USER MOD reduce.3.24.130724 H: found=0, std=0, add=449, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 449 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 126 LYS NZ :NH3+ -146:sc= -0.0111 (180deg=-0.525) USER MOD Single : A 128 LYS NZ :NH3+ 162:sc= -0.0573 (180deg=-0.276) USER MOD Single : A 134 ASN : amide:sc= -2.72 X(o=-2.7,f=-3!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ -137:sc= 0.0824 (180deg=-0.445) USER MOD Single : A 138 HIS :FLIP no HE2:sc= -0.521 F(o=-1.4,f=-0.52) USER MOD Single : A 141 ASN : amide:sc= -2.94! C(o=-2.9!,f=-3.3!) USER MOD Single : A 142 LYS NZ :NH3+ -146:sc= -0.0807 (180deg=-0.387) USER MOD Single : A 145 GLN :FLIP amide:sc= -4.15! C(o=-5!,f=-4.1!) USER MOD Single : A 147 GLN : amide:sc= -0.0189 X(o=-0.019,f=-0.021) USER MOD Single : A 152 SER OG : rot 180:sc= 0.167 USER MOD Single : A 154 GLN :FLIP amide:sc= -0.281 F(o=-2.2,f=-0.28) USER MOD Single : A 156 GLN :FLIP amide:sc= -5.24! C(o=-6.1!,f=-5.2!) USER MOD Single : A 158 ASN :FLIP amide:sc= -0.581 F(o=-1.4,f=-0.58) USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 ASN : amide:sc= -0.0756 K(o=-0.076,f=-1.7) USER MOD Single : A 169 SER OG : rot -79:sc= 0.697 USER MOD Single : A 170 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 61 N PRO A 122 15.088 4.113 0.731 1.00 0.00 N ATOM 62 CA PRO A 122 14.243 3.277 1.581 1.00 0.00 C ATOM 63 C PRO A 122 13.048 4.041 2.135 1.00 0.00 C ATOM 64 O PRO A 122 11.931 3.522 2.164 1.00 0.00 O ATOM 65 CB PRO A 122 15.176 2.829 2.715 1.00 0.00 C ATOM 66 CG PRO A 122 16.396 3.685 2.594 1.00 0.00 C ATOM 67 CD PRO A 122 16.497 4.065 1.145 1.00 0.00 C ATOM 0 HA PRO A 122 13.815 2.443 1.025 1.00 0.00 H new ATOM 0 HB2 PRO A 122 14.701 2.959 3.688 1.00 0.00 H new ATOM 0 HB3 PRO A 122 15.428 1.773 2.621 1.00 0.00 H new ATOM 0 HG2 PRO A 122 16.315 4.571 3.224 1.00 0.00 H new ATOM 0 HG3 PRO A 122 17.285 3.144 2.918 1.00 0.00 H new ATOM 0 HD2 PRO A 122 16.992 5.027 1.011 1.00 0.00 H new ATOM 0 HD3 PRO A 122 17.064 3.332 0.572 1.00 0.00 H new ATOM 75 N GLU A 123 13.273 5.276 2.567 1.00 0.00 N ATOM 76 CA GLU A 123 12.194 6.089 3.099 1.00 0.00 C ATOM 77 C GLU A 123 11.277 6.543 1.969 1.00 0.00 C ATOM 78 O GLU A 123 10.086 6.779 2.178 1.00 0.00 O ATOM 79 CB GLU A 123 12.758 7.302 3.842 1.00 0.00 C ATOM 80 CG GLU A 123 11.690 8.208 4.432 1.00 0.00 C ATOM 81 CD GLU A 123 12.268 9.271 5.346 1.00 0.00 C ATOM 82 OE1 GLU A 123 13.099 10.073 4.871 1.00 0.00 O ATOM 83 OE2 GLU A 123 11.890 9.301 6.536 1.00 0.00 O ATOM 0 H GLU A 123 14.186 5.731 2.559 1.00 0.00 H new ATOM 0 HA GLU A 123 11.617 5.489 3.803 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.411 6.955 4.643 1.00 0.00 H new ATOM 0 HB3 GLU A 123 13.376 7.882 3.156 1.00 0.00 H new ATOM 0 HG2 GLU A 123 11.140 8.689 3.624 1.00 0.00 H new ATOM 0 HG3 GLU A 123 10.974 7.604 4.990 1.00 0.00 H new ATOM 90 N GLU A 124 11.840 6.659 0.767 1.00 0.00 N ATOM 91 CA GLU A 124 11.069 7.077 -0.394 1.00 0.00 C ATOM 92 C GLU A 124 10.160 5.957 -0.872 1.00 0.00 C ATOM 93 O GLU A 124 9.002 6.191 -1.213 1.00 0.00 O ATOM 94 CB GLU A 124 11.997 7.518 -1.526 1.00 0.00 C ATOM 95 CG GLU A 124 11.285 8.284 -2.629 1.00 0.00 C ATOM 96 CD GLU A 124 12.080 9.477 -3.120 1.00 0.00 C ATOM 97 OE1 GLU A 124 11.475 10.550 -3.327 1.00 0.00 O ATOM 98 OE2 GLU A 124 13.310 9.341 -3.297 1.00 0.00 O ATOM 0 H GLU A 124 12.824 6.469 0.576 1.00 0.00 H new ATOM 0 HA GLU A 124 10.449 7.923 -0.098 1.00 0.00 H new ATOM 0 HB2 GLU A 124 12.789 8.143 -1.113 1.00 0.00 H new ATOM 0 HB3 GLU A 124 12.476 6.638 -1.956 1.00 0.00 H new ATOM 0 HG2 GLU A 124 11.092 7.612 -3.465 1.00 0.00 H new ATOM 0 HG3 GLU A 124 10.316 8.624 -2.263 1.00 0.00 H new ATOM 105 N ILE A 125 10.683 4.735 -0.886 1.00 0.00 N ATOM 106 CA ILE A 125 9.895 3.589 -1.317 1.00 0.00 C ATOM 107 C ILE A 125 8.788 3.315 -0.307 1.00 0.00 C ATOM 108 O ILE A 125 7.658 2.993 -0.673 1.00 0.00 O ATOM 109 CB ILE A 125 10.765 2.321 -1.507 1.00 0.00 C ATOM 110 CG1 ILE A 125 10.977 1.583 -0.179 1.00 0.00 C ATOM 111 CG2 ILE A 125 12.105 2.692 -2.122 1.00 0.00 C ATOM 112 CD1 ILE A 125 11.837 0.344 -0.308 1.00 0.00 C ATOM 0 H ILE A 125 11.639 4.515 -0.607 1.00 0.00 H new ATOM 0 HA ILE A 125 9.459 3.834 -2.286 1.00 0.00 H new ATOM 0 HB ILE A 125 10.235 1.649 -2.182 1.00 0.00 H new ATOM 0 HG12 ILE A 125 11.439 2.264 0.536 1.00 0.00 H new ATOM 0 HG13 ILE A 125 10.007 1.301 0.230 1.00 0.00 H new ATOM 0 HG21 ILE A 125 12.708 1.793 -2.251 1.00 0.00 H new ATOM 0 HG22 ILE A 125 11.943 3.162 -3.092 1.00 0.00 H new ATOM 0 HG23 ILE A 125 12.627 3.388 -1.465 1.00 0.00 H new ATOM 0 HD11 ILE A 125 11.945 -0.127 0.669 1.00 0.00 H new ATOM 0 HD12 ILE A 125 11.366 -0.356 -0.998 1.00 0.00 H new ATOM 0 HD13 ILE A 125 12.820 0.622 -0.688 1.00 0.00 H new ATOM 124 N LYS A 126 9.129 3.458 0.969 1.00 0.00 N ATOM 125 CA LYS A 126 8.171 3.238 2.045 1.00 0.00 C ATOM 126 C LYS A 126 7.054 4.270 1.994 1.00 0.00 C ATOM 127 O LYS A 126 5.874 3.926 2.066 1.00 0.00 O ATOM 128 CB LYS A 126 8.876 3.286 3.403 1.00 0.00 C ATOM 129 CG LYS A 126 8.148 2.526 4.500 1.00 0.00 C ATOM 130 CD LYS A 126 7.093 3.392 5.171 1.00 0.00 C ATOM 131 CE LYS A 126 7.660 4.133 6.371 1.00 0.00 C ATOM 132 NZ LYS A 126 7.912 3.220 7.520 1.00 0.00 N ATOM 0 H LYS A 126 10.062 3.725 1.283 1.00 0.00 H new ATOM 0 HA LYS A 126 7.730 2.250 1.913 1.00 0.00 H new ATOM 0 HB2 LYS A 126 9.880 2.876 3.295 1.00 0.00 H new ATOM 0 HB3 LYS A 126 8.987 4.327 3.707 1.00 0.00 H new ATOM 0 HG2 LYS A 126 7.677 1.638 4.078 1.00 0.00 H new ATOM 0 HG3 LYS A 126 8.866 2.183 5.245 1.00 0.00 H new ATOM 0 HD2 LYS A 126 6.699 4.110 4.452 1.00 0.00 H new ATOM 0 HD3 LYS A 126 6.257 2.768 5.489 1.00 0.00 H new ATOM 0 HE2 LYS A 126 8.591 4.625 6.087 1.00 0.00 H new ATOM 0 HE3 LYS A 126 6.966 4.916 6.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 7.734 3.726 8.411 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 7.278 2.398 7.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 8.900 2.897 7.497 1.00 0.00 H new ATOM 146 N ALA A 127 7.428 5.535 1.852 1.00 0.00 N ATOM 147 CA ALA A 127 6.445 6.606 1.773 1.00 0.00 C ATOM 148 C ALA A 127 5.648 6.481 0.486 1.00 0.00 C ATOM 149 O ALA A 127 4.443 6.725 0.461 1.00 0.00 O ATOM 150 CB ALA A 127 7.125 7.966 1.852 1.00 0.00 C ATOM 0 H ALA A 127 8.398 5.843 1.790 1.00 0.00 H new ATOM 0 HA ALA A 127 5.763 6.520 2.619 1.00 0.00 H new ATOM 0 HB1 ALA A 127 6.373 8.753 1.791 1.00 0.00 H new ATOM 0 HB2 ALA A 127 7.662 8.050 2.797 1.00 0.00 H new ATOM 0 HB3 ALA A 127 7.827 8.070 1.025 1.00 0.00 H new ATOM 156 N LYS A 128 6.333 6.087 -0.584 1.00 0.00 N ATOM 157 CA LYS A 128 5.689 5.912 -1.877 1.00 0.00 C ATOM 158 C LYS A 128 4.571 4.888 -1.772 1.00 0.00 C ATOM 159 O LYS A 128 3.471 5.097 -2.281 1.00 0.00 O ATOM 160 CB LYS A 128 6.708 5.472 -2.931 1.00 0.00 C ATOM 161 CG LYS A 128 7.156 6.589 -3.859 1.00 0.00 C ATOM 162 CD LYS A 128 7.692 7.785 -3.086 1.00 0.00 C ATOM 163 CE LYS A 128 7.202 9.096 -3.680 1.00 0.00 C ATOM 164 NZ LYS A 128 5.732 9.268 -3.511 1.00 0.00 N ATOM 0 H LYS A 128 7.333 5.884 -0.579 1.00 0.00 H new ATOM 0 HA LYS A 128 5.265 6.868 -2.183 1.00 0.00 H new ATOM 0 HB2 LYS A 128 7.582 5.059 -2.427 1.00 0.00 H new ATOM 0 HB3 LYS A 128 6.275 4.669 -3.528 1.00 0.00 H new ATOM 0 HG2 LYS A 128 7.928 6.215 -4.531 1.00 0.00 H new ATOM 0 HG3 LYS A 128 6.317 6.904 -4.480 1.00 0.00 H new ATOM 0 HD2 LYS A 128 7.379 7.717 -2.044 1.00 0.00 H new ATOM 0 HD3 LYS A 128 8.782 7.766 -3.093 1.00 0.00 H new ATOM 0 HE2 LYS A 128 7.722 9.927 -3.203 1.00 0.00 H new ATOM 0 HE3 LYS A 128 7.452 9.130 -4.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 5.482 10.269 -3.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 5.232 8.692 -4.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 5.454 8.963 -2.556 1.00 0.00 H new ATOM 178 N ALA A 129 4.856 3.783 -1.093 1.00 0.00 N ATOM 179 CA ALA A 129 3.865 2.736 -0.905 1.00 0.00 C ATOM 180 C ALA A 129 2.705 3.256 -0.077 1.00 0.00 C ATOM 181 O ALA A 129 1.547 3.104 -0.447 1.00 0.00 O ATOM 182 CB ALA A 129 4.495 1.524 -0.239 1.00 0.00 C ATOM 0 H ALA A 129 5.762 3.591 -0.666 1.00 0.00 H new ATOM 0 HA ALA A 129 3.486 2.433 -1.881 1.00 0.00 H new ATOM 0 HB1 ALA A 129 3.740 0.749 -0.105 1.00 0.00 H new ATOM 0 HB2 ALA A 129 5.300 1.142 -0.866 1.00 0.00 H new ATOM 0 HB3 ALA A 129 4.897 1.811 0.733 1.00 0.00 H new ATOM 188 N LEU A 130 3.037 3.874 1.046 1.00 0.00 N ATOM 189 CA LEU A 130 2.036 4.433 1.943 1.00 0.00 C ATOM 190 C LEU A 130 1.188 5.475 1.229 1.00 0.00 C ATOM 191 O LEU A 130 -0.010 5.588 1.483 1.00 0.00 O ATOM 192 CB LEU A 130 2.728 5.050 3.161 1.00 0.00 C ATOM 193 CG LEU A 130 2.612 4.236 4.452 1.00 0.00 C ATOM 194 CD1 LEU A 130 3.972 4.092 5.118 1.00 0.00 C ATOM 195 CD2 LEU A 130 1.616 4.881 5.403 1.00 0.00 C ATOM 0 H LEU A 130 3.999 4.002 1.360 1.00 0.00 H new ATOM 0 HA LEU A 130 1.374 3.632 2.273 1.00 0.00 H new ATOM 0 HB2 LEU A 130 3.784 5.187 2.929 1.00 0.00 H new ATOM 0 HB3 LEU A 130 2.309 6.041 3.335 1.00 0.00 H new ATOM 0 HG LEU A 130 2.248 3.240 4.198 1.00 0.00 H new ATOM 0 HD11 LEU A 130 3.869 3.510 6.034 1.00 0.00 H new ATOM 0 HD12 LEU A 130 4.657 3.583 4.440 1.00 0.00 H new ATOM 0 HD13 LEU A 130 4.366 5.080 5.358 1.00 0.00 H new ATOM 0 HD21 LEU A 130 1.547 4.288 6.315 1.00 0.00 H new ATOM 0 HD22 LEU A 130 1.949 5.889 5.650 1.00 0.00 H new ATOM 0 HD23 LEU A 130 0.637 4.929 4.927 1.00 0.00 H new ATOM 207 N ASP A 131 1.809 6.232 0.338 1.00 0.00 N ATOM 208 CA ASP A 131 1.098 7.259 -0.406 1.00 0.00 C ATOM 209 C ASP A 131 0.132 6.637 -1.404 1.00 0.00 C ATOM 210 O ASP A 131 -1.037 7.019 -1.469 1.00 0.00 O ATOM 211 CB ASP A 131 2.086 8.169 -1.137 1.00 0.00 C ATOM 212 CG ASP A 131 1.609 9.606 -1.198 1.00 0.00 C ATOM 213 OD1 ASP A 131 2.015 10.404 -0.326 1.00 0.00 O ATOM 214 OD2 ASP A 131 0.831 9.936 -2.118 1.00 0.00 O ATOM 0 H ASP A 131 2.801 6.155 0.113 1.00 0.00 H new ATOM 0 HA ASP A 131 0.526 7.854 0.306 1.00 0.00 H new ATOM 0 HB2 ASP A 131 3.052 8.131 -0.634 1.00 0.00 H new ATOM 0 HB3 ASP A 131 2.239 7.796 -2.150 1.00 0.00 H new ATOM 219 N LEU A 132 0.621 5.682 -2.187 1.00 0.00 N ATOM 220 CA LEU A 132 -0.218 5.027 -3.179 1.00 0.00 C ATOM 221 C LEU A 132 -1.266 4.153 -2.514 1.00 0.00 C ATOM 222 O LEU A 132 -2.387 4.034 -3.007 1.00 0.00 O ATOM 223 CB LEU A 132 0.626 4.185 -4.135 1.00 0.00 C ATOM 224 CG LEU A 132 1.198 4.946 -5.333 1.00 0.00 C ATOM 225 CD1 LEU A 132 2.690 5.167 -5.155 1.00 0.00 C ATOM 226 CD2 LEU A 132 0.917 4.197 -6.627 1.00 0.00 C ATOM 0 H LEU A 132 1.584 5.348 -2.154 1.00 0.00 H new ATOM 0 HA LEU A 132 -0.723 5.807 -3.749 1.00 0.00 H new ATOM 0 HB2 LEU A 132 1.451 3.745 -3.576 1.00 0.00 H new ATOM 0 HB3 LEU A 132 0.016 3.361 -4.505 1.00 0.00 H new ATOM 0 HG LEU A 132 0.710 5.919 -5.390 1.00 0.00 H new ATOM 0 HD11 LEU A 132 3.083 5.709 -6.015 1.00 0.00 H new ATOM 0 HD12 LEU A 132 2.866 5.747 -4.249 1.00 0.00 H new ATOM 0 HD13 LEU A 132 3.193 4.204 -5.073 1.00 0.00 H new ATOM 0 HD21 LEU A 132 1.331 4.754 -7.467 1.00 0.00 H new ATOM 0 HD22 LEU A 132 1.377 3.210 -6.583 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -0.160 4.090 -6.759 1.00 0.00 H new ATOM 238 N LEU A 133 -0.913 3.551 -1.385 1.00 0.00 N ATOM 239 CA LEU A 133 -1.845 2.711 -0.661 1.00 0.00 C ATOM 240 C LEU A 133 -2.859 3.574 0.069 1.00 0.00 C ATOM 241 O LEU A 133 -4.035 3.235 0.141 1.00 0.00 O ATOM 242 CB LEU A 133 -1.105 1.818 0.332 1.00 0.00 C ATOM 243 CG LEU A 133 -0.493 0.553 -0.271 1.00 0.00 C ATOM 244 CD1 LEU A 133 0.880 0.280 0.328 1.00 0.00 C ATOM 245 CD2 LEU A 133 -1.418 -0.639 -0.060 1.00 0.00 C ATOM 0 H LEU A 133 0.009 3.631 -0.956 1.00 0.00 H new ATOM 0 HA LEU A 133 -2.366 2.074 -1.375 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -0.311 2.400 0.800 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -1.797 1.528 1.123 1.00 0.00 H new ATOM 0 HG LEU A 133 -0.371 0.709 -1.343 1.00 0.00 H new ATOM 0 HD11 LEU A 133 1.297 -0.624 -0.115 1.00 0.00 H new ATOM 0 HD12 LEU A 133 1.541 1.122 0.123 1.00 0.00 H new ATOM 0 HD13 LEU A 133 0.787 0.146 1.406 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -0.967 -1.531 -0.495 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -1.573 -0.795 1.008 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -2.377 -0.445 -0.541 1.00 0.00 H new ATOM 257 N ASN A 134 -2.393 4.701 0.605 1.00 0.00 N ATOM 258 CA ASN A 134 -3.275 5.610 1.317 1.00 0.00 C ATOM 259 C ASN A 134 -4.306 6.193 0.365 1.00 0.00 C ATOM 260 O ASN A 134 -5.495 6.251 0.680 1.00 0.00 O ATOM 261 CB ASN A 134 -2.475 6.737 1.964 1.00 0.00 C ATOM 262 CG ASN A 134 -1.879 6.334 3.297 1.00 0.00 C ATOM 263 OD1 ASN A 134 -2.467 5.551 4.043 1.00 0.00 O ATOM 264 ND2 ASN A 134 -0.705 6.869 3.601 1.00 0.00 N ATOM 0 H ASN A 134 -1.419 5.000 0.558 1.00 0.00 H new ATOM 0 HA ASN A 134 -3.786 5.049 2.099 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -1.675 7.044 1.290 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -3.122 7.603 2.106 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -0.252 6.636 4.485 1.00 0.00 H new ATOM 0 HD22 ASN A 134 -0.255 7.514 2.951 1.00 0.00 H new ATOM 271 N LYS A 135 -3.847 6.624 -0.805 1.00 0.00 N ATOM 272 CA LYS A 135 -4.744 7.202 -1.799 1.00 0.00 C ATOM 273 C LYS A 135 -5.717 6.152 -2.322 1.00 0.00 C ATOM 274 O LYS A 135 -6.905 6.422 -2.498 1.00 0.00 O ATOM 275 CB LYS A 135 -3.945 7.811 -2.958 1.00 0.00 C ATOM 276 CG LYS A 135 -3.421 6.787 -3.953 1.00 0.00 C ATOM 277 CD LYS A 135 -2.744 7.457 -5.139 1.00 0.00 C ATOM 278 CE LYS A 135 -2.677 6.528 -6.342 1.00 0.00 C ATOM 279 NZ LYS A 135 -3.548 7.000 -7.455 1.00 0.00 N ATOM 0 H LYS A 135 -2.868 6.585 -1.087 1.00 0.00 H new ATOM 0 HA LYS A 135 -5.317 7.995 -1.318 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -4.577 8.525 -3.486 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -3.103 8.371 -2.551 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -2.713 6.124 -3.456 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -4.245 6.167 -4.306 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -3.289 8.362 -5.407 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -1.736 7.764 -4.858 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -1.647 6.459 -6.691 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -2.980 5.524 -6.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -3.475 6.341 -8.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -4.535 7.042 -7.130 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -3.243 7.947 -7.757 1.00 0.00 H new ATOM 293 N LYS A 136 -5.205 4.948 -2.561 1.00 0.00 N ATOM 294 CA LYS A 136 -6.029 3.855 -3.056 1.00 0.00 C ATOM 295 C LYS A 136 -6.990 3.385 -1.978 1.00 0.00 C ATOM 296 O LYS A 136 -8.132 3.028 -2.264 1.00 0.00 O ATOM 297 CB LYS A 136 -5.152 2.693 -3.529 1.00 0.00 C ATOM 298 CG LYS A 136 -4.849 2.729 -5.018 1.00 0.00 C ATOM 299 CD LYS A 136 -3.827 1.672 -5.408 1.00 0.00 C ATOM 300 CE LYS A 136 -2.422 2.250 -5.470 1.00 0.00 C ATOM 301 NZ LYS A 136 -1.516 1.424 -6.318 1.00 0.00 N ATOM 0 H LYS A 136 -4.224 4.707 -2.419 1.00 0.00 H new ATOM 0 HA LYS A 136 -6.609 4.219 -3.904 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -4.213 2.708 -2.975 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -5.649 1.753 -3.290 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -5.769 2.571 -5.581 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -4.474 3.716 -5.290 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -3.854 0.855 -4.687 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -4.091 1.250 -6.378 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -2.464 3.265 -5.866 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -2.013 2.318 -4.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -0.594 1.325 -5.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -1.936 0.483 -6.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -1.385 1.887 -7.240 1.00 0.00 H new ATOM 315 N LEU A 137 -6.531 3.406 -0.734 1.00 0.00 N ATOM 316 CA LEU A 137 -7.355 3.007 0.394 1.00 0.00 C ATOM 317 C LEU A 137 -8.474 4.017 0.603 1.00 0.00 C ATOM 318 O LEU A 137 -9.631 3.654 0.812 1.00 0.00 O ATOM 319 CB LEU A 137 -6.493 2.900 1.656 1.00 0.00 C ATOM 320 CG LEU A 137 -7.223 2.417 2.907 1.00 0.00 C ATOM 321 CD1 LEU A 137 -7.842 1.050 2.668 1.00 0.00 C ATOM 322 CD2 LEU A 137 -6.277 2.375 4.095 1.00 0.00 C ATOM 0 H LEU A 137 -5.587 3.697 -0.482 1.00 0.00 H new ATOM 0 HA LEU A 137 -7.798 2.033 0.187 1.00 0.00 H new ATOM 0 HB2 LEU A 137 -5.665 2.221 1.454 1.00 0.00 H new ATOM 0 HB3 LEU A 137 -6.059 3.878 1.864 1.00 0.00 H new ATOM 0 HG LEU A 137 -8.023 3.122 3.132 1.00 0.00 H new ATOM 0 HD11 LEU A 137 -8.358 0.722 3.570 1.00 0.00 H new ATOM 0 HD12 LEU A 137 -8.554 1.112 1.845 1.00 0.00 H new ATOM 0 HD13 LEU A 137 -7.059 0.335 2.417 1.00 0.00 H new ATOM 0 HD21 LEU A 137 -6.816 2.028 4.977 1.00 0.00 H new ATOM 0 HD22 LEU A 137 -5.454 1.693 3.881 1.00 0.00 H new ATOM 0 HD23 LEU A 137 -5.881 3.374 4.281 1.00 0.00 H new ATOM 334 N HIS A 138 -8.109 5.293 0.531 1.00 0.00 N ATOM 335 CA HIS A 138 -9.067 6.376 0.696 1.00 0.00 C ATOM 336 C HIS A 138 -10.022 6.423 -0.490 1.00 0.00 C ATOM 337 O HIS A 138 -11.222 6.642 -0.328 1.00 0.00 O ATOM 338 CB HIS A 138 -8.343 7.714 0.854 1.00 0.00 C ATOM 339 CG HIS A 138 -7.664 7.866 2.179 1.00 0.00 C ATOM 340 ND1 HIS A 138 -6.367 8.101 2.490 1.00 0.00 N flip ATOM 341 CD2 HIS A 138 -8.332 7.769 3.382 1.00 0.00 C flip ATOM 342 CE1 HIS A 138 -6.278 8.145 3.860 1.00 0.00 C flip ATOM 343 NE2 HIS A 138 -7.477 7.943 4.375 1.00 0.00 N flip ATOM 0 H HIS A 138 -7.152 5.601 0.359 1.00 0.00 H new ATOM 0 HA HIS A 138 -9.646 6.191 1.601 1.00 0.00 H new ATOM 0 HB2 HIS A 138 -7.603 7.815 0.060 1.00 0.00 H new ATOM 0 HB3 HIS A 138 -9.060 8.525 0.726 1.00 0.00 H new ATOM 0 HD1 HIS A 138 -5.599 8.223 1.830 1.00 0.00 H new ATOM 0 HD2 HIS A 138 -9.389 7.580 3.495 1.00 0.00 H new ATOM 0 HE1 HIS A 138 -5.374 8.317 4.425 1.00 0.00 H new ATOM 352 N ARG A 139 -9.480 6.185 -1.682 1.00 0.00 N ATOM 353 CA ARG A 139 -10.285 6.166 -2.896 1.00 0.00 C ATOM 354 C ARG A 139 -11.163 4.926 -2.912 1.00 0.00 C ATOM 355 O ARG A 139 -12.322 4.973 -3.316 1.00 0.00 O ATOM 356 CB ARG A 139 -9.391 6.196 -4.139 1.00 0.00 C ATOM 357 CG ARG A 139 -10.166 6.231 -5.446 1.00 0.00 C ATOM 358 CD ARG A 139 -9.248 6.064 -6.649 1.00 0.00 C ATOM 359 NE ARG A 139 -9.099 7.308 -7.401 1.00 0.00 N ATOM 360 CZ ARG A 139 -8.206 8.253 -7.110 1.00 0.00 C ATOM 361 NH1 ARG A 139 -7.380 8.103 -6.082 1.00 0.00 N ATOM 362 NH2 ARG A 139 -8.140 9.351 -7.851 1.00 0.00 N ATOM 0 H ARG A 139 -8.487 6.003 -1.831 1.00 0.00 H new ATOM 0 HA ARG A 139 -10.918 7.053 -2.909 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -8.742 7.070 -4.088 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -8.745 5.318 -4.133 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -10.915 5.439 -5.447 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -10.702 7.176 -5.526 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -8.268 5.724 -6.313 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -9.647 5.290 -7.304 1.00 0.00 H new ATOM 0 HE ARG A 139 -9.717 7.462 -8.198 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -7.426 7.260 -5.509 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -6.699 8.830 -5.865 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -8.772 9.471 -8.642 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -7.457 10.075 -7.630 1.00 0.00 H new ATOM 376 N ALA A 140 -10.598 3.815 -2.454 1.00 0.00 N ATOM 377 CA ALA A 140 -11.326 2.555 -2.395 1.00 0.00 C ATOM 378 C ALA A 140 -12.429 2.625 -1.347 1.00 0.00 C ATOM 379 O ALA A 140 -13.529 2.113 -1.549 1.00 0.00 O ATOM 380 CB ALA A 140 -10.372 1.411 -2.091 1.00 0.00 C ATOM 0 H ALA A 140 -9.636 3.762 -2.118 1.00 0.00 H new ATOM 0 HA ALA A 140 -11.788 2.373 -3.366 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -10.928 0.475 -2.049 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -9.616 1.350 -2.874 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -9.887 1.587 -1.131 1.00 0.00 H new ATOM 386 N ASN A 141 -12.125 3.273 -0.229 1.00 0.00 N ATOM 387 CA ASN A 141 -13.084 3.430 0.857 1.00 0.00 C ATOM 388 C ASN A 141 -14.199 4.387 0.453 1.00 0.00 C ATOM 389 O ASN A 141 -15.367 4.173 0.778 1.00 0.00 O ATOM 390 CB ASN A 141 -12.379 3.951 2.112 1.00 0.00 C ATOM 391 CG ASN A 141 -11.910 2.835 3.023 1.00 0.00 C ATOM 392 OD1 ASN A 141 -12.716 2.070 3.552 1.00 0.00 O ATOM 393 ND2 ASN A 141 -10.599 2.736 3.213 1.00 0.00 N ATOM 0 H ASN A 141 -11.216 3.700 -0.051 1.00 0.00 H new ATOM 0 HA ASN A 141 -13.522 2.456 1.073 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -11.523 4.558 1.818 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -13.058 4.602 2.662 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -10.225 2.004 3.817 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -9.966 3.392 2.755 1.00 0.00 H new ATOM 400 N LYS A 142 -13.825 5.446 -0.257 1.00 0.00 N ATOM 401 CA LYS A 142 -14.783 6.444 -0.710 1.00 0.00 C ATOM 402 C LYS A 142 -15.573 5.932 -1.914 1.00 0.00 C ATOM 403 O LYS A 142 -16.732 6.297 -2.110 1.00 0.00 O ATOM 404 CB LYS A 142 -14.062 7.757 -1.037 1.00 0.00 C ATOM 405 CG LYS A 142 -13.204 7.709 -2.286 1.00 0.00 C ATOM 406 CD LYS A 142 -13.519 8.859 -3.231 1.00 0.00 C ATOM 407 CE LYS A 142 -12.287 9.296 -4.008 1.00 0.00 C ATOM 408 NZ LYS A 142 -11.262 9.919 -3.125 1.00 0.00 N ATOM 0 H LYS A 142 -12.861 5.634 -0.531 1.00 0.00 H new ATOM 0 HA LYS A 142 -15.495 6.635 0.093 1.00 0.00 H new ATOM 0 HB2 LYS A 142 -14.805 8.546 -1.152 1.00 0.00 H new ATOM 0 HB3 LYS A 142 -13.433 8.032 -0.190 1.00 0.00 H new ATOM 0 HG2 LYS A 142 -12.151 7.746 -2.006 1.00 0.00 H new ATOM 0 HG3 LYS A 142 -13.363 6.761 -2.801 1.00 0.00 H new ATOM 0 HD2 LYS A 142 -14.301 8.555 -3.927 1.00 0.00 H new ATOM 0 HD3 LYS A 142 -13.909 9.703 -2.662 1.00 0.00 H new ATOM 0 HE2 LYS A 142 -11.853 8.434 -4.515 1.00 0.00 H new ATOM 0 HE3 LYS A 142 -12.579 10.006 -4.781 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 -10.766 10.671 -3.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 -11.726 10.326 -2.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 -10.577 9.196 -2.825 1.00 0.00 H new ATOM 422 N PHE A 143 -14.941 5.070 -2.708 1.00 0.00 N ATOM 423 CA PHE A 143 -15.587 4.488 -3.887 1.00 0.00 C ATOM 424 C PHE A 143 -16.471 3.300 -3.502 1.00 0.00 C ATOM 425 O PHE A 143 -17.198 2.762 -4.338 1.00 0.00 O ATOM 426 CB PHE A 143 -14.537 4.038 -4.908 1.00 0.00 C ATOM 427 CG PHE A 143 -14.095 5.132 -5.840 1.00 0.00 C ATOM 428 CD1 PHE A 143 -13.952 6.431 -5.384 1.00 0.00 C ATOM 429 CD2 PHE A 143 -13.829 4.863 -7.173 1.00 0.00 C ATOM 430 CE1 PHE A 143 -13.551 7.440 -6.235 1.00 0.00 C ATOM 431 CE2 PHE A 143 -13.426 5.870 -8.030 1.00 0.00 C ATOM 432 CZ PHE A 143 -13.286 7.161 -7.558 1.00 0.00 C ATOM 0 H PHE A 143 -13.982 4.758 -2.558 1.00 0.00 H new ATOM 0 HA PHE A 143 -16.215 5.259 -4.334 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -13.667 3.652 -4.376 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -14.943 3.214 -5.495 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -14.157 6.658 -4.348 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -13.938 3.856 -7.547 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -13.445 8.449 -5.864 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -13.221 5.648 -9.067 1.00 0.00 H new ATOM 0 HZ PHE A 143 -12.970 7.950 -8.225 1.00 0.00 H new ATOM 442 N GLY A 144 -16.407 2.896 -2.235 1.00 0.00 N ATOM 443 CA GLY A 144 -17.208 1.778 -1.767 1.00 0.00 C ATOM 444 C GLY A 144 -16.815 0.457 -2.406 1.00 0.00 C ATOM 445 O GLY A 144 -17.562 -0.517 -2.330 1.00 0.00 O ATOM 0 H GLY A 144 -15.814 3.324 -1.524 1.00 0.00 H new ATOM 0 HA2 GLY A 144 -17.109 1.695 -0.685 1.00 0.00 H new ATOM 0 HA3 GLY A 144 -18.259 1.978 -1.977 1.00 0.00 H new ATOM 449 N GLN A 145 -15.646 0.422 -3.045 1.00 0.00 N ATOM 450 CA GLN A 145 -15.174 -0.796 -3.702 1.00 0.00 C ATOM 451 C GLN A 145 -15.224 -1.992 -2.749 1.00 0.00 C ATOM 452 O GLN A 145 -15.668 -1.872 -1.607 1.00 0.00 O ATOM 453 CB GLN A 145 -13.754 -0.601 -4.245 1.00 0.00 C ATOM 454 CG GLN A 145 -12.681 -0.520 -3.170 1.00 0.00 C ATOM 455 CD GLN A 145 -11.314 -0.923 -3.688 1.00 0.00 C ATOM 456 OE1 GLN A 145 -10.543 -1.612 -2.853 1.00 0.00 O flip ATOM 457 NE2 GLN A 145 -10.956 -0.620 -4.825 1.00 0.00 N flip ATOM 0 H GLN A 145 -15.012 1.218 -3.122 1.00 0.00 H new ATOM 0 HA GLN A 145 -15.840 -1.004 -4.539 1.00 0.00 H new ATOM 0 HB2 GLN A 145 -13.518 -1.426 -4.917 1.00 0.00 H new ATOM 0 HB3 GLN A 145 -13.727 0.312 -4.839 1.00 0.00 H new ATOM 0 HG2 GLN A 145 -12.634 0.498 -2.783 1.00 0.00 H new ATOM 0 HG3 GLN A 145 -12.956 -1.166 -2.336 1.00 0.00 H new ATOM 0 HE21 GLN A 145 -11.581 -0.090 -5.432 1.00 0.00 H new ATOM 0 HE22 GLN A 145 -10.034 -0.899 -5.161 1.00 0.00 H new ATOM 466 N ASP A 146 -14.769 -3.147 -3.228 1.00 0.00 N ATOM 467 CA ASP A 146 -14.768 -4.369 -2.424 1.00 0.00 C ATOM 468 C ASP A 146 -14.155 -4.131 -1.045 1.00 0.00 C ATOM 469 O ASP A 146 -12.952 -3.889 -0.922 1.00 0.00 O ATOM 470 CB ASP A 146 -14.003 -5.474 -3.152 1.00 0.00 C ATOM 471 CG ASP A 146 -14.699 -5.912 -4.425 1.00 0.00 C ATOM 472 OD1 ASP A 146 -15.180 -5.034 -5.173 1.00 0.00 O ATOM 473 OD2 ASP A 146 -14.765 -7.134 -4.675 1.00 0.00 O ATOM 0 H ASP A 146 -14.396 -3.264 -4.170 1.00 0.00 H new ATOM 0 HA ASP A 146 -15.804 -4.677 -2.282 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -13.000 -5.121 -3.392 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -13.889 -6.332 -2.489 1.00 0.00 H new ATOM 478 N GLN A 147 -14.989 -4.208 -0.007 1.00 0.00 N ATOM 479 CA GLN A 147 -14.535 -4.003 1.365 1.00 0.00 C ATOM 480 C GLN A 147 -13.347 -4.901 1.693 1.00 0.00 C ATOM 481 O GLN A 147 -12.418 -4.486 2.385 1.00 0.00 O ATOM 482 CB GLN A 147 -15.677 -4.275 2.347 1.00 0.00 C ATOM 483 CG GLN A 147 -15.295 -4.066 3.804 1.00 0.00 C ATOM 484 CD GLN A 147 -14.954 -2.621 4.119 1.00 0.00 C ATOM 485 OE1 GLN A 147 -15.836 -1.767 4.204 1.00 0.00 O ATOM 486 NE2 GLN A 147 -13.667 -2.344 4.298 1.00 0.00 N ATOM 0 H GLN A 147 -15.985 -4.412 -0.093 1.00 0.00 H new ATOM 0 HA GLN A 147 -14.217 -2.965 1.460 1.00 0.00 H new ATOM 0 HB2 GLN A 147 -16.516 -3.623 2.104 1.00 0.00 H new ATOM 0 HB3 GLN A 147 -16.021 -5.301 2.215 1.00 0.00 H new ATOM 0 HG2 GLN A 147 -16.119 -4.388 4.441 1.00 0.00 H new ATOM 0 HG3 GLN A 147 -14.440 -4.698 4.045 1.00 0.00 H new ATOM 0 HE21 GLN A 147 -12.970 -3.084 4.218 1.00 0.00 H new ATOM 0 HE22 GLN A 147 -13.376 -1.391 4.516 1.00 0.00 H new ATOM 495 N ALA A 148 -13.380 -6.130 1.189 1.00 0.00 N ATOM 496 CA ALA A 148 -12.297 -7.071 1.430 1.00 0.00 C ATOM 497 C ALA A 148 -10.999 -6.548 0.836 1.00 0.00 C ATOM 498 O ALA A 148 -9.925 -6.717 1.413 1.00 0.00 O ATOM 499 CB ALA A 148 -12.634 -8.438 0.853 1.00 0.00 C ATOM 0 H ALA A 148 -14.140 -6.494 0.615 1.00 0.00 H new ATOM 0 HA ALA A 148 -12.168 -7.177 2.507 1.00 0.00 H new ATOM 0 HB1 ALA A 148 -11.811 -9.127 1.044 1.00 0.00 H new ATOM 0 HB2 ALA A 148 -13.541 -8.818 1.323 1.00 0.00 H new ATOM 0 HB3 ALA A 148 -12.792 -8.350 -0.222 1.00 0.00 H new ATOM 505 N ASP A 149 -11.110 -5.899 -0.316 1.00 0.00 N ATOM 506 CA ASP A 149 -9.950 -5.334 -0.986 1.00 0.00 C ATOM 507 C ASP A 149 -9.417 -4.145 -0.200 1.00 0.00 C ATOM 508 O ASP A 149 -8.209 -3.895 -0.171 1.00 0.00 O ATOM 509 CB ASP A 149 -10.311 -4.901 -2.408 1.00 0.00 C ATOM 510 CG ASP A 149 -9.086 -4.624 -3.256 1.00 0.00 C ATOM 511 OD1 ASP A 149 -8.142 -3.985 -2.745 1.00 0.00 O ATOM 512 OD2 ASP A 149 -9.069 -5.047 -4.431 1.00 0.00 O ATOM 0 H ASP A 149 -11.993 -5.752 -0.805 1.00 0.00 H new ATOM 0 HA ASP A 149 -9.176 -6.099 -1.040 1.00 0.00 H new ATOM 0 HB2 ASP A 149 -10.909 -5.680 -2.881 1.00 0.00 H new ATOM 0 HB3 ASP A 149 -10.931 -4.005 -2.366 1.00 0.00 H new ATOM 517 N ILE A 150 -10.323 -3.415 0.448 1.00 0.00 N ATOM 518 CA ILE A 150 -9.927 -2.257 1.241 1.00 0.00 C ATOM 519 C ILE A 150 -9.118 -2.695 2.452 1.00 0.00 C ATOM 520 O ILE A 150 -8.060 -2.134 2.741 1.00 0.00 O ATOM 521 CB ILE A 150 -11.152 -1.451 1.722 1.00 0.00 C ATOM 522 CG1 ILE A 150 -12.216 -1.388 0.623 1.00 0.00 C ATOM 523 CG2 ILE A 150 -10.730 -0.053 2.146 1.00 0.00 C ATOM 524 CD1 ILE A 150 -13.328 -0.397 0.895 1.00 0.00 C ATOM 0 H ILE A 150 -11.325 -3.603 0.439 1.00 0.00 H new ATOM 0 HA ILE A 150 -9.320 -1.620 0.599 1.00 0.00 H new ATOM 0 HB ILE A 150 -11.585 -1.955 2.586 1.00 0.00 H new ATOM 0 HG12 ILE A 150 -11.734 -1.128 -0.320 1.00 0.00 H new ATOM 0 HG13 ILE A 150 -12.651 -2.379 0.496 1.00 0.00 H new ATOM 0 HG21 ILE A 150 -11.604 0.504 2.483 1.00 0.00 H new ATOM 0 HG22 ILE A 150 -10.008 -0.122 2.960 1.00 0.00 H new ATOM 0 HG23 ILE A 150 -10.275 0.462 1.300 1.00 0.00 H new ATOM 0 HD11 ILE A 150 -14.040 -0.413 0.070 1.00 0.00 H new ATOM 0 HD12 ILE A 150 -13.838 -0.667 1.820 1.00 0.00 H new ATOM 0 HD13 ILE A 150 -12.908 0.604 0.992 1.00 0.00 H new ATOM 536 N ASP A 151 -9.613 -3.710 3.157 1.00 0.00 N ATOM 537 CA ASP A 151 -8.921 -4.225 4.332 1.00 0.00 C ATOM 538 C ASP A 151 -7.565 -4.790 3.933 1.00 0.00 C ATOM 539 O ASP A 151 -6.586 -4.658 4.666 1.00 0.00 O ATOM 540 CB ASP A 151 -9.759 -5.300 5.025 1.00 0.00 C ATOM 541 CG ASP A 151 -9.195 -5.690 6.377 1.00 0.00 C ATOM 542 OD1 ASP A 151 -9.966 -5.708 7.359 1.00 0.00 O ATOM 543 OD2 ASP A 151 -7.981 -5.977 6.454 1.00 0.00 O ATOM 0 H ASP A 151 -10.486 -4.189 2.935 1.00 0.00 H new ATOM 0 HA ASP A 151 -8.771 -3.404 5.033 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -10.779 -4.937 5.151 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -9.811 -6.183 4.388 1.00 0.00 H new ATOM 548 N SER A 152 -7.505 -5.402 2.751 1.00 0.00 N ATOM 549 CA SER A 152 -6.254 -5.956 2.255 1.00 0.00 C ATOM 550 C SER A 152 -5.252 -4.825 2.096 1.00 0.00 C ATOM 551 O SER A 152 -4.084 -4.944 2.478 1.00 0.00 O ATOM 552 CB SER A 152 -6.470 -6.666 0.917 1.00 0.00 C ATOM 553 OG SER A 152 -5.411 -7.566 0.638 1.00 0.00 O ATOM 0 H SER A 152 -8.302 -5.524 2.127 1.00 0.00 H new ATOM 0 HA SER A 152 -5.874 -6.691 2.965 1.00 0.00 H new ATOM 0 HB2 SER A 152 -7.415 -7.208 0.938 1.00 0.00 H new ATOM 0 HB3 SER A 152 -6.544 -5.928 0.118 1.00 0.00 H new ATOM 0 HG SER A 152 -5.575 -8.007 -0.221 1.00 0.00 H new ATOM 559 N LEU A 153 -5.736 -3.710 1.560 1.00 0.00 N ATOM 560 CA LEU A 153 -4.906 -2.533 1.382 1.00 0.00 C ATOM 561 C LEU A 153 -4.394 -2.065 2.736 1.00 0.00 C ATOM 562 O LEU A 153 -3.250 -1.634 2.868 1.00 0.00 O ATOM 563 CB LEU A 153 -5.703 -1.415 0.706 1.00 0.00 C ATOM 564 CG LEU A 153 -5.646 -1.409 -0.821 1.00 0.00 C ATOM 565 CD1 LEU A 153 -6.662 -0.433 -1.392 1.00 0.00 C ATOM 566 CD2 LEU A 153 -4.246 -1.058 -1.295 1.00 0.00 C ATOM 0 H LEU A 153 -6.699 -3.600 1.243 1.00 0.00 H new ATOM 0 HA LEU A 153 -4.060 -2.787 0.743 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -6.745 -1.495 1.015 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -5.335 -0.456 1.071 1.00 0.00 H new ATOM 0 HG LEU A 153 -5.894 -2.408 -1.179 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -6.605 -0.444 -2.480 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -7.664 -0.726 -1.078 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -6.446 0.571 -1.028 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -4.220 -1.058 -2.385 1.00 0.00 H new ATOM 0 HD22 LEU A 153 -3.974 -0.069 -0.925 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -3.538 -1.795 -0.916 1.00 0.00 H new ATOM 578 N GLN A 154 -5.258 -2.165 3.743 1.00 0.00 N ATOM 579 CA GLN A 154 -4.914 -1.765 5.100 1.00 0.00 C ATOM 580 C GLN A 154 -3.797 -2.632 5.658 1.00 0.00 C ATOM 581 O GLN A 154 -2.849 -2.130 6.260 1.00 0.00 O ATOM 582 CB GLN A 154 -6.149 -1.869 5.999 1.00 0.00 C ATOM 583 CG GLN A 154 -5.878 -1.536 7.458 1.00 0.00 C ATOM 584 CD GLN A 154 -6.228 -0.104 7.797 1.00 0.00 C ATOM 585 OE1 GLN A 154 -5.989 0.801 6.856 1.00 0.00 O flip ATOM 586 NE2 GLN A 154 -6.708 0.188 8.892 1.00 0.00 N flip ATOM 0 H GLN A 154 -6.208 -2.523 3.641 1.00 0.00 H new ATOM 0 HA GLN A 154 -4.566 -0.732 5.075 1.00 0.00 H new ATOM 0 HB2 GLN A 154 -6.920 -1.198 5.620 1.00 0.00 H new ATOM 0 HB3 GLN A 154 -6.549 -2.881 5.935 1.00 0.00 H new ATOM 0 HG2 GLN A 154 -6.454 -2.208 8.094 1.00 0.00 H new ATOM 0 HG3 GLN A 154 -4.825 -1.712 7.679 1.00 0.00 H new ATOM 0 HE21 GLN A 154 -6.875 -0.540 9.586 1.00 0.00 H new ATOM 0 HE22 GLN A 154 -6.939 1.158 9.105 1.00 0.00 H new ATOM 595 N ARG A 155 -3.916 -3.937 5.456 1.00 0.00 N ATOM 596 CA ARG A 155 -2.910 -4.870 5.942 1.00 0.00 C ATOM 597 C ARG A 155 -1.562 -4.542 5.326 1.00 0.00 C ATOM 598 O ARG A 155 -0.522 -4.612 5.988 1.00 0.00 O ATOM 599 CB ARG A 155 -3.302 -6.311 5.605 1.00 0.00 C ATOM 600 CG ARG A 155 -4.602 -6.757 6.254 1.00 0.00 C ATOM 601 CD ARG A 155 -4.915 -8.212 5.936 1.00 0.00 C ATOM 602 NE ARG A 155 -4.962 -8.461 4.495 1.00 0.00 N ATOM 603 CZ ARG A 155 -3.905 -8.814 3.763 1.00 0.00 C ATOM 604 NH1 ARG A 155 -2.713 -8.965 4.327 1.00 0.00 N ATOM 605 NH2 ARG A 155 -4.043 -9.019 2.461 1.00 0.00 N ATOM 0 H ARG A 155 -4.695 -4.372 4.961 1.00 0.00 H new ATOM 0 HA ARG A 155 -2.843 -4.775 7.026 1.00 0.00 H new ATOM 0 HB2 ARG A 155 -3.393 -6.410 4.523 1.00 0.00 H new ATOM 0 HB3 ARG A 155 -2.501 -6.980 5.920 1.00 0.00 H new ATOM 0 HG2 ARG A 155 -4.534 -6.626 7.334 1.00 0.00 H new ATOM 0 HG3 ARG A 155 -5.419 -6.124 5.907 1.00 0.00 H new ATOM 0 HD2 ARG A 155 -4.159 -8.853 6.390 1.00 0.00 H new ATOM 0 HD3 ARG A 155 -5.872 -8.483 6.382 1.00 0.00 H new ATOM 0 HE ARG A 155 -5.859 -8.358 4.021 1.00 0.00 H new ATOM 0 HH11 ARG A 155 -2.600 -8.811 5.329 1.00 0.00 H new ATOM 0 HH12 ARG A 155 -1.910 -9.235 3.759 1.00 0.00 H new ATOM 0 HH21 ARG A 155 -4.956 -8.907 2.021 1.00 0.00 H new ATOM 0 HH22 ARG A 155 -3.236 -9.289 1.899 1.00 0.00 H new ATOM 619 N GLN A 156 -1.587 -4.161 4.055 1.00 0.00 N ATOM 620 CA GLN A 156 -0.368 -3.802 3.350 1.00 0.00 C ATOM 621 C GLN A 156 0.210 -2.508 3.901 1.00 0.00 C ATOM 622 O GLN A 156 1.416 -2.397 4.099 1.00 0.00 O ATOM 623 CB GLN A 156 -0.644 -3.654 1.852 1.00 0.00 C ATOM 624 CG GLN A 156 -0.885 -4.978 1.144 1.00 0.00 C ATOM 625 CD GLN A 156 -0.896 -4.837 -0.365 1.00 0.00 C ATOM 626 OE1 GLN A 156 -1.578 -3.809 -0.859 1.00 0.00 O flip ATOM 627 NE2 GLN A 156 -0.298 -5.640 -1.080 1.00 0.00 N flip ATOM 0 H GLN A 156 -2.437 -4.093 3.495 1.00 0.00 H new ATOM 0 HA GLN A 156 0.360 -4.600 3.500 1.00 0.00 H new ATOM 0 HB2 GLN A 156 -1.515 -3.013 1.713 1.00 0.00 H new ATOM 0 HB3 GLN A 156 0.201 -3.149 1.383 1.00 0.00 H new ATOM 0 HG2 GLN A 156 -0.110 -5.687 1.434 1.00 0.00 H new ATOM 0 HG3 GLN A 156 -1.837 -5.394 1.474 1.00 0.00 H new ATOM 0 HE21 GLN A 156 0.214 -6.415 -0.659 1.00 0.00 H new ATOM 0 HE22 GLN A 156 -0.314 -5.530 -2.094 1.00 0.00 H new ATOM 636 N ILE A 157 -0.657 -1.533 4.155 1.00 0.00 N ATOM 637 CA ILE A 157 -0.216 -0.248 4.687 1.00 0.00 C ATOM 638 C ILE A 157 0.457 -0.422 6.040 1.00 0.00 C ATOM 639 O ILE A 157 1.563 0.069 6.262 1.00 0.00 O ATOM 640 CB ILE A 157 -1.395 0.738 4.827 1.00 0.00 C ATOM 641 CG1 ILE A 157 -2.053 0.970 3.468 1.00 0.00 C ATOM 642 CG2 ILE A 157 -0.922 2.059 5.421 1.00 0.00 C ATOM 643 CD1 ILE A 157 -3.550 1.174 3.546 1.00 0.00 C ATOM 0 H ILE A 157 -1.663 -1.607 4.002 1.00 0.00 H new ATOM 0 HA ILE A 157 0.503 0.162 3.978 1.00 0.00 H new ATOM 0 HB ILE A 157 -2.132 0.303 5.503 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -1.600 1.843 2.999 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -1.844 0.117 2.822 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -1.768 2.741 5.512 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -0.492 1.881 6.407 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -0.168 2.501 4.770 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -3.948 1.333 2.544 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -4.015 0.292 3.986 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -3.767 2.045 4.165 1.00 0.00 H new ATOM 655 N ASN A 158 -0.213 -1.127 6.940 1.00 0.00 N ATOM 656 CA ASN A 158 0.328 -1.369 8.272 1.00 0.00 C ATOM 657 C ASN A 158 1.662 -2.101 8.189 1.00 0.00 C ATOM 658 O ASN A 158 2.592 -1.818 8.951 1.00 0.00 O ATOM 659 CB ASN A 158 -0.664 -2.181 9.107 1.00 0.00 C ATOM 660 CG ASN A 158 -1.901 -1.384 9.474 1.00 0.00 C ATOM 661 OD1 ASN A 158 -3.071 -1.954 9.212 1.00 0.00 O flip ATOM 662 ND2 ASN A 158 -1.806 -0.268 9.985 1.00 0.00 N flip ATOM 0 H ASN A 158 -1.130 -1.541 6.774 1.00 0.00 H new ATOM 0 HA ASN A 158 0.492 -0.405 8.754 1.00 0.00 H new ATOM 0 HB2 ASN A 158 -0.960 -3.070 8.551 1.00 0.00 H new ATOM 0 HB3 ASN A 158 -0.173 -2.524 10.018 1.00 0.00 H new ATOM 0 HD21 ASN A 158 -0.886 0.132 10.169 1.00 0.00 H new ATOM 0 HD22 ASN A 158 -2.647 0.257 10.224 1.00 0.00 H new ATOM 669 N ARG A 159 1.757 -3.037 7.250 1.00 0.00 N ATOM 670 CA ARG A 159 2.982 -3.802 7.063 1.00 0.00 C ATOM 671 C ARG A 159 4.126 -2.892 6.633 1.00 0.00 C ATOM 672 O ARG A 159 5.265 -3.055 7.070 1.00 0.00 O ATOM 673 CB ARG A 159 2.771 -4.899 6.018 1.00 0.00 C ATOM 674 CG ARG A 159 3.871 -5.947 6.007 1.00 0.00 C ATOM 675 CD ARG A 159 3.442 -7.214 6.727 1.00 0.00 C ATOM 676 NE ARG A 159 2.621 -8.075 5.877 1.00 0.00 N ATOM 677 CZ ARG A 159 3.114 -8.848 4.912 1.00 0.00 C ATOM 678 NH1 ARG A 159 4.419 -8.873 4.672 1.00 0.00 N ATOM 679 NH2 ARG A 159 2.299 -9.599 4.185 1.00 0.00 N ATOM 0 H ARG A 159 1.002 -3.283 6.609 1.00 0.00 H new ATOM 0 HA ARG A 159 3.242 -4.263 8.016 1.00 0.00 H new ATOM 0 HB2 ARG A 159 1.816 -5.389 6.205 1.00 0.00 H new ATOM 0 HB3 ARG A 159 2.706 -4.441 5.031 1.00 0.00 H new ATOM 0 HG2 ARG A 159 4.137 -6.185 4.977 1.00 0.00 H new ATOM 0 HG3 ARG A 159 4.765 -5.542 6.482 1.00 0.00 H new ATOM 0 HD2 ARG A 159 4.326 -7.763 7.053 1.00 0.00 H new ATOM 0 HD3 ARG A 159 2.882 -6.950 7.624 1.00 0.00 H new ATOM 0 HE ARG A 159 1.613 -8.084 6.032 1.00 0.00 H new ATOM 0 HH11 ARG A 159 5.051 -8.298 5.229 1.00 0.00 H new ATOM 0 HH12 ARG A 159 4.790 -9.468 3.931 1.00 0.00 H new ATOM 0 HH21 ARG A 159 1.295 -9.584 4.365 1.00 0.00 H new ATOM 0 HH22 ARG A 159 2.676 -10.192 3.445 1.00 0.00 H new ATOM 693 N VAL A 160 3.821 -1.937 5.768 1.00 0.00 N ATOM 694 CA VAL A 160 4.831 -1.008 5.278 1.00 0.00 C ATOM 695 C VAL A 160 5.290 -0.062 6.371 1.00 0.00 C ATOM 696 O VAL A 160 6.467 0.286 6.452 1.00 0.00 O ATOM 697 CB VAL A 160 4.325 -0.169 4.088 1.00 0.00 C ATOM 698 CG1 VAL A 160 5.490 0.438 3.323 1.00 0.00 C ATOM 699 CG2 VAL A 160 3.452 -1.002 3.169 1.00 0.00 C ATOM 0 H VAL A 160 2.886 -1.784 5.391 1.00 0.00 H new ATOM 0 HA VAL A 160 5.667 -1.625 4.947 1.00 0.00 H new ATOM 0 HB VAL A 160 3.717 0.645 4.483 1.00 0.00 H new ATOM 0 HG11 VAL A 160 5.110 1.026 2.488 1.00 0.00 H new ATOM 0 HG12 VAL A 160 6.066 1.082 3.988 1.00 0.00 H new ATOM 0 HG13 VAL A 160 6.131 -0.358 2.944 1.00 0.00 H new ATOM 0 HG21 VAL A 160 3.108 -0.387 2.338 1.00 0.00 H new ATOM 0 HG22 VAL A 160 4.028 -1.843 2.784 1.00 0.00 H new ATOM 0 HG23 VAL A 160 2.592 -1.375 3.724 1.00 0.00 H new ATOM 709 N GLU A 161 4.362 0.356 7.210 1.00 0.00 N ATOM 710 CA GLU A 161 4.686 1.268 8.294 1.00 0.00 C ATOM 711 C GLU A 161 5.645 0.619 9.285 1.00 0.00 C ATOM 712 O GLU A 161 6.586 1.257 9.757 1.00 0.00 O ATOM 713 CB GLU A 161 3.412 1.710 9.017 1.00 0.00 C ATOM 714 CG GLU A 161 3.438 3.164 9.459 1.00 0.00 C ATOM 715 CD GLU A 161 2.396 3.470 10.518 1.00 0.00 C ATOM 716 OE1 GLU A 161 2.782 3.682 11.686 1.00 0.00 O ATOM 717 OE2 GLU A 161 1.195 3.495 10.178 1.00 0.00 O ATOM 0 H GLU A 161 3.381 0.081 7.164 1.00 0.00 H new ATOM 0 HA GLU A 161 5.174 2.142 7.863 1.00 0.00 H new ATOM 0 HB2 GLU A 161 2.558 1.554 8.358 1.00 0.00 H new ATOM 0 HB3 GLU A 161 3.261 1.076 9.891 1.00 0.00 H new ATOM 0 HG2 GLU A 161 4.428 3.404 9.848 1.00 0.00 H new ATOM 0 HG3 GLU A 161 3.271 3.806 8.594 1.00 0.00 H new ATOM 724 N LYS A 162 5.387 -0.641 9.621 1.00 0.00 N ATOM 725 CA LYS A 162 6.221 -1.351 10.585 1.00 0.00 C ATOM 726 C LYS A 162 7.449 -2.005 9.952 1.00 0.00 C ATOM 727 O LYS A 162 8.524 -2.012 10.551 1.00 0.00 O ATOM 728 CB LYS A 162 5.394 -2.415 11.312 1.00 0.00 C ATOM 729 CG LYS A 162 4.032 -1.922 11.769 1.00 0.00 C ATOM 730 CD LYS A 162 3.148 -3.073 12.224 1.00 0.00 C ATOM 731 CE LYS A 162 3.553 -3.582 13.599 1.00 0.00 C ATOM 732 NZ LYS A 162 2.391 -3.660 14.526 1.00 0.00 N ATOM 0 H LYS A 162 4.613 -1.188 9.244 1.00 0.00 H new ATOM 0 HA LYS A 162 6.583 -0.603 11.290 1.00 0.00 H new ATOM 0 HB2 LYS A 162 5.258 -3.271 10.651 1.00 0.00 H new ATOM 0 HB3 LYS A 162 5.953 -2.767 12.179 1.00 0.00 H new ATOM 0 HG2 LYS A 162 4.156 -1.212 12.586 1.00 0.00 H new ATOM 0 HG3 LYS A 162 3.545 -1.388 10.954 1.00 0.00 H new ATOM 0 HD2 LYS A 162 2.108 -2.746 12.248 1.00 0.00 H new ATOM 0 HD3 LYS A 162 3.209 -3.887 11.502 1.00 0.00 H new ATOM 0 HE2 LYS A 162 4.007 -4.568 13.502 1.00 0.00 H new ATOM 0 HE3 LYS A 162 4.311 -2.922 14.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 2.709 -4.011 15.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 1.973 -2.714 14.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 1.678 -4.309 14.136 1.00 0.00 H new ATOM 746 N PHE A 163 7.290 -2.593 8.770 1.00 0.00 N ATOM 747 CA PHE A 163 8.411 -3.285 8.127 1.00 0.00 C ATOM 748 C PHE A 163 8.759 -2.709 6.759 1.00 0.00 C ATOM 749 O PHE A 163 9.863 -2.925 6.257 1.00 0.00 O ATOM 750 CB PHE A 163 8.093 -4.777 7.994 1.00 0.00 C ATOM 751 CG PHE A 163 7.310 -5.331 9.151 1.00 0.00 C ATOM 752 CD1 PHE A 163 7.959 -5.841 10.263 1.00 0.00 C ATOM 753 CD2 PHE A 163 5.924 -5.334 9.128 1.00 0.00 C ATOM 754 CE1 PHE A 163 7.240 -6.345 11.332 1.00 0.00 C ATOM 755 CE2 PHE A 163 5.200 -5.837 10.191 1.00 0.00 C ATOM 756 CZ PHE A 163 5.859 -6.343 11.295 1.00 0.00 C ATOM 0 H PHE A 163 6.416 -2.607 8.244 1.00 0.00 H new ATOM 0 HA PHE A 163 9.282 -3.139 8.766 1.00 0.00 H new ATOM 0 HB2 PHE A 163 7.531 -4.939 7.075 1.00 0.00 H new ATOM 0 HB3 PHE A 163 9.026 -5.332 7.899 1.00 0.00 H new ATOM 0 HD1 PHE A 163 9.038 -5.845 10.296 1.00 0.00 H new ATOM 0 HD2 PHE A 163 5.404 -4.938 8.268 1.00 0.00 H new ATOM 0 HE1 PHE A 163 7.757 -6.739 12.194 1.00 0.00 H new ATOM 0 HE2 PHE A 163 4.120 -5.835 10.159 1.00 0.00 H new ATOM 0 HZ PHE A 163 5.295 -6.736 12.128 1.00 0.00 H new ATOM 766 N GLY A 164 7.831 -1.982 6.155 1.00 0.00 N ATOM 767 CA GLY A 164 8.099 -1.406 4.849 1.00 0.00 C ATOM 768 C GLY A 164 7.606 -2.283 3.716 1.00 0.00 C ATOM 769 O GLY A 164 6.913 -3.273 3.946 1.00 0.00 O ATOM 0 H GLY A 164 6.907 -1.781 6.538 1.00 0.00 H new ATOM 0 HA2 GLY A 164 7.622 -0.428 4.782 1.00 0.00 H new ATOM 0 HA3 GLY A 164 9.171 -1.245 4.740 1.00 0.00 H new ATOM 773 N VAL A 165 7.956 -1.913 2.491 1.00 0.00 N ATOM 774 CA VAL A 165 7.537 -2.670 1.319 1.00 0.00 C ATOM 775 C VAL A 165 8.435 -3.882 1.093 1.00 0.00 C ATOM 776 O VAL A 165 9.658 -3.788 1.195 1.00 0.00 O ATOM 777 CB VAL A 165 7.546 -1.791 0.056 1.00 0.00 C ATOM 778 CG1 VAL A 165 6.915 -2.528 -1.115 1.00 0.00 C ATOM 779 CG2 VAL A 165 6.827 -0.477 0.322 1.00 0.00 C ATOM 0 H VAL A 165 8.528 -1.095 2.283 1.00 0.00 H new ATOM 0 HA VAL A 165 6.519 -3.012 1.509 1.00 0.00 H new ATOM 0 HB VAL A 165 8.581 -1.569 -0.205 1.00 0.00 H new ATOM 0 HG11 VAL A 165 6.931 -1.889 -1.998 1.00 0.00 H new ATOM 0 HG12 VAL A 165 7.477 -3.440 -1.316 1.00 0.00 H new ATOM 0 HG13 VAL A 165 5.884 -2.784 -0.871 1.00 0.00 H new ATOM 0 HG21 VAL A 165 6.841 0.135 -0.580 1.00 0.00 H new ATOM 0 HG22 VAL A 165 5.795 -0.679 0.608 1.00 0.00 H new ATOM 0 HG23 VAL A 165 7.329 0.056 1.129 1.00 0.00 H new ATOM 789 N ASP A 166 7.818 -5.018 0.786 1.00 0.00 N ATOM 790 CA ASP A 166 8.559 -6.250 0.545 1.00 0.00 C ATOM 791 C ASP A 166 8.891 -6.403 -0.936 1.00 0.00 C ATOM 792 O ASP A 166 8.005 -6.357 -1.787 1.00 0.00 O ATOM 793 CB ASP A 166 7.756 -7.458 1.031 1.00 0.00 C ATOM 794 CG ASP A 166 8.121 -7.863 2.445 1.00 0.00 C ATOM 795 OD1 ASP A 166 9.263 -8.321 2.655 1.00 0.00 O ATOM 796 OD2 ASP A 166 7.265 -7.723 3.344 1.00 0.00 O ATOM 0 H ASP A 166 6.806 -5.111 0.698 1.00 0.00 H new ATOM 0 HA ASP A 166 9.493 -6.199 1.104 1.00 0.00 H new ATOM 0 HB2 ASP A 166 6.692 -7.226 0.986 1.00 0.00 H new ATOM 0 HB3 ASP A 166 7.928 -8.299 0.359 1.00 0.00 H new ATOM 801 N LEU A 167 10.174 -6.575 -1.235 1.00 0.00 N ATOM 802 CA LEU A 167 10.627 -6.723 -2.614 1.00 0.00 C ATOM 803 C LEU A 167 9.927 -7.887 -3.312 1.00 0.00 C ATOM 804 O LEU A 167 9.873 -7.939 -4.541 1.00 0.00 O ATOM 805 CB LEU A 167 12.143 -6.928 -2.652 1.00 0.00 C ATOM 806 CG LEU A 167 12.959 -5.878 -1.894 1.00 0.00 C ATOM 807 CD1 LEU A 167 14.248 -6.487 -1.363 1.00 0.00 C ATOM 808 CD2 LEU A 167 13.258 -4.688 -2.794 1.00 0.00 C ATOM 0 H LEU A 167 10.920 -6.615 -0.540 1.00 0.00 H new ATOM 0 HA LEU A 167 10.371 -5.808 -3.148 1.00 0.00 H new ATOM 0 HB2 LEU A 167 12.372 -7.911 -2.240 1.00 0.00 H new ATOM 0 HB3 LEU A 167 12.467 -6.936 -3.693 1.00 0.00 H new ATOM 0 HG LEU A 167 12.371 -5.528 -1.045 1.00 0.00 H new ATOM 0 HD11 LEU A 167 14.816 -5.727 -0.827 1.00 0.00 H new ATOM 0 HD12 LEU A 167 14.011 -7.308 -0.686 1.00 0.00 H new ATOM 0 HD13 LEU A 167 14.842 -6.864 -2.195 1.00 0.00 H new ATOM 0 HD21 LEU A 167 13.839 -3.950 -2.241 1.00 0.00 H new ATOM 0 HD22 LEU A 167 13.828 -5.022 -3.661 1.00 0.00 H new ATOM 0 HD23 LEU A 167 12.322 -4.238 -3.126 1.00 0.00 H new ATOM 820 N ASN A 168 9.393 -8.819 -2.531 1.00 0.00 N ATOM 821 CA ASN A 168 8.702 -9.973 -3.093 1.00 0.00 C ATOM 822 C ASN A 168 7.232 -9.986 -2.681 1.00 0.00 C ATOM 823 O ASN A 168 6.711 -11.012 -2.242 1.00 0.00 O ATOM 824 CB ASN A 168 9.385 -11.270 -2.648 1.00 0.00 C ATOM 825 CG ASN A 168 9.350 -11.461 -1.144 1.00 0.00 C ATOM 826 OD1 ASN A 168 9.917 -10.667 -0.392 1.00 0.00 O ATOM 827 ND2 ASN A 168 8.683 -12.519 -0.698 1.00 0.00 N ATOM 0 H ASN A 168 9.425 -8.799 -1.512 1.00 0.00 H new ATOM 0 HA ASN A 168 8.751 -9.900 -4.179 1.00 0.00 H new ATOM 0 HB2 ASN A 168 8.897 -12.117 -3.130 1.00 0.00 H new ATOM 0 HB3 ASN A 168 10.421 -11.265 -2.986 1.00 0.00 H new ATOM 0 HD21 ASN A 168 8.625 -12.700 0.304 1.00 0.00 H new ATOM 0 HD22 ASN A 168 8.228 -13.150 -1.358 1.00 0.00 H new ATOM 834 N SER A 169 6.562 -8.845 -2.833 1.00 0.00 N ATOM 835 CA SER A 169 5.150 -8.735 -2.480 1.00 0.00 C ATOM 836 C SER A 169 4.339 -8.151 -3.636 1.00 0.00 C ATOM 837 O SER A 169 4.887 -7.493 -4.529 1.00 0.00 O ATOM 838 CB SER A 169 4.981 -7.862 -1.236 1.00 0.00 C ATOM 839 OG SER A 169 5.017 -6.485 -1.569 1.00 0.00 O ATOM 0 H SER A 169 6.974 -7.986 -3.197 1.00 0.00 H new ATOM 0 HA SER A 169 4.778 -9.737 -2.269 1.00 0.00 H new ATOM 0 HB2 SER A 169 4.034 -8.097 -0.749 1.00 0.00 H new ATOM 0 HB3 SER A 169 5.772 -8.087 -0.520 1.00 0.00 H new ATOM 0 HG SER A 169 5.947 -6.203 -1.694 1.00 0.00 H new ATOM 845 N LYS A 170 3.027 -8.379 -3.608 1.00 0.00 N ATOM 846 CA LYS A 170 2.141 -7.865 -4.644 1.00 0.00 C ATOM 847 C LYS A 170 2.152 -6.341 -4.651 1.00 0.00 C ATOM 848 O LYS A 170 1.978 -5.710 -5.692 1.00 0.00 O ATOM 849 CB LYS A 170 0.715 -8.373 -4.423 1.00 0.00 C ATOM 850 CG LYS A 170 0.642 -9.849 -4.063 1.00 0.00 C ATOM 851 CD LYS A 170 0.468 -10.054 -2.566 1.00 0.00 C ATOM 852 CE LYS A 170 1.549 -10.960 -1.996 1.00 0.00 C ATOM 853 NZ LYS A 170 1.958 -10.542 -0.627 1.00 0.00 N ATOM 0 H LYS A 170 2.557 -8.916 -2.879 1.00 0.00 H new ATOM 0 HA LYS A 170 2.500 -8.222 -5.609 1.00 0.00 H new ATOM 0 HB2 LYS A 170 0.250 -7.790 -3.628 1.00 0.00 H new ATOM 0 HB3 LYS A 170 0.132 -8.199 -5.328 1.00 0.00 H new ATOM 0 HG2 LYS A 170 -0.190 -10.312 -4.593 1.00 0.00 H new ATOM 0 HG3 LYS A 170 1.551 -10.350 -4.396 1.00 0.00 H new ATOM 0 HD2 LYS A 170 0.497 -9.089 -2.060 1.00 0.00 H new ATOM 0 HD3 LYS A 170 -0.512 -10.488 -2.369 1.00 0.00 H new ATOM 0 HE2 LYS A 170 1.185 -11.987 -1.968 1.00 0.00 H new ATOM 0 HE3 LYS A 170 2.418 -10.947 -2.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 170 2.696 -11.184 -0.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 170 2.329 -9.571 -0.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 170 1.135 -10.578 0.008 1.00 0.00 H new ATOM 867 N LEU A 171 2.358 -5.759 -3.474 1.00 0.00 N ATOM 868 CA LEU A 171 2.394 -4.311 -3.325 1.00 0.00 C ATOM 869 C LEU A 171 3.625 -3.724 -4.004 1.00 0.00 C ATOM 870 O LEU A 171 3.534 -2.731 -4.726 1.00 0.00 O ATOM 871 CB LEU A 171 2.392 -3.941 -1.843 1.00 0.00 C ATOM 872 CG LEU A 171 2.181 -2.459 -1.541 1.00 0.00 C ATOM 873 CD1 LEU A 171 0.707 -2.102 -1.633 1.00 0.00 C ATOM 874 CD2 LEU A 171 2.731 -2.121 -0.164 1.00 0.00 C ATOM 0 H LEU A 171 2.503 -6.273 -2.605 1.00 0.00 H new ATOM 0 HA LEU A 171 1.507 -3.895 -3.804 1.00 0.00 H new ATOM 0 HB2 LEU A 171 1.609 -4.512 -1.344 1.00 0.00 H new ATOM 0 HB3 LEU A 171 3.341 -4.252 -1.406 1.00 0.00 H new ATOM 0 HG LEU A 171 2.720 -1.870 -2.283 1.00 0.00 H new ATOM 0 HD11 LEU A 171 0.575 -1.042 -1.415 1.00 0.00 H new ATOM 0 HD12 LEU A 171 0.343 -2.313 -2.639 1.00 0.00 H new ATOM 0 HD13 LEU A 171 0.144 -2.694 -0.912 1.00 0.00 H new ATOM 0 HD21 LEU A 171 2.575 -1.062 0.040 1.00 0.00 H new ATOM 0 HD22 LEU A 171 2.215 -2.716 0.590 1.00 0.00 H new ATOM 0 HD23 LEU A 171 3.798 -2.343 -0.134 1.00 0.00 H new ATOM 886 N ALA A 172 4.778 -4.340 -3.764 1.00 0.00 N ATOM 887 CA ALA A 172 6.024 -3.874 -4.351 1.00 0.00 C ATOM 888 C ALA A 172 5.982 -3.967 -5.868 1.00 0.00 C ATOM 889 O ALA A 172 6.442 -3.062 -6.564 1.00 0.00 O ATOM 890 CB ALA A 172 7.195 -4.672 -3.799 1.00 0.00 C ATOM 0 H ALA A 172 4.873 -5.162 -3.167 1.00 0.00 H new ATOM 0 HA ALA A 172 6.156 -2.826 -4.084 1.00 0.00 H new ATOM 0 HB1 ALA A 172 8.122 -4.314 -4.246 1.00 0.00 H new ATOM 0 HB2 ALA A 172 7.242 -4.548 -2.717 1.00 0.00 H new ATOM 0 HB3 ALA A 172 7.061 -5.727 -4.038 1.00 0.00 H new ATOM 896 N GLU A 173 5.405 -5.050 -6.386 1.00 0.00 N ATOM 897 CA GLU A 173 5.288 -5.214 -7.829 1.00 0.00 C ATOM 898 C GLU A 173 4.341 -4.164 -8.404 1.00 0.00 C ATOM 899 O GLU A 173 4.622 -3.553 -9.435 1.00 0.00 O ATOM 900 CB GLU A 173 4.804 -6.621 -8.185 1.00 0.00 C ATOM 901 CG GLU A 173 3.481 -6.993 -7.544 1.00 0.00 C ATOM 902 CD GLU A 173 2.936 -8.312 -8.054 1.00 0.00 C ATOM 903 OE1 GLU A 173 3.249 -9.358 -7.448 1.00 0.00 O ATOM 904 OE2 GLU A 173 2.197 -8.298 -9.062 1.00 0.00 O ATOM 0 H GLU A 173 5.017 -5.816 -5.835 1.00 0.00 H new ATOM 0 HA GLU A 173 6.276 -5.076 -8.268 1.00 0.00 H new ATOM 0 HB2 GLU A 173 4.707 -6.699 -9.268 1.00 0.00 H new ATOM 0 HB3 GLU A 173 5.561 -7.344 -7.880 1.00 0.00 H new ATOM 0 HG2 GLU A 173 3.609 -7.051 -6.463 1.00 0.00 H new ATOM 0 HG3 GLU A 173 2.754 -6.205 -7.737 1.00 0.00 H new ATOM 911 N GLU A 174 3.219 -3.956 -7.718 1.00 0.00 N ATOM 912 CA GLU A 174 2.226 -2.974 -8.144 1.00 0.00 C ATOM 913 C GLU A 174 2.805 -1.566 -8.044 1.00 0.00 C ATOM 914 O GLU A 174 2.491 -0.691 -8.852 1.00 0.00 O ATOM 915 CB GLU A 174 0.950 -3.108 -7.297 1.00 0.00 C ATOM 916 CG GLU A 174 0.449 -1.803 -6.689 1.00 0.00 C ATOM 917 CD GLU A 174 -0.907 -1.951 -6.027 1.00 0.00 C ATOM 918 OE1 GLU A 174 -0.945 -2.273 -4.820 1.00 0.00 O ATOM 919 OE2 GLU A 174 -1.930 -1.745 -6.713 1.00 0.00 O ATOM 0 H GLU A 174 2.975 -4.456 -6.863 1.00 0.00 H new ATOM 0 HA GLU A 174 1.963 -3.161 -9.185 1.00 0.00 H new ATOM 0 HB2 GLU A 174 0.160 -3.530 -7.919 1.00 0.00 H new ATOM 0 HB3 GLU A 174 1.137 -3.819 -6.493 1.00 0.00 H new ATOM 0 HG2 GLU A 174 1.171 -1.448 -5.954 1.00 0.00 H new ATOM 0 HG3 GLU A 174 0.388 -1.043 -7.468 1.00 0.00 H new ATOM 926 N LEU A 175 3.658 -1.362 -7.047 1.00 0.00 N ATOM 927 CA LEU A 175 4.295 -0.073 -6.832 1.00 0.00 C ATOM 928 C LEU A 175 5.406 0.158 -7.851 1.00 0.00 C ATOM 929 O LEU A 175 5.968 1.251 -7.932 1.00 0.00 O ATOM 930 CB LEU A 175 4.865 -0.008 -5.413 1.00 0.00 C ATOM 931 CG LEU A 175 4.064 0.849 -4.434 1.00 0.00 C ATOM 932 CD1 LEU A 175 4.096 0.237 -3.043 1.00 0.00 C ATOM 933 CD2 LEU A 175 4.604 2.270 -4.404 1.00 0.00 C ATOM 0 H LEU A 175 3.924 -2.079 -6.372 1.00 0.00 H new ATOM 0 HA LEU A 175 3.547 0.709 -6.957 1.00 0.00 H new ATOM 0 HB2 LEU A 175 4.929 -1.021 -5.017 1.00 0.00 H new ATOM 0 HB3 LEU A 175 5.882 0.380 -5.464 1.00 0.00 H new ATOM 0 HG LEU A 175 3.028 0.882 -4.772 1.00 0.00 H new ATOM 0 HD11 LEU A 175 3.521 0.860 -2.358 1.00 0.00 H new ATOM 0 HD12 LEU A 175 3.663 -0.763 -3.075 1.00 0.00 H new ATOM 0 HD13 LEU A 175 5.128 0.174 -2.697 1.00 0.00 H new ATOM 0 HD21 LEU A 175 4.021 2.866 -3.701 1.00 0.00 H new ATOM 0 HD22 LEU A 175 5.648 2.256 -4.090 1.00 0.00 H new ATOM 0 HD23 LEU A 175 4.531 2.708 -5.399 1.00 0.00 H new