.145 1.00 0.00 C ATOM 858 C ARG A 71 -0.513 3.791 -1.132 1.00 0.00 C ATOM 859 O ARG A 71 -1.612 4.343 -1.219 1.00 0.00 O ATOM 860 CB ARG A 71 1.714 4.979 -0.878 1.00 0.00 C ATOM 861 CG ARG A 71 2.385 6.106 -0.066 1.00 0.00 C ATOM 862 CD ARG A 71 3.921 6.066 -0.090 1.00 0.00 C ATOM 863 NE ARG A 71 4.464 5.307 1.055 1.00 0.00 N ATOM 864 CZ ARG A 71 4.745 5.784 2.263 1.00 0.00 C ATOM 865 NH1 ARG A 71 4.518 7.034 2.604 1.00 0.00 N1+ ATOM 866 NH2 ARG A 71 5.253 4.973 3.159 1.00 0.00 N ATOM 0 H ARG A 71 1.984 3.026 0.610 1.00 0.00 H new ATOM 0 HA ARG A 71 0.030 5.096 0.451 1.00 0.00 H new ATOM 0 HB2 ARG A 71 2.455 4.213 -1.105 1.00 0.00 H new ATOM 0 HB3 ARG A 71 1.369 5.381 -1.830 1.00 0.00 H new ATOM 0 HG2 ARG A 71 2.051 7.068 -0.455 1.00 0.00 H new ATOM 0 HG3 ARG A 71 2.047 6.045 0.968 1.00 0.00 H new ATOM 0 HD2 ARG A 71 4.259 5.612 -1.021 1.00 0.00 H new ATOM 0 HD3 ARG A 71 4.312 7.083 -0.071 1.00 0.00 H new ATOM 0 HE ARG A 71 4.642 4.314 0.903 1.00 0.00 H new ATOM 0 HH11 ARG A 71 4.110 7.681 1.929 1.00 0.00 H new ATOM 0 HH12 ARG A 71 4.750 7.356 3.543 1.00 0.00 H new ATOM 0 HH21 ARG A 71 5.425 3.996 2.923 1.00 0.00 H new ATOM 0 HH22 ARG A 71 5.476 5.319 4.092 1.00 0.00 H new ATOM 880 N ILE A 72 -0.229 2.667 -1.802 1.00 0.00 N ATOM 881 CA ILE A 72 -1.195 2.072 -2.749 1.00 0.00 C ATOM 882 C ILE A 72 -2.472 1.618 -2.041 1.00 0.00 C ATOM 883 O ILE A 72 -3.535 1.710 -2.640 1.00 0.00 O ATOM 884 CB ILE A 72 -0.587 0.960 -3.637 1.00 0.00 C ATOM 885 CG1 ILE A 72 -0.390 -0.349 -2.855 1.00 0.00 C ATOM 886 CG2 ILE A 72 0.699 1.451 -4.324 1.00 0.00 C ATOM 887 CD1 ILE A 72 0.416 -1.411 -3.605 1.00 0.00 C ATOM 0 H ILE A 72 0.648 2.153 -1.712 1.00 0.00 H new ATOM 0 HA ILE A 72 -1.470 2.870 -3.439 1.00 0.00 H new ATOM 0 HB ILE A 72 -1.299 0.728 -4.429 1.00 0.00 H new ATOM 0 HG12 ILE A 72 0.112 -0.125 -1.914 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -1.368 -0.760 -2.605 1.00 0.00 H new ATOM 0 HG21 ILE A 72 1.109 0.653 -4.943 1.00 0.00 H new ATOM 0 HG22 ILE A 72 0.471 2.314 -4.949 1.00 0.00 H new ATOM 0 HG23 ILE A 72 1.430 1.735 -3.567 1.00 0.00 H new ATOM 0 HD11 ILE A 72 0.509 -2.302 -2.985 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -0.094 -1.667 -4.533 1.00 0.00 H new ATOM 0 HD13 ILE A 72 1.408 -1.022 -3.832 1.00 0.00 H new ATOM 899 N ALA A 73 -2.423 1.218 -0.767 1.00 0.00 N ATOM 900 CA ALA A 73 -3.631 0.943 0.003 1.00 0.00 C ATOM 901 C ALA A 73 -4.439 2.213 0.318 1.00 0.00 C ATOM 902 O ALA A 73 -5.653 2.239 0.122 1.00 0.00 O ATOM 903 CB ALA A 73 -3.269 0.170 1.270 1.00 0.00 C ATOM 0 H ALA A 73 -1.555 1.078 -0.249 1.00 0.00 H new ATOM 0 HA ALA A 73 -4.286 0.326 -0.612 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -4.174 -0.034 1.843 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -2.792 -0.772 0.998 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -2.583 0.763 1.874 1.00 0.00 H new ATOM 909 N ASN A 74 -3.765 3.285 0.740 1.00 0.00 N ATOM 910 CA ASN A 74 -4.395 4.587 0.988 1.00 0.00 C ATOM 911 C ASN A 74 -5.100 5.154 -0.271 1.00 0.00 C ATOM 912 O ASN A 74 -6.145 5.794 -0.143 1.00 0.00 O ATOM 913 CB ASN A 74 -3.337 5.562 1.543 1.00 0.00 C ATOM 914 CG ASN A 74 -3.210 5.499 3.066 1.00 0.00 C ATOM 915 OD1 ASN A 74 -3.669 6.384 3.780 1.00 0.00 O ATOM 916 ND2 ASN A 74 -2.594 4.470 3.614 1.00 0.00 N ATOM 0 H ASN A 74 -2.761 3.276 0.921 1.00 0.00 H new ATOM 0 HA ASN A 74 -5.183 4.455 1.729 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -2.370 5.336 1.093 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -3.596 6.578 1.247 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -2.501 4.412 4.628 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -2.211 3.732 3.024 1.00 0.00 H new ATOM 923 N GLU A 75 -4.580 4.881 -1.476 1.00 0.00 N ATOM 924 CA GLU A 75 -5.176 5.325 -2.747 1.00 0.00 C ATOM 925 C GLU A 75 -6.118 4.283 -3.385 1.00 0.00 C ATOM 926 O GLU A 75 -7.303 4.555 -3.577 1.00 0.00 O ATOM 927 CB GLU A 75 -4.066 5.708 -3.742 1.00 0.00 C ATOM 928 CG GLU A 75 -3.216 6.905 -3.292 1.00 0.00 C ATOM 929 CD GLU A 75 -4.067 8.152 -3.016 1.00 0.00 C ATOM 930 OE1 GLU A 75 -4.713 8.657 -3.963 1.00 0.00 O ATOM 931 OE2 GLU A 75 -4.077 8.628 -1.858 1.00 0.00 O1- ATOM 0 H GLU A 75 -3.724 4.340 -1.598 1.00 0.00 H new ATOM 0 HA GLU A 75 -5.791 6.194 -2.512 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -3.414 4.848 -3.893 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -4.519 5.938 -4.706 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -2.664 6.638 -2.391 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -2.479 7.134 -4.061 1.00 0.00 H new ATOM 938 N ALA A 76 -5.605 3.102 -3.745 1.00 0.00 N ATOM 939 CA ALA A 76 -6.310 2.097 -4.545 1.00 0.00 C ATOM 940 C ALA A 76 -7.172 1.137 -3.710 1.00 0.00 C ATOM 941 O ALA A 76 -8.225 0.727 -4.192 1.00 0.00 O ATOM 942 CB ALA A 76 -5.285 1.328 -5.392 1.00 0.00 C ATOM 0 H ALA A 76 -4.664 2.812 -3.481 1.00 0.00 H new ATOM 0 HA ALA A 76 -7.014 2.623 -5.189 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -5.799 0.577 -5.992 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -4.762 2.022 -6.050 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -4.565 0.838 -4.736 1.00 0.00 H new ATOM 948 N LEU A 77 -6.777 0.790 -2.475 1.00 0.00 N ATOM 949 CA LEU A 77 -7.572 -0.108 -1.614 1.00 0.00 C ATOM 950 C LEU A 77 -8.700 0.639 -0.861 1.00 0.00 C ATOM 951 O LEU A 77 -9.610 0.010 -0.326 1.00 0.00 O ATOM 952 CB LEU A 77 -6.693 -0.918 -0.647 1.00 0.00 C ATOM 953 CG LEU A 77 -5.792 -2.041 -1.217 1.00 0.00 C ATOM 954 CD1 LEU A 77 -6.598 -3.331 -1.408 1.00 0.00 C ATOM 955 CD2 LEU A 77 -5.056 -1.742 -2.534 1.00 0.00 C ATOM 0 H LEU A 77 -5.911 1.117 -2.047 1.00 0.00 H new ATOM 0 HA LEU A 77 -8.053 -0.819 -2.285 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -6.049 -0.215 -0.119 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -7.350 -1.368 0.097 1.00 0.00 H new ATOM 0 HG LEU A 77 -5.014 -2.138 -0.459 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -5.949 -4.109 -1.809 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -7.001 -3.654 -0.448 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -7.418 -3.148 -2.103 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -4.461 -2.608 -2.823 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -5.783 -1.524 -3.316 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -4.401 -0.881 -2.398 1.00 0.00 H new ATOM 967 N ASP A 78 -8.689 1.974 -0.846 1.00 0.00 N ATOM 968 CA ASP A 78 -9.819 2.794 -0.369 1.00 0.00 C ATOM 969 C ASP A 78 -11.037 2.761 -1.325 1.00 0.00 C ATOM 970 O ASP A 78 -12.161 3.078 -0.928 1.00 0.00 O ATOM 971 CB ASP A 78 -9.328 4.234 -0.162 1.00 0.00 C ATOM 972 CG ASP A 78 -10.435 5.137 0.355 1.00 0.00 C ATOM 973 OD1 ASP A 78 -10.737 5.061 1.570 1.00 0.00 O ATOM 974 OD2 ASP A 78 -10.978 5.923 -0.457 1.00 0.00 O1- ATOM 0 H ASP A 78 -7.893 2.526 -1.166 1.00 0.00 H new ATOM 0 HA ASP A 78 -10.169 2.372 0.573 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -8.497 4.237 0.543 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -8.948 4.628 -1.105 1.00 0.00 H new ATOM 979 N GLN A 79 -10.818 2.368 -2.585 1.00 0.00 N ATOM 980 CA GLN A 79 -11.817 2.403 -3.651 1.00 0.00 C ATOM 981 C GLN A 79 -13.022 1.469 -3.389 1.00 0.00 C ATOM 982 O GLN A 79 -12.867 0.421 -2.749 1.00 0.00 O ATOM 983 CB GLN A 79 -11.152 2.006 -4.977 1.00 0.00 C ATOM 984 CG GLN A 79 -10.090 2.975 -5.496 1.00 0.00 C ATOM 985 CD GLN A 79 -9.426 2.536 -6.786 1.00 0.00 C ATOM 986 OE1 GLN A 79 -8.604 3.258 -7.327 1.00 0.00 O ATOM 987 NE2 GLN A 79 -9.734 1.396 -7.363 1.00 0.00 N ATOM 0 H GLN A 79 -9.916 2.008 -2.896 1.00 0.00 H new ATOM 0 HA GLN A 79 -12.205 3.421 -3.692 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -10.694 1.024 -4.854 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -11.928 1.904 -5.736 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -10.550 3.951 -5.651 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -9.324 3.101 -4.731 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -10.418 0.774 -6.931 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -9.289 1.133 -8.242 1.00 0.00 H new ATOM 996 N PRO A 80 -14.217 1.791 -3.932 1.00 0.00 N ATOM 997 CA PRO A 80 -15.447 1.025 -3.709 1.00 0.00 C ATOM 998 C PRO A 80 -15.426 -0.415 -4.260 1.00 0.00 C ATOM 999 O PRO A 80 -16.298 -1.203 -3.901 1.00 0.00 O ATOM 1000 CB PRO A 80 -16.567 1.855 -4.352 1.00 0.00 C ATOM 1001 CG PRO A 80 -15.847 2.688 -5.409 1.00 0.00 C ATOM 1002 CD PRO A 80 -14.509 2.971 -4.738 1.00 0.00 C ATOM 0 HA PRO A 80 -15.589 0.876 -2.639 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -17.331 1.218 -4.798 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -17.067 2.487 -3.618 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -15.726 2.142 -6.345 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -16.388 3.605 -5.643 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -13.728 3.143 -5.478 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -14.563 3.866 -4.118 1.00 0.00 H new ATOM 1010 N ASP A 81 -14.449 -0.793 -5.094 1.00 0.00 N ATOM 1011 CA ASP A 81 -14.304 -2.152 -5.645 1.00 0.00 C ATOM 1012 C ASP A 81 -13.632 -3.160 -4.682 1.00 0.00 C ATOM 1013 O ASP A 81 -13.546 -4.350 -4.988 1.00 0.00 O ATOM 1014 CB ASP A 81 -13.543 -2.062 -6.979 1.00 0.00 C ATOM 1015 CG ASP A 81 -12.068 -1.670 -6.841 1.00 0.00 C ATOM 1016 OD1 ASP A 81 -11.808 -0.453 -6.694 1.00 0.00 O ATOM 1017 OD2 ASP A 81 -11.196 -2.565 -6.923 1.00 0.00 O1- ATOM 0 H ASP A 81 -13.722 -0.153 -5.413 1.00 0.00 H new ATOM 0 HA ASP A 81 -15.307 -2.550 -5.801 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -13.604 -3.026 -7.484 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -14.041 -1.334 -7.619 1.00 0.00 H new ATOM 1022 N VAL A 82 -13.145 -2.686 -3.533 1.00 0.00 N ATOM 1023 CA VAL A 82 -12.202 -3.401 -2.646 1.00 0.00 C ATOM 1024 C VAL A 82 -12.916 -4.094 -1.475 1.00 0.00 C ATOM 1025 O VAL A 82 -13.917 -3.581 -0.972 1.00 0.00 O ATOM 1026 CB VAL A 82 -11.143 -2.412 -2.112 1.00 0.00 C ATOM 1027 CG1 VAL A 82 -10.123 -3.101 -1.188 1.00 0.00 C ATOM 1028 CG2 VAL A 82 -10.395 -1.730 -3.275 1.00 0.00 C ATOM 0 H VAL A 82 -13.399 -1.765 -3.176 1.00 0.00 H new ATOM 0 HA VAL A 82 -11.719 -4.181 -3.235 1.00 0.00 H new ATOM 0 HB VAL A 82 -11.680 -1.662 -1.531 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -9.397 -2.368 -0.836 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -10.642 -3.537 -0.334 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -9.606 -3.887 -1.739 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -9.654 -1.038 -2.875 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -9.895 -2.487 -3.880 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -11.106 -1.183 -3.894 1.00 0.00 H new ATOM 1038 N ARG A 83 -12.380 -5.241 -1.022 1.00 0.00 N ATOM 1039 CA ARG A 83 -12.946 -6.026 0.085 1.00 0.00 C ATOM 1040 C ARG A 83 -12.391 -5.612 1.466 1.00 0.00 C ATOM 1041 O ARG A 83 -13.193 -5.268 2.337 1.00 0.00 O ATOM 1042 CB ARG A 83 -12.763 -7.536 -0.162 1.00 0.00 C ATOM 1043 CG ARG A 83 -13.135 -8.054 -1.563 1.00 0.00 C ATOM 1044 CD ARG A 83 -14.581 -7.756 -1.978 1.00 0.00 C ATOM 1045 NE ARG A 83 -14.919 -8.452 -3.234 1.00 0.00 N ATOM 1046 CZ ARG A 83 -16.093 -8.444 -3.853 1.00 0.00 C ATOM 1047 NH1 ARG A 83 -17.113 -7.737 -3.412 1.00 0.00 N1+ ATOM 1048 NH2 ARG A 83 -16.261 -9.164 -4.941 1.00 0.00 N ATOM 0 H ARG A 83 -11.535 -5.651 -1.419 1.00 0.00 H new ATOM 0 HA ARG A 83 -14.013 -5.806 0.109 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -11.720 -7.789 0.029 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -13.362 -8.076 0.571 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -12.460 -7.609 -2.294 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -12.974 -9.132 -1.595 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -15.263 -8.070 -1.188 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -14.714 -6.682 -2.105 1.00 0.00 H new ATOM 0 HE ARG A 83 -14.174 -8.995 -3.671 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -17.015 -7.172 -2.569 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -18.001 -7.755 -3.914 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -15.491 -9.725 -5.305 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -17.161 -9.161 -5.420 1.00 0.00 H new ATOM 1062 N ALA A 84 -11.062 -5.613 1.677 1.00 0.00 N ATOM 1063 CA ALA A 84 -10.416 -5.410 2.996 1.00 0.00 C ATOM 1064 C ALA A 84 -8.869 -5.385 2.929 1.00 0.00 C ATOM 1065 O ALA A 84 -8.266 -6.185 2.214 1.00 0.00 O ATOM 1066 CB ALA A 84 -10.877 -6.525 3.961 1.00 0.00 C ATOM 0 H ALA A 84 -10.390 -5.757 0.923 1.00 0.00 H new ATOM 0 HA ALA A 84 -10.725 -4.428 3.355 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -10.406 -6.382 4.933 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -11.960 -6.484 4.073 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.590 -7.496 3.558 1.00 0.00 H new ATOM 1072 N VAL A 85 -8.205 -4.534 3.726 1.00 0.00 N ATOM 1073 CA VAL A 85 -6.727 -4.468 3.797 1.00 0.00 C ATOM 1074 C VAL A 85 -6.226 -3.830 5.109 1.00 0.00 C ATOM 1075 O VAL A 85 -6.890 -2.948 5.662 1.00 0.00 O ATOM 1076 CB VAL A 85 -6.154 -3.745 2.545 1.00 0.00 C ATOM 1077 CG1 VAL A 85 -6.088 -2.225 2.707 1.00 0.00 C ATOM 1078 CG2 VAL A 85 -4.778 -4.260 2.127 1.00 0.00 C ATOM 0 H VAL A 85 -8.673 -3.869 4.342 1.00 0.00 H new ATOM 0 HA VAL A 85 -6.353 -5.492 3.800 1.00 0.00 H new ATOM 0 HB VAL A 85 -6.867 -3.982 1.755 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -5.680 -1.780 1.800 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -7.090 -1.834 2.884 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -5.447 -1.977 3.553 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -4.437 -3.713 1.248 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -4.071 -4.112 2.943 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -4.843 -5.322 1.891 1.00 0.00 H new ATOM 1088 N THR A 86 -5.033 -4.237 5.572 1.00 0.00 N ATOM 1089 CA THR A 86 -4.402 -3.781 6.832 1.00 0.00 C ATOM 1090 C THR A 86 -2.907 -4.076 6.836 1.00 0.00 C ATOM 1091 O THR A 86 -2.489 -5.008 6.159 1.00 0.00 O ATOM 1092 CB THR A 86 -5.009 -4.437 8.091 1.00 0.00 C ATOM 1093 OG1 THR A 86 -6.168 -5.189 7.832 1.00 0.00 O ATOM 1094 CG2 THR A 86 -5.377 -3.352 9.100 1.00 0.00 C ATOM 0 H THR A 86 -4.459 -4.913 5.068 1.00 0.00 H new ATOM 0 HA THR A 86 -4.590 -2.708 6.870 1.00 0.00 H new ATOM 0 HB THR A 86 -4.248 -5.117 8.474 1.00 0.00 H new ATOM 0 HG1 THR A 86 -6.500 -5.577 8.668 1.00 0.00 H new ATOM 0 HG21 THR A 86 -5.806 -3.813 9.990 1.00 0.00 H new ATOM 0 HG22 THR A 86 -4.483 -2.793 9.376 1.00 0.00 H new ATOM 0 HG23 THR A 86 -6.106 -2.674 8.656 1.00 0.00 H new ATOM 1102 N PHE A 87 -2.121 -3.328 7.623 1.00 0.00 N ATOM 1103 CA PHE A 87 -0.663 -3.491 7.747 1.00 0.00 C ATOM 1104 C PHE A 87 -0.172 -3.041 9.135 1.00 0.00 C ATOM 1105 O PHE A 87 -0.510 -1.932 9.550 1.00 0.00 O ATOM 1106 CB PHE A 87 0.060 -2.652 6.672 1.00 0.00 C ATOM 1107 CG PHE A 87 -0.494 -2.728 5.261 1.00 0.00 C ATOM 1108 CD1 PHE A 87 0.084 -3.575 4.301 1.00 0.00 C ATOM 1109 CD2 PHE A 87 -1.625 -1.967 4.917 1.00 0.00 C ATOM 1110 CE1 PHE A 87 -0.513 -3.713 3.039 1.00 0.00 C ATOM 1111 CE2 PHE A 87 -2.203 -2.077 3.646 1.00 0.00 C ATOM 1112 CZ PHE A 87 -1.649 -2.956 2.705 1.00 0.00 C ATOM 0 H PHE A 87 -2.488 -2.575 8.205 1.00 0.00 H new ATOM 0 HA PHE A 87 -0.436 -4.549 7.612 1.00 0.00 H new ATOM 0 HB2 PHE A 87 0.045 -1.609 6.988 1.00 0.00 H new ATOM 0 HB3 PHE A 87 1.105 -2.962 6.644 1.00 0.00 H new ATOM 0 HD1 PHE A 87 0.987 -4.119 4.534 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -2.053 -1.290 5.641 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -0.098 -4.404 2.321 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -3.071 -1.487 3.392 1.00 0.00 H new ATOM 0 HZ PHE A 87 -2.094 -3.051 1.726 1.00 0.00 H new ATOM 1122 N LEU A 88 0.661 -3.839 9.819 1.00 0.00 N ATOM 1123 CA LEU A 88 1.187 -3.549 11.168 1.00 0.00 C ATOM 1124 C LEU A 88 2.552 -4.214 11.428 1.00 0.00 C ATOM 1125 O LEU A 88 2.834 -5.303 10.928 1.00 0.00 O ATOM 1126 CB LEU A 88 0.111 -3.921 12.212 1.00 0.00 C ATOM 1127 CG LEU A 88 0.517 -3.893 13.708 1.00 0.00 C ATOM 1128 CD1 LEU A 88 -0.605 -3.321 14.588 1.00 0.00 C ATOM 1129 CD2 LEU A 88 0.854 -5.309 14.199 1.00 0.00 C ATOM 0 H LEU A 88 0.998 -4.726 9.444 1.00 0.00 H new ATOM 0 HA LEU A 88 1.392 -2.482 11.253 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -0.732 -3.243 12.081 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.248 -4.924 11.981 1.00 0.00 H new ATOM 0 HG LEU A 88 1.393 -3.250 13.790 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -0.284 -3.317 15.630 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -0.830 -2.302 14.274 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -1.498 -3.938 14.486 1.00 0.00 H new ATOM 0 HD21 LEU A 88 1.137 -5.272 15.251 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -0.018 -5.952 14.080 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.682 -5.709 13.614 1.00 0.00 H new ATOM 1141 N ASP A 89 3.400 -3.541 12.213 1.00 0.00 N ATOM 1142 CA ASP A 89 4.768 -3.950 12.566 1.00 0.00 C ATOM 1143 C ASP A 89 4.918 -4.616 13.956 1.00 0.00 C ATOM 1144 O ASP A 89 3.967 -4.756 14.728 1.00 0.00 O ATOM 1145 CB ASP A 89 5.710 -2.733 12.427 1.00 0.00 C ATOM 1146 CG ASP A 89 5.559 -1.632 13.497 1.00 0.00 C ATOM 1147 OD1 ASP A 89 4.750 -1.784 14.446 1.00 0.00 O ATOM 1148 OD2 ASP A 89 6.302 -0.629 13.401 1.00 0.00 O1- ATOM 0 H ASP A 89 3.140 -2.653 12.642 1.00 0.00 H new ATOM 0 HA ASP A 89 5.045 -4.736 11.864 1.00 0.00 H new ATOM 0 HB2 ASP A 89 6.739 -3.092 12.447 1.00 0.00 H new ATOM 0 HB3 ASP A 89 5.548 -2.284 11.447 1.00 0.00 H new ATOM 1153 N ALA A 90 6.159 -4.982 14.306 1.00 0.00 N ATOM 1154 CA ALA A 90 6.539 -5.561 15.599 1.00 0.00 C ATOM 1155 C ALA A 90 6.229 -4.662 16.817 1.00 0.00 C ATOM 1156 O ALA A 90 6.023 -5.169 17.923 1.00 0.00 O ATOM 1157 CB ALA A 90 8.046 -5.866 15.536 1.00 0.00 C ATOM 0 H ALA A 90 6.952 -4.879 13.673 1.00 0.00 H new ATOM 0 HA ALA A 90 5.940 -6.458 15.754 1.00 0.00 H new ATOM 0 HB1 ALA A 90 8.369 -6.300 16.482 1.00 0.00 H new ATOM 0 HB2 ALA A 90 8.241 -6.571 14.728 1.00 0.00 H new ATOM 0 HB3 ALA A 90 8.597 -4.943 15.353 1.00 0.00 H new ATOM 1163 N ARG A 91 6.193 -3.337 16.618 1.00 0.00 N ATOM 1164 CA ARG A 91 5.900 -2.331 17.652 1.00 0.00 C ATOM 1165 C ARG A 91 4.390 -2.149 17.913 1.00 0.00 C ATOM 1166 O ARG A 91 4.012 -1.369 18.790 1.00 0.00 O ATOM 1167 CB ARG A 91 6.542 -0.981 17.269 1.00 0.00 C ATOM 1168 CG ARG A 91 8.062 -1.068 17.059 1.00 0.00 C ATOM 1169 CD ARG A 91 8.657 0.314 16.793 1.00 0.00 C ATOM 1170 NE ARG A 91 10.126 0.248 16.674 1.00 0.00 N ATOM 1171 CZ ARG A 91 10.966 1.276 16.717 1.00 0.00 C ATOM 1172 NH1 ARG A 91 10.549 2.520 16.840 1.00 0.00 N1+ ATOM 1173 NH2 ARG A 91 12.262 1.059 16.638 1.00 0.00 N ATOM 0 H ARG A 91 6.373 -2.921 15.704 1.00 0.00 H new ATOM 0 HA ARG A 91 6.333 -2.699 18.582 1.00 0.00 H new ATOM 0 HB2 ARG A 91 6.077 -0.612 16.355 1.00 0.00 H new ATOM 0 HB3 ARG A 91 6.332 -0.252 18.051 1.00 0.00 H new ATOM 0 HG2 ARG A 91 8.530 -1.506 17.940 1.00 0.00 H new ATOM 0 HG3 ARG A 91 8.280 -1.729 16.220 1.00 0.00 H new ATOM 0 HD2 ARG A 91 8.233 0.725 15.877 1.00 0.00 H new ATOM 0 HD3 ARG A 91 8.385 0.992 17.602 1.00 0.00 H new ATOM 0 HE ARG A 91 10.536 -0.677 16.546 1.00 0.00 H new ATOM 0 HH11 ARG A 91 9.551 2.719 16.906 1.00 0.00 H new ATOM 0 HH12 ARG A 91 11.224 3.284 16.869 1.00 0.00 H new ATOM 0 HH21 ARG A 91 12.615 0.107 16.544 1.00 0.00 H new ATOM 0 HH22 ARG A 91 12.913 1.843 16.670 1.00 0.00 H new ATOM 1187 N GLN A 92 3.536 -2.828 17.138 1.00 0.00 N ATOM 1188 CA GLN A 92 2.071 -2.714 17.130 1.00 0.00 C ATOM 1189 C GLN A 92 1.581 -1.369 16.558 1.00 0.00 C ATOM 1190 O GLN A 92 0.483 -0.920 16.885 1.00 0.00 O ATOM 1191 CB GLN A 92 1.421 -3.057 18.491 1.00 0.00 C ATOM 1192 CG GLN A 92 1.679 -4.500 18.949 1.00 0.00 C ATOM 1193 CD GLN A 92 0.863 -4.848 20.196 1.00 0.00 C ATOM 1194 OE1 GLN A 92 1.369 -4.914 21.310 1.00 0.00 O ATOM 1195 NE2 GLN A 92 -0.431 -5.069 20.068 1.00 0.00 N ATOM 0 H GLN A 92 3.868 -3.513 16.459 1.00 0.00 H new ATOM 0 HA GLN A 92 1.724 -3.483 16.440 1.00 0.00 H new ATOM 0 HB2 GLN A 92 1.800 -2.371 19.248 1.00 0.00 H new ATOM 0 HB3 GLN A 92 0.346 -2.893 18.422 1.00 0.00 H new ATOM 0 HG2 GLN A 92 1.426 -5.189 18.143 1.00 0.00 H new ATOM 0 HG3 GLN A 92 2.740 -4.632 19.159 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -0.869 -5.018 19.148 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -0.994 -5.291 20.889 1.00 0.00 H new ATOM 1204 N GLU A 93 2.369 -0.727 15.687 1.00 0.00 N ATOM 1205 CA GLU A 93 1.921 0.407 14.880 1.00 0.00 C ATOM 1206 C GLU A 93 1.261 -0.121 13.600 1.00 0.00 C ATOM 1207 O GLU A 93 1.903 -0.829 12.822 1.00 0.00 O ATOM 1208 CB GLU A 93 3.117 1.324 14.561 1.00 0.00 C ATOM 1209 CG GLU A 93 2.792 2.426 13.544 1.00 0.00 C ATOM 1210 CD GLU A 93 3.940 3.438 13.428 1.00 0.00 C ATOM 1211 OE1 GLU A 93 4.612 3.476 12.370 1.00 0.00 O ATOM 1212 OE2 GLU A 93 4.166 4.219 14.383 1.00 0.00 O1- ATOM 0 H GLU A 93 3.342 -0.984 15.524 1.00 0.00 H new ATOM 0 HA GLU A 93 1.188 0.996 15.430 1.00 0.00 H new ATOM 0 HB2 GLU A 93 3.467 1.785 15.485 1.00 0.00 H new ATOM 0 HB3 GLU A 93 3.937 0.717 14.177 1.00 0.00 H new ATOM 0 HG2 GLU A 93 2.600 1.978 12.569 1.00 0.00 H new ATOM 0 HG3 GLU A 93 1.879 2.942 13.843 1.00 0.00 H new ATOM 1219 N ARG A 94 0.001 0.264 13.351 1.00 0.00 N ATOM 1220 CA ARG A 94 -0.614 0.151 12.025 1.00 0.00 C ATOM 1221 C ARG A 94 0.022 1.200 11.113 1.00 0.00 C ATOM 1222 O ARG A 94 -0.003 2.393 11.426 1.00 0.00 O ATOM 1223 CB ARG A 94 -2.144 0.342 12.055 1.00 0.00 C ATOM 1224 CG ARG A 94 -2.888 -0.939 12.458 1.00 0.00 C ATOM 1225 CD ARG A 94 -4.323 -0.671 12.932 1.00 0.00 C ATOM 1226 NE ARG A 94 -5.307 -0.635 11.837 1.00 0.00 N ATOM 1227 CZ ARG A 94 -6.578 -0.270 11.969 1.00 0.00 C ATOM 1228 NH1 ARG A 94 -7.027 0.331 13.045 1.00 0.00 N1+ ATOM 1229 NH2 ARG A 94 -7.442 -0.541 11.020 1.00 0.00 N ATOM 0 H ARG A 94 -0.616 0.660 14.060 1.00 0.00 H new ATOM 0 HA ARG A 94 -0.436 -0.858 11.653 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -2.394 1.139 12.755 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -2.486 0.663 11.071 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -2.913 -1.622 11.609 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -2.335 -1.439 13.253 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -4.612 -1.444 13.644 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -4.349 0.279 13.465 1.00 0.00 H new ATOM 0 HE ARG A 94 -4.989 -0.911 10.908 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -6.393 0.534 13.818 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -8.010 0.596 13.109 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -7.139 -1.033 10.179 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -8.417 -0.260 11.123 1.00 0.00 H new ATOM 1243 N LEU A 95 0.570 0.759 9.983 1.00 0.00 N ATOM 1244 CA LEU A 95 1.098 1.656 8.950 1.00 0.00 C ATOM 1245 C LEU A 95 -0.061 2.180 8.089 1.00 0.00 C ATOM 1246 O LEU A 95 -0.184 3.388 7.891 1.00 0.00 O ATOM 1247 CB LEU A 95 2.202 0.960 8.124 1.00 0.00 C ATOM 1248 CG LEU A 95 3.472 0.622 8.947 1.00 0.00 C ATOM 1249 CD1 LEU A 95 3.384 -0.764 9.607 1.00 0.00 C ATOM 1250 CD2 LEU A 95 4.740 0.661 8.078 1.00 0.00 C ATOM 0 H LEU A 95 0.662 -0.231 9.755 1.00 0.00 H new ATOM 0 HA LEU A 95 1.576 2.517 9.417 1.00 0.00 H new ATOM 0 HB2 LEU A 95 1.800 0.041 7.697 1.00 0.00 H new ATOM 0 HB3 LEU A 95 2.480 1.604 7.290 1.00 0.00 H new ATOM 0 HG LEU A 95 3.532 1.387 9.722 1.00 0.00 H new ATOM 0 HD11 LEU A 95 4.296 -0.956 10.172 1.00 0.00 H new ATOM 0 HD12 LEU A 95 2.527 -0.793 10.280 1.00 0.00 H new ATOM 0 HD13 LEU A 95 3.267 -1.527 8.837 1.00 0.00 H new ATOM 0 HD21 LEU A 95 5.608 0.419 8.691 1.00 0.00 H new ATOM 0 HD22 LEU A 95 4.651 -0.066 7.271 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.861 1.658 7.655 1.00 0.00 H new ATOM 1262 N ALA A 96 -0.959 1.283 7.666 1.00 0.00 N ATOM 1263 CA ALA A 96 -2.118 1.587 6.827 1.00 0.00 C ATOM 1264 C ALA A 96 -3.279 0.610 7.058 1.00 0.00 C ATOM 1265 O ALA A 96 -3.142 -0.421 7.720 1.00 0.00 O ATOM 1266 CB ALA A 96 -1.667 1.588 5.356 1.00 0.00 C ATOM 0 H ALA A 96 -0.895 0.294 7.908 1.00 0.00 H new ATOM 0 HA ALA A 96 -2.502 2.571 7.097 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -2.519 1.813 4.714 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -0.895 2.344 5.213 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -1.267 0.608 5.097 1.00 0.00 H new ATOM 1272 N HIS A 97 -4.426 0.938 6.469 1.00 0.00 N ATOM 1273 CA HIS A 97 -5.672 0.178 6.512 1.00 0.00 C ATOM 1274 C HIS A 97 -6.706 0.779 5.542 1.00 0.00 C ATOM 1275 O HIS A 97 -6.716 1.992 5.328 1.00 0.00 O ATOM 1276 CB HIS A 97 -6.201 0.089 7.955 1.00 0.00 C ATOM 1277 CG HIS A 97 -6.217 1.368 8.763 1.00 0.00 C ATOM 1278 ND1 HIS A 97 -7.326 2.118 9.076 1.00 0.00 N ATOM 1279 CD2 HIS A 97 -5.171 1.899 9.474 1.00 0.00 C ATOM 1280 CE1 HIS A 97 -6.955 3.086 9.930 1.00 0.00 C ATOM 1281 NE2 HIS A 97 -5.643 2.995 10.205 1.00 0.00 N ATOM 0 H HIS A 97 -4.516 1.791 5.917 1.00 0.00 H new ATOM 0 HA HIS A 97 -5.479 -0.842 6.180 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -7.218 -0.301 7.919 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -5.598 -0.643 8.492 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -4.155 1.533 9.470 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -7.619 3.833 10.339 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -5.101 3.601 10.821 1.00 0.00 H new ATOM 1289 N ALA A 98 -7.566 -0.067 4.960 1.00 0.00 N ATOM 1290 CA ALA A 98 -8.572 0.303 3.953 1.00 0.00 C ATOM 1291 C ALA A 98 -9.626 -0.813 3.776 1.00 0.00 C ATOM 1292 O ALA A 98 -9.427 -1.960 4.197 1.00 0.00 O ATOM 1293 CB ALA A 98 -7.899 0.717 2.625 1.00 0.00 C ATOM 0 H ALA A 98 -7.582 -1.062 5.184 1.00 0.00 H new ATOM 0 HA ALA A 98 -9.114 1.178 4.312 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -8.665 0.986 1.897 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -7.247 1.573 2.799 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -7.310 -0.116 2.241 1.00 0.00 H new ATOM 1299 N GLY A 99 -10.760 -0.465 3.162 1.00 0.00 N ATOM 1300 CA GLY A 99 -11.960 -1.311 3.100 1.00 0.00 C ATOM 1301 C GLY A 99 -12.856 -1.146 4.342 1.00 0.00 C ATOM 1302 O GLY A 99 -12.378 -0.703 5.394 1.00 0.00 O ATOM 0 H GLY A 99 -10.874 0.429 2.684 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -12.532 -1.062 2.206 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -11.661 -2.355 3.006 1.00 0.00 H new ATOM 1306 N PRO A 100 -14.153 -1.498 4.246 1.00 0.00 N ATOM 1307 CA PRO A 100 -15.172 -1.137 5.231 1.00 0.00 C ATOM 1308 C PRO A 100 -14.967 -1.776 6.609 1.00 0.00 C ATOM 1309 O PRO A 100 -15.300 -1.158 7.618 1.00 0.00 O ATOM 1310 CB PRO A 100 -16.505 -1.568 4.605 1.00 0.00 C ATOM 1311 CG PRO A 100 -16.114 -2.670 3.623 1.00 0.00 C ATOM 1312 CD PRO A 100 -14.762 -2.181 3.117 1.00 0.00 C ATOM 0 HA PRO A 100 -15.129 -0.068 5.438 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -17.200 -1.935 5.360 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -16.995 -0.737 4.098 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -16.040 -3.642 4.110 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -16.839 -2.772 2.815 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -14.144 -3.013 2.781 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -14.880 -1.508 2.268 1.00 0.00 H new ATOM 1320 N SER A 101 -14.411 -2.988 6.679 1.00 0.00 N ATOM 1321 CA SER A 101 -14.187 -3.732 7.928 1.00 0.00 C ATOM 1322 C SER A 101 -12.878 -3.370 8.665 1.00 0.00 C ATOM 1323 O SER A 101 -12.622 -3.915 9.743 1.00 0.00 O ATOM 1324 CB SER A 101 -14.292 -5.241 7.636 1.00 0.00 C ATOM 1325 OG SER A 101 -13.704 -5.598 6.388 1.00 0.00 O ATOM 0 H SER A 101 -14.096 -3.494 5.851 1.00 0.00 H new ATOM 0 HA SER A 101 -14.968 -3.434 8.628 1.00 0.00 H new ATOM 0 HB2 SER A 101 -13.804 -5.797 8.436 1.00 0.00 H new ATOM 0 HB3 SER A 101 -15.341 -5.536 7.637 1.00 0.00 H new ATOM 0 HG SER A 101 -12.735 -5.454 6.430 1.00 0.00 H new ATOM 1331 N MET A 102 -12.069 -2.437 8.129 1.00 0.00 N ATOM 1332 CA MET A 102 -10.790 -1.992 8.723 1.00 0.00 C ATOM 1333 C MET A 102 -10.655 -0.475 8.869 1.00 0.00 C ATOM 1334 O MET A 102 -10.023 -0.016 9.824 1.00 0.00 O ATOM 1335 CB MET A 102 -9.602 -2.480 7.875 1.00 0.00 C ATOM 1336 CG MET A 102 -9.358 -3.981 7.997 1.00 0.00 C ATOM 1337 SD MET A 102 -10.458 -5.015 7.013 1.00 0.00 S ATOM 1338 CE MET A 102 -10.417 -6.493 8.051 1.00 0.00 C ATOM 0 H MET A 102 -12.289 -1.961 7.254 1.00 0.00 H new ATOM 0 HA MET A 102 -10.784 -2.427 9.722 1.00 0.00 H new ATOM 0 HB2 MET A 102 -9.783 -2.231 6.829 1.00 0.00 H new ATOM 0 HB3 MET A 102 -8.702 -1.945 8.179 1.00 0.00 H new ATOM 0 HG2 MET A 102 -8.329 -4.191 7.705 1.00 0.00 H new ATOM 0 HG3 MET A 102 -9.457 -4.266 9.044 1.00 0.00 H new ATOM 0 HE1 MET A 102 -11.031 -7.272 7.599 1.00 0.00 H new ATOM 0 HE2 MET A 102 -9.390 -6.847 8.140 1.00 0.00 H new ATOM 0 HE3 MET A 102 -10.805 -6.253 9.041 1.00 0.00 H new ATOM 1348 N LEU A 103 -11.172 0.309 7.918 1.00 0.00 N ATOM 1349 CA LEU A 103 -11.006 1.764 7.888 1.00 0.00 C ATOM 1350 C LEU A 103 -12.303 2.474 8.288 1.00 0.00 C ATOM 1351 O LEU A 103 -13.254 2.555 7.511 1.00 0.00 O ATOM 1352 CB LEU A 103 -10.478 2.164 6.498 1.00 0.00 C ATOM 1353 CG LEU A 103 -10.265 3.673 6.268 1.00 0.00 C ATOM 1354 CD1 LEU A 103 -9.280 4.273 7.277 1.00 0.00 C ATOM 1355 CD2 LEU A 103 -9.745 3.929 4.841 1.00 0.00 C ATOM 0 H LEU A 103 -11.723 -0.053 7.140 1.00 0.00 H new ATOM 0 HA LEU A 103 -10.272 2.085 8.627 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -9.530 1.653 6.330 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -11.176 1.796 5.746 1.00 0.00 H new ATOM 0 HG LEU A 103 -11.232 4.157 6.404 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -9.159 5.338 7.078 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.664 4.134 8.287 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -8.315 3.775 7.184 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -9.599 4.999 4.693 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -8.796 3.411 4.701 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -10.471 3.558 4.117 1.00 0.00 H new ATOM 1367 N THR A 104 -12.302 3.034 9.506 1.00 0.00 N ATOM 1368 CA THR A 104 -13.415 3.781 10.117 1.00 0.00 C ATOM 1369 C THR A 104 -13.831 4.993 9.280 1.00 0.00 C ATOM 1370 O THR A 104 -15.021 5.259 9.129 1.00 0.00 O ATOM 1371 CB THR A 104 -13.020 4.211 11.538 1.00 0.00 C ATOM 1372 OG1 THR A 104 -12.349 3.156 12.212 1.00 0.00 O ATOM 1373 CG2 THR A 104 -14.235 4.596 12.385 1.00 0.00 C ATOM 0 H THR A 104 -11.490 2.977 10.121 1.00 0.00 H new ATOM 0 HA THR A 104 -14.281 3.121 10.160 1.00 0.00 H new ATOM 0 HB THR A 104 -12.369 5.078 11.422 1.00 0.00 H new ATOM 0 HG1 THR A 104 -12.103 3.448 13.115 1.00 0.00 H new ATOM 0 HG21 THR A 104 -13.905 4.893 13.381 1.00 0.00 H new ATOM 0 HG22 THR A 104 -14.758 5.428 11.913 1.00 0.00 H new ATOM 0 HG23 THR A 104 -14.908 3.742 12.465 1.00 0.00 H new ATOM 1381 N VAL A 105 -12.849 5.698 8.710 1.00 0.00 N ATOM 1382 CA VAL A 105 -13.025 6.916 7.890 1.00 0.00 C ATOM 1383 C VAL A 105 -13.076 6.627 6.375 1.00 0.00 C ATOM 1384 O VAL A 105 -12.592 7.428 5.575 1.00 0.00 O ATOM 1385 CB VAL A 105 -11.996 8.022 8.262 1.00 0.00 C ATOM 1386 CG1 VAL A 105 -12.174 8.454 9.729 1.00 0.00 C ATOM 1387 CG2 VAL A 105 -10.529 7.609 8.038 1.00 0.00 C ATOM 0 H VAL A 105 -11.869 5.431 8.807 1.00 0.00 H new ATOM 0 HA VAL A 105 -14.010 7.311 8.138 1.00 0.00 H new ATOM 0 HB VAL A 105 -12.204 8.852 7.587 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -11.446 9.228 9.971 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -13.181 8.845 9.873 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -12.021 7.595 10.382 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -9.872 8.432 8.320 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -10.299 6.736 8.649 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -10.376 7.366 6.986 1.00 0.00 H new ATOM 1397 N ALA A 106 -13.651 5.481 5.974 1.00 0.00 N ATOM 1398 CA ALA A 106 -13.928 5.128 4.576 1.00 0.00 C ATOM 1399 C ALA A 106 -15.388 5.468 4.175 1.00 0.00 C ATOM 1400 O ALA A 106 -16.294 4.676 4.461 1.00 0.00 O ATOM 1401 CB ALA A 106 -13.629 3.631 4.368 1.00 0.00 C ATOM 0 H ALA A 106 -13.943 4.758 6.632 1.00 0.00 H new ATOM 0 HA ALA A 106 -13.282 5.721 3.929 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -13.832 3.360 3.332 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -12.581 3.434 4.596 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -14.262 3.038 5.029 1.00 0.00 H new ATOM 1407 N PRO A 107 -15.652 6.608 3.504 1.00 0.00 N ATOM 1408 CA PRO A 107 -16.959 6.897 2.920 1.00 0.00 C ATOM 1409 C PRO A 107 -17.176 6.182 1.573 1.00 0.00 C ATOM 1410 O PRO A 107 -18.321 6.051 1.142 1.00 0.00 O ATOM 1411 CB PRO A 107 -16.971 8.415 2.747 1.00 0.00 C ATOM 1412 CG PRO A 107 -15.511 8.734 2.438 1.00 0.00 C ATOM 1413 CD PRO A 107 -14.757 7.738 3.314 1.00 0.00 C ATOM 0 HA PRO A 107 -17.767 6.538 3.557 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -17.632 8.724 1.938 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -17.313 8.922 3.649 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -15.282 8.598 1.381 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -15.260 9.765 2.689 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -13.829 7.424 2.836 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -14.487 8.186 4.270 1.00 0.00 H new ATOM 1421 N ALA A 108 -16.092 5.732 0.916 1.00 0.00 N ATOM 1422 CA ALA A 108 -16.063 5.074 -0.402 1.00 0.00 C ATOM 1423 C ALA A 108 -16.480 6.023 -1.557 1.00 0.00 C ATOM 1424 O ALA A 108 -16.560 7.245 -1.395 1.00 0.00 O ATOM 1425 CB ALA A 108 -16.856 3.747 -0.351 1.00 0.00 C ATOM 0 H ALA A 108 -15.158 5.824 1.315 1.00 0.00 H new ATOM 0 HA ALA A 108 -15.031 4.816 -0.638 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -16.828 3.269 -1.330 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -16.409 3.084 0.390 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -17.891 3.952 -0.076 1.00 0.00 H new ATOM 1431 N GLY A 109 -16.694 5.467 -2.758 1.00 0.00 N ATOM 1432 CA GLY A 109 -17.102 6.192 -3.975 1.00 0.00 C ATOM 1433 C GLY A 109 -15.947 6.901 -4.696 1.00 0.00 C ATOM 1434 O GLY A 109 -15.903 6.911 -5.927 1.00 0.00 O ATOM 0 H GLY A 109 -16.585 4.465 -2.917 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -17.570 5.489 -4.664 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -17.859 6.930 -3.709 1.00 0.00 H new ATOM 1438 N ASP A 110 -15.006 7.469 -3.937 1.00 0.00 N ATOM 1439 CA ASP A 110 -13.812 8.160 -4.436 1.00 0.00 C ATOM 1440 C ASP A 110 -12.635 7.204 -4.746 1.00 0.00 C ATOM 1441 O ASP A 110 -12.624 6.027 -4.371 1.00 0.00 O ATOM 1442 CB ASP A 110 -13.387 9.240 -3.420 1.00 0.00 C ATOM 1443 CG ASP A 110 -14.393 10.399 -3.328 1.00 0.00 C ATOM 1444 OD1 ASP A 110 -14.898 10.665 -2.213 1.00 0.00 O ATOM 1445 OD2 ASP A 110 -14.641 11.059 -4.364 1.00 0.00 O1- ATOM 0 H ASP A 110 -15.056 7.460 -2.918 1.00 0.00 H new ATOM 0 HA ASP A 110 -14.076 8.623 -5.387 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -13.275 8.783 -2.437 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -12.411 9.634 -3.702 1.00 0.00 H new ATOM 1450 N ALA A 111 -11.618 7.751 -5.420 1.00 0.00 N ATOM 1451 CA ALA A 111 -10.303 7.138 -5.627 1.00 0.00 C ATOM 1452 C ALA A 111 -9.195 8.129 -5.203 1.00 0.00 C ATOM 1453 O ALA A 111 -8.887 8.246 -4.018 1.00 0.00 O ATOM 1454 CB ALA A 111 -10.216 6.659 -7.089 1.00 0.00 C ATOM 0 H ALA A 111 -11.692 8.671 -5.854 1.00 0.00 H new ATOM 0 HA ALA A 111 -10.157 6.258 -5.000 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -9.243 6.199 -7.264 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -11.002 5.929 -7.280 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -10.341 7.510 -7.759 1.00 0.00 H new ATOM 1460 N SER A 112 -8.626 8.880 -6.149 1.00 0.00 N ATOM 1461 CA SER A 112 -7.538 9.854 -5.897 1.00 0.00 C ATOM 1462 C SER A 112 -7.992 11.148 -5.188 1.00 0.00 C ATOM 1463 O SER A 112 -7.187 11.836 -4.556 1.00 0.00 O ATOM 1464 CB SER A 112 -6.874 10.204 -7.233 1.00 0.00 C ATOM 1465 OG SER A 112 -7.852 10.635 -8.162 1.00 0.00 O ATOM 0 H SER A 112 -8.906 8.835 -7.129 1.00 0.00 H new ATOM 0 HA SER A 112 -6.839 9.373 -5.213 1.00 0.00 H new ATOM 0 HB2 SER A 112 -6.131 10.988 -7.085 1.00 0.00 H new ATOM 0 HB3 SER A 112 -6.346 9.335 -7.625 1.00 0.00 H new ATOM 0 HG SER A 112 -7.419 10.858 -9.012 1.00 0.00 H new ATOM 1471 N HIS A 113 -9.290 11.473 -5.239 1.00 0.00 N ATOM 1472 CA HIS A 113 -9.868 12.699 -4.660 1.00 0.00 C ATOM 1473 C HIS A 113 -9.677 12.810 -3.126 1.00 0.00 C ATOM 1474 O HIS A 113 -9.761 13.900 -2.551 1.00 0.00 O ATOM 1475 CB HIS A 113 -11.358 12.751 -5.045 1.00 0.00 C ATOM 1476 CG HIS A 113 -11.960 14.134 -4.980 1.00 0.00 C ATOM 1477 ND1 HIS A 113 -11.838 15.112 -5.943 1.00 0.00 N ATOM 1478 CD2 HIS A 113 -12.764 14.641 -3.992 1.00 0.00 C ATOM 1479 CE1 HIS A 113 -12.544 16.183 -5.542 1.00 0.00 C ATOM 1480 NE2 HIS A 113 -13.130 15.948 -4.351 1.00 0.00 N ATOM 0 H HIS A 113 -9.985 10.880 -5.693 1.00 0.00 H new ATOM 0 HA HIS A 113 -9.334 13.557 -5.070 1.00 0.00 H new ATOM 0 HB2 HIS A 113 -11.475 12.362 -6.056 1.00 0.00 H new ATOM 0 HB3 HIS A 113 -11.917 12.091 -4.382 1.00 0.00 H new ATOM 0 HD2 HIS A 113 -13.064 14.124 -3.093 1.00 0.00 H new ATOM 0 HE1 HIS A 113 -12.630 17.105 -6.098 1.00 0.00 H new ATOM 0 HE2 HIS A 113 -13.719 16.589 -3.819 1.00 0.00 H new ATOM 1488 N LEU A 114 -9.366 11.684 -2.470 1.00 0.00 N ATOM 1489 CA LEU A 114 -9.051 11.567 -1.043 1.00 0.00 C ATOM 1490 C LEU A 114 -7.834 12.414 -0.616 1.00 0.00 C ATOM 1491 O LEU A 114 -7.790 12.883 0.521 1.00 0.00 O ATOM 1492 CB LEU A 114 -8.805 10.069 -0.767 1.00 0.00 C ATOM 1493 CG LEU A 114 -9.198 9.613 0.650 1.00 0.00 C ATOM 1494 CD1 LEU A 114 -10.726 9.536 0.815 1.00 0.00 C ATOM 1495 CD2 LEU A 114 -8.581 8.232 0.902 1.00 0.00 C ATOM 0 H LEU A 114 -9.326 10.783 -2.947 1.00 0.00 H new ATOM 0 HA LEU A 114 -9.883 11.955 -0.456 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -9.365 9.481 -1.494 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -7.749 9.851 -0.926 1.00 0.00 H new ATOM 0 HG LEU A 114 -8.825 10.340 1.371 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -10.967 9.211 1.827 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -11.161 10.519 0.637 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -11.134 8.823 0.098 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -8.848 7.891 1.902 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -8.959 7.524 0.164 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -7.496 8.298 0.819 1.00 0.00 H new ATOM 1507 N SER A 115 -6.869 12.616 -1.522 1.00 0.00 N ATOM 1508 CA SER A 115 -5.735 13.566 -1.464 1.00 0.00 C ATOM 1509 C SER A 115 -4.742 13.360 -0.298 1.00 0.00 C ATOM 1510 O SER A 115 -3.593 12.969 -0.517 1.00 0.00 O ATOM 1511 CB SER A 115 -6.237 15.024 -1.481 1.00 0.00 C ATOM 1512 OG SER A 115 -7.024 15.305 -2.630 1.00 0.00 O ATOM 0 H SER A 115 -6.854 12.078 -2.388 1.00 0.00 H new ATOM 0 HA SER A 115 -5.161 13.348 -2.365 1.00 0.00 H new ATOM 0 HB2 SER A 115 -6.825 15.215 -0.584 1.00 0.00 H new ATOM 0 HB3 SER A 115 -5.383 15.701 -1.452 1.00 0.00 H new ATOM 0 HG SER A 115 -7.869 14.811 -2.576 1.00 0.00 H new ATOM 1518 N MET A 116 -5.168 13.650 0.938 1.00 0.00 N ATOM 1519 CA MET A 116 -4.408 13.475 2.182 1.00 0.00 C ATOM 1520 C MET A 116 -4.532 12.049 2.733 1.00 0.00 C ATOM 1521 O MET A 116 -3.557 11.511 3.254 1.00 0.00 O ATOM 1522 CB MET A 116 -4.937 14.491 3.205 1.00 0.00 C ATOM 1523 CG MET A 116 -4.128 14.564 4.491 1.00 0.00 C ATOM 1524 SD MET A 116 -4.839 15.590 5.807 1.00 0.00 S ATOM 1525 CE MET A 116 -4.783 17.222 5.034 1.00 0.00 C ATOM 0 H MET A 116 -6.099 14.032 1.106 1.00 0.00 H new ATOM 0 HA MET A 116 -3.350 13.642 1.982 1.00 0.00 H new ATOM 0 HB2 MET A 116 -4.954 15.478 2.744 1.00 0.00 H new ATOM 0 HB3 MET A 116 -5.968 14.237 3.452 1.00 0.00 H new ATOM 0 HG2 MET A 116 -3.997 13.552 4.875 1.00 0.00 H new ATOM 0 HG3 MET A 116 -3.135 14.946 4.253 1.00 0.00 H new ATOM 0 HE1 MET A 116 -5.087 17.978 5.758 1.00 0.00 H new ATOM 0 HE2 MET A 116 -3.768 17.430 4.697 1.00 0.00 H new ATOM 0 HE3 MET A 116 -5.460 17.244 4.180 1.00 0.00 H new ATOM 1535 N SER A 117 -5.719 11.441 2.611 1.00 0.00 N ATOM 1536 CA SER A 117 -6.042 10.082 3.086 1.00 0.00 C ATOM 1537 C SER A 117 -6.024 9.923 4.628 1.00 0.00 C ATOM 1538 O SER A 117 -5.897 10.896 5.380 1.00 0.00 O ATOM 1539 CB SER A 117 -5.130 9.051 2.396 1.00 0.00 C ATOM 1540 OG SER A 117 -5.672 7.748 2.504 1.00 0.00 O ATOM 0 H SER A 117 -6.514 11.896 2.162 1.00 0.00 H new ATOM 0 HA SER A 117 -7.078 9.894 2.803 1.00 0.00 H new ATOM 0 HB2 SER A 117 -5.008 9.313 1.345 1.00 0.00 H new ATOM 0 HB3 SER A 117 -4.138 9.076 2.848 1.00 0.00 H new ATOM 0 HG SER A 117 -5.095 7.200 3.076 1.00 0.00 H new ATOM 1546 N THR A 118 -6.154 8.672 5.097 1.00 0.00 N ATOM 1547 CA THR A 118 -5.958 8.206 6.477 1.00 0.00 C ATOM 1548 C THR A 118 -4.595 8.634 7.014 1.00 0.00 C ATOM 1549 O THR A 118 -4.517 9.183 8.112 1.00 0.00 O ATOM 1550 CB THR A 118 -6.058 6.675 6.509 1.00 0.00 C ATOM 1551 OG1 THR A 118 -7.116 6.244 5.681 1.00 0.00 O ATOM 1552 CG2 THR A 118 -6.289 6.152 7.929 1.00 0.00 C ATOM 0 H THR A 118 -6.418 7.906 4.477 1.00 0.00 H new ATOM 0 HA THR A 118 -6.729 8.650 7.106 1.00 0.00 H new ATOM 0 HB THR A 118 -5.110 6.277 6.146 1.00 0.00 H new ATOM 0 HG1 THR A 118 -7.173 5.266 5.705 1.00 0.00 H new ATOM 0 HG21 THR A 118 -6.354 5.064 7.910 1.00 0.00 H new ATOM 0 HG22 THR A 118 -5.459 6.455 8.568 1.00 0.00 H new ATOM 0 HG23 THR A 118 -7.218 6.564 8.322 1.00 0.00 H new ATOM 1560 N GLU A 119 -3.550 8.410 6.210 1.00 0.00 N ATOM 1561 CA GLU A 119 -2.153 8.799 6.446 1.00 0.00 C ATOM 1562 C GLU A 119 -1.478 7.932 7.544 1.00 0.00 C ATOM 1563 O GLU A 119 -2.117 7.122 8.220 1.00 0.00 O ATOM 1564 CB GLU A 119 -2.032 10.311 6.760 1.00 0.00 C ATOM 1565 CG GLU A 119 -0.789 10.947 6.120 1.00 0.00 C ATOM 1566 CD GLU A 119 -0.447 12.289 6.780 1.00 0.00 C ATOM 1567 OE1 GLU A 119 0.403 12.302 7.702 1.00 0.00 O ATOM 1568 OE2 GLU A 119 -1.005 13.337 6.375 1.00 0.00 O1- ATOM 0 H GLU A 119 -3.663 7.922 5.321 1.00 0.00 H new ATOM 0 HA GLU A 119 -1.611 8.609 5.520 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -2.924 10.825 6.403 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -1.993 10.453 7.840 1.00 0.00 H new ATOM 0 HG2 GLU A 119 0.058 10.267 6.212 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -0.962 11.097 5.054 1.00 0.00 H new ATOM 1575 N LEU A 120 -0.171 8.135 7.735 1.00 0.00 N ATOM 1576 CA LEU A 120 0.635 7.499 8.791 1.00 0.00 C ATOM 1577 C LEU A 120 0.269 8.004 10.209 1.00 0.00 C ATOM 1578 O LEU A 120 0.559 7.328 11.192 1.00 0.00 O ATOM 1579 CB LEU A 120 2.122 7.783 8.502 1.00 0.00 C ATOM 1580 CG LEU A 120 2.669 7.163 7.196 1.00 0.00 C ATOM 1581 CD1 LEU A 120 4.032 7.785 6.863 1.00 0.00 C ATOM 1582 CD2 LEU A 120 2.815 5.640 7.307 1.00 0.00 C ATOM 0 H LEU A 120 0.374 8.763 7.145 1.00 0.00 H new ATOM 0 HA LEU A 120 0.429 6.429 8.779 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.268 8.862 8.462 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.715 7.412 9.338 1.00 0.00 H new ATOM 0 HG LEU A 120 1.954 7.375 6.401 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.417 7.347 5.942 1.00 0.00 H new ATOM 0 HD12 LEU A 120 3.919 8.861 6.733 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.730 7.589 7.677 1.00 0.00 H new ATOM 0 HD21 LEU A 120 3.202 5.242 6.369 1.00 0.00 H new ATOM 0 HD22 LEU A 120 3.505 5.399 8.116 1.00 0.00 H new ATOM 0 HD23 LEU A 120 1.842 5.195 7.515 1.00 0.00 H new ATOM 1594 N ASP A 121 -0.355 9.181 10.309 1.00 0.00 N ATOM 1595 CA ASP A 121 -0.699 9.847 11.576 1.00 0.00 C ATOM 1596 C ASP A 121 -1.774 9.098 12.393 1.00 0.00 C ATOM 1597 O ASP A 121 -1.792 9.203 13.622 1.00 0.00 O ATOM 1598 CB ASP A 121 -1.156 11.283 11.272 1.00 0.00 C ATOM 1599 CG ASP A 121 -1.288 12.128 12.539 1.00 0.00 C ATOM 1600 OD1 ASP A 121 -2.438 12.484 12.919 1.00 0.00 O ATOM 1601 OD2 ASP A 121 -0.235 12.481 13.146 1.00 0.00 O1- ATOM 0 H ASP A 121 -0.645 9.715 9.490 1.00 0.00 H new ATOM 0 HA ASP A 121 0.195 9.851 12.199 1.00 0.00 H new ATOM 0 HB2 ASP A 121 -0.442 11.754 10.596 1.00 0.00 H new ATOM 0 HB3 ASP A 121 -2.115 11.255 10.754 1.00 0.00 H new ATOM 1606 N THR A 122 -2.633 8.317 11.724 1.00 0.00 N ATOM 1607 CA THR A 122 -3.597 7.408 12.367 1.00 0.00 C ATOM 1608 C THR A 122 -2.866 6.121 12.750 1.00 0.00 C ATOM 1609 O THR A 122 -2.833 5.149 11.992 1.00 0.00 O ATOM 1610 CB THR A 122 -4.814 7.165 11.467 1.00 0.00 C ATOM 1611 OG1 THR A 122 -5.407 8.420 11.206 1.00 0.00 O ATOM 1612 CG2 THR A 122 -5.881 6.292 12.138 1.00 0.00 C ATOM 0 H THR A 122 -2.680 8.297 10.705 1.00 0.00 H new ATOM 0 HA THR A 122 -3.995 7.858 13.276 1.00 0.00 H new ATOM 0 HB THR A 122 -4.469 6.654 10.568 1.00 0.00 H new ATOM 0 HG1 THR A 122 -5.192 8.700 10.292 1.00 0.00 H new ATOM 0 HG21 THR A 122 -6.719 6.153 11.455 1.00 0.00 H new ATOM 0 HG22 THR A 122 -5.452 5.322 12.389 1.00 0.00 H new ATOM 0 HG23 THR A 122 -6.231 6.780 13.048 1.00 0.00 H new ATOM 1620 N THR A 123 -2.254 6.141 13.939 1.00 0.00 N ATOM 1621 CA THR A 123 -1.609 4.987 14.590 1.00 0.00 C ATOM 1622 C THR A 123 -2.674 3.971 15.012 1.00 0.00 C ATOM 1623 O THR A 123 -3.862 4.287 15.075 1.00 0.00 O ATOM 1624 CB THR A 123 -0.777 5.444 15.807 1.00 0.00 C ATOM 1625 OG1 THR A 123 -0.275 6.748 15.613 1.00 0.00 O ATOM 1626 CG2 THR A 123 0.435 4.548 16.075 1.00 0.00 C ATOM 0 H THR A 123 -2.190 6.992 14.498 1.00 0.00 H new ATOM 0 HA THR A 123 -0.931 4.513 13.880 1.00 0.00 H new ATOM 0 HB THR A 123 -1.463 5.396 16.653 1.00 0.00 H new ATOM 0 HG1 THR A 123 -0.913 7.401 15.969 1.00 0.00 H new ATOM 0 HG21 THR A 123 0.979 4.922 16.943 1.00 0.00 H new ATOM 0 HG22 THR A 123 0.099 3.529 16.268 1.00 0.00 H new ATOM 0 HG23 THR A 123 1.092 4.554 15.205 1.00 0.00 H new ATOM 1634 N HIS A 124 -2.260 2.746 15.334 1.00 0.00 N ATOM 1635 CA HIS A 124 -3.164 1.708 15.846 1.00 0.00 C ATOM 1636 C HIS A 124 -3.835 2.110 17.168 1.00 0.00 C ATOM 1637 O HIS A 124 -5.059 2.012 17.276 1.00 0.00 O ATOM 1638 CB HIS A 124 -2.375 0.400 16.023 1.00 0.00 C ATOM 1639 CG HIS A 124 -3.073 -0.672 16.830 1.00 0.00 C ATOM 1640 ND1 HIS A 124 -2.512 -1.361 17.879 1.00 0.00 N ATOM 1641 CD2 HIS A 124 -4.369 -1.104 16.712 1.00 0.00 C ATOM 1642 CE1 HIS A 124 -3.448 -2.178 18.391 1.00 0.00 C ATOM 1643 NE2 HIS A 124 -4.603 -2.060 17.709 1.00 0.00 N ATOM 0 H HIS A 124 -1.290 2.442 15.249 1.00 0.00 H new ATOM 0 HA HIS A 124 -3.965 1.571 15.120 1.00 0.00 H new ATOM 0 HB2 HIS A 124 -2.145 -0.003 15.037 1.00 0.00 H new ATOM 0 HB3 HIS A 124 -1.424 0.631 16.502 1.00 0.00 H new ATOM 0 HD2 HIS A 124 -5.085 -0.766 15.978 1.00 0.00 H new ATOM 0 HE1 HIS A 124 -3.295 -2.838 19.232 1.00 0.00 H new ATOM 0 HE2 HIS A 124 -5.472 -2.564 17.883 1.00 0.00 H new ATOM 1651 N PHE A 125 -3.030 2.529 18.156 1.00 0.00 N ATOM 1652 CA PHE A 125 -3.449 2.852 19.522 1.00 0.00 C ATOM 1653 C PHE A 125 -4.300 1.720 20.137 1.00 0.00 C ATOM 1654 O PHE A 125 -3.740 0.764 20.678 1.00 0.00 O ATOM 1655 CB PHE A 125 -4.093 4.253 19.542 1.00 0.00 C ATOM 1656 CG PHE A 125 -4.626 4.679 20.897 1.00 0.00 C ATOM 1657 CD1 PHE A 125 -5.998 4.955 21.062 1.00 0.00 C ATOM 1658 CD2 PHE A 125 -3.758 4.773 22.003 1.00 0.00 C ATOM 1659 CE1 PHE A 125 -6.499 5.312 22.326 1.00 0.00 C ATOM 1660 CE2 PHE A 125 -4.261 5.130 23.267 1.00 0.00 C ATOM 1661 CZ PHE A 125 -5.632 5.398 23.429 1.00 0.00 C ATOM 0 H PHE A 125 -2.028 2.656 18.016 1.00 0.00 H new ATOM 0 HA PHE A 125 -2.584 2.909 20.182 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.355 4.983 19.209 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -4.910 4.274 18.821 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -6.666 4.892 20.216 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -2.704 4.571 21.880 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -7.551 5.520 22.450 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -3.594 5.198 24.114 1.00 0.00 H new ATOM 0 HZ PHE A 125 -6.018 5.670 24.400 1.00 0.00 H new ATOM 1671 N LEU A 126 -5.633 1.822 20.040 1.00 0.00 N ATOM 1672 CA LEU A 126 -6.622 0.855 20.527 1.00 0.00 C ATOM 1673 C LEU A 126 -7.967 1.073 19.794 1.00 0.00 C ATOM 1674 O LEU A 126 -9.001 1.348 20.406 1.00 0.00 O ATOM 1675 CB LEU A 126 -6.671 0.926 22.077 1.00 0.00 C ATOM 1676 CG LEU A 126 -7.108 -0.384 22.777 1.00 0.00 C ATOM 1677 CD1 LEU A 126 -6.441 -0.478 24.160 1.00 0.00 C ATOM 1678 CD2 LEU A 126 -8.631 -0.494 22.956 1.00 0.00 C ATOM 0 H LEU A 126 -6.073 2.627 19.594 1.00 0.00 H new ATOM 0 HA LEU A 126 -6.347 -0.173 20.293 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.684 1.205 22.445 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -7.356 1.722 22.368 1.00 0.00 H new ATOM 0 HG LEU A 126 -6.793 -1.203 22.130 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -6.750 -1.401 24.651 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -5.357 -0.475 24.042 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -6.742 0.375 24.768 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -8.872 -1.434 23.452 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -8.987 0.339 23.563 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -9.115 -0.465 21.980 1.00 0.00 H new ATOM 1690 N LEU A 127 -7.946 1.015 18.453 1.00 0.00 N ATOM 1691 CA LEU A 127 -9.157 1.097 17.613 1.00 0.00 C ATOM 1692 C LEU A 127 -10.005 -0.200 17.673 1.00 0.00 C ATOM 1693 O LEU A 127 -9.453 -1.276 17.931 1.00 0.00 O ATOM 1694 CB LEU A 127 -8.787 1.449 16.150 1.00 0.00 C ATOM 1695 CG LEU A 127 -8.925 2.953 15.823 1.00 0.00 C ATOM 1696 CD1 LEU A 127 -7.705 3.758 16.292 1.00 0.00 C ATOM 1697 CD2 LEU A 127 -9.129 3.153 14.311 1.00 0.00 C ATOM 0 H LEU A 127 -7.085 0.909 17.916 1.00 0.00 H new ATOM 0 HA LEU A 127 -9.775 1.898 18.018 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -7.761 1.136 15.958 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -9.425 0.879 15.475 1.00 0.00 H new ATOM 0 HG LEU A 127 -9.797 3.323 16.363 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -7.845 4.810 16.042 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -7.593 3.654 17.371 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -6.809 3.383 15.797 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -9.225 4.217 14.094 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -8.272 2.749 13.772 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -10.034 2.635 13.994 1.00 0.00 H new ATOM 1709 N PRO A 128 -11.328 -0.124 17.393 1.00 0.00 N ATOM 1710 CA PRO A 128 -12.235 -1.275 17.418 1.00 0.00 C ATOM 1711 C PRO A 128 -12.136 -2.169 16.169 1.00 0.00 C ATOM 1712 O PRO A 128 -12.381 -3.369 16.276 1.00 0.00 O ATOM 1713 CB PRO A 128 -13.637 -0.671 17.550 1.00 0.00 C ATOM 1714 CG PRO A 128 -13.516 0.673 16.835 1.00 0.00 C ATOM 1715 CD PRO A 128 -12.086 1.103 17.163 1.00 0.00 C ATOM 0 HA PRO A 128 -11.978 -1.940 18.242 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -14.392 -1.305 17.086 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -13.923 -0.546 18.594 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -13.673 0.575 15.761 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -14.249 1.393 17.200 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -11.655 1.677 16.343 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -12.066 1.743 18.045 1.00 0.00 H new ATOM 1723 N VAL A 129 -11.774 -1.610 15.005 1.00 0.00 N ATOM 1724 CA VAL A 129 -11.524 -2.342 13.748 1.00 0.00 C ATOM 1725 C VAL A 129 -10.045 -2.253 13.371 1.00 0.00 C ATOM 1726 O VAL A 129 -9.459 -1.172 13.425 1.00 0.00 O ATOM 1727 CB VAL A 129 -12.399 -1.843 12.571 1.00 0.00 C ATOM 1728 CG1 VAL A 129 -13.833 -2.381 12.707 1.00 0.00 C ATOM 1729 CG2 VAL A 129 -12.442 -0.313 12.398 1.00 0.00 C ATOM 0 H VAL A 129 -11.642 -0.603 14.906 1.00 0.00 H new ATOM 0 HA VAL A 129 -11.800 -3.380 13.931 1.00 0.00 H new ATOM 0 HB VAL A 129 -11.917 -2.234 11.675 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -14.437 -2.022 11.873 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -13.815 -3.471 12.700 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -14.265 -2.032 13.645 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -13.079 -0.060 11.550 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -12.844 0.144 13.302 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -11.434 0.061 12.219 1.00 0.00 H new ATOM 1739 N LEU A 130 -9.464 -3.400 12.997 1.00 0.00 N ATOM 1740 CA LEU A 130 -8.036 -3.641 12.737 1.00 0.00 C ATOM 1741 C LEU A 130 -7.803 -5.047 12.154 1.00 0.00 C ATOM 1742 O LEU A 130 -8.748 -5.818 11.976 1.00 0.00 O ATOM 1743 CB LEU A 130 -7.152 -3.300 13.972 1.00 0.00 C ATOM 1744 CG LEU A 130 -7.215 -4.156 15.263 1.00 0.00 C ATOM 1745 CD1 LEU A 130 -8.630 -4.350 15.825 1.00 0.00 C ATOM 1746 CD2 LEU A 130 -6.526 -5.521 15.121 1.00 0.00 C ATOM 0 H LEU A 130 -10.018 -4.245 12.858 1.00 0.00 H new ATOM 0 HA LEU A 130 -7.707 -2.947 11.963 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -6.116 -3.308 13.634 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -7.386 -2.274 14.258 1.00 0.00 H new ATOM 0 HG LEU A 130 -6.657 -3.559 15.984 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -8.583 -4.960 16.727 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -9.062 -3.379 16.066 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -9.251 -4.849 15.082 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -6.607 -6.069 16.060 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -7.007 -6.091 14.326 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -5.474 -5.374 14.876 1.00 0.00 H new ATOM 1758 N GLY A 131 -6.543 -5.378 11.846 1.00 0.00 N ATOM 1759 CA GLY A 131 -6.139 -6.640 11.219 1.00 0.00 C ATOM 1760 C GLY A 131 -6.147 -7.780 12.228 1.00 0.00 C ATOM 1761 O GLY A 131 -5.144 -8.060 12.880 1.00 0.00 O ATOM 0 H GLY A 131 -5.755 -4.757 12.032 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -6.815 -6.874 10.396 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -5.142 -6.535 10.792 1.00 0.00 H new ATOM 1765 N ARG A 132 -7.285 -8.465 12.328 1.00 0.00 N ATOM 1766 CA ARG A 132 -7.594 -9.547 13.279 1.00 0.00 C ATOM 1767 C ARG A 132 -6.850 -10.881 13.022 1.00 0.00 C ATOM 1768 O ARG A 132 -7.377 -11.950 13.324 1.00 0.00 O ATOM 1769 CB ARG A 132 -9.129 -9.707 13.341 1.00 0.00 C ATOM 1770 CG ARG A 132 -9.777 -9.963 11.966 1.00 0.00 C ATOM 1771 CD ARG A 132 -11.288 -10.179 12.090 1.00 0.00 C ATOM 1772 NE ARG A 132 -11.937 -10.101 10.769 1.00 0.00 N ATOM 1773 CZ ARG A 132 -13.223 -10.305 10.510 1.00 0.00 C ATOM 1774 NH1 ARG A 132 -14.071 -10.691 11.441 1.00 0.00 N1+ ATOM 1775 NH2 ARG A 132 -13.678 -10.117 9.290 1.00 0.00 N ATOM 0 H ARG A 132 -8.072 -8.271 11.709 1.00 0.00 H new ATOM 0 HA ARG A 132 -7.209 -9.255 14.256 1.00 0.00 H new ATOM 0 HB2 ARG A 132 -9.373 -10.533 14.008 1.00 0.00 H new ATOM 0 HB3 ARG A 132 -9.563 -8.807 13.776 1.00 0.00 H new ATOM 0 HG2 ARG A 132 -9.582 -9.117 11.307 1.00 0.00 H new ATOM 0 HG3 ARG A 132 -9.320 -10.838 11.504 1.00 0.00 H new ATOM 0 HD2 ARG A 132 -11.485 -11.152 12.540 1.00 0.00 H new ATOM 0 HD3 ARG A 132 -11.714 -9.428 12.755 1.00 0.00 H new ATOM 0 HE ARG A 132 -11.339 -9.867 9.976 1.00 0.00 H new ATOM 0 HH11 ARG A 132 -13.746 -10.842 12.396 1.00 0.00 H new ATOM 0 HH12 ARG A 132 -15.053 -10.838 11.207 1.00 0.00 H new ATOM 0 HH21 ARG A 132 -13.044 -9.816 8.550 1.00 0.00 H new ATOM 0 HH22 ARG A 132 -14.665 -10.272 9.084 1.00 0.00 H new ATOM 1789 N HIS A 133 -5.644 -10.829 12.445 1.00 0.00 N ATOM 1790 CA HIS A 133 -4.803 -11.971 12.059 1.00 0.00 C ATOM 1791 C HIS A 133 -5.585 -12.997 11.200 1.00 0.00 C ATOM 1792 O HIS A 133 -5.845 -14.129 11.615 1.00 0.00 O ATOM 1793 CB HIS A 133 -4.119 -12.553 13.312 1.00 0.00 C ATOM 1794 CG HIS A 133 -3.093 -13.632 13.039 1.00 0.00 C ATOM 1795 ND1 HIS A 133 -2.853 -14.731 13.834 1.00 0.00 N ATOM 1796 CD2 HIS A 133 -2.212 -13.701 11.988 1.00 0.00 C ATOM 1797 CE1 HIS A 133 -1.861 -15.445 13.275 1.00 0.00 C ATOM 1798 NE2 HIS A 133 -1.433 -14.856 12.142 1.00 0.00 N ATOM 0 H HIS A 133 -5.202 -9.937 12.221 1.00 0.00 H new ATOM 0 HA HIS A 133 -4.002 -11.639 11.399 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -3.634 -11.740 13.853 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -4.886 -12.961 13.970 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -2.133 -12.988 11.181 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -1.462 -16.364 13.679 1.00 0.00 H new ATOM 0 HE2 HIS A 133 -0.692 -15.184 11.522 1.00 0.00 H new ATOM 1806 N HIS A 134 -6.016 -12.566 10.008 1.00 0.00 N ATOM 1807 CA HIS A 134 -6.853 -13.358 9.096 1.00 0.00 C ATOM 1808 C HIS A 134 -6.192 -14.711 8.745 1.00 0.00 C ATOM 1809 O HIS A 134 -5.002 -14.769 8.432 1.00 0.00 O ATOM 1810 CB HIS A 134 -7.157 -12.520 7.839 1.00 0.00 C ATOM 1811 CG HIS A 134 -8.465 -12.823 7.139 1.00 0.00 C ATOM 1812 ND1 HIS A 134 -9.393 -11.886 6.738 1.00 0.00 N ATOM 1813 CD2 HIS A 134 -8.941 -14.041 6.726 1.00 0.00 C ATOM 1814 CE1 HIS A 134 -10.400 -12.519 6.118 1.00 0.00 C ATOM 1815 NE2 HIS A 134 -10.177 -13.845 6.095 1.00 0.00 N ATOM 0 H HIS A 134 -5.789 -11.641 9.643 1.00 0.00 H new ATOM 0 HA HIS A 134 -7.793 -13.602 9.592 1.00 0.00 H new ATOM 0 HB2 HIS A 134 -7.153 -11.467 8.119 1.00 0.00 H new ATOM 0 HB3 HIS A 134 -6.345 -12.663 7.126 1.00 0.00 H new ATOM 0 HD1 HIS A 134 -9.325 -10.879 6.888 1.00 0.00 H new ATOM 0 HD2 HIS A 134 -8.447 -14.991 6.864 1.00 0.00 H new ATOM 0 HE1 HIS A 134 -11.267 -12.033 5.697 1.00 0.00 H new ATOM 1823 N SER A 135 -6.967 -15.799 8.753 1.00 0.00 N ATOM 1824 CA SER A 135 -6.539 -17.194 8.620 1.00 0.00 C ATOM 1825 C SER A 135 -5.813 -17.585 7.310 1.00 0.00 C ATOM 1826 O SER A 135 -5.428 -18.748 7.161 1.00 0.00 O ATOM 1827 CB SER A 135 -7.804 -18.077 8.778 1.00 0.00 C ATOM 1828 OG SER A 135 -8.596 -17.750 9.905 1.00 0.00 O ATOM 0 H SER A 135 -7.979 -15.723 8.860 1.00 0.00 H new ATOM 0 HA SER A 135 -5.785 -17.348 9.392 1.00 0.00 H new ATOM 0 HB2 SER A 135 -8.414 -17.985 7.879 1.00 0.00 H new ATOM 0 HB3 SER A 135 -7.499 -19.121 8.851 1.00 0.00 H new ATOM 0 HG SER A 135 -9.375 -18.344 9.941 1.00 0.00 H new ATOM 1834 N LEU A 136 -5.617 -16.655 6.364 1.00 0.00 N ATOM 1835 CA LEU A 136 -4.825 -16.853 5.140 1.00 0.00 C ATOM 1836 C LEU A 136 -3.334 -17.052 5.464 1.00 0.00 C ATOM 1837 O LEU A 136 -2.777 -18.094 5.125 1.00 0.00 O ATOM 1838 CB LEU A 136 -5.034 -15.657 4.180 1.00 0.00 C ATOM 1839 CG LEU A 136 -6.181 -15.842 3.163 1.00 0.00 C ATOM 1840 CD1 LEU A 136 -7.565 -15.949 3.820 1.00 0.00 C ATOM 1841 CD2 LEU A 136 -6.174 -14.663 2.177 1.00 0.00 C ATOM 0 H LEU A 136 -6.016 -15.719 6.430 1.00 0.00 H new ATOM 0 HA LEU A 136 -5.170 -17.762 4.647 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -5.231 -14.763 4.772 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -4.107 -15.480 3.634 1.00 0.00 H new ATOM 0 HG LEU A 136 -6.003 -16.787 2.649 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -8.325 -16.078 3.049 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -7.583 -16.806 4.493 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -7.771 -15.040 4.384 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -6.982 -14.787 1.456 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -6.316 -13.731 2.724 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -5.220 -14.634 1.651 1.00 0.00 H new ATOM 1853 N SER A 137 -2.708 -16.050 6.095 1.00 0.00 N ATOM 1854 CA SER A 137 -1.280 -15.939 6.488 1.00 0.00 C ATOM 1855 C SER A 137 -0.855 -14.467 6.644 1.00 0.00 C ATOM 1856 O SER A 137 -0.601 -14.003 7.758 1.00 0.00 O ATOM 1857 CB SER A 137 -0.290 -16.664 5.546 1.00 0.00 C ATOM 1858 OG SER A 137 -0.473 -16.330 4.172 1.00 0.00 O ATOM 0 H SER A 137 -3.227 -15.217 6.373 1.00 0.00 H new ATOM 0 HA SER A 137 -1.223 -16.452 7.448 1.00 0.00 H new ATOM 0 HB2 SER A 137 0.730 -16.415 5.841 1.00 0.00 H new ATOM 0 HB3 SER A 137 -0.404 -17.741 5.669 1.00 0.00 H new ATOM 0 HG SER A 137 0.180 -16.816 3.627 1.00 0.00 H new ATOM 1864 N GLY A 138 -0.782 -13.723 5.530 1.00 0.00 N ATOM 1865 CA GLY A 138 -0.447 -12.296 5.500 1.00 0.00 C ATOM 1866 C GLY A 138 1.056 -12.037 5.414 1.00 0.00 C ATOM 1867 O GLY A 138 1.698 -12.423 4.437 1.00 0.00 O ATOM 0 H GLY A 138 -0.959 -14.109 4.603 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -0.940 -11.831 4.646 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -0.842 -11.817 6.396 1.00 0.00 H new ATOM 1871 N ALA A 139 1.608 -11.357 6.426 1.00 0.00 N ATOM 1872 CA ALA A 139 3.043 -11.111 6.609 1.00 0.00 C ATOM 1873 C ALA A 139 3.568 -11.938 7.800 1.00 0.00 C ATOM 1874 O ALA A 139 3.967 -11.406 8.838 1.00 0.00 O ATOM 1875 CB ALA A 139 3.298 -9.605 6.758 1.00 0.00 C ATOM 0 H ALA A 139 1.044 -10.946 7.170 1.00 0.00 H new ATOM 0 HA ALA A 139 3.599 -11.438 5.730 1.00 0.00 H new ATOM 0 HB1 ALA A 139 4.365 -9.428 6.894 1.00 0.00 H new ATOM 0 HB2 ALA A 139 2.956 -9.088 5.862 1.00 0.00 H new ATOM 0 HB3 ALA A 139 2.755 -9.228 7.625 1.00 0.00 H new ATOM 1881 N THR A 140 3.532 -13.266 7.636 1.00 0.00 N ATOM 1882 CA THR A 140 4.085 -14.253 8.585 1.00 0.00 C ATOM 1883 C THR A 140 5.622 -14.317 8.556 1.00 0.00 C ATOM 1884 O THR A 140 6.231 -14.876 9.467 1.00 0.00 O ATOM 1885 CB THR A 140 3.415 -15.614 8.334 1.00 0.00 C ATOM 1886 OG1 THR A 140 3.753 -16.514 9.366 1.00 0.00 O ATOM 1887 CG2 THR A 140 3.769 -16.242 6.979 1.00 0.00 C ATOM 0 H THR A 140 3.106 -13.701 6.817 1.00 0.00 H new ATOM 0 HA THR A 140 3.852 -13.935 9.601 1.00 0.00 H new ATOM 0 HB THR A 140 2.342 -15.422 8.320 1.00 0.00 H new ATOM 0 HG1 THR A 140 4.662 -16.326 9.679 1.00 0.00 H new ATOM 0 HG21 THR A 140 3.258 -17.199 6.877 1.00 0.00 H new ATOM 0 HG22 THR A 140 3.455 -15.575 6.176 1.00 0.00 H new ATOM 0 HG23 THR A 140 4.846 -16.398 6.921 1.00 0.00 H new ATOM 1895 N GLU A 141 6.245 -13.748 7.522 1.00 0.00 N ATOM 1896 CA GLU A 141 7.695 -13.565 7.385 1.00 0.00 C ATOM 1897 C GLU A 141 8.222 -12.433 8.307 1.00 0.00 C ATOM 1898 O GLU A 141 7.446 -11.552 8.697 1.00 0.00 O ATOM 1899 CB GLU A 141 8.009 -13.249 5.913 1.00 0.00 C ATOM 1900 CG GLU A 141 7.709 -14.393 4.934 1.00 0.00 C ATOM 1901 CD GLU A 141 8.672 -15.573 5.113 1.00 0.00 C ATOM 1902 OE1 GLU A 141 9.767 -15.555 4.503 1.00 0.00 O ATOM 1903 OE2 GLU A 141 8.330 -16.530 5.847 1.00 0.00 O1- ATOM 0 H GLU A 141 5.731 -13.385 6.720 1.00 0.00 H new ATOM 0 HA GLU A 141 8.198 -14.482 7.691 1.00 0.00 H new ATOM 0 HB2 GLU A 141 7.435 -12.372 5.613 1.00 0.00 H new ATOM 0 HB3 GLU A 141 9.063 -12.984 5.829 1.00 0.00 H new ATOM 0 HG2 GLU A 141 6.685 -14.736 5.081 1.00 0.00 H new ATOM 0 HG3 GLU A 141 7.777 -14.022 3.911 1.00 0.00 H new ATOM 1910 N PRO A 142 9.528 -12.422 8.654 1.00 0.00 N ATOM 1911 CA PRO A 142 10.133 -11.421 9.536 1.00 0.00 C ATOM 1912 C PRO A 142 10.360 -10.063 8.843 1.00 0.00 C ATOM 1913 O PRO A 142 10.037 -9.870 7.669 1.00 0.00 O ATOM 1914 CB PRO A 142 11.444 -12.067 10.009 1.00 0.00 C ATOM 1915 CG PRO A 142 11.852 -12.931 8.819 1.00 0.00 C ATOM 1916 CD PRO A 142 10.507 -13.450 8.318 1.00 0.00 C ATOM 0 HA PRO A 142 9.475 -11.172 10.369 1.00 0.00 H new ATOM 0 HB2 PRO A 142 12.201 -11.318 10.242 1.00 0.00 H new ATOM 0 HB3 PRO A 142 11.298 -12.664 10.909 1.00 0.00 H new ATOM 0 HG2 PRO A 142 12.374 -12.353 8.057 1.00 0.00 H new ATOM 0 HG3 PRO A 142 12.517 -13.743 9.115 1.00 0.00 H new ATOM 0 HD2 PRO A 142 10.533 -13.627 7.243 1.00 0.00 H new ATOM 0 HD3 PRO A 142 10.254 -14.399 8.791 1.00 0.00 H new ATOM 1924 N ASP A 143 10.967 -9.120 9.579 1.00 0.00 N ATOM 1925 CA ASP A 143 11.311 -7.759 9.125 1.00 0.00 C ATOM 1926 C ASP A 143 12.267 -7.719 7.912 1.00 0.00 C ATOM 1927 O ASP A 143 12.422 -6.672 7.284 1.00 0.00 O ATOM 1928 CB ASP A 143 11.953 -6.980 10.286 1.00 0.00 C ATOM 1929 CG ASP A 143 11.004 -6.742 11.468 1.00 0.00 C ATOM 1930 OD1 ASP A 143 9.977 -6.048 11.290 1.00 0.00 O ATOM 1931 OD2 ASP A 143 11.323 -7.228 12.579 1.00 0.00 O1- ATOM 0 H ASP A 143 11.244 -9.289 10.546 1.00 0.00 H new ATOM 0 HA ASP A 143 10.375 -7.304 8.802 1.00 0.00 H new ATOM 0 HB2 ASP A 143 12.828 -7.526 10.638 1.00 0.00 H new ATOM 0 HB3 ASP A 143 12.306 -6.018 9.915 1.00 0.00 H new ATOM 1936 N ASP A 144 12.883 -8.854 7.556 1.00 0.00 N ATOM 1937 CA ASP A 144 13.702 -9.033 6.349 1.00 0.00 C ATOM 1938 C ASP A 144 12.918 -8.762 5.047 1.00 0.00 C ATOM 1939 O ASP A 144 13.516 -8.378 4.040 1.00 0.00 O ATOM 1940 CB ASP A 144 14.275 -10.461 6.354 1.00 0.00 C ATOM 1941 CG ASP A 144 15.352 -10.676 5.276 1.00 0.00 C ATOM 1942 OD1 ASP A 144 15.194 -11.597 4.440 1.00 0.00 O ATOM 1943 OD2 ASP A 144 16.380 -9.956 5.299 1.00 0.00 O1- ATOM 0 H ASP A 144 12.823 -9.702 8.119 1.00 0.00 H new ATOM 0 HA ASP A 144 14.508 -8.299 6.371 1.00 0.00 H new ATOM 0 HB2 ASP A 144 14.702 -10.673 7.334 1.00 0.00 H new ATOM 0 HB3 ASP A 144 13.465 -11.173 6.198 1.00 0.00 H new ATOM 1948 N GLU A 145 11.585 -8.907 5.086 1.00 0.00 N ATOM 1949 CA GLU A 145 10.676 -8.466 4.022 1.00 0.00 C ATOM 1950 C GLU A 145 10.377 -6.961 4.173 1.00 0.00 C ATOM 1951 O GLU A 145 10.823 -6.159 3.349 1.00 0.00 O ATOM 1952 CB GLU A 145 9.380 -9.299 4.029 1.00 0.00 C ATOM 1953 CG GLU A 145 9.579 -10.812 3.860 1.00 0.00 C ATOM 1954 CD GLU A 145 10.285 -11.205 2.549 1.00 0.00 C ATOM 1955 OE1 GLU A 145 11.533 -11.333 2.540 1.00 0.00 O ATOM 1956 OE2 GLU A 145 9.590 -11.442 1.532 1.00 0.00 O1- ATOM 0 H GLU A 145 11.102 -9.342 5.872 1.00 0.00 H new ATOM 0 HA GLU A 145 11.160 -8.623 3.058 1.00 0.00 H new ATOM 0 HB2 GLU A 145 8.856 -9.120 4.968 1.00 0.00 H new ATOM 0 HB3 GLU A 145 8.732 -8.942 3.229 1.00 0.00 H new ATOM 0 HG2 GLU A 145 10.161 -11.188 4.702 1.00 0.00 H new ATOM 0 HG3 GLU A 145 8.607 -11.303 3.899 1.00 0.00 H new ATOM 1963 N ARG A 146 9.675 -6.579 5.257 1.00 0.00 N ATOM 1964 CA ARG A 146 9.431 -5.185 5.679 1.00 0.00 C ATOM 1965 C ARG A 146 8.830 -5.091 7.091 1.00 0.00 C ATOM 1966 O ARG A 146 9.318 -4.303 7.900 1.00 0.00 O ATOM 1967 CB ARG A 146 8.538 -4.427 4.666 1.00 0.00 C ATOM 1968 CG ARG A 146 8.425 -2.917 4.952 1.00 0.00 C ATOM 1969 CD ARG A 146 9.729 -2.146 4.708 1.00 0.00 C ATOM 1970 NE ARG A 146 9.689 -0.819 5.352 1.00 0.00 N ATOM 1971 CZ ARG A 146 10.583 0.153 5.208 1.00 0.00 C ATOM 1972 NH1 ARG A 146 11.596 0.055 4.371 1.00 0.00 N1+ ATOM 1973 NH2 ARG A 146 10.464 1.257 5.914 1.00 0.00 N ATOM 0 H ARG A 146 9.246 -7.257 5.887 1.00 0.00 H new ATOM 0 HA ARG A 146 10.409 -4.705 5.705 1.00 0.00 H new ATOM 0 HB2 ARG A 146 8.940 -4.569 3.663 1.00 0.00 H new ATOM 0 HB3 ARG A 146 7.540 -4.866 4.675 1.00 0.00 H new ATOM 0 HG2 ARG A 146 7.640 -2.495 4.324 1.00 0.00 H new ATOM 0 HG3 ARG A 146 8.117 -2.774 5.988 1.00 0.00 H new ATOM 0 HD2 ARG A 146 10.572 -2.718 5.097 1.00 0.00 H new ATOM 0 HD3 ARG A 146 9.891 -2.029 3.636 1.00 0.00 H new ATOM 0 HE ARG A 146 8.898 -0.630 5.968 1.00 0.00 H new ATOM 0 HH11 ARG A 146 11.713 -0.787 3.808 1.00 0.00 H new ATOM 0 HH12 ARG A 146 12.264 0.822 4.286 1.00 0.00 H new ATOM 0 HH21 ARG A 146 9.688 1.363 6.568 1.00 0.00 H new ATOM 0 HH22 ARG A 146 11.147 2.007 5.808 1.00 0.00 H new ATOM 1987 N VAL A 147 7.783 -5.872 7.384 1.00 0.00 N ATOM 1988 CA VAL A 147 7.103 -5.914 8.697 1.00 0.00 C ATOM 1989 C VAL A 147 6.946 -7.353 9.200 1.00 0.00 C ATOM 1990 O VAL A 147 6.617 -8.255 8.429 1.00 0.00 O ATOM 1991 CB VAL A 147 5.723 -5.204 8.697 1.00 0.00 C ATOM 1992 CG1 VAL A 147 5.864 -3.710 8.362 1.00 0.00 C ATOM 1993 CG2 VAL A 147 4.680 -5.842 7.760 1.00 0.00 C ATOM 0 H VAL A 147 7.371 -6.510 6.703 1.00 0.00 H new ATOM 0 HA VAL A 147 7.751 -5.362 9.378 1.00 0.00 H new ATOM 0 HB VAL A 147 5.349 -5.327 9.713 1.00 0.00 H new ATOM 0 HG11 VAL A 147 4.880 -3.241 8.370 1.00 0.00 H new ATOM 0 HG12 VAL A 147 6.501 -3.229 9.104 1.00 0.00 H new ATOM 0 HG13 VAL A 147 6.311 -3.599 7.374 1.00 0.00 H new ATOM 0 HG21 VAL A 147 3.746 -5.284 7.822 1.00 0.00 H new ATOM 0 HG22 VAL A 147 5.049 -5.819 6.735 1.00 0.00 H new ATOM 0 HG23 VAL A 147 4.506 -6.875 8.059 1.00 0.00 H new ATOM 2003 N LEU A 148 7.169 -7.544 10.505 1.00 0.00 N ATOM 2004 CA LEU A 148 7.039 -8.821 11.221 1.00 0.00 C ATOM 2005 C LEU A 148 5.615 -9.083 11.754 1.00 0.00 C ATOM 2006 O LEU A 148 5.278 -10.234 12.031 1.00 0.00 O ATOM 2007 CB LEU A 148 8.114 -8.800 12.333 1.00 0.00 C ATOM 2008 CG LEU A 148 8.096 -9.951 13.368 1.00 0.00 C ATOM 2009 CD1 LEU A 148 9.528 -10.230 13.860 1.00 0.00 C ATOM 2010 CD2 LEU A 148 7.230 -9.613 14.602 1.00 0.00 C ATOM 0 H LEU A 148 7.457 -6.782 11.118 1.00 0.00 H new ATOM 0 HA LEU A 148 7.203 -9.658 10.543 1.00 0.00 H new ATOM 0 HB2 LEU A 148 9.093 -8.794 11.854 1.00 0.00 H new ATOM 0 HB3 LEU A 148 8.019 -7.859 12.875 1.00 0.00 H new ATOM 0 HG LEU A 148 7.671 -10.821 12.867 1.00 0.00 H new ATOM 0 HD11 LEU A 148 9.511 -11.041 14.588 1.00 0.00 H new ATOM 0 HD12 LEU A 148 10.154 -10.515 13.015 1.00 0.00 H new ATOM 0 HD13 LEU A 148 9.934 -9.332 14.326 1.00 0.00 H new ATOM 0 HD21 LEU A 148 7.248 -10.450 15.300 1.00 0.00 H new ATOM 0 HD22 LEU A 148 7.626 -8.724 15.092 1.00 0.00 H new ATOM 0 HD23 LEU A 148 6.204 -9.426 14.286 1.00 0.00 H new ATOM 2022 N GLY A 149 4.790 -8.037 11.916 1.00 0.00 N ATOM 2023 CA GLY A 149 3.496 -8.090 12.613 1.00 0.00 C ATOM 2024 C GLY A 149 2.432 -8.860 11.831 1.00 0.00 C ATOM 2025 O GLY A 149 2.200 -10.038 12.107 1.00 0.00 O ATOM 0 H GLY A 149 5.010 -7.108 11.557 1.00 0.00 H new ATOM 0 HA2 GLY A 149 3.633 -8.558 13.588 1.00 0.00 H new ATOM 0 HA3 GLY A 149 3.144 -7.074 12.793 1.00 0.00 H new ATOM 2029 N TRP A 150 1.799 -8.195 10.859 1.00 0.00 N ATOM 2030 CA TRP A 150 0.853 -8.783 9.897 1.00 0.00 C ATOM 2031 C TRP A 150 0.485 -7.818 8.757 1.00 0.00 C ATOM 2032 O TRP A 150 0.742 -6.616 8.823 1.00 0.00 O ATOM 2033 CB TRP A 150 -0.399 -9.386 10.580 1.00 0.00 C ATOM 2034 CG TRP A 150 -1.078 -8.585 11.653 1.00 0.00 C ATOM 2035 CD1 TRP A 150 -1.155 -8.977 12.943 1.00 0.00 C ATOM 2036 CD2 TRP A 150 -1.791 -7.305 11.584 1.00 0.00 C ATOM 2037 NE1 TRP A 150 -1.854 -8.041 13.677 1.00 0.00 N ATOM 2038 CE2 TRP A 150 -2.249 -6.979 12.899 1.00 0.00 C ATOM 2039 CE3 TRP A 150 -2.091 -6.369 10.567 1.00 0.00 C ATOM 2040 CZ2 TRP A 150 -2.939 -5.795 13.194 1.00 0.00 C ATOM 2041 CZ3 TRP A 150 -2.746 -5.156 10.862 1.00 0.00 C ATOM 2042 CH2 TRP A 150 -3.178 -4.868 12.167 1.00 0.00 C ATOM 0 H TRP A 150 1.935 -7.195 10.713 1.00 0.00 H new ATOM 0 HA TRP A 150 1.382 -9.616 9.435 1.00 0.00 H new ATOM 0 HB2 TRP A 150 -1.135 -9.593 9.803 1.00 0.00 H new ATOM 0 HB3 TRP A 150 -0.113 -10.345 11.011 1.00 0.00 H new ATOM 0 HD1 TRP A 150 -0.732 -9.888 13.341 1.00 0.00 H new ATOM 0 HE1 TRP A 150 -2.053 -8.127 14.674 1.00 0.00 H new ATOM 0 HE3 TRP A 150 -1.813 -6.587 9.546 1.00 0.00 H new ATOM 0 HZ2 TRP A 150 -3.283 -5.598 14.199 1.00 0.00 H new ATOM 0 HZ3 TRP A 150 -2.918 -4.438 10.074 1.00 0.00 H new ATOM 0 HH2 TRP A 150 -3.690 -3.941 12.379 1.00 0.00 H new ATOM 2053 N VAL A 151 -0.144 -8.372 7.716 1.00 0.00 N ATOM 2054 CA VAL A 151 -0.687 -7.680 6.540 1.00 0.00 C ATOM 2055 C VAL A 151 -1.924 -8.457 6.078 1.00 0.00 C ATOM 2056 O VAL A 151 -1.845 -9.671 5.907 1.00 0.00 O ATOM 2057 CB VAL A 151 0.347 -7.573 5.387 1.00 0.00 C ATOM 2058 CG1 VAL A 151 -0.280 -7.122 4.056 1.00 0.00 C ATOM 2059 CG2 VAL A 151 1.493 -6.613 5.756 1.00 0.00 C ATOM 0 H VAL A 151 -0.298 -9.379 7.668 1.00 0.00 H new ATOM 0 HA VAL A 151 -0.944 -6.657 6.814 1.00 0.00 H new ATOM 0 HB VAL A 151 0.738 -8.581 5.247 1.00 0.00 H new ATOM 0 HG11 VAL A 151 0.493 -7.066 3.290 1.00 0.00 H new ATOM 0 HG12 VAL A 151 -1.042 -7.839 3.751 1.00 0.00 H new ATOM 0 HG13 VAL A 151 -0.736 -6.140 4.183 1.00 0.00 H new ATOM 0 HG21 VAL A 151 2.202 -6.558 4.930 1.00 0.00 H new ATOM 0 HG22 VAL A 151 1.087 -5.621 5.953 1.00 0.00 H new ATOM 0 HG23 VAL A 151 2.002 -6.980 6.647 1.00 0.00 H new ATOM 2069 N GLU A 152 -3.052 -7.777 5.884 1.00 0.00 N ATOM 2070 CA GLU A 152 -4.271 -8.342 5.288 1.00 0.00 C ATOM 2071 C GLU A 152 -4.402 -7.852 3.836 1.00 0.00 C ATOM 2072 O GLU A 152 -3.852 -6.807 3.496 1.00 0.00 O ATOM 2073 CB GLU A 152 -5.488 -7.982 6.156 1.00 0.00 C ATOM 2074 CG GLU A 152 -6.653 -8.961 5.948 1.00 0.00 C ATOM 2075 CD GLU A 152 -7.716 -8.902 7.059 1.00 0.00 C ATOM 2076 OE1 GLU A 152 -8.904 -9.134 6.739 1.00 0.00 O ATOM 2077 OE2 GLU A 152 -7.368 -8.749 8.253 1.00 0.00 O1- ATOM 0 H GLU A 152 -3.151 -6.795 6.141 1.00 0.00 H new ATOM 0 HA GLU A 152 -4.216 -9.430 5.258 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -5.197 -7.983 7.206 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -5.817 -6.971 5.917 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -7.129 -8.748 4.991 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -6.258 -9.975 5.889 1.00 0.00 H new ATOM 2084 N LEU A 153 -5.070 -8.619 2.962 1.00 0.00 N ATOM 2085 CA LEU A 153 -4.874 -8.533 1.504 1.00 0.00 C ATOM 2086 C LEU A 153 -6.065 -9.087 0.695 1.00 0.00 C ATOM 2087 O LEU A 153 -5.946 -10.076 -0.029 1.00 0.00 O ATOM 2088 CB LEU A 153 -3.492 -9.131 1.124 1.00 0.00 C ATOM 2089 CG LEU A 153 -3.000 -10.398 1.870 1.00 0.00 C ATOM 2090 CD1 LEU A 153 -3.940 -11.610 1.768 1.00 0.00 C ATOM 2091 CD2 LEU A 153 -1.617 -10.798 1.336 1.00 0.00 C ATOM 0 H LEU A 153 -5.760 -9.315 3.243 1.00 0.00 H new ATOM 0 HA LEU A 153 -4.854 -7.482 1.216 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -3.513 -9.361 0.059 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -2.744 -8.351 1.267 1.00 0.00 H new ATOM 0 HG LEU A 153 -2.967 -10.125 2.925 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -3.514 -12.448 2.320 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -4.911 -11.354 2.191 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -4.062 -11.889 0.721 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -1.269 -11.689 1.859 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -1.686 -11.008 0.269 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -0.913 -9.982 1.501 1.00 0.00 H new ATOM 2103 N GLU A 154 -7.230 -8.443 0.820 1.00 0.00 N ATOM 2104 CA GLU A 154 -8.497 -8.890 0.230 1.00 0.00 C ATOM 2105 C GLU A 154 -9.021 -7.879 -0.816 1.00 0.00 C ATOM 2106 O GLU A 154 -9.477 -6.777 -0.490 1.00 0.00 O ATOM 2107 CB GLU A 154 -9.504 -9.132 1.373 1.00 0.00 C ATOM 2108 CG GLU A 154 -10.460 -10.300 1.108 1.00 0.00 C ATOM 2109 CD GLU A 154 -9.736 -11.652 1.137 1.00 0.00 C ATOM 2110 OE1 GLU A 154 -9.234 -12.056 2.216 1.00 0.00 O ATOM 2111 OE2 GLU A 154 -9.691 -12.328 0.079 1.00 0.00 O1- ATOM 0 H GLU A 154 -7.321 -7.575 1.347 1.00 0.00 H new ATOM 0 HA GLU A 154 -8.348 -9.823 -0.313 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -8.956 -9.324 2.295 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -10.087 -8.225 1.531 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -11.253 -10.297 1.856 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -10.937 -10.165 0.137 1.00 0.00 H new ATOM 2118 N LEU A 155 -8.970 -8.271 -2.094 1.00 0.00 N ATOM 2119 CA LEU A 155 -9.252 -7.439 -3.275 1.00 0.00 C ATOM 2120 C LEU A 155 -9.350 -8.296 -4.555 1.00 0.00 C ATOM 2121 O LEU A 155 -9.187 -9.518 -4.509 1.00 0.00 O ATOM 2122 CB LEU A 155 -8.214 -6.291 -3.406 1.00 0.00 C ATOM 2123 CG LEU A 155 -6.754 -6.720 -3.701 1.00 0.00 C ATOM 2124 CD1 LEU A 155 -6.021 -5.583 -4.439 1.00 0.00 C ATOM 2125 CD2 LEU A 155 -5.975 -7.133 -2.439 1.00 0.00 C ATOM 0 H LEU A 155 -8.718 -9.226 -2.348 1.00 0.00 H new ATOM 0 HA LEU A 155 -10.227 -6.972 -3.139 1.00 0.00 H new ATOM 0 HB2 LEU A 155 -8.542 -5.622 -4.201 1.00 0.00 H new ATOM 0 HB3 LEU A 155 -8.222 -5.715 -2.481 1.00 0.00 H new ATOM 0 HG LEU A 155 -6.801 -7.607 -4.332 1.00 0.00 H new ATOM 0 HD11 LEU A 155 -4.995 -5.886 -4.646 1.00 0.00 H new ATOM 0 HD12 LEU A 155 -6.532 -5.369 -5.378 1.00 0.00 H new ATOM 0 HD13 LEU A 155 -6.017 -4.688 -3.816 1.00 0.00 H new ATOM 0 HD21 LEU A 155 -4.961 -7.422 -2.716 1.00 0.00 H new ATOM 0 HD22 LEU A 155 -5.937 -6.294 -1.744 1.00 0.00 H new ATOM 0 HD23 LEU A 155 -6.475 -7.976 -1.962 1.00 0.00 H new ATOM 2137 N SER A 156 -9.588 -7.662 -5.706 1.00 0.00 N ATOM 2138 CA SER A 156 -9.474 -8.313 -7.025 1.00 0.00 C ATOM 2139 C SER A 156 -8.005 -8.605 -7.414 1.00 0.00 C ATOM 2140 O SER A 156 -7.068 -8.196 -6.729 1.00 0.00 O ATOM 2141 CB SER A 156 -10.179 -7.453 -8.090 1.00 0.00 C ATOM 2142 OG SER A 156 -10.315 -8.169 -9.312 1.00 0.00 O ATOM 0 H SER A 156 -9.866 -6.682 -5.756 1.00 0.00 H new ATOM 0 HA SER A 156 -9.969 -9.282 -6.966 1.00 0.00 H new ATOM 0 HB2 SER A 156 -11.162 -7.153 -7.728 1.00 0.00 H new ATOM 0 HB3 SER A 156 -9.610 -6.539 -8.261 1.00 0.00 H new ATOM 0 HG SER A 156 -10.767 -7.604 -9.973 1.00 0.00 H new ATOM 2148 N HIS A 157 -7.768 -9.308 -8.526 1.00 0.00 N ATOM 2149 CA HIS A 157 -6.443 -9.831 -8.903 1.00 0.00 C ATOM 2150 C HIS A 157 -5.369 -8.750 -9.182 1.00 0.00 C ATOM 2151 O HIS A 157 -4.175 -9.051 -9.131 1.00 0.00 O ATOM 2152 CB HIS A 157 -6.612 -10.742 -10.129 1.00 0.00 C ATOM 2153 CG HIS A 157 -7.450 -11.969 -9.862 1.00 0.00 C ATOM 2154 ND1 HIS A 157 -7.040 -13.107 -9.202 1.00 0.00 N ATOM 2155 CD2 HIS A 157 -8.754 -12.165 -10.232 1.00 0.00 C ATOM 2156 CE1 HIS A 157 -8.073 -13.966 -9.173 1.00 0.00 C ATOM 2157 NE2 HIS A 157 -9.148 -13.437 -9.789 1.00 0.00 N ATOM 0 H HIS A 157 -8.498 -9.535 -9.201 1.00 0.00 H new ATOM 0 HA HIS A 157 -6.066 -10.380 -8.041 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -7.069 -10.169 -10.936 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -5.627 -11.054 -10.477 1.00 0.00 H new ATOM 0 HD2 HIS A 157 -9.372 -11.462 -10.771 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -8.045 -14.945 -8.719 1.00 0.00 H new ATOM 0 HE2 HIS A 157 -10.063 -13.873 -9.909 1.00 0.00 H new ATOM 2165 N HIS A 158 -5.797 -7.516 -9.477 1.00 0.00 N ATOM 2166 CA HIS A 158 -4.999 -6.329 -9.825 1.00 0.00 C ATOM 2167 C HIS A 158 -4.508 -6.371 -11.299 1.00 0.00 C ATOM 2168 O HIS A 158 -4.061 -7.409 -11.806 1.00 0.00 O ATOM 2169 CB HIS A 158 -3.869 -6.064 -8.809 1.00 0.00 C ATOM 2170 CG HIS A 158 -3.319 -4.659 -8.895 1.00 0.00 C ATOM 2171 ND1 HIS A 158 -3.767 -3.559 -8.195 1.00 0.00 N ATOM 2172 CD2 HIS A 158 -2.294 -4.235 -9.698 1.00 0.00 C ATOM 2173 CE1 HIS A 158 -3.028 -2.500 -8.571 1.00 0.00 C ATOM 2174 NE2 HIS A 158 -2.111 -2.861 -9.488 1.00 0.00 N ATOM 0 H HIS A 158 -6.794 -7.302 -9.479 1.00 0.00 H new ATOM 0 HA HIS A 158 -5.660 -5.465 -9.755 1.00 0.00 H new ATOM 0 HB2 HIS A 158 -4.245 -6.241 -7.801 1.00 0.00 H new ATOM 0 HB3 HIS A 158 -3.061 -6.776 -8.978 1.00 0.00 H new ATOM 0 HD2 HIS A 158 -1.724 -4.853 -10.376 1.00 0.00 H new ATOM 0 HE1 HIS A 158 -3.153 -1.497 -8.189 1.00 0.00 H new ATOM 0 HE2 HIS A 158 -1.423 -2.258 -9.938 1.00 0.00 H new ATOM 2182 N GLY A 159 -4.613 -5.227 -11.996 1.00 0.00 N ATOM 2183 CA GLY A 159 -4.248 -5.078 -13.418 1.00 0.00 C ATOM 2184 C GLY A 159 -5.398 -5.280 -14.416 1.00 0.00 C ATOM 2185 O GLY A 159 -5.230 -4.919 -15.583 1.00 0.00 O ATOM 0 H GLY A 159 -4.960 -4.363 -11.580 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -3.831 -4.082 -13.566 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -3.458 -5.792 -13.650 1.00 0.00 H new ATOM 2189 N THR A 160 -6.555 -5.807 -13.979 1.00 0.00 N ATOM 2190 CA THR A 160 -7.770 -6.024 -14.798 1.00 0.00 C ATOM 2191 C THR A 160 -9.038 -5.665 -14.016 1.00 0.00 C ATOM 2192 O THR A 160 -9.288 -6.232 -12.953 1.00 0.00 O ATOM 2193 CB THR A 160 -7.866 -7.476 -15.306 1.00 0.00 C ATOM 2194 OG1 THR A 160 -7.635 -8.393 -14.260 1.00 0.00 O ATOM 2195 CG2 THR A 160 -6.857 -7.772 -16.418 1.00 0.00 C ATOM 0 H THR A 160 -6.679 -6.106 -13.012 1.00 0.00 H new ATOM 0 HA THR A 160 -7.688 -5.364 -15.661 1.00 0.00 H new ATOM 0 HB THR A 160 -8.876 -7.588 -15.699 1.00 0.00 H new ATOM 0 HG1 THR A 160 -8.104 -8.094 -13.453 1.00 0.00 H new ATOM 0 HG21 THR A 160 -6.965 -8.807 -16.741 1.00 0.00 H new ATOM 0 HG22 THR A 160 -7.040 -7.107 -17.262 1.00 0.00 H new ATOM 0 HG23 THR A 160 -5.846 -7.613 -16.044 1.00 0.00 H new ATOM 2203 N LEU A 161 -9.840 -4.745 -14.574 1.00 0.00 N ATOM 2204 CA LEU A 161 -11.214 -4.382 -14.163 1.00 0.00 C ATOM 2205 C LEU A 161 -11.368 -4.123 -12.645 1.00 0.00 C ATOM 2206 O LEU A 161 -12.014 -4.879 -11.914 1.00 0.00 O ATOM 2207 CB LEU A 161 -12.226 -5.410 -14.734 1.00 0.00 C ATOM 2208 CG LEU A 161 -12.659 -5.220 -16.207 1.00 0.00 C ATOM 2209 CD1 LEU A 161 -13.478 -3.932 -16.396 1.00 0.00 C ATOM 2210 CD2 LEU A 161 -11.494 -5.247 -17.208 1.00 0.00 C ATOM 0 H LEU A 161 -9.530 -4.197 -15.376 1.00 0.00 H new ATOM 0 HA LEU A 161 -11.446 -3.412 -14.602 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -11.793 -6.405 -14.633 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -13.121 -5.387 -14.112 1.00 0.00 H new ATOM 0 HG LEU A 161 -13.286 -6.084 -16.427 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -13.764 -3.833 -17.443 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -14.375 -3.977 -15.778 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -12.877 -3.072 -16.101 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -11.879 -5.107 -18.218 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -10.793 -4.446 -16.973 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -10.982 -6.207 -17.144 1.00 0.00 H new ATOM 2222 N LEU A 162 -10.781 -3.015 -12.175 1.00 0.00 N ATOM 2223 CA LEU A 162 -10.742 -2.605 -10.760 1.00 0.00 C ATOM 2224 C LEU A 162 -11.808 -1.536 -10.441 1.00 0.00 C ATOM 2225 O LEU A 162 -11.491 -0.422 -10.010 1.00 0.00 O ATOM 2226 CB LEU A 162 -9.304 -2.162 -10.402 1.00 0.00 C ATOM 2227 CG LEU A 162 -8.186 -3.159 -10.775 1.00 0.00 C ATOM 2228 CD1 LEU A 162 -6.834 -2.589 -10.319 1.00 0.00 C ATOM 2229 CD2 LEU A 162 -8.394 -4.557 -10.170 1.00 0.00 C ATOM 0 H LEU A 162 -10.303 -2.355 -12.788 1.00 0.00 H new ATOM 0 HA LEU A 162 -10.999 -3.455 -10.127 1.00 0.00 H new ATOM 0 HB2 LEU A 162 -9.101 -1.214 -10.899 1.00 0.00 H new ATOM 0 HB3 LEU A 162 -9.257 -1.976 -9.329 1.00 0.00 H new ATOM 0 HG LEU A 162 -8.210 -3.284 -11.858 1.00 0.00 H new ATOM 0 HD11 LEU A 162 -6.038 -3.287 -10.579 1.00 0.00 H new ATOM 0 HD12 LEU A 162 -6.656 -1.635 -10.815 1.00 0.00 H new ATOM 0 HD13 LEU A 162 -6.848 -2.440 -9.239 1.00 0.00 H new ATOM 0 HD21 LEU A 162 -7.574 -5.209 -10.470 1.00 0.00 H new ATOM 0 HD22 LEU A 162 -8.419 -4.483 -9.083 1.00 0.00 H new ATOM 0 HD23 LEU A 162 -9.337 -4.971 -10.527 1.00 0.00 H new ATOM 2241 N ARG A 163 -13.085 -1.858 -10.695 1.00 0.00 N ATOM 2242 CA ARG A 163 -14.226 -0.946 -10.499 1.00 0.00 C ATOM 2243 C ARG A 163 -15.461 -1.664 -9.929 1.00 0.00 C ATOM 2244 O ARG A 163 -15.738 -2.814 -10.276 1.00 0.00 O ATOM 2245 CB ARG A 163 -14.564 -0.222 -11.822 1.00 0.00 C ATOM 2246 CG ARG A 163 -14.808 1.279 -11.595 1.00 0.00 C ATOM 2247 CD ARG A 163 -13.488 2.059 -11.473 1.00 0.00 C ATOM 2248 NE ARG A 163 -13.612 3.190 -10.536 1.00 0.00 N ATOM 2249 CZ ARG A 163 -13.248 3.200 -9.259 1.00 0.00 C ATOM 2250 NH1 ARG A 163 -12.660 2.167 -8.690 1.00 0.00 N1+ ATOM 2251 NH2 ARG A 163 -13.484 4.271 -8.533 1.00 0.00 N ATOM 0 H ARG A 163 -13.360 -2.774 -11.048 1.00 0.00 H new ATOM 0 HA ARG A 163 -13.929 -0.205 -9.757 1.00 0.00 H new ATOM 0 HB2 ARG A 163 -13.747 -0.356 -12.531 1.00 0.00 H new ATOM 0 HB3 ARG A 163 -15.450 -0.673 -12.269 1.00 0.00 H new ATOM 0 HG2 ARG A 163 -15.393 1.681 -12.422 1.00 0.00 H new ATOM 0 HG3 ARG A 163 -15.398 1.419 -10.689 1.00 0.00 H new ATOM 0 HD2 ARG A 163 -12.699 1.389 -11.133 1.00 0.00 H new ATOM 0 HD3 ARG A 163 -13.191 2.429 -12.454 1.00 0.00 H new ATOM 0 HE ARG A 163 -14.018 4.050 -10.905 1.00 0.00 H new ATOM 0 HH11 ARG A 163 -12.471 1.325 -9.233 1.00 0.00 H new ATOM 0 HH12 ARG A 163 -12.394 2.210 -7.706 1.00 0.00 H new ATOM 0 HH21 ARG A 163 -13.941 5.081 -8.952 1.00 0.00 H new ATOM 0 HH22 ARG A 163 -13.210 4.292 -7.551 1.00 0.00 H new ATOM 2265 N GLY A 164 -16.198 -0.973 -9.050 1.00 0.00 N ATOM 2266 CA GLY A 164 -17.362 -1.488 -8.312 1.00 0.00 C ATOM 2267 C GLY A 164 -18.683 -1.099 -8.973 1.00 0.00 C ATOM 2268 O GLY A 164 -19.032 0.090 -9.007 1.00 0.00 O ATOM 0 H GLY A 164 -15.992 0.000 -8.823 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -17.297 -2.574 -8.246 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -17.342 -1.105 -7.292 1.00 0.00 H new