USER MOD reduce.3.24.130724 H: found=0, std=0, add=447, rem=0, adj=6 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 Single : A 135 CYS SG : rot -42:sc= 0.812 USER MOD Single : A 136 TYR OH : rot 46:sc= 0.00643 USER MOD Single : A 144 ASN : amide:sc= -1.35 K(o=-1.4,f=-3.8!) USER MOD Single : A 146 ASN : amide:sc= -0.457 X(o=-0.46,f=-0.46) USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 GLN : amide:sc= -2.83! C(o=-2.8!,f=-2.5!) USER MOD Single : A 171 ASN : amide:sc= -0.115 K(o=-0.11,f=-0.74) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 MET CE :methyl 151:sc= -0.305 (180deg=-1.72!) 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 0.835 0.382 -0.514 1.00 0.00 N ATOM 2 CA CYS A 135 1.899 0.188 -1.483 1.00 0.00 C ATOM 3 C CYS A 135 1.881 -1.275 -1.932 1.00 0.00 C ATOM 4 O CYS A 135 2.882 -1.788 -2.431 1.00 0.00 O ATOM 5 CB CYS A 135 3.262 0.594 -0.916 1.00 0.00 C ATOM 6 SG CYS A 135 3.784 -0.598 0.370 1.00 0.00 S ATOM 0 HA CYS A 135 1.730 0.833 -2.345 1.00 0.00 H new ATOM 0 HB2 CYS A 135 4.002 0.627 -1.715 1.00 0.00 H new ATOM 0 HB3 CYS A 135 3.205 1.597 -0.493 1.00 0.00 H new ATOM 0 HG CYS A 135 2.766 -0.900 1.120 1.00 0.00 H new ATOM 12 N TYR A 136 0.732 -1.906 -1.737 1.00 0.00 N ATOM 13 CA TYR A 136 0.569 -3.300 -2.114 1.00 0.00 C ATOM 14 C TYR A 136 -0.887 -3.604 -2.470 1.00 0.00 C ATOM 15 O TYR A 136 -1.789 -2.854 -2.103 1.00 0.00 O ATOM 16 CB TYR A 136 0.965 -4.119 -0.884 1.00 0.00 C ATOM 17 CG TYR A 136 2.397 -4.653 -0.925 1.00 0.00 C ATOM 18 CD1 TYR A 136 2.790 -5.497 -1.943 1.00 0.00 C ATOM 19 CD2 TYR A 136 3.298 -4.289 0.055 1.00 0.00 C ATOM 20 CE1 TYR A 136 4.138 -6.001 -1.983 1.00 0.00 C ATOM 21 CE2 TYR A 136 4.648 -4.792 0.016 1.00 0.00 C ATOM 22 CZ TYR A 136 5.000 -5.623 -1.001 1.00 0.00 C ATOM 23 OH TYR A 136 6.275 -6.098 -1.038 1.00 0.00 O ATOM 0 H TYR A 136 -0.095 -1.477 -1.323 1.00 0.00 H new ATOM 0 HA TYR A 136 1.179 -3.536 -2.986 1.00 0.00 H new ATOM 0 HB2 TYR A 136 0.844 -3.500 0.005 1.00 0.00 H new ATOM 0 HB3 TYR A 136 0.278 -4.959 -0.783 1.00 0.00 H new ATOM 0 HD1 TYR A 136 2.085 -5.780 -2.711 1.00 0.00 H new ATOM 0 HD2 TYR A 136 2.991 -3.627 0.851 1.00 0.00 H new ATOM 0 HE1 TYR A 136 4.457 -6.663 -2.774 1.00 0.00 H new ATOM 0 HE2 TYR A 136 5.363 -4.515 0.777 1.00 0.00 H new ATOM 0 HH TYR A 136 6.631 -6.009 -1.947 1.00 0.00 H new ATOM 33 N VAL A 137 -1.069 -4.708 -3.180 1.00 0.00 N ATOM 34 CA VAL A 137 -2.401 -5.123 -3.589 1.00 0.00 C ATOM 35 C VAL A 137 -2.492 -6.650 -3.544 1.00 0.00 C ATOM 36 O VAL A 137 -1.511 -7.342 -3.810 1.00 0.00 O ATOM 37 CB VAL A 137 -2.728 -4.546 -4.968 1.00 0.00 C ATOM 38 CG1 VAL A 137 -2.812 -3.018 -4.917 1.00 0.00 C ATOM 39 CG2 VAL A 137 -1.706 -5.004 -6.010 1.00 0.00 C ATOM 0 H VAL A 137 -0.317 -5.328 -3.482 1.00 0.00 H new ATOM 0 HA VAL A 137 -3.150 -4.732 -2.901 1.00 0.00 H new ATOM 0 HB VAL A 137 -3.705 -4.926 -5.267 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -3.045 -2.633 -5.910 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -3.594 -2.720 -4.219 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -1.856 -2.612 -4.586 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -1.961 -4.580 -6.981 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -0.712 -4.667 -5.717 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -1.716 -6.092 -6.075 1.00 0.00 H new ATOM 49 N ARG A 138 -3.678 -7.130 -3.203 1.00 0.00 N ATOM 50 CA ARG A 138 -3.911 -8.562 -3.119 1.00 0.00 C ATOM 51 C ARG A 138 -4.801 -9.024 -4.275 1.00 0.00 C ATOM 52 O ARG A 138 -5.977 -8.673 -4.335 1.00 0.00 O ATOM 53 CB ARG A 138 -4.575 -8.935 -1.792 1.00 0.00 C ATOM 54 CG ARG A 138 -4.017 -10.252 -1.251 1.00 0.00 C ATOM 55 CD ARG A 138 -4.416 -10.457 0.212 1.00 0.00 C ATOM 56 NE ARG A 138 -5.727 -11.139 0.289 1.00 0.00 N ATOM 57 CZ ARG A 138 -6.069 -12.003 1.256 1.00 0.00 C ATOM 58 NH1 ARG A 138 -5.200 -12.293 2.233 1.00 0.00 N ATOM 59 NH2 ARG A 138 -7.281 -12.573 1.245 1.00 0.00 N ATOM 0 H ARG A 138 -4.489 -6.553 -2.981 1.00 0.00 H new ATOM 0 HA ARG A 138 -2.943 -9.060 -3.180 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -4.412 -8.140 -1.064 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -5.652 -9.023 -1.932 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -4.387 -11.082 -1.852 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -2.931 -10.254 -1.339 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -3.658 -11.050 0.724 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -4.467 -9.495 0.722 1.00 0.00 H new ATOM 0 HE ARG A 138 -6.413 -10.940 -0.439 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -4.278 -11.857 2.242 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -5.460 -12.950 2.968 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -7.943 -12.350 0.502 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -7.542 -13.230 1.980 1.00 0.00 H new ATOM 73 N ALA A 139 -4.203 -9.805 -5.163 1.00 0.00 N ATOM 74 CA ALA A 139 -4.926 -10.319 -6.313 1.00 0.00 C ATOM 75 C ALA A 139 -5.749 -11.538 -5.891 1.00 0.00 C ATOM 76 O ALA A 139 -5.194 -12.599 -5.610 1.00 0.00 O ATOM 77 CB ALA A 139 -3.937 -10.644 -7.435 1.00 0.00 C ATOM 0 H ALA A 139 -3.226 -10.094 -5.109 1.00 0.00 H new ATOM 0 HA ALA A 139 -5.619 -9.570 -6.696 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -4.480 -11.030 -8.298 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -3.399 -9.740 -7.719 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -3.227 -11.395 -7.088 1.00 0.00 H new ATOM 83 N LEU A 140 -7.060 -11.345 -5.857 1.00 0.00 N ATOM 84 CA LEU A 140 -7.964 -12.415 -5.472 1.00 0.00 C ATOM 85 C LEU A 140 -8.345 -13.224 -6.712 1.00 0.00 C ATOM 86 O LEU A 140 -9.401 -13.856 -6.746 1.00 0.00 O ATOM 87 CB LEU A 140 -9.166 -11.852 -4.711 1.00 0.00 C ATOM 88 CG LEU A 140 -8.945 -11.566 -3.225 1.00 0.00 C ATOM 89 CD1 LEU A 140 -8.550 -10.105 -3.001 1.00 0.00 C ATOM 90 CD2 LEU A 140 -10.173 -11.960 -2.401 1.00 0.00 C ATOM 0 H LEU A 140 -7.517 -10.463 -6.090 1.00 0.00 H new ATOM 0 HA LEU A 140 -7.472 -13.101 -4.782 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -9.477 -10.927 -5.196 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -9.993 -12.556 -4.806 1.00 0.00 H new ATOM 0 HG LEU A 140 -8.115 -12.182 -2.879 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -8.399 -9.928 -1.936 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -7.626 -9.891 -3.539 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -9.343 -9.453 -3.368 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -9.989 -11.746 -1.348 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -11.038 -11.390 -2.741 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -10.369 -13.025 -2.526 1.00 0.00 H new ATOM 102 N PHE A 141 -7.465 -13.180 -7.703 1.00 0.00 N ATOM 103 CA PHE A 141 -7.696 -13.902 -8.942 1.00 0.00 C ATOM 104 C PHE A 141 -6.408 -14.556 -9.445 1.00 0.00 C ATOM 105 O PHE A 141 -5.323 -14.261 -8.946 1.00 0.00 O ATOM 106 CB PHE A 141 -8.172 -12.878 -9.975 1.00 0.00 C ATOM 107 CG PHE A 141 -8.916 -13.491 -11.163 1.00 0.00 C ATOM 108 CD1 PHE A 141 -10.216 -13.867 -11.030 1.00 0.00 C ATOM 109 CD2 PHE A 141 -8.276 -13.660 -12.351 1.00 0.00 C ATOM 110 CE1 PHE A 141 -10.907 -14.435 -12.132 1.00 0.00 C ATOM 111 CE2 PHE A 141 -8.967 -14.228 -13.454 1.00 0.00 C ATOM 112 CZ PHE A 141 -10.267 -14.604 -13.321 1.00 0.00 C ATOM 0 H PHE A 141 -6.591 -12.655 -7.672 1.00 0.00 H new ATOM 0 HA PHE A 141 -8.432 -14.690 -8.781 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -8.826 -12.158 -9.483 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -7.310 -12.324 -10.346 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -10.723 -13.733 -10.086 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -7.243 -13.362 -12.456 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -11.940 -14.733 -12.027 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -8.460 -14.361 -14.398 1.00 0.00 H new ATOM 0 HZ PHE A 141 -10.792 -15.037 -14.160 1.00 0.00 H new ATOM 122 N ASP A 142 -6.569 -15.430 -10.427 1.00 0.00 N ATOM 123 CA ASP A 142 -5.432 -16.128 -11.003 1.00 0.00 C ATOM 124 C ASP A 142 -5.244 -15.679 -12.453 1.00 0.00 C ATOM 125 O ASP A 142 -6.176 -15.748 -13.253 1.00 0.00 O ATOM 126 CB ASP A 142 -5.657 -17.641 -11.002 1.00 0.00 C ATOM 127 CG ASP A 142 -7.123 -18.078 -10.984 1.00 0.00 C ATOM 128 OD1 ASP A 142 -7.781 -17.811 -9.955 1.00 0.00 O ATOM 129 OD2 ASP A 142 -7.552 -18.668 -11.999 1.00 0.00 O ATOM 0 H ASP A 142 -7.470 -15.671 -10.839 1.00 0.00 H new ATOM 0 HA ASP A 142 -4.553 -15.893 -10.403 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -5.178 -18.065 -11.885 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -5.156 -18.067 -10.133 1.00 0.00 H new ATOM 134 N PHE A 143 -4.034 -15.226 -12.746 1.00 0.00 N ATOM 135 CA PHE A 143 -3.712 -14.766 -14.086 1.00 0.00 C ATOM 136 C PHE A 143 -2.199 -14.758 -14.315 1.00 0.00 C ATOM 137 O PHE A 143 -1.426 -14.589 -13.373 1.00 0.00 O ATOM 138 CB PHE A 143 -4.240 -13.334 -14.206 1.00 0.00 C ATOM 139 CG PHE A 143 -4.690 -12.952 -15.618 1.00 0.00 C ATOM 140 CD1 PHE A 143 -3.767 -12.781 -16.601 1.00 0.00 C ATOM 141 CD2 PHE A 143 -6.012 -12.785 -15.888 1.00 0.00 C ATOM 142 CE1 PHE A 143 -4.184 -12.426 -17.912 1.00 0.00 C ATOM 143 CE2 PHE A 143 -6.429 -12.431 -17.199 1.00 0.00 C ATOM 144 CZ PHE A 143 -5.506 -12.259 -18.182 1.00 0.00 C ATOM 0 H PHE A 143 -3.265 -15.168 -12.079 1.00 0.00 H new ATOM 0 HA PHE A 143 -4.161 -15.430 -14.825 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -5.079 -13.209 -13.522 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -3.461 -12.643 -13.885 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -2.717 -12.915 -16.386 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -6.745 -12.921 -15.106 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -3.451 -12.289 -18.694 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -7.479 -12.299 -17.415 1.00 0.00 H new ATOM 0 HZ PHE A 143 -5.823 -11.989 -19.179 1.00 0.00 H new ATOM 154 N ASN A 144 -1.822 -14.944 -15.572 1.00 0.00 N ATOM 155 CA ASN A 144 -0.416 -14.962 -15.936 1.00 0.00 C ATOM 156 C ASN A 144 -0.224 -14.196 -17.247 1.00 0.00 C ATOM 157 O ASN A 144 -1.123 -14.159 -18.086 1.00 0.00 O ATOM 158 CB ASN A 144 0.081 -16.393 -16.148 1.00 0.00 C ATOM 159 CG ASN A 144 -0.631 -17.052 -17.332 1.00 0.00 C ATOM 160 OD1 ASN A 144 -0.528 -16.620 -18.469 1.00 0.00 O ATOM 161 ND2 ASN A 144 -1.356 -18.116 -17.002 1.00 0.00 N ATOM 0 H ASN A 144 -2.466 -15.083 -16.351 1.00 0.00 H new ATOM 0 HA ASN A 144 0.148 -14.502 -15.125 1.00 0.00 H new ATOM 0 HB2 ASN A 144 1.157 -16.386 -16.324 1.00 0.00 H new ATOM 0 HB3 ASN A 144 -0.090 -16.979 -15.245 1.00 0.00 H new ATOM 0 HD21 ASN A 144 -1.870 -18.625 -17.721 1.00 0.00 H new ATOM 0 HD22 ASN A 144 -1.398 -18.423 -16.030 1.00 0.00 H new ATOM 168 N GLY A 145 0.954 -13.604 -17.382 1.00 0.00 N ATOM 169 CA GLY A 145 1.276 -12.842 -18.577 1.00 0.00 C ATOM 170 C GLY A 145 2.706 -13.124 -19.038 1.00 0.00 C ATOM 171 O GLY A 145 3.072 -14.275 -19.272 1.00 0.00 O ATOM 0 H GLY A 145 1.697 -13.637 -16.684 1.00 0.00 H new ATOM 0 HA2 GLY A 145 0.577 -13.096 -19.374 1.00 0.00 H new ATOM 0 HA3 GLY A 145 1.158 -11.777 -18.376 1.00 0.00 H new ATOM 175 N ASN A 146 3.478 -12.054 -19.157 1.00 0.00 N ATOM 176 CA ASN A 146 4.861 -12.172 -19.587 1.00 0.00 C ATOM 177 C ASN A 146 5.509 -10.786 -19.593 1.00 0.00 C ATOM 178 O ASN A 146 6.371 -10.503 -20.423 1.00 0.00 O ATOM 179 CB ASN A 146 4.951 -12.742 -21.004 1.00 0.00 C ATOM 180 CG ASN A 146 4.414 -11.743 -22.031 1.00 0.00 C ATOM 181 OD1 ASN A 146 3.240 -11.414 -22.062 1.00 0.00 O ATOM 182 ND2 ASN A 146 5.338 -11.281 -22.869 1.00 0.00 N ATOM 0 H ASN A 146 3.172 -11.101 -18.963 1.00 0.00 H new ATOM 0 HA ASN A 146 5.373 -12.842 -18.896 1.00 0.00 H new ATOM 0 HB2 ASN A 146 5.987 -12.987 -21.236 1.00 0.00 H new ATOM 0 HB3 ASN A 146 4.383 -13.671 -21.063 1.00 0.00 H new ATOM 0 HD21 ASN A 146 5.080 -10.610 -23.592 1.00 0.00 H new ATOM 0 HD22 ASN A 146 6.304 -11.598 -22.788 1.00 0.00 H new ATOM 189 N ASP A 147 5.068 -9.958 -18.657 1.00 0.00 N ATOM 190 CA ASP A 147 5.593 -8.608 -18.545 1.00 0.00 C ATOM 191 C ASP A 147 5.012 -7.743 -19.665 1.00 0.00 C ATOM 192 O ASP A 147 3.908 -8.001 -20.144 1.00 0.00 O ATOM 193 CB ASP A 147 7.118 -8.597 -18.683 1.00 0.00 C ATOM 194 CG ASP A 147 7.822 -9.858 -18.177 1.00 0.00 C ATOM 195 OD1 ASP A 147 7.364 -10.386 -17.140 1.00 0.00 O ATOM 196 OD2 ASP A 147 8.801 -10.265 -18.838 1.00 0.00 O ATOM 0 H ASP A 147 4.353 -10.196 -17.969 1.00 0.00 H new ATOM 0 HA ASP A 147 5.315 -8.219 -17.565 1.00 0.00 H new ATOM 0 HB2 ASP A 147 7.372 -8.454 -19.733 1.00 0.00 H new ATOM 0 HB3 ASP A 147 7.511 -7.737 -18.140 1.00 0.00 H new ATOM 201 N GLU A 148 5.779 -6.733 -20.049 1.00 0.00 N ATOM 202 CA GLU A 148 5.353 -5.830 -21.104 1.00 0.00 C ATOM 203 C GLU A 148 3.946 -5.303 -20.815 1.00 0.00 C ATOM 204 O GLU A 148 3.120 -5.199 -21.721 1.00 0.00 O ATOM 205 CB GLU A 148 5.413 -6.514 -22.471 1.00 0.00 C ATOM 206 CG GLU A 148 5.587 -5.486 -23.590 1.00 0.00 C ATOM 207 CD GLU A 148 7.032 -4.987 -23.657 1.00 0.00 C ATOM 208 OE1 GLU A 148 7.445 -4.314 -22.689 1.00 0.00 O ATOM 209 OE2 GLU A 148 7.691 -5.292 -24.675 1.00 0.00 O ATOM 0 H GLU A 148 6.693 -6.520 -19.648 1.00 0.00 H new ATOM 0 HA GLU A 148 6.039 -4.983 -21.129 1.00 0.00 H new ATOM 0 HB2 GLU A 148 6.241 -7.223 -22.491 1.00 0.00 H new ATOM 0 HB3 GLU A 148 4.500 -7.086 -22.636 1.00 0.00 H new ATOM 0 HG2 GLU A 148 5.308 -5.932 -24.545 1.00 0.00 H new ATOM 0 HG3 GLU A 148 4.915 -4.644 -23.423 1.00 0.00 H new ATOM 216 N GLU A 149 3.716 -4.984 -19.550 1.00 0.00 N ATOM 217 CA GLU A 149 2.423 -4.471 -19.131 1.00 0.00 C ATOM 218 C GLU A 149 1.525 -5.616 -18.657 1.00 0.00 C ATOM 219 O GLU A 149 0.301 -5.508 -18.700 1.00 0.00 O ATOM 220 CB GLU A 149 1.755 -3.681 -20.258 1.00 0.00 C ATOM 221 CG GLU A 149 2.741 -2.707 -20.904 1.00 0.00 C ATOM 222 CD GLU A 149 2.644 -2.761 -22.431 1.00 0.00 C ATOM 223 OE1 GLU A 149 1.520 -3.007 -22.919 1.00 0.00 O ATOM 224 OE2 GLU A 149 3.696 -2.554 -23.074 1.00 0.00 O ATOM 0 H GLU A 149 4.403 -5.071 -18.801 1.00 0.00 H new ATOM 0 HA GLU A 149 2.579 -3.788 -18.296 1.00 0.00 H new ATOM 0 HB2 GLU A 149 1.372 -4.369 -21.011 1.00 0.00 H new ATOM 0 HB3 GLU A 149 0.900 -3.131 -19.864 1.00 0.00 H new ATOM 0 HG2 GLU A 149 2.536 -1.694 -20.559 1.00 0.00 H new ATOM 0 HG3 GLU A 149 3.756 -2.951 -20.592 1.00 0.00 H new ATOM 231 N ASP A 150 2.169 -6.686 -18.217 1.00 0.00 N ATOM 232 CA ASP A 150 1.445 -7.850 -17.736 1.00 0.00 C ATOM 233 C ASP A 150 2.198 -8.461 -16.552 1.00 0.00 C ATOM 234 O ASP A 150 3.392 -8.741 -16.648 1.00 0.00 O ATOM 235 CB ASP A 150 1.332 -8.918 -18.825 1.00 0.00 C ATOM 236 CG ASP A 150 -0.097 -9.258 -19.253 1.00 0.00 C ATOM 237 OD1 ASP A 150 -0.775 -9.952 -18.465 1.00 0.00 O ATOM 238 OD2 ASP A 150 -0.478 -8.816 -20.357 1.00 0.00 O ATOM 0 H ASP A 150 3.185 -6.772 -18.183 1.00 0.00 H new ATOM 0 HA ASP A 150 0.446 -7.527 -17.442 1.00 0.00 H new ATOM 0 HB2 ASP A 150 1.887 -8.582 -19.701 1.00 0.00 H new ATOM 0 HB3 ASP A 150 1.815 -9.829 -18.471 1.00 0.00 H new ATOM 243 N LEU A 151 1.469 -8.650 -15.462 1.00 0.00 N ATOM 244 CA LEU A 151 2.052 -9.222 -14.260 1.00 0.00 C ATOM 245 C LEU A 151 1.277 -10.482 -13.872 1.00 0.00 C ATOM 246 O LEU A 151 0.083 -10.417 -13.583 1.00 0.00 O ATOM 247 CB LEU A 151 2.121 -8.175 -13.147 1.00 0.00 C ATOM 248 CG LEU A 151 2.869 -8.592 -11.879 1.00 0.00 C ATOM 249 CD1 LEU A 151 4.300 -9.025 -12.205 1.00 0.00 C ATOM 250 CD2 LEU A 151 2.833 -7.479 -10.829 1.00 0.00 C ATOM 0 H LEU A 151 0.479 -8.417 -15.386 1.00 0.00 H new ATOM 0 HA LEU A 151 3.083 -9.526 -14.444 1.00 0.00 H new ATOM 0 HB2 LEU A 151 2.596 -7.279 -13.547 1.00 0.00 H new ATOM 0 HB3 LEU A 151 1.103 -7.900 -12.871 1.00 0.00 H new ATOM 0 HG LEU A 151 2.360 -9.455 -11.451 1.00 0.00 H new ATOM 0 HD11 LEU A 151 4.810 -9.316 -11.287 1.00 0.00 H new ATOM 0 HD12 LEU A 151 4.277 -9.871 -12.891 1.00 0.00 H new ATOM 0 HD13 LEU A 151 4.834 -8.196 -12.669 1.00 0.00 H new ATOM 0 HD21 LEU A 151 3.372 -7.802 -9.938 1.00 0.00 H new ATOM 0 HD22 LEU A 151 3.303 -6.582 -11.233 1.00 0.00 H new ATOM 0 HD23 LEU A 151 1.798 -7.259 -10.567 1.00 0.00 H new ATOM 262 N PRO A 152 2.006 -11.630 -13.878 1.00 0.00 N ATOM 263 CA PRO A 152 1.399 -12.904 -13.531 1.00 0.00 C ATOM 264 C PRO A 152 1.178 -13.012 -12.020 1.00 0.00 C ATOM 265 O PRO A 152 1.998 -12.540 -11.234 1.00 0.00 O ATOM 266 CB PRO A 152 2.357 -13.955 -14.067 1.00 0.00 C ATOM 267 CG PRO A 152 3.681 -13.242 -14.281 1.00 0.00 C ATOM 268 CD PRO A 152 3.421 -11.746 -14.215 1.00 0.00 C ATOM 0 HA PRO A 152 0.407 -13.030 -13.965 1.00 0.00 H new ATOM 0 HB2 PRO A 152 2.467 -14.779 -13.362 1.00 0.00 H new ATOM 0 HB3 PRO A 152 1.987 -14.381 -15.000 1.00 0.00 H new ATOM 0 HG2 PRO A 152 4.402 -13.538 -13.519 1.00 0.00 H new ATOM 0 HG3 PRO A 152 4.109 -13.513 -15.246 1.00 0.00 H new ATOM 0 HD2 PRO A 152 4.048 -11.268 -13.462 1.00 0.00 H new ATOM 0 HD3 PRO A 152 3.642 -11.263 -15.167 1.00 0.00 H new ATOM 276 N PHE A 153 0.066 -13.635 -11.660 1.00 0.00 N ATOM 277 CA PHE A 153 -0.273 -13.811 -10.258 1.00 0.00 C ATOM 278 C PHE A 153 -1.231 -14.989 -10.069 1.00 0.00 C ATOM 279 O PHE A 153 -1.711 -15.566 -11.044 1.00 0.00 O ATOM 280 CB PHE A 153 -0.966 -12.526 -9.801 1.00 0.00 C ATOM 281 CG PHE A 153 -2.197 -12.155 -10.630 1.00 0.00 C ATOM 282 CD1 PHE A 153 -3.354 -12.854 -10.482 1.00 0.00 C ATOM 283 CD2 PHE A 153 -2.135 -11.124 -11.515 1.00 0.00 C ATOM 284 CE1 PHE A 153 -4.496 -12.509 -11.251 1.00 0.00 C ATOM 285 CE2 PHE A 153 -3.277 -10.780 -12.285 1.00 0.00 C ATOM 286 CZ PHE A 153 -4.434 -11.479 -12.136 1.00 0.00 C ATOM 0 H PHE A 153 -0.612 -14.024 -12.315 1.00 0.00 H new ATOM 0 HA PHE A 153 0.628 -14.015 -9.680 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -1.263 -12.636 -8.758 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -0.251 -11.705 -9.844 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -3.404 -13.672 -9.779 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -1.217 -10.567 -11.632 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -5.414 -13.065 -11.133 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -3.227 -9.963 -12.989 1.00 0.00 H new ATOM 0 HZ PHE A 153 -5.303 -11.216 -12.721 1.00 0.00 H new ATOM 296 N LYS A 154 -1.481 -15.310 -8.809 1.00 0.00 N ATOM 297 CA LYS A 154 -2.375 -16.408 -8.479 1.00 0.00 C ATOM 298 C LYS A 154 -3.393 -15.937 -7.440 1.00 0.00 C ATOM 299 O LYS A 154 -3.040 -15.242 -6.489 1.00 0.00 O ATOM 300 CB LYS A 154 -1.574 -17.637 -8.044 1.00 0.00 C ATOM 301 CG LYS A 154 -1.810 -17.949 -6.564 1.00 0.00 C ATOM 302 CD LYS A 154 -0.717 -18.867 -6.016 1.00 0.00 C ATOM 303 CE LYS A 154 -1.294 -20.225 -5.608 1.00 0.00 C ATOM 304 NZ LYS A 154 -1.569 -21.052 -6.804 1.00 0.00 N ATOM 0 H LYS A 154 -1.080 -14.829 -8.003 1.00 0.00 H new ATOM 0 HA LYS A 154 -2.939 -16.718 -9.359 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -1.861 -18.496 -8.651 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -0.512 -17.464 -8.218 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -1.831 -17.021 -5.992 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -2.784 -18.423 -6.439 1.00 0.00 H new ATOM 0 HD2 LYS A 154 0.056 -19.009 -6.771 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -0.240 -18.397 -5.156 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -0.593 -20.743 -4.954 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -2.213 -20.080 -5.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -1.960 -21.970 -6.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -2.255 -20.563 -7.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -0.685 -21.205 -7.331 1.00 0.00 H new ATOM 318 N LYS A 155 -4.639 -16.336 -7.656 1.00 0.00 N ATOM 319 CA LYS A 155 -5.712 -15.964 -6.749 1.00 0.00 C ATOM 320 C LYS A 155 -5.204 -16.037 -5.308 1.00 0.00 C ATOM 321 O LYS A 155 -4.988 -17.126 -4.777 1.00 0.00 O ATOM 322 CB LYS A 155 -6.953 -16.818 -7.008 1.00 0.00 C ATOM 323 CG LYS A 155 -8.175 -16.244 -6.290 1.00 0.00 C ATOM 324 CD LYS A 155 -8.801 -17.282 -5.355 1.00 0.00 C ATOM 325 CE LYS A 155 -7.904 -17.537 -4.142 1.00 0.00 C ATOM 326 NZ LYS A 155 -8.695 -17.478 -2.892 1.00 0.00 N ATOM 0 H LYS A 155 -4.929 -16.913 -8.446 1.00 0.00 H new ATOM 0 HA LYS A 155 -6.021 -14.934 -6.926 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -7.147 -16.868 -8.079 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -6.774 -17.838 -6.669 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -7.884 -15.363 -5.718 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -8.913 -15.919 -7.024 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -9.779 -16.934 -5.022 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -8.961 -18.215 -5.896 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -7.428 -18.513 -4.233 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -7.106 -16.795 -4.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -8.072 -17.653 -2.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -9.129 -16.537 -2.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -9.441 -18.202 -2.919 1.00 0.00 H new ATOM 340 N GLY A 156 -5.029 -14.866 -4.715 1.00 0.00 N ATOM 341 CA GLY A 156 -4.552 -14.784 -3.346 1.00 0.00 C ATOM 342 C GLY A 156 -3.073 -14.394 -3.303 1.00 0.00 C ATOM 343 O GLY A 156 -2.335 -14.836 -2.423 1.00 0.00 O ATOM 0 H GLY A 156 -5.209 -13.965 -5.158 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -5.141 -14.051 -2.795 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -4.693 -15.744 -2.850 1.00 0.00 H new ATOM 347 N ASP A 157 -2.683 -13.570 -4.264 1.00 0.00 N ATOM 348 CA ASP A 157 -1.305 -13.116 -4.348 1.00 0.00 C ATOM 349 C ASP A 157 -1.238 -11.633 -3.979 1.00 0.00 C ATOM 350 O ASP A 157 -2.268 -10.969 -3.876 1.00 0.00 O ATOM 351 CB ASP A 157 -0.758 -13.275 -5.768 1.00 0.00 C ATOM 352 CG ASP A 157 0.690 -12.818 -5.958 1.00 0.00 C ATOM 353 OD1 ASP A 157 0.872 -11.619 -6.259 1.00 0.00 O ATOM 354 OD2 ASP A 157 1.582 -13.679 -5.798 1.00 0.00 O ATOM 0 H ASP A 157 -3.297 -13.205 -4.992 1.00 0.00 H new ATOM 0 HA ASP A 157 -0.709 -13.719 -3.663 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -0.833 -14.324 -6.055 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -1.394 -12.712 -6.451 1.00 0.00 H new ATOM 359 N ILE A 158 -0.016 -11.157 -3.792 1.00 0.00 N ATOM 360 CA ILE A 158 0.199 -9.764 -3.437 1.00 0.00 C ATOM 361 C ILE A 158 1.179 -9.135 -4.429 1.00 0.00 C ATOM 362 O ILE A 158 2.080 -9.808 -4.927 1.00 0.00 O ATOM 363 CB ILE A 158 0.640 -9.646 -1.977 1.00 0.00 C ATOM 364 CG1 ILE A 158 -0.416 -10.229 -1.035 1.00 0.00 C ATOM 365 CG2 ILE A 158 0.984 -8.198 -1.624 1.00 0.00 C ATOM 366 CD1 ILE A 158 0.240 -10.934 0.154 1.00 0.00 C ATOM 0 H ILE A 158 0.836 -11.711 -3.880 1.00 0.00 H new ATOM 0 HA ILE A 158 -0.733 -9.203 -3.511 1.00 0.00 H new ATOM 0 HB ILE A 158 1.548 -10.235 -1.847 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -1.068 -9.433 -0.676 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -1.044 -10.934 -1.579 1.00 0.00 H new ATOM 0 HG21 ILE A 158 1.294 -8.142 -0.581 1.00 0.00 H new ATOM 0 HG22 ILE A 158 1.796 -7.851 -2.263 1.00 0.00 H new ATOM 0 HG23 ILE A 158 0.107 -7.568 -1.776 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -0.532 -11.339 0.808 1.00 0.00 H new ATOM 0 HD12 ILE A 158 0.872 -11.745 -0.207 1.00 0.00 H new ATOM 0 HD13 ILE A 158 0.848 -10.220 0.710 1.00 0.00 H new ATOM 378 N LEU A 159 0.970 -7.852 -4.685 1.00 0.00 N ATOM 379 CA LEU A 159 1.823 -7.125 -5.608 1.00 0.00 C ATOM 380 C LEU A 159 2.017 -5.695 -5.099 1.00 0.00 C ATOM 381 O LEU A 159 1.074 -5.073 -4.610 1.00 0.00 O ATOM 382 CB LEU A 159 1.261 -7.200 -7.030 1.00 0.00 C ATOM 383 CG LEU A 159 0.717 -8.562 -7.464 1.00 0.00 C ATOM 384 CD1 LEU A 159 -0.318 -8.407 -8.580 1.00 0.00 C ATOM 385 CD2 LEU A 159 1.854 -9.504 -7.864 1.00 0.00 C ATOM 0 H LEU A 159 0.222 -7.298 -4.269 1.00 0.00 H new ATOM 0 HA LEU A 159 2.811 -7.584 -5.655 1.00 0.00 H new ATOM 0 HB2 LEU A 159 0.461 -6.465 -7.123 1.00 0.00 H new ATOM 0 HB3 LEU A 159 2.047 -6.906 -7.726 1.00 0.00 H new ATOM 0 HG LEU A 159 0.208 -9.015 -6.613 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -0.689 -9.390 -8.871 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.148 -7.796 -8.224 1.00 0.00 H new ATOM 0 HD13 LEU A 159 0.145 -7.925 -9.441 1.00 0.00 H new ATOM 0 HD21 LEU A 159 1.440 -10.465 -8.168 1.00 0.00 H new ATOM 0 HD22 LEU A 159 2.411 -9.070 -8.694 1.00 0.00 H new ATOM 0 HD23 LEU A 159 2.522 -9.649 -7.015 1.00 0.00 H new ATOM 397 N ARG A 160 3.244 -5.215 -5.230 1.00 0.00 N ATOM 398 CA ARG A 160 3.573 -3.870 -4.789 1.00 0.00 C ATOM 399 C ARG A 160 3.319 -2.865 -5.914 1.00 0.00 C ATOM 400 O ARG A 160 4.088 -2.791 -6.871 1.00 0.00 O ATOM 401 CB ARG A 160 5.037 -3.776 -4.353 1.00 0.00 C ATOM 402 CG ARG A 160 5.340 -2.407 -3.741 1.00 0.00 C ATOM 403 CD ARG A 160 5.666 -2.531 -2.252 1.00 0.00 C ATOM 404 NE ARG A 160 6.462 -1.365 -1.808 1.00 0.00 N ATOM 405 CZ ARG A 160 7.795 -1.280 -1.914 1.00 0.00 C ATOM 406 NH1 ARG A 160 8.490 -2.293 -2.450 1.00 0.00 N ATOM 407 NH2 ARG A 160 8.432 -0.183 -1.485 1.00 0.00 N ATOM 0 H ARG A 160 4.023 -5.733 -5.635 1.00 0.00 H new ATOM 0 HA ARG A 160 2.935 -3.636 -3.937 1.00 0.00 H new ATOM 0 HB2 ARG A 160 5.255 -4.559 -3.627 1.00 0.00 H new ATOM 0 HB3 ARG A 160 5.687 -3.947 -5.211 1.00 0.00 H new ATOM 0 HG2 ARG A 160 6.180 -1.949 -4.264 1.00 0.00 H new ATOM 0 HG3 ARG A 160 4.483 -1.747 -3.875 1.00 0.00 H new ATOM 0 HD2 ARG A 160 4.744 -2.594 -1.674 1.00 0.00 H new ATOM 0 HD3 ARG A 160 6.221 -3.451 -2.068 1.00 0.00 H new ATOM 0 HE ARG A 160 5.964 -0.576 -1.395 1.00 0.00 H new ATOM 0 HH11 ARG A 160 8.004 -3.128 -2.777 1.00 0.00 H new ATOM 0 HH12 ARG A 160 9.505 -2.229 -2.531 1.00 0.00 H new ATOM 0 HH21 ARG A 160 7.902 0.588 -1.078 1.00 0.00 H new ATOM 0 HH22 ARG A 160 9.447 -0.118 -1.566 1.00 0.00 H new ATOM 421 N ILE A 161 2.237 -2.116 -5.761 1.00 0.00 N ATOM 422 CA ILE A 161 1.870 -1.119 -6.752 1.00 0.00 C ATOM 423 C ILE A 161 2.682 0.156 -6.510 1.00 0.00 C ATOM 424 O ILE A 161 2.678 0.698 -5.406 1.00 0.00 O ATOM 425 CB ILE A 161 0.356 -0.894 -6.753 1.00 0.00 C ATOM 426 CG1 ILE A 161 -0.053 0.078 -5.644 1.00 0.00 C ATOM 427 CG2 ILE A 161 -0.395 -2.222 -6.657 1.00 0.00 C ATOM 428 CD1 ILE A 161 -0.018 1.524 -6.142 1.00 0.00 C ATOM 0 H ILE A 161 1.602 -2.180 -4.965 1.00 0.00 H new ATOM 0 HA ILE A 161 2.116 -1.470 -7.754 1.00 0.00 H new ATOM 0 HB ILE A 161 0.078 -0.436 -7.702 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -1.056 -0.166 -5.294 1.00 0.00 H new ATOM 0 HG13 ILE A 161 0.618 -0.033 -4.792 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -1.469 -2.034 -6.660 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -0.135 -2.850 -7.509 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -0.118 -2.731 -5.734 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -0.313 2.194 -5.335 1.00 0.00 H new ATOM 0 HD12 ILE A 161 0.992 1.772 -6.469 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -0.708 1.638 -6.978 1.00 0.00 H new ATOM 440 N ARG A 162 3.357 0.597 -7.561 1.00 0.00 N ATOM 441 CA ARG A 162 4.171 1.798 -7.476 1.00 0.00 C ATOM 442 C ARG A 162 3.701 2.831 -8.503 1.00 0.00 C ATOM 443 O ARG A 162 3.968 4.023 -8.355 1.00 0.00 O ATOM 444 CB ARG A 162 5.647 1.481 -7.723 1.00 0.00 C ATOM 445 CG ARG A 162 6.534 2.668 -7.342 1.00 0.00 C ATOM 446 CD ARG A 162 7.048 2.530 -5.907 1.00 0.00 C ATOM 447 NE ARG A 162 8.457 2.976 -5.828 1.00 0.00 N ATOM 448 CZ ARG A 162 9.006 3.546 -4.747 1.00 0.00 C ATOM 449 NH1 ARG A 162 8.267 3.742 -3.645 1.00 0.00 N ATOM 450 NH2 ARG A 162 10.292 3.920 -4.766 1.00 0.00 N ATOM 0 H ARG A 162 3.357 0.145 -8.475 1.00 0.00 H new ATOM 0 HA ARG A 162 4.061 2.203 -6.470 1.00 0.00 H new ATOM 0 HB2 ARG A 162 5.937 0.605 -7.143 1.00 0.00 H new ATOM 0 HB3 ARG A 162 5.798 1.232 -8.773 1.00 0.00 H new ATOM 0 HG2 ARG A 162 7.377 2.732 -8.030 1.00 0.00 H new ATOM 0 HG3 ARG A 162 5.970 3.595 -7.442 1.00 0.00 H new ATOM 0 HD2 ARG A 162 6.432 3.124 -5.233 1.00 0.00 H new ATOM 0 HD3 ARG A 162 6.968 1.493 -5.581 1.00 0.00 H new ATOM 0 HE ARG A 162 9.048 2.841 -6.649 1.00 0.00 H new ATOM 0 HH11 ARG A 162 7.288 3.457 -3.630 1.00 0.00 H new ATOM 0 HH12 ARG A 162 8.684 4.176 -2.822 1.00 0.00 H new ATOM 0 HH21 ARG A 162 10.854 3.771 -5.604 1.00 0.00 H new ATOM 0 HH22 ARG A 162 10.709 4.354 -3.943 1.00 0.00 H new ATOM 464 N ASP A 163 3.009 2.337 -9.519 1.00 0.00 N ATOM 465 CA ASP A 163 2.499 3.202 -10.568 1.00 0.00 C ATOM 466 C ASP A 163 1.027 2.876 -10.823 1.00 0.00 C ATOM 467 O ASP A 163 0.645 1.706 -10.863 1.00 0.00 O ATOM 468 CB ASP A 163 3.264 2.990 -11.877 1.00 0.00 C ATOM 469 CG ASP A 163 4.571 3.776 -11.997 1.00 0.00 C ATOM 470 OD1 ASP A 163 4.477 5.011 -12.170 1.00 0.00 O ATOM 471 OD2 ASP A 163 5.635 3.125 -11.914 1.00 0.00 O ATOM 0 H ASP A 163 2.790 1.348 -9.638 1.00 0.00 H new ATOM 0 HA ASP A 163 2.621 4.235 -10.242 1.00 0.00 H new ATOM 0 HB2 ASP A 163 3.485 1.928 -11.983 1.00 0.00 H new ATOM 0 HB3 ASP A 163 2.615 3.265 -12.708 1.00 0.00 H new ATOM 476 N LYS A 164 0.240 3.928 -10.989 1.00 0.00 N ATOM 477 CA LYS A 164 -1.183 3.767 -11.238 1.00 0.00 C ATOM 478 C LYS A 164 -1.631 4.790 -12.283 1.00 0.00 C ATOM 479 O LYS A 164 -2.317 5.758 -11.956 1.00 0.00 O ATOM 480 CB LYS A 164 -1.968 3.843 -9.928 1.00 0.00 C ATOM 481 CG LYS A 164 -1.279 3.032 -8.827 1.00 0.00 C ATOM 482 CD LYS A 164 -0.295 3.901 -8.041 1.00 0.00 C ATOM 483 CE LYS A 164 -0.922 4.394 -6.736 1.00 0.00 C ATOM 484 NZ LYS A 164 -1.138 5.857 -6.785 1.00 0.00 N ATOM 0 H LYS A 164 0.560 4.896 -10.956 1.00 0.00 H new ATOM 0 HA LYS A 164 -1.389 2.779 -11.649 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -2.060 4.883 -9.615 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -2.979 3.466 -10.083 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -2.028 2.621 -8.150 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -0.751 2.187 -9.269 1.00 0.00 H new ATOM 0 HD2 LYS A 164 0.607 3.329 -7.822 1.00 0.00 H new ATOM 0 HD3 LYS A 164 0.008 4.754 -8.648 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -1.871 3.886 -6.567 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -0.273 4.144 -5.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -1.564 6.175 -5.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -0.227 6.338 -6.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -1.775 6.088 -7.574 1.00 0.00 H new ATOM 498 N PRO A 165 -1.215 4.535 -13.553 1.00 0.00 N ATOM 499 CA PRO A 165 -1.567 5.423 -14.648 1.00 0.00 C ATOM 500 C PRO A 165 -3.030 5.240 -15.055 1.00 0.00 C ATOM 501 O PRO A 165 -3.771 6.214 -15.178 1.00 0.00 O ATOM 502 CB PRO A 165 -0.594 5.076 -15.764 1.00 0.00 C ATOM 503 CG PRO A 165 -0.042 3.702 -15.423 1.00 0.00 C ATOM 504 CD PRO A 165 -0.402 3.400 -13.977 1.00 0.00 C ATOM 0 HA PRO A 165 -1.485 6.476 -14.378 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -1.096 5.066 -16.731 1.00 0.00 H new ATOM 0 HB3 PRO A 165 0.206 5.813 -15.828 1.00 0.00 H new ATOM 0 HG2 PRO A 165 -0.462 2.946 -16.087 1.00 0.00 H new ATOM 0 HG3 PRO A 165 1.039 3.680 -15.560 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -0.954 2.464 -13.894 1.00 0.00 H new ATOM 0 HD3 PRO A 165 0.490 3.299 -13.359 1.00 0.00 H new ATOM 512 N GLU A 166 -3.404 3.983 -15.251 1.00 0.00 N ATOM 513 CA GLU A 166 -4.766 3.660 -15.640 1.00 0.00 C ATOM 514 C GLU A 166 -5.690 3.695 -14.421 1.00 0.00 C ATOM 515 O GLU A 166 -5.228 3.869 -13.293 1.00 0.00 O ATOM 516 CB GLU A 166 -4.828 2.299 -16.336 1.00 0.00 C ATOM 517 CG GLU A 166 -3.784 2.203 -17.449 1.00 0.00 C ATOM 518 CD GLU A 166 -4.402 2.529 -18.811 1.00 0.00 C ATOM 519 OE1 GLU A 166 -5.344 3.352 -18.823 1.00 0.00 O ATOM 520 OE2 GLU A 166 -3.919 1.950 -19.807 1.00 0.00 O ATOM 0 H GLU A 166 -2.787 3.177 -15.148 1.00 0.00 H new ATOM 0 HA GLU A 166 -5.108 4.412 -16.351 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -4.661 1.506 -15.607 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -5.823 2.145 -16.752 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -2.964 2.891 -17.244 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -3.360 1.199 -17.469 1.00 0.00 H new ATOM 527 N GLU A 167 -6.977 3.528 -14.687 1.00 0.00 N ATOM 528 CA GLU A 167 -7.969 3.539 -13.626 1.00 0.00 C ATOM 529 C GLU A 167 -8.464 2.119 -13.347 1.00 0.00 C ATOM 530 O GLU A 167 -9.620 1.921 -12.980 1.00 0.00 O ATOM 531 CB GLU A 167 -9.134 4.467 -13.974 1.00 0.00 C ATOM 532 CG GLU A 167 -9.080 5.750 -13.142 1.00 0.00 C ATOM 533 CD GLU A 167 -10.168 5.751 -12.065 1.00 0.00 C ATOM 534 OE1 GLU A 167 -11.237 5.164 -12.338 1.00 0.00 O ATOM 535 OE2 GLU A 167 -9.905 6.338 -10.994 1.00 0.00 O ATOM 0 H GLU A 167 -7.356 3.384 -15.623 1.00 0.00 H new ATOM 0 HA GLU A 167 -7.499 3.923 -12.721 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -9.101 4.716 -15.035 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -10.079 3.953 -13.796 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -8.100 5.843 -12.674 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -9.206 6.615 -13.793 1.00 0.00 H new ATOM 542 N GLN A 168 -7.563 1.165 -13.534 1.00 0.00 N ATOM 543 CA GLN A 168 -7.894 -0.232 -13.307 1.00 0.00 C ATOM 544 C GLN A 168 -6.638 -1.099 -13.415 1.00 0.00 C ATOM 545 O GLN A 168 -6.477 -2.062 -12.666 1.00 0.00 O ATOM 546 CB GLN A 168 -8.972 -0.705 -14.283 1.00 0.00 C ATOM 547 CG GLN A 168 -10.372 -0.410 -13.740 1.00 0.00 C ATOM 548 CD GLN A 168 -11.296 -1.616 -13.924 1.00 0.00 C ATOM 549 OE1 GLN A 168 -11.300 -2.276 -14.950 1.00 0.00 O ATOM 550 NE2 GLN A 168 -12.077 -1.863 -12.877 1.00 0.00 N ATOM 0 H GLN A 168 -6.604 1.332 -13.840 1.00 0.00 H new ATOM 0 HA GLN A 168 -8.295 -0.331 -12.298 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -8.839 -0.209 -15.245 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -8.864 -1.775 -14.458 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -10.309 -0.153 -12.683 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -10.791 0.455 -14.254 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -12.022 -1.270 -12.049 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -12.731 -2.645 -12.902 1.00 0.00 H new ATOM 559 N TRP A 169 -5.779 -0.727 -14.353 1.00 0.00 N ATOM 560 CA TRP A 169 -4.542 -1.458 -14.568 1.00 0.00 C ATOM 561 C TRP A 169 -3.388 -0.602 -14.043 1.00 0.00 C ATOM 562 O TRP A 169 -3.030 0.404 -14.654 1.00 0.00 O ATOM 563 CB TRP A 169 -4.380 -1.841 -16.040 1.00 0.00 C ATOM 564 CG TRP A 169 -5.418 -2.850 -16.538 1.00 0.00 C ATOM 565 CD1 TRP A 169 -6.661 -2.608 -16.975 1.00 0.00 C ATOM 566 CD2 TRP A 169 -5.249 -4.280 -16.634 1.00 0.00 C ATOM 567 NE1 TRP A 169 -7.303 -3.772 -17.344 1.00 0.00 N ATOM 568 CE2 TRP A 169 -6.417 -4.822 -17.129 1.00 0.00 C ATOM 569 CE3 TRP A 169 -4.145 -5.089 -16.312 1.00 0.00 C ATOM 570 CZ2 TRP A 169 -6.595 -6.193 -17.348 1.00 0.00 C ATOM 571 CZ3 TRP A 169 -4.338 -6.458 -16.535 1.00 0.00 C ATOM 572 CH2 TRP A 169 -5.509 -7.018 -17.033 1.00 0.00 C ATOM 0 H TRP A 169 -5.916 0.071 -14.973 1.00 0.00 H new ATOM 0 HA TRP A 169 -4.552 -2.401 -14.021 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -4.444 -0.939 -16.649 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -3.383 -2.257 -16.189 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -7.105 -1.625 -17.031 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -8.253 -3.848 -17.708 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -3.221 -4.686 -15.923 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -7.519 -6.592 -17.739 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -3.521 -7.125 -16.304 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -5.580 -8.086 -17.176 1.00 0.00 H new ATOM 583 N TRP A 170 -2.839 -1.032 -12.917 1.00 0.00 N ATOM 584 CA TRP A 170 -1.733 -0.317 -12.302 1.00 0.00 C ATOM 585 C TRP A 170 -0.492 -1.208 -12.381 1.00 0.00 C ATOM 586 O TRP A 170 -0.605 -2.424 -12.531 1.00 0.00 O ATOM 587 CB TRP A 170 -2.078 0.105 -10.873 1.00 0.00 C ATOM 588 CG TRP A 170 -3.296 1.025 -10.772 1.00 0.00 C ATOM 589 CD1 TRP A 170 -3.884 1.724 -11.752 1.00 0.00 C ATOM 590 CD2 TRP A 170 -4.054 1.321 -9.580 1.00 0.00 C ATOM 591 NE1 TRP A 170 -4.963 2.445 -11.281 1.00 0.00 N ATOM 592 CE2 TRP A 170 -5.068 2.193 -9.919 1.00 0.00 C ATOM 593 CE3 TRP A 170 -3.887 0.867 -8.260 1.00 0.00 C ATOM 594 CZ2 TRP A 170 -5.996 2.685 -8.992 1.00 0.00 C ATOM 595 CZ3 TRP A 170 -4.822 1.369 -7.347 1.00 0.00 C ATOM 596 CH2 TRP A 170 -5.850 2.246 -7.671 1.00 0.00 C ATOM 0 H TRP A 170 -3.139 -1.867 -12.414 1.00 0.00 H new ATOM 0 HA TRP A 170 -1.529 0.611 -12.836 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -2.260 -0.788 -10.275 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -1.217 0.611 -10.437 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -3.555 1.724 -12.781 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -5.571 3.051 -11.832 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -3.100 0.185 -7.973 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -6.782 3.367 -9.281 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -4.738 1.052 -6.318 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -6.533 2.587 -6.907 1.00 0.00 H new ATOM 607 N ASN A 171 0.664 -0.570 -12.274 1.00 0.00 N ATOM 608 CA ASN A 171 1.925 -1.290 -12.330 1.00 0.00 C ATOM 609 C ASN A 171 2.388 -1.612 -10.908 1.00 0.00 C ATOM 610 O ASN A 171 2.627 -0.707 -10.110 1.00 0.00 O ATOM 611 CB ASN A 171 3.011 -0.448 -13.002 1.00 0.00 C ATOM 612 CG ASN A 171 3.750 -1.256 -14.070 1.00 0.00 C ATOM 613 OD1 ASN A 171 4.468 -2.200 -13.785 1.00 0.00 O ATOM 614 ND2 ASN A 171 3.536 -0.833 -15.313 1.00 0.00 N ATOM 0 H ASN A 171 0.754 0.438 -12.149 1.00 0.00 H new ATOM 0 HA ASN A 171 1.767 -2.201 -12.907 1.00 0.00 H new ATOM 0 HB2 ASN A 171 2.562 0.436 -13.456 1.00 0.00 H new ATOM 0 HB3 ASN A 171 3.720 -0.096 -12.252 1.00 0.00 H new ATOM 0 HD21 ASN A 171 3.985 -1.306 -16.097 1.00 0.00 H new ATOM 0 HD22 ASN A 171 2.923 -0.036 -15.482 1.00 0.00 H new ATOM 621 N ALA A 172 2.498 -2.903 -10.634 1.00 0.00 N ATOM 622 CA ALA A 172 2.928 -3.355 -9.321 1.00 0.00 C ATOM 623 C ALA A 172 4.012 -4.423 -9.484 1.00 0.00 C ATOM 624 O ALA A 172 4.209 -4.950 -10.578 1.00 0.00 O ATOM 625 CB ALA A 172 1.718 -3.867 -8.537 1.00 0.00 C ATOM 0 H ALA A 172 2.297 -3.651 -11.298 1.00 0.00 H new ATOM 0 HA ALA A 172 3.360 -2.531 -8.753 1.00 0.00 H new ATOM 0 HB1 ALA A 172 2.039 -4.206 -7.552 1.00 0.00 H new ATOM 0 HB2 ALA A 172 0.991 -3.063 -8.424 1.00 0.00 H new ATOM 0 HB3 ALA A 172 1.261 -4.697 -9.075 1.00 0.00 H new ATOM 631 N GLU A 173 4.686 -4.708 -8.380 1.00 0.00 N ATOM 632 CA GLU A 173 5.745 -5.704 -8.387 1.00 0.00 C ATOM 633 C GLU A 173 5.216 -7.045 -7.874 1.00 0.00 C ATOM 634 O GLU A 173 4.189 -7.094 -7.198 1.00 0.00 O ATOM 635 CB GLU A 173 6.944 -5.235 -7.559 1.00 0.00 C ATOM 636 CG GLU A 173 7.328 -6.280 -6.509 1.00 0.00 C ATOM 637 CD GLU A 173 6.452 -6.150 -5.261 1.00 0.00 C ATOM 638 OE1 GLU A 173 5.279 -6.574 -5.345 1.00 0.00 O ATOM 639 OE2 GLU A 173 6.976 -5.630 -4.252 1.00 0.00 O ATOM 0 H GLU A 173 4.520 -4.267 -7.475 1.00 0.00 H new ATOM 0 HA GLU A 173 6.084 -5.838 -9.414 1.00 0.00 H new ATOM 0 HB2 GLU A 173 7.793 -5.046 -8.216 1.00 0.00 H new ATOM 0 HB3 GLU A 173 6.705 -4.292 -7.068 1.00 0.00 H new ATOM 0 HG2 GLU A 173 7.222 -7.280 -6.930 1.00 0.00 H new ATOM 0 HG3 GLU A 173 8.376 -6.159 -6.236 1.00 0.00 H new ATOM 646 N ASP A 174 5.942 -8.101 -8.215 1.00 0.00 N ATOM 647 CA ASP A 174 5.558 -9.438 -7.798 1.00 0.00 C ATOM 648 C ASP A 174 6.351 -9.824 -6.548 1.00 0.00 C ATOM 649 O ASP A 174 6.815 -8.957 -5.810 1.00 0.00 O ATOM 650 CB ASP A 174 5.866 -10.465 -8.889 1.00 0.00 C ATOM 651 CG ASP A 174 7.354 -10.710 -9.145 1.00 0.00 C ATOM 652 OD1 ASP A 174 8.158 -9.893 -8.646 1.00 0.00 O ATOM 653 OD2 ASP A 174 7.654 -11.709 -9.835 1.00 0.00 O ATOM 0 H ASP A 174 6.793 -8.057 -8.775 1.00 0.00 H new ATOM 0 HA ASP A 174 4.486 -9.435 -7.598 1.00 0.00 H new ATOM 0 HB2 ASP A 174 5.399 -11.412 -8.618 1.00 0.00 H new ATOM 0 HB3 ASP A 174 5.402 -10.135 -9.819 1.00 0.00 H new ATOM 658 N SER A 175 6.482 -11.128 -6.349 1.00 0.00 N ATOM 659 CA SER A 175 7.212 -11.640 -5.201 1.00 0.00 C ATOM 660 C SER A 175 8.704 -11.728 -5.525 1.00 0.00 C ATOM 661 O SER A 175 9.465 -12.363 -4.797 1.00 0.00 O ATOM 662 CB SER A 175 6.679 -13.011 -4.777 1.00 0.00 C ATOM 663 OG SER A 175 5.779 -12.917 -3.677 1.00 0.00 O ATOM 0 H SER A 175 6.095 -11.845 -6.963 1.00 0.00 H new ATOM 0 HA SER A 175 7.068 -10.950 -4.369 1.00 0.00 H new ATOM 0 HB2 SER A 175 6.173 -13.480 -5.621 1.00 0.00 H new ATOM 0 HB3 SER A 175 7.514 -13.657 -4.508 1.00 0.00 H new ATOM 0 HG SER A 175 5.460 -13.812 -3.438 1.00 0.00 H new ATOM 669 N GLU A 176 9.078 -11.080 -6.619 1.00 0.00 N ATOM 670 CA GLU A 176 10.466 -11.077 -7.049 1.00 0.00 C ATOM 671 C GLU A 176 10.882 -9.671 -7.486 1.00 0.00 C ATOM 672 O GLU A 176 12.029 -9.451 -7.874 1.00 0.00 O ATOM 673 CB GLU A 176 10.695 -12.091 -8.172 1.00 0.00 C ATOM 674 CG GLU A 176 10.575 -13.524 -7.650 1.00 0.00 C ATOM 675 CD GLU A 176 11.842 -14.326 -7.952 1.00 0.00 C ATOM 676 OE1 GLU A 176 12.130 -14.499 -9.155 1.00 0.00 O ATOM 677 OE2 GLU A 176 12.494 -14.746 -6.971 1.00 0.00 O ATOM 0 H GLU A 176 8.444 -10.554 -7.220 1.00 0.00 H new ATOM 0 HA GLU A 176 11.089 -11.374 -6.205 1.00 0.00 H new ATOM 0 HB2 GLU A 176 9.968 -11.928 -8.968 1.00 0.00 H new ATOM 0 HB3 GLU A 176 11.683 -11.940 -8.607 1.00 0.00 H new ATOM 0 HG2 GLU A 176 10.397 -13.509 -6.575 1.00 0.00 H new ATOM 0 HG3 GLU A 176 9.714 -14.011 -8.109 1.00 0.00 H new ATOM 684 N GLY A 177 9.928 -8.755 -7.410 1.00 0.00 N ATOM 685 CA GLY A 177 10.181 -7.376 -7.793 1.00 0.00 C ATOM 686 C GLY A 177 9.670 -7.097 -9.207 1.00 0.00 C ATOM 687 O GLY A 177 9.466 -5.943 -9.581 1.00 0.00 O ATOM 0 H GLY A 177 8.978 -8.941 -7.089 1.00 0.00 H new ATOM 0 HA2 GLY A 177 9.693 -6.704 -7.087 1.00 0.00 H new ATOM 0 HA3 GLY A 177 11.250 -7.171 -7.742 1.00 0.00 H new ATOM 691 N LYS A 178 9.476 -8.174 -9.955 1.00 0.00 N ATOM 692 CA LYS A 178 8.992 -8.059 -11.320 1.00 0.00 C ATOM 693 C LYS A 178 7.795 -7.106 -11.354 1.00 0.00 C ATOM 694 O LYS A 178 6.726 -7.429 -10.837 1.00 0.00 O ATOM 695 CB LYS A 178 8.693 -9.443 -11.900 1.00 0.00 C ATOM 696 CG LYS A 178 9.977 -10.260 -12.057 1.00 0.00 C ATOM 697 CD LYS A 178 10.118 -10.791 -13.485 1.00 0.00 C ATOM 698 CE LYS A 178 10.491 -9.668 -14.454 1.00 0.00 C ATOM 699 NZ LYS A 178 11.565 -10.109 -15.372 1.00 0.00 N ATOM 0 H LYS A 178 9.645 -9.130 -9.641 1.00 0.00 H new ATOM 0 HA LYS A 178 9.761 -7.629 -11.962 1.00 0.00 H new ATOM 0 HB2 LYS A 178 7.998 -9.972 -11.248 1.00 0.00 H new ATOM 0 HB3 LYS A 178 8.204 -9.338 -12.868 1.00 0.00 H new ATOM 0 HG2 LYS A 178 10.839 -9.641 -11.809 1.00 0.00 H new ATOM 0 HG3 LYS A 178 9.970 -11.093 -11.354 1.00 0.00 H new ATOM 0 HD2 LYS A 178 10.881 -11.569 -13.514 1.00 0.00 H new ATOM 0 HD3 LYS A 178 9.181 -11.251 -13.800 1.00 0.00 H new ATOM 0 HE2 LYS A 178 9.614 -9.369 -15.028 1.00 0.00 H new ATOM 0 HE3 LYS A 178 10.820 -8.792 -13.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 11.805 -9.334 -16.023 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 12.407 -10.372 -14.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 11.239 -10.931 -15.919 1.00 0.00 H new ATOM 713 N ARG A 179 8.015 -5.952 -11.966 1.00 0.00 N ATOM 714 CA ARG A 179 6.968 -4.952 -12.074 1.00 0.00 C ATOM 715 C ARG A 179 6.209 -5.116 -13.392 1.00 0.00 C ATOM 716 O ARG A 179 6.816 -5.147 -14.462 1.00 0.00 O ATOM 717 CB ARG A 179 7.548 -3.537 -12.001 1.00 0.00 C ATOM 718 CG ARG A 179 8.238 -3.297 -10.657 1.00 0.00 C ATOM 719 CD ARG A 179 8.309 -1.802 -10.336 1.00 0.00 C ATOM 720 NE ARG A 179 9.010 -1.593 -9.050 1.00 0.00 N ATOM 721 CZ ARG A 179 9.236 -0.391 -8.504 1.00 0.00 C ATOM 722 NH1 ARG A 179 8.818 0.719 -9.130 1.00 0.00 N ATOM 723 NH2 ARG A 179 9.880 -0.296 -7.333 1.00 0.00 N ATOM 0 H ARG A 179 8.903 -5.688 -12.392 1.00 0.00 H new ATOM 0 HA ARG A 179 6.285 -5.097 -11.237 1.00 0.00 H new ATOM 0 HB2 ARG A 179 8.262 -3.390 -12.812 1.00 0.00 H new ATOM 0 HB3 ARG A 179 6.752 -2.806 -12.141 1.00 0.00 H new ATOM 0 HG2 ARG A 179 7.695 -3.817 -9.868 1.00 0.00 H new ATOM 0 HG3 ARG A 179 9.244 -3.716 -10.681 1.00 0.00 H new ATOM 0 HD2 ARG A 179 8.831 -1.275 -11.134 1.00 0.00 H new ATOM 0 HD3 ARG A 179 7.303 -1.385 -10.283 1.00 0.00 H new ATOM 0 HE ARG A 179 9.342 -2.416 -8.548 1.00 0.00 H new ATOM 0 HH11 ARG A 179 8.328 0.648 -10.022 1.00 0.00 H new ATOM 0 HH12 ARG A 179 8.990 1.634 -8.714 1.00 0.00 H new ATOM 0 HH21 ARG A 179 10.199 -1.140 -6.856 1.00 0.00 H new ATOM 0 HH22 ARG A 179 10.052 0.620 -6.918 1.00 0.00 H new ATOM 737 N GLY A 180 4.894 -5.218 -13.272 1.00 0.00 N ATOM 738 CA GLY A 180 4.046 -5.379 -14.442 1.00 0.00 C ATOM 739 C GLY A 180 2.670 -4.747 -14.213 1.00 0.00 C ATOM 740 O GLY A 180 2.490 -3.964 -13.283 1.00 0.00 O ATOM 0 H GLY A 180 4.394 -5.192 -12.383 1.00 0.00 H new ATOM 0 HA2 GLY A 180 4.522 -4.918 -15.307 1.00 0.00 H new ATOM 0 HA3 GLY A 180 3.930 -6.439 -14.669 1.00 0.00 H new ATOM 744 N MET A 181 1.736 -5.114 -15.078 1.00 0.00 N ATOM 745 CA MET A 181 0.383 -4.594 -14.982 1.00 0.00 C ATOM 746 C MET A 181 -0.532 -5.578 -14.250 1.00 0.00 C ATOM 747 O MET A 181 -0.589 -6.756 -14.601 1.00 0.00 O ATOM 748 CB MET A 181 -0.165 -4.333 -16.386 1.00 0.00 C ATOM 749 CG MET A 181 -1.165 -3.174 -16.379 1.00 0.00 C ATOM 750 SD MET A 181 -0.299 -1.623 -16.208 1.00 0.00 S ATOM 751 CE MET A 181 0.264 -1.396 -17.887 1.00 0.00 C ATOM 0 H MET A 181 1.890 -5.765 -15.848 1.00 0.00 H new ATOM 0 HA MET A 181 0.411 -3.663 -14.415 1.00 0.00 H new ATOM 0 HB2 MET A 181 0.657 -4.104 -17.064 1.00 0.00 H new ATOM 0 HB3 MET A 181 -0.649 -5.233 -16.764 1.00 0.00 H new ATOM 0 HG2 MET A 181 -1.744 -3.177 -17.302 1.00 0.00 H new ATOM 0 HG3 MET A 181 -1.872 -3.298 -15.559 1.00 0.00 H new ATOM 0 HE1 MET A 181 0.352 -0.331 -18.100 1.00 0.00 H new ATOM 0 HE2 MET A 181 1.236 -1.873 -18.012 1.00 0.00 H new ATOM 0 HE3 MET A 181 -0.452 -1.846 -18.575 1.00 0.00 H new ATOM 761 N ILE A 182 -1.227 -5.060 -13.248 1.00 0.00 N ATOM 762 CA ILE A 182 -2.137 -5.878 -12.465 1.00 0.00 C ATOM 763 C ILE A 182 -3.512 -5.208 -12.424 1.00 0.00 C ATOM 764 O ILE A 182 -3.607 -3.982 -12.383 1.00 0.00 O ATOM 765 CB ILE A 182 -1.548 -6.160 -11.081 1.00 0.00 C ATOM 766 CG1 ILE A 182 -1.510 -4.888 -10.232 1.00 0.00 C ATOM 767 CG2 ILE A 182 -0.170 -6.814 -11.195 1.00 0.00 C ATOM 768 CD1 ILE A 182 -2.917 -4.485 -9.786 1.00 0.00 C ATOM 0 H ILE A 182 -1.178 -4.083 -12.960 1.00 0.00 H new ATOM 0 HA ILE A 182 -2.272 -6.853 -12.933 1.00 0.00 H new ATOM 0 HB ILE A 182 -2.200 -6.869 -10.570 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -0.879 -5.049 -9.358 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -1.060 -4.077 -10.805 1.00 0.00 H new ATOM 0 HG21 ILE A 182 0.226 -7.004 -10.197 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -0.258 -7.756 -11.736 1.00 0.00 H new ATOM 0 HG23 ILE A 182 0.505 -6.149 -11.733 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -2.862 -3.578 -9.184 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -3.538 -4.302 -10.663 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -3.355 -5.288 -9.193 1.00 0.00 H new ATOM 780 N PRO A 183 -4.568 -6.065 -12.436 1.00 0.00 N ATOM 781 CA PRO A 183 -5.934 -5.568 -12.401 1.00 0.00 C ATOM 782 C PRO A 183 -6.302 -5.078 -10.998 1.00 0.00 C ATOM 783 O PRO A 183 -6.193 -5.825 -10.027 1.00 0.00 O ATOM 784 CB PRO A 183 -6.788 -6.735 -12.866 1.00 0.00 C ATOM 785 CG PRO A 183 -5.926 -7.976 -12.699 1.00 0.00 C ATOM 786 CD PRO A 183 -4.492 -7.522 -12.484 1.00 0.00 C ATOM 0 HA PRO A 183 -6.084 -4.701 -13.044 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -7.701 -6.811 -12.275 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -7.091 -6.607 -13.905 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -6.270 -8.568 -11.851 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -5.997 -8.612 -13.582 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -4.083 -7.928 -11.559 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -3.844 -7.858 -13.294 1.00 0.00 H new ATOM 794 N VAL A 184 -6.730 -3.826 -10.938 1.00 0.00 N ATOM 795 CA VAL A 184 -7.115 -3.227 -9.672 1.00 0.00 C ATOM 796 C VAL A 184 -8.432 -3.847 -9.198 1.00 0.00 C ATOM 797 O VAL A 184 -8.670 -3.967 -7.997 1.00 0.00 O ATOM 798 CB VAL A 184 -7.190 -1.705 -9.813 1.00 0.00 C ATOM 799 CG1 VAL A 184 -7.924 -1.080 -8.625 1.00 0.00 C ATOM 800 CG2 VAL A 184 -5.793 -1.101 -9.973 1.00 0.00 C ATOM 0 H VAL A 184 -6.819 -3.210 -11.746 1.00 0.00 H new ATOM 0 HA VAL A 184 -6.364 -3.434 -8.909 1.00 0.00 H new ATOM 0 HB VAL A 184 -7.759 -1.479 -10.715 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -7.963 0.002 -8.750 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -8.938 -1.477 -8.574 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -7.394 -1.320 -7.703 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -5.874 -0.018 -10.071 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -5.190 -1.342 -9.098 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -5.319 -1.512 -10.864 1.00 0.00 H new ATOM 810 N PRO A 185 -9.274 -4.236 -10.192 1.00 0.00 N ATOM 811 CA PRO A 185 -10.560 -4.841 -9.890 1.00 0.00 C ATOM 812 C PRO A 185 -10.389 -6.289 -9.423 1.00 0.00 C ATOM 813 O PRO A 185 -11.248 -6.826 -8.726 1.00 0.00 O ATOM 814 CB PRO A 185 -11.362 -4.724 -11.176 1.00 0.00 C ATOM 815 CG PRO A 185 -10.346 -4.481 -12.281 1.00 0.00 C ATOM 816 CD PRO A 185 -9.026 -4.110 -11.626 1.00 0.00 C ATOM 0 HA PRO A 185 -11.075 -4.344 -9.068 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -11.933 -5.633 -11.364 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -12.078 -3.904 -11.117 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -10.230 -5.374 -12.896 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -10.683 -3.681 -12.941 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -8.224 -4.774 -11.949 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -8.725 -3.096 -11.888 1.00 0.00 H new ATOM 824 N TYR A 186 -9.272 -6.878 -9.825 1.00 0.00 N ATOM 825 CA TYR A 186 -8.977 -8.252 -9.457 1.00 0.00 C ATOM 826 C TYR A 186 -8.031 -8.307 -8.256 1.00 0.00 C ATOM 827 O TYR A 186 -7.703 -9.387 -7.768 1.00 0.00 O ATOM 828 CB TYR A 186 -8.279 -8.874 -10.669 1.00 0.00 C ATOM 829 CG TYR A 186 -9.237 -9.335 -11.770 1.00 0.00 C ATOM 830 CD1 TYR A 186 -10.207 -8.476 -12.244 1.00 0.00 C ATOM 831 CD2 TYR A 186 -9.129 -10.609 -12.287 1.00 0.00 C ATOM 832 CE1 TYR A 186 -11.108 -8.910 -13.280 1.00 0.00 C ATOM 833 CE2 TYR A 186 -10.030 -11.044 -13.323 1.00 0.00 C ATOM 834 CZ TYR A 186 -10.975 -10.172 -13.769 1.00 0.00 C ATOM 835 OH TYR A 186 -11.826 -10.582 -14.747 1.00 0.00 O ATOM 0 H TYR A 186 -8.561 -6.429 -10.402 1.00 0.00 H new ATOM 0 HA TYR A 186 -9.891 -8.780 -9.184 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -7.584 -8.147 -11.088 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -7.687 -9.726 -10.336 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -10.290 -7.479 -11.838 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -8.369 -11.280 -11.915 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -11.872 -8.248 -13.660 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -9.957 -12.039 -13.736 1.00 0.00 H new ATOM 0 HH TYR A 186 -11.613 -11.505 -15.000 1.00 0.00 H new ATOM 845 N VAL A 187 -7.620 -7.128 -7.813 1.00 0.00 N ATOM 846 CA VAL A 187 -6.718 -7.026 -6.678 1.00 0.00 C ATOM 847 C VAL A 187 -7.312 -6.067 -5.644 1.00 0.00 C ATOM 848 O VAL A 187 -8.087 -5.177 -5.992 1.00 0.00 O ATOM 849 CB VAL A 187 -5.325 -6.608 -7.152 1.00 0.00 C ATOM 850 CG1 VAL A 187 -4.846 -7.498 -8.300 1.00 0.00 C ATOM 851 CG2 VAL A 187 -5.304 -5.133 -7.557 1.00 0.00 C ATOM 0 H VAL A 187 -7.895 -6.234 -8.220 1.00 0.00 H new ATOM 0 HA VAL A 187 -6.603 -7.995 -6.193 1.00 0.00 H new ATOM 0 HB VAL A 187 -4.635 -6.737 -6.318 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -3.853 -7.179 -8.618 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -4.804 -8.534 -7.964 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -5.539 -7.416 -9.137 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -4.302 -4.861 -7.890 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -6.013 -4.968 -8.368 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -5.582 -4.517 -6.702 1.00 0.00 H new ATOM 861 N GLU A 188 -6.925 -6.282 -4.395 1.00 0.00 N ATOM 862 CA GLU A 188 -7.410 -5.447 -3.309 1.00 0.00 C ATOM 863 C GLU A 188 -6.350 -4.415 -2.919 1.00 0.00 C ATOM 864 O GLU A 188 -5.171 -4.583 -3.230 1.00 0.00 O ATOM 865 CB GLU A 188 -7.817 -6.297 -2.104 1.00 0.00 C ATOM 866 CG GLU A 188 -9.322 -6.568 -2.107 1.00 0.00 C ATOM 867 CD GLU A 188 -10.094 -5.379 -1.533 1.00 0.00 C ATOM 868 OE1 GLU A 188 -9.526 -4.707 -0.644 1.00 0.00 O ATOM 869 OE2 GLU A 188 -11.236 -5.167 -1.996 1.00 0.00 O ATOM 0 H GLU A 188 -6.282 -7.021 -4.111 1.00 0.00 H new ATOM 0 HA GLU A 188 -8.297 -4.915 -3.653 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -7.274 -7.242 -2.121 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -7.538 -5.785 -1.183 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -9.657 -6.767 -3.125 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -9.535 -7.462 -1.521 1.00 0.00 H new ATOM 876 N LYS A 189 -6.807 -3.370 -2.245 1.00 0.00 N ATOM 877 CA LYS A 189 -5.912 -2.311 -1.811 1.00 0.00 C ATOM 878 C LYS A 189 -5.345 -2.661 -0.433 1.00 0.00 C ATOM 879 O LYS A 189 -6.067 -2.638 0.563 1.00 0.00 O ATOM 880 CB LYS A 189 -6.623 -0.956 -1.856 1.00 0.00 C ATOM 881 CG LYS A 189 -5.926 -0.004 -2.830 1.00 0.00 C ATOM 882 CD LYS A 189 -5.018 0.975 -2.084 1.00 0.00 C ATOM 883 CE LYS A 189 -3.557 0.530 -2.154 1.00 0.00 C ATOM 884 NZ LYS A 189 -2.852 1.237 -3.247 1.00 0.00 N ATOM 0 H LYS A 189 -7.785 -3.234 -1.989 1.00 0.00 H new ATOM 0 HA LYS A 189 -5.066 -2.225 -2.493 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -7.661 -1.096 -2.158 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -6.638 -0.516 -0.859 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -5.338 -0.577 -3.546 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -6.672 0.549 -3.400 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -5.119 1.971 -2.515 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -5.331 1.045 -1.042 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -3.063 0.733 -1.204 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -3.506 -0.547 -2.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -1.861 0.923 -3.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -3.314 1.023 -4.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -2.885 2.262 -3.075 1.00 0.00 H new ATOM 898 N TYR A 190 -4.060 -2.978 -0.421 1.00 0.00 N ATOM 899 CA TYR A 190 -3.388 -3.333 0.818 1.00 0.00 C ATOM 900 C TYR A 190 -2.701 -2.115 1.438 1.00 0.00 C ATOM 901 O TYR A 190 -3.009 -1.730 2.564 1.00 0.00 O ATOM 902 CB TYR A 190 -2.324 -4.366 0.439 1.00 0.00 C ATOM 903 CG TYR A 190 -1.711 -5.094 1.637 1.00 0.00 C ATOM 904 CD1 TYR A 190 -2.306 -6.238 2.128 1.00 0.00 C ATOM 905 CD2 TYR A 190 -0.561 -4.608 2.225 1.00 0.00 C ATOM 906 CE1 TYR A 190 -1.729 -6.923 3.255 1.00 0.00 C ATOM 907 CE2 TYR A 190 0.017 -5.293 3.353 1.00 0.00 C ATOM 908 CZ TYR A 190 -0.596 -6.417 3.811 1.00 0.00 C ATOM 909 OH TYR A 190 -0.049 -7.064 4.876 1.00 0.00 O ATOM 0 H TYR A 190 -3.465 -2.997 -1.249 1.00 0.00 H new ATOM 0 HA TYR A 190 -4.103 -3.716 1.546 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -2.768 -5.101 -0.232 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -1.529 -3.867 -0.116 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -3.205 -6.620 1.667 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -0.094 -3.714 1.839 1.00 0.00 H new ATOM 0 HE1 TYR A 190 -2.186 -7.818 3.650 1.00 0.00 H new ATOM 0 HE2 TYR A 190 0.916 -4.923 3.824 1.00 0.00 H new ATOM 0 HH TYR A 190 0.757 -6.590 5.168 1.00 0.00 H new ATOM 919 N GLY A 191 -1.782 -1.542 0.674 1.00 0.00 N ATOM 920 CA GLY A 191 -1.048 -0.375 1.134 1.00 0.00 C ATOM 921 C GLY A 191 0.414 -0.434 0.685 1.00 0.00 C ATOM 922 O GLY A 191 1.276 -0.898 1.429 1.00 0.00 O ATOM 0 H GLY A 191 -1.529 -1.864 -0.260 1.00 0.00 H new ATOM 0 HA2 GLY A 191 -1.515 0.530 0.745 1.00 0.00 H new ATOM 0 HA3 GLY A 191 -1.096 -0.316 2.221 1.00 0.00 H new TER 926 GLY A 191