USER MOD reduce.3.24.130724 H: found=0, std=0, add=304, rem=0, adj=4 USER MOD reduce.3.24.130724 removed 245 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 133 ASN :FLIP amide:sc= -0.32 F(o=-1.9,f=-0.32) USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= -0.0519 K(o=-0.052,f=-0.56) USER MOD Single : A 142 GLN : amide:sc= -0.148 K(o=-0.15,f=-1.2) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 LYS NZ :NH3+ -147:sc= 0.452 (180deg=0.0914) USER MOD Single : A 148 THR OG1 : rot 180:sc= -1.2 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 163 ASN : amide:sc= -0.103 K(o=-0.1,f=-2!) USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 SER OG : rot 156:sc= -0.3 USER MOD ----------------------------------------------------------------- ATOM 19 N VAL A 132 -23.265 -1.909 1.595 1.00 0.00 N ATOM 20 CA VAL A 132 -22.728 -0.576 1.803 1.00 0.00 C ATOM 21 C VAL A 132 -21.775 -0.596 3.000 1.00 0.00 C ATOM 22 O VAL A 132 -20.592 -0.285 2.862 1.00 0.00 O ATOM 23 CB VAL A 132 -23.871 0.428 1.967 1.00 0.00 C ATOM 24 CG1 VAL A 132 -23.344 1.789 2.424 1.00 0.00 C ATOM 25 CG2 VAL A 132 -24.676 0.558 0.672 1.00 0.00 C ATOM 0 HA VAL A 132 -22.153 -0.256 0.934 1.00 0.00 H new ATOM 0 HB VAL A 132 -24.540 0.051 2.741 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -24.177 2.484 2.533 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -22.835 1.679 3.382 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -22.644 2.175 1.684 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -25.482 1.277 0.815 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -24.022 0.901 -0.130 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -25.098 -0.411 0.407 1.00 0.00 H new ATOM 35 N ASN A 133 -22.324 -0.965 4.148 1.00 0.00 N ATOM 36 CA ASN A 133 -21.538 -1.030 5.368 1.00 0.00 C ATOM 37 C ASN A 133 -20.119 -1.492 5.031 1.00 0.00 C ATOM 38 O ASN A 133 -19.150 -1.022 5.626 1.00 0.00 O ATOM 39 CB ASN A 133 -22.138 -2.029 6.358 1.00 0.00 C ATOM 40 CG ASN A 133 -23.071 -3.011 5.648 1.00 0.00 C ATOM 41 OD1 ASN A 133 -22.439 -3.943 4.940 1.00 0.00 O flip ATOM 42 ND2 ASN A 133 -24.286 -2.930 5.737 1.00 0.00 N flip ATOM 0 H ASN A 133 -23.305 -1.222 4.259 1.00 0.00 H new ATOM 0 HA ASN A 133 -21.532 -0.037 5.818 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -21.339 -2.577 6.857 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -22.688 -1.494 7.132 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -24.708 -2.190 6.298 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -24.879 -3.603 5.251 1.00 0.00 H new ATOM 48 N MET A 134 -20.041 -2.409 4.077 1.00 0.00 N ATOM 49 CA MET A 134 -18.757 -2.940 3.653 1.00 0.00 C ATOM 50 C MET A 134 -17.993 -1.921 2.807 1.00 0.00 C ATOM 51 O MET A 134 -16.845 -1.596 3.105 1.00 0.00 O ATOM 52 CB MET A 134 -18.976 -4.217 2.840 1.00 0.00 C ATOM 53 CG MET A 134 -19.390 -5.381 3.745 1.00 0.00 C ATOM 54 SD MET A 134 -17.972 -6.401 4.114 1.00 0.00 S ATOM 55 CE MET A 134 -18.785 -7.803 4.862 1.00 0.00 C ATOM 0 H MET A 134 -20.846 -2.797 3.586 1.00 0.00 H new ATOM 0 HA MET A 134 -18.166 -3.161 4.542 1.00 0.00 H new ATOM 0 HB2 MET A 134 -19.746 -4.045 2.087 1.00 0.00 H new ATOM 0 HB3 MET A 134 -18.061 -4.474 2.307 1.00 0.00 H new ATOM 0 HG2 MET A 134 -19.823 -4.998 4.669 1.00 0.00 H new ATOM 0 HG3 MET A 134 -20.160 -5.977 3.255 1.00 0.00 H new ATOM 0 HE1 MET A 134 -18.040 -8.543 5.154 1.00 0.00 H new ATOM 0 HE2 MET A 134 -19.337 -7.476 5.743 1.00 0.00 H new ATOM 0 HE3 MET A 134 -19.476 -8.248 4.146 1.00 0.00 H new ATOM 63 N ASP A 135 -18.662 -1.444 1.767 1.00 0.00 N ATOM 64 CA ASP A 135 -18.061 -0.467 0.874 1.00 0.00 C ATOM 65 C ASP A 135 -17.454 0.668 1.702 1.00 0.00 C ATOM 66 O ASP A 135 -16.367 1.154 1.393 1.00 0.00 O ATOM 67 CB ASP A 135 -19.107 0.139 -0.064 1.00 0.00 C ATOM 68 CG ASP A 135 -18.546 0.741 -1.353 1.00 0.00 C ATOM 69 OD1 ASP A 135 -17.916 -0.027 -2.112 1.00 0.00 O ATOM 70 OD2 ASP A 135 -18.760 1.957 -1.552 1.00 0.00 O ATOM 0 H ASP A 135 -19.614 -1.716 1.523 1.00 0.00 H new ATOM 0 HA ASP A 135 -17.298 -0.974 0.283 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -19.830 -0.634 -0.326 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -19.651 0.915 0.475 1.00 0.00 H new ATOM 74 N LEU A 136 -18.181 1.057 2.738 1.00 0.00 N ATOM 75 CA LEU A 136 -17.729 2.125 3.613 1.00 0.00 C ATOM 76 C LEU A 136 -16.485 1.662 4.375 1.00 0.00 C ATOM 77 O LEU A 136 -15.457 2.336 4.360 1.00 0.00 O ATOM 78 CB LEU A 136 -18.867 2.594 4.520 1.00 0.00 C ATOM 79 CG LEU A 136 -18.473 3.540 5.656 1.00 0.00 C ATOM 80 CD1 LEU A 136 -19.315 4.818 5.623 1.00 0.00 C ATOM 81 CD2 LEU A 136 -18.557 2.834 7.011 1.00 0.00 C ATOM 0 H LEU A 136 -19.082 0.651 2.992 1.00 0.00 H new ATOM 0 HA LEU A 136 -17.439 2.998 3.029 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -19.615 3.091 3.903 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -19.344 1.716 4.954 1.00 0.00 H new ATOM 0 HG LEU A 136 -17.434 3.835 5.510 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -19.015 5.473 6.441 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -19.162 5.330 4.673 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -20.369 4.562 5.731 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -18.272 3.528 7.801 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -19.578 2.491 7.180 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -17.881 1.979 7.018 1.00 0.00 H new ATOM 92 N ARG A 137 -16.622 0.514 5.023 1.00 0.00 N ATOM 93 CA ARG A 137 -15.523 -0.047 5.790 1.00 0.00 C ATOM 94 C ARG A 137 -14.216 0.061 5.002 1.00 0.00 C ATOM 95 O ARG A 137 -13.307 0.791 5.396 1.00 0.00 O ATOM 96 CB ARG A 137 -15.783 -1.515 6.132 1.00 0.00 C ATOM 97 CG ARG A 137 -17.020 -1.659 7.023 1.00 0.00 C ATOM 98 CD ARG A 137 -16.633 -2.125 8.428 1.00 0.00 C ATOM 99 NE ARG A 137 -17.849 -2.434 9.212 1.00 0.00 N ATOM 100 CZ ARG A 137 -17.868 -3.235 10.286 1.00 0.00 C ATOM 101 NH1 ARG A 137 -16.736 -3.812 10.710 1.00 0.00 N ATOM 102 NH2 ARG A 137 -19.018 -3.458 10.935 1.00 0.00 N ATOM 0 H ARG A 137 -17.477 -0.042 5.032 1.00 0.00 H new ATOM 0 HA ARG A 137 -15.441 0.522 6.716 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -15.922 -2.087 5.215 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -14.914 -1.934 6.640 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -17.542 -0.704 7.084 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -17.713 -2.373 6.577 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -15.997 -3.008 8.365 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -16.054 -1.350 8.930 1.00 0.00 H new ATOM 0 HE ARG A 137 -18.729 -2.011 8.916 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -15.860 -3.641 10.215 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -16.750 -4.422 11.527 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -19.880 -3.018 10.612 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -19.032 -4.068 11.753 1.00 0.00 H new ATOM 113 N ALA A 138 -14.163 -0.677 3.902 1.00 0.00 N ATOM 114 CA ALA A 138 -12.983 -0.672 3.056 1.00 0.00 C ATOM 115 C ALA A 138 -12.708 0.755 2.576 1.00 0.00 C ATOM 116 O ALA A 138 -11.595 1.258 2.720 1.00 0.00 O ATOM 117 CB ALA A 138 -13.184 -1.648 1.894 1.00 0.00 C ATOM 0 H ALA A 138 -14.918 -1.282 3.578 1.00 0.00 H new ATOM 0 HA ALA A 138 -12.109 -1.005 3.616 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -12.298 -1.645 1.259 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -13.345 -2.652 2.286 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -14.052 -1.343 1.309 1.00 0.00 H new ATOM 123 N ASN A 139 -13.741 1.366 2.017 1.00 0.00 N ATOM 124 CA ASN A 139 -13.626 2.726 1.516 1.00 0.00 C ATOM 125 C ASN A 139 -12.742 3.540 2.463 1.00 0.00 C ATOM 126 O ASN A 139 -11.992 4.410 2.022 1.00 0.00 O ATOM 127 CB ASN A 139 -14.996 3.404 1.446 1.00 0.00 C ATOM 128 CG ASN A 139 -14.848 4.922 1.316 1.00 0.00 C ATOM 129 OD1 ASN A 139 -14.052 5.431 0.545 1.00 0.00 O ATOM 130 ND2 ASN A 139 -15.659 5.614 2.112 1.00 0.00 N ATOM 0 H ASN A 139 -14.663 0.945 1.899 1.00 0.00 H new ATOM 0 HA ASN A 139 -13.194 2.683 0.516 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -15.556 3.015 0.595 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -15.570 3.166 2.341 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -15.638 6.634 2.100 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -16.302 5.125 2.734 1.00 0.00 H new ATOM 136 N LEU A 140 -12.859 3.228 3.745 1.00 0.00 N ATOM 137 CA LEU A 140 -12.080 3.920 4.757 1.00 0.00 C ATOM 138 C LEU A 140 -10.661 3.349 4.781 1.00 0.00 C ATOM 139 O LEU A 140 -9.686 4.099 4.752 1.00 0.00 O ATOM 140 CB LEU A 140 -12.789 3.861 6.112 1.00 0.00 C ATOM 141 CG LEU A 140 -13.621 5.089 6.487 1.00 0.00 C ATOM 142 CD1 LEU A 140 -14.989 4.678 7.038 1.00 0.00 C ATOM 143 CD2 LEU A 140 -12.860 5.992 7.460 1.00 0.00 C ATOM 0 H LEU A 140 -13.482 2.505 4.106 1.00 0.00 H new ATOM 0 HA LEU A 140 -11.994 4.979 4.513 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -13.442 2.988 6.121 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -12.038 3.705 6.886 1.00 0.00 H new ATOM 0 HG LEU A 140 -13.799 5.669 5.582 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -15.560 5.570 7.297 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -15.529 4.108 6.282 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -14.853 4.063 7.928 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -13.474 6.857 7.710 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -12.630 5.436 8.369 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -11.933 6.327 6.996 1.00 0.00 H new ATOM 172 N GLN A 142 -8.131 0.457 2.954 1.00 0.00 N ATOM 173 CA GLN A 142 -7.923 -0.414 1.810 1.00 0.00 C ATOM 174 C GLN A 142 -6.504 -0.242 1.262 1.00 0.00 C ATOM 175 O GLN A 142 -5.866 -1.215 0.864 1.00 0.00 O ATOM 176 CB GLN A 142 -8.966 -0.150 0.722 1.00 0.00 C ATOM 177 CG GLN A 142 -9.263 1.346 0.599 1.00 0.00 C ATOM 178 CD GLN A 142 -9.310 1.777 -0.869 1.00 0.00 C ATOM 179 OE1 GLN A 142 -9.516 0.981 -1.769 1.00 0.00 O ATOM 180 NE2 GLN A 142 -9.109 3.078 -1.057 1.00 0.00 N ATOM 0 HA GLN A 142 -8.042 -1.446 2.139 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -8.606 -0.533 -0.233 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -9.884 -0.689 0.955 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -10.215 1.572 1.079 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -8.498 1.917 1.125 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -8.942 3.689 -0.258 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -9.122 3.465 -2.001 1.00 0.00 H new ATOM 187 N VAL A 143 -6.053 1.004 1.260 1.00 0.00 N ATOM 188 CA VAL A 143 -4.721 1.317 0.768 1.00 0.00 C ATOM 189 C VAL A 143 -4.420 2.793 1.030 1.00 0.00 C ATOM 190 O VAL A 143 -4.608 3.635 0.153 1.00 0.00 O ATOM 191 CB VAL A 143 -4.608 0.937 -0.710 1.00 0.00 C ATOM 192 CG1 VAL A 143 -5.931 1.172 -1.441 1.00 0.00 C ATOM 193 CG2 VAL A 143 -3.465 1.698 -1.384 1.00 0.00 C ATOM 0 H VAL A 143 -6.586 1.809 1.591 1.00 0.00 H new ATOM 0 HA VAL A 143 -3.970 0.733 1.299 1.00 0.00 H new ATOM 0 HB VAL A 143 -4.381 -0.128 -0.766 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -5.822 0.894 -2.489 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -6.712 0.565 -0.984 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -6.203 2.225 -1.372 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -3.406 1.410 -2.434 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -3.649 2.770 -1.311 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -2.525 1.457 -0.888 1.00 0.00 H new ATOM 203 N LYS A 144 -3.955 3.063 2.242 1.00 0.00 N ATOM 204 CA LYS A 144 -3.624 4.423 2.631 1.00 0.00 C ATOM 205 C LYS A 144 -2.133 4.669 2.393 1.00 0.00 C ATOM 206 O LYS A 144 -1.330 4.582 3.321 1.00 0.00 O ATOM 207 CB LYS A 144 -4.070 4.691 4.070 1.00 0.00 C ATOM 208 CG LYS A 144 -5.354 3.927 4.398 1.00 0.00 C ATOM 209 CD LYS A 144 -5.748 4.121 5.863 1.00 0.00 C ATOM 210 CE LYS A 144 -6.957 5.050 5.989 1.00 0.00 C ATOM 211 NZ LYS A 144 -7.731 4.733 7.210 1.00 0.00 N ATOM 0 H LYS A 144 -3.800 2.362 2.967 1.00 0.00 H new ATOM 0 HA LYS A 144 -4.167 5.139 2.014 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -3.280 4.395 4.760 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -4.232 5.760 4.211 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -6.161 4.271 3.752 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -5.212 2.866 4.193 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -5.979 3.155 6.312 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -4.907 4.537 6.417 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -6.624 6.087 6.022 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -7.594 4.948 5.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -8.548 5.373 7.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -8.065 3.749 7.164 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -7.125 4.854 8.046 1.00 0.00 H new ATOM 221 N LYS A 145 -1.808 4.972 1.145 1.00 0.00 N ATOM 222 CA LYS A 145 -0.427 5.230 0.774 1.00 0.00 C ATOM 223 C LYS A 145 -0.180 6.741 0.769 1.00 0.00 C ATOM 224 O LYS A 145 -0.967 7.501 0.207 1.00 0.00 O ATOM 225 CB LYS A 145 -0.092 4.549 -0.554 1.00 0.00 C ATOM 226 CG LYS A 145 1.144 3.658 -0.418 1.00 0.00 C ATOM 227 CD LYS A 145 1.943 3.625 -1.723 1.00 0.00 C ATOM 228 CE LYS A 145 3.373 3.137 -1.478 1.00 0.00 C ATOM 229 NZ LYS A 145 4.316 4.277 -1.474 1.00 0.00 N ATOM 0 H LYS A 145 -2.477 5.045 0.378 1.00 0.00 H new ATOM 0 HA LYS A 145 0.252 4.796 1.508 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -0.941 3.951 -0.884 1.00 0.00 H new ATOM 0 HB3 LYS A 145 0.083 5.304 -1.320 1.00 0.00 H new ATOM 0 HG2 LYS A 145 1.776 4.027 0.390 1.00 0.00 H new ATOM 0 HG3 LYS A 145 0.840 2.647 -0.148 1.00 0.00 H new ATOM 0 HD2 LYS A 145 1.449 2.969 -2.440 1.00 0.00 H new ATOM 0 HD3 LYS A 145 1.965 4.621 -2.165 1.00 0.00 H new ATOM 0 HE2 LYS A 145 3.426 2.611 -0.525 1.00 0.00 H new ATOM 0 HE3 LYS A 145 3.658 2.424 -2.252 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 5.232 3.971 -1.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 3.933 5.046 -2.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 4.447 4.616 -0.500 1.00 0.00 H new ATOM 239 N GLU A 146 0.917 7.129 1.402 1.00 0.00 N ATOM 240 CA GLU A 146 1.278 8.535 1.478 1.00 0.00 C ATOM 241 C GLU A 146 2.789 8.685 1.668 1.00 0.00 C ATOM 242 O GLU A 146 3.262 9.736 2.098 1.00 0.00 O ATOM 243 CB GLU A 146 0.513 9.238 2.601 1.00 0.00 C ATOM 244 CG GLU A 146 -0.587 10.139 2.034 1.00 0.00 C ATOM 245 CD GLU A 146 -0.136 11.600 2.002 1.00 0.00 C ATOM 246 OE1 GLU A 146 1.083 11.814 1.832 1.00 0.00 O ATOM 247 OE2 GLU A 146 -1.022 12.470 2.147 1.00 0.00 O ATOM 0 H GLU A 146 1.567 6.495 1.867 1.00 0.00 H new ATOM 0 HA GLU A 146 0.999 9.013 0.539 1.00 0.00 H new ATOM 0 HB2 GLU A 146 0.073 8.495 3.267 1.00 0.00 H new ATOM 0 HB3 GLU A 146 1.203 9.833 3.199 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -0.846 9.813 1.027 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -1.487 10.046 2.641 1.00 0.00 H new ATOM 252 N ASP A 147 3.503 7.620 1.337 1.00 0.00 N ATOM 253 CA ASP A 147 4.951 7.620 1.465 1.00 0.00 C ATOM 254 C ASP A 147 5.447 6.178 1.599 1.00 0.00 C ATOM 255 O ASP A 147 4.684 5.235 1.400 1.00 0.00 O ATOM 256 CB ASP A 147 5.394 8.389 2.711 1.00 0.00 C ATOM 257 CG ASP A 147 6.016 9.760 2.437 1.00 0.00 C ATOM 258 OD1 ASP A 147 6.925 9.810 1.581 1.00 0.00 O ATOM 259 OD2 ASP A 147 5.569 10.728 3.090 1.00 0.00 O ATOM 0 H ASP A 147 3.106 6.751 0.980 1.00 0.00 H new ATOM 0 HA ASP A 147 5.368 8.098 0.579 1.00 0.00 H new ATOM 0 HB2 ASP A 147 4.531 8.522 3.364 1.00 0.00 H new ATOM 0 HB3 ASP A 147 6.116 7.782 3.257 1.00 0.00 H new ATOM 263 N THR A 148 6.723 6.055 1.937 1.00 0.00 N ATOM 264 CA THR A 148 7.329 4.745 2.100 1.00 0.00 C ATOM 265 C THR A 148 6.737 4.030 3.316 1.00 0.00 C ATOM 266 O THR A 148 6.258 2.902 3.204 1.00 0.00 O ATOM 267 CB THR A 148 8.845 4.933 2.185 1.00 0.00 C ATOM 268 OG1 THR A 148 9.350 3.613 2.363 1.00 0.00 O ATOM 269 CG2 THR A 148 9.273 5.670 3.456 1.00 0.00 C ATOM 0 H THR A 148 7.353 6.840 2.102 1.00 0.00 H new ATOM 0 HA THR A 148 7.113 4.101 1.247 1.00 0.00 H new ATOM 0 HB THR A 148 9.191 5.485 1.311 1.00 0.00 H new ATOM 0 HG1 THR A 148 10.328 3.642 2.426 1.00 0.00 H new ATOM 0 HG21 THR A 148 10.358 5.777 3.467 1.00 0.00 H new ATOM 0 HG22 THR A 148 8.811 6.657 3.477 1.00 0.00 H new ATOM 0 HG23 THR A 148 8.956 5.102 4.330 1.00 0.00 H new ATOM 277 N GLU A 149 6.787 4.715 4.448 1.00 0.00 N ATOM 278 CA GLU A 149 6.261 4.160 5.683 1.00 0.00 C ATOM 279 C GLU A 149 4.760 4.436 5.793 1.00 0.00 C ATOM 280 O GLU A 149 4.147 4.156 6.821 1.00 0.00 O ATOM 281 CB GLU A 149 7.010 4.715 6.897 1.00 0.00 C ATOM 282 CG GLU A 149 7.119 6.239 6.824 1.00 0.00 C ATOM 283 CD GLU A 149 6.896 6.871 8.199 1.00 0.00 C ATOM 284 OE1 GLU A 149 6.087 6.301 8.961 1.00 0.00 O ATOM 285 OE2 GLU A 149 7.542 7.910 8.457 1.00 0.00 O ATOM 0 H GLU A 149 7.184 5.650 4.536 1.00 0.00 H new ATOM 0 HA GLU A 149 6.412 3.081 5.666 1.00 0.00 H new ATOM 0 HB2 GLU A 149 6.491 4.427 7.812 1.00 0.00 H new ATOM 0 HB3 GLU A 149 8.007 4.277 6.945 1.00 0.00 H new ATOM 0 HG2 GLU A 149 8.102 6.519 6.446 1.00 0.00 H new ATOM 0 HG3 GLU A 149 6.384 6.626 6.118 1.00 0.00 H new ATOM 290 N LYS A 150 4.212 4.982 4.717 1.00 0.00 N ATOM 291 CA LYS A 150 2.794 5.299 4.679 1.00 0.00 C ATOM 292 C LYS A 150 2.109 4.432 3.621 1.00 0.00 C ATOM 293 O LYS A 150 2.222 4.701 2.426 1.00 0.00 O ATOM 294 CB LYS A 150 2.586 6.801 4.473 1.00 0.00 C ATOM 295 CG LYS A 150 3.491 7.613 5.401 1.00 0.00 C ATOM 296 CD LYS A 150 3.354 7.140 6.850 1.00 0.00 C ATOM 297 CE LYS A 150 3.333 8.328 7.813 1.00 0.00 C ATOM 298 NZ LYS A 150 1.986 8.938 7.856 1.00 0.00 N ATOM 0 H LYS A 150 4.724 5.213 3.865 1.00 0.00 H new ATOM 0 HA LYS A 150 2.326 5.064 5.635 1.00 0.00 H new ATOM 0 HB2 LYS A 150 2.796 7.062 3.436 1.00 0.00 H new ATOM 0 HB3 LYS A 150 1.543 7.056 4.661 1.00 0.00 H new ATOM 0 HG2 LYS A 150 4.528 7.517 5.080 1.00 0.00 H new ATOM 0 HG3 LYS A 150 3.233 8.670 5.333 1.00 0.00 H new ATOM 0 HD2 LYS A 150 2.438 6.560 6.962 1.00 0.00 H new ATOM 0 HD3 LYS A 150 4.183 6.478 7.101 1.00 0.00 H new ATOM 0 HE2 LYS A 150 3.622 7.999 8.811 1.00 0.00 H new ATOM 0 HE3 LYS A 150 4.065 9.072 7.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 1.990 9.743 8.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 1.725 9.270 6.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 1.295 8.231 8.178 1.00 0.00 H new ATOM 308 N GLU A 151 1.416 3.409 4.098 1.00 0.00 N ATOM 309 CA GLU A 151 0.714 2.500 3.207 1.00 0.00 C ATOM 310 C GLU A 151 -0.155 1.533 4.013 1.00 0.00 C ATOM 311 O GLU A 151 0.017 0.318 3.924 1.00 0.00 O ATOM 312 CB GLU A 151 1.696 1.742 2.313 1.00 0.00 C ATOM 313 CG GLU A 151 2.946 1.332 3.095 1.00 0.00 C ATOM 314 CD GLU A 151 2.590 0.936 4.529 1.00 0.00 C ATOM 315 OE1 GLU A 151 2.180 -0.231 4.710 1.00 0.00 O ATOM 316 OE2 GLU A 151 2.736 1.808 5.412 1.00 0.00 O ATOM 0 H GLU A 151 1.325 3.189 5.090 1.00 0.00 H new ATOM 0 HA GLU A 151 0.063 3.087 2.559 1.00 0.00 H new ATOM 0 HB2 GLU A 151 1.211 0.855 1.904 1.00 0.00 H new ATOM 0 HB3 GLU A 151 1.981 2.368 1.467 1.00 0.00 H new ATOM 0 HG2 GLU A 151 3.435 0.497 2.594 1.00 0.00 H new ATOM 0 HG3 GLU A 151 3.658 2.157 3.108 1.00 0.00 H new ATOM 321 N LYS A 152 -1.068 2.108 4.782 1.00 0.00 N ATOM 322 CA LYS A 152 -1.963 1.311 5.603 1.00 0.00 C ATOM 323 C LYS A 152 -2.517 0.152 4.771 1.00 0.00 C ATOM 324 O LYS A 152 -3.260 0.368 3.816 1.00 0.00 O ATOM 325 CB LYS A 152 -3.047 2.193 6.225 1.00 0.00 C ATOM 326 CG LYS A 152 -2.428 3.321 7.054 1.00 0.00 C ATOM 327 CD LYS A 152 -3.366 3.748 8.185 1.00 0.00 C ATOM 328 CE LYS A 152 -3.383 5.271 8.336 1.00 0.00 C ATOM 329 NZ LYS A 152 -2.975 5.661 9.704 1.00 0.00 N ATOM 0 H LYS A 152 -1.207 3.116 4.854 1.00 0.00 H new ATOM 0 HA LYS A 152 -1.421 0.872 6.441 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -3.672 2.616 5.439 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -3.696 1.587 6.857 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -1.477 2.991 7.471 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -2.215 4.175 6.411 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -4.374 3.388 7.982 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -3.046 3.289 9.121 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -2.710 5.722 7.607 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -4.382 5.652 8.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -2.992 6.697 9.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -3.633 5.246 10.394 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -2.013 5.314 9.891 1.00 0.00 H new ATOM 339 N ASP A 153 -2.131 -1.054 5.164 1.00 0.00 N ATOM 340 CA ASP A 153 -2.579 -2.246 4.466 1.00 0.00 C ATOM 341 C ASP A 153 -3.566 -3.010 5.351 1.00 0.00 C ATOM 342 O ASP A 153 -3.484 -2.945 6.577 1.00 0.00 O ATOM 343 CB ASP A 153 -1.405 -3.178 4.157 1.00 0.00 C ATOM 344 CG ASP A 153 -1.022 -4.134 5.288 1.00 0.00 C ATOM 345 OD1 ASP A 153 -1.258 -3.755 6.456 1.00 0.00 O ATOM 346 OD2 ASP A 153 -0.504 -5.223 4.959 1.00 0.00 O ATOM 0 H ASP A 153 -1.513 -1.230 5.956 1.00 0.00 H new ATOM 0 HA ASP A 153 -3.048 -1.933 3.533 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -1.651 -3.766 3.273 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -0.536 -2.571 3.905 1.00 0.00 H new ATOM 350 N LEU A 154 -4.476 -3.715 4.696 1.00 0.00 N ATOM 351 CA LEU A 154 -5.478 -4.490 5.408 1.00 0.00 C ATOM 352 C LEU A 154 -6.192 -5.419 4.425 1.00 0.00 C ATOM 353 O LEU A 154 -5.704 -5.651 3.320 1.00 0.00 O ATOM 354 CB LEU A 154 -6.425 -3.564 6.176 1.00 0.00 C ATOM 355 CG LEU A 154 -6.924 -2.334 5.415 1.00 0.00 C ATOM 356 CD1 LEU A 154 -5.803 -1.310 5.230 1.00 0.00 C ATOM 357 CD2 LEU A 154 -7.560 -2.735 4.082 1.00 0.00 C ATOM 0 H LEU A 154 -4.541 -3.766 3.679 1.00 0.00 H new ATOM 0 HA LEU A 154 -5.006 -5.122 6.160 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -7.290 -4.145 6.495 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -5.917 -3.226 7.080 1.00 0.00 H new ATOM 0 HG LEU A 154 -7.701 -1.856 6.012 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -6.185 -0.446 4.686 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -5.437 -0.991 6.206 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -4.987 -1.762 4.666 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -7.906 -1.842 3.561 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -6.822 -3.251 3.467 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -8.405 -3.398 4.267 1.00 0.00 H new ATOM 368 N ARG A 155 -7.334 -5.928 4.863 1.00 0.00 N ATOM 369 CA ARG A 155 -8.119 -6.828 4.036 1.00 0.00 C ATOM 370 C ARG A 155 -7.825 -6.579 2.554 1.00 0.00 C ATOM 371 O ARG A 155 -7.730 -5.431 2.122 1.00 0.00 O ATOM 372 CB ARG A 155 -9.616 -6.644 4.290 1.00 0.00 C ATOM 373 CG ARG A 155 -10.175 -5.482 3.466 1.00 0.00 C ATOM 374 CD ARG A 155 -11.416 -4.885 4.130 1.00 0.00 C ATOM 375 NE ARG A 155 -12.558 -5.817 3.999 1.00 0.00 N ATOM 376 CZ ARG A 155 -13.703 -5.704 4.686 1.00 0.00 C ATOM 377 NH1 ARG A 155 -13.865 -4.699 5.558 1.00 0.00 N ATOM 378 NH2 ARG A 155 -14.685 -6.597 4.502 1.00 0.00 N ATOM 0 H ARG A 155 -7.735 -5.734 5.781 1.00 0.00 H new ATOM 0 HA ARG A 155 -7.840 -7.848 4.299 1.00 0.00 H new ATOM 0 HB2 ARG A 155 -10.147 -7.562 4.037 1.00 0.00 H new ATOM 0 HB3 ARG A 155 -9.788 -6.458 5.350 1.00 0.00 H new ATOM 0 HG2 ARG A 155 -9.412 -4.711 3.354 1.00 0.00 H new ATOM 0 HG3 ARG A 155 -10.426 -5.830 2.464 1.00 0.00 H new ATOM 0 HD2 ARG A 155 -11.216 -4.688 5.183 1.00 0.00 H new ATOM 0 HD3 ARG A 155 -11.661 -3.929 3.668 1.00 0.00 H new ATOM 0 HE ARG A 155 -12.468 -6.594 3.345 1.00 0.00 H new ATOM 0 HH11 ARG A 155 -13.117 -4.020 5.699 1.00 0.00 H new ATOM 0 HH12 ARG A 155 -14.737 -4.613 6.081 1.00 0.00 H new ATOM 0 HH21 ARG A 155 -14.561 -7.362 3.839 1.00 0.00 H new ATOM 0 HH22 ARG A 155 -15.557 -6.511 5.025 1.00 0.00 H new ATOM 389 N ASP A 156 -7.692 -7.672 1.818 1.00 0.00 N ATOM 390 CA ASP A 156 -7.411 -7.587 0.395 1.00 0.00 C ATOM 391 C ASP A 156 -5.906 -7.408 0.187 1.00 0.00 C ATOM 392 O ASP A 156 -5.427 -7.422 -0.946 1.00 0.00 O ATOM 393 CB ASP A 156 -8.121 -6.387 -0.235 1.00 0.00 C ATOM 394 CG ASP A 156 -8.336 -6.484 -1.746 1.00 0.00 C ATOM 395 OD1 ASP A 156 -7.775 -7.430 -2.340 1.00 0.00 O ATOM 396 OD2 ASP A 156 -9.057 -5.610 -2.274 1.00 0.00 O ATOM 0 H ASP A 156 -7.774 -8.622 2.180 1.00 0.00 H new ATOM 0 HA ASP A 156 -7.766 -8.504 -0.075 1.00 0.00 H new ATOM 0 HB2 ASP A 156 -9.090 -6.263 0.248 1.00 0.00 H new ATOM 0 HB3 ASP A 156 -7.542 -5.488 -0.022 1.00 0.00 H new ATOM 400 N VAL A 157 -5.202 -7.246 1.297 1.00 0.00 N ATOM 401 CA VAL A 157 -3.761 -7.065 1.250 1.00 0.00 C ATOM 402 C VAL A 157 -3.182 -7.913 0.115 1.00 0.00 C ATOM 403 O VAL A 157 -2.848 -7.390 -0.947 1.00 0.00 O ATOM 404 CB VAL A 157 -3.147 -7.391 2.613 1.00 0.00 C ATOM 405 CG1 VAL A 157 -2.690 -6.118 3.328 1.00 0.00 C ATOM 406 CG2 VAL A 157 -4.128 -8.185 3.479 1.00 0.00 C ATOM 0 H VAL A 157 -5.603 -7.236 2.235 1.00 0.00 H new ATOM 0 HA VAL A 157 -3.514 -6.025 1.038 1.00 0.00 H new ATOM 0 HB VAL A 157 -2.268 -8.013 2.445 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -2.258 -6.379 4.294 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -1.942 -5.608 2.721 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -3.545 -5.459 3.479 1.00 0.00 H new ATOM 0 HG21 VAL A 157 -3.668 -8.404 4.442 1.00 0.00 H new ATOM 0 HG22 VAL A 157 -5.033 -7.598 3.634 1.00 0.00 H new ATOM 0 HG23 VAL A 157 -4.382 -9.119 2.978 1.00 0.00 H new ATOM 416 N GLY A 158 -3.080 -9.207 0.379 1.00 0.00 N ATOM 417 CA GLY A 158 -2.547 -10.132 -0.607 1.00 0.00 C ATOM 418 C GLY A 158 -1.424 -9.482 -1.418 1.00 0.00 C ATOM 419 O GLY A 158 -0.397 -9.094 -0.863 1.00 0.00 O ATOM 0 H GLY A 158 -3.357 -9.637 1.261 1.00 0.00 H new ATOM 0 HA2 GLY A 158 -2.170 -11.024 -0.107 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -3.344 -10.455 -1.277 1.00 0.00 H new ATOM 423 N ASP A 159 -1.658 -9.383 -2.719 1.00 0.00 N ATOM 424 CA ASP A 159 -0.679 -8.787 -3.611 1.00 0.00 C ATOM 425 C ASP A 159 -0.552 -7.295 -3.298 1.00 0.00 C ATOM 426 O ASP A 159 0.532 -6.816 -2.968 1.00 0.00 O ATOM 427 CB ASP A 159 -1.108 -8.929 -5.073 1.00 0.00 C ATOM 428 CG ASP A 159 -0.402 -10.042 -5.849 1.00 0.00 C ATOM 429 OD1 ASP A 159 0.843 -10.097 -5.755 1.00 0.00 O ATOM 430 OD2 ASP A 159 -1.123 -10.812 -6.519 1.00 0.00 O ATOM 0 H ASP A 159 -2.511 -9.706 -3.176 1.00 0.00 H new ATOM 0 HA ASP A 159 0.270 -9.301 -3.462 1.00 0.00 H new ATOM 0 HB2 ASP A 159 -2.182 -9.110 -5.105 1.00 0.00 H new ATOM 0 HB3 ASP A 159 -0.929 -7.982 -5.582 1.00 0.00 H new ATOM 434 N TRP A 160 -1.675 -6.601 -3.415 1.00 0.00 N ATOM 435 CA TRP A 160 -1.703 -5.172 -3.148 1.00 0.00 C ATOM 436 C TRP A 160 -0.801 -4.898 -1.943 1.00 0.00 C ATOM 437 O TRP A 160 -0.190 -3.836 -1.849 1.00 0.00 O ATOM 438 CB TRP A 160 -3.137 -4.680 -2.946 1.00 0.00 C ATOM 439 CG TRP A 160 -3.384 -4.022 -1.588 1.00 0.00 C ATOM 440 CD1 TRP A 160 -4.071 -4.511 -0.546 1.00 0.00 C ATOM 441 CD2 TRP A 160 -2.915 -2.725 -1.164 1.00 0.00 C ATOM 442 NE1 TRP A 160 -4.079 -3.628 0.514 1.00 0.00 N ATOM 443 CE2 TRP A 160 -3.353 -2.507 0.127 1.00 0.00 C ATOM 444 CE3 TRP A 160 -2.146 -1.767 -1.847 1.00 0.00 C ATOM 445 CZ2 TRP A 160 -3.073 -1.339 0.845 1.00 0.00 C ATOM 446 CZ3 TRP A 160 -1.875 -0.604 -1.116 1.00 0.00 C ATOM 447 CH2 TRP A 160 -2.308 -0.370 0.184 1.00 0.00 C ATOM 0 H TRP A 160 -2.572 -7.001 -3.691 1.00 0.00 H new ATOM 0 HA TRP A 160 -1.321 -4.613 -4.002 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -3.379 -3.966 -3.733 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -3.819 -5.523 -3.059 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -4.557 -5.475 -0.537 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -4.534 -3.771 1.416 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -1.792 -1.916 -2.856 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -3.428 -1.193 1.855 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -1.288 0.165 -1.596 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -2.056 0.555 0.682 1.00 0.00 H new ATOM 457 N ARG A 161 -0.748 -5.876 -1.050 1.00 0.00 N ATOM 458 CA ARG A 161 0.067 -5.753 0.146 1.00 0.00 C ATOM 459 C ARG A 161 1.550 -5.899 -0.205 1.00 0.00 C ATOM 460 O ARG A 161 2.300 -4.925 -0.160 1.00 0.00 O ATOM 461 CB ARG A 161 -0.310 -6.815 1.182 1.00 0.00 C ATOM 462 CG ARG A 161 0.326 -6.508 2.539 1.00 0.00 C ATOM 463 CD ARG A 161 1.545 -7.400 2.787 1.00 0.00 C ATOM 464 NE ARG A 161 1.118 -8.809 2.940 1.00 0.00 N ATOM 465 CZ ARG A 161 0.701 -9.345 4.096 1.00 0.00 C ATOM 466 NH1 ARG A 161 0.652 -8.594 5.204 1.00 0.00 N ATOM 467 NH2 ARG A 161 0.333 -10.633 4.142 1.00 0.00 N ATOM 0 H ARG A 161 -1.256 -6.757 -1.131 1.00 0.00 H new ATOM 0 HA ARG A 161 -0.115 -4.766 0.571 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -1.394 -6.858 1.286 1.00 0.00 H new ATOM 0 HB3 ARG A 161 0.016 -7.796 0.837 1.00 0.00 H new ATOM 0 HG2 ARG A 161 0.624 -5.460 2.576 1.00 0.00 H new ATOM 0 HG3 ARG A 161 -0.407 -6.659 3.331 1.00 0.00 H new ATOM 0 HD2 ARG A 161 2.246 -7.312 1.957 1.00 0.00 H new ATOM 0 HD3 ARG A 161 2.070 -7.071 3.684 1.00 0.00 H new ATOM 0 HE ARG A 161 1.143 -9.409 2.115 1.00 0.00 H new ATOM 0 HH11 ARG A 161 0.932 -7.614 5.169 1.00 0.00 H new ATOM 0 HH12 ARG A 161 0.335 -9.002 6.083 1.00 0.00 H new ATOM 0 HH21 ARG A 161 0.370 -11.205 3.298 1.00 0.00 H new ATOM 0 HH22 ARG A 161 0.016 -11.042 5.021 1.00 0.00 H new ATOM 478 N LYS A 162 1.927 -7.122 -0.548 1.00 0.00 N ATOM 479 CA LYS A 162 3.305 -7.407 -0.906 1.00 0.00 C ATOM 480 C LYS A 162 3.872 -6.235 -1.709 1.00 0.00 C ATOM 481 O LYS A 162 5.075 -5.980 -1.678 1.00 0.00 O ATOM 482 CB LYS A 162 3.404 -8.752 -1.629 1.00 0.00 C ATOM 483 CG LYS A 162 3.804 -8.559 -3.093 1.00 0.00 C ATOM 484 CD LYS A 162 5.325 -8.503 -3.243 1.00 0.00 C ATOM 485 CE LYS A 162 5.831 -9.636 -4.139 1.00 0.00 C ATOM 486 NZ LYS A 162 7.178 -9.319 -4.665 1.00 0.00 N ATOM 0 H LYS A 162 1.301 -7.927 -0.585 1.00 0.00 H new ATOM 0 HA LYS A 162 3.918 -7.507 -0.010 1.00 0.00 H new ATOM 0 HB2 LYS A 162 4.137 -9.385 -1.128 1.00 0.00 H new ATOM 0 HB3 LYS A 162 2.446 -9.269 -1.575 1.00 0.00 H new ATOM 0 HG2 LYS A 162 3.406 -9.377 -3.693 1.00 0.00 H new ATOM 0 HG3 LYS A 162 3.363 -7.639 -3.476 1.00 0.00 H new ATOM 0 HD2 LYS A 162 5.617 -7.542 -3.666 1.00 0.00 H new ATOM 0 HD3 LYS A 162 5.793 -8.574 -2.261 1.00 0.00 H new ATOM 0 HE2 LYS A 162 5.865 -10.567 -3.574 1.00 0.00 H new ATOM 0 HE3 LYS A 162 5.138 -9.790 -4.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 7.506 -10.098 -5.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 7.136 -8.442 -5.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 7.840 -9.194 -3.872 1.00 0.00 H new ATOM 496 N ASN A 163 2.978 -5.552 -2.409 1.00 0.00 N ATOM 497 CA ASN A 163 3.374 -4.412 -3.220 1.00 0.00 C ATOM 498 C ASN A 163 3.785 -3.258 -2.303 1.00 0.00 C ATOM 499 O ASN A 163 4.965 -2.924 -2.211 1.00 0.00 O ATOM 500 CB ASN A 163 2.216 -3.930 -4.096 1.00 0.00 C ATOM 501 CG ASN A 163 2.114 -4.760 -5.377 1.00 0.00 C ATOM 502 OD1 ASN A 163 2.980 -5.556 -5.702 1.00 0.00 O ATOM 503 ND2 ASN A 163 1.011 -4.531 -6.084 1.00 0.00 N ATOM 0 H ASN A 163 1.981 -5.766 -2.432 1.00 0.00 H new ATOM 0 HA ASN A 163 4.202 -4.723 -3.857 1.00 0.00 H new ATOM 0 HB2 ASN A 163 1.281 -3.998 -3.539 1.00 0.00 H new ATOM 0 HB3 ASN A 163 2.360 -2.880 -4.350 1.00 0.00 H new ATOM 0 HD21 ASN A 163 0.850 -5.036 -6.956 1.00 0.00 H new ATOM 0 HD22 ASN A 163 0.326 -3.851 -5.755 1.00 0.00 H new ATOM 509 N ILE A 164 2.788 -2.682 -1.647 1.00 0.00 N ATOM 510 CA ILE A 164 3.031 -1.573 -0.741 1.00 0.00 C ATOM 511 C ILE A 164 3.507 -2.117 0.607 1.00 0.00 C ATOM 512 O ILE A 164 3.537 -1.389 1.599 1.00 0.00 O ATOM 513 CB ILE A 164 1.792 -0.680 -0.642 1.00 0.00 C ATOM 514 CG1 ILE A 164 0.935 -1.066 0.566 1.00 0.00 C ATOM 515 CG2 ILE A 164 0.992 -0.705 -1.945 1.00 0.00 C ATOM 516 CD1 ILE A 164 0.332 -2.461 0.386 1.00 0.00 C ATOM 0 H ILE A 164 1.811 -2.963 -1.725 1.00 0.00 H new ATOM 0 HA ILE A 164 3.826 -0.934 -1.126 1.00 0.00 H new ATOM 0 HB ILE A 164 2.122 0.347 -0.488 1.00 0.00 H new ATOM 0 HG12 ILE A 164 1.543 -1.042 1.470 1.00 0.00 H new ATOM 0 HG13 ILE A 164 0.137 -0.335 0.699 1.00 0.00 H new ATOM 0 HG21 ILE A 164 0.117 -0.062 -1.847 1.00 0.00 H new ATOM 0 HG22 ILE A 164 1.617 -0.345 -2.763 1.00 0.00 H new ATOM 0 HG23 ILE A 164 0.671 -1.725 -2.155 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -0.272 -2.711 1.258 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -0.295 -2.474 -0.506 1.00 0.00 H new ATOM 0 HD13 ILE A 164 1.133 -3.192 0.278 1.00 0.00 H new ATOM 527 N GLU A 165 3.868 -3.391 0.601 1.00 0.00 N ATOM 528 CA GLU A 165 4.341 -4.041 1.811 1.00 0.00 C ATOM 529 C GLU A 165 5.856 -4.253 1.743 1.00 0.00 C ATOM 530 O GLU A 165 6.563 -4.017 2.722 1.00 0.00 O ATOM 531 CB GLU A 165 3.613 -5.367 2.042 1.00 0.00 C ATOM 532 CG GLU A 165 4.221 -6.128 3.222 1.00 0.00 C ATOM 533 CD GLU A 165 3.713 -5.573 4.554 1.00 0.00 C ATOM 534 OE1 GLU A 165 2.595 -5.013 4.546 1.00 0.00 O ATOM 535 OE2 GLU A 165 4.454 -5.721 5.551 1.00 0.00 O ATOM 0 H GLU A 165 3.843 -3.991 -0.223 1.00 0.00 H new ATOM 0 HA GLU A 165 4.122 -3.391 2.658 1.00 0.00 H new ATOM 0 HB2 GLU A 165 2.557 -5.178 2.232 1.00 0.00 H new ATOM 0 HB3 GLU A 165 3.670 -5.979 1.142 1.00 0.00 H new ATOM 0 HG2 GLU A 165 3.969 -7.186 3.145 1.00 0.00 H new ATOM 0 HG3 GLU A 165 5.308 -6.055 3.185 1.00 0.00 H new ATOM 540 N GLU A 166 6.307 -4.694 0.579 1.00 0.00 N ATOM 541 CA GLU A 166 7.724 -4.939 0.371 1.00 0.00 C ATOM 542 C GLU A 166 8.277 -3.989 -0.694 1.00 0.00 C ATOM 543 O GLU A 166 9.403 -3.509 -0.578 1.00 0.00 O ATOM 544 CB GLU A 166 7.978 -6.399 -0.013 1.00 0.00 C ATOM 545 CG GLU A 166 7.295 -7.351 0.972 1.00 0.00 C ATOM 546 CD GLU A 166 8.232 -8.494 1.367 1.00 0.00 C ATOM 547 OE1 GLU A 166 8.995 -8.295 2.336 1.00 0.00 O ATOM 548 OE2 GLU A 166 8.163 -9.543 0.690 1.00 0.00 O ATOM 0 H GLU A 166 5.717 -4.888 -0.230 1.00 0.00 H new ATOM 0 HA GLU A 166 8.247 -4.747 1.308 1.00 0.00 H new ATOM 0 HB2 GLU A 166 7.606 -6.584 -1.021 1.00 0.00 H new ATOM 0 HB3 GLU A 166 9.050 -6.594 -0.028 1.00 0.00 H new ATOM 0 HG2 GLU A 166 6.990 -6.802 1.863 1.00 0.00 H new ATOM 0 HG3 GLU A 166 6.389 -7.757 0.522 1.00 0.00 H new ATOM 553 N LYS A 167 7.458 -3.747 -1.707 1.00 0.00 N ATOM 554 CA LYS A 167 7.851 -2.862 -2.792 1.00 0.00 C ATOM 555 C LYS A 167 7.859 -1.418 -2.287 1.00 0.00 C ATOM 556 O LYS A 167 8.827 -0.688 -2.500 1.00 0.00 O ATOM 557 CB LYS A 167 6.956 -3.083 -4.013 1.00 0.00 C ATOM 558 CG LYS A 167 6.283 -1.777 -4.442 1.00 0.00 C ATOM 559 CD LYS A 167 5.395 -1.996 -5.669 1.00 0.00 C ATOM 560 CE LYS A 167 5.599 -0.882 -6.698 1.00 0.00 C ATOM 561 NZ LYS A 167 6.081 -1.442 -7.980 1.00 0.00 N ATOM 0 H LYS A 167 6.525 -4.148 -1.800 1.00 0.00 H new ATOM 0 HA LYS A 167 8.864 -3.090 -3.123 1.00 0.00 H new ATOM 0 HB2 LYS A 167 7.550 -3.478 -4.837 1.00 0.00 H new ATOM 0 HB3 LYS A 167 6.196 -3.829 -3.781 1.00 0.00 H new ATOM 0 HG2 LYS A 167 5.684 -1.385 -3.620 1.00 0.00 H new ATOM 0 HG3 LYS A 167 7.043 -1.029 -4.667 1.00 0.00 H new ATOM 0 HD2 LYS A 167 5.625 -2.961 -6.121 1.00 0.00 H new ATOM 0 HD3 LYS A 167 4.349 -2.028 -5.365 1.00 0.00 H new ATOM 0 HE2 LYS A 167 4.661 -0.349 -6.857 1.00 0.00 H new ATOM 0 HE3 LYS A 167 6.318 -0.156 -6.319 1.00 0.00 H new ATOM 0 HZ1 LYS A 167 6.214 -0.672 -8.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 167 6.987 -1.930 -7.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 167 5.382 -2.118 -8.349 1.00 0.00 H new ATOM 571 N SER A 168 6.770 -1.047 -1.631 1.00 0.00 N ATOM 572 CA SER A 168 6.640 0.297 -1.095 1.00 0.00 C ATOM 573 C SER A 168 7.979 0.762 -0.517 1.00 0.00 C ATOM 574 O SER A 168 8.665 1.587 -1.117 1.00 0.00 O ATOM 575 CB SER A 168 5.550 0.360 -0.024 1.00 0.00 C ATOM 576 OG SER A 168 5.911 1.215 1.057 1.00 0.00 O ATOM 0 H SER A 168 5.969 -1.654 -1.458 1.00 0.00 H new ATOM 0 HA SER A 168 6.351 0.963 -1.908 1.00 0.00 H new ATOM 0 HB2 SER A 168 4.622 0.715 -0.472 1.00 0.00 H new ATOM 0 HB3 SER A 168 5.357 -0.643 0.356 1.00 0.00 H new ATOM 0 HG SER A 168 5.100 1.540 1.502 1.00 0.00 H new ATOM 581 N GLY A 169 8.309 0.212 0.642 1.00 0.00 N ATOM 582 CA GLY A 169 9.553 0.560 1.308 1.00 0.00 C ATOM 583 C GLY A 169 10.677 0.773 0.293 1.00 0.00 C ATOM 584 O GLY A 169 11.201 1.879 0.165 1.00 0.00 O ATOM 0 H GLY A 169 7.737 -0.472 1.137 1.00 0.00 H new ATOM 0 HA2 GLY A 169 9.413 1.467 1.897 1.00 0.00 H new ATOM 0 HA3 GLY A 169 9.831 -0.232 2.003 1.00 0.00 H new