USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=22 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 231 HIS : no HE2:sc= 0.772 K(o=1.6,f=-5.3) USER MOD Set 1.2: A 234 LYS NZ :NH3+ 144:sc= 0.875 (180deg=-0.126) USER MOD Set 2.1: A 229 LYS NZ :NH3+ -159:sc= -0.0702 (180deg=-0.805) USER MOD Set 2.2: A 244 SER OG : rot 180:sc= 0.343 USER MOD Set 3.1: A 214 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 235 GLN : amide:sc= -0.2 K(o=-0.2,f=-0.87) USER MOD Set 4.1: A 203 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 204 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 176 SER OG : rot 180:sc= 0.0611 USER MOD Single : A 179 GLN : amide:sc= 0.277 K(o=0.28,f=-3.5!) USER MOD Single : A 182 GLN : amide:sc= -0.03 K(o=-0.03,f=-3.2!) USER MOD Single : A 184 THR OG1 : rot -34:sc= 0.335 USER MOD Single : A 188 CYS SG : rot 180:sc= 0 USER MOD Single : A 191 MET CE :methyl -172:sc=-0.00834 (180deg=-0.116) 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 USER MOD Single : A 196 LYS NZ :NH3+ -94:sc= 1.23 (180deg=-0.578) USER MOD Single : A 197 GLN : amide:sc= -0.0732 X(o=-0.073,f=0) USER MOD Single : A 198 SER OG : rot 180:sc= -0.0562 USER MOD Single : A 199 LYS NZ :NH3+ 165:sc= -0.0023 (180deg=-0.0784) USER MOD Single : A 205 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 207 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 209 HIS : no HE2:sc= -0.0656 K(o=-0.066,f=-3.2!) USER MOD Single : A 211 SER OG : rot 45:sc= 0.61 USER MOD Single : A 217 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 218 CYS SG : rot 180:sc= 0 USER MOD Single : A 224 SER OG : rot -160:sc= 0 USER MOD Single : A 228 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 236 HIS : no HE2:sc= 0.0902 K(o=0.09,f=-0.87) USER MOD Single : A 237 THR OG1 : rot 180:sc= 0 USER MOD Single : A 241 SER OG : rot 180:sc= 0.0594 USER MOD Single : A 243 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 175 -66.427 -68.036 1.665 1.00 44.44 N ATOM 2 CA ARG A 175 -65.820 -66.713 1.888 1.00 25.31 C ATOM 3 C ARG A 175 -66.162 -65.683 0.806 1.00 23.33 C ATOM 4 O ARG A 175 -66.371 -64.526 1.150 1.00 72.25 O ATOM 5 CB ARG A 175 -64.291 -66.837 2.063 1.00 63.20 C ATOM 6 CG ARG A 175 -63.626 -65.490 2.411 1.00 35.43 C ATOM 7 CD ARG A 175 -62.122 -65.631 2.676 1.00 51.31 C ATOM 8 NE ARG A 175 -61.491 -64.305 2.823 1.00 63.41 N ATOM 9 CZ ARG A 175 -60.532 -63.948 3.692 1.00 22.04 C ATOM 10 NH1 ARG A 175 -59.998 -64.838 4.531 1.00 63.22 N1+ ATOM 11 NH2 ARG A 175 -60.106 -62.688 3.717 1.00 52.51 N ATOM 0 HA ARG A 175 -66.260 -66.333 2.810 1.00 25.31 H new ATOM 0 HB2 ARG A 175 -64.076 -67.559 2.851 1.00 63.20 H new ATOM 0 HB3 ARG A 175 -63.854 -67.228 1.144 1.00 63.20 H new ATOM 0 HG2 ARG A 175 -63.784 -64.788 1.592 1.00 35.43 H new ATOM 0 HG3 ARG A 175 -64.109 -65.066 3.291 1.00 35.43 H new ATOM 0 HD2 ARG A 175 -61.961 -66.218 3.580 1.00 51.31 H new ATOM 0 HD3 ARG A 175 -61.653 -66.174 1.855 1.00 51.31 H new ATOM 0 HE ARG A 175 -61.822 -63.576 2.191 1.00 63.41 H new ATOM 0 HH11 ARG A 175 -60.318 -65.807 4.518 1.00 63.22 H new ATOM 0 HH12 ARG A 175 -59.270 -64.550 5.185 1.00 63.22 H new ATOM 0 HH21 ARG A 175 -60.508 -62.001 3.079 1.00 52.51 H new ATOM 0 HH22 ARG A 175 -59.378 -62.409 4.374 1.00 52.51 H new ATOM 25 N SER A 176 -66.220 -66.086 -0.469 1.00 54.30 N ATOM 26 CA SER A 176 -66.257 -65.137 -1.579 1.00 40.15 C ATOM 27 C SER A 176 -65.013 -64.229 -1.523 1.00 12.11 C ATOM 28 O SER A 176 -63.968 -64.651 -1.025 1.00 40.04 O ATOM 29 CB SER A 176 -67.619 -64.407 -1.589 1.00 24.33 C ATOM 30 OG SER A 176 -67.855 -63.825 -2.857 1.00 71.11 O ATOM 0 H SER A 176 -66.242 -67.065 -0.754 1.00 54.30 H new ATOM 0 HA SER A 176 -66.197 -65.640 -2.544 1.00 40.15 H new ATOM 0 HB2 SER A 176 -68.417 -65.109 -1.349 1.00 24.33 H new ATOM 0 HB3 SER A 176 -67.631 -63.635 -0.819 1.00 24.33 H new ATOM 0 HG SER A 176 -68.721 -63.367 -2.851 1.00 71.11 H new ATOM 36 N LEU A 177 -65.137 -63.037 -2.113 1.00 42.40 N ATOM 37 CA LEU A 177 -64.444 -61.789 -1.809 1.00 14.14 C ATOM 38 C LEU A 177 -62.932 -61.908 -1.579 1.00 25.25 C ATOM 39 O LEU A 177 -62.441 -62.252 -0.501 1.00 72.32 O ATOM 40 CB LEU A 177 -65.164 -61.094 -0.645 1.00 62.05 C ATOM 41 CG LEU A 177 -65.160 -59.550 -0.664 1.00 74.24 C ATOM 42 CD1 LEU A 177 -63.764 -58.929 -0.802 1.00 32.31 C ATOM 43 CD2 LEU A 177 -66.072 -59.004 -1.772 1.00 21.13 C ATOM 0 H LEU A 177 -65.788 -62.913 -2.889 1.00 42.40 H new ATOM 0 HA LEU A 177 -64.498 -61.173 -2.707 1.00 14.14 H new ATOM 0 HB2 LEU A 177 -66.200 -61.434 -0.631 1.00 62.05 H new ATOM 0 HB3 LEU A 177 -64.707 -61.426 0.287 1.00 62.05 H new ATOM 0 HG LEU A 177 -65.543 -59.257 0.313 1.00 74.24 H new ATOM 0 HD11 LEU A 177 -63.848 -57.842 -0.807 1.00 32.31 H new ATOM 0 HD12 LEU A 177 -63.142 -59.241 0.037 1.00 32.31 H new ATOM 0 HD13 LEU A 177 -63.308 -59.262 -1.734 1.00 32.31 H new ATOM 0 HD21 LEU A 177 -66.048 -57.914 -1.759 1.00 21.13 H new ATOM 0 HD22 LEU A 177 -65.724 -59.364 -2.740 1.00 21.13 H new ATOM 0 HD23 LEU A 177 -67.093 -59.346 -1.604 1.00 21.13 H new ATOM 55 N ARG A 178 -62.189 -61.540 -2.620 1.00 24.30 N ATOM 56 CA ARG A 178 -60.741 -61.368 -2.609 1.00 3.45 C ATOM 57 C ARG A 178 -60.393 -60.199 -3.527 1.00 25.42 C ATOM 58 O ARG A 178 -61.056 -60.027 -4.551 1.00 34.30 O ATOM 59 CB ARG A 178 -60.062 -62.674 -3.079 1.00 73.44 C ATOM 60 CG ARG A 178 -60.200 -62.918 -4.596 1.00 23.23 C ATOM 61 CD ARG A 178 -59.791 -64.329 -5.040 1.00 61.32 C ATOM 62 NE ARG A 178 -60.949 -65.232 -5.203 1.00 43.12 N ATOM 63 CZ ARG A 178 -61.806 -65.241 -6.238 1.00 4.41 C ATOM 64 NH1 ARG A 178 -61.736 -64.309 -7.190 1.00 33.23 N1+ ATOM 65 NH2 ARG A 178 -62.739 -66.187 -6.319 1.00 63.23 N ATOM 0 H ARG A 178 -62.599 -61.345 -3.533 1.00 24.30 H new ATOM 0 HA ARG A 178 -60.382 -61.151 -1.603 1.00 3.45 H new ATOM 0 HB2 ARG A 178 -59.004 -62.641 -2.818 1.00 73.44 H new ATOM 0 HB3 ARG A 178 -60.497 -63.516 -2.541 1.00 73.44 H new ATOM 0 HG2 ARG A 178 -61.235 -62.741 -4.890 1.00 23.23 H new ATOM 0 HG3 ARG A 178 -59.589 -62.189 -5.128 1.00 23.23 H new ATOM 0 HD2 ARG A 178 -59.249 -64.266 -5.983 1.00 61.32 H new ATOM 0 HD3 ARG A 178 -59.105 -64.752 -4.306 1.00 61.32 H new ATOM 0 HE ARG A 178 -61.113 -65.912 -4.461 1.00 43.12 H new ATOM 0 HH11 ARG A 178 -61.026 -63.579 -7.137 1.00 33.23 H new ATOM 0 HH12 ARG A 178 -62.392 -64.327 -7.971 1.00 33.23 H new ATOM 0 HH21 ARG A 178 -62.803 -66.904 -5.596 1.00 63.23 H new ATOM 0 HH22 ARG A 178 -63.390 -66.195 -7.104 1.00 63.23 H new ATOM 79 N GLN A 179 -59.331 -59.461 -3.223 1.00 24.00 N ATOM 80 CA GLN A 179 -58.627 -58.638 -4.197 1.00 3.32 C ATOM 81 C GLN A 179 -57.821 -59.571 -5.111 1.00 35.51 C ATOM 82 O GLN A 179 -57.455 -60.681 -4.709 1.00 2.32 O ATOM 83 CB GLN A 179 -57.670 -57.668 -3.473 1.00 52.52 C ATOM 84 CG GLN A 179 -58.347 -56.559 -2.645 1.00 55.30 C ATOM 85 CD GLN A 179 -59.051 -57.020 -1.363 1.00 71.53 C ATOM 86 OE1 GLN A 179 -58.808 -58.102 -0.835 1.00 14.25 O ATOM 87 NE2 GLN A 179 -59.955 -56.211 -0.835 1.00 3.14 N ATOM 0 H GLN A 179 -58.932 -59.417 -2.285 1.00 24.00 H new ATOM 0 HA GLN A 179 -59.338 -58.053 -4.780 1.00 3.32 H new ATOM 0 HB2 GLN A 179 -57.025 -58.248 -2.812 1.00 52.52 H new ATOM 0 HB3 GLN A 179 -57.025 -57.199 -4.217 1.00 52.52 H new ATOM 0 HG2 GLN A 179 -57.592 -55.820 -2.377 1.00 55.30 H new ATOM 0 HG3 GLN A 179 -59.078 -56.054 -3.277 1.00 55.30 H new ATOM 0 HE21 GLN A 179 -60.155 -55.313 -1.275 1.00 3.14 H new ATOM 0 HE22 GLN A 179 -60.452 -56.485 0.012 1.00 3.14 H new ATOM 96 N ARG A 180 -57.484 -59.120 -6.322 1.00 65.05 N ATOM 97 CA ARG A 180 -56.400 -59.663 -7.139 1.00 64.25 C ATOM 98 C ARG A 180 -56.033 -58.592 -8.167 1.00 43.03 C ATOM 99 O ARG A 180 -56.804 -57.657 -8.370 1.00 61.12 O ATOM 100 CB ARG A 180 -56.812 -60.994 -7.813 1.00 54.40 C ATOM 101 CG ARG A 180 -55.978 -62.194 -7.326 1.00 40.31 C ATOM 102 CD ARG A 180 -54.532 -62.167 -7.846 1.00 25.33 C ATOM 103 NE ARG A 180 -53.742 -63.300 -7.324 1.00 63.12 N ATOM 104 CZ ARG A 180 -52.624 -63.811 -7.862 1.00 4.44 C ATOM 105 NH1 ARG A 180 -52.120 -63.314 -8.992 1.00 33.41 N1+ ATOM 106 NH2 ARG A 180 -52.009 -64.829 -7.263 1.00 74.54 N ATOM 0 H ARG A 180 -57.972 -58.346 -6.772 1.00 65.05 H new ATOM 0 HA ARG A 180 -55.535 -59.902 -6.520 1.00 64.25 H new ATOM 0 HB2 ARG A 180 -57.866 -61.186 -7.614 1.00 54.40 H new ATOM 0 HB3 ARG A 180 -56.704 -60.897 -8.893 1.00 54.40 H new ATOM 0 HG2 ARG A 180 -55.967 -62.204 -6.236 1.00 40.31 H new ATOM 0 HG3 ARG A 180 -56.458 -63.118 -7.648 1.00 40.31 H new ATOM 0 HD2 ARG A 180 -54.537 -62.198 -8.936 1.00 25.33 H new ATOM 0 HD3 ARG A 180 -54.059 -61.229 -7.556 1.00 25.33 H new ATOM 0 HE ARG A 180 -54.080 -63.739 -6.468 1.00 63.12 H new ATOM 0 HH11 ARG A 180 -52.585 -62.535 -9.459 1.00 33.41 H new ATOM 0 HH12 ARG A 180 -51.269 -63.712 -9.390 1.00 33.41 H new ATOM 0 HH21 ARG A 180 -52.388 -65.217 -6.399 1.00 74.54 H new ATOM 0 HH22 ARG A 180 -51.159 -65.221 -7.668 1.00 74.54 H new ATOM 120 N LEU A 181 -54.894 -58.784 -8.839 1.00 42.44 N ATOM 121 CA LEU A 181 -54.198 -57.761 -9.615 1.00 73.23 C ATOM 122 C LEU A 181 -53.892 -56.539 -8.733 1.00 71.21 C ATOM 123 O LEU A 181 -54.001 -56.617 -7.507 1.00 74.14 O ATOM 124 CB LEU A 181 -54.947 -57.425 -10.922 1.00 33.22 C ATOM 125 CG LEU A 181 -53.971 -57.007 -12.048 1.00 33.35 C ATOM 126 CD1 LEU A 181 -53.691 -58.182 -12.992 1.00 5.21 C ATOM 127 CD2 LEU A 181 -54.519 -55.808 -12.816 1.00 70.12 C ATOM 0 H LEU A 181 -54.418 -59.686 -8.856 1.00 42.44 H new ATOM 0 HA LEU A 181 -53.235 -58.155 -9.941 1.00 73.23 H new ATOM 0 HB2 LEU A 181 -55.525 -58.292 -11.244 1.00 33.22 H new ATOM 0 HB3 LEU A 181 -55.657 -56.619 -10.738 1.00 33.22 H new ATOM 0 HG LEU A 181 -53.026 -56.714 -11.590 1.00 33.35 H new ATOM 0 HD11 LEU A 181 -53.003 -57.864 -13.775 1.00 5.21 H new ATOM 0 HD12 LEU A 181 -53.246 -59.003 -12.429 1.00 5.21 H new ATOM 0 HD13 LEU A 181 -54.625 -58.516 -13.444 1.00 5.21 H new ATOM 0 HD21 LEU A 181 -53.819 -55.529 -13.603 1.00 70.12 H new ATOM 0 HD22 LEU A 181 -55.480 -56.069 -13.260 1.00 70.12 H new ATOM 0 HD23 LEU A 181 -54.651 -54.968 -12.134 1.00 70.12 H new ATOM 139 N GLN A 182 -53.427 -55.446 -9.339 1.00 62.31 N ATOM 140 CA GLN A 182 -52.921 -54.264 -8.665 1.00 40.10 C ATOM 141 C GLN A 182 -52.966 -53.101 -9.663 1.00 63.11 C ATOM 142 O GLN A 182 -51.942 -52.554 -10.037 1.00 12.30 O ATOM 143 CB GLN A 182 -51.505 -54.549 -8.113 1.00 72.53 C ATOM 144 CG GLN A 182 -50.483 -55.060 -9.154 1.00 23.40 C ATOM 145 CD GLN A 182 -50.136 -56.540 -8.988 1.00 41.05 C ATOM 146 OE1 GLN A 182 -50.930 -57.434 -9.265 1.00 54.13 O ATOM 147 NE2 GLN A 182 -48.927 -56.842 -8.544 1.00 22.23 N ATOM 0 H GLN A 182 -53.394 -55.363 -10.355 1.00 62.31 H new ATOM 0 HA GLN A 182 -53.532 -53.992 -7.804 1.00 40.10 H new ATOM 0 HB2 GLN A 182 -51.116 -53.635 -7.665 1.00 72.53 H new ATOM 0 HB3 GLN A 182 -51.585 -55.286 -7.314 1.00 72.53 H new ATOM 0 HG2 GLN A 182 -50.883 -54.898 -10.155 1.00 23.40 H new ATOM 0 HG3 GLN A 182 -49.570 -54.469 -9.076 1.00 23.40 H new ATOM 0 HE21 GLN A 182 -48.268 -56.098 -8.314 1.00 22.23 H new ATOM 0 HE22 GLN A 182 -48.654 -57.818 -8.432 1.00 22.23 H new ATOM 156 N ASP A 183 -54.153 -52.745 -10.140 1.00 20.03 N ATOM 157 CA ASP A 183 -54.336 -51.860 -11.301 1.00 43.12 C ATOM 158 C ASP A 183 -54.160 -50.393 -10.940 1.00 32.23 C ATOM 159 O ASP A 183 -53.835 -49.535 -11.751 1.00 34.24 O ATOM 160 CB ASP A 183 -55.738 -52.098 -11.874 1.00 20.31 C ATOM 161 CG ASP A 183 -55.848 -51.600 -13.311 1.00 12.13 C ATOM 162 OD1 ASP A 183 -55.086 -52.142 -14.142 1.00 23.45 O1- ATOM 163 OD2 ASP A 183 -56.736 -50.756 -13.556 1.00 22.45 O ATOM 0 H ASP A 183 -55.032 -53.063 -9.731 1.00 20.03 H new ATOM 0 HA ASP A 183 -53.571 -52.096 -12.041 1.00 43.12 H new ATOM 0 HB2 ASP A 183 -55.971 -53.162 -11.838 1.00 20.31 H new ATOM 0 HB3 ASP A 183 -56.476 -51.589 -11.254 1.00 20.31 H new ATOM 168 N THR A 184 -54.215 -50.139 -9.642 1.00 51.30 N ATOM 169 CA THR A 184 -54.016 -48.835 -9.057 1.00 22.11 C ATOM 170 C THR A 184 -52.540 -48.409 -9.098 1.00 53.13 C ATOM 171 O THR A 184 -52.243 -47.282 -8.701 1.00 71.31 O ATOM 172 CB THR A 184 -54.626 -48.838 -7.640 1.00 3.31 C ATOM 173 OG1 THR A 184 -54.587 -47.556 -7.056 1.00 25.41 O ATOM 174 CG2 THR A 184 -53.956 -49.838 -6.684 1.00 51.10 C ATOM 0 H THR A 184 -54.406 -50.863 -8.949 1.00 51.30 H new ATOM 0 HA THR A 184 -54.532 -48.076 -9.645 1.00 22.11 H new ATOM 0 HB THR A 184 -55.660 -49.152 -7.782 1.00 3.31 H new ATOM 0 HG1 THR A 184 -53.780 -47.085 -7.353 1.00 25.41 H new ATOM 0 HG21 THR A 184 -54.436 -49.785 -5.707 1.00 51.10 H new ATOM 0 HG22 THR A 184 -54.057 -50.847 -7.084 1.00 51.10 H new ATOM 0 HG23 THR A 184 -52.899 -49.592 -6.583 1.00 51.10 H new ATOM 182 N VAL A 185 -51.612 -49.269 -9.535 1.00 43.51 N ATOM 183 CA VAL A 185 -50.171 -48.950 -9.507 1.00 73.04 C ATOM 184 C VAL A 185 -49.711 -47.942 -10.585 1.00 11.42 C ATOM 185 O VAL A 185 -48.506 -47.797 -10.799 1.00 54.52 O ATOM 186 CB VAL A 185 -49.320 -50.235 -9.509 1.00 23.54 C ATOM 187 CG1 VAL A 185 -49.645 -51.105 -8.281 1.00 72.43 C ATOM 188 CG2 VAL A 185 -49.398 -51.007 -10.837 1.00 23.12 C ATOM 0 H VAL A 185 -51.828 -50.191 -9.913 1.00 43.51 H new ATOM 0 HA VAL A 185 -50.005 -48.428 -8.565 1.00 73.04 H new ATOM 0 HB VAL A 185 -48.275 -49.936 -9.426 1.00 23.54 H new ATOM 0 HG11 VAL A 185 -49.033 -52.007 -8.302 1.00 72.43 H new ATOM 0 HG12 VAL A 185 -49.433 -50.544 -7.371 1.00 72.43 H new ATOM 0 HG13 VAL A 185 -50.699 -51.381 -8.299 1.00 72.43 H new ATOM 0 HG21 VAL A 185 -48.778 -51.901 -10.775 1.00 23.12 H new ATOM 0 HG22 VAL A 185 -50.431 -51.295 -11.030 1.00 23.12 H new ATOM 0 HG23 VAL A 185 -49.040 -50.373 -11.648 1.00 23.12 H new ATOM 198 N GLY A 186 -50.627 -47.254 -11.276 1.00 64.11 N ATOM 199 CA GLY A 186 -50.338 -46.287 -12.331 1.00 14.24 C ATOM 200 C GLY A 186 -49.648 -45.021 -11.810 1.00 62.45 C ATOM 201 O GLY A 186 -50.271 -43.964 -11.718 1.00 21.23 O ATOM 0 H GLY A 186 -51.627 -47.363 -11.106 1.00 64.11 H new ATOM 0 HA2 GLY A 186 -49.704 -46.757 -13.083 1.00 14.24 H new ATOM 0 HA3 GLY A 186 -51.268 -46.009 -12.827 1.00 14.24 H new ATOM 205 N LEU A 187 -48.365 -45.114 -11.458 1.00 72.41 N ATOM 206 CA LEU A 187 -47.508 -44.001 -11.056 1.00 12.03 C ATOM 207 C LEU A 187 -46.898 -43.377 -12.307 1.00 61.21 C ATOM 208 O LEU A 187 -46.214 -44.066 -13.065 1.00 12.43 O ATOM 209 CB LEU A 187 -46.390 -44.501 -10.115 1.00 63.55 C ATOM 210 CG LEU A 187 -46.705 -44.422 -8.609 1.00 32.34 C ATOM 211 CD1 LEU A 187 -46.802 -42.971 -8.126 1.00 15.23 C ATOM 212 CD2 LEU A 187 -47.963 -45.207 -8.218 1.00 11.21 C ATOM 0 H LEU A 187 -47.874 -46.008 -11.445 1.00 72.41 H new ATOM 0 HA LEU A 187 -48.099 -43.257 -10.521 1.00 12.03 H new ATOM 0 HB2 LEU A 187 -46.163 -45.537 -10.367 1.00 63.55 H new ATOM 0 HB3 LEU A 187 -45.488 -43.921 -10.311 1.00 63.55 H new ATOM 0 HG LEU A 187 -45.864 -44.897 -8.104 1.00 32.34 H new ATOM 0 HD11 LEU A 187 -47.025 -42.957 -7.059 1.00 15.23 H new ATOM 0 HD12 LEU A 187 -45.854 -42.464 -8.305 1.00 15.23 H new ATOM 0 HD13 LEU A 187 -47.596 -42.459 -8.670 1.00 15.23 H new ATOM 0 HD21 LEU A 187 -48.132 -45.113 -7.145 1.00 11.21 H new ATOM 0 HD22 LEU A 187 -48.823 -44.809 -8.757 1.00 11.21 H new ATOM 0 HD23 LEU A 187 -47.830 -46.258 -8.473 1.00 11.21 H new ATOM 224 N CYS A 188 -47.109 -42.080 -12.524 1.00 5.10 N ATOM 225 CA CYS A 188 -46.554 -41.333 -13.647 1.00 41.23 C ATOM 226 C CYS A 188 -45.067 -41.021 -13.432 1.00 61.24 C ATOM 227 O CYS A 188 -44.707 -39.902 -13.072 1.00 13.40 O ATOM 228 CB CYS A 188 -47.385 -40.063 -13.836 1.00 24.44 C ATOM 229 SG CYS A 188 -46.923 -39.182 -15.349 1.00 53.45 S ATOM 0 H CYS A 188 -47.685 -41.507 -11.907 1.00 5.10 H new ATOM 0 HA CYS A 188 -46.606 -41.935 -14.554 1.00 41.23 H new ATOM 0 HB2 CYS A 188 -48.443 -40.322 -13.874 1.00 24.44 H new ATOM 0 HB3 CYS A 188 -47.248 -39.407 -12.976 1.00 24.44 H new ATOM 0 HG CYS A 188 -47.654 -38.114 -15.469 1.00 53.45 H new ATOM 235 N PHE A 189 -44.224 -42.022 -13.682 1.00 52.22 N ATOM 236 CA PHE A 189 -42.773 -41.938 -13.878 1.00 21.13 C ATOM 237 C PHE A 189 -42.084 -41.015 -12.856 1.00 22.14 C ATOM 238 O PHE A 189 -41.502 -40.002 -13.256 1.00 63.21 O ATOM 239 CB PHE A 189 -42.464 -41.559 -15.339 1.00 11.22 C ATOM 240 CG PHE A 189 -43.062 -42.493 -16.374 1.00 52.44 C ATOM 241 CD1 PHE A 189 -42.670 -43.846 -16.412 1.00 72.12 C ATOM 242 CD2 PHE A 189 -44.007 -42.013 -17.303 1.00 41.44 C ATOM 243 CE1 PHE A 189 -43.222 -44.714 -17.371 1.00 71.13 C ATOM 244 CE2 PHE A 189 -44.557 -42.882 -18.260 1.00 33.44 C ATOM 245 CZ PHE A 189 -44.166 -44.233 -18.294 1.00 32.31 C ATOM 0 H PHE A 189 -44.559 -42.982 -13.759 1.00 52.22 H new ATOM 0 HA PHE A 189 -42.346 -42.923 -13.689 1.00 21.13 H new ATOM 0 HB2 PHE A 189 -42.832 -40.550 -15.524 1.00 11.22 H new ATOM 0 HB3 PHE A 189 -41.383 -41.534 -15.473 1.00 11.22 H new ATOM 0 HD1 PHE A 189 -41.944 -44.217 -15.703 1.00 72.12 H new ATOM 0 HD2 PHE A 189 -44.309 -40.976 -17.279 1.00 41.44 H new ATOM 0 HE1 PHE A 189 -42.920 -45.751 -17.398 1.00 71.13 H new ATOM 0 HE2 PHE A 189 -45.281 -42.512 -18.971 1.00 33.44 H new ATOM 0 HZ PHE A 189 -44.591 -44.900 -19.029 1.00 32.31 H new ATOM 255 N PRO A 190 -42.159 -41.297 -11.544 1.00 74.42 N ATOM 256 CA PRO A 190 -41.770 -40.342 -10.515 1.00 62.01 C ATOM 257 C PRO A 190 -40.242 -40.205 -10.422 1.00 31.33 C ATOM 258 O PRO A 190 -39.576 -40.939 -9.688 1.00 55.50 O ATOM 259 CB PRO A 190 -42.426 -40.863 -9.236 1.00 44.41 C ATOM 260 CG PRO A 190 -42.445 -42.377 -9.442 1.00 32.21 C ATOM 261 CD PRO A 190 -42.720 -42.498 -10.940 1.00 14.15 C ATOM 0 HA PRO A 190 -42.104 -39.327 -10.728 1.00 62.01 H new ATOM 0 HB2 PRO A 190 -41.856 -40.585 -8.350 1.00 44.41 H new ATOM 0 HB3 PRO A 190 -43.431 -40.462 -9.107 1.00 44.41 H new ATOM 0 HG2 PRO A 190 -41.497 -42.837 -9.164 1.00 32.21 H new ATOM 0 HG3 PRO A 190 -43.220 -42.859 -8.846 1.00 32.21 H new ATOM 0 HD2 PRO A 190 -42.258 -43.395 -11.351 1.00 14.15 H new ATOM 0 HD3 PRO A 190 -43.790 -42.572 -11.137 1.00 14.15 H new ATOM 269 N MET A 191 -39.676 -39.250 -11.160 1.00 5.12 N ATOM 270 CA MET A 191 -38.237 -39.035 -11.320 1.00 32.15 C ATOM 271 C MET A 191 -37.746 -37.798 -10.557 1.00 53.20 C ATOM 272 O MET A 191 -36.599 -37.384 -10.748 1.00 13.41 O ATOM 273 CB MET A 191 -37.902 -38.977 -12.823 1.00 33.21 C ATOM 274 CG MET A 191 -37.916 -40.371 -13.469 1.00 23.31 C ATOM 275 SD MET A 191 -36.749 -41.590 -12.788 1.00 33.12 S ATOM 276 CE MET A 191 -35.161 -40.733 -12.963 1.00 34.42 C ATOM 0 H MET A 191 -40.232 -38.575 -11.686 1.00 5.12 H new ATOM 0 HA MET A 191 -37.701 -39.874 -10.876 1.00 32.15 H new ATOM 0 HB2 MET A 191 -38.622 -38.335 -13.331 1.00 33.21 H new ATOM 0 HB3 MET A 191 -36.920 -38.524 -12.959 1.00 33.21 H new ATOM 0 HG2 MET A 191 -38.924 -40.777 -13.383 1.00 23.31 H new ATOM 0 HG3 MET A 191 -37.708 -40.257 -14.533 1.00 23.31 H new ATOM 0 HE1 MET A 191 -34.349 -41.418 -12.718 1.00 34.42 H new ATOM 0 HE2 MET A 191 -35.046 -40.386 -13.990 1.00 34.42 H new ATOM 0 HE3 MET A 191 -35.132 -39.879 -12.286 1.00 34.42 H new ATOM 286 N ARG A 192 -38.589 -37.241 -9.674 1.00 54.31 N ATOM 287 CA ARG A 192 -38.440 -35.980 -8.938 1.00 71.24 C ATOM 288 C ARG A 192 -38.675 -34.815 -9.888 1.00 74.33 C ATOM 289 O ARG A 192 -38.211 -34.843 -11.027 1.00 44.54 O ATOM 290 CB ARG A 192 -37.072 -35.856 -8.232 1.00 53.03 C ATOM 291 CG ARG A 192 -37.051 -34.816 -7.098 1.00 10.34 C ATOM 292 CD ARG A 192 -37.752 -35.344 -5.840 1.00 64.52 C ATOM 293 NE ARG A 192 -38.114 -34.260 -4.916 1.00 53.10 N ATOM 294 CZ ARG A 192 -38.661 -34.429 -3.711 1.00 23.44 C ATOM 295 NH1 ARG A 192 -38.783 -35.643 -3.184 1.00 33.24 N1+ ATOM 296 NH2 ARG A 192 -39.109 -33.377 -3.040 1.00 13.53 N ATOM 0 H ARG A 192 -39.467 -37.703 -9.438 1.00 54.31 H new ATOM 0 HA ARG A 192 -39.187 -35.964 -8.145 1.00 71.24 H new ATOM 0 HB2 ARG A 192 -36.794 -36.828 -7.826 1.00 53.03 H new ATOM 0 HB3 ARG A 192 -36.315 -35.590 -8.970 1.00 53.03 H new ATOM 0 HG2 ARG A 192 -36.020 -34.557 -6.860 1.00 10.34 H new ATOM 0 HG3 ARG A 192 -37.541 -33.901 -7.432 1.00 10.34 H new ATOM 0 HD2 ARG A 192 -38.650 -35.890 -6.128 1.00 64.52 H new ATOM 0 HD3 ARG A 192 -37.098 -36.052 -5.330 1.00 64.52 H new ATOM 0 HE ARG A 192 -37.933 -33.303 -5.220 1.00 53.10 H new ATOM 0 HH11 ARG A 192 -38.457 -36.459 -3.702 1.00 33.24 H new ATOM 0 HH12 ARG A 192 -39.203 -35.759 -2.262 1.00 33.24 H new ATOM 0 HH21 ARG A 192 -39.035 -32.444 -3.445 1.00 13.53 H new ATOM 0 HH22 ARG A 192 -39.528 -33.501 -2.118 1.00 13.53 H new ATOM 310 N THR A 193 -39.364 -33.780 -9.430 1.00 21.21 N ATOM 311 CA THR A 193 -39.526 -32.547 -10.176 1.00 71.03 C ATOM 312 C THR A 193 -39.446 -31.389 -9.184 1.00 61.34 C ATOM 313 O THR A 193 -40.065 -31.442 -8.115 1.00 73.14 O ATOM 314 CB THR A 193 -40.839 -32.569 -10.980 1.00 53.20 C ATOM 315 OG1 THR A 193 -41.961 -32.833 -10.166 1.00 41.42 O ATOM 316 CG2 THR A 193 -40.856 -33.644 -12.071 1.00 75.33 C ATOM 0 H THR A 193 -39.829 -33.775 -8.522 1.00 21.21 H new ATOM 0 HA THR A 193 -38.734 -32.425 -10.915 1.00 71.03 H new ATOM 0 HB THR A 193 -40.892 -31.573 -11.420 1.00 53.20 H new ATOM 0 HG1 THR A 193 -42.771 -32.836 -10.717 1.00 41.42 H new ATOM 0 HG21 THR A 193 -41.807 -33.609 -12.602 1.00 75.33 H new ATOM 0 HG22 THR A 193 -40.042 -33.463 -12.773 1.00 75.33 H new ATOM 0 HG23 THR A 193 -40.731 -34.626 -11.616 1.00 75.33 H new ATOM 324 N TYR A 194 -38.651 -30.364 -9.497 1.00 32.21 N ATOM 325 CA TYR A 194 -38.585 -29.137 -8.704 1.00 24.41 C ATOM 326 C TYR A 194 -38.101 -27.944 -9.539 1.00 2.42 C ATOM 327 O TYR A 194 -37.572 -26.962 -9.012 1.00 43.14 O ATOM 328 CB TYR A 194 -37.710 -29.365 -7.462 1.00 72.14 C ATOM 329 CG TYR A 194 -37.921 -28.349 -6.358 1.00 73.13 C ATOM 330 CD1 TYR A 194 -39.148 -28.291 -5.670 1.00 72.31 C ATOM 331 CD2 TYR A 194 -36.894 -27.446 -6.035 1.00 45.31 C ATOM 332 CE1 TYR A 194 -39.348 -27.327 -4.669 1.00 32.21 C ATOM 333 CE2 TYR A 194 -37.100 -26.452 -5.070 1.00 5.30 C ATOM 334 CZ TYR A 194 -38.331 -26.392 -4.382 1.00 42.51 C ATOM 335 OH TYR A 194 -38.513 -25.457 -3.415 1.00 72.23 O ATOM 0 H TYR A 194 -38.034 -30.362 -10.309 1.00 32.21 H new ATOM 0 HA TYR A 194 -39.592 -28.885 -8.371 1.00 24.41 H new ATOM 0 HB2 TYR A 194 -37.912 -30.361 -7.067 1.00 72.14 H new ATOM 0 HB3 TYR A 194 -36.662 -29.347 -7.761 1.00 72.14 H new ATOM 0 HD1 TYR A 194 -39.936 -28.989 -5.912 1.00 72.31 H new ATOM 0 HD2 TYR A 194 -35.939 -27.519 -6.534 1.00 45.31 H new ATOM 0 HE1 TYR A 194 -40.278 -27.301 -4.120 1.00 32.21 H new ATOM 0 HE2 TYR A 194 -36.321 -25.736 -4.854 1.00 5.30 H new ATOM 0 HH TYR A 194 -37.713 -24.895 -3.348 1.00 72.23 H new ATOM 345 N SER A 195 -38.244 -28.019 -10.857 1.00 32.13 N ATOM 346 CA SER A 195 -37.942 -26.919 -11.757 1.00 10.15 C ATOM 347 C SER A 195 -38.724 -27.121 -13.048 1.00 61.15 C ATOM 348 O SER A 195 -38.784 -28.230 -13.580 1.00 42.40 O ATOM 349 CB SER A 195 -36.428 -26.852 -12.002 1.00 65.44 C ATOM 350 OG SER A 195 -35.892 -28.117 -12.339 1.00 24.24 O ATOM 0 H SER A 195 -38.577 -28.857 -11.334 1.00 32.13 H new ATOM 0 HA SER A 195 -38.240 -25.966 -11.320 1.00 10.15 H new ATOM 0 HB2 SER A 195 -36.221 -26.144 -12.805 1.00 65.44 H new ATOM 0 HB3 SER A 195 -35.932 -26.474 -11.108 1.00 65.44 H new ATOM 0 HG SER A 195 -34.927 -28.034 -12.489 1.00 24.24 H new ATOM 356 N LYS A 196 -39.281 -26.047 -13.603 1.00 35.23 N ATOM 357 CA LYS A 196 -39.683 -25.997 -15.003 1.00 32.13 C ATOM 358 C LYS A 196 -39.400 -24.581 -15.467 1.00 0.52 C ATOM 359 O LYS A 196 -40.135 -23.655 -15.135 1.00 54.11 O ATOM 360 CB LYS A 196 -41.120 -26.517 -15.212 1.00 20.51 C ATOM 361 CG LYS A 196 -42.265 -25.744 -14.538 1.00 51.31 C ATOM 362 CD LYS A 196 -42.963 -24.766 -15.508 1.00 13.40 C ATOM 363 CE LYS A 196 -43.556 -23.532 -14.815 1.00 13.14 C ATOM 364 NZ LYS A 196 -42.520 -22.721 -14.140 1.00 11.14 N1+ ATOM 0 H LYS A 196 -39.466 -25.185 -13.091 1.00 35.23 H new ATOM 0 HA LYS A 196 -39.113 -26.680 -15.633 1.00 32.13 H new ATOM 0 HB2 LYS A 196 -41.316 -26.539 -16.284 1.00 20.51 H new ATOM 0 HB3 LYS A 196 -41.158 -27.548 -14.860 1.00 20.51 H new ATOM 0 HG2 LYS A 196 -42.998 -26.451 -14.149 1.00 51.31 H new ATOM 0 HG3 LYS A 196 -41.873 -25.189 -13.686 1.00 51.31 H new ATOM 0 HD2 LYS A 196 -42.245 -24.440 -16.261 1.00 13.40 H new ATOM 0 HD3 LYS A 196 -43.758 -25.294 -16.034 1.00 13.40 H new ATOM 0 HE2 LYS A 196 -44.074 -22.917 -15.551 1.00 13.14 H new ATOM 0 HE3 LYS A 196 -44.300 -23.850 -14.085 1.00 13.14 H new ATOM 0 HZ1 LYS A 196 -42.451 -23.007 -13.142 1.00 11.14 H new ATOM 0 HZ2 LYS A 196 -41.603 -22.870 -14.607 1.00 11.14 H new ATOM 0 HZ3 LYS A 196 -42.777 -21.715 -14.195 1.00 11.14 H new ATOM 378 N GLN A 197 -38.236 -24.382 -16.070 1.00 54.34 N ATOM 379 CA GLN A 197 -37.714 -23.094 -16.452 1.00 31.24 C ATOM 380 C GLN A 197 -36.646 -23.311 -17.523 1.00 14.24 C ATOM 381 O GLN A 197 -36.597 -24.380 -18.143 1.00 54.12 O ATOM 382 CB GLN A 197 -37.225 -22.358 -15.202 1.00 52.12 C ATOM 383 CG GLN A 197 -36.061 -23.016 -14.458 1.00 43.43 C ATOM 384 CD GLN A 197 -35.872 -22.339 -13.104 1.00 62.31 C ATOM 385 OE1 GLN A 197 -36.436 -22.772 -12.103 1.00 22.03 O ATOM 386 NE2 GLN A 197 -35.160 -21.230 -13.052 1.00 44.20 N ATOM 0 H GLN A 197 -37.611 -25.150 -16.313 1.00 54.34 H new ATOM 0 HA GLN A 197 -38.475 -22.451 -16.893 1.00 31.24 H new ATOM 0 HB2 GLN A 197 -36.925 -21.350 -15.490 1.00 52.12 H new ATOM 0 HB3 GLN A 197 -38.062 -22.256 -14.512 1.00 52.12 H new ATOM 0 HG2 GLN A 197 -36.259 -24.079 -14.320 1.00 43.43 H new ATOM 0 HG3 GLN A 197 -35.147 -22.935 -15.047 1.00 43.43 H new ATOM 0 HE21 GLN A 197 -34.697 -20.882 -13.891 1.00 44.20 H new ATOM 0 HE22 GLN A 197 -35.073 -20.721 -12.173 1.00 44.20 H new ATOM 395 N SER A 198 -35.855 -22.282 -17.814 1.00 41.44 N ATOM 396 CA SER A 198 -35.246 -22.109 -19.118 1.00 54.41 C ATOM 397 C SER A 198 -33.885 -21.441 -18.944 1.00 63.14 C ATOM 398 O SER A 198 -33.820 -20.246 -18.658 1.00 14.14 O ATOM 399 CB SER A 198 -36.224 -21.281 -19.951 1.00 23.42 C ATOM 400 OG SER A 198 -37.443 -21.997 -20.116 1.00 4.34 O ATOM 0 H SER A 198 -35.621 -21.546 -17.147 1.00 41.44 H new ATOM 0 HA SER A 198 -35.062 -23.052 -19.632 1.00 54.41 H new ATOM 0 HB2 SER A 198 -36.416 -20.326 -19.461 1.00 23.42 H new ATOM 0 HB3 SER A 198 -35.788 -21.058 -20.925 1.00 23.42 H new ATOM 0 HG SER A 198 -38.067 -21.462 -20.649 1.00 4.34 H new ATOM 406 N LYS A 199 -32.816 -22.239 -19.069 1.00 11.23 N ATOM 407 CA LYS A 199 -31.432 -21.940 -18.700 1.00 2.21 C ATOM 408 C LYS A 199 -31.335 -21.256 -17.326 1.00 2.30 C ATOM 409 O LYS A 199 -31.142 -20.037 -17.264 1.00 75.01 O ATOM 410 CB LYS A 199 -30.608 -21.278 -19.817 1.00 55.42 C ATOM 411 CG LYS A 199 -31.225 -20.117 -20.604 1.00 60.32 C ATOM 412 CD LYS A 199 -32.048 -20.558 -21.830 1.00 62.24 C ATOM 413 CE LYS A 199 -31.793 -19.675 -23.062 1.00 63.50 C ATOM 414 NZ LYS A 199 -30.424 -19.809 -23.609 1.00 45.33 N1+ ATOM 0 H LYS A 199 -32.906 -23.177 -19.459 1.00 11.23 H new ATOM 0 HA LYS A 199 -30.934 -22.902 -18.578 1.00 2.21 H new ATOM 0 HB2 LYS A 199 -29.680 -20.918 -19.373 1.00 55.42 H new ATOM 0 HB3 LYS A 199 -30.339 -22.055 -20.533 1.00 55.42 H new ATOM 0 HG2 LYS A 199 -31.866 -19.540 -19.938 1.00 60.32 H new ATOM 0 HG3 LYS A 199 -30.428 -19.451 -20.935 1.00 60.32 H new ATOM 0 HD2 LYS A 199 -31.805 -21.593 -22.073 1.00 62.24 H new ATOM 0 HD3 LYS A 199 -33.109 -20.529 -21.580 1.00 62.24 H new ATOM 0 HE2 LYS A 199 -32.513 -19.932 -23.839 1.00 63.50 H new ATOM 0 HE3 LYS A 199 -31.969 -18.633 -22.796 1.00 63.50 H new ATOM 0 HZ1 LYS A 199 -30.390 -19.398 -24.564 1.00 45.33 H new ATOM 0 HZ2 LYS A 199 -29.753 -19.308 -22.992 1.00 45.33 H new ATOM 0 HZ3 LYS A 199 -30.166 -20.815 -23.655 1.00 45.33 H new ATOM 428 N PRO A 200 -31.448 -22.021 -16.222 1.00 22.33 N ATOM 429 CA PRO A 200 -31.427 -21.503 -14.859 1.00 61.21 C ATOM 430 C PRO A 200 -30.016 -21.066 -14.444 1.00 63.15 C ATOM 431 O PRO A 200 -29.297 -21.777 -13.732 1.00 70.42 O ATOM 432 CB PRO A 200 -31.984 -22.633 -13.988 1.00 43.42 C ATOM 433 CG PRO A 200 -31.533 -23.886 -14.728 1.00 75.53 C ATOM 434 CD PRO A 200 -31.660 -23.464 -16.190 1.00 21.14 C ATOM 0 HA PRO A 200 -32.031 -20.602 -14.753 1.00 61.21 H new ATOM 0 HB2 PRO A 200 -31.585 -22.596 -12.974 1.00 43.42 H new ATOM 0 HB3 PRO A 200 -33.070 -22.582 -13.905 1.00 43.42 H new ATOM 0 HG2 PRO A 200 -30.510 -24.163 -14.472 1.00 75.53 H new ATOM 0 HG3 PRO A 200 -32.164 -24.744 -14.496 1.00 75.53 H new ATOM 0 HD2 PRO A 200 -30.924 -23.978 -16.808 1.00 21.14 H new ATOM 0 HD3 PRO A 200 -32.643 -23.721 -16.584 1.00 21.14 H new ATOM 442 N LEU A 201 -29.609 -19.868 -14.854 1.00 44.43 N ATOM 443 CA LEU A 201 -28.430 -19.194 -14.341 1.00 11.42 C ATOM 444 C LEU A 201 -28.828 -18.506 -13.051 1.00 51.40 C ATOM 445 O LEU A 201 -29.031 -17.288 -13.026 1.00 54.24 O ATOM 446 CB LEU A 201 -27.828 -18.219 -15.372 1.00 24.05 C ATOM 447 CG LEU A 201 -26.895 -18.910 -16.381 1.00 44.05 C ATOM 448 CD1 LEU A 201 -27.660 -19.631 -17.498 1.00 42.43 C ATOM 449 CD2 LEU A 201 -25.950 -17.872 -16.996 1.00 3.33 C ATOM 0 H LEU A 201 -30.103 -19.331 -15.567 1.00 44.43 H new ATOM 0 HA LEU A 201 -27.637 -19.915 -14.143 1.00 11.42 H new ATOM 0 HB2 LEU A 201 -28.636 -17.726 -15.912 1.00 24.05 H new ATOM 0 HB3 LEU A 201 -27.274 -17.441 -14.847 1.00 24.05 H new ATOM 0 HG LEU A 201 -26.332 -19.667 -15.835 1.00 44.05 H new ATOM 0 HD11 LEU A 201 -26.951 -20.100 -18.180 1.00 42.43 H new ATOM 0 HD12 LEU A 201 -28.305 -20.395 -17.063 1.00 42.43 H new ATOM 0 HD13 LEU A 201 -28.268 -18.911 -18.046 1.00 42.43 H new ATOM 0 HD21 LEU A 201 -25.288 -18.361 -17.711 1.00 3.33 H new ATOM 0 HD22 LEU A 201 -26.534 -17.106 -17.506 1.00 3.33 H new ATOM 0 HD23 LEU A 201 -25.355 -17.410 -16.208 1.00 3.33 H new ATOM 461 N PHE A 202 -28.849 -19.304 -11.978 1.00 5.10 N ATOM 462 CA PHE A 202 -28.790 -18.839 -10.607 1.00 64.12 C ATOM 463 C PHE A 202 -29.870 -17.785 -10.323 1.00 52.51 C ATOM 464 O PHE A 202 -30.883 -17.749 -11.030 1.00 4.24 O ATOM 465 CB PHE A 202 -27.331 -18.503 -10.250 1.00 64.31 C ATOM 466 CG PHE A 202 -26.474 -17.837 -11.308 1.00 42.43 C ATOM 467 CD1 PHE A 202 -26.451 -16.440 -11.455 1.00 65.05 C ATOM 468 CD2 PHE A 202 -25.734 -18.644 -12.190 1.00 30.41 C ATOM 469 CE1 PHE A 202 -25.681 -15.859 -12.477 1.00 14.43 C ATOM 470 CE2 PHE A 202 -24.977 -18.063 -13.220 1.00 24.05 C ATOM 471 CZ PHE A 202 -24.941 -16.668 -13.355 1.00 35.32 C ATOM 0 H PHE A 202 -28.909 -20.319 -12.052 1.00 5.10 H new ATOM 0 HA PHE A 202 -29.063 -19.621 -9.898 1.00 64.12 H new ATOM 0 HB2 PHE A 202 -27.343 -17.855 -9.373 1.00 64.31 H new ATOM 0 HB3 PHE A 202 -26.838 -19.429 -9.955 1.00 64.31 H new ATOM 0 HD1 PHE A 202 -27.023 -15.815 -10.785 1.00 65.05 H new ATOM 0 HD2 PHE A 202 -25.748 -19.718 -12.075 1.00 30.41 H new ATOM 0 HE1 PHE A 202 -25.658 -14.785 -12.588 1.00 14.43 H new ATOM 0 HE2 PHE A 202 -24.425 -18.688 -13.906 1.00 24.05 H new ATOM 0 HZ PHE A 202 -24.345 -16.216 -14.134 1.00 35.32 H new ATOM 481 N SER A 203 -29.773 -17.007 -9.243 1.00 15.14 N ATOM 482 CA SER A 203 -30.645 -15.841 -9.084 1.00 33.33 C ATOM 483 C SER A 203 -29.926 -14.560 -8.662 1.00 3.11 C ATOM 484 O SER A 203 -30.573 -13.515 -8.559 1.00 43.21 O ATOM 485 CB SER A 203 -31.853 -16.179 -8.207 1.00 34.23 C ATOM 486 OG SER A 203 -31.534 -16.743 -6.949 1.00 54.15 O ATOM 0 H SER A 203 -29.114 -17.158 -8.480 1.00 15.14 H new ATOM 0 HA SER A 203 -31.017 -15.601 -10.080 1.00 33.33 H new ATOM 0 HB2 SER A 203 -32.433 -15.270 -8.045 1.00 34.23 H new ATOM 0 HB3 SER A 203 -32.494 -16.874 -8.749 1.00 34.23 H new ATOM 0 HG SER A 203 -32.360 -16.926 -6.454 1.00 54.15 H new ATOM 492 N ASN A 204 -28.601 -14.581 -8.493 1.00 33.34 N ATOM 493 CA ASN A 204 -27.841 -13.493 -7.928 1.00 23.22 C ATOM 494 C ASN A 204 -26.520 -13.368 -8.666 1.00 63.13 C ATOM 495 O ASN A 204 -25.872 -14.368 -8.984 1.00 34.55 O ATOM 496 CB ASN A 204 -27.568 -13.743 -6.448 1.00 43.13 C ATOM 497 CG ASN A 204 -28.749 -13.410 -5.558 1.00 52.12 C ATOM 498 OD1 ASN A 204 -29.577 -14.268 -5.276 1.00 12.14 O ATOM 499 ND2 ASN A 204 -28.830 -12.190 -5.057 1.00 65.03 N ATOM 0 H ASN A 204 -28.025 -15.381 -8.756 1.00 33.34 H new ATOM 0 HA ASN A 204 -28.416 -12.573 -8.030 1.00 23.22 H new ATOM 0 HB2 ASN A 204 -27.299 -14.790 -6.307 1.00 43.13 H new ATOM 0 HB3 ASN A 204 -26.709 -13.148 -6.138 1.00 43.13 H new ATOM 0 HD21 ASN A 204 -29.592 -11.948 -4.423 1.00 65.03 H new ATOM 0 HD22 ASN A 204 -28.131 -11.490 -5.304 1.00 65.03 H new ATOM 506 N LYS A 205 -26.105 -12.125 -8.859 1.00 32.23 N ATOM 507 CA LYS A 205 -24.739 -11.706 -9.172 1.00 5.31 C ATOM 508 C LYS A 205 -24.311 -10.650 -8.144 1.00 74.31 C ATOM 509 O LYS A 205 -25.153 -9.862 -7.691 1.00 44.22 O ATOM 510 CB LYS A 205 -24.625 -11.130 -10.598 1.00 4.33 C ATOM 511 CG LYS A 205 -25.100 -12.026 -11.758 1.00 24.12 C ATOM 512 CD LYS A 205 -26.604 -11.909 -12.095 1.00 43.10 C ATOM 513 CE LYS A 205 -26.867 -11.610 -13.584 1.00 53.42 C ATOM 514 NZ LYS A 205 -26.672 -12.775 -14.484 1.00 41.42 N1+ ATOM 0 H LYS A 205 -26.746 -11.334 -8.799 1.00 32.23 H new ATOM 0 HA LYS A 205 -24.086 -12.577 -9.126 1.00 5.31 H new ATOM 0 HB2 LYS A 205 -25.194 -10.201 -10.634 1.00 4.33 H new ATOM 0 HB3 LYS A 205 -23.581 -10.872 -10.776 1.00 4.33 H new ATOM 0 HG2 LYS A 205 -24.522 -11.779 -12.649 1.00 24.12 H new ATOM 0 HG3 LYS A 205 -24.877 -13.064 -11.511 1.00 24.12 H new ATOM 0 HD2 LYS A 205 -27.105 -12.838 -11.823 1.00 43.10 H new ATOM 0 HD3 LYS A 205 -27.046 -11.119 -11.488 1.00 43.10 H new ATOM 0 HE2 LYS A 205 -27.889 -11.247 -13.695 1.00 53.42 H new ATOM 0 HE3 LYS A 205 -26.206 -10.804 -13.903 1.00 53.42 H new ATOM 0 HZ1 LYS A 205 -26.868 -12.492 -15.465 1.00 41.42 H new ATOM 0 HZ2 LYS A 205 -25.690 -13.111 -14.410 1.00 41.42 H new ATOM 0 HZ3 LYS A 205 -27.321 -13.539 -14.208 1.00 41.42 H new ATOM 528 N ARG A 206 -23.029 -10.628 -7.762 1.00 72.04 N ATOM 529 CA ARG A 206 -22.438 -9.599 -6.892 1.00 44.22 C ATOM 530 C ARG A 206 -21.019 -9.199 -7.315 1.00 14.02 C ATOM 531 O ARG A 206 -20.252 -8.690 -6.494 1.00 71.11 O ATOM 532 CB ARG A 206 -22.494 -10.050 -5.427 1.00 34.22 C ATOM 533 CG ARG A 206 -21.519 -11.176 -5.041 1.00 44.22 C ATOM 534 CD ARG A 206 -21.839 -11.578 -3.604 1.00 73.05 C ATOM 535 NE ARG A 206 -20.921 -12.598 -3.083 1.00 44.20 N ATOM 536 CZ ARG A 206 -21.166 -13.370 -2.021 1.00 1.34 C ATOM 537 NH1 ARG A 206 -22.375 -13.415 -1.472 1.00 3.11 N1+ ATOM 538 NH2 ARG A 206 -20.189 -14.101 -1.503 1.00 20.34 N ATOM 0 H ARG A 206 -22.358 -11.339 -8.054 1.00 72.04 H new ATOM 0 HA ARG A 206 -23.038 -8.696 -7.001 1.00 44.22 H new ATOM 0 HB2 ARG A 206 -22.294 -9.187 -4.792 1.00 34.22 H new ATOM 0 HB3 ARG A 206 -23.509 -10.381 -5.206 1.00 34.22 H new ATOM 0 HG2 ARG A 206 -21.630 -12.028 -5.712 1.00 44.22 H new ATOM 0 HG3 ARG A 206 -20.487 -10.836 -5.125 1.00 44.22 H new ATOM 0 HD2 ARG A 206 -21.795 -10.695 -2.966 1.00 73.05 H new ATOM 0 HD3 ARG A 206 -22.860 -11.956 -3.556 1.00 73.05 H new ATOM 0 HE ARG A 206 -20.032 -12.726 -3.567 1.00 44.20 H new ATOM 0 HH11 ARG A 206 -23.133 -12.855 -1.861 1.00 3.11 H new ATOM 0 HH12 ARG A 206 -22.545 -14.010 -0.661 1.00 3.11 H new ATOM 0 HH21 ARG A 206 -19.257 -14.072 -1.915 1.00 20.34 H new ATOM 0 HH22 ARG A 206 -20.370 -14.693 -0.692 1.00 20.34 H new ATOM 552 N LYS A 207 -20.624 -9.548 -8.537 1.00 13.45 N ATOM 553 CA LYS A 207 -19.263 -9.491 -9.042 1.00 44.04 C ATOM 554 C LYS A 207 -19.355 -9.434 -10.564 1.00 62.01 C ATOM 555 O LYS A 207 -19.528 -10.480 -11.197 1.00 42.43 O ATOM 556 CB LYS A 207 -18.440 -10.682 -8.488 1.00 24.21 C ATOM 557 CG LYS A 207 -19.064 -12.096 -8.584 1.00 43.43 C ATOM 558 CD LYS A 207 -18.371 -13.077 -7.623 1.00 14.11 C ATOM 559 CE LYS A 207 -18.436 -14.551 -8.055 1.00 12.52 C ATOM 560 NZ LYS A 207 -19.771 -15.171 -7.939 1.00 13.51 N1+ ATOM 0 H LYS A 207 -21.282 -9.896 -9.234 1.00 13.45 H new ATOM 0 HA LYS A 207 -18.726 -8.604 -8.705 1.00 44.04 H new ATOM 0 HB2 LYS A 207 -17.484 -10.701 -9.012 1.00 24.21 H new ATOM 0 HB3 LYS A 207 -18.225 -10.481 -7.439 1.00 24.21 H new ATOM 0 HG2 LYS A 207 -20.127 -12.044 -8.350 1.00 43.43 H new ATOM 0 HG3 LYS A 207 -18.980 -12.464 -9.606 1.00 43.43 H new ATOM 0 HD2 LYS A 207 -17.325 -12.788 -7.522 1.00 14.11 H new ATOM 0 HD3 LYS A 207 -18.825 -12.981 -6.637 1.00 14.11 H new ATOM 0 HE2 LYS A 207 -18.104 -14.627 -9.091 1.00 12.52 H new ATOM 0 HE3 LYS A 207 -17.731 -15.123 -7.452 1.00 12.52 H new ATOM 0 HZ1 LYS A 207 -19.722 -16.162 -8.251 1.00 13.51 H new ATOM 0 HZ2 LYS A 207 -20.086 -15.135 -6.948 1.00 13.51 H new ATOM 0 HZ3 LYS A 207 -20.447 -14.654 -8.536 1.00 13.51 H new ATOM 574 N ILE A 208 -19.313 -8.236 -11.156 1.00 1.30 N ATOM 575 CA ILE A 208 -19.375 -8.043 -12.602 1.00 11.50 C ATOM 576 C ILE A 208 -18.300 -7.061 -13.026 1.00 21.22 C ATOM 577 O ILE A 208 -18.246 -5.922 -12.566 1.00 5.12 O ATOM 578 CB ILE A 208 -20.793 -7.619 -13.071 1.00 32.34 C ATOM 579 CG1 ILE A 208 -21.768 -8.815 -13.017 1.00 21.11 C ATOM 580 CG2 ILE A 208 -20.782 -7.039 -14.503 1.00 34.12 C ATOM 581 CD1 ILE A 208 -23.237 -8.418 -13.221 1.00 64.43 C ATOM 0 H ILE A 208 -19.234 -7.363 -10.634 1.00 1.30 H new ATOM 0 HA ILE A 208 -19.179 -8.995 -13.095 1.00 11.50 H new ATOM 0 HB ILE A 208 -21.128 -6.839 -12.387 1.00 32.34 H new ATOM 0 HG12 ILE A 208 -21.486 -9.538 -13.782 1.00 21.11 H new ATOM 0 HG13 ILE A 208 -21.665 -9.314 -12.053 1.00 21.11 H new ATOM 0 HG21 ILE A 208 -21.795 -6.756 -14.789 1.00 34.12 H new ATOM 0 HG22 ILE A 208 -20.137 -6.161 -14.535 1.00 34.12 H new ATOM 0 HG23 ILE A 208 -20.406 -7.791 -15.197 1.00 34.12 H new ATOM 0 HD11 ILE A 208 -23.865 -9.308 -13.171 1.00 64.43 H new ATOM 0 HD12 ILE A 208 -23.536 -7.718 -12.441 1.00 64.43 H new ATOM 0 HD13 ILE A 208 -23.354 -7.946 -14.196 1.00 64.43 H new ATOM 593 N HIS A 209 -17.474 -7.512 -13.966 1.00 41.32 N ATOM 594 CA HIS A 209 -16.342 -6.770 -14.481 1.00 63.01 C ATOM 595 C HIS A 209 -16.218 -6.937 -15.982 1.00 55.52 C ATOM 596 O HIS A 209 -15.114 -7.065 -16.508 1.00 14.34 O ATOM 597 CB HIS A 209 -15.111 -7.158 -13.689 1.00 3.24 C ATOM 598 CG HIS A 209 -14.689 -8.603 -13.808 1.00 14.44 C ATOM 599 ND1 HIS A 209 -14.024 -9.157 -14.879 1.00 43.42 N ATOM 600 CD2 HIS A 209 -14.902 -9.594 -12.890 1.00 41.34 C ATOM 601 CE1 HIS A 209 -13.843 -10.460 -14.618 1.00 35.43 C ATOM 602 NE2 HIS A 209 -14.370 -10.774 -13.421 1.00 2.45 N ATOM 0 H HIS A 209 -17.582 -8.430 -14.398 1.00 41.32 H new ATOM 0 HA HIS A 209 -16.480 -5.697 -14.344 1.00 63.01 H new ATOM 0 HB2 HIS A 209 -14.281 -6.528 -14.009 1.00 3.24 H new ATOM 0 HB3 HIS A 209 -15.292 -6.936 -12.637 1.00 3.24 H new ATOM 0 HD1 HIS A 209 -13.723 -8.665 -15.720 1.00 43.42 H new ATOM 0 HD2 HIS A 209 -15.390 -9.486 -11.933 1.00 41.34 H new ATOM 0 HE1 HIS A 209 -13.345 -11.158 -15.275 1.00 35.43 H new ATOM 610 N LEU A 210 -17.349 -6.877 -16.684 1.00 24.30 N ATOM 611 CA LEU A 210 -17.347 -6.714 -18.132 1.00 74.33 C ATOM 612 C LEU A 210 -16.479 -5.522 -18.537 1.00 64.15 C ATOM 613 O LEU A 210 -15.842 -5.583 -19.589 1.00 4.22 O ATOM 614 CB LEU A 210 -18.776 -6.599 -18.648 1.00 35.43 C ATOM 615 CG LEU A 210 -18.861 -6.515 -20.189 1.00 23.31 C ATOM 616 CD1 LEU A 210 -20.037 -7.325 -20.739 1.00 42.23 C ATOM 617 CD2 LEU A 210 -19.023 -5.071 -20.668 1.00 61.45 C ATOM 0 H LEU A 210 -18.279 -6.939 -16.270 1.00 24.30 H new ATOM 0 HA LEU A 210 -16.906 -7.596 -18.595 1.00 74.33 H new ATOM 0 HB2 LEU A 210 -19.350 -7.460 -18.305 1.00 35.43 H new ATOM 0 HB3 LEU A 210 -19.241 -5.713 -18.216 1.00 35.43 H new ATOM 0 HG LEU A 210 -17.923 -6.927 -20.561 1.00 23.31 H new ATOM 0 HD11 LEU A 210 -20.061 -7.240 -21.825 1.00 42.23 H new ATOM 0 HD12 LEU A 210 -19.920 -8.372 -20.460 1.00 42.23 H new ATOM 0 HD13 LEU A 210 -20.969 -6.941 -20.324 1.00 42.23 H new ATOM 0 HD21 LEU A 210 -19.079 -5.053 -21.756 1.00 61.45 H new ATOM 0 HD22 LEU A 210 -19.937 -4.650 -20.250 1.00 61.45 H new ATOM 0 HD23 LEU A 210 -18.168 -4.480 -20.339 1.00 61.45 H new ATOM 629 N SER A 211 -16.417 -4.494 -17.682 1.00 3.02 N ATOM 630 CA SER A 211 -15.708 -3.244 -17.949 1.00 64.31 C ATOM 631 C SER A 211 -15.559 -2.350 -16.713 1.00 54.04 C ATOM 632 O SER A 211 -14.972 -1.280 -16.867 1.00 2.11 O ATOM 633 CB SER A 211 -16.363 -2.477 -19.118 1.00 73.53 C ATOM 634 OG SER A 211 -15.758 -2.826 -20.354 1.00 23.32 O ATOM 0 H SER A 211 -16.869 -4.512 -16.768 1.00 3.02 H new ATOM 0 HA SER A 211 -14.695 -3.524 -18.238 1.00 64.31 H new ATOM 0 HB2 SER A 211 -17.429 -2.702 -19.154 1.00 73.53 H new ATOM 0 HB3 SER A 211 -16.269 -1.404 -18.952 1.00 73.53 H new ATOM 0 HG SER A 211 -15.641 -3.798 -20.398 1.00 23.32 H new ATOM 640 N GLU A 212 -15.984 -2.766 -15.509 1.00 61.43 N ATOM 641 CA GLU A 212 -15.663 -2.042 -14.278 1.00 71.32 C ATOM 642 C GLU A 212 -14.140 -1.863 -14.171 1.00 51.54 C ATOM 643 O GLU A 212 -13.659 -0.729 -14.229 1.00 40.14 O ATOM 644 CB GLU A 212 -16.234 -2.747 -13.026 1.00 52.21 C ATOM 645 CG GLU A 212 -17.597 -2.207 -12.555 1.00 41.53 C ATOM 646 CD GLU A 212 -17.887 -2.561 -11.088 1.00 31.35 C ATOM 647 OE1 GLU A 212 -17.481 -3.648 -10.609 1.00 43.43 O ATOM 648 OE2 GLU A 212 -18.485 -1.735 -10.354 1.00 24.25 O1- ATOM 0 H GLU A 212 -16.551 -3.602 -15.367 1.00 61.43 H new ATOM 0 HA GLU A 212 -16.136 -1.061 -14.323 1.00 71.32 H new ATOM 0 HB2 GLU A 212 -16.333 -3.812 -13.237 1.00 52.21 H new ATOM 0 HB3 GLU A 212 -15.517 -2.649 -12.211 1.00 52.21 H new ATOM 0 HG2 GLU A 212 -17.618 -1.124 -12.677 1.00 41.53 H new ATOM 0 HG3 GLU A 212 -18.385 -2.614 -13.188 1.00 41.53 H new ATOM 655 N LEU A 213 -13.381 -2.974 -14.074 1.00 24.44 N ATOM 656 CA LEU A 213 -11.939 -2.979 -13.759 1.00 44.23 C ATOM 657 C LEU A 213 -11.724 -2.429 -12.342 1.00 32.50 C ATOM 658 O LEU A 213 -12.565 -1.723 -11.786 1.00 52.31 O ATOM 659 CB LEU A 213 -11.168 -2.190 -14.852 1.00 53.53 C ATOM 660 CG LEU A 213 -10.069 -2.891 -15.663 1.00 40.33 C ATOM 661 CD1 LEU A 213 -8.798 -3.051 -14.845 1.00 1.01 C ATOM 662 CD2 LEU A 213 -10.514 -4.240 -16.233 1.00 32.21 C ATOM 0 H LEU A 213 -13.761 -3.910 -14.215 1.00 24.44 H new ATOM 0 HA LEU A 213 -11.542 -3.994 -13.766 1.00 44.23 H new ATOM 0 HB2 LEU A 213 -11.904 -1.811 -15.561 1.00 53.53 H new ATOM 0 HB3 LEU A 213 -10.715 -1.324 -14.370 1.00 53.53 H new ATOM 0 HG LEU A 213 -9.860 -2.242 -16.513 1.00 40.33 H new ATOM 0 HD11 LEU A 213 -8.039 -3.551 -15.447 1.00 1.01 H new ATOM 0 HD12 LEU A 213 -8.434 -2.069 -14.543 1.00 1.01 H new ATOM 0 HD13 LEU A 213 -9.009 -3.648 -13.958 1.00 1.01 H new ATOM 0 HD21 LEU A 213 -9.694 -4.686 -16.796 1.00 32.21 H new ATOM 0 HD22 LEU A 213 -10.797 -4.904 -15.417 1.00 32.21 H new ATOM 0 HD23 LEU A 213 -11.369 -4.092 -16.893 1.00 32.21 H new ATOM 674 N MET A 214 -10.586 -2.788 -11.743 1.00 0.24 N ATOM 675 CA MET A 214 -10.082 -2.238 -10.485 1.00 32.05 C ATOM 676 C MET A 214 -11.185 -2.134 -9.421 1.00 23.33 C ATOM 677 O MET A 214 -11.463 -1.036 -8.935 1.00 53.34 O ATOM 678 CB MET A 214 -9.415 -0.866 -10.727 1.00 13.22 C ATOM 679 CG MET A 214 -8.338 -0.864 -11.809 1.00 41.51 C ATOM 680 SD MET A 214 -7.575 0.752 -12.108 1.00 21.51 S ATOM 681 CE MET A 214 -6.482 0.881 -10.672 1.00 63.42 C ATOM 0 H MET A 214 -9.968 -3.497 -12.137 1.00 0.24 H new ATOM 0 HA MET A 214 -9.331 -2.928 -10.099 1.00 32.05 H new ATOM 0 HB2 MET A 214 -10.186 -0.145 -10.999 1.00 13.22 H new ATOM 0 HB3 MET A 214 -8.973 -0.522 -9.792 1.00 13.22 H new ATOM 0 HG2 MET A 214 -7.559 -1.573 -11.529 1.00 41.51 H new ATOM 0 HG3 MET A 214 -8.776 -1.223 -12.740 1.00 41.51 H new ATOM 0 HE1 MET A 214 -5.940 1.826 -10.711 1.00 63.42 H new ATOM 0 HE2 MET A 214 -7.075 0.840 -9.758 1.00 63.42 H new ATOM 0 HE3 MET A 214 -5.771 0.054 -10.680 1.00 63.42 H new ATOM 691 N LEU A 215 -11.782 -3.273 -9.045 1.00 34.21 N ATOM 692 CA LEU A 215 -12.972 -3.328 -8.195 1.00 73.12 C ATOM 693 C LEU A 215 -12.876 -2.417 -6.978 1.00 63.53 C ATOM 694 O LEU A 215 -11.822 -2.301 -6.351 1.00 4.22 O ATOM 695 CB LEU A 215 -13.249 -4.776 -7.769 1.00 11.32 C ATOM 696 CG LEU A 215 -14.327 -4.934 -6.673 1.00 5.51 C ATOM 697 CD1 LEU A 215 -15.064 -6.249 -6.869 1.00 20.01 C ATOM 698 CD2 LEU A 215 -13.743 -4.900 -5.250 1.00 75.40 C ATOM 0 H LEU A 215 -11.445 -4.193 -9.328 1.00 34.21 H new ATOM 0 HA LEU A 215 -13.807 -2.958 -8.790 1.00 73.12 H new ATOM 0 HB2 LEU A 215 -13.556 -5.345 -8.646 1.00 11.32 H new ATOM 0 HB3 LEU A 215 -12.319 -5.219 -7.411 1.00 11.32 H new ATOM 0 HG LEU A 215 -15.005 -4.086 -6.772 1.00 5.51 H new ATOM 0 HD11 LEU A 215 -15.824 -6.359 -6.095 1.00 20.01 H new ATOM 0 HD12 LEU A 215 -15.540 -6.256 -7.849 1.00 20.01 H new ATOM 0 HD13 LEU A 215 -14.357 -7.076 -6.803 1.00 20.01 H new ATOM 0 HD21 LEU A 215 -14.547 -5.016 -4.524 1.00 75.40 H new ATOM 0 HD22 LEU A 215 -13.027 -5.713 -5.131 1.00 75.40 H new ATOM 0 HD23 LEU A 215 -13.240 -3.947 -5.086 1.00 75.40 H new ATOM 710 N GLU A 216 -14.020 -1.877 -6.573 1.00 42.34 N ATOM 711 CA GLU A 216 -14.110 -0.812 -5.590 1.00 21.22 C ATOM 712 C GLU A 216 -15.113 -1.094 -4.463 1.00 61.20 C ATOM 713 O GLU A 216 -15.688 -0.176 -3.881 1.00 11.33 O ATOM 714 CB GLU A 216 -14.385 0.509 -6.337 1.00 25.21 C ATOM 715 CG GLU A 216 -15.759 0.487 -7.029 1.00 54.02 C ATOM 716 CD GLU A 216 -16.041 1.751 -7.828 1.00 1.13 C ATOM 717 OE1 GLU A 216 -16.175 2.833 -7.210 1.00 44.35 O1- ATOM 718 OE2 GLU A 216 -16.217 1.625 -9.060 1.00 13.22 O ATOM 0 H GLU A 216 -14.928 -2.176 -6.928 1.00 42.34 H new ATOM 0 HA GLU A 216 -13.159 -0.737 -5.063 1.00 21.22 H new ATOM 0 HB2 GLU A 216 -14.343 1.341 -5.635 1.00 25.21 H new ATOM 0 HB3 GLU A 216 -13.605 0.678 -7.079 1.00 25.21 H new ATOM 0 HG2 GLU A 216 -15.812 -0.376 -7.693 1.00 54.02 H new ATOM 0 HG3 GLU A 216 -16.537 0.358 -6.277 1.00 54.02 H new ATOM 725 N LYS A 217 -15.322 -2.363 -4.110 1.00 71.23 N ATOM 726 CA LYS A 217 -16.333 -2.792 -3.146 1.00 24.12 C ATOM 727 C LYS A 217 -15.703 -3.782 -2.172 1.00 41.53 C ATOM 728 O LYS A 217 -15.737 -4.991 -2.408 1.00 65.12 O ATOM 729 CB LYS A 217 -17.510 -3.347 -3.959 1.00 63.53 C ATOM 730 CG LYS A 217 -18.806 -3.591 -3.169 1.00 33.31 C ATOM 731 CD LYS A 217 -19.884 -3.936 -4.204 1.00 21.23 C ATOM 732 CE LYS A 217 -21.295 -4.130 -3.642 1.00 11.23 C ATOM 733 NZ LYS A 217 -22.290 -4.042 -4.732 1.00 34.23 N1+ ATOM 0 H LYS A 217 -14.781 -3.137 -4.495 1.00 71.23 H new ATOM 0 HA LYS A 217 -16.714 -1.982 -2.524 1.00 24.12 H new ATOM 0 HB2 LYS A 217 -17.726 -2.654 -4.772 1.00 63.53 H new ATOM 0 HB3 LYS A 217 -17.202 -4.287 -4.416 1.00 63.53 H new ATOM 0 HG2 LYS A 217 -18.678 -4.405 -2.455 1.00 33.31 H new ATOM 0 HG3 LYS A 217 -19.085 -2.706 -2.597 1.00 33.31 H new ATOM 0 HD2 LYS A 217 -19.914 -3.142 -4.950 1.00 21.23 H new ATOM 0 HD3 LYS A 217 -19.588 -4.849 -4.721 1.00 21.23 H new ATOM 0 HE2 LYS A 217 -21.369 -5.099 -3.149 1.00 11.23 H new ATOM 0 HE3 LYS A 217 -21.502 -3.371 -2.887 1.00 11.23 H new ATOM 0 HZ1 LYS A 217 -23.245 -4.175 -4.342 1.00 34.23 H new ATOM 0 HZ2 LYS A 217 -22.228 -3.108 -5.184 1.00 34.23 H new ATOM 0 HZ3 LYS A 217 -22.098 -4.782 -5.438 1.00 34.23 H new ATOM 747 N CYS A 218 -15.065 -3.280 -1.112 1.00 72.34 N ATOM 748 CA CYS A 218 -14.363 -4.098 -0.123 1.00 52.25 C ATOM 749 C CYS A 218 -14.935 -3.809 1.272 1.00 53.24 C ATOM 750 O CYS A 218 -14.266 -3.177 2.086 1.00 3.44 O ATOM 751 CB CYS A 218 -12.843 -3.876 -0.222 1.00 41.44 C ATOM 752 SG CYS A 218 -11.965 -5.053 0.854 1.00 24.22 S ATOM 0 H CYS A 218 -15.022 -2.280 -0.915 1.00 72.34 H new ATOM 0 HA CYS A 218 -14.523 -5.157 -0.323 1.00 52.25 H new ATOM 0 HB2 CYS A 218 -12.516 -4.002 -1.254 1.00 41.44 H new ATOM 0 HB3 CYS A 218 -12.598 -2.854 0.068 1.00 41.44 H new ATOM 0 HG CYS A 218 -10.684 -4.855 0.759 1.00 24.22 H new ATOM 758 N PRO A 219 -16.156 -4.276 1.575 1.00 2.24 N ATOM 759 CA PRO A 219 -16.766 -4.179 2.897 1.00 23.03 C ATOM 760 C PRO A 219 -16.169 -5.167 3.914 1.00 53.55 C ATOM 761 O PRO A 219 -16.653 -5.223 5.044 1.00 51.44 O ATOM 762 CB PRO A 219 -18.257 -4.423 2.667 1.00 13.32 C ATOM 763 CG PRO A 219 -18.258 -5.387 1.493 1.00 34.20 C ATOM 764 CD PRO A 219 -17.094 -4.889 0.648 1.00 63.34 C ATOM 0 HA PRO A 219 -16.575 -3.202 3.342 1.00 23.03 H new ATOM 0 HB2 PRO A 219 -18.737 -4.854 3.545 1.00 13.32 H new ATOM 0 HB3 PRO A 219 -18.788 -3.500 2.434 1.00 13.32 H new ATOM 0 HG2 PRO A 219 -18.112 -6.418 1.816 1.00 34.20 H new ATOM 0 HG3 PRO A 219 -19.199 -5.355 0.944 1.00 34.20 H new ATOM 0 HD2 PRO A 219 -16.626 -5.711 0.106 1.00 63.34 H new ATOM 0 HD3 PRO A 219 -17.433 -4.169 -0.097 1.00 63.34 H new ATOM 772 N PHE A 220 -15.239 -6.048 3.519 1.00 52.33 N ATOM 773 CA PHE A 220 -14.439 -6.776 4.487 1.00 13.33 C ATOM 774 C PHE A 220 -13.512 -5.769 5.188 1.00 31.11 C ATOM 775 O PHE A 220 -13.035 -4.841 4.533 1.00 61.21 O ATOM 776 CB PHE A 220 -13.629 -7.880 3.787 1.00 12.53 C ATOM 777 CG PHE A 220 -14.448 -9.052 3.274 1.00 53.04 C ATOM 778 CD1 PHE A 220 -15.369 -9.704 4.118 1.00 11.32 C ATOM 779 CD2 PHE A 220 -14.253 -9.529 1.963 1.00 43.24 C ATOM 780 CE1 PHE A 220 -16.114 -10.799 3.648 1.00 35.04 C ATOM 781 CE2 PHE A 220 -14.987 -10.636 1.502 1.00 24.41 C ATOM 782 CZ PHE A 220 -15.924 -11.266 2.337 1.00 24.35 C ATOM 0 H PHE A 220 -15.031 -6.265 2.544 1.00 52.33 H new ATOM 0 HA PHE A 220 -15.079 -7.261 5.224 1.00 13.33 H new ATOM 0 HB2 PHE A 220 -13.091 -7.438 2.949 1.00 12.53 H new ATOM 0 HB3 PHE A 220 -12.880 -8.257 4.484 1.00 12.53 H new ATOM 0 HD1 PHE A 220 -15.503 -9.360 5.133 1.00 11.32 H new ATOM 0 HD2 PHE A 220 -13.540 -9.045 1.312 1.00 43.24 H new ATOM 0 HE1 PHE A 220 -16.832 -11.281 4.295 1.00 35.04 H new ATOM 0 HE2 PHE A 220 -14.829 -11.004 0.499 1.00 24.41 H new ATOM 0 HZ PHE A 220 -16.496 -12.106 1.973 1.00 24.35 H new ATOM 792 N PRO A 221 -13.244 -5.962 6.486 1.00 52.42 N ATOM 793 CA PRO A 221 -12.546 -5.011 7.335 1.00 64.02 C ATOM 794 C PRO A 221 -11.038 -5.001 7.094 1.00 52.52 C ATOM 795 O PRO A 221 -10.466 -5.902 6.470 1.00 61.24 O ATOM 796 CB PRO A 221 -12.857 -5.475 8.766 1.00 3.32 C ATOM 797 CG PRO A 221 -13.001 -6.982 8.616 1.00 31.34 C ATOM 798 CD PRO A 221 -13.726 -7.072 7.276 1.00 13.23 C ATOM 0 HA PRO A 221 -12.873 -3.991 7.131 1.00 64.02 H new ATOM 0 HB2 PRO A 221 -12.056 -5.213 9.458 1.00 3.32 H new ATOM 0 HB3 PRO A 221 -13.770 -5.019 9.148 1.00 3.32 H new ATOM 0 HG2 PRO A 221 -12.036 -7.489 8.598 1.00 31.34 H new ATOM 0 HG3 PRO A 221 -13.578 -7.424 9.428 1.00 31.34 H new ATOM 0 HD2 PRO A 221 -13.517 -8.021 6.783 1.00 13.23 H new ATOM 0 HD3 PRO A 221 -14.806 -7.014 7.412 1.00 13.23 H new ATOM 806 N ALA A 222 -10.378 -4.028 7.719 1.00 15.10 N ATOM 807 CA ALA A 222 -8.934 -3.896 7.851 1.00 33.50 C ATOM 808 C ALA A 222 -8.339 -4.911 8.844 1.00 45.31 C ATOM 809 O ALA A 222 -7.407 -4.580 9.580 1.00 5.14 O ATOM 810 CB ALA A 222 -8.630 -2.449 8.268 1.00 54.51 C ATOM 0 H ALA A 222 -10.873 -3.262 8.176 1.00 15.10 H new ATOM 0 HA ALA A 222 -8.462 -4.118 6.894 1.00 33.50 H new ATOM 0 HB1 ALA A 222 -7.553 -2.320 8.375 1.00 54.51 H new ATOM 0 HB2 ALA A 222 -9.004 -1.765 7.506 1.00 54.51 H new ATOM 0 HB3 ALA A 222 -9.117 -2.234 9.219 1.00 54.51 H new ATOM 816 N GLY A 223 -8.874 -6.129 8.910 1.00 72.54 N ATOM 817 CA GLY A 223 -8.343 -7.227 9.710 1.00 54.34 C ATOM 818 C GLY A 223 -8.812 -8.595 9.226 1.00 13.20 C ATOM 819 O GLY A 223 -9.025 -9.483 10.054 1.00 13.51 O ATOM 0 H GLY A 223 -9.714 -6.385 8.392 1.00 72.54 H new ATOM 0 HA2 GLY A 223 -7.254 -7.193 9.687 1.00 54.34 H new ATOM 0 HA3 GLY A 223 -8.644 -7.092 10.749 1.00 54.34 H new ATOM 823 N SER A 224 -9.043 -8.782 7.926 1.00 12.10 N ATOM 824 CA SER A 224 -9.462 -10.047 7.331 1.00 32.34 C ATOM 825 C SER A 224 -8.450 -10.437 6.256 1.00 62.33 C ATOM 826 O SER A 224 -8.205 -9.662 5.329 1.00 52.54 O ATOM 827 CB SER A 224 -10.853 -9.913 6.700 1.00 2.20 C ATOM 828 OG SER A 224 -11.923 -9.876 7.628 1.00 61.34 O ATOM 0 H SER A 224 -8.940 -8.034 7.240 1.00 12.10 H new ATOM 0 HA SER A 224 -9.509 -10.812 8.106 1.00 32.34 H new ATOM 0 HB2 SER A 224 -10.879 -9.003 6.100 1.00 2.20 H new ATOM 0 HB3 SER A 224 -11.010 -10.749 6.018 1.00 2.20 H new ATOM 0 HG SER A 224 -12.759 -10.107 7.172 1.00 61.34 H new ATOM 834 N ASP A 225 -7.950 -11.674 6.321 1.00 61.25 N ATOM 835 CA ASP A 225 -7.145 -12.317 5.272 1.00 53.22 C ATOM 836 C ASP A 225 -7.794 -12.113 3.903 1.00 11.51 C ATOM 837 O ASP A 225 -7.125 -11.726 2.949 1.00 20.21 O ATOM 838 CB ASP A 225 -7.034 -13.818 5.573 1.00 65.42 C ATOM 839 CG ASP A 225 -6.128 -14.561 4.595 1.00 1.12 C ATOM 840 OD1 ASP A 225 -4.914 -14.660 4.882 1.00 54.24 O1- ATOM 841 OD2 ASP A 225 -6.638 -15.155 3.622 1.00 40.32 O ATOM 0 H ASP A 225 -8.098 -12.277 7.130 1.00 61.25 H new ATOM 0 HA ASP A 225 -6.152 -11.868 5.257 1.00 53.22 H new ATOM 0 HB2 ASP A 225 -6.653 -13.952 6.585 1.00 65.42 H new ATOM 0 HB3 ASP A 225 -8.029 -14.262 5.546 1.00 65.42 H new ATOM 846 N LEU A 226 -9.124 -12.259 3.860 1.00 65.13 N ATOM 847 CA LEU A 226 -9.993 -12.028 2.709 1.00 13.44 C ATOM 848 C LEU A 226 -9.655 -10.722 2.001 1.00 72.23 C ATOM 849 O LEU A 226 -9.463 -10.699 0.782 1.00 44.25 O ATOM 850 CB LEU A 226 -11.465 -11.970 3.159 1.00 21.33 C ATOM 851 CG LEU A 226 -12.020 -13.304 3.683 1.00 42.04 C ATOM 852 CD1 LEU A 226 -13.225 -13.062 4.598 1.00 2.14 C ATOM 853 CD2 LEU A 226 -12.431 -14.207 2.521 1.00 31.03 C ATOM 0 H LEU A 226 -9.650 -12.560 4.680 1.00 65.13 H new ATOM 0 HA LEU A 226 -9.837 -12.856 2.017 1.00 13.44 H new ATOM 0 HB2 LEU A 226 -11.564 -11.217 3.941 1.00 21.33 H new ATOM 0 HB3 LEU A 226 -12.077 -11.640 2.319 1.00 21.33 H new ATOM 0 HG LEU A 226 -11.233 -13.797 4.254 1.00 42.04 H new ATOM 0 HD11 LEU A 226 -13.605 -14.017 4.960 1.00 2.14 H new ATOM 0 HD12 LEU A 226 -12.921 -12.448 5.446 1.00 2.14 H new ATOM 0 HD13 LEU A 226 -14.008 -12.548 4.040 1.00 2.14 H new ATOM 0 HD21 LEU A 226 -12.822 -15.147 2.911 1.00 31.03 H new ATOM 0 HD22 LEU A 226 -13.201 -13.711 1.930 1.00 31.03 H new ATOM 0 HD23 LEU A 226 -11.564 -14.408 1.892 1.00 31.03 H new ATOM 865 N ALA A 227 -9.635 -9.629 2.766 1.00 33.13 N ATOM 866 CA ALA A 227 -9.498 -8.280 2.255 1.00 31.51 C ATOM 867 C ALA A 227 -8.092 -8.040 1.711 1.00 61.32 C ATOM 868 O ALA A 227 -7.929 -7.228 0.799 1.00 1.22 O ATOM 869 CB ALA A 227 -9.801 -7.281 3.377 1.00 20.11 C ATOM 0 H ALA A 227 -9.716 -9.667 3.782 1.00 33.13 H new ATOM 0 HA ALA A 227 -10.205 -8.143 1.436 1.00 31.51 H new ATOM 0 HB1 ALA A 227 -9.699 -6.265 2.997 1.00 20.11 H new ATOM 0 HB2 ALA A 227 -10.819 -7.434 3.735 1.00 20.11 H new ATOM 0 HB3 ALA A 227 -9.101 -7.433 4.198 1.00 20.11 H new ATOM 875 N GLN A 228 -7.072 -8.696 2.276 1.00 2.11 N ATOM 876 CA GLN A 228 -5.694 -8.537 1.837 1.00 62.54 C ATOM 877 C GLN A 228 -5.407 -9.434 0.631 1.00 60.13 C ATOM 878 O GLN A 228 -4.869 -8.952 -0.366 1.00 43.54 O ATOM 879 CB GLN A 228 -4.734 -8.752 3.024 1.00 74.33 C ATOM 880 CG GLN A 228 -3.623 -7.690 2.992 1.00 13.33 C ATOM 881 CD GLN A 228 -2.906 -7.517 4.331 1.00 64.54 C ATOM 882 OE1 GLN A 228 -1.757 -7.924 4.486 1.00 5.12 O ATOM 883 NE2 GLN A 228 -3.539 -6.869 5.295 1.00 5.01 N ATOM 0 H GLN A 228 -7.186 -9.351 3.050 1.00 2.11 H new ATOM 0 HA GLN A 228 -5.527 -7.517 1.491 1.00 62.54 H new ATOM 0 HB2 GLN A 228 -5.283 -8.690 3.964 1.00 74.33 H new ATOM 0 HB3 GLN A 228 -4.298 -9.750 2.975 1.00 74.33 H new ATOM 0 HG2 GLN A 228 -2.893 -7.963 2.230 1.00 13.33 H new ATOM 0 HG3 GLN A 228 -4.053 -6.734 2.693 1.00 13.33 H new ATOM 0 HE21 GLN A 228 -4.493 -6.539 5.147 1.00 5.01 H new ATOM 0 HE22 GLN A 228 -3.073 -6.699 6.186 1.00 5.01 H new ATOM 892 N LYS A 229 -5.846 -10.700 0.657 1.00 14.24 N ATOM 893 CA LYS A 229 -5.747 -11.590 -0.499 1.00 61.11 C ATOM 894 C LYS A 229 -6.472 -11.025 -1.720 1.00 50.14 C ATOM 895 O LYS A 229 -6.039 -11.287 -2.839 1.00 20.33 O ATOM 896 CB LYS A 229 -6.267 -12.998 -0.179 1.00 43.15 C ATOM 897 CG LYS A 229 -5.189 -13.878 0.474 1.00 65.30 C ATOM 898 CD LYS A 229 -5.582 -15.361 0.484 1.00 2.11 C ATOM 899 CE LYS A 229 -5.638 -15.961 -0.926 1.00 22.04 C ATOM 900 NZ LYS A 229 -6.103 -17.361 -0.936 1.00 4.21 N1+ ATOM 0 H LYS A 229 -6.276 -11.130 1.476 1.00 14.24 H new ATOM 0 HA LYS A 229 -4.686 -11.663 -0.740 1.00 61.11 H new ATOM 0 HB2 LYS A 229 -7.126 -12.924 0.487 1.00 43.15 H new ATOM 0 HB3 LYS A 229 -6.615 -13.473 -1.096 1.00 43.15 H new ATOM 0 HG2 LYS A 229 -4.248 -13.756 -0.063 1.00 65.30 H new ATOM 0 HG3 LYS A 229 -5.018 -13.542 1.497 1.00 65.30 H new ATOM 0 HD2 LYS A 229 -4.865 -15.920 1.085 1.00 2.11 H new ATOM 0 HD3 LYS A 229 -6.555 -15.473 0.962 1.00 2.11 H new ATOM 0 HE2 LYS A 229 -6.302 -15.358 -1.546 1.00 22.04 H new ATOM 0 HE3 LYS A 229 -4.647 -15.909 -1.377 1.00 22.04 H new ATOM 0 HZ1 LYS A 229 -5.795 -17.823 -1.815 1.00 4.21 H new ATOM 0 HZ2 LYS A 229 -5.701 -17.866 -0.121 1.00 4.21 H new ATOM 0 HZ3 LYS A 229 -7.141 -17.382 -0.879 1.00 4.21 H new ATOM 914 N TRP A 230 -7.517 -10.214 -1.539 1.00 13.20 N ATOM 915 CA TRP A 230 -8.137 -9.536 -2.665 1.00 72.33 C ATOM 916 C TRP A 230 -7.134 -8.649 -3.409 1.00 31.00 C ATOM 917 O TRP A 230 -7.056 -8.733 -4.636 1.00 23.12 O ATOM 918 CB TRP A 230 -9.366 -8.734 -2.209 1.00 34.15 C ATOM 919 CG TRP A 230 -9.781 -7.639 -3.145 1.00 61.20 C ATOM 920 CD1 TRP A 230 -10.501 -7.793 -4.277 1.00 14.12 C ATOM 921 CD2 TRP A 230 -9.410 -6.229 -3.103 1.00 53.24 C ATOM 922 NE1 TRP A 230 -10.577 -6.591 -4.948 1.00 24.03 N ATOM 923 CE2 TRP A 230 -9.949 -5.583 -4.250 1.00 13.24 C ATOM 924 CE3 TRP A 230 -8.647 -5.436 -2.223 1.00 35.03 C ATOM 925 CZ2 TRP A 230 -9.766 -4.214 -4.487 1.00 2.33 C ATOM 926 CZ3 TRP A 230 -8.454 -4.060 -2.449 1.00 33.44 C ATOM 927 CH2 TRP A 230 -9.020 -3.444 -3.579 1.00 4.35 C ATOM 0 H TRP A 230 -7.943 -10.016 -0.633 1.00 13.20 H new ATOM 0 HA TRP A 230 -8.475 -10.297 -3.368 1.00 72.33 H new ATOM 0 HB2 TRP A 230 -10.203 -9.420 -2.080 1.00 34.15 H new ATOM 0 HB3 TRP A 230 -9.157 -8.299 -1.232 1.00 34.15 H new ATOM 0 HD1 TRP A 230 -10.950 -8.718 -4.607 1.00 14.12 H new ATOM 0 HE1 TRP A 230 -11.040 -6.464 -5.848 1.00 24.03 H new ATOM 0 HE3 TRP A 230 -8.199 -5.895 -1.354 1.00 35.03 H new ATOM 0 HZ2 TRP A 230 -10.196 -3.753 -5.364 1.00 2.33 H new ATOM 0 HZ3 TRP A 230 -7.870 -3.476 -1.753 1.00 33.44 H new ATOM 0 HH2 TRP A 230 -8.882 -2.386 -3.748 1.00 4.35 H new ATOM 938 N HIS A 231 -6.370 -7.810 -2.697 1.00 41.52 N ATOM 939 CA HIS A 231 -5.426 -6.902 -3.343 1.00 44.11 C ATOM 940 C HIS A 231 -4.312 -7.688 -4.043 1.00 62.42 C ATOM 941 O HIS A 231 -3.809 -7.256 -5.081 1.00 2.10 O ATOM 942 CB HIS A 231 -4.843 -5.905 -2.333 1.00 73.30 C ATOM 943 CG HIS A 231 -3.976 -4.880 -3.021 1.00 1.23 C ATOM 944 ND1 HIS A 231 -2.617 -4.979 -3.220 1.00 54.43 N ATOM 945 CD2 HIS A 231 -4.420 -3.786 -3.713 1.00 54.44 C ATOM 946 CE1 HIS A 231 -2.252 -3.973 -4.031 1.00 44.02 C ATOM 947 NE2 HIS A 231 -3.313 -3.200 -4.346 1.00 72.12 N ATOM 0 H HIS A 231 -6.390 -7.745 -1.679 1.00 41.52 H new ATOM 0 HA HIS A 231 -5.967 -6.333 -4.099 1.00 44.11 H new ATOM 0 HB2 HIS A 231 -5.653 -5.404 -1.803 1.00 73.30 H new ATOM 0 HB3 HIS A 231 -4.256 -6.440 -1.586 1.00 73.30 H new ATOM 0 HD1 HIS A 231 -2.000 -5.688 -2.823 1.00 54.43 H new ATOM 0 HD2 HIS A 231 -5.440 -3.436 -3.763 1.00 54.44 H new ATOM 0 HE1 HIS A 231 -1.245 -3.805 -4.384 1.00 44.02 H new ATOM 955 N LEU A 232 -3.981 -8.872 -3.523 1.00 43.21 N ATOM 956 CA LEU A 232 -3.052 -9.812 -4.138 1.00 54.14 C ATOM 957 C LEU A 232 -3.434 -10.097 -5.587 1.00 63.01 C ATOM 958 O LEU A 232 -2.559 -10.182 -6.445 1.00 33.14 O ATOM 959 CB LEU A 232 -3.067 -11.132 -3.351 1.00 63.34 C ATOM 960 CG LEU A 232 -1.662 -11.708 -3.117 1.00 62.14 C ATOM 961 CD1 LEU A 232 -0.959 -10.965 -1.978 1.00 23.25 C ATOM 962 CD2 LEU A 232 -1.762 -13.196 -2.766 1.00 64.32 C ATOM 0 H LEU A 232 -4.364 -9.209 -2.639 1.00 43.21 H new ATOM 0 HA LEU A 232 -2.057 -9.368 -4.120 1.00 54.14 H new ATOM 0 HB2 LEU A 232 -3.552 -10.969 -2.388 1.00 63.34 H new ATOM 0 HB3 LEU A 232 -3.668 -11.864 -3.891 1.00 63.34 H new ATOM 0 HG LEU A 232 -1.082 -11.584 -4.032 1.00 62.14 H new ATOM 0 HD11 LEU A 232 0.035 -11.387 -1.827 1.00 23.25 H new ATOM 0 HD12 LEU A 232 -0.870 -9.909 -2.233 1.00 23.25 H new ATOM 0 HD13 LEU A 232 -1.541 -11.069 -1.062 1.00 23.25 H new ATOM 0 HD21 LEU A 232 -0.763 -13.599 -2.601 1.00 64.32 H new ATOM 0 HD22 LEU A 232 -2.356 -13.317 -1.860 1.00 64.32 H new ATOM 0 HD23 LEU A 232 -2.239 -13.732 -3.587 1.00 64.32 H new ATOM 974 N ILE A 233 -4.731 -10.274 -5.850 1.00 20.31 N ATOM 975 CA ILE A 233 -5.251 -10.622 -7.168 1.00 12.23 C ATOM 976 C ILE A 233 -5.549 -9.353 -7.967 1.00 33.40 C ATOM 977 O ILE A 233 -5.225 -9.289 -9.156 1.00 73.01 O ATOM 978 CB ILE A 233 -6.477 -11.553 -7.015 1.00 31.24 C ATOM 979 CG1 ILE A 233 -6.170 -12.793 -6.139 1.00 41.21 C ATOM 980 CG2 ILE A 233 -6.999 -12.009 -8.386 1.00 11.11 C ATOM 981 CD1 ILE A 233 -4.849 -13.505 -6.471 1.00 1.50 C ATOM 0 H ILE A 233 -5.458 -10.177 -5.141 1.00 20.31 H new ATOM 0 HA ILE A 233 -4.503 -11.175 -7.736 1.00 12.23 H new ATOM 0 HB ILE A 233 -7.246 -10.967 -6.512 1.00 31.24 H new ATOM 0 HG12 ILE A 233 -6.148 -12.485 -5.094 1.00 41.21 H new ATOM 0 HG13 ILE A 233 -6.987 -13.506 -6.244 1.00 41.21 H new ATOM 0 HG21 ILE A 233 -7.861 -12.662 -8.248 1.00 11.11 H new ATOM 0 HG22 ILE A 233 -7.294 -11.138 -8.971 1.00 11.11 H new ATOM 0 HG23 ILE A 233 -6.213 -12.551 -8.913 1.00 11.11 H new ATOM 0 HD11 ILE A 233 -4.720 -14.360 -5.807 1.00 1.50 H new ATOM 0 HD12 ILE A 233 -4.871 -13.849 -7.505 1.00 1.50 H new ATOM 0 HD13 ILE A 233 -4.018 -12.812 -6.336 1.00 1.50 H new ATOM 993 N LYS A 234 -6.087 -8.312 -7.318 1.00 35.12 N ATOM 994 CA LYS A 234 -6.353 -7.025 -7.944 1.00 65.43 C ATOM 995 C LYS A 234 -7.249 -7.200 -9.178 1.00 71.04 C ATOM 996 O LYS A 234 -8.127 -8.069 -9.203 1.00 11.24 O ATOM 997 CB LYS A 234 -5.014 -6.311 -8.191 1.00 41.01 C ATOM 998 CG LYS A 234 -5.177 -4.815 -7.951 1.00 40.11 C ATOM 999 CD LYS A 234 -3.950 -4.036 -8.426 1.00 52.01 C ATOM 1000 CE LYS A 234 -4.253 -2.546 -8.295 1.00 24.13 C ATOM 1001 NZ LYS A 234 -4.360 -2.127 -6.881 1.00 64.53 N1+ ATOM 0 H LYS A 234 -6.350 -8.348 -6.333 1.00 35.12 H new ATOM 0 HA LYS A 234 -6.929 -6.371 -7.289 1.00 65.43 H new ATOM 0 HB2 LYS A 234 -4.248 -6.714 -7.528 1.00 41.01 H new ATOM 0 HB3 LYS A 234 -4.678 -6.491 -9.212 1.00 41.01 H new ATOM 0 HG2 LYS A 234 -6.063 -4.456 -8.474 1.00 40.11 H new ATOM 0 HG3 LYS A 234 -5.338 -4.631 -6.889 1.00 40.11 H new ATOM 0 HD2 LYS A 234 -3.077 -4.301 -7.829 1.00 52.01 H new ATOM 0 HD3 LYS A 234 -3.717 -4.287 -9.461 1.00 52.01 H new ATOM 0 HE2 LYS A 234 -3.467 -1.971 -8.785 1.00 24.13 H new ATOM 0 HE3 LYS A 234 -5.185 -2.318 -8.813 1.00 24.13 H new ATOM 0 HZ1 LYS A 234 -3.967 -1.170 -6.772 1.00 64.53 H new ATOM 0 HZ2 LYS A 234 -5.360 -2.126 -6.594 1.00 64.53 H new ATOM 0 HZ3 LYS A 234 -3.829 -2.790 -6.281 1.00 64.53 H new ATOM 1015 N GLN A 235 -7.155 -6.275 -10.126 1.00 72.02 N ATOM 1016 CA GLN A 235 -7.771 -6.298 -11.442 1.00 11.35 C ATOM 1017 C GLN A 235 -7.115 -7.392 -12.313 1.00 33.24 C ATOM 1018 O GLN A 235 -6.316 -7.076 -13.197 1.00 30.21 O ATOM 1019 CB GLN A 235 -7.622 -4.907 -12.093 1.00 22.32 C ATOM 1020 CG GLN A 235 -6.242 -4.254 -11.836 1.00 50.13 C ATOM 1021 CD GLN A 235 -5.752 -3.308 -12.925 1.00 24.00 C ATOM 1022 OE1 GLN A 235 -5.483 -2.147 -12.653 1.00 23.03 O ATOM 1023 NE2 GLN A 235 -5.590 -3.789 -14.145 1.00 43.20 N ATOM 0 H GLN A 235 -6.605 -5.428 -9.982 1.00 72.02 H new ATOM 0 HA GLN A 235 -8.832 -6.533 -11.352 1.00 11.35 H new ATOM 0 HB2 GLN A 235 -7.778 -4.998 -13.168 1.00 22.32 H new ATOM 0 HB3 GLN A 235 -8.404 -4.250 -11.712 1.00 22.32 H new ATOM 0 HG2 GLN A 235 -6.289 -3.705 -10.896 1.00 50.13 H new ATOM 0 HG3 GLN A 235 -5.503 -5.045 -11.707 1.00 50.13 H new ATOM 0 HE21 GLN A 235 -5.822 -4.762 -14.345 1.00 43.20 H new ATOM 0 HE22 GLN A 235 -5.233 -3.187 -14.887 1.00 43.20 H new ATOM 1032 N HIS A 236 -7.415 -8.674 -12.092 1.00 22.23 N ATOM 1033 CA HIS A 236 -6.874 -9.770 -12.897 1.00 73.33 C ATOM 1034 C HIS A 236 -7.920 -10.877 -13.040 1.00 63.54 C ATOM 1035 O HIS A 236 -7.700 -12.016 -12.609 1.00 34.42 O ATOM 1036 CB HIS A 236 -5.534 -10.260 -12.323 1.00 2.44 C ATOM 1037 CG HIS A 236 -4.717 -11.082 -13.294 1.00 4.45 C ATOM 1038 ND1 HIS A 236 -5.146 -12.171 -14.030 1.00 31.54 N ATOM 1039 CD2 HIS A 236 -3.403 -10.864 -13.611 1.00 72.22 C ATOM 1040 CE1 HIS A 236 -4.106 -12.611 -14.754 1.00 31.30 C ATOM 1041 NE2 HIS A 236 -3.021 -11.846 -14.533 1.00 63.23 N ATOM 0 H HIS A 236 -8.041 -8.981 -11.348 1.00 22.23 H new ATOM 0 HA HIS A 236 -6.653 -9.414 -13.903 1.00 73.33 H new ATOM 0 HB2 HIS A 236 -4.947 -9.397 -12.009 1.00 2.44 H new ATOM 0 HB3 HIS A 236 -5.728 -10.856 -11.431 1.00 2.44 H new ATOM 0 HD1 HIS A 236 -6.085 -12.569 -14.024 1.00 31.54 H new ATOM 0 HD2 HIS A 236 -2.775 -10.077 -13.221 1.00 72.22 H new ATOM 0 HE1 HIS A 236 -4.135 -13.460 -15.421 1.00 31.30 H new ATOM 1049 N THR A 237 -9.058 -10.503 -13.631 1.00 74.12 N ATOM 1050 CA THR A 237 -10.067 -11.388 -14.197 1.00 64.12 C ATOM 1051 C THR A 237 -10.382 -12.584 -13.299 1.00 22.14 C ATOM 1052 O THR A 237 -10.112 -13.752 -13.602 1.00 63.42 O ATOM 1053 CB THR A 237 -9.738 -11.745 -15.646 1.00 1.11 C ATOM 1054 OG1 THR A 237 -8.387 -12.119 -15.854 1.00 61.40 O ATOM 1055 CG2 THR A 237 -10.000 -10.556 -16.565 1.00 50.03 C ATOM 0 H THR A 237 -9.309 -9.519 -13.730 1.00 74.12 H new ATOM 0 HA THR A 237 -11.008 -10.840 -14.234 1.00 64.12 H new ATOM 0 HB THR A 237 -10.381 -12.596 -15.872 1.00 1.11 H new ATOM 0 HG1 THR A 237 -8.249 -12.335 -16.800 1.00 61.40 H new ATOM 0 HG21 THR A 237 -9.760 -10.830 -17.592 1.00 50.03 H new ATOM 0 HG22 THR A 237 -11.050 -10.272 -16.502 1.00 50.03 H new ATOM 0 HG23 THR A 237 -9.377 -9.715 -16.259 1.00 50.03 H new ATOM 1063 N ALA A 238 -10.936 -12.244 -12.149 1.00 64.25 N ATOM 1064 CA ALA A 238 -11.223 -13.126 -11.035 1.00 34.41 C ATOM 1065 C ALA A 238 -12.479 -12.618 -10.333 1.00 70.53 C ATOM 1066 O ALA A 238 -12.357 -11.800 -9.414 1.00 41.40 O ATOM 1067 CB ALA A 238 -10.030 -13.170 -10.077 1.00 14.52 C ATOM 0 H ALA A 238 -11.215 -11.282 -11.957 1.00 64.25 H new ATOM 0 HA ALA A 238 -11.395 -14.143 -11.389 1.00 34.41 H new ATOM 0 HB1 ALA A 238 -10.257 -13.835 -9.244 1.00 14.52 H new ATOM 0 HB2 ALA A 238 -9.151 -13.538 -10.607 1.00 14.52 H new ATOM 0 HB3 ALA A 238 -9.831 -12.168 -9.697 1.00 14.52 H new ATOM 1073 N PRO A 239 -13.690 -12.995 -10.772 1.00 61.40 N ATOM 1074 CA PRO A 239 -14.907 -12.693 -10.036 1.00 14.44 C ATOM 1075 C PRO A 239 -14.921 -13.522 -8.740 1.00 74.14 C ATOM 1076 O PRO A 239 -15.612 -14.536 -8.664 1.00 42.52 O ATOM 1077 CB PRO A 239 -16.045 -13.016 -11.013 1.00 51.21 C ATOM 1078 CG PRO A 239 -15.471 -14.146 -11.866 1.00 20.31 C ATOM 1079 CD PRO A 239 -13.982 -13.813 -11.944 1.00 1.53 C ATOM 0 HA PRO A 239 -15.000 -11.657 -9.711 1.00 14.44 H new ATOM 0 HB2 PRO A 239 -16.948 -13.328 -10.489 1.00 51.21 H new ATOM 0 HB3 PRO A 239 -16.311 -12.150 -11.620 1.00 51.21 H new ATOM 0 HG2 PRO A 239 -15.641 -15.121 -11.408 1.00 20.31 H new ATOM 0 HG3 PRO A 239 -15.928 -14.174 -12.855 1.00 20.31 H new ATOM 0 HD2 PRO A 239 -13.379 -14.721 -11.946 1.00 1.53 H new ATOM 0 HD3 PRO A 239 -13.750 -13.275 -12.863 1.00 1.53 H new ATOM 1087 N VAL A 240 -14.171 -13.074 -7.730 1.00 55.30 N ATOM 1088 CA VAL A 240 -13.935 -13.671 -6.415 1.00 73.31 C ATOM 1089 C VAL A 240 -13.624 -15.169 -6.495 1.00 73.24 C ATOM 1090 O VAL A 240 -14.533 -16.007 -6.501 1.00 4.41 O ATOM 1091 CB VAL A 240 -15.065 -13.335 -5.421 1.00 1.54 C ATOM 1092 CG1 VAL A 240 -14.604 -13.646 -3.992 1.00 2.11 C ATOM 1093 CG2 VAL A 240 -15.446 -11.851 -5.466 1.00 62.34 C ATOM 0 H VAL A 240 -13.663 -12.195 -7.824 1.00 55.30 H new ATOM 0 HA VAL A 240 -13.032 -13.211 -6.015 1.00 73.31 H new ATOM 0 HB VAL A 240 -15.928 -13.937 -5.705 1.00 1.54 H new ATOM 0 HG11 VAL A 240 -15.404 -13.408 -3.292 1.00 2.11 H new ATOM 0 HG12 VAL A 240 -14.355 -14.704 -3.912 1.00 2.11 H new ATOM 0 HG13 VAL A 240 -13.724 -13.048 -3.755 1.00 2.11 H new ATOM 0 HG21 VAL A 240 -16.245 -11.659 -4.750 1.00 62.34 H new ATOM 0 HG22 VAL A 240 -14.577 -11.244 -5.211 1.00 62.34 H new ATOM 0 HG23 VAL A 240 -15.787 -11.593 -6.469 1.00 62.34 H new ATOM 1103 N SER A 241 -12.330 -15.501 -6.530 1.00 23.54 N ATOM 1104 CA SER A 241 -11.828 -16.860 -6.667 1.00 33.20 C ATOM 1105 C SER A 241 -12.485 -17.795 -5.632 1.00 22.33 C ATOM 1106 O SER A 241 -12.759 -17.357 -4.506 1.00 4.10 O ATOM 1107 CB SER A 241 -10.297 -16.832 -6.527 1.00 73.01 C ATOM 1108 OG SER A 241 -9.735 -15.674 -7.135 1.00 42.03 O ATOM 0 H SER A 241 -11.586 -14.807 -6.461 1.00 23.54 H new ATOM 0 HA SER A 241 -12.086 -17.256 -7.649 1.00 33.20 H new ATOM 0 HB2 SER A 241 -10.027 -16.856 -5.471 1.00 73.01 H new ATOM 0 HB3 SER A 241 -9.873 -17.726 -6.985 1.00 73.01 H new ATOM 0 HG SER A 241 -8.761 -15.687 -7.026 1.00 42.03 H new ATOM 1114 N PRO A 242 -12.756 -19.067 -5.969 1.00 54.33 N ATOM 1115 CA PRO A 242 -13.498 -19.961 -5.095 1.00 33.53 C ATOM 1116 C PRO A 242 -12.644 -20.321 -3.877 1.00 62.22 C ATOM 1117 O PRO A 242 -11.646 -21.034 -4.016 1.00 3.45 O ATOM 1118 CB PRO A 242 -13.874 -21.169 -5.960 1.00 40.15 C ATOM 1119 CG PRO A 242 -12.804 -21.191 -7.053 1.00 23.42 C ATOM 1120 CD PRO A 242 -12.468 -19.711 -7.242 1.00 33.01 C ATOM 0 HA PRO A 242 -14.404 -19.511 -4.688 1.00 33.53 H new ATOM 0 HB2 PRO A 242 -13.870 -22.092 -5.380 1.00 40.15 H new ATOM 0 HB3 PRO A 242 -14.873 -21.062 -6.382 1.00 40.15 H new ATOM 0 HG2 PRO A 242 -11.930 -21.767 -6.749 1.00 23.42 H new ATOM 0 HG3 PRO A 242 -13.177 -21.640 -7.973 1.00 23.42 H new ATOM 0 HD2 PRO A 242 -11.421 -19.581 -7.517 1.00 33.01 H new ATOM 0 HD3 PRO A 242 -13.065 -19.275 -8.043 1.00 33.01 H new ATOM 1128 N HIS A 243 -13.059 -19.865 -2.693 1.00 45.13 N ATOM 1129 CA HIS A 243 -12.392 -20.066 -1.403 1.00 20.32 C ATOM 1130 C HIS A 243 -10.971 -19.477 -1.388 1.00 25.15 C ATOM 1131 O HIS A 243 -10.600 -18.735 -2.300 1.00 54.22 O ATOM 1132 CB HIS A 243 -12.501 -21.544 -0.975 1.00 51.05 C ATOM 1133 CG HIS A 243 -13.883 -22.115 -1.205 1.00 23.30 C ATOM 1134 ND1 HIS A 243 -14.234 -23.002 -2.198 1.00 43.14 N ATOM 1135 CD2 HIS A 243 -15.030 -21.737 -0.563 1.00 22.02 C ATOM 1136 CE1 HIS A 243 -15.571 -23.135 -2.184 1.00 63.04 C ATOM 1137 NE2 HIS A 243 -16.102 -22.362 -1.219 1.00 1.40 N ATOM 0 H HIS A 243 -13.914 -19.317 -2.603 1.00 45.13 H new ATOM 0 HA HIS A 243 -12.910 -19.496 -0.632 1.00 20.32 H new ATOM 0 HB2 HIS A 243 -11.771 -22.134 -1.529 1.00 51.05 H new ATOM 0 HB3 HIS A 243 -12.246 -21.632 0.081 1.00 51.05 H new ATOM 0 HD2 HIS A 243 -15.098 -21.079 0.291 1.00 22.02 H new ATOM 0 HE1 HIS A 243 -16.137 -23.770 -2.850 1.00 63.04 H new ATOM 0 HE2 HIS A 243 -17.093 -22.251 -1.005 1.00 1.40 H new ATOM 1145 N SER A 244 -10.211 -19.739 -0.321 1.00 53.22 N ATOM 1146 CA SER A 244 -8.808 -19.362 -0.167 1.00 22.22 C ATOM 1147 C SER A 244 -8.030 -20.624 0.177 1.00 53.24 C ATOM 1148 O SER A 244 -8.332 -21.684 -0.419 1.00 34.02 O ATOM 1149 CB SER A 244 -8.677 -18.235 0.875 1.00 24.31 C ATOM 1150 OG SER A 244 -8.806 -16.972 0.253 1.00 51.22 O ATOM 0 H SER A 244 -10.573 -20.240 0.490 1.00 53.22 H new ATOM 0 HA SER A 244 -8.388 -18.952 -1.086 1.00 22.22 H new ATOM 0 HB2 SER A 244 -9.443 -18.350 1.642 1.00 24.31 H new ATOM 0 HB3 SER A 244 -7.711 -18.304 1.376 1.00 24.31 H new ATOM 0 HG SER A 244 -8.722 -16.265 0.927 1.00 51.22 H new TER 1156 SER A 244