USER MOD reduce.3.24.130724 H: found=0, std=0, add=680, rem=0, adj=0 USER MOD reduce.3.24.130724 removed 680 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 Single : A 31 ASN : amide:sc= -2.72 X(o=-2.7,f=-3!) USER MOD Single : A 37 HIS : no HD1:sc= -9.79! C(o=-9.8!,f=-11!) USER MOD Single : B 31 ASN : amide:sc= -2.63 X(o=-2.6,f=-2.9!) USER MOD Single : B 37 HIS : no HD1:sc= -9.83! C(o=-9.8!,f=-12!) USER MOD Single : C 31 ASN : amide:sc= -2.71 X(o=-2.7,f=-3.2!) USER MOD Single : C 37 HIS : no HD1:sc= -9.48! C(o=-9.5!,f=-11!) USER MOD Single : D 31 ASN : amide:sc= -2.71 X(o=-2.7,f=-2.8!) USER MOD Single : D 37 HIS : no HD1:sc= -9.69! C(o=-9.7!,f=-11!) USER MOD ----------------------------------------------------------------- ATOM 107 N VAL A 27 -1.213 12.806 -4.493 1.00 0.00 N ATOM 108 CA VAL A 27 -2.019 12.434 -3.331 1.00 0.00 C ATOM 109 C VAL A 27 -3.277 11.675 -3.741 1.00 0.00 C ATOM 110 O VAL A 27 -3.569 10.605 -3.207 1.00 0.00 O ATOM 111 CB VAL A 27 -2.430 13.697 -2.570 1.00 0.00 C ATOM 112 CG1 VAL A 27 -3.282 13.313 -1.360 1.00 0.00 C ATOM 113 CG2 VAL A 27 -1.180 14.446 -2.108 1.00 0.00 C ATOM 0 HA VAL A 27 -1.414 11.784 -2.699 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.013 14.343 -3.227 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -3.573 14.214 -0.820 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -4.175 12.787 -1.696 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.706 12.665 -0.700 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.474 15.345 -1.566 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -0.592 13.803 -1.453 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -0.581 14.724 -2.975 1.00 0.00 H new ATOM 123 N VAL A 28 -4.020 12.231 -4.692 1.00 0.00 N ATOM 124 CA VAL A 28 -5.242 11.590 -5.160 1.00 0.00 C ATOM 125 C VAL A 28 -4.905 10.346 -5.965 1.00 0.00 C ATOM 126 O VAL A 28 -5.532 9.297 -5.814 1.00 0.00 O ATOM 127 CB VAL A 28 -6.043 12.566 -6.019 1.00 0.00 C ATOM 128 CG1 VAL A 28 -5.219 12.992 -7.231 1.00 0.00 C ATOM 129 CG2 VAL A 28 -7.335 11.894 -6.489 1.00 0.00 C ATOM 0 H VAL A 28 -3.800 13.116 -5.150 1.00 0.00 H new ATOM 0 HA VAL A 28 -5.841 11.299 -4.297 1.00 0.00 H new ATOM 0 HB VAL A 28 -6.286 13.447 -5.425 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -5.798 13.688 -7.838 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -4.303 13.478 -6.895 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -4.967 12.114 -7.826 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -7.906 12.592 -7.102 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -7.092 11.009 -7.077 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -7.929 11.602 -5.623 1.00 0.00 H new ATOM 139 N ALA A 29 -3.906 10.482 -6.824 1.00 0.00 N ATOM 140 CA ALA A 29 -3.471 9.373 -7.668 1.00 0.00 C ATOM 141 C ALA A 29 -3.045 8.185 -6.817 1.00 0.00 C ATOM 142 O ALA A 29 -3.429 7.048 -7.087 1.00 0.00 O ATOM 143 CB ALA A 29 -2.296 9.811 -8.545 1.00 0.00 C ATOM 0 H ALA A 29 -3.381 11.346 -6.957 1.00 0.00 H new ATOM 0 HA ALA A 29 -4.309 9.076 -8.299 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -1.979 8.977 -9.171 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -2.605 10.643 -9.178 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -1.467 10.125 -7.912 1.00 0.00 H new ATOM 149 N ALA A 30 -2.250 8.454 -5.787 1.00 0.00 N ATOM 150 CA ALA A 30 -1.782 7.392 -4.907 1.00 0.00 C ATOM 151 C ALA A 30 -2.953 6.744 -4.181 1.00 0.00 C ATOM 152 O ALA A 30 -2.993 5.525 -4.011 1.00 0.00 O ATOM 153 CB ALA A 30 -0.794 7.958 -3.885 1.00 0.00 C ATOM 0 H ALA A 30 -1.920 9.388 -5.543 1.00 0.00 H new ATOM 0 HA ALA A 30 -1.283 6.636 -5.514 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -0.449 7.157 -3.231 1.00 0.00 H new ATOM 0 HB2 ALA A 30 0.058 8.394 -4.406 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -1.287 8.726 -3.289 1.00 0.00 H new ATOM 159 N ASN A 31 -3.908 7.564 -3.750 1.00 0.00 N ATOM 160 CA ASN A 31 -5.074 7.050 -3.041 1.00 0.00 C ATOM 161 C ASN A 31 -5.911 6.152 -3.945 1.00 0.00 C ATOM 162 O ASN A 31 -6.363 5.088 -3.531 1.00 0.00 O ATOM 163 CB ASN A 31 -5.939 8.209 -2.545 1.00 0.00 C ATOM 164 CG ASN A 31 -7.177 7.664 -1.841 1.00 0.00 C ATOM 165 OD1 ASN A 31 -7.061 6.951 -0.844 1.00 0.00 O ATOM 166 ND2 ASN A 31 -8.362 7.951 -2.306 1.00 0.00 N ATOM 0 H ASN A 31 -3.898 8.576 -3.878 1.00 0.00 H new ATOM 0 HA ASN A 31 -4.720 6.464 -2.193 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -5.367 8.836 -1.861 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -6.234 8.840 -3.384 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -9.194 7.585 -1.843 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -8.456 8.542 -3.132 1.00 0.00 H new ATOM 173 N ILE A 32 -6.116 6.587 -5.185 1.00 0.00 N ATOM 174 CA ILE A 32 -6.905 5.808 -6.131 1.00 0.00 C ATOM 175 C ILE A 32 -6.216 4.481 -6.434 1.00 0.00 C ATOM 176 O ILE A 32 -6.856 3.431 -6.470 1.00 0.00 O ATOM 177 CB ILE A 32 -7.098 6.603 -7.427 1.00 0.00 C ATOM 178 CG1 ILE A 32 -7.986 7.819 -7.145 1.00 0.00 C ATOM 179 CG2 ILE A 32 -7.774 5.720 -8.481 1.00 0.00 C ATOM 180 CD1 ILE A 32 -7.944 8.771 -8.340 1.00 0.00 C ATOM 0 H ILE A 32 -5.751 7.465 -5.554 1.00 0.00 H new ATOM 0 HA ILE A 32 -7.879 5.602 -5.687 1.00 0.00 H new ATOM 0 HB ILE A 32 -6.127 6.930 -7.798 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -9.011 7.498 -6.958 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -7.644 8.332 -6.246 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -7.909 6.290 -9.400 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -7.149 4.850 -8.682 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -8.746 5.392 -8.112 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -8.576 9.636 -8.139 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -6.919 9.102 -8.506 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -8.307 8.255 -9.229 1.00 0.00 H new ATOM 192 N ILE A 33 -4.908 4.538 -6.653 1.00 0.00 N ATOM 193 CA ILE A 33 -4.138 3.339 -6.954 1.00 0.00 C ATOM 194 C ILE A 33 -4.137 2.378 -5.762 1.00 0.00 C ATOM 195 O ILE A 33 -4.305 1.170 -5.930 1.00 0.00 O ATOM 196 CB ILE A 33 -2.702 3.727 -7.324 1.00 0.00 C ATOM 197 CG1 ILE A 33 -2.711 4.478 -8.661 1.00 0.00 C ATOM 198 CG2 ILE A 33 -1.843 2.467 -7.454 1.00 0.00 C ATOM 199 CD1 ILE A 33 -1.335 5.093 -8.926 1.00 0.00 C ATOM 0 H ILE A 33 -4.361 5.398 -6.628 1.00 0.00 H new ATOM 0 HA ILE A 33 -4.602 2.830 -7.798 1.00 0.00 H new ATOM 0 HB ILE A 33 -2.287 4.366 -6.545 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -2.975 3.796 -9.469 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -3.470 5.260 -8.643 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -0.823 2.748 -7.717 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.838 1.930 -6.505 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -2.255 1.825 -8.232 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -1.351 5.624 -9.878 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -1.088 5.790 -8.125 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -0.585 4.303 -8.964 1.00 0.00 H new ATOM 211 N GLY A 34 -3.945 2.920 -4.561 1.00 0.00 N ATOM 212 CA GLY A 34 -3.919 2.093 -3.357 1.00 0.00 C ATOM 213 C GLY A 34 -5.277 1.440 -3.110 1.00 0.00 C ATOM 214 O GLY A 34 -5.363 0.247 -2.814 1.00 0.00 O ATOM 0 H GLY A 34 -3.807 3.917 -4.396 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -3.154 1.323 -3.457 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -3.644 2.705 -2.498 1.00 0.00 H new ATOM 218 N ILE A 35 -6.336 2.229 -3.240 1.00 0.00 N ATOM 219 CA ILE A 35 -7.688 1.723 -3.036 1.00 0.00 C ATOM 220 C ILE A 35 -8.013 0.662 -4.083 1.00 0.00 C ATOM 221 O ILE A 35 -8.588 -0.384 -3.771 1.00 0.00 O ATOM 222 CB ILE A 35 -8.688 2.880 -3.111 1.00 0.00 C ATOM 223 CG1 ILE A 35 -8.482 3.800 -1.904 1.00 0.00 C ATOM 224 CG2 ILE A 35 -10.117 2.333 -3.094 1.00 0.00 C ATOM 225 CD1 ILE A 35 -9.200 5.129 -2.140 1.00 0.00 C ATOM 0 H ILE A 35 -6.286 3.218 -3.485 1.00 0.00 H new ATOM 0 HA ILE A 35 -7.757 1.264 -2.050 1.00 0.00 H new ATOM 0 HB ILE A 35 -8.529 3.438 -4.034 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -8.866 3.324 -1.002 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -7.418 3.974 -1.745 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -10.824 3.161 -3.148 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -10.264 1.674 -3.949 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -10.282 1.774 -2.173 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -9.051 5.781 -1.279 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -8.796 5.608 -3.032 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -10.266 4.947 -2.277 1.00 0.00 H new ATOM 237 N LEU A 36 -7.629 0.933 -5.324 1.00 0.00 N ATOM 238 CA LEU A 36 -7.874 -0.005 -6.412 1.00 0.00 C ATOM 239 C LEU A 36 -7.160 -1.321 -6.130 1.00 0.00 C ATOM 240 O LEU A 36 -7.685 -2.400 -6.418 1.00 0.00 O ATOM 241 CB LEU A 36 -7.391 0.593 -7.742 1.00 0.00 C ATOM 242 CG LEU A 36 -7.625 -0.411 -8.905 1.00 0.00 C ATOM 243 CD1 LEU A 36 -8.110 0.335 -10.158 1.00 0.00 C ATOM 244 CD2 LEU A 36 -6.315 -1.147 -9.246 1.00 0.00 C ATOM 0 H LEU A 36 -7.149 1.789 -5.601 1.00 0.00 H new ATOM 0 HA LEU A 36 -8.945 -0.195 -6.486 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -7.922 1.523 -7.944 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -6.331 0.839 -7.674 1.00 0.00 H new ATOM 0 HG LEU A 36 -8.379 -1.131 -8.588 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -8.271 -0.378 -10.967 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -9.045 0.849 -9.936 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -7.358 1.064 -10.461 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -6.493 -1.847 -10.062 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -5.559 -0.423 -9.548 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.965 -1.693 -8.370 1.00 0.00 H new ATOM 256 N HIS A 37 -5.964 -1.229 -5.557 1.00 0.00 N ATOM 257 CA HIS A 37 -5.198 -2.424 -5.239 1.00 0.00 C ATOM 258 C HIS A 37 -5.998 -3.317 -4.301 1.00 0.00 C ATOM 259 O HIS A 37 -6.021 -4.538 -4.458 1.00 0.00 O ATOM 260 CB HIS A 37 -3.878 -2.050 -4.566 1.00 0.00 C ATOM 261 CG HIS A 37 -3.100 -3.308 -4.290 1.00 0.00 C ATOM 262 ND1 HIS A 37 -1.876 -3.565 -4.879 1.00 0.00 N ATOM 263 CD2 HIS A 37 -3.376 -4.402 -3.508 1.00 0.00 C ATOM 264 CE1 HIS A 37 -1.468 -4.772 -4.449 1.00 0.00 C ATOM 265 NE2 HIS A 37 -2.344 -5.323 -3.612 1.00 0.00 N ATOM 0 H HIS A 37 -5.511 -0.350 -5.307 1.00 0.00 H new ATOM 0 HA HIS A 37 -4.989 -2.955 -6.167 1.00 0.00 H new ATOM 0 HB2 HIS A 37 -3.302 -1.384 -5.209 1.00 0.00 H new ATOM 0 HB3 HIS A 37 -4.067 -1.512 -3.637 1.00 0.00 H new ATOM 0 HD2 HIS A 37 -4.262 -4.527 -2.903 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -0.541 -5.238 -4.747 1.00 0.00 H new ATOM 0 HE2 HIS A 37 -2.272 -6.228 -3.147 1.00 0.00 H new ATOM 273 N LEU A 38 -6.656 -2.700 -3.326 1.00 0.00 N ATOM 274 CA LEU A 38 -7.456 -3.453 -2.366 1.00 0.00 C ATOM 275 C LEU A 38 -8.579 -4.209 -3.065 1.00 0.00 C ATOM 276 O LEU A 38 -8.886 -5.338 -2.702 1.00 0.00 O ATOM 277 CB LEU A 38 -8.039 -2.503 -1.297 1.00 0.00 C ATOM 278 CG LEU A 38 -7.063 -2.371 -0.106 1.00 0.00 C ATOM 279 CD1 LEU A 38 -7.327 -1.064 0.643 1.00 0.00 C ATOM 280 CD2 LEU A 38 -7.248 -3.554 0.862 1.00 0.00 C ATOM 0 H LEU A 38 -6.652 -1.691 -3.180 1.00 0.00 H new ATOM 0 HA LEU A 38 -6.807 -4.181 -1.879 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -8.224 -1.522 -1.735 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -8.999 -2.883 -0.948 1.00 0.00 H new ATOM 0 HG LEU A 38 -6.043 -2.372 -0.490 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.635 -0.979 1.481 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.183 -0.222 -0.034 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -8.351 -1.059 1.016 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.556 -3.452 1.698 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -8.271 -3.561 1.237 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -7.048 -4.488 0.337 1.00 0.00 H new ATOM 292 N ILE A 39 -9.200 -3.593 -4.057 1.00 0.00 N ATOM 293 CA ILE A 39 -10.291 -4.265 -4.749 1.00 0.00 C ATOM 294 C ILE A 39 -9.809 -5.590 -5.340 1.00 0.00 C ATOM 295 O ILE A 39 -10.437 -6.633 -5.140 1.00 0.00 O ATOM 296 CB ILE A 39 -10.827 -3.363 -5.866 1.00 0.00 C ATOM 297 CG1 ILE A 39 -11.440 -2.101 -5.243 1.00 0.00 C ATOM 298 CG2 ILE A 39 -11.901 -4.111 -6.663 1.00 0.00 C ATOM 299 CD1 ILE A 39 -11.786 -1.086 -6.341 1.00 0.00 C ATOM 0 H ILE A 39 -8.978 -2.657 -4.395 1.00 0.00 H new ATOM 0 HA ILE A 39 -11.088 -4.470 -4.035 1.00 0.00 H new ATOM 0 HB ILE A 39 -10.011 -3.086 -6.534 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -12.337 -2.362 -4.682 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -10.739 -1.658 -4.535 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -12.280 -3.467 -7.456 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -11.468 -5.010 -7.101 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -12.720 -4.389 -5.999 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -12.220 -0.194 -5.889 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -10.880 -0.814 -6.883 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -12.503 -1.528 -7.032 1.00 0.00 H new ATOM 311 N LEU A 40 -8.693 -5.548 -6.060 1.00 0.00 N ATOM 312 CA LEU A 40 -8.144 -6.760 -6.669 1.00 0.00 C ATOM 313 C LEU A 40 -7.595 -7.731 -5.616 1.00 0.00 C ATOM 314 O LEU A 40 -7.828 -8.939 -5.694 1.00 0.00 O ATOM 315 CB LEU A 40 -7.028 -6.379 -7.645 1.00 0.00 C ATOM 316 CG LEU A 40 -7.540 -5.315 -8.624 1.00 0.00 C ATOM 317 CD1 LEU A 40 -6.406 -4.906 -9.568 1.00 0.00 C ATOM 318 CD2 LEU A 40 -8.717 -5.874 -9.443 1.00 0.00 C ATOM 0 H LEU A 40 -8.154 -4.700 -6.236 1.00 0.00 H new ATOM 0 HA LEU A 40 -8.953 -7.265 -7.197 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -6.166 -5.998 -7.097 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.694 -7.260 -8.192 1.00 0.00 H new ATOM 0 HG LEU A 40 -7.881 -4.445 -8.062 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -6.768 -4.150 -10.265 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -5.578 -4.498 -8.987 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -6.064 -5.778 -10.125 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -9.073 -5.111 -10.135 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -8.387 -6.748 -10.005 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -9.525 -6.160 -8.770 1.00 0.00 H new ATOM 330 N TRP A 41 -6.860 -7.204 -4.639 1.00 0.00 N ATOM 331 CA TRP A 41 -6.276 -8.039 -3.591 1.00 0.00 C ATOM 332 C TRP A 41 -7.364 -8.669 -2.722 1.00 0.00 C ATOM 333 O TRP A 41 -7.239 -9.817 -2.292 1.00 0.00 O ATOM 334 CB TRP A 41 -5.302 -7.214 -2.740 1.00 0.00 C ATOM 335 CG TRP A 41 -4.778 -8.035 -1.602 1.00 0.00 C ATOM 336 CD1 TRP A 41 -3.723 -8.885 -1.664 1.00 0.00 C ATOM 337 CD2 TRP A 41 -5.232 -8.056 -0.221 1.00 0.00 C ATOM 338 NE1 TRP A 41 -3.522 -9.441 -0.414 1.00 0.00 N ATOM 339 CE2 TRP A 41 -4.424 -8.958 0.508 1.00 0.00 C ATOM 340 CE3 TRP A 41 -6.258 -7.387 0.460 1.00 0.00 C ATOM 341 CZ2 TRP A 41 -4.633 -9.184 1.864 1.00 0.00 C ATOM 342 CZ3 TRP A 41 -6.467 -7.611 1.828 1.00 0.00 C ATOM 343 CH2 TRP A 41 -5.657 -8.508 2.526 1.00 0.00 C ATOM 0 H TRP A 41 -6.655 -6.209 -4.551 1.00 0.00 H new ATOM 0 HA TRP A 41 -5.722 -8.850 -4.064 1.00 0.00 H new ATOM 0 HB2 TRP A 41 -4.474 -6.867 -3.358 1.00 0.00 H new ATOM 0 HB3 TRP A 41 -5.806 -6.328 -2.355 1.00 0.00 H new ATOM 0 HD1 TRP A 41 -3.136 -9.094 -2.546 1.00 0.00 H new ATOM 0 HE1 TRP A 41 -2.795 -10.124 -0.201 1.00 0.00 H new ATOM 0 HE3 TRP A 41 -6.892 -6.694 -0.073 1.00 0.00 H new ATOM 0 HZ2 TRP A 41 -4.005 -9.879 2.402 1.00 0.00 H new ATOM 0 HZ3 TRP A 41 -7.258 -7.087 2.344 1.00 0.00 H new ATOM 0 HH2 TRP A 41 -5.824 -8.679 3.579 1.00 0.00 H new ATOM 354 N ILE A 42 -8.435 -7.919 -2.474 1.00 0.00 N ATOM 355 CA ILE A 42 -9.543 -8.420 -1.663 1.00 0.00 C ATOM 356 C ILE A 42 -10.163 -9.644 -2.338 1.00 0.00 C ATOM 357 O ILE A 42 -10.481 -10.631 -1.681 1.00 0.00 O ATOM 358 CB ILE A 42 -10.603 -7.313 -1.480 1.00 0.00 C ATOM 359 CG1 ILE A 42 -10.141 -6.329 -0.396 1.00 0.00 C ATOM 360 CG2 ILE A 42 -11.952 -7.919 -1.064 1.00 0.00 C ATOM 361 CD1 ILE A 42 -10.949 -5.032 -0.504 1.00 0.00 C ATOM 0 H ILE A 42 -8.560 -6.968 -2.820 1.00 0.00 H new ATOM 0 HA ILE A 42 -9.169 -8.710 -0.681 1.00 0.00 H new ATOM 0 HB ILE A 42 -10.724 -6.792 -2.430 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -10.273 -6.771 0.591 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -9.078 -6.118 -0.511 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -12.686 -7.123 -0.940 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -12.293 -8.610 -1.834 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -11.835 -8.455 -0.122 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -10.621 -4.334 0.266 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -10.794 -4.588 -1.487 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -12.008 -5.251 -0.368 1.00 0.00 H new ATOM 373 N LEU A 43 -10.339 -9.571 -3.653 1.00 0.00 N ATOM 374 CA LEU A 43 -10.925 -10.683 -4.390 1.00 0.00 C ATOM 375 C LEU A 43 -10.052 -11.932 -4.250 1.00 0.00 C ATOM 376 O LEU A 43 -10.562 -13.041 -4.099 1.00 0.00 O ATOM 377 CB LEU A 43 -11.065 -10.314 -5.869 1.00 0.00 C ATOM 378 CG LEU A 43 -12.137 -9.225 -6.042 1.00 0.00 C ATOM 379 CD1 LEU A 43 -12.059 -8.659 -7.464 1.00 0.00 C ATOM 380 CD2 LEU A 43 -13.549 -9.804 -5.794 1.00 0.00 C ATOM 0 H LEU A 43 -10.088 -8.764 -4.224 1.00 0.00 H new ATOM 0 HA LEU A 43 -11.912 -10.894 -3.977 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -10.109 -9.959 -6.256 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -11.335 -11.197 -6.448 1.00 0.00 H new ATOM 0 HG LEU A 43 -11.954 -8.434 -5.315 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -12.818 -7.887 -7.590 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -11.072 -8.228 -7.631 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -12.232 -9.459 -8.184 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -14.292 -9.017 -5.921 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -13.744 -10.606 -6.506 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -13.608 -10.198 -4.779 1.00 0.00 H new ATOM 392 N ASP A 44 -8.736 -11.741 -4.297 1.00 0.00 N ATOM 393 CA ASP A 44 -7.802 -12.857 -4.172 1.00 0.00 C ATOM 394 C ASP A 44 -7.907 -13.508 -2.792 1.00 0.00 C ATOM 395 O ASP A 44 -7.677 -14.708 -2.644 1.00 0.00 O ATOM 396 CB ASP A 44 -6.368 -12.374 -4.397 1.00 0.00 C ATOM 397 CG ASP A 44 -6.146 -12.050 -5.871 1.00 0.00 C ATOM 398 OD1 ASP A 44 -7.018 -12.365 -6.664 1.00 0.00 O ATOM 399 OD2 ASP A 44 -5.105 -11.496 -6.184 1.00 0.00 O ATOM 0 H ASP A 44 -8.294 -10.830 -4.420 1.00 0.00 H new ATOM 0 HA ASP A 44 -8.061 -13.597 -4.929 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -6.175 -11.490 -3.790 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -5.664 -13.141 -4.076 1.00 0.00 H new ATOM 404 N ARG A 45 -8.248 -12.707 -1.786 1.00 0.00 N ATOM 405 CA ARG A 45 -8.370 -13.214 -0.421 1.00 0.00 C ATOM 406 C ARG A 45 -9.398 -14.338 -0.367 1.00 0.00 C ATOM 407 O ARG A 45 -9.224 -15.319 0.358 1.00 0.00 O ATOM 408 CB ARG A 45 -8.794 -12.084 0.524 1.00 0.00 C ATOM 409 CG ARG A 45 -8.829 -12.594 1.968 1.00 0.00 C ATOM 410 CD ARG A 45 -9.245 -11.455 2.900 1.00 0.00 C ATOM 411 NE ARG A 45 -9.307 -11.929 4.281 1.00 0.00 N ATOM 412 CZ ARG A 45 -8.229 -11.926 5.062 1.00 0.00 C ATOM 413 NH1 ARG A 45 -7.087 -11.494 4.599 1.00 0.00 N ATOM 414 NH2 ARG A 45 -8.314 -12.357 6.292 1.00 0.00 N ATOM 0 H ARG A 45 -8.444 -11.711 -1.888 1.00 0.00 H new ATOM 0 HA ARG A 45 -7.401 -13.601 -0.106 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -8.098 -11.249 0.441 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -9.777 -11.709 0.238 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -9.530 -13.424 2.055 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -7.848 -12.974 2.255 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -8.533 -10.633 2.822 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -10.217 -11.065 2.598 1.00 0.00 H new ATOM 0 HE ARG A 45 -10.194 -12.269 4.654 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -7.020 -11.158 3.638 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -6.262 -11.492 5.198 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -9.206 -12.695 6.653 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -7.489 -12.355 6.891 1.00 0.00 H new ATOM 617 N VAL B 27 6.259 12.205 0.012 1.00 0.00 N ATOM 618 CA VAL B 27 5.054 12.063 -0.803 1.00 0.00 C ATOM 619 C VAL B 27 5.359 11.382 -2.136 1.00 0.00 C ATOM 620 O VAL B 27 4.690 10.422 -2.519 1.00 0.00 O ATOM 621 CB VAL B 27 4.458 13.441 -1.075 1.00 0.00 C ATOM 622 CG1 VAL B 27 3.188 13.297 -1.918 1.00 0.00 C ATOM 623 CG2 VAL B 27 4.129 14.131 0.251 1.00 0.00 C ATOM 0 HA VAL B 27 4.346 11.444 -0.252 1.00 0.00 H new ATOM 0 HB VAL B 27 5.182 14.046 -1.622 1.00 0.00 H new ATOM 0 HG11 VAL B 27 2.765 14.283 -2.110 1.00 0.00 H new ATOM 0 HG12 VAL B 27 3.433 12.816 -2.865 1.00 0.00 H new ATOM 0 HG13 VAL B 27 2.461 12.689 -1.380 1.00 0.00 H new ATOM 0 HG21 VAL B 27 3.704 15.115 0.053 1.00 0.00 H new ATOM 0 HG22 VAL B 27 3.409 13.529 0.806 1.00 0.00 H new ATOM 0 HG23 VAL B 27 5.040 14.241 0.840 1.00 0.00 H new ATOM 633 N VAL B 28 6.370 11.881 -2.837 1.00 0.00 N ATOM 634 CA VAL B 28 6.748 11.305 -4.124 1.00 0.00 C ATOM 635 C VAL B 28 7.388 9.941 -3.921 1.00 0.00 C ATOM 636 O VAL B 28 7.099 8.986 -4.643 1.00 0.00 O ATOM 637 CB VAL B 28 7.723 12.233 -4.845 1.00 0.00 C ATOM 638 CG1 VAL B 28 8.984 12.420 -4.005 1.00 0.00 C ATOM 639 CG2 VAL B 28 8.096 11.636 -6.202 1.00 0.00 C ATOM 0 H VAL B 28 6.938 12.675 -2.541 1.00 0.00 H new ATOM 0 HA VAL B 28 5.851 11.187 -4.732 1.00 0.00 H new ATOM 0 HB VAL B 28 7.246 13.202 -4.994 1.00 0.00 H new ATOM 0 HG11 VAL B 28 9.674 13.083 -4.527 1.00 0.00 H new ATOM 0 HG12 VAL B 28 8.718 12.857 -3.042 1.00 0.00 H new ATOM 0 HG13 VAL B 28 9.461 11.453 -3.845 1.00 0.00 H new ATOM 0 HG21 VAL B 28 8.792 12.301 -6.713 1.00 0.00 H new ATOM 0 HG22 VAL B 28 8.565 10.663 -6.055 1.00 0.00 H new ATOM 0 HG23 VAL B 28 7.197 11.517 -6.807 1.00 0.00 H new ATOM 649 N ALA B 29 8.259 9.870 -2.930 1.00 0.00 N ATOM 650 CA ALA B 29 8.957 8.627 -2.616 1.00 0.00 C ATOM 651 C ALA B 29 7.964 7.520 -2.289 1.00 0.00 C ATOM 652 O ALA B 29 8.085 6.401 -2.783 1.00 0.00 O ATOM 653 CB ALA B 29 9.892 8.837 -1.422 1.00 0.00 C ATOM 0 H ALA B 29 8.503 10.656 -2.327 1.00 0.00 H new ATOM 0 HA ALA B 29 9.539 8.334 -3.490 1.00 0.00 H new ATOM 0 HB1 ALA B 29 10.408 7.904 -1.196 1.00 0.00 H new ATOM 0 HB2 ALA B 29 10.624 9.607 -1.664 1.00 0.00 H new ATOM 0 HB3 ALA B 29 9.310 9.150 -0.555 1.00 0.00 H new ATOM 659 N ALA B 30 6.980 7.840 -1.455 1.00 0.00 N ATOM 660 CA ALA B 30 5.975 6.859 -1.073 1.00 0.00 C ATOM 661 C ALA B 30 5.165 6.423 -2.289 1.00 0.00 C ATOM 662 O ALA B 30 4.843 5.245 -2.439 1.00 0.00 O ATOM 663 CB ALA B 30 5.038 7.453 -0.019 1.00 0.00 C ATOM 0 H ALA B 30 6.859 8.762 -1.035 1.00 0.00 H new ATOM 0 HA ALA B 30 6.483 5.989 -0.657 1.00 0.00 H new ATOM 0 HB1 ALA B 30 4.289 6.712 0.261 1.00 0.00 H new ATOM 0 HB2 ALA B 30 5.614 7.737 0.861 1.00 0.00 H new ATOM 0 HB3 ALA B 30 4.542 8.333 -0.428 1.00 0.00 H new ATOM 669 N ASN B 31 4.841 7.379 -3.153 1.00 0.00 N ATOM 670 CA ASN B 31 4.065 7.074 -4.350 1.00 0.00 C ATOM 671 C ASN B 31 4.844 6.152 -5.283 1.00 0.00 C ATOM 672 O ASN B 31 4.291 5.198 -5.828 1.00 0.00 O ATOM 673 CB ASN B 31 3.718 8.365 -5.093 1.00 0.00 C ATOM 674 CG ASN B 31 2.944 8.034 -6.365 1.00 0.00 C ATOM 675 OD1 ASN B 31 1.870 7.436 -6.300 1.00 0.00 O ATOM 676 ND2 ASN B 31 3.429 8.385 -7.524 1.00 0.00 N ATOM 0 H ASN B 31 5.100 8.360 -3.050 1.00 0.00 H new ATOM 0 HA ASN B 31 3.150 6.570 -4.039 1.00 0.00 H new ATOM 0 HB2 ASN B 31 3.123 9.016 -4.453 1.00 0.00 H new ATOM 0 HB3 ASN B 31 4.629 8.909 -5.341 1.00 0.00 H new ATOM 0 HD21 ASN B 31 2.918 8.164 -8.379 1.00 0.00 H new ATOM 0 HD22 ASN B 31 4.319 8.880 -7.575 1.00 0.00 H new ATOM 683 N ILE B 32 6.127 6.443 -5.467 1.00 0.00 N ATOM 684 CA ILE B 32 6.962 5.628 -6.343 1.00 0.00 C ATOM 685 C ILE B 32 7.093 4.215 -5.786 1.00 0.00 C ATOM 686 O ILE B 32 6.992 3.235 -6.525 1.00 0.00 O ATOM 687 CB ILE B 32 8.347 6.268 -6.481 1.00 0.00 C ATOM 688 CG1 ILE B 32 8.220 7.587 -7.245 1.00 0.00 C ATOM 689 CG2 ILE B 32 9.277 5.326 -7.253 1.00 0.00 C ATOM 690 CD1 ILE B 32 9.529 8.372 -7.135 1.00 0.00 C ATOM 0 H ILE B 32 6.608 7.228 -5.027 1.00 0.00 H new ATOM 0 HA ILE B 32 6.493 5.572 -7.326 1.00 0.00 H new ATOM 0 HB ILE B 32 8.760 6.453 -5.489 1.00 0.00 H new ATOM 0 HG12 ILE B 32 7.988 7.392 -8.292 1.00 0.00 H new ATOM 0 HG13 ILE B 32 7.396 8.175 -6.841 1.00 0.00 H new ATOM 0 HG21 ILE B 32 10.261 5.785 -7.349 1.00 0.00 H new ATOM 0 HG22 ILE B 32 9.367 4.382 -6.715 1.00 0.00 H new ATOM 0 HG23 ILE B 32 8.865 5.140 -8.245 1.00 0.00 H new ATOM 0 HD11 ILE B 32 9.437 9.311 -7.680 1.00 0.00 H new ATOM 0 HD12 ILE B 32 9.741 8.580 -6.086 1.00 0.00 H new ATOM 0 HD13 ILE B 32 10.343 7.784 -7.560 1.00 0.00 H new ATOM 702 N ILE B 33 7.324 4.118 -4.485 1.00 0.00 N ATOM 703 CA ILE B 33 7.472 2.821 -3.837 1.00 0.00 C ATOM 704 C ILE B 33 6.166 2.027 -3.907 1.00 0.00 C ATOM 705 O ILE B 33 6.176 0.829 -4.190 1.00 0.00 O ATOM 706 CB ILE B 33 7.895 3.018 -2.377 1.00 0.00 C ATOM 707 CG1 ILE B 33 9.317 3.594 -2.340 1.00 0.00 C ATOM 708 CG2 ILE B 33 7.870 1.675 -1.645 1.00 0.00 C ATOM 709 CD1 ILE B 33 9.666 4.033 -0.916 1.00 0.00 C ATOM 0 H ILE B 33 7.413 4.918 -3.858 1.00 0.00 H new ATOM 0 HA ILE B 33 8.242 2.255 -4.361 1.00 0.00 H new ATOM 0 HB ILE B 33 7.205 3.705 -1.887 1.00 0.00 H new ATOM 0 HG12 ILE B 33 10.031 2.845 -2.684 1.00 0.00 H new ATOM 0 HG13 ILE B 33 9.393 4.443 -3.020 1.00 0.00 H new ATOM 0 HG21 ILE B 33 8.171 1.820 -0.608 1.00 0.00 H new ATOM 0 HG22 ILE B 33 6.861 1.263 -1.675 1.00 0.00 H new ATOM 0 HG23 ILE B 33 8.559 0.984 -2.130 1.00 0.00 H new ATOM 0 HD11 ILE B 33 10.677 4.441 -0.898 1.00 0.00 H new ATOM 0 HD12 ILE B 33 8.961 4.797 -0.588 1.00 0.00 H new ATOM 0 HD13 ILE B 33 9.609 3.175 -0.246 1.00 0.00 H new ATOM 721 N GLY B 34 5.047 2.696 -3.642 1.00 0.00 N ATOM 722 CA GLY B 34 3.745 2.030 -3.676 1.00 0.00 C ATOM 723 C GLY B 34 3.410 1.549 -5.085 1.00 0.00 C ATOM 724 O GLY B 34 2.963 0.417 -5.278 1.00 0.00 O ATOM 0 H GLY B 34 5.013 3.687 -3.404 1.00 0.00 H new ATOM 0 HA2 GLY B 34 3.749 1.183 -2.990 1.00 0.00 H new ATOM 0 HA3 GLY B 34 2.973 2.717 -3.330 1.00 0.00 H new ATOM 728 N ILE B 35 3.635 2.412 -6.065 1.00 0.00 N ATOM 729 CA ILE B 35 3.362 2.069 -7.457 1.00 0.00 C ATOM 730 C ILE B 35 4.262 0.917 -7.898 1.00 0.00 C ATOM 731 O ILE B 35 3.817 -0.018 -8.564 1.00 0.00 O ATOM 732 CB ILE B 35 3.580 3.298 -8.343 1.00 0.00 C ATOM 733 CG1 ILE B 35 2.498 4.339 -8.031 1.00 0.00 C ATOM 734 CG2 ILE B 35 3.485 2.898 -9.817 1.00 0.00 C ATOM 735 CD1 ILE B 35 2.899 5.693 -8.621 1.00 0.00 C ATOM 0 H ILE B 35 4.005 3.352 -5.925 1.00 0.00 H new ATOM 0 HA ILE B 35 2.325 1.749 -7.554 1.00 0.00 H new ATOM 0 HB ILE B 35 4.567 3.716 -8.147 1.00 0.00 H new ATOM 0 HG12 ILE B 35 1.542 4.020 -8.446 1.00 0.00 H new ATOM 0 HG13 ILE B 35 2.364 4.427 -6.953 1.00 0.00 H new ATOM 0 HG21 ILE B 35 3.641 3.776 -10.443 1.00 0.00 H new ATOM 0 HG22 ILE B 35 4.248 2.152 -10.042 1.00 0.00 H new ATOM 0 HG23 ILE B 35 2.499 2.480 -10.018 1.00 0.00 H new ATOM 0 HD11 ILE B 35 2.128 6.430 -8.397 1.00 0.00 H new ATOM 0 HD12 ILE B 35 3.845 6.014 -8.185 1.00 0.00 H new ATOM 0 HD13 ILE B 35 3.010 5.601 -9.701 1.00 0.00 H new ATOM 747 N LEU B 36 5.532 0.991 -7.511 1.00 0.00 N ATOM 748 CA LEU B 36 6.487 -0.052 -7.861 1.00 0.00 C ATOM 749 C LEU B 36 6.043 -1.385 -7.270 1.00 0.00 C ATOM 750 O LEU B 36 6.187 -2.435 -7.899 1.00 0.00 O ATOM 751 CB LEU B 36 7.886 0.323 -7.347 1.00 0.00 C ATOM 752 CG LEU B 36 8.912 -0.795 -7.692 1.00 0.00 C ATOM 753 CD1 LEU B 36 10.246 -0.172 -8.126 1.00 0.00 C ATOM 754 CD2 LEU B 36 9.161 -1.689 -6.463 1.00 0.00 C ATOM 0 H LEU B 36 5.920 1.756 -6.959 1.00 0.00 H new ATOM 0 HA LEU B 36 6.528 -0.148 -8.946 1.00 0.00 H new ATOM 0 HB2 LEU B 36 8.203 1.266 -7.793 1.00 0.00 H new ATOM 0 HB3 LEU B 36 7.855 0.475 -6.268 1.00 0.00 H new ATOM 0 HG LEU B 36 8.502 -1.395 -8.505 1.00 0.00 H new ATOM 0 HD11 LEU B 36 10.956 -0.963 -8.365 1.00 0.00 H new ATOM 0 HD12 LEU B 36 10.087 0.451 -9.006 1.00 0.00 H new ATOM 0 HD13 LEU B 36 10.643 0.439 -7.315 1.00 0.00 H new ATOM 0 HD21 LEU B 36 9.881 -2.467 -6.719 1.00 0.00 H new ATOM 0 HD22 LEU B 36 9.555 -1.084 -5.647 1.00 0.00 H new ATOM 0 HD23 LEU B 36 8.223 -2.150 -6.153 1.00 0.00 H new ATOM 766 N HIS B 37 5.492 -1.336 -6.061 1.00 0.00 N ATOM 767 CA HIS B 37 5.025 -2.549 -5.406 1.00 0.00 C ATOM 768 C HIS B 37 3.978 -3.232 -6.272 1.00 0.00 C ATOM 769 O HIS B 37 3.978 -4.455 -6.415 1.00 0.00 O ATOM 770 CB HIS B 37 4.409 -2.222 -4.044 1.00 0.00 C ATOM 771 CG HIS B 37 3.976 -3.503 -3.389 1.00 0.00 C ATOM 772 ND1 HIS B 37 4.530 -3.955 -2.203 1.00 0.00 N ATOM 773 CD2 HIS B 37 3.060 -4.457 -3.756 1.00 0.00 C ATOM 774 CE1 HIS B 37 3.949 -5.130 -1.908 1.00 0.00 C ATOM 775 NE2 HIS B 37 3.046 -5.482 -2.821 1.00 0.00 N ATOM 0 H HIS B 37 5.360 -0.480 -5.522 1.00 0.00 H new ATOM 0 HA HIS B 37 5.878 -3.212 -5.263 1.00 0.00 H new ATOM 0 HB2 HIS B 37 5.134 -1.703 -3.417 1.00 0.00 H new ATOM 0 HB3 HIS B 37 3.557 -1.553 -4.166 1.00 0.00 H new ATOM 0 HD2 HIS B 37 2.442 -4.416 -4.641 1.00 0.00 H new ATOM 0 HE1 HIS B 37 4.186 -5.719 -1.034 1.00 0.00 H new ATOM 0 HE2 HIS B 37 2.469 -6.323 -2.831 1.00 0.00 H new ATOM 783 N LEU B 38 3.087 -2.437 -6.852 1.00 0.00 N ATOM 784 CA LEU B 38 2.035 -2.980 -7.704 1.00 0.00 C ATOM 785 C LEU B 38 2.626 -3.707 -8.905 1.00 0.00 C ATOM 786 O LEU B 38 2.120 -4.746 -9.312 1.00 0.00 O ATOM 787 CB LEU B 38 1.091 -1.850 -8.174 1.00 0.00 C ATOM 788 CG LEU B 38 -0.068 -1.664 -7.171 1.00 0.00 C ATOM 789 CD1 LEU B 38 -0.649 -0.255 -7.298 1.00 0.00 C ATOM 790 CD2 LEU B 38 -1.178 -2.693 -7.449 1.00 0.00 C ATOM 0 H LEU B 38 3.071 -1.422 -6.750 1.00 0.00 H new ATOM 0 HA LEU B 38 1.462 -3.700 -7.120 1.00 0.00 H new ATOM 0 HB2 LEU B 38 1.649 -0.919 -8.272 1.00 0.00 H new ATOM 0 HB3 LEU B 38 0.692 -2.087 -9.160 1.00 0.00 H new ATOM 0 HG LEU B 38 0.319 -1.810 -6.163 1.00 0.00 H new ATOM 0 HD11 LEU B 38 -1.466 -0.133 -6.587 1.00 0.00 H new ATOM 0 HD12 LEU B 38 0.128 0.479 -7.087 1.00 0.00 H new ATOM 0 HD13 LEU B 38 -1.024 -0.106 -8.311 1.00 0.00 H new ATOM 0 HD21 LEU B 38 -1.991 -2.553 -6.736 1.00 0.00 H new ATOM 0 HD22 LEU B 38 -1.556 -2.555 -8.462 1.00 0.00 H new ATOM 0 HD23 LEU B 38 -0.774 -3.700 -7.346 1.00 0.00 H new ATOM 802 N ILE B 39 3.685 -3.167 -9.482 1.00 0.00 N ATOM 803 CA ILE B 39 4.280 -3.813 -10.642 1.00 0.00 C ATOM 804 C ILE B 39 4.698 -5.244 -10.297 1.00 0.00 C ATOM 805 O ILE B 39 4.362 -6.187 -11.015 1.00 0.00 O ATOM 806 CB ILE B 39 5.501 -3.015 -11.109 1.00 0.00 C ATOM 807 CG1 ILE B 39 5.045 -1.632 -11.590 1.00 0.00 C ATOM 808 CG2 ILE B 39 6.192 -3.752 -12.261 1.00 0.00 C ATOM 809 CD1 ILE B 39 6.261 -0.735 -11.856 1.00 0.00 C ATOM 0 H ILE B 39 4.142 -2.307 -9.179 1.00 0.00 H new ATOM 0 HA ILE B 39 3.542 -3.846 -11.443 1.00 0.00 H new ATOM 0 HB ILE B 39 6.202 -2.906 -10.281 1.00 0.00 H new ATOM 0 HG12 ILE B 39 4.452 -1.733 -12.499 1.00 0.00 H new ATOM 0 HG13 ILE B 39 4.402 -1.172 -10.840 1.00 0.00 H new ATOM 0 HG21 ILE B 39 7.060 -3.181 -12.590 1.00 0.00 H new ATOM 0 HG22 ILE B 39 6.513 -4.737 -11.922 1.00 0.00 H new ATOM 0 HG23 ILE B 39 5.495 -3.864 -13.092 1.00 0.00 H new ATOM 0 HD11 ILE B 39 5.924 0.244 -12.197 1.00 0.00 H new ATOM 0 HD12 ILE B 39 6.837 -0.621 -10.938 1.00 0.00 H new ATOM 0 HD13 ILE B 39 6.888 -1.190 -12.623 1.00 0.00 H new ATOM 821 N LEU B 40 5.422 -5.402 -9.194 1.00 0.00 N ATOM 822 CA LEU B 40 5.873 -6.726 -8.771 1.00 0.00 C ATOM 823 C LEU B 40 4.707 -7.604 -8.300 1.00 0.00 C ATOM 824 O LEU B 40 4.627 -8.784 -8.647 1.00 0.00 O ATOM 825 CB LEU B 40 6.895 -6.582 -7.642 1.00 0.00 C ATOM 826 CG LEU B 40 8.001 -5.608 -8.067 1.00 0.00 C ATOM 827 CD1 LEU B 40 8.994 -5.432 -6.913 1.00 0.00 C ATOM 828 CD2 LEU B 40 8.736 -6.153 -9.304 1.00 0.00 C ATOM 0 H LEU B 40 5.708 -4.639 -8.581 1.00 0.00 H new ATOM 0 HA LEU B 40 6.330 -7.214 -9.632 1.00 0.00 H new ATOM 0 HB2 LEU B 40 6.405 -6.219 -6.739 1.00 0.00 H new ATOM 0 HB3 LEU B 40 7.326 -7.554 -7.402 1.00 0.00 H new ATOM 0 HG LEU B 40 7.555 -4.645 -8.316 1.00 0.00 H new ATOM 0 HD11 LEU B 40 9.781 -4.740 -7.213 1.00 0.00 H new ATOM 0 HD12 LEU B 40 8.473 -5.034 -6.042 1.00 0.00 H new ATOM 0 HD13 LEU B 40 9.435 -6.397 -6.662 1.00 0.00 H new ATOM 0 HD21 LEU B 40 9.520 -5.455 -9.599 1.00 0.00 H new ATOM 0 HD22 LEU B 40 9.181 -7.119 -9.066 1.00 0.00 H new ATOM 0 HD23 LEU B 40 8.029 -6.272 -10.125 1.00 0.00 H new ATOM 840 N TRP B 41 3.811 -7.029 -7.502 1.00 0.00 N ATOM 841 CA TRP B 41 2.664 -7.776 -6.980 1.00 0.00 C ATOM 842 C TRP B 41 1.718 -8.183 -8.109 1.00 0.00 C ATOM 843 O TRP B 41 1.145 -9.272 -8.086 1.00 0.00 O ATOM 844 CB TRP B 41 1.934 -6.948 -5.921 1.00 0.00 C ATOM 845 CG TRP B 41 0.702 -7.666 -5.456 1.00 0.00 C ATOM 846 CD1 TRP B 41 0.660 -8.614 -4.488 1.00 0.00 C ATOM 847 CD2 TRP B 41 -0.673 -7.470 -5.890 1.00 0.00 C ATOM 848 NE1 TRP B 41 -0.650 -9.026 -4.324 1.00 0.00 N ATOM 849 CE2 TRP B 41 -1.507 -8.344 -5.161 1.00 0.00 C ATOM 850 CE3 TRP B 41 -1.265 -6.624 -6.838 1.00 0.00 C ATOM 851 CZ2 TRP B 41 -2.883 -8.376 -5.370 1.00 0.00 C ATOM 852 CZ3 TRP B 41 -2.651 -6.652 -7.046 1.00 0.00 C ATOM 853 CH2 TRP B 41 -3.456 -7.525 -6.313 1.00 0.00 C ATOM 0 H TRP B 41 3.854 -6.055 -7.203 1.00 0.00 H new ATOM 0 HA TRP B 41 3.029 -8.690 -6.511 1.00 0.00 H new ATOM 0 HB2 TRP B 41 2.596 -6.762 -5.075 1.00 0.00 H new ATOM 0 HB3 TRP B 41 1.663 -5.976 -6.333 1.00 0.00 H new ATOM 0 HD1 TRP B 41 1.510 -8.986 -3.936 1.00 0.00 H new ATOM 0 HE1 TRP B 41 -0.946 -9.746 -3.665 1.00 0.00 H new ATOM 0 HE3 TRP B 41 -0.650 -5.947 -7.412 1.00 0.00 H new ATOM 0 HZ2 TRP B 41 -3.503 -9.056 -4.805 1.00 0.00 H new ATOM 0 HZ3 TRP B 41 -3.098 -5.995 -7.777 1.00 0.00 H new ATOM 0 HH2 TRP B 41 -4.523 -7.541 -6.477 1.00 0.00 H new ATOM 864 N ILE B 42 1.565 -7.309 -9.100 1.00 0.00 N ATOM 865 CA ILE B 42 0.690 -7.594 -10.236 1.00 0.00 C ATOM 866 C ILE B 42 1.200 -8.829 -10.981 1.00 0.00 C ATOM 867 O ILE B 42 0.418 -9.689 -11.381 1.00 0.00 O ATOM 868 CB ILE B 42 0.647 -6.376 -11.184 1.00 0.00 C ATOM 869 CG1 ILE B 42 -0.299 -5.311 -10.614 1.00 0.00 C ATOM 870 CG2 ILE B 42 0.150 -6.793 -12.579 1.00 0.00 C ATOM 871 CD1 ILE B 42 -0.031 -3.967 -11.298 1.00 0.00 C ATOM 0 H ILE B 42 2.032 -6.403 -9.141 1.00 0.00 H new ATOM 0 HA ILE B 42 -0.319 -7.791 -9.874 1.00 0.00 H new ATOM 0 HB ILE B 42 1.655 -5.971 -11.271 1.00 0.00 H new ATOM 0 HG12 ILE B 42 -1.336 -5.610 -10.770 1.00 0.00 H new ATOM 0 HG13 ILE B 42 -0.153 -5.218 -9.538 1.00 0.00 H new ATOM 0 HG21 ILE B 42 0.127 -5.921 -13.233 1.00 0.00 H new ATOM 0 HG22 ILE B 42 0.823 -7.541 -12.996 1.00 0.00 H new ATOM 0 HG23 ILE B 42 -0.853 -7.212 -12.498 1.00 0.00 H new ATOM 0 HD11 ILE B 42 -0.704 -3.212 -10.892 1.00 0.00 H new ATOM 0 HD12 ILE B 42 1.002 -3.667 -11.119 1.00 0.00 H new ATOM 0 HD13 ILE B 42 -0.200 -4.064 -12.370 1.00 0.00 H new ATOM 883 N LEU B 43 2.511 -8.908 -11.170 1.00 0.00 N ATOM 884 CA LEU B 43 3.096 -10.043 -11.870 1.00 0.00 C ATOM 885 C LEU B 43 2.800 -11.341 -11.117 1.00 0.00 C ATOM 886 O LEU B 43 2.506 -12.370 -11.728 1.00 0.00 O ATOM 887 CB LEU B 43 4.611 -9.854 -12.000 1.00 0.00 C ATOM 888 CG LEU B 43 4.916 -8.698 -12.968 1.00 0.00 C ATOM 889 CD1 LEU B 43 6.400 -8.329 -12.859 1.00 0.00 C ATOM 890 CD2 LEU B 43 4.591 -9.105 -14.421 1.00 0.00 C ATOM 0 H LEU B 43 3.182 -8.209 -10.853 1.00 0.00 H new ATOM 0 HA LEU B 43 2.655 -10.104 -12.865 1.00 0.00 H new ATOM 0 HB2 LEU B 43 5.045 -9.645 -11.022 1.00 0.00 H new ATOM 0 HB3 LEU B 43 5.071 -10.774 -12.362 1.00 0.00 H new ATOM 0 HG LEU B 43 4.297 -7.841 -12.701 1.00 0.00 H new ATOM 0 HD11 LEU B 43 6.622 -7.510 -13.543 1.00 0.00 H new ATOM 0 HD12 LEU B 43 6.624 -8.020 -11.838 1.00 0.00 H new ATOM 0 HD13 LEU B 43 7.010 -9.194 -13.118 1.00 0.00 H new ATOM 0 HD21 LEU B 43 4.814 -8.274 -15.090 1.00 0.00 H new ATOM 0 HD22 LEU B 43 5.195 -9.968 -14.701 1.00 0.00 H new ATOM 0 HD23 LEU B 43 3.534 -9.361 -14.499 1.00 0.00 H new ATOM 902 N ASP B 44 2.877 -11.284 -9.790 1.00 0.00 N ATOM 903 CA ASP B 44 2.615 -12.461 -8.965 1.00 0.00 C ATOM 904 C ASP B 44 1.162 -12.917 -9.108 1.00 0.00 C ATOM 905 O ASP B 44 0.861 -14.104 -8.991 1.00 0.00 O ATOM 906 CB ASP B 44 2.903 -12.151 -7.494 1.00 0.00 C ATOM 907 CG ASP B 44 4.407 -12.044 -7.263 1.00 0.00 C ATOM 908 OD1 ASP B 44 5.152 -12.365 -8.174 1.00 0.00 O ATOM 909 OD2 ASP B 44 4.791 -11.645 -6.177 1.00 0.00 O ATOM 0 H ASP B 44 3.117 -10.443 -9.266 1.00 0.00 H new ATOM 0 HA ASP B 44 3.272 -13.261 -9.306 1.00 0.00 H new ATOM 0 HB2 ASP B 44 2.417 -11.218 -7.209 1.00 0.00 H new ATOM 0 HB3 ASP B 44 2.485 -12.934 -6.861 1.00 0.00 H new ATOM 914 N ARG B 45 0.265 -11.967 -9.354 1.00 0.00 N ATOM 915 CA ARG B 45 -1.153 -12.280 -9.502 1.00 0.00 C ATOM 916 C ARG B 45 -1.357 -13.285 -10.631 1.00 0.00 C ATOM 917 O ARG B 45 -2.201 -14.177 -10.538 1.00 0.00 O ATOM 918 CB ARG B 45 -1.946 -11.003 -9.801 1.00 0.00 C ATOM 919 CG ARG B 45 -3.446 -11.319 -9.858 1.00 0.00 C ATOM 920 CD ARG B 45 -4.225 -10.034 -10.149 1.00 0.00 C ATOM 921 NE ARG B 45 -5.655 -10.321 -10.231 1.00 0.00 N ATOM 922 CZ ARG B 45 -6.424 -10.323 -9.146 1.00 0.00 C ATOM 923 NH1 ARG B 45 -5.906 -10.067 -7.977 1.00 0.00 N ATOM 924 NH2 ARG B 45 -7.699 -10.583 -9.249 1.00 0.00 N ATOM 0 H ARG B 45 0.493 -10.978 -9.455 1.00 0.00 H new ATOM 0 HA ARG B 45 -1.511 -12.715 -8.569 1.00 0.00 H new ATOM 0 HB2 ARG B 45 -1.752 -10.256 -9.031 1.00 0.00 H new ATOM 0 HB3 ARG B 45 -1.620 -10.576 -10.749 1.00 0.00 H new ATOM 0 HG2 ARG B 45 -3.644 -12.060 -10.632 1.00 0.00 H new ATOM 0 HG3 ARG B 45 -3.774 -11.750 -8.912 1.00 0.00 H new ATOM 0 HD2 ARG B 45 -4.038 -9.301 -9.365 1.00 0.00 H new ATOM 0 HD3 ARG B 45 -3.880 -9.595 -11.085 1.00 0.00 H new ATOM 0 HE ARG B 45 -6.072 -10.524 -11.139 1.00 0.00 H new ATOM 0 HH11 ARG B 45 -4.910 -9.865 -7.894 1.00 0.00 H new ATOM 0 HH12 ARG B 45 -6.497 -10.069 -7.146 1.00 0.00 H new ATOM 0 HH21 ARG B 45 -8.106 -10.785 -10.162 1.00 0.00 H new ATOM 0 HH22 ARG B 45 -8.288 -10.584 -8.416 1.00 0.00 H new ATOM 1127 N VAL C 27 1.559 11.499 7.263 1.00 0.00 N ATOM 1128 CA VAL C 27 2.356 11.363 6.044 1.00 0.00 C ATOM 1129 C VAL C 27 3.592 10.499 6.280 1.00 0.00 C ATOM 1130 O VAL C 27 3.857 9.559 5.529 1.00 0.00 O ATOM 1131 CB VAL C 27 2.801 12.746 5.567 1.00 0.00 C ATOM 1132 CG1 VAL C 27 3.647 12.606 4.300 1.00 0.00 C ATOM 1133 CG2 VAL C 27 1.573 13.612 5.278 1.00 0.00 C ATOM 0 HA VAL C 27 1.735 10.881 5.289 1.00 0.00 H new ATOM 0 HB VAL C 27 3.398 13.221 6.346 1.00 0.00 H new ATOM 0 HG11 VAL C 27 3.963 13.593 3.962 1.00 0.00 H new ATOM 0 HG12 VAL C 27 4.526 11.998 4.515 1.00 0.00 H new ATOM 0 HG13 VAL C 27 3.056 12.127 3.519 1.00 0.00 H new ATOM 0 HG21 VAL C 27 1.894 14.597 4.938 1.00 0.00 H new ATOM 0 HG22 VAL C 27 0.969 13.140 4.503 1.00 0.00 H new ATOM 0 HG23 VAL C 27 0.980 13.717 6.186 1.00 0.00 H new ATOM 1143 N VAL C 28 4.349 10.821 7.323 1.00 0.00 N ATOM 1144 CA VAL C 28 5.553 10.061 7.641 1.00 0.00 C ATOM 1145 C VAL C 28 5.183 8.682 8.163 1.00 0.00 C ATOM 1146 O VAL C 28 5.782 7.675 7.790 1.00 0.00 O ATOM 1147 CB VAL C 28 6.380 10.808 8.684 1.00 0.00 C ATOM 1148 CG1 VAL C 28 5.567 10.989 9.963 1.00 0.00 C ATOM 1149 CG2 VAL C 28 7.653 10.018 8.995 1.00 0.00 C ATOM 0 H VAL C 28 4.153 11.595 7.957 1.00 0.00 H new ATOM 0 HA VAL C 28 6.145 9.945 6.733 1.00 0.00 H new ATOM 0 HB VAL C 28 6.648 11.788 8.289 1.00 0.00 H new ATOM 0 HG11 VAL C 28 6.165 11.523 10.702 1.00 0.00 H new ATOM 0 HG12 VAL C 28 4.666 11.561 9.743 1.00 0.00 H new ATOM 0 HG13 VAL C 28 5.289 10.012 10.359 1.00 0.00 H new ATOM 0 HG21 VAL C 28 8.241 10.554 9.740 1.00 0.00 H new ATOM 0 HG22 VAL C 28 7.386 9.035 9.383 1.00 0.00 H new ATOM 0 HG23 VAL C 28 8.240 9.901 8.084 1.00 0.00 H new ATOM 1159 N ALA C 29 4.188 8.660 9.035 1.00 0.00 N ATOM 1160 CA ALA C 29 3.721 7.410 9.628 1.00 0.00 C ATOM 1161 C ALA C 29 3.265 6.440 8.544 1.00 0.00 C ATOM 1162 O ALA C 29 3.617 5.261 8.567 1.00 0.00 O ATOM 1163 CB ALA C 29 2.558 7.681 10.583 1.00 0.00 C ATOM 0 H ALA C 29 3.686 9.491 9.350 1.00 0.00 H new ATOM 0 HA ALA C 29 4.549 6.966 10.180 1.00 0.00 H new ATOM 0 HB1 ALA C 29 2.219 6.741 11.019 1.00 0.00 H new ATOM 0 HB2 ALA C 29 2.888 8.351 11.377 1.00 0.00 H new ATOM 0 HB3 ALA C 29 1.737 8.144 10.035 1.00 0.00 H new ATOM 1169 N ALA C 30 2.480 6.944 7.599 1.00 0.00 N ATOM 1170 CA ALA C 30 1.983 6.105 6.515 1.00 0.00 C ATOM 1171 C ALA C 30 3.140 5.594 5.662 1.00 0.00 C ATOM 1172 O ALA C 30 3.147 4.439 5.238 1.00 0.00 O ATOM 1173 CB ALA C 30 1.014 6.900 5.640 1.00 0.00 C ATOM 0 H ALA C 30 2.177 7.917 7.561 1.00 0.00 H new ATOM 0 HA ALA C 30 1.461 5.252 6.950 1.00 0.00 H new ATOM 0 HB1 ALA C 30 0.648 6.265 4.833 1.00 0.00 H new ATOM 0 HB2 ALA C 30 0.173 7.240 6.244 1.00 0.00 H new ATOM 0 HB3 ALA C 30 1.529 7.763 5.218 1.00 0.00 H new ATOM 1179 N ASN C 31 4.115 6.461 5.413 1.00 0.00 N ATOM 1180 CA ASN C 31 5.268 6.079 4.605 1.00 0.00 C ATOM 1181 C ASN C 31 6.079 4.987 5.296 1.00 0.00 C ATOM 1182 O ASN C 31 6.504 4.024 4.659 1.00 0.00 O ATOM 1183 CB ASN C 31 6.165 7.294 4.364 1.00 0.00 C ATOM 1184 CG ASN C 31 7.392 6.878 3.557 1.00 0.00 C ATOM 1185 OD1 ASN C 31 7.260 6.403 2.427 1.00 0.00 O ATOM 1186 ND2 ASN C 31 8.581 7.022 4.070 1.00 0.00 N ATOM 0 H ASN C 31 4.132 7.422 5.754 1.00 0.00 H new ATOM 0 HA ASN C 31 4.900 5.697 3.653 1.00 0.00 H new ATOM 0 HB2 ASN C 31 5.611 8.066 3.830 1.00 0.00 H new ATOM 0 HB3 ASN C 31 6.474 7.725 5.317 1.00 0.00 H new ATOM 0 HD21 ASN C 31 9.404 6.742 3.537 1.00 0.00 H new ATOM 0 HD22 ASN C 31 8.689 7.415 5.005 1.00 0.00 H new ATOM 1193 N ILE C 32 6.292 5.143 6.598 1.00 0.00 N ATOM 1194 CA ILE C 32 7.059 4.159 7.355 1.00 0.00 C ATOM 1195 C ILE C 32 6.334 2.817 7.370 1.00 0.00 C ATOM 1196 O ILE C 32 6.946 1.767 7.180 1.00 0.00 O ATOM 1197 CB ILE C 32 7.272 4.656 8.788 1.00 0.00 C ATOM 1198 CG1 ILE C 32 8.192 5.878 8.768 1.00 0.00 C ATOM 1199 CG2 ILE C 32 7.920 3.551 9.629 1.00 0.00 C ATOM 1200 CD1 ILE C 32 8.174 6.556 10.141 1.00 0.00 C ATOM 0 H ILE C 32 5.949 5.932 7.147 1.00 0.00 H new ATOM 0 HA ILE C 32 8.028 4.025 6.875 1.00 0.00 H new ATOM 0 HB ILE C 32 6.309 4.924 9.223 1.00 0.00 H new ATOM 0 HG12 ILE C 32 9.208 5.577 8.513 1.00 0.00 H new ATOM 0 HG13 ILE C 32 7.865 6.579 8.000 1.00 0.00 H new ATOM 0 HG21 ILE C 32 8.070 3.909 10.648 1.00 0.00 H new ATOM 0 HG22 ILE C 32 7.270 2.676 9.644 1.00 0.00 H new ATOM 0 HG23 ILE C 32 8.882 3.280 9.195 1.00 0.00 H new ATOM 0 HD11 ILE C 32 8.830 7.426 10.126 1.00 0.00 H new ATOM 0 HD12 ILE C 32 7.158 6.871 10.378 1.00 0.00 H new ATOM 0 HD13 ILE C 32 8.522 5.853 10.898 1.00 0.00 H new ATOM 1212 N ILE C 33 5.027 2.862 7.601 1.00 0.00 N ATOM 1213 CA ILE C 33 4.226 1.646 7.644 1.00 0.00 C ATOM 1214 C ILE C 33 4.202 0.962 6.276 1.00 0.00 C ATOM 1215 O ILE C 33 4.336 -0.258 6.182 1.00 0.00 O ATOM 1216 CB ILE C 33 2.800 1.983 8.094 1.00 0.00 C ATOM 1217 CG1 ILE C 33 2.830 2.434 9.559 1.00 0.00 C ATOM 1218 CG2 ILE C 33 1.907 0.747 7.961 1.00 0.00 C ATOM 1219 CD1 ILE C 33 1.468 3.016 9.957 1.00 0.00 C ATOM 0 H ILE C 33 4.503 3.722 7.760 1.00 0.00 H new ATOM 0 HA ILE C 33 4.675 0.957 8.359 1.00 0.00 H new ATOM 0 HB ILE C 33 2.401 2.781 7.468 1.00 0.00 H new ATOM 0 HG12 ILE C 33 3.076 1.590 10.203 1.00 0.00 H new ATOM 0 HG13 ILE C 33 3.610 3.182 9.702 1.00 0.00 H new ATOM 0 HG21 ILE C 33 0.895 0.993 8.282 1.00 0.00 H new ATOM 0 HG22 ILE C 33 1.888 0.422 6.921 1.00 0.00 H new ATOM 0 HG23 ILE C 33 2.301 -0.055 8.585 1.00 0.00 H new ATOM 0 HD11 ILE C 33 1.499 3.334 10.999 1.00 0.00 H new ATOM 0 HD12 ILE C 33 1.239 3.873 9.323 1.00 0.00 H new ATOM 0 HD13 ILE C 33 0.697 2.256 9.832 1.00 0.00 H new ATOM 1231 N GLY C 34 4.024 1.752 5.218 1.00 0.00 N ATOM 1232 CA GLY C 34 3.980 1.201 3.865 1.00 0.00 C ATOM 1233 C GLY C 34 5.321 0.578 3.479 1.00 0.00 C ATOM 1234 O GLY C 34 5.372 -0.526 2.938 1.00 0.00 O ATOM 0 H GLY C 34 3.909 2.764 5.270 1.00 0.00 H new ATOM 0 HA2 GLY C 34 3.194 0.448 3.801 1.00 0.00 H new ATOM 0 HA3 GLY C 34 3.725 1.989 3.157 1.00 0.00 H new ATOM 1238 N ILE C 35 6.399 1.294 3.769 1.00 0.00 N ATOM 1239 CA ILE C 35 7.739 0.806 3.458 1.00 0.00 C ATOM 1240 C ILE C 35 8.033 -0.461 4.256 1.00 0.00 C ATOM 1241 O ILE C 35 8.582 -1.432 3.727 1.00 0.00 O ATOM 1242 CB ILE C 35 8.768 1.894 3.773 1.00 0.00 C ATOM 1243 CG1 ILE C 35 8.588 3.056 2.787 1.00 0.00 C ATOM 1244 CG2 ILE C 35 10.182 1.326 3.633 1.00 0.00 C ATOM 1245 CD1 ILE C 35 9.336 4.285 3.301 1.00 0.00 C ATOM 0 H ILE C 35 6.374 2.210 4.217 1.00 0.00 H new ATOM 0 HA ILE C 35 7.799 0.564 2.397 1.00 0.00 H new ATOM 0 HB ILE C 35 8.622 2.247 4.794 1.00 0.00 H new ATOM 0 HG12 ILE C 35 8.964 2.774 1.804 1.00 0.00 H new ATOM 0 HG13 ILE C 35 7.529 3.285 2.669 1.00 0.00 H new ATOM 0 HG21 ILE C 35 10.911 2.105 3.858 1.00 0.00 H new ATOM 0 HG22 ILE C 35 10.311 0.496 4.328 1.00 0.00 H new ATOM 0 HG23 ILE C 35 10.333 0.972 2.613 1.00 0.00 H new ATOM 0 HD11 ILE C 35 9.207 5.109 2.599 1.00 0.00 H new ATOM 0 HD12 ILE C 35 8.939 4.572 4.275 1.00 0.00 H new ATOM 0 HD13 ILE C 35 10.397 4.052 3.396 1.00 0.00 H new ATOM 1257 N LEU C 36 7.654 -0.448 5.528 1.00 0.00 N ATOM 1258 CA LEU C 36 7.872 -1.602 6.388 1.00 0.00 C ATOM 1259 C LEU C 36 7.124 -2.810 5.838 1.00 0.00 C ATOM 1260 O LEU C 36 7.619 -3.939 5.887 1.00 0.00 O ATOM 1261 CB LEU C 36 7.403 -1.289 7.819 1.00 0.00 C ATOM 1262 CG LEU C 36 7.606 -2.525 8.742 1.00 0.00 C ATOM 1263 CD1 LEU C 36 8.110 -2.076 10.121 1.00 0.00 C ATOM 1264 CD2 LEU C 36 6.278 -3.279 8.923 1.00 0.00 C ATOM 0 H LEU C 36 7.198 0.343 5.983 1.00 0.00 H new ATOM 0 HA LEU C 36 8.937 -1.831 6.412 1.00 0.00 H new ATOM 0 HB2 LEU C 36 7.960 -0.439 8.213 1.00 0.00 H new ATOM 0 HB3 LEU C 36 6.351 -1.004 7.809 1.00 0.00 H new ATOM 0 HG LEU C 36 8.340 -3.183 8.276 1.00 0.00 H new ATOM 0 HD11 LEU C 36 8.249 -2.948 10.759 1.00 0.00 H new ATOM 0 HD12 LEU C 36 9.060 -1.554 10.009 1.00 0.00 H new ATOM 0 HD13 LEU C 36 7.379 -1.407 10.575 1.00 0.00 H new ATOM 0 HD21 LEU C 36 6.435 -4.141 9.571 1.00 0.00 H new ATOM 0 HD22 LEU C 36 5.541 -2.615 9.375 1.00 0.00 H new ATOM 0 HD23 LEU C 36 5.916 -3.616 7.952 1.00 0.00 H new ATOM 1276 N HIS C 37 5.931 -2.568 5.304 1.00 0.00 N ATOM 1277 CA HIS C 37 5.134 -3.646 4.740 1.00 0.00 C ATOM 1278 C HIS C 37 5.911 -4.339 3.631 1.00 0.00 C ATOM 1279 O HIS C 37 5.901 -5.566 3.524 1.00 0.00 O ATOM 1280 CB HIS C 37 3.824 -3.102 4.168 1.00 0.00 C ATOM 1281 CG HIS C 37 3.015 -4.251 3.636 1.00 0.00 C ATOM 1282 ND1 HIS C 37 1.783 -4.599 4.161 1.00 0.00 N ATOM 1283 CD2 HIS C 37 3.263 -5.160 2.636 1.00 0.00 C ATOM 1284 CE1 HIS C 37 1.344 -5.674 3.485 1.00 0.00 C ATOM 1285 NE2 HIS C 37 2.207 -6.055 2.546 1.00 0.00 N ATOM 0 H HIS C 37 5.500 -1.645 5.251 1.00 0.00 H new ATOM 0 HA HIS C 37 4.909 -4.358 5.534 1.00 0.00 H new ATOM 0 HB2 HIS C 37 3.266 -2.573 4.940 1.00 0.00 H new ATOM 0 HB3 HIS C 37 4.028 -2.384 3.374 1.00 0.00 H new ATOM 0 HD2 HIS C 37 4.146 -5.175 2.014 1.00 0.00 H new ATOM 0 HE1 HIS C 37 0.404 -6.169 3.680 1.00 0.00 H new ATOM 0 HE2 HIS C 37 2.112 -6.838 1.899 1.00 0.00 H new ATOM 1293 N LEU C 38 6.589 -3.548 2.808 1.00 0.00 N ATOM 1294 CA LEU C 38 7.368 -4.100 1.706 1.00 0.00 C ATOM 1295 C LEU C 38 8.470 -5.018 2.225 1.00 0.00 C ATOM 1296 O LEU C 38 8.748 -6.051 1.627 1.00 0.00 O ATOM 1297 CB LEU C 38 7.980 -2.959 0.863 1.00 0.00 C ATOM 1298 CG LEU C 38 7.012 -2.551 -0.271 1.00 0.00 C ATOM 1299 CD1 LEU C 38 7.312 -1.122 -0.724 1.00 0.00 C ATOM 1300 CD2 LEU C 38 7.175 -3.506 -1.470 1.00 0.00 C ATOM 0 H LEU C 38 6.616 -2.531 2.881 1.00 0.00 H new ATOM 0 HA LEU C 38 6.700 -4.689 1.077 1.00 0.00 H new ATOM 0 HB2 LEU C 38 8.188 -2.099 1.499 1.00 0.00 H new ATOM 0 HB3 LEU C 38 8.932 -3.280 0.440 1.00 0.00 H new ATOM 0 HG LEU C 38 5.990 -2.607 0.104 1.00 0.00 H new ATOM 0 HD11 LEU C 38 6.626 -0.842 -1.523 1.00 0.00 H new ATOM 0 HD12 LEU C 38 7.187 -0.440 0.117 1.00 0.00 H new ATOM 0 HD13 LEU C 38 8.337 -1.064 -1.089 1.00 0.00 H new ATOM 0 HD21 LEU C 38 6.490 -3.212 -2.265 1.00 0.00 H new ATOM 0 HD22 LEU C 38 8.200 -3.457 -1.838 1.00 0.00 H new ATOM 0 HD23 LEU C 38 6.951 -4.526 -1.156 1.00 0.00 H new ATOM 1312 N ILE C 39 9.105 -4.644 3.321 1.00 0.00 N ATOM 1313 CA ILE C 39 10.177 -5.474 3.851 1.00 0.00 C ATOM 1314 C ILE C 39 9.658 -6.882 4.148 1.00 0.00 C ATOM 1315 O ILE C 39 10.257 -7.874 3.728 1.00 0.00 O ATOM 1316 CB ILE C 39 10.733 -4.846 5.130 1.00 0.00 C ATOM 1317 CG1 ILE C 39 11.380 -3.498 4.789 1.00 0.00 C ATOM 1318 CG2 ILE C 39 11.785 -5.775 5.745 1.00 0.00 C ATOM 1319 CD1 ILE C 39 11.753 -2.748 6.075 1.00 0.00 C ATOM 0 H ILE C 39 8.907 -3.795 3.851 1.00 0.00 H new ATOM 0 HA ILE C 39 10.971 -5.541 3.108 1.00 0.00 H new ATOM 0 HB ILE C 39 9.923 -4.696 5.844 1.00 0.00 H new ATOM 0 HG12 ILE C 39 12.271 -3.657 4.181 1.00 0.00 H new ATOM 0 HG13 ILE C 39 10.692 -2.896 4.195 1.00 0.00 H new ATOM 0 HG21 ILE C 39 12.180 -5.325 6.656 1.00 0.00 H new ATOM 0 HG22 ILE C 39 11.328 -6.735 5.983 1.00 0.00 H new ATOM 0 HG23 ILE C 39 12.597 -5.926 5.034 1.00 0.00 H new ATOM 0 HD11 ILE C 39 12.211 -1.793 5.819 1.00 0.00 H new ATOM 0 HD12 ILE C 39 10.855 -2.572 6.667 1.00 0.00 H new ATOM 0 HD13 ILE C 39 12.458 -3.345 6.653 1.00 0.00 H new ATOM 1331 N LEU C 40 8.541 -6.965 4.865 1.00 0.00 N ATOM 1332 CA LEU C 40 7.958 -8.263 5.205 1.00 0.00 C ATOM 1333 C LEU C 40 7.386 -8.974 3.970 1.00 0.00 C ATOM 1334 O LEU C 40 7.585 -10.176 3.790 1.00 0.00 O ATOM 1335 CB LEU C 40 6.853 -8.067 6.242 1.00 0.00 C ATOM 1336 CG LEU C 40 7.391 -7.252 7.425 1.00 0.00 C ATOM 1337 CD1 LEU C 40 6.264 -7.021 8.436 1.00 0.00 C ATOM 1338 CD2 LEU C 40 8.550 -8.004 8.101 1.00 0.00 C ATOM 0 H LEU C 40 8.025 -6.160 5.219 1.00 0.00 H new ATOM 0 HA LEU C 40 8.750 -8.891 5.612 1.00 0.00 H new ATOM 0 HB2 LEU C 40 6.004 -7.553 5.790 1.00 0.00 H new ATOM 0 HB3 LEU C 40 6.492 -9.035 6.589 1.00 0.00 H new ATOM 0 HG LEU C 40 7.759 -6.292 7.062 1.00 0.00 H new ATOM 0 HD11 LEU C 40 6.643 -6.442 9.278 1.00 0.00 H new ATOM 0 HD12 LEU C 40 5.452 -6.475 7.957 1.00 0.00 H new ATOM 0 HD13 LEU C 40 5.894 -7.982 8.794 1.00 0.00 H new ATOM 0 HD21 LEU C 40 8.925 -7.417 8.939 1.00 0.00 H new ATOM 0 HD22 LEU C 40 8.195 -8.969 8.463 1.00 0.00 H new ATOM 0 HD23 LEU C 40 9.352 -8.160 7.380 1.00 0.00 H new ATOM 1350 N TRP C 41 6.669 -8.230 3.132 1.00 0.00 N ATOM 1351 CA TRP C 41 6.062 -8.807 1.931 1.00 0.00 C ATOM 1352 C TRP C 41 7.136 -9.267 0.944 1.00 0.00 C ATOM 1353 O TRP C 41 6.981 -10.291 0.279 1.00 0.00 O ATOM 1354 CB TRP C 41 5.114 -7.793 1.280 1.00 0.00 C ATOM 1355 CG TRP C 41 4.569 -8.339 -0.005 1.00 0.00 C ATOM 1356 CD1 TRP C 41 3.492 -9.155 -0.120 1.00 0.00 C ATOM 1357 CD2 TRP C 41 5.027 -8.080 -1.361 1.00 0.00 C ATOM 1358 NE1 TRP C 41 3.280 -9.428 -1.460 1.00 0.00 N ATOM 1359 CE2 TRP C 41 4.196 -8.784 -2.262 1.00 0.00 C ATOM 1360 CE3 TRP C 41 6.074 -7.311 -1.888 1.00 0.00 C ATOM 1361 CZ2 TRP C 41 4.402 -8.723 -3.637 1.00 0.00 C ATOM 1362 CZ3 TRP C 41 6.279 -7.245 -3.273 1.00 0.00 C ATOM 1363 CH2 TRP C 41 5.445 -7.950 -4.144 1.00 0.00 C ATOM 0 H TRP C 41 6.494 -7.233 3.259 1.00 0.00 H new ATOM 0 HA TRP C 41 5.483 -9.684 2.221 1.00 0.00 H new ATOM 0 HB2 TRP C 41 4.295 -7.562 1.961 1.00 0.00 H new ATOM 0 HB3 TRP C 41 5.644 -6.860 1.090 1.00 0.00 H new ATOM 0 HD1 TRP C 41 2.897 -9.530 0.700 1.00 0.00 H new ATOM 0 HE1 TRP C 41 2.537 -10.032 -1.811 1.00 0.00 H new ATOM 0 HE3 TRP C 41 6.727 -6.766 -1.222 1.00 0.00 H new ATOM 0 HZ2 TRP C 41 3.757 -9.272 -4.307 1.00 0.00 H new ATOM 0 HZ3 TRP C 41 7.086 -6.646 -3.669 1.00 0.00 H new ATOM 0 HH2 TRP C 41 5.608 -7.896 -5.210 1.00 0.00 H new ATOM 1374 N ILE C 42 8.227 -8.511 0.859 1.00 0.00 N ATOM 1375 CA ILE C 42 9.322 -8.858 -0.045 1.00 0.00 C ATOM 1376 C ILE C 42 9.908 -10.213 0.351 1.00 0.00 C ATOM 1377 O ILE C 42 10.201 -11.046 -0.504 1.00 0.00 O ATOM 1378 CB ILE C 42 10.412 -7.766 0.008 1.00 0.00 C ATOM 1379 CG1 ILE C 42 9.978 -6.561 -0.840 1.00 0.00 C ATOM 1380 CG2 ILE C 42 11.746 -8.306 -0.535 1.00 0.00 C ATOM 1381 CD1 ILE C 42 10.821 -5.340 -0.463 1.00 0.00 C ATOM 0 H ILE C 42 8.377 -7.660 1.400 1.00 0.00 H new ATOM 0 HA ILE C 42 8.942 -8.923 -1.064 1.00 0.00 H new ATOM 0 HB ILE C 42 10.546 -7.463 1.046 1.00 0.00 H new ATOM 0 HG12 ILE C 42 10.099 -6.786 -1.900 1.00 0.00 H new ATOM 0 HG13 ILE C 42 8.921 -6.350 -0.677 1.00 0.00 H new ATOM 0 HG21 ILE C 42 12.502 -7.522 -0.489 1.00 0.00 H new ATOM 0 HG22 ILE C 42 12.067 -9.155 0.068 1.00 0.00 H new ATOM 0 HG23 ILE C 42 11.616 -8.625 -1.569 1.00 0.00 H new ATOM 0 HD11 ILE C 42 10.513 -4.485 -1.065 1.00 0.00 H new ATOM 0 HD12 ILE C 42 10.678 -5.111 0.593 1.00 0.00 H new ATOM 0 HD13 ILE C 42 11.874 -5.553 -0.648 1.00 0.00 H new ATOM 1393 N LEU C 43 10.082 -10.426 1.648 1.00 0.00 N ATOM 1394 CA LEU C 43 10.637 -11.685 2.131 1.00 0.00 C ATOM 1395 C LEU C 43 9.732 -12.851 1.732 1.00 0.00 C ATOM 1396 O LEU C 43 10.211 -13.918 1.347 1.00 0.00 O ATOM 1397 CB LEU C 43 10.785 -11.641 3.656 1.00 0.00 C ATOM 1398 CG LEU C 43 11.885 -10.643 4.051 1.00 0.00 C ATOM 1399 CD1 LEU C 43 11.819 -10.391 5.561 1.00 0.00 C ATOM 1400 CD2 LEU C 43 13.279 -11.195 3.681 1.00 0.00 C ATOM 0 H LEU C 43 9.850 -9.753 2.378 1.00 0.00 H new ATOM 0 HA LEU C 43 11.619 -11.830 1.680 1.00 0.00 H new ATOM 0 HB2 LEU C 43 9.839 -11.351 4.113 1.00 0.00 H new ATOM 0 HB3 LEU C 43 11.031 -12.633 4.034 1.00 0.00 H new ATOM 0 HG LEU C 43 11.726 -9.710 3.510 1.00 0.00 H new ATOM 0 HD11 LEU C 43 12.598 -9.683 5.846 1.00 0.00 H new ATOM 0 HD12 LEU C 43 10.843 -9.980 5.819 1.00 0.00 H new ATOM 0 HD13 LEU C 43 11.969 -11.330 6.094 1.00 0.00 H new ATOM 0 HD21 LEU C 43 14.044 -10.474 3.969 1.00 0.00 H new ATOM 0 HD22 LEU C 43 13.450 -12.134 4.207 1.00 0.00 H new ATOM 0 HD23 LEU C 43 13.329 -11.367 2.606 1.00 0.00 H new ATOM 1412 N ASP C 44 8.421 -12.640 1.825 1.00 0.00 N ATOM 1413 CA ASP C 44 7.456 -13.680 1.469 1.00 0.00 C ATOM 1414 C ASP C 44 7.547 -14.023 -0.019 1.00 0.00 C ATOM 1415 O ASP C 44 7.287 -15.158 -0.419 1.00 0.00 O ATOM 1416 CB ASP C 44 6.034 -13.215 1.796 1.00 0.00 C ATOM 1417 CG ASP C 44 5.818 -13.210 3.305 1.00 0.00 C ATOM 1418 OD1 ASP C 44 6.675 -13.718 4.009 1.00 0.00 O ATOM 1419 OD2 ASP C 44 4.797 -12.698 3.735 1.00 0.00 O ATOM 0 H ASP C 44 8.004 -11.765 2.142 1.00 0.00 H new ATOM 0 HA ASP C 44 7.692 -14.571 2.051 1.00 0.00 H new ATOM 0 HB2 ASP C 44 5.869 -12.215 1.394 1.00 0.00 H new ATOM 0 HB3 ASP C 44 5.309 -13.874 1.319 1.00 0.00 H new ATOM 1424 N ARG C 45 7.910 -13.037 -0.833 1.00 0.00 N ATOM 1425 CA ARG C 45 8.023 -13.246 -2.274 1.00 0.00 C ATOM 1426 C ARG C 45 9.022 -14.360 -2.572 1.00 0.00 C ATOM 1427 O ARG C 45 8.822 -15.158 -3.486 1.00 0.00 O ATOM 1428 CB ARG C 45 8.480 -11.951 -2.959 1.00 0.00 C ATOM 1429 CG ARG C 45 8.503 -12.142 -4.479 1.00 0.00 C ATOM 1430 CD ARG C 45 8.953 -10.842 -5.149 1.00 0.00 C ATOM 1431 NE ARG C 45 9.003 -11.014 -6.600 1.00 0.00 N ATOM 1432 CZ ARG C 45 7.929 -10.817 -7.359 1.00 0.00 C ATOM 1433 NH1 ARG C 45 6.799 -10.460 -6.810 1.00 0.00 N ATOM 1434 NH2 ARG C 45 8.003 -10.979 -8.652 1.00 0.00 N ATOM 0 H ARG C 45 8.130 -12.090 -0.523 1.00 0.00 H new ATOM 0 HA ARG C 45 7.045 -13.533 -2.660 1.00 0.00 H new ATOM 0 HB2 ARG C 45 7.807 -11.134 -2.697 1.00 0.00 H new ATOM 0 HB3 ARG C 45 9.472 -11.673 -2.604 1.00 0.00 H new ATOM 0 HG2 ARG C 45 9.180 -12.954 -4.744 1.00 0.00 H new ATOM 0 HG3 ARG C 45 7.512 -12.424 -4.836 1.00 0.00 H new ATOM 0 HD2 ARG C 45 8.265 -10.036 -4.894 1.00 0.00 H new ATOM 0 HD3 ARG C 45 9.935 -10.553 -4.776 1.00 0.00 H new ATOM 0 HE ARG C 45 9.881 -11.291 -7.040 1.00 0.00 H new ATOM 0 HH11 ARG C 45 6.741 -10.332 -5.800 1.00 0.00 H new ATOM 0 HH12 ARG C 45 5.975 -10.309 -7.392 1.00 0.00 H new ATOM 0 HH21 ARG C 45 8.885 -11.257 -9.081 1.00 0.00 H new ATOM 0 HH22 ARG C 45 7.178 -10.828 -9.233 1.00 0.00 H new ATOM 1637 N VAL D 27 -5.855 12.073 2.782 1.00 0.00 N ATOM 1638 CA VAL D 27 -4.660 11.724 3.549 1.00 0.00 C ATOM 1639 C VAL D 27 -4.992 10.780 4.703 1.00 0.00 C ATOM 1640 O VAL D 27 -4.354 9.742 4.869 1.00 0.00 O ATOM 1641 CB VAL D 27 -4.033 12.996 4.120 1.00 0.00 C ATOM 1642 CG1 VAL D 27 -2.786 12.635 4.929 1.00 0.00 C ATOM 1643 CG2 VAL D 27 -3.655 13.941 2.977 1.00 0.00 C ATOM 0 HA VAL D 27 -3.965 11.220 2.877 1.00 0.00 H new ATOM 0 HB VAL D 27 -4.752 13.493 4.772 1.00 0.00 H new ATOM 0 HG11 VAL D 27 -2.340 13.543 5.335 1.00 0.00 H new ATOM 0 HG12 VAL D 27 -3.063 11.969 5.747 1.00 0.00 H new ATOM 0 HG13 VAL D 27 -2.065 12.135 4.282 1.00 0.00 H new ATOM 0 HG21 VAL D 27 -3.208 14.847 3.387 1.00 0.00 H new ATOM 0 HG22 VAL D 27 -2.939 13.448 2.319 1.00 0.00 H new ATOM 0 HG23 VAL D 27 -4.549 14.202 2.410 1.00 0.00 H new ATOM 1653 N VAL D 28 -5.993 11.146 5.497 1.00 0.00 N ATOM 1654 CA VAL D 28 -6.395 10.317 6.628 1.00 0.00 C ATOM 1655 C VAL D 28 -7.072 9.049 6.137 1.00 0.00 C ATOM 1656 O VAL D 28 -6.818 7.954 6.634 1.00 0.00 O ATOM 1657 CB VAL D 28 -7.346 11.099 7.532 1.00 0.00 C ATOM 1658 CG1 VAL D 28 -8.596 11.501 6.751 1.00 0.00 C ATOM 1659 CG2 VAL D 28 -7.746 10.235 8.728 1.00 0.00 C ATOM 0 H VAL D 28 -6.536 12.002 5.381 1.00 0.00 H new ATOM 0 HA VAL D 28 -5.506 10.042 7.196 1.00 0.00 H new ATOM 0 HB VAL D 28 -6.841 11.998 7.886 1.00 0.00 H new ATOM 0 HG11 VAL D 28 -9.269 12.058 7.403 1.00 0.00 H new ATOM 0 HG12 VAL D 28 -8.311 12.126 5.905 1.00 0.00 H new ATOM 0 HG13 VAL D 28 -9.101 10.606 6.388 1.00 0.00 H new ATOM 0 HG21 VAL D 28 -8.424 10.796 9.371 1.00 0.00 H new ATOM 0 HG22 VAL D 28 -8.244 9.332 8.374 1.00 0.00 H new ATOM 0 HG23 VAL D 28 -6.855 9.960 9.293 1.00 0.00 H new ATOM 1669 N ALA D 29 -7.940 9.221 5.152 1.00 0.00 N ATOM 1670 CA ALA D 29 -8.672 8.094 4.579 1.00 0.00 C ATOM 1671 C ALA D 29 -7.707 7.056 4.022 1.00 0.00 C ATOM 1672 O ALA D 29 -7.863 5.860 4.261 1.00 0.00 O ATOM 1673 CB ALA D 29 -9.592 8.582 3.457 1.00 0.00 C ATOM 0 H ALA D 29 -8.157 10.125 4.732 1.00 0.00 H new ATOM 0 HA ALA D 29 -9.269 7.637 5.369 1.00 0.00 H new ATOM 0 HB1 ALA D 29 -10.133 7.735 3.036 1.00 0.00 H new ATOM 0 HB2 ALA D 29 -10.303 9.304 3.858 1.00 0.00 H new ATOM 0 HB3 ALA D 29 -8.995 9.055 2.677 1.00 0.00 H new ATOM 1679 N ALA D 30 -6.710 7.518 3.276 1.00 0.00 N ATOM 1680 CA ALA D 30 -5.729 6.613 2.693 1.00 0.00 C ATOM 1681 C ALA D 30 -4.941 5.902 3.788 1.00 0.00 C ATOM 1682 O ALA D 30 -4.651 4.710 3.681 1.00 0.00 O ATOM 1683 CB ALA D 30 -4.767 7.392 1.792 1.00 0.00 C ATOM 0 H ALA D 30 -6.561 8.504 3.063 1.00 0.00 H new ATOM 0 HA ALA D 30 -6.258 5.868 2.099 1.00 0.00 H new ATOM 0 HB1 ALA D 30 -4.037 6.707 1.361 1.00 0.00 H new ATOM 0 HB2 ALA D 30 -5.328 7.875 0.992 1.00 0.00 H new ATOM 0 HB3 ALA D 30 -4.250 8.149 2.381 1.00 0.00 H new ATOM 1689 N ASN D 31 -4.594 6.640 4.838 1.00 0.00 N ATOM 1690 CA ASN D 31 -3.835 6.063 5.942 1.00 0.00 C ATOM 1691 C ASN D 31 -4.647 4.985 6.654 1.00 0.00 C ATOM 1692 O ASN D 31 -4.126 3.921 6.981 1.00 0.00 O ATOM 1693 CB ASN D 31 -3.456 7.153 6.944 1.00 0.00 C ATOM 1694 CG ASN D 31 -2.700 6.534 8.115 1.00 0.00 C ATOM 1695 OD1 ASN D 31 -1.645 5.931 7.925 1.00 0.00 O ATOM 1696 ND2 ASN D 31 -3.183 6.642 9.323 1.00 0.00 N ATOM 0 H ASN D 31 -4.823 7.628 4.948 1.00 0.00 H new ATOM 0 HA ASN D 31 -2.932 5.611 5.532 1.00 0.00 H new ATOM 0 HB2 ASN D 31 -2.838 7.908 6.458 1.00 0.00 H new ATOM 0 HB3 ASN D 31 -4.353 7.658 7.304 1.00 0.00 H new ATOM 0 HD21 ASN D 31 -2.685 6.226 10.110 1.00 0.00 H new ATOM 0 HD22 ASN D 31 -4.058 7.142 9.480 1.00 0.00 H new ATOM 1703 N ILE D 32 -5.922 5.267 6.896 1.00 0.00 N ATOM 1704 CA ILE D 32 -6.786 4.310 7.575 1.00 0.00 C ATOM 1705 C ILE D 32 -6.955 3.050 6.730 1.00 0.00 C ATOM 1706 O ILE D 32 -6.887 1.934 7.241 1.00 0.00 O ATOM 1707 CB ILE D 32 -8.153 4.943 7.849 1.00 0.00 C ATOM 1708 CG1 ILE D 32 -7.994 6.065 8.878 1.00 0.00 C ATOM 1709 CG2 ILE D 32 -9.114 3.885 8.399 1.00 0.00 C ATOM 1710 CD1 ILE D 32 -9.280 6.892 8.938 1.00 0.00 C ATOM 0 H ILE D 32 -6.377 6.142 6.635 1.00 0.00 H new ATOM 0 HA ILE D 32 -6.323 4.034 8.523 1.00 0.00 H new ATOM 0 HB ILE D 32 -8.555 5.348 6.920 1.00 0.00 H new ATOM 0 HG12 ILE D 32 -7.774 5.644 9.859 1.00 0.00 H new ATOM 0 HG13 ILE D 32 -7.152 6.702 8.609 1.00 0.00 H new ATOM 0 HG21 ILE D 32 -10.085 4.341 8.592 1.00 0.00 H new ATOM 0 HG22 ILE D 32 -9.228 3.083 7.670 1.00 0.00 H new ATOM 0 HG23 ILE D 32 -8.714 3.477 9.327 1.00 0.00 H new ATOM 0 HD11 ILE D 32 -9.165 7.690 9.671 1.00 0.00 H new ATOM 0 HD12 ILE D 32 -9.480 7.325 7.958 1.00 0.00 H new ATOM 0 HD13 ILE D 32 -10.112 6.250 9.228 1.00 0.00 H new ATOM 1722 N ILE D 33 -7.180 3.244 5.436 1.00 0.00 N ATOM 1723 CA ILE D 33 -7.360 2.121 4.525 1.00 0.00 C ATOM 1724 C ILE D 33 -6.077 1.291 4.423 1.00 0.00 C ATOM 1725 O ILE D 33 -6.124 0.061 4.442 1.00 0.00 O ATOM 1726 CB ILE D 33 -7.768 2.639 3.143 1.00 0.00 C ATOM 1727 CG1 ILE D 33 -9.172 3.250 3.230 1.00 0.00 C ATOM 1728 CG2 ILE D 33 -7.776 1.486 2.138 1.00 0.00 C ATOM 1729 CD1 ILE D 33 -9.501 3.995 1.933 1.00 0.00 C ATOM 0 H ILE D 33 -7.242 4.162 4.996 1.00 0.00 H new ATOM 0 HA ILE D 33 -8.149 1.478 4.915 1.00 0.00 H new ATOM 0 HB ILE D 33 -7.055 3.395 2.814 1.00 0.00 H new ATOM 0 HG12 ILE D 33 -9.908 2.466 3.405 1.00 0.00 H new ATOM 0 HG13 ILE D 33 -9.228 3.935 4.076 1.00 0.00 H new ATOM 0 HG21 ILE D 33 -8.067 1.861 1.157 1.00 0.00 H new ATOM 0 HG22 ILE D 33 -6.779 1.048 2.078 1.00 0.00 H new ATOM 0 HG23 ILE D 33 -8.487 0.726 2.462 1.00 0.00 H new ATOM 0 HD11 ILE D 33 -10.500 4.425 2.004 1.00 0.00 H new ATOM 0 HD12 ILE D 33 -8.773 4.791 1.776 1.00 0.00 H new ATOM 0 HD13 ILE D 33 -9.464 3.299 1.095 1.00 0.00 H new ATOM 1741 N GLY D 34 -4.937 1.969 4.309 1.00 0.00 N ATOM 1742 CA GLY D 34 -3.656 1.275 4.199 1.00 0.00 C ATOM 1743 C GLY D 34 -3.344 0.490 5.470 1.00 0.00 C ATOM 1744 O GLY D 34 -2.931 -0.670 5.415 1.00 0.00 O ATOM 0 H GLY D 34 -4.873 2.987 4.290 1.00 0.00 H new ATOM 0 HA2 GLY D 34 -3.679 0.597 3.346 1.00 0.00 H new ATOM 0 HA3 GLY D 34 -2.862 1.998 4.011 1.00 0.00 H new ATOM 1748 N ILE D 35 -3.552 1.130 6.615 1.00 0.00 N ATOM 1749 CA ILE D 35 -3.296 0.488 7.898 1.00 0.00 C ATOM 1750 C ILE D 35 -4.233 -0.703 8.083 1.00 0.00 C ATOM 1751 O ILE D 35 -3.818 -1.775 8.532 1.00 0.00 O ATOM 1752 CB ILE D 35 -3.486 1.505 9.028 1.00 0.00 C ATOM 1753 CG1 ILE D 35 -2.373 2.557 8.946 1.00 0.00 C ATOM 1754 CG2 ILE D 35 -3.414 0.795 10.382 1.00 0.00 C ATOM 1755 CD1 ILE D 35 -2.737 3.764 9.812 1.00 0.00 C ATOM 0 H ILE D 35 -3.895 2.088 6.681 1.00 0.00 H new ATOM 0 HA ILE D 35 -2.269 0.124 7.922 1.00 0.00 H new ATOM 0 HB ILE D 35 -4.460 1.985 8.926 1.00 0.00 H new ATOM 0 HG12 ILE D 35 -1.429 2.128 9.282 1.00 0.00 H new ATOM 0 HG13 ILE D 35 -2.231 2.870 7.912 1.00 0.00 H new ATOM 0 HG21 ILE D 35 -3.550 1.523 11.182 1.00 0.00 H new ATOM 0 HG22 ILE D 35 -4.199 0.041 10.440 1.00 0.00 H new ATOM 0 HG23 ILE D 35 -2.442 0.315 10.490 1.00 0.00 H new ATOM 0 HD11 ILE D 35 -1.943 4.509 9.750 1.00 0.00 H new ATOM 0 HD12 ILE D 35 -3.671 4.199 9.456 1.00 0.00 H new ATOM 0 HD13 ILE D 35 -2.857 3.446 10.848 1.00 0.00 H new ATOM 1767 N LEU D 36 -5.497 -0.511 7.721 1.00 0.00 N ATOM 1768 CA LEU D 36 -6.484 -1.575 7.838 1.00 0.00 C ATOM 1769 C LEU D 36 -6.074 -2.763 6.975 1.00 0.00 C ATOM 1770 O LEU D 36 -6.251 -3.921 7.364 1.00 0.00 O ATOM 1771 CB LEU D 36 -7.869 -1.060 7.415 1.00 0.00 C ATOM 1772 CG LEU D 36 -8.929 -2.195 7.512 1.00 0.00 C ATOM 1773 CD1 LEU D 36 -10.248 -1.642 8.069 1.00 0.00 C ATOM 1774 CD2 LEU D 36 -9.193 -2.796 6.121 1.00 0.00 C ATOM 0 H LEU D 36 -5.859 0.366 7.347 1.00 0.00 H new ATOM 0 HA LEU D 36 -6.536 -1.898 8.878 1.00 0.00 H new ATOM 0 HB2 LEU D 36 -8.163 -0.226 8.052 1.00 0.00 H new ATOM 0 HB3 LEU D 36 -7.826 -0.682 6.394 1.00 0.00 H new ATOM 0 HG LEU D 36 -8.543 -2.966 8.178 1.00 0.00 H new ATOM 0 HD11 LEU D 36 -10.982 -2.446 8.132 1.00 0.00 H new ATOM 0 HD12 LEU D 36 -10.078 -1.227 9.062 1.00 0.00 H new ATOM 0 HD13 LEU D 36 -10.622 -0.860 7.408 1.00 0.00 H new ATOM 0 HD21 LEU D 36 -9.936 -3.589 6.202 1.00 0.00 H new ATOM 0 HD22 LEU D 36 -9.564 -2.018 5.453 1.00 0.00 H new ATOM 0 HD23 LEU D 36 -8.266 -3.207 5.720 1.00 0.00 H new ATOM 1786 N HIS D 37 -5.514 -2.472 5.804 1.00 0.00 N ATOM 1787 CA HIS D 37 -5.078 -3.529 4.906 1.00 0.00 C ATOM 1788 C HIS D 37 -4.056 -4.413 5.603 1.00 0.00 C ATOM 1789 O HIS D 37 -4.090 -5.637 5.479 1.00 0.00 O ATOM 1790 CB HIS D 37 -4.447 -2.936 3.646 1.00 0.00 C ATOM 1791 CG HIS D 37 -4.049 -4.058 2.727 1.00 0.00 C ATOM 1792 ND1 HIS D 37 -4.611 -4.229 1.475 1.00 0.00 N ATOM 1793 CD2 HIS D 37 -3.161 -5.095 2.880 1.00 0.00 C ATOM 1794 CE1 HIS D 37 -4.064 -5.330 0.933 1.00 0.00 C ATOM 1795 NE2 HIS D 37 -3.173 -5.893 1.747 1.00 0.00 N ATOM 0 H HIS D 37 -5.354 -1.525 5.461 1.00 0.00 H new ATOM 0 HA HIS D 37 -5.949 -4.121 4.626 1.00 0.00 H new ATOM 0 HB2 HIS D 37 -5.153 -2.272 3.147 1.00 0.00 H new ATOM 0 HB3 HIS D 37 -3.576 -2.336 3.907 1.00 0.00 H new ATOM 0 HD2 HIS D 37 -2.546 -5.263 3.752 1.00 0.00 H new ATOM 0 HE1 HIS D 37 -4.316 -5.712 -0.045 1.00 0.00 H new ATOM 0 HE2 HIS D 37 -2.619 -6.731 1.574 1.00 0.00 H new ATOM 1803 N LEU D 38 -3.146 -3.788 6.342 1.00 0.00 N ATOM 1804 CA LEU D 38 -2.115 -4.533 7.056 1.00 0.00 C ATOM 1805 C LEU D 38 -2.736 -5.483 8.072 1.00 0.00 C ATOM 1806 O LEU D 38 -2.262 -6.600 8.248 1.00 0.00 O ATOM 1807 CB LEU D 38 -1.144 -3.559 7.759 1.00 0.00 C ATOM 1808 CG LEU D 38 0.025 -3.192 6.818 1.00 0.00 C ATOM 1809 CD1 LEU D 38 0.645 -1.862 7.246 1.00 0.00 C ATOM 1810 CD2 LEU D 38 1.105 -4.290 6.865 1.00 0.00 C ATOM 0 H LEU D 38 -3.101 -2.776 6.462 1.00 0.00 H new ATOM 0 HA LEU D 38 -1.558 -5.126 6.331 1.00 0.00 H new ATOM 0 HB2 LEU D 38 -1.677 -2.656 8.057 1.00 0.00 H new ATOM 0 HB3 LEU D 38 -0.757 -4.016 8.670 1.00 0.00 H new ATOM 0 HG LEU D 38 -0.361 -3.104 5.803 1.00 0.00 H new ATOM 0 HD11 LEU D 38 1.468 -1.612 6.577 1.00 0.00 H new ATOM 0 HD12 LEU D 38 -0.110 -1.077 7.201 1.00 0.00 H new ATOM 0 HD13 LEU D 38 1.020 -1.947 8.266 1.00 0.00 H new ATOM 0 HD21 LEU D 38 1.925 -4.023 6.199 1.00 0.00 H new ATOM 0 HD22 LEU D 38 1.482 -4.386 7.883 1.00 0.00 H new ATOM 0 HD23 LEU D 38 0.673 -5.239 6.546 1.00 0.00 H new ATOM 1822 N ILE D 39 -3.783 -5.048 8.751 1.00 0.00 N ATOM 1823 CA ILE D 39 -4.405 -5.910 9.745 1.00 0.00 C ATOM 1824 C ILE D 39 -4.861 -7.221 9.101 1.00 0.00 C ATOM 1825 O ILE D 39 -4.557 -8.306 9.600 1.00 0.00 O ATOM 1826 CB ILE D 39 -5.605 -5.195 10.373 1.00 0.00 C ATOM 1827 CG1 ILE D 39 -5.111 -3.963 11.140 1.00 0.00 C ATOM 1828 CG2 ILE D 39 -6.322 -6.142 11.338 1.00 0.00 C ATOM 1829 CD1 ILE D 39 -6.305 -3.109 11.592 1.00 0.00 C ATOM 0 H ILE D 39 -4.212 -4.129 8.639 1.00 0.00 H new ATOM 0 HA ILE D 39 -3.674 -6.136 10.521 1.00 0.00 H new ATOM 0 HB ILE D 39 -6.298 -4.888 9.589 1.00 0.00 H new ATOM 0 HG12 ILE D 39 -4.528 -4.274 12.007 1.00 0.00 H new ATOM 0 HG13 ILE D 39 -4.450 -3.372 10.507 1.00 0.00 H new ATOM 0 HG21 ILE D 39 -7.175 -5.630 11.783 1.00 0.00 H new ATOM 0 HG22 ILE D 39 -6.669 -7.021 10.795 1.00 0.00 H new ATOM 0 HG23 ILE D 39 -5.633 -6.450 12.124 1.00 0.00 H new ATOM 0 HD11 ILE D 39 -5.943 -2.236 12.136 1.00 0.00 H new ATOM 0 HD12 ILE D 39 -6.871 -2.784 10.719 1.00 0.00 H new ATOM 0 HD13 ILE D 39 -6.950 -3.700 12.242 1.00 0.00 H new ATOM 1841 N LEU D 40 -5.583 -7.116 7.989 1.00 0.00 N ATOM 1842 CA LEU D 40 -6.069 -8.306 7.294 1.00 0.00 C ATOM 1843 C LEU D 40 -4.926 -9.097 6.644 1.00 0.00 C ATOM 1844 O LEU D 40 -4.884 -10.325 6.729 1.00 0.00 O ATOM 1845 CB LEU D 40 -7.077 -7.892 6.220 1.00 0.00 C ATOM 1846 CG LEU D 40 -8.159 -7.000 6.844 1.00 0.00 C ATOM 1847 CD1 LEU D 40 -9.137 -6.553 5.754 1.00 0.00 C ATOM 1848 CD2 LEU D 40 -8.917 -7.775 7.935 1.00 0.00 C ATOM 0 H LEU D 40 -5.843 -6.231 7.553 1.00 0.00 H new ATOM 0 HA LEU D 40 -6.544 -8.952 8.032 1.00 0.00 H new ATOM 0 HB2 LEU D 40 -6.569 -7.357 5.417 1.00 0.00 H new ATOM 0 HB3 LEU D 40 -7.533 -8.776 5.775 1.00 0.00 H new ATOM 0 HG LEU D 40 -7.689 -6.126 7.295 1.00 0.00 H new ATOM 0 HD11 LEU D 40 -9.907 -5.919 6.194 1.00 0.00 H new ATOM 0 HD12 LEU D 40 -8.599 -5.993 4.990 1.00 0.00 H new ATOM 0 HD13 LEU D 40 -9.603 -7.429 5.302 1.00 0.00 H new ATOM 0 HD21 LEU D 40 -9.683 -7.134 8.372 1.00 0.00 H new ATOM 0 HD22 LEU D 40 -9.388 -8.655 7.496 1.00 0.00 H new ATOM 0 HD23 LEU D 40 -8.219 -8.087 8.712 1.00 0.00 H new ATOM 1860 N TRP D 41 -4.006 -8.389 5.989 1.00 0.00 N ATOM 1861 CA TRP D 41 -2.880 -9.040 5.320 1.00 0.00 C ATOM 1862 C TRP D 41 -1.952 -9.708 6.336 1.00 0.00 C ATOM 1863 O TRP D 41 -1.410 -10.782 6.079 1.00 0.00 O ATOM 1864 CB TRP D 41 -2.119 -8.025 4.463 1.00 0.00 C ATOM 1865 CG TRP D 41 -0.905 -8.661 3.856 1.00 0.00 C ATOM 1866 CD1 TRP D 41 -0.885 -9.383 2.707 1.00 0.00 C ATOM 1867 CD2 TRP D 41 0.472 -8.602 4.319 1.00 0.00 C ATOM 1868 NE1 TRP D 41 0.413 -9.787 2.456 1.00 0.00 N ATOM 1869 CE2 TRP D 41 1.285 -9.325 3.420 1.00 0.00 C ATOM 1870 CE3 TRP D 41 1.084 -7.998 5.426 1.00 0.00 C ATOM 1871 CZ2 TRP D 41 2.658 -9.441 3.615 1.00 0.00 C ATOM 1872 CZ3 TRP D 41 2.466 -8.109 5.621 1.00 0.00 C ATOM 1873 CH2 TRP D 41 3.250 -8.829 4.718 1.00 0.00 C ATOM 0 H TRP D 41 -4.017 -7.372 5.908 1.00 0.00 H new ATOM 0 HA TRP D 41 -3.268 -9.821 4.666 1.00 0.00 H new ATOM 0 HB2 TRP D 41 -2.770 -7.643 3.676 1.00 0.00 H new ATOM 0 HB3 TRP D 41 -1.824 -7.172 5.074 1.00 0.00 H new ATOM 0 HD1 TRP D 41 -1.743 -9.606 2.090 1.00 0.00 H new ATOM 0 HE1 TRP D 41 0.692 -10.356 1.657 1.00 0.00 H new ATOM 0 HE3 TRP D 41 0.485 -7.443 6.133 1.00 0.00 H new ATOM 0 HZ2 TRP D 41 3.261 -10.002 2.916 1.00 0.00 H new ATOM 0 HZ3 TRP D 41 2.928 -7.635 6.475 1.00 0.00 H new ATOM 0 HH2 TRP D 41 4.315 -8.912 4.874 1.00 0.00 H new ATOM 1884 N ILE D 42 -1.780 -9.071 7.492 1.00 0.00 N ATOM 1885 CA ILE D 42 -0.923 -9.619 8.539 1.00 0.00 C ATOM 1886 C ILE D 42 -1.472 -10.971 9.003 1.00 0.00 C ATOM 1887 O ILE D 42 -0.717 -11.919 9.207 1.00 0.00 O ATOM 1888 CB ILE D 42 -0.850 -8.636 9.728 1.00 0.00 C ATOM 1889 CG1 ILE D 42 0.132 -7.501 9.399 1.00 0.00 C ATOM 1890 CG2 ILE D 42 -0.373 -9.357 10.999 1.00 0.00 C ATOM 1891 CD1 ILE D 42 -0.105 -6.329 10.355 1.00 0.00 C ATOM 0 H ILE D 42 -2.220 -8.181 7.726 1.00 0.00 H new ATOM 0 HA ILE D 42 0.082 -9.763 8.141 1.00 0.00 H new ATOM 0 HB ILE D 42 -1.847 -8.231 9.902 1.00 0.00 H new ATOM 0 HG12 ILE D 42 1.159 -7.856 9.489 1.00 0.00 H new ATOM 0 HG13 ILE D 42 -0.003 -7.176 8.367 1.00 0.00 H new ATOM 0 HG21 ILE D 42 -0.328 -8.647 11.825 1.00 0.00 H new ATOM 0 HG22 ILE D 42 -1.070 -10.158 11.246 1.00 0.00 H new ATOM 0 HG23 ILE D 42 0.618 -9.778 10.828 1.00 0.00 H new ATOM 0 HD11 ILE D 42 0.591 -5.523 10.122 1.00 0.00 H new ATOM 0 HD12 ILE D 42 -1.128 -5.969 10.243 1.00 0.00 H new ATOM 0 HD13 ILE D 42 0.052 -6.659 11.382 1.00 0.00 H new ATOM 1903 N LEU D 43 -2.785 -11.050 9.167 1.00 0.00 N ATOM 1904 CA LEU D 43 -3.408 -12.294 9.608 1.00 0.00 C ATOM 1905 C LEU D 43 -3.144 -13.405 8.594 1.00 0.00 C ATOM 1906 O LEU D 43 -2.883 -14.550 8.968 1.00 0.00 O ATOM 1907 CB LEU D 43 -4.917 -12.090 9.775 1.00 0.00 C ATOM 1908 CG LEU D 43 -5.197 -11.161 10.970 1.00 0.00 C ATOM 1909 CD1 LEU D 43 -6.668 -10.734 10.941 1.00 0.00 C ATOM 1910 CD2 LEU D 43 -4.892 -11.878 12.301 1.00 0.00 C ATOM 0 H LEU D 43 -3.434 -10.280 9.004 1.00 0.00 H new ATOM 0 HA LEU D 43 -2.977 -12.583 10.567 1.00 0.00 H new ATOM 0 HB2 LEU D 43 -5.337 -11.661 8.865 1.00 0.00 H new ATOM 0 HB3 LEU D 43 -5.407 -13.051 9.929 1.00 0.00 H new ATOM 0 HG LEU D 43 -4.553 -10.285 10.895 1.00 0.00 H new ATOM 0 HD11 LEU D 43 -6.872 -10.076 11.785 1.00 0.00 H new ATOM 0 HD12 LEU D 43 -6.875 -10.206 10.010 1.00 0.00 H new ATOM 0 HD13 LEU D 43 -7.304 -11.616 11.007 1.00 0.00 H new ATOM 0 HD21 LEU D 43 -5.097 -11.204 13.133 1.00 0.00 H new ATOM 0 HD22 LEU D 43 -5.520 -12.764 12.389 1.00 0.00 H new ATOM 0 HD23 LEU D 43 -3.843 -12.173 12.323 1.00 0.00 H new ATOM 1922 N ASP D 44 -3.212 -13.064 7.310 1.00 0.00 N ATOM 1923 CA ASP D 44 -2.977 -14.042 6.248 1.00 0.00 C ATOM 1924 C ASP D 44 -1.539 -14.559 6.293 1.00 0.00 C ATOM 1925 O ASP D 44 -1.272 -15.705 5.926 1.00 0.00 O ATOM 1926 CB ASP D 44 -3.248 -13.413 4.880 1.00 0.00 C ATOM 1927 CG ASP D 44 -4.746 -13.214 4.681 1.00 0.00 C ATOM 1928 OD1 ASP D 44 -5.504 -13.706 5.501 1.00 0.00 O ATOM 1929 OD2 ASP D 44 -5.114 -12.575 3.708 1.00 0.00 O ATOM 0 H ASP D 44 -3.427 -12.123 6.979 1.00 0.00 H new ATOM 0 HA ASP D 44 -3.657 -14.879 6.405 1.00 0.00 H new ATOM 0 HB2 ASP D 44 -2.733 -12.455 4.803 1.00 0.00 H new ATOM 0 HB3 ASP D 44 -2.851 -14.053 4.092 1.00 0.00 H new ATOM 1934 N ARG D 45 -0.617 -13.709 6.737 1.00 0.00 N ATOM 1935 CA ARG D 45 0.792 -14.092 6.814 1.00 0.00 C ATOM 1936 C ARG D 45 0.959 -15.321 7.703 1.00 0.00 C ATOM 1937 O ARG D 45 1.777 -16.197 7.419 1.00 0.00 O ATOM 1938 CB ARG D 45 1.619 -12.933 7.382 1.00 0.00 C ATOM 1939 CG ARG D 45 3.107 -13.296 7.372 1.00 0.00 C ATOM 1940 CD ARG D 45 3.922 -12.129 7.932 1.00 0.00 C ATOM 1941 NE ARG D 45 5.342 -12.469 7.951 1.00 0.00 N ATOM 1942 CZ ARG D 45 6.119 -12.259 6.892 1.00 0.00 C ATOM 1943 NH1 ARG D 45 5.615 -11.742 5.805 1.00 0.00 N ATOM 1944 NH2 ARG D 45 7.385 -12.574 6.939 1.00 0.00 N ATOM 0 H ARG D 45 -0.816 -12.758 7.047 1.00 0.00 H new ATOM 0 HA ARG D 45 1.143 -14.329 5.810 1.00 0.00 H new ATOM 0 HB2 ARG D 45 1.452 -12.033 6.791 1.00 0.00 H new ATOM 0 HB3 ARG D 45 1.297 -12.711 8.399 1.00 0.00 H new ATOM 0 HG2 ARG D 45 3.277 -14.192 7.969 1.00 0.00 H new ATOM 0 HG3 ARG D 45 3.430 -13.524 6.356 1.00 0.00 H new ATOM 0 HD2 ARG D 45 3.762 -11.239 7.324 1.00 0.00 H new ATOM 0 HD3 ARG D 45 3.584 -11.891 8.941 1.00 0.00 H new ATOM 0 HE ARG D 45 5.747 -12.876 8.794 1.00 0.00 H new ATOM 0 HH11 ARG D 45 4.625 -11.499 5.767 1.00 0.00 H new ATOM 0 HH12 ARG D 45 6.211 -11.581 4.993 1.00 0.00 H new ATOM 0 HH21 ARG D 45 7.778 -12.981 7.788 1.00 0.00 H new ATOM 0 HH22 ARG D 45 7.981 -12.413 6.127 1.00 0.00 H new