USER MOD reduce.3.24.130724 H: found=0, std=0, add=453, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 454 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 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 ASN : amide:sc= -1.19 K(o=-1.2,f=-2.9!) USER MOD Single : A 146 ASN : amide:sc= -0.687 K(o=-0.69,f=-2!) 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+ -159:sc= 0 (180deg=-0.00327) USER MOD Single : A 168 GLN : amide:sc=-0.00195 X(o=-0.002,f=0) USER MOD Single : A 171 ASN : amide:sc= -0.0112 X(o=-0.011,f=0) 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 180:sc= 0 (180deg=0) USER MOD Single : A 186 TYR OH : rot -87:sc= 1.11 USER MOD Single : A 189 LYS NZ :NH3+ -108:sc= 1.27 (180deg=-0.702) USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 134 1.325 0.000 0.000 1.00 0.00 N ATOM 2 CA ALA A 134 2.073 0.000 -1.245 1.00 0.00 C ATOM 3 C ALA A 134 2.123 1.423 -1.805 1.00 0.00 C ATOM 4 O ALA A 134 1.166 1.883 -2.426 1.00 0.00 O ATOM 5 CB ALA A 134 1.437 -0.990 -2.224 1.00 0.00 C ATOM 0 HA ALA A 134 3.100 -0.324 -1.075 1.00 0.00 H new ATOM 0 HB1 ALA A 134 1.999 -0.990 -3.158 1.00 0.00 H new ATOM 0 HB2 ALA A 134 1.453 -1.990 -1.791 1.00 0.00 H new ATOM 0 HB3 ALA A 134 0.406 -0.696 -2.420 1.00 0.00 H new ATOM 11 N GLU A 135 3.249 2.080 -1.566 1.00 0.00 N ATOM 12 CA GLU A 135 3.436 3.441 -2.038 1.00 0.00 C ATOM 13 C GLU A 135 4.670 4.065 -1.384 1.00 0.00 C ATOM 14 O GLU A 135 5.404 4.816 -2.025 1.00 0.00 O ATOM 15 CB GLU A 135 2.189 4.288 -1.777 1.00 0.00 C ATOM 16 CG GLU A 135 1.640 4.037 -0.371 1.00 0.00 C ATOM 17 CD GLU A 135 1.507 5.347 0.407 1.00 0.00 C ATOM 18 OE1 GLU A 135 0.981 6.312 -0.190 1.00 0.00 O ATOM 19 OE2 GLU A 135 1.933 5.355 1.582 1.00 0.00 O ATOM 0 H GLU A 135 4.041 1.695 -1.051 1.00 0.00 H new ATOM 0 HA GLU A 135 3.596 3.412 -3.116 1.00 0.00 H new ATOM 0 HB2 GLU A 135 2.432 5.344 -1.893 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.424 4.053 -2.517 1.00 0.00 H new ATOM 0 HG2 GLU A 135 0.667 3.549 -0.438 1.00 0.00 H new ATOM 0 HG3 GLU A 135 2.301 3.357 0.166 1.00 0.00 H new ATOM 26 N TYR A 136 4.860 3.732 -0.116 1.00 0.00 N ATOM 27 CA TYR A 136 5.993 4.250 0.632 1.00 0.00 C ATOM 28 C TYR A 136 6.485 3.229 1.660 1.00 0.00 C ATOM 29 O TYR A 136 5.794 2.942 2.636 1.00 0.00 O ATOM 30 CB TYR A 136 5.480 5.490 1.369 1.00 0.00 C ATOM 31 CG TYR A 136 5.918 6.813 0.738 1.00 0.00 C ATOM 32 CD1 TYR A 136 7.259 7.126 0.652 1.00 0.00 C ATOM 33 CD2 TYR A 136 4.971 7.695 0.256 1.00 0.00 C ATOM 34 CE1 TYR A 136 7.671 8.372 0.058 1.00 0.00 C ATOM 35 CE2 TYR A 136 5.383 8.940 -0.337 1.00 0.00 C ATOM 36 CZ TYR A 136 6.713 9.217 -0.407 1.00 0.00 C ATOM 37 OH TYR A 136 7.102 10.394 -0.967 1.00 0.00 O ATOM 0 H TYR A 136 4.248 3.110 0.413 1.00 0.00 H new ATOM 0 HA TYR A 136 6.824 4.474 -0.037 1.00 0.00 H new ATOM 0 HB2 TYR A 136 4.391 5.457 1.400 1.00 0.00 H new ATOM 0 HB3 TYR A 136 5.830 5.458 2.401 1.00 0.00 H new ATOM 0 HD1 TYR A 136 8.000 6.437 1.030 1.00 0.00 H new ATOM 0 HD2 TYR A 136 3.921 7.451 0.324 1.00 0.00 H new ATOM 0 HE1 TYR A 136 8.717 8.629 -0.016 1.00 0.00 H new ATOM 0 HE2 TYR A 136 4.653 9.639 -0.718 1.00 0.00 H new ATOM 0 HH TYR A 136 6.311 10.896 -1.256 1.00 0.00 H new ATOM 47 N VAL A 137 7.676 2.708 1.405 1.00 0.00 N ATOM 48 CA VAL A 137 8.269 1.725 2.295 1.00 0.00 C ATOM 49 C VAL A 137 9.694 2.156 2.648 1.00 0.00 C ATOM 50 O VAL A 137 10.331 2.886 1.890 1.00 0.00 O ATOM 51 CB VAL A 137 8.206 0.335 1.657 1.00 0.00 C ATOM 52 CG1 VAL A 137 6.774 -0.201 1.652 1.00 0.00 C ATOM 53 CG2 VAL A 137 8.789 0.355 0.242 1.00 0.00 C ATOM 0 H VAL A 137 8.247 2.948 0.594 1.00 0.00 H new ATOM 0 HA VAL A 137 7.707 1.666 3.227 1.00 0.00 H new ATOM 0 HB VAL A 137 8.814 -0.339 2.261 1.00 0.00 H new ATOM 0 HG11 VAL A 137 6.757 -1.190 1.193 1.00 0.00 H new ATOM 0 HG12 VAL A 137 6.408 -0.270 2.676 1.00 0.00 H new ATOM 0 HG13 VAL A 137 6.135 0.474 1.083 1.00 0.00 H new ATOM 0 HG21 VAL A 137 8.732 -0.645 -0.189 1.00 0.00 H new ATOM 0 HG22 VAL A 137 8.220 1.049 -0.376 1.00 0.00 H new ATOM 0 HG23 VAL A 137 9.830 0.674 0.282 1.00 0.00 H new ATOM 63 N ARG A 138 10.152 1.687 3.799 1.00 0.00 N ATOM 64 CA ARG A 138 11.490 2.016 4.262 1.00 0.00 C ATOM 65 C ARG A 138 12.221 0.749 4.712 1.00 0.00 C ATOM 66 O ARG A 138 11.618 -0.142 5.307 1.00 0.00 O ATOM 67 CB ARG A 138 11.442 3.009 5.425 1.00 0.00 C ATOM 68 CG ARG A 138 10.680 2.424 6.615 1.00 0.00 C ATOM 69 CD ARG A 138 9.999 3.528 7.427 1.00 0.00 C ATOM 70 NE ARG A 138 9.453 4.561 6.519 1.00 0.00 N ATOM 71 CZ ARG A 138 9.361 5.861 6.828 1.00 0.00 C ATOM 72 NH1 ARG A 138 9.779 6.296 8.025 1.00 0.00 N ATOM 73 NH2 ARG A 138 8.852 6.727 5.941 1.00 0.00 N ATOM 0 H ARG A 138 9.621 1.082 4.425 1.00 0.00 H new ATOM 0 HA ARG A 138 12.026 2.474 3.431 1.00 0.00 H new ATOM 0 HB2 ARG A 138 12.456 3.267 5.730 1.00 0.00 H new ATOM 0 HB3 ARG A 138 10.962 3.932 5.100 1.00 0.00 H new ATOM 0 HG2 ARG A 138 9.932 1.715 6.259 1.00 0.00 H new ATOM 0 HG3 ARG A 138 11.367 1.869 7.254 1.00 0.00 H new ATOM 0 HD2 ARG A 138 9.198 3.104 8.032 1.00 0.00 H new ATOM 0 HD3 ARG A 138 10.714 3.978 8.115 1.00 0.00 H new ATOM 0 HE ARG A 138 9.126 4.264 5.600 1.00 0.00 H new ATOM 0 HH11 ARG A 138 10.167 5.637 8.700 1.00 0.00 H new ATOM 0 HH12 ARG A 138 9.709 7.286 8.261 1.00 0.00 H new ATOM 0 HH21 ARG A 138 8.534 6.396 5.030 1.00 0.00 H new ATOM 0 HH22 ARG A 138 8.782 7.717 6.177 1.00 0.00 H new ATOM 87 N ALA A 139 13.511 0.711 4.411 1.00 0.00 N ATOM 88 CA ALA A 139 14.331 -0.431 4.777 1.00 0.00 C ATOM 89 C ALA A 139 15.016 -0.153 6.117 1.00 0.00 C ATOM 90 O ALA A 139 15.631 0.897 6.297 1.00 0.00 O ATOM 91 CB ALA A 139 15.334 -0.719 3.658 1.00 0.00 C ATOM 0 H ALA A 139 14.008 1.453 3.918 1.00 0.00 H new ATOM 0 HA ALA A 139 13.715 -1.322 4.900 1.00 0.00 H new ATOM 0 HB1 ALA A 139 15.949 -1.576 3.933 1.00 0.00 H new ATOM 0 HB2 ALA A 139 14.797 -0.939 2.735 1.00 0.00 H new ATOM 0 HB3 ALA A 139 15.972 0.152 3.508 1.00 0.00 H new ATOM 97 N LEU A 140 14.887 -1.112 7.021 1.00 0.00 N ATOM 98 CA LEU A 140 15.486 -0.984 8.339 1.00 0.00 C ATOM 99 C LEU A 140 16.542 -2.075 8.523 1.00 0.00 C ATOM 100 O LEU A 140 16.840 -2.473 9.648 1.00 0.00 O ATOM 101 CB LEU A 140 14.405 -0.986 9.421 1.00 0.00 C ATOM 102 CG LEU A 140 12.967 -0.790 8.934 1.00 0.00 C ATOM 103 CD1 LEU A 140 12.312 -2.133 8.606 1.00 0.00 C ATOM 104 CD2 LEU A 140 12.150 0.013 9.947 1.00 0.00 C ATOM 0 H LEU A 140 14.376 -1.982 6.867 1.00 0.00 H new ATOM 0 HA LEU A 140 15.997 -0.026 8.433 1.00 0.00 H new ATOM 0 HB2 LEU A 140 14.459 -1.932 9.959 1.00 0.00 H new ATOM 0 HB3 LEU A 140 14.635 -0.198 10.138 1.00 0.00 H new ATOM 0 HG LEU A 140 12.995 -0.211 8.011 1.00 0.00 H new ATOM 0 HD11 LEU A 140 11.291 -1.966 8.262 1.00 0.00 H new ATOM 0 HD12 LEU A 140 12.881 -2.634 7.823 1.00 0.00 H new ATOM 0 HD13 LEU A 140 12.296 -2.758 9.499 1.00 0.00 H new ATOM 0 HD21 LEU A 140 11.132 0.138 9.577 1.00 0.00 H new ATOM 0 HD22 LEU A 140 12.127 -0.518 10.899 1.00 0.00 H new ATOM 0 HD23 LEU A 140 12.607 0.992 10.089 1.00 0.00 H new ATOM 116 N PHE A 141 17.080 -2.529 7.400 1.00 0.00 N ATOM 117 CA PHE A 141 18.097 -3.566 7.423 1.00 0.00 C ATOM 118 C PHE A 141 19.223 -3.253 6.435 1.00 0.00 C ATOM 119 O PHE A 141 20.262 -3.912 6.443 1.00 0.00 O ATOM 120 CB PHE A 141 17.415 -4.870 7.004 1.00 0.00 C ATOM 121 CG PHE A 141 17.748 -6.063 7.903 1.00 0.00 C ATOM 122 CD1 PHE A 141 18.937 -6.708 7.765 1.00 0.00 C ATOM 123 CD2 PHE A 141 16.854 -6.478 8.841 1.00 0.00 C ATOM 124 CE1 PHE A 141 19.246 -7.815 8.599 1.00 0.00 C ATOM 125 CE2 PHE A 141 17.163 -7.585 9.675 1.00 0.00 C ATOM 126 CZ PHE A 141 18.352 -8.230 9.536 1.00 0.00 C ATOM 0 H PHE A 141 16.830 -2.197 6.468 1.00 0.00 H new ATOM 0 HA PHE A 141 18.534 -3.636 8.419 1.00 0.00 H new ATOM 0 HB2 PHE A 141 16.335 -4.719 7.003 1.00 0.00 H new ATOM 0 HB3 PHE A 141 17.705 -5.107 5.980 1.00 0.00 H new ATOM 0 HD1 PHE A 141 19.647 -6.378 7.021 1.00 0.00 H new ATOM 0 HD2 PHE A 141 15.910 -5.966 8.951 1.00 0.00 H new ATOM 0 HE1 PHE A 141 20.191 -8.327 8.489 1.00 0.00 H new ATOM 0 HE2 PHE A 141 16.454 -7.915 10.420 1.00 0.00 H new ATOM 0 HZ PHE A 141 18.586 -9.072 10.170 1.00 0.00 H new ATOM 136 N ASP A 142 18.978 -2.247 5.608 1.00 0.00 N ATOM 137 CA ASP A 142 19.958 -1.839 4.616 1.00 0.00 C ATOM 138 C ASP A 142 20.339 -3.045 3.756 1.00 0.00 C ATOM 139 O ASP A 142 20.143 -4.189 4.162 1.00 0.00 O ATOM 140 CB ASP A 142 21.230 -1.312 5.283 1.00 0.00 C ATOM 141 CG ASP A 142 22.510 -1.488 4.464 1.00 0.00 C ATOM 142 OD1 ASP A 142 22.585 -0.858 3.387 1.00 0.00 O ATOM 143 OD2 ASP A 142 23.385 -2.248 4.932 1.00 0.00 O ATOM 0 H ASP A 142 18.115 -1.703 5.605 1.00 0.00 H new ATOM 0 HA ASP A 142 19.515 -1.049 4.009 1.00 0.00 H new ATOM 0 HB2 ASP A 142 21.097 -0.252 5.498 1.00 0.00 H new ATOM 0 HB3 ASP A 142 21.357 -1.818 6.240 1.00 0.00 H new ATOM 148 N PHE A 143 20.878 -2.747 2.582 1.00 0.00 N ATOM 149 CA PHE A 143 21.288 -3.793 1.661 1.00 0.00 C ATOM 150 C PHE A 143 22.194 -3.231 0.562 1.00 0.00 C ATOM 151 O PHE A 143 23.253 -3.789 0.280 1.00 0.00 O ATOM 152 CB PHE A 143 20.015 -4.350 1.020 1.00 0.00 C ATOM 153 CG PHE A 143 20.273 -5.323 -0.132 1.00 0.00 C ATOM 154 CD1 PHE A 143 21.075 -6.404 0.057 1.00 0.00 C ATOM 155 CD2 PHE A 143 19.700 -5.105 -1.346 1.00 0.00 C ATOM 156 CE1 PHE A 143 21.314 -7.307 -1.013 1.00 0.00 C ATOM 157 CE2 PHE A 143 19.939 -6.007 -2.416 1.00 0.00 C ATOM 158 CZ PHE A 143 20.741 -7.089 -2.227 1.00 0.00 C ATOM 0 H PHE A 143 21.040 -1.797 2.248 1.00 0.00 H new ATOM 0 HA PHE A 143 21.844 -4.563 2.196 1.00 0.00 H new ATOM 0 HB2 PHE A 143 19.427 -4.857 1.785 1.00 0.00 H new ATOM 0 HB3 PHE A 143 19.412 -3.520 0.653 1.00 0.00 H new ATOM 0 HD1 PHE A 143 21.531 -6.576 1.021 1.00 0.00 H new ATOM 0 HD2 PHE A 143 19.063 -4.246 -1.496 1.00 0.00 H new ATOM 0 HE1 PHE A 143 21.951 -8.166 -0.863 1.00 0.00 H new ATOM 0 HE2 PHE A 143 19.484 -5.834 -3.380 1.00 0.00 H new ATOM 0 HZ PHE A 143 20.923 -7.775 -3.041 1.00 0.00 H new ATOM 168 N ASN A 144 21.743 -2.134 -0.028 1.00 0.00 N ATOM 169 CA ASN A 144 22.499 -1.491 -1.089 1.00 0.00 C ATOM 170 C ASN A 144 22.892 -2.536 -2.135 1.00 0.00 C ATOM 171 O ASN A 144 23.923 -3.194 -2.004 1.00 0.00 O ATOM 172 CB ASN A 144 23.783 -0.860 -0.546 1.00 0.00 C ATOM 173 CG ASN A 144 23.803 0.648 -0.803 1.00 0.00 C ATOM 174 OD1 ASN A 144 23.698 1.115 -1.925 1.00 0.00 O ATOM 175 ND2 ASN A 144 23.943 1.382 0.298 1.00 0.00 N ATOM 0 H ASN A 144 20.864 -1.674 0.208 1.00 0.00 H new ATOM 0 HA ASN A 144 21.872 -0.714 -1.526 1.00 0.00 H new ATOM 0 HB2 ASN A 144 23.862 -1.051 0.524 1.00 0.00 H new ATOM 0 HB3 ASN A 144 24.649 -1.325 -1.018 1.00 0.00 H new ATOM 0 HD21 ASN A 144 23.968 2.400 0.233 1.00 0.00 H new ATOM 0 HD22 ASN A 144 24.026 0.927 1.207 1.00 0.00 H new ATOM 182 N GLY A 145 22.049 -2.656 -3.151 1.00 0.00 N ATOM 183 CA GLY A 145 22.295 -3.610 -4.219 1.00 0.00 C ATOM 184 C GLY A 145 23.180 -2.999 -5.307 1.00 0.00 C ATOM 185 O GLY A 145 24.330 -3.400 -5.474 1.00 0.00 O ATOM 0 H GLY A 145 21.195 -2.108 -3.257 1.00 0.00 H new ATOM 0 HA2 GLY A 145 22.775 -4.500 -3.813 1.00 0.00 H new ATOM 0 HA3 GLY A 145 21.347 -3.928 -4.653 1.00 0.00 H new ATOM 189 N ASN A 146 22.609 -2.038 -6.018 1.00 0.00 N ATOM 190 CA ASN A 146 23.331 -1.367 -7.086 1.00 0.00 C ATOM 191 C ASN A 146 22.330 -0.729 -8.051 1.00 0.00 C ATOM 192 O ASN A 146 22.687 0.155 -8.827 1.00 0.00 O ATOM 193 CB ASN A 146 24.187 -2.357 -7.879 1.00 0.00 C ATOM 194 CG ASN A 146 25.677 -2.105 -7.643 1.00 0.00 C ATOM 195 OD1 ASN A 146 26.105 -1.008 -7.325 1.00 0.00 O ATOM 196 ND2 ASN A 146 26.441 -3.180 -7.815 1.00 0.00 N ATOM 0 H ASN A 146 21.654 -1.708 -5.876 1.00 0.00 H new ATOM 0 HA ASN A 146 23.976 -0.613 -6.635 1.00 0.00 H new ATOM 0 HB2 ASN A 146 23.936 -3.376 -7.586 1.00 0.00 H new ATOM 0 HB3 ASN A 146 23.963 -2.267 -8.942 1.00 0.00 H new ATOM 0 HD21 ASN A 146 27.450 -3.115 -7.680 1.00 0.00 H new ATOM 0 HD22 ASN A 146 26.018 -4.069 -8.082 1.00 0.00 H new ATOM 203 N ASP A 147 21.095 -1.203 -7.971 1.00 0.00 N ATOM 204 CA ASP A 147 20.039 -0.690 -8.827 1.00 0.00 C ATOM 205 C ASP A 147 20.046 -1.455 -10.152 1.00 0.00 C ATOM 206 O ASP A 147 20.937 -2.267 -10.400 1.00 0.00 O ATOM 207 CB ASP A 147 20.253 0.793 -9.137 1.00 0.00 C ATOM 208 CG ASP A 147 20.851 1.086 -10.514 1.00 0.00 C ATOM 209 OD1 ASP A 147 20.107 0.914 -11.504 1.00 0.00 O ATOM 210 OD2 ASP A 147 22.038 1.476 -10.547 1.00 0.00 O ATOM 0 H ASP A 147 20.802 -1.937 -7.326 1.00 0.00 H new ATOM 0 HA ASP A 147 19.091 -0.816 -8.305 1.00 0.00 H new ATOM 0 HB2 ASP A 147 19.295 1.307 -9.057 1.00 0.00 H new ATOM 0 HB3 ASP A 147 20.908 1.217 -8.376 1.00 0.00 H new ATOM 215 N GLU A 148 19.043 -1.170 -10.969 1.00 0.00 N ATOM 216 CA GLU A 148 18.922 -1.821 -12.262 1.00 0.00 C ATOM 217 C GLU A 148 18.556 -3.296 -12.082 1.00 0.00 C ATOM 218 O GLU A 148 18.568 -4.064 -13.042 1.00 0.00 O ATOM 219 CB GLU A 148 20.211 -1.671 -13.074 1.00 0.00 C ATOM 220 CG GLU A 148 21.046 -2.952 -13.019 1.00 0.00 C ATOM 221 CD GLU A 148 20.804 -3.818 -14.257 1.00 0.00 C ATOM 222 OE1 GLU A 148 20.572 -3.221 -15.330 1.00 0.00 O ATOM 223 OE2 GLU A 148 20.856 -5.057 -14.102 1.00 0.00 O ATOM 0 H GLU A 148 18.306 -0.496 -10.760 1.00 0.00 H new ATOM 0 HA GLU A 148 18.122 -1.334 -12.819 1.00 0.00 H new ATOM 0 HB2 GLU A 148 19.967 -1.436 -14.110 1.00 0.00 H new ATOM 0 HB3 GLU A 148 20.794 -0.836 -12.686 1.00 0.00 H new ATOM 0 HG2 GLU A 148 22.104 -2.698 -12.950 1.00 0.00 H new ATOM 0 HG3 GLU A 148 20.794 -3.516 -12.121 1.00 0.00 H new ATOM 230 N GLU A 149 18.240 -3.647 -10.844 1.00 0.00 N ATOM 231 CA GLU A 149 17.871 -5.016 -10.525 1.00 0.00 C ATOM 232 C GLU A 149 17.560 -5.148 -9.033 1.00 0.00 C ATOM 233 O GLU A 149 16.788 -6.017 -8.631 1.00 0.00 O ATOM 234 CB GLU A 149 18.972 -5.992 -10.945 1.00 0.00 C ATOM 235 CG GLU A 149 18.598 -7.430 -10.580 1.00 0.00 C ATOM 236 CD GLU A 149 19.367 -8.432 -11.442 1.00 0.00 C ATOM 237 OE1 GLU A 149 20.515 -8.101 -11.811 1.00 0.00 O ATOM 238 OE2 GLU A 149 18.790 -9.507 -11.714 1.00 0.00 O ATOM 0 H GLU A 149 18.232 -3.007 -10.050 1.00 0.00 H new ATOM 0 HA GLU A 149 16.972 -5.270 -11.087 1.00 0.00 H new ATOM 0 HB2 GLU A 149 19.139 -5.917 -12.020 1.00 0.00 H new ATOM 0 HB3 GLU A 149 19.909 -5.721 -10.458 1.00 0.00 H new ATOM 0 HG2 GLU A 149 18.814 -7.610 -9.527 1.00 0.00 H new ATOM 0 HG3 GLU A 149 17.526 -7.576 -10.715 1.00 0.00 H new ATOM 245 N ASP A 150 18.178 -4.274 -8.253 1.00 0.00 N ATOM 246 CA ASP A 150 17.977 -4.282 -6.814 1.00 0.00 C ATOM 247 C ASP A 150 18.143 -2.861 -6.272 1.00 0.00 C ATOM 248 O ASP A 150 19.231 -2.291 -6.336 1.00 0.00 O ATOM 249 CB ASP A 150 19.006 -5.176 -6.119 1.00 0.00 C ATOM 250 CG ASP A 150 18.691 -6.673 -6.154 1.00 0.00 C ATOM 251 OD1 ASP A 150 17.557 -7.023 -5.762 1.00 0.00 O ATOM 252 OD2 ASP A 150 19.592 -7.433 -6.571 1.00 0.00 O ATOM 0 H ASP A 150 18.818 -3.555 -8.590 1.00 0.00 H new ATOM 0 HA ASP A 150 16.975 -4.663 -6.616 1.00 0.00 H new ATOM 0 HB2 ASP A 150 19.979 -5.014 -6.584 1.00 0.00 H new ATOM 0 HB3 ASP A 150 19.093 -4.863 -5.079 1.00 0.00 H new ATOM 257 N LEU A 151 17.047 -2.329 -5.750 1.00 0.00 N ATOM 258 CA LEU A 151 17.057 -0.985 -5.197 1.00 0.00 C ATOM 259 C LEU A 151 17.886 -0.974 -3.912 1.00 0.00 C ATOM 260 O LEU A 151 17.526 -1.622 -2.930 1.00 0.00 O ATOM 261 CB LEU A 151 15.628 -0.471 -5.012 1.00 0.00 C ATOM 262 CG LEU A 151 15.445 0.647 -3.984 1.00 0.00 C ATOM 263 CD1 LEU A 151 16.565 1.683 -4.096 1.00 0.00 C ATOM 264 CD2 LEU A 151 14.060 1.284 -4.107 1.00 0.00 C ATOM 0 H LEU A 151 16.146 -2.805 -5.698 1.00 0.00 H new ATOM 0 HA LEU A 151 17.533 -0.291 -5.890 1.00 0.00 H new ATOM 0 HB2 LEU A 151 15.264 -0.115 -5.976 1.00 0.00 H new ATOM 0 HB3 LEU A 151 14.996 -1.310 -4.723 1.00 0.00 H new ATOM 0 HG LEU A 151 15.510 0.209 -2.988 1.00 0.00 H new ATOM 0 HD11 LEU A 151 16.411 2.467 -3.354 1.00 0.00 H new ATOM 0 HD12 LEU A 151 17.526 1.200 -3.920 1.00 0.00 H new ATOM 0 HD13 LEU A 151 16.557 2.121 -5.094 1.00 0.00 H new ATOM 0 HD21 LEU A 151 13.956 2.076 -3.365 1.00 0.00 H new ATOM 0 HD22 LEU A 151 13.940 1.705 -5.105 1.00 0.00 H new ATOM 0 HD23 LEU A 151 13.295 0.526 -3.939 1.00 0.00 H new ATOM 276 N PRO A 152 19.011 -0.210 -3.960 1.00 0.00 N ATOM 277 CA PRO A 152 19.894 -0.105 -2.811 1.00 0.00 C ATOM 278 C PRO A 152 19.287 0.795 -1.733 1.00 0.00 C ATOM 279 O PRO A 152 19.000 1.964 -1.984 1.00 0.00 O ATOM 280 CB PRO A 152 21.201 0.434 -3.367 1.00 0.00 C ATOM 281 CG PRO A 152 20.859 1.047 -4.715 1.00 0.00 C ATOM 282 CD PRO A 152 19.469 0.571 -5.105 1.00 0.00 C ATOM 0 HA PRO A 152 20.052 -1.062 -2.314 1.00 0.00 H new ATOM 0 HB2 PRO A 152 21.633 1.178 -2.698 1.00 0.00 H new ATOM 0 HB3 PRO A 152 21.937 -0.362 -3.476 1.00 0.00 H new ATOM 0 HG2 PRO A 152 20.888 2.135 -4.658 1.00 0.00 H new ATOM 0 HG3 PRO A 152 21.590 0.748 -5.467 1.00 0.00 H new ATOM 0 HD2 PRO A 152 18.804 1.411 -5.303 1.00 0.00 H new ATOM 0 HD3 PRO A 152 19.497 -0.034 -6.011 1.00 0.00 H new ATOM 290 N PHE A 153 19.109 0.215 -0.554 1.00 0.00 N ATOM 291 CA PHE A 153 18.541 0.950 0.563 1.00 0.00 C ATOM 292 C PHE A 153 19.430 0.836 1.803 1.00 0.00 C ATOM 293 O PHE A 153 20.425 0.113 1.793 1.00 0.00 O ATOM 294 CB PHE A 153 17.179 0.322 0.867 1.00 0.00 C ATOM 295 CG PHE A 153 17.228 -1.192 1.088 1.00 0.00 C ATOM 296 CD1 PHE A 153 17.535 -1.690 2.316 1.00 0.00 C ATOM 297 CD2 PHE A 153 16.965 -2.039 0.057 1.00 0.00 C ATOM 298 CE1 PHE A 153 17.580 -3.094 2.522 1.00 0.00 C ATOM 299 CE2 PHE A 153 17.011 -3.443 0.263 1.00 0.00 C ATOM 300 CZ PHE A 153 17.317 -3.941 1.491 1.00 0.00 C ATOM 0 H PHE A 153 19.348 -0.755 -0.349 1.00 0.00 H new ATOM 0 HA PHE A 153 18.454 2.006 0.307 1.00 0.00 H new ATOM 0 HB2 PHE A 153 16.762 0.795 1.756 1.00 0.00 H new ATOM 0 HB3 PHE A 153 16.499 0.537 0.043 1.00 0.00 H new ATOM 0 HD1 PHE A 153 17.745 -1.017 3.134 1.00 0.00 H new ATOM 0 HD2 PHE A 153 16.721 -1.644 -0.918 1.00 0.00 H new ATOM 0 HE1 PHE A 153 17.823 -3.489 3.497 1.00 0.00 H new ATOM 0 HE2 PHE A 153 16.803 -4.116 -0.556 1.00 0.00 H new ATOM 0 HZ PHE A 153 17.351 -5.009 1.647 1.00 0.00 H new ATOM 310 N LYS A 154 19.039 1.561 2.841 1.00 0.00 N ATOM 311 CA LYS A 154 19.788 1.550 4.086 1.00 0.00 C ATOM 312 C LYS A 154 18.920 0.947 5.193 1.00 0.00 C ATOM 313 O LYS A 154 17.791 0.529 4.943 1.00 0.00 O ATOM 314 CB LYS A 154 20.311 2.951 4.409 1.00 0.00 C ATOM 315 CG LYS A 154 21.705 3.165 3.816 1.00 0.00 C ATOM 316 CD LYS A 154 22.621 3.877 4.814 1.00 0.00 C ATOM 317 CE LYS A 154 23.549 4.863 4.101 1.00 0.00 C ATOM 318 NZ LYS A 154 24.559 5.397 5.041 1.00 0.00 N ATOM 0 H LYS A 154 18.213 2.160 2.845 1.00 0.00 H new ATOM 0 HA LYS A 154 20.672 0.919 3.993 1.00 0.00 H new ATOM 0 HB2 LYS A 154 19.625 3.700 4.013 1.00 0.00 H new ATOM 0 HB3 LYS A 154 20.346 3.090 5.490 1.00 0.00 H new ATOM 0 HG2 LYS A 154 22.139 2.204 3.540 1.00 0.00 H new ATOM 0 HG3 LYS A 154 21.629 3.754 2.902 1.00 0.00 H new ATOM 0 HD2 LYS A 154 22.019 4.408 5.551 1.00 0.00 H new ATOM 0 HD3 LYS A 154 23.214 3.141 5.357 1.00 0.00 H new ATOM 0 HE2 LYS A 154 24.046 4.366 3.268 1.00 0.00 H new ATOM 0 HE3 LYS A 154 22.965 5.682 3.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 25.180 6.064 4.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 24.080 5.889 5.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 25.127 4.614 5.422 1.00 0.00 H new ATOM 332 N LYS A 155 19.482 0.922 6.393 1.00 0.00 N ATOM 333 CA LYS A 155 18.773 0.377 7.539 1.00 0.00 C ATOM 334 C LYS A 155 17.795 1.425 8.073 1.00 0.00 C ATOM 335 O LYS A 155 17.766 1.698 9.272 1.00 0.00 O ATOM 336 CB LYS A 155 19.764 -0.131 8.588 1.00 0.00 C ATOM 337 CG LYS A 155 20.513 1.031 9.243 1.00 0.00 C ATOM 338 CD LYS A 155 21.785 1.371 8.463 1.00 0.00 C ATOM 339 CE LYS A 155 21.667 2.743 7.795 1.00 0.00 C ATOM 340 NZ LYS A 155 22.656 3.684 8.367 1.00 0.00 N ATOM 0 H LYS A 155 20.419 1.270 6.596 1.00 0.00 H new ATOM 0 HA LYS A 155 18.182 -0.490 7.245 1.00 0.00 H new ATOM 0 HB2 LYS A 155 19.232 -0.701 9.350 1.00 0.00 H new ATOM 0 HB3 LYS A 155 20.477 -0.811 8.121 1.00 0.00 H new ATOM 0 HG2 LYS A 155 19.865 1.906 9.289 1.00 0.00 H new ATOM 0 HG3 LYS A 155 20.770 0.770 10.270 1.00 0.00 H new ATOM 0 HD2 LYS A 155 22.642 1.363 9.136 1.00 0.00 H new ATOM 0 HD3 LYS A 155 21.967 0.608 7.706 1.00 0.00 H new ATOM 0 HE2 LYS A 155 21.827 2.646 6.721 1.00 0.00 H new ATOM 0 HE3 LYS A 155 20.660 3.136 7.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 22.563 4.610 7.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 22.485 3.789 9.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 23.616 3.315 8.213 1.00 0.00 H new ATOM 354 N GLY A 156 17.017 1.983 7.157 1.00 0.00 N ATOM 355 CA GLY A 156 16.040 2.995 7.521 1.00 0.00 C ATOM 356 C GLY A 156 15.859 4.014 6.394 1.00 0.00 C ATOM 357 O GLY A 156 15.647 5.198 6.651 1.00 0.00 O ATOM 0 H GLY A 156 17.043 1.753 6.164 1.00 0.00 H new ATOM 0 HA2 GLY A 156 15.085 2.520 7.743 1.00 0.00 H new ATOM 0 HA3 GLY A 156 16.361 3.505 8.429 1.00 0.00 H new ATOM 361 N ASP A 157 15.950 3.516 5.169 1.00 0.00 N ATOM 362 CA ASP A 157 15.800 4.368 4.002 1.00 0.00 C ATOM 363 C ASP A 157 14.325 4.416 3.599 1.00 0.00 C ATOM 364 O ASP A 157 13.565 3.496 3.898 1.00 0.00 O ATOM 365 CB ASP A 157 16.596 3.822 2.815 1.00 0.00 C ATOM 366 CG ASP A 157 16.343 4.532 1.484 1.00 0.00 C ATOM 367 OD1 ASP A 157 15.998 5.733 1.539 1.00 0.00 O ATOM 368 OD2 ASP A 157 16.499 3.859 0.443 1.00 0.00 O ATOM 0 H ASP A 157 16.126 2.533 4.960 1.00 0.00 H new ATOM 0 HA ASP A 157 16.171 5.360 4.259 1.00 0.00 H new ATOM 0 HB2 ASP A 157 17.659 3.888 3.048 1.00 0.00 H new ATOM 0 HB3 ASP A 157 16.361 2.764 2.695 1.00 0.00 H new ATOM 373 N ILE A 158 13.964 5.500 2.926 1.00 0.00 N ATOM 374 CA ILE A 158 12.593 5.680 2.479 1.00 0.00 C ATOM 375 C ILE A 158 12.517 5.439 0.970 1.00 0.00 C ATOM 376 O ILE A 158 13.424 5.820 0.231 1.00 0.00 O ATOM 377 CB ILE A 158 12.065 7.051 2.910 1.00 0.00 C ATOM 378 CG1 ILE A 158 11.276 6.948 4.217 1.00 0.00 C ATOM 379 CG2 ILE A 158 11.243 7.697 1.793 1.00 0.00 C ATOM 380 CD1 ILE A 158 12.209 6.691 5.402 1.00 0.00 C ATOM 0 H ILE A 158 14.597 6.261 2.680 1.00 0.00 H new ATOM 0 HA ILE A 158 11.939 4.948 2.952 1.00 0.00 H new ATOM 0 HB ILE A 158 12.918 7.702 3.100 1.00 0.00 H new ATOM 0 HG12 ILE A 158 10.718 7.869 4.382 1.00 0.00 H new ATOM 0 HG13 ILE A 158 10.546 6.142 4.143 1.00 0.00 H new ATOM 0 HG21 ILE A 158 10.880 8.670 2.125 1.00 0.00 H new ATOM 0 HG22 ILE A 158 11.868 7.825 0.909 1.00 0.00 H new ATOM 0 HG23 ILE A 158 10.395 7.057 1.548 1.00 0.00 H new ATOM 0 HD11 ILE A 158 11.623 6.622 6.318 1.00 0.00 H new ATOM 0 HD12 ILE A 158 12.748 5.757 5.245 1.00 0.00 H new ATOM 0 HD13 ILE A 158 12.922 7.511 5.488 1.00 0.00 H new ATOM 392 N LEU A 159 11.428 4.807 0.558 1.00 0.00 N ATOM 393 CA LEU A 159 11.222 4.510 -0.849 1.00 0.00 C ATOM 394 C LEU A 159 9.723 4.515 -1.153 1.00 0.00 C ATOM 395 O LEU A 159 8.907 4.757 -0.265 1.00 0.00 O ATOM 396 CB LEU A 159 11.923 3.204 -1.229 1.00 0.00 C ATOM 397 CG LEU A 159 12.680 2.497 -0.103 1.00 0.00 C ATOM 398 CD1 LEU A 159 12.590 0.977 -0.252 1.00 0.00 C ATOM 399 CD2 LEU A 159 14.129 2.981 -0.029 1.00 0.00 C ATOM 0 H LEU A 159 10.679 4.492 1.174 1.00 0.00 H new ATOM 0 HA LEU A 159 11.676 5.281 -1.472 1.00 0.00 H new ATOM 0 HB2 LEU A 159 11.176 2.516 -1.626 1.00 0.00 H new ATOM 0 HB3 LEU A 159 12.625 3.413 -2.036 1.00 0.00 H new ATOM 0 HG LEU A 159 12.205 2.756 0.843 1.00 0.00 H new ATOM 0 HD11 LEU A 159 13.136 0.499 0.561 1.00 0.00 H new ATOM 0 HD12 LEU A 159 11.545 0.669 -0.217 1.00 0.00 H new ATOM 0 HD13 LEU A 159 13.025 0.679 -1.206 1.00 0.00 H new ATOM 0 HD21 LEU A 159 14.645 2.463 0.779 1.00 0.00 H new ATOM 0 HD22 LEU A 159 14.631 2.771 -0.973 1.00 0.00 H new ATOM 0 HD23 LEU A 159 14.145 4.054 0.160 1.00 0.00 H new ATOM 411 N ARG A 160 9.405 4.243 -2.410 1.00 0.00 N ATOM 412 CA ARG A 160 8.018 4.213 -2.842 1.00 0.00 C ATOM 413 C ARG A 160 7.750 2.959 -3.677 1.00 0.00 C ATOM 414 O ARG A 160 8.605 2.527 -4.448 1.00 0.00 O ATOM 415 CB ARG A 160 7.672 5.452 -3.670 1.00 0.00 C ATOM 416 CG ARG A 160 6.303 5.301 -4.337 1.00 0.00 C ATOM 417 CD ARG A 160 6.420 5.413 -5.858 1.00 0.00 C ATOM 418 NE ARG A 160 5.332 6.265 -6.388 1.00 0.00 N ATOM 419 CZ ARG A 160 4.112 5.812 -6.708 1.00 0.00 C ATOM 420 NH1 ARG A 160 3.817 4.514 -6.555 1.00 0.00 N ATOM 421 NH2 ARG A 160 3.187 6.658 -7.182 1.00 0.00 N ATOM 0 H ARG A 160 10.084 4.041 -3.144 1.00 0.00 H new ATOM 0 HA ARG A 160 7.393 4.201 -1.949 1.00 0.00 H new ATOM 0 HB2 ARG A 160 7.673 6.334 -3.029 1.00 0.00 H new ATOM 0 HB3 ARG A 160 8.436 5.610 -4.431 1.00 0.00 H new ATOM 0 HG2 ARG A 160 5.870 4.337 -4.072 1.00 0.00 H new ATOM 0 HG3 ARG A 160 5.625 6.069 -3.963 1.00 0.00 H new ATOM 0 HD2 ARG A 160 7.388 5.836 -6.126 1.00 0.00 H new ATOM 0 HD3 ARG A 160 6.369 4.422 -6.309 1.00 0.00 H new ATOM 0 HE ARG A 160 5.523 7.259 -6.518 1.00 0.00 H new ATOM 0 HH11 ARG A 160 4.521 3.870 -6.195 1.00 0.00 H new ATOM 0 HH12 ARG A 160 2.888 4.170 -6.799 1.00 0.00 H new ATOM 0 HH21 ARG A 160 3.412 7.646 -7.299 1.00 0.00 H new ATOM 0 HH22 ARG A 160 2.258 6.314 -7.426 1.00 0.00 H new ATOM 435 N ILE A 161 6.558 2.410 -3.495 1.00 0.00 N ATOM 436 CA ILE A 161 6.166 1.215 -4.222 1.00 0.00 C ATOM 437 C ILE A 161 5.553 1.618 -5.565 1.00 0.00 C ATOM 438 O ILE A 161 4.521 2.287 -5.605 1.00 0.00 O ATOM 439 CB ILE A 161 5.247 0.343 -3.364 1.00 0.00 C ATOM 440 CG1 ILE A 161 5.942 -0.962 -2.969 1.00 0.00 C ATOM 441 CG2 ILE A 161 3.913 0.091 -4.070 1.00 0.00 C ATOM 442 CD1 ILE A 161 7.159 -0.688 -2.083 1.00 0.00 C ATOM 0 H ILE A 161 5.851 2.771 -2.855 1.00 0.00 H new ATOM 0 HA ILE A 161 7.038 0.599 -4.441 1.00 0.00 H new ATOM 0 HB ILE A 161 5.026 0.882 -2.443 1.00 0.00 H new ATOM 0 HG12 ILE A 161 5.240 -1.606 -2.440 1.00 0.00 H new ATOM 0 HG13 ILE A 161 6.253 -1.498 -3.865 1.00 0.00 H new ATOM 0 HG21 ILE A 161 3.279 -0.531 -3.438 1.00 0.00 H new ATOM 0 HG22 ILE A 161 3.416 1.042 -4.258 1.00 0.00 H new ATOM 0 HG23 ILE A 161 4.093 -0.418 -5.017 1.00 0.00 H new ATOM 0 HD11 ILE A 161 7.635 -1.632 -1.816 1.00 0.00 H new ATOM 0 HD12 ILE A 161 7.870 -0.063 -2.624 1.00 0.00 H new ATOM 0 HD13 ILE A 161 6.841 -0.173 -1.176 1.00 0.00 H new ATOM 454 N ARG A 162 6.213 1.193 -6.632 1.00 0.00 N ATOM 455 CA ARG A 162 5.746 1.501 -7.973 1.00 0.00 C ATOM 456 C ARG A 162 5.173 0.248 -8.637 1.00 0.00 C ATOM 457 O ARG A 162 4.075 0.281 -9.190 1.00 0.00 O ATOM 458 CB ARG A 162 6.881 2.054 -8.838 1.00 0.00 C ATOM 459 CG ARG A 162 6.447 2.174 -10.300 1.00 0.00 C ATOM 460 CD ARG A 162 7.483 2.949 -11.117 1.00 0.00 C ATOM 461 NE ARG A 162 7.098 4.376 -11.199 1.00 0.00 N ATOM 462 CZ ARG A 162 6.186 4.861 -12.052 1.00 0.00 C ATOM 463 NH1 ARG A 162 5.559 4.036 -12.902 1.00 0.00 N ATOM 464 NH2 ARG A 162 5.900 6.170 -12.056 1.00 0.00 N ATOM 0 H ARG A 162 7.068 0.638 -6.595 1.00 0.00 H new ATOM 0 HA ARG A 162 4.967 2.259 -7.887 1.00 0.00 H new ATOM 0 HB2 ARG A 162 7.185 3.032 -8.464 1.00 0.00 H new ATOM 0 HB3 ARG A 162 7.750 1.400 -8.765 1.00 0.00 H new ATOM 0 HG2 ARG A 162 6.312 1.180 -10.726 1.00 0.00 H new ATOM 0 HG3 ARG A 162 5.482 2.678 -10.357 1.00 0.00 H new ATOM 0 HD2 ARG A 162 8.466 2.855 -10.656 1.00 0.00 H new ATOM 0 HD3 ARG A 162 7.559 2.526 -12.119 1.00 0.00 H new ATOM 0 HE ARG A 162 7.556 5.032 -10.566 1.00 0.00 H new ATOM 0 HH11 ARG A 162 5.776 3.039 -12.899 1.00 0.00 H new ATOM 0 HH12 ARG A 162 4.864 4.405 -13.552 1.00 0.00 H new ATOM 0 HH21 ARG A 162 6.377 6.798 -11.409 1.00 0.00 H new ATOM 0 HH22 ARG A 162 5.205 6.538 -12.706 1.00 0.00 H new ATOM 478 N ASP A 163 5.942 -0.828 -8.559 1.00 0.00 N ATOM 479 CA ASP A 163 5.525 -2.091 -9.146 1.00 0.00 C ATOM 480 C ASP A 163 5.749 -3.217 -8.134 1.00 0.00 C ATOM 481 O ASP A 163 6.417 -3.021 -7.121 1.00 0.00 O ATOM 482 CB ASP A 163 6.340 -2.412 -10.400 1.00 0.00 C ATOM 483 CG ASP A 163 5.564 -2.330 -11.715 1.00 0.00 C ATOM 484 OD1 ASP A 163 5.113 -1.210 -12.039 1.00 0.00 O ATOM 485 OD2 ASP A 163 5.438 -3.389 -12.367 1.00 0.00 O ATOM 0 H ASP A 163 6.852 -0.852 -8.098 1.00 0.00 H new ATOM 0 HA ASP A 163 4.472 -2.007 -9.413 1.00 0.00 H new ATOM 0 HB2 ASP A 163 7.185 -1.725 -10.451 1.00 0.00 H new ATOM 0 HB3 ASP A 163 6.751 -3.417 -10.300 1.00 0.00 H new ATOM 490 N LYS A 164 5.177 -4.370 -8.445 1.00 0.00 N ATOM 491 CA LYS A 164 5.305 -5.528 -7.576 1.00 0.00 C ATOM 492 C LYS A 164 5.122 -6.803 -8.402 1.00 0.00 C ATOM 493 O LYS A 164 4.025 -7.355 -8.464 1.00 0.00 O ATOM 494 CB LYS A 164 4.343 -5.418 -6.392 1.00 0.00 C ATOM 495 CG LYS A 164 4.155 -6.775 -5.711 1.00 0.00 C ATOM 496 CD LYS A 164 2.747 -7.322 -5.954 1.00 0.00 C ATOM 497 CE LYS A 164 2.206 -8.019 -4.704 1.00 0.00 C ATOM 498 NZ LYS A 164 1.767 -7.021 -3.703 1.00 0.00 N ATOM 0 H LYS A 164 4.623 -4.528 -9.287 1.00 0.00 H new ATOM 0 HA LYS A 164 6.304 -5.570 -7.142 1.00 0.00 H new ATOM 0 HB2 LYS A 164 4.728 -4.696 -5.672 1.00 0.00 H new ATOM 0 HB3 LYS A 164 3.379 -5.043 -6.736 1.00 0.00 H new ATOM 0 HG2 LYS A 164 4.893 -7.481 -6.090 1.00 0.00 H new ATOM 0 HG3 LYS A 164 4.330 -6.675 -4.640 1.00 0.00 H new ATOM 0 HD2 LYS A 164 2.081 -6.507 -6.238 1.00 0.00 H new ATOM 0 HD3 LYS A 164 2.765 -8.024 -6.787 1.00 0.00 H new ATOM 0 HE2 LYS A 164 1.370 -8.665 -4.973 1.00 0.00 H new ATOM 0 HE3 LYS A 164 2.977 -8.659 -4.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 1.742 -7.462 -2.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 2.433 -6.222 -3.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 0.817 -6.677 -3.949 1.00 0.00 H new ATOM 512 N PRO A 165 6.244 -7.245 -9.032 1.00 0.00 N ATOM 513 CA PRO A 165 6.217 -8.445 -9.851 1.00 0.00 C ATOM 514 C PRO A 165 6.169 -9.702 -8.980 1.00 0.00 C ATOM 515 O PRO A 165 5.384 -10.613 -9.242 1.00 0.00 O ATOM 516 CB PRO A 165 7.471 -8.364 -10.707 1.00 0.00 C ATOM 517 CG PRO A 165 8.386 -7.368 -10.014 1.00 0.00 C ATOM 518 CD PRO A 165 7.561 -6.618 -8.981 1.00 0.00 C ATOM 0 HA PRO A 165 5.326 -8.508 -10.476 1.00 0.00 H new ATOM 0 HB2 PRO A 165 7.949 -9.340 -10.792 1.00 0.00 H new ATOM 0 HB3 PRO A 165 7.232 -8.037 -11.719 1.00 0.00 H new ATOM 0 HG2 PRO A 165 9.219 -7.883 -9.536 1.00 0.00 H new ATOM 0 HG3 PRO A 165 8.813 -6.674 -10.738 1.00 0.00 H new ATOM 0 HD2 PRO A 165 8.001 -6.701 -7.987 1.00 0.00 H new ATOM 0 HD3 PRO A 165 7.503 -5.555 -9.216 1.00 0.00 H new ATOM 526 N GLU A 166 7.017 -9.712 -7.963 1.00 0.00 N ATOM 527 CA GLU A 166 7.081 -10.843 -7.052 1.00 0.00 C ATOM 528 C GLU A 166 6.302 -10.537 -5.772 1.00 0.00 C ATOM 529 O GLU A 166 5.633 -9.509 -5.678 1.00 0.00 O ATOM 530 CB GLU A 166 8.532 -11.212 -6.737 1.00 0.00 C ATOM 531 CG GLU A 166 9.382 -11.231 -8.009 1.00 0.00 C ATOM 532 CD GLU A 166 9.016 -12.424 -8.894 1.00 0.00 C ATOM 533 OE1 GLU A 166 9.334 -13.559 -8.478 1.00 0.00 O ATOM 534 OE2 GLU A 166 8.426 -12.174 -9.968 1.00 0.00 O ATOM 0 H GLU A 166 7.666 -8.955 -7.749 1.00 0.00 H new ATOM 0 HA GLU A 166 6.620 -11.703 -7.538 1.00 0.00 H new ATOM 0 HB2 GLU A 166 8.947 -10.495 -6.028 1.00 0.00 H new ATOM 0 HB3 GLU A 166 8.566 -12.190 -6.258 1.00 0.00 H new ATOM 0 HG2 GLU A 166 9.235 -10.304 -8.563 1.00 0.00 H new ATOM 0 HG3 GLU A 166 10.438 -11.280 -7.744 1.00 0.00 H new ATOM 541 N GLU A 167 6.414 -11.449 -4.817 1.00 0.00 N ATOM 542 CA GLU A 167 5.729 -11.289 -3.545 1.00 0.00 C ATOM 543 C GLU A 167 6.728 -10.926 -2.445 1.00 0.00 C ATOM 544 O GLU A 167 6.391 -10.203 -1.509 1.00 0.00 O ATOM 545 CB GLU A 167 4.948 -12.554 -3.181 1.00 0.00 C ATOM 546 CG GLU A 167 3.535 -12.208 -2.706 1.00 0.00 C ATOM 547 CD GLU A 167 2.856 -13.424 -2.074 1.00 0.00 C ATOM 548 OE1 GLU A 167 3.593 -14.240 -1.479 1.00 0.00 O ATOM 549 OE2 GLU A 167 1.615 -13.511 -2.200 1.00 0.00 O ATOM 0 H GLU A 167 6.969 -12.301 -4.898 1.00 0.00 H new ATOM 0 HA GLU A 167 5.013 -10.473 -3.640 1.00 0.00 H new ATOM 0 HB2 GLU A 167 4.893 -13.214 -4.047 1.00 0.00 H new ATOM 0 HB3 GLU A 167 5.476 -13.099 -2.398 1.00 0.00 H new ATOM 0 HG2 GLU A 167 3.580 -11.395 -1.982 1.00 0.00 H new ATOM 0 HG3 GLU A 167 2.941 -11.852 -3.548 1.00 0.00 H new ATOM 556 N GLN A 168 7.938 -11.445 -2.595 1.00 0.00 N ATOM 557 CA GLN A 168 8.989 -11.184 -1.625 1.00 0.00 C ATOM 558 C GLN A 168 9.767 -9.925 -2.012 1.00 0.00 C ATOM 559 O GLN A 168 10.236 -9.190 -1.144 1.00 0.00 O ATOM 560 CB GLN A 168 9.924 -12.388 -1.493 1.00 0.00 C ATOM 561 CG GLN A 168 11.314 -11.954 -1.025 1.00 0.00 C ATOM 562 CD GLN A 168 12.243 -13.160 -0.873 1.00 0.00 C ATOM 563 OE1 GLN A 168 12.677 -13.510 0.213 1.00 0.00 O ATOM 564 NE2 GLN A 168 12.523 -13.775 -2.019 1.00 0.00 N ATOM 0 H GLN A 168 8.214 -12.044 -3.373 1.00 0.00 H new ATOM 0 HA GLN A 168 8.526 -11.017 -0.652 1.00 0.00 H new ATOM 0 HB2 GLN A 168 9.505 -13.103 -0.785 1.00 0.00 H new ATOM 0 HB3 GLN A 168 10.003 -12.899 -2.453 1.00 0.00 H new ATOM 0 HG2 GLN A 168 11.739 -11.251 -1.741 1.00 0.00 H new ATOM 0 HG3 GLN A 168 11.234 -11.430 -0.073 1.00 0.00 H new ATOM 0 HE21 GLN A 168 12.126 -13.430 -2.893 1.00 0.00 H new ATOM 0 HE22 GLN A 168 13.134 -14.591 -2.024 1.00 0.00 H new ATOM 573 N TRP A 169 9.881 -9.715 -3.315 1.00 0.00 N ATOM 574 CA TRP A 169 10.594 -8.558 -3.827 1.00 0.00 C ATOM 575 C TRP A 169 9.571 -7.613 -4.460 1.00 0.00 C ATOM 576 O TRP A 169 8.724 -8.043 -5.242 1.00 0.00 O ATOM 577 CB TRP A 169 11.699 -8.980 -4.798 1.00 0.00 C ATOM 578 CG TRP A 169 12.926 -9.590 -4.118 1.00 0.00 C ATOM 579 CD1 TRP A 169 13.073 -10.835 -3.646 1.00 0.00 C ATOM 580 CD2 TRP A 169 14.180 -8.927 -3.852 1.00 0.00 C ATOM 581 NE1 TRP A 169 14.326 -11.023 -3.097 1.00 0.00 N ATOM 582 CE2 TRP A 169 15.020 -9.826 -3.226 1.00 0.00 C ATOM 583 CE3 TRP A 169 14.591 -7.612 -4.131 1.00 0.00 C ATOM 584 CZ2 TRP A 169 16.323 -9.506 -2.827 1.00 0.00 C ATOM 585 CZ3 TRP A 169 15.896 -7.308 -3.725 1.00 0.00 C ATOM 586 CH2 TRP A 169 16.754 -8.201 -3.094 1.00 0.00 C ATOM 0 H TRP A 169 9.491 -10.327 -4.032 1.00 0.00 H new ATOM 0 HA TRP A 169 11.102 -8.030 -3.020 1.00 0.00 H new ATOM 0 HB2 TRP A 169 11.291 -9.703 -5.504 1.00 0.00 H new ATOM 0 HB3 TRP A 169 12.012 -8.111 -5.376 1.00 0.00 H new ATOM 0 HD1 TRP A 169 12.308 -11.596 -3.689 1.00 0.00 H new ATOM 0 HE1 TRP A 169 14.677 -11.882 -2.675 1.00 0.00 H new ATOM 0 HE3 TRP A 169 13.951 -6.893 -4.620 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 16.962 -10.227 -2.339 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 16.262 -6.310 -3.915 1.00 0.00 H new ATOM 0 HH2 TRP A 169 17.749 -7.890 -2.811 1.00 0.00 H new ATOM 597 N TRP A 170 9.682 -6.343 -4.098 1.00 0.00 N ATOM 598 CA TRP A 170 8.776 -5.334 -4.621 1.00 0.00 C ATOM 599 C TRP A 170 9.608 -4.303 -5.386 1.00 0.00 C ATOM 600 O TRP A 170 10.732 -3.992 -4.994 1.00 0.00 O ATOM 601 CB TRP A 170 7.940 -4.714 -3.500 1.00 0.00 C ATOM 602 CG TRP A 170 6.847 -5.636 -2.956 1.00 0.00 C ATOM 603 CD1 TRP A 170 6.417 -6.797 -3.467 1.00 0.00 C ATOM 604 CD2 TRP A 170 6.057 -5.425 -1.766 1.00 0.00 C ATOM 605 NE1 TRP A 170 5.413 -7.348 -2.698 1.00 0.00 N ATOM 606 CE2 TRP A 170 5.187 -6.487 -1.631 1.00 0.00 C ATOM 607 CE3 TRP A 170 6.078 -4.371 -0.835 1.00 0.00 C ATOM 608 CZ2 TRP A 170 4.272 -6.599 -0.577 1.00 0.00 C ATOM 609 CZ3 TRP A 170 5.158 -4.498 0.212 1.00 0.00 C ATOM 610 CH2 TRP A 170 4.275 -5.561 0.363 1.00 0.00 C ATOM 0 H TRP A 170 10.385 -5.990 -3.449 1.00 0.00 H new ATOM 0 HA TRP A 170 8.057 -5.780 -5.308 1.00 0.00 H new ATOM 0 HB2 TRP A 170 8.602 -4.430 -2.682 1.00 0.00 H new ATOM 0 HB3 TRP A 170 7.478 -3.798 -3.869 1.00 0.00 H new ATOM 0 HD1 TRP A 170 6.807 -7.246 -4.368 1.00 0.00 H new ATOM 0 HE1 TRP A 170 4.926 -8.226 -2.879 1.00 0.00 H new ATOM 0 HE3 TRP A 170 6.751 -3.530 -0.921 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 3.600 -7.441 -0.494 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 5.132 -3.715 0.955 1.00 0.00 H new ATOM 0 HH2 TRP A 170 3.595 -5.586 1.201 1.00 0.00 H new ATOM 621 N ASN A 171 9.024 -3.801 -6.464 1.00 0.00 N ATOM 622 CA ASN A 171 9.698 -2.812 -7.288 1.00 0.00 C ATOM 623 C ASN A 171 9.391 -1.413 -6.750 1.00 0.00 C ATOM 624 O ASN A 171 8.398 -0.799 -7.137 1.00 0.00 O ATOM 625 CB ASN A 171 9.211 -2.878 -8.737 1.00 0.00 C ATOM 626 CG ASN A 171 10.352 -2.581 -9.713 1.00 0.00 C ATOM 627 OD1 ASN A 171 10.864 -3.454 -10.394 1.00 0.00 O ATOM 628 ND2 ASN A 171 10.720 -1.303 -9.741 1.00 0.00 N ATOM 0 H ASN A 171 8.092 -4.061 -6.786 1.00 0.00 H new ATOM 0 HA ASN A 171 10.768 -3.019 -7.257 1.00 0.00 H new ATOM 0 HB2 ASN A 171 8.801 -3.867 -8.942 1.00 0.00 H new ATOM 0 HB3 ASN A 171 8.404 -2.161 -8.886 1.00 0.00 H new ATOM 0 HD21 ASN A 171 11.474 -1.003 -10.359 1.00 0.00 H new ATOM 0 HD22 ASN A 171 10.249 -0.623 -9.144 1.00 0.00 H new ATOM 635 N ALA A 172 10.263 -0.949 -5.866 1.00 0.00 N ATOM 636 CA ALA A 172 10.097 0.366 -5.271 1.00 0.00 C ATOM 637 C ALA A 172 11.103 1.334 -5.898 1.00 0.00 C ATOM 638 O ALA A 172 12.102 0.909 -6.476 1.00 0.00 O ATOM 639 CB ALA A 172 10.255 0.263 -3.753 1.00 0.00 C ATOM 0 H ALA A 172 11.086 -1.460 -5.548 1.00 0.00 H new ATOM 0 HA ALA A 172 9.098 0.754 -5.469 1.00 0.00 H new ATOM 0 HB1 ALA A 172 10.131 1.250 -3.306 1.00 0.00 H new ATOM 0 HB2 ALA A 172 9.500 -0.414 -3.354 1.00 0.00 H new ATOM 0 HB3 ALA A 172 11.247 -0.120 -3.516 1.00 0.00 H new ATOM 645 N GLU A 173 10.804 2.618 -5.761 1.00 0.00 N ATOM 646 CA GLU A 173 11.669 3.650 -6.307 1.00 0.00 C ATOM 647 C GLU A 173 12.393 4.387 -5.178 1.00 0.00 C ATOM 648 O GLU A 173 11.772 4.786 -4.194 1.00 0.00 O ATOM 649 CB GLU A 173 10.876 4.625 -7.179 1.00 0.00 C ATOM 650 CG GLU A 173 11.147 4.377 -8.664 1.00 0.00 C ATOM 651 CD GLU A 173 10.195 5.196 -9.539 1.00 0.00 C ATOM 652 OE1 GLU A 173 8.999 5.252 -9.178 1.00 0.00 O ATOM 653 OE2 GLU A 173 10.684 5.746 -10.549 1.00 0.00 O ATOM 0 H GLU A 173 9.975 2.967 -5.280 1.00 0.00 H new ATOM 0 HA GLU A 173 12.416 3.173 -6.941 1.00 0.00 H new ATOM 0 HB2 GLU A 173 9.811 4.515 -6.977 1.00 0.00 H new ATOM 0 HB3 GLU A 173 11.145 5.650 -6.923 1.00 0.00 H new ATOM 0 HG2 GLU A 173 12.179 4.640 -8.898 1.00 0.00 H new ATOM 0 HG3 GLU A 173 11.030 3.316 -8.887 1.00 0.00 H new ATOM 660 N ASP A 174 13.696 4.544 -5.358 1.00 0.00 N ATOM 661 CA ASP A 174 14.511 5.226 -4.367 1.00 0.00 C ATOM 662 C ASP A 174 14.241 6.730 -4.438 1.00 0.00 C ATOM 663 O ASP A 174 13.684 7.219 -5.420 1.00 0.00 O ATOM 664 CB ASP A 174 16.001 5.000 -4.629 1.00 0.00 C ATOM 665 CG ASP A 174 16.897 5.089 -3.392 1.00 0.00 C ATOM 666 OD1 ASP A 174 16.594 4.364 -2.419 1.00 0.00 O ATOM 667 OD2 ASP A 174 17.863 5.880 -3.446 1.00 0.00 O ATOM 0 H ASP A 174 14.208 4.211 -6.175 1.00 0.00 H new ATOM 0 HA ASP A 174 14.253 4.827 -3.386 1.00 0.00 H new ATOM 0 HB2 ASP A 174 16.130 4.017 -5.082 1.00 0.00 H new ATOM 0 HB3 ASP A 174 16.341 5.734 -5.359 1.00 0.00 H new ATOM 672 N SER A 175 14.648 7.423 -3.384 1.00 0.00 N ATOM 673 CA SER A 175 14.457 8.862 -3.315 1.00 0.00 C ATOM 674 C SER A 175 15.052 9.529 -4.557 1.00 0.00 C ATOM 675 O SER A 175 14.713 10.667 -4.877 1.00 0.00 O ATOM 676 CB SER A 175 15.088 9.441 -2.048 1.00 0.00 C ATOM 677 OG SER A 175 14.344 9.105 -0.880 1.00 0.00 O ATOM 0 H SER A 175 15.109 7.015 -2.571 1.00 0.00 H new ATOM 0 HA SER A 175 13.386 9.064 -3.280 1.00 0.00 H new ATOM 0 HB2 SER A 175 16.108 9.069 -1.948 1.00 0.00 H new ATOM 0 HB3 SER A 175 15.152 10.525 -2.138 1.00 0.00 H new ATOM 0 HG SER A 175 14.780 9.492 -0.092 1.00 0.00 H new ATOM 683 N GLU A 176 15.928 8.792 -5.223 1.00 0.00 N ATOM 684 CA GLU A 176 16.574 9.298 -6.423 1.00 0.00 C ATOM 685 C GLU A 176 15.653 9.127 -7.633 1.00 0.00 C ATOM 686 O GLU A 176 15.802 9.826 -8.634 1.00 0.00 O ATOM 687 CB GLU A 176 17.918 8.606 -6.655 1.00 0.00 C ATOM 688 CG GLU A 176 18.841 8.781 -5.447 1.00 0.00 C ATOM 689 CD GLU A 176 19.544 10.139 -5.487 1.00 0.00 C ATOM 690 OE1 GLU A 176 18.833 11.140 -5.721 1.00 0.00 O ATOM 691 OE2 GLU A 176 20.777 10.146 -5.283 1.00 0.00 O ATOM 0 H GLU A 176 16.206 7.848 -4.955 1.00 0.00 H new ATOM 0 HA GLU A 176 16.769 10.362 -6.287 1.00 0.00 H new ATOM 0 HB2 GLU A 176 17.757 7.545 -6.843 1.00 0.00 H new ATOM 0 HB3 GLU A 176 18.395 9.019 -7.544 1.00 0.00 H new ATOM 0 HG2 GLU A 176 18.263 8.694 -4.527 1.00 0.00 H new ATOM 0 HG3 GLU A 176 19.584 7.983 -5.434 1.00 0.00 H new ATOM 698 N GLY A 177 14.722 8.194 -7.501 1.00 0.00 N ATOM 699 CA GLY A 177 13.777 7.923 -8.571 1.00 0.00 C ATOM 700 C GLY A 177 14.224 6.721 -9.405 1.00 0.00 C ATOM 701 O GLY A 177 13.951 6.657 -10.603 1.00 0.00 O ATOM 0 H GLY A 177 14.602 7.616 -6.669 1.00 0.00 H new ATOM 0 HA2 GLY A 177 12.790 7.731 -8.150 1.00 0.00 H new ATOM 0 HA3 GLY A 177 13.685 8.800 -9.211 1.00 0.00 H new ATOM 705 N LYS A 178 14.903 5.799 -8.740 1.00 0.00 N ATOM 706 CA LYS A 178 15.390 4.602 -9.405 1.00 0.00 C ATOM 707 C LYS A 178 14.441 3.438 -9.111 1.00 0.00 C ATOM 708 O LYS A 178 14.208 3.100 -7.952 1.00 0.00 O ATOM 709 CB LYS A 178 16.843 4.325 -9.013 1.00 0.00 C ATOM 710 CG LYS A 178 17.038 4.461 -7.501 1.00 0.00 C ATOM 711 CD LYS A 178 18.016 3.407 -6.978 1.00 0.00 C ATOM 712 CE LYS A 178 19.456 3.760 -7.355 1.00 0.00 C ATOM 713 NZ LYS A 178 19.997 4.783 -6.433 1.00 0.00 N ATOM 0 H LYS A 178 15.128 5.856 -7.747 1.00 0.00 H new ATOM 0 HA LYS A 178 15.397 4.743 -10.486 1.00 0.00 H new ATOM 0 HB2 LYS A 178 17.124 3.321 -9.331 1.00 0.00 H new ATOM 0 HB3 LYS A 178 17.503 5.020 -9.532 1.00 0.00 H new ATOM 0 HG2 LYS A 178 17.412 5.458 -7.267 1.00 0.00 H new ATOM 0 HG3 LYS A 178 16.078 4.354 -6.996 1.00 0.00 H new ATOM 0 HD2 LYS A 178 17.928 3.331 -5.894 1.00 0.00 H new ATOM 0 HD3 LYS A 178 17.758 2.431 -7.388 1.00 0.00 H new ATOM 0 HE2 LYS A 178 20.077 2.865 -7.320 1.00 0.00 H new ATOM 0 HE3 LYS A 178 19.489 4.131 -8.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 20.975 5.011 -6.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 19.414 5.642 -6.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 19.983 4.416 -5.460 1.00 0.00 H new ATOM 727 N ARG A 179 13.919 2.858 -10.182 1.00 0.00 N ATOM 728 CA ARG A 179 13.001 1.739 -10.054 1.00 0.00 C ATOM 729 C ARG A 179 13.776 0.425 -9.952 1.00 0.00 C ATOM 730 O ARG A 179 14.423 0.005 -10.910 1.00 0.00 O ATOM 731 CB ARG A 179 12.047 1.670 -11.249 1.00 0.00 C ATOM 732 CG ARG A 179 11.708 3.070 -11.762 1.00 0.00 C ATOM 733 CD ARG A 179 10.503 3.033 -12.703 1.00 0.00 C ATOM 734 NE ARG A 179 10.926 2.586 -14.050 1.00 0.00 N ATOM 735 CZ ARG A 179 10.077 2.241 -15.028 1.00 0.00 C ATOM 736 NH1 ARG A 179 8.755 2.289 -14.815 1.00 0.00 N ATOM 737 NH2 ARG A 179 10.551 1.849 -16.218 1.00 0.00 N ATOM 0 H ARG A 179 14.114 3.142 -11.142 1.00 0.00 H new ATOM 0 HA ARG A 179 12.418 1.891 -9.146 1.00 0.00 H new ATOM 0 HB2 ARG A 179 12.502 1.086 -12.049 1.00 0.00 H new ATOM 0 HB3 ARG A 179 11.132 1.154 -10.959 1.00 0.00 H new ATOM 0 HG2 ARG A 179 11.496 3.728 -10.919 1.00 0.00 H new ATOM 0 HG3 ARG A 179 12.569 3.488 -12.284 1.00 0.00 H new ATOM 0 HD2 ARG A 179 9.744 2.358 -12.309 1.00 0.00 H new ATOM 0 HD3 ARG A 179 10.049 4.022 -12.765 1.00 0.00 H new ATOM 0 HE ARG A 179 11.926 2.538 -14.246 1.00 0.00 H new ATOM 0 HH11 ARG A 179 8.395 2.588 -13.909 1.00 0.00 H new ATOM 0 HH12 ARG A 179 8.109 2.027 -15.559 1.00 0.00 H new ATOM 0 HH21 ARG A 179 11.558 1.813 -16.379 1.00 0.00 H new ATOM 0 HH22 ARG A 179 9.905 1.586 -16.963 1.00 0.00 H new ATOM 751 N GLY A 180 13.686 -0.190 -8.781 1.00 0.00 N ATOM 752 CA GLY A 180 14.371 -1.448 -8.542 1.00 0.00 C ATOM 753 C GLY A 180 13.604 -2.307 -7.534 1.00 0.00 C ATOM 754 O GLY A 180 12.790 -1.794 -6.769 1.00 0.00 O ATOM 0 H GLY A 180 13.149 0.160 -7.988 1.00 0.00 H new ATOM 0 HA2 GLY A 180 14.479 -1.992 -9.481 1.00 0.00 H new ATOM 0 HA3 GLY A 180 15.377 -1.254 -8.169 1.00 0.00 H new ATOM 758 N MET A 181 13.892 -3.600 -7.567 1.00 0.00 N ATOM 759 CA MET A 181 13.240 -4.535 -6.666 1.00 0.00 C ATOM 760 C MET A 181 13.996 -4.636 -5.340 1.00 0.00 C ATOM 761 O MET A 181 15.225 -4.626 -5.319 1.00 0.00 O ATOM 762 CB MET A 181 13.173 -5.915 -7.323 1.00 0.00 C ATOM 763 CG MET A 181 11.825 -6.129 -8.013 1.00 0.00 C ATOM 764 SD MET A 181 11.390 -7.860 -7.979 1.00 0.00 S ATOM 765 CE MET A 181 12.279 -8.432 -9.417 1.00 0.00 C ATOM 0 H MET A 181 14.568 -4.022 -8.204 1.00 0.00 H new ATOM 0 HA MET A 181 12.233 -4.172 -6.461 1.00 0.00 H new ATOM 0 HB2 MET A 181 13.978 -6.014 -8.051 1.00 0.00 H new ATOM 0 HB3 MET A 181 13.327 -6.688 -6.570 1.00 0.00 H new ATOM 0 HG2 MET A 181 11.054 -5.542 -7.514 1.00 0.00 H new ATOM 0 HG3 MET A 181 11.875 -5.778 -9.044 1.00 0.00 H new ATOM 0 HE1 MET A 181 12.116 -9.502 -9.544 1.00 0.00 H new ATOM 0 HE2 MET A 181 11.921 -7.903 -10.300 1.00 0.00 H new ATOM 0 HE3 MET A 181 13.344 -8.241 -9.286 1.00 0.00 H new ATOM 775 N ILE A 182 13.228 -4.733 -4.264 1.00 0.00 N ATOM 776 CA ILE A 182 13.810 -4.836 -2.936 1.00 0.00 C ATOM 777 C ILE A 182 12.966 -5.789 -2.088 1.00 0.00 C ATOM 778 O ILE A 182 11.824 -6.087 -2.432 1.00 0.00 O ATOM 779 CB ILE A 182 13.980 -3.448 -2.316 1.00 0.00 C ATOM 780 CG1 ILE A 182 12.762 -2.566 -2.602 1.00 0.00 C ATOM 781 CG2 ILE A 182 15.282 -2.795 -2.783 1.00 0.00 C ATOM 782 CD1 ILE A 182 11.596 -2.928 -1.681 1.00 0.00 C ATOM 0 H ILE A 182 12.208 -4.742 -4.285 1.00 0.00 H new ATOM 0 HA ILE A 182 14.813 -5.260 -2.991 1.00 0.00 H new ATOM 0 HB ILE A 182 14.047 -3.563 -1.234 1.00 0.00 H new ATOM 0 HG12 ILE A 182 13.027 -1.518 -2.464 1.00 0.00 H new ATOM 0 HG13 ILE A 182 12.459 -2.684 -3.642 1.00 0.00 H new ATOM 0 HG21 ILE A 182 15.378 -1.809 -2.328 1.00 0.00 H new ATOM 0 HG22 ILE A 182 16.127 -3.416 -2.486 1.00 0.00 H new ATOM 0 HG23 ILE A 182 15.269 -2.694 -3.868 1.00 0.00 H new ATOM 0 HD11 ILE A 182 10.743 -2.287 -1.904 1.00 0.00 H new ATOM 0 HD12 ILE A 182 11.318 -3.970 -1.839 1.00 0.00 H new ATOM 0 HD13 ILE A 182 11.895 -2.785 -0.643 1.00 0.00 H new ATOM 794 N PRO A 183 13.578 -6.253 -0.965 1.00 0.00 N ATOM 795 CA PRO A 183 12.895 -7.167 -0.064 1.00 0.00 C ATOM 796 C PRO A 183 11.845 -6.431 0.770 1.00 0.00 C ATOM 797 O PRO A 183 12.101 -5.339 1.275 1.00 0.00 O ATOM 798 CB PRO A 183 13.999 -7.784 0.780 1.00 0.00 C ATOM 799 CG PRO A 183 15.196 -6.858 0.642 1.00 0.00 C ATOM 800 CD PRO A 183 14.930 -5.922 -0.525 1.00 0.00 C ATOM 0 HA PRO A 183 12.336 -7.940 -0.592 1.00 0.00 H new ATOM 0 HB2 PRO A 183 13.691 -7.872 1.822 1.00 0.00 H new ATOM 0 HB3 PRO A 183 14.240 -8.789 0.433 1.00 0.00 H new ATOM 0 HG2 PRO A 183 15.347 -6.290 1.560 1.00 0.00 H new ATOM 0 HG3 PRO A 183 16.106 -7.433 0.470 1.00 0.00 H new ATOM 0 HD2 PRO A 183 15.003 -4.878 -0.220 1.00 0.00 H new ATOM 0 HD3 PRO A 183 15.655 -6.071 -1.325 1.00 0.00 H new ATOM 808 N VAL A 184 10.685 -7.060 0.890 1.00 0.00 N ATOM 809 CA VAL A 184 9.594 -6.479 1.655 1.00 0.00 C ATOM 810 C VAL A 184 9.825 -6.741 3.144 1.00 0.00 C ATOM 811 O VAL A 184 9.421 -5.943 3.988 1.00 0.00 O ATOM 812 CB VAL A 184 8.255 -7.022 1.152 1.00 0.00 C ATOM 813 CG1 VAL A 184 7.084 -6.323 1.846 1.00 0.00 C ATOM 814 CG2 VAL A 184 8.147 -6.894 -0.369 1.00 0.00 C ATOM 0 H VAL A 184 10.477 -7.966 0.470 1.00 0.00 H new ATOM 0 HA VAL A 184 9.563 -5.398 1.517 1.00 0.00 H new ATOM 0 HB VAL A 184 8.208 -8.082 1.403 1.00 0.00 H new ATOM 0 HG11 VAL A 184 6.144 -6.728 1.470 1.00 0.00 H new ATOM 0 HG12 VAL A 184 7.147 -6.489 2.921 1.00 0.00 H new ATOM 0 HG13 VAL A 184 7.126 -5.253 1.641 1.00 0.00 H new ATOM 0 HG21 VAL A 184 7.186 -7.287 -0.700 1.00 0.00 H new ATOM 0 HG22 VAL A 184 8.227 -5.844 -0.652 1.00 0.00 H new ATOM 0 HG23 VAL A 184 8.952 -7.459 -0.840 1.00 0.00 H new ATOM 824 N PRO A 185 10.491 -7.892 3.429 1.00 0.00 N ATOM 825 CA PRO A 185 10.780 -8.269 4.802 1.00 0.00 C ATOM 826 C PRO A 185 11.922 -7.427 5.373 1.00 0.00 C ATOM 827 O PRO A 185 12.062 -7.307 6.589 1.00 0.00 O ATOM 828 CB PRO A 185 11.109 -9.752 4.741 1.00 0.00 C ATOM 829 CG PRO A 185 11.446 -10.045 3.288 1.00 0.00 C ATOM 830 CD PRO A 185 10.985 -8.861 2.454 1.00 0.00 C ATOM 0 HA PRO A 185 9.941 -8.087 5.474 1.00 0.00 H new ATOM 0 HB2 PRO A 185 11.949 -9.993 5.393 1.00 0.00 H new ATOM 0 HB3 PRO A 185 10.264 -10.354 5.075 1.00 0.00 H new ATOM 0 HG2 PRO A 185 12.518 -10.201 3.169 1.00 0.00 H new ATOM 0 HG3 PRO A 185 10.952 -10.959 2.959 1.00 0.00 H new ATOM 0 HD2 PRO A 185 11.804 -8.448 1.865 1.00 0.00 H new ATOM 0 HD3 PRO A 185 10.203 -9.151 1.752 1.00 0.00 H new ATOM 838 N TYR A 186 12.710 -6.864 4.468 1.00 0.00 N ATOM 839 CA TYR A 186 13.835 -6.035 4.867 1.00 0.00 C ATOM 840 C TYR A 186 13.441 -4.557 4.905 1.00 0.00 C ATOM 841 O TYR A 186 14.295 -3.688 5.073 1.00 0.00 O ATOM 842 CB TYR A 186 14.908 -6.237 3.795 1.00 0.00 C ATOM 843 CG TYR A 186 16.159 -6.961 4.296 1.00 0.00 C ATOM 844 CD1 TYR A 186 16.041 -8.166 4.959 1.00 0.00 C ATOM 845 CD2 TYR A 186 17.407 -6.410 4.085 1.00 0.00 C ATOM 846 CE1 TYR A 186 17.218 -8.848 5.431 1.00 0.00 C ATOM 847 CE2 TYR A 186 18.584 -7.091 4.557 1.00 0.00 C ATOM 848 CZ TYR A 186 18.432 -8.276 5.206 1.00 0.00 C ATOM 849 OH TYR A 186 19.544 -8.920 5.652 1.00 0.00 O ATOM 0 H TYR A 186 12.591 -6.966 3.460 1.00 0.00 H new ATOM 0 HA TYR A 186 14.181 -6.311 5.863 1.00 0.00 H new ATOM 0 HB2 TYR A 186 14.479 -6.804 2.968 1.00 0.00 H new ATOM 0 HB3 TYR A 186 15.198 -5.264 3.398 1.00 0.00 H new ATOM 0 HD1 TYR A 186 15.065 -8.598 5.124 1.00 0.00 H new ATOM 0 HD2 TYR A 186 17.500 -5.468 3.566 1.00 0.00 H new ATOM 0 HE1 TYR A 186 17.139 -9.791 5.951 1.00 0.00 H new ATOM 0 HE2 TYR A 186 19.566 -6.670 4.399 1.00 0.00 H new ATOM 0 HH TYR A 186 19.722 -8.661 6.580 1.00 0.00 H new ATOM 859 N VAL A 187 12.148 -4.318 4.746 1.00 0.00 N ATOM 860 CA VAL A 187 11.631 -2.960 4.761 1.00 0.00 C ATOM 861 C VAL A 187 10.211 -2.966 5.331 1.00 0.00 C ATOM 862 O VAL A 187 9.660 -4.026 5.624 1.00 0.00 O ATOM 863 CB VAL A 187 11.709 -2.356 3.357 1.00 0.00 C ATOM 864 CG1 VAL A 187 13.003 -2.768 2.654 1.00 0.00 C ATOM 865 CG2 VAL A 187 10.485 -2.743 2.525 1.00 0.00 C ATOM 0 H VAL A 187 11.443 -5.042 4.606 1.00 0.00 H new ATOM 0 HA VAL A 187 12.238 -2.327 5.408 1.00 0.00 H new ATOM 0 HB VAL A 187 11.715 -1.271 3.459 1.00 0.00 H new ATOM 0 HG11 VAL A 187 13.033 -2.325 1.658 1.00 0.00 H new ATOM 0 HG12 VAL A 187 13.858 -2.419 3.232 1.00 0.00 H new ATOM 0 HG13 VAL A 187 13.041 -3.854 2.569 1.00 0.00 H new ATOM 0 HG21 VAL A 187 10.566 -2.301 1.532 1.00 0.00 H new ATOM 0 HG22 VAL A 187 10.434 -3.828 2.436 1.00 0.00 H new ATOM 0 HG23 VAL A 187 9.582 -2.376 3.013 1.00 0.00 H new ATOM 875 N GLU A 188 9.660 -1.769 5.473 1.00 0.00 N ATOM 876 CA GLU A 188 8.315 -1.623 6.003 1.00 0.00 C ATOM 877 C GLU A 188 7.564 -0.523 5.249 1.00 0.00 C ATOM 878 O GLU A 188 8.030 -0.045 4.216 1.00 0.00 O ATOM 879 CB GLU A 188 8.347 -1.334 7.505 1.00 0.00 C ATOM 880 CG GLU A 188 9.523 -0.423 7.864 1.00 0.00 C ATOM 881 CD GLU A 188 9.048 0.804 8.645 1.00 0.00 C ATOM 882 OE1 GLU A 188 7.893 1.218 8.404 1.00 0.00 O ATOM 883 OE2 GLU A 188 9.849 1.300 9.466 1.00 0.00 O ATOM 0 H GLU A 188 10.121 -0.892 5.230 1.00 0.00 H new ATOM 0 HA GLU A 188 7.784 -2.564 5.858 1.00 0.00 H new ATOM 0 HB2 GLU A 188 7.412 -0.863 7.808 1.00 0.00 H new ATOM 0 HB3 GLU A 188 8.426 -2.270 8.057 1.00 0.00 H new ATOM 0 HG2 GLU A 188 10.249 -0.978 8.458 1.00 0.00 H new ATOM 0 HG3 GLU A 188 10.032 -0.105 6.954 1.00 0.00 H new ATOM 890 N LYS A 189 6.414 -0.155 5.795 1.00 0.00 N ATOM 891 CA LYS A 189 5.594 0.878 5.187 1.00 0.00 C ATOM 892 C LYS A 189 5.638 2.136 6.058 1.00 0.00 C ATOM 893 O LYS A 189 5.988 2.068 7.235 1.00 0.00 O ATOM 894 CB LYS A 189 4.179 0.357 4.931 1.00 0.00 C ATOM 895 CG LYS A 189 3.962 0.068 3.444 1.00 0.00 C ATOM 896 CD LYS A 189 4.041 -1.433 3.160 1.00 0.00 C ATOM 897 CE LYS A 189 3.205 -1.804 1.934 1.00 0.00 C ATOM 898 NZ LYS A 189 1.761 -1.743 2.254 1.00 0.00 N ATOM 0 H LYS A 189 6.031 -0.554 6.652 1.00 0.00 H new ATOM 0 HA LYS A 189 5.990 1.152 4.209 1.00 0.00 H new ATOM 0 HB2 LYS A 189 4.012 -0.551 5.510 1.00 0.00 H new ATOM 0 HB3 LYS A 189 3.450 1.092 5.273 1.00 0.00 H new ATOM 0 HG2 LYS A 189 2.989 0.450 3.134 1.00 0.00 H new ATOM 0 HG3 LYS A 189 4.713 0.593 2.854 1.00 0.00 H new ATOM 0 HD2 LYS A 189 5.079 -1.722 2.997 1.00 0.00 H new ATOM 0 HD3 LYS A 189 3.687 -1.990 4.028 1.00 0.00 H new ATOM 0 HE2 LYS A 189 3.431 -1.123 1.113 1.00 0.00 H new ATOM 0 HE3 LYS A 189 3.467 -2.807 1.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 1.375 -2.708 2.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 1.628 -1.270 3.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 1.264 -1.209 1.513 1.00 0.00 H new ATOM 912 N TYR A 190 5.278 3.254 5.445 1.00 0.00 N ATOM 913 CA TYR A 190 5.272 4.525 6.149 1.00 0.00 C ATOM 914 C TYR A 190 3.898 5.194 6.062 1.00 0.00 C ATOM 915 O TYR A 190 3.074 4.820 5.229 1.00 0.00 O ATOM 916 CB TYR A 190 6.301 5.406 5.439 1.00 0.00 C ATOM 917 CG TYR A 190 6.167 6.897 5.753 1.00 0.00 C ATOM 918 CD1 TYR A 190 6.517 7.374 7.000 1.00 0.00 C ATOM 919 CD2 TYR A 190 5.695 7.766 4.790 1.00 0.00 C ATOM 920 CE1 TYR A 190 6.391 8.777 7.296 1.00 0.00 C ATOM 921 CE2 TYR A 190 5.569 9.169 5.086 1.00 0.00 C ATOM 922 CZ TYR A 190 5.923 9.606 6.324 1.00 0.00 C ATOM 923 OH TYR A 190 5.803 10.931 6.603 1.00 0.00 O ATOM 0 H TYR A 190 4.988 3.306 4.468 1.00 0.00 H new ATOM 0 HA TYR A 190 5.504 4.380 7.204 1.00 0.00 H new ATOM 0 HB2 TYR A 190 7.301 5.075 5.718 1.00 0.00 H new ATOM 0 HB3 TYR A 190 6.206 5.262 4.363 1.00 0.00 H new ATOM 0 HD1 TYR A 190 6.886 6.694 7.754 1.00 0.00 H new ATOM 0 HD2 TYR A 190 5.420 7.393 3.814 1.00 0.00 H new ATOM 0 HE1 TYR A 190 6.662 9.163 8.268 1.00 0.00 H new ATOM 0 HE2 TYR A 190 5.201 9.859 4.341 1.00 0.00 H new ATOM 0 HH TYR A 190 5.458 11.401 5.815 1.00 0.00 H new ATOM 933 N GLY A 191 3.695 6.171 6.933 1.00 0.00 N ATOM 934 CA GLY A 191 2.436 6.895 6.964 1.00 0.00 C ATOM 935 C GLY A 191 2.662 8.397 6.780 1.00 0.00 C ATOM 936 O GLY A 191 2.972 8.852 5.680 1.00 0.00 O ATOM 0 H GLY A 191 4.381 6.478 7.622 1.00 0.00 H new ATOM 0 HA2 GLY A 191 1.779 6.523 6.177 1.00 0.00 H new ATOM 0 HA3 GLY A 191 1.931 6.713 7.913 1.00 0.00 H new TER 940 GLY A 191