USER MOD reduce.3.24.130724 H: found=0, std=0, add=415, rem=0, adj=7 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+ 178:sc= 0 (180deg=-0.00816) USER MOD Single : A 100 ASN : amide:sc= -0.676 K(o=-0.68,f=-3.6!) USER MOD Single : A 111 LYS NZ :NH3+ 152:sc= 1.19 (180deg=0.898) USER MOD Single : A 114 MET CE :methyl -124:sc= 0 (180deg=-0.142) USER MOD Single : A 123 THR OG1 : rot -24:sc= -0.164 USER MOD Single : A 131 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 169:sc= 1.75 (180deg=1.44) USER MOD Single : A 139 ASN : amide:sc= -0.449 K(o=-0.45,f=-2.6!) USER MOD Single : A 148 MET CE :methyl -169:sc= -2.78! (180deg=-2.99!) USER MOD Single : A 152 LYS NZ :NH3+ -155:sc= 1.97 (180deg=1.06) USER MOD ----------------------------------------------------------------- ATOM 31 N GLU A 89 -3.874 -12.362 -0.909 1.00 0.00 N ATOM 32 CA GLU A 89 -3.803 -11.549 0.349 1.00 0.00 C ATOM 33 C GLU A 89 -3.307 -10.078 0.145 1.00 0.00 C ATOM 34 O GLU A 89 -3.897 -9.145 0.707 1.00 0.00 O ATOM 35 CB GLU A 89 -3.023 -12.317 1.451 1.00 0.00 C ATOM 36 CG GLU A 89 -3.764 -13.544 2.062 1.00 0.00 C ATOM 37 CD GLU A 89 -4.972 -13.275 2.966 1.00 0.00 C ATOM 38 OE1 GLU A 89 -5.965 -12.663 2.518 1.00 0.00 O ATOM 39 OE2 GLU A 89 -4.955 -13.736 4.124 1.00 0.00 O ATOM 0 HA GLU A 89 -4.829 -11.420 0.694 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -2.076 -12.658 1.032 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -2.784 -11.621 2.255 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -4.096 -14.178 1.240 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -3.039 -14.121 2.636 1.00 0.00 H new ATOM 46 N ILE A 90 -2.268 -9.880 -0.690 1.00 0.00 N ATOM 47 CA ILE A 90 -1.722 -8.541 -1.028 1.00 0.00 C ATOM 48 C ILE A 90 -2.754 -7.748 -1.892 1.00 0.00 C ATOM 49 O ILE A 90 -2.986 -6.586 -1.552 1.00 0.00 O ATOM 50 CB ILE A 90 -0.306 -8.694 -1.665 1.00 0.00 C ATOM 51 CG1 ILE A 90 0.814 -9.088 -0.688 1.00 0.00 C ATOM 52 CG2 ILE A 90 0.270 -7.386 -2.231 1.00 0.00 C ATOM 53 CD1 ILE A 90 0.811 -10.458 -0.048 1.00 0.00 C ATOM 0 H ILE A 90 -1.778 -10.645 -1.154 1.00 0.00 H new ATOM 0 HA ILE A 90 -1.574 -7.939 -0.131 1.00 0.00 H new ATOM 0 HB ILE A 90 -0.522 -9.459 -2.411 1.00 0.00 H new ATOM 0 HG12 ILE A 90 1.760 -8.980 -1.219 1.00 0.00 H new ATOM 0 HG13 ILE A 90 0.815 -8.354 0.118 1.00 0.00 H new ATOM 0 HG21 ILE A 90 1.256 -7.576 -2.656 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -0.392 -7.003 -3.008 1.00 0.00 H new ATOM 0 HG23 ILE A 90 0.355 -6.650 -1.432 1.00 0.00 H new ATOM 0 HD11 ILE A 90 1.675 -10.555 0.609 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -0.102 -10.586 0.533 1.00 0.00 H new ATOM 0 HD13 ILE A 90 0.858 -11.222 -0.824 1.00 0.00 H new ATOM 65 N LEU A 91 -3.359 -8.311 -2.976 1.00 0.00 N ATOM 66 CA LEU A 91 -4.401 -7.580 -3.760 1.00 0.00 C ATOM 67 C LEU A 91 -5.651 -7.281 -2.861 1.00 0.00 C ATOM 68 O LEU A 91 -6.172 -6.174 -2.959 1.00 0.00 O ATOM 69 CB LEU A 91 -4.712 -8.259 -5.126 1.00 0.00 C ATOM 70 CG LEU A 91 -5.497 -9.600 -5.185 1.00 0.00 C ATOM 71 CD1 LEU A 91 -7.030 -9.420 -5.229 1.00 0.00 C ATOM 72 CD2 LEU A 91 -5.060 -10.454 -6.395 1.00 0.00 C ATOM 0 H LEU A 91 -3.151 -9.247 -3.322 1.00 0.00 H new ATOM 0 HA LEU A 91 -4.004 -6.608 -4.052 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -5.266 -7.536 -5.725 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -3.758 -8.423 -5.627 1.00 0.00 H new ATOM 0 HG LEU A 91 -5.251 -10.112 -4.255 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -7.510 -10.398 -5.269 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -7.360 -8.890 -4.335 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -7.304 -8.845 -6.114 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -5.627 -11.385 -6.407 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -5.247 -9.902 -7.316 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -3.996 -10.679 -6.317 1.00 0.00 H new ATOM 84 N ARG A 92 -6.094 -8.193 -1.952 1.00 0.00 N ATOM 85 CA ARG A 92 -7.204 -7.939 -0.985 1.00 0.00 C ATOM 86 C ARG A 92 -6.861 -6.673 -0.115 1.00 0.00 C ATOM 87 O ARG A 92 -7.596 -5.682 -0.198 1.00 0.00 O ATOM 88 CB ARG A 92 -7.438 -9.177 -0.061 1.00 0.00 C ATOM 89 CG ARG A 92 -8.192 -10.423 -0.603 1.00 0.00 C ATOM 90 CD ARG A 92 -7.953 -11.615 0.352 1.00 0.00 C ATOM 91 NE ARG A 92 -8.611 -12.885 -0.048 1.00 0.00 N ATOM 92 CZ ARG A 92 -8.662 -13.987 0.708 1.00 0.00 C ATOM 93 NH1 ARG A 92 -8.124 -14.104 1.898 1.00 0.00 N ATOM 94 NH2 ARG A 92 -9.266 -15.023 0.212 1.00 0.00 N ATOM 0 H ARG A 92 -5.692 -9.127 -1.868 1.00 0.00 H new ATOM 0 HA ARG A 92 -8.121 -7.760 -1.547 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -6.460 -9.514 0.282 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -7.980 -8.827 0.817 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -9.259 -10.212 -0.681 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -7.841 -10.668 -1.605 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -6.880 -11.789 0.430 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -8.304 -11.340 1.347 1.00 0.00 H new ATOM 0 HE ARG A 92 -9.056 -12.919 -0.965 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -7.622 -13.318 2.310 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -8.208 -14.981 2.412 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -9.678 -14.975 -0.720 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -9.329 -15.885 0.754 1.00 0.00 H new ATOM 108 N ALA A 93 -5.708 -6.694 0.610 1.00 0.00 N ATOM 109 CA ALA A 93 -5.238 -5.573 1.462 1.00 0.00 C ATOM 110 C ALA A 93 -5.073 -4.228 0.713 1.00 0.00 C ATOM 111 O ALA A 93 -5.754 -3.274 1.105 1.00 0.00 O ATOM 112 CB ALA A 93 -3.958 -6.004 2.205 1.00 0.00 C ATOM 0 H ALA A 93 -5.077 -7.496 0.617 1.00 0.00 H new ATOM 0 HA ALA A 93 -6.022 -5.363 2.190 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -3.608 -5.184 2.833 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -4.174 -6.872 2.828 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -3.186 -6.261 1.480 1.00 0.00 H new ATOM 118 N PHE A 94 -4.245 -4.148 -0.361 1.00 0.00 N ATOM 119 CA PHE A 94 -4.103 -2.883 -1.154 1.00 0.00 C ATOM 120 C PHE A 94 -5.460 -2.381 -1.722 1.00 0.00 C ATOM 121 O PHE A 94 -5.719 -1.181 -1.638 1.00 0.00 O ATOM 122 CB PHE A 94 -3.097 -3.027 -2.334 1.00 0.00 C ATOM 123 CG PHE A 94 -2.671 -1.696 -3.011 1.00 0.00 C ATOM 124 CD1 PHE A 94 -3.584 -1.064 -3.859 1.00 0.00 C ATOM 125 CD2 PHE A 94 -1.470 -1.041 -2.716 1.00 0.00 C ATOM 126 CE1 PHE A 94 -3.349 0.219 -4.318 1.00 0.00 C ATOM 127 CE2 PHE A 94 -1.178 0.205 -3.275 1.00 0.00 C ATOM 128 CZ PHE A 94 -2.153 0.848 -4.051 1.00 0.00 C ATOM 0 H PHE A 94 -3.674 -4.923 -0.698 1.00 0.00 H new ATOM 0 HA PHE A 94 -3.719 -2.151 -0.444 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -2.203 -3.531 -1.968 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -3.540 -3.674 -3.091 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -4.482 -1.583 -4.159 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -0.760 -1.505 -2.048 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -4.108 0.731 -4.890 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -0.215 0.667 -3.112 1.00 0.00 H new ATOM 0 HZ PHE A 94 -1.966 1.838 -4.440 1.00 0.00 H new ATOM 138 N LYS A 95 -6.284 -3.260 -2.329 1.00 0.00 N ATOM 139 CA LYS A 95 -7.603 -2.852 -2.886 1.00 0.00 C ATOM 140 C LYS A 95 -8.575 -2.316 -1.783 1.00 0.00 C ATOM 141 O LYS A 95 -9.322 -1.393 -2.121 1.00 0.00 O ATOM 142 CB LYS A 95 -8.175 -3.978 -3.781 1.00 0.00 C ATOM 143 CG LYS A 95 -7.314 -4.293 -5.041 1.00 0.00 C ATOM 144 CD LYS A 95 -7.900 -5.461 -5.863 1.00 0.00 C ATOM 145 CE LYS A 95 -7.159 -5.730 -7.188 1.00 0.00 C ATOM 146 NZ LYS A 95 -7.607 -4.783 -8.247 1.00 0.00 N ATOM 0 H LYS A 95 -6.068 -4.250 -2.448 1.00 0.00 H new ATOM 0 HA LYS A 95 -7.466 -1.991 -3.540 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -8.273 -4.886 -3.185 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -9.178 -3.698 -4.101 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -7.250 -3.404 -5.668 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -6.298 -4.540 -4.734 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -7.877 -6.366 -5.256 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -8.947 -5.249 -6.081 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -6.084 -5.630 -7.036 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -7.341 -6.755 -7.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -7.071 -4.960 -9.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -8.622 -4.921 -8.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -7.442 -3.806 -7.932 1.00 0.00 H new ATOM 160 N VAL A 96 -8.601 -2.830 -0.513 1.00 0.00 N ATOM 161 CA VAL A 96 -9.400 -2.159 0.568 1.00 0.00 C ATOM 162 C VAL A 96 -8.739 -0.759 0.862 1.00 0.00 C ATOM 163 O VAL A 96 -9.453 0.238 1.008 1.00 0.00 O ATOM 164 CB VAL A 96 -9.521 -2.873 1.959 1.00 0.00 C ATOM 165 CG1 VAL A 96 -10.690 -2.306 2.792 1.00 0.00 C ATOM 166 CG2 VAL A 96 -9.624 -4.387 1.932 1.00 0.00 C ATOM 0 H VAL A 96 -8.102 -3.670 -0.220 1.00 0.00 H new ATOM 0 HA VAL A 96 -10.410 -2.143 0.159 1.00 0.00 H new ATOM 0 HB VAL A 96 -8.562 -2.649 2.427 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -10.741 -2.826 3.749 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -10.530 -1.242 2.966 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -11.625 -2.449 2.251 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -9.703 -4.765 2.951 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -10.508 -4.682 1.367 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -8.735 -4.804 1.458 1.00 0.00 H new ATOM 176 N PHE A 97 -7.382 -0.718 0.940 1.00 0.00 N ATOM 177 CA PHE A 97 -6.596 0.490 1.199 1.00 0.00 C ATOM 178 C PHE A 97 -6.856 1.677 0.197 1.00 0.00 C ATOM 179 O PHE A 97 -6.932 2.826 0.640 1.00 0.00 O ATOM 180 CB PHE A 97 -5.111 0.034 1.309 1.00 0.00 C ATOM 181 CG PHE A 97 -4.409 0.732 2.460 1.00 0.00 C ATOM 182 CD1 PHE A 97 -4.073 2.067 2.284 1.00 0.00 C ATOM 183 CD2 PHE A 97 -4.289 0.143 3.727 1.00 0.00 C ATOM 184 CE1 PHE A 97 -3.646 2.814 3.353 1.00 0.00 C ATOM 185 CE2 PHE A 97 -3.867 0.912 4.812 1.00 0.00 C ATOM 186 CZ PHE A 97 -3.559 2.259 4.625 1.00 0.00 C ATOM 0 H PHE A 97 -6.804 -1.550 0.820 1.00 0.00 H new ATOM 0 HA PHE A 97 -6.913 0.949 2.135 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -5.069 -1.045 1.454 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -4.591 0.251 0.376 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -4.148 2.518 1.306 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -4.523 -0.903 3.862 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -3.373 3.848 3.204 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -3.779 0.466 5.792 1.00 0.00 H new ATOM 0 HZ PHE A 97 -3.255 2.868 5.463 1.00 0.00 H new ATOM 196 N ASP A 98 -6.993 1.399 -1.127 1.00 0.00 N ATOM 197 CA ASP A 98 -7.366 2.385 -2.182 1.00 0.00 C ATOM 198 C ASP A 98 -8.836 2.814 -1.860 1.00 0.00 C ATOM 199 O ASP A 98 -9.757 1.983 -1.859 1.00 0.00 O ATOM 200 CB ASP A 98 -7.161 1.700 -3.563 1.00 0.00 C ATOM 201 CG ASP A 98 -7.759 2.292 -4.831 1.00 0.00 C ATOM 202 OD1 ASP A 98 -7.840 3.540 -4.962 1.00 0.00 O ATOM 203 OD2 ASP A 98 -8.136 1.513 -5.722 1.00 0.00 O ATOM 0 H ASP A 98 -6.844 0.462 -1.501 1.00 0.00 H new ATOM 0 HA ASP A 98 -6.757 3.289 -2.209 1.00 0.00 H new ATOM 0 HB2 ASP A 98 -6.086 1.623 -3.724 1.00 0.00 H new ATOM 0 HB3 ASP A 98 -7.544 0.683 -3.474 1.00 0.00 H new ATOM 208 N ALA A 99 -9.018 4.097 -1.497 1.00 0.00 N ATOM 209 CA ALA A 99 -10.364 4.698 -1.184 1.00 0.00 C ATOM 210 C ALA A 99 -11.188 4.988 -2.495 1.00 0.00 C ATOM 211 O ALA A 99 -11.709 6.081 -2.741 1.00 0.00 O ATOM 212 CB ALA A 99 -10.069 6.030 -0.506 1.00 0.00 C ATOM 0 H ALA A 99 -8.248 4.760 -1.407 1.00 0.00 H new ATOM 0 HA ALA A 99 -10.948 4.015 -0.568 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -11.007 6.523 -0.250 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -9.491 5.856 0.401 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -9.498 6.665 -1.184 1.00 0.00 H new ATOM 218 N ASN A 100 -11.260 3.937 -3.320 1.00 0.00 N ATOM 219 CA ASN A 100 -11.776 3.882 -4.699 1.00 0.00 C ATOM 220 C ASN A 100 -10.553 4.322 -5.579 1.00 0.00 C ATOM 221 O ASN A 100 -10.138 3.501 -6.394 1.00 0.00 O ATOM 222 CB ASN A 100 -13.134 4.575 -5.041 1.00 0.00 C ATOM 223 CG ASN A 100 -13.485 4.788 -6.560 1.00 0.00 C ATOM 224 OD1 ASN A 100 -12.656 4.583 -7.456 1.00 0.00 O ATOM 225 ND2 ASN A 100 -14.684 5.235 -6.939 1.00 0.00 N ATOM 0 H ASN A 100 -10.930 3.021 -3.016 1.00 0.00 H new ATOM 0 HA ASN A 100 -12.122 2.870 -4.907 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -13.933 3.986 -4.592 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -13.145 5.550 -4.555 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -14.881 5.392 -7.928 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -15.404 5.420 -6.240 1.00 0.00 H new ATOM 232 N GLY A 101 -10.039 5.566 -5.410 1.00 0.00 N ATOM 233 CA GLY A 101 -8.915 6.191 -6.134 1.00 0.00 C ATOM 234 C GLY A 101 -8.507 5.867 -7.573 1.00 0.00 C ATOM 235 O GLY A 101 -7.405 6.293 -7.894 1.00 0.00 O ATOM 0 H GLY A 101 -10.430 6.200 -4.713 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -9.105 7.264 -6.111 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -8.030 6.011 -5.524 1.00 0.00 H new ATOM 239 N ASP A 102 -9.328 5.193 -8.411 1.00 0.00 N ATOM 240 CA ASP A 102 -8.905 4.656 -9.757 1.00 0.00 C ATOM 241 C ASP A 102 -7.789 3.520 -9.632 1.00 0.00 C ATOM 242 O ASP A 102 -7.230 3.079 -10.646 1.00 0.00 O ATOM 243 CB ASP A 102 -8.515 5.777 -10.781 1.00 0.00 C ATOM 244 CG ASP A 102 -7.092 6.378 -10.811 1.00 0.00 C ATOM 245 OD1 ASP A 102 -6.166 5.874 -10.122 1.00 0.00 O ATOM 246 OD2 ASP A 102 -6.905 7.371 -11.546 1.00 0.00 O ATOM 0 H ASP A 102 -10.304 4.998 -8.188 1.00 0.00 H new ATOM 0 HA ASP A 102 -9.790 4.179 -10.177 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -8.713 5.381 -11.777 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -9.206 6.605 -10.624 1.00 0.00 H new ATOM 251 N GLY A 103 -7.560 2.983 -8.411 1.00 0.00 N ATOM 252 CA GLY A 103 -6.463 2.073 -8.085 1.00 0.00 C ATOM 253 C GLY A 103 -5.312 2.818 -7.342 1.00 0.00 C ATOM 254 O GLY A 103 -4.396 2.110 -6.918 1.00 0.00 O ATOM 0 H GLY A 103 -8.157 3.184 -7.609 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -6.835 1.260 -7.462 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -6.077 1.623 -8.999 1.00 0.00 H new ATOM 258 N VAL A 104 -5.321 4.183 -7.175 1.00 0.00 N ATOM 259 CA VAL A 104 -4.226 4.903 -6.460 1.00 0.00 C ATOM 260 C VAL A 104 -4.587 5.314 -4.989 1.00 0.00 C ATOM 261 O VAL A 104 -5.706 5.711 -4.658 1.00 0.00 O ATOM 262 CB VAL A 104 -3.644 6.111 -7.289 1.00 0.00 C ATOM 263 CG1 VAL A 104 -4.244 7.519 -7.071 1.00 0.00 C ATOM 264 CG2 VAL A 104 -2.114 6.146 -7.256 1.00 0.00 C ATOM 0 H VAL A 104 -6.063 4.790 -7.522 1.00 0.00 H new ATOM 0 HA VAL A 104 -3.426 4.168 -6.369 1.00 0.00 H new ATOM 0 HB VAL A 104 -3.997 5.867 -8.291 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -3.734 8.235 -7.715 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -5.306 7.504 -7.315 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -4.115 7.812 -6.029 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -1.757 6.994 -7.840 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -1.775 6.247 -6.225 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -1.720 5.222 -7.679 1.00 0.00 H new ATOM 274 N ILE A 105 -3.545 5.239 -4.149 1.00 0.00 N ATOM 275 CA ILE A 105 -3.570 5.594 -2.700 1.00 0.00 C ATOM 276 C ILE A 105 -2.708 6.868 -2.485 1.00 0.00 C ATOM 277 O ILE A 105 -1.521 6.874 -2.816 1.00 0.00 O ATOM 278 CB ILE A 105 -2.986 4.506 -1.720 1.00 0.00 C ATOM 279 CG1 ILE A 105 -3.691 3.134 -1.794 1.00 0.00 C ATOM 280 CG2 ILE A 105 -3.004 4.953 -0.219 1.00 0.00 C ATOM 281 CD1 ILE A 105 -2.838 2.021 -1.174 1.00 0.00 C ATOM 0 H ILE A 105 -2.626 4.921 -4.457 1.00 0.00 H new ATOM 0 HA ILE A 105 -4.627 5.715 -2.463 1.00 0.00 H new ATOM 0 HB ILE A 105 -1.960 4.399 -2.073 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -4.649 3.189 -1.276 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -3.905 2.891 -2.835 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -2.589 4.159 0.402 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -2.406 5.856 -0.101 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -4.030 5.155 0.088 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -3.370 1.072 -1.246 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -1.891 1.948 -1.709 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -2.646 2.251 -0.126 1.00 0.00 H new ATOM 293 N ASP A 106 -3.280 7.878 -1.813 1.00 0.00 N ATOM 294 CA ASP A 106 -2.563 9.133 -1.458 1.00 0.00 C ATOM 295 C ASP A 106 -2.216 9.203 0.074 1.00 0.00 C ATOM 296 O ASP A 106 -2.435 8.251 0.836 1.00 0.00 O ATOM 297 CB ASP A 106 -3.346 10.352 -2.045 1.00 0.00 C ATOM 298 CG ASP A 106 -4.523 11.001 -1.299 1.00 0.00 C ATOM 299 OD1 ASP A 106 -4.710 10.783 -0.085 1.00 0.00 O ATOM 300 OD2 ASP A 106 -5.246 11.788 -1.944 1.00 0.00 O ATOM 0 H ASP A 106 -4.249 7.858 -1.497 1.00 0.00 H new ATOM 0 HA ASP A 106 -1.578 9.157 -1.924 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -2.614 11.140 -2.222 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -3.724 10.043 -3.020 1.00 0.00 H new ATOM 305 N PHE A 107 -1.623 10.331 0.526 1.00 0.00 N ATOM 306 CA PHE A 107 -1.254 10.518 1.961 1.00 0.00 C ATOM 307 C PHE A 107 -2.473 10.707 2.901 1.00 0.00 C ATOM 308 O PHE A 107 -2.519 10.036 3.933 1.00 0.00 O ATOM 309 CB PHE A 107 -0.203 11.645 2.162 1.00 0.00 C ATOM 310 CG PHE A 107 0.419 11.785 3.583 1.00 0.00 C ATOM 311 CD1 PHE A 107 0.654 10.682 4.423 1.00 0.00 C ATOM 312 CD2 PHE A 107 0.657 13.072 4.080 1.00 0.00 C ATOM 313 CE1 PHE A 107 1.043 10.872 5.745 1.00 0.00 C ATOM 314 CE2 PHE A 107 1.084 13.257 5.393 1.00 0.00 C ATOM 315 CZ PHE A 107 1.255 12.158 6.229 1.00 0.00 C ATOM 0 H PHE A 107 -1.388 11.124 -0.071 1.00 0.00 H new ATOM 0 HA PHE A 107 -0.789 9.577 2.255 1.00 0.00 H new ATOM 0 HB2 PHE A 107 0.608 11.483 1.452 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -0.670 12.595 1.901 1.00 0.00 H new ATOM 0 HD1 PHE A 107 0.532 9.680 4.039 1.00 0.00 H new ATOM 0 HD2 PHE A 107 0.508 13.929 3.440 1.00 0.00 H new ATOM 0 HE1 PHE A 107 1.180 10.021 6.395 1.00 0.00 H new ATOM 0 HE2 PHE A 107 1.282 14.253 5.762 1.00 0.00 H new ATOM 0 HZ PHE A 107 1.553 12.304 7.257 1.00 0.00 H new ATOM 325 N ASP A 108 -3.418 11.610 2.576 1.00 0.00 N ATOM 326 CA ASP A 108 -4.654 11.808 3.402 1.00 0.00 C ATOM 327 C ASP A 108 -5.538 10.501 3.441 1.00 0.00 C ATOM 328 O ASP A 108 -5.968 10.135 4.545 1.00 0.00 O ATOM 329 CB ASP A 108 -5.409 13.111 3.019 1.00 0.00 C ATOM 330 CG ASP A 108 -4.670 14.405 3.411 1.00 0.00 C ATOM 331 OD1 ASP A 108 -4.324 14.570 4.607 1.00 0.00 O ATOM 332 OD2 ASP A 108 -4.419 15.255 2.534 1.00 0.00 O ATOM 0 H ASP A 108 -3.363 12.216 1.757 1.00 0.00 H new ATOM 0 HA ASP A 108 -4.357 11.971 4.438 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -5.581 13.115 1.943 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -6.388 13.105 3.498 1.00 0.00 H new ATOM 337 N GLU A 109 -5.762 9.757 2.320 1.00 0.00 N ATOM 338 CA GLU A 109 -6.464 8.441 2.336 1.00 0.00 C ATOM 339 C GLU A 109 -5.810 7.427 3.345 1.00 0.00 C ATOM 340 O GLU A 109 -6.532 6.801 4.125 1.00 0.00 O ATOM 341 CB GLU A 109 -6.376 7.748 0.939 1.00 0.00 C ATOM 342 CG GLU A 109 -7.138 8.334 -0.272 1.00 0.00 C ATOM 343 CD GLU A 109 -6.979 7.518 -1.556 1.00 0.00 C ATOM 344 OE1 GLU A 109 -6.872 6.274 -1.492 1.00 0.00 O ATOM 345 OE2 GLU A 109 -6.995 8.125 -2.645 1.00 0.00 O ATOM 0 H GLU A 109 -5.464 10.049 1.389 1.00 0.00 H new ATOM 0 HA GLU A 109 -7.491 8.666 2.623 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -5.322 7.704 0.666 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -6.715 6.720 1.067 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -8.197 8.402 -0.025 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -6.787 9.350 -0.453 1.00 0.00 H new ATOM 352 N PHE A 110 -4.453 7.318 3.360 1.00 0.00 N ATOM 353 CA PHE A 110 -3.712 6.365 4.245 1.00 0.00 C ATOM 354 C PHE A 110 -3.853 6.853 5.733 1.00 0.00 C ATOM 355 O PHE A 110 -4.272 6.077 6.588 1.00 0.00 O ATOM 356 CB PHE A 110 -2.226 6.315 3.727 1.00 0.00 C ATOM 357 CG PHE A 110 -1.315 5.072 3.869 1.00 0.00 C ATOM 358 CD1 PHE A 110 -1.016 4.505 5.110 1.00 0.00 C ATOM 359 CD2 PHE A 110 -0.644 4.592 2.738 1.00 0.00 C ATOM 360 CE1 PHE A 110 -0.020 3.531 5.225 1.00 0.00 C ATOM 361 CE2 PHE A 110 0.315 3.590 2.843 1.00 0.00 C ATOM 362 CZ PHE A 110 0.658 3.090 4.091 1.00 0.00 C ATOM 0 H PHE A 110 -3.844 7.881 2.766 1.00 0.00 H new ATOM 0 HA PHE A 110 -4.110 5.351 4.216 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -2.264 6.548 2.663 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -1.703 7.137 4.215 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -1.559 4.822 5.988 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -0.875 5.007 1.768 1.00 0.00 H new ATOM 0 HE1 PHE A 110 0.224 3.120 6.194 1.00 0.00 H new ATOM 0 HE2 PHE A 110 0.792 3.202 1.955 1.00 0.00 H new ATOM 0 HZ PHE A 110 1.449 2.360 4.183 1.00 0.00 H new ATOM 372 N LYS A 111 -3.584 8.154 6.004 1.00 0.00 N ATOM 373 CA LYS A 111 -3.788 8.820 7.328 1.00 0.00 C ATOM 374 C LYS A 111 -5.268 8.786 7.879 1.00 0.00 C ATOM 375 O LYS A 111 -5.481 9.148 9.035 1.00 0.00 O ATOM 376 CB LYS A 111 -3.250 10.258 7.089 1.00 0.00 C ATOM 377 CG LYS A 111 -3.256 11.308 8.230 1.00 0.00 C ATOM 378 CD LYS A 111 -3.313 12.763 7.701 1.00 0.00 C ATOM 379 CE LYS A 111 -2.109 13.173 6.835 1.00 0.00 C ATOM 380 NZ LYS A 111 -2.314 14.532 6.269 1.00 0.00 N ATOM 0 H LYS A 111 -3.211 8.789 5.298 1.00 0.00 H new ATOM 0 HA LYS A 111 -3.264 8.291 8.124 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -2.219 10.162 6.748 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -3.821 10.680 6.262 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -4.112 11.128 8.880 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -2.361 11.182 8.840 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -4.225 12.889 7.117 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -3.382 13.443 8.550 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -1.199 13.156 7.435 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -1.972 12.453 6.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -1.391 14.984 6.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -2.824 14.459 5.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -2.870 15.105 6.935 1.00 0.00 H new ATOM 394 N PHE A 112 -6.288 8.484 7.056 1.00 0.00 N ATOM 395 CA PHE A 112 -7.698 8.287 7.496 1.00 0.00 C ATOM 396 C PHE A 112 -7.994 6.760 7.783 1.00 0.00 C ATOM 397 O PHE A 112 -8.508 6.390 8.842 1.00 0.00 O ATOM 398 CB PHE A 112 -8.649 8.901 6.415 1.00 0.00 C ATOM 399 CG PHE A 112 -10.144 8.546 6.560 1.00 0.00 C ATOM 400 CD1 PHE A 112 -10.890 9.054 7.630 1.00 0.00 C ATOM 401 CD2 PHE A 112 -10.728 7.602 5.703 1.00 0.00 C ATOM 402 CE1 PHE A 112 -12.202 8.640 7.830 1.00 0.00 C ATOM 403 CE2 PHE A 112 -12.043 7.194 5.902 1.00 0.00 C ATOM 404 CZ PHE A 112 -12.781 7.713 6.966 1.00 0.00 C ATOM 0 H PHE A 112 -6.164 8.366 6.050 1.00 0.00 H new ATOM 0 HA PHE A 112 -7.876 8.804 8.439 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -8.548 9.986 6.443 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -8.310 8.574 5.432 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -10.444 9.771 8.303 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -10.155 7.190 4.886 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -12.773 9.037 8.656 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -12.493 6.475 5.233 1.00 0.00 H new ATOM 0 HZ PHE A 112 -13.802 7.396 7.120 1.00 0.00 H new ATOM 414 N ILE A 113 -7.691 5.918 6.782 1.00 0.00 N ATOM 415 CA ILE A 113 -7.940 4.454 6.720 1.00 0.00 C ATOM 416 C ILE A 113 -7.004 3.471 7.476 1.00 0.00 C ATOM 417 O ILE A 113 -7.416 2.332 7.708 1.00 0.00 O ATOM 418 CB ILE A 113 -8.035 4.144 5.171 1.00 0.00 C ATOM 419 CG1 ILE A 113 -9.339 3.387 4.835 1.00 0.00 C ATOM 420 CG2 ILE A 113 -6.796 3.509 4.519 1.00 0.00 C ATOM 421 CD1 ILE A 113 -9.733 3.405 3.350 1.00 0.00 C ATOM 0 H ILE A 113 -7.235 6.256 5.935 1.00 0.00 H new ATOM 0 HA ILE A 113 -8.845 4.255 7.294 1.00 0.00 H new ATOM 0 HB ILE A 113 -8.065 5.128 4.702 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -9.233 2.351 5.155 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -10.153 3.819 5.417 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -6.986 3.346 3.458 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -5.941 4.175 4.636 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -6.581 2.555 5.000 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -10.660 2.849 3.213 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -9.876 4.435 3.024 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -8.942 2.944 2.758 1.00 0.00 H new ATOM 433 N MET A 114 -5.754 3.883 7.769 1.00 0.00 N ATOM 434 CA MET A 114 -4.728 3.069 8.504 1.00 0.00 C ATOM 435 C MET A 114 -5.324 2.365 9.742 1.00 0.00 C ATOM 436 O MET A 114 -5.251 1.135 9.841 1.00 0.00 O ATOM 437 CB MET A 114 -3.522 4.002 8.847 1.00 0.00 C ATOM 438 CG MET A 114 -2.381 3.384 9.679 1.00 0.00 C ATOM 439 SD MET A 114 -0.948 2.966 8.667 1.00 0.00 S ATOM 440 CE MET A 114 -1.436 1.374 7.981 1.00 0.00 C ATOM 0 H MET A 114 -5.410 4.805 7.503 1.00 0.00 H new ATOM 0 HA MET A 114 -4.374 2.256 7.871 1.00 0.00 H new ATOM 0 HB2 MET A 114 -3.100 4.370 7.912 1.00 0.00 H new ATOM 0 HB3 MET A 114 -3.905 4.868 9.386 1.00 0.00 H new ATOM 0 HG2 MET A 114 -2.081 4.085 10.458 1.00 0.00 H new ATOM 0 HG3 MET A 114 -2.744 2.487 10.180 1.00 0.00 H new ATOM 0 HE1 MET A 114 -0.681 0.626 8.224 1.00 0.00 H new ATOM 0 HE2 MET A 114 -2.394 1.074 8.405 1.00 0.00 H new ATOM 0 HE3 MET A 114 -1.528 1.457 6.898 1.00 0.00 H new ATOM 575 N THR A 123 -0.787 8.626 15.642 1.00 0.00 N ATOM 576 CA THR A 123 0.466 9.396 15.416 1.00 0.00 C ATOM 577 C THR A 123 0.701 9.334 13.885 1.00 0.00 C ATOM 578 O THR A 123 0.778 8.270 13.263 1.00 0.00 O ATOM 579 CB THR A 123 1.725 8.914 16.170 1.00 0.00 C ATOM 580 OG1 THR A 123 1.854 7.500 16.106 1.00 0.00 O ATOM 581 CG2 THR A 123 1.755 9.320 17.649 1.00 0.00 C ATOM 0 HA THR A 123 0.322 10.399 15.817 1.00 0.00 H new ATOM 0 HB THR A 123 2.555 9.406 15.663 1.00 0.00 H new ATOM 0 HG1 THR A 123 0.974 7.098 15.953 1.00 0.00 H new ATOM 0 HG21 THR A 123 2.669 8.946 18.111 1.00 0.00 H new ATOM 0 HG22 THR A 123 1.727 10.407 17.729 1.00 0.00 H new ATOM 0 HG23 THR A 123 0.890 8.896 18.160 1.00 0.00 H new ATOM 589 N ASP A 124 0.844 10.535 13.326 1.00 0.00 N ATOM 590 CA ASP A 124 1.076 10.768 11.877 1.00 0.00 C ATOM 591 C ASP A 124 2.461 10.314 11.341 1.00 0.00 C ATOM 592 O ASP A 124 2.537 9.858 10.193 1.00 0.00 O ATOM 593 CB ASP A 124 0.815 12.266 11.574 1.00 0.00 C ATOM 594 CG ASP A 124 -0.646 12.718 11.632 1.00 0.00 C ATOM 595 OD1 ASP A 124 -1.147 13.026 12.734 1.00 0.00 O ATOM 596 OD2 ASP A 124 -1.286 12.791 10.558 1.00 0.00 O ATOM 0 H ASP A 124 0.803 11.399 13.867 1.00 0.00 H new ATOM 0 HA ASP A 124 0.375 10.129 11.340 1.00 0.00 H new ATOM 0 HB2 ASP A 124 1.388 12.865 12.282 1.00 0.00 H new ATOM 0 HB3 ASP A 124 1.204 12.488 10.580 1.00 0.00 H new ATOM 601 N ALA A 125 3.522 10.441 12.164 1.00 0.00 N ATOM 602 CA ALA A 125 4.893 10.010 11.813 1.00 0.00 C ATOM 603 C ALA A 125 5.012 8.511 11.431 1.00 0.00 C ATOM 604 O ALA A 125 5.727 8.211 10.467 1.00 0.00 O ATOM 605 CB ALA A 125 5.797 10.376 13.000 1.00 0.00 C ATOM 0 H ALA A 125 3.452 10.848 13.097 1.00 0.00 H new ATOM 0 HA ALA A 125 5.204 10.529 10.906 1.00 0.00 H new ATOM 0 HB1 ALA A 125 6.822 10.075 12.783 1.00 0.00 H new ATOM 0 HB2 ALA A 125 5.763 11.453 13.165 1.00 0.00 H new ATOM 0 HB3 ALA A 125 5.449 9.860 13.895 1.00 0.00 H new ATOM 611 N GLU A 126 4.300 7.586 12.129 1.00 0.00 N ATOM 612 CA GLU A 126 4.319 6.134 11.775 1.00 0.00 C ATOM 613 C GLU A 126 3.800 5.867 10.302 1.00 0.00 C ATOM 614 O GLU A 126 4.461 5.218 9.473 1.00 0.00 O ATOM 615 CB GLU A 126 3.452 5.417 12.853 1.00 0.00 C ATOM 616 CG GLU A 126 3.811 5.636 14.349 1.00 0.00 C ATOM 617 CD GLU A 126 4.717 4.599 14.994 1.00 0.00 C ATOM 618 OE1 GLU A 126 5.954 4.754 14.926 1.00 0.00 O ATOM 619 OE2 GLU A 126 4.189 3.644 15.599 1.00 0.00 O ATOM 0 H GLU A 126 3.712 7.812 12.931 1.00 0.00 H new ATOM 0 HA GLU A 126 5.337 5.745 11.776 1.00 0.00 H new ATOM 0 HB2 GLU A 126 2.418 5.729 12.710 1.00 0.00 H new ATOM 0 HB3 GLU A 126 3.492 4.346 12.654 1.00 0.00 H new ATOM 0 HG2 GLU A 126 4.288 6.611 14.445 1.00 0.00 H new ATOM 0 HG3 GLU A 126 2.883 5.678 14.919 1.00 0.00 H new ATOM 626 N VAL A 127 2.623 6.471 10.012 1.00 0.00 N ATOM 627 CA VAL A 127 1.913 6.422 8.711 1.00 0.00 C ATOM 628 C VAL A 127 2.751 7.121 7.580 1.00 0.00 C ATOM 629 O VAL A 127 2.972 6.504 6.532 1.00 0.00 O ATOM 630 CB VAL A 127 0.449 6.992 8.882 1.00 0.00 C ATOM 631 CG1 VAL A 127 -0.465 6.476 7.764 1.00 0.00 C ATOM 632 CG2 VAL A 127 -0.315 6.679 10.200 1.00 0.00 C ATOM 0 H VAL A 127 2.122 7.028 10.705 1.00 0.00 H new ATOM 0 HA VAL A 127 1.807 5.388 8.383 1.00 0.00 H new ATOM 0 HB VAL A 127 0.641 8.065 8.870 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -1.469 6.879 7.899 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -0.073 6.794 6.798 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -0.504 5.387 7.799 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -1.303 7.138 10.166 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -0.420 5.600 10.312 1.00 0.00 H new ATOM 0 HG23 VAL A 127 0.242 7.079 11.047 1.00 0.00 H new ATOM 642 N GLU A 128 3.240 8.373 7.804 1.00 0.00 N ATOM 643 CA GLU A 128 4.111 9.109 6.829 1.00 0.00 C ATOM 644 C GLU A 128 5.430 8.328 6.486 1.00 0.00 C ATOM 645 O GLU A 128 5.807 8.245 5.309 1.00 0.00 O ATOM 646 CB GLU A 128 4.344 10.551 7.379 1.00 0.00 C ATOM 647 CG GLU A 128 4.652 11.662 6.333 1.00 0.00 C ATOM 648 CD GLU A 128 6.058 11.749 5.791 1.00 0.00 C ATOM 649 OE1 GLU A 128 7.010 11.882 6.590 1.00 0.00 O ATOM 650 OE2 GLU A 128 6.239 11.656 4.561 1.00 0.00 O ATOM 0 H GLU A 128 3.047 8.900 8.655 1.00 0.00 H new ATOM 0 HA GLU A 128 3.609 9.188 5.865 1.00 0.00 H new ATOM 0 HB2 GLU A 128 3.457 10.848 7.938 1.00 0.00 H new ATOM 0 HB3 GLU A 128 5.171 10.514 8.088 1.00 0.00 H new ATOM 0 HG2 GLU A 128 3.976 11.524 5.489 1.00 0.00 H new ATOM 0 HG3 GLU A 128 4.407 12.624 6.784 1.00 0.00 H new ATOM 657 N GLU A 129 6.115 7.728 7.492 1.00 0.00 N ATOM 658 CA GLU A 129 7.317 6.874 7.266 1.00 0.00 C ATOM 659 C GLU A 129 6.977 5.626 6.392 1.00 0.00 C ATOM 660 O GLU A 129 7.634 5.441 5.351 1.00 0.00 O ATOM 661 CB GLU A 129 8.010 6.502 8.605 1.00 0.00 C ATOM 662 CG GLU A 129 8.819 7.645 9.277 1.00 0.00 C ATOM 663 CD GLU A 129 10.049 8.154 8.522 1.00 0.00 C ATOM 664 OE1 GLU A 129 9.892 9.012 7.625 1.00 0.00 O ATOM 665 OE2 GLU A 129 11.174 7.717 8.838 1.00 0.00 O ATOM 0 H GLU A 129 5.856 7.819 8.474 1.00 0.00 H new ATOM 0 HA GLU A 129 8.040 7.458 6.697 1.00 0.00 H new ATOM 0 HB2 GLU A 129 7.249 6.159 9.305 1.00 0.00 H new ATOM 0 HB3 GLU A 129 8.681 5.662 8.426 1.00 0.00 H new ATOM 0 HG2 GLU A 129 8.147 8.488 9.439 1.00 0.00 H new ATOM 0 HG3 GLU A 129 9.142 7.301 10.260 1.00 0.00 H new ATOM 672 N ALA A 130 5.923 4.844 6.750 1.00 0.00 N ATOM 673 CA ALA A 130 5.509 3.668 5.940 1.00 0.00 C ATOM 674 C ALA A 130 5.090 3.981 4.469 1.00 0.00 C ATOM 675 O ALA A 130 5.546 3.272 3.559 1.00 0.00 O ATOM 676 CB ALA A 130 4.406 2.903 6.688 1.00 0.00 C ATOM 0 H ALA A 130 5.353 5.004 7.581 1.00 0.00 H new ATOM 0 HA ALA A 130 6.398 3.048 5.828 1.00 0.00 H new ATOM 0 HB1 ALA A 130 4.098 2.039 6.099 1.00 0.00 H new ATOM 0 HB2 ALA A 130 4.786 2.567 7.653 1.00 0.00 H new ATOM 0 HB3 ALA A 130 3.550 3.559 6.844 1.00 0.00 H new ATOM 682 N MET A 131 4.266 5.028 4.207 1.00 0.00 N ATOM 683 CA MET A 131 3.890 5.370 2.803 1.00 0.00 C ATOM 684 C MET A 131 5.086 5.984 2.019 1.00 0.00 C ATOM 685 O MET A 131 5.238 5.628 0.849 1.00 0.00 O ATOM 686 CB MET A 131 2.641 6.274 2.728 1.00 0.00 C ATOM 687 CG MET A 131 2.011 6.274 1.329 1.00 0.00 C ATOM 688 SD MET A 131 0.852 7.640 1.186 1.00 0.00 S ATOM 689 CE MET A 131 1.421 8.261 -0.399 1.00 0.00 C ATOM 0 H MET A 131 3.859 5.634 4.919 1.00 0.00 H new ATOM 0 HA MET A 131 3.626 4.430 2.318 1.00 0.00 H new ATOM 0 HB2 MET A 131 1.905 5.935 3.457 1.00 0.00 H new ATOM 0 HB3 MET A 131 2.915 7.293 3.002 1.00 0.00 H new ATOM 0 HG2 MET A 131 2.788 6.363 0.570 1.00 0.00 H new ATOM 0 HG3 MET A 131 1.498 5.329 1.151 1.00 0.00 H new ATOM 0 HE1 MET A 131 0.826 9.128 -0.685 1.00 0.00 H new ATOM 0 HE2 MET A 131 2.469 8.550 -0.322 1.00 0.00 H new ATOM 0 HE3 MET A 131 1.314 7.483 -1.154 1.00 0.00 H new ATOM 699 N LYS A 132 5.907 6.897 2.601 1.00 0.00 N ATOM 700 CA LYS A 132 7.126 7.417 1.909 1.00 0.00 C ATOM 701 C LYS A 132 8.089 6.239 1.518 1.00 0.00 C ATOM 702 O LYS A 132 8.573 6.251 0.382 1.00 0.00 O ATOM 703 CB LYS A 132 7.750 8.508 2.798 1.00 0.00 C ATOM 704 CG LYS A 132 9.090 9.149 2.359 1.00 0.00 C ATOM 705 CD LYS A 132 9.973 9.638 3.535 1.00 0.00 C ATOM 706 CE LYS A 132 9.323 10.653 4.494 1.00 0.00 C ATOM 707 NZ LYS A 132 8.591 10.015 5.613 1.00 0.00 N ATOM 0 H LYS A 132 5.755 7.286 3.532 1.00 0.00 H new ATOM 0 HA LYS A 132 6.882 7.886 0.956 1.00 0.00 H new ATOM 0 HB2 LYS A 132 7.018 9.309 2.901 1.00 0.00 H new ATOM 0 HB3 LYS A 132 7.897 8.082 3.790 1.00 0.00 H new ATOM 0 HG2 LYS A 132 9.653 8.422 1.774 1.00 0.00 H new ATOM 0 HG3 LYS A 132 8.879 9.993 1.702 1.00 0.00 H new ATOM 0 HD2 LYS A 132 10.284 8.769 4.115 1.00 0.00 H new ATOM 0 HD3 LYS A 132 10.877 10.086 3.122 1.00 0.00 H new ATOM 0 HE2 LYS A 132 10.096 11.306 4.900 1.00 0.00 H new ATOM 0 HE3 LYS A 132 8.635 11.285 3.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 8.338 10.736 6.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 7.726 9.566 5.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 9.195 9.294 6.057 1.00 0.00 H new ATOM 721 N GLU A 133 8.358 5.228 2.392 1.00 0.00 N ATOM 722 CA GLU A 133 9.178 4.054 1.981 1.00 0.00 C ATOM 723 C GLU A 133 8.450 3.130 0.925 1.00 0.00 C ATOM 724 O GLU A 133 9.150 2.528 0.106 1.00 0.00 O ATOM 725 CB GLU A 133 9.707 3.303 3.233 1.00 0.00 C ATOM 726 CG GLU A 133 8.714 2.464 4.063 1.00 0.00 C ATOM 727 CD GLU A 133 9.304 1.845 5.316 1.00 0.00 C ATOM 728 OE1 GLU A 133 9.297 2.501 6.378 1.00 0.00 O ATOM 729 OE2 GLU A 133 9.744 0.677 5.249 1.00 0.00 O ATOM 0 H GLU A 133 8.030 5.201 3.357 1.00 0.00 H new ATOM 0 HA GLU A 133 10.052 4.419 1.441 1.00 0.00 H new ATOM 0 HB2 GLU A 133 10.509 2.641 2.908 1.00 0.00 H new ATOM 0 HB3 GLU A 133 10.154 4.042 3.898 1.00 0.00 H new ATOM 0 HG2 GLU A 133 7.873 3.097 4.347 1.00 0.00 H new ATOM 0 HG3 GLU A 133 8.316 1.668 3.433 1.00 0.00 H new ATOM 736 N ALA A 134 7.089 3.031 0.923 1.00 0.00 N ATOM 737 CA ALA A 134 6.338 2.217 -0.074 1.00 0.00 C ATOM 738 C ALA A 134 6.086 2.886 -1.485 1.00 0.00 C ATOM 739 O ALA A 134 5.923 2.125 -2.443 1.00 0.00 O ATOM 740 CB ALA A 134 5.039 1.693 0.566 1.00 0.00 C ATOM 0 H ALA A 134 6.492 3.505 1.601 1.00 0.00 H new ATOM 0 HA ALA A 134 6.997 1.387 -0.328 1.00 0.00 H new ATOM 0 HB1 ALA A 134 4.489 1.097 -0.163 1.00 0.00 H new ATOM 0 HB2 ALA A 134 5.283 1.075 1.430 1.00 0.00 H new ATOM 0 HB3 ALA A 134 4.425 2.535 0.884 1.00 0.00 H new ATOM 746 N ASP A 135 6.086 4.244 -1.658 1.00 0.00 N ATOM 747 CA ASP A 135 6.030 4.880 -3.012 1.00 0.00 C ATOM 748 C ASP A 135 7.535 4.907 -3.486 1.00 0.00 C ATOM 749 O ASP A 135 8.325 5.694 -2.942 1.00 0.00 O ATOM 750 CB ASP A 135 5.471 6.331 -3.102 1.00 0.00 C ATOM 751 CG ASP A 135 5.641 6.987 -4.519 1.00 0.00 C ATOM 752 OD1 ASP A 135 5.750 6.371 -5.564 1.00 0.00 O ATOM 753 OD2 ASP A 135 5.549 8.279 -4.516 1.00 0.00 O ATOM 0 H ASP A 135 6.124 4.911 -0.887 1.00 0.00 H new ATOM 0 HA ASP A 135 5.331 4.301 -3.616 1.00 0.00 H new ATOM 0 HB2 ASP A 135 4.413 6.320 -2.841 1.00 0.00 H new ATOM 0 HB3 ASP A 135 5.975 6.952 -2.361 1.00 0.00 H new ATOM 758 N GLU A 136 7.959 4.085 -4.460 1.00 0.00 N ATOM 759 CA GLU A 136 9.377 4.153 -4.960 1.00 0.00 C ATOM 760 C GLU A 136 9.653 5.390 -5.915 1.00 0.00 C ATOM 761 O GLU A 136 10.789 5.873 -5.972 1.00 0.00 O ATOM 762 CB GLU A 136 9.834 2.799 -5.574 1.00 0.00 C ATOM 763 CG GLU A 136 9.749 1.573 -4.614 1.00 0.00 C ATOM 764 CD GLU A 136 10.927 0.598 -4.596 1.00 0.00 C ATOM 765 OE1 GLU A 136 12.044 1.008 -4.215 1.00 0.00 O ATOM 766 OE2 GLU A 136 10.732 -0.591 -4.928 1.00 0.00 O ATOM 0 H GLU A 136 7.377 3.382 -4.916 1.00 0.00 H new ATOM 0 HA GLU A 136 10.002 4.332 -4.085 1.00 0.00 H new ATOM 0 HB2 GLU A 136 9.225 2.594 -6.455 1.00 0.00 H new ATOM 0 HB3 GLU A 136 10.864 2.902 -5.915 1.00 0.00 H new ATOM 0 HG2 GLU A 136 9.611 1.950 -3.601 1.00 0.00 H new ATOM 0 HG3 GLU A 136 8.852 1.009 -4.869 1.00 0.00 H new ATOM 773 N ASP A 137 8.644 5.887 -6.663 1.00 0.00 N ATOM 774 CA ASP A 137 8.705 7.064 -7.557 1.00 0.00 C ATOM 775 C ASP A 137 7.176 7.281 -7.783 1.00 0.00 C ATOM 776 O ASP A 137 6.730 8.277 -7.217 1.00 0.00 O ATOM 777 CB ASP A 137 9.688 6.954 -8.758 1.00 0.00 C ATOM 778 CG ASP A 137 9.313 7.602 -10.113 1.00 0.00 C ATOM 779 OD1 ASP A 137 8.297 8.339 -10.212 1.00 0.00 O ATOM 780 OD2 ASP A 137 10.060 7.372 -11.088 1.00 0.00 O ATOM 0 H ASP A 137 7.719 5.457 -6.660 1.00 0.00 H new ATOM 0 HA ASP A 137 9.186 7.963 -7.171 1.00 0.00 H new ATOM 0 HB2 ASP A 137 10.638 7.384 -8.442 1.00 0.00 H new ATOM 0 HB3 ASP A 137 9.863 5.894 -8.941 1.00 0.00 H new ATOM 785 N GLY A 138 6.418 6.494 -8.612 1.00 0.00 N ATOM 786 CA GLY A 138 4.947 6.575 -8.803 1.00 0.00 C ATOM 787 C GLY A 138 4.254 7.938 -8.732 1.00 0.00 C ATOM 788 O GLY A 138 3.098 7.953 -8.310 1.00 0.00 O ATOM 0 H GLY A 138 6.840 5.761 -9.183 1.00 0.00 H new ATOM 0 HA2 GLY A 138 4.719 6.143 -9.777 1.00 0.00 H new ATOM 0 HA3 GLY A 138 4.484 5.933 -8.053 1.00 0.00 H new ATOM 792 N ASN A 139 4.929 9.054 -9.106 1.00 0.00 N ATOM 793 CA ASN A 139 4.375 10.429 -8.920 1.00 0.00 C ATOM 794 C ASN A 139 4.188 10.864 -7.399 1.00 0.00 C ATOM 795 O ASN A 139 3.816 12.025 -7.197 1.00 0.00 O ATOM 796 CB ASN A 139 3.087 10.636 -9.806 1.00 0.00 C ATOM 797 CG ASN A 139 1.699 10.824 -9.099 1.00 0.00 C ATOM 798 OD1 ASN A 139 1.191 9.868 -8.511 1.00 0.00 O ATOM 799 ND2 ASN A 139 1.056 11.992 -9.042 1.00 0.00 N ATOM 0 H ASN A 139 5.853 9.034 -9.537 1.00 0.00 H new ATOM 0 HA ASN A 139 5.133 11.124 -9.281 1.00 0.00 H new ATOM 0 HB2 ASN A 139 3.257 11.510 -10.435 1.00 0.00 H new ATOM 0 HB3 ASN A 139 3.004 9.777 -10.471 1.00 0.00 H new ATOM 0 HD21 ASN A 139 0.179 12.067 -8.526 1.00 0.00 H new ATOM 0 HD22 ASN A 139 1.441 12.810 -9.515 1.00 0.00 H new ATOM 806 N GLY A 140 4.446 10.029 -6.350 1.00 0.00 N ATOM 807 CA GLY A 140 4.176 10.402 -4.939 1.00 0.00 C ATOM 808 C GLY A 140 2.938 9.681 -4.324 1.00 0.00 C ATOM 809 O GLY A 140 2.892 9.559 -3.098 1.00 0.00 O ATOM 0 H GLY A 140 4.840 9.095 -6.461 1.00 0.00 H new ATOM 0 HA2 GLY A 140 5.055 10.171 -4.337 1.00 0.00 H new ATOM 0 HA3 GLY A 140 4.023 11.480 -4.881 1.00 0.00 H new ATOM 813 N VAL A 141 1.961 9.198 -5.135 1.00 0.00 N ATOM 814 CA VAL A 141 0.758 8.459 -4.641 1.00 0.00 C ATOM 815 C VAL A 141 0.888 7.060 -5.313 1.00 0.00 C ATOM 816 O VAL A 141 1.149 6.909 -6.514 1.00 0.00 O ATOM 817 CB VAL A 141 -0.565 9.283 -4.808 1.00 0.00 C ATOM 818 CG1 VAL A 141 -0.481 10.628 -4.053 1.00 0.00 C ATOM 819 CG2 VAL A 141 -1.133 9.570 -6.201 1.00 0.00 C ATOM 0 H VAL A 141 1.980 9.307 -6.149 1.00 0.00 H new ATOM 0 HA VAL A 141 0.704 8.308 -3.563 1.00 0.00 H new ATOM 0 HB VAL A 141 -1.272 8.569 -4.387 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -1.412 11.179 -4.186 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -0.319 10.440 -2.992 1.00 0.00 H new ATOM 0 HG13 VAL A 141 0.348 11.216 -4.448 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -2.050 10.152 -6.107 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -0.403 10.134 -6.782 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -1.350 8.629 -6.706 1.00 0.00 H new ATOM 829 N ILE A 142 0.687 6.029 -4.479 1.00 0.00 N ATOM 830 CA ILE A 142 0.905 4.625 -4.855 1.00 0.00 C ATOM 831 C ILE A 142 -0.184 3.938 -5.713 1.00 0.00 C ATOM 832 O ILE A 142 -1.343 3.884 -5.319 1.00 0.00 O ATOM 833 CB ILE A 142 1.103 3.675 -3.606 1.00 0.00 C ATOM 834 CG1 ILE A 142 1.648 4.207 -2.232 1.00 0.00 C ATOM 835 CG2 ILE A 142 1.987 2.504 -4.066 1.00 0.00 C ATOM 836 CD1 ILE A 142 2.237 3.127 -1.308 1.00 0.00 C ATOM 0 H ILE A 142 0.366 6.147 -3.518 1.00 0.00 H new ATOM 0 HA ILE A 142 1.804 4.735 -5.462 1.00 0.00 H new ATOM 0 HB ILE A 142 0.074 3.445 -3.329 1.00 0.00 H new ATOM 0 HG12 ILE A 142 2.416 4.956 -2.427 1.00 0.00 H new ATOM 0 HG13 ILE A 142 0.837 4.711 -1.707 1.00 0.00 H new ATOM 0 HG21 ILE A 142 2.150 1.821 -3.232 1.00 0.00 H new ATOM 0 HG22 ILE A 142 1.493 1.972 -4.879 1.00 0.00 H new ATOM 0 HG23 ILE A 142 2.946 2.887 -4.414 1.00 0.00 H new ATOM 0 HD11 ILE A 142 2.587 3.589 -0.385 1.00 0.00 H new ATOM 0 HD12 ILE A 142 1.469 2.389 -1.076 1.00 0.00 H new ATOM 0 HD13 ILE A 142 3.073 2.637 -1.808 1.00 0.00 H new ATOM 848 N ASP A 143 0.238 3.351 -6.837 1.00 0.00 N ATOM 849 CA ASP A 143 -0.614 2.513 -7.702 1.00 0.00 C ATOM 850 C ASP A 143 -0.461 1.041 -7.196 1.00 0.00 C ATOM 851 O ASP A 143 0.539 0.653 -6.568 1.00 0.00 O ATOM 852 CB ASP A 143 -0.269 2.733 -9.192 1.00 0.00 C ATOM 853 CG ASP A 143 1.158 2.469 -9.702 1.00 0.00 C ATOM 854 OD1 ASP A 143 1.805 1.495 -9.261 1.00 0.00 O ATOM 855 OD2 ASP A 143 1.618 3.236 -10.573 1.00 0.00 O ATOM 0 H ASP A 143 1.194 3.443 -7.181 1.00 0.00 H new ATOM 0 HA ASP A 143 -1.668 2.784 -7.638 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -0.942 2.105 -9.776 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -0.511 3.769 -9.431 1.00 0.00 H new ATOM 860 N ILE A 144 -1.461 0.191 -7.471 1.00 0.00 N ATOM 861 CA ILE A 144 -1.425 -1.228 -7.008 1.00 0.00 C ATOM 862 C ILE A 144 -0.147 -2.024 -7.467 1.00 0.00 C ATOM 863 O ILE A 144 0.419 -2.650 -6.563 1.00 0.00 O ATOM 864 CB ILE A 144 -2.693 -2.085 -7.421 1.00 0.00 C ATOM 865 CG1 ILE A 144 -4.089 -1.390 -7.389 1.00 0.00 C ATOM 866 CG2 ILE A 144 -2.700 -3.470 -6.698 1.00 0.00 C ATOM 867 CD1 ILE A 144 -5.266 -2.210 -7.936 1.00 0.00 C ATOM 0 H ILE A 144 -2.296 0.443 -8.001 1.00 0.00 H new ATOM 0 HA ILE A 144 -1.410 -1.107 -5.925 1.00 0.00 H new ATOM 0 HB ILE A 144 -2.550 -2.229 -8.492 1.00 0.00 H new ATOM 0 HG12 ILE A 144 -4.312 -1.116 -6.358 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -4.023 -0.463 -7.958 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -3.582 -4.034 -7.002 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -1.802 -4.026 -6.968 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -2.721 -3.317 -5.619 1.00 0.00 H new ATOM 0 HD11 ILE A 144 -6.183 -1.625 -7.862 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -5.080 -2.462 -8.980 1.00 0.00 H new ATOM 0 HD13 ILE A 144 -5.373 -3.126 -7.355 1.00 0.00 H new ATOM 879 N PRO A 145 0.343 -2.073 -8.750 1.00 0.00 N ATOM 880 CA PRO A 145 1.564 -2.828 -9.122 1.00 0.00 C ATOM 881 C PRO A 145 2.839 -2.535 -8.287 1.00 0.00 C ATOM 882 O PRO A 145 3.604 -3.465 -8.084 1.00 0.00 O ATOM 883 CB PRO A 145 1.735 -2.547 -10.627 1.00 0.00 C ATOM 884 CG PRO A 145 0.336 -2.147 -11.101 1.00 0.00 C ATOM 885 CD PRO A 145 -0.204 -1.353 -9.914 1.00 0.00 C ATOM 0 HA PRO A 145 1.433 -3.886 -8.896 1.00 0.00 H new ATOM 0 HB2 PRO A 145 2.457 -1.750 -10.803 1.00 0.00 H new ATOM 0 HB3 PRO A 145 2.097 -3.428 -11.157 1.00 0.00 H new ATOM 0 HG2 PRO A 145 0.372 -1.545 -12.009 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -0.282 -3.018 -11.321 1.00 0.00 H new ATOM 0 HD2 PRO A 145 0.129 -0.315 -9.939 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -1.294 -1.338 -9.902 1.00 0.00 H new ATOM 893 N GLU A 146 3.063 -1.313 -7.761 1.00 0.00 N ATOM 894 CA GLU A 146 4.251 -0.986 -6.933 1.00 0.00 C ATOM 895 C GLU A 146 4.338 -1.776 -5.599 1.00 0.00 C ATOM 896 O GLU A 146 5.299 -2.527 -5.446 1.00 0.00 O ATOM 897 CB GLU A 146 4.225 0.561 -6.714 1.00 0.00 C ATOM 898 CG GLU A 146 5.135 1.384 -7.650 1.00 0.00 C ATOM 899 CD GLU A 146 6.533 1.627 -7.114 1.00 0.00 C ATOM 900 OE1 GLU A 146 6.659 2.085 -5.957 1.00 0.00 O ATOM 901 OE2 GLU A 146 7.505 1.365 -7.851 1.00 0.00 O ATOM 0 H GLU A 146 2.430 -0.525 -7.896 1.00 0.00 H new ATOM 0 HA GLU A 146 5.155 -1.296 -7.457 1.00 0.00 H new ATOM 0 HB2 GLU A 146 3.199 0.910 -6.836 1.00 0.00 H new ATOM 0 HB3 GLU A 146 4.512 0.769 -5.683 1.00 0.00 H new ATOM 0 HG2 GLU A 146 5.211 0.869 -8.607 1.00 0.00 H new ATOM 0 HG3 GLU A 146 4.661 2.346 -7.843 1.00 0.00 H new ATOM 908 N PHE A 147 3.363 -1.652 -4.671 1.00 0.00 N ATOM 909 CA PHE A 147 3.337 -2.407 -3.379 1.00 0.00 C ATOM 910 C PHE A 147 3.472 -3.952 -3.553 1.00 0.00 C ATOM 911 O PHE A 147 4.318 -4.613 -2.908 1.00 0.00 O ATOM 912 CB PHE A 147 2.054 -1.971 -2.593 1.00 0.00 C ATOM 913 CG PHE A 147 1.575 -2.887 -1.438 1.00 0.00 C ATOM 914 CD1 PHE A 147 2.266 -2.999 -0.230 1.00 0.00 C ATOM 915 CD2 PHE A 147 0.459 -3.704 -1.662 1.00 0.00 C ATOM 916 CE1 PHE A 147 1.840 -3.911 0.741 1.00 0.00 C ATOM 917 CE2 PHE A 147 -0.015 -4.544 -0.661 1.00 0.00 C ATOM 918 CZ PHE A 147 0.685 -4.665 0.529 1.00 0.00 C ATOM 0 H PHE A 147 2.566 -1.026 -4.789 1.00 0.00 H new ATOM 0 HA PHE A 147 4.221 -2.151 -2.795 1.00 0.00 H new ATOM 0 HB2 PHE A 147 2.233 -0.978 -2.182 1.00 0.00 H new ATOM 0 HB3 PHE A 147 1.237 -1.877 -3.309 1.00 0.00 H new ATOM 0 HD1 PHE A 147 3.131 -2.380 -0.045 1.00 0.00 H new ATOM 0 HD2 PHE A 147 -0.037 -3.681 -2.621 1.00 0.00 H new ATOM 0 HE1 PHE A 147 2.404 -4.032 1.654 1.00 0.00 H new ATOM 0 HE2 PHE A 147 -0.928 -5.102 -0.810 1.00 0.00 H new ATOM 0 HZ PHE A 147 0.336 -5.344 1.293 1.00 0.00 H new ATOM 928 N MET A 148 2.630 -4.523 -4.444 1.00 0.00 N ATOM 929 CA MET A 148 2.697 -5.962 -4.684 1.00 0.00 C ATOM 930 C MET A 148 3.997 -6.344 -5.402 1.00 0.00 C ATOM 931 O MET A 148 4.599 -7.269 -4.878 1.00 0.00 O ATOM 932 CB MET A 148 1.444 -6.567 -5.293 1.00 0.00 C ATOM 933 CG MET A 148 0.673 -6.325 -6.580 1.00 0.00 C ATOM 934 SD MET A 148 -0.459 -7.768 -6.783 1.00 0.00 S ATOM 935 CE MET A 148 -0.649 -8.629 -5.160 1.00 0.00 C ATOM 0 H MET A 148 1.925 -4.023 -4.985 1.00 0.00 H new ATOM 0 HA MET A 148 2.729 -6.433 -3.702 1.00 0.00 H new ATOM 0 HB2 MET A 148 1.669 -7.633 -5.329 1.00 0.00 H new ATOM 0 HB3 MET A 148 0.692 -6.426 -4.517 1.00 0.00 H new ATOM 0 HG2 MET A 148 0.110 -5.393 -6.527 1.00 0.00 H new ATOM 0 HG3 MET A 148 1.351 -6.240 -7.429 1.00 0.00 H new ATOM 0 HE1 MET A 148 -1.152 -9.584 -5.311 1.00 0.00 H new ATOM 0 HE2 MET A 148 0.334 -8.802 -4.723 1.00 0.00 H new ATOM 0 HE3 MET A 148 -1.241 -8.010 -4.487 1.00 0.00 H new ATOM 945 N ASP A 149 4.507 -5.723 -6.484 1.00 0.00 N ATOM 946 CA ASP A 149 5.842 -6.131 -7.020 1.00 0.00 C ATOM 947 C ASP A 149 7.013 -5.922 -5.971 1.00 0.00 C ATOM 948 O ASP A 149 7.952 -6.722 -5.945 1.00 0.00 O ATOM 949 CB ASP A 149 6.047 -5.466 -8.398 1.00 0.00 C ATOM 950 CG ASP A 149 6.392 -6.447 -9.530 1.00 0.00 C ATOM 951 OD1 ASP A 149 5.710 -7.490 -9.670 1.00 0.00 O ATOM 952 OD2 ASP A 149 7.322 -6.174 -10.313 1.00 0.00 O ATOM 0 H ASP A 149 4.047 -4.968 -6.993 1.00 0.00 H new ATOM 0 HA ASP A 149 5.870 -7.208 -7.184 1.00 0.00 H new ATOM 0 HB2 ASP A 149 5.139 -4.925 -8.666 1.00 0.00 H new ATOM 0 HB3 ASP A 149 6.845 -4.728 -8.317 1.00 0.00 H new ATOM 957 N LEU A 150 6.897 -4.928 -5.050 1.00 0.00 N ATOM 958 CA LEU A 150 7.824 -4.688 -3.907 1.00 0.00 C ATOM 959 C LEU A 150 7.891 -5.971 -2.996 1.00 0.00 C ATOM 960 O LEU A 150 9.002 -6.330 -2.595 1.00 0.00 O ATOM 961 CB LEU A 150 7.313 -3.330 -3.334 1.00 0.00 C ATOM 962 CG LEU A 150 7.794 -2.676 -2.010 1.00 0.00 C ATOM 963 CD1 LEU A 150 7.815 -1.155 -2.239 1.00 0.00 C ATOM 964 CD2 LEU A 150 6.852 -2.896 -0.799 1.00 0.00 C ATOM 0 H LEU A 150 6.134 -4.251 -5.082 1.00 0.00 H new ATOM 0 HA LEU A 150 8.886 -4.565 -4.117 1.00 0.00 H new ATOM 0 HB2 LEU A 150 7.494 -2.591 -4.114 1.00 0.00 H new ATOM 0 HB3 LEU A 150 6.232 -3.435 -3.239 1.00 0.00 H new ATOM 0 HG LEU A 150 8.757 -3.130 -1.776 1.00 0.00 H new ATOM 0 HD11 LEU A 150 8.149 -0.655 -1.330 1.00 0.00 H new ATOM 0 HD12 LEU A 150 8.499 -0.919 -3.055 1.00 0.00 H new ATOM 0 HD13 LEU A 150 6.813 -0.812 -2.495 1.00 0.00 H new ATOM 0 HD21 LEU A 150 7.269 -2.404 0.080 1.00 0.00 H new ATOM 0 HD22 LEU A 150 5.871 -2.475 -1.020 1.00 0.00 H new ATOM 0 HD23 LEU A 150 6.753 -3.964 -0.604 1.00 0.00 H new ATOM 976 N ILE A 151 6.757 -6.677 -2.716 1.00 0.00 N ATOM 977 CA ILE A 151 6.788 -7.983 -1.964 1.00 0.00 C ATOM 978 C ILE A 151 6.932 -9.204 -2.994 1.00 0.00 C ATOM 979 O ILE A 151 7.921 -9.935 -2.992 1.00 0.00 O ATOM 980 CB ILE A 151 5.567 -8.130 -0.975 1.00 0.00 C ATOM 981 CG1 ILE A 151 5.411 -6.931 0.015 1.00 0.00 C ATOM 982 CG2 ILE A 151 5.626 -9.460 -0.168 1.00 0.00 C ATOM 983 CD1 ILE A 151 4.095 -6.869 0.807 1.00 0.00 C ATOM 0 H ILE A 151 5.822 -6.376 -2.991 1.00 0.00 H new ATOM 0 HA ILE A 151 7.668 -7.998 -1.321 1.00 0.00 H new ATOM 0 HB ILE A 151 4.690 -8.138 -1.622 1.00 0.00 H new ATOM 0 HG12 ILE A 151 6.237 -6.964 0.726 1.00 0.00 H new ATOM 0 HG13 ILE A 151 5.514 -6.005 -0.550 1.00 0.00 H new ATOM 0 HG21 ILE A 151 4.766 -9.519 0.500 1.00 0.00 H new ATOM 0 HG22 ILE A 151 5.609 -10.305 -0.857 1.00 0.00 H new ATOM 0 HG23 ILE A 151 6.544 -9.489 0.419 1.00 0.00 H new ATOM 0 HD11 ILE A 151 4.104 -5.996 1.459 1.00 0.00 H new ATOM 0 HD12 ILE A 151 3.257 -6.797 0.114 1.00 0.00 H new ATOM 0 HD13 ILE A 151 3.990 -7.771 1.410 1.00 0.00 H new ATOM 995 N LYS A 152 5.903 -9.385 -3.836 1.00 0.00 N ATOM 996 CA LYS A 152 5.679 -10.412 -4.900 1.00 0.00 C ATOM 997 C LYS A 152 6.482 -10.359 -6.273 1.00 0.00 C ATOM 998 O LYS A 152 6.139 -11.182 -7.113 1.00 0.00 O ATOM 999 CB LYS A 152 4.102 -10.445 -5.012 1.00 0.00 C ATOM 1000 CG LYS A 152 3.356 -11.241 -6.123 1.00 0.00 C ATOM 1001 CD LYS A 152 2.574 -10.410 -7.186 1.00 0.00 C ATOM 1002 CE LYS A 152 3.209 -9.155 -7.832 1.00 0.00 C ATOM 1003 NZ LYS A 152 4.368 -9.507 -8.682 1.00 0.00 N ATOM 0 H LYS A 152 5.108 -8.748 -3.794 1.00 0.00 H new ATOM 0 HA LYS A 152 6.141 -11.353 -4.601 1.00 0.00 H new ATOM 0 HB2 LYS A 152 3.730 -10.819 -4.058 1.00 0.00 H new ATOM 0 HB3 LYS A 152 3.774 -9.409 -5.098 1.00 0.00 H new ATOM 0 HG2 LYS A 152 4.087 -11.858 -6.646 1.00 0.00 H new ATOM 0 HG3 LYS A 152 2.653 -11.920 -5.640 1.00 0.00 H new ATOM 0 HD2 LYS A 152 2.313 -11.091 -7.996 1.00 0.00 H new ATOM 0 HD3 LYS A 152 1.640 -10.094 -6.722 1.00 0.00 H new ATOM 0 HE2 LYS A 152 2.461 -8.636 -8.432 1.00 0.00 H new ATOM 0 HE3 LYS A 152 3.526 -8.464 -7.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 5.008 -8.690 -8.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 4.876 -10.311 -8.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 4.035 -9.768 -9.632 1.00 0.00 H new