USER MOD reduce.3.24.130724 H: found=0, std=0, add=415, rem=0, adj=5 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= 0 K(o=0,f=-0.9) USER MOD Single : A 111 LYS NZ :NH3+ 169:sc= 1.06 (180deg=0.8) USER MOD Single : A 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 123 THR OG1 : rot -23:sc= -0.396 USER MOD Single : A 131 MET CE :methyl 165:sc= -0.636 (180deg=-0.681) USER MOD Single : A 132 LYS NZ :NH3+ 167:sc= 2.06 (180deg=1.22) USER MOD Single : A 139 ASN : amide:sc= -0.0316 X(o=-0.032,f=-0.42) USER MOD Single : A 148 MET CE :methyl 176:sc= -0.0251 (180deg=-0.0447) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 31 N GLU A 89 -3.946 -11.980 0.303 1.00 0.00 N ATOM 32 CA GLU A 89 -3.746 -10.778 1.149 1.00 0.00 C ATOM 33 C GLU A 89 -3.276 -9.489 0.399 1.00 0.00 C ATOM 34 O GLU A 89 -3.607 -8.407 0.893 1.00 0.00 O ATOM 35 CB GLU A 89 -2.894 -11.149 2.385 1.00 0.00 C ATOM 36 CG GLU A 89 -3.592 -12.142 3.359 1.00 0.00 C ATOM 37 CD GLU A 89 -3.053 -12.144 4.775 1.00 0.00 C ATOM 38 OE1 GLU A 89 -3.463 -11.277 5.574 1.00 0.00 O ATOM 39 OE2 GLU A 89 -2.227 -13.022 5.099 1.00 0.00 O ATOM 0 HA GLU A 89 -4.732 -10.467 1.494 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -1.954 -11.587 2.048 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -2.644 -10.238 2.928 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -4.656 -11.906 3.393 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -3.502 -13.149 2.952 1.00 0.00 H new ATOM 46 N ILE A 90 -2.580 -9.541 -0.767 1.00 0.00 N ATOM 47 CA ILE A 90 -2.178 -8.317 -1.511 1.00 0.00 C ATOM 48 C ILE A 90 -3.421 -7.715 -2.220 1.00 0.00 C ATOM 49 O ILE A 90 -3.686 -6.539 -1.953 1.00 0.00 O ATOM 50 CB ILE A 90 -0.986 -8.510 -2.520 1.00 0.00 C ATOM 51 CG1 ILE A 90 0.374 -8.862 -1.877 1.00 0.00 C ATOM 52 CG2 ILE A 90 -0.759 -7.262 -3.419 1.00 0.00 C ATOM 53 CD1 ILE A 90 0.580 -10.291 -1.409 1.00 0.00 C ATOM 0 H ILE A 90 -2.287 -10.412 -1.210 1.00 0.00 H new ATOM 0 HA ILE A 90 -1.788 -7.623 -0.767 1.00 0.00 H new ATOM 0 HB ILE A 90 -1.316 -9.366 -3.108 1.00 0.00 H new ATOM 0 HG12 ILE A 90 1.157 -8.628 -2.598 1.00 0.00 H new ATOM 0 HG13 ILE A 90 0.522 -8.203 -1.021 1.00 0.00 H new ATOM 0 HG21 ILE A 90 0.074 -7.448 -4.096 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -1.660 -7.063 -3.999 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -0.532 -6.399 -2.793 1.00 0.00 H new ATOM 0 HD11 ILE A 90 1.577 -10.393 -0.980 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -0.167 -10.538 -0.655 1.00 0.00 H new ATOM 0 HD13 ILE A 90 0.478 -10.969 -2.256 1.00 0.00 H new ATOM 65 N LEU A 91 -4.150 -8.429 -3.120 1.00 0.00 N ATOM 66 CA LEU A 91 -5.347 -7.824 -3.766 1.00 0.00 C ATOM 67 C LEU A 91 -6.428 -7.495 -2.688 1.00 0.00 C ATOM 68 O LEU A 91 -6.939 -6.377 -2.743 1.00 0.00 O ATOM 69 CB LEU A 91 -5.831 -8.617 -5.019 1.00 0.00 C ATOM 70 CG LEU A 91 -6.940 -9.702 -5.011 1.00 0.00 C ATOM 71 CD1 LEU A 91 -8.370 -9.152 -4.781 1.00 0.00 C ATOM 72 CD2 LEU A 91 -6.957 -10.417 -6.382 1.00 0.00 C ATOM 0 H LEU A 91 -3.942 -9.386 -3.406 1.00 0.00 H new ATOM 0 HA LEU A 91 -5.076 -6.863 -4.204 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -6.151 -7.867 -5.743 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -4.944 -9.099 -5.430 1.00 0.00 H new ATOM 0 HG LEU A 91 -6.695 -10.364 -4.180 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -9.083 -9.977 -4.790 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -8.414 -8.645 -3.817 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -8.621 -8.447 -5.574 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -7.734 -11.181 -6.384 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -7.160 -9.691 -7.169 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -5.988 -10.884 -6.561 1.00 0.00 H new ATOM 84 N ARG A 92 -6.715 -8.355 -1.668 1.00 0.00 N ATOM 85 CA ARG A 92 -7.710 -8.015 -0.612 1.00 0.00 C ATOM 86 C ARG A 92 -7.269 -6.728 0.176 1.00 0.00 C ATOM 87 O ARG A 92 -8.045 -5.764 0.175 1.00 0.00 O ATOM 88 CB ARG A 92 -7.998 -9.230 0.325 1.00 0.00 C ATOM 89 CG ARG A 92 -8.915 -10.406 -0.144 1.00 0.00 C ATOM 90 CD ARG A 92 -8.763 -10.943 -1.588 1.00 0.00 C ATOM 91 NE ARG A 92 -8.921 -12.427 -1.701 1.00 0.00 N ATOM 92 CZ ARG A 92 -8.624 -13.129 -2.808 1.00 0.00 C ATOM 93 NH1 ARG A 92 -8.396 -12.576 -3.965 1.00 0.00 N ATOM 94 NH2 ARG A 92 -8.499 -14.419 -2.751 1.00 0.00 N ATOM 0 H ARG A 92 -6.280 -9.271 -1.557 1.00 0.00 H new ATOM 0 HA ARG A 92 -8.657 -7.782 -1.099 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -7.034 -9.663 0.592 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -8.433 -8.831 1.241 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -8.754 -11.242 0.537 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -9.950 -10.087 -0.018 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -9.503 -10.459 -2.225 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -7.781 -10.662 -1.969 1.00 0.00 H new ATOM 0 HE ARG A 92 -9.275 -12.935 -0.891 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -8.439 -11.562 -4.063 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -8.175 -13.157 -4.773 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -8.626 -14.905 -1.863 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -8.274 -14.947 -3.594 1.00 0.00 H new ATOM 108 N ALA A 93 -6.026 -6.648 0.729 1.00 0.00 N ATOM 109 CA ALA A 93 -5.580 -5.451 1.481 1.00 0.00 C ATOM 110 C ALA A 93 -5.406 -4.167 0.643 1.00 0.00 C ATOM 111 O ALA A 93 -6.046 -3.187 1.019 1.00 0.00 O ATOM 112 CB ALA A 93 -4.318 -5.758 2.309 1.00 0.00 C ATOM 0 H ALA A 93 -5.328 -7.389 0.667 1.00 0.00 H new ATOM 0 HA ALA A 93 -6.407 -5.222 2.153 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -4.012 -4.863 2.851 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -4.534 -6.556 3.019 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -3.514 -6.072 1.644 1.00 0.00 H new ATOM 118 N PHE A 94 -4.612 -4.134 -0.453 1.00 0.00 N ATOM 119 CA PHE A 94 -4.470 -2.901 -1.292 1.00 0.00 C ATOM 120 C PHE A 94 -5.799 -2.488 -1.953 1.00 0.00 C ATOM 121 O PHE A 94 -6.153 -1.307 -1.873 1.00 0.00 O ATOM 122 CB PHE A 94 -3.404 -3.005 -2.429 1.00 0.00 C ATOM 123 CG PHE A 94 -3.018 -1.676 -3.150 1.00 0.00 C ATOM 124 CD1 PHE A 94 -3.932 -1.029 -3.998 1.00 0.00 C ATOM 125 CD2 PHE A 94 -1.789 -1.056 -2.902 1.00 0.00 C ATOM 126 CE1 PHE A 94 -3.676 0.250 -4.479 1.00 0.00 C ATOM 127 CE2 PHE A 94 -1.485 0.174 -3.483 1.00 0.00 C ATOM 128 CZ PHE A 94 -2.441 0.839 -4.248 1.00 0.00 C ATOM 0 H PHE A 94 -4.064 -4.929 -0.781 1.00 0.00 H new ATOM 0 HA PHE A 94 -4.139 -2.152 -0.573 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -2.498 -3.439 -2.007 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -3.773 -3.704 -3.179 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -4.845 -1.532 -4.280 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -1.069 -1.535 -2.255 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -4.436 0.783 -5.031 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -0.508 0.612 -3.340 1.00 0.00 H new ATOM 0 HZ PHE A 94 -2.221 1.812 -4.661 1.00 0.00 H new ATOM 138 N LYS A 95 -6.490 -3.424 -2.636 1.00 0.00 N ATOM 139 CA LYS A 95 -7.764 -3.084 -3.319 1.00 0.00 C ATOM 140 C LYS A 95 -8.883 -2.659 -2.271 1.00 0.00 C ATOM 141 O LYS A 95 -9.783 -1.917 -2.672 1.00 0.00 O ATOM 142 CB LYS A 95 -8.061 -4.161 -4.411 1.00 0.00 C ATOM 143 CG LYS A 95 -6.861 -4.488 -5.391 1.00 0.00 C ATOM 144 CD LYS A 95 -7.257 -5.338 -6.614 1.00 0.00 C ATOM 145 CE LYS A 95 -6.040 -5.767 -7.470 1.00 0.00 C ATOM 146 NZ LYS A 95 -6.492 -6.708 -8.531 1.00 0.00 N ATOM 0 H LYS A 95 -6.201 -4.398 -2.731 1.00 0.00 H new ATOM 0 HA LYS A 95 -7.714 -2.169 -3.909 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -8.363 -5.083 -3.914 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -8.911 -3.826 -5.005 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -6.426 -3.551 -5.739 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -6.085 -5.013 -4.834 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -7.788 -6.228 -6.275 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -7.950 -4.771 -7.235 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -5.571 -4.892 -7.920 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -5.288 -6.244 -6.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -5.677 -6.998 -9.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -6.921 -7.547 -8.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -7.194 -6.237 -9.136 1.00 0.00 H new ATOM 160 N VAL A 96 -8.817 -3.056 -0.956 1.00 0.00 N ATOM 161 CA VAL A 96 -9.698 -2.482 0.115 1.00 0.00 C ATOM 162 C VAL A 96 -9.206 -1.033 0.428 1.00 0.00 C ATOM 163 O VAL A 96 -10.020 -0.108 0.492 1.00 0.00 O ATOM 164 CB VAL A 96 -9.685 -3.306 1.463 1.00 0.00 C ATOM 165 CG1 VAL A 96 -10.027 -2.587 2.805 1.00 0.00 C ATOM 166 CG2 VAL A 96 -10.681 -4.426 1.323 1.00 0.00 C ATOM 0 H VAL A 96 -8.167 -3.766 -0.618 1.00 0.00 H new ATOM 0 HA VAL A 96 -10.719 -2.509 -0.266 1.00 0.00 H new ATOM 0 HB VAL A 96 -8.637 -3.587 1.565 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -9.970 -3.302 3.626 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -9.315 -1.780 2.977 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -11.035 -2.176 2.751 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -10.697 -5.016 2.240 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -11.672 -4.011 1.142 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -10.396 -5.064 0.486 1.00 0.00 H new ATOM 176 N PHE A 97 -7.882 -0.882 0.662 1.00 0.00 N ATOM 177 CA PHE A 97 -7.224 0.382 1.009 1.00 0.00 C ATOM 178 C PHE A 97 -7.540 1.610 0.091 1.00 0.00 C ATOM 179 O PHE A 97 -7.670 2.724 0.595 1.00 0.00 O ATOM 180 CB PHE A 97 -5.694 0.099 1.095 1.00 0.00 C ATOM 181 CG PHE A 97 -4.981 0.821 2.230 1.00 0.00 C ATOM 182 CD1 PHE A 97 -4.536 2.121 2.022 1.00 0.00 C ATOM 183 CD2 PHE A 97 -4.748 0.196 3.463 1.00 0.00 C ATOM 184 CE1 PHE A 97 -3.867 2.797 3.027 1.00 0.00 C ATOM 185 CE2 PHE A 97 -4.106 0.893 4.487 1.00 0.00 C ATOM 186 CZ PHE A 97 -3.676 2.201 4.269 1.00 0.00 C ATOM 0 H PHE A 97 -7.230 -1.665 0.611 1.00 0.00 H new ATOM 0 HA PHE A 97 -7.637 0.704 1.965 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -5.542 -0.974 1.212 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -5.231 0.386 0.151 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -4.713 2.605 1.073 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -5.065 -0.824 3.620 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -3.491 3.793 2.846 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -3.943 0.421 5.445 1.00 0.00 H new ATOM 0 HZ PHE A 97 -3.195 2.751 5.064 1.00 0.00 H new ATOM 196 N ASP A 98 -7.672 1.378 -1.233 1.00 0.00 N ATOM 197 CA ASP A 98 -7.998 2.398 -2.259 1.00 0.00 C ATOM 198 C ASP A 98 -9.401 3.078 -2.018 1.00 0.00 C ATOM 199 O ASP A 98 -10.457 2.431 -2.065 1.00 0.00 O ATOM 200 CB ASP A 98 -7.855 1.597 -3.596 1.00 0.00 C ATOM 201 CG ASP A 98 -8.478 2.168 -4.861 1.00 0.00 C ATOM 202 OD1 ASP A 98 -8.502 3.399 -5.079 1.00 0.00 O ATOM 203 OD2 ASP A 98 -8.919 1.349 -5.704 1.00 0.00 O ATOM 0 H ASP A 98 -7.551 0.447 -1.632 1.00 0.00 H new ATOM 0 HA ASP A 98 -7.343 3.269 -2.248 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -6.791 1.458 -3.786 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -8.282 0.607 -3.435 1.00 0.00 H new ATOM 208 N ALA A 99 -9.371 4.396 -1.745 1.00 0.00 N ATOM 209 CA ALA A 99 -10.588 5.222 -1.484 1.00 0.00 C ATOM 210 C ALA A 99 -11.399 5.626 -2.746 1.00 0.00 C ATOM 211 O ALA A 99 -12.615 5.413 -2.771 1.00 0.00 O ATOM 212 CB ALA A 99 -10.225 6.482 -0.664 1.00 0.00 C ATOM 0 H ALA A 99 -8.503 4.930 -1.697 1.00 0.00 H new ATOM 0 HA ALA A 99 -11.248 4.569 -0.912 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -11.125 7.071 -0.484 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -9.790 6.183 0.290 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -9.504 7.082 -1.219 1.00 0.00 H new ATOM 218 N ASN A 100 -10.744 6.208 -3.773 1.00 0.00 N ATOM 219 CA ASN A 100 -11.411 6.649 -5.032 1.00 0.00 C ATOM 220 C ASN A 100 -11.961 5.539 -5.996 1.00 0.00 C ATOM 221 O ASN A 100 -12.729 5.886 -6.899 1.00 0.00 O ATOM 222 CB ASN A 100 -10.478 7.648 -5.790 1.00 0.00 C ATOM 223 CG ASN A 100 -9.067 7.149 -6.250 1.00 0.00 C ATOM 224 OD1 ASN A 100 -8.792 5.949 -6.243 1.00 0.00 O ATOM 225 ND2 ASN A 100 -8.127 7.993 -6.681 1.00 0.00 N ATOM 0 H ASN A 100 -9.740 6.388 -3.760 1.00 0.00 H new ATOM 0 HA ASN A 100 -12.329 7.130 -4.695 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -11.012 7.994 -6.675 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -10.330 8.516 -5.147 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -7.222 7.635 -6.988 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -8.313 8.996 -6.703 1.00 0.00 H new ATOM 232 N GLY A 101 -11.605 4.246 -5.830 1.00 0.00 N ATOM 233 CA GLY A 101 -12.095 3.160 -6.718 1.00 0.00 C ATOM 234 C GLY A 101 -11.418 2.934 -8.097 1.00 0.00 C ATOM 235 O GLY A 101 -11.930 2.117 -8.867 1.00 0.00 O ATOM 0 H GLY A 101 -10.980 3.926 -5.090 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -12.022 2.226 -6.162 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -13.154 3.340 -6.900 1.00 0.00 H new ATOM 239 N ASP A 102 -10.302 3.620 -8.409 1.00 0.00 N ATOM 240 CA ASP A 102 -9.521 3.447 -9.666 1.00 0.00 C ATOM 241 C ASP A 102 -8.175 2.643 -9.502 1.00 0.00 C ATOM 242 O ASP A 102 -7.622 2.177 -10.507 1.00 0.00 O ATOM 243 CB ASP A 102 -9.316 4.835 -10.339 1.00 0.00 C ATOM 244 CG ASP A 102 -8.465 5.902 -9.635 1.00 0.00 C ATOM 245 OD1 ASP A 102 -7.512 5.559 -8.902 1.00 0.00 O ATOM 246 OD2 ASP A 102 -8.748 7.102 -9.840 1.00 0.00 O ATOM 0 H ASP A 102 -9.904 4.325 -7.788 1.00 0.00 H new ATOM 0 HA ASP A 102 -10.111 2.810 -10.325 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -8.873 4.660 -11.319 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -10.304 5.265 -10.507 1.00 0.00 H new ATOM 251 N GLY A 103 -7.691 2.460 -8.258 1.00 0.00 N ATOM 252 CA GLY A 103 -6.448 1.757 -7.924 1.00 0.00 C ATOM 253 C GLY A 103 -5.298 2.623 -7.363 1.00 0.00 C ATOM 254 O GLY A 103 -4.168 2.138 -7.433 1.00 0.00 O ATOM 0 H GLY A 103 -8.176 2.812 -7.433 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -6.680 0.982 -7.193 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -6.089 1.252 -8.821 1.00 0.00 H new ATOM 258 N VAL A 104 -5.530 3.843 -6.800 1.00 0.00 N ATOM 259 CA VAL A 104 -4.435 4.697 -6.260 1.00 0.00 C ATOM 260 C VAL A 104 -4.791 5.221 -4.834 1.00 0.00 C ATOM 261 O VAL A 104 -5.900 5.676 -4.531 1.00 0.00 O ATOM 262 CB VAL A 104 -3.981 5.880 -7.197 1.00 0.00 C ATOM 263 CG1 VAL A 104 -2.541 6.335 -6.900 1.00 0.00 C ATOM 264 CG2 VAL A 104 -3.973 5.529 -8.697 1.00 0.00 C ATOM 0 H VAL A 104 -6.459 4.254 -6.709 1.00 0.00 H new ATOM 0 HA VAL A 104 -3.568 4.038 -6.205 1.00 0.00 H new ATOM 0 HB VAL A 104 -4.720 6.653 -6.986 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -2.272 7.152 -7.570 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -2.473 6.676 -5.867 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -1.857 5.500 -7.053 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -3.649 6.397 -9.272 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -3.287 4.700 -8.873 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -4.977 5.241 -9.009 1.00 0.00 H new ATOM 274 N ILE A 105 -3.749 5.148 -3.997 1.00 0.00 N ATOM 275 CA ILE A 105 -3.720 5.570 -2.578 1.00 0.00 C ATOM 276 C ILE A 105 -2.842 6.847 -2.465 1.00 0.00 C ATOM 277 O ILE A 105 -1.759 6.918 -3.046 1.00 0.00 O ATOM 278 CB ILE A 105 -3.100 4.447 -1.664 1.00 0.00 C ATOM 279 CG1 ILE A 105 -3.892 3.109 -1.705 1.00 0.00 C ATOM 280 CG2 ILE A 105 -2.905 4.887 -0.179 1.00 0.00 C ATOM 281 CD1 ILE A 105 -3.068 1.920 -1.211 1.00 0.00 C ATOM 0 H ILE A 105 -2.851 4.773 -4.302 1.00 0.00 H new ATOM 0 HA ILE A 105 -4.740 5.761 -2.246 1.00 0.00 H new ATOM 0 HB ILE A 105 -2.116 4.277 -2.100 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -4.789 3.204 -1.093 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -4.222 2.918 -2.726 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -2.474 4.064 0.391 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -2.235 5.746 -0.139 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -3.870 5.159 0.249 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -3.671 1.013 -1.262 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -2.184 1.804 -1.839 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -2.760 2.094 -0.180 1.00 0.00 H new ATOM 293 N ASP A 106 -3.292 7.799 -1.635 1.00 0.00 N ATOM 294 CA ASP A 106 -2.565 9.063 -1.338 1.00 0.00 C ATOM 295 C ASP A 106 -2.212 9.171 0.192 1.00 0.00 C ATOM 296 O ASP A 106 -2.392 8.218 0.963 1.00 0.00 O ATOM 297 CB ASP A 106 -3.379 10.245 -1.946 1.00 0.00 C ATOM 298 CG ASP A 106 -4.682 10.663 -1.236 1.00 0.00 C ATOM 299 OD1 ASP A 106 -4.644 11.034 -0.044 1.00 0.00 O ATOM 300 OD2 ASP A 106 -5.750 10.623 -1.881 1.00 0.00 O ATOM 0 H ASP A 106 -4.181 7.721 -1.140 1.00 0.00 H new ATOM 0 HA ASP A 106 -1.585 9.091 -1.814 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -2.725 11.116 -1.985 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -3.627 9.986 -2.975 1.00 0.00 H new ATOM 305 N PHE A 107 -1.666 10.323 0.637 1.00 0.00 N ATOM 306 CA PHE A 107 -1.305 10.533 2.071 1.00 0.00 C ATOM 307 C PHE A 107 -2.530 10.717 3.007 1.00 0.00 C ATOM 308 O PHE A 107 -2.612 10.006 4.015 1.00 0.00 O ATOM 309 CB PHE A 107 -0.262 11.676 2.244 1.00 0.00 C ATOM 310 CG PHE A 107 0.342 11.756 3.664 1.00 0.00 C ATOM 311 CD1 PHE A 107 1.063 10.674 4.186 1.00 0.00 C ATOM 312 CD2 PHE A 107 0.016 12.830 4.504 1.00 0.00 C ATOM 313 CE1 PHE A 107 1.402 10.646 5.533 1.00 0.00 C ATOM 314 CE2 PHE A 107 0.386 12.809 5.847 1.00 0.00 C ATOM 315 CZ PHE A 107 1.072 11.713 6.362 1.00 0.00 C ATOM 0 H PHE A 107 -1.464 11.121 0.035 1.00 0.00 H new ATOM 0 HA PHE A 107 -0.834 9.604 2.392 1.00 0.00 H new ATOM 0 HB2 PHE A 107 0.543 11.533 1.524 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -0.737 12.628 2.006 1.00 0.00 H new ATOM 0 HD1 PHE A 107 1.356 9.860 3.540 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -0.524 13.677 4.108 1.00 0.00 H new ATOM 0 HE1 PHE A 107 1.924 9.792 5.938 1.00 0.00 H new ATOM 0 HE2 PHE A 107 0.141 13.643 6.488 1.00 0.00 H new ATOM 0 HZ PHE A 107 1.348 11.691 7.406 1.00 0.00 H new ATOM 325 N ASP A 108 -3.439 11.664 2.692 1.00 0.00 N ATOM 326 CA ASP A 108 -4.681 11.885 3.500 1.00 0.00 C ATOM 327 C ASP A 108 -5.549 10.587 3.623 1.00 0.00 C ATOM 328 O ASP A 108 -5.924 10.214 4.742 1.00 0.00 O ATOM 329 CB ASP A 108 -5.507 13.113 3.016 1.00 0.00 C ATOM 330 CG ASP A 108 -4.856 14.470 3.293 1.00 0.00 C ATOM 331 OD1 ASP A 108 -5.044 14.995 4.414 1.00 0.00 O ATOM 332 OD2 ASP A 108 -4.136 14.999 2.426 1.00 0.00 O ATOM 0 H ASP A 108 -3.347 12.289 1.892 1.00 0.00 H new ATOM 0 HA ASP A 108 -4.347 12.130 4.508 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -5.678 13.019 1.944 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -6.485 13.089 3.498 1.00 0.00 H new ATOM 337 N GLU A 109 -5.795 9.878 2.506 1.00 0.00 N ATOM 338 CA GLU A 109 -6.499 8.580 2.474 1.00 0.00 C ATOM 339 C GLU A 109 -5.883 7.490 3.417 1.00 0.00 C ATOM 340 O GLU A 109 -6.602 6.907 4.234 1.00 0.00 O ATOM 341 CB GLU A 109 -6.405 8.208 0.972 1.00 0.00 C ATOM 342 CG GLU A 109 -7.212 6.967 0.578 1.00 0.00 C ATOM 343 CD GLU A 109 -6.522 5.619 0.495 1.00 0.00 C ATOM 344 OE1 GLU A 109 -6.068 5.091 1.529 1.00 0.00 O ATOM 345 OE2 GLU A 109 -6.471 5.062 -0.618 1.00 0.00 O ATOM 0 H GLU A 109 -5.505 10.197 1.581 1.00 0.00 H new ATOM 0 HA GLU A 109 -7.519 8.642 2.853 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -6.749 9.055 0.378 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -5.359 8.043 0.715 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -8.031 6.871 1.291 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -7.659 7.165 -0.396 1.00 0.00 H new ATOM 352 N PHE A 110 -4.553 7.280 3.321 1.00 0.00 N ATOM 353 CA PHE A 110 -3.785 6.302 4.152 1.00 0.00 C ATOM 354 C PHE A 110 -3.876 6.680 5.657 1.00 0.00 C ATOM 355 O PHE A 110 -4.279 5.814 6.452 1.00 0.00 O ATOM 356 CB PHE A 110 -2.314 6.238 3.599 1.00 0.00 C ATOM 357 CG PHE A 110 -1.356 5.059 3.920 1.00 0.00 C ATOM 358 CD1 PHE A 110 -1.155 4.571 5.214 1.00 0.00 C ATOM 359 CD2 PHE A 110 -0.647 4.459 2.869 1.00 0.00 C ATOM 360 CE1 PHE A 110 -0.219 3.569 5.464 1.00 0.00 C ATOM 361 CE2 PHE A 110 0.247 3.421 3.109 1.00 0.00 C ATOM 362 CZ PHE A 110 0.490 3.002 4.409 1.00 0.00 C ATOM 0 H PHE A 110 -3.966 7.787 2.658 1.00 0.00 H new ATOM 0 HA PHE A 110 -4.210 5.301 4.081 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -2.386 6.296 2.513 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -1.814 7.147 3.934 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -1.733 4.976 6.032 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -0.798 4.808 1.858 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -0.044 3.233 6.475 1.00 0.00 H new ATOM 0 HE2 PHE A 110 0.752 2.941 2.284 1.00 0.00 H new ATOM 0 HZ PHE A 110 1.228 2.237 4.602 1.00 0.00 H new ATOM 372 N LYS A 111 -3.569 7.946 6.039 1.00 0.00 N ATOM 373 CA LYS A 111 -3.708 8.390 7.454 1.00 0.00 C ATOM 374 C LYS A 111 -5.182 8.514 8.000 1.00 0.00 C ATOM 375 O LYS A 111 -5.367 8.817 9.180 1.00 0.00 O ATOM 376 CB LYS A 111 -2.856 9.664 7.707 1.00 0.00 C ATOM 377 CG LYS A 111 -3.336 10.990 7.065 1.00 0.00 C ATOM 378 CD LYS A 111 -4.175 11.920 7.974 1.00 0.00 C ATOM 379 CE LYS A 111 -4.963 13.006 7.208 1.00 0.00 C ATOM 380 NZ LYS A 111 -4.067 14.012 6.575 1.00 0.00 N ATOM 0 H LYS A 111 -3.230 8.667 5.402 1.00 0.00 H new ATOM 0 HA LYS A 111 -3.309 7.572 8.054 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -2.793 9.817 8.784 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -1.844 9.467 7.353 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -2.461 11.542 6.723 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -3.927 10.750 6.181 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -4.876 11.314 8.548 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -3.512 12.405 8.691 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -5.576 12.534 6.440 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -5.644 13.510 7.894 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -4.618 14.607 5.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -3.640 14.609 7.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -3.316 13.524 6.046 1.00 0.00 H new ATOM 394 N PHE A 112 -6.199 8.398 7.135 1.00 0.00 N ATOM 395 CA PHE A 112 -7.634 8.332 7.514 1.00 0.00 C ATOM 396 C PHE A 112 -8.097 6.828 7.695 1.00 0.00 C ATOM 397 O PHE A 112 -8.867 6.534 8.610 1.00 0.00 O ATOM 398 CB PHE A 112 -8.424 9.071 6.389 1.00 0.00 C ATOM 399 CG PHE A 112 -9.947 8.849 6.308 1.00 0.00 C ATOM 400 CD1 PHE A 112 -10.799 9.438 7.242 1.00 0.00 C ATOM 401 CD2 PHE A 112 -10.482 8.021 5.309 1.00 0.00 C ATOM 402 CE1 PHE A 112 -12.175 9.229 7.167 1.00 0.00 C ATOM 403 CE2 PHE A 112 -11.859 7.817 5.235 1.00 0.00 C ATOM 404 CZ PHE A 112 -12.703 8.422 6.161 1.00 0.00 C ATOM 0 H PHE A 112 -6.053 8.346 6.127 1.00 0.00 H new ATOM 0 HA PHE A 112 -7.821 8.813 8.474 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -8.248 10.140 6.505 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -7.993 8.779 5.431 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -10.391 10.058 8.026 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -9.826 7.542 4.597 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -12.832 9.692 7.888 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -12.271 7.189 4.459 1.00 0.00 H new ATOM 0 HZ PHE A 112 -13.770 8.266 6.100 1.00 0.00 H new ATOM 414 N ILE A 113 -7.642 5.915 6.808 1.00 0.00 N ATOM 415 CA ILE A 113 -8.041 4.484 6.736 1.00 0.00 C ATOM 416 C ILE A 113 -7.251 3.384 7.504 1.00 0.00 C ATOM 417 O ILE A 113 -7.877 2.410 7.924 1.00 0.00 O ATOM 418 CB ILE A 113 -8.109 4.150 5.190 1.00 0.00 C ATOM 419 CG1 ILE A 113 -9.363 3.301 4.866 1.00 0.00 C ATOM 420 CG2 ILE A 113 -6.835 3.588 4.537 1.00 0.00 C ATOM 421 CD1 ILE A 113 -9.688 3.112 3.375 1.00 0.00 C ATOM 0 H ILE A 113 -6.959 6.161 6.092 1.00 0.00 H new ATOM 0 HA ILE A 113 -8.977 4.427 7.292 1.00 0.00 H new ATOM 0 HB ILE A 113 -8.195 5.127 4.714 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -9.236 2.317 5.316 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -10.224 3.764 5.348 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -7.019 3.404 3.479 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -6.023 4.308 4.644 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -6.558 2.654 5.025 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -10.585 2.502 3.273 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -9.856 4.085 2.913 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -8.853 2.615 2.881 1.00 0.00 H new ATOM 433 N MET A 114 -5.911 3.506 7.605 1.00 0.00 N ATOM 434 CA MET A 114 -5.000 2.497 8.236 1.00 0.00 C ATOM 435 C MET A 114 -5.515 1.758 9.514 1.00 0.00 C ATOM 436 O MET A 114 -5.507 0.524 9.557 1.00 0.00 O ATOM 437 CB MET A 114 -3.617 3.188 8.438 1.00 0.00 C ATOM 438 CG MET A 114 -2.505 2.314 9.027 1.00 0.00 C ATOM 439 SD MET A 114 -1.645 1.410 7.722 1.00 0.00 S ATOM 440 CE MET A 114 -2.233 -0.276 7.990 1.00 0.00 C ATOM 0 H MET A 114 -5.411 4.320 7.247 1.00 0.00 H new ATOM 0 HA MET A 114 -4.934 1.654 7.548 1.00 0.00 H new ATOM 0 HB2 MET A 114 -3.280 3.568 7.474 1.00 0.00 H new ATOM 0 HB3 MET A 114 -3.757 4.051 9.090 1.00 0.00 H new ATOM 0 HG2 MET A 114 -1.796 2.937 9.572 1.00 0.00 H new ATOM 0 HG3 MET A 114 -2.929 1.611 9.744 1.00 0.00 H new ATOM 0 HE1 MET A 114 -1.781 -0.940 7.253 1.00 0.00 H new ATOM 0 HE2 MET A 114 -1.955 -0.603 8.992 1.00 0.00 H new ATOM 0 HE3 MET A 114 -3.318 -0.304 7.887 1.00 0.00 H new ATOM 575 N THR A 123 -0.959 10.077 14.631 1.00 0.00 N ATOM 576 CA THR A 123 0.301 10.828 14.366 1.00 0.00 C ATOM 577 C THR A 123 0.739 10.555 12.900 1.00 0.00 C ATOM 578 O THR A 123 0.895 9.413 12.458 1.00 0.00 O ATOM 579 CB THR A 123 1.487 10.531 15.318 1.00 0.00 C ATOM 580 OG1 THR A 123 1.664 9.136 15.500 1.00 0.00 O ATOM 581 CG2 THR A 123 1.372 11.177 16.705 1.00 0.00 C ATOM 0 HA THR A 123 0.058 11.875 14.548 1.00 0.00 H new ATOM 0 HB THR A 123 2.346 10.977 14.816 1.00 0.00 H new ATOM 0 HG1 THR A 123 0.822 8.672 15.310 1.00 0.00 H new ATOM 0 HG21 THR A 123 2.245 10.915 17.302 1.00 0.00 H new ATOM 0 HG22 THR A 123 1.317 12.260 16.598 1.00 0.00 H new ATOM 0 HG23 THR A 123 0.471 10.815 17.201 1.00 0.00 H new ATOM 589 N ASP A 124 0.940 11.667 12.189 1.00 0.00 N ATOM 590 CA ASP A 124 1.394 11.698 10.771 1.00 0.00 C ATOM 591 C ASP A 124 2.763 11.043 10.457 1.00 0.00 C ATOM 592 O ASP A 124 2.918 10.396 9.418 1.00 0.00 O ATOM 593 CB ASP A 124 1.319 13.169 10.296 1.00 0.00 C ATOM 594 CG ASP A 124 2.265 14.197 10.917 1.00 0.00 C ATOM 595 OD1 ASP A 124 1.958 14.699 12.020 1.00 0.00 O ATOM 596 OD2 ASP A 124 3.318 14.490 10.313 1.00 0.00 O ATOM 0 H ASP A 124 0.792 12.598 12.579 1.00 0.00 H new ATOM 0 HA ASP A 124 0.720 11.053 10.208 1.00 0.00 H new ATOM 0 HB2 ASP A 124 1.486 13.176 9.219 1.00 0.00 H new ATOM 0 HB3 ASP A 124 0.300 13.517 10.462 1.00 0.00 H new ATOM 601 N ALA A 125 3.711 11.226 11.385 1.00 0.00 N ATOM 602 CA ALA A 125 5.073 10.649 11.317 1.00 0.00 C ATOM 603 C ALA A 125 5.087 9.102 11.169 1.00 0.00 C ATOM 604 O ALA A 125 5.821 8.603 10.304 1.00 0.00 O ATOM 605 CB ALA A 125 5.840 11.124 12.561 1.00 0.00 C ATOM 0 H ALA A 125 3.557 11.788 12.222 1.00 0.00 H new ATOM 0 HA ALA A 125 5.564 11.003 10.410 1.00 0.00 H new ATOM 0 HB1 ALA A 125 6.851 10.716 12.543 1.00 0.00 H new ATOM 0 HB2 ALA A 125 5.888 12.213 12.565 1.00 0.00 H new ATOM 0 HB3 ALA A 125 5.326 10.780 13.459 1.00 0.00 H new ATOM 611 N GLU A 126 4.264 8.353 11.957 1.00 0.00 N ATOM 612 CA GLU A 126 4.171 6.865 11.819 1.00 0.00 C ATOM 613 C GLU A 126 3.745 6.418 10.366 1.00 0.00 C ATOM 614 O GLU A 126 4.414 5.610 9.696 1.00 0.00 O ATOM 615 CB GLU A 126 3.138 6.349 12.869 1.00 0.00 C ATOM 616 CG GLU A 126 3.352 6.713 14.358 1.00 0.00 C ATOM 617 CD GLU A 126 3.912 5.616 15.249 1.00 0.00 C ATOM 618 OE1 GLU A 126 3.112 4.851 15.827 1.00 0.00 O ATOM 619 OE2 GLU A 126 5.149 5.530 15.389 1.00 0.00 O ATOM 0 H GLU A 126 3.664 8.744 12.683 1.00 0.00 H new ATOM 0 HA GLU A 126 5.157 6.434 11.995 1.00 0.00 H new ATOM 0 HB2 GLU A 126 2.155 6.718 12.576 1.00 0.00 H new ATOM 0 HB3 GLU A 126 3.105 5.262 12.795 1.00 0.00 H new ATOM 0 HG2 GLU A 126 4.025 7.569 14.407 1.00 0.00 H new ATOM 0 HG3 GLU A 126 2.396 7.034 14.772 1.00 0.00 H new ATOM 626 N VAL A 127 2.638 7.046 9.898 1.00 0.00 N ATOM 627 CA VAL A 127 2.027 6.810 8.575 1.00 0.00 C ATOM 628 C VAL A 127 2.944 7.303 7.404 1.00 0.00 C ATOM 629 O VAL A 127 3.047 6.579 6.408 1.00 0.00 O ATOM 630 CB VAL A 127 0.570 7.401 8.535 1.00 0.00 C ATOM 631 CG1 VAL A 127 -0.250 6.654 7.479 1.00 0.00 C ATOM 632 CG2 VAL A 127 -0.290 7.337 9.827 1.00 0.00 C ATOM 0 H VAL A 127 2.137 7.746 10.446 1.00 0.00 H new ATOM 0 HA VAL A 127 1.935 5.735 8.419 1.00 0.00 H new ATOM 0 HB VAL A 127 0.760 8.456 8.339 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -1.261 7.061 7.448 1.00 0.00 H new ATOM 0 HG12 VAL A 127 0.219 6.774 6.502 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -0.293 5.595 7.734 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -1.266 7.784 9.637 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -0.419 6.297 10.127 1.00 0.00 H new ATOM 0 HG23 VAL A 127 0.211 7.885 10.625 1.00 0.00 H new ATOM 642 N GLU A 128 3.613 8.485 7.503 1.00 0.00 N ATOM 643 CA GLU A 128 4.573 8.969 6.461 1.00 0.00 C ATOM 644 C GLU A 128 5.787 7.995 6.364 1.00 0.00 C ATOM 645 O GLU A 128 6.125 7.606 5.246 1.00 0.00 O ATOM 646 CB GLU A 128 4.984 10.450 6.709 1.00 0.00 C ATOM 647 CG GLU A 128 5.937 11.093 5.655 1.00 0.00 C ATOM 648 CD GLU A 128 5.414 11.239 4.229 1.00 0.00 C ATOM 649 OE1 GLU A 128 5.588 10.306 3.410 1.00 0.00 O ATOM 650 OE2 GLU A 128 4.831 12.292 3.908 1.00 0.00 O ATOM 0 H GLU A 128 3.508 9.123 8.292 1.00 0.00 H new ATOM 0 HA GLU A 128 4.081 8.965 5.488 1.00 0.00 H new ATOM 0 HB2 GLU A 128 4.077 11.052 6.761 1.00 0.00 H new ATOM 0 HB3 GLU A 128 5.464 10.512 7.686 1.00 0.00 H new ATOM 0 HG2 GLU A 128 6.216 12.084 6.014 1.00 0.00 H new ATOM 0 HG3 GLU A 128 6.850 10.498 5.619 1.00 0.00 H new ATOM 657 N GLU A 129 6.416 7.554 7.486 1.00 0.00 N ATOM 658 CA GLU A 129 7.521 6.555 7.439 1.00 0.00 C ATOM 659 C GLU A 129 7.084 5.223 6.747 1.00 0.00 C ATOM 660 O GLU A 129 7.753 4.804 5.790 1.00 0.00 O ATOM 661 CB GLU A 129 8.134 6.334 8.845 1.00 0.00 C ATOM 662 CG GLU A 129 9.010 7.492 9.394 1.00 0.00 C ATOM 663 CD GLU A 129 10.256 7.812 8.575 1.00 0.00 C ATOM 664 OE1 GLU A 129 11.214 7.010 8.574 1.00 0.00 O ATOM 665 OE2 GLU A 129 10.262 8.834 7.862 1.00 0.00 O ATOM 0 H GLU A 129 6.180 7.870 8.427 1.00 0.00 H new ATOM 0 HA GLU A 129 8.312 6.965 6.811 1.00 0.00 H new ATOM 0 HB2 GLU A 129 7.322 6.153 9.549 1.00 0.00 H new ATOM 0 HB3 GLU A 129 8.740 5.428 8.817 1.00 0.00 H new ATOM 0 HG2 GLU A 129 8.397 8.391 9.458 1.00 0.00 H new ATOM 0 HG3 GLU A 129 9.317 7.243 10.410 1.00 0.00 H new ATOM 672 N ALA A 130 5.947 4.609 7.167 1.00 0.00 N ATOM 673 CA ALA A 130 5.436 3.373 6.502 1.00 0.00 C ATOM 674 C ALA A 130 5.116 3.541 4.976 1.00 0.00 C ATOM 675 O ALA A 130 5.561 2.708 4.173 1.00 0.00 O ATOM 676 CB ALA A 130 4.232 2.832 7.297 1.00 0.00 C ATOM 0 H ALA A 130 5.375 4.938 7.945 1.00 0.00 H new ATOM 0 HA ALA A 130 6.243 2.641 6.517 1.00 0.00 H new ATOM 0 HB1 ALA A 130 3.854 1.930 6.816 1.00 0.00 H new ATOM 0 HB2 ALA A 130 4.544 2.598 8.315 1.00 0.00 H new ATOM 0 HB3 ALA A 130 3.445 3.586 7.323 1.00 0.00 H new ATOM 682 N MET A 131 4.402 4.623 4.570 1.00 0.00 N ATOM 683 CA MET A 131 4.102 4.882 3.133 1.00 0.00 C ATOM 684 C MET A 131 5.387 5.266 2.332 1.00 0.00 C ATOM 685 O MET A 131 5.485 4.834 1.185 1.00 0.00 O ATOM 686 CB MET A 131 2.974 5.923 2.957 1.00 0.00 C ATOM 687 CG MET A 131 2.325 5.849 1.568 1.00 0.00 C ATOM 688 SD MET A 131 1.291 7.296 1.306 1.00 0.00 S ATOM 689 CE MET A 131 2.033 7.870 -0.228 1.00 0.00 C ATOM 0 H MET A 131 4.026 5.324 5.208 1.00 0.00 H new ATOM 0 HA MET A 131 3.734 3.947 2.710 1.00 0.00 H new ATOM 0 HB2 MET A 131 2.213 5.763 3.720 1.00 0.00 H new ATOM 0 HB3 MET A 131 3.378 6.923 3.114 1.00 0.00 H new ATOM 0 HG2 MET A 131 3.095 5.796 0.798 1.00 0.00 H new ATOM 0 HG3 MET A 131 1.726 4.942 1.483 1.00 0.00 H new ATOM 0 HE1 MET A 131 1.375 8.599 -0.700 1.00 0.00 H new ATOM 0 HE2 MET A 131 2.996 8.335 -0.015 1.00 0.00 H new ATOM 0 HE3 MET A 131 2.179 7.024 -0.900 1.00 0.00 H new ATOM 699 N LYS A 132 6.345 6.070 2.870 1.00 0.00 N ATOM 700 CA LYS A 132 7.643 6.350 2.180 1.00 0.00 C ATOM 701 C LYS A 132 8.434 5.009 1.968 1.00 0.00 C ATOM 702 O LYS A 132 8.983 4.829 0.879 1.00 0.00 O ATOM 703 CB LYS A 132 8.379 7.501 2.925 1.00 0.00 C ATOM 704 CG LYS A 132 9.903 7.709 2.681 1.00 0.00 C ATOM 705 CD LYS A 132 10.834 6.907 3.623 1.00 0.00 C ATOM 706 CE LYS A 132 10.905 7.455 5.064 1.00 0.00 C ATOM 707 NZ LYS A 132 11.558 6.477 5.971 1.00 0.00 N ATOM 0 H LYS A 132 6.247 6.534 3.773 1.00 0.00 H new ATOM 0 HA LYS A 132 7.506 6.729 1.167 1.00 0.00 H new ATOM 0 HB2 LYS A 132 7.875 8.433 2.669 1.00 0.00 H new ATOM 0 HB3 LYS A 132 8.236 7.345 3.994 1.00 0.00 H new ATOM 0 HG2 LYS A 132 10.131 7.435 1.651 1.00 0.00 H new ATOM 0 HG3 LYS A 132 10.131 8.770 2.787 1.00 0.00 H new ATOM 0 HD2 LYS A 132 10.493 5.872 3.657 1.00 0.00 H new ATOM 0 HD3 LYS A 132 11.839 6.898 3.200 1.00 0.00 H new ATOM 0 HE2 LYS A 132 11.460 8.393 5.074 1.00 0.00 H new ATOM 0 HE3 LYS A 132 9.900 7.676 5.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 11.794 6.942 6.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 10.910 5.684 6.150 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 12.428 6.120 5.528 1.00 0.00 H new ATOM 721 N GLU A 133 8.483 4.063 2.943 1.00 0.00 N ATOM 722 CA GLU A 133 9.099 2.724 2.708 1.00 0.00 C ATOM 723 C GLU A 133 8.305 1.883 1.625 1.00 0.00 C ATOM 724 O GLU A 133 8.934 1.110 0.895 1.00 0.00 O ATOM 725 CB GLU A 133 9.259 1.967 4.062 1.00 0.00 C ATOM 726 CG GLU A 133 10.664 2.033 4.721 1.00 0.00 C ATOM 727 CD GLU A 133 11.167 3.408 5.132 1.00 0.00 C ATOM 728 OE1 GLU A 133 10.660 3.980 6.119 1.00 0.00 O ATOM 729 OE2 GLU A 133 12.080 3.944 4.474 1.00 0.00 O ATOM 0 H GLU A 133 8.111 4.196 3.884 1.00 0.00 H new ATOM 0 HA GLU A 133 10.094 2.870 2.288 1.00 0.00 H new ATOM 0 HB2 GLU A 133 8.530 2.368 4.767 1.00 0.00 H new ATOM 0 HB3 GLU A 133 9.004 0.919 3.901 1.00 0.00 H new ATOM 0 HG2 GLU A 133 10.654 1.397 5.606 1.00 0.00 H new ATOM 0 HG3 GLU A 133 11.385 1.602 4.027 1.00 0.00 H new ATOM 736 N ALA A 134 6.955 2.031 1.526 1.00 0.00 N ATOM 737 CA ALA A 134 6.125 1.317 0.519 1.00 0.00 C ATOM 738 C ALA A 134 6.069 1.925 -0.934 1.00 0.00 C ATOM 739 O ALA A 134 5.903 1.142 -1.872 1.00 0.00 O ATOM 740 CB ALA A 134 4.714 1.106 1.077 1.00 0.00 C ATOM 0 H ALA A 134 6.416 2.644 2.138 1.00 0.00 H new ATOM 0 HA ALA A 134 6.643 0.371 0.364 1.00 0.00 H new ATOM 0 HB1 ALA A 134 4.105 0.583 0.339 1.00 0.00 H new ATOM 0 HB2 ALA A 134 4.769 0.512 1.989 1.00 0.00 H new ATOM 0 HB3 ALA A 134 4.263 2.073 1.300 1.00 0.00 H new ATOM 746 N ASP A 135 6.260 3.267 -1.200 1.00 0.00 N ATOM 747 CA ASP A 135 6.283 3.839 -2.604 1.00 0.00 C ATOM 748 C ASP A 135 7.677 3.567 -3.271 1.00 0.00 C ATOM 749 O ASP A 135 8.697 4.147 -2.881 1.00 0.00 O ATOM 750 CB ASP A 135 6.007 5.371 -2.774 1.00 0.00 C ATOM 751 CG ASP A 135 6.134 5.942 -4.246 1.00 0.00 C ATOM 752 OD1 ASP A 135 6.010 5.238 -5.238 1.00 0.00 O ATOM 753 OD2 ASP A 135 6.293 7.199 -4.316 1.00 0.00 O ATOM 0 H ASP A 135 6.399 3.966 -0.470 1.00 0.00 H new ATOM 0 HA ASP A 135 5.445 3.325 -3.075 1.00 0.00 H new ATOM 0 HB2 ASP A 135 5.001 5.581 -2.410 1.00 0.00 H new ATOM 0 HB3 ASP A 135 6.699 5.918 -2.133 1.00 0.00 H new ATOM 758 N GLU A 136 7.714 2.671 -4.262 1.00 0.00 N ATOM 759 CA GLU A 136 8.963 2.375 -5.027 1.00 0.00 C ATOM 760 C GLU A 136 9.281 3.295 -6.272 1.00 0.00 C ATOM 761 O GLU A 136 10.435 3.320 -6.714 1.00 0.00 O ATOM 762 CB GLU A 136 8.998 0.864 -5.382 1.00 0.00 C ATOM 763 CG GLU A 136 8.886 -0.082 -4.155 1.00 0.00 C ATOM 764 CD GLU A 136 9.642 -1.410 -4.187 1.00 0.00 C ATOM 765 OE1 GLU A 136 9.679 -2.070 -5.242 1.00 0.00 O ATOM 766 OE2 GLU A 136 10.145 -1.844 -3.123 1.00 0.00 O ATOM 0 H GLU A 136 6.903 2.131 -4.565 1.00 0.00 H new ATOM 0 HA GLU A 136 9.780 2.633 -4.353 1.00 0.00 H new ATOM 0 HB2 GLU A 136 8.182 0.645 -6.071 1.00 0.00 H new ATOM 0 HB3 GLU A 136 9.927 0.648 -5.910 1.00 0.00 H new ATOM 0 HG2 GLU A 136 9.224 0.471 -3.278 1.00 0.00 H new ATOM 0 HG3 GLU A 136 7.830 -0.305 -4.004 1.00 0.00 H new ATOM 773 N ASP A 137 8.292 4.019 -6.853 1.00 0.00 N ATOM 774 CA ASP A 137 8.486 4.767 -8.147 1.00 0.00 C ATOM 775 C ASP A 137 9.082 6.201 -8.205 1.00 0.00 C ATOM 776 O ASP A 137 9.551 6.597 -9.281 1.00 0.00 O ATOM 777 CB ASP A 137 7.088 4.731 -8.842 1.00 0.00 C ATOM 778 CG ASP A 137 6.829 5.575 -10.101 1.00 0.00 C ATOM 779 OD1 ASP A 137 6.509 6.774 -9.956 1.00 0.00 O ATOM 780 OD2 ASP A 137 6.968 5.051 -11.227 1.00 0.00 O ATOM 0 H ASP A 137 7.355 4.108 -6.460 1.00 0.00 H new ATOM 0 HA ASP A 137 9.312 4.247 -8.632 1.00 0.00 H new ATOM 0 HB2 ASP A 137 6.882 3.692 -9.101 1.00 0.00 H new ATOM 0 HB3 ASP A 137 6.349 5.026 -8.097 1.00 0.00 H new ATOM 785 N GLY A 138 9.187 6.948 -7.103 1.00 0.00 N ATOM 786 CA GLY A 138 9.594 8.372 -7.173 1.00 0.00 C ATOM 787 C GLY A 138 8.427 9.381 -7.465 1.00 0.00 C ATOM 788 O GLY A 138 8.693 10.579 -7.582 1.00 0.00 O ATOM 0 H GLY A 138 9.001 6.606 -6.160 1.00 0.00 H new ATOM 0 HA2 GLY A 138 10.064 8.647 -6.229 1.00 0.00 H new ATOM 0 HA3 GLY A 138 10.351 8.480 -7.950 1.00 0.00 H new ATOM 792 N ASN A 139 7.154 8.914 -7.498 1.00 0.00 N ATOM 793 CA ASN A 139 5.940 9.751 -7.668 1.00 0.00 C ATOM 794 C ASN A 139 5.427 10.254 -6.286 1.00 0.00 C ATOM 795 O ASN A 139 5.181 11.459 -6.175 1.00 0.00 O ATOM 796 CB ASN A 139 4.841 8.989 -8.471 1.00 0.00 C ATOM 797 CG ASN A 139 3.346 9.404 -8.363 1.00 0.00 C ATOM 798 OD1 ASN A 139 2.491 8.574 -8.063 1.00 0.00 O ATOM 799 ND2 ASN A 139 2.984 10.663 -8.560 1.00 0.00 N ATOM 0 H ASN A 139 6.938 7.921 -7.405 1.00 0.00 H new ATOM 0 HA ASN A 139 6.201 10.631 -8.256 1.00 0.00 H new ATOM 0 HB2 ASN A 139 5.115 9.048 -9.524 1.00 0.00 H new ATOM 0 HB3 ASN A 139 4.904 7.939 -8.184 1.00 0.00 H new ATOM 0 HD21 ASN A 139 2.005 10.934 -8.462 1.00 0.00 H new ATOM 0 HD22 ASN A 139 3.684 11.362 -8.809 1.00 0.00 H new ATOM 806 N GLY A 140 5.226 9.374 -5.274 1.00 0.00 N ATOM 807 CA GLY A 140 4.696 9.817 -3.966 1.00 0.00 C ATOM 808 C GLY A 140 3.266 9.349 -3.625 1.00 0.00 C ATOM 809 O GLY A 140 2.942 9.445 -2.446 1.00 0.00 O ATOM 0 H GLY A 140 5.419 8.374 -5.337 1.00 0.00 H new ATOM 0 HA2 GLY A 140 5.369 9.464 -3.185 1.00 0.00 H new ATOM 0 HA3 GLY A 140 4.718 10.906 -3.937 1.00 0.00 H new ATOM 813 N VAL A 141 2.392 8.938 -4.578 1.00 0.00 N ATOM 814 CA VAL A 141 1.024 8.410 -4.259 1.00 0.00 C ATOM 815 C VAL A 141 1.044 7.054 -5.008 1.00 0.00 C ATOM 816 O VAL A 141 1.276 6.941 -6.218 1.00 0.00 O ATOM 817 CB VAL A 141 -0.172 9.392 -4.501 1.00 0.00 C ATOM 818 CG1 VAL A 141 0.072 10.723 -3.777 1.00 0.00 C ATOM 819 CG2 VAL A 141 -0.726 9.682 -5.899 1.00 0.00 C ATOM 0 H VAL A 141 2.602 8.959 -5.576 1.00 0.00 H new ATOM 0 HA VAL A 141 0.823 8.281 -3.196 1.00 0.00 H new ATOM 0 HB VAL A 141 -0.974 8.778 -4.091 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -0.768 11.394 -3.956 1.00 0.00 H new ATOM 0 HG12 VAL A 141 0.171 10.542 -2.707 1.00 0.00 H new ATOM 0 HG13 VAL A 141 0.987 11.180 -4.154 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -1.551 10.390 -5.824 1.00 0.00 H new ATOM 0 HG22 VAL A 141 0.061 10.107 -6.522 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -1.083 8.755 -6.348 1.00 0.00 H new ATOM 829 N ILE A 142 0.779 6.013 -4.213 1.00 0.00 N ATOM 830 CA ILE A 142 0.901 4.624 -4.656 1.00 0.00 C ATOM 831 C ILE A 142 -0.241 4.075 -5.536 1.00 0.00 C ATOM 832 O ILE A 142 -1.398 4.063 -5.130 1.00 0.00 O ATOM 833 CB ILE A 142 1.033 3.606 -3.455 1.00 0.00 C ATOM 834 CG1 ILE A 142 1.580 4.043 -2.051 1.00 0.00 C ATOM 835 CG2 ILE A 142 1.880 2.431 -3.969 1.00 0.00 C ATOM 836 CD1 ILE A 142 1.886 2.875 -1.104 1.00 0.00 C ATOM 0 H ILE A 142 0.474 6.111 -3.245 1.00 0.00 H new ATOM 0 HA ILE A 142 1.807 4.686 -5.259 1.00 0.00 H new ATOM 0 HB ILE A 142 -0.007 3.404 -3.200 1.00 0.00 H new ATOM 0 HG12 ILE A 142 2.489 4.628 -2.194 1.00 0.00 H new ATOM 0 HG13 ILE A 142 0.850 4.699 -1.577 1.00 0.00 H new ATOM 0 HG21 ILE A 142 2.002 1.695 -3.174 1.00 0.00 H new ATOM 0 HG22 ILE A 142 1.380 1.967 -4.819 1.00 0.00 H new ATOM 0 HG23 ILE A 142 2.859 2.796 -4.279 1.00 0.00 H new ATOM 0 HD11 ILE A 142 2.259 3.263 -0.156 1.00 0.00 H new ATOM 0 HD12 ILE A 142 0.976 2.301 -0.928 1.00 0.00 H new ATOM 0 HD13 ILE A 142 2.640 2.230 -1.554 1.00 0.00 H new ATOM 848 N ASP A 143 0.145 3.569 -6.706 1.00 0.00 N ATOM 849 CA ASP A 143 -0.745 2.835 -7.620 1.00 0.00 C ATOM 850 C ASP A 143 -0.566 1.324 -7.247 1.00 0.00 C ATOM 851 O ASP A 143 0.422 0.907 -6.616 1.00 0.00 O ATOM 852 CB ASP A 143 -0.449 3.222 -9.086 1.00 0.00 C ATOM 853 CG ASP A 143 0.934 2.975 -9.704 1.00 0.00 C ATOM 854 OD1 ASP A 143 1.753 2.218 -9.135 1.00 0.00 O ATOM 855 OD2 ASP A 143 1.176 3.520 -10.800 1.00 0.00 O ATOM 0 H ASP A 143 1.099 3.656 -7.056 1.00 0.00 H new ATOM 0 HA ASP A 143 -1.801 3.085 -7.516 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -1.175 2.698 -9.708 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -0.657 4.288 -9.183 1.00 0.00 H new ATOM 860 N ILE A 144 -1.521 0.458 -7.617 1.00 0.00 N ATOM 861 CA ILE A 144 -1.419 -0.990 -7.272 1.00 0.00 C ATOM 862 C ILE A 144 -0.101 -1.671 -7.813 1.00 0.00 C ATOM 863 O ILE A 144 0.468 -2.414 -7.007 1.00 0.00 O ATOM 864 CB ILE A 144 -2.652 -1.866 -7.722 1.00 0.00 C ATOM 865 CG1 ILE A 144 -4.051 -1.178 -7.770 1.00 0.00 C ATOM 866 CG2 ILE A 144 -2.682 -3.205 -6.923 1.00 0.00 C ATOM 867 CD1 ILE A 144 -5.241 -2.076 -8.138 1.00 0.00 C ATOM 0 H ILE A 144 -2.357 0.714 -8.142 1.00 0.00 H new ATOM 0 HA ILE A 144 -1.400 -0.970 -6.182 1.00 0.00 H new ATOM 0 HB ILE A 144 -2.466 -2.056 -8.779 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -4.247 -0.734 -6.794 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -4.005 -0.360 -8.489 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -3.537 -3.800 -7.243 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -1.763 -3.761 -7.110 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -2.767 -2.991 -5.858 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -6.157 -1.485 -8.138 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -5.083 -2.501 -9.129 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -5.329 -2.881 -7.408 1.00 0.00 H new ATOM 879 N PRO A 145 0.437 -1.475 -9.064 1.00 0.00 N ATOM 880 CA PRO A 145 1.695 -2.105 -9.522 1.00 0.00 C ATOM 881 C PRO A 145 2.937 -1.924 -8.611 1.00 0.00 C ATOM 882 O PRO A 145 3.647 -2.912 -8.470 1.00 0.00 O ATOM 883 CB PRO A 145 1.888 -1.577 -10.956 1.00 0.00 C ATOM 884 CG PRO A 145 0.470 -1.240 -11.417 1.00 0.00 C ATOM 885 CD PRO A 145 -0.168 -0.677 -10.148 1.00 0.00 C ATOM 0 HA PRO A 145 1.602 -3.190 -9.480 1.00 0.00 H new ATOM 0 HB2 PRO A 145 2.534 -0.699 -10.975 1.00 0.00 H new ATOM 0 HB3 PRO A 145 2.350 -2.326 -11.599 1.00 0.00 H new ATOM 0 HG2 PRO A 145 0.470 -0.512 -12.228 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -0.059 -2.122 -11.780 1.00 0.00 H new ATOM 0 HD2 PRO A 145 0.047 0.385 -10.030 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -1.253 -0.783 -10.165 1.00 0.00 H new ATOM 893 N GLU A 146 3.194 -0.760 -7.960 1.00 0.00 N ATOM 894 CA GLU A 146 4.375 -0.604 -7.057 1.00 0.00 C ATOM 895 C GLU A 146 4.289 -1.448 -5.754 1.00 0.00 C ATOM 896 O GLU A 146 5.332 -1.961 -5.348 1.00 0.00 O ATOM 897 CB GLU A 146 4.690 0.891 -6.846 1.00 0.00 C ATOM 898 CG GLU A 146 5.305 1.555 -8.108 1.00 0.00 C ATOM 899 CD GLU A 146 6.514 0.909 -8.830 1.00 0.00 C ATOM 900 OE1 GLU A 146 7.679 1.151 -8.459 1.00 0.00 O ATOM 901 OE2 GLU A 146 6.309 0.147 -9.799 1.00 0.00 O ATOM 0 H GLU A 146 2.613 0.074 -8.038 1.00 0.00 H new ATOM 0 HA GLU A 146 5.240 -1.039 -7.557 1.00 0.00 H new ATOM 0 HB2 GLU A 146 3.775 1.416 -6.573 1.00 0.00 H new ATOM 0 HB3 GLU A 146 5.381 0.999 -6.010 1.00 0.00 H new ATOM 0 HG2 GLU A 146 4.505 1.650 -8.843 1.00 0.00 H new ATOM 0 HG3 GLU A 146 5.601 2.566 -7.827 1.00 0.00 H new ATOM 908 N PHE A 147 3.118 -1.606 -5.091 1.00 0.00 N ATOM 909 CA PHE A 147 2.967 -2.541 -3.941 1.00 0.00 C ATOM 910 C PHE A 147 3.168 -4.035 -4.408 1.00 0.00 C ATOM 911 O PHE A 147 3.925 -4.777 -3.763 1.00 0.00 O ATOM 912 CB PHE A 147 1.619 -2.224 -3.239 1.00 0.00 C ATOM 913 CG PHE A 147 1.227 -3.135 -2.059 1.00 0.00 C ATOM 914 CD1 PHE A 147 1.944 -3.135 -0.858 1.00 0.00 C ATOM 915 CD2 PHE A 147 0.124 -3.978 -2.192 1.00 0.00 C ATOM 916 CE1 PHE A 147 1.581 -4.005 0.172 1.00 0.00 C ATOM 917 CE2 PHE A 147 -0.274 -4.797 -1.134 1.00 0.00 C ATOM 918 CZ PHE A 147 0.463 -4.820 0.038 1.00 0.00 C ATOM 0 H PHE A 147 2.264 -1.101 -5.329 1.00 0.00 H new ATOM 0 HA PHE A 147 3.746 -2.401 -3.191 1.00 0.00 H new ATOM 0 HB2 PHE A 147 1.655 -1.196 -2.879 1.00 0.00 H new ATOM 0 HB3 PHE A 147 0.826 -2.272 -3.985 1.00 0.00 H new ATOM 0 HD1 PHE A 147 2.778 -2.462 -0.727 1.00 0.00 H new ATOM 0 HD2 PHE A 147 -0.427 -3.997 -3.121 1.00 0.00 H new ATOM 0 HE1 PHE A 147 2.171 -4.045 1.076 1.00 0.00 H new ATOM 0 HE2 PHE A 147 -1.156 -5.412 -1.230 1.00 0.00 H new ATOM 0 HZ PHE A 147 0.169 -5.471 0.848 1.00 0.00 H new ATOM 928 N MET A 148 2.518 -4.458 -5.529 1.00 0.00 N ATOM 929 CA MET A 148 2.711 -5.834 -6.101 1.00 0.00 C ATOM 930 C MET A 148 4.217 -6.107 -6.487 1.00 0.00 C ATOM 931 O MET A 148 4.745 -7.180 -6.148 1.00 0.00 O ATOM 932 CB MET A 148 1.716 -6.180 -7.278 1.00 0.00 C ATOM 933 CG MET A 148 0.502 -6.991 -6.827 1.00 0.00 C ATOM 934 SD MET A 148 0.598 -8.700 -7.409 1.00 0.00 S ATOM 935 CE MET A 148 0.090 -9.590 -5.923 1.00 0.00 C ATOM 0 H MET A 148 1.863 -3.878 -6.053 1.00 0.00 H new ATOM 0 HA MET A 148 2.453 -6.525 -5.298 1.00 0.00 H new ATOM 0 HB2 MET A 148 1.374 -5.253 -7.739 1.00 0.00 H new ATOM 0 HB3 MET A 148 2.252 -6.739 -8.045 1.00 0.00 H new ATOM 0 HG2 MET A 148 0.438 -6.979 -5.739 1.00 0.00 H new ATOM 0 HG3 MET A 148 -0.409 -6.527 -7.205 1.00 0.00 H new ATOM 0 HE1 MET A 148 0.029 -10.656 -6.140 1.00 0.00 H new ATOM 0 HE2 MET A 148 0.820 -9.422 -5.131 1.00 0.00 H new ATOM 0 HE3 MET A 148 -0.886 -9.230 -5.599 1.00 0.00 H new ATOM 945 N ASP A 149 4.912 -5.141 -7.140 1.00 0.00 N ATOM 946 CA ASP A 149 6.357 -5.233 -7.484 1.00 0.00 C ATOM 947 C ASP A 149 7.216 -5.262 -6.172 1.00 0.00 C ATOM 948 O ASP A 149 8.077 -6.133 -6.048 1.00 0.00 O ATOM 949 CB ASP A 149 6.665 -4.064 -8.468 1.00 0.00 C ATOM 950 CG ASP A 149 7.654 -4.318 -9.592 1.00 0.00 C ATOM 951 OD1 ASP A 149 8.462 -5.261 -9.522 1.00 0.00 O ATOM 952 OD2 ASP A 149 7.636 -3.530 -10.562 1.00 0.00 O ATOM 0 H ASP A 149 4.482 -4.268 -7.446 1.00 0.00 H new ATOM 0 HA ASP A 149 6.621 -6.160 -7.994 1.00 0.00 H new ATOM 0 HB2 ASP A 149 5.723 -3.749 -8.917 1.00 0.00 H new ATOM 0 HB3 ASP A 149 7.035 -3.223 -7.882 1.00 0.00 H new ATOM 957 N LEU A 150 6.931 -4.389 -5.169 1.00 0.00 N ATOM 958 CA LEU A 150 7.591 -4.384 -3.834 1.00 0.00 C ATOM 959 C LEU A 150 7.549 -5.784 -3.161 1.00 0.00 C ATOM 960 O LEU A 150 8.597 -6.211 -2.665 1.00 0.00 O ATOM 961 CB LEU A 150 6.937 -3.252 -2.964 1.00 0.00 C ATOM 962 CG LEU A 150 6.964 -3.309 -1.393 1.00 0.00 C ATOM 963 CD1 LEU A 150 7.770 -2.187 -0.725 1.00 0.00 C ATOM 964 CD2 LEU A 150 5.532 -3.275 -0.827 1.00 0.00 C ATOM 0 H LEU A 150 6.226 -3.658 -5.266 1.00 0.00 H new ATOM 0 HA LEU A 150 8.653 -4.164 -3.943 1.00 0.00 H new ATOM 0 HB2 LEU A 150 7.410 -2.314 -3.256 1.00 0.00 H new ATOM 0 HB3 LEU A 150 5.890 -3.188 -3.261 1.00 0.00 H new ATOM 0 HG LEU A 150 7.466 -4.248 -1.159 1.00 0.00 H new ATOM 0 HD11 LEU A 150 7.733 -2.307 0.358 1.00 0.00 H new ATOM 0 HD12 LEU A 150 8.806 -2.234 -1.060 1.00 0.00 H new ATOM 0 HD13 LEU A 150 7.344 -1.221 -0.998 1.00 0.00 H new ATOM 0 HD21 LEU A 150 5.570 -3.315 0.262 1.00 0.00 H new ATOM 0 HD22 LEU A 150 5.039 -2.354 -1.139 1.00 0.00 H new ATOM 0 HD23 LEU A 150 4.972 -4.131 -1.202 1.00 0.00 H new ATOM 976 N ILE A 151 6.401 -6.508 -3.160 1.00 0.00 N ATOM 977 CA ILE A 151 6.344 -7.844 -2.525 1.00 0.00 C ATOM 978 C ILE A 151 6.971 -8.973 -3.370 1.00 0.00 C ATOM 979 O ILE A 151 7.787 -9.709 -2.802 1.00 0.00 O ATOM 980 CB ILE A 151 4.881 -8.158 -2.024 1.00 0.00 C ATOM 981 CG1 ILE A 151 4.468 -7.180 -0.885 1.00 0.00 C ATOM 982 CG2 ILE A 151 4.668 -9.625 -1.549 1.00 0.00 C ATOM 983 CD1 ILE A 151 3.009 -7.231 -0.427 1.00 0.00 C ATOM 0 H ILE A 151 5.525 -6.198 -3.581 1.00 0.00 H new ATOM 0 HA ILE A 151 6.987 -7.807 -1.646 1.00 0.00 H new ATOM 0 HB ILE A 151 4.244 -8.018 -2.897 1.00 0.00 H new ATOM 0 HG12 ILE A 151 5.102 -7.378 -0.021 1.00 0.00 H new ATOM 0 HG13 ILE A 151 4.685 -6.164 -1.214 1.00 0.00 H new ATOM 0 HG21 ILE A 151 3.637 -9.755 -1.222 1.00 0.00 H new ATOM 0 HG22 ILE A 151 4.876 -10.308 -2.373 1.00 0.00 H new ATOM 0 HG23 ILE A 151 5.342 -9.840 -0.720 1.00 0.00 H new ATOM 0 HD11 ILE A 151 2.852 -6.503 0.369 1.00 0.00 H new ATOM 0 HD12 ILE A 151 2.355 -6.997 -1.267 1.00 0.00 H new ATOM 0 HD13 ILE A 151 2.779 -8.230 -0.055 1.00 0.00 H new ATOM 995 N LYS A 152 6.625 -9.141 -4.658 1.00 0.00 N ATOM 996 CA LYS A 152 7.182 -10.278 -5.433 1.00 0.00 C ATOM 997 C LYS A 152 8.513 -9.989 -6.204 1.00 0.00 C ATOM 998 O LYS A 152 9.391 -10.860 -6.159 1.00 0.00 O ATOM 999 CB LYS A 152 6.006 -10.892 -6.269 1.00 0.00 C ATOM 1000 CG LYS A 152 4.837 -11.431 -5.377 1.00 0.00 C ATOM 1001 CD LYS A 152 3.731 -12.281 -6.043 1.00 0.00 C ATOM 1002 CE LYS A 152 2.544 -12.508 -5.069 1.00 0.00 C ATOM 1003 NZ LYS A 152 1.561 -13.485 -5.610 1.00 0.00 N ATOM 0 H LYS A 152 5.988 -8.534 -5.174 1.00 0.00 H new ATOM 0 HA LYS A 152 7.556 -11.039 -4.748 1.00 0.00 H new ATOM 0 HB2 LYS A 152 5.617 -10.134 -6.949 1.00 0.00 H new ATOM 0 HB3 LYS A 152 6.391 -11.705 -6.884 1.00 0.00 H new ATOM 0 HG2 LYS A 152 5.278 -12.028 -4.578 1.00 0.00 H new ATOM 0 HG3 LYS A 152 4.357 -10.573 -4.906 1.00 0.00 H new ATOM 0 HD2 LYS A 152 3.376 -11.781 -6.945 1.00 0.00 H new ATOM 0 HD3 LYS A 152 4.142 -13.242 -6.352 1.00 0.00 H new ATOM 0 HE2 LYS A 152 2.923 -12.867 -4.112 1.00 0.00 H new ATOM 0 HE3 LYS A 152 2.044 -11.558 -4.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 0.784 -13.609 -4.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 1.180 -13.131 -6.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 2.031 -14.399 -5.768 1.00 0.00 H new