USER MOD reduce.3.24.130724 H: found=0, std=0, add=415, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 417 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 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= -2.44! K(o=-2.4!,f=-1.2) USER MOD Single : A 111 LYS NZ :NH3+ 166:sc= 1.13 (180deg=1.09) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot -19:sc= -0.127 USER MOD Single : A 131 MET CE :methyl -139:sc= -0.187 (180deg=-2.43!) USER MOD Single : A 132 LYS NZ :NH3+ -163:sc= 2.37 (180deg=1.65) USER MOD Single : A 139 ASN : amide:sc= 0 X(o=0,f=-0.04) USER MOD Single : A 148 MET CE :methyl -142:sc= -0.406 (180deg=-3.33!) USER MOD Single : A 152 LYS NZ :NH3+ -177:sc= -0.267! (180deg=-0.37!) USER MOD ----------------------------------------------------------------- ATOM 31 N GLU A 89 -4.195 -11.937 0.325 1.00 0.00 N ATOM 32 CA GLU A 89 -3.880 -10.812 1.256 1.00 0.00 C ATOM 33 C GLU A 89 -3.496 -9.467 0.534 1.00 0.00 C ATOM 34 O GLU A 89 -3.949 -8.402 0.975 1.00 0.00 O ATOM 35 CB GLU A 89 -2.831 -11.245 2.316 1.00 0.00 C ATOM 36 CG GLU A 89 -2.796 -10.338 3.584 1.00 0.00 C ATOM 37 CD GLU A 89 -4.067 -10.369 4.425 1.00 0.00 C ATOM 38 OE1 GLU A 89 -4.229 -11.307 5.229 1.00 0.00 O ATOM 39 OE2 GLU A 89 -4.979 -9.544 4.204 1.00 0.00 O ATOM 0 HA GLU A 89 -4.808 -10.580 1.779 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -3.041 -12.270 2.621 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -1.843 -11.245 1.855 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -1.956 -10.642 4.208 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -2.607 -9.310 3.274 1.00 0.00 H new ATOM 46 N ILE A 90 -2.704 -9.506 -0.569 1.00 0.00 N ATOM 47 CA ILE A 90 -2.323 -8.288 -1.344 1.00 0.00 C ATOM 48 C ILE A 90 -3.593 -7.661 -1.991 1.00 0.00 C ATOM 49 O ILE A 90 -3.806 -6.474 -1.734 1.00 0.00 O ATOM 50 CB ILE A 90 -1.207 -8.498 -2.425 1.00 0.00 C ATOM 51 CG1 ILE A 90 0.077 -9.231 -1.956 1.00 0.00 C ATOM 52 CG2 ILE A 90 -0.762 -7.166 -3.074 1.00 0.00 C ATOM 53 CD1 ILE A 90 0.054 -10.763 -2.028 1.00 0.00 C ATOM 0 H ILE A 90 -2.314 -10.370 -0.945 1.00 0.00 H new ATOM 0 HA ILE A 90 -1.878 -7.609 -0.617 1.00 0.00 H new ATOM 0 HB ILE A 90 -1.711 -9.150 -3.139 1.00 0.00 H new ATOM 0 HG12 ILE A 90 0.913 -8.873 -2.557 1.00 0.00 H new ATOM 0 HG13 ILE A 90 0.279 -8.941 -0.925 1.00 0.00 H new ATOM 0 HG21 ILE A 90 0.012 -7.363 -3.816 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -1.617 -6.694 -3.558 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -0.367 -6.501 -2.306 1.00 0.00 H new ATOM 0 HD11 ILE A 90 1.006 -11.158 -1.674 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -0.752 -11.145 -1.402 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -0.108 -11.076 -3.059 1.00 0.00 H new ATOM 65 N LEU A 91 -4.423 -8.381 -2.801 1.00 0.00 N ATOM 66 CA LEU A 91 -5.662 -7.756 -3.347 1.00 0.00 C ATOM 67 C LEU A 91 -6.643 -7.356 -2.204 1.00 0.00 C ATOM 68 O LEU A 91 -7.263 -6.301 -2.356 1.00 0.00 O ATOM 69 CB LEU A 91 -6.345 -8.527 -4.512 1.00 0.00 C ATOM 70 CG LEU A 91 -7.519 -9.528 -4.328 1.00 0.00 C ATOM 71 CD1 LEU A 91 -8.325 -9.718 -5.630 1.00 0.00 C ATOM 72 CD2 LEU A 91 -7.037 -10.878 -3.818 1.00 0.00 C ATOM 0 H LEU A 91 -4.267 -9.350 -3.080 1.00 0.00 H new ATOM 0 HA LEU A 91 -5.331 -6.839 -3.835 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -6.699 -7.769 -5.211 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -5.552 -9.079 -5.016 1.00 0.00 H new ATOM 0 HG LEU A 91 -8.177 -9.090 -3.578 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -9.136 -10.426 -5.456 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -8.740 -8.760 -5.944 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -7.669 -10.103 -6.411 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -7.889 -11.549 -3.703 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -6.332 -11.306 -4.531 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -6.545 -10.748 -2.854 1.00 0.00 H new ATOM 84 N ARG A 92 -6.744 -8.105 -1.062 1.00 0.00 N ATOM 85 CA ARG A 92 -7.568 -7.682 0.106 1.00 0.00 C ATOM 86 C ARG A 92 -7.146 -6.236 0.508 1.00 0.00 C ATOM 87 O ARG A 92 -7.931 -5.306 0.294 1.00 0.00 O ATOM 88 CB ARG A 92 -7.411 -8.614 1.357 1.00 0.00 C ATOM 89 CG ARG A 92 -8.513 -9.657 1.642 1.00 0.00 C ATOM 90 CD ARG A 92 -8.551 -10.106 3.130 1.00 0.00 C ATOM 91 NE ARG A 92 -7.347 -10.871 3.586 1.00 0.00 N ATOM 92 CZ ARG A 92 -7.137 -12.169 3.358 1.00 0.00 C ATOM 93 NH1 ARG A 92 -7.978 -12.926 2.701 1.00 0.00 N ATOM 94 NH2 ARG A 92 -6.042 -12.713 3.790 1.00 0.00 N ATOM 0 H ARG A 92 -6.267 -8.997 -0.931 1.00 0.00 H new ATOM 0 HA ARG A 92 -8.612 -7.738 -0.202 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -6.467 -9.149 1.255 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -7.323 -7.976 2.236 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -9.482 -9.238 1.369 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -8.353 -10.529 1.008 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -8.662 -9.223 3.759 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -9.436 -10.722 3.286 1.00 0.00 H new ATOM 0 HE ARG A 92 -6.635 -10.362 4.110 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -8.843 -12.529 2.335 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -7.768 -13.913 2.555 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -5.358 -12.150 4.295 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -5.865 -13.704 3.625 1.00 0.00 H new ATOM 108 N ALA A 93 -5.871 -6.033 0.919 1.00 0.00 N ATOM 109 CA ALA A 93 -5.422 -4.705 1.336 1.00 0.00 C ATOM 110 C ALA A 93 -5.352 -3.656 0.235 1.00 0.00 C ATOM 111 O ALA A 93 -6.142 -2.726 0.378 1.00 0.00 O ATOM 112 CB ALA A 93 -4.108 -4.826 2.132 1.00 0.00 C ATOM 0 H ALA A 93 -5.158 -6.761 0.967 1.00 0.00 H new ATOM 0 HA ALA A 93 -6.204 -4.312 1.986 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -3.777 -3.834 2.441 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -4.273 -5.445 3.014 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -3.344 -5.285 1.505 1.00 0.00 H new ATOM 118 N PHE A 94 -4.560 -3.745 -0.852 1.00 0.00 N ATOM 119 CA PHE A 94 -4.600 -2.636 -1.853 1.00 0.00 C ATOM 120 C PHE A 94 -5.901 -2.550 -2.633 1.00 0.00 C ATOM 121 O PHE A 94 -6.470 -1.454 -2.681 1.00 0.00 O ATOM 122 CB PHE A 94 -3.492 -2.608 -2.920 1.00 0.00 C ATOM 123 CG PHE A 94 -3.263 -1.262 -3.665 1.00 0.00 C ATOM 124 CD1 PHE A 94 -4.231 -0.697 -4.514 1.00 0.00 C ATOM 125 CD2 PHE A 94 -2.100 -0.536 -3.408 1.00 0.00 C ATOM 126 CE1 PHE A 94 -4.075 0.586 -5.013 1.00 0.00 C ATOM 127 CE2 PHE A 94 -1.895 0.704 -3.997 1.00 0.00 C ATOM 128 CZ PHE A 94 -2.897 1.276 -4.775 1.00 0.00 C ATOM 0 H PHE A 94 -3.922 -4.513 -1.061 1.00 0.00 H new ATOM 0 HA PHE A 94 -4.462 -1.794 -1.175 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -2.555 -2.895 -2.443 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -3.718 -3.372 -3.663 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -5.107 -1.270 -4.780 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -1.352 -0.943 -2.744 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -4.867 1.046 -5.585 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -0.960 1.224 -3.852 1.00 0.00 H new ATOM 0 HZ PHE A 94 -2.756 2.261 -5.195 1.00 0.00 H new ATOM 138 N LYS A 95 -6.347 -3.657 -3.257 1.00 0.00 N ATOM 139 CA LYS A 95 -7.566 -3.576 -4.081 1.00 0.00 C ATOM 140 C LYS A 95 -8.837 -3.190 -3.201 1.00 0.00 C ATOM 141 O LYS A 95 -9.798 -2.731 -3.827 1.00 0.00 O ATOM 142 CB LYS A 95 -7.580 -4.792 -5.078 1.00 0.00 C ATOM 143 CG LYS A 95 -6.266 -5.107 -5.923 1.00 0.00 C ATOM 144 CD LYS A 95 -6.482 -6.068 -7.125 1.00 0.00 C ATOM 145 CE LYS A 95 -5.198 -6.849 -7.513 1.00 0.00 C ATOM 146 NZ LYS A 95 -5.506 -8.157 -8.156 1.00 0.00 N ATOM 0 H LYS A 95 -5.906 -4.576 -3.212 1.00 0.00 H new ATOM 0 HA LYS A 95 -7.596 -2.731 -4.769 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -7.826 -5.686 -4.505 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -8.395 -4.631 -5.783 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -5.856 -4.168 -6.295 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -5.518 -5.540 -5.259 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -7.272 -6.777 -6.879 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -6.826 -5.494 -7.985 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -4.599 -6.244 -8.194 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -4.594 -7.018 -6.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -4.619 -8.643 -8.397 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -6.055 -8.746 -7.498 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -6.059 -7.996 -9.022 1.00 0.00 H new ATOM 160 N VAL A 96 -8.859 -3.283 -1.816 1.00 0.00 N ATOM 161 CA VAL A 96 -9.962 -2.659 -1.017 1.00 0.00 C ATOM 162 C VAL A 96 -9.600 -1.123 -0.763 1.00 0.00 C ATOM 163 O VAL A 96 -10.443 -0.243 -0.949 1.00 0.00 O ATOM 164 CB VAL A 96 -10.300 -3.442 0.306 1.00 0.00 C ATOM 165 CG1 VAL A 96 -9.636 -2.990 1.632 1.00 0.00 C ATOM 166 CG2 VAL A 96 -11.789 -3.402 0.603 1.00 0.00 C ATOM 0 H VAL A 96 -8.152 -3.765 -1.262 1.00 0.00 H new ATOM 0 HA VAL A 96 -10.886 -2.717 -1.593 1.00 0.00 H new ATOM 0 HB VAL A 96 -9.895 -4.422 0.053 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -9.974 -3.632 2.445 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -8.552 -3.062 1.539 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -9.914 -1.958 1.845 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -11.991 -3.951 1.523 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -12.109 -2.367 0.721 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -12.337 -3.859 -0.221 1.00 0.00 H new ATOM 176 N PHE A 97 -8.339 -0.847 -0.340 1.00 0.00 N ATOM 177 CA PHE A 97 -7.750 0.484 -0.009 1.00 0.00 C ATOM 178 C PHE A 97 -7.744 1.595 -1.090 1.00 0.00 C ATOM 179 O PHE A 97 -7.710 2.757 -0.687 1.00 0.00 O ATOM 180 CB PHE A 97 -6.345 0.151 0.586 1.00 0.00 C ATOM 181 CG PHE A 97 -5.360 1.100 1.281 1.00 0.00 C ATOM 182 CD1 PHE A 97 -5.612 2.440 1.573 1.00 0.00 C ATOM 183 CD2 PHE A 97 -4.116 0.552 1.641 1.00 0.00 C ATOM 184 CE1 PHE A 97 -4.621 3.237 2.129 1.00 0.00 C ATOM 185 CE2 PHE A 97 -3.145 1.336 2.248 1.00 0.00 C ATOM 186 CZ PHE A 97 -3.402 2.674 2.494 1.00 0.00 C ATOM 0 H PHE A 97 -7.659 -1.596 -0.211 1.00 0.00 H new ATOM 0 HA PHE A 97 -8.413 0.990 0.692 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -6.524 -0.648 1.306 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -5.783 -0.285 -0.240 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -6.585 2.861 1.365 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -3.914 -0.490 1.443 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -4.796 4.292 2.278 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -2.195 0.905 2.527 1.00 0.00 H new ATOM 0 HZ PHE A 97 -2.651 3.285 2.973 1.00 0.00 H new ATOM 196 N ASP A 98 -7.789 1.304 -2.406 1.00 0.00 N ATOM 197 CA ASP A 98 -7.857 2.342 -3.492 1.00 0.00 C ATOM 198 C ASP A 98 -8.777 3.605 -3.206 1.00 0.00 C ATOM 199 O ASP A 98 -8.309 4.732 -3.397 1.00 0.00 O ATOM 200 CB ASP A 98 -8.154 1.518 -4.788 1.00 0.00 C ATOM 201 CG ASP A 98 -8.767 2.213 -6.003 1.00 0.00 C ATOM 202 OD1 ASP A 98 -8.464 3.396 -6.282 1.00 0.00 O ATOM 203 OD2 ASP A 98 -9.543 1.546 -6.717 1.00 0.00 O ATOM 0 H ASP A 98 -7.780 0.348 -2.761 1.00 0.00 H new ATOM 0 HA ASP A 98 -6.919 2.889 -3.587 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -7.215 1.068 -5.110 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -8.820 0.702 -4.509 1.00 0.00 H new ATOM 208 N ALA A 99 -10.011 3.402 -2.678 1.00 0.00 N ATOM 209 CA ALA A 99 -11.015 4.446 -2.313 1.00 0.00 C ATOM 210 C ALA A 99 -11.614 5.291 -3.447 1.00 0.00 C ATOM 211 O ALA A 99 -12.839 5.312 -3.598 1.00 0.00 O ATOM 212 CB ALA A 99 -10.527 5.382 -1.192 1.00 0.00 C ATOM 0 H ALA A 99 -10.354 2.461 -2.484 1.00 0.00 H new ATOM 0 HA ALA A 99 -11.835 3.818 -1.965 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -11.299 6.119 -0.971 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -10.316 4.798 -0.296 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -9.620 5.893 -1.514 1.00 0.00 H new ATOM 218 N ASN A 100 -10.768 5.995 -4.217 1.00 0.00 N ATOM 219 CA ASN A 100 -11.243 6.859 -5.316 1.00 0.00 C ATOM 220 C ASN A 100 -11.872 6.127 -6.563 1.00 0.00 C ATOM 221 O ASN A 100 -12.515 6.811 -7.366 1.00 0.00 O ATOM 222 CB ASN A 100 -10.143 7.876 -5.728 1.00 0.00 C ATOM 223 CG ASN A 100 -8.818 7.355 -6.357 1.00 0.00 C ATOM 224 OD1 ASN A 100 -8.707 6.187 -6.731 1.00 0.00 O ATOM 225 ND2 ASN A 100 -7.778 8.169 -6.531 1.00 0.00 N ATOM 0 H ASN A 100 -9.755 5.985 -4.101 1.00 0.00 H new ATOM 0 HA ASN A 100 -12.095 7.392 -4.895 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -10.590 8.572 -6.437 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -9.880 8.451 -4.840 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -6.923 7.819 -6.963 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -7.837 9.143 -6.232 1.00 0.00 H new ATOM 232 N GLY A 101 -11.723 4.787 -6.737 1.00 0.00 N ATOM 233 CA GLY A 101 -12.312 4.056 -7.890 1.00 0.00 C ATOM 234 C GLY A 101 -11.600 4.047 -9.268 1.00 0.00 C ATOM 235 O GLY A 101 -12.197 3.553 -10.227 1.00 0.00 O ATOM 0 H GLY A 101 -11.201 4.192 -6.094 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -12.432 3.017 -7.584 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -13.312 4.459 -8.048 1.00 0.00 H new ATOM 239 N ASP A 102 -10.362 4.557 -9.373 1.00 0.00 N ATOM 240 CA ASP A 102 -9.539 4.557 -10.616 1.00 0.00 C ATOM 241 C ASP A 102 -8.230 3.679 -10.542 1.00 0.00 C ATOM 242 O ASP A 102 -7.610 3.433 -11.585 1.00 0.00 O ATOM 243 CB ASP A 102 -9.262 6.027 -11.043 1.00 0.00 C ATOM 244 CG ASP A 102 -8.422 6.913 -10.115 1.00 0.00 C ATOM 245 OD1 ASP A 102 -7.289 6.525 -9.760 1.00 0.00 O ATOM 246 OD2 ASP A 102 -8.892 8.014 -9.752 1.00 0.00 O ATOM 0 H ASP A 102 -9.885 4.993 -8.584 1.00 0.00 H new ATOM 0 HA ASP A 102 -10.122 4.060 -11.392 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -8.768 6.002 -12.014 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -10.225 6.517 -11.187 1.00 0.00 H new ATOM 251 N GLY A 103 -7.848 3.190 -9.346 1.00 0.00 N ATOM 252 CA GLY A 103 -6.644 2.382 -9.104 1.00 0.00 C ATOM 253 C GLY A 103 -5.508 3.059 -8.295 1.00 0.00 C ATOM 254 O GLY A 103 -4.501 2.375 -8.095 1.00 0.00 O ATOM 0 H GLY A 103 -8.389 3.354 -8.497 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -6.942 1.474 -8.580 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -6.240 2.075 -10.068 1.00 0.00 H new ATOM 258 N VAL A 104 -5.631 4.333 -7.824 1.00 0.00 N ATOM 259 CA VAL A 104 -4.572 5.015 -7.037 1.00 0.00 C ATOM 260 C VAL A 104 -5.035 5.337 -5.577 1.00 0.00 C ATOM 261 O VAL A 104 -6.211 5.521 -5.259 1.00 0.00 O ATOM 262 CB VAL A 104 -3.972 6.253 -7.810 1.00 0.00 C ATOM 263 CG1 VAL A 104 -4.623 7.637 -7.617 1.00 0.00 C ATOM 264 CG2 VAL A 104 -2.453 6.335 -7.669 1.00 0.00 C ATOM 0 H VAL A 104 -6.460 4.907 -7.979 1.00 0.00 H new ATOM 0 HA VAL A 104 -3.744 4.315 -6.923 1.00 0.00 H new ATOM 0 HB VAL A 104 -4.250 6.011 -8.836 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -4.092 8.376 -8.217 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -5.666 7.596 -7.932 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -4.573 7.919 -6.565 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -2.083 7.202 -8.217 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -2.190 6.432 -6.616 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -2.001 5.430 -8.074 1.00 0.00 H new ATOM 274 N ILE A 105 -4.010 5.403 -4.720 1.00 0.00 N ATOM 275 CA ILE A 105 -4.096 5.710 -3.271 1.00 0.00 C ATOM 276 C ILE A 105 -3.225 6.962 -3.030 1.00 0.00 C ATOM 277 O ILE A 105 -2.041 6.987 -3.362 1.00 0.00 O ATOM 278 CB ILE A 105 -3.551 4.569 -2.330 1.00 0.00 C ATOM 279 CG1 ILE A 105 -4.441 3.308 -2.396 1.00 0.00 C ATOM 280 CG2 ILE A 105 -3.377 4.974 -0.827 1.00 0.00 C ATOM 281 CD1 ILE A 105 -3.800 2.094 -1.727 1.00 0.00 C ATOM 0 H ILE A 105 -3.050 5.238 -5.022 1.00 0.00 H new ATOM 0 HA ILE A 105 -5.150 5.841 -3.027 1.00 0.00 H new ATOM 0 HB ILE A 105 -2.555 4.365 -2.723 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -5.397 3.518 -1.917 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -4.652 3.073 -3.439 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -2.998 4.122 -0.262 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -2.672 5.802 -0.753 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -4.340 5.280 -0.419 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -4.471 1.239 -1.805 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -2.857 1.861 -2.222 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -3.613 2.314 -0.676 1.00 0.00 H new ATOM 293 N ASP A 106 -3.806 7.939 -2.336 1.00 0.00 N ATOM 294 CA ASP A 106 -3.113 9.183 -1.936 1.00 0.00 C ATOM 295 C ASP A 106 -2.795 9.168 -0.396 1.00 0.00 C ATOM 296 O ASP A 106 -2.946 8.149 0.298 1.00 0.00 O ATOM 297 CB ASP A 106 -3.949 10.369 -2.503 1.00 0.00 C ATOM 298 CG ASP A 106 -5.197 10.835 -1.735 1.00 0.00 C ATOM 299 OD1 ASP A 106 -5.676 10.132 -0.815 1.00 0.00 O ATOM 300 OD2 ASP A 106 -5.705 11.924 -2.072 1.00 0.00 O ATOM 0 H ASP A 106 -4.778 7.899 -2.029 1.00 0.00 H new ATOM 0 HA ASP A 106 -2.117 9.294 -2.364 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -3.282 11.226 -2.598 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -4.265 10.097 -3.510 1.00 0.00 H new ATOM 305 N PHE A 107 -2.290 10.296 0.136 1.00 0.00 N ATOM 306 CA PHE A 107 -1.978 10.414 1.592 1.00 0.00 C ATOM 307 C PHE A 107 -3.267 10.509 2.478 1.00 0.00 C ATOM 308 O PHE A 107 -3.286 9.922 3.564 1.00 0.00 O ATOM 309 CB PHE A 107 -0.965 11.553 1.869 1.00 0.00 C ATOM 310 CG PHE A 107 -0.092 11.299 3.123 1.00 0.00 C ATOM 311 CD1 PHE A 107 1.029 10.461 3.044 1.00 0.00 C ATOM 312 CD2 PHE A 107 -0.454 11.836 4.365 1.00 0.00 C ATOM 313 CE1 PHE A 107 1.766 10.157 4.187 1.00 0.00 C ATOM 314 CE2 PHE A 107 0.287 11.532 5.506 1.00 0.00 C ATOM 315 CZ PHE A 107 1.393 10.693 5.417 1.00 0.00 C ATOM 0 H PHE A 107 -2.087 11.137 -0.405 1.00 0.00 H new ATOM 0 HA PHE A 107 -1.489 9.486 1.890 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -0.317 11.674 1.001 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -1.507 12.490 1.995 1.00 0.00 H new ATOM 0 HD1 PHE A 107 1.324 10.048 2.091 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -1.311 12.489 4.439 1.00 0.00 H new ATOM 0 HE1 PHE A 107 2.625 9.506 4.119 1.00 0.00 H new ATOM 0 HE2 PHE A 107 0.002 11.949 6.461 1.00 0.00 H new ATOM 0 HZ PHE A 107 1.963 10.457 6.303 1.00 0.00 H new ATOM 325 N ASP A 108 -4.323 11.227 2.020 1.00 0.00 N ATOM 326 CA ASP A 108 -5.637 11.315 2.735 1.00 0.00 C ATOM 327 C ASP A 108 -6.297 9.898 2.937 1.00 0.00 C ATOM 328 O ASP A 108 -6.732 9.595 4.058 1.00 0.00 O ATOM 329 CB ASP A 108 -6.616 12.331 2.075 1.00 0.00 C ATOM 330 CG ASP A 108 -6.248 13.799 2.296 1.00 0.00 C ATOM 331 OD1 ASP A 108 -6.556 14.315 3.396 1.00 0.00 O ATOM 332 OD2 ASP A 108 -5.640 14.433 1.413 1.00 0.00 O ATOM 0 H ASP A 108 -4.296 11.761 1.151 1.00 0.00 H new ATOM 0 HA ASP A 108 -5.418 11.708 3.728 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -6.654 12.136 1.003 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -7.618 12.158 2.466 1.00 0.00 H new ATOM 337 N GLU A 109 -6.353 9.010 1.916 1.00 0.00 N ATOM 338 CA GLU A 109 -6.875 7.621 2.108 1.00 0.00 C ATOM 339 C GLU A 109 -6.006 6.787 3.140 1.00 0.00 C ATOM 340 O GLU A 109 -6.565 6.031 3.945 1.00 0.00 O ATOM 341 CB GLU A 109 -7.093 6.965 0.720 1.00 0.00 C ATOM 342 CG GLU A 109 -7.629 5.518 0.746 1.00 0.00 C ATOM 343 CD GLU A 109 -8.787 5.159 1.682 1.00 0.00 C ATOM 344 OE1 GLU A 109 -9.646 6.020 1.969 1.00 0.00 O ATOM 345 OE2 GLU A 109 -8.867 3.981 2.080 1.00 0.00 O ATOM 0 H GLU A 109 -6.051 9.218 0.964 1.00 0.00 H new ATOM 0 HA GLU A 109 -7.852 7.648 2.590 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -7.789 7.582 0.151 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -6.146 6.973 0.181 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -7.939 5.266 -0.268 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -6.793 4.865 0.995 1.00 0.00 H new ATOM 352 N PHE A 110 -4.655 6.948 3.143 1.00 0.00 N ATOM 353 CA PHE A 110 -3.741 6.330 4.142 1.00 0.00 C ATOM 354 C PHE A 110 -4.114 6.838 5.581 1.00 0.00 C ATOM 355 O PHE A 110 -4.217 6.016 6.490 1.00 0.00 O ATOM 356 CB PHE A 110 -2.261 6.607 3.726 1.00 0.00 C ATOM 357 CG PHE A 110 -1.232 5.497 4.024 1.00 0.00 C ATOM 358 CD1 PHE A 110 -0.857 5.180 5.334 1.00 0.00 C ATOM 359 CD2 PHE A 110 -0.619 4.825 2.959 1.00 0.00 C ATOM 360 CE1 PHE A 110 0.114 4.206 5.572 1.00 0.00 C ATOM 361 CE2 PHE A 110 0.334 3.839 3.198 1.00 0.00 C ATOM 362 CZ PHE A 110 0.710 3.538 4.502 1.00 0.00 C ATOM 0 H PHE A 110 -4.167 7.513 2.448 1.00 0.00 H new ATOM 0 HA PHE A 110 -3.854 5.246 4.167 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -2.242 6.808 2.655 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -1.933 7.517 4.227 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -1.321 5.691 6.165 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -0.888 5.074 1.943 1.00 0.00 H new ATOM 0 HE1 PHE A 110 0.404 3.969 6.585 1.00 0.00 H new ATOM 0 HE2 PHE A 110 0.781 3.308 2.371 1.00 0.00 H new ATOM 0 HZ PHE A 110 1.464 2.787 4.687 1.00 0.00 H new ATOM 372 N LYS A 111 -4.357 8.165 5.760 1.00 0.00 N ATOM 373 CA LYS A 111 -4.854 8.784 7.028 1.00 0.00 C ATOM 374 C LYS A 111 -6.192 8.126 7.519 1.00 0.00 C ATOM 375 O LYS A 111 -6.307 7.817 8.710 1.00 0.00 O ATOM 376 CB LYS A 111 -4.951 10.324 6.758 1.00 0.00 C ATOM 377 CG LYS A 111 -5.775 11.232 7.719 1.00 0.00 C ATOM 378 CD LYS A 111 -7.245 11.555 7.345 1.00 0.00 C ATOM 379 CE LYS A 111 -7.525 12.265 6.003 1.00 0.00 C ATOM 380 NZ LYS A 111 -6.780 13.547 5.850 1.00 0.00 N ATOM 0 H LYS A 111 -4.212 8.849 5.017 1.00 0.00 H new ATOM 0 HA LYS A 111 -4.170 8.608 7.859 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -3.933 10.714 6.736 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -5.363 10.453 5.757 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -5.778 10.760 8.701 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -5.242 12.178 7.821 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -7.801 10.617 7.346 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -7.661 12.173 8.140 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -7.258 11.597 5.184 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -8.594 12.461 5.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -6.817 13.854 4.857 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -7.213 14.275 6.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -5.789 13.408 6.132 1.00 0.00 H new ATOM 394 N PHE A 112 -7.174 7.935 6.606 1.00 0.00 N ATOM 395 CA PHE A 112 -8.463 7.255 6.913 1.00 0.00 C ATOM 396 C PHE A 112 -8.276 5.777 7.399 1.00 0.00 C ATOM 397 O PHE A 112 -8.816 5.405 8.444 1.00 0.00 O ATOM 398 CB PHE A 112 -9.367 7.357 5.637 1.00 0.00 C ATOM 399 CG PHE A 112 -10.586 6.408 5.557 1.00 0.00 C ATOM 400 CD1 PHE A 112 -11.773 6.740 6.212 1.00 0.00 C ATOM 401 CD2 PHE A 112 -10.476 5.161 4.924 1.00 0.00 C ATOM 402 CE1 PHE A 112 -12.853 5.859 6.201 1.00 0.00 C ATOM 403 CE2 PHE A 112 -11.555 4.280 4.916 1.00 0.00 C ATOM 404 CZ PHE A 112 -12.743 4.632 5.549 1.00 0.00 C ATOM 0 H PHE A 112 -7.099 8.246 5.637 1.00 0.00 H new ATOM 0 HA PHE A 112 -8.946 7.754 7.753 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -9.731 8.382 5.562 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -8.740 7.176 4.764 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -11.855 7.684 6.730 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -9.551 4.883 4.441 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -13.774 6.127 6.697 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -11.470 3.325 4.419 1.00 0.00 H new ATOM 0 HZ PHE A 112 -13.582 3.953 5.535 1.00 0.00 H new ATOM 414 N ILE A 113 -7.551 4.954 6.619 1.00 0.00 N ATOM 415 CA ILE A 113 -7.334 3.511 6.924 1.00 0.00 C ATOM 416 C ILE A 113 -6.344 3.180 8.078 1.00 0.00 C ATOM 417 O ILE A 113 -6.493 2.130 8.709 1.00 0.00 O ATOM 418 CB ILE A 113 -7.036 2.802 5.544 1.00 0.00 C ATOM 419 CG1 ILE A 113 -7.985 1.591 5.350 1.00 0.00 C ATOM 420 CG2 ILE A 113 -5.572 2.428 5.254 1.00 0.00 C ATOM 421 CD1 ILE A 113 -8.100 1.062 3.913 1.00 0.00 C ATOM 0 H ILE A 113 -7.096 5.261 5.759 1.00 0.00 H new ATOM 0 HA ILE A 113 -8.240 3.102 7.373 1.00 0.00 H new ATOM 0 HB ILE A 113 -7.237 3.570 4.797 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -7.644 0.778 5.991 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -8.980 1.873 5.695 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -5.505 1.949 4.277 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -4.958 3.329 5.259 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -5.213 1.741 6.020 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -8.788 0.217 3.890 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -8.476 1.853 3.263 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -7.119 0.741 3.564 1.00 0.00 H new ATOM 433 N MET A 114 -5.352 4.055 8.333 1.00 0.00 N ATOM 434 CA MET A 114 -4.371 3.907 9.445 1.00 0.00 C ATOM 435 C MET A 114 -5.157 3.912 10.796 1.00 0.00 C ATOM 436 O MET A 114 -5.182 2.891 11.489 1.00 0.00 O ATOM 437 CB MET A 114 -3.298 5.029 9.346 1.00 0.00 C ATOM 438 CG MET A 114 -2.137 4.884 10.335 1.00 0.00 C ATOM 439 SD MET A 114 -0.799 3.928 9.590 1.00 0.00 S ATOM 440 CE MET A 114 0.254 3.634 11.028 1.00 0.00 C ATOM 0 H MET A 114 -5.201 4.894 7.773 1.00 0.00 H new ATOM 0 HA MET A 114 -3.831 2.963 9.382 1.00 0.00 H new ATOM 0 HB2 MET A 114 -2.896 5.042 8.333 1.00 0.00 H new ATOM 0 HB3 MET A 114 -3.781 5.992 9.510 1.00 0.00 H new ATOM 0 HG2 MET A 114 -1.772 5.869 10.625 1.00 0.00 H new ATOM 0 HG3 MET A 114 -2.483 4.392 11.244 1.00 0.00 H new ATOM 0 HE1 MET A 114 1.126 3.053 10.728 1.00 0.00 H new ATOM 0 HE2 MET A 114 0.579 4.588 11.442 1.00 0.00 H new ATOM 0 HE3 MET A 114 -0.307 3.083 11.783 1.00 0.00 H new ATOM 575 N THR A 123 1.355 10.087 15.362 1.00 0.00 N ATOM 576 CA THR A 123 2.839 10.147 15.385 1.00 0.00 C ATOM 577 C THR A 123 3.193 10.014 13.879 1.00 0.00 C ATOM 578 O THR A 123 2.896 9.024 13.197 1.00 0.00 O ATOM 579 CB THR A 123 3.633 9.097 16.185 1.00 0.00 C ATOM 580 OG1 THR A 123 3.117 7.789 15.985 1.00 0.00 O ATOM 581 CG2 THR A 123 3.685 9.372 17.697 1.00 0.00 C ATOM 0 HA THR A 123 3.127 11.058 15.910 1.00 0.00 H new ATOM 0 HB THR A 123 4.649 9.170 15.797 1.00 0.00 H new ATOM 0 HG1 THR A 123 2.203 7.848 15.636 1.00 0.00 H new ATOM 0 HG21 THR A 123 4.261 8.589 18.190 1.00 0.00 H new ATOM 0 HG22 THR A 123 4.158 10.338 17.875 1.00 0.00 H new ATOM 0 HG23 THR A 123 2.672 9.385 18.100 1.00 0.00 H new ATOM 589 N ASP A 124 3.829 11.078 13.404 1.00 0.00 N ATOM 590 CA ASP A 124 4.288 11.216 12.000 1.00 0.00 C ATOM 591 C ASP A 124 5.248 10.141 11.462 1.00 0.00 C ATOM 592 O ASP A 124 5.091 9.697 10.324 1.00 0.00 O ATOM 593 CB ASP A 124 4.863 12.644 11.839 1.00 0.00 C ATOM 594 CG ASP A 124 6.131 13.029 12.614 1.00 0.00 C ATOM 595 OD1 ASP A 124 6.044 13.213 13.848 1.00 0.00 O ATOM 596 OD2 ASP A 124 7.209 13.133 11.995 1.00 0.00 O ATOM 0 H ASP A 124 4.051 11.889 13.981 1.00 0.00 H new ATOM 0 HA ASP A 124 3.413 11.049 11.372 1.00 0.00 H new ATOM 0 HB2 ASP A 124 5.066 12.799 10.779 1.00 0.00 H new ATOM 0 HB3 ASP A 124 4.079 13.348 12.120 1.00 0.00 H new ATOM 601 N ALA A 125 6.194 9.731 12.311 1.00 0.00 N ATOM 602 CA ALA A 125 7.176 8.682 11.971 1.00 0.00 C ATOM 603 C ALA A 125 6.556 7.320 11.570 1.00 0.00 C ATOM 604 O ALA A 125 7.067 6.720 10.620 1.00 0.00 O ATOM 605 CB ALA A 125 8.179 8.557 13.125 1.00 0.00 C ATOM 0 H ALA A 125 6.306 10.111 13.251 1.00 0.00 H new ATOM 0 HA ALA A 125 7.692 8.996 11.064 1.00 0.00 H new ATOM 0 HB1 ALA A 125 8.911 7.785 12.888 1.00 0.00 H new ATOM 0 HB2 ALA A 125 8.689 9.510 13.269 1.00 0.00 H new ATOM 0 HB3 ALA A 125 7.650 8.287 14.039 1.00 0.00 H new ATOM 611 N GLU A 126 5.462 6.848 12.215 1.00 0.00 N ATOM 612 CA GLU A 126 4.807 5.571 11.820 1.00 0.00 C ATOM 613 C GLU A 126 4.205 5.621 10.367 1.00 0.00 C ATOM 614 O GLU A 126 4.521 4.778 9.510 1.00 0.00 O ATOM 615 CB GLU A 126 3.709 5.275 12.878 1.00 0.00 C ATOM 616 CG GLU A 126 4.142 5.256 14.364 1.00 0.00 C ATOM 617 CD GLU A 126 4.633 3.922 14.903 1.00 0.00 C ATOM 618 OE1 GLU A 126 3.799 3.128 15.383 1.00 0.00 O ATOM 619 OE2 GLU A 126 5.857 3.679 14.871 1.00 0.00 O ATOM 0 H GLU A 126 5.017 7.322 13.001 1.00 0.00 H new ATOM 0 HA GLU A 126 5.549 4.773 11.794 1.00 0.00 H new ATOM 0 HB2 GLU A 126 2.922 6.021 12.765 1.00 0.00 H new ATOM 0 HB3 GLU A 126 3.266 4.307 12.643 1.00 0.00 H new ATOM 0 HG2 GLU A 126 4.934 5.993 14.500 1.00 0.00 H new ATOM 0 HG3 GLU A 126 3.297 5.581 14.971 1.00 0.00 H new ATOM 626 N VAL A 127 3.383 6.668 10.108 1.00 0.00 N ATOM 627 CA VAL A 127 2.704 6.887 8.808 1.00 0.00 C ATOM 628 C VAL A 127 3.708 7.312 7.698 1.00 0.00 C ATOM 629 O VAL A 127 3.636 6.744 6.601 1.00 0.00 O ATOM 630 CB VAL A 127 1.489 7.868 8.959 1.00 0.00 C ATOM 631 CG1 VAL A 127 0.538 7.754 7.752 1.00 0.00 C ATOM 632 CG2 VAL A 127 0.624 7.668 10.231 1.00 0.00 C ATOM 0 H VAL A 127 3.172 7.388 10.799 1.00 0.00 H new ATOM 0 HA VAL A 127 2.287 5.935 8.479 1.00 0.00 H new ATOM 0 HB VAL A 127 1.962 8.847 9.029 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -0.296 8.444 7.880 1.00 0.00 H new ATOM 0 HG12 VAL A 127 1.078 8.003 6.839 1.00 0.00 H new ATOM 0 HG13 VAL A 127 0.159 6.734 7.683 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -0.187 8.396 10.237 1.00 0.00 H new ATOM 0 HG22 VAL A 127 0.208 6.661 10.233 1.00 0.00 H new ATOM 0 HG23 VAL A 127 1.243 7.807 11.117 1.00 0.00 H new ATOM 642 N GLU A 128 4.631 8.276 7.959 1.00 0.00 N ATOM 643 CA GLU A 128 5.672 8.676 6.976 1.00 0.00 C ATOM 644 C GLU A 128 6.588 7.471 6.629 1.00 0.00 C ATOM 645 O GLU A 128 6.711 7.186 5.439 1.00 0.00 O ATOM 646 CB GLU A 128 6.438 9.923 7.507 1.00 0.00 C ATOM 647 CG GLU A 128 7.476 10.585 6.557 1.00 0.00 C ATOM 648 CD GLU A 128 8.916 10.070 6.537 1.00 0.00 C ATOM 649 OE1 GLU A 128 9.253 9.023 7.123 1.00 0.00 O ATOM 650 OE2 GLU A 128 9.750 10.731 5.891 1.00 0.00 O ATOM 0 H GLU A 128 4.675 8.789 8.840 1.00 0.00 H new ATOM 0 HA GLU A 128 5.210 8.971 6.034 1.00 0.00 H new ATOM 0 HB2 GLU A 128 5.702 10.679 7.780 1.00 0.00 H new ATOM 0 HB3 GLU A 128 6.955 9.636 8.423 1.00 0.00 H new ATOM 0 HG2 GLU A 128 7.087 10.505 5.542 1.00 0.00 H new ATOM 0 HG3 GLU A 128 7.512 11.646 6.802 1.00 0.00 H new ATOM 657 N GLU A 129 7.138 6.708 7.608 1.00 0.00 N ATOM 658 CA GLU A 129 7.984 5.530 7.295 1.00 0.00 C ATOM 659 C GLU A 129 7.218 4.422 6.507 1.00 0.00 C ATOM 660 O GLU A 129 7.781 3.938 5.520 1.00 0.00 O ATOM 661 CB GLU A 129 8.711 5.019 8.566 1.00 0.00 C ATOM 662 CG GLU A 129 9.966 4.140 8.296 1.00 0.00 C ATOM 663 CD GLU A 129 11.088 4.821 7.513 1.00 0.00 C ATOM 664 OE1 GLU A 129 11.630 5.850 7.975 1.00 0.00 O ATOM 665 OE2 GLU A 129 11.390 4.377 6.388 1.00 0.00 O ATOM 0 H GLU A 129 7.013 6.884 8.605 1.00 0.00 H new ATOM 0 HA GLU A 129 8.763 5.853 6.604 1.00 0.00 H new ATOM 0 HB2 GLU A 129 9.010 5.879 9.166 1.00 0.00 H new ATOM 0 HB3 GLU A 129 8.004 4.443 9.164 1.00 0.00 H new ATOM 0 HG2 GLU A 129 10.366 3.804 9.253 1.00 0.00 H new ATOM 0 HG3 GLU A 129 9.654 3.249 7.750 1.00 0.00 H new ATOM 672 N ALA A 130 5.955 4.067 6.863 1.00 0.00 N ATOM 673 CA ALA A 130 5.193 3.058 6.081 1.00 0.00 C ATOM 674 C ALA A 130 4.818 3.512 4.633 1.00 0.00 C ATOM 675 O ALA A 130 5.017 2.718 3.703 1.00 0.00 O ATOM 676 CB ALA A 130 3.956 2.607 6.880 1.00 0.00 C ATOM 0 H ALA A 130 5.454 4.452 7.664 1.00 0.00 H new ATOM 0 HA ALA A 130 5.859 2.208 5.932 1.00 0.00 H new ATOM 0 HB1 ALA A 130 3.400 1.868 6.303 1.00 0.00 H new ATOM 0 HB2 ALA A 130 4.274 2.166 7.825 1.00 0.00 H new ATOM 0 HB3 ALA A 130 3.317 3.468 7.078 1.00 0.00 H new ATOM 682 N MET A 131 4.309 4.751 4.407 1.00 0.00 N ATOM 683 CA MET A 131 3.983 5.208 3.018 1.00 0.00 C ATOM 684 C MET A 131 5.263 5.558 2.207 1.00 0.00 C ATOM 685 O MET A 131 5.259 5.274 1.011 1.00 0.00 O ATOM 686 CB MET A 131 2.950 6.357 3.056 1.00 0.00 C ATOM 687 CG MET A 131 2.109 6.557 1.793 1.00 0.00 C ATOM 688 SD MET A 131 3.079 7.340 0.497 1.00 0.00 S ATOM 689 CE MET A 131 1.740 7.874 -0.578 1.00 0.00 C ATOM 0 H MET A 131 4.118 5.436 5.138 1.00 0.00 H new ATOM 0 HA MET A 131 3.519 4.381 2.481 1.00 0.00 H new ATOM 0 HB2 MET A 131 2.274 6.181 3.893 1.00 0.00 H new ATOM 0 HB3 MET A 131 3.480 7.286 3.264 1.00 0.00 H new ATOM 0 HG2 MET A 131 1.736 5.595 1.443 1.00 0.00 H new ATOM 0 HG3 MET A 131 1.239 7.171 2.024 1.00 0.00 H new ATOM 0 HE1 MET A 131 2.017 7.700 -1.618 1.00 0.00 H new ATOM 0 HE2 MET A 131 0.838 7.309 -0.344 1.00 0.00 H new ATOM 0 HE3 MET A 131 1.552 8.937 -0.425 1.00 0.00 H new ATOM 699 N LYS A 132 6.326 6.170 2.783 1.00 0.00 N ATOM 700 CA LYS A 132 7.614 6.404 2.066 1.00 0.00 C ATOM 701 C LYS A 132 8.264 5.021 1.706 1.00 0.00 C ATOM 702 O LYS A 132 8.679 4.883 0.557 1.00 0.00 O ATOM 703 CB LYS A 132 8.483 7.362 2.915 1.00 0.00 C ATOM 704 CG LYS A 132 9.977 7.562 2.549 1.00 0.00 C ATOM 705 CD LYS A 132 10.785 8.140 3.736 1.00 0.00 C ATOM 706 CE LYS A 132 11.031 7.112 4.865 1.00 0.00 C ATOM 707 NZ LYS A 132 11.379 7.786 6.139 1.00 0.00 N ATOM 0 H LYS A 132 6.322 6.513 3.744 1.00 0.00 H new ATOM 0 HA LYS A 132 7.479 6.905 1.108 1.00 0.00 H new ATOM 0 HB2 LYS A 132 8.007 8.342 2.892 1.00 0.00 H new ATOM 0 HB3 LYS A 132 8.443 7.012 3.947 1.00 0.00 H new ATOM 0 HG2 LYS A 132 10.408 6.608 2.246 1.00 0.00 H new ATOM 0 HG3 LYS A 132 10.055 8.234 1.694 1.00 0.00 H new ATOM 0 HD2 LYS A 132 11.745 8.505 3.370 1.00 0.00 H new ATOM 0 HD3 LYS A 132 10.253 8.999 4.145 1.00 0.00 H new ATOM 0 HE2 LYS A 132 10.139 6.502 5.005 1.00 0.00 H new ATOM 0 HE3 LYS A 132 11.836 6.437 4.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 11.813 7.099 6.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 12.051 8.557 5.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 10.518 8.175 6.572 1.00 0.00 H new ATOM 721 N GLU A 133 8.348 4.000 2.607 1.00 0.00 N ATOM 722 CA GLU A 133 8.877 2.658 2.223 1.00 0.00 C ATOM 723 C GLU A 133 7.970 1.945 1.144 1.00 0.00 C ATOM 724 O GLU A 133 8.529 1.269 0.272 1.00 0.00 O ATOM 725 CB GLU A 133 9.197 1.820 3.499 1.00 0.00 C ATOM 726 CG GLU A 133 8.069 1.053 4.241 1.00 0.00 C ATOM 727 CD GLU A 133 7.866 -0.395 3.826 1.00 0.00 C ATOM 728 OE1 GLU A 133 7.156 -0.657 2.833 1.00 0.00 O ATOM 729 OE2 GLU A 133 8.442 -1.298 4.463 1.00 0.00 O ATOM 0 H GLU A 133 8.063 4.077 3.583 1.00 0.00 H new ATOM 0 HA GLU A 133 9.830 2.776 1.706 1.00 0.00 H new ATOM 0 HB2 GLU A 133 9.955 1.088 3.221 1.00 0.00 H new ATOM 0 HB3 GLU A 133 9.656 2.496 4.221 1.00 0.00 H new ATOM 0 HG2 GLU A 133 8.282 1.078 5.310 1.00 0.00 H new ATOM 0 HG3 GLU A 133 7.132 1.589 4.090 1.00 0.00 H new ATOM 736 N ALA A 134 6.617 2.131 1.177 1.00 0.00 N ATOM 737 CA ALA A 134 5.697 1.560 0.158 1.00 0.00 C ATOM 738 C ALA A 134 5.695 2.313 -1.221 1.00 0.00 C ATOM 739 O ALA A 134 5.551 1.653 -2.254 1.00 0.00 O ATOM 740 CB ALA A 134 4.311 1.372 0.756 1.00 0.00 C ATOM 0 H ALA A 134 6.144 2.673 1.900 1.00 0.00 H new ATOM 0 HA ALA A 134 6.087 0.578 -0.109 1.00 0.00 H new ATOM 0 HB1 ALA A 134 3.643 0.953 0.003 1.00 0.00 H new ATOM 0 HB2 ALA A 134 4.371 0.692 1.606 1.00 0.00 H new ATOM 0 HB3 ALA A 134 3.924 2.335 1.088 1.00 0.00 H new ATOM 746 N ASP A 135 5.909 3.665 -1.358 1.00 0.00 N ATOM 747 CA ASP A 135 5.992 4.340 -2.709 1.00 0.00 C ATOM 748 C ASP A 135 7.404 4.073 -3.341 1.00 0.00 C ATOM 749 O ASP A 135 8.450 4.522 -2.855 1.00 0.00 O ATOM 750 CB ASP A 135 5.728 5.883 -2.745 1.00 0.00 C ATOM 751 CG ASP A 135 5.857 6.564 -4.158 1.00 0.00 C ATOM 752 OD1 ASP A 135 5.726 5.955 -5.210 1.00 0.00 O ATOM 753 OD2 ASP A 135 6.026 7.828 -4.128 1.00 0.00 O ATOM 0 H ASP A 135 6.025 4.300 -0.568 1.00 0.00 H new ATOM 0 HA ASP A 135 5.174 3.894 -3.275 1.00 0.00 H new ATOM 0 HB2 ASP A 135 4.725 6.071 -2.362 1.00 0.00 H new ATOM 0 HB3 ASP A 135 6.426 6.369 -2.063 1.00 0.00 H new ATOM 758 N GLU A 136 7.389 3.329 -4.445 1.00 0.00 N ATOM 759 CA GLU A 136 8.599 3.023 -5.248 1.00 0.00 C ATOM 760 C GLU A 136 9.078 4.109 -6.277 1.00 0.00 C ATOM 761 O GLU A 136 10.275 4.154 -6.586 1.00 0.00 O ATOM 762 CB GLU A 136 8.362 1.670 -5.966 1.00 0.00 C ATOM 763 CG GLU A 136 8.421 0.435 -5.026 1.00 0.00 C ATOM 764 CD GLU A 136 9.421 -0.680 -5.379 1.00 0.00 C ATOM 765 OE1 GLU A 136 10.208 -0.546 -6.343 1.00 0.00 O ATOM 766 OE2 GLU A 136 9.503 -1.652 -4.612 1.00 0.00 O ATOM 0 H GLU A 136 6.537 2.913 -4.821 1.00 0.00 H new ATOM 0 HA GLU A 136 9.421 2.993 -4.533 1.00 0.00 H new ATOM 0 HB2 GLU A 136 7.388 1.696 -6.454 1.00 0.00 H new ATOM 0 HB3 GLU A 136 9.109 1.552 -6.751 1.00 0.00 H new ATOM 0 HG2 GLU A 136 8.652 0.788 -4.021 1.00 0.00 H new ATOM 0 HG3 GLU A 136 7.425 -0.006 -4.988 1.00 0.00 H new ATOM 773 N ASP A 137 8.157 4.913 -6.853 1.00 0.00 N ATOM 774 CA ASP A 137 8.500 5.869 -7.960 1.00 0.00 C ATOM 775 C ASP A 137 9.031 7.305 -7.651 1.00 0.00 C ATOM 776 O ASP A 137 9.630 7.928 -8.540 1.00 0.00 O ATOM 777 CB ASP A 137 7.212 5.893 -8.843 1.00 0.00 C ATOM 778 CG ASP A 137 7.160 6.860 -10.034 1.00 0.00 C ATOM 779 OD1 ASP A 137 6.873 8.056 -9.807 1.00 0.00 O ATOM 780 OD2 ASP A 137 7.424 6.438 -11.182 1.00 0.00 O ATOM 0 H ASP A 137 7.174 4.929 -6.581 1.00 0.00 H new ATOM 0 HA ASP A 137 9.407 5.489 -8.430 1.00 0.00 H new ATOM 0 HB2 ASP A 137 7.054 4.885 -9.227 1.00 0.00 H new ATOM 0 HB3 ASP A 137 6.368 6.122 -8.192 1.00 0.00 H new ATOM 785 N GLY A 138 8.926 7.808 -6.419 1.00 0.00 N ATOM 786 CA GLY A 138 9.258 9.215 -6.095 1.00 0.00 C ATOM 787 C GLY A 138 8.113 10.235 -6.440 1.00 0.00 C ATOM 788 O GLY A 138 8.310 11.436 -6.243 1.00 0.00 O ATOM 0 H GLY A 138 8.611 7.263 -5.616 1.00 0.00 H new ATOM 0 HA2 GLY A 138 9.488 9.288 -5.032 1.00 0.00 H new ATOM 0 HA3 GLY A 138 10.160 9.499 -6.637 1.00 0.00 H new ATOM 792 N ASN A 139 6.917 9.763 -6.885 1.00 0.00 N ATOM 793 CA ASN A 139 5.725 10.597 -7.181 1.00 0.00 C ATOM 794 C ASN A 139 4.956 10.951 -5.878 1.00 0.00 C ATOM 795 O ASN A 139 4.662 12.137 -5.693 1.00 0.00 O ATOM 796 CB ASN A 139 4.829 9.879 -8.240 1.00 0.00 C ATOM 797 CG ASN A 139 3.313 10.203 -8.355 1.00 0.00 C ATOM 798 OD1 ASN A 139 2.473 9.313 -8.232 1.00 0.00 O ATOM 799 ND2 ASN A 139 2.915 11.451 -8.561 1.00 0.00 N ATOM 0 H ASN A 139 6.754 8.770 -7.051 1.00 0.00 H new ATOM 0 HA ASN A 139 6.043 11.547 -7.612 1.00 0.00 H new ATOM 0 HB2 ASN A 139 5.272 10.072 -9.217 1.00 0.00 H new ATOM 0 HB3 ASN A 139 4.914 8.808 -8.057 1.00 0.00 H new ATOM 0 HD21 ASN A 139 1.920 11.666 -8.616 1.00 0.00 H new ATOM 0 HD22 ASN A 139 3.604 12.196 -8.664 1.00 0.00 H new ATOM 806 N GLY A 140 4.608 9.967 -5.016 1.00 0.00 N ATOM 807 CA GLY A 140 3.826 10.265 -3.795 1.00 0.00 C ATOM 808 C GLY A 140 2.365 9.755 -3.757 1.00 0.00 C ATOM 809 O GLY A 140 1.748 9.964 -2.712 1.00 0.00 O ATOM 0 H GLY A 140 4.849 8.984 -5.139 1.00 0.00 H new ATOM 0 HA2 GLY A 140 4.355 9.842 -2.941 1.00 0.00 H new ATOM 0 HA3 GLY A 140 3.812 11.346 -3.657 1.00 0.00 H new ATOM 813 N VAL A 141 1.762 9.206 -4.842 1.00 0.00 N ATOM 814 CA VAL A 141 0.390 8.608 -4.791 1.00 0.00 C ATOM 815 C VAL A 141 0.602 7.283 -5.582 1.00 0.00 C ATOM 816 O VAL A 141 1.025 7.213 -6.742 1.00 0.00 O ATOM 817 CB VAL A 141 -0.839 9.517 -5.161 1.00 0.00 C ATOM 818 CG1 VAL A 141 -0.754 10.890 -4.476 1.00 0.00 C ATOM 819 CG2 VAL A 141 -1.348 9.735 -6.588 1.00 0.00 C ATOM 0 H VAL A 141 2.197 9.162 -5.763 1.00 0.00 H new ATOM 0 HA VAL A 141 0.035 8.442 -3.774 1.00 0.00 H new ATOM 0 HB VAL A 141 -1.596 8.829 -4.784 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -1.620 11.490 -4.755 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -0.739 10.757 -3.394 1.00 0.00 H new ATOM 0 HG13 VAL A 141 0.157 11.398 -4.792 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -2.207 10.405 -6.569 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -0.556 10.177 -7.193 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -1.643 8.778 -7.019 1.00 0.00 H new ATOM 829 N ILE A 142 0.300 6.229 -4.824 1.00 0.00 N ATOM 830 CA ILE A 142 0.531 4.826 -5.190 1.00 0.00 C ATOM 831 C ILE A 142 -0.524 4.168 -6.094 1.00 0.00 C ATOM 832 O ILE A 142 -1.700 4.175 -5.759 1.00 0.00 O ATOM 833 CB ILE A 142 0.613 3.926 -3.889 1.00 0.00 C ATOM 834 CG1 ILE A 142 1.254 4.526 -2.583 1.00 0.00 C ATOM 835 CG2 ILE A 142 1.336 2.621 -4.223 1.00 0.00 C ATOM 836 CD1 ILE A 142 1.501 3.538 -1.443 1.00 0.00 C ATOM 0 H ILE A 142 -0.128 6.329 -3.904 1.00 0.00 H new ATOM 0 HA ILE A 142 1.461 4.874 -5.757 1.00 0.00 H new ATOM 0 HB ILE A 142 -0.437 3.805 -3.623 1.00 0.00 H new ATOM 0 HG12 ILE A 142 2.204 4.989 -2.848 1.00 0.00 H new ATOM 0 HG13 ILE A 142 0.604 5.320 -2.215 1.00 0.00 H new ATOM 0 HG21 ILE A 142 1.395 1.999 -3.330 1.00 0.00 H new ATOM 0 HG22 ILE A 142 0.787 2.090 -5.000 1.00 0.00 H new ATOM 0 HG23 ILE A 142 2.343 2.843 -4.577 1.00 0.00 H new ATOM 0 HD11 ILE A 142 1.944 4.062 -0.597 1.00 0.00 H new ATOM 0 HD12 ILE A 142 0.555 3.091 -1.138 1.00 0.00 H new ATOM 0 HD13 ILE A 142 2.180 2.755 -1.781 1.00 0.00 H new ATOM 848 N ASP A 143 -0.068 3.549 -7.183 1.00 0.00 N ATOM 849 CA ASP A 143 -0.905 2.722 -8.074 1.00 0.00 C ATOM 850 C ASP A 143 -0.752 1.249 -7.578 1.00 0.00 C ATOM 851 O ASP A 143 0.246 0.867 -6.945 1.00 0.00 O ATOM 852 CB ASP A 143 -0.581 2.957 -9.566 1.00 0.00 C ATOM 853 CG ASP A 143 0.750 2.549 -10.205 1.00 0.00 C ATOM 854 OD1 ASP A 143 1.480 1.697 -9.654 1.00 0.00 O ATOM 855 OD2 ASP A 143 1.030 3.044 -11.318 1.00 0.00 O ATOM 0 H ASP A 143 0.906 3.604 -7.481 1.00 0.00 H new ATOM 0 HA ASP A 143 -1.958 3.000 -8.020 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -1.364 2.456 -10.135 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -0.694 4.027 -9.742 1.00 0.00 H new ATOM 860 N ILE A 144 -1.741 0.383 -7.854 1.00 0.00 N ATOM 861 CA ILE A 144 -1.687 -1.033 -7.379 1.00 0.00 C ATOM 862 C ILE A 144 -0.373 -1.783 -7.844 1.00 0.00 C ATOM 863 O ILE A 144 0.184 -2.450 -6.967 1.00 0.00 O ATOM 864 CB ILE A 144 -2.945 -1.911 -7.792 1.00 0.00 C ATOM 865 CG1 ILE A 144 -4.315 -1.177 -8.017 1.00 0.00 C ATOM 866 CG2 ILE A 144 -3.047 -3.232 -6.964 1.00 0.00 C ATOM 867 CD1 ILE A 144 -5.632 -1.929 -7.751 1.00 0.00 C ATOM 0 H ILE A 144 -2.576 0.619 -8.391 1.00 0.00 H new ATOM 0 HA ILE A 144 -1.690 -0.935 -6.293 1.00 0.00 H new ATOM 0 HB ILE A 144 -2.713 -2.189 -8.820 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -4.315 -0.286 -7.389 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -4.337 -0.837 -9.052 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -3.923 -3.796 -7.285 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -2.151 -3.832 -7.124 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -3.138 -2.991 -5.905 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -6.475 -1.270 -7.958 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -5.688 -2.804 -8.398 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -5.666 -2.245 -6.709 1.00 0.00 H new ATOM 879 N PRO A 145 0.173 -1.717 -9.111 1.00 0.00 N ATOM 880 CA PRO A 145 1.450 -2.378 -9.492 1.00 0.00 C ATOM 881 C PRO A 145 2.680 -2.021 -8.601 1.00 0.00 C ATOM 882 O PRO A 145 3.524 -2.900 -8.425 1.00 0.00 O ATOM 883 CB PRO A 145 1.620 -2.034 -10.983 1.00 0.00 C ATOM 884 CG PRO A 145 0.192 -1.773 -11.470 1.00 0.00 C ATOM 885 CD PRO A 145 -0.440 -1.055 -10.279 1.00 0.00 C ATOM 0 HA PRO A 145 1.402 -3.454 -9.323 1.00 0.00 H new ATOM 0 HB2 PRO A 145 2.255 -1.158 -11.120 1.00 0.00 H new ATOM 0 HB3 PRO A 145 2.085 -2.854 -11.531 1.00 0.00 H new ATOM 0 HG2 PRO A 145 0.177 -1.157 -12.369 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -0.331 -2.699 -11.709 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -0.224 0.013 -10.294 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -1.525 -1.161 -10.276 1.00 0.00 H new ATOM 893 N GLU A 146 2.791 -0.788 -8.030 1.00 0.00 N ATOM 894 CA GLU A 146 3.883 -0.419 -7.085 1.00 0.00 C ATOM 895 C GLU A 146 3.811 -1.306 -5.809 1.00 0.00 C ATOM 896 O GLU A 146 4.793 -1.994 -5.560 1.00 0.00 O ATOM 897 CB GLU A 146 3.809 1.082 -6.717 1.00 0.00 C ATOM 898 CG GLU A 146 4.347 2.061 -7.777 1.00 0.00 C ATOM 899 CD GLU A 146 4.213 3.503 -7.313 1.00 0.00 C ATOM 900 OE1 GLU A 146 5.160 3.991 -6.665 1.00 0.00 O ATOM 901 OE2 GLU A 146 3.159 4.128 -7.558 1.00 0.00 O ATOM 0 H GLU A 146 2.133 -0.030 -8.210 1.00 0.00 H new ATOM 0 HA GLU A 146 4.840 -0.595 -7.576 1.00 0.00 H new ATOM 0 HB2 GLU A 146 2.769 1.335 -6.511 1.00 0.00 H new ATOM 0 HB3 GLU A 146 4.364 1.237 -5.792 1.00 0.00 H new ATOM 0 HG2 GLU A 146 5.394 1.838 -7.983 1.00 0.00 H new ATOM 0 HG3 GLU A 146 3.802 1.925 -8.711 1.00 0.00 H new ATOM 908 N PHE A 147 2.690 -1.330 -5.047 1.00 0.00 N ATOM 909 CA PHE A 147 2.509 -2.217 -3.846 1.00 0.00 C ATOM 910 C PHE A 147 2.779 -3.746 -4.115 1.00 0.00 C ATOM 911 O PHE A 147 3.398 -4.421 -3.282 1.00 0.00 O ATOM 912 CB PHE A 147 1.115 -1.934 -3.234 1.00 0.00 C ATOM 913 CG PHE A 147 0.662 -2.816 -2.050 1.00 0.00 C ATOM 914 CD1 PHE A 147 1.238 -2.723 -0.778 1.00 0.00 C ATOM 915 CD2 PHE A 147 -0.376 -3.725 -2.257 1.00 0.00 C ATOM 916 CE1 PHE A 147 0.750 -3.509 0.269 1.00 0.00 C ATOM 917 CE2 PHE A 147 -0.911 -4.447 -1.192 1.00 0.00 C ATOM 918 CZ PHE A 147 -0.341 -4.347 0.068 1.00 0.00 C ATOM 0 H PHE A 147 1.880 -0.740 -5.238 1.00 0.00 H new ATOM 0 HA PHE A 147 3.281 -1.966 -3.118 1.00 0.00 H new ATOM 0 HB2 PHE A 147 1.097 -0.895 -2.905 1.00 0.00 H new ATOM 0 HB3 PHE A 147 0.374 -2.030 -4.027 1.00 0.00 H new ATOM 0 HD1 PHE A 147 2.060 -2.044 -0.606 1.00 0.00 H new ATOM 0 HD2 PHE A 147 -0.769 -3.870 -3.252 1.00 0.00 H new ATOM 0 HE1 PHE A 147 1.223 -3.465 1.239 1.00 0.00 H new ATOM 0 HE2 PHE A 147 -1.769 -5.084 -1.348 1.00 0.00 H new ATOM 0 HZ PHE A 147 -0.743 -4.919 0.891 1.00 0.00 H new ATOM 928 N MET A 148 2.320 -4.287 -5.263 1.00 0.00 N ATOM 929 CA MET A 148 2.593 -5.703 -5.651 1.00 0.00 C ATOM 930 C MET A 148 4.129 -5.919 -5.915 1.00 0.00 C ATOM 931 O MET A 148 4.709 -6.864 -5.363 1.00 0.00 O ATOM 932 CB MET A 148 1.733 -6.141 -6.857 1.00 0.00 C ATOM 933 CG MET A 148 0.198 -6.080 -6.733 1.00 0.00 C ATOM 934 SD MET A 148 -0.537 -7.673 -7.230 1.00 0.00 S ATOM 935 CE MET A 148 0.061 -8.896 -6.015 1.00 0.00 C ATOM 0 H MET A 148 1.759 -3.773 -5.942 1.00 0.00 H new ATOM 0 HA MET A 148 2.306 -6.342 -4.816 1.00 0.00 H new ATOM 0 HB2 MET A 148 2.020 -5.525 -7.709 1.00 0.00 H new ATOM 0 HB3 MET A 148 2.004 -7.168 -7.101 1.00 0.00 H new ATOM 0 HG2 MET A 148 -0.082 -5.846 -5.706 1.00 0.00 H new ATOM 0 HG3 MET A 148 -0.193 -5.279 -7.360 1.00 0.00 H new ATOM 0 HE1 MET A 148 0.269 -9.839 -6.520 1.00 0.00 H new ATOM 0 HE2 MET A 148 0.973 -8.527 -5.546 1.00 0.00 H new ATOM 0 HE3 MET A 148 -0.701 -9.053 -5.252 1.00 0.00 H new ATOM 945 N ASP A 149 4.781 -5.040 -6.728 1.00 0.00 N ATOM 946 CA ASP A 149 6.258 -5.087 -6.980 1.00 0.00 C ATOM 947 C ASP A 149 7.107 -4.876 -5.671 1.00 0.00 C ATOM 948 O ASP A 149 8.128 -5.545 -5.483 1.00 0.00 O ATOM 949 CB ASP A 149 6.612 -4.101 -8.126 1.00 0.00 C ATOM 950 CG ASP A 149 7.776 -4.600 -8.961 1.00 0.00 C ATOM 951 OD1 ASP A 149 7.581 -5.560 -9.740 1.00 0.00 O ATOM 952 OD2 ASP A 149 8.926 -4.174 -8.749 1.00 0.00 O ATOM 0 H ASP A 149 4.307 -4.285 -7.224 1.00 0.00 H new ATOM 0 HA ASP A 149 6.531 -6.090 -7.308 1.00 0.00 H new ATOM 0 HB2 ASP A 149 5.741 -3.959 -8.765 1.00 0.00 H new ATOM 0 HB3 ASP A 149 6.859 -3.127 -7.704 1.00 0.00 H new ATOM 957 N LEU A 150 6.621 -3.985 -4.780 1.00 0.00 N ATOM 958 CA LEU A 150 7.120 -3.676 -3.428 1.00 0.00 C ATOM 959 C LEU A 150 7.138 -4.954 -2.551 1.00 0.00 C ATOM 960 O LEU A 150 8.175 -5.213 -1.933 1.00 0.00 O ATOM 961 CB LEU A 150 6.142 -2.545 -2.972 1.00 0.00 C ATOM 962 CG LEU A 150 6.057 -1.994 -1.542 1.00 0.00 C ATOM 963 CD1 LEU A 150 5.415 -2.920 -0.492 1.00 0.00 C ATOM 964 CD2 LEU A 150 7.434 -1.506 -1.159 1.00 0.00 C ATOM 0 H LEU A 150 5.804 -3.419 -5.009 1.00 0.00 H new ATOM 0 HA LEU A 150 8.154 -3.339 -3.363 1.00 0.00 H new ATOM 0 HB2 LEU A 150 6.350 -1.689 -3.614 1.00 0.00 H new ATOM 0 HB3 LEU A 150 5.140 -2.894 -3.221 1.00 0.00 H new ATOM 0 HG LEU A 150 5.345 -1.169 -1.547 1.00 0.00 H new ATOM 0 HD11 LEU A 150 5.411 -2.423 0.478 1.00 0.00 H new ATOM 0 HD12 LEU A 150 4.391 -3.149 -0.786 1.00 0.00 H new ATOM 0 HD13 LEU A 150 5.988 -3.845 -0.423 1.00 0.00 H new ATOM 0 HD21 LEU A 150 7.410 -1.107 -0.145 1.00 0.00 H new ATOM 0 HD22 LEU A 150 8.140 -2.335 -1.205 1.00 0.00 H new ATOM 0 HD23 LEU A 150 7.748 -0.723 -1.850 1.00 0.00 H new ATOM 976 N ILE A 151 6.032 -5.750 -2.494 1.00 0.00 N ATOM 977 CA ILE A 151 6.041 -7.031 -1.725 1.00 0.00 C ATOM 978 C ILE A 151 6.972 -8.086 -2.419 1.00 0.00 C ATOM 979 O ILE A 151 7.696 -8.790 -1.709 1.00 0.00 O ATOM 980 CB ILE A 151 4.578 -7.536 -1.432 1.00 0.00 C ATOM 981 CG1 ILE A 151 3.816 -6.538 -0.505 1.00 0.00 C ATOM 982 CG2 ILE A 151 4.540 -8.961 -0.808 1.00 0.00 C ATOM 983 CD1 ILE A 151 2.330 -6.823 -0.243 1.00 0.00 C ATOM 0 H ILE A 151 5.148 -5.537 -2.956 1.00 0.00 H new ATOM 0 HA ILE A 151 6.477 -6.858 -0.741 1.00 0.00 H new ATOM 0 HB ILE A 151 4.080 -7.589 -2.400 1.00 0.00 H new ATOM 0 HG12 ILE A 151 4.330 -6.509 0.456 1.00 0.00 H new ATOM 0 HG13 ILE A 151 3.898 -5.542 -0.940 1.00 0.00 H new ATOM 0 HG21 ILE A 151 3.505 -9.253 -0.629 1.00 0.00 H new ATOM 0 HG22 ILE A 151 5.004 -9.671 -1.493 1.00 0.00 H new ATOM 0 HG23 ILE A 151 5.085 -8.959 0.136 1.00 0.00 H new ATOM 0 HD11 ILE A 151 1.923 -6.055 0.415 1.00 0.00 H new ATOM 0 HD12 ILE A 151 1.786 -6.817 -1.188 1.00 0.00 H new ATOM 0 HD13 ILE A 151 2.225 -7.799 0.230 1.00 0.00 H new ATOM 995 N LYS A 152 6.966 -8.183 -3.762 1.00 0.00 N ATOM 996 CA LYS A 152 7.839 -9.113 -4.514 1.00 0.00 C ATOM 997 C LYS A 152 9.390 -8.894 -4.320 1.00 0.00 C ATOM 998 O LYS A 152 10.063 -9.803 -3.826 1.00 0.00 O ATOM 999 CB LYS A 152 7.356 -8.988 -5.994 1.00 0.00 C ATOM 1000 CG LYS A 152 8.010 -9.934 -7.032 1.00 0.00 C ATOM 1001 CD LYS A 152 7.899 -9.425 -8.493 1.00 0.00 C ATOM 1002 CE LYS A 152 9.121 -8.642 -9.029 1.00 0.00 C ATOM 1003 NZ LYS A 152 9.193 -7.249 -8.526 1.00 0.00 N ATOM 0 H LYS A 152 6.358 -7.621 -4.358 1.00 0.00 H new ATOM 0 HA LYS A 152 7.738 -10.130 -4.134 1.00 0.00 H new ATOM 0 HB2 LYS A 152 6.279 -9.157 -6.014 1.00 0.00 H new ATOM 0 HB3 LYS A 152 7.524 -7.961 -6.319 1.00 0.00 H new ATOM 0 HG2 LYS A 152 9.063 -10.064 -6.780 1.00 0.00 H new ATOM 0 HG3 LYS A 152 7.542 -10.916 -6.962 1.00 0.00 H new ATOM 0 HD2 LYS A 152 7.727 -10.282 -9.144 1.00 0.00 H new ATOM 0 HD3 LYS A 152 7.020 -8.785 -8.569 1.00 0.00 H new ATOM 0 HE2 LYS A 152 10.033 -9.169 -8.749 1.00 0.00 H new ATOM 0 HE3 LYS A 152 9.084 -8.626 -10.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 10.004 -6.764 -8.961 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 8.316 -6.746 -8.771 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 9.309 -7.259 -7.493 1.00 0.00 H new