USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 587 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 209 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 1.2: A 211 SER OG : rot 180:sc= 0 USER MOD Single : A 176 SER OG : rot 180:sc= 0 USER MOD Single : A 179 GLN : amide:sc=-6.7e-05 X(o=-6.7e-05,f=0) USER MOD Single : A 182 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 184 THR OG1 : rot 180:sc= 0 USER MOD Single : A 188 CYS SG : rot 180:sc= 0 USER MOD Single : A 191 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 TYR OH : rot 180:sc= 0 USER MOD Single : A 195 SER OG : rot 180:sc= 0.208 USER MOD Single : A 196 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 GLN : amide:sc= 0 X(o=0,f=-0.001) USER MOD Single : A 198 SER OG : rot 40:sc= 1.25 USER MOD Single : A 199 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 203 SER OG : rot 180:sc= 0 USER MOD Single : A 204 ASN : amide:sc= -0.148 K(o=-0.15,f=-3.6!) USER MOD Single : A 205 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 207 LYS NZ :NH3+ -128:sc=-0.00546 (180deg=-0.415) USER MOD Single : A 214 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 217 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 218 CYS SG : rot 96:sc= 0.00901 USER MOD Single : A 224 SER OG : rot -9:sc= 0.582 USER MOD Single : A 228 GLN : amide:sc=-0.00565 X(o=-0.0057,f=-0.0053) USER MOD Single : A 229 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 231 HIS : no HE2:sc= 1.26 K(o=1.3,f=-3.8!) USER MOD Single : A 234 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 235 GLN : amide:sc= -0.424 X(o=-0.42,f=-0.51) USER MOD Single : A 236 HIS : no HD1:sc= -0.181 X(o=-0.18,f=-0.0014) USER MOD Single : A 237 THR OG1 : rot 180:sc= 0 USER MOD Single : A 241 SER OG : rot 180:sc= 0 USER MOD Single : A 243 HIS : no HD1:sc= -0.043 X(o=-0.043,f=0) USER MOD Single : A 244 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 175 -27.998 -27.980 -74.686 1.00 44.44 N ATOM 2 CA ARG A 175 -26.598 -27.777 -74.316 1.00 25.31 C ATOM 3 C ARG A 175 -26.531 -26.322 -73.841 1.00 23.33 C ATOM 4 O ARG A 175 -27.357 -25.521 -74.284 1.00 72.25 O ATOM 5 CB ARG A 175 -25.656 -28.027 -75.515 1.00 63.20 C ATOM 6 CG ARG A 175 -25.383 -29.520 -75.778 1.00 35.43 C ATOM 7 CD ARG A 175 -24.458 -29.728 -76.989 1.00 51.31 C ATOM 8 NE ARG A 175 -24.013 -31.132 -77.105 1.00 63.41 N ATOM 9 CZ ARG A 175 -23.483 -31.722 -78.190 1.00 22.04 C ATOM 10 NH1 ARG A 175 -23.364 -31.058 -79.339 1.00 63.22 N1+ ATOM 11 NH2 ARG A 175 -23.071 -32.987 -78.120 1.00 52.51 N ATOM 0 HA ARG A 175 -26.272 -28.474 -73.544 1.00 25.31 H new ATOM 0 HB2 ARG A 175 -26.092 -27.582 -76.409 1.00 63.20 H new ATOM 0 HB3 ARG A 175 -24.709 -27.518 -75.336 1.00 63.20 H new ATOM 0 HG2 ARG A 175 -24.930 -29.968 -74.894 1.00 35.43 H new ATOM 0 HG3 ARG A 175 -26.327 -30.037 -75.949 1.00 35.43 H new ATOM 0 HD2 ARG A 175 -24.981 -29.436 -77.900 1.00 51.31 H new ATOM 0 HD3 ARG A 175 -23.588 -29.077 -76.898 1.00 51.31 H new ATOM 0 HE ARG A 175 -24.119 -31.715 -76.275 1.00 63.41 H new ATOM 0 HH11 ARG A 175 -23.677 -30.089 -79.403 1.00 63.22 H new ATOM 0 HH12 ARG A 175 -22.960 -31.518 -80.155 1.00 63.22 H new ATOM 0 HH21 ARG A 175 -23.158 -33.504 -77.245 1.00 52.51 H new ATOM 0 HH22 ARG A 175 -22.668 -33.438 -78.941 1.00 52.51 H new ATOM 25 N SER A 176 -25.598 -25.982 -72.960 1.00 54.30 N ATOM 26 CA SER A 176 -25.526 -24.679 -72.311 1.00 40.15 C ATOM 27 C SER A 176 -24.145 -24.525 -71.663 1.00 12.11 C ATOM 28 O SER A 176 -23.329 -25.446 -71.725 1.00 40.04 O ATOM 29 CB SER A 176 -26.680 -24.544 -71.295 1.00 24.33 C ATOM 30 OG SER A 176 -26.907 -25.754 -70.588 1.00 71.11 O ATOM 0 H SER A 176 -24.855 -26.618 -72.671 1.00 54.30 H new ATOM 0 HA SER A 176 -25.644 -23.874 -73.036 1.00 40.15 H new ATOM 0 HB2 SER A 176 -26.449 -23.748 -70.587 1.00 24.33 H new ATOM 0 HB3 SER A 176 -27.591 -24.252 -71.817 1.00 24.33 H new ATOM 0 HG SER A 176 -27.643 -25.629 -69.953 1.00 71.11 H new ATOM 36 N LEU A 177 -23.861 -23.353 -71.087 1.00 42.40 N ATOM 37 CA LEU A 177 -22.593 -23.008 -70.453 1.00 14.14 C ATOM 38 C LEU A 177 -22.831 -21.940 -69.378 1.00 25.25 C ATOM 39 O LEU A 177 -23.955 -21.463 -69.233 1.00 72.32 O ATOM 40 CB LEU A 177 -21.538 -22.586 -71.508 1.00 62.05 C ATOM 41 CG LEU A 177 -21.863 -21.515 -72.581 1.00 74.24 C ATOM 42 CD1 LEU A 177 -22.595 -22.094 -73.799 1.00 32.31 C ATOM 43 CD2 LEU A 177 -22.633 -20.292 -72.071 1.00 21.13 C ATOM 0 H LEU A 177 -24.538 -22.591 -71.050 1.00 42.40 H new ATOM 0 HA LEU A 177 -22.181 -23.886 -69.956 1.00 14.14 H new ATOM 0 HB2 LEU A 177 -20.663 -22.234 -70.961 1.00 62.05 H new ATOM 0 HB3 LEU A 177 -21.239 -23.490 -72.040 1.00 62.05 H new ATOM 0 HG LEU A 177 -20.873 -21.168 -72.878 1.00 74.24 H new ATOM 0 HD11 LEU A 177 -22.796 -21.297 -74.515 1.00 32.31 H new ATOM 0 HD12 LEU A 177 -21.973 -22.856 -74.269 1.00 32.31 H new ATOM 0 HD13 LEU A 177 -23.537 -22.540 -73.479 1.00 32.31 H new ATOM 0 HD21 LEU A 177 -22.811 -19.603 -72.897 1.00 21.13 H new ATOM 0 HD22 LEU A 177 -23.588 -20.611 -71.653 1.00 21.13 H new ATOM 0 HD23 LEU A 177 -22.049 -19.790 -71.300 1.00 21.13 H new ATOM 55 N ARG A 178 -21.775 -21.568 -68.637 1.00 24.30 N ATOM 56 CA ARG A 178 -21.759 -20.522 -67.594 1.00 3.45 C ATOM 57 C ARG A 178 -22.966 -20.614 -66.646 1.00 25.42 C ATOM 58 O ARG A 178 -23.679 -19.631 -66.429 1.00 34.30 O ATOM 59 CB ARG A 178 -21.601 -19.119 -68.206 1.00 73.44 C ATOM 60 CG ARG A 178 -20.285 -18.925 -68.981 1.00 23.23 C ATOM 61 CD ARG A 178 -20.116 -17.472 -69.451 1.00 61.32 C ATOM 62 NE ARG A 178 -19.804 -16.559 -68.332 1.00 43.12 N ATOM 63 CZ ARG A 178 -18.592 -16.117 -67.958 1.00 4.41 C ATOM 64 NH1 ARG A 178 -17.499 -16.457 -68.642 1.00 33.23 N1+ ATOM 65 NH2 ARG A 178 -18.476 -15.332 -66.889 1.00 63.23 N ATOM 0 H ARG A 178 -20.862 -22.009 -68.752 1.00 24.30 H new ATOM 0 HA ARG A 178 -20.880 -20.704 -66.976 1.00 3.45 H new ATOM 0 HB2 ARG A 178 -22.439 -18.929 -68.877 1.00 73.44 H new ATOM 0 HB3 ARG A 178 -21.656 -18.377 -67.410 1.00 73.44 H new ATOM 0 HG2 ARG A 178 -19.444 -19.203 -68.346 1.00 23.23 H new ATOM 0 HG3 ARG A 178 -20.268 -19.592 -69.843 1.00 23.23 H new ATOM 0 HD2 ARG A 178 -19.319 -17.422 -70.193 1.00 61.32 H new ATOM 0 HD3 ARG A 178 -21.031 -17.142 -69.943 1.00 61.32 H new ATOM 0 HE ARG A 178 -20.597 -16.228 -67.783 1.00 43.12 H new ATOM 0 HH11 ARG A 178 -17.577 -17.060 -69.461 1.00 33.23 H new ATOM 0 HH12 ARG A 178 -16.585 -16.114 -68.346 1.00 33.23 H new ATOM 0 HH21 ARG A 178 -19.306 -15.068 -66.357 1.00 63.23 H new ATOM 0 HH22 ARG A 178 -17.557 -14.994 -66.602 1.00 63.23 H new ATOM 79 N GLN A 179 -23.189 -21.795 -66.071 1.00 24.00 N ATOM 80 CA GLN A 179 -24.227 -21.994 -65.076 1.00 3.32 C ATOM 81 C GLN A 179 -23.805 -21.307 -63.771 1.00 35.51 C ATOM 82 O GLN A 179 -23.137 -21.921 -62.945 1.00 2.32 O ATOM 83 CB GLN A 179 -24.507 -23.496 -64.875 1.00 52.52 C ATOM 84 CG GLN A 179 -24.995 -24.172 -66.167 1.00 55.30 C ATOM 85 CD GLN A 179 -25.521 -25.593 -65.962 1.00 71.53 C ATOM 86 OE1 GLN A 179 -26.528 -25.965 -66.546 1.00 14.25 O ATOM 87 NE2 GLN A 179 -24.866 -26.420 -65.160 1.00 3.14 N ATOM 0 H GLN A 179 -22.653 -22.636 -66.285 1.00 24.00 H new ATOM 0 HA GLN A 179 -25.160 -21.544 -65.417 1.00 3.32 H new ATOM 0 HB2 GLN A 179 -23.599 -23.990 -64.528 1.00 52.52 H new ATOM 0 HB3 GLN A 179 -25.257 -23.623 -64.094 1.00 52.52 H new ATOM 0 HG2 GLN A 179 -25.784 -23.563 -66.608 1.00 55.30 H new ATOM 0 HG3 GLN A 179 -24.174 -24.199 -66.884 1.00 55.30 H new ATOM 0 HE21 GLN A 179 -24.026 -26.103 -64.676 1.00 3.14 H new ATOM 0 HE22 GLN A 179 -25.202 -27.374 -65.027 1.00 3.14 H new ATOM 96 N ARG A 180 -24.236 -20.054 -63.577 1.00 65.05 N ATOM 97 CA ARG A 180 -23.983 -19.216 -62.396 1.00 64.25 C ATOM 98 C ARG A 180 -22.518 -18.752 -62.334 1.00 43.03 C ATOM 99 O ARG A 180 -21.725 -19.028 -63.233 1.00 61.12 O ATOM 100 CB ARG A 180 -24.436 -19.933 -61.093 1.00 54.40 C ATOM 101 CG ARG A 180 -25.466 -19.168 -60.249 1.00 40.31 C ATOM 102 CD ARG A 180 -26.837 -19.096 -60.945 1.00 25.33 C ATOM 103 NE ARG A 180 -27.955 -19.043 -59.982 1.00 63.12 N ATOM 104 CZ ARG A 180 -28.390 -17.985 -59.283 1.00 4.44 C ATOM 105 NH1 ARG A 180 -27.797 -16.797 -59.403 1.00 33.41 N1+ ATOM 106 NH2 ARG A 180 -29.427 -18.124 -58.458 1.00 74.54 N ATOM 0 H ARG A 180 -24.800 -19.571 -64.276 1.00 65.05 H new ATOM 0 HA ARG A 180 -24.588 -18.314 -62.489 1.00 64.25 H new ATOM 0 HB2 ARG A 180 -24.856 -20.903 -61.359 1.00 54.40 H new ATOM 0 HB3 ARG A 180 -23.557 -20.124 -60.478 1.00 54.40 H new ATOM 0 HG2 ARG A 180 -25.576 -19.655 -59.280 1.00 40.31 H new ATOM 0 HG3 ARG A 180 -25.102 -18.158 -60.059 1.00 40.31 H new ATOM 0 HD2 ARG A 180 -26.871 -18.215 -61.585 1.00 25.33 H new ATOM 0 HD3 ARG A 180 -26.959 -19.965 -61.592 1.00 25.33 H new ATOM 0 HE ARG A 180 -28.457 -19.918 -59.830 1.00 63.12 H new ATOM 0 HH11 ARG A 180 -27.002 -16.685 -60.033 1.00 33.41 H new ATOM 0 HH12 ARG A 180 -28.138 -16.000 -58.865 1.00 33.41 H new ATOM 0 HH21 ARG A 180 -29.884 -19.031 -58.362 1.00 74.54 H new ATOM 0 HH22 ARG A 180 -29.764 -17.324 -57.923 1.00 74.54 H new ATOM 120 N LEU A 181 -22.225 -17.951 -61.307 1.00 42.44 N ATOM 121 CA LEU A 181 -20.940 -17.413 -60.872 1.00 73.23 C ATOM 122 C LEU A 181 -21.265 -16.870 -59.477 1.00 71.21 C ATOM 123 O LEU A 181 -22.210 -16.085 -59.367 1.00 74.14 O ATOM 124 CB LEU A 181 -20.481 -16.297 -61.837 1.00 33.22 C ATOM 125 CG LEU A 181 -19.032 -15.800 -61.644 1.00 33.35 C ATOM 126 CD1 LEU A 181 -18.648 -14.942 -62.862 1.00 5.21 C ATOM 127 CD2 LEU A 181 -18.823 -14.946 -60.387 1.00 70.12 C ATOM 0 H LEU A 181 -22.972 -17.629 -60.691 1.00 42.44 H new ATOM 0 HA LEU A 181 -20.126 -18.138 -60.860 1.00 73.23 H new ATOM 0 HB2 LEU A 181 -20.588 -16.659 -62.859 1.00 33.22 H new ATOM 0 HB3 LEU A 181 -21.155 -15.447 -61.727 1.00 33.22 H new ATOM 0 HG LEU A 181 -18.412 -16.690 -61.535 1.00 33.35 H new ATOM 0 HD11 LEU A 181 -17.626 -14.581 -62.745 1.00 5.21 H new ATOM 0 HD12 LEU A 181 -18.718 -15.544 -63.768 1.00 5.21 H new ATOM 0 HD13 LEU A 181 -19.327 -14.093 -62.937 1.00 5.21 H new ATOM 0 HD21 LEU A 181 -17.779 -14.638 -60.326 1.00 70.12 H new ATOM 0 HD22 LEU A 181 -19.460 -14.063 -60.437 1.00 70.12 H new ATOM 0 HD23 LEU A 181 -19.081 -15.530 -59.503 1.00 70.12 H new ATOM 139 N GLN A 182 -20.593 -17.323 -58.418 1.00 62.31 N ATOM 140 CA GLN A 182 -20.721 -16.782 -57.064 1.00 40.10 C ATOM 141 C GLN A 182 -19.417 -17.086 -56.318 1.00 63.11 C ATOM 142 O GLN A 182 -19.364 -17.898 -55.396 1.00 12.30 O ATOM 143 CB GLN A 182 -21.994 -17.302 -56.359 1.00 72.53 C ATOM 144 CG GLN A 182 -22.197 -16.665 -54.970 1.00 23.40 C ATOM 145 CD GLN A 182 -23.674 -16.474 -54.624 1.00 41.05 C ATOM 146 OE1 GLN A 182 -24.314 -15.529 -55.081 1.00 54.13 O ATOM 147 NE2 GLN A 182 -24.256 -17.328 -53.798 1.00 22.23 N ATOM 0 H GLN A 182 -19.929 -18.095 -58.479 1.00 62.31 H new ATOM 0 HA GLN A 182 -20.858 -15.701 -57.085 1.00 40.10 H new ATOM 0 HB2 GLN A 182 -22.863 -17.092 -56.983 1.00 72.53 H new ATOM 0 HB3 GLN A 182 -21.931 -18.385 -56.254 1.00 72.53 H new ATOM 0 HG2 GLN A 182 -21.728 -17.294 -54.213 1.00 23.40 H new ATOM 0 HG3 GLN A 182 -21.692 -15.699 -54.939 1.00 23.40 H new ATOM 0 HE21 GLN A 182 -23.726 -18.112 -53.418 1.00 22.23 H new ATOM 0 HE22 GLN A 182 -25.235 -17.202 -53.541 1.00 22.23 H new ATOM 156 N ASP A 183 -18.355 -16.402 -56.736 1.00 20.03 N ATOM 157 CA ASP A 183 -16.955 -16.780 -56.541 1.00 43.12 C ATOM 158 C ASP A 183 -16.184 -15.676 -55.810 1.00 32.23 C ATOM 159 O ASP A 183 -14.965 -15.694 -55.682 1.00 34.24 O ATOM 160 CB ASP A 183 -16.362 -17.026 -57.930 1.00 20.31 C ATOM 161 CG ASP A 183 -16.979 -18.262 -58.588 1.00 12.13 C ATOM 162 OD1 ASP A 183 -16.427 -19.364 -58.365 1.00 22.45 O ATOM 163 OD2 ASP A 183 -18.027 -18.092 -59.245 1.00 23.45 O1- ATOM 0 H ASP A 183 -18.451 -15.524 -57.246 1.00 20.03 H new ATOM 0 HA ASP A 183 -16.883 -17.675 -55.924 1.00 43.12 H new ATOM 0 HB2 ASP A 183 -16.532 -16.153 -58.560 1.00 20.31 H new ATOM 0 HB3 ASP A 183 -15.283 -17.155 -57.849 1.00 20.31 H new ATOM 168 N THR A 184 -16.928 -14.674 -55.361 1.00 51.30 N ATOM 169 CA THR A 184 -16.491 -13.457 -54.698 1.00 22.11 C ATOM 170 C THR A 184 -16.880 -13.498 -53.208 1.00 53.13 C ATOM 171 O THR A 184 -16.497 -12.618 -52.440 1.00 71.31 O ATOM 172 CB THR A 184 -17.047 -12.255 -55.512 1.00 3.31 C ATOM 173 OG1 THR A 184 -17.024 -11.023 -54.826 1.00 25.41 O ATOM 174 CG2 THR A 184 -18.505 -12.432 -55.976 1.00 51.10 C ATOM 0 H THR A 184 -17.943 -14.696 -55.462 1.00 51.30 H new ATOM 0 HA THR A 184 -15.406 -13.349 -54.683 1.00 22.11 H new ATOM 0 HB THR A 184 -16.362 -12.238 -56.360 1.00 3.31 H new ATOM 0 HG1 THR A 184 -17.387 -10.320 -55.404 1.00 25.41 H new ATOM 0 HG21 THR A 184 -18.818 -11.551 -56.537 1.00 51.10 H new ATOM 0 HG22 THR A 184 -18.580 -13.313 -56.613 1.00 51.10 H new ATOM 0 HG23 THR A 184 -19.151 -12.557 -55.107 1.00 51.10 H new ATOM 182 N VAL A 185 -17.626 -14.520 -52.772 1.00 43.51 N ATOM 183 CA VAL A 185 -18.153 -14.607 -51.406 1.00 73.04 C ATOM 184 C VAL A 185 -17.165 -15.197 -50.393 1.00 11.42 C ATOM 185 O VAL A 185 -17.479 -15.296 -49.207 1.00 54.52 O ATOM 186 CB VAL A 185 -19.524 -15.320 -51.401 1.00 23.54 C ATOM 187 CG1 VAL A 185 -20.581 -14.480 -52.136 1.00 72.43 C ATOM 188 CG2 VAL A 185 -19.473 -16.719 -52.033 1.00 23.12 C ATOM 0 H VAL A 185 -17.882 -15.313 -53.360 1.00 43.51 H new ATOM 0 HA VAL A 185 -18.304 -13.585 -51.059 1.00 73.04 H new ATOM 0 HB VAL A 185 -19.798 -15.434 -50.352 1.00 23.54 H new ATOM 0 HG11 VAL A 185 -21.537 -15.003 -52.119 1.00 72.43 H new ATOM 0 HG12 VAL A 185 -20.686 -13.514 -51.642 1.00 72.43 H new ATOM 0 HG13 VAL A 185 -20.270 -14.327 -53.169 1.00 72.43 H new ATOM 0 HG21 VAL A 185 -20.465 -17.169 -52.000 1.00 23.12 H new ATOM 0 HG22 VAL A 185 -19.145 -16.638 -53.069 1.00 23.12 H new ATOM 0 HG23 VAL A 185 -18.773 -17.343 -51.478 1.00 23.12 H new ATOM 198 N GLY A 186 -15.970 -15.567 -50.838 1.00 64.11 N ATOM 199 CA GLY A 186 -14.945 -16.208 -50.026 1.00 14.24 C ATOM 200 C GLY A 186 -14.216 -17.276 -50.828 1.00 62.45 C ATOM 201 O GLY A 186 -14.286 -17.276 -52.056 1.00 21.23 O ATOM 0 H GLY A 186 -15.679 -15.424 -51.805 1.00 64.11 H new ATOM 0 HA2 GLY A 186 -14.233 -15.461 -49.673 1.00 14.24 H new ATOM 0 HA3 GLY A 186 -15.401 -16.656 -49.143 1.00 14.24 H new ATOM 205 N LEU A 187 -13.486 -18.161 -50.141 1.00 72.41 N ATOM 206 CA LEU A 187 -12.852 -19.335 -50.748 1.00 12.03 C ATOM 207 C LEU A 187 -12.716 -20.493 -49.742 1.00 61.21 C ATOM 208 O LEU A 187 -11.785 -21.293 -49.849 1.00 12.43 O ATOM 209 CB LEU A 187 -11.498 -18.957 -51.374 1.00 63.55 C ATOM 210 CG LEU A 187 -11.203 -19.878 -52.579 1.00 32.34 C ATOM 211 CD1 LEU A 187 -11.770 -19.296 -53.880 1.00 15.23 C ATOM 212 CD2 LEU A 187 -9.701 -20.084 -52.739 1.00 11.21 C ATOM 0 H LEU A 187 -13.317 -18.081 -49.138 1.00 72.41 H new ATOM 0 HA LEU A 187 -13.501 -19.692 -51.548 1.00 12.03 H new ATOM 0 HB2 LEU A 187 -11.514 -17.916 -51.696 1.00 63.55 H new ATOM 0 HB3 LEU A 187 -10.705 -19.049 -50.632 1.00 63.55 H new ATOM 0 HG LEU A 187 -11.686 -20.835 -52.382 1.00 32.34 H new ATOM 0 HD11 LEU A 187 -11.545 -19.968 -54.708 1.00 15.23 H new ATOM 0 HD12 LEU A 187 -12.850 -19.183 -53.788 1.00 15.23 H new ATOM 0 HD13 LEU A 187 -11.318 -18.322 -54.070 1.00 15.23 H new ATOM 0 HD21 LEU A 187 -9.512 -20.735 -53.592 1.00 11.21 H new ATOM 0 HD22 LEU A 187 -9.217 -19.121 -52.903 1.00 11.21 H new ATOM 0 HD23 LEU A 187 -9.299 -20.543 -51.836 1.00 11.21 H new ATOM 224 N CYS A 188 -13.607 -20.562 -48.743 1.00 5.10 N ATOM 225 CA CYS A 188 -13.581 -21.524 -47.637 1.00 41.23 C ATOM 226 C CYS A 188 -12.303 -21.453 -46.778 1.00 61.24 C ATOM 227 O CYS A 188 -11.390 -20.663 -47.027 1.00 13.40 O ATOM 228 CB CYS A 188 -13.869 -22.940 -48.166 1.00 24.44 C ATOM 229 SG CYS A 188 -15.616 -23.064 -48.617 1.00 53.45 S ATOM 0 H CYS A 188 -14.398 -19.921 -48.683 1.00 5.10 H new ATOM 0 HA CYS A 188 -14.377 -21.246 -46.947 1.00 41.23 H new ATOM 0 HB2 CYS A 188 -13.242 -23.152 -49.032 1.00 24.44 H new ATOM 0 HB3 CYS A 188 -13.624 -23.682 -47.406 1.00 24.44 H new ATOM 0 HG CYS A 188 -15.864 -24.258 -49.067 1.00 53.45 H new ATOM 235 N PHE A 189 -12.267 -22.266 -45.721 1.00 52.22 N ATOM 236 CA PHE A 189 -11.249 -22.284 -44.678 1.00 21.13 C ATOM 237 C PHE A 189 -10.842 -23.745 -44.436 1.00 22.14 C ATOM 238 O PHE A 189 -11.207 -24.324 -43.405 1.00 63.21 O ATOM 239 CB PHE A 189 -11.803 -21.616 -43.405 1.00 11.22 C ATOM 240 CG PHE A 189 -11.896 -20.106 -43.471 1.00 52.44 C ATOM 241 CD1 PHE A 189 -12.968 -19.479 -44.134 1.00 72.12 C ATOM 242 CD2 PHE A 189 -10.906 -19.321 -42.853 1.00 41.44 C ATOM 243 CE1 PHE A 189 -13.037 -18.077 -44.197 1.00 71.13 C ATOM 244 CE2 PHE A 189 -10.979 -17.921 -42.913 1.00 33.44 C ATOM 245 CZ PHE A 189 -12.038 -17.297 -43.591 1.00 32.31 C ATOM 0 H PHE A 189 -12.990 -22.968 -45.564 1.00 52.22 H new ATOM 0 HA PHE A 189 -10.365 -21.721 -44.977 1.00 21.13 H new ATOM 0 HB2 PHE A 189 -12.795 -22.019 -43.202 1.00 11.22 H new ATOM 0 HB3 PHE A 189 -11.169 -21.891 -42.562 1.00 11.22 H new ATOM 0 HD1 PHE A 189 -13.740 -20.077 -44.596 1.00 72.12 H new ATOM 0 HD2 PHE A 189 -10.088 -19.796 -42.332 1.00 41.44 H new ATOM 0 HE1 PHE A 189 -13.858 -17.599 -44.711 1.00 71.13 H new ATOM 0 HE2 PHE A 189 -10.218 -17.321 -42.436 1.00 33.44 H new ATOM 0 HZ PHE A 189 -12.085 -16.219 -43.647 1.00 32.31 H new ATOM 255 N PRO A 190 -10.130 -24.385 -45.379 1.00 74.42 N ATOM 256 CA PRO A 190 -9.647 -25.743 -45.184 1.00 62.01 C ATOM 257 C PRO A 190 -8.513 -25.750 -44.155 1.00 31.33 C ATOM 258 O PRO A 190 -7.902 -24.714 -43.886 1.00 55.50 O ATOM 259 CB PRO A 190 -9.180 -26.183 -46.569 1.00 44.41 C ATOM 260 CG PRO A 190 -8.670 -24.884 -47.193 1.00 32.21 C ATOM 261 CD PRO A 190 -9.640 -23.840 -46.639 1.00 14.15 C ATOM 0 HA PRO A 190 -10.404 -26.422 -44.792 1.00 62.01 H new ATOM 0 HB2 PRO A 190 -8.395 -26.937 -46.509 1.00 44.41 H new ATOM 0 HB3 PRO A 190 -9.994 -26.617 -47.150 1.00 44.41 H new ATOM 0 HG2 PRO A 190 -7.640 -24.673 -46.904 1.00 32.21 H new ATOM 0 HG3 PRO A 190 -8.694 -24.921 -48.282 1.00 32.21 H new ATOM 0 HD2 PRO A 190 -9.140 -22.884 -46.484 1.00 14.15 H new ATOM 0 HD3 PRO A 190 -10.461 -23.661 -47.333 1.00 14.15 H new ATOM 269 N MET A 191 -8.238 -26.911 -43.553 1.00 5.12 N ATOM 270 CA MET A 191 -7.164 -27.126 -42.578 1.00 32.15 C ATOM 271 C MET A 191 -7.399 -26.307 -41.302 1.00 53.20 C ATOM 272 O MET A 191 -6.479 -26.047 -40.531 1.00 13.41 O ATOM 273 CB MET A 191 -5.760 -26.941 -43.189 1.00 33.21 C ATOM 274 CG MET A 191 -5.537 -27.802 -44.441 1.00 23.31 C ATOM 275 SD MET A 191 -5.662 -26.915 -46.019 1.00 33.12 S ATOM 276 CE MET A 191 -4.012 -26.168 -46.110 1.00 34.42 C ATOM 0 H MET A 191 -8.776 -27.757 -43.738 1.00 5.12 H new ATOM 0 HA MET A 191 -7.196 -28.173 -42.278 1.00 32.15 H new ATOM 0 HB2 MET A 191 -5.616 -25.891 -43.445 1.00 33.21 H new ATOM 0 HB3 MET A 191 -5.008 -27.193 -42.442 1.00 33.21 H new ATOM 0 HG2 MET A 191 -4.550 -28.260 -44.377 1.00 23.31 H new ATOM 0 HG3 MET A 191 -6.265 -28.613 -44.439 1.00 23.31 H new ATOM 0 HE1 MET A 191 -3.926 -25.586 -47.027 1.00 34.42 H new ATOM 0 HE2 MET A 191 -3.860 -25.515 -45.250 1.00 34.42 H new ATOM 0 HE3 MET A 191 -3.256 -26.954 -46.107 1.00 34.42 H new ATOM 286 N ARG A 192 -8.644 -25.876 -41.091 1.00 54.31 N ATOM 287 CA ARG A 192 -9.041 -24.969 -40.009 1.00 71.24 C ATOM 288 C ARG A 192 -10.199 -25.549 -39.193 1.00 74.33 C ATOM 289 O ARG A 192 -10.765 -24.850 -38.351 1.00 44.54 O ATOM 290 CB ARG A 192 -9.335 -23.583 -40.628 1.00 53.03 C ATOM 291 CG ARG A 192 -9.304 -22.361 -39.690 1.00 10.34 C ATOM 292 CD ARG A 192 -8.017 -22.277 -38.861 1.00 64.52 C ATOM 293 NE ARG A 192 -7.787 -20.937 -38.291 1.00 53.10 N ATOM 294 CZ ARG A 192 -6.650 -20.549 -37.696 1.00 23.44 C ATOM 295 NH1 ARG A 192 -5.660 -21.411 -37.479 1.00 33.24 N1+ ATOM 296 NH2 ARG A 192 -6.500 -19.289 -37.306 1.00 13.53 N ATOM 0 H ARG A 192 -9.426 -26.155 -41.683 1.00 54.31 H new ATOM 0 HA ARG A 192 -8.234 -24.848 -39.286 1.00 71.24 H new ATOM 0 HB2 ARG A 192 -8.613 -23.412 -41.426 1.00 53.03 H new ATOM 0 HB3 ARG A 192 -10.320 -23.625 -41.093 1.00 53.03 H new ATOM 0 HG2 ARG A 192 -9.408 -21.452 -40.282 1.00 10.34 H new ATOM 0 HG3 ARG A 192 -10.161 -22.404 -39.018 1.00 10.34 H new ATOM 0 HD2 ARG A 192 -8.063 -23.007 -38.053 1.00 64.52 H new ATOM 0 HD3 ARG A 192 -7.168 -22.550 -39.488 1.00 64.52 H new ATOM 0 HE ARG A 192 -8.546 -20.258 -38.354 1.00 53.10 H new ATOM 0 HH11 ARG A 192 -5.759 -22.385 -37.767 1.00 33.24 H new ATOM 0 HH12 ARG A 192 -4.802 -21.098 -37.025 1.00 33.24 H new ATOM 0 HH21 ARG A 192 -7.250 -18.615 -37.459 1.00 13.53 H new ATOM 0 HH22 ARG A 192 -5.635 -18.995 -36.853 1.00 13.53 H new ATOM 310 N THR A 193 -10.565 -26.806 -39.445 1.00 21.21 N ATOM 311 CA THR A 193 -11.652 -27.526 -38.805 1.00 71.03 C ATOM 312 C THR A 193 -11.241 -29.006 -38.719 1.00 61.34 C ATOM 313 O THR A 193 -10.886 -29.577 -39.748 1.00 73.14 O ATOM 314 CB THR A 193 -12.962 -27.311 -39.589 1.00 53.20 C ATOM 315 OG1 THR A 193 -12.772 -27.090 -40.976 1.00 41.42 O ATOM 316 CG2 THR A 193 -13.773 -26.126 -39.053 1.00 75.33 C ATOM 0 H THR A 193 -10.081 -27.375 -40.140 1.00 21.21 H new ATOM 0 HA THR A 193 -11.839 -27.157 -37.797 1.00 71.03 H new ATOM 0 HB THR A 193 -13.501 -28.247 -39.446 1.00 53.20 H new ATOM 0 HG1 THR A 193 -13.642 -26.964 -41.409 1.00 41.42 H new ATOM 0 HG21 THR A 193 -14.686 -26.016 -39.638 1.00 75.33 H new ATOM 0 HG22 THR A 193 -14.030 -26.304 -38.009 1.00 75.33 H new ATOM 0 HG23 THR A 193 -13.180 -25.215 -39.131 1.00 75.33 H new ATOM 324 N TYR A 194 -11.246 -29.615 -37.526 1.00 32.21 N ATOM 325 CA TYR A 194 -10.850 -31.006 -37.263 1.00 24.41 C ATOM 326 C TYR A 194 -11.565 -31.582 -36.023 1.00 2.42 C ATOM 327 O TYR A 194 -11.058 -32.498 -35.374 1.00 43.14 O ATOM 328 CB TYR A 194 -9.315 -31.098 -37.143 1.00 72.14 C ATOM 329 CG TYR A 194 -8.602 -31.140 -38.480 1.00 73.13 C ATOM 330 CD1 TYR A 194 -8.792 -32.252 -39.323 1.00 72.31 C ATOM 331 CD2 TYR A 194 -7.775 -30.080 -38.897 1.00 45.31 C ATOM 332 CE1 TYR A 194 -8.190 -32.290 -40.590 1.00 32.21 C ATOM 333 CE2 TYR A 194 -7.159 -30.118 -40.160 1.00 5.30 C ATOM 334 CZ TYR A 194 -7.375 -31.219 -41.016 1.00 42.51 C ATOM 335 OH TYR A 194 -6.835 -31.229 -42.265 1.00 72.23 O ATOM 0 H TYR A 194 -11.540 -29.129 -36.678 1.00 32.21 H new ATOM 0 HA TYR A 194 -11.165 -31.622 -38.106 1.00 24.41 H new ATOM 0 HB2 TYR A 194 -8.952 -30.242 -36.574 1.00 72.14 H new ATOM 0 HB3 TYR A 194 -9.056 -31.992 -36.575 1.00 72.14 H new ATOM 0 HD1 TYR A 194 -9.403 -33.079 -38.993 1.00 72.31 H new ATOM 0 HD2 TYR A 194 -7.613 -29.235 -38.244 1.00 45.31 H new ATOM 0 HE1 TYR A 194 -8.350 -33.138 -41.239 1.00 32.21 H new ATOM 0 HE2 TYR A 194 -6.521 -29.305 -40.475 1.00 5.30 H new ATOM 0 HH TYR A 194 -6.302 -30.417 -42.397 1.00 72.23 H new ATOM 345 N SER A 195 -12.748 -31.058 -35.679 1.00 32.13 N ATOM 346 CA SER A 195 -13.468 -31.354 -34.444 1.00 10.15 C ATOM 347 C SER A 195 -12.613 -31.050 -33.204 1.00 61.15 C ATOM 348 O SER A 195 -11.597 -30.351 -33.264 1.00 42.40 O ATOM 349 CB SER A 195 -13.984 -32.807 -34.460 1.00 65.44 C ATOM 350 OG SER A 195 -15.117 -32.924 -33.606 1.00 24.24 O ATOM 0 H SER A 195 -13.243 -30.395 -36.276 1.00 32.13 H new ATOM 0 HA SER A 195 -14.336 -30.697 -34.384 1.00 10.15 H new ATOM 0 HB2 SER A 195 -14.251 -33.097 -35.476 1.00 65.44 H new ATOM 0 HB3 SER A 195 -13.197 -33.486 -34.131 1.00 65.44 H new ATOM 0 HG SER A 195 -15.443 -33.848 -33.620 1.00 24.24 H new ATOM 356 N LYS A 196 -13.063 -31.573 -32.062 1.00 35.23 N ATOM 357 CA LYS A 196 -12.412 -31.522 -30.758 1.00 32.13 C ATOM 358 C LYS A 196 -12.505 -30.092 -30.258 1.00 0.52 C ATOM 359 O LYS A 196 -11.524 -29.359 -30.139 1.00 54.11 O ATOM 360 CB LYS A 196 -10.990 -32.115 -30.805 1.00 20.51 C ATOM 361 CG LYS A 196 -10.960 -33.528 -31.411 1.00 51.31 C ATOM 362 CD LYS A 196 -9.619 -34.229 -31.160 1.00 13.40 C ATOM 363 CE LYS A 196 -9.600 -35.548 -31.940 1.00 13.14 C ATOM 364 NZ LYS A 196 -8.618 -36.510 -31.408 1.00 11.14 N1+ ATOM 0 H LYS A 196 -13.950 -32.075 -32.024 1.00 35.23 H new ATOM 0 HA LYS A 196 -12.918 -32.159 -30.032 1.00 32.13 H new ATOM 0 HB2 LYS A 196 -10.346 -31.459 -31.390 1.00 20.51 H new ATOM 0 HB3 LYS A 196 -10.580 -32.147 -29.796 1.00 20.51 H new ATOM 0 HG2 LYS A 196 -11.767 -34.124 -30.984 1.00 51.31 H new ATOM 0 HG3 LYS A 196 -11.143 -33.467 -32.484 1.00 51.31 H new ATOM 0 HD2 LYS A 196 -8.794 -33.591 -31.477 1.00 13.40 H new ATOM 0 HD3 LYS A 196 -9.485 -34.418 -30.095 1.00 13.40 H new ATOM 0 HE2 LYS A 196 -10.593 -35.996 -31.912 1.00 13.14 H new ATOM 0 HE3 LYS A 196 -9.372 -35.343 -32.986 1.00 13.14 H new ATOM 0 HZ1 LYS A 196 -8.647 -37.383 -31.972 1.00 11.14 H new ATOM 0 HZ2 LYS A 196 -7.665 -36.097 -31.458 1.00 11.14 H new ATOM 0 HZ3 LYS A 196 -8.848 -36.729 -30.418 1.00 11.14 H new ATOM 378 N GLN A 197 -13.750 -29.668 -30.081 1.00 54.34 N ATOM 379 CA GLN A 197 -14.157 -28.294 -29.922 1.00 31.24 C ATOM 380 C GLN A 197 -15.253 -28.308 -28.872 1.00 14.24 C ATOM 381 O GLN A 197 -16.362 -28.778 -29.138 1.00 54.12 O ATOM 382 CB GLN A 197 -14.600 -27.726 -31.284 1.00 52.12 C ATOM 383 CG GLN A 197 -15.376 -26.405 -31.106 1.00 43.43 C ATOM 384 CD GLN A 197 -15.600 -25.640 -32.412 1.00 62.31 C ATOM 385 OE1 GLN A 197 -15.948 -26.206 -33.441 1.00 22.03 O ATOM 386 NE2 GLN A 197 -15.407 -24.329 -32.419 1.00 44.20 N ATOM 0 H GLN A 197 -14.538 -30.314 -30.044 1.00 54.34 H new ATOM 0 HA GLN A 197 -13.353 -27.638 -29.588 1.00 31.24 H new ATOM 0 HB2 GLN A 197 -13.726 -27.557 -31.913 1.00 52.12 H new ATOM 0 HB3 GLN A 197 -15.227 -28.454 -31.799 1.00 52.12 H new ATOM 0 HG2 GLN A 197 -16.343 -26.621 -30.652 1.00 43.43 H new ATOM 0 HG3 GLN A 197 -14.832 -25.766 -30.410 1.00 43.43 H new ATOM 0 HE21 GLN A 197 -15.117 -23.852 -31.565 1.00 44.20 H new ATOM 0 HE22 GLN A 197 -15.548 -23.797 -33.278 1.00 44.20 H new ATOM 395 N SER A 198 -14.923 -27.849 -27.670 1.00 41.44 N ATOM 396 CA SER A 198 -15.826 -27.666 -26.547 1.00 54.41 C ATOM 397 C SER A 198 -15.045 -26.944 -25.463 1.00 63.14 C ATOM 398 O SER A 198 -14.269 -27.582 -24.748 1.00 14.14 O ATOM 399 CB SER A 198 -16.276 -29.020 -26.013 1.00 23.42 C ATOM 400 OG SER A 198 -17.338 -29.564 -26.763 1.00 4.34 O ATOM 0 H SER A 198 -13.965 -27.581 -27.444 1.00 41.44 H new ATOM 0 HA SER A 198 -16.707 -27.101 -26.852 1.00 54.41 H new ATOM 0 HB2 SER A 198 -15.433 -29.711 -26.026 1.00 23.42 H new ATOM 0 HB3 SER A 198 -16.585 -28.914 -24.973 1.00 23.42 H new ATOM 0 HG SER A 198 -17.190 -29.387 -27.716 1.00 4.34 H new ATOM 406 N LYS A 199 -15.230 -25.628 -25.350 1.00 11.23 N ATOM 407 CA LYS A 199 -14.681 -24.849 -24.244 1.00 2.21 C ATOM 408 C LYS A 199 -15.769 -23.911 -23.732 1.00 2.30 C ATOM 409 O LYS A 199 -15.760 -22.725 -24.065 1.00 75.01 O ATOM 410 CB LYS A 199 -13.428 -24.083 -24.679 1.00 55.42 C ATOM 411 CG LYS A 199 -12.260 -24.998 -25.051 1.00 60.32 C ATOM 412 CD LYS A 199 -11.029 -24.128 -25.334 1.00 62.24 C ATOM 413 CE LYS A 199 -9.768 -24.959 -25.583 1.00 63.50 C ATOM 414 NZ LYS A 199 -8.785 -24.185 -26.366 1.00 45.33 N1+ ATOM 0 H LYS A 199 -15.763 -25.075 -26.021 1.00 11.23 H new ATOM 0 HA LYS A 199 -14.371 -25.514 -23.438 1.00 2.21 H new ATOM 0 HB2 LYS A 199 -13.674 -23.453 -25.534 1.00 55.42 H new ATOM 0 HB3 LYS A 199 -13.118 -23.419 -23.872 1.00 55.42 H new ATOM 0 HG2 LYS A 199 -12.052 -25.695 -24.239 1.00 60.32 H new ATOM 0 HG3 LYS A 199 -12.511 -25.595 -25.928 1.00 60.32 H new ATOM 0 HD2 LYS A 199 -11.224 -23.500 -26.204 1.00 62.24 H new ATOM 0 HD3 LYS A 199 -10.859 -23.460 -24.490 1.00 62.24 H new ATOM 0 HE2 LYS A 199 -9.329 -25.259 -24.631 1.00 63.50 H new ATOM 0 HE3 LYS A 199 -10.027 -25.874 -26.116 1.00 63.50 H new ATOM 0 HZ1 LYS A 199 -7.936 -24.763 -26.526 1.00 45.33 H new ATOM 0 HZ2 LYS A 199 -9.201 -23.921 -27.282 1.00 45.33 H new ATOM 0 HZ3 LYS A 199 -8.524 -23.325 -25.843 1.00 45.33 H new ATOM 428 N PRO A 200 -16.751 -24.425 -22.981 1.00 22.33 N ATOM 429 CA PRO A 200 -17.803 -23.584 -22.453 1.00 61.21 C ATOM 430 C PRO A 200 -17.234 -22.688 -21.350 1.00 63.15 C ATOM 431 O PRO A 200 -16.300 -23.069 -20.637 1.00 70.42 O ATOM 432 CB PRO A 200 -18.852 -24.556 -21.912 1.00 43.42 C ATOM 433 CG PRO A 200 -18.026 -25.774 -21.513 1.00 75.53 C ATOM 434 CD PRO A 200 -16.882 -25.791 -22.517 1.00 21.14 C ATOM 0 HA PRO A 200 -18.237 -22.919 -23.200 1.00 61.21 H new ATOM 0 HB2 PRO A 200 -19.388 -24.137 -21.061 1.00 43.42 H new ATOM 0 HB3 PRO A 200 -19.598 -24.805 -22.667 1.00 43.42 H new ATOM 0 HG2 PRO A 200 -17.658 -25.689 -20.491 1.00 75.53 H new ATOM 0 HG3 PRO A 200 -18.615 -26.690 -21.564 1.00 75.53 H new ATOM 0 HD2 PRO A 200 -15.959 -26.138 -22.053 1.00 21.14 H new ATOM 0 HD3 PRO A 200 -17.097 -26.467 -23.344 1.00 21.14 H new ATOM 442 N LEU A 201 -17.870 -21.542 -21.141 1.00 44.43 N ATOM 443 CA LEU A 201 -17.585 -20.609 -20.062 1.00 11.42 C ATOM 444 C LEU A 201 -18.873 -20.066 -19.481 1.00 51.40 C ATOM 445 O LEU A 201 -19.975 -20.363 -19.951 1.00 54.24 O ATOM 446 CB LEU A 201 -16.616 -19.504 -20.527 1.00 24.05 C ATOM 447 CG LEU A 201 -17.259 -18.390 -21.389 1.00 44.05 C ATOM 448 CD1 LEU A 201 -17.078 -17.011 -20.734 1.00 42.43 C ATOM 449 CD2 LEU A 201 -16.662 -18.363 -22.798 1.00 3.33 C ATOM 0 H LEU A 201 -18.629 -21.226 -21.744 1.00 44.43 H new ATOM 0 HA LEU A 201 -17.075 -21.139 -19.257 1.00 11.42 H new ATOM 0 HB2 LEU A 201 -16.162 -19.046 -19.648 1.00 24.05 H new ATOM 0 HB3 LEU A 201 -15.810 -19.965 -21.098 1.00 24.05 H new ATOM 0 HG LEU A 201 -18.323 -18.615 -21.461 1.00 44.05 H new ATOM 0 HD11 LEU A 201 -17.539 -16.247 -21.360 1.00 42.43 H new ATOM 0 HD12 LEU A 201 -17.552 -17.010 -19.752 1.00 42.43 H new ATOM 0 HD13 LEU A 201 -16.015 -16.797 -20.624 1.00 42.43 H new ATOM 0 HD21 LEU A 201 -17.134 -17.570 -23.378 1.00 3.33 H new ATOM 0 HD22 LEU A 201 -15.590 -18.177 -22.735 1.00 3.33 H new ATOM 0 HD23 LEU A 201 -16.836 -19.322 -23.285 1.00 3.33 H new ATOM 461 N PHE A 202 -18.723 -19.324 -18.399 1.00 5.10 N ATOM 462 CA PHE A 202 -19.800 -18.943 -17.515 1.00 64.12 C ATOM 463 C PHE A 202 -19.277 -17.767 -16.690 1.00 52.51 C ATOM 464 O PHE A 202 -18.207 -17.895 -16.087 1.00 4.24 O ATOM 465 CB PHE A 202 -20.171 -20.165 -16.659 1.00 64.31 C ATOM 466 CG PHE A 202 -19.046 -21.111 -16.288 1.00 42.43 C ATOM 467 CD1 PHE A 202 -18.267 -20.888 -15.139 1.00 65.05 C ATOM 468 CD2 PHE A 202 -18.785 -22.219 -17.110 1.00 30.41 C ATOM 469 CE1 PHE A 202 -17.210 -21.764 -14.831 1.00 14.43 C ATOM 470 CE2 PHE A 202 -17.738 -23.099 -16.792 1.00 24.05 C ATOM 471 CZ PHE A 202 -16.946 -22.868 -15.656 1.00 35.32 C ATOM 0 H PHE A 202 -17.817 -18.960 -18.105 1.00 5.10 H new ATOM 0 HA PHE A 202 -20.707 -18.633 -18.034 1.00 64.12 H new ATOM 0 HB2 PHE A 202 -20.630 -19.807 -15.738 1.00 64.31 H new ATOM 0 HB3 PHE A 202 -20.931 -20.735 -17.193 1.00 64.31 H new ATOM 0 HD1 PHE A 202 -18.479 -20.047 -14.495 1.00 65.05 H new ATOM 0 HD2 PHE A 202 -19.390 -22.395 -17.987 1.00 30.41 H new ATOM 0 HE1 PHE A 202 -16.600 -21.586 -13.957 1.00 14.43 H new ATOM 0 HE2 PHE A 202 -17.542 -23.954 -17.422 1.00 24.05 H new ATOM 0 HZ PHE A 202 -16.134 -23.539 -15.417 1.00 35.32 H new ATOM 481 N SER A 203 -19.932 -16.607 -16.707 1.00 15.14 N ATOM 482 CA SER A 203 -19.501 -15.469 -15.902 1.00 33.33 C ATOM 483 C SER A 203 -20.602 -14.425 -15.738 1.00 3.11 C ATOM 484 O SER A 203 -21.628 -14.444 -16.420 1.00 43.21 O ATOM 485 CB SER A 203 -18.257 -14.844 -16.554 1.00 34.23 C ATOM 486 OG SER A 203 -18.454 -14.471 -17.913 1.00 54.15 O ATOM 0 H SER A 203 -20.764 -16.432 -17.271 1.00 15.14 H new ATOM 0 HA SER A 203 -19.262 -15.827 -14.901 1.00 33.33 H new ATOM 0 HB2 SER A 203 -17.961 -13.964 -15.983 1.00 34.23 H new ATOM 0 HB3 SER A 203 -17.431 -15.553 -16.496 1.00 34.23 H new ATOM 0 HG SER A 203 -17.629 -14.080 -18.268 1.00 54.15 H new ATOM 492 N ASN A 204 -20.337 -13.458 -14.871 1.00 33.34 N ATOM 493 CA ASN A 204 -20.973 -12.159 -14.832 1.00 23.22 C ATOM 494 C ASN A 204 -20.454 -11.371 -16.029 1.00 63.13 C ATOM 495 O ASN A 204 -19.387 -10.758 -15.956 1.00 34.55 O ATOM 496 CB ASN A 204 -20.634 -11.410 -13.531 1.00 43.13 C ATOM 497 CG ASN A 204 -21.463 -11.884 -12.351 1.00 52.12 C ATOM 498 OD1 ASN A 204 -22.354 -11.182 -11.890 1.00 12.14 O ATOM 499 ND2 ASN A 204 -21.226 -13.085 -11.862 1.00 65.03 N ATOM 0 H ASN A 204 -19.635 -13.570 -14.140 1.00 33.34 H new ATOM 0 HA ASN A 204 -22.056 -12.274 -14.868 1.00 23.22 H new ATOM 0 HB2 ASN A 204 -19.576 -11.544 -13.304 1.00 43.13 H new ATOM 0 HB3 ASN A 204 -20.796 -10.342 -13.678 1.00 43.13 H new ATOM 0 HD21 ASN A 204 -21.788 -13.441 -11.089 1.00 65.03 H new ATOM 0 HD22 ASN A 204 -20.480 -13.658 -12.257 1.00 65.03 H new ATOM 506 N LYS A 205 -21.190 -11.385 -17.137 1.00 32.23 N ATOM 507 CA LYS A 205 -21.042 -10.412 -18.225 1.00 5.31 C ATOM 508 C LYS A 205 -22.312 -9.558 -18.291 1.00 74.31 C ATOM 509 O LYS A 205 -23.225 -9.764 -17.489 1.00 44.22 O ATOM 510 CB LYS A 205 -20.682 -11.120 -19.554 1.00 4.33 C ATOM 511 CG LYS A 205 -19.344 -10.616 -20.130 1.00 24.12 C ATOM 512 CD LYS A 205 -18.136 -11.260 -19.433 1.00 43.10 C ATOM 513 CE LYS A 205 -16.843 -10.504 -19.771 1.00 53.42 C ATOM 514 NZ LYS A 205 -15.667 -11.050 -19.062 1.00 41.42 N1+ ATOM 0 H LYS A 205 -21.916 -12.080 -17.310 1.00 32.23 H new ATOM 0 HA LYS A 205 -20.207 -9.738 -18.034 1.00 5.31 H new ATOM 0 HB2 LYS A 205 -20.623 -12.196 -19.388 1.00 4.33 H new ATOM 0 HB3 LYS A 205 -21.476 -10.952 -20.281 1.00 4.33 H new ATOM 0 HG2 LYS A 205 -19.304 -10.833 -21.197 1.00 24.12 H new ATOM 0 HG3 LYS A 205 -19.289 -9.533 -20.023 1.00 24.12 H new ATOM 0 HD2 LYS A 205 -18.291 -11.260 -18.354 1.00 43.10 H new ATOM 0 HD3 LYS A 205 -18.045 -12.301 -19.742 1.00 43.10 H new ATOM 0 HE2 LYS A 205 -16.669 -10.551 -20.846 1.00 53.42 H new ATOM 0 HE3 LYS A 205 -16.963 -9.452 -19.513 1.00 53.42 H new ATOM 0 HZ1 LYS A 205 -14.820 -10.506 -19.324 1.00 41.42 H new ATOM 0 HZ2 LYS A 205 -15.818 -10.982 -18.035 1.00 41.42 H new ATOM 0 HZ3 LYS A 205 -15.534 -12.047 -19.327 1.00 41.42 H new ATOM 528 N ARG A 206 -22.388 -8.592 -19.216 1.00 72.04 N ATOM 529 CA ARG A 206 -23.542 -7.703 -19.401 1.00 44.22 C ATOM 530 C ARG A 206 -23.985 -7.044 -18.093 1.00 14.02 C ATOM 531 O ARG A 206 -25.160 -7.120 -17.739 1.00 71.11 O ATOM 532 CB ARG A 206 -24.660 -8.466 -20.151 1.00 34.22 C ATOM 533 CG ARG A 206 -25.732 -7.569 -20.814 1.00 44.22 C ATOM 534 CD ARG A 206 -27.114 -7.515 -20.135 1.00 73.05 C ATOM 535 NE ARG A 206 -27.656 -8.856 -19.829 1.00 44.20 N ATOM 536 CZ ARG A 206 -28.924 -9.272 -19.941 1.00 1.34 C ATOM 537 NH1 ARG A 206 -29.888 -8.495 -20.424 1.00 3.11 N1+ ATOM 538 NH2 ARG A 206 -29.242 -10.501 -19.560 1.00 20.34 N ATOM 0 H ARG A 206 -21.630 -8.403 -19.872 1.00 72.04 H new ATOM 0 HA ARG A 206 -23.256 -6.859 -20.028 1.00 44.22 H new ATOM 0 HB2 ARG A 206 -24.202 -9.088 -20.920 1.00 34.22 H new ATOM 0 HB3 ARG A 206 -25.154 -9.139 -19.450 1.00 34.22 H new ATOM 0 HG2 ARG A 206 -25.340 -6.553 -20.865 1.00 44.22 H new ATOM 0 HG3 ARG A 206 -25.871 -7.909 -21.840 1.00 44.22 H new ATOM 0 HD2 ARG A 206 -27.038 -6.940 -19.212 1.00 73.05 H new ATOM 0 HD3 ARG A 206 -27.812 -6.986 -20.784 1.00 73.05 H new ATOM 0 HE ARG A 206 -26.985 -9.546 -19.493 1.00 44.20 H new ATOM 0 HH11 ARG A 206 -29.674 -7.544 -20.725 1.00 3.11 H new ATOM 0 HH12 ARG A 206 -30.842 -8.849 -20.493 1.00 3.11 H new ATOM 0 HH21 ARG A 206 -28.524 -11.121 -19.185 1.00 20.34 H new ATOM 0 HH22 ARG A 206 -30.205 -10.827 -19.641 1.00 20.34 H new ATOM 552 N LYS A 207 -23.041 -6.464 -17.345 1.00 13.45 N ATOM 553 CA LYS A 207 -23.300 -5.580 -16.198 1.00 44.04 C ATOM 554 C LYS A 207 -22.068 -4.773 -15.774 1.00 62.01 C ATOM 555 O LYS A 207 -22.089 -4.097 -14.749 1.00 42.43 O ATOM 556 CB LYS A 207 -23.899 -6.353 -15.001 1.00 24.21 C ATOM 557 CG LYS A 207 -23.088 -7.585 -14.567 1.00 43.43 C ATOM 558 CD LYS A 207 -23.583 -8.269 -13.281 1.00 14.11 C ATOM 559 CE LYS A 207 -25.069 -8.663 -13.261 1.00 12.52 C ATOM 560 NZ LYS A 207 -25.949 -7.560 -12.814 1.00 13.51 N1+ ATOM 0 H LYS A 207 -22.046 -6.599 -17.524 1.00 13.45 H new ATOM 0 HA LYS A 207 -24.043 -4.859 -16.539 1.00 44.04 H new ATOM 0 HB2 LYS A 207 -23.986 -5.674 -14.153 1.00 24.21 H new ATOM 0 HB3 LYS A 207 -24.909 -6.671 -15.259 1.00 24.21 H new ATOM 0 HG2 LYS A 207 -23.102 -8.314 -15.377 1.00 43.43 H new ATOM 0 HG3 LYS A 207 -22.049 -7.286 -14.425 1.00 43.43 H new ATOM 0 HD2 LYS A 207 -22.987 -9.166 -13.117 1.00 14.11 H new ATOM 0 HD3 LYS A 207 -23.392 -7.601 -12.441 1.00 14.11 H new ATOM 0 HE2 LYS A 207 -25.370 -8.980 -14.260 1.00 12.52 H new ATOM 0 HE3 LYS A 207 -25.204 -9.520 -12.601 1.00 12.52 H new ATOM 0 HZ1 LYS A 207 -26.564 -7.896 -12.046 1.00 13.51 H new ATOM 0 HZ2 LYS A 207 -25.367 -6.769 -12.471 1.00 13.51 H new ATOM 0 HZ3 LYS A 207 -26.535 -7.238 -13.611 1.00 13.51 H new ATOM 574 N ILE A 208 -20.983 -4.830 -16.539 1.00 1.30 N ATOM 575 CA ILE A 208 -19.689 -4.293 -16.124 1.00 11.50 C ATOM 576 C ILE A 208 -19.609 -2.818 -16.540 1.00 21.22 C ATOM 577 O ILE A 208 -20.274 -2.403 -17.498 1.00 5.12 O ATOM 578 CB ILE A 208 -18.566 -5.196 -16.696 1.00 32.34 C ATOM 579 CG1 ILE A 208 -18.785 -6.708 -16.420 1.00 21.11 C ATOM 580 CG2 ILE A 208 -17.183 -4.784 -16.184 1.00 34.12 C ATOM 581 CD1 ILE A 208 -18.883 -7.099 -14.937 1.00 64.43 C ATOM 0 H ILE A 208 -20.975 -5.251 -17.468 1.00 1.30 H new ATOM 0 HA ILE A 208 -19.561 -4.306 -15.042 1.00 11.50 H new ATOM 0 HB ILE A 208 -18.612 -5.046 -17.775 1.00 32.34 H new ATOM 0 HG12 ILE A 208 -19.699 -7.023 -16.923 1.00 21.11 H new ATOM 0 HG13 ILE A 208 -17.964 -7.265 -16.872 1.00 21.11 H new ATOM 0 HG21 ILE A 208 -16.426 -5.443 -16.610 1.00 34.12 H new ATOM 0 HG22 ILE A 208 -16.977 -3.756 -16.480 1.00 34.12 H new ATOM 0 HG23 ILE A 208 -17.160 -4.860 -15.097 1.00 34.12 H new ATOM 0 HD11 ILE A 208 -19.036 -8.175 -14.854 1.00 64.43 H new ATOM 0 HD12 ILE A 208 -17.961 -6.823 -14.426 1.00 64.43 H new ATOM 0 HD13 ILE A 208 -19.722 -6.577 -14.478 1.00 64.43 H new ATOM 593 N HIS A 209 -18.830 -2.016 -15.807 1.00 41.32 N ATOM 594 CA HIS A 209 -18.592 -0.606 -16.119 1.00 63.01 C ATOM 595 C HIS A 209 -17.512 -0.468 -17.210 1.00 55.52 C ATOM 596 O HIS A 209 -17.108 -1.469 -17.809 1.00 14.34 O ATOM 597 CB HIS A 209 -18.260 0.174 -14.828 1.00 3.24 C ATOM 598 CG HIS A 209 -19.141 1.387 -14.642 1.00 14.44 C ATOM 599 ND1 HIS A 209 -18.841 2.700 -14.953 1.00 43.42 N ATOM 600 CD2 HIS A 209 -20.427 1.361 -14.170 1.00 41.34 C ATOM 601 CE1 HIS A 209 -19.922 3.447 -14.674 1.00 35.43 C ATOM 602 NE2 HIS A 209 -20.923 2.666 -14.231 1.00 2.45 N ATOM 0 H HIS A 209 -18.341 -2.334 -14.970 1.00 41.32 H new ATOM 0 HA HIS A 209 -19.499 -0.162 -16.530 1.00 63.01 H new ATOM 0 HB2 HIS A 209 -18.372 -0.487 -13.969 1.00 3.24 H new ATOM 0 HB3 HIS A 209 -17.216 0.488 -14.855 1.00 3.24 H new ATOM 0 HD2 HIS A 209 -20.960 0.491 -13.816 1.00 41.34 H new ATOM 0 HE1 HIS A 209 -19.979 4.519 -14.789 1.00 35.43 H new ATOM 0 HE2 HIS A 209 -21.866 2.969 -13.986 1.00 2.45 H new ATOM 610 N LEU A 210 -17.043 0.757 -17.478 1.00 24.30 N ATOM 611 CA LEU A 210 -15.956 1.066 -18.420 1.00 74.33 C ATOM 612 C LEU A 210 -14.834 1.894 -17.784 1.00 64.15 C ATOM 613 O LEU A 210 -13.895 2.301 -18.468 1.00 4.22 O ATOM 614 CB LEU A 210 -16.541 1.774 -19.656 1.00 35.43 C ATOM 615 CG LEU A 210 -16.268 1.075 -21.002 1.00 23.31 C ATOM 616 CD1 LEU A 210 -14.789 1.106 -21.394 1.00 42.23 C ATOM 617 CD2 LEU A 210 -16.773 -0.373 -21.029 1.00 61.45 C ATOM 0 H LEU A 210 -17.422 1.591 -17.030 1.00 24.30 H new ATOM 0 HA LEU A 210 -15.495 0.125 -18.721 1.00 74.33 H new ATOM 0 HB2 LEU A 210 -17.619 1.867 -19.525 1.00 35.43 H new ATOM 0 HB3 LEU A 210 -16.137 2.785 -19.701 1.00 35.43 H new ATOM 0 HG LEU A 210 -16.831 1.651 -21.736 1.00 23.31 H new ATOM 0 HD11 LEU A 210 -14.655 0.599 -22.350 1.00 42.23 H new ATOM 0 HD12 LEU A 210 -14.458 2.141 -21.482 1.00 42.23 H new ATOM 0 HD13 LEU A 210 -14.199 0.600 -20.630 1.00 42.23 H new ATOM 0 HD21 LEU A 210 -16.554 -0.817 -22.000 1.00 61.45 H new ATOM 0 HD22 LEU A 210 -16.275 -0.947 -20.248 1.00 61.45 H new ATOM 0 HD23 LEU A 210 -17.849 -0.386 -20.858 1.00 61.45 H new ATOM 629 N SER A 211 -14.937 2.149 -16.485 1.00 3.02 N ATOM 630 CA SER A 211 -13.901 2.779 -15.671 1.00 64.31 C ATOM 631 C SER A 211 -13.747 2.080 -14.318 1.00 54.04 C ATOM 632 O SER A 211 -13.310 2.698 -13.347 1.00 2.11 O ATOM 633 CB SER A 211 -14.210 4.273 -15.522 1.00 73.53 C ATOM 634 OG SER A 211 -15.478 4.524 -14.928 1.00 23.32 O ATOM 0 H SER A 211 -15.773 1.915 -15.949 1.00 3.02 H new ATOM 0 HA SER A 211 -12.939 2.676 -16.174 1.00 64.31 H new ATOM 0 HB2 SER A 211 -13.433 4.740 -14.917 1.00 73.53 H new ATOM 0 HB3 SER A 211 -14.176 4.745 -16.504 1.00 73.53 H new ATOM 0 HG SER A 211 -15.620 5.491 -14.857 1.00 23.32 H new ATOM 640 N GLU A 212 -14.188 0.823 -14.200 1.00 61.43 N ATOM 641 CA GLU A 212 -14.147 0.154 -12.916 1.00 71.32 C ATOM 642 C GLU A 212 -12.722 -0.287 -12.579 1.00 51.54 C ATOM 643 O GLU A 212 -12.127 -1.145 -13.235 1.00 40.14 O ATOM 644 CB GLU A 212 -15.180 -0.960 -12.806 1.00 52.21 C ATOM 645 CG GLU A 212 -15.169 -2.066 -13.862 1.00 41.53 C ATOM 646 CD GLU A 212 -15.786 -3.351 -13.285 1.00 31.35 C ATOM 647 OE1 GLU A 212 -16.852 -3.297 -12.629 1.00 43.43 O ATOM 648 OE2 GLU A 212 -15.175 -4.425 -13.508 1.00 24.25 O1- ATOM 0 H GLU A 212 -14.568 0.267 -14.966 1.00 61.43 H new ATOM 0 HA GLU A 212 -14.438 0.873 -12.150 1.00 71.32 H new ATOM 0 HB2 GLU A 212 -15.059 -1.431 -11.830 1.00 52.21 H new ATOM 0 HB3 GLU A 212 -16.168 -0.500 -12.817 1.00 52.21 H new ATOM 0 HG2 GLU A 212 -15.729 -1.747 -14.741 1.00 41.53 H new ATOM 0 HG3 GLU A 212 -14.147 -2.258 -14.188 1.00 41.53 H new ATOM 655 N LEU A 213 -12.162 0.324 -11.542 1.00 24.44 N ATOM 656 CA LEU A 213 -10.861 0.023 -10.972 1.00 44.23 C ATOM 657 C LEU A 213 -11.048 -0.180 -9.472 1.00 32.50 C ATOM 658 O LEU A 213 -11.116 0.782 -8.709 1.00 52.31 O ATOM 659 CB LEU A 213 -9.768 1.028 -11.400 1.00 53.53 C ATOM 660 CG LEU A 213 -10.171 2.466 -11.759 1.00 40.33 C ATOM 661 CD1 LEU A 213 -10.887 3.151 -10.608 1.00 1.01 C ATOM 662 CD2 LEU A 213 -8.922 3.274 -12.123 1.00 32.21 C ATOM 0 H LEU A 213 -12.632 1.085 -11.051 1.00 24.44 H new ATOM 0 HA LEU A 213 -10.461 -0.907 -11.375 1.00 44.23 H new ATOM 0 HB2 LEU A 213 -9.039 1.084 -10.592 1.00 53.53 H new ATOM 0 HB3 LEU A 213 -9.254 0.606 -12.264 1.00 53.53 H new ATOM 0 HG LEU A 213 -10.854 2.418 -12.607 1.00 40.33 H new ATOM 0 HD11 LEU A 213 -11.156 4.166 -10.900 1.00 1.01 H new ATOM 0 HD12 LEU A 213 -11.790 2.594 -10.358 1.00 1.01 H new ATOM 0 HD13 LEU A 213 -10.229 3.185 -9.739 1.00 1.01 H new ATOM 0 HD21 LEU A 213 -9.210 4.294 -12.377 1.00 32.21 H new ATOM 0 HD22 LEU A 213 -8.239 3.291 -11.274 1.00 32.21 H new ATOM 0 HD23 LEU A 213 -8.427 2.813 -12.978 1.00 32.21 H new ATOM 674 N MET A 214 -11.187 -1.454 -9.078 1.00 0.24 N ATOM 675 CA MET A 214 -11.401 -2.013 -7.731 1.00 32.05 C ATOM 676 C MET A 214 -12.579 -1.442 -6.913 1.00 23.33 C ATOM 677 O MET A 214 -12.804 -1.893 -5.790 1.00 53.34 O ATOM 678 CB MET A 214 -10.084 -2.059 -6.927 1.00 13.22 C ATOM 679 CG MET A 214 -9.506 -0.685 -6.578 1.00 41.51 C ATOM 680 SD MET A 214 -8.064 -0.722 -5.487 1.00 21.51 S ATOM 681 CE MET A 214 -8.355 0.858 -4.652 1.00 63.42 C ATOM 0 H MET A 214 -11.148 -2.202 -9.770 1.00 0.24 H new ATOM 0 HA MET A 214 -11.734 -3.032 -7.925 1.00 32.05 H new ATOM 0 HB2 MET A 214 -10.256 -2.612 -6.004 1.00 13.22 H new ATOM 0 HB3 MET A 214 -9.343 -2.616 -7.499 1.00 13.22 H new ATOM 0 HG2 MET A 214 -9.231 -0.177 -7.502 1.00 41.51 H new ATOM 0 HG3 MET A 214 -10.286 -0.088 -6.106 1.00 41.51 H new ATOM 0 HE1 MET A 214 -7.565 1.035 -3.922 1.00 63.42 H new ATOM 0 HE2 MET A 214 -8.357 1.663 -5.387 1.00 63.42 H new ATOM 0 HE3 MET A 214 -9.319 0.829 -4.144 1.00 63.42 H new ATOM 691 N LEU A 215 -13.341 -0.494 -7.467 1.00 34.21 N ATOM 692 CA LEU A 215 -14.253 0.396 -6.758 1.00 73.12 C ATOM 693 C LEU A 215 -15.194 -0.341 -5.817 1.00 63.53 C ATOM 694 O LEU A 215 -15.109 -0.162 -4.608 1.00 4.22 O ATOM 695 CB LEU A 215 -15.020 1.267 -7.767 1.00 11.32 C ATOM 696 CG LEU A 215 -15.896 2.342 -7.080 1.00 5.51 C ATOM 697 CD1 LEU A 215 -15.921 3.579 -7.988 1.00 20.01 C ATOM 698 CD2 LEU A 215 -17.347 1.924 -6.814 1.00 75.40 C ATOM 0 H LEU A 215 -13.335 -0.321 -8.472 1.00 34.21 H new ATOM 0 HA LEU A 215 -13.652 1.042 -6.118 1.00 73.12 H new ATOM 0 HB2 LEU A 215 -14.309 1.755 -8.434 1.00 11.32 H new ATOM 0 HB3 LEU A 215 -15.652 0.629 -8.385 1.00 11.32 H new ATOM 0 HG LEU A 215 -15.447 2.525 -6.104 1.00 5.51 H new ATOM 0 HD11 LEU A 215 -16.533 4.355 -7.528 1.00 20.01 H new ATOM 0 HD12 LEU A 215 -14.905 3.950 -8.125 1.00 20.01 H new ATOM 0 HD13 LEU A 215 -16.343 3.311 -8.957 1.00 20.01 H new ATOM 0 HD21 LEU A 215 -17.879 2.743 -6.331 1.00 75.40 H new ATOM 0 HD22 LEU A 215 -17.835 1.682 -7.758 1.00 75.40 H new ATOM 0 HD23 LEU A 215 -17.360 1.049 -6.164 1.00 75.40 H new ATOM 710 N GLU A 216 -16.119 -1.130 -6.355 1.00 42.34 N ATOM 711 CA GLU A 216 -17.229 -1.656 -5.565 1.00 21.22 C ATOM 712 C GLU A 216 -16.860 -2.986 -4.889 1.00 61.20 C ATOM 713 O GLU A 216 -17.749 -3.774 -4.540 1.00 11.33 O ATOM 714 CB GLU A 216 -18.493 -1.766 -6.442 1.00 25.21 C ATOM 715 CG GLU A 216 -18.413 -2.839 -7.542 1.00 54.02 C ATOM 716 CD GLU A 216 -19.637 -2.812 -8.468 1.00 1.13 C ATOM 717 OE1 GLU A 216 -20.777 -3.049 -8.005 1.00 13.22 O ATOM 718 OE2 GLU A 216 -19.460 -2.555 -9.687 1.00 44.35 O1- ATOM 0 H GLU A 216 -16.123 -1.419 -7.333 1.00 42.34 H new ATOM 0 HA GLU A 216 -17.447 -0.959 -4.756 1.00 21.22 H new ATOM 0 HB2 GLU A 216 -19.347 -1.984 -5.801 1.00 25.21 H new ATOM 0 HB3 GLU A 216 -18.682 -0.799 -6.908 1.00 25.21 H new ATOM 0 HG2 GLU A 216 -17.510 -2.685 -8.132 1.00 54.02 H new ATOM 0 HG3 GLU A 216 -18.329 -3.823 -7.082 1.00 54.02 H new ATOM 725 N LYS A 217 -15.558 -3.297 -4.804 1.00 71.23 N ATOM 726 CA LYS A 217 -15.047 -4.661 -4.692 1.00 24.12 C ATOM 727 C LYS A 217 -14.247 -4.946 -3.450 1.00 41.53 C ATOM 728 O LYS A 217 -13.507 -5.929 -3.423 1.00 65.12 O ATOM 729 CB LYS A 217 -14.325 -5.052 -5.988 1.00 63.53 C ATOM 730 CG LYS A 217 -15.338 -5.218 -7.127 1.00 33.31 C ATOM 731 CD LYS A 217 -15.106 -6.514 -7.896 1.00 21.23 C ATOM 732 CE LYS A 217 -15.421 -7.738 -7.029 1.00 11.23 C ATOM 733 NZ LYS A 217 -15.436 -8.977 -7.821 1.00 34.23 N1+ ATOM 0 H LYS A 217 -14.822 -2.591 -4.812 1.00 71.23 H new ATOM 0 HA LYS A 217 -15.913 -5.311 -4.565 1.00 24.12 H new ATOM 0 HB2 LYS A 217 -13.593 -4.288 -6.250 1.00 63.53 H new ATOM 0 HB3 LYS A 217 -13.776 -5.982 -5.841 1.00 63.53 H new ATOM 0 HG2 LYS A 217 -16.349 -5.211 -6.720 1.00 33.31 H new ATOM 0 HG3 LYS A 217 -15.263 -4.371 -7.809 1.00 33.31 H new ATOM 0 HD2 LYS A 217 -15.731 -6.527 -8.789 1.00 21.23 H new ATOM 0 HD3 LYS A 217 -14.070 -6.560 -8.232 1.00 21.23 H new ATOM 0 HE2 LYS A 217 -14.679 -7.822 -6.235 1.00 11.23 H new ATOM 0 HE3 LYS A 217 -16.389 -7.603 -6.547 1.00 11.23 H new ATOM 0 HZ1 LYS A 217 -15.652 -9.783 -7.201 1.00 34.23 H new ATOM 0 HZ2 LYS A 217 -16.162 -8.906 -8.563 1.00 34.23 H new ATOM 0 HZ3 LYS A 217 -14.504 -9.119 -8.261 1.00 34.23 H new ATOM 747 N CYS A 218 -14.490 -4.185 -2.401 1.00 72.34 N ATOM 748 CA CYS A 218 -13.831 -4.281 -1.120 1.00 52.25 C ATOM 749 C CYS A 218 -14.851 -4.769 -0.075 1.00 53.24 C ATOM 750 O CYS A 218 -15.319 -3.979 0.746 1.00 3.44 O ATOM 751 CB CYS A 218 -13.264 -2.883 -0.883 1.00 41.44 C ATOM 752 SG CYS A 218 -11.937 -2.879 0.351 1.00 24.22 S ATOM 0 H CYS A 218 -15.191 -3.444 -2.424 1.00 72.34 H new ATOM 0 HA CYS A 218 -13.018 -5.004 -1.062 1.00 52.25 H new ATOM 0 HB2 CYS A 218 -12.884 -2.483 -1.823 1.00 41.44 H new ATOM 0 HB3 CYS A 218 -14.064 -2.220 -0.555 1.00 41.44 H new ATOM 0 HG CYS A 218 -10.785 -2.931 -0.250 1.00 24.22 H new ATOM 758 N PRO A 219 -15.261 -6.053 -0.106 1.00 2.24 N ATOM 759 CA PRO A 219 -16.377 -6.555 0.688 1.00 23.03 C ATOM 760 C PRO A 219 -15.985 -6.949 2.116 1.00 53.55 C ATOM 761 O PRO A 219 -16.844 -7.393 2.883 1.00 51.44 O ATOM 762 CB PRO A 219 -16.838 -7.790 -0.080 1.00 13.32 C ATOM 763 CG PRO A 219 -15.515 -8.391 -0.543 1.00 34.20 C ATOM 764 CD PRO A 219 -14.785 -7.123 -0.974 1.00 63.34 C ATOM 0 HA PRO A 219 -17.141 -5.787 0.811 1.00 23.03 H new ATOM 0 HB2 PRO A 219 -17.399 -8.478 0.553 1.00 13.32 H new ATOM 0 HB3 PRO A 219 -17.484 -7.531 -0.919 1.00 13.32 H new ATOM 0 HG2 PRO A 219 -14.995 -8.920 0.256 1.00 34.20 H new ATOM 0 HG3 PRO A 219 -15.643 -9.098 -1.363 1.00 34.20 H new ATOM 0 HD2 PRO A 219 -13.706 -7.246 -0.881 1.00 63.34 H new ATOM 0 HD3 PRO A 219 -14.991 -6.894 -2.020 1.00 63.34 H new ATOM 772 N PHE A 220 -14.695 -6.884 2.434 1.00 52.33 N ATOM 773 CA PHE A 220 -14.110 -7.306 3.687 1.00 13.33 C ATOM 774 C PHE A 220 -13.892 -6.060 4.550 1.00 31.11 C ATOM 775 O PHE A 220 -13.778 -4.956 4.003 1.00 61.21 O ATOM 776 CB PHE A 220 -12.792 -8.036 3.361 1.00 12.53 C ATOM 777 CG PHE A 220 -12.960 -9.230 2.432 1.00 53.04 C ATOM 778 CD1 PHE A 220 -13.926 -10.220 2.706 1.00 43.24 C ATOM 779 CD2 PHE A 220 -12.168 -9.346 1.272 1.00 11.32 C ATOM 780 CE1 PHE A 220 -14.100 -11.309 1.834 1.00 24.41 C ATOM 781 CE2 PHE A 220 -12.342 -10.439 0.403 1.00 35.04 C ATOM 782 CZ PHE A 220 -13.306 -11.422 0.682 1.00 24.35 C ATOM 0 H PHE A 220 -14.000 -6.515 1.785 1.00 52.33 H new ATOM 0 HA PHE A 220 -14.751 -7.990 4.244 1.00 13.33 H new ATOM 0 HB2 PHE A 220 -12.100 -7.328 2.905 1.00 12.53 H new ATOM 0 HB3 PHE A 220 -12.336 -8.374 4.291 1.00 12.53 H new ATOM 0 HD1 PHE A 220 -14.537 -10.141 3.593 1.00 43.24 H new ATOM 0 HD2 PHE A 220 -11.426 -8.594 1.049 1.00 11.32 H new ATOM 0 HE1 PHE A 220 -14.846 -12.060 2.051 1.00 24.41 H new ATOM 0 HE2 PHE A 220 -11.731 -10.523 -0.484 1.00 35.04 H new ATOM 0 HZ PHE A 220 -13.436 -12.260 0.014 1.00 24.35 H new ATOM 792 N PRO A 221 -13.810 -6.215 5.881 1.00 52.42 N ATOM 793 CA PRO A 221 -13.451 -5.119 6.764 1.00 64.02 C ATOM 794 C PRO A 221 -12.008 -4.679 6.499 1.00 52.52 C ATOM 795 O PRO A 221 -11.196 -5.414 5.921 1.00 61.24 O ATOM 796 CB PRO A 221 -13.638 -5.664 8.186 1.00 3.32 C ATOM 797 CG PRO A 221 -13.406 -7.165 8.017 1.00 31.34 C ATOM 798 CD PRO A 221 -13.994 -7.445 6.635 1.00 13.23 C ATOM 0 HA PRO A 221 -14.068 -4.234 6.607 1.00 64.02 H new ATOM 0 HB2 PRO A 221 -12.926 -5.222 8.883 1.00 3.32 H new ATOM 0 HB3 PRO A 221 -14.635 -5.451 8.571 1.00 3.32 H new ATOM 0 HG2 PRO A 221 -12.347 -7.418 8.065 1.00 31.34 H new ATOM 0 HG3 PRO A 221 -13.907 -7.742 8.794 1.00 31.34 H new ATOM 0 HD2 PRO A 221 -13.486 -8.281 6.154 1.00 13.23 H new ATOM 0 HD3 PRO A 221 -15.049 -7.710 6.703 1.00 13.23 H new ATOM 806 N ALA A 222 -11.685 -3.467 6.948 1.00 15.10 N ATOM 807 CA ALA A 222 -10.309 -3.037 7.078 1.00 33.50 C ATOM 808 C ALA A 222 -9.679 -3.825 8.220 1.00 45.31 C ATOM 809 O ALA A 222 -10.290 -3.961 9.279 1.00 5.14 O ATOM 810 CB ALA A 222 -10.257 -1.527 7.331 1.00 54.51 C ATOM 0 H ALA A 222 -12.371 -2.766 7.228 1.00 15.10 H new ATOM 0 HA ALA A 222 -9.750 -3.227 6.162 1.00 33.50 H new ATOM 0 HB1 ALA A 222 -9.219 -1.210 7.428 1.00 54.51 H new ATOM 0 HB2 ALA A 222 -10.720 -1.002 6.496 1.00 54.51 H new ATOM 0 HB3 ALA A 222 -10.795 -1.293 8.250 1.00 54.51 H new ATOM 816 N GLY A 223 -8.460 -4.312 8.004 1.00 72.54 N ATOM 817 CA GLY A 223 -7.685 -4.997 9.020 1.00 54.34 C ATOM 818 C GLY A 223 -8.173 -6.422 9.259 1.00 13.20 C ATOM 819 O GLY A 223 -8.357 -6.822 10.406 1.00 13.51 O ATOM 0 H GLY A 223 -7.982 -4.238 7.106 1.00 72.54 H new ATOM 0 HA2 GLY A 223 -6.637 -5.020 8.720 1.00 54.34 H new ATOM 0 HA3 GLY A 223 -7.738 -4.436 9.953 1.00 54.34 H new ATOM 823 N SER A 224 -8.384 -7.215 8.203 1.00 12.10 N ATOM 824 CA SER A 224 -8.502 -8.669 8.348 1.00 32.34 C ATOM 825 C SER A 224 -7.935 -9.386 7.120 1.00 62.33 C ATOM 826 O SER A 224 -7.975 -8.851 6.011 1.00 52.54 O ATOM 827 CB SER A 224 -9.960 -9.070 8.582 1.00 2.20 C ATOM 828 OG SER A 224 -10.539 -8.367 9.664 1.00 61.34 O ATOM 0 H SER A 224 -8.476 -6.877 7.245 1.00 12.10 H new ATOM 0 HA SER A 224 -7.919 -8.973 9.217 1.00 32.34 H new ATOM 0 HB2 SER A 224 -10.537 -8.880 7.677 1.00 2.20 H new ATOM 0 HB3 SER A 224 -10.014 -10.141 8.776 1.00 2.20 H new ATOM 0 HG SER A 224 -9.843 -7.868 10.140 1.00 61.34 H new ATOM 834 N ASP A 225 -7.463 -10.620 7.298 1.00 61.25 N ATOM 835 CA ASP A 225 -6.662 -11.399 6.347 1.00 53.22 C ATOM 836 C ASP A 225 -7.360 -11.649 5.017 1.00 11.51 C ATOM 837 O ASP A 225 -6.699 -11.832 3.992 1.00 20.21 O ATOM 838 CB ASP A 225 -6.309 -12.760 6.963 1.00 65.42 C ATOM 839 CG ASP A 225 -5.409 -12.585 8.182 1.00 1.12 C ATOM 840 OD1 ASP A 225 -5.957 -12.102 9.196 1.00 40.32 O ATOM 841 OD2 ASP A 225 -4.207 -12.911 8.058 1.00 54.24 O1- ATOM 0 H ASP A 225 -7.639 -11.135 8.161 1.00 61.25 H new ATOM 0 HA ASP A 225 -5.773 -10.802 6.145 1.00 53.22 H new ATOM 0 HB2 ASP A 225 -7.222 -13.282 7.251 1.00 65.42 H new ATOM 0 HB3 ASP A 225 -5.807 -13.381 6.221 1.00 65.42 H new ATOM 846 N LEU A 226 -8.694 -11.641 5.009 1.00 65.13 N ATOM 847 CA LEU A 226 -9.506 -11.749 3.799 1.00 13.44 C ATOM 848 C LEU A 226 -9.119 -10.643 2.813 1.00 72.23 C ATOM 849 O LEU A 226 -9.037 -10.871 1.602 1.00 44.25 O ATOM 850 CB LEU A 226 -10.997 -11.617 4.155 1.00 21.33 C ATOM 851 CG LEU A 226 -11.560 -12.709 5.085 1.00 42.04 C ATOM 852 CD1 LEU A 226 -12.940 -12.298 5.609 1.00 2.14 C ATOM 853 CD2 LEU A 226 -11.675 -14.054 4.368 1.00 31.03 C ATOM 0 H LEU A 226 -9.249 -11.558 5.860 1.00 65.13 H new ATOM 0 HA LEU A 226 -9.329 -12.722 3.341 1.00 13.44 H new ATOM 0 HB2 LEU A 226 -11.155 -10.647 4.626 1.00 21.33 H new ATOM 0 HB3 LEU A 226 -11.574 -11.620 3.230 1.00 21.33 H new ATOM 0 HG LEU A 226 -10.865 -12.819 5.917 1.00 42.04 H new ATOM 0 HD11 LEU A 226 -13.327 -13.078 6.265 1.00 2.14 H new ATOM 0 HD12 LEU A 226 -12.855 -11.365 6.166 1.00 2.14 H new ATOM 0 HD13 LEU A 226 -13.621 -12.159 4.770 1.00 2.14 H new ATOM 0 HD21 LEU A 226 -12.075 -14.799 5.055 1.00 31.03 H new ATOM 0 HD22 LEU A 226 -12.342 -13.954 3.512 1.00 31.03 H new ATOM 0 HD23 LEU A 226 -10.689 -14.369 4.025 1.00 31.03 H new ATOM 865 N ALA A 227 -8.855 -9.441 3.329 1.00 33.13 N ATOM 866 CA ALA A 227 -8.486 -8.299 2.524 1.00 31.51 C ATOM 867 C ALA A 227 -7.058 -8.421 1.982 1.00 61.32 C ATOM 868 O ALA A 227 -6.783 -7.894 0.905 1.00 1.22 O ATOM 869 CB ALA A 227 -8.619 -7.028 3.353 1.00 20.11 C ATOM 0 H ALA A 227 -8.895 -9.242 4.329 1.00 33.13 H new ATOM 0 HA ALA A 227 -9.160 -8.258 1.669 1.00 31.51 H new ATOM 0 HB1 ALA A 227 -8.341 -6.167 2.746 1.00 20.11 H new ATOM 0 HB2 ALA A 227 -9.651 -6.918 3.687 1.00 20.11 H new ATOM 0 HB3 ALA A 227 -7.961 -7.089 4.220 1.00 20.11 H new ATOM 875 N GLN A 228 -6.129 -9.085 2.680 1.00 2.11 N ATOM 876 CA GLN A 228 -4.744 -9.149 2.207 1.00 62.54 C ATOM 877 C GLN A 228 -4.647 -10.041 0.961 1.00 60.13 C ATOM 878 O GLN A 228 -3.908 -9.720 0.027 1.00 43.54 O ATOM 879 CB GLN A 228 -3.779 -9.510 3.348 1.00 74.33 C ATOM 880 CG GLN A 228 -3.413 -10.990 3.481 1.00 13.33 C ATOM 881 CD GLN A 228 -2.762 -11.280 4.831 1.00 64.54 C ATOM 882 OE1 GLN A 228 -1.853 -10.575 5.248 1.00 5.12 O ATOM 883 NE2 GLN A 228 -3.240 -12.301 5.523 1.00 5.01 N ATOM 0 H GLN A 228 -6.307 -9.576 3.556 1.00 2.11 H new ATOM 0 HA GLN A 228 -4.418 -8.161 1.882 1.00 62.54 H new ATOM 0 HB2 GLN A 228 -2.860 -8.941 3.212 1.00 74.33 H new ATOM 0 HB3 GLN A 228 -4.222 -9.181 4.288 1.00 74.33 H new ATOM 0 HG2 GLN A 228 -4.309 -11.600 3.368 1.00 13.33 H new ATOM 0 HG3 GLN A 228 -2.732 -11.272 2.678 1.00 13.33 H new ATOM 0 HE21 GLN A 228 -3.999 -12.865 5.141 1.00 5.01 H new ATOM 0 HE22 GLN A 228 -2.850 -12.524 6.439 1.00 5.01 H new ATOM 892 N LYS A 229 -5.452 -11.112 0.898 1.00 14.24 N ATOM 893 CA LYS A 229 -5.702 -11.856 -0.316 1.00 61.11 C ATOM 894 C LYS A 229 -6.383 -10.963 -1.347 1.00 50.14 C ATOM 895 O LYS A 229 -5.991 -11.014 -2.501 1.00 20.33 O ATOM 896 CB LYS A 229 -6.533 -13.103 0.018 1.00 43.15 C ATOM 897 CG LYS A 229 -6.872 -13.862 -1.266 1.00 65.30 C ATOM 898 CD LYS A 229 -7.615 -15.181 -1.017 1.00 2.11 C ATOM 899 CE LYS A 229 -8.502 -15.572 -2.207 1.00 22.04 C ATOM 900 NZ LYS A 229 -7.745 -16.157 -3.331 1.00 4.21 N1+ ATOM 0 H LYS A 229 -5.949 -11.480 1.709 1.00 14.24 H new ATOM 0 HA LYS A 229 -4.762 -12.189 -0.756 1.00 61.11 H new ATOM 0 HB2 LYS A 229 -5.977 -13.750 0.697 1.00 43.15 H new ATOM 0 HB3 LYS A 229 -7.449 -12.813 0.532 1.00 43.15 H new ATOM 0 HG2 LYS A 229 -7.483 -13.225 -1.905 1.00 65.30 H new ATOM 0 HG3 LYS A 229 -5.951 -14.070 -1.810 1.00 65.30 H new ATOM 0 HD2 LYS A 229 -6.892 -15.974 -0.827 1.00 2.11 H new ATOM 0 HD3 LYS A 229 -8.229 -15.088 -0.121 1.00 2.11 H new ATOM 0 HE2 LYS A 229 -9.253 -16.288 -1.872 1.00 22.04 H new ATOM 0 HE3 LYS A 229 -9.037 -14.690 -2.558 1.00 22.04 H new ATOM 0 HZ1 LYS A 229 -8.400 -16.399 -4.102 1.00 4.21 H new ATOM 0 HZ2 LYS A 229 -7.046 -15.468 -3.675 1.00 4.21 H new ATOM 0 HZ3 LYS A 229 -7.255 -17.016 -3.010 1.00 4.21 H new ATOM 914 N TRP A 230 -7.376 -10.140 -0.994 1.00 13.20 N ATOM 915 CA TRP A 230 -8.016 -9.269 -1.987 1.00 72.33 C ATOM 916 C TRP A 230 -7.000 -8.370 -2.716 1.00 31.00 C ATOM 917 O TRP A 230 -7.055 -8.270 -3.943 1.00 23.12 O ATOM 918 CB TRP A 230 -9.153 -8.464 -1.358 1.00 34.15 C ATOM 919 CG TRP A 230 -9.679 -7.358 -2.209 1.00 61.20 C ATOM 920 CD1 TRP A 230 -10.550 -7.492 -3.231 1.00 14.12 C ATOM 921 CD2 TRP A 230 -9.343 -5.939 -2.147 1.00 53.24 C ATOM 922 NE1 TRP A 230 -10.789 -6.252 -3.785 1.00 24.03 N ATOM 923 CE2 TRP A 230 -10.112 -5.251 -3.126 1.00 13.24 C ATOM 924 CE3 TRP A 230 -8.479 -5.163 -1.348 1.00 35.03 C ATOM 925 CZ2 TRP A 230 -10.086 -3.855 -3.254 1.00 2.33 C ATOM 926 CZ3 TRP A 230 -8.397 -3.766 -1.506 1.00 33.44 C ATOM 927 CH2 TRP A 230 -9.215 -3.108 -2.444 1.00 4.35 C ATOM 0 H TRP A 230 -7.749 -10.058 -0.048 1.00 13.20 H new ATOM 0 HA TRP A 230 -8.453 -9.912 -2.751 1.00 72.33 H new ATOM 0 HB2 TRP A 230 -9.972 -9.143 -1.121 1.00 34.15 H new ATOM 0 HB3 TRP A 230 -8.804 -8.044 -0.415 1.00 34.15 H new ATOM 0 HD1 TRP A 230 -10.989 -8.421 -3.562 1.00 14.12 H new ATOM 0 HE1 TRP A 230 -11.396 -6.095 -4.589 1.00 24.03 H new ATOM 0 HE3 TRP A 230 -7.869 -5.649 -0.601 1.00 35.03 H new ATOM 0 HZ2 TRP A 230 -10.728 -3.360 -3.967 1.00 2.33 H new ATOM 0 HZ3 TRP A 230 -7.703 -3.197 -0.905 1.00 33.44 H new ATOM 0 HH2 TRP A 230 -9.173 -2.033 -2.540 1.00 4.35 H new ATOM 938 N HIS A 231 -6.034 -7.787 -1.992 1.00 41.52 N ATOM 939 CA HIS A 231 -4.956 -6.979 -2.572 1.00 44.11 C ATOM 940 C HIS A 231 -4.113 -7.767 -3.592 1.00 62.42 C ATOM 941 O HIS A 231 -3.432 -7.154 -4.409 1.00 2.10 O ATOM 942 CB HIS A 231 -4.027 -6.432 -1.469 1.00 73.30 C ATOM 943 CG HIS A 231 -4.597 -5.337 -0.597 1.00 1.23 C ATOM 944 ND1 HIS A 231 -5.457 -5.493 0.467 1.00 54.43 N ATOM 945 CD2 HIS A 231 -4.251 -4.014 -0.646 1.00 54.44 C ATOM 946 CE1 HIS A 231 -5.650 -4.287 1.026 1.00 44.02 C ATOM 947 NE2 HIS A 231 -4.943 -3.350 0.374 1.00 72.12 N ATOM 0 H HIS A 231 -5.980 -7.865 -0.976 1.00 41.52 H new ATOM 0 HA HIS A 231 -5.440 -6.154 -3.095 1.00 44.11 H new ATOM 0 HB2 HIS A 231 -3.732 -7.262 -0.827 1.00 73.30 H new ATOM 0 HB3 HIS A 231 -3.119 -6.056 -1.941 1.00 73.30 H new ATOM 0 HD1 HIS A 231 -5.874 -6.371 0.776 1.00 54.43 H new ATOM 0 HD2 HIS A 231 -3.565 -3.562 -1.347 1.00 54.44 H new ATOM 0 HE1 HIS A 231 -6.284 -4.098 1.879 1.00 44.02 H new ATOM 955 N LEU A 232 -4.140 -9.104 -3.564 1.00 43.21 N ATOM 956 CA LEU A 232 -3.418 -9.972 -4.486 1.00 54.14 C ATOM 957 C LEU A 232 -3.994 -9.812 -5.893 1.00 63.01 C ATOM 958 O LEU A 232 -3.244 -9.505 -6.820 1.00 33.14 O ATOM 959 CB LEU A 232 -3.477 -11.424 -3.981 1.00 63.34 C ATOM 960 CG LEU A 232 -2.368 -12.365 -4.475 1.00 62.14 C ATOM 961 CD1 LEU A 232 -2.342 -13.592 -3.559 1.00 23.25 C ATOM 962 CD2 LEU A 232 -2.558 -12.816 -5.926 1.00 64.32 C ATOM 0 H LEU A 232 -4.684 -9.623 -2.875 1.00 43.21 H new ATOM 0 HA LEU A 232 -2.366 -9.690 -4.533 1.00 54.14 H new ATOM 0 HB2 LEU A 232 -3.451 -11.408 -2.891 1.00 63.34 H new ATOM 0 HB3 LEU A 232 -4.439 -11.848 -4.271 1.00 63.34 H new ATOM 0 HG LEU A 232 -1.427 -11.816 -4.443 1.00 62.14 H new ATOM 0 HD11 LEU A 232 -1.561 -14.277 -3.890 1.00 23.25 H new ATOM 0 HD12 LEU A 232 -2.139 -13.278 -2.535 1.00 23.25 H new ATOM 0 HD13 LEU A 232 -3.307 -14.096 -3.599 1.00 23.25 H new ATOM 0 HD21 LEU A 232 -1.741 -13.478 -6.211 1.00 64.32 H new ATOM 0 HD22 LEU A 232 -3.505 -13.347 -6.021 1.00 64.32 H new ATOM 0 HD23 LEU A 232 -2.564 -11.944 -6.580 1.00 64.32 H new ATOM 974 N ILE A 233 -5.314 -9.991 -6.042 1.00 20.31 N ATOM 975 CA ILE A 233 -6.025 -9.801 -7.307 1.00 12.23 C ATOM 976 C ILE A 233 -6.014 -8.312 -7.683 1.00 33.40 C ATOM 977 O ILE A 233 -5.840 -7.959 -8.848 1.00 73.01 O ATOM 978 CB ILE A 233 -7.492 -10.313 -7.253 1.00 31.24 C ATOM 979 CG1 ILE A 233 -7.716 -11.721 -6.661 1.00 41.21 C ATOM 980 CG2 ILE A 233 -8.039 -10.369 -8.689 1.00 11.11 C ATOM 981 CD1 ILE A 233 -7.790 -11.782 -5.138 1.00 1.50 C ATOM 0 H ILE A 233 -5.923 -10.276 -5.275 1.00 20.31 H new ATOM 0 HA ILE A 233 -5.505 -10.390 -8.062 1.00 12.23 H new ATOM 0 HB ILE A 233 -7.995 -9.610 -6.589 1.00 31.24 H new ATOM 0 HG12 ILE A 233 -8.641 -12.127 -7.070 1.00 41.21 H new ATOM 0 HG13 ILE A 233 -6.908 -12.371 -6.996 1.00 41.21 H new ATOM 0 HG21 ILE A 233 -9.069 -10.726 -8.672 1.00 11.11 H new ATOM 0 HG22 ILE A 233 -8.008 -9.372 -9.129 1.00 11.11 H new ATOM 0 HG23 ILE A 233 -7.429 -11.048 -9.285 1.00 11.11 H new ATOM 0 HD11 ILE A 233 -7.949 -12.813 -4.822 1.00 1.50 H new ATOM 0 HD12 ILE A 233 -6.857 -11.412 -4.713 1.00 1.50 H new ATOM 0 HD13 ILE A 233 -8.617 -11.164 -4.789 1.00 1.50 H new ATOM 993 N LYS A 234 -6.214 -7.425 -6.704 1.00 35.12 N ATOM 994 CA LYS A 234 -6.339 -5.986 -6.854 1.00 65.43 C ATOM 995 C LYS A 234 -7.549 -5.591 -7.710 1.00 71.04 C ATOM 996 O LYS A 234 -8.597 -5.242 -7.171 1.00 11.24 O ATOM 997 CB LYS A 234 -4.989 -5.383 -7.292 1.00 41.01 C ATOM 998 CG LYS A 234 -4.957 -3.853 -7.140 1.00 40.11 C ATOM 999 CD LYS A 234 -4.205 -3.156 -8.284 1.00 52.01 C ATOM 1000 CE LYS A 234 -2.723 -3.523 -8.244 1.00 24.13 C ATOM 1001 NZ LYS A 234 -1.980 -2.716 -7.252 1.00 64.53 N1+ ATOM 0 H LYS A 234 -6.297 -7.717 -5.730 1.00 35.12 H new ATOM 0 HA LYS A 234 -6.565 -5.538 -5.887 1.00 65.43 H new ATOM 0 HB2 LYS A 234 -4.188 -5.822 -6.698 1.00 41.01 H new ATOM 0 HB3 LYS A 234 -4.796 -5.647 -8.332 1.00 41.01 H new ATOM 0 HG2 LYS A 234 -5.979 -3.475 -7.100 1.00 40.11 H new ATOM 0 HG3 LYS A 234 -4.485 -3.597 -6.192 1.00 40.11 H new ATOM 0 HD2 LYS A 234 -4.634 -3.449 -9.242 1.00 52.01 H new ATOM 0 HD3 LYS A 234 -4.322 -2.076 -8.200 1.00 52.01 H new ATOM 0 HE2 LYS A 234 -2.618 -4.581 -8.003 1.00 24.13 H new ATOM 0 HE3 LYS A 234 -2.286 -3.376 -9.232 1.00 24.13 H new ATOM 0 HZ1 LYS A 234 -0.978 -2.996 -7.257 1.00 64.53 H new ATOM 0 HZ2 LYS A 234 -2.059 -1.708 -7.496 1.00 64.53 H new ATOM 0 HZ3 LYS A 234 -2.380 -2.876 -6.305 1.00 64.53 H new ATOM 1015 N GLN A 235 -7.445 -5.650 -9.033 1.00 72.02 N ATOM 1016 CA GLN A 235 -8.401 -5.120 -10.002 1.00 11.35 C ATOM 1017 C GLN A 235 -8.804 -6.228 -10.983 1.00 33.24 C ATOM 1018 O GLN A 235 -8.600 -7.407 -10.696 1.00 30.21 O ATOM 1019 CB GLN A 235 -7.769 -3.906 -10.705 1.00 22.32 C ATOM 1020 CG GLN A 235 -7.708 -2.649 -9.840 1.00 50.13 C ATOM 1021 CD GLN A 235 -7.036 -1.517 -10.596 1.00 24.00 C ATOM 1022 OE1 GLN A 235 -6.056 -0.940 -10.132 1.00 23.03 O ATOM 1023 NE2 GLN A 235 -7.520 -1.185 -11.781 1.00 43.20 N ATOM 0 H GLN A 235 -6.646 -6.094 -9.485 1.00 72.02 H new ATOM 0 HA GLN A 235 -9.313 -4.783 -9.510 1.00 11.35 H new ATOM 0 HB2 GLN A 235 -6.759 -4.167 -11.020 1.00 22.32 H new ATOM 0 HB3 GLN A 235 -8.338 -3.686 -11.608 1.00 22.32 H new ATOM 0 HG2 GLN A 235 -8.715 -2.352 -9.548 1.00 50.13 H new ATOM 0 HG3 GLN A 235 -7.159 -2.858 -8.922 1.00 50.13 H new ATOM 0 HE21 GLN A 235 -8.334 -1.673 -12.154 1.00 43.20 H new ATOM 0 HE22 GLN A 235 -7.079 -0.441 -12.322 1.00 43.20 H new ATOM 1032 N HIS A 236 -9.412 -5.875 -12.120 1.00 22.23 N ATOM 1033 CA HIS A 236 -9.601 -6.787 -13.247 1.00 73.33 C ATOM 1034 C HIS A 236 -8.271 -7.236 -13.893 1.00 63.54 C ATOM 1035 O HIS A 236 -8.275 -8.132 -14.742 1.00 34.42 O ATOM 1036 CB HIS A 236 -10.491 -6.108 -14.305 1.00 2.44 C ATOM 1037 CG HIS A 236 -11.141 -7.117 -15.215 1.00 4.45 C ATOM 1038 ND1 HIS A 236 -12.269 -7.833 -14.904 1.00 31.54 N ATOM 1039 CD2 HIS A 236 -10.671 -7.584 -16.415 1.00 72.22 C ATOM 1040 CE1 HIS A 236 -12.470 -8.732 -15.875 1.00 31.30 C ATOM 1041 NE2 HIS A 236 -11.518 -8.625 -16.819 1.00 63.23 N ATOM 0 H HIS A 236 -9.789 -4.941 -12.283 1.00 22.23 H new ATOM 0 HA HIS A 236 -10.080 -7.686 -12.859 1.00 73.33 H new ATOM 0 HB2 HIS A 236 -11.260 -5.517 -13.808 1.00 2.44 H new ATOM 0 HB3 HIS A 236 -9.891 -5.417 -14.897 1.00 2.44 H new ATOM 0 HD2 HIS A 236 -9.808 -7.217 -16.950 1.00 72.22 H new ATOM 0 HE1 HIS A 236 -13.282 -9.443 -15.897 1.00 31.30 H new ATOM 0 HE2 HIS A 236 -11.430 -9.191 -17.663 1.00 63.23 H new ATOM 1049 N THR A 237 -7.143 -6.608 -13.553 1.00 74.12 N ATOM 1050 CA THR A 237 -5.837 -6.912 -14.113 1.00 64.12 C ATOM 1051 C THR A 237 -4.772 -6.590 -13.060 1.00 22.14 C ATOM 1052 O THR A 237 -4.901 -5.597 -12.329 1.00 63.42 O ATOM 1053 CB THR A 237 -5.664 -6.150 -15.444 1.00 1.11 C ATOM 1054 OG1 THR A 237 -4.365 -6.344 -15.938 1.00 61.40 O ATOM 1055 CG2 THR A 237 -5.915 -4.638 -15.372 1.00 50.03 C ATOM 0 H THR A 237 -7.119 -5.857 -12.863 1.00 74.12 H new ATOM 0 HA THR A 237 -5.731 -7.969 -14.357 1.00 64.12 H new ATOM 0 HB THR A 237 -6.429 -6.566 -16.100 1.00 1.11 H new ATOM 0 HG1 THR A 237 -4.261 -5.860 -16.784 1.00 61.40 H new ATOM 0 HG21 THR A 237 -5.768 -4.197 -16.358 1.00 50.03 H new ATOM 0 HG22 THR A 237 -6.937 -4.454 -15.042 1.00 50.03 H new ATOM 0 HG23 THR A 237 -5.219 -4.187 -14.665 1.00 50.03 H new ATOM 1063 N ALA A 238 -3.737 -7.429 -12.970 1.00 64.25 N ATOM 1064 CA ALA A 238 -2.634 -7.348 -12.021 1.00 34.41 C ATOM 1065 C ALA A 238 -1.437 -8.152 -12.568 1.00 70.53 C ATOM 1066 O ALA A 238 -1.614 -8.944 -13.498 1.00 41.40 O ATOM 1067 CB ALA A 238 -3.114 -7.912 -10.675 1.00 14.52 C ATOM 0 H ALA A 238 -3.645 -8.229 -13.597 1.00 64.25 H new ATOM 0 HA ALA A 238 -2.313 -6.316 -11.879 1.00 34.41 H new ATOM 0 HB1 ALA A 238 -2.303 -7.861 -9.949 1.00 14.52 H new ATOM 0 HB2 ALA A 238 -3.960 -7.326 -10.316 1.00 14.52 H new ATOM 0 HB3 ALA A 238 -3.421 -8.950 -10.804 1.00 14.52 H new ATOM 1073 N PRO A 239 -0.220 -7.988 -12.022 1.00 61.40 N ATOM 1074 CA PRO A 239 0.919 -8.846 -12.338 1.00 14.44 C ATOM 1075 C PRO A 239 0.740 -10.237 -11.703 1.00 74.14 C ATOM 1076 O PRO A 239 1.162 -10.452 -10.566 1.00 42.52 O ATOM 1077 CB PRO A 239 2.136 -8.090 -11.791 1.00 51.21 C ATOM 1078 CG PRO A 239 1.575 -7.303 -10.606 1.00 20.31 C ATOM 1079 CD PRO A 239 0.174 -6.937 -11.087 1.00 1.53 C ATOM 0 HA PRO A 239 1.030 -9.038 -13.405 1.00 14.44 H new ATOM 0 HB2 PRO A 239 2.925 -8.774 -11.479 1.00 51.21 H new ATOM 0 HB3 PRO A 239 2.567 -7.428 -12.543 1.00 51.21 H new ATOM 0 HG2 PRO A 239 1.548 -7.903 -9.696 1.00 20.31 H new ATOM 0 HG3 PRO A 239 2.173 -6.418 -10.387 1.00 20.31 H new ATOM 0 HD2 PRO A 239 -0.522 -6.878 -10.251 1.00 1.53 H new ATOM 0 HD3 PRO A 239 0.171 -5.961 -11.573 1.00 1.53 H new ATOM 1087 N VAL A 240 0.105 -11.187 -12.398 1.00 55.30 N ATOM 1088 CA VAL A 240 -0.254 -12.497 -11.840 1.00 73.31 C ATOM 1089 C VAL A 240 0.027 -13.666 -12.803 1.00 73.24 C ATOM 1090 O VAL A 240 -0.506 -14.755 -12.595 1.00 4.41 O ATOM 1091 CB VAL A 240 -1.704 -12.487 -11.293 1.00 1.54 C ATOM 1092 CG1 VAL A 240 -1.877 -11.483 -10.141 1.00 2.11 C ATOM 1093 CG2 VAL A 240 -2.755 -12.201 -12.374 1.00 62.34 C ATOM 0 H VAL A 240 -0.177 -11.068 -13.371 1.00 55.30 H new ATOM 0 HA VAL A 240 0.407 -12.678 -10.993 1.00 73.31 H new ATOM 0 HB VAL A 240 -1.872 -13.497 -10.919 1.00 1.54 H new ATOM 0 HG11 VAL A 240 -2.908 -11.509 -9.788 1.00 2.11 H new ATOM 0 HG12 VAL A 240 -1.207 -11.748 -9.324 1.00 2.11 H new ATOM 0 HG13 VAL A 240 -1.639 -10.480 -10.494 1.00 2.11 H new ATOM 0 HG21 VAL A 240 -3.749 -12.208 -11.926 1.00 62.34 H new ATOM 0 HG22 VAL A 240 -2.564 -11.224 -12.818 1.00 62.34 H new ATOM 0 HG23 VAL A 240 -2.700 -12.968 -13.147 1.00 62.34 H new ATOM 1103 N SER A 241 0.878 -13.447 -13.815 1.00 23.54 N ATOM 1104 CA SER A 241 1.082 -14.262 -15.024 1.00 33.20 C ATOM 1105 C SER A 241 -0.072 -14.081 -16.027 1.00 22.33 C ATOM 1106 O SER A 241 -1.182 -13.729 -15.625 1.00 4.10 O ATOM 1107 CB SER A 241 1.278 -15.755 -14.709 1.00 73.01 C ATOM 1108 OG SER A 241 2.475 -15.976 -13.988 1.00 42.03 O ATOM 0 H SER A 241 1.491 -12.631 -13.810 1.00 23.54 H new ATOM 0 HA SER A 241 2.004 -13.899 -15.478 1.00 33.20 H new ATOM 0 HB2 SER A 241 0.430 -16.121 -14.131 1.00 73.01 H new ATOM 0 HB3 SER A 241 1.300 -16.325 -15.638 1.00 73.01 H new ATOM 0 HG SER A 241 2.572 -16.933 -13.801 1.00 42.03 H new ATOM 1114 N PRO A 242 0.159 -14.344 -17.332 1.00 54.33 N ATOM 1115 CA PRO A 242 -0.908 -14.385 -18.327 1.00 33.53 C ATOM 1116 C PRO A 242 -1.886 -15.512 -18.006 1.00 62.22 C ATOM 1117 O PRO A 242 -1.504 -16.539 -17.439 1.00 3.45 O ATOM 1118 CB PRO A 242 -0.218 -14.599 -19.678 1.00 40.15 C ATOM 1119 CG PRO A 242 1.058 -15.335 -19.290 1.00 23.42 C ATOM 1120 CD PRO A 242 1.427 -14.687 -17.960 1.00 33.01 C ATOM 0 HA PRO A 242 -1.493 -13.465 -18.338 1.00 33.53 H new ATOM 0 HB2 PRO A 242 -0.834 -15.187 -20.358 1.00 40.15 H new ATOM 0 HB3 PRO A 242 -0.004 -13.654 -20.178 1.00 40.15 H new ATOM 0 HG2 PRO A 242 0.891 -16.407 -19.186 1.00 23.42 H new ATOM 0 HG3 PRO A 242 1.843 -15.205 -20.035 1.00 23.42 H new ATOM 0 HD2 PRO A 242 2.002 -15.371 -17.336 1.00 33.01 H new ATOM 0 HD3 PRO A 242 2.043 -13.800 -18.112 1.00 33.01 H new ATOM 1128 N HIS A 243 -3.144 -15.342 -18.406 1.00 45.13 N ATOM 1129 CA HIS A 243 -4.230 -16.222 -18.014 1.00 20.32 C ATOM 1130 C HIS A 243 -4.894 -16.719 -19.296 1.00 25.15 C ATOM 1131 O HIS A 243 -4.500 -17.760 -19.827 1.00 54.22 O ATOM 1132 CB HIS A 243 -5.143 -15.453 -17.044 1.00 51.05 C ATOM 1133 CG HIS A 243 -6.297 -16.266 -16.532 1.00 23.30 C ATOM 1134 ND1 HIS A 243 -6.287 -17.135 -15.464 1.00 43.14 N ATOM 1135 CD2 HIS A 243 -7.567 -16.227 -17.028 1.00 22.02 C ATOM 1136 CE1 HIS A 243 -7.525 -17.640 -15.335 1.00 63.04 C ATOM 1137 NE2 HIS A 243 -8.341 -17.114 -16.273 1.00 1.40 N ATOM 0 H HIS A 243 -3.436 -14.580 -19.018 1.00 45.13 H new ATOM 0 HA HIS A 243 -3.911 -17.110 -17.469 1.00 20.32 H new ATOM 0 HB2 HIS A 243 -4.550 -15.106 -16.198 1.00 51.05 H new ATOM 0 HB3 HIS A 243 -5.529 -14.566 -17.547 1.00 51.05 H new ATOM 0 HD2 HIS A 243 -7.912 -15.622 -17.853 1.00 22.02 H new ATOM 0 HE1 HIS A 243 -7.824 -18.362 -14.589 1.00 63.04 H new ATOM 0 HE2 HIS A 243 -9.331 -17.323 -16.405 1.00 1.40 H new ATOM 1145 N SER A 244 -5.829 -15.938 -19.823 1.00 53.22 N ATOM 1146 CA SER A 244 -6.109 -15.797 -21.240 1.00 22.22 C ATOM 1147 C SER A 244 -5.649 -14.391 -21.593 1.00 53.24 C ATOM 1148 O SER A 244 -5.325 -13.630 -20.655 1.00 34.02 O ATOM 1149 CB SER A 244 -7.604 -15.950 -21.523 1.00 24.31 C ATOM 1150 OG SER A 244 -8.043 -17.262 -21.213 1.00 51.22 O ATOM 0 H SER A 244 -6.439 -15.361 -19.244 1.00 53.22 H new ATOM 0 HA SER A 244 -5.602 -16.562 -21.828 1.00 22.22 H new ATOM 0 HB2 SER A 244 -8.166 -15.225 -20.935 1.00 24.31 H new ATOM 0 HB3 SER A 244 -7.804 -15.733 -22.572 1.00 24.31 H new ATOM 0 HG SER A 244 -9.002 -17.339 -21.399 1.00 51.22 H new TER 1156 SER A 244