USER MOD reduce.3.24.130724 H: found=0, std=0, add=447, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 448 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 Set 1.1: A 171 ASN : amide:sc= 0 K(o=-0.79,f=-3.9) USER MOD Set 1.2: A 181 MET CE :methyl 158:sc= -0.794 (180deg=-2.66) USER MOD Single : A 135 CYS SG : rot 180:sc= 0 USER MOD Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= -1.12! C(o=-1.1!,f=-2!) USER MOD Single : A 146 ASN : amide:sc= -0.98 K(o=-0.98,f=-1.9!) USER MOD Single : A 154 LYS NZ :NH3+ -157:sc= 0.999 (180deg=-0.715!) USER MOD Single : A 155 LYS NZ :NH3+ -164:sc= -0.0235 (180deg=-0.32) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 GLN : amide:sc= -0.0393 K(o=-0.039,f=-0.68) USER MOD Single : A 175 SER OG : rot -40:sc= 0.575 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 TYR OH : rot 180:sc= 0 USER MOD Single : A 189 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 135 1.086 0.039 0.322 1.00 0.00 N ATOM 2 CA CYS A 135 1.888 0.015 -0.889 1.00 0.00 C ATOM 3 C CYS A 135 1.897 -1.416 -1.431 1.00 0.00 C ATOM 4 O CYS A 135 2.942 -1.924 -1.834 1.00 0.00 O ATOM 5 CB CYS A 135 3.303 0.541 -0.641 1.00 0.00 C ATOM 6 SG CYS A 135 3.255 2.340 -0.317 1.00 0.00 S ATOM 0 HA CYS A 135 1.449 0.681 -1.632 1.00 0.00 H new ATOM 0 HB2 CYS A 135 3.749 0.022 0.208 1.00 0.00 H new ATOM 0 HB3 CYS A 135 3.933 0.336 -1.507 1.00 0.00 H new ATOM 0 HG CYS A 135 4.462 2.775 -0.106 1.00 0.00 H new ATOM 12 N TYR A 136 0.721 -2.026 -1.421 1.00 0.00 N ATOM 13 CA TYR A 136 0.581 -3.388 -1.907 1.00 0.00 C ATOM 14 C TYR A 136 -0.837 -3.644 -2.422 1.00 0.00 C ATOM 15 O TYR A 136 -1.740 -2.842 -2.188 1.00 0.00 O ATOM 16 CB TYR A 136 0.843 -4.295 -0.702 1.00 0.00 C ATOM 17 CG TYR A 136 2.318 -4.646 -0.497 1.00 0.00 C ATOM 18 CD1 TYR A 136 3.059 -5.152 -1.546 1.00 0.00 C ATOM 19 CD2 TYR A 136 2.908 -4.456 0.736 1.00 0.00 C ATOM 20 CE1 TYR A 136 4.446 -5.484 -1.353 1.00 0.00 C ATOM 21 CE2 TYR A 136 4.296 -4.787 0.929 1.00 0.00 C ATOM 22 CZ TYR A 136 4.997 -5.285 -0.125 1.00 0.00 C ATOM 23 OH TYR A 136 6.308 -5.598 0.057 1.00 0.00 O ATOM 0 H TYR A 136 -0.143 -1.602 -1.084 1.00 0.00 H new ATOM 0 HA TYR A 136 1.272 -3.574 -2.730 1.00 0.00 H new ATOM 0 HB2 TYR A 136 0.468 -3.805 0.197 1.00 0.00 H new ATOM 0 HB3 TYR A 136 0.274 -5.217 -0.823 1.00 0.00 H new ATOM 0 HD1 TYR A 136 2.598 -5.299 -2.512 1.00 0.00 H new ATOM 0 HD2 TYR A 136 2.329 -4.059 1.556 1.00 0.00 H new ATOM 0 HE1 TYR A 136 5.036 -5.882 -2.165 1.00 0.00 H new ATOM 0 HE2 TYR A 136 4.770 -4.643 1.889 1.00 0.00 H new ATOM 0 HH TYR A 136 6.566 -5.403 0.982 1.00 0.00 H new ATOM 33 N VAL A 137 -0.988 -4.762 -3.115 1.00 0.00 N ATOM 34 CA VAL A 137 -2.280 -5.133 -3.665 1.00 0.00 C ATOM 35 C VAL A 137 -2.457 -6.650 -3.565 1.00 0.00 C ATOM 36 O VAL A 137 -1.527 -7.406 -3.843 1.00 0.00 O ATOM 37 CB VAL A 137 -2.409 -4.610 -5.097 1.00 0.00 C ATOM 38 CG1 VAL A 137 -2.514 -3.084 -5.116 1.00 0.00 C ATOM 39 CG2 VAL A 137 -1.242 -5.090 -5.963 1.00 0.00 C ATOM 0 H VAL A 137 -0.236 -5.424 -3.308 1.00 0.00 H new ATOM 0 HA VAL A 137 -3.085 -4.673 -3.091 1.00 0.00 H new ATOM 0 HB VAL A 137 -3.329 -5.014 -5.520 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -2.605 -2.738 -6.146 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -3.392 -2.773 -4.550 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -1.620 -2.652 -4.666 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -1.358 -4.704 -6.976 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -0.304 -4.728 -5.542 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -1.232 -6.180 -5.989 1.00 0.00 H new ATOM 49 N ARG A 138 -3.655 -7.049 -3.167 1.00 0.00 N ATOM 50 CA ARG A 138 -3.965 -8.462 -3.026 1.00 0.00 C ATOM 51 C ARG A 138 -4.760 -8.954 -4.238 1.00 0.00 C ATOM 52 O ARG A 138 -5.940 -8.637 -4.382 1.00 0.00 O ATOM 53 CB ARG A 138 -4.775 -8.724 -1.755 1.00 0.00 C ATOM 54 CG ARG A 138 -4.530 -10.141 -1.231 1.00 0.00 C ATOM 55 CD ARG A 138 -5.249 -10.366 0.100 1.00 0.00 C ATOM 56 NE ARG A 138 -4.436 -9.824 1.213 1.00 0.00 N ATOM 57 CZ ARG A 138 -4.494 -10.275 2.473 1.00 0.00 C ATOM 58 NH1 ARG A 138 -5.325 -11.277 2.789 1.00 0.00 N ATOM 59 NH2 ARG A 138 -3.719 -9.723 3.417 1.00 0.00 N ATOM 0 H ARG A 138 -4.423 -6.419 -2.937 1.00 0.00 H new ATOM 0 HA ARG A 138 -3.021 -9.004 -2.961 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -4.503 -7.997 -0.990 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -5.837 -8.587 -1.961 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -4.878 -10.869 -1.964 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -3.460 -10.305 -1.103 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -6.225 -9.881 0.082 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -5.425 -11.431 0.252 1.00 0.00 H new ATOM 0 HE ARG A 138 -3.792 -9.060 1.007 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -5.914 -11.697 2.070 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -5.369 -11.620 3.749 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -3.086 -8.960 3.176 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -3.762 -10.065 4.377 1.00 0.00 H new ATOM 73 N ALA A 139 -4.081 -9.721 -5.079 1.00 0.00 N ATOM 74 CA ALA A 139 -4.708 -10.260 -6.273 1.00 0.00 C ATOM 75 C ALA A 139 -5.533 -11.493 -5.899 1.00 0.00 C ATOM 76 O ALA A 139 -4.979 -12.563 -5.653 1.00 0.00 O ATOM 77 CB ALA A 139 -3.634 -10.572 -7.318 1.00 0.00 C ATOM 0 H ALA A 139 -3.103 -9.982 -4.956 1.00 0.00 H new ATOM 0 HA ALA A 139 -5.388 -9.530 -6.712 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -4.105 -10.977 -8.214 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -3.097 -9.658 -7.571 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -2.935 -11.304 -6.914 1.00 0.00 H new ATOM 83 N LEU A 140 -6.844 -11.302 -5.867 1.00 0.00 N ATOM 84 CA LEU A 140 -7.751 -12.384 -5.528 1.00 0.00 C ATOM 85 C LEU A 140 -8.155 -13.125 -6.803 1.00 0.00 C ATOM 86 O LEU A 140 -9.246 -13.687 -6.880 1.00 0.00 O ATOM 87 CB LEU A 140 -8.938 -11.856 -4.720 1.00 0.00 C ATOM 88 CG LEU A 140 -8.646 -11.475 -3.268 1.00 0.00 C ATOM 89 CD1 LEU A 140 -8.049 -10.070 -3.178 1.00 0.00 C ATOM 90 CD2 LEU A 140 -9.897 -11.623 -2.400 1.00 0.00 C ATOM 0 H LEU A 140 -7.300 -10.412 -6.071 1.00 0.00 H new ATOM 0 HA LEU A 140 -7.254 -13.109 -4.883 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -9.339 -10.980 -5.231 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -9.721 -12.614 -4.725 1.00 0.00 H new ATOM 0 HG LEU A 140 -7.899 -12.167 -2.878 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -7.851 -9.825 -2.135 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -7.117 -10.034 -3.742 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -8.753 -9.348 -3.593 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -9.662 -11.346 -1.372 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -10.683 -10.971 -2.781 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -10.239 -12.658 -2.428 1.00 0.00 H new ATOM 102 N PHE A 141 -7.253 -13.103 -7.774 1.00 0.00 N ATOM 103 CA PHE A 141 -7.502 -13.766 -9.042 1.00 0.00 C ATOM 104 C PHE A 141 -6.217 -14.377 -9.603 1.00 0.00 C ATOM 105 O PHE A 141 -5.134 -13.818 -9.434 1.00 0.00 O ATOM 106 CB PHE A 141 -8.011 -12.697 -10.012 1.00 0.00 C ATOM 107 CG PHE A 141 -9.491 -12.355 -9.841 1.00 0.00 C ATOM 108 CD1 PHE A 141 -9.894 -11.573 -8.803 1.00 0.00 C ATOM 109 CD2 PHE A 141 -10.407 -12.833 -10.727 1.00 0.00 C ATOM 110 CE1 PHE A 141 -11.268 -11.255 -8.644 1.00 0.00 C ATOM 111 CE2 PHE A 141 -11.781 -12.515 -10.567 1.00 0.00 C ATOM 112 CZ PHE A 141 -12.183 -11.733 -9.529 1.00 0.00 C ATOM 0 H PHE A 141 -6.349 -12.636 -7.707 1.00 0.00 H new ATOM 0 HA PHE A 141 -8.225 -14.570 -8.906 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -7.421 -11.790 -9.879 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -7.843 -13.039 -11.033 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -9.168 -11.194 -8.099 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -10.089 -13.454 -11.551 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -11.587 -10.633 -7.820 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -12.508 -12.894 -11.270 1.00 0.00 H new ATOM 0 HZ PHE A 141 -13.229 -11.492 -9.408 1.00 0.00 H new ATOM 122 N ASP A 142 -6.378 -15.516 -10.260 1.00 0.00 N ATOM 123 CA ASP A 142 -5.244 -16.209 -10.847 1.00 0.00 C ATOM 124 C ASP A 142 -5.037 -15.717 -12.281 1.00 0.00 C ATOM 125 O ASP A 142 -5.986 -15.648 -13.060 1.00 0.00 O ATOM 126 CB ASP A 142 -5.486 -17.719 -10.896 1.00 0.00 C ATOM 127 CG ASP A 142 -6.956 -18.135 -10.993 1.00 0.00 C ATOM 128 OD1 ASP A 142 -7.592 -17.743 -11.995 1.00 0.00 O ATOM 129 OD2 ASP A 142 -7.409 -18.836 -10.063 1.00 0.00 O ATOM 0 H ASP A 142 -7.277 -15.977 -10.399 1.00 0.00 H new ATOM 0 HA ASP A 142 -4.368 -16.004 -10.231 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -4.950 -18.130 -11.752 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -5.054 -18.170 -10.003 1.00 0.00 H new ATOM 134 N PHE A 143 -3.790 -15.386 -12.585 1.00 0.00 N ATOM 135 CA PHE A 143 -3.447 -14.903 -13.911 1.00 0.00 C ATOM 136 C PHE A 143 -1.981 -15.193 -14.238 1.00 0.00 C ATOM 137 O PHE A 143 -1.094 -14.426 -13.865 1.00 0.00 O ATOM 138 CB PHE A 143 -3.666 -13.388 -13.905 1.00 0.00 C ATOM 139 CG PHE A 143 -3.638 -12.750 -15.295 1.00 0.00 C ATOM 140 CD1 PHE A 143 -2.515 -12.829 -16.058 1.00 0.00 C ATOM 141 CD2 PHE A 143 -4.737 -12.104 -15.769 1.00 0.00 C ATOM 142 CE1 PHE A 143 -2.488 -12.236 -17.348 1.00 0.00 C ATOM 143 CE2 PHE A 143 -4.711 -11.512 -17.059 1.00 0.00 C ATOM 144 CZ PHE A 143 -3.588 -11.591 -17.822 1.00 0.00 C ATOM 0 H PHE A 143 -3.006 -15.443 -11.935 1.00 0.00 H new ATOM 0 HA PHE A 143 -4.063 -15.401 -14.660 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -4.626 -13.172 -13.437 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -2.898 -12.923 -13.287 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -1.643 -13.343 -15.682 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -5.629 -12.041 -15.164 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -1.595 -12.297 -17.952 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -5.584 -10.999 -17.435 1.00 0.00 H new ATOM 0 HZ PHE A 143 -3.569 -11.142 -18.804 1.00 0.00 H new ATOM 154 N ASN A 144 -1.771 -16.302 -14.931 1.00 0.00 N ATOM 155 CA ASN A 144 -0.428 -16.703 -15.313 1.00 0.00 C ATOM 156 C ASN A 144 -0.285 -16.613 -16.834 1.00 0.00 C ATOM 157 O ASN A 144 -1.014 -17.279 -17.569 1.00 0.00 O ATOM 158 CB ASN A 144 -0.145 -18.148 -14.896 1.00 0.00 C ATOM 159 CG ASN A 144 -1.028 -19.126 -15.672 1.00 0.00 C ATOM 160 OD1 ASN A 144 -0.677 -19.611 -16.735 1.00 0.00 O ATOM 161 ND2 ASN A 144 -2.192 -19.387 -15.083 1.00 0.00 N ATOM 0 H ASN A 144 -2.509 -16.936 -15.238 1.00 0.00 H new ATOM 0 HA ASN A 144 0.277 -16.038 -14.813 1.00 0.00 H new ATOM 0 HB2 ASN A 144 0.905 -18.382 -15.072 1.00 0.00 H new ATOM 0 HB3 ASN A 144 -0.322 -18.263 -13.827 1.00 0.00 H new ATOM 0 HD21 ASN A 144 -2.853 -20.028 -15.522 1.00 0.00 H new ATOM 0 HD22 ASN A 144 -2.423 -18.946 -14.193 1.00 0.00 H new ATOM 168 N GLY A 145 0.657 -15.786 -17.260 1.00 0.00 N ATOM 169 CA GLY A 145 0.903 -15.601 -18.681 1.00 0.00 C ATOM 170 C GLY A 145 2.202 -14.826 -18.915 1.00 0.00 C ATOM 171 O GLY A 145 3.243 -15.169 -18.357 1.00 0.00 O ATOM 0 H GLY A 145 1.259 -15.236 -16.647 1.00 0.00 H new ATOM 0 HA2 GLY A 145 0.960 -16.572 -19.173 1.00 0.00 H new ATOM 0 HA3 GLY A 145 0.068 -15.064 -19.132 1.00 0.00 H new ATOM 175 N ASN A 146 2.097 -13.797 -19.742 1.00 0.00 N ATOM 176 CA ASN A 146 3.251 -12.970 -20.057 1.00 0.00 C ATOM 177 C ASN A 146 3.104 -12.419 -21.477 1.00 0.00 C ATOM 178 O ASN A 146 3.512 -13.064 -22.442 1.00 0.00 O ATOM 179 CB ASN A 146 4.544 -13.784 -19.997 1.00 0.00 C ATOM 180 CG ASN A 146 5.647 -13.123 -20.826 1.00 0.00 C ATOM 181 OD1 ASN A 146 5.878 -13.454 -21.977 1.00 0.00 O ATOM 182 ND2 ASN A 146 6.314 -12.172 -20.178 1.00 0.00 N ATOM 0 H ASN A 146 1.232 -13.516 -20.204 1.00 0.00 H new ATOM 0 HA ASN A 146 3.299 -12.163 -19.325 1.00 0.00 H new ATOM 0 HB2 ASN A 146 4.870 -13.879 -18.961 1.00 0.00 H new ATOM 0 HB3 ASN A 146 4.361 -14.793 -20.368 1.00 0.00 H new ATOM 0 HD21 ASN A 146 7.070 -11.671 -20.645 1.00 0.00 H new ATOM 0 HD22 ASN A 146 6.070 -11.944 -19.214 1.00 0.00 H new ATOM 189 N ASP A 147 2.522 -11.232 -21.559 1.00 0.00 N ATOM 190 CA ASP A 147 2.316 -10.587 -22.845 1.00 0.00 C ATOM 191 C ASP A 147 3.483 -9.637 -23.126 1.00 0.00 C ATOM 192 O ASP A 147 4.355 -9.942 -23.938 1.00 0.00 O ATOM 193 CB ASP A 147 1.026 -9.764 -22.848 1.00 0.00 C ATOM 194 CG ASP A 147 0.042 -10.111 -23.966 1.00 0.00 C ATOM 195 OD1 ASP A 147 -0.383 -11.287 -24.003 1.00 0.00 O ATOM 196 OD2 ASP A 147 -0.265 -9.195 -24.759 1.00 0.00 O ATOM 0 H ASP A 147 2.186 -10.700 -20.756 1.00 0.00 H new ATOM 0 HA ASP A 147 2.250 -11.365 -23.606 1.00 0.00 H new ATOM 0 HB2 ASP A 147 0.525 -9.897 -21.889 1.00 0.00 H new ATOM 0 HB3 ASP A 147 1.286 -8.708 -22.928 1.00 0.00 H new ATOM 201 N GLU A 148 3.462 -8.504 -22.437 1.00 0.00 N ATOM 202 CA GLU A 148 4.507 -7.509 -22.603 1.00 0.00 C ATOM 203 C GLU A 148 4.218 -6.286 -21.729 1.00 0.00 C ATOM 204 O GLU A 148 4.410 -5.151 -22.160 1.00 0.00 O ATOM 205 CB GLU A 148 4.656 -7.110 -24.072 1.00 0.00 C ATOM 206 CG GLU A 148 5.959 -6.341 -24.301 1.00 0.00 C ATOM 207 CD GLU A 148 7.171 -7.264 -24.167 1.00 0.00 C ATOM 208 OE1 GLU A 148 7.521 -7.577 -23.008 1.00 0.00 O ATOM 209 OE2 GLU A 148 7.721 -7.636 -25.226 1.00 0.00 O ATOM 0 H GLU A 148 2.738 -8.254 -21.763 1.00 0.00 H new ATOM 0 HA GLU A 148 5.453 -7.946 -22.282 1.00 0.00 H new ATOM 0 HB2 GLU A 148 4.641 -8.002 -24.698 1.00 0.00 H new ATOM 0 HB3 GLU A 148 3.808 -6.495 -24.373 1.00 0.00 H new ATOM 0 HG2 GLU A 148 5.949 -5.889 -25.293 1.00 0.00 H new ATOM 0 HG3 GLU A 148 6.036 -5.527 -23.581 1.00 0.00 H new ATOM 216 N GLU A 149 3.762 -6.561 -20.515 1.00 0.00 N ATOM 217 CA GLU A 149 3.445 -5.498 -19.577 1.00 0.00 C ATOM 218 C GLU A 149 2.510 -6.017 -18.482 1.00 0.00 C ATOM 219 O GLU A 149 2.436 -5.439 -17.399 1.00 0.00 O ATOM 220 CB GLU A 149 2.832 -4.295 -20.297 1.00 0.00 C ATOM 221 CG GLU A 149 1.703 -4.734 -21.233 1.00 0.00 C ATOM 222 CD GLU A 149 1.381 -3.640 -22.253 1.00 0.00 C ATOM 223 OE1 GLU A 149 1.062 -2.519 -21.802 1.00 0.00 O ATOM 224 OE2 GLU A 149 1.461 -3.950 -23.462 1.00 0.00 O ATOM 0 H GLU A 149 3.605 -7.504 -20.160 1.00 0.00 H new ATOM 0 HA GLU A 149 4.372 -5.166 -19.109 1.00 0.00 H new ATOM 0 HB2 GLU A 149 2.447 -3.585 -19.565 1.00 0.00 H new ATOM 0 HB3 GLU A 149 3.602 -3.777 -20.868 1.00 0.00 H new ATOM 0 HG2 GLU A 149 1.991 -5.648 -21.753 1.00 0.00 H new ATOM 0 HG3 GLU A 149 0.812 -4.967 -20.650 1.00 0.00 H new ATOM 231 N ASP A 150 1.820 -7.102 -18.804 1.00 0.00 N ATOM 232 CA ASP A 150 0.893 -7.705 -17.862 1.00 0.00 C ATOM 233 C ASP A 150 1.680 -8.485 -16.807 1.00 0.00 C ATOM 234 O ASP A 150 2.620 -9.207 -17.137 1.00 0.00 O ATOM 235 CB ASP A 150 -0.050 -8.682 -18.566 1.00 0.00 C ATOM 236 CG ASP A 150 -1.255 -8.036 -19.252 1.00 0.00 C ATOM 237 OD1 ASP A 150 -1.231 -6.794 -19.392 1.00 0.00 O ATOM 238 OD2 ASP A 150 -2.173 -8.798 -19.624 1.00 0.00 O ATOM 0 H ASP A 150 1.885 -7.578 -19.704 1.00 0.00 H new ATOM 0 HA ASP A 150 0.309 -6.906 -17.405 1.00 0.00 H new ATOM 0 HB2 ASP A 150 0.518 -9.239 -19.311 1.00 0.00 H new ATOM 0 HB3 ASP A 150 -0.412 -9.405 -17.835 1.00 0.00 H new ATOM 243 N LEU A 151 1.268 -8.314 -15.560 1.00 0.00 N ATOM 244 CA LEU A 151 1.922 -8.994 -14.455 1.00 0.00 C ATOM 245 C LEU A 151 1.022 -10.124 -13.952 1.00 0.00 C ATOM 246 O LEU A 151 -0.027 -9.871 -13.361 1.00 0.00 O ATOM 247 CB LEU A 151 2.317 -7.992 -13.368 1.00 0.00 C ATOM 248 CG LEU A 151 3.583 -8.325 -12.576 1.00 0.00 C ATOM 249 CD1 LEU A 151 4.821 -8.276 -13.473 1.00 0.00 C ATOM 250 CD2 LEU A 151 3.723 -7.412 -11.356 1.00 0.00 C ATOM 0 H LEU A 151 0.489 -7.714 -15.290 1.00 0.00 H new ATOM 0 HA LEU A 151 2.853 -9.452 -14.788 1.00 0.00 H new ATOM 0 HB2 LEU A 151 2.450 -7.015 -13.833 1.00 0.00 H new ATOM 0 HB3 LEU A 151 1.487 -7.901 -12.667 1.00 0.00 H new ATOM 0 HG LEU A 151 3.494 -9.346 -12.206 1.00 0.00 H new ATOM 0 HD11 LEU A 151 5.706 -8.517 -12.885 1.00 0.00 H new ATOM 0 HD12 LEU A 151 4.714 -9.000 -14.281 1.00 0.00 H new ATOM 0 HD13 LEU A 151 4.926 -7.276 -13.894 1.00 0.00 H new ATOM 0 HD21 LEU A 151 4.631 -7.670 -10.811 1.00 0.00 H new ATOM 0 HD22 LEU A 151 3.779 -6.374 -11.683 1.00 0.00 H new ATOM 0 HD23 LEU A 151 2.859 -7.541 -10.704 1.00 0.00 H new ATOM 262 N PRO A 152 1.478 -11.379 -14.209 1.00 0.00 N ATOM 263 CA PRO A 152 0.725 -12.550 -13.789 1.00 0.00 C ATOM 264 C PRO A 152 0.858 -12.773 -12.281 1.00 0.00 C ATOM 265 O PRO A 152 1.683 -12.139 -11.625 1.00 0.00 O ATOM 266 CB PRO A 152 1.290 -13.696 -14.611 1.00 0.00 C ATOM 267 CG PRO A 152 2.641 -13.220 -15.119 1.00 0.00 C ATOM 268 CD PRO A 152 2.716 -11.717 -14.905 1.00 0.00 C ATOM 0 HA PRO A 152 -0.347 -12.446 -13.960 1.00 0.00 H new ATOM 0 HB2 PRO A 152 1.396 -14.596 -14.005 1.00 0.00 H new ATOM 0 HB3 PRO A 152 0.627 -13.946 -15.440 1.00 0.00 H new ATOM 0 HG2 PRO A 152 3.448 -13.722 -14.586 1.00 0.00 H new ATOM 0 HG3 PRO A 152 2.758 -13.462 -16.175 1.00 0.00 H new ATOM 0 HD2 PRO A 152 3.590 -11.444 -14.313 1.00 0.00 H new ATOM 0 HD3 PRO A 152 2.795 -11.186 -15.853 1.00 0.00 H new ATOM 276 N PHE A 153 0.032 -13.678 -11.775 1.00 0.00 N ATOM 277 CA PHE A 153 0.047 -13.993 -10.357 1.00 0.00 C ATOM 278 C PHE A 153 -0.866 -15.183 -10.051 1.00 0.00 C ATOM 279 O PHE A 153 -1.360 -15.843 -10.964 1.00 0.00 O ATOM 280 CB PHE A 153 -0.478 -12.760 -9.618 1.00 0.00 C ATOM 281 CG PHE A 153 -1.669 -12.087 -10.301 1.00 0.00 C ATOM 282 CD1 PHE A 153 -2.821 -12.782 -10.500 1.00 0.00 C ATOM 283 CD2 PHE A 153 -1.578 -10.792 -10.709 1.00 0.00 C ATOM 284 CE1 PHE A 153 -3.928 -12.156 -11.134 1.00 0.00 C ATOM 285 CE2 PHE A 153 -2.685 -10.167 -11.342 1.00 0.00 C ATOM 286 CZ PHE A 153 -3.836 -10.862 -11.541 1.00 0.00 C ATOM 0 H PHE A 153 -0.651 -14.202 -12.322 1.00 0.00 H new ATOM 0 HA PHE A 153 1.058 -14.254 -10.045 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -0.768 -13.050 -8.608 1.00 0.00 H new ATOM 0 HB3 PHE A 153 0.330 -12.035 -9.522 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -2.894 -13.810 -10.176 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -0.664 -10.239 -10.551 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -4.843 -12.708 -11.293 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -2.612 -9.139 -11.665 1.00 0.00 H new ATOM 0 HZ PHE A 153 -4.678 -10.386 -12.022 1.00 0.00 H new ATOM 296 N LYS A 154 -1.063 -15.421 -8.762 1.00 0.00 N ATOM 297 CA LYS A 154 -1.908 -16.519 -8.324 1.00 0.00 C ATOM 298 C LYS A 154 -2.983 -15.983 -7.378 1.00 0.00 C ATOM 299 O LYS A 154 -2.707 -15.121 -6.544 1.00 0.00 O ATOM 300 CB LYS A 154 -1.059 -17.639 -7.720 1.00 0.00 C ATOM 301 CG LYS A 154 -1.061 -17.566 -6.191 1.00 0.00 C ATOM 302 CD LYS A 154 -2.015 -18.602 -5.594 1.00 0.00 C ATOM 303 CE LYS A 154 -1.721 -18.828 -4.111 1.00 0.00 C ATOM 304 NZ LYS A 154 -2.877 -18.415 -3.284 1.00 0.00 N ATOM 0 H LYS A 154 -0.652 -14.872 -8.007 1.00 0.00 H new ATOM 0 HA LYS A 154 -2.425 -16.965 -9.174 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -1.445 -18.606 -8.042 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -0.036 -17.565 -8.090 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -0.052 -17.735 -5.814 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -1.357 -16.567 -5.871 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -3.045 -18.267 -5.717 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -1.920 -19.544 -6.135 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -1.498 -19.880 -3.935 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -0.837 -18.261 -3.819 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -2.554 -18.201 -2.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -3.315 -17.568 -3.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -3.575 -19.186 -3.253 1.00 0.00 H new ATOM 318 N LYS A 155 -4.186 -16.516 -7.537 1.00 0.00 N ATOM 319 CA LYS A 155 -5.304 -16.102 -6.706 1.00 0.00 C ATOM 320 C LYS A 155 -4.856 -16.053 -5.244 1.00 0.00 C ATOM 321 O LYS A 155 -4.487 -17.077 -4.669 1.00 0.00 O ATOM 322 CB LYS A 155 -6.514 -17.005 -6.950 1.00 0.00 C ATOM 323 CG LYS A 155 -7.817 -16.278 -6.610 1.00 0.00 C ATOM 324 CD LYS A 155 -7.939 -16.047 -5.102 1.00 0.00 C ATOM 325 CE LYS A 155 -8.050 -17.375 -4.351 1.00 0.00 C ATOM 326 NZ LYS A 155 -9.299 -18.077 -4.720 1.00 0.00 N ATOM 0 H LYS A 155 -4.411 -17.231 -8.229 1.00 0.00 H new ATOM 0 HA LYS A 155 -5.627 -15.096 -6.974 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -6.531 -17.322 -7.993 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -6.428 -17.907 -6.344 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -7.851 -15.322 -7.132 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -8.667 -16.863 -6.962 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -7.071 -15.494 -4.744 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -8.816 -15.433 -4.894 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -7.190 -18.004 -4.583 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -8.032 -17.194 -3.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -9.497 -18.823 -4.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -10.087 -17.399 -4.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -9.192 -18.503 -5.662 1.00 0.00 H new ATOM 340 N GLY A 156 -4.905 -14.854 -4.684 1.00 0.00 N ATOM 341 CA GLY A 156 -4.509 -14.658 -3.299 1.00 0.00 C ATOM 342 C GLY A 156 -3.037 -14.253 -3.202 1.00 0.00 C ATOM 343 O GLY A 156 -2.371 -14.553 -2.212 1.00 0.00 O ATOM 0 H GLY A 156 -5.213 -14.008 -5.164 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -5.132 -13.888 -2.844 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -4.675 -15.576 -2.736 1.00 0.00 H new ATOM 347 N ASP A 157 -2.573 -13.576 -4.242 1.00 0.00 N ATOM 348 CA ASP A 157 -1.192 -13.124 -4.286 1.00 0.00 C ATOM 349 C ASP A 157 -1.133 -11.641 -3.915 1.00 0.00 C ATOM 350 O ASP A 157 -2.164 -10.977 -3.832 1.00 0.00 O ATOM 351 CB ASP A 157 -0.605 -13.287 -5.689 1.00 0.00 C ATOM 352 CG ASP A 157 0.879 -12.933 -5.813 1.00 0.00 C ATOM 353 OD1 ASP A 157 1.701 -13.836 -5.544 1.00 0.00 O ATOM 354 OD2 ASP A 157 1.157 -11.769 -6.174 1.00 0.00 O ATOM 0 H ASP A 157 -3.129 -13.329 -5.061 1.00 0.00 H new ATOM 0 HA ASP A 157 -0.616 -13.726 -3.583 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -0.745 -14.320 -6.008 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -1.171 -12.661 -6.379 1.00 0.00 H new ATOM 359 N ILE A 158 0.086 -11.166 -3.704 1.00 0.00 N ATOM 360 CA ILE A 158 0.293 -9.773 -3.346 1.00 0.00 C ATOM 361 C ILE A 158 1.217 -9.118 -4.375 1.00 0.00 C ATOM 362 O ILE A 158 2.106 -9.771 -4.920 1.00 0.00 O ATOM 363 CB ILE A 158 0.798 -9.660 -1.906 1.00 0.00 C ATOM 364 CG1 ILE A 158 -0.282 -10.088 -0.911 1.00 0.00 C ATOM 365 CG2 ILE A 158 1.318 -8.250 -1.616 1.00 0.00 C ATOM 366 CD1 ILE A 158 0.331 -10.840 0.273 1.00 0.00 C ATOM 0 H ILE A 158 0.939 -11.720 -3.774 1.00 0.00 H new ATOM 0 HA ILE A 158 -0.651 -9.228 -3.373 1.00 0.00 H new ATOM 0 HB ILE A 158 1.638 -10.344 -1.784 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -0.818 -9.210 -0.551 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -1.012 -10.724 -1.412 1.00 0.00 H new ATOM 0 HG21 ILE A 158 1.671 -8.197 -0.586 1.00 0.00 H new ATOM 0 HG22 ILE A 158 2.140 -8.019 -2.293 1.00 0.00 H new ATOM 0 HG23 ILE A 158 0.514 -7.529 -1.762 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -0.458 -11.133 0.966 1.00 0.00 H new ATOM 0 HD12 ILE A 158 0.846 -11.730 -0.089 1.00 0.00 H new ATOM 0 HD13 ILE A 158 1.042 -10.193 0.786 1.00 0.00 H new ATOM 378 N LEU A 159 0.975 -7.837 -4.609 1.00 0.00 N ATOM 379 CA LEU A 159 1.775 -7.086 -5.563 1.00 0.00 C ATOM 380 C LEU A 159 2.019 -5.676 -5.020 1.00 0.00 C ATOM 381 O LEU A 159 1.106 -5.046 -4.491 1.00 0.00 O ATOM 382 CB LEU A 159 1.120 -7.109 -6.946 1.00 0.00 C ATOM 383 CG LEU A 159 0.331 -8.373 -7.293 1.00 0.00 C ATOM 384 CD1 LEU A 159 -0.890 -8.037 -8.151 1.00 0.00 C ATOM 385 CD2 LEU A 159 1.231 -9.415 -7.959 1.00 0.00 C ATOM 0 H LEU A 159 0.237 -7.299 -4.155 1.00 0.00 H new ATOM 0 HA LEU A 159 2.752 -7.551 -5.691 1.00 0.00 H new ATOM 0 HB2 LEU A 159 0.449 -6.253 -7.023 1.00 0.00 H new ATOM 0 HB3 LEU A 159 1.898 -6.973 -7.697 1.00 0.00 H new ATOM 0 HG LEU A 159 -0.038 -8.812 -6.366 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -1.434 -8.952 -8.384 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.543 -7.356 -7.604 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -0.565 -7.563 -9.077 1.00 0.00 H new ATOM 0 HD21 LEU A 159 0.646 -10.304 -8.195 1.00 0.00 H new ATOM 0 HD22 LEU A 159 1.649 -9.001 -8.877 1.00 0.00 H new ATOM 0 HD23 LEU A 159 2.040 -9.684 -7.280 1.00 0.00 H new ATOM 397 N ARG A 160 3.255 -5.225 -5.171 1.00 0.00 N ATOM 398 CA ARG A 160 3.630 -3.901 -4.703 1.00 0.00 C ATOM 399 C ARG A 160 3.366 -2.858 -5.792 1.00 0.00 C ATOM 400 O ARG A 160 4.043 -2.842 -6.818 1.00 0.00 O ATOM 401 CB ARG A 160 5.108 -3.855 -4.310 1.00 0.00 C ATOM 402 CG ARG A 160 5.415 -2.606 -3.481 1.00 0.00 C ATOM 403 CD ARG A 160 6.072 -2.979 -2.150 1.00 0.00 C ATOM 404 NE ARG A 160 6.908 -1.858 -1.667 1.00 0.00 N ATOM 405 CZ ARG A 160 8.186 -1.664 -2.024 1.00 0.00 C ATOM 406 NH1 ARG A 160 8.781 -2.516 -2.870 1.00 0.00 N ATOM 407 NH2 ARG A 160 8.867 -0.619 -1.535 1.00 0.00 N ATOM 0 H ARG A 160 4.010 -5.752 -5.610 1.00 0.00 H new ATOM 0 HA ARG A 160 3.025 -3.675 -3.825 1.00 0.00 H new ATOM 0 HB2 ARG A 160 5.364 -4.747 -3.739 1.00 0.00 H new ATOM 0 HB3 ARG A 160 5.727 -3.862 -5.207 1.00 0.00 H new ATOM 0 HG2 ARG A 160 6.074 -1.945 -4.043 1.00 0.00 H new ATOM 0 HG3 ARG A 160 4.494 -2.054 -3.294 1.00 0.00 H new ATOM 0 HD2 ARG A 160 5.307 -3.217 -1.411 1.00 0.00 H new ATOM 0 HD3 ARG A 160 6.684 -3.872 -2.275 1.00 0.00 H new ATOM 0 HE ARG A 160 6.486 -1.191 -1.022 1.00 0.00 H new ATOM 0 HH11 ARG A 160 8.262 -3.311 -3.242 1.00 0.00 H new ATOM 0 HH12 ARG A 160 9.753 -2.369 -3.142 1.00 0.00 H new ATOM 0 HH21 ARG A 160 8.413 0.029 -0.891 1.00 0.00 H new ATOM 0 HH22 ARG A 160 9.839 -0.472 -1.807 1.00 0.00 H new ATOM 421 N ILE A 161 2.378 -2.014 -5.530 1.00 0.00 N ATOM 422 CA ILE A 161 2.016 -0.971 -6.473 1.00 0.00 C ATOM 423 C ILE A 161 2.984 0.205 -6.325 1.00 0.00 C ATOM 424 O ILE A 161 3.154 0.738 -5.229 1.00 0.00 O ATOM 425 CB ILE A 161 0.546 -0.583 -6.305 1.00 0.00 C ATOM 426 CG1 ILE A 161 -0.089 -0.240 -7.654 1.00 0.00 C ATOM 427 CG2 ILE A 161 0.393 0.556 -5.293 1.00 0.00 C ATOM 428 CD1 ILE A 161 -0.794 -1.457 -8.253 1.00 0.00 C ATOM 0 H ILE A 161 1.818 -2.032 -4.678 1.00 0.00 H new ATOM 0 HA ILE A 161 2.111 -1.334 -7.496 1.00 0.00 H new ATOM 0 HB ILE A 161 0.009 -1.444 -5.907 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -0.804 0.573 -7.527 1.00 0.00 H new ATOM 0 HG13 ILE A 161 0.679 0.115 -8.342 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -0.661 0.813 -5.191 1.00 0.00 H new ATOM 0 HG22 ILE A 161 0.784 0.239 -4.326 1.00 0.00 H new ATOM 0 HG23 ILE A 161 0.947 1.428 -5.640 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -1.237 -1.186 -9.211 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -0.072 -2.260 -8.401 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -1.577 -1.794 -7.574 1.00 0.00 H new ATOM 440 N ARG A 162 3.593 0.574 -7.442 1.00 0.00 N ATOM 441 CA ARG A 162 4.540 1.676 -7.450 1.00 0.00 C ATOM 442 C ARG A 162 4.025 2.812 -8.336 1.00 0.00 C ATOM 443 O ARG A 162 4.372 3.974 -8.128 1.00 0.00 O ATOM 444 CB ARG A 162 5.909 1.222 -7.958 1.00 0.00 C ATOM 445 CG ARG A 162 6.961 2.313 -7.745 1.00 0.00 C ATOM 446 CD ARG A 162 8.343 1.702 -7.498 1.00 0.00 C ATOM 447 NE ARG A 162 8.802 2.025 -6.128 1.00 0.00 N ATOM 448 CZ ARG A 162 9.880 1.480 -5.550 1.00 0.00 C ATOM 449 NH1 ARG A 162 10.618 0.583 -6.218 1.00 0.00 N ATOM 450 NH2 ARG A 162 10.221 1.833 -4.303 1.00 0.00 N ATOM 0 H ARG A 162 3.449 0.129 -8.349 1.00 0.00 H new ATOM 0 HA ARG A 162 4.645 2.030 -6.425 1.00 0.00 H new ATOM 0 HB2 ARG A 162 6.211 0.313 -7.437 1.00 0.00 H new ATOM 0 HB3 ARG A 162 5.844 0.976 -9.018 1.00 0.00 H new ATOM 0 HG2 ARG A 162 6.998 2.963 -8.619 1.00 0.00 H new ATOM 0 HG3 ARG A 162 6.678 2.936 -6.896 1.00 0.00 H new ATOM 0 HD2 ARG A 162 8.301 0.621 -7.631 1.00 0.00 H new ATOM 0 HD3 ARG A 162 9.055 2.085 -8.229 1.00 0.00 H new ATOM 0 HE ARG A 162 8.264 2.705 -5.591 1.00 0.00 H new ATOM 0 HH11 ARG A 162 10.359 0.315 -7.167 1.00 0.00 H new ATOM 0 HH12 ARG A 162 11.439 0.168 -5.777 1.00 0.00 H new ATOM 0 HH21 ARG A 162 9.660 2.516 -3.795 1.00 0.00 H new ATOM 0 HH22 ARG A 162 11.042 1.418 -3.862 1.00 0.00 H new ATOM 464 N ASP A 163 3.205 2.437 -9.306 1.00 0.00 N ATOM 465 CA ASP A 163 2.638 3.409 -10.226 1.00 0.00 C ATOM 466 C ASP A 163 1.258 2.932 -10.680 1.00 0.00 C ATOM 467 O ASP A 163 0.961 1.739 -10.626 1.00 0.00 O ATOM 468 CB ASP A 163 3.516 3.568 -11.469 1.00 0.00 C ATOM 469 CG ASP A 163 4.335 2.332 -11.846 1.00 0.00 C ATOM 470 OD1 ASP A 163 4.997 1.790 -10.935 1.00 0.00 O ATOM 471 OD2 ASP A 163 4.279 1.955 -13.036 1.00 0.00 O ATOM 0 H ASP A 163 2.919 1.473 -9.475 1.00 0.00 H new ATOM 0 HA ASP A 163 2.571 4.365 -9.707 1.00 0.00 H new ATOM 0 HB2 ASP A 163 2.880 3.835 -12.313 1.00 0.00 H new ATOM 0 HB3 ASP A 163 4.199 4.402 -11.309 1.00 0.00 H new ATOM 476 N LYS A 164 0.450 3.887 -11.118 1.00 0.00 N ATOM 477 CA LYS A 164 -0.891 3.579 -11.581 1.00 0.00 C ATOM 478 C LYS A 164 -1.260 4.525 -12.725 1.00 0.00 C ATOM 479 O LYS A 164 -1.776 5.616 -12.492 1.00 0.00 O ATOM 480 CB LYS A 164 -1.881 3.610 -10.414 1.00 0.00 C ATOM 481 CG LYS A 164 -3.268 4.055 -10.884 1.00 0.00 C ATOM 482 CD LYS A 164 -3.496 5.539 -10.588 1.00 0.00 C ATOM 483 CE LYS A 164 -4.666 5.732 -9.621 1.00 0.00 C ATOM 484 NZ LYS A 164 -4.287 6.655 -8.528 1.00 0.00 N ATOM 0 H LYS A 164 0.700 4.875 -11.162 1.00 0.00 H new ATOM 0 HA LYS A 164 -0.934 2.565 -11.978 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -1.946 2.621 -9.961 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -1.519 4.290 -9.643 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -3.369 3.874 -11.954 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -4.033 3.459 -10.386 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -2.591 5.971 -10.161 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -3.696 6.072 -11.517 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -5.528 6.129 -10.158 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -4.965 4.770 -9.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -5.092 6.775 -7.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -3.478 6.261 -8.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -4.024 7.578 -8.929 1.00 0.00 H new ATOM 498 N PRO A 165 -0.975 4.058 -13.971 1.00 0.00 N ATOM 499 CA PRO A 165 -1.272 4.850 -15.152 1.00 0.00 C ATOM 500 C PRO A 165 -2.772 4.843 -15.456 1.00 0.00 C ATOM 501 O PRO A 165 -3.372 5.896 -15.660 1.00 0.00 O ATOM 502 CB PRO A 165 -0.439 4.230 -16.261 1.00 0.00 C ATOM 503 CG PRO A 165 -0.066 2.839 -15.775 1.00 0.00 C ATOM 504 CD PRO A 165 -0.365 2.771 -14.286 1.00 0.00 C ATOM 0 HA PRO A 165 -1.022 5.903 -15.025 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -1.004 4.180 -17.192 1.00 0.00 H new ATOM 0 HB3 PRO A 165 0.452 4.826 -16.460 1.00 0.00 H new ATOM 0 HG2 PRO A 165 -0.635 2.081 -16.314 1.00 0.00 H new ATOM 0 HG3 PRO A 165 0.989 2.639 -15.962 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -1.039 1.946 -14.055 1.00 0.00 H new ATOM 0 HD3 PRO A 165 0.544 2.611 -13.706 1.00 0.00 H new ATOM 512 N GLU A 166 -3.332 3.642 -15.475 1.00 0.00 N ATOM 513 CA GLU A 166 -4.750 3.483 -15.750 1.00 0.00 C ATOM 514 C GLU A 166 -5.555 3.562 -14.451 1.00 0.00 C ATOM 515 O GLU A 166 -4.991 3.782 -13.380 1.00 0.00 O ATOM 516 CB GLU A 166 -5.022 2.169 -16.485 1.00 0.00 C ATOM 517 CG GLU A 166 -4.133 2.039 -17.723 1.00 0.00 C ATOM 518 CD GLU A 166 -4.842 1.253 -18.828 1.00 0.00 C ATOM 519 OE1 GLU A 166 -5.503 0.252 -18.477 1.00 0.00 O ATOM 520 OE2 GLU A 166 -4.708 1.672 -19.997 1.00 0.00 O ATOM 0 H GLU A 166 -2.830 2.771 -15.305 1.00 0.00 H new ATOM 0 HA GLU A 166 -5.067 4.298 -16.401 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -4.842 1.329 -15.814 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -6.070 2.123 -16.779 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -3.868 3.030 -18.090 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -3.202 1.538 -17.456 1.00 0.00 H new ATOM 527 N GLU A 167 -6.859 3.377 -14.588 1.00 0.00 N ATOM 528 CA GLU A 167 -7.747 3.424 -13.440 1.00 0.00 C ATOM 529 C GLU A 167 -8.219 2.014 -13.075 1.00 0.00 C ATOM 530 O GLU A 167 -8.832 1.813 -12.028 1.00 0.00 O ATOM 531 CB GLU A 167 -8.936 4.349 -13.702 1.00 0.00 C ATOM 532 CG GLU A 167 -9.820 3.801 -14.825 1.00 0.00 C ATOM 533 CD GLU A 167 -9.507 4.487 -16.155 1.00 0.00 C ATOM 534 OE1 GLU A 167 -9.351 5.727 -16.131 1.00 0.00 O ATOM 535 OE2 GLU A 167 -9.430 3.757 -17.167 1.00 0.00 O ATOM 0 H GLU A 167 -7.323 3.194 -15.478 1.00 0.00 H new ATOM 0 HA GLU A 167 -7.193 3.831 -12.594 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -9.525 4.457 -12.791 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -8.576 5.343 -13.969 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -9.666 2.726 -14.921 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -10.870 3.952 -14.572 1.00 0.00 H new ATOM 542 N GLN A 168 -7.915 1.076 -13.959 1.00 0.00 N ATOM 543 CA GLN A 168 -8.300 -0.308 -13.744 1.00 0.00 C ATOM 544 C GLN A 168 -7.060 -1.204 -13.706 1.00 0.00 C ATOM 545 O GLN A 168 -7.069 -2.254 -13.066 1.00 0.00 O ATOM 546 CB GLN A 168 -9.284 -0.777 -14.817 1.00 0.00 C ATOM 547 CG GLN A 168 -9.396 -2.303 -14.829 1.00 0.00 C ATOM 548 CD GLN A 168 -10.425 -2.769 -15.861 1.00 0.00 C ATOM 549 OE1 GLN A 168 -11.402 -3.427 -15.547 1.00 0.00 O ATOM 550 NE2 GLN A 168 -10.153 -2.391 -17.106 1.00 0.00 N ATOM 0 H GLN A 168 -7.406 1.247 -14.826 1.00 0.00 H new ATOM 0 HA GLN A 168 -8.805 -0.379 -12.781 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -10.265 -0.338 -14.633 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -8.956 -0.425 -15.795 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -8.424 -2.741 -15.056 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -9.682 -2.658 -13.839 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -9.317 -1.840 -17.301 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -10.781 -2.652 -17.867 1.00 0.00 H new ATOM 559 N TRP A 169 -6.025 -0.757 -14.401 1.00 0.00 N ATOM 560 CA TRP A 169 -4.781 -1.506 -14.456 1.00 0.00 C ATOM 561 C TRP A 169 -3.664 -0.605 -13.924 1.00 0.00 C ATOM 562 O TRP A 169 -3.380 0.444 -14.500 1.00 0.00 O ATOM 563 CB TRP A 169 -4.511 -2.019 -15.871 1.00 0.00 C ATOM 564 CG TRP A 169 -5.302 -3.278 -16.238 1.00 0.00 C ATOM 565 CD1 TRP A 169 -6.544 -3.356 -16.733 1.00 0.00 C ATOM 566 CD2 TRP A 169 -4.848 -4.643 -16.116 1.00 0.00 C ATOM 567 NE1 TRP A 169 -6.923 -4.668 -16.939 1.00 0.00 N ATOM 568 CE2 TRP A 169 -5.860 -5.474 -16.552 1.00 0.00 C ATOM 569 CE3 TRP A 169 -3.625 -5.158 -15.653 1.00 0.00 C ATOM 570 CZ2 TRP A 169 -5.750 -6.869 -16.567 1.00 0.00 C ATOM 571 CZ3 TRP A 169 -3.532 -6.554 -15.675 1.00 0.00 C ATOM 572 CH2 TRP A 169 -4.541 -7.405 -16.111 1.00 0.00 C ATOM 0 H TRP A 169 -6.022 0.115 -14.931 1.00 0.00 H new ATOM 0 HA TRP A 169 -4.839 -2.397 -13.830 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -4.751 -1.231 -16.584 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -3.446 -2.228 -15.974 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -7.170 -2.501 -16.944 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -7.819 -4.987 -17.308 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -2.820 -4.526 -15.307 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -6.556 -7.499 -16.913 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -2.612 -7.002 -15.329 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -4.392 -8.475 -16.098 1.00 0.00 H new ATOM 583 N TRP A 170 -3.060 -1.049 -12.831 1.00 0.00 N ATOM 584 CA TRP A 170 -1.981 -0.295 -12.215 1.00 0.00 C ATOM 585 C TRP A 170 -0.697 -1.118 -12.344 1.00 0.00 C ATOM 586 O TRP A 170 -0.747 -2.311 -12.643 1.00 0.00 O ATOM 587 CB TRP A 170 -2.318 0.061 -10.766 1.00 0.00 C ATOM 588 CG TRP A 170 -3.651 0.794 -10.599 1.00 0.00 C ATOM 589 CD1 TRP A 170 -4.437 1.303 -11.557 1.00 0.00 C ATOM 590 CD2 TRP A 170 -4.326 1.079 -9.356 1.00 0.00 C ATOM 591 NE1 TRP A 170 -5.565 1.894 -11.025 1.00 0.00 N ATOM 592 CE2 TRP A 170 -5.495 1.754 -9.644 1.00 0.00 C ATOM 593 CE3 TRP A 170 -3.960 0.777 -8.033 1.00 0.00 C ATOM 594 CZ2 TRP A 170 -6.394 2.183 -8.660 1.00 0.00 C ATOM 595 CZ3 TRP A 170 -4.869 1.213 -7.061 1.00 0.00 C ATOM 596 CH2 TRP A 170 -6.051 1.893 -7.334 1.00 0.00 C ATOM 0 H TRP A 170 -3.297 -1.920 -12.357 1.00 0.00 H new ATOM 0 HA TRP A 170 -1.838 0.659 -12.723 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -2.342 -0.854 -10.174 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -1.520 0.683 -10.360 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -4.216 1.257 -12.613 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -6.312 2.350 -11.549 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -3.050 0.251 -7.786 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -7.303 2.709 -8.910 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -4.636 1.007 -6.027 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -6.701 2.196 -6.527 1.00 0.00 H new ATOM 607 N ASN A 171 0.422 -0.449 -12.114 1.00 0.00 N ATOM 608 CA ASN A 171 1.718 -1.103 -12.201 1.00 0.00 C ATOM 609 C ASN A 171 2.206 -1.447 -10.793 1.00 0.00 C ATOM 610 O ASN A 171 2.464 -0.555 -9.986 1.00 0.00 O ATOM 611 CB ASN A 171 2.755 -0.185 -12.850 1.00 0.00 C ATOM 612 CG ASN A 171 3.475 -0.896 -13.999 1.00 0.00 C ATOM 613 OD1 ASN A 171 3.150 -0.734 -15.163 1.00 0.00 O ATOM 614 ND2 ASN A 171 4.465 -1.692 -13.606 1.00 0.00 N ATOM 0 H ASN A 171 0.459 0.540 -11.867 1.00 0.00 H new ATOM 0 HA ASN A 171 1.603 -2.002 -12.807 1.00 0.00 H new ATOM 0 HB2 ASN A 171 2.266 0.715 -13.224 1.00 0.00 H new ATOM 0 HB3 ASN A 171 3.482 0.134 -12.103 1.00 0.00 H new ATOM 0 HD21 ASN A 171 5.005 -2.213 -14.297 1.00 0.00 H new ATOM 0 HD22 ASN A 171 4.684 -1.781 -12.614 1.00 0.00 H new ATOM 621 N ALA A 172 2.318 -2.743 -10.541 1.00 0.00 N ATOM 622 CA ALA A 172 2.771 -3.216 -9.243 1.00 0.00 C ATOM 623 C ALA A 172 3.771 -4.357 -9.443 1.00 0.00 C ATOM 624 O ALA A 172 3.916 -4.875 -10.549 1.00 0.00 O ATOM 625 CB ALA A 172 1.564 -3.640 -8.404 1.00 0.00 C ATOM 0 H ALA A 172 2.103 -3.480 -11.213 1.00 0.00 H new ATOM 0 HA ALA A 172 3.281 -2.420 -8.701 1.00 0.00 H new ATOM 0 HB1 ALA A 172 1.904 -3.995 -7.431 1.00 0.00 H new ATOM 0 HB2 ALA A 172 0.898 -2.788 -8.267 1.00 0.00 H new ATOM 0 HB3 ALA A 172 1.029 -4.440 -8.915 1.00 0.00 H new ATOM 631 N GLU A 173 4.437 -4.714 -8.354 1.00 0.00 N ATOM 632 CA GLU A 173 5.419 -5.784 -8.395 1.00 0.00 C ATOM 633 C GLU A 173 4.794 -7.097 -7.918 1.00 0.00 C ATOM 634 O GLU A 173 3.828 -7.088 -7.157 1.00 0.00 O ATOM 635 CB GLU A 173 6.651 -5.429 -7.561 1.00 0.00 C ATOM 636 CG GLU A 173 7.617 -4.549 -8.358 1.00 0.00 C ATOM 637 CD GLU A 173 7.252 -3.069 -8.218 1.00 0.00 C ATOM 638 OE1 GLU A 173 6.311 -2.648 -8.924 1.00 0.00 O ATOM 639 OE2 GLU A 173 7.924 -2.392 -7.410 1.00 0.00 O ATOM 0 H GLU A 173 4.316 -4.281 -7.438 1.00 0.00 H new ATOM 0 HA GLU A 173 5.744 -5.913 -9.427 1.00 0.00 H new ATOM 0 HB2 GLU A 173 6.343 -4.909 -6.654 1.00 0.00 H new ATOM 0 HB3 GLU A 173 7.158 -6.342 -7.248 1.00 0.00 H new ATOM 0 HG2 GLU A 173 8.636 -4.711 -8.007 1.00 0.00 H new ATOM 0 HG3 GLU A 173 7.593 -4.836 -9.409 1.00 0.00 H new ATOM 646 N ASP A 174 5.372 -8.194 -8.386 1.00 0.00 N ATOM 647 CA ASP A 174 4.885 -9.512 -8.017 1.00 0.00 C ATOM 648 C ASP A 174 5.578 -9.966 -6.731 1.00 0.00 C ATOM 649 O ASP A 174 6.172 -9.155 -6.022 1.00 0.00 O ATOM 650 CB ASP A 174 5.193 -10.539 -9.108 1.00 0.00 C ATOM 651 CG ASP A 174 3.969 -11.236 -9.704 1.00 0.00 C ATOM 652 OD1 ASP A 174 2.847 -10.845 -9.315 1.00 0.00 O ATOM 653 OD2 ASP A 174 4.182 -12.144 -10.536 1.00 0.00 O ATOM 0 H ASP A 174 6.173 -8.197 -9.017 1.00 0.00 H new ATOM 0 HA ASP A 174 3.806 -9.446 -7.879 1.00 0.00 H new ATOM 0 HB2 ASP A 174 5.736 -10.041 -9.911 1.00 0.00 H new ATOM 0 HB3 ASP A 174 5.859 -11.297 -8.695 1.00 0.00 H new ATOM 658 N SER A 175 5.480 -11.261 -6.469 1.00 0.00 N ATOM 659 CA SER A 175 6.090 -11.833 -5.281 1.00 0.00 C ATOM 660 C SER A 175 7.596 -12.002 -5.496 1.00 0.00 C ATOM 661 O SER A 175 8.277 -12.627 -4.683 1.00 0.00 O ATOM 662 CB SER A 175 5.451 -13.176 -4.925 1.00 0.00 C ATOM 663 OG SER A 175 5.916 -13.674 -3.673 1.00 0.00 O ATOM 0 H SER A 175 4.987 -11.931 -7.060 1.00 0.00 H new ATOM 0 HA SER A 175 5.922 -11.150 -4.448 1.00 0.00 H new ATOM 0 HB2 SER A 175 4.367 -13.064 -4.891 1.00 0.00 H new ATOM 0 HB3 SER A 175 5.672 -13.901 -5.708 1.00 0.00 H new ATOM 0 HG SER A 175 6.878 -13.507 -3.591 1.00 0.00 H new ATOM 669 N GLU A 176 8.072 -11.434 -6.594 1.00 0.00 N ATOM 670 CA GLU A 176 9.484 -11.515 -6.927 1.00 0.00 C ATOM 671 C GLU A 176 10.040 -10.121 -7.221 1.00 0.00 C ATOM 672 O GLU A 176 11.243 -9.957 -7.424 1.00 0.00 O ATOM 673 CB GLU A 176 9.717 -12.459 -8.108 1.00 0.00 C ATOM 674 CG GLU A 176 9.414 -13.908 -7.721 1.00 0.00 C ATOM 675 CD GLU A 176 10.416 -14.869 -8.362 1.00 0.00 C ATOM 676 OE1 GLU A 176 10.180 -15.239 -9.531 1.00 0.00 O ATOM 677 OE2 GLU A 176 11.398 -15.212 -7.667 1.00 0.00 O ATOM 0 H GLU A 176 7.505 -10.916 -7.265 1.00 0.00 H new ATOM 0 HA GLU A 176 10.017 -11.924 -6.068 1.00 0.00 H new ATOM 0 HB2 GLU A 176 9.085 -12.163 -8.945 1.00 0.00 H new ATOM 0 HB3 GLU A 176 10.750 -12.377 -8.445 1.00 0.00 H new ATOM 0 HG2 GLU A 176 9.447 -14.013 -6.637 1.00 0.00 H new ATOM 0 HG3 GLU A 176 8.403 -14.168 -8.036 1.00 0.00 H new ATOM 684 N GLY A 177 9.138 -9.150 -7.236 1.00 0.00 N ATOM 685 CA GLY A 177 9.525 -7.774 -7.503 1.00 0.00 C ATOM 686 C GLY A 177 9.233 -7.396 -8.957 1.00 0.00 C ATOM 687 O GLY A 177 9.298 -6.222 -9.321 1.00 0.00 O ATOM 0 H GLY A 177 8.142 -9.288 -7.068 1.00 0.00 H new ATOM 0 HA2 GLY A 177 8.985 -7.104 -6.834 1.00 0.00 H new ATOM 0 HA3 GLY A 177 10.587 -7.644 -7.296 1.00 0.00 H new ATOM 691 N LYS A 178 8.920 -8.410 -9.748 1.00 0.00 N ATOM 692 CA LYS A 178 8.619 -8.199 -11.153 1.00 0.00 C ATOM 693 C LYS A 178 7.524 -7.138 -11.282 1.00 0.00 C ATOM 694 O LYS A 178 6.381 -7.369 -10.889 1.00 0.00 O ATOM 695 CB LYS A 178 8.273 -9.525 -11.834 1.00 0.00 C ATOM 696 CG LYS A 178 9.518 -10.400 -11.993 1.00 0.00 C ATOM 697 CD LYS A 178 9.654 -10.904 -13.431 1.00 0.00 C ATOM 698 CE LYS A 178 9.331 -12.396 -13.523 1.00 0.00 C ATOM 699 NZ LYS A 178 10.568 -13.201 -13.419 1.00 0.00 N ATOM 0 H LYS A 178 8.868 -9.382 -9.442 1.00 0.00 H new ATOM 0 HA LYS A 178 9.496 -7.819 -11.676 1.00 0.00 H new ATOM 0 HB2 LYS A 178 7.524 -10.055 -11.246 1.00 0.00 H new ATOM 0 HB3 LYS A 178 7.832 -9.332 -12.812 1.00 0.00 H new ATOM 0 HG2 LYS A 178 10.405 -9.830 -11.718 1.00 0.00 H new ATOM 0 HG3 LYS A 178 9.460 -11.248 -11.311 1.00 0.00 H new ATOM 0 HD2 LYS A 178 8.983 -10.343 -14.082 1.00 0.00 H new ATOM 0 HD3 LYS A 178 10.668 -10.725 -13.788 1.00 0.00 H new ATOM 0 HE2 LYS A 178 8.641 -12.675 -12.727 1.00 0.00 H new ATOM 0 HE3 LYS A 178 8.830 -12.608 -14.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 10.331 -14.212 -13.483 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 11.214 -12.947 -14.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 11.030 -13.011 -12.507 1.00 0.00 H new ATOM 713 N ARG A 179 7.912 -5.997 -11.833 1.00 0.00 N ATOM 714 CA ARG A 179 6.977 -4.900 -12.018 1.00 0.00 C ATOM 715 C ARG A 179 6.232 -5.055 -13.345 1.00 0.00 C ATOM 716 O ARG A 179 6.853 -5.165 -14.401 1.00 0.00 O ATOM 717 CB ARG A 179 7.700 -3.551 -12.002 1.00 0.00 C ATOM 718 CG ARG A 179 8.863 -3.566 -11.008 1.00 0.00 C ATOM 719 CD ARG A 179 10.123 -2.962 -11.630 1.00 0.00 C ATOM 720 NE ARG A 179 11.287 -3.837 -11.366 1.00 0.00 N ATOM 721 CZ ARG A 179 12.544 -3.545 -11.727 1.00 0.00 C ATOM 722 NH1 ARG A 179 12.807 -2.399 -12.372 1.00 0.00 N ATOM 723 NH2 ARG A 179 13.538 -4.398 -11.446 1.00 0.00 N ATOM 0 H ARG A 179 8.861 -5.809 -12.157 1.00 0.00 H new ATOM 0 HA ARG A 179 6.266 -4.928 -11.193 1.00 0.00 H new ATOM 0 HB2 ARG A 179 8.073 -3.322 -13.000 1.00 0.00 H new ATOM 0 HB3 ARG A 179 6.998 -2.761 -11.735 1.00 0.00 H new ATOM 0 HG2 ARG A 179 8.590 -3.005 -10.114 1.00 0.00 H new ATOM 0 HG3 ARG A 179 9.064 -4.590 -10.693 1.00 0.00 H new ATOM 0 HD2 ARG A 179 9.986 -2.840 -12.704 1.00 0.00 H new ATOM 0 HD3 ARG A 179 10.303 -1.969 -11.217 1.00 0.00 H new ATOM 0 HE ARG A 179 11.122 -4.718 -10.879 1.00 0.00 H new ATOM 0 HH11 ARG A 179 12.050 -1.750 -12.588 1.00 0.00 H new ATOM 0 HH12 ARG A 179 13.764 -2.176 -12.647 1.00 0.00 H new ATOM 0 HH21 ARG A 179 13.338 -5.271 -10.957 1.00 0.00 H new ATOM 0 HH22 ARG A 179 14.495 -4.175 -11.721 1.00 0.00 H new ATOM 737 N GLY A 180 4.910 -5.060 -13.248 1.00 0.00 N ATOM 738 CA GLY A 180 4.074 -5.200 -14.428 1.00 0.00 C ATOM 739 C GLY A 180 2.687 -4.600 -14.192 1.00 0.00 C ATOM 740 O GLY A 180 2.483 -3.858 -13.232 1.00 0.00 O ATOM 0 H GLY A 180 4.398 -4.969 -12.371 1.00 0.00 H new ATOM 0 HA2 GLY A 180 4.549 -4.705 -15.275 1.00 0.00 H new ATOM 0 HA3 GLY A 180 3.979 -6.254 -14.687 1.00 0.00 H new ATOM 744 N MET A 181 1.769 -4.942 -15.084 1.00 0.00 N ATOM 745 CA MET A 181 0.407 -4.446 -14.984 1.00 0.00 C ATOM 746 C MET A 181 -0.514 -5.495 -14.358 1.00 0.00 C ATOM 747 O MET A 181 -0.510 -6.654 -14.768 1.00 0.00 O ATOM 748 CB MET A 181 -0.107 -4.082 -16.379 1.00 0.00 C ATOM 749 CG MET A 181 -1.222 -3.037 -16.296 1.00 0.00 C ATOM 750 SD MET A 181 -0.654 -1.485 -16.971 1.00 0.00 S ATOM 751 CE MET A 181 -0.088 -0.687 -15.478 1.00 0.00 C ATOM 0 H MET A 181 1.942 -5.557 -15.879 1.00 0.00 H new ATOM 0 HA MET A 181 0.407 -3.563 -14.345 1.00 0.00 H new ATOM 0 HB2 MET A 181 0.714 -3.696 -16.984 1.00 0.00 H new ATOM 0 HB3 MET A 181 -0.478 -4.977 -16.879 1.00 0.00 H new ATOM 0 HG2 MET A 181 -2.098 -3.383 -16.845 1.00 0.00 H new ATOM 0 HG3 MET A 181 -1.529 -2.902 -15.259 1.00 0.00 H new ATOM 0 HE1 MET A 181 0.632 0.091 -15.732 1.00 0.00 H new ATOM 0 HE2 MET A 181 -0.937 -0.241 -14.960 1.00 0.00 H new ATOM 0 HE3 MET A 181 0.387 -1.423 -14.829 1.00 0.00 H new ATOM 761 N ILE A 182 -1.283 -5.050 -13.375 1.00 0.00 N ATOM 762 CA ILE A 182 -2.207 -5.935 -12.688 1.00 0.00 C ATOM 763 C ILE A 182 -3.574 -5.257 -12.584 1.00 0.00 C ATOM 764 O ILE A 182 -3.658 -4.032 -12.494 1.00 0.00 O ATOM 765 CB ILE A 182 -1.631 -6.368 -11.338 1.00 0.00 C ATOM 766 CG1 ILE A 182 -1.193 -5.155 -10.514 1.00 0.00 C ATOM 767 CG2 ILE A 182 -0.495 -7.376 -11.524 1.00 0.00 C ATOM 768 CD1 ILE A 182 -2.264 -4.771 -9.492 1.00 0.00 C ATOM 0 H ILE A 182 -1.285 -4.087 -13.038 1.00 0.00 H new ATOM 0 HA ILE A 182 -2.349 -6.854 -13.257 1.00 0.00 H new ATOM 0 HB ILE A 182 -2.418 -6.871 -10.776 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -0.258 -5.378 -10.000 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -0.999 -4.312 -11.177 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -0.104 -7.667 -10.549 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -0.872 -8.258 -12.042 1.00 0.00 H new ATOM 0 HG23 ILE A 182 0.301 -6.922 -12.114 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -1.928 -3.906 -8.920 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -3.190 -4.525 -10.011 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -2.438 -5.608 -8.816 1.00 0.00 H new ATOM 780 N PRO A 183 -4.639 -6.103 -12.599 1.00 0.00 N ATOM 781 CA PRO A 183 -5.998 -5.598 -12.507 1.00 0.00 C ATOM 782 C PRO A 183 -6.325 -5.158 -11.079 1.00 0.00 C ATOM 783 O PRO A 183 -6.101 -5.907 -10.128 1.00 0.00 O ATOM 784 CB PRO A 183 -6.876 -6.740 -12.992 1.00 0.00 C ATOM 785 CG PRO A 183 -6.020 -7.993 -12.896 1.00 0.00 C ATOM 786 CD PRO A 183 -4.577 -7.558 -12.703 1.00 0.00 C ATOM 0 HA PRO A 183 -6.156 -4.706 -13.113 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -7.772 -6.831 -12.379 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -7.207 -6.570 -14.017 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -6.346 -8.615 -12.062 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -6.120 -8.594 -13.800 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -4.147 -8.001 -11.805 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -3.954 -7.869 -13.542 1.00 0.00 H new ATOM 794 N VAL A 184 -6.847 -3.946 -10.972 1.00 0.00 N ATOM 795 CA VAL A 184 -7.207 -3.397 -9.676 1.00 0.00 C ATOM 796 C VAL A 184 -8.489 -4.069 -9.180 1.00 0.00 C ATOM 797 O VAL A 184 -8.683 -4.234 -7.976 1.00 0.00 O ATOM 798 CB VAL A 184 -7.326 -1.874 -9.766 1.00 0.00 C ATOM 799 CG1 VAL A 184 -7.941 -1.296 -8.490 1.00 0.00 C ATOM 800 CG2 VAL A 184 -5.968 -1.234 -10.060 1.00 0.00 C ATOM 0 H VAL A 184 -7.030 -3.328 -11.762 1.00 0.00 H new ATOM 0 HA VAL A 184 -6.427 -3.605 -8.944 1.00 0.00 H new ATOM 0 HB VAL A 184 -7.993 -1.638 -10.595 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -8.014 -0.212 -8.580 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -8.936 -1.716 -8.343 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -7.311 -1.547 -7.636 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -6.081 -0.151 -10.119 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -5.268 -1.483 -9.262 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -5.586 -1.611 -11.009 1.00 0.00 H new ATOM 810 N PRO A 185 -9.354 -4.448 -10.159 1.00 0.00 N ATOM 811 CA PRO A 185 -10.612 -5.099 -9.834 1.00 0.00 C ATOM 812 C PRO A 185 -10.387 -6.554 -9.420 1.00 0.00 C ATOM 813 O PRO A 185 -11.259 -7.174 -8.813 1.00 0.00 O ATOM 814 CB PRO A 185 -11.461 -4.962 -11.088 1.00 0.00 C ATOM 815 CG PRO A 185 -10.490 -4.655 -12.216 1.00 0.00 C ATOM 816 CD PRO A 185 -9.158 -4.269 -11.594 1.00 0.00 C ATOM 0 HA PRO A 185 -11.112 -4.644 -8.979 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -12.014 -5.880 -11.288 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -12.196 -4.165 -10.977 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -10.371 -5.523 -12.864 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -10.871 -3.844 -12.837 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -8.350 -4.900 -11.965 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -8.893 -3.239 -11.832 1.00 0.00 H new ATOM 824 N TYR A 186 -9.211 -7.059 -9.767 1.00 0.00 N ATOM 825 CA TYR A 186 -8.861 -8.430 -9.439 1.00 0.00 C ATOM 826 C TYR A 186 -7.996 -8.489 -8.178 1.00 0.00 C ATOM 827 O TYR A 186 -7.791 -9.560 -7.611 1.00 0.00 O ATOM 828 CB TYR A 186 -8.046 -8.952 -10.626 1.00 0.00 C ATOM 829 CG TYR A 186 -8.894 -9.348 -11.836 1.00 0.00 C ATOM 830 CD1 TYR A 186 -9.803 -8.454 -12.363 1.00 0.00 C ATOM 831 CD2 TYR A 186 -8.749 -10.599 -12.400 1.00 0.00 C ATOM 832 CE1 TYR A 186 -10.602 -8.827 -13.502 1.00 0.00 C ATOM 833 CE2 TYR A 186 -9.547 -10.972 -13.539 1.00 0.00 C ATOM 834 CZ TYR A 186 -10.434 -10.068 -14.034 1.00 0.00 C ATOM 835 OH TYR A 186 -11.188 -10.420 -15.110 1.00 0.00 O ATOM 0 H TYR A 186 -8.490 -6.543 -10.271 1.00 0.00 H new ATOM 0 HA TYR A 186 -9.758 -9.021 -9.254 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -7.333 -8.185 -10.930 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -7.466 -9.816 -10.303 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -9.916 -7.475 -11.922 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -8.037 -11.298 -11.987 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -11.318 -8.137 -13.924 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -9.443 -11.948 -13.990 1.00 0.00 H new ATOM 0 HH TYR A 186 -10.961 -11.333 -15.384 1.00 0.00 H new ATOM 845 N VAL A 187 -7.512 -7.323 -7.777 1.00 0.00 N ATOM 846 CA VAL A 187 -6.675 -7.227 -6.592 1.00 0.00 C ATOM 847 C VAL A 187 -7.251 -6.171 -5.648 1.00 0.00 C ATOM 848 O VAL A 187 -7.982 -5.280 -6.080 1.00 0.00 O ATOM 849 CB VAL A 187 -5.227 -6.942 -6.997 1.00 0.00 C ATOM 850 CG1 VAL A 187 -4.827 -7.768 -8.221 1.00 0.00 C ATOM 851 CG2 VAL A 187 -5.013 -5.448 -7.250 1.00 0.00 C ATOM 0 H VAL A 187 -7.683 -6.436 -8.251 1.00 0.00 H new ATOM 0 HA VAL A 187 -6.668 -8.174 -6.052 1.00 0.00 H new ATOM 0 HB VAL A 187 -4.583 -7.238 -6.169 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -3.794 -7.546 -8.488 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -4.923 -8.829 -7.991 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -5.479 -7.518 -9.058 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -3.976 -5.272 -7.536 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -5.672 -5.117 -8.053 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -5.238 -4.889 -6.342 1.00 0.00 H new ATOM 861 N GLU A 188 -6.902 -6.303 -4.378 1.00 0.00 N ATOM 862 CA GLU A 188 -7.375 -5.370 -3.369 1.00 0.00 C ATOM 863 C GLU A 188 -6.309 -4.310 -3.085 1.00 0.00 C ATOM 864 O GLU A 188 -5.138 -4.500 -3.408 1.00 0.00 O ATOM 865 CB GLU A 188 -7.773 -6.105 -2.087 1.00 0.00 C ATOM 866 CG GLU A 188 -6.616 -6.127 -1.087 1.00 0.00 C ATOM 867 CD GLU A 188 -6.941 -7.029 0.107 1.00 0.00 C ATOM 868 OE1 GLU A 188 -7.624 -8.050 -0.122 1.00 0.00 O ATOM 869 OE2 GLU A 188 -6.499 -6.674 1.221 1.00 0.00 O ATOM 0 H GLU A 188 -6.296 -7.043 -4.023 1.00 0.00 H new ATOM 0 HA GLU A 188 -8.264 -4.869 -3.753 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -8.638 -5.617 -1.637 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -8.071 -7.126 -2.326 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -5.711 -6.482 -1.580 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -6.413 -5.115 -0.738 1.00 0.00 H new ATOM 876 N LYS A 189 -6.754 -3.216 -2.484 1.00 0.00 N ATOM 877 CA LYS A 189 -5.854 -2.125 -2.154 1.00 0.00 C ATOM 878 C LYS A 189 -5.246 -2.373 -0.771 1.00 0.00 C ATOM 879 O LYS A 189 -5.950 -2.324 0.237 1.00 0.00 O ATOM 880 CB LYS A 189 -6.572 -0.780 -2.278 1.00 0.00 C ATOM 881 CG LYS A 189 -7.686 -0.655 -1.238 1.00 0.00 C ATOM 882 CD LYS A 189 -7.377 0.457 -0.234 1.00 0.00 C ATOM 883 CE LYS A 189 -7.990 1.785 -0.681 1.00 0.00 C ATOM 884 NZ LYS A 189 -7.573 2.880 0.225 1.00 0.00 N ATOM 0 H LYS A 189 -7.726 -3.062 -2.217 1.00 0.00 H new ATOM 0 HA LYS A 189 -5.028 -2.084 -2.864 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -5.856 0.032 -2.148 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -6.991 -0.679 -3.279 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -8.632 -0.447 -1.737 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -7.805 -1.602 -0.712 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -7.766 0.185 0.747 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -6.298 0.568 -0.129 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -7.679 2.011 -1.701 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -9.077 1.706 -0.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -7.998 3.774 -0.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -7.891 2.670 1.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -6.537 2.965 0.212 1.00 0.00 H new ATOM 898 N TYR A 190 -3.948 -2.631 -0.768 1.00 0.00 N ATOM 899 CA TYR A 190 -3.238 -2.886 0.474 1.00 0.00 C ATOM 900 C TYR A 190 -2.083 -1.899 0.658 1.00 0.00 C ATOM 901 O TYR A 190 -1.697 -1.208 -0.283 1.00 0.00 O ATOM 902 CB TYR A 190 -2.669 -4.301 0.353 1.00 0.00 C ATOM 903 CG TYR A 190 -2.316 -4.947 1.694 1.00 0.00 C ATOM 904 CD1 TYR A 190 -3.259 -5.004 2.701 1.00 0.00 C ATOM 905 CD2 TYR A 190 -1.057 -5.473 1.897 1.00 0.00 C ATOM 906 CE1 TYR A 190 -2.926 -5.612 3.964 1.00 0.00 C ATOM 907 CE2 TYR A 190 -0.725 -6.080 3.159 1.00 0.00 C ATOM 908 CZ TYR A 190 -1.676 -6.120 4.130 1.00 0.00 C ATOM 909 OH TYR A 190 -1.363 -6.694 5.323 1.00 0.00 O ATOM 0 H TYR A 190 -3.368 -2.669 -1.606 1.00 0.00 H new ATOM 0 HA TYR A 190 -3.907 -2.776 1.327 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -3.395 -4.930 -0.162 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -1.775 -4.270 -0.270 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -4.245 -4.593 2.542 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -0.320 -5.429 1.109 1.00 0.00 H new ATOM 0 HE1 TYR A 190 -3.653 -5.663 4.761 1.00 0.00 H new ATOM 0 HE2 TYR A 190 0.257 -6.494 3.331 1.00 0.00 H new ATOM 0 HH TYR A 190 -0.437 -7.014 5.299 1.00 0.00 H new ATOM 919 N GLY A 191 -1.564 -1.865 1.876 1.00 0.00 N ATOM 920 CA GLY A 191 -0.461 -0.975 2.196 1.00 0.00 C ATOM 921 C GLY A 191 0.671 -1.117 1.176 1.00 0.00 C ATOM 922 O GLY A 191 1.398 -2.108 1.184 1.00 0.00 O ATOM 0 H GLY A 191 -1.887 -2.440 2.654 1.00 0.00 H new ATOM 0 HA2 GLY A 191 -0.814 0.056 2.212 1.00 0.00 H new ATOM 0 HA3 GLY A 191 -0.086 -1.199 3.195 1.00 0.00 H new TER 926 GLY A 191