USER MOD reduce.3.24.130724 H: found=0, std=0, add=431, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 340 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 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 ASN :FLIP amide:sc= -0.268 F(o=-1.7,f=-0.27) USER MOD Single : A 134 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 139 ASN : amide:sc= -2.51! C(o=-2.5!,f=-9.3!) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 142 GLN :FLIP amide:sc= -0.155 F(o=-1.2!,f=-0.16) USER MOD Single : A 144 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 148 THR OG1 : rot 180:sc= -1.01! 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= 0.751 K(o=0.75,f=-0.13) USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 SER OG : rot -131:sc= -2.34 USER MOD Single : A 170 MET CE :methyl 146:sc= -0.207 (180deg=-0.933) USER MOD Single : A 174 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 175 LYS NZ :NH3+ 140:sc= 0.1 (180deg=0) USER MOD Single : A 176 MET CE :methyl -109:sc= 0 (180deg=-0.0587) USER MOD Single : A 182 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 131 -20.780 -6.021 13.440 1.00 0.00 N ATOM 2 CA LYS A 131 -19.531 -5.312 13.660 1.00 0.00 C ATOM 3 C LYS A 131 -19.586 -3.958 12.951 1.00 0.00 C ATOM 4 O LYS A 131 -18.988 -3.783 11.891 1.00 0.00 O ATOM 5 CB LYS A 131 -18.342 -6.179 13.239 1.00 0.00 C ATOM 6 CG LYS A 131 -18.341 -6.411 11.726 1.00 0.00 C ATOM 7 CD LYS A 131 -17.744 -7.776 11.381 1.00 0.00 C ATOM 8 CE LYS A 131 -16.465 -7.623 10.555 1.00 0.00 C ATOM 9 NZ LYS A 131 -16.697 -8.049 9.157 1.00 0.00 N ATOM 0 HA LYS A 131 -19.389 -5.110 14.722 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -17.411 -5.696 13.537 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -18.384 -7.137 13.757 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -19.360 -6.349 11.344 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -17.768 -5.625 11.234 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -17.526 -8.323 12.298 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -18.473 -8.365 10.824 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -16.134 -6.585 10.575 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -15.667 -8.220 10.996 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -15.819 -7.939 8.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -16.991 -9.046 9.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -17.444 -7.462 8.735 1.00 0.00 H new ATOM 19 N VAL A 132 -20.309 -3.033 13.566 1.00 0.00 N ATOM 20 CA VAL A 132 -20.450 -1.699 13.008 1.00 0.00 C ATOM 21 C VAL A 132 -19.098 -0.986 13.056 1.00 0.00 C ATOM 22 O VAL A 132 -18.487 -0.733 12.017 1.00 0.00 O ATOM 23 CB VAL A 132 -21.554 -0.938 13.744 1.00 0.00 C ATOM 24 CG1 VAL A 132 -21.572 0.536 13.332 1.00 0.00 C ATOM 25 CG2 VAL A 132 -22.918 -1.589 13.512 1.00 0.00 C ATOM 0 H VAL A 132 -20.803 -3.182 14.446 1.00 0.00 H new ATOM 0 HA VAL A 132 -20.753 -1.752 11.962 1.00 0.00 H new ATOM 0 HB VAL A 132 -21.339 -0.985 14.811 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -22.366 1.054 13.870 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -20.612 0.993 13.573 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -21.751 0.612 12.259 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -23.685 -1.028 14.046 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -23.145 -1.588 12.446 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -22.898 -2.616 13.878 1.00 0.00 H new ATOM 35 N ASN A 133 -18.668 -0.680 14.271 1.00 0.00 N ATOM 36 CA ASN A 133 -17.399 0.000 14.467 1.00 0.00 C ATOM 37 C ASN A 133 -16.384 -0.519 13.447 1.00 0.00 C ATOM 38 O ASN A 133 -15.516 0.226 12.996 1.00 0.00 O ATOM 39 CB ASN A 133 -16.841 -0.268 15.867 1.00 0.00 C ATOM 40 CG ASN A 133 -17.469 -1.523 16.476 1.00 0.00 C ATOM 41 OD1 ASN A 133 -17.087 -2.656 15.896 1.00 0.00 O flip ATOM 42 ND2 ASN A 133 -18.250 -1.465 17.412 1.00 0.00 N flip ATOM 0 H ASN A 133 -19.176 -0.891 15.130 1.00 0.00 H new ATOM 0 HA ASN A 133 -17.567 1.070 14.344 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -15.759 -0.387 15.814 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -17.036 0.590 16.511 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -18.501 -0.561 17.811 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -18.651 -2.321 17.795 1.00 0.00 H new ATOM 48 N MET A 134 -16.528 -1.794 13.113 1.00 0.00 N ATOM 49 CA MET A 134 -15.634 -2.420 12.153 1.00 0.00 C ATOM 50 C MET A 134 -15.892 -1.896 10.739 1.00 0.00 C ATOM 51 O MET A 134 -14.977 -1.413 10.075 1.00 0.00 O ATOM 52 CB MET A 134 -15.837 -3.937 12.181 1.00 0.00 C ATOM 53 CG MET A 134 -14.966 -4.587 13.258 1.00 0.00 C ATOM 54 SD MET A 134 -13.278 -4.699 12.690 1.00 0.00 S ATOM 55 CE MET A 134 -12.468 -5.154 14.215 1.00 0.00 C ATOM 0 H MET A 134 -17.249 -2.409 13.489 1.00 0.00 H new ATOM 0 HA MET A 134 -14.608 -2.176 12.428 1.00 0.00 H new ATOM 0 HB2 MET A 134 -16.886 -4.164 12.371 1.00 0.00 H new ATOM 0 HB3 MET A 134 -15.591 -4.358 11.206 1.00 0.00 H new ATOM 0 HG2 MET A 134 -15.011 -4.002 14.177 1.00 0.00 H new ATOM 0 HG3 MET A 134 -15.346 -5.581 13.494 1.00 0.00 H new ATOM 0 HE1 MET A 134 -11.398 -5.266 14.039 1.00 0.00 H new ATOM 0 HE2 MET A 134 -12.634 -4.377 14.961 1.00 0.00 H new ATOM 0 HE3 MET A 134 -12.877 -6.097 14.577 1.00 0.00 H new ATOM 63 N ASP A 135 -17.144 -2.010 10.320 1.00 0.00 N ATOM 64 CA ASP A 135 -17.535 -1.554 8.998 1.00 0.00 C ATOM 65 C ASP A 135 -17.062 -0.112 8.800 1.00 0.00 C ATOM 66 O ASP A 135 -16.690 0.276 7.694 1.00 0.00 O ATOM 67 CB ASP A 135 -19.056 -1.580 8.832 1.00 0.00 C ATOM 68 CG ASP A 135 -19.551 -2.116 7.488 1.00 0.00 C ATOM 69 OD1 ASP A 135 -18.682 -2.460 6.659 1.00 0.00 O ATOM 70 OD2 ASP A 135 -20.789 -2.172 7.320 1.00 0.00 O ATOM 0 H ASP A 135 -17.901 -2.412 10.874 1.00 0.00 H new ATOM 0 HA ASP A 135 -17.082 -2.221 8.264 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -19.483 -2.190 9.628 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -19.438 -0.568 8.965 1.00 0.00 H new ATOM 74 N LEU A 136 -17.093 0.642 9.889 1.00 0.00 N ATOM 75 CA LEU A 136 -16.672 2.032 9.849 1.00 0.00 C ATOM 76 C LEU A 136 -15.154 2.096 9.673 1.00 0.00 C ATOM 77 O LEU A 136 -14.650 2.887 8.877 1.00 0.00 O ATOM 78 CB LEU A 136 -17.180 2.781 11.082 1.00 0.00 C ATOM 79 CG LEU A 136 -16.910 4.287 11.111 1.00 0.00 C ATOM 80 CD1 LEU A 136 -18.101 5.069 10.554 1.00 0.00 C ATOM 81 CD2 LEU A 136 -16.530 4.748 12.520 1.00 0.00 C ATOM 0 H LEU A 136 -17.403 0.316 10.805 1.00 0.00 H new ATOM 0 HA LEU A 136 -17.114 2.539 8.992 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -18.256 2.623 11.161 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -16.727 2.334 11.967 1.00 0.00 H new ATOM 0 HG LEU A 136 -16.058 4.494 10.463 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -17.883 6.136 10.586 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -18.284 4.767 9.523 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -18.986 4.861 11.156 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -16.343 5.822 12.513 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -17.346 4.526 13.208 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -15.630 4.225 12.844 1.00 0.00 H new ATOM 92 N ARG A 137 -14.466 1.254 10.431 1.00 0.00 N ATOM 93 CA ARG A 137 -13.016 1.204 10.368 1.00 0.00 C ATOM 94 C ARG A 137 -12.552 1.003 8.924 1.00 0.00 C ATOM 95 O ARG A 137 -11.870 1.858 8.362 1.00 0.00 O ATOM 96 CB ARG A 137 -12.465 0.070 11.235 1.00 0.00 C ATOM 97 CG ARG A 137 -12.874 0.251 12.698 1.00 0.00 C ATOM 98 CD ARG A 137 -11.645 0.353 13.603 1.00 0.00 C ATOM 99 NE ARG A 137 -11.555 1.710 14.185 1.00 0.00 N ATOM 100 CZ ARG A 137 -10.574 2.114 15.003 1.00 0.00 C ATOM 101 NH1 ARG A 137 -9.593 1.266 15.342 1.00 0.00 N ATOM 102 NH2 ARG A 137 -10.574 3.364 15.484 1.00 0.00 N ATOM 0 H ARG A 137 -14.887 0.601 11.092 1.00 0.00 H new ATOM 0 HA ARG A 137 -12.636 2.153 10.746 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -12.834 -0.887 10.866 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -11.378 0.044 11.158 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -13.481 1.150 12.801 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -13.493 -0.589 13.013 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -11.707 -0.389 14.399 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -10.743 0.133 13.031 1.00 0.00 H new ATOM 0 HE ARG A 137 -12.286 2.381 13.948 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -9.594 0.313 14.977 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -8.846 1.573 15.965 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -11.321 4.009 15.228 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -9.827 3.671 16.107 1.00 0.00 H new ATOM 113 N ALA A 138 -12.942 -0.133 8.363 1.00 0.00 N ATOM 114 CA ALA A 138 -12.575 -0.457 6.996 1.00 0.00 C ATOM 115 C ALA A 138 -13.146 0.605 6.054 1.00 0.00 C ATOM 116 O ALA A 138 -12.442 1.109 5.181 1.00 0.00 O ATOM 117 CB ALA A 138 -13.068 -1.864 6.655 1.00 0.00 C ATOM 0 H ALA A 138 -13.509 -0.840 8.831 1.00 0.00 H new ATOM 0 HA ALA A 138 -11.491 -0.454 6.878 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -12.793 -2.107 5.629 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -12.611 -2.584 7.334 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -14.152 -1.905 6.759 1.00 0.00 H new ATOM 123 N ASN A 139 -14.418 0.915 6.263 1.00 0.00 N ATOM 124 CA ASN A 139 -15.091 1.907 5.443 1.00 0.00 C ATOM 125 C ASN A 139 -14.119 3.047 5.130 1.00 0.00 C ATOM 126 O ASN A 139 -13.784 3.279 3.970 1.00 0.00 O ATOM 127 CB ASN A 139 -16.295 2.501 6.177 1.00 0.00 C ATOM 128 CG ASN A 139 -16.751 3.804 5.517 1.00 0.00 C ATOM 129 OD1 ASN A 139 -16.034 4.790 5.469 1.00 0.00 O ATOM 130 ND2 ASN A 139 -17.980 3.752 5.011 1.00 0.00 N ATOM 0 H ASN A 139 -15.000 0.496 6.989 1.00 0.00 H new ATOM 0 HA ASN A 139 -15.430 1.418 4.530 1.00 0.00 H new ATOM 0 HB2 ASN A 139 -17.115 1.783 6.178 1.00 0.00 H new ATOM 0 HB3 ASN A 139 -16.034 2.689 7.219 1.00 0.00 H new ATOM 0 HD21 ASN A 139 -18.376 4.570 4.548 1.00 0.00 H new ATOM 0 HD22 ASN A 139 -18.526 2.894 5.086 1.00 0.00 H new ATOM 136 N LEU A 140 -13.694 3.727 6.185 1.00 0.00 N ATOM 137 CA LEU A 140 -12.767 4.836 6.036 1.00 0.00 C ATOM 138 C LEU A 140 -11.436 4.314 5.494 1.00 0.00 C ATOM 139 O LEU A 140 -10.796 4.969 4.674 1.00 0.00 O ATOM 140 CB LEU A 140 -12.637 5.605 7.352 1.00 0.00 C ATOM 141 CG LEU A 140 -13.602 6.777 7.543 1.00 0.00 C ATOM 142 CD1 LEU A 140 -14.898 6.316 8.214 1.00 0.00 C ATOM 143 CD2 LEU A 140 -12.933 7.918 8.312 1.00 0.00 C ATOM 0 H LEU A 140 -13.974 3.531 7.146 1.00 0.00 H new ATOM 0 HA LEU A 140 -13.146 5.555 5.310 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -12.780 4.904 8.175 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -11.618 5.983 7.429 1.00 0.00 H new ATOM 0 HG LEU A 140 -13.868 7.164 6.560 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -15.566 7.168 8.338 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -15.382 5.563 7.592 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -14.670 5.888 9.190 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -13.640 8.738 8.434 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -12.619 7.561 9.293 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -12.063 8.269 7.758 1.00 0.00 H new ATOM 154 N LYS A 141 -11.058 3.139 5.975 1.00 0.00 N ATOM 155 CA LYS A 141 -9.814 2.521 5.548 1.00 0.00 C ATOM 156 C LYS A 141 -9.942 2.079 4.089 1.00 0.00 C ATOM 157 O LYS A 141 -10.500 2.802 3.265 1.00 0.00 O ATOM 158 CB LYS A 141 -9.424 1.389 6.500 1.00 0.00 C ATOM 159 CG LYS A 141 -7.906 1.321 6.680 1.00 0.00 C ATOM 160 CD LYS A 141 -7.536 1.106 8.150 1.00 0.00 C ATOM 161 CE LYS A 141 -7.034 -0.320 8.385 1.00 0.00 C ATOM 162 NZ LYS A 141 -7.398 -0.780 9.743 1.00 0.00 N ATOM 0 H LYS A 141 -11.591 2.598 6.656 1.00 0.00 H new ATOM 0 HA LYS A 141 -8.997 3.241 5.593 1.00 0.00 H new ATOM 0 HB2 LYS A 141 -9.902 1.542 7.468 1.00 0.00 H new ATOM 0 HB3 LYS A 141 -9.790 0.439 6.110 1.00 0.00 H new ATOM 0 HG2 LYS A 141 -7.501 0.508 6.077 1.00 0.00 H new ATOM 0 HG3 LYS A 141 -7.452 2.243 6.318 1.00 0.00 H new ATOM 0 HD2 LYS A 141 -6.766 1.820 8.443 1.00 0.00 H new ATOM 0 HD3 LYS A 141 -8.405 1.298 8.779 1.00 0.00 H new ATOM 0 HE2 LYS A 141 -7.463 -0.990 7.640 1.00 0.00 H new ATOM 0 HE3 LYS A 141 -5.952 -0.356 8.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 -7.050 -1.749 9.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 -6.968 -0.150 10.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 -8.432 -0.764 9.849 1.00 0.00 H new ATOM 172 N GLN A 142 -9.416 0.895 3.813 1.00 0.00 N ATOM 173 CA GLN A 142 -9.464 0.349 2.468 1.00 0.00 C ATOM 174 C GLN A 142 -8.206 0.741 1.690 1.00 0.00 C ATOM 175 O GLN A 142 -8.297 1.289 0.593 1.00 0.00 O ATOM 176 CB GLN A 142 -10.728 0.808 1.735 1.00 0.00 C ATOM 177 CG GLN A 142 -11.966 0.628 2.614 1.00 0.00 C ATOM 178 CD GLN A 142 -13.142 0.085 1.799 1.00 0.00 C ATOM 179 OE1 GLN A 142 -13.133 0.458 0.522 1.00 0.00 O flip ATOM 180 NE2 GLN A 142 -14.000 -0.625 2.296 1.00 0.00 N flip ATOM 0 H GLN A 142 -8.954 0.298 4.499 1.00 0.00 H new ATOM 0 HA GLN A 142 -9.499 -0.738 2.539 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -10.628 1.856 1.451 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -10.846 0.238 0.813 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -11.739 -0.056 3.432 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -12.240 1.583 3.063 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -13.947 -0.874 3.284 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -14.771 -0.970 1.724 1.00 0.00 H new ATOM 187 N VAL A 143 -7.063 0.445 2.290 1.00 0.00 N ATOM 188 CA VAL A 143 -5.788 0.759 1.667 1.00 0.00 C ATOM 189 C VAL A 143 -5.609 2.278 1.621 1.00 0.00 C ATOM 190 O VAL A 143 -6.407 2.982 1.005 1.00 0.00 O ATOM 191 CB VAL A 143 -5.705 0.105 0.286 1.00 0.00 C ATOM 192 CG1 VAL A 143 -4.493 0.621 -0.493 1.00 0.00 C ATOM 193 CG2 VAL A 143 -5.673 -1.420 0.403 1.00 0.00 C ATOM 0 H VAL A 143 -6.993 -0.009 3.201 1.00 0.00 H new ATOM 0 HA VAL A 143 -4.965 0.352 2.254 1.00 0.00 H new ATOM 0 HB VAL A 143 -6.602 0.380 -0.269 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -4.457 0.140 -1.471 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -4.576 1.700 -0.622 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -3.581 0.390 0.058 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -5.614 -1.860 -0.592 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -4.803 -1.722 0.986 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -6.580 -1.766 0.899 1.00 0.00 H new ATOM 203 N LYS A 144 -4.555 2.738 2.279 1.00 0.00 N ATOM 204 CA LYS A 144 -4.262 4.160 2.322 1.00 0.00 C ATOM 205 C LYS A 144 -2.766 4.360 2.576 1.00 0.00 C ATOM 206 O LYS A 144 -2.307 4.262 3.713 1.00 0.00 O ATOM 207 CB LYS A 144 -5.158 4.863 3.342 1.00 0.00 C ATOM 208 CG LYS A 144 -4.929 4.305 4.749 1.00 0.00 C ATOM 209 CD LYS A 144 -6.168 4.503 5.625 1.00 0.00 C ATOM 210 CE LYS A 144 -5.889 4.084 7.070 1.00 0.00 C ATOM 211 NZ LYS A 144 -5.380 5.231 7.854 1.00 0.00 N ATOM 0 H LYS A 144 -3.893 2.151 2.787 1.00 0.00 H new ATOM 0 HA LYS A 144 -4.489 4.624 1.362 1.00 0.00 H new ATOM 0 HB2 LYS A 144 -4.954 5.934 3.334 1.00 0.00 H new ATOM 0 HB3 LYS A 144 -6.204 4.736 3.062 1.00 0.00 H new ATOM 0 HG2 LYS A 144 -4.688 3.244 4.689 1.00 0.00 H new ATOM 0 HG3 LYS A 144 -4.073 4.801 5.206 1.00 0.00 H new ATOM 0 HD2 LYS A 144 -6.474 5.549 5.598 1.00 0.00 H new ATOM 0 HD3 LYS A 144 -6.997 3.918 5.226 1.00 0.00 H new ATOM 0 HE2 LYS A 144 -6.802 3.701 7.526 1.00 0.00 H new ATOM 0 HE3 LYS A 144 -5.160 3.274 7.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 144 -5.196 4.929 8.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 144 -4.498 5.579 7.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 144 -6.088 5.993 7.855 1.00 0.00 H new ATOM 221 N LYS A 145 -2.047 4.638 1.498 1.00 0.00 N ATOM 222 CA LYS A 145 -0.613 4.852 1.590 1.00 0.00 C ATOM 223 C LYS A 145 -0.245 6.139 0.850 1.00 0.00 C ATOM 224 O LYS A 145 -1.026 6.639 0.040 1.00 0.00 O ATOM 225 CB LYS A 145 0.146 3.620 1.094 1.00 0.00 C ATOM 226 CG LYS A 145 0.059 3.499 -0.429 1.00 0.00 C ATOM 227 CD LYS A 145 1.451 3.512 -1.061 1.00 0.00 C ATOM 228 CE LYS A 145 1.362 3.445 -2.587 1.00 0.00 C ATOM 229 NZ LYS A 145 2.043 4.608 -3.198 1.00 0.00 N ATOM 0 H LYS A 145 -2.431 4.720 0.557 1.00 0.00 H new ATOM 0 HA LYS A 145 -0.314 4.985 2.630 1.00 0.00 H new ATOM 0 HB2 LYS A 145 1.191 3.685 1.398 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -0.266 2.724 1.558 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -0.456 2.576 -0.695 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -0.534 4.322 -0.829 1.00 0.00 H new ATOM 0 HD2 LYS A 145 1.981 4.417 -0.764 1.00 0.00 H new ATOM 0 HD3 LYS A 145 2.031 2.667 -0.690 1.00 0.00 H new ATOM 0 HE2 LYS A 145 1.817 2.521 -2.943 1.00 0.00 H new ATOM 0 HE3 LYS A 145 0.317 3.425 -2.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 1.973 4.547 -4.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 1.591 5.486 -2.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 3.045 4.610 -2.918 1.00 0.00 H new ATOM 239 N GLU A 146 0.943 6.641 1.155 1.00 0.00 N ATOM 240 CA GLU A 146 1.422 7.861 0.528 1.00 0.00 C ATOM 241 C GLU A 146 2.938 7.795 0.328 1.00 0.00 C ATOM 242 O GLU A 146 3.573 8.805 0.031 1.00 0.00 O ATOM 243 CB GLU A 146 1.032 9.091 1.351 1.00 0.00 C ATOM 244 CG GLU A 146 -0.162 9.814 0.722 1.00 0.00 C ATOM 245 CD GLU A 146 0.292 11.061 -0.038 1.00 0.00 C ATOM 246 OE1 GLU A 146 1.428 11.026 -0.559 1.00 0.00 O ATOM 247 OE2 GLU A 146 -0.507 12.021 -0.082 1.00 0.00 O ATOM 0 H GLU A 146 1.587 6.225 1.828 1.00 0.00 H new ATOM 0 HA GLU A 146 0.949 7.953 -0.450 1.00 0.00 H new ATOM 0 HB2 GLU A 146 0.784 8.789 2.369 1.00 0.00 H new ATOM 0 HB3 GLU A 146 1.880 9.772 1.418 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -0.684 9.140 0.043 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -0.872 10.096 1.499 1.00 0.00 H new ATOM 252 N ASP A 147 3.473 6.595 0.499 1.00 0.00 N ATOM 253 CA ASP A 147 4.902 6.383 0.341 1.00 0.00 C ATOM 254 C ASP A 147 5.315 5.125 1.108 1.00 0.00 C ATOM 255 O ASP A 147 4.463 4.350 1.541 1.00 0.00 O ATOM 256 CB ASP A 147 5.699 7.562 0.903 1.00 0.00 C ATOM 257 CG ASP A 147 6.371 8.448 -0.148 1.00 0.00 C ATOM 258 OD1 ASP A 147 6.836 7.877 -1.158 1.00 0.00 O ATOM 259 OD2 ASP A 147 6.403 9.676 0.081 1.00 0.00 O ATOM 0 H ASP A 147 2.943 5.759 0.745 1.00 0.00 H new ATOM 0 HA ASP A 147 5.112 6.280 -0.724 1.00 0.00 H new ATOM 0 HB2 ASP A 147 5.031 8.179 1.503 1.00 0.00 H new ATOM 0 HB3 ASP A 147 6.466 7.176 1.575 1.00 0.00 H new ATOM 263 N THR A 148 6.622 4.961 1.253 1.00 0.00 N ATOM 264 CA THR A 148 7.157 3.811 1.960 1.00 0.00 C ATOM 265 C THR A 148 6.439 3.625 3.299 1.00 0.00 C ATOM 266 O THR A 148 5.402 2.967 3.365 1.00 0.00 O ATOM 267 CB THR A 148 8.668 4.006 2.104 1.00 0.00 C ATOM 268 OG1 THR A 148 9.003 3.271 3.277 1.00 0.00 O ATOM 269 CG2 THR A 148 9.043 5.448 2.448 1.00 0.00 C ATOM 0 H THR A 148 7.326 5.606 0.893 1.00 0.00 H new ATOM 0 HA THR A 148 6.984 2.890 1.404 1.00 0.00 H new ATOM 0 HB THR A 148 9.161 3.715 1.176 1.00 0.00 H new ATOM 0 HG1 THR A 148 9.966 3.342 3.444 1.00 0.00 H new ATOM 0 HG21 THR A 148 10.126 5.531 2.539 1.00 0.00 H new ATOM 0 HG22 THR A 148 8.693 6.113 1.659 1.00 0.00 H new ATOM 0 HG23 THR A 148 8.577 5.730 3.392 1.00 0.00 H new ATOM 277 N GLU A 149 7.019 4.218 4.333 1.00 0.00 N ATOM 278 CA GLU A 149 6.448 4.127 5.664 1.00 0.00 C ATOM 279 C GLU A 149 4.931 4.328 5.607 1.00 0.00 C ATOM 280 O GLU A 149 4.168 3.419 5.931 1.00 0.00 O ATOM 281 CB GLU A 149 7.099 5.136 6.612 1.00 0.00 C ATOM 282 CG GLU A 149 8.535 4.729 6.944 1.00 0.00 C ATOM 283 CD GLU A 149 8.630 4.157 8.360 1.00 0.00 C ATOM 284 OE1 GLU A 149 8.759 4.975 9.295 1.00 0.00 O ATOM 285 OE2 GLU A 149 8.570 2.913 8.475 1.00 0.00 O ATOM 0 H GLU A 149 7.879 4.763 4.274 1.00 0.00 H new ATOM 0 HA GLU A 149 6.649 3.130 6.055 1.00 0.00 H new ATOM 0 HB2 GLU A 149 7.094 6.125 6.155 1.00 0.00 H new ATOM 0 HB3 GLU A 149 6.516 5.206 7.530 1.00 0.00 H new ATOM 0 HG2 GLU A 149 8.882 3.987 6.224 1.00 0.00 H new ATOM 0 HG3 GLU A 149 9.192 5.594 6.853 1.00 0.00 H new ATOM 290 N LYS A 150 4.542 5.525 5.193 1.00 0.00 N ATOM 291 CA LYS A 150 3.131 5.857 5.089 1.00 0.00 C ATOM 292 C LYS A 150 2.438 4.842 4.176 1.00 0.00 C ATOM 293 O LYS A 150 2.335 5.056 2.970 1.00 0.00 O ATOM 294 CB LYS A 150 2.954 7.309 4.640 1.00 0.00 C ATOM 295 CG LYS A 150 3.971 7.675 3.558 1.00 0.00 C ATOM 296 CD LYS A 150 5.086 8.554 4.128 1.00 0.00 C ATOM 297 CE LYS A 150 4.639 10.016 4.220 1.00 0.00 C ATOM 298 NZ LYS A 150 5.415 10.730 5.258 1.00 0.00 N ATOM 0 H LYS A 150 5.178 6.276 4.926 1.00 0.00 H new ATOM 0 HA LYS A 150 2.651 5.788 6.065 1.00 0.00 H new ATOM 0 HB2 LYS A 150 1.943 7.455 4.259 1.00 0.00 H new ATOM 0 HB3 LYS A 150 3.071 7.975 5.495 1.00 0.00 H new ATOM 0 HG2 LYS A 150 4.400 6.767 3.135 1.00 0.00 H new ATOM 0 HG3 LYS A 150 3.469 8.200 2.745 1.00 0.00 H new ATOM 0 HD2 LYS A 150 5.369 8.193 5.117 1.00 0.00 H new ATOM 0 HD3 LYS A 150 5.971 8.480 3.497 1.00 0.00 H new ATOM 0 HE2 LYS A 150 4.774 10.505 3.255 1.00 0.00 H new ATOM 0 HE3 LYS A 150 3.576 10.063 4.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 5.100 11.720 5.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 5.265 10.272 6.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 6.426 10.700 5.017 1.00 0.00 H new ATOM 308 N GLU A 151 1.981 3.760 4.789 1.00 0.00 N ATOM 309 CA GLU A 151 1.301 2.712 4.047 1.00 0.00 C ATOM 310 C GLU A 151 0.397 1.903 4.979 1.00 0.00 C ATOM 311 O GLU A 151 0.883 1.177 5.845 1.00 0.00 O ATOM 312 CB GLU A 151 2.305 1.805 3.334 1.00 0.00 C ATOM 313 CG GLU A 151 1.591 0.684 2.577 1.00 0.00 C ATOM 314 CD GLU A 151 1.034 -0.363 3.544 1.00 0.00 C ATOM 315 OE1 GLU A 151 1.846 -0.900 4.327 1.00 0.00 O ATOM 316 OE2 GLU A 151 -0.191 -0.603 3.477 1.00 0.00 O ATOM 0 H GLU A 151 2.068 3.586 5.790 1.00 0.00 H new ATOM 0 HA GLU A 151 0.678 3.179 3.284 1.00 0.00 H new ATOM 0 HB2 GLU A 151 2.903 2.394 2.639 1.00 0.00 H new ATOM 0 HB3 GLU A 151 2.993 1.376 4.062 1.00 0.00 H new ATOM 0 HG2 GLU A 151 0.780 1.102 1.981 1.00 0.00 H new ATOM 0 HG3 GLU A 151 2.285 0.210 1.883 1.00 0.00 H new ATOM 321 N LYS A 152 -0.902 2.054 4.769 1.00 0.00 N ATOM 322 CA LYS A 152 -1.879 1.346 5.580 1.00 0.00 C ATOM 323 C LYS A 152 -2.449 0.174 4.777 1.00 0.00 C ATOM 324 O LYS A 152 -3.278 0.370 3.891 1.00 0.00 O ATOM 325 CB LYS A 152 -2.946 2.312 6.099 1.00 0.00 C ATOM 326 CG LYS A 152 -2.759 2.586 7.592 1.00 0.00 C ATOM 327 CD LYS A 152 -3.284 1.420 8.434 1.00 0.00 C ATOM 328 CE LYS A 152 -2.828 1.544 9.889 1.00 0.00 C ATOM 329 NZ LYS A 152 -3.524 2.667 10.555 1.00 0.00 N ATOM 0 H LYS A 152 -1.301 2.656 4.049 1.00 0.00 H new ATOM 0 HA LYS A 152 -1.405 0.925 6.467 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -2.894 3.249 5.545 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -3.937 1.893 5.924 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -1.702 2.747 7.806 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -3.283 3.502 7.866 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -4.373 1.398 8.391 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -2.929 0.477 8.017 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -3.032 0.615 10.421 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -1.750 1.703 9.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -3.203 2.738 11.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -3.308 3.554 10.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -4.550 2.500 10.536 1.00 0.00 H new ATOM 339 N ASP A 153 -1.980 -1.017 5.118 1.00 0.00 N ATOM 340 CA ASP A 153 -2.432 -2.221 4.440 1.00 0.00 C ATOM 341 C ASP A 153 -3.500 -2.909 5.292 1.00 0.00 C ATOM 342 O ASP A 153 -3.420 -2.904 6.520 1.00 0.00 O ATOM 343 CB ASP A 153 -1.279 -3.206 4.240 1.00 0.00 C ATOM 344 CG ASP A 153 -1.168 -4.296 5.308 1.00 0.00 C ATOM 345 OD1 ASP A 153 -1.337 -3.947 6.496 1.00 0.00 O ATOM 346 OD2 ASP A 153 -0.916 -5.455 4.913 1.00 0.00 O ATOM 0 H ASP A 153 -1.292 -1.175 5.854 1.00 0.00 H new ATOM 0 HA ASP A 153 -2.831 -1.932 3.468 1.00 0.00 H new ATOM 0 HB2 ASP A 153 -1.393 -3.682 3.266 1.00 0.00 H new ATOM 0 HB3 ASP A 153 -0.344 -2.647 4.214 1.00 0.00 H new ATOM 350 N LEU A 154 -4.476 -3.485 4.607 1.00 0.00 N ATOM 351 CA LEU A 154 -5.560 -4.177 5.284 1.00 0.00 C ATOM 352 C LEU A 154 -6.275 -5.094 4.290 1.00 0.00 C ATOM 353 O LEU A 154 -5.750 -5.379 3.215 1.00 0.00 O ATOM 354 CB LEU A 154 -6.488 -3.174 5.972 1.00 0.00 C ATOM 355 CG LEU A 154 -6.805 -1.902 5.183 1.00 0.00 C ATOM 356 CD1 LEU A 154 -5.603 -0.955 5.163 1.00 0.00 C ATOM 357 CD2 LEU A 154 -7.291 -2.239 3.772 1.00 0.00 C ATOM 0 H LEU A 154 -4.539 -3.487 3.589 1.00 0.00 H new ATOM 0 HA LEU A 154 -5.168 -4.812 6.079 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -7.427 -3.677 6.203 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -6.038 -2.886 6.922 1.00 0.00 H new ATOM 0 HG LEU A 154 -7.618 -1.381 5.688 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -5.855 -0.059 4.596 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -5.342 -0.677 6.184 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -4.754 -1.454 4.695 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -7.509 -1.317 3.233 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -6.516 -2.794 3.243 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -8.194 -2.846 3.834 1.00 0.00 H new ATOM 368 N ARG A 155 -7.462 -5.532 4.686 1.00 0.00 N ATOM 369 CA ARG A 155 -8.254 -6.411 3.842 1.00 0.00 C ATOM 370 C ARG A 155 -7.939 -6.157 2.367 1.00 0.00 C ATOM 371 O ARG A 155 -7.852 -5.009 1.937 1.00 0.00 O ATOM 372 CB ARG A 155 -9.750 -6.203 4.082 1.00 0.00 C ATOM 373 CG ARG A 155 -10.242 -4.927 3.394 1.00 0.00 C ATOM 374 CD ARG A 155 -11.606 -4.500 3.941 1.00 0.00 C ATOM 375 NE ARG A 155 -12.686 -5.057 3.096 1.00 0.00 N ATOM 376 CZ ARG A 155 -13.208 -6.281 3.253 1.00 0.00 C ATOM 377 NH1 ARG A 155 -12.751 -7.084 4.224 1.00 0.00 N ATOM 378 NH2 ARG A 155 -14.186 -6.702 2.440 1.00 0.00 N ATOM 0 H ARG A 155 -7.894 -5.295 5.579 1.00 0.00 H new ATOM 0 HA ARG A 155 -7.996 -7.439 4.099 1.00 0.00 H new ATOM 0 HB2 ARG A 155 -10.306 -7.062 3.705 1.00 0.00 H new ATOM 0 HB3 ARG A 155 -9.946 -6.142 5.153 1.00 0.00 H new ATOM 0 HG2 ARG A 155 -9.519 -4.126 3.545 1.00 0.00 H new ATOM 0 HG3 ARG A 155 -10.313 -5.093 2.319 1.00 0.00 H new ATOM 0 HD2 ARG A 155 -11.720 -4.847 4.968 1.00 0.00 H new ATOM 0 HD3 ARG A 155 -11.674 -3.412 3.963 1.00 0.00 H new ATOM 0 HE ARG A 155 -13.056 -4.472 2.347 1.00 0.00 H new ATOM 0 HH11 ARG A 155 -12.006 -6.763 4.843 1.00 0.00 H new ATOM 0 HH12 ARG A 155 -13.148 -8.016 4.344 1.00 0.00 H new ATOM 0 HH21 ARG A 155 -14.534 -6.091 1.701 1.00 0.00 H new ATOM 0 HH22 ARG A 155 -14.583 -7.634 2.560 1.00 0.00 H new ATOM 389 N ASP A 156 -7.777 -7.249 1.633 1.00 0.00 N ATOM 390 CA ASP A 156 -7.474 -7.158 0.215 1.00 0.00 C ATOM 391 C ASP A 156 -5.960 -7.038 0.027 1.00 0.00 C ATOM 392 O ASP A 156 -5.467 -7.061 -1.099 1.00 0.00 O ATOM 393 CB ASP A 156 -8.127 -5.924 -0.410 1.00 0.00 C ATOM 394 CG ASP A 156 -8.359 -6.010 -1.920 1.00 0.00 C ATOM 395 OD1 ASP A 156 -8.633 -7.136 -2.389 1.00 0.00 O ATOM 396 OD2 ASP A 156 -8.256 -4.948 -2.571 1.00 0.00 O ATOM 0 H ASP A 156 -7.850 -8.200 1.994 1.00 0.00 H new ATOM 0 HA ASP A 156 -7.860 -8.055 -0.270 1.00 0.00 H new ATOM 0 HB2 ASP A 156 -9.085 -5.751 0.080 1.00 0.00 H new ATOM 0 HB3 ASP A 156 -7.501 -5.056 -0.203 1.00 0.00 H new ATOM 400 N VAL A 157 -5.266 -6.914 1.149 1.00 0.00 N ATOM 401 CA VAL A 157 -3.818 -6.790 1.123 1.00 0.00 C ATOM 402 C VAL A 157 -3.256 -7.663 -0.001 1.00 0.00 C ATOM 403 O VAL A 157 -2.859 -7.154 -1.048 1.00 0.00 O ATOM 404 CB VAL A 157 -3.238 -7.137 2.496 1.00 0.00 C ATOM 405 CG1 VAL A 157 -2.877 -5.871 3.274 1.00 0.00 C ATOM 406 CG2 VAL A 157 -4.205 -8.013 3.294 1.00 0.00 C ATOM 0 H VAL A 157 -5.679 -6.897 2.081 1.00 0.00 H new ATOM 0 HA VAL A 157 -3.527 -5.761 0.913 1.00 0.00 H new ATOM 0 HB VAL A 157 -2.322 -7.706 2.338 1.00 0.00 H new ATOM 0 HG11 VAL A 157 -2.467 -6.146 4.246 1.00 0.00 H new ATOM 0 HG12 VAL A 157 -2.135 -5.300 2.716 1.00 0.00 H new ATOM 0 HG13 VAL A 157 -3.771 -5.264 3.416 1.00 0.00 H new ATOM 0 HG21 VAL A 157 -3.769 -8.245 4.265 1.00 0.00 H new ATOM 0 HG22 VAL A 157 -5.145 -7.480 3.437 1.00 0.00 H new ATOM 0 HG23 VAL A 157 -4.391 -8.939 2.749 1.00 0.00 H new ATOM 416 N GLY A 158 -3.241 -8.963 0.254 1.00 0.00 N ATOM 417 CA GLY A 158 -2.735 -9.911 -0.723 1.00 0.00 C ATOM 418 C GLY A 158 -1.548 -9.327 -1.490 1.00 0.00 C ATOM 419 O GLY A 158 -0.528 -8.982 -0.895 1.00 0.00 O ATOM 0 H GLY A 158 -3.571 -9.382 1.123 1.00 0.00 H new ATOM 0 HA2 GLY A 158 -2.431 -10.829 -0.220 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -3.528 -10.177 -1.421 1.00 0.00 H new ATOM 423 N ASP A 159 -1.719 -9.233 -2.801 1.00 0.00 N ATOM 424 CA ASP A 159 -0.674 -8.695 -3.656 1.00 0.00 C ATOM 425 C ASP A 159 -0.482 -7.210 -3.348 1.00 0.00 C ATOM 426 O ASP A 159 0.605 -6.788 -2.957 1.00 0.00 O ATOM 427 CB ASP A 159 -1.049 -8.827 -5.134 1.00 0.00 C ATOM 428 CG ASP A 159 -0.839 -10.219 -5.732 1.00 0.00 C ATOM 429 OD1 ASP A 159 0.316 -10.692 -5.677 1.00 0.00 O ATOM 430 OD2 ASP A 159 -1.839 -10.778 -6.233 1.00 0.00 O ATOM 0 H ASP A 159 -2.566 -9.520 -3.292 1.00 0.00 H new ATOM 0 HA ASP A 159 0.240 -9.257 -3.464 1.00 0.00 H new ATOM 0 HB2 ASP A 159 -2.097 -8.551 -5.254 1.00 0.00 H new ATOM 0 HB3 ASP A 159 -0.463 -8.109 -5.708 1.00 0.00 H new ATOM 434 N TRP A 160 -1.555 -6.456 -3.534 1.00 0.00 N ATOM 435 CA TRP A 160 -1.519 -5.026 -3.281 1.00 0.00 C ATOM 436 C TRP A 160 -0.606 -4.781 -2.078 1.00 0.00 C ATOM 437 O TRP A 160 0.121 -3.791 -2.036 1.00 0.00 O ATOM 438 CB TRP A 160 -2.930 -4.467 -3.083 1.00 0.00 C ATOM 439 CG TRP A 160 -3.151 -3.802 -1.723 1.00 0.00 C ATOM 440 CD1 TRP A 160 -3.869 -4.260 -0.688 1.00 0.00 C ATOM 441 CD2 TRP A 160 -2.619 -2.533 -1.291 1.00 0.00 C ATOM 442 NE1 TRP A 160 -3.838 -3.381 0.376 1.00 0.00 N ATOM 443 CE2 TRP A 160 -3.054 -2.298 -0.002 1.00 0.00 C ATOM 444 CE3 TRP A 160 -1.797 -1.613 -1.966 1.00 0.00 C ATOM 445 CZ2 TRP A 160 -2.719 -1.148 0.722 1.00 0.00 C ATOM 446 CZ3 TRP A 160 -1.471 -0.469 -1.228 1.00 0.00 C ATOM 447 CH2 TRP A 160 -1.901 -0.217 0.070 1.00 0.00 C ATOM 0 H TRP A 160 -2.456 -6.809 -3.857 1.00 0.00 H new ATOM 0 HA TRP A 160 -1.113 -4.494 -4.141 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -3.135 -3.740 -3.869 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -3.650 -5.276 -3.201 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -4.404 -5.198 -0.687 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -4.305 -3.504 1.275 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -1.445 -1.776 -2.974 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -3.073 -0.987 1.730 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -0.841 0.270 -1.700 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -1.606 0.692 0.573 1.00 0.00 H new ATOM 457 N ARG A 161 -0.674 -5.703 -1.127 1.00 0.00 N ATOM 458 CA ARG A 161 0.138 -5.600 0.073 1.00 0.00 C ATOM 459 C ARG A 161 1.602 -5.904 -0.248 1.00 0.00 C ATOM 460 O ARG A 161 2.420 -4.992 -0.357 1.00 0.00 O ATOM 461 CB ARG A 161 -0.351 -6.568 1.153 1.00 0.00 C ATOM 462 CG ARG A 161 0.425 -6.373 2.456 1.00 0.00 C ATOM 463 CD ARG A 161 0.068 -7.458 3.475 1.00 0.00 C ATOM 464 NE ARG A 161 0.964 -7.364 4.649 1.00 0.00 N ATOM 465 CZ ARG A 161 1.223 -8.383 5.480 1.00 0.00 C ATOM 466 NH1 ARG A 161 0.656 -9.579 5.271 1.00 0.00 N ATOM 467 NH2 ARG A 161 2.049 -8.206 6.521 1.00 0.00 N ATOM 0 H ARG A 161 -1.279 -6.524 -1.164 1.00 0.00 H new ATOM 0 HA ARG A 161 0.049 -4.580 0.447 1.00 0.00 H new ATOM 0 HB2 ARG A 161 -1.415 -6.411 1.332 1.00 0.00 H new ATOM 0 HB3 ARG A 161 -0.234 -7.595 0.806 1.00 0.00 H new ATOM 0 HG2 ARG A 161 1.496 -6.398 2.253 1.00 0.00 H new ATOM 0 HG3 ARG A 161 0.202 -5.391 2.872 1.00 0.00 H new ATOM 0 HD2 ARG A 161 -0.970 -7.346 3.789 1.00 0.00 H new ATOM 0 HD3 ARG A 161 0.158 -8.443 3.017 1.00 0.00 H new ATOM 0 HE ARG A 161 1.413 -6.468 4.838 1.00 0.00 H new ATOM 0 HH11 ARG A 161 0.027 -9.714 4.479 1.00 0.00 H new ATOM 0 HH12 ARG A 161 0.853 -10.354 5.904 1.00 0.00 H new ATOM 0 HH21 ARG A 161 2.480 -7.296 6.681 1.00 0.00 H new ATOM 0 HH22 ARG A 161 2.246 -8.982 7.153 1.00 0.00 H new ATOM 478 N LYS A 162 1.889 -7.190 -0.392 1.00 0.00 N ATOM 479 CA LYS A 162 3.241 -7.625 -0.699 1.00 0.00 C ATOM 480 C LYS A 162 3.939 -6.554 -1.541 1.00 0.00 C ATOM 481 O LYS A 162 5.122 -6.282 -1.347 1.00 0.00 O ATOM 482 CB LYS A 162 3.222 -9.008 -1.354 1.00 0.00 C ATOM 483 CG LYS A 162 4.612 -9.647 -1.325 1.00 0.00 C ATOM 484 CD LYS A 162 5.433 -9.230 -2.549 1.00 0.00 C ATOM 485 CE LYS A 162 6.704 -10.073 -2.668 1.00 0.00 C ATOM 486 NZ LYS A 162 7.398 -9.785 -3.943 1.00 0.00 N ATOM 0 H LYS A 162 1.208 -7.944 -0.302 1.00 0.00 H new ATOM 0 HA LYS A 162 3.822 -7.739 0.216 1.00 0.00 H new ATOM 0 HB2 LYS A 162 2.511 -9.651 -0.834 1.00 0.00 H new ATOM 0 HB3 LYS A 162 2.879 -8.921 -2.385 1.00 0.00 H new ATOM 0 HG2 LYS A 162 5.133 -9.351 -0.415 1.00 0.00 H new ATOM 0 HG3 LYS A 162 4.517 -10.733 -1.299 1.00 0.00 H new ATOM 0 HD2 LYS A 162 4.831 -9.343 -3.451 1.00 0.00 H new ATOM 0 HD3 LYS A 162 5.697 -8.175 -2.472 1.00 0.00 H new ATOM 0 HE2 LYS A 162 7.368 -9.862 -1.830 1.00 0.00 H new ATOM 0 HE3 LYS A 162 6.452 -11.132 -2.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 162 8.259 -10.365 -4.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 162 6.768 -10.009 -4.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 162 7.656 -8.778 -3.978 1.00 0.00 H new ATOM 496 N ASN A 163 3.175 -5.977 -2.456 1.00 0.00 N ATOM 497 CA ASN A 163 3.704 -4.942 -3.328 1.00 0.00 C ATOM 498 C ASN A 163 4.158 -3.752 -2.482 1.00 0.00 C ATOM 499 O ASN A 163 5.354 -3.547 -2.283 1.00 0.00 O ATOM 500 CB ASN A 163 2.638 -4.448 -4.307 1.00 0.00 C ATOM 501 CG ASN A 163 2.536 -5.374 -5.522 1.00 0.00 C ATOM 502 OD1 ASN A 163 2.947 -5.044 -6.621 1.00 0.00 O ATOM 503 ND2 ASN A 163 1.966 -6.547 -5.260 1.00 0.00 N ATOM 0 H ASN A 163 2.194 -6.206 -2.613 1.00 0.00 H new ATOM 0 HA ASN A 163 4.537 -5.366 -3.888 1.00 0.00 H new ATOM 0 HB2 ASN A 163 1.673 -4.396 -3.803 1.00 0.00 H new ATOM 0 HB3 ASN A 163 2.881 -3.437 -4.635 1.00 0.00 H new ATOM 0 HD21 ASN A 163 1.851 -7.236 -6.004 1.00 0.00 H new ATOM 0 HD22 ASN A 163 1.644 -6.758 -4.315 1.00 0.00 H new ATOM 509 N ILE A 164 3.179 -2.997 -2.007 1.00 0.00 N ATOM 510 CA ILE A 164 3.462 -1.831 -1.186 1.00 0.00 C ATOM 511 C ILE A 164 4.302 -2.254 0.020 1.00 0.00 C ATOM 512 O ILE A 164 5.317 -1.629 0.323 1.00 0.00 O ATOM 513 CB ILE A 164 2.164 -1.112 -0.810 1.00 0.00 C ATOM 514 CG1 ILE A 164 1.127 -2.099 -0.270 1.00 0.00 C ATOM 515 CG2 ILE A 164 1.625 -0.302 -1.991 1.00 0.00 C ATOM 516 CD1 ILE A 164 0.886 -1.877 1.224 1.00 0.00 C ATOM 0 H ILE A 164 2.188 -3.170 -2.175 1.00 0.00 H new ATOM 0 HA ILE A 164 4.051 -1.105 -1.746 1.00 0.00 H new ATOM 0 HB ILE A 164 2.383 -0.406 -0.009 1.00 0.00 H new ATOM 0 HG12 ILE A 164 0.190 -1.982 -0.815 1.00 0.00 H new ATOM 0 HG13 ILE A 164 1.469 -3.120 -0.439 1.00 0.00 H new ATOM 0 HG21 ILE A 164 0.702 0.199 -1.698 1.00 0.00 H new ATOM 0 HG22 ILE A 164 2.363 0.442 -2.289 1.00 0.00 H new ATOM 0 HG23 ILE A 164 1.425 -0.970 -2.829 1.00 0.00 H new ATOM 0 HD11 ILE A 164 0.145 -2.591 1.583 1.00 0.00 H new ATOM 0 HD12 ILE A 164 1.820 -2.019 1.768 1.00 0.00 H new ATOM 0 HD13 ILE A 164 0.521 -0.863 1.387 1.00 0.00 H new ATOM 527 N GLU A 165 3.849 -3.314 0.674 1.00 0.00 N ATOM 528 CA GLU A 165 4.546 -3.828 1.841 1.00 0.00 C ATOM 529 C GLU A 165 6.059 -3.770 1.622 1.00 0.00 C ATOM 530 O GLU A 165 6.794 -3.258 2.467 1.00 0.00 O ATOM 531 CB GLU A 165 4.093 -5.252 2.167 1.00 0.00 C ATOM 532 CG GLU A 165 3.904 -5.435 3.675 1.00 0.00 C ATOM 533 CD GLU A 165 4.672 -6.658 4.179 1.00 0.00 C ATOM 534 OE1 GLU A 165 5.848 -6.796 3.775 1.00 0.00 O ATOM 535 OE2 GLU A 165 4.067 -7.428 4.956 1.00 0.00 O ATOM 0 H GLU A 165 3.008 -3.831 0.418 1.00 0.00 H new ATOM 0 HA GLU A 165 4.297 -3.199 2.696 1.00 0.00 H new ATOM 0 HB2 GLU A 165 3.157 -5.467 1.651 1.00 0.00 H new ATOM 0 HB3 GLU A 165 4.831 -5.965 1.800 1.00 0.00 H new ATOM 0 HG2 GLU A 165 4.248 -4.543 4.199 1.00 0.00 H new ATOM 0 HG3 GLU A 165 2.844 -5.548 3.901 1.00 0.00 H new ATOM 540 N GLU A 166 6.482 -4.303 0.485 1.00 0.00 N ATOM 541 CA GLU A 166 7.894 -4.319 0.144 1.00 0.00 C ATOM 542 C GLU A 166 8.283 -3.022 -0.567 1.00 0.00 C ATOM 543 O GLU A 166 8.914 -2.149 0.027 1.00 0.00 O ATOM 544 CB GLU A 166 8.237 -5.539 -0.712 1.00 0.00 C ATOM 545 CG GLU A 166 8.081 -6.833 0.089 1.00 0.00 C ATOM 546 CD GLU A 166 9.402 -7.601 0.153 1.00 0.00 C ATOM 547 OE1 GLU A 166 9.991 -7.810 -0.930 1.00 0.00 O ATOM 548 OE2 GLU A 166 9.794 -7.965 1.284 1.00 0.00 O ATOM 0 H GLU A 166 5.871 -4.727 -0.212 1.00 0.00 H new ATOM 0 HA GLU A 166 8.470 -4.391 1.066 1.00 0.00 H new ATOM 0 HB2 GLU A 166 7.587 -5.568 -1.587 1.00 0.00 H new ATOM 0 HB3 GLU A 166 9.260 -5.455 -1.078 1.00 0.00 H new ATOM 0 HG2 GLU A 166 7.742 -6.601 1.099 1.00 0.00 H new ATOM 0 HG3 GLU A 166 7.315 -7.458 -0.369 1.00 0.00 H new ATOM 553 N LYS A 167 7.891 -2.937 -1.830 1.00 0.00 N ATOM 554 CA LYS A 167 8.191 -1.761 -2.630 1.00 0.00 C ATOM 555 C LYS A 167 7.989 -0.506 -1.778 1.00 0.00 C ATOM 556 O LYS A 167 8.922 0.271 -1.581 1.00 0.00 O ATOM 557 CB LYS A 167 7.369 -1.767 -3.920 1.00 0.00 C ATOM 558 CG LYS A 167 6.578 -0.466 -4.072 1.00 0.00 C ATOM 559 CD LYS A 167 6.015 -0.329 -5.488 1.00 0.00 C ATOM 560 CE LYS A 167 6.087 1.121 -5.969 1.00 0.00 C ATOM 561 NZ LYS A 167 5.530 1.243 -7.335 1.00 0.00 N ATOM 0 H LYS A 167 7.368 -3.663 -2.319 1.00 0.00 H new ATOM 0 HA LYS A 167 9.235 -1.770 -2.944 1.00 0.00 H new ATOM 0 HB2 LYS A 167 8.031 -1.897 -4.776 1.00 0.00 H new ATOM 0 HB3 LYS A 167 6.684 -2.615 -3.915 1.00 0.00 H new ATOM 0 HG2 LYS A 167 5.763 -0.445 -3.349 1.00 0.00 H new ATOM 0 HG3 LYS A 167 7.223 0.384 -3.849 1.00 0.00 H new ATOM 0 HD2 LYS A 167 6.575 -0.970 -6.169 1.00 0.00 H new ATOM 0 HD3 LYS A 167 4.980 -0.671 -5.506 1.00 0.00 H new ATOM 0 HE2 LYS A 167 5.533 1.765 -5.285 1.00 0.00 H new ATOM 0 HE3 LYS A 167 7.122 1.462 -5.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 167 5.587 2.234 -7.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 167 6.075 0.644 -7.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 167 4.536 0.937 -7.333 1.00 0.00 H new ATOM 571 N SER A 168 6.766 -0.347 -1.295 1.00 0.00 N ATOM 572 CA SER A 168 6.430 0.801 -0.470 1.00 0.00 C ATOM 573 C SER A 168 6.884 0.559 0.971 1.00 0.00 C ATOM 574 O SER A 168 6.078 0.621 1.898 1.00 0.00 O ATOM 575 CB SER A 168 4.928 1.089 -0.512 1.00 0.00 C ATOM 576 OG SER A 168 4.418 1.063 -1.842 1.00 0.00 O ATOM 0 H SER A 168 5.995 -0.994 -1.459 1.00 0.00 H new ATOM 0 HA SER A 168 6.950 1.672 -0.867 1.00 0.00 H new ATOM 0 HB2 SER A 168 4.400 0.352 0.093 1.00 0.00 H new ATOM 0 HB3 SER A 168 4.733 2.065 -0.068 1.00 0.00 H new ATOM 0 HG SER A 168 3.878 1.865 -2.001 1.00 0.00 H new ATOM 581 N GLY A 169 8.173 0.288 1.115 1.00 0.00 N ATOM 582 CA GLY A 169 8.743 0.037 2.428 1.00 0.00 C ATOM 583 C GLY A 169 10.241 -0.262 2.326 1.00 0.00 C ATOM 584 O GLY A 169 11.069 0.583 2.663 1.00 0.00 O ATOM 0 H GLY A 169 8.839 0.237 0.344 1.00 0.00 H new ATOM 0 HA2 GLY A 169 8.584 0.904 3.069 1.00 0.00 H new ATOM 0 HA3 GLY A 169 8.231 -0.804 2.896 1.00 0.00 H new ATOM 588 N MET A 170 10.542 -1.465 1.862 1.00 0.00 N ATOM 589 CA MET A 170 11.925 -1.885 1.713 1.00 0.00 C ATOM 590 C MET A 170 12.758 -0.798 1.030 1.00 0.00 C ATOM 591 O MET A 170 13.921 -0.596 1.373 1.00 0.00 O ATOM 592 CB MET A 170 11.982 -3.169 0.882 1.00 0.00 C ATOM 593 CG MET A 170 13.429 -3.609 0.652 1.00 0.00 C ATOM 594 SD MET A 170 13.658 -5.281 1.233 1.00 0.00 S ATOM 595 CE MET A 170 15.210 -5.099 2.096 1.00 0.00 C ATOM 0 H MET A 170 9.852 -2.163 1.584 1.00 0.00 H new ATOM 0 HA MET A 170 12.339 -2.064 2.705 1.00 0.00 H new ATOM 0 HB2 MET A 170 11.434 -3.961 1.392 1.00 0.00 H new ATOM 0 HB3 MET A 170 11.490 -3.008 -0.077 1.00 0.00 H new ATOM 0 HG2 MET A 170 13.672 -3.547 -0.409 1.00 0.00 H new ATOM 0 HG3 MET A 170 14.110 -2.937 1.175 1.00 0.00 H new ATOM 0 HE1 MET A 170 15.223 -5.759 2.964 1.00 0.00 H new ATOM 0 HE2 MET A 170 16.031 -5.361 1.428 1.00 0.00 H new ATOM 0 HE3 MET A 170 15.325 -4.066 2.424 1.00 0.00 H new ATOM 603 N GLU A 171 12.128 -0.128 0.076 1.00 0.00 N ATOM 604 CA GLU A 171 12.797 0.934 -0.658 1.00 0.00 C ATOM 605 C GLU A 171 13.295 2.013 0.306 1.00 0.00 C ATOM 606 O GLU A 171 14.466 2.025 0.679 1.00 0.00 O ATOM 607 CB GLU A 171 11.874 1.531 -1.721 1.00 0.00 C ATOM 608 CG GLU A 171 12.048 0.817 -3.063 1.00 0.00 C ATOM 609 CD GLU A 171 13.281 1.338 -3.805 1.00 0.00 C ATOM 610 OE1 GLU A 171 13.174 2.445 -4.375 1.00 0.00 O ATOM 611 OE2 GLU A 171 14.301 0.617 -3.784 1.00 0.00 O ATOM 0 H GLU A 171 11.163 -0.299 -0.206 1.00 0.00 H new ATOM 0 HA GLU A 171 13.659 0.508 -1.171 1.00 0.00 H new ATOM 0 HB2 GLU A 171 10.837 1.450 -1.394 1.00 0.00 H new ATOM 0 HB3 GLU A 171 12.089 2.593 -1.840 1.00 0.00 H new ATOM 0 HG2 GLU A 171 12.145 -0.256 -2.898 1.00 0.00 H new ATOM 0 HG3 GLU A 171 11.160 0.967 -3.677 1.00 0.00 H new ATOM 616 N GLY A 172 12.378 2.894 0.680 1.00 0.00 N ATOM 617 CA GLY A 172 12.709 3.975 1.593 1.00 0.00 C ATOM 618 C GLY A 172 13.711 3.512 2.652 1.00 0.00 C ATOM 619 O GLY A 172 14.646 4.237 2.987 1.00 0.00 O ATOM 0 H GLY A 172 11.407 2.881 0.368 1.00 0.00 H new ATOM 0 HA2 GLY A 172 13.126 4.813 1.034 1.00 0.00 H new ATOM 0 HA3 GLY A 172 11.802 4.336 2.079 1.00 0.00 H new ATOM 623 N ARG A 173 13.482 2.305 3.150 1.00 0.00 N ATOM 624 CA ARG A 173 14.353 1.737 4.164 1.00 0.00 C ATOM 625 C ARG A 173 15.811 1.786 3.701 1.00 0.00 C ATOM 626 O ARG A 173 16.643 2.440 4.328 1.00 0.00 O ATOM 627 CB ARG A 173 13.971 0.286 4.468 1.00 0.00 C ATOM 628 CG ARG A 173 13.089 0.201 5.715 1.00 0.00 C ATOM 629 CD ARG A 173 13.352 -1.094 6.486 1.00 0.00 C ATOM 630 NE ARG A 173 13.123 -0.878 7.931 1.00 0.00 N ATOM 631 CZ ARG A 173 12.984 -1.866 8.826 1.00 0.00 C ATOM 632 NH1 ARG A 173 13.047 -3.143 8.428 1.00 0.00 N ATOM 633 NH2 ARG A 173 12.779 -1.576 10.118 1.00 0.00 N ATOM 0 H ARG A 173 12.706 1.705 2.870 1.00 0.00 H new ATOM 0 HA ARG A 173 14.236 2.330 5.071 1.00 0.00 H new ATOM 0 HB2 ARG A 173 13.443 -0.141 3.615 1.00 0.00 H new ATOM 0 HB3 ARG A 173 14.873 -0.308 4.615 1.00 0.00 H new ATOM 0 HG2 ARG A 173 13.282 1.058 6.360 1.00 0.00 H new ATOM 0 HG3 ARG A 173 12.039 0.249 5.426 1.00 0.00 H new ATOM 0 HD2 ARG A 173 12.697 -1.884 6.120 1.00 0.00 H new ATOM 0 HD3 ARG A 173 14.377 -1.426 6.317 1.00 0.00 H new ATOM 0 HE ARG A 173 13.067 0.083 8.268 1.00 0.00 H new ATOM 0 HH11 ARG A 173 13.201 -3.364 7.444 1.00 0.00 H new ATOM 0 HH12 ARG A 173 12.941 -3.895 9.109 1.00 0.00 H new ATOM 0 HH21 ARG A 173 12.729 -0.603 10.421 1.00 0.00 H new ATOM 0 HH22 ARG A 173 12.673 -2.328 10.799 1.00 0.00 H new ATOM 644 N LYS A 174 16.074 1.088 2.606 1.00 0.00 N ATOM 645 CA LYS A 174 17.416 1.045 2.051 1.00 0.00 C ATOM 646 C LYS A 174 17.845 2.459 1.652 1.00 0.00 C ATOM 647 O LYS A 174 19.033 2.725 1.477 1.00 0.00 O ATOM 648 CB LYS A 174 17.491 0.033 0.906 1.00 0.00 C ATOM 649 CG LYS A 174 16.756 -1.259 1.268 1.00 0.00 C ATOM 650 CD LYS A 174 17.709 -2.455 1.253 1.00 0.00 C ATOM 651 CE LYS A 174 17.622 -3.208 -0.076 1.00 0.00 C ATOM 652 NZ LYS A 174 18.687 -4.232 -0.162 1.00 0.00 N ATOM 0 H LYS A 174 15.381 0.548 2.088 1.00 0.00 H new ATOM 0 HA LYS A 174 18.126 0.696 2.800 1.00 0.00 H new ATOM 0 HB2 LYS A 174 17.054 0.464 0.005 1.00 0.00 H new ATOM 0 HB3 LYS A 174 18.534 -0.189 0.679 1.00 0.00 H new ATOM 0 HG2 LYS A 174 16.306 -1.161 2.256 1.00 0.00 H new ATOM 0 HG3 LYS A 174 15.943 -1.429 0.562 1.00 0.00 H new ATOM 0 HD2 LYS A 174 18.731 -2.112 1.415 1.00 0.00 H new ATOM 0 HD3 LYS A 174 17.465 -3.129 2.074 1.00 0.00 H new ATOM 0 HE2 LYS A 174 16.645 -3.682 -0.169 1.00 0.00 H new ATOM 0 HE3 LYS A 174 17.716 -2.507 -0.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 174 18.614 -4.734 -1.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 174 19.617 -3.772 -0.095 1.00 0.00 H new ATOM 0 HZ3 LYS A 174 18.580 -4.911 0.618 1.00 0.00 H new ATOM 662 N LYS A 175 16.853 3.327 1.519 1.00 0.00 N ATOM 663 CA LYS A 175 17.112 4.707 1.143 1.00 0.00 C ATOM 664 C LYS A 175 17.358 5.537 2.405 1.00 0.00 C ATOM 665 O LYS A 175 17.786 6.687 2.322 1.00 0.00 O ATOM 666 CB LYS A 175 15.980 5.244 0.265 1.00 0.00 C ATOM 667 CG LYS A 175 16.304 5.061 -1.218 1.00 0.00 C ATOM 668 CD LYS A 175 15.367 4.036 -1.862 1.00 0.00 C ATOM 669 CE LYS A 175 15.783 2.609 -1.499 1.00 0.00 C ATOM 670 NZ LYS A 175 16.758 2.088 -2.485 1.00 0.00 N ATOM 0 H LYS A 175 15.869 3.102 1.665 1.00 0.00 H new ATOM 0 HA LYS A 175 18.015 4.774 0.536 1.00 0.00 H new ATOM 0 HB2 LYS A 175 15.052 4.726 0.505 1.00 0.00 H new ATOM 0 HB3 LYS A 175 15.819 6.301 0.478 1.00 0.00 H new ATOM 0 HG2 LYS A 175 16.213 6.017 -1.734 1.00 0.00 H new ATOM 0 HG3 LYS A 175 17.338 4.735 -1.330 1.00 0.00 H new ATOM 0 HD2 LYS A 175 14.344 4.215 -1.532 1.00 0.00 H new ATOM 0 HD3 LYS A 175 15.378 4.158 -2.945 1.00 0.00 H new ATOM 0 HE2 LYS A 175 16.222 2.594 -0.501 1.00 0.00 H new ATOM 0 HE3 LYS A 175 14.905 1.964 -1.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 175 17.494 1.544 -1.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 175 16.269 1.472 -3.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 175 17.197 2.883 -2.992 1.00 0.00 H new ATOM 680 N MET A 176 17.077 4.921 3.545 1.00 0.00 N ATOM 681 CA MET A 176 17.262 5.589 4.822 1.00 0.00 C ATOM 682 C MET A 176 18.582 5.168 5.473 1.00 0.00 C ATOM 683 O MET A 176 19.304 6.004 6.015 1.00 0.00 O ATOM 684 CB MET A 176 16.099 5.241 5.753 1.00 0.00 C ATOM 685 CG MET A 176 16.510 4.172 6.769 1.00 0.00 C ATOM 686 SD MET A 176 15.153 3.827 7.874 1.00 0.00 S ATOM 687 CE MET A 176 15.321 5.193 9.009 1.00 0.00 C ATOM 0 H MET A 176 16.723 3.967 3.610 1.00 0.00 H new ATOM 0 HA MET A 176 17.290 6.665 4.649 1.00 0.00 H new ATOM 0 HB2 MET A 176 15.767 6.137 6.277 1.00 0.00 H new ATOM 0 HB3 MET A 176 15.253 4.884 5.166 1.00 0.00 H new ATOM 0 HG2 MET A 176 16.808 3.261 6.250 1.00 0.00 H new ATOM 0 HG3 MET A 176 17.375 4.513 7.338 1.00 0.00 H new ATOM 0 HE1 MET A 176 15.681 4.825 9.970 1.00 0.00 H new ATOM 0 HE2 MET A 176 16.032 5.915 8.607 1.00 0.00 H new ATOM 0 HE3 MET A 176 14.353 5.675 9.144 1.00 0.00 H new ATOM 695 N PHE A 177 18.856 3.875 5.398 1.00 0.00 N ATOM 696 CA PHE A 177 20.076 3.334 5.973 1.00 0.00 C ATOM 697 C PHE A 177 20.985 2.754 4.888 1.00 0.00 C ATOM 698 O PHE A 177 22.189 2.610 5.093 1.00 0.00 O ATOM 699 CB PHE A 177 19.661 2.212 6.927 1.00 0.00 C ATOM 700 CG PHE A 177 19.749 0.813 6.317 1.00 0.00 C ATOM 701 CD1 PHE A 177 19.075 0.527 5.171 1.00 0.00 C ATOM 702 CD2 PHE A 177 20.501 -0.147 6.920 1.00 0.00 C ATOM 703 CE1 PHE A 177 19.156 -0.772 4.604 1.00 0.00 C ATOM 704 CE2 PHE A 177 20.583 -1.446 6.353 1.00 0.00 C ATOM 705 CZ PHE A 177 19.908 -1.732 5.207 1.00 0.00 C ATOM 0 H PHE A 177 18.254 3.185 4.948 1.00 0.00 H new ATOM 0 HA PHE A 177 20.626 4.123 6.486 1.00 0.00 H new ATOM 0 HB2 PHE A 177 20.293 2.251 7.814 1.00 0.00 H new ATOM 0 HB3 PHE A 177 18.637 2.390 7.257 1.00 0.00 H new ATOM 0 HD1 PHE A 177 18.478 1.289 4.692 1.00 0.00 H new ATOM 0 HD2 PHE A 177 21.036 0.079 7.831 1.00 0.00 H new ATOM 0 HE1 PHE A 177 18.621 -0.998 3.694 1.00 0.00 H new ATOM 0 HE2 PHE A 177 21.181 -2.207 6.832 1.00 0.00 H new ATOM 0 HZ PHE A 177 19.969 -2.720 4.776 1.00 0.00 H new ATOM 714 N GLU A 178 20.373 2.438 3.756 1.00 0.00 N ATOM 715 CA GLU A 178 21.112 1.878 2.638 1.00 0.00 C ATOM 716 C GLU A 178 22.308 1.068 3.143 1.00 0.00 C ATOM 717 O GLU A 178 23.405 1.605 3.298 1.00 0.00 O ATOM 718 CB GLU A 178 21.563 2.976 1.672 1.00 0.00 C ATOM 719 CG GLU A 178 21.450 2.509 0.220 1.00 0.00 C ATOM 720 CD GLU A 178 21.431 3.701 -0.739 1.00 0.00 C ATOM 721 OE1 GLU A 178 20.486 4.510 -0.620 1.00 0.00 O ATOM 722 OE2 GLU A 178 22.362 3.776 -1.571 1.00 0.00 O ATOM 0 H GLU A 178 19.374 2.559 3.589 1.00 0.00 H new ATOM 0 HA GLU A 178 20.449 1.208 2.091 1.00 0.00 H new ATOM 0 HB2 GLU A 178 20.954 3.868 1.819 1.00 0.00 H new ATOM 0 HB3 GLU A 178 22.594 3.255 1.889 1.00 0.00 H new ATOM 0 HG2 GLU A 178 22.289 1.856 -0.022 1.00 0.00 H new ATOM 0 HG3 GLU A 178 20.541 1.921 0.093 1.00 0.00 H new ATOM 727 N ALA A 179 22.056 -0.210 3.388 1.00 0.00 N ATOM 728 CA ALA A 179 23.098 -1.097 3.873 1.00 0.00 C ATOM 729 C ALA A 179 22.809 -2.523 3.398 1.00 0.00 C ATOM 730 O ALA A 179 21.943 -3.201 3.948 1.00 0.00 O ATOM 731 CB ALA A 179 23.186 -0.997 5.397 1.00 0.00 C ATOM 0 H ALA A 179 21.145 -0.651 3.259 1.00 0.00 H new ATOM 0 HA ALA A 179 24.068 -0.805 3.471 1.00 0.00 H new ATOM 0 HB1 ALA A 179 23.968 -1.663 5.761 1.00 0.00 H new ATOM 0 HB2 ALA A 179 23.421 0.029 5.681 1.00 0.00 H new ATOM 0 HB3 ALA A 179 22.231 -1.285 5.836 1.00 0.00 H new ATOM 737 N GLY A 180 23.553 -2.936 2.381 1.00 0.00 N ATOM 738 CA GLY A 180 23.387 -4.268 1.826 1.00 0.00 C ATOM 739 C GLY A 180 24.689 -4.766 1.197 1.00 0.00 C ATOM 740 O GLY A 180 25.432 -3.987 0.601 1.00 0.00 O ATOM 0 H GLY A 180 24.271 -2.371 1.928 1.00 0.00 H new ATOM 0 HA2 GLY A 180 23.072 -4.956 2.610 1.00 0.00 H new ATOM 0 HA3 GLY A 180 22.597 -4.257 1.075 1.00 0.00 H new ATOM 744 N GLU A 181 24.927 -6.061 1.349 1.00 0.00 N ATOM 745 CA GLU A 181 26.127 -6.671 0.802 1.00 0.00 C ATOM 746 C GLU A 181 25.924 -8.177 0.628 1.00 0.00 C ATOM 747 O GLU A 181 26.022 -8.936 1.592 1.00 0.00 O ATOM 748 CB GLU A 181 27.341 -6.379 1.686 1.00 0.00 C ATOM 749 CG GLU A 181 28.644 -6.545 0.900 1.00 0.00 C ATOM 750 CD GLU A 181 29.618 -7.463 1.640 1.00 0.00 C ATOM 751 OE1 GLU A 181 29.522 -8.690 1.417 1.00 0.00 O ATOM 752 OE2 GLU A 181 30.436 -6.918 2.413 1.00 0.00 O ATOM 0 H GLU A 181 24.309 -6.704 1.843 1.00 0.00 H new ATOM 0 HA GLU A 181 26.319 -6.235 -0.178 1.00 0.00 H new ATOM 0 HB2 GLU A 181 27.275 -5.364 2.077 1.00 0.00 H new ATOM 0 HB3 GLU A 181 27.341 -7.052 2.544 1.00 0.00 H new ATOM 0 HG2 GLU A 181 28.428 -6.957 -0.086 1.00 0.00 H new ATOM 0 HG3 GLU A 181 29.105 -5.570 0.744 1.00 0.00 H new ATOM 757 N SER A 182 25.645 -8.566 -0.607 1.00 0.00 N ATOM 758 CA SER A 182 25.427 -9.968 -0.919 1.00 0.00 C ATOM 759 C SER A 182 26.673 -10.556 -1.584 1.00 0.00 C ATOM 760 O SER A 182 27.498 -9.820 -2.125 1.00 0.00 O ATOM 761 CB SER A 182 24.207 -10.149 -1.824 1.00 0.00 C ATOM 762 OG SER A 182 24.471 -9.742 -3.164 1.00 0.00 O ATOM 0 H SER A 182 25.565 -7.934 -1.404 1.00 0.00 H new ATOM 0 HA SER A 182 25.235 -10.499 0.013 1.00 0.00 H new ATOM 0 HB2 SER A 182 23.902 -11.195 -1.816 1.00 0.00 H new ATOM 0 HB3 SER A 182 23.372 -9.571 -1.427 1.00 0.00 H new ATOM 0 HG SER A 182 23.668 -9.875 -3.710 1.00 0.00 H new TER 767 SER A 182