USER MOD reduce.3.24.130724 H: found=0, std=0, add=1062, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1066 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 14 SER OG : rot 99:sc= 0.719 USER MOD Set 1.2: A 151 GLN : amide:sc= -0.401 K(o=0.32,f=-3.6!) USER MOD Set 2.1: A 95 LYS NZ :NH3+ 159:sc= 0.559 (180deg=0) USER MOD Set 2.2: A 147 TYR OH : rot 180:sc= 0.502 USER MOD Set 3.1: A 127 HIS : no HD1:sc= 0 X(o=-0.077,f=0) USER MOD Set 3.2: A 129 HIS : no HD1:sc= -0.0773 X(o=-0.077,f=0) USER MOD Set 4.1: A 18 THR OG1 : rot -4:sc= 0.736 USER MOD Set 4.2: A 24 TYR OH : rot -70:sc= -2.08! USER MOD Set 4.3: A 36 SER OG : rot -143:sc= -0.198 USER MOD Single : A 10 THR OG1 : rot 162:sc= 0.488 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0.00352 USER MOD Single : A 12 TYR OH : rot 180:sc= -0.0363 USER MOD Single : A 15 LYS NZ :NH3+ 166:sc= 1.04 (180deg=0.879) USER MOD Single : A 16 GLN : amide:sc= -0.0816 X(o=-0.082,f=-0.082) USER MOD Single : A 20 MET CE :methyl 157:sc= -0.0634 (180deg=-1.08) USER MOD Single : A 26 ASN : amide:sc= 0.0576 K(o=0.058,f=-7.6!) USER MOD Single : A 27 SER OG : rot -26:sc= 0.336 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 ASN : amide:sc= -0.0317 X(o=-0.032,f=0) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot -36:sc= 0.0484 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= -0.631 K(o=-0.63,f=-3.5!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 LYS NZ :NH3+ -166:sc= -0.0171 (180deg=-0.191) USER MOD Single : A 55 TYR OH : rot 41:sc= -0.354 USER MOD Single : A 58 MET CE :methyl 135:sc= -1.02 (180deg=-2.68!) USER MOD Single : A 62 THR OG1 : rot 113:sc= 0.433 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 HIS : no HE2:sc= 0.625 K(o=0.63,f=-2!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 SER OG : rot -52:sc= 0.604 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 100 SER OG : rot 180:sc= -0.123 USER MOD Single : A 104 GLN : amide:sc= -0.0556 X(o=-0.056,f=0) USER MOD Single : A 114 GLN : amide:sc= -1.64 K(o=-1.6,f=-0.63) USER MOD Single : A 115 THR OG1 : rot -110:sc= -0.526 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 ASN : amide:sc= -0.0855 X(o=-0.086,f=-0.48) USER MOD Single : A 119 TYR OH : rot -148:sc= 0.465 USER MOD Single : A 120 GLN : amide:sc= -1.06 K(o=-1.1,f=-0.13) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 HIS : no HD1:sc= -0.417 X(o=-0.42,f=-0.29) USER MOD Single : A 140 GLN : amide:sc= -1.63! C(o=-1.6!,f=-5.5!) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 139 N THR A 10 -8.723 2.290 -9.176 1.00 53.43 N ATOM 140 CA THR A 10 -8.194 2.092 -10.525 1.00 51.12 C ATOM 141 C THR A 10 -6.788 1.448 -10.536 1.00 33.51 C ATOM 142 O THR A 10 -6.102 1.385 -9.508 1.00 0.34 O ATOM 143 CB THR A 10 -8.161 3.475 -11.227 1.00 74.44 C ATOM 144 OG1 THR A 10 -7.343 4.387 -10.461 1.00 65.51 O ATOM 145 CG2 THR A 10 -9.581 4.066 -11.385 1.00 21.15 C ATOM 0 HA THR A 10 -8.844 1.395 -11.054 1.00 51.12 H new ATOM 0 HB THR A 10 -7.739 3.337 -12.222 1.00 74.44 H new ATOM 0 HG1 THR A 10 -7.084 5.146 -11.024 1.00 65.51 H new ATOM 0 HG21 THR A 10 -9.519 5.035 -11.881 1.00 21.15 H new ATOM 0 HG22 THR A 10 -10.192 3.390 -11.984 1.00 21.15 H new ATOM 0 HG23 THR A 10 -10.035 4.190 -10.402 1.00 21.15 H new ATOM 153 N THR A 11 -6.379 0.970 -11.718 1.00 63.21 N ATOM 154 CA THR A 11 -5.085 0.308 -11.908 1.00 44.22 C ATOM 155 C THR A 11 -3.939 1.332 -12.056 1.00 24.33 C ATOM 156 O THR A 11 -2.897 1.156 -11.425 1.00 61.23 O ATOM 157 CB THR A 11 -5.135 -0.653 -13.139 1.00 4.42 C ATOM 158 OG1 THR A 11 -5.634 0.053 -14.287 1.00 53.32 O ATOM 159 CG2 THR A 11 -6.022 -1.888 -12.865 1.00 54.44 C ATOM 0 H THR A 11 -6.937 1.032 -12.569 1.00 63.21 H new ATOM 0 HA THR A 11 -4.881 -0.284 -11.016 1.00 44.22 H new ATOM 0 HB THR A 11 -4.120 -1.003 -13.329 1.00 4.42 H new ATOM 0 HG1 THR A 11 -5.662 -0.553 -15.057 1.00 53.32 H new ATOM 0 HG21 THR A 11 -6.031 -2.532 -13.745 1.00 54.44 H new ATOM 0 HG22 THR A 11 -5.623 -2.441 -12.015 1.00 54.44 H new ATOM 0 HG23 THR A 11 -7.038 -1.564 -12.642 1.00 54.44 H new ATOM 167 N TYR A 12 -4.160 2.417 -12.849 1.00 73.21 N ATOM 168 CA TYR A 12 -3.100 3.418 -13.182 1.00 50.14 C ATOM 169 C TYR A 12 -2.468 4.063 -11.921 1.00 24.24 C ATOM 170 O TYR A 12 -1.256 4.323 -11.873 1.00 30.11 O ATOM 171 CB TYR A 12 -3.645 4.518 -14.157 1.00 52.50 C ATOM 172 CG TYR A 12 -4.755 5.441 -13.591 1.00 53.44 C ATOM 173 CD1 TYR A 12 -4.443 6.544 -12.777 1.00 53.23 C ATOM 174 CD2 TYR A 12 -6.106 5.206 -13.855 1.00 63.03 C ATOM 175 CE1 TYR A 12 -5.425 7.355 -12.253 1.00 74.33 C ATOM 176 CE2 TYR A 12 -7.090 6.022 -13.330 1.00 22.11 C ATOM 177 CZ TYR A 12 -6.744 7.091 -12.526 1.00 31.54 C ATOM 178 OH TYR A 12 -7.728 7.895 -11.990 1.00 41.42 O ATOM 0 H TYR A 12 -5.065 2.623 -13.272 1.00 73.21 H new ATOM 0 HA TYR A 12 -2.306 2.869 -13.688 1.00 50.14 H new ATOM 0 HB2 TYR A 12 -2.809 5.141 -14.473 1.00 52.50 H new ATOM 0 HB3 TYR A 12 -4.030 4.025 -15.049 1.00 52.50 H new ATOM 0 HD1 TYR A 12 -3.408 6.761 -12.557 1.00 53.23 H new ATOM 0 HD2 TYR A 12 -6.387 4.372 -14.481 1.00 63.03 H new ATOM 0 HE1 TYR A 12 -5.158 8.196 -11.630 1.00 74.33 H new ATOM 0 HE2 TYR A 12 -8.129 5.824 -13.548 1.00 22.11 H new ATOM 0 HH TYR A 12 -8.607 7.574 -12.281 1.00 41.42 H new ATOM 188 N ALA A 13 -3.314 4.307 -10.909 1.00 35.22 N ATOM 189 CA ALA A 13 -2.913 4.947 -9.651 1.00 14.31 C ATOM 190 C ALA A 13 -2.084 3.987 -8.792 1.00 1.13 C ATOM 191 O ALA A 13 -1.089 4.382 -8.172 1.00 52.23 O ATOM 192 CB ALA A 13 -4.166 5.401 -8.909 1.00 13.34 C ATOM 0 H ALA A 13 -4.304 4.063 -10.943 1.00 35.22 H new ATOM 0 HA ALA A 13 -2.287 5.813 -9.866 1.00 14.31 H new ATOM 0 HB1 ALA A 13 -3.881 5.879 -7.972 1.00 13.34 H new ATOM 0 HB2 ALA A 13 -4.717 6.112 -9.525 1.00 13.34 H new ATOM 0 HB3 ALA A 13 -4.797 4.538 -8.699 1.00 13.34 H new ATOM 198 N SER A 14 -2.512 2.716 -8.796 1.00 31.03 N ATOM 199 CA SER A 14 -1.860 1.635 -8.057 1.00 73.41 C ATOM 200 C SER A 14 -0.524 1.227 -8.712 1.00 32.10 C ATOM 201 O SER A 14 0.387 0.746 -8.026 1.00 72.10 O ATOM 202 CB SER A 14 -2.827 0.445 -7.976 1.00 34.53 C ATOM 203 OG SER A 14 -4.033 0.819 -7.330 1.00 13.25 O ATOM 0 H SER A 14 -3.332 2.410 -9.321 1.00 31.03 H new ATOM 0 HA SER A 14 -1.620 1.980 -7.051 1.00 73.41 H new ATOM 0 HB2 SER A 14 -3.045 0.079 -8.979 1.00 34.53 H new ATOM 0 HB3 SER A 14 -2.357 -0.375 -7.433 1.00 34.53 H new ATOM 0 HG SER A 14 -4.719 1.010 -8.003 1.00 13.25 H new ATOM 209 N LYS A 15 -0.428 1.454 -10.042 1.00 73.11 N ATOM 210 CA LYS A 15 0.792 1.218 -10.830 1.00 23.23 C ATOM 211 C LYS A 15 1.938 2.104 -10.323 1.00 25.40 C ATOM 212 O LYS A 15 2.963 1.605 -9.852 1.00 30.42 O ATOM 213 CB LYS A 15 0.521 1.540 -12.332 1.00 63.34 C ATOM 214 CG LYS A 15 -0.289 0.484 -13.117 1.00 31.25 C ATOM 215 CD LYS A 15 0.529 -0.792 -13.380 1.00 23.14 C ATOM 216 CE LYS A 15 -0.165 -1.784 -14.321 1.00 33.13 C ATOM 217 NZ LYS A 15 0.722 -2.939 -14.638 1.00 60.52 N ATOM 0 H LYS A 15 -1.205 1.809 -10.599 1.00 73.11 H new ATOM 0 HA LYS A 15 1.076 0.171 -10.722 1.00 23.23 H new ATOM 0 HB2 LYS A 15 -0.009 2.491 -12.389 1.00 63.34 H new ATOM 0 HB3 LYS A 15 1.480 1.679 -12.832 1.00 63.34 H new ATOM 0 HG2 LYS A 15 -1.189 0.229 -12.558 1.00 31.25 H new ATOM 0 HG3 LYS A 15 -0.613 0.909 -14.067 1.00 31.25 H new ATOM 0 HD2 LYS A 15 1.493 -0.514 -13.806 1.00 23.14 H new ATOM 0 HD3 LYS A 15 0.731 -1.286 -12.430 1.00 23.14 H new ATOM 0 HE2 LYS A 15 -1.084 -2.144 -13.859 1.00 33.13 H new ATOM 0 HE3 LYS A 15 -0.449 -1.277 -15.243 1.00 33.13 H new ATOM 0 HZ1 LYS A 15 0.160 -3.699 -15.072 1.00 60.52 H new ATOM 0 HZ2 LYS A 15 1.464 -2.635 -15.300 1.00 60.52 H new ATOM 0 HZ3 LYS A 15 1.161 -3.290 -13.763 1.00 60.52 H new ATOM 231 N GLN A 16 1.699 3.423 -10.357 1.00 63.40 N ATOM 232 CA GLN A 16 2.724 4.428 -10.056 1.00 2.05 C ATOM 233 C GLN A 16 3.136 4.378 -8.581 1.00 3.52 C ATOM 234 O GLN A 16 4.323 4.518 -8.267 1.00 52.31 O ATOM 235 CB GLN A 16 2.219 5.835 -10.454 1.00 52.21 C ATOM 236 CG GLN A 16 1.871 5.982 -11.953 1.00 75.24 C ATOM 237 CD GLN A 16 3.029 5.619 -12.885 1.00 53.14 C ATOM 238 OE1 GLN A 16 3.155 4.477 -13.330 1.00 12.34 O ATOM 239 NE2 GLN A 16 3.891 6.581 -13.173 1.00 1.11 N ATOM 0 H GLN A 16 0.790 3.821 -10.594 1.00 63.40 H new ATOM 0 HA GLN A 16 3.614 4.203 -10.644 1.00 2.05 H new ATOM 0 HB2 GLN A 16 1.335 6.072 -9.862 1.00 52.21 H new ATOM 0 HB3 GLN A 16 2.982 6.569 -10.196 1.00 52.21 H new ATOM 0 HG2 GLN A 16 1.016 5.347 -12.184 1.00 75.24 H new ATOM 0 HG3 GLN A 16 1.566 7.010 -12.148 1.00 75.24 H new ATOM 0 HE21 GLN A 16 3.759 7.516 -12.788 1.00 1.11 H new ATOM 0 HE22 GLN A 16 4.688 6.387 -13.780 1.00 1.11 H new ATOM 248 N ALA A 17 2.147 4.135 -7.695 1.00 64.04 N ATOM 249 CA ALA A 17 2.362 4.032 -6.241 1.00 4.21 C ATOM 250 C ALA A 17 3.453 3.000 -5.909 1.00 24.43 C ATOM 251 O ALA A 17 4.409 3.300 -5.178 1.00 54.14 O ATOM 252 CB ALA A 17 1.050 3.659 -5.538 1.00 52.40 C ATOM 0 H ALA A 17 1.174 4.005 -7.972 1.00 64.04 H new ATOM 0 HA ALA A 17 2.698 5.004 -5.881 1.00 4.21 H new ATOM 0 HB1 ALA A 17 1.221 3.586 -4.464 1.00 52.40 H new ATOM 0 HB2 ALA A 17 0.301 4.426 -5.735 1.00 52.40 H new ATOM 0 HB3 ALA A 17 0.695 2.700 -5.915 1.00 52.40 H new ATOM 258 N THR A 18 3.311 1.799 -6.497 1.00 25.01 N ATOM 259 CA THR A 18 4.238 0.690 -6.269 1.00 23.31 C ATOM 260 C THR A 18 5.615 0.970 -6.908 1.00 43.15 C ATOM 261 O THR A 18 6.647 0.615 -6.324 1.00 14.40 O ATOM 262 CB THR A 18 3.643 -0.660 -6.777 1.00 52.04 C ATOM 263 OG1 THR A 18 3.270 -0.559 -8.154 1.00 35.40 O ATOM 264 CG2 THR A 18 2.415 -1.076 -5.960 1.00 2.14 C ATOM 0 H THR A 18 2.552 1.576 -7.140 1.00 25.01 H new ATOM 0 HA THR A 18 4.386 0.601 -5.193 1.00 23.31 H new ATOM 0 HB THR A 18 4.418 -1.417 -6.658 1.00 52.04 H new ATOM 0 HG1 THR A 18 3.403 0.362 -8.462 1.00 35.40 H new ATOM 0 HG21 THR A 18 2.027 -2.020 -6.342 1.00 2.14 H new ATOM 0 HG22 THR A 18 2.697 -1.196 -4.914 1.00 2.14 H new ATOM 0 HG23 THR A 18 1.646 -0.308 -6.042 1.00 2.14 H new ATOM 272 N ASP A 19 5.611 1.646 -8.082 1.00 41.45 N ATOM 273 CA ASP A 19 6.846 2.063 -8.800 1.00 1.33 C ATOM 274 C ASP A 19 7.769 2.937 -7.919 1.00 44.52 C ATOM 275 O ASP A 19 8.988 2.707 -7.895 1.00 44.55 O ATOM 276 CB ASP A 19 6.493 2.809 -10.131 1.00 52.43 C ATOM 277 CG ASP A 19 6.127 1.873 -11.302 1.00 61.35 C ATOM 278 OD1 ASP A 19 5.400 0.887 -11.092 1.00 42.54 O ATOM 279 OD2 ASP A 19 6.553 2.130 -12.448 1.00 61.35 O ATOM 0 H ASP A 19 4.753 1.919 -8.560 1.00 41.45 H new ATOM 0 HA ASP A 19 7.394 1.153 -9.042 1.00 1.33 H new ATOM 0 HB2 ASP A 19 5.658 3.484 -9.945 1.00 52.43 H new ATOM 0 HB3 ASP A 19 7.342 3.426 -10.425 1.00 52.43 H new ATOM 284 N MET A 20 7.192 3.923 -7.191 1.00 1.23 N ATOM 285 CA MET A 20 7.978 4.790 -6.272 1.00 32.11 C ATOM 286 C MET A 20 8.383 4.027 -4.994 1.00 30.22 C ATOM 287 O MET A 20 9.506 4.203 -4.496 1.00 64.23 O ATOM 288 CB MET A 20 7.223 6.107 -5.892 1.00 42.12 C ATOM 289 CG MET A 20 7.229 7.204 -6.982 1.00 14.02 C ATOM 290 SD MET A 20 5.918 7.022 -8.209 1.00 51.10 S ATOM 291 CE MET A 20 4.465 7.447 -7.243 1.00 21.31 C ATOM 0 H MET A 20 6.195 4.139 -7.219 1.00 1.23 H new ATOM 0 HA MET A 20 8.878 5.074 -6.818 1.00 32.11 H new ATOM 0 HB2 MET A 20 6.189 5.859 -5.654 1.00 42.12 H new ATOM 0 HB3 MET A 20 7.670 6.515 -4.985 1.00 42.12 H new ATOM 0 HG2 MET A 20 7.133 8.179 -6.503 1.00 14.02 H new ATOM 0 HG3 MET A 20 8.193 7.192 -7.490 1.00 14.02 H new ATOM 0 HE1 MET A 20 3.668 7.776 -7.910 1.00 21.31 H new ATOM 0 HE2 MET A 20 4.132 6.573 -6.683 1.00 21.31 H new ATOM 0 HE3 MET A 20 4.712 8.250 -6.549 1.00 21.31 H new ATOM 301 N GLY A 21 7.475 3.182 -4.469 1.00 62.34 N ATOM 302 CA GLY A 21 7.764 2.381 -3.274 1.00 11.44 C ATOM 303 C GLY A 21 6.538 2.169 -2.399 1.00 1.10 C ATOM 304 O GLY A 21 6.399 2.798 -1.341 1.00 63.42 O ATOM 0 H GLY A 21 6.541 3.040 -4.854 1.00 62.34 H new ATOM 0 HA2 GLY A 21 8.160 1.412 -3.578 1.00 11.44 H new ATOM 0 HA3 GLY A 21 8.541 2.874 -2.690 1.00 11.44 H new ATOM 308 N ALA A 22 5.644 1.281 -2.854 1.00 40.10 N ATOM 309 CA ALA A 22 4.450 0.860 -2.102 1.00 71.25 C ATOM 310 C ALA A 22 4.254 -0.645 -2.279 1.00 22.33 C ATOM 311 O ALA A 22 4.591 -1.197 -3.331 1.00 54.35 O ATOM 312 CB ALA A 22 3.215 1.634 -2.572 1.00 60.11 C ATOM 0 H ALA A 22 5.729 0.829 -3.764 1.00 40.10 H new ATOM 0 HA ALA A 22 4.590 1.080 -1.044 1.00 71.25 H new ATOM 0 HB1 ALA A 22 2.344 1.308 -2.004 1.00 60.11 H new ATOM 0 HB2 ALA A 22 3.373 2.701 -2.415 1.00 60.11 H new ATOM 0 HB3 ALA A 22 3.049 1.444 -3.632 1.00 60.11 H new ATOM 318 N ILE A 23 3.698 -1.303 -1.256 1.00 73.53 N ATOM 319 CA ILE A 23 3.562 -2.774 -1.219 1.00 64.33 C ATOM 320 C ILE A 23 2.093 -3.181 -1.039 1.00 44.45 C ATOM 321 O ILE A 23 1.300 -2.428 -0.469 1.00 51.31 O ATOM 322 CB ILE A 23 4.484 -3.398 -0.085 1.00 55.13 C ATOM 323 CG1 ILE A 23 4.289 -2.696 1.323 1.00 63.24 C ATOM 324 CG2 ILE A 23 5.974 -3.359 -0.522 1.00 15.32 C ATOM 325 CD1 ILE A 23 3.241 -3.313 2.227 1.00 24.50 C ATOM 0 H ILE A 23 3.328 -0.836 -0.428 1.00 73.53 H new ATOM 0 HA ILE A 23 3.900 -3.174 -2.175 1.00 64.33 H new ATOM 0 HB ILE A 23 4.175 -4.435 0.044 1.00 55.13 H new ATOM 0 HG12 ILE A 23 5.245 -2.704 1.847 1.00 63.24 H new ATOM 0 HG13 ILE A 23 4.027 -1.652 1.154 1.00 63.24 H new ATOM 0 HG21 ILE A 23 6.595 -3.789 0.264 1.00 15.32 H new ATOM 0 HG22 ILE A 23 6.099 -3.934 -1.439 1.00 15.32 H new ATOM 0 HG23 ILE A 23 6.275 -2.326 -0.697 1.00 15.32 H new ATOM 0 HD11 ILE A 23 3.192 -2.754 3.162 1.00 24.50 H new ATOM 0 HD12 ILE A 23 2.270 -3.280 1.733 1.00 24.50 H new ATOM 0 HD13 ILE A 23 3.506 -4.349 2.437 1.00 24.50 H new ATOM 337 N TYR A 24 1.742 -4.374 -1.546 1.00 22.32 N ATOM 338 CA TYR A 24 0.400 -4.950 -1.383 1.00 41.22 C ATOM 339 C TYR A 24 0.416 -5.987 -0.269 1.00 44.15 C ATOM 340 O TYR A 24 1.222 -6.921 -0.296 1.00 33.05 O ATOM 341 CB TYR A 24 -0.084 -5.630 -2.683 1.00 0.12 C ATOM 342 CG TYR A 24 -0.368 -4.667 -3.829 1.00 65.35 C ATOM 343 CD1 TYR A 24 -1.456 -3.789 -3.768 1.00 54.41 C ATOM 344 CD2 TYR A 24 0.418 -4.654 -4.980 1.00 61.22 C ATOM 345 CE1 TYR A 24 -1.735 -2.931 -4.812 1.00 53.43 C ATOM 346 CE2 TYR A 24 0.140 -3.798 -6.014 1.00 73.22 C ATOM 347 CZ TYR A 24 -0.936 -2.944 -5.930 1.00 44.50 C ATOM 348 OH TYR A 24 -1.203 -2.091 -6.968 1.00 74.44 O ATOM 0 H TYR A 24 2.380 -4.964 -2.079 1.00 22.32 H new ATOM 0 HA TYR A 24 -0.281 -4.136 -1.137 1.00 41.22 H new ATOM 0 HB2 TYR A 24 0.670 -6.347 -3.006 1.00 0.12 H new ATOM 0 HB3 TYR A 24 -0.990 -6.196 -2.467 1.00 0.12 H new ATOM 0 HD1 TYR A 24 -2.086 -3.783 -2.891 1.00 54.41 H new ATOM 0 HD2 TYR A 24 1.258 -5.328 -5.058 1.00 61.22 H new ATOM 0 HE1 TYR A 24 -2.575 -2.255 -4.751 1.00 53.43 H new ATOM 0 HE2 TYR A 24 0.765 -3.794 -6.895 1.00 73.22 H new ATOM 0 HH TYR A 24 -2.027 -2.371 -7.418 1.00 74.44 H new ATOM 358 N VAL A 25 -0.489 -5.822 0.689 1.00 2.53 N ATOM 359 CA VAL A 25 -0.752 -6.808 1.737 1.00 44.03 C ATOM 360 C VAL A 25 -2.206 -7.269 1.643 1.00 35.30 C ATOM 361 O VAL A 25 -3.051 -6.565 1.098 1.00 12.11 O ATOM 362 CB VAL A 25 -0.465 -6.231 3.173 1.00 51.43 C ATOM 363 CG1 VAL A 25 1.034 -5.900 3.358 1.00 23.32 C ATOM 364 CG2 VAL A 25 -1.354 -5.004 3.498 1.00 64.52 C ATOM 0 H VAL A 25 -1.071 -4.987 0.763 1.00 2.53 H new ATOM 0 HA VAL A 25 -0.079 -7.652 1.584 1.00 44.03 H new ATOM 0 HB VAL A 25 -0.726 -7.013 3.886 1.00 51.43 H new ATOM 0 HG11 VAL A 25 1.198 -5.504 4.360 1.00 23.32 H new ATOM 0 HG12 VAL A 25 1.626 -6.806 3.225 1.00 23.32 H new ATOM 0 HG13 VAL A 25 1.336 -5.157 2.620 1.00 23.32 H new ATOM 0 HG21 VAL A 25 -1.121 -4.640 4.499 1.00 64.52 H new ATOM 0 HG22 VAL A 25 -1.164 -4.214 2.771 1.00 64.52 H new ATOM 0 HG23 VAL A 25 -2.404 -5.293 3.453 1.00 64.52 H new ATOM 374 N ASN A 26 -2.486 -8.466 2.153 1.00 21.41 N ATOM 375 CA ASN A 26 -3.873 -8.933 2.360 1.00 64.22 C ATOM 376 C ASN A 26 -4.402 -8.354 3.684 1.00 31.53 C ATOM 377 O ASN A 26 -3.703 -7.576 4.353 1.00 71.21 O ATOM 378 CB ASN A 26 -3.928 -10.490 2.348 1.00 3.31 C ATOM 379 CG ASN A 26 -3.085 -11.168 3.437 1.00 30.43 C ATOM 380 OD1 ASN A 26 -2.116 -10.606 3.952 1.00 3.14 O ATOM 381 ND2 ASN A 26 -3.424 -12.401 3.769 1.00 52.44 N ATOM 0 H ASN A 26 -1.774 -9.140 2.435 1.00 21.41 H new ATOM 0 HA ASN A 26 -4.510 -8.583 1.548 1.00 64.22 H new ATOM 0 HB2 ASN A 26 -4.965 -10.805 2.462 1.00 3.31 H new ATOM 0 HB3 ASN A 26 -3.592 -10.845 1.374 1.00 3.31 H new ATOM 0 HD21 ASN A 26 -2.880 -12.910 4.466 1.00 52.44 H new ATOM 0 HD22 ASN A 26 -4.230 -12.844 3.329 1.00 52.44 H new ATOM 388 N SER A 27 -5.631 -8.741 4.076 1.00 43.41 N ATOM 389 CA SER A 27 -6.243 -8.271 5.336 1.00 5.20 C ATOM 390 C SER A 27 -5.560 -8.908 6.588 1.00 34.24 C ATOM 391 O SER A 27 -5.947 -8.616 7.726 1.00 65.21 O ATOM 392 CB SER A 27 -7.771 -8.512 5.314 1.00 64.05 C ATOM 393 OG SER A 27 -8.421 -7.905 6.411 1.00 50.04 O ATOM 0 H SER A 27 -6.220 -9.378 3.539 1.00 43.41 H new ATOM 0 HA SER A 27 -6.077 -7.197 5.416 1.00 5.20 H new ATOM 0 HB2 SER A 27 -8.186 -8.120 4.385 1.00 64.05 H new ATOM 0 HB3 SER A 27 -7.969 -9.584 5.324 1.00 64.05 H new ATOM 0 HG SER A 27 -7.793 -7.821 7.158 1.00 50.04 H new ATOM 399 N LYS A 28 -4.536 -9.775 6.373 1.00 23.45 N ATOM 400 CA LYS A 28 -3.581 -10.154 7.434 1.00 70.51 C ATOM 401 C LYS A 28 -2.507 -9.063 7.575 1.00 30.24 C ATOM 402 O LYS A 28 -2.245 -8.577 8.659 1.00 0.42 O ATOM 403 CB LYS A 28 -2.883 -11.512 7.147 1.00 24.54 C ATOM 404 CG LYS A 28 -3.812 -12.738 7.118 1.00 61.14 C ATOM 405 CD LYS A 28 -4.535 -12.979 8.460 1.00 23.23 C ATOM 406 CE LYS A 28 -5.368 -14.272 8.453 1.00 14.31 C ATOM 407 NZ LYS A 28 -6.144 -14.431 9.712 1.00 20.42 N ATOM 0 H LYS A 28 -4.355 -10.221 5.474 1.00 23.45 H new ATOM 0 HA LYS A 28 -4.151 -10.259 8.357 1.00 70.51 H new ATOM 0 HB2 LYS A 28 -2.371 -11.442 6.187 1.00 24.54 H new ATOM 0 HB3 LYS A 28 -2.117 -11.675 7.906 1.00 24.54 H new ATOM 0 HG2 LYS A 28 -4.554 -12.606 6.331 1.00 61.14 H new ATOM 0 HG3 LYS A 28 -3.229 -13.623 6.862 1.00 61.14 H new ATOM 0 HD2 LYS A 28 -3.799 -13.029 9.262 1.00 23.23 H new ATOM 0 HD3 LYS A 28 -5.186 -12.132 8.676 1.00 23.23 H new ATOM 0 HE2 LYS A 28 -6.051 -14.261 7.603 1.00 14.31 H new ATOM 0 HE3 LYS A 28 -4.708 -15.130 8.321 1.00 14.31 H new ATOM 0 HZ1 LYS A 28 -6.693 -15.313 9.672 1.00 20.42 H new ATOM 0 HZ2 LYS A 28 -5.491 -14.466 10.520 1.00 20.42 H new ATOM 0 HZ3 LYS A 28 -6.791 -13.625 9.825 1.00 20.42 H new ATOM 421 N GLY A 29 -1.912 -8.659 6.459 1.00 4.43 N ATOM 422 CA GLY A 29 -0.774 -7.733 6.486 1.00 52.25 C ATOM 423 C GLY A 29 0.509 -8.407 6.066 1.00 54.22 C ATOM 424 O GLY A 29 1.597 -7.971 6.438 1.00 41.42 O ATOM 0 H GLY A 29 -2.194 -8.954 5.524 1.00 4.43 H new ATOM 0 HA2 GLY A 29 -0.975 -6.891 5.824 1.00 52.25 H new ATOM 0 HA3 GLY A 29 -0.659 -7.328 7.491 1.00 52.25 H new ATOM 428 N ASP A 30 0.369 -9.500 5.309 1.00 20.13 N ATOM 429 CA ASP A 30 1.491 -10.193 4.674 1.00 64.52 C ATOM 430 C ASP A 30 1.626 -9.676 3.241 1.00 3.02 C ATOM 431 O ASP A 30 0.628 -9.621 2.516 1.00 21.54 O ATOM 432 CB ASP A 30 1.247 -11.723 4.664 1.00 42.31 C ATOM 433 CG ASP A 30 2.415 -12.513 4.047 1.00 23.55 C ATOM 434 OD1 ASP A 30 3.379 -12.840 4.772 1.00 64.05 O ATOM 435 OD2 ASP A 30 2.385 -12.803 2.830 1.00 34.51 O ATOM 0 H ASP A 30 -0.536 -9.931 5.119 1.00 20.13 H new ATOM 0 HA ASP A 30 2.407 -10.000 5.232 1.00 64.52 H new ATOM 0 HB2 ASP A 30 1.083 -12.066 5.685 1.00 42.31 H new ATOM 0 HB3 ASP A 30 0.336 -11.937 4.106 1.00 42.31 H new ATOM 440 N ARG A 31 2.848 -9.262 2.865 1.00 61.14 N ATOM 441 CA ARG A 31 3.176 -8.840 1.489 1.00 72.03 C ATOM 442 C ARG A 31 2.863 -9.985 0.476 1.00 14.54 C ATOM 443 O ARG A 31 3.586 -10.985 0.380 1.00 35.22 O ATOM 444 CB ARG A 31 4.662 -8.326 1.390 1.00 31.44 C ATOM 445 CG ARG A 31 5.806 -9.383 1.508 1.00 24.04 C ATOM 446 CD ARG A 31 5.797 -10.189 2.826 1.00 30.15 C ATOM 447 NE ARG A 31 6.834 -11.229 2.852 1.00 70.33 N ATOM 448 CZ ARG A 31 6.626 -12.550 2.734 1.00 53.31 C ATOM 449 NH1 ARG A 31 5.400 -13.055 2.586 1.00 34.43 N ATOM 450 NH2 ARG A 31 7.664 -13.363 2.782 1.00 42.44 N ATOM 0 H ARG A 31 3.639 -9.210 3.507 1.00 61.14 H new ATOM 0 HA ARG A 31 2.542 -7.995 1.221 1.00 72.03 H new ATOM 0 HB2 ARG A 31 4.776 -7.813 0.435 1.00 31.44 H new ATOM 0 HB3 ARG A 31 4.812 -7.581 2.172 1.00 31.44 H new ATOM 0 HG2 ARG A 31 5.730 -10.077 0.671 1.00 24.04 H new ATOM 0 HG3 ARG A 31 6.765 -8.874 1.414 1.00 24.04 H new ATOM 0 HD2 ARG A 31 5.946 -9.510 3.665 1.00 30.15 H new ATOM 0 HD3 ARG A 31 4.819 -10.651 2.960 1.00 30.15 H new ATOM 0 HE ARG A 31 7.799 -10.920 2.970 1.00 70.33 H new ATOM 0 HH11 ARG A 31 4.592 -12.433 2.560 1.00 34.43 H new ATOM 0 HH12 ARG A 31 5.271 -14.063 2.499 1.00 34.43 H new ATOM 0 HH21 ARG A 31 8.603 -12.984 2.907 1.00 42.44 H new ATOM 0 HH22 ARG A 31 7.528 -14.370 2.694 1.00 42.44 H new ATOM 464 N ILE A 32 1.725 -9.852 -0.222 1.00 24.14 N ATOM 465 CA ILE A 32 1.207 -10.897 -1.135 1.00 42.14 C ATOM 466 C ILE A 32 1.923 -10.868 -2.498 1.00 3.40 C ATOM 467 O ILE A 32 2.046 -11.901 -3.165 1.00 53.00 O ATOM 468 CB ILE A 32 -0.348 -10.752 -1.336 1.00 63.32 C ATOM 469 CG1 ILE A 32 -0.720 -9.384 -2.004 1.00 4.14 C ATOM 470 CG2 ILE A 32 -1.079 -10.921 0.014 1.00 44.23 C ATOM 471 CD1 ILE A 32 -2.196 -9.213 -2.339 1.00 51.12 C ATOM 0 H ILE A 32 1.135 -9.021 -0.174 1.00 24.14 H new ATOM 0 HA ILE A 32 1.411 -11.860 -0.667 1.00 42.14 H new ATOM 0 HB ILE A 32 -0.674 -11.542 -2.013 1.00 63.32 H new ATOM 0 HG12 ILE A 32 -0.418 -8.577 -1.337 1.00 4.14 H new ATOM 0 HG13 ILE A 32 -0.140 -9.274 -2.920 1.00 4.14 H new ATOM 0 HG21 ILE A 32 -2.153 -10.819 -0.139 1.00 44.23 H new ATOM 0 HG22 ILE A 32 -0.863 -11.908 0.424 1.00 44.23 H new ATOM 0 HG23 ILE A 32 -0.737 -10.156 0.711 1.00 44.23 H new ATOM 0 HD11 ILE A 32 -2.354 -8.237 -2.797 1.00 51.12 H new ATOM 0 HD12 ILE A 32 -2.504 -9.994 -3.034 1.00 51.12 H new ATOM 0 HD13 ILE A 32 -2.787 -9.286 -1.426 1.00 51.12 H new ATOM 483 N VAL A 33 2.383 -9.673 -2.895 1.00 21.44 N ATOM 484 CA VAL A 33 3.111 -9.463 -4.156 1.00 32.22 C ATOM 485 C VAL A 33 3.984 -8.193 -4.038 1.00 73.10 C ATOM 486 O VAL A 33 3.651 -7.274 -3.273 1.00 2.23 O ATOM 487 CB VAL A 33 2.129 -9.382 -5.391 1.00 2.53 C ATOM 488 CG1 VAL A 33 1.151 -8.188 -5.287 1.00 74.10 C ATOM 489 CG2 VAL A 33 2.896 -9.369 -6.731 1.00 22.22 C ATOM 0 H VAL A 33 2.260 -8.821 -2.348 1.00 21.44 H new ATOM 0 HA VAL A 33 3.759 -10.321 -4.334 1.00 32.22 H new ATOM 0 HB VAL A 33 1.524 -10.289 -5.367 1.00 2.53 H new ATOM 0 HG11 VAL A 33 0.497 -8.176 -6.159 1.00 74.10 H new ATOM 0 HG12 VAL A 33 0.549 -8.288 -4.384 1.00 74.10 H new ATOM 0 HG13 VAL A 33 1.716 -7.257 -5.245 1.00 74.10 H new ATOM 0 HG21 VAL A 33 2.186 -9.313 -7.556 1.00 22.22 H new ATOM 0 HG22 VAL A 33 3.558 -8.504 -6.763 1.00 22.22 H new ATOM 0 HG23 VAL A 33 3.486 -10.281 -6.822 1.00 22.22 H new ATOM 499 N ASN A 34 5.120 -8.191 -4.767 1.00 52.13 N ATOM 500 CA ASN A 34 6.085 -7.073 -4.803 1.00 42.42 C ATOM 501 C ASN A 34 5.408 -5.759 -5.237 1.00 44.11 C ATOM 502 O ASN A 34 5.472 -4.748 -4.523 1.00 24.22 O ATOM 503 CB ASN A 34 7.240 -7.436 -5.786 1.00 45.21 C ATOM 504 CG ASN A 34 8.283 -6.325 -6.037 1.00 12.21 C ATOM 505 OD1 ASN A 34 8.814 -6.200 -7.147 1.00 31.45 O ATOM 506 ND2 ASN A 34 8.613 -5.535 -5.022 1.00 33.33 N ATOM 0 H ASN A 34 5.396 -8.977 -5.355 1.00 52.13 H new ATOM 0 HA ASN A 34 6.483 -6.919 -3.800 1.00 42.42 H new ATOM 0 HB2 ASN A 34 7.758 -8.314 -5.400 1.00 45.21 H new ATOM 0 HB3 ASN A 34 6.802 -7.720 -6.743 1.00 45.21 H new ATOM 0 HD21 ASN A 34 9.317 -4.808 -5.150 1.00 33.33 H new ATOM 0 HD22 ASN A 34 8.163 -5.655 -4.115 1.00 33.33 H new ATOM 513 N GLU A 35 4.749 -5.816 -6.402 1.00 10.55 N ATOM 514 CA GLU A 35 4.158 -4.643 -7.054 1.00 60.43 C ATOM 515 C GLU A 35 3.109 -5.069 -8.091 1.00 23.12 C ATOM 516 O GLU A 35 2.905 -6.264 -8.343 1.00 13.24 O ATOM 517 CB GLU A 35 5.278 -3.800 -7.728 1.00 30.41 C ATOM 518 CG GLU A 35 6.081 -4.557 -8.805 1.00 62.44 C ATOM 519 CD GLU A 35 7.236 -3.732 -9.385 1.00 32.40 C ATOM 520 OE1 GLU A 35 8.143 -3.345 -8.614 1.00 12.02 O ATOM 521 OE2 GLU A 35 7.271 -3.494 -10.610 1.00 11.44 O ATOM 0 H GLU A 35 4.611 -6.683 -6.921 1.00 10.55 H new ATOM 0 HA GLU A 35 3.658 -4.035 -6.300 1.00 60.43 H new ATOM 0 HB2 GLU A 35 4.829 -2.916 -8.181 1.00 30.41 H new ATOM 0 HB3 GLU A 35 5.966 -3.449 -6.958 1.00 30.41 H new ATOM 0 HG2 GLU A 35 6.479 -5.476 -8.374 1.00 62.44 H new ATOM 0 HG3 GLU A 35 5.409 -4.849 -9.612 1.00 62.44 H new ATOM 528 N SER A 36 2.454 -4.068 -8.688 1.00 5.02 N ATOM 529 CA SER A 36 1.460 -4.261 -9.751 1.00 21.25 C ATOM 530 C SER A 36 2.119 -4.182 -11.146 1.00 41.54 C ATOM 531 O SER A 36 1.612 -3.478 -12.025 1.00 51.32 O ATOM 532 CB SER A 36 0.355 -3.184 -9.588 1.00 30.12 C ATOM 533 OG SER A 36 0.912 -1.878 -9.498 1.00 70.11 O ATOM 0 H SER A 36 2.600 -3.088 -8.444 1.00 5.02 H new ATOM 0 HA SER A 36 1.017 -5.253 -9.667 1.00 21.25 H new ATOM 0 HB2 SER A 36 -0.329 -3.232 -10.435 1.00 30.12 H new ATOM 0 HB3 SER A 36 -0.231 -3.394 -8.693 1.00 30.12 H new ATOM 0 HG SER A 36 0.396 -1.346 -8.858 1.00 70.11 H new ATOM 539 N ASN A 37 3.247 -4.910 -11.345 1.00 52.24 N ATOM 540 CA ASN A 37 3.934 -4.989 -12.666 1.00 65.21 C ATOM 541 C ASN A 37 2.938 -5.450 -13.748 1.00 43.04 C ATOM 542 O ASN A 37 2.827 -4.847 -14.823 1.00 34.31 O ATOM 543 CB ASN A 37 5.143 -5.963 -12.623 1.00 21.21 C ATOM 544 CG ASN A 37 5.931 -5.994 -13.949 1.00 32.43 C ATOM 545 OD1 ASN A 37 6.122 -4.970 -14.599 1.00 40.20 O ATOM 546 ND2 ASN A 37 6.362 -7.166 -14.374 1.00 71.10 N ATOM 0 H ASN A 37 3.702 -5.451 -10.610 1.00 52.24 H new ATOM 0 HA ASN A 37 4.308 -3.994 -12.907 1.00 65.21 H new ATOM 0 HB2 ASN A 37 5.812 -5.669 -11.814 1.00 21.21 H new ATOM 0 HB3 ASN A 37 4.787 -6.967 -12.393 1.00 21.21 H new ATOM 0 HD21 ASN A 37 6.865 -7.234 -15.259 1.00 71.10 H new ATOM 0 HD22 ASN A 37 6.192 -8.004 -13.818 1.00 71.10 H new ATOM 553 N VAL A 38 2.210 -6.525 -13.419 1.00 64.00 N ATOM 554 CA VAL A 38 1.026 -6.965 -14.159 1.00 52.35 C ATOM 555 C VAL A 38 -0.126 -7.145 -13.153 1.00 35.21 C ATOM 556 O VAL A 38 0.116 -7.452 -11.978 1.00 13.54 O ATOM 557 CB VAL A 38 1.294 -8.293 -14.973 1.00 73.34 C ATOM 558 CG1 VAL A 38 1.609 -9.492 -14.052 1.00 61.15 C ATOM 559 CG2 VAL A 38 0.123 -8.616 -15.938 1.00 34.24 C ATOM 0 H VAL A 38 2.432 -7.120 -12.620 1.00 64.00 H new ATOM 0 HA VAL A 38 0.761 -6.210 -14.899 1.00 52.35 H new ATOM 0 HB VAL A 38 2.184 -8.115 -15.577 1.00 73.34 H new ATOM 0 HG11 VAL A 38 1.785 -10.380 -14.659 1.00 61.15 H new ATOM 0 HG12 VAL A 38 2.499 -9.273 -13.461 1.00 61.15 H new ATOM 0 HG13 VAL A 38 0.765 -9.670 -13.385 1.00 61.15 H new ATOM 0 HG21 VAL A 38 0.342 -9.535 -16.481 1.00 34.24 H new ATOM 0 HG22 VAL A 38 -0.796 -8.743 -15.366 1.00 34.24 H new ATOM 0 HG23 VAL A 38 -0.001 -7.797 -16.647 1.00 34.24 H new ATOM 569 N TYR A 39 -1.369 -6.932 -13.610 1.00 3.34 N ATOM 570 CA TYR A 39 -2.575 -7.098 -12.776 1.00 24.24 C ATOM 571 C TYR A 39 -2.743 -8.561 -12.319 1.00 71.43 C ATOM 572 O TYR A 39 -3.310 -8.821 -11.265 1.00 21.32 O ATOM 573 CB TYR A 39 -3.838 -6.636 -13.555 1.00 74.15 C ATOM 574 CG TYR A 39 -4.204 -7.504 -14.788 1.00 63.14 C ATOM 575 CD1 TYR A 39 -3.593 -7.294 -16.028 1.00 23.43 C ATOM 576 CD2 TYR A 39 -5.151 -8.537 -14.700 1.00 31.44 C ATOM 577 CE1 TYR A 39 -3.911 -8.073 -17.123 1.00 60.14 C ATOM 578 CE2 TYR A 39 -5.467 -9.311 -15.794 1.00 63.45 C ATOM 579 CZ TYR A 39 -4.848 -9.076 -16.998 1.00 62.21 C ATOM 580 OH TYR A 39 -5.166 -9.851 -18.089 1.00 34.11 O ATOM 0 H TYR A 39 -1.569 -6.640 -14.567 1.00 3.34 H new ATOM 0 HA TYR A 39 -2.455 -6.477 -11.889 1.00 24.24 H new ATOM 0 HB2 TYR A 39 -4.686 -6.629 -12.870 1.00 74.15 H new ATOM 0 HB3 TYR A 39 -3.687 -5.608 -13.885 1.00 74.15 H new ATOM 0 HD1 TYR A 39 -2.859 -6.508 -16.131 1.00 23.43 H new ATOM 0 HD2 TYR A 39 -5.641 -8.728 -13.757 1.00 31.44 H new ATOM 0 HE1 TYR A 39 -3.428 -7.897 -18.073 1.00 60.14 H new ATOM 0 HE2 TYR A 39 -6.199 -10.100 -15.706 1.00 63.45 H new ATOM 0 HH TYR A 39 -5.842 -10.513 -17.834 1.00 34.11 H new ATOM 590 N THR A 40 -2.232 -9.490 -13.150 1.00 44.02 N ATOM 591 CA THR A 40 -2.438 -10.932 -12.998 1.00 50.34 C ATOM 592 C THR A 40 -1.758 -11.479 -11.727 1.00 72.12 C ATOM 593 O THR A 40 -2.376 -12.226 -10.971 1.00 42.32 O ATOM 594 CB THR A 40 -1.909 -11.682 -14.265 1.00 72.23 C ATOM 595 OG1 THR A 40 -2.321 -10.974 -15.449 1.00 71.01 O ATOM 596 CG2 THR A 40 -2.438 -13.123 -14.342 1.00 2.12 C ATOM 0 H THR A 40 -1.656 -9.249 -13.957 1.00 44.02 H new ATOM 0 HA THR A 40 -3.509 -11.107 -12.894 1.00 50.34 H new ATOM 0 HB THR A 40 -0.822 -11.720 -14.195 1.00 72.23 H new ATOM 0 HG1 THR A 40 -3.215 -10.598 -15.311 1.00 71.01 H new ATOM 0 HG21 THR A 40 -2.046 -13.607 -15.237 1.00 2.12 H new ATOM 0 HG22 THR A 40 -2.116 -13.676 -13.460 1.00 2.12 H new ATOM 0 HG23 THR A 40 -3.527 -13.109 -14.384 1.00 2.12 H new ATOM 604 N THR A 41 -0.491 -11.065 -11.482 1.00 60.35 N ATOM 605 CA THR A 41 0.279 -11.505 -10.297 1.00 22.23 C ATOM 606 C THR A 41 -0.358 -10.965 -9.001 1.00 34.34 C ATOM 607 O THR A 41 -0.286 -11.605 -7.952 1.00 14.34 O ATOM 608 CB THR A 41 1.794 -11.081 -10.377 1.00 14.12 C ATOM 609 OG1 THR A 41 2.529 -11.643 -9.276 1.00 10.12 O ATOM 610 CG2 THR A 41 1.995 -9.550 -10.384 1.00 3.33 C ATOM 0 H THR A 41 0.019 -10.426 -12.092 1.00 60.35 H new ATOM 0 HA THR A 41 0.245 -12.594 -10.284 1.00 22.23 H new ATOM 0 HB THR A 41 2.168 -11.468 -11.325 1.00 14.12 H new ATOM 0 HG1 THR A 41 3.469 -11.373 -9.339 1.00 10.12 H new ATOM 0 HG21 THR A 41 3.060 -9.323 -10.440 1.00 3.33 H new ATOM 0 HG22 THR A 41 1.486 -9.120 -11.247 1.00 3.33 H new ATOM 0 HG23 THR A 41 1.581 -9.125 -9.470 1.00 3.33 H new ATOM 618 N PHE A 42 -0.981 -9.778 -9.111 1.00 34.34 N ATOM 619 CA PHE A 42 -1.680 -9.116 -8.006 1.00 63.23 C ATOM 620 C PHE A 42 -3.029 -9.815 -7.710 1.00 61.43 C ATOM 621 O PHE A 42 -3.372 -10.053 -6.546 1.00 74.41 O ATOM 622 CB PHE A 42 -1.890 -7.615 -8.360 1.00 12.22 C ATOM 623 CG PHE A 42 -2.848 -6.879 -7.429 1.00 73.11 C ATOM 624 CD1 PHE A 42 -2.566 -6.765 -6.069 1.00 3.41 C ATOM 625 CD2 PHE A 42 -4.045 -6.337 -7.905 1.00 53.40 C ATOM 626 CE1 PHE A 42 -3.444 -6.135 -5.222 1.00 20.41 C ATOM 627 CE2 PHE A 42 -4.916 -5.700 -7.050 1.00 2.11 C ATOM 628 CZ PHE A 42 -4.613 -5.602 -5.709 1.00 51.44 C ATOM 0 H PHE A 42 -1.011 -9.249 -9.982 1.00 34.34 H new ATOM 0 HA PHE A 42 -1.075 -9.186 -7.102 1.00 63.23 H new ATOM 0 HB2 PHE A 42 -0.924 -7.111 -8.341 1.00 12.22 H new ATOM 0 HB3 PHE A 42 -2.267 -7.544 -9.380 1.00 12.22 H new ATOM 0 HD1 PHE A 42 -1.647 -7.176 -5.677 1.00 3.41 H new ATOM 0 HD2 PHE A 42 -4.289 -6.419 -8.954 1.00 53.40 H new ATOM 0 HE1 PHE A 42 -3.215 -6.058 -4.169 1.00 20.41 H new ATOM 0 HE2 PHE A 42 -5.835 -5.278 -7.429 1.00 2.11 H new ATOM 0 HZ PHE A 42 -5.297 -5.104 -5.038 1.00 51.44 H new ATOM 638 N ARG A 43 -3.768 -10.140 -8.784 1.00 54.24 N ATOM 639 CA ARG A 43 -5.120 -10.712 -8.696 1.00 41.01 C ATOM 640 C ARG A 43 -5.051 -12.122 -8.105 1.00 2.11 C ATOM 641 O ARG A 43 -5.766 -12.437 -7.155 1.00 62.00 O ATOM 642 CB ARG A 43 -5.779 -10.743 -10.101 1.00 52.54 C ATOM 643 CG ARG A 43 -7.254 -11.205 -10.107 1.00 0.01 C ATOM 644 CD ARG A 43 -7.836 -11.272 -11.530 1.00 25.40 C ATOM 645 NE ARG A 43 -9.274 -11.608 -11.544 1.00 5.45 N ATOM 646 CZ ARG A 43 -9.790 -12.844 -11.628 1.00 53.10 C ATOM 647 NH1 ARG A 43 -9.009 -13.912 -11.711 1.00 72.23 N ATOM 648 NH2 ARG A 43 -11.104 -12.996 -11.654 1.00 60.24 N ATOM 0 H ARG A 43 -3.442 -10.012 -9.742 1.00 54.24 H new ATOM 0 HA ARG A 43 -5.730 -10.088 -8.042 1.00 41.01 H new ATOM 0 HB2 ARG A 43 -5.722 -9.746 -10.537 1.00 52.54 H new ATOM 0 HB3 ARG A 43 -5.201 -11.406 -10.745 1.00 52.54 H new ATOM 0 HG2 ARG A 43 -7.327 -12.187 -9.640 1.00 0.01 H new ATOM 0 HG3 ARG A 43 -7.850 -10.520 -9.504 1.00 0.01 H new ATOM 0 HD2 ARG A 43 -7.687 -10.312 -12.024 1.00 25.40 H new ATOM 0 HD3 ARG A 43 -7.288 -12.016 -12.107 1.00 25.40 H new ATOM 0 HE ARG A 43 -9.933 -10.832 -11.485 1.00 5.45 H new ATOM 0 HH11 ARG A 43 -7.995 -13.803 -11.712 1.00 72.23 H new ATOM 0 HH12 ARG A 43 -9.422 -14.842 -11.774 1.00 72.23 H new ATOM 0 HH21 ARG A 43 -11.713 -12.179 -11.610 1.00 60.24 H new ATOM 0 HH22 ARG A 43 -11.508 -13.930 -11.718 1.00 60.24 H new ATOM 662 N ASN A 44 -4.135 -12.935 -8.663 1.00 43.21 N ATOM 663 CA ASN A 44 -3.906 -14.326 -8.226 1.00 23.25 C ATOM 664 C ASN A 44 -3.354 -14.375 -6.794 1.00 2.14 C ATOM 665 O ASN A 44 -3.577 -15.355 -6.079 1.00 14.03 O ATOM 666 CB ASN A 44 -2.952 -15.062 -9.200 1.00 71.10 C ATOM 667 CG ASN A 44 -3.517 -15.194 -10.617 1.00 44.05 C ATOM 668 OD1 ASN A 44 -4.731 -15.274 -10.821 1.00 33.24 O ATOM 669 ND2 ASN A 44 -2.644 -15.229 -11.605 1.00 43.42 N ATOM 0 H ASN A 44 -3.531 -12.645 -9.432 1.00 43.21 H new ATOM 0 HA ASN A 44 -4.869 -14.837 -8.235 1.00 23.25 H new ATOM 0 HB2 ASN A 44 -2.004 -14.526 -9.243 1.00 71.10 H new ATOM 0 HB3 ASN A 44 -2.739 -16.056 -8.807 1.00 71.10 H new ATOM 0 HD21 ASN A 44 -2.967 -15.324 -12.568 1.00 43.42 H new ATOM 0 HD22 ASN A 44 -1.646 -15.161 -11.406 1.00 43.42 H new ATOM 676 N ALA A 45 -2.644 -13.306 -6.387 1.00 0.50 N ATOM 677 CA ALA A 45 -2.160 -13.145 -5.008 1.00 60.44 C ATOM 678 C ALA A 45 -3.341 -13.049 -4.016 1.00 2.43 C ATOM 679 O ALA A 45 -3.306 -13.670 -2.957 1.00 64.00 O ATOM 680 CB ALA A 45 -1.241 -11.920 -4.904 1.00 55.01 C ATOM 0 H ALA A 45 -2.392 -12.534 -7.004 1.00 0.50 H new ATOM 0 HA ALA A 45 -1.579 -14.027 -4.740 1.00 60.44 H new ATOM 0 HB1 ALA A 45 -0.891 -11.814 -3.877 1.00 55.01 H new ATOM 0 HB2 ALA A 45 -0.386 -12.049 -5.568 1.00 55.01 H new ATOM 0 HB3 ALA A 45 -1.793 -11.026 -5.193 1.00 55.01 H new ATOM 686 N ILE A 46 -4.394 -12.291 -4.403 1.00 10.11 N ATOM 687 CA ILE A 46 -5.650 -12.177 -3.618 1.00 15.14 C ATOM 688 C ILE A 46 -6.397 -13.533 -3.604 1.00 33.34 C ATOM 689 O ILE A 46 -6.914 -13.967 -2.567 1.00 74.32 O ATOM 690 CB ILE A 46 -6.607 -11.071 -4.210 1.00 11.11 C ATOM 691 CG1 ILE A 46 -5.873 -9.705 -4.364 1.00 54.40 C ATOM 692 CG2 ILE A 46 -7.878 -10.911 -3.338 1.00 11.44 C ATOM 693 CD1 ILE A 46 -6.715 -8.612 -5.011 1.00 3.45 C ATOM 0 H ILE A 46 -4.399 -11.743 -5.263 1.00 10.11 H new ATOM 0 HA ILE A 46 -5.374 -11.891 -2.603 1.00 15.14 H new ATOM 0 HB ILE A 46 -6.912 -11.401 -5.203 1.00 11.11 H new ATOM 0 HG12 ILE A 46 -5.551 -9.365 -3.379 1.00 54.40 H new ATOM 0 HG13 ILE A 46 -4.972 -9.854 -4.960 1.00 54.40 H new ATOM 0 HG21 ILE A 46 -8.520 -10.143 -3.768 1.00 11.44 H new ATOM 0 HG22 ILE A 46 -8.417 -11.858 -3.304 1.00 11.44 H new ATOM 0 HG23 ILE A 46 -7.592 -10.620 -2.327 1.00 11.44 H new ATOM 0 HD11 ILE A 46 -6.130 -7.695 -5.080 1.00 3.45 H new ATOM 0 HD12 ILE A 46 -7.015 -8.927 -6.010 1.00 3.45 H new ATOM 0 HD13 ILE A 46 -7.603 -8.431 -4.406 1.00 3.45 H new ATOM 705 N LEU A 47 -6.415 -14.192 -4.783 1.00 61.04 N ATOM 706 CA LEU A 47 -7.079 -15.498 -4.986 1.00 14.50 C ATOM 707 C LEU A 47 -6.383 -16.618 -4.186 1.00 64.43 C ATOM 708 O LEU A 47 -6.999 -17.642 -3.879 1.00 13.33 O ATOM 709 CB LEU A 47 -7.101 -15.858 -6.496 1.00 41.41 C ATOM 710 CG LEU A 47 -7.839 -14.853 -7.441 1.00 5.12 C ATOM 711 CD1 LEU A 47 -7.712 -15.275 -8.917 1.00 23.01 C ATOM 712 CD2 LEU A 47 -9.315 -14.669 -7.038 1.00 40.34 C ATOM 0 H LEU A 47 -5.967 -13.831 -5.625 1.00 61.04 H new ATOM 0 HA LEU A 47 -8.102 -15.411 -4.620 1.00 14.50 H new ATOM 0 HB2 LEU A 47 -6.071 -15.955 -6.839 1.00 41.41 H new ATOM 0 HB3 LEU A 47 -7.568 -16.837 -6.607 1.00 41.41 H new ATOM 0 HG LEU A 47 -7.349 -13.886 -7.329 1.00 5.12 H new ATOM 0 HD11 LEU A 47 -8.235 -14.556 -9.547 1.00 23.01 H new ATOM 0 HD12 LEU A 47 -6.659 -15.305 -9.198 1.00 23.01 H new ATOM 0 HD13 LEU A 47 -8.151 -16.263 -9.052 1.00 23.01 H new ATOM 0 HD21 LEU A 47 -9.793 -13.964 -7.718 1.00 40.34 H new ATOM 0 HD22 LEU A 47 -9.829 -15.629 -7.091 1.00 40.34 H new ATOM 0 HD23 LEU A 47 -9.369 -14.284 -6.020 1.00 40.34 H new ATOM 724 N LYS A 48 -5.095 -16.407 -3.874 1.00 63.41 N ATOM 725 CA LYS A 48 -4.278 -17.351 -3.094 1.00 31.11 C ATOM 726 C LYS A 48 -4.540 -17.190 -1.579 1.00 21.55 C ATOM 727 O LYS A 48 -4.390 -18.143 -0.810 1.00 41.44 O ATOM 728 CB LYS A 48 -2.783 -17.112 -3.419 1.00 24.21 C ATOM 729 CG LYS A 48 -1.803 -18.121 -2.781 1.00 1.40 C ATOM 730 CD LYS A 48 -0.348 -17.919 -3.261 1.00 72.42 C ATOM 731 CE LYS A 48 -0.177 -18.153 -4.775 1.00 21.24 C ATOM 732 NZ LYS A 48 1.239 -18.016 -5.203 1.00 2.13 N ATOM 0 H LYS A 48 -4.587 -15.570 -4.158 1.00 63.41 H new ATOM 0 HA LYS A 48 -4.551 -18.371 -3.366 1.00 31.11 H new ATOM 0 HB2 LYS A 48 -2.654 -17.139 -4.501 1.00 24.21 H new ATOM 0 HB3 LYS A 48 -2.512 -16.109 -3.090 1.00 24.21 H new ATOM 0 HG2 LYS A 48 -1.841 -18.023 -1.696 1.00 1.40 H new ATOM 0 HG3 LYS A 48 -2.124 -19.135 -3.021 1.00 1.40 H new ATOM 0 HD2 LYS A 48 -0.028 -16.906 -3.017 1.00 72.42 H new ATOM 0 HD3 LYS A 48 0.306 -18.600 -2.717 1.00 72.42 H new ATOM 0 HE2 LYS A 48 -0.538 -19.149 -5.031 1.00 21.24 H new ATOM 0 HE3 LYS A 48 -0.792 -17.440 -5.324 1.00 21.24 H new ATOM 0 HZ1 LYS A 48 1.310 -18.181 -6.227 1.00 2.13 H new ATOM 0 HZ2 LYS A 48 1.577 -17.057 -4.983 1.00 2.13 H new ATOM 0 HZ3 LYS A 48 1.823 -18.713 -4.699 1.00 2.13 H new ATOM 785 N LYS A 52 -10.079 -12.149 1.003 1.00 73.05 N ATOM 786 CA LYS A 52 -10.373 -11.979 -0.439 1.00 12.23 C ATOM 787 C LYS A 52 -10.400 -10.483 -0.840 1.00 44.44 C ATOM 788 O LYS A 52 -11.209 -10.047 -1.675 1.00 63.21 O ATOM 789 CB LYS A 52 -11.713 -12.722 -0.779 1.00 24.01 C ATOM 790 CG LYS A 52 -11.753 -13.376 -2.176 1.00 11.43 C ATOM 791 CD LYS A 52 -10.560 -14.342 -2.402 1.00 1.45 C ATOM 792 CE LYS A 52 -10.705 -15.175 -3.680 1.00 41.21 C ATOM 793 NZ LYS A 52 -11.892 -16.072 -3.645 1.00 65.23 N ATOM 0 HA LYS A 52 -9.574 -12.427 -1.030 1.00 12.23 H new ATOM 0 HB2 LYS A 52 -11.886 -13.492 -0.027 1.00 24.01 H new ATOM 0 HB3 LYS A 52 -12.536 -12.011 -0.702 1.00 24.01 H new ATOM 0 HG2 LYS A 52 -12.689 -13.922 -2.293 1.00 11.43 H new ATOM 0 HG3 LYS A 52 -11.740 -12.599 -2.940 1.00 11.43 H new ATOM 0 HD2 LYS A 52 -9.636 -13.766 -2.452 1.00 1.45 H new ATOM 0 HD3 LYS A 52 -10.473 -15.011 -1.546 1.00 1.45 H new ATOM 0 HE2 LYS A 52 -10.784 -14.507 -4.538 1.00 41.21 H new ATOM 0 HE3 LYS A 52 -9.806 -15.774 -3.823 1.00 41.21 H new ATOM 0 HZ1 LYS A 52 -11.819 -16.775 -4.408 1.00 65.23 H new ATOM 0 HZ2 LYS A 52 -11.931 -16.560 -2.728 1.00 65.23 H new ATOM 0 HZ3 LYS A 52 -12.757 -15.509 -3.775 1.00 65.23 H new ATOM 807 N VAL A 53 -9.445 -9.728 -0.268 1.00 14.40 N ATOM 808 CA VAL A 53 -9.247 -8.303 -0.530 1.00 2.10 C ATOM 809 C VAL A 53 -7.798 -7.911 -0.172 1.00 45.12 C ATOM 810 O VAL A 53 -7.266 -8.328 0.870 1.00 24.41 O ATOM 811 CB VAL A 53 -10.292 -7.413 0.251 1.00 62.12 C ATOM 812 CG1 VAL A 53 -10.385 -7.773 1.751 1.00 63.31 C ATOM 813 CG2 VAL A 53 -10.021 -5.904 0.052 1.00 75.11 C ATOM 0 H VAL A 53 -8.777 -10.107 0.404 1.00 14.40 H new ATOM 0 HA VAL A 53 -9.413 -8.119 -1.591 1.00 2.10 H new ATOM 0 HB VAL A 53 -11.266 -7.638 -0.184 1.00 62.12 H new ATOM 0 HG11 VAL A 53 -11.119 -7.128 2.235 1.00 63.31 H new ATOM 0 HG12 VAL A 53 -10.690 -8.814 1.857 1.00 63.31 H new ATOM 0 HG13 VAL A 53 -9.412 -7.631 2.220 1.00 63.31 H new ATOM 0 HG21 VAL A 53 -10.761 -5.325 0.605 1.00 75.11 H new ATOM 0 HG22 VAL A 53 -9.023 -5.662 0.419 1.00 75.11 H new ATOM 0 HG23 VAL A 53 -10.087 -5.659 -1.008 1.00 75.11 H new ATOM 823 N ALA A 54 -7.169 -7.119 -1.049 1.00 44.21 N ATOM 824 CA ALA A 54 -5.799 -6.624 -0.865 1.00 55.32 C ATOM 825 C ALA A 54 -5.814 -5.134 -0.510 1.00 60.55 C ATOM 826 O ALA A 54 -6.831 -4.450 -0.676 1.00 0.22 O ATOM 827 CB ALA A 54 -4.974 -6.863 -2.124 1.00 11.41 C ATOM 0 H ALA A 54 -7.602 -6.800 -1.916 1.00 44.21 H new ATOM 0 HA ALA A 54 -5.340 -7.172 -0.042 1.00 55.32 H new ATOM 0 HB1 ALA A 54 -3.961 -6.490 -1.971 1.00 11.41 H new ATOM 0 HB2 ALA A 54 -4.939 -7.931 -2.339 1.00 11.41 H new ATOM 0 HB3 ALA A 54 -5.431 -6.339 -2.963 1.00 11.41 H new ATOM 833 N TYR A 55 -4.663 -4.644 -0.024 1.00 11.43 N ATOM 834 CA TYR A 55 -4.513 -3.304 0.557 1.00 43.11 C ATOM 835 C TYR A 55 -3.129 -2.736 0.208 1.00 14.35 C ATOM 836 O TYR A 55 -2.099 -3.257 0.646 1.00 24.04 O ATOM 837 CB TYR A 55 -4.712 -3.361 2.099 1.00 52.54 C ATOM 838 CG TYR A 55 -6.169 -3.627 2.521 1.00 50.31 C ATOM 839 CD1 TYR A 55 -7.096 -2.580 2.582 1.00 62.23 C ATOM 840 CD2 TYR A 55 -6.624 -4.918 2.825 1.00 72.35 C ATOM 841 CE1 TYR A 55 -8.412 -2.811 2.918 1.00 23.41 C ATOM 842 CE2 TYR A 55 -7.943 -5.145 3.168 1.00 34.03 C ATOM 843 CZ TYR A 55 -8.829 -4.088 3.211 1.00 33.14 C ATOM 844 OH TYR A 55 -10.153 -4.316 3.511 1.00 40.20 O ATOM 0 H TYR A 55 -3.795 -5.180 -0.025 1.00 11.43 H new ATOM 0 HA TYR A 55 -5.275 -2.646 0.139 1.00 43.11 H new ATOM 0 HB2 TYR A 55 -4.074 -4.143 2.511 1.00 52.54 H new ATOM 0 HB3 TYR A 55 -4.382 -2.418 2.535 1.00 52.54 H new ATOM 0 HD1 TYR A 55 -6.774 -1.573 2.362 1.00 62.23 H new ATOM 0 HD2 TYR A 55 -5.933 -5.747 2.791 1.00 72.35 H new ATOM 0 HE1 TYR A 55 -9.114 -1.991 2.951 1.00 23.41 H new ATOM 0 HE2 TYR A 55 -8.279 -6.145 3.401 1.00 34.03 H new ATOM 0 HH TYR A 55 -10.720 -3.785 2.914 1.00 40.20 H new ATOM 854 N LEU A 56 -3.131 -1.684 -0.614 1.00 31.52 N ATOM 855 CA LEU A 56 -1.929 -0.970 -1.036 1.00 14.32 C ATOM 856 C LEU A 56 -1.465 -0.011 0.077 1.00 23.22 C ATOM 857 O LEU A 56 -2.066 1.049 0.290 1.00 74.44 O ATOM 858 CB LEU A 56 -2.229 -0.201 -2.352 1.00 15.33 C ATOM 859 CG LEU A 56 -1.048 0.609 -2.976 1.00 53.22 C ATOM 860 CD1 LEU A 56 0.189 -0.283 -3.207 1.00 62.44 C ATOM 861 CD2 LEU A 56 -1.496 1.290 -4.283 1.00 63.00 C ATOM 0 H LEU A 56 -3.988 -1.299 -1.012 1.00 31.52 H new ATOM 0 HA LEU A 56 -1.122 -1.679 -1.221 1.00 14.32 H new ATOM 0 HB2 LEU A 56 -2.578 -0.919 -3.094 1.00 15.33 H new ATOM 0 HB3 LEU A 56 -3.052 0.488 -2.163 1.00 15.33 H new ATOM 0 HG LEU A 56 -0.758 1.384 -2.267 1.00 53.22 H new ATOM 0 HD11 LEU A 56 0.991 0.313 -3.642 1.00 62.44 H new ATOM 0 HD12 LEU A 56 0.521 -0.699 -2.255 1.00 62.44 H new ATOM 0 HD13 LEU A 56 -0.070 -1.095 -3.887 1.00 62.44 H new ATOM 0 HD21 LEU A 56 -0.662 1.850 -4.706 1.00 63.00 H new ATOM 0 HD22 LEU A 56 -1.822 0.532 -4.995 1.00 63.00 H new ATOM 0 HD23 LEU A 56 -2.322 1.970 -4.074 1.00 63.00 H new ATOM 873 N VAL A 57 -0.409 -0.413 0.799 1.00 34.44 N ATOM 874 CA VAL A 57 0.207 0.408 1.852 1.00 0.14 C ATOM 875 C VAL A 57 1.276 1.311 1.223 1.00 55.22 C ATOM 876 O VAL A 57 2.269 0.816 0.674 1.00 3.22 O ATOM 877 CB VAL A 57 0.867 -0.468 2.985 1.00 32.11 C ATOM 878 CG1 VAL A 57 1.457 0.411 4.125 1.00 33.54 C ATOM 879 CG2 VAL A 57 -0.136 -1.500 3.536 1.00 13.35 C ATOM 0 H VAL A 57 0.043 -1.318 0.669 1.00 34.44 H new ATOM 0 HA VAL A 57 -0.581 1.003 2.313 1.00 0.14 H new ATOM 0 HB VAL A 57 1.699 -1.011 2.537 1.00 32.11 H new ATOM 0 HG11 VAL A 57 1.902 -0.230 4.886 1.00 33.54 H new ATOM 0 HG12 VAL A 57 2.220 1.073 3.716 1.00 33.54 H new ATOM 0 HG13 VAL A 57 0.662 1.007 4.573 1.00 33.54 H new ATOM 0 HG21 VAL A 57 0.343 -2.092 4.316 1.00 13.35 H new ATOM 0 HG22 VAL A 57 -1.000 -0.982 3.952 1.00 13.35 H new ATOM 0 HG23 VAL A 57 -0.461 -2.157 2.730 1.00 13.35 H new ATOM 889 N MET A 58 1.036 2.623 1.279 1.00 12.31 N ATOM 890 CA MET A 58 2.011 3.650 0.886 1.00 74.22 C ATOM 891 C MET A 58 2.009 4.761 1.935 1.00 65.24 C ATOM 892 O MET A 58 1.234 4.722 2.895 1.00 71.10 O ATOM 893 CB MET A 58 1.693 4.225 -0.522 1.00 2.25 C ATOM 894 CG MET A 58 0.357 4.946 -0.650 1.00 15.41 C ATOM 895 SD MET A 58 0.112 5.574 -2.325 1.00 32.15 S ATOM 896 CE MET A 58 -1.610 5.193 -2.596 1.00 31.50 C ATOM 0 H MET A 58 0.149 3.010 1.602 1.00 12.31 H new ATOM 0 HA MET A 58 3.001 3.197 0.832 1.00 74.22 H new ATOM 0 HB2 MET A 58 2.488 4.917 -0.800 1.00 2.25 H new ATOM 0 HB3 MET A 58 1.715 3.407 -1.243 1.00 2.25 H new ATOM 0 HG2 MET A 58 -0.453 4.264 -0.392 1.00 15.41 H new ATOM 0 HG3 MET A 58 0.317 5.772 0.060 1.00 15.41 H new ATOM 0 HE1 MET A 58 -2.106 6.053 -3.046 1.00 31.50 H new ATOM 0 HE2 MET A 58 -1.692 4.336 -3.264 1.00 31.50 H new ATOM 0 HE3 MET A 58 -2.085 4.958 -1.643 1.00 31.50 H new ATOM 906 N ASP A 59 2.888 5.737 1.743 1.00 14.21 N ATOM 907 CA ASP A 59 2.981 6.926 2.602 1.00 1.13 C ATOM 908 C ASP A 59 2.264 8.120 1.950 1.00 75.24 C ATOM 909 O ASP A 59 1.728 8.000 0.839 1.00 22.22 O ATOM 910 CB ASP A 59 4.466 7.240 2.865 1.00 45.23 C ATOM 911 CG ASP A 59 5.283 7.455 1.576 1.00 44.53 C ATOM 912 OD1 ASP A 59 5.778 6.461 0.998 1.00 10.14 O ATOM 913 OD2 ASP A 59 5.436 8.609 1.142 1.00 43.30 O ATOM 0 H ASP A 59 3.566 5.732 0.981 1.00 14.21 H new ATOM 0 HA ASP A 59 2.487 6.731 3.554 1.00 1.13 H new ATOM 0 HB2 ASP A 59 4.537 8.134 3.485 1.00 45.23 H new ATOM 0 HB3 ASP A 59 4.908 6.422 3.434 1.00 45.23 H new ATOM 918 N GLU A 60 2.284 9.275 2.645 1.00 65.42 N ATOM 919 CA GLU A 60 1.575 10.490 2.209 1.00 43.22 C ATOM 920 C GLU A 60 2.271 11.164 1.015 1.00 44.44 C ATOM 921 O GLU A 60 1.597 11.742 0.167 1.00 21.43 O ATOM 922 CB GLU A 60 1.410 11.494 3.379 1.00 63.24 C ATOM 923 CG GLU A 60 0.550 12.728 3.016 1.00 30.23 C ATOM 924 CD GLU A 60 0.192 13.602 4.220 1.00 62.11 C ATOM 925 OE1 GLU A 60 -0.723 13.230 4.979 1.00 63.35 O ATOM 926 OE2 GLU A 60 0.812 14.666 4.403 1.00 44.01 O ATOM 0 H GLU A 60 2.792 9.389 3.522 1.00 65.42 H new ATOM 0 HA GLU A 60 0.584 10.178 1.881 1.00 43.22 H new ATOM 0 HB2 GLU A 60 0.956 10.981 4.226 1.00 63.24 H new ATOM 0 HB3 GLU A 60 2.396 11.830 3.701 1.00 63.24 H new ATOM 0 HG2 GLU A 60 1.088 13.333 2.286 1.00 30.23 H new ATOM 0 HG3 GLU A 60 -0.369 12.391 2.536 1.00 30.23 H new ATOM 933 N ARG A 61 3.608 11.066 0.941 1.00 75.43 N ATOM 934 CA ARG A 61 4.396 11.720 -0.127 1.00 62.54 C ATOM 935 C ARG A 61 4.184 10.994 -1.474 1.00 71.03 C ATOM 936 O ARG A 61 4.105 11.634 -2.530 1.00 55.13 O ATOM 937 CB ARG A 61 5.892 11.747 0.263 1.00 65.34 C ATOM 938 CG ARG A 61 6.184 12.447 1.609 1.00 72.13 C ATOM 939 CD ARG A 61 5.798 13.925 1.612 1.00 3.12 C ATOM 940 NE ARG A 61 6.489 14.669 0.545 1.00 64.23 N ATOM 941 CZ ARG A 61 5.956 15.675 -0.166 1.00 55.13 C ATOM 942 NH1 ARG A 61 4.715 16.091 0.064 1.00 73.31 N ATOM 943 NH2 ARG A 61 6.674 16.255 -1.118 1.00 61.31 N ATOM 0 H ARG A 61 4.171 10.539 1.608 1.00 75.43 H new ATOM 0 HA ARG A 61 4.054 12.748 -0.244 1.00 62.54 H new ATOM 0 HB2 ARG A 61 6.262 10.723 0.311 1.00 65.34 H new ATOM 0 HB3 ARG A 61 6.452 12.251 -0.525 1.00 65.34 H new ATOM 0 HG2 ARG A 61 5.642 11.934 2.403 1.00 72.13 H new ATOM 0 HG3 ARG A 61 7.246 12.354 1.837 1.00 72.13 H new ATOM 0 HD2 ARG A 61 4.720 14.020 1.483 1.00 3.12 H new ATOM 0 HD3 ARG A 61 6.043 14.364 2.579 1.00 3.12 H new ATOM 0 HE ARG A 61 7.448 14.398 0.329 1.00 64.23 H new ATOM 0 HH11 ARG A 61 4.154 15.645 0.789 1.00 73.31 H new ATOM 0 HH12 ARG A 61 4.324 16.857 -0.485 1.00 73.31 H new ATOM 0 HH21 ARG A 61 7.624 15.936 -1.306 1.00 61.31 H new ATOM 0 HH22 ARG A 61 6.276 17.020 -1.663 1.00 61.31 H new ATOM 957 N THR A 62 4.078 9.651 -1.409 1.00 34.44 N ATOM 958 CA THR A 62 3.705 8.805 -2.561 1.00 1.42 C ATOM 959 C THR A 62 2.224 9.038 -2.934 1.00 35.43 C ATOM 960 O THR A 62 1.863 9.028 -4.117 1.00 55.53 O ATOM 961 CB THR A 62 3.974 7.293 -2.247 1.00 32.31 C ATOM 962 OG1 THR A 62 5.357 7.127 -1.905 1.00 42.41 O ATOM 963 CG2 THR A 62 3.640 6.354 -3.427 1.00 31.11 C ATOM 0 H THR A 62 4.249 9.122 -0.554 1.00 34.44 H new ATOM 0 HA THR A 62 4.323 9.084 -3.415 1.00 1.42 H new ATOM 0 HB THR A 62 3.318 7.019 -1.421 1.00 32.31 H new ATOM 0 HG1 THR A 62 5.432 6.867 -0.963 1.00 42.41 H new ATOM 0 HG21 THR A 62 3.849 5.323 -3.142 1.00 31.11 H new ATOM 0 HG22 THR A 62 2.585 6.453 -3.683 1.00 31.11 H new ATOM 0 HG23 THR A 62 4.250 6.623 -4.290 1.00 31.11 H new ATOM 971 N TRP A 63 1.388 9.282 -1.901 1.00 55.23 N ATOM 972 CA TRP A 63 -0.032 9.638 -2.071 1.00 4.03 C ATOM 973 C TRP A 63 -0.186 10.989 -2.792 1.00 72.33 C ATOM 974 O TRP A 63 -1.106 11.143 -3.571 1.00 53.20 O ATOM 975 CB TRP A 63 -0.760 9.655 -0.699 1.00 31.40 C ATOM 976 CG TRP A 63 -2.186 10.179 -0.724 1.00 53.43 C ATOM 977 CD1 TRP A 63 -2.628 11.381 -0.237 1.00 65.11 C ATOM 978 CD2 TRP A 63 -3.345 9.525 -1.273 1.00 14.22 C ATOM 979 NE1 TRP A 63 -3.982 11.495 -0.413 1.00 34.23 N ATOM 980 CE2 TRP A 63 -4.446 10.373 -1.048 1.00 53.14 C ATOM 981 CE3 TRP A 63 -3.561 8.302 -1.915 1.00 20.22 C ATOM 982 CZ2 TRP A 63 -5.737 10.041 -1.450 1.00 31.22 C ATOM 983 CZ3 TRP A 63 -4.842 7.977 -2.318 1.00 34.13 C ATOM 984 CH2 TRP A 63 -5.918 8.840 -2.079 1.00 73.32 C ATOM 0 H TRP A 63 1.682 9.237 -0.925 1.00 55.23 H new ATOM 0 HA TRP A 63 -0.497 8.875 -2.696 1.00 4.03 H new ATOM 0 HB2 TRP A 63 -0.771 8.641 -0.300 1.00 31.40 H new ATOM 0 HB3 TRP A 63 -0.179 10.264 -0.006 1.00 31.40 H new ATOM 0 HD1 TRP A 63 -1.999 12.131 0.220 1.00 65.11 H new ATOM 0 HE1 TRP A 63 -4.553 12.288 -0.119 1.00 34.23 H new ATOM 0 HE3 TRP A 63 -2.740 7.623 -2.093 1.00 20.22 H new ATOM 0 HZ2 TRP A 63 -6.567 10.709 -1.271 1.00 31.22 H new ATOM 0 HZ3 TRP A 63 -5.016 7.040 -2.827 1.00 34.13 H new ATOM 0 HH2 TRP A 63 -6.909 8.552 -2.397 1.00 73.32 H new ATOM 995 N LYS A 64 0.737 11.955 -2.553 1.00 55.13 N ATOM 996 CA LYS A 64 0.712 13.269 -3.244 1.00 64.45 C ATOM 997 C LYS A 64 0.796 13.103 -4.777 1.00 34.31 C ATOM 998 O LYS A 64 0.377 13.987 -5.526 1.00 64.23 O ATOM 999 CB LYS A 64 1.859 14.194 -2.747 1.00 62.31 C ATOM 1000 CG LYS A 64 1.809 14.554 -1.247 1.00 62.51 C ATOM 1001 CD LYS A 64 0.415 15.067 -0.793 1.00 21.52 C ATOM 1002 CE LYS A 64 0.441 15.687 0.609 1.00 34.30 C ATOM 1003 NZ LYS A 64 -0.893 16.199 1.025 1.00 14.44 N ATOM 0 H LYS A 64 1.505 11.849 -1.890 1.00 55.13 H new ATOM 0 HA LYS A 64 -0.241 13.738 -2.999 1.00 64.45 H new ATOM 0 HB2 LYS A 64 2.812 13.709 -2.956 1.00 62.31 H new ATOM 0 HB3 LYS A 64 1.837 15.117 -3.327 1.00 62.31 H new ATOM 0 HG2 LYS A 64 2.076 13.676 -0.659 1.00 62.51 H new ATOM 0 HG3 LYS A 64 2.557 15.318 -1.037 1.00 62.51 H new ATOM 0 HD2 LYS A 64 0.055 15.808 -1.507 1.00 21.52 H new ATOM 0 HD3 LYS A 64 -0.294 14.240 -0.807 1.00 21.52 H new ATOM 0 HE2 LYS A 64 0.782 14.941 1.327 1.00 34.30 H new ATOM 0 HE3 LYS A 64 1.163 16.503 0.630 1.00 34.30 H new ATOM 0 HZ1 LYS A 64 -0.826 16.609 1.979 1.00 14.44 H new ATOM 0 HZ2 LYS A 64 -1.208 16.930 0.356 1.00 14.44 H new ATOM 0 HZ3 LYS A 64 -1.578 15.417 1.032 1.00 14.44 H new ATOM 1017 N LYS A 65 1.358 11.960 -5.219 1.00 72.21 N ATOM 1018 CA LYS A 65 1.422 11.585 -6.637 1.00 41.03 C ATOM 1019 C LYS A 65 0.118 10.892 -7.074 1.00 1.31 C ATOM 1020 O LYS A 65 -0.481 11.279 -8.070 1.00 4.13 O ATOM 1021 CB LYS A 65 2.646 10.661 -6.893 1.00 44.02 C ATOM 1022 CG LYS A 65 4.010 11.248 -6.442 1.00 72.54 C ATOM 1023 CD LYS A 65 4.302 12.638 -7.049 1.00 61.23 C ATOM 1024 CE LYS A 65 4.385 12.629 -8.586 1.00 13.05 C ATOM 1025 NZ LYS A 65 4.375 14.007 -9.136 1.00 72.32 N ATOM 0 H LYS A 65 1.781 11.272 -4.596 1.00 72.21 H new ATOM 0 HA LYS A 65 1.540 12.491 -7.231 1.00 41.03 H new ATOM 0 HB2 LYS A 65 2.484 9.715 -6.375 1.00 44.02 H new ATOM 0 HB3 LYS A 65 2.697 10.436 -7.958 1.00 44.02 H new ATOM 0 HG2 LYS A 65 4.025 11.323 -5.355 1.00 72.54 H new ATOM 0 HG3 LYS A 65 4.806 10.560 -6.725 1.00 72.54 H new ATOM 0 HD2 LYS A 65 3.522 13.333 -6.739 1.00 61.23 H new ATOM 0 HD3 LYS A 65 5.242 13.013 -6.644 1.00 61.23 H new ATOM 0 HE2 LYS A 65 5.294 12.117 -8.900 1.00 13.05 H new ATOM 0 HE3 LYS A 65 3.545 12.066 -8.994 1.00 13.05 H new ATOM 0 HZ1 LYS A 65 4.432 13.967 -10.174 1.00 72.32 H new ATOM 0 HZ2 LYS A 65 3.496 14.486 -8.856 1.00 72.32 H new ATOM 0 HZ3 LYS A 65 5.190 14.535 -8.765 1.00 72.32 H new ATOM 1039 N VAL A 66 -0.314 9.891 -6.288 1.00 72.41 N ATOM 1040 CA VAL A 66 -1.488 9.038 -6.594 1.00 43.20 C ATOM 1041 C VAL A 66 -2.795 9.859 -6.606 1.00 4.05 C ATOM 1042 O VAL A 66 -3.528 9.838 -7.593 1.00 3.22 O ATOM 1043 CB VAL A 66 -1.581 7.869 -5.546 1.00 2.04 C ATOM 1044 CG1 VAL A 66 -2.837 6.989 -5.750 1.00 13.35 C ATOM 1045 CG2 VAL A 66 -0.290 7.019 -5.587 1.00 30.40 C ATOM 0 H VAL A 66 0.144 9.644 -5.411 1.00 72.41 H new ATOM 0 HA VAL A 66 -1.356 8.619 -7.591 1.00 43.20 H new ATOM 0 HB VAL A 66 -1.680 8.319 -4.558 1.00 2.04 H new ATOM 0 HG11 VAL A 66 -2.852 6.198 -5.001 1.00 13.35 H new ATOM 0 HG12 VAL A 66 -3.732 7.603 -5.648 1.00 13.35 H new ATOM 0 HG13 VAL A 66 -2.813 6.546 -6.745 1.00 13.35 H new ATOM 0 HG21 VAL A 66 -0.363 6.212 -4.858 1.00 30.40 H new ATOM 0 HG22 VAL A 66 -0.163 6.597 -6.584 1.00 30.40 H new ATOM 0 HG23 VAL A 66 0.567 7.648 -5.347 1.00 30.40 H new ATOM 1055 N TYR A 67 -3.046 10.562 -5.487 1.00 71.20 N ATOM 1056 CA TYR A 67 -4.144 11.543 -5.317 1.00 52.01 C ATOM 1057 C TYR A 67 -4.231 12.519 -6.502 1.00 72.04 C ATOM 1058 O TYR A 67 -5.323 12.795 -7.009 1.00 34.23 O ATOM 1059 CB TYR A 67 -3.902 12.326 -4.001 1.00 13.21 C ATOM 1060 CG TYR A 67 -4.918 13.422 -3.658 1.00 4.22 C ATOM 1061 CD1 TYR A 67 -6.219 13.105 -3.268 1.00 1.41 C ATOM 1062 CD2 TYR A 67 -4.557 14.777 -3.684 1.00 51.31 C ATOM 1063 CE1 TYR A 67 -7.121 14.089 -2.922 1.00 2.54 C ATOM 1064 CE2 TYR A 67 -5.459 15.761 -3.344 1.00 22.14 C ATOM 1065 CZ TYR A 67 -6.736 15.411 -2.961 1.00 72.31 C ATOM 1066 OH TYR A 67 -7.630 16.391 -2.613 1.00 34.52 O ATOM 0 H TYR A 67 -2.475 10.463 -4.647 1.00 71.20 H new ATOM 0 HA TYR A 67 -5.091 11.005 -5.276 1.00 52.01 H new ATOM 0 HB2 TYR A 67 -3.881 11.611 -3.178 1.00 13.21 H new ATOM 0 HB3 TYR A 67 -2.913 12.782 -4.053 1.00 13.21 H new ATOM 0 HD1 TYR A 67 -6.526 12.070 -3.236 1.00 1.41 H new ATOM 0 HD2 TYR A 67 -3.555 15.054 -3.976 1.00 51.31 H new ATOM 0 HE1 TYR A 67 -8.124 13.824 -2.622 1.00 2.54 H new ATOM 0 HE2 TYR A 67 -5.167 16.800 -3.377 1.00 22.14 H new ATOM 0 HH TYR A 67 -7.201 17.268 -2.693 1.00 34.52 H new ATOM 1076 N ASP A 68 -3.054 13.015 -6.932 1.00 3.15 N ATOM 1077 CA ASP A 68 -2.938 13.936 -8.068 1.00 51.31 C ATOM 1078 C ASP A 68 -3.411 13.258 -9.363 1.00 41.45 C ATOM 1079 O ASP A 68 -4.205 13.838 -10.090 1.00 24.15 O ATOM 1080 CB ASP A 68 -1.484 14.444 -8.223 1.00 73.22 C ATOM 1081 CG ASP A 68 -1.295 15.365 -9.446 1.00 65.40 C ATOM 1082 OD1 ASP A 68 -1.684 16.548 -9.377 1.00 21.20 O ATOM 1083 OD2 ASP A 68 -0.777 14.908 -10.479 1.00 32.31 O ATOM 0 H ASP A 68 -2.160 12.785 -6.498 1.00 3.15 H new ATOM 0 HA ASP A 68 -3.579 14.796 -7.872 1.00 51.31 H new ATOM 0 HB2 ASP A 68 -1.195 14.983 -7.321 1.00 73.22 H new ATOM 0 HB3 ASP A 68 -0.814 13.589 -8.312 1.00 73.22 H new ATOM 1088 N LEU A 69 -2.946 12.012 -9.599 1.00 13.43 N ATOM 1089 CA LEU A 69 -3.260 11.238 -10.821 1.00 31.12 C ATOM 1090 C LEU A 69 -4.748 10.884 -10.905 1.00 11.22 C ATOM 1091 O LEU A 69 -5.294 10.767 -12.006 1.00 13.04 O ATOM 1092 CB LEU A 69 -2.406 9.950 -10.877 1.00 31.30 C ATOM 1093 CG LEU A 69 -0.872 10.178 -11.001 1.00 44.02 C ATOM 1094 CD1 LEU A 69 -0.097 8.861 -10.830 1.00 61.44 C ATOM 1095 CD2 LEU A 69 -0.529 10.875 -12.334 1.00 21.32 C ATOM 0 H LEU A 69 -2.341 11.513 -8.947 1.00 13.43 H new ATOM 0 HA LEU A 69 -3.019 11.868 -11.677 1.00 31.12 H new ATOM 0 HB2 LEU A 69 -2.599 9.366 -9.977 1.00 31.30 H new ATOM 0 HB3 LEU A 69 -2.738 9.350 -11.724 1.00 31.30 H new ATOM 0 HG LEU A 69 -0.560 10.840 -10.193 1.00 44.02 H new ATOM 0 HD11 LEU A 69 0.972 9.053 -10.922 1.00 61.44 H new ATOM 0 HD12 LEU A 69 -0.307 8.440 -9.847 1.00 61.44 H new ATOM 0 HD13 LEU A 69 -0.406 8.154 -11.600 1.00 61.44 H new ATOM 0 HD21 LEU A 69 0.549 11.025 -12.400 1.00 21.32 H new ATOM 0 HD22 LEU A 69 -0.860 10.253 -13.166 1.00 21.32 H new ATOM 0 HD23 LEU A 69 -1.033 11.841 -12.380 1.00 21.32 H new ATOM 1107 N LEU A 70 -5.387 10.695 -9.736 1.00 41.34 N ATOM 1108 CA LEU A 70 -6.836 10.462 -9.647 1.00 65.12 C ATOM 1109 C LEU A 70 -7.587 11.688 -10.205 1.00 13.34 C ATOM 1110 O LEU A 70 -8.383 11.567 -11.144 1.00 32.20 O ATOM 1111 CB LEU A 70 -7.253 10.168 -8.178 1.00 61.53 C ATOM 1112 CG LEU A 70 -6.637 8.885 -7.533 1.00 1.10 C ATOM 1113 CD1 LEU A 70 -7.079 8.728 -6.062 1.00 24.02 C ATOM 1114 CD2 LEU A 70 -6.975 7.626 -8.358 1.00 1.01 C ATOM 0 H LEU A 70 -4.914 10.700 -8.832 1.00 41.34 H new ATOM 0 HA LEU A 70 -7.099 9.589 -10.244 1.00 65.12 H new ATOM 0 HB2 LEU A 70 -6.978 11.026 -7.565 1.00 61.53 H new ATOM 0 HB3 LEU A 70 -8.339 10.084 -8.140 1.00 61.53 H new ATOM 0 HG LEU A 70 -5.553 9.001 -7.539 1.00 1.10 H new ATOM 0 HD11 LEU A 70 -6.633 7.826 -5.642 1.00 24.02 H new ATOM 0 HD12 LEU A 70 -6.751 9.595 -5.489 1.00 24.02 H new ATOM 0 HD13 LEU A 70 -8.165 8.652 -6.015 1.00 24.02 H new ATOM 0 HD21 LEU A 70 -6.532 6.750 -7.883 1.00 1.01 H new ATOM 0 HD22 LEU A 70 -8.057 7.504 -8.408 1.00 1.01 H new ATOM 0 HD23 LEU A 70 -6.575 7.733 -9.366 1.00 1.01 H new ATOM 1126 N ILE A 71 -7.244 12.871 -9.658 1.00 71.40 N ATOM 1127 CA ILE A 71 -7.858 14.163 -10.040 1.00 33.33 C ATOM 1128 C ILE A 71 -7.502 14.546 -11.494 1.00 0.51 C ATOM 1129 O ILE A 71 -8.317 15.126 -12.225 1.00 61.31 O ATOM 1130 CB ILE A 71 -7.418 15.306 -9.046 1.00 65.41 C ATOM 1131 CG1 ILE A 71 -7.731 14.896 -7.574 1.00 3.51 C ATOM 1132 CG2 ILE A 71 -8.094 16.659 -9.392 1.00 21.52 C ATOM 1133 CD1 ILE A 71 -7.269 15.893 -6.531 1.00 34.20 C ATOM 0 H ILE A 71 -6.530 12.960 -8.935 1.00 71.40 H new ATOM 0 HA ILE A 71 -8.940 14.046 -9.978 1.00 33.33 H new ATOM 0 HB ILE A 71 -6.342 15.442 -9.152 1.00 65.41 H new ATOM 0 HG12 ILE A 71 -8.807 14.754 -7.471 1.00 3.51 H new ATOM 0 HG13 ILE A 71 -7.262 13.933 -7.371 1.00 3.51 H new ATOM 0 HG21 ILE A 71 -7.766 17.421 -8.685 1.00 21.52 H new ATOM 0 HG22 ILE A 71 -7.815 16.957 -10.403 1.00 21.52 H new ATOM 0 HG23 ILE A 71 -9.177 16.551 -9.332 1.00 21.52 H new ATOM 0 HD11 ILE A 71 -7.528 15.527 -5.538 1.00 34.20 H new ATOM 0 HD12 ILE A 71 -6.189 16.019 -6.601 1.00 34.20 H new ATOM 0 HD13 ILE A 71 -7.758 16.852 -6.703 1.00 34.20 H new ATOM 1145 N LEU A 72 -6.290 14.159 -11.898 1.00 65.35 N ATOM 1146 CA LEU A 72 -5.733 14.433 -13.227 1.00 34.02 C ATOM 1147 C LEU A 72 -6.520 13.635 -14.286 1.00 72.44 C ATOM 1148 O LEU A 72 -6.843 14.165 -15.353 1.00 13.20 O ATOM 1149 CB LEU A 72 -4.203 14.072 -13.201 1.00 34.33 C ATOM 1150 CG LEU A 72 -3.317 14.283 -14.489 1.00 24.41 C ATOM 1151 CD1 LEU A 72 -3.478 13.141 -15.521 1.00 42.42 C ATOM 1152 CD2 LEU A 72 -3.571 15.667 -15.129 1.00 64.23 C ATOM 0 H LEU A 72 -5.653 13.635 -11.298 1.00 65.35 H new ATOM 0 HA LEU A 72 -5.827 15.486 -13.493 1.00 34.02 H new ATOM 0 HB2 LEU A 72 -3.748 14.650 -12.397 1.00 34.33 H new ATOM 0 HB3 LEU A 72 -4.123 13.021 -12.922 1.00 34.33 H new ATOM 0 HG LEU A 72 -2.279 14.253 -14.158 1.00 24.41 H new ATOM 0 HD11 LEU A 72 -2.845 13.340 -16.386 1.00 42.42 H new ATOM 0 HD12 LEU A 72 -3.184 12.195 -15.066 1.00 42.42 H new ATOM 0 HD13 LEU A 72 -4.519 13.082 -15.839 1.00 42.42 H new ATOM 0 HD21 LEU A 72 -2.944 15.779 -16.014 1.00 64.23 H new ATOM 0 HD22 LEU A 72 -4.620 15.749 -15.414 1.00 64.23 H new ATOM 0 HD23 LEU A 72 -3.328 16.450 -14.411 1.00 64.23 H new ATOM 1164 N HIS A 73 -6.827 12.362 -13.967 1.00 5.01 N ATOM 1165 CA HIS A 73 -7.413 11.418 -14.939 1.00 34.33 C ATOM 1166 C HIS A 73 -8.942 11.601 -15.019 1.00 73.52 C ATOM 1167 O HIS A 73 -9.445 12.070 -16.050 1.00 41.21 O ATOM 1168 CB HIS A 73 -7.041 9.959 -14.530 1.00 34.32 C ATOM 1169 CG HIS A 73 -6.740 9.034 -15.668 1.00 72.52 C ATOM 1170 ND1 HIS A 73 -7.703 8.342 -16.359 1.00 21.31 N ATOM 1171 CD2 HIS A 73 -5.559 8.676 -16.211 1.00 23.31 C ATOM 1172 CE1 HIS A 73 -7.132 7.598 -17.273 1.00 73.34 C ATOM 1173 NE2 HIS A 73 -5.831 7.786 -17.207 1.00 41.42 N ATOM 0 H HIS A 73 -6.678 11.963 -13.040 1.00 5.01 H new ATOM 0 HA HIS A 73 -7.007 11.620 -15.930 1.00 34.33 H new ATOM 0 HB2 HIS A 73 -6.173 9.994 -13.872 1.00 34.32 H new ATOM 0 HB3 HIS A 73 -7.864 9.540 -13.951 1.00 34.32 H new ATOM 0 HD1 HIS A 73 -8.707 8.398 -16.187 1.00 21.31 H new ATOM 0 HD2 HIS A 73 -4.582 9.028 -15.913 1.00 23.31 H new ATOM 0 HE1 HIS A 73 -7.642 6.942 -17.963 1.00 73.34 H new ATOM 1182 N ASP A 74 -9.659 11.288 -13.896 1.00 65.41 N ATOM 1183 CA ASP A 74 -11.145 11.350 -13.815 1.00 64.43 C ATOM 1184 C ASP A 74 -11.649 10.900 -12.416 1.00 54.20 C ATOM 1185 O ASP A 74 -12.341 9.884 -12.274 1.00 44.04 O ATOM 1186 CB ASP A 74 -11.844 10.523 -14.965 1.00 34.05 C ATOM 1187 CG ASP A 74 -11.560 9.003 -14.953 1.00 62.45 C ATOM 1188 OD1 ASP A 74 -10.433 8.600 -15.270 1.00 72.20 O ATOM 1189 OD2 ASP A 74 -12.465 8.210 -14.627 1.00 53.30 O ATOM 0 H ASP A 74 -9.219 10.987 -13.026 1.00 65.41 H new ATOM 0 HA ASP A 74 -11.427 12.393 -13.959 1.00 64.43 H new ATOM 0 HB2 ASP A 74 -12.921 10.675 -14.896 1.00 34.05 H new ATOM 0 HB3 ASP A 74 -11.526 10.928 -15.926 1.00 34.05 H new ATOM 1194 N PHE A 75 -11.302 11.666 -11.368 1.00 43.11 N ATOM 1195 CA PHE A 75 -11.722 11.338 -9.986 1.00 62.52 C ATOM 1196 C PHE A 75 -11.640 12.613 -9.129 1.00 62.41 C ATOM 1197 O PHE A 75 -10.550 13.038 -8.744 1.00 42.54 O ATOM 1198 CB PHE A 75 -10.821 10.193 -9.411 1.00 70.45 C ATOM 1199 CG PHE A 75 -11.401 9.345 -8.270 1.00 22.25 C ATOM 1200 CD1 PHE A 75 -12.627 9.636 -7.664 1.00 4.32 C ATOM 1201 CD2 PHE A 75 -10.708 8.215 -7.820 1.00 2.14 C ATOM 1202 CE1 PHE A 75 -13.124 8.834 -6.652 1.00 61.54 C ATOM 1203 CE2 PHE A 75 -11.211 7.427 -6.810 1.00 13.03 C ATOM 1204 CZ PHE A 75 -12.421 7.734 -6.229 1.00 34.14 C ATOM 0 H PHE A 75 -10.736 12.511 -11.445 1.00 43.11 H new ATOM 0 HA PHE A 75 -12.751 10.978 -9.976 1.00 62.52 H new ATOM 0 HB2 PHE A 75 -10.563 9.523 -10.231 1.00 70.45 H new ATOM 0 HB3 PHE A 75 -9.891 10.640 -9.060 1.00 70.45 H new ATOM 0 HD1 PHE A 75 -13.192 10.497 -7.990 1.00 4.32 H new ATOM 0 HD2 PHE A 75 -9.762 7.957 -8.273 1.00 2.14 H new ATOM 0 HE1 PHE A 75 -14.071 9.075 -6.192 1.00 61.54 H new ATOM 0 HE2 PHE A 75 -10.655 6.565 -6.472 1.00 13.03 H new ATOM 0 HZ PHE A 75 -12.816 7.110 -5.441 1.00 34.14 H new ATOM 1214 N THR A 76 -12.802 13.233 -8.882 1.00 75.42 N ATOM 1215 CA THR A 76 -12.925 14.501 -8.164 1.00 61.22 C ATOM 1216 C THR A 76 -12.416 14.367 -6.705 1.00 35.31 C ATOM 1217 O THR A 76 -12.712 13.357 -6.058 1.00 65.44 O ATOM 1218 CB THR A 76 -14.426 14.942 -8.200 1.00 3.21 C ATOM 1219 OG1 THR A 76 -14.851 15.076 -9.568 1.00 50.20 O ATOM 1220 CG2 THR A 76 -14.697 16.250 -7.460 1.00 65.24 C ATOM 0 H THR A 76 -13.700 12.855 -9.184 1.00 75.42 H new ATOM 0 HA THR A 76 -12.308 15.259 -8.646 1.00 61.22 H new ATOM 0 HB THR A 76 -14.991 14.166 -7.685 1.00 3.21 H new ATOM 0 HG1 THR A 76 -15.791 15.350 -9.593 1.00 50.20 H new ATOM 0 HG21 THR A 76 -15.757 16.493 -7.527 1.00 65.24 H new ATOM 0 HG22 THR A 76 -14.415 16.141 -6.413 1.00 65.24 H new ATOM 0 HG23 THR A 76 -14.112 17.051 -7.911 1.00 65.24 H new ATOM 1228 N PRO A 77 -11.635 15.386 -6.173 1.00 24.00 N ATOM 1229 CA PRO A 77 -11.113 15.381 -4.770 1.00 22.23 C ATOM 1230 C PRO A 77 -12.212 15.133 -3.724 1.00 21.13 C ATOM 1231 O PRO A 77 -11.947 14.530 -2.684 1.00 2.24 O ATOM 1232 CB PRO A 77 -10.479 16.794 -4.608 1.00 75.33 C ATOM 1233 CG PRO A 77 -11.015 17.599 -5.757 1.00 61.00 C ATOM 1234 CD PRO A 77 -11.185 16.614 -6.888 1.00 4.04 C ATOM 0 HA PRO A 77 -10.403 14.571 -4.605 1.00 22.23 H new ATOM 0 HB2 PRO A 77 -10.752 17.241 -3.652 1.00 75.33 H new ATOM 0 HB3 PRO A 77 -9.391 16.743 -4.636 1.00 75.33 H new ATOM 0 HG2 PRO A 77 -11.964 18.069 -5.499 1.00 61.00 H new ATOM 0 HG3 PRO A 77 -10.327 18.399 -6.032 1.00 61.00 H new ATOM 0 HD2 PRO A 77 -11.921 16.954 -7.616 1.00 4.04 H new ATOM 0 HD3 PRO A 77 -10.253 16.451 -7.429 1.00 4.04 H new ATOM 1242 N GLU A 78 -13.438 15.592 -4.040 1.00 72.11 N ATOM 1243 CA GLU A 78 -14.627 15.389 -3.198 1.00 12.10 C ATOM 1244 C GLU A 78 -14.996 13.898 -3.110 1.00 4.53 C ATOM 1245 O GLU A 78 -15.234 13.374 -2.016 1.00 2.02 O ATOM 1246 CB GLU A 78 -15.809 16.228 -3.738 1.00 22.01 C ATOM 1247 CG GLU A 78 -15.519 17.739 -3.739 1.00 72.20 C ATOM 1248 CD GLU A 78 -16.671 18.576 -4.294 1.00 73.44 C ATOM 1249 OE1 GLU A 78 -16.744 18.762 -5.525 1.00 43.15 O ATOM 1250 OE2 GLU A 78 -17.507 19.051 -3.503 1.00 62.31 O ATOM 0 H GLU A 78 -13.630 16.117 -4.893 1.00 72.11 H new ATOM 0 HA GLU A 78 -14.398 15.727 -2.187 1.00 12.10 H new ATOM 0 HB2 GLU A 78 -16.042 15.907 -4.753 1.00 22.01 H new ATOM 0 HB3 GLU A 78 -16.693 16.033 -3.131 1.00 22.01 H new ATOM 0 HG2 GLU A 78 -15.303 18.061 -2.720 1.00 72.20 H new ATOM 0 HG3 GLU A 78 -14.623 17.929 -4.330 1.00 72.20 H new ATOM 1257 N GLU A 79 -14.999 13.215 -4.266 1.00 44.44 N ATOM 1258 CA GLU A 79 -15.289 11.769 -4.342 1.00 3.23 C ATOM 1259 C GLU A 79 -14.209 10.941 -3.612 1.00 40.44 C ATOM 1260 O GLU A 79 -14.500 9.871 -3.081 1.00 71.51 O ATOM 1261 CB GLU A 79 -15.378 11.304 -5.808 1.00 34.42 C ATOM 1262 CG GLU A 79 -16.437 12.006 -6.668 1.00 73.31 C ATOM 1263 CD GLU A 79 -16.438 11.472 -8.111 1.00 25.02 C ATOM 1264 OE1 GLU A 79 -15.576 11.895 -8.909 1.00 43.44 O ATOM 1265 OE2 GLU A 79 -17.273 10.602 -8.442 1.00 1.35 O ATOM 0 H GLU A 79 -14.802 13.644 -5.170 1.00 44.44 H new ATOM 0 HA GLU A 79 -16.249 11.607 -3.852 1.00 3.23 H new ATOM 0 HB2 GLU A 79 -14.404 11.449 -6.275 1.00 34.42 H new ATOM 0 HB3 GLU A 79 -15.581 10.233 -5.818 1.00 34.42 H new ATOM 0 HG2 GLU A 79 -17.422 11.860 -6.225 1.00 73.31 H new ATOM 0 HG3 GLU A 79 -16.247 13.079 -6.676 1.00 73.31 H new ATOM 1272 N ILE A 80 -12.967 11.452 -3.603 1.00 64.14 N ATOM 1273 CA ILE A 80 -11.834 10.811 -2.911 1.00 71.43 C ATOM 1274 C ILE A 80 -11.992 10.949 -1.377 1.00 42.31 C ATOM 1275 O ILE A 80 -11.975 9.947 -0.644 1.00 62.14 O ATOM 1276 CB ILE A 80 -10.464 11.437 -3.391 1.00 44.33 C ATOM 1277 CG1 ILE A 80 -10.328 11.312 -4.945 1.00 13.43 C ATOM 1278 CG2 ILE A 80 -9.254 10.785 -2.674 1.00 1.14 C ATOM 1279 CD1 ILE A 80 -9.121 12.024 -5.535 1.00 13.05 C ATOM 0 H ILE A 80 -12.719 12.321 -4.075 1.00 64.14 H new ATOM 0 HA ILE A 80 -11.829 9.750 -3.162 1.00 71.43 H new ATOM 0 HB ILE A 80 -10.465 12.494 -3.124 1.00 44.33 H new ATOM 0 HG12 ILE A 80 -10.274 10.256 -5.208 1.00 13.43 H new ATOM 0 HG13 ILE A 80 -11.231 11.710 -5.409 1.00 13.43 H new ATOM 0 HG21 ILE A 80 -8.331 11.242 -3.030 1.00 1.14 H new ATOM 0 HG22 ILE A 80 -9.343 10.938 -1.598 1.00 1.14 H new ATOM 0 HG23 ILE A 80 -9.237 9.716 -2.888 1.00 1.14 H new ATOM 0 HD11 ILE A 80 -9.108 11.883 -6.616 1.00 13.05 H new ATOM 0 HD12 ILE A 80 -9.180 13.089 -5.308 1.00 13.05 H new ATOM 0 HD13 ILE A 80 -8.209 11.611 -5.104 1.00 13.05 H new ATOM 1291 N LYS A 81 -12.219 12.198 -0.920 1.00 45.10 N ATOM 1292 CA LYS A 81 -12.284 12.539 0.520 1.00 73.12 C ATOM 1293 C LYS A 81 -13.554 11.976 1.196 1.00 30.13 C ATOM 1294 O LYS A 81 -13.591 11.838 2.420 1.00 1.52 O ATOM 1295 CB LYS A 81 -12.169 14.074 0.719 1.00 72.42 C ATOM 1296 CG LYS A 81 -13.397 14.890 0.251 1.00 1.42 C ATOM 1297 CD LYS A 81 -13.085 16.390 0.016 1.00 54.12 C ATOM 1298 CE LYS A 81 -12.666 17.148 1.292 1.00 32.15 C ATOM 1299 NZ LYS A 81 -13.791 17.302 2.249 1.00 75.42 N ATOM 0 H LYS A 81 -12.362 12.998 -1.536 1.00 45.10 H new ATOM 0 HA LYS A 81 -11.435 12.063 1.010 1.00 73.12 H new ATOM 0 HB2 LYS A 81 -12.000 14.276 1.777 1.00 72.42 H new ATOM 0 HB3 LYS A 81 -11.290 14.430 0.182 1.00 72.42 H new ATOM 0 HG2 LYS A 81 -13.781 14.457 -0.673 1.00 1.42 H new ATOM 0 HG3 LYS A 81 -14.187 14.803 0.997 1.00 1.42 H new ATOM 0 HD2 LYS A 81 -12.288 16.474 -0.723 1.00 54.12 H new ATOM 0 HD3 LYS A 81 -13.966 16.872 -0.409 1.00 54.12 H new ATOM 0 HE2 LYS A 81 -11.849 16.614 1.778 1.00 32.15 H new ATOM 0 HE3 LYS A 81 -12.286 18.133 1.019 1.00 32.15 H new ATOM 0 HZ1 LYS A 81 -13.463 17.817 3.091 1.00 75.42 H new ATOM 0 HZ2 LYS A 81 -14.562 17.834 1.796 1.00 75.42 H new ATOM 0 HZ3 LYS A 81 -14.138 16.363 2.531 1.00 75.42 H new ATOM 1313 N SER A 82 -14.581 11.642 0.377 1.00 23.33 N ATOM 1314 CA SER A 82 -15.871 11.106 0.863 1.00 71.34 C ATOM 1315 C SER A 82 -15.732 9.675 1.431 1.00 4.52 C ATOM 1316 O SER A 82 -16.548 9.254 2.255 1.00 75.32 O ATOM 1317 CB SER A 82 -16.926 11.142 -0.269 1.00 42.21 C ATOM 1318 OG SER A 82 -16.611 10.235 -1.310 1.00 33.54 O ATOM 0 H SER A 82 -14.536 11.737 -0.638 1.00 23.33 H new ATOM 0 HA SER A 82 -16.203 11.745 1.682 1.00 71.34 H new ATOM 0 HB2 SER A 82 -17.907 10.899 0.140 1.00 42.21 H new ATOM 0 HB3 SER A 82 -16.991 12.152 -0.674 1.00 42.21 H new ATOM 0 HG SER A 82 -15.690 10.386 -1.608 1.00 33.54 H new ATOM 1324 N PHE A 83 -14.693 8.931 0.986 1.00 5.32 N ATOM 1325 CA PHE A 83 -14.408 7.576 1.510 1.00 51.43 C ATOM 1326 C PHE A 83 -13.753 7.638 2.901 1.00 72.50 C ATOM 1327 O PHE A 83 -13.850 6.684 3.676 1.00 23.21 O ATOM 1328 CB PHE A 83 -13.527 6.768 0.523 1.00 20.21 C ATOM 1329 CG PHE A 83 -14.241 6.431 -0.794 1.00 54.23 C ATOM 1330 CD1 PHE A 83 -15.326 5.548 -0.808 1.00 14.25 C ATOM 1331 CD2 PHE A 83 -13.841 6.989 -2.005 1.00 21.30 C ATOM 1332 CE1 PHE A 83 -15.977 5.238 -1.992 1.00 73.01 C ATOM 1333 CE2 PHE A 83 -14.493 6.677 -3.188 1.00 42.32 C ATOM 1334 CZ PHE A 83 -15.559 5.802 -3.180 1.00 75.15 C ATOM 0 H PHE A 83 -14.040 9.245 0.268 1.00 5.32 H new ATOM 0 HA PHE A 83 -15.362 7.059 1.613 1.00 51.43 H new ATOM 0 HB2 PHE A 83 -12.624 7.338 0.303 1.00 20.21 H new ATOM 0 HB3 PHE A 83 -13.211 5.842 1.004 1.00 20.21 H new ATOM 0 HD1 PHE A 83 -15.661 5.102 0.117 1.00 14.25 H new ATOM 0 HD2 PHE A 83 -13.008 7.677 -2.023 1.00 21.30 H new ATOM 0 HE1 PHE A 83 -16.813 4.554 -1.985 1.00 73.01 H new ATOM 0 HE2 PHE A 83 -14.166 7.120 -4.117 1.00 42.32 H new ATOM 0 HZ PHE A 83 -16.066 5.559 -4.102 1.00 75.15 H new ATOM 1344 N PHE A 84 -13.096 8.772 3.210 1.00 22.41 N ATOM 1345 CA PHE A 84 -12.512 9.023 4.547 1.00 45.40 C ATOM 1346 C PHE A 84 -13.607 9.421 5.567 1.00 12.40 C ATOM 1347 O PHE A 84 -13.350 9.467 6.773 1.00 1.33 O ATOM 1348 CB PHE A 84 -11.438 10.140 4.485 1.00 23.32 C ATOM 1349 CG PHE A 84 -10.231 9.851 3.582 1.00 61.23 C ATOM 1350 CD1 PHE A 84 -10.257 10.179 2.229 1.00 32.42 C ATOM 1351 CD2 PHE A 84 -9.059 9.297 4.090 1.00 33.11 C ATOM 1352 CE1 PHE A 84 -9.162 9.973 1.413 1.00 14.25 C ATOM 1353 CE2 PHE A 84 -7.963 9.079 3.270 1.00 73.40 C ATOM 1354 CZ PHE A 84 -8.015 9.421 1.934 1.00 62.45 C ATOM 0 H PHE A 84 -12.954 9.535 2.549 1.00 22.41 H new ATOM 0 HA PHE A 84 -12.042 8.095 4.874 1.00 45.40 H new ATOM 0 HB2 PHE A 84 -11.914 11.058 4.141 1.00 23.32 H new ATOM 0 HB3 PHE A 84 -11.076 10.328 5.496 1.00 23.32 H new ATOM 0 HD1 PHE A 84 -11.155 10.605 1.807 1.00 32.42 H new ATOM 0 HD2 PHE A 84 -9.003 9.034 5.136 1.00 33.11 H new ATOM 0 HE1 PHE A 84 -9.206 10.245 0.369 1.00 14.25 H new ATOM 0 HE2 PHE A 84 -7.065 8.640 3.678 1.00 73.40 H new ATOM 0 HZ PHE A 84 -7.157 9.256 1.299 1.00 62.45 H new ATOM 1364 N GLU A 85 -14.834 9.692 5.075 1.00 44.45 N ATOM 1365 CA GLU A 85 -15.989 10.097 5.916 1.00 4.44 C ATOM 1366 C GLU A 85 -16.747 8.858 6.452 1.00 33.41 C ATOM 1367 O GLU A 85 -17.973 8.887 6.611 1.00 22.21 O ATOM 1368 CB GLU A 85 -16.945 11.003 5.083 1.00 75.44 C ATOM 1369 CG GLU A 85 -16.269 12.200 4.383 1.00 34.45 C ATOM 1370 CD GLU A 85 -15.504 13.127 5.339 1.00 74.42 C ATOM 1371 OE1 GLU A 85 -16.148 13.965 6.004 1.00 71.40 O ATOM 1372 OE2 GLU A 85 -14.260 13.026 5.422 1.00 51.13 O ATOM 0 H GLU A 85 -15.056 9.637 4.081 1.00 44.45 H new ATOM 0 HA GLU A 85 -15.619 10.657 6.775 1.00 4.44 H new ATOM 0 HB2 GLU A 85 -17.435 10.389 4.327 1.00 75.44 H new ATOM 0 HB3 GLU A 85 -17.727 11.382 5.741 1.00 75.44 H new ATOM 0 HG2 GLU A 85 -15.579 11.824 3.627 1.00 34.45 H new ATOM 0 HG3 GLU A 85 -17.030 12.780 3.861 1.00 34.45 H new ATOM 1444 N ARG A 90 -15.641 0.501 7.045 1.00 50.03 N ATOM 1445 CA ARG A 90 -14.347 0.248 6.392 1.00 2.52 C ATOM 1446 C ARG A 90 -14.179 1.231 5.211 1.00 61.23 C ATOM 1447 O ARG A 90 -14.968 1.173 4.257 1.00 15.22 O ATOM 1448 CB ARG A 90 -14.242 -1.212 5.905 1.00 52.04 C ATOM 1449 CG ARG A 90 -12.869 -1.576 5.298 1.00 25.31 C ATOM 1450 CD ARG A 90 -12.720 -3.080 5.035 1.00 44.14 C ATOM 1451 NE ARG A 90 -12.907 -3.870 6.267 1.00 70.25 N ATOM 1452 CZ ARG A 90 -12.280 -5.018 6.565 1.00 54.04 C ATOM 1453 NH1 ARG A 90 -11.386 -5.551 5.736 1.00 22.55 N ATOM 1454 NH2 ARG A 90 -12.550 -5.616 7.713 1.00 1.14 N ATOM 0 HA ARG A 90 -13.547 0.406 7.116 1.00 2.52 H new ATOM 0 HB2 ARG A 90 -14.445 -1.879 6.743 1.00 52.04 H new ATOM 0 HB3 ARG A 90 -15.016 -1.392 5.159 1.00 52.04 H new ATOM 0 HG2 ARG A 90 -12.734 -1.032 4.363 1.00 25.31 H new ATOM 0 HG3 ARG A 90 -12.079 -1.249 5.974 1.00 25.31 H new ATOM 0 HD2 ARG A 90 -13.449 -3.393 4.288 1.00 44.14 H new ATOM 0 HD3 ARG A 90 -11.732 -3.281 4.620 1.00 44.14 H new ATOM 0 HE ARG A 90 -13.572 -3.512 6.953 1.00 70.25 H new ATOM 0 HH11 ARG A 90 -11.166 -5.086 4.855 1.00 22.55 H new ATOM 0 HH12 ARG A 90 -10.920 -6.425 5.981 1.00 22.55 H new ATOM 0 HH21 ARG A 90 -13.226 -5.204 8.356 1.00 1.14 H new ATOM 0 HH22 ARG A 90 -12.082 -6.489 7.955 1.00 1.14 H new ATOM 1468 N PRO A 91 -13.181 2.171 5.264 1.00 45.31 N ATOM 1469 CA PRO A 91 -12.934 3.124 4.171 1.00 73.20 C ATOM 1470 C PRO A 91 -12.207 2.449 2.991 1.00 24.22 C ATOM 1471 O PRO A 91 -11.392 1.542 3.192 1.00 53.12 O ATOM 1472 CB PRO A 91 -12.053 4.237 4.829 1.00 13.11 C ATOM 1473 CG PRO A 91 -11.905 3.854 6.283 1.00 32.00 C ATOM 1474 CD PRO A 91 -12.209 2.373 6.367 1.00 10.45 C ATOM 0 HA PRO A 91 -13.856 3.522 3.747 1.00 73.20 H new ATOM 0 HB2 PRO A 91 -11.080 4.301 4.343 1.00 13.11 H new ATOM 0 HB3 PRO A 91 -12.524 5.215 4.730 1.00 13.11 H new ATOM 0 HG2 PRO A 91 -10.897 4.064 6.640 1.00 32.00 H new ATOM 0 HG3 PRO A 91 -12.590 4.427 6.908 1.00 32.00 H new ATOM 0 HD2 PRO A 91 -11.312 1.768 6.231 1.00 10.45 H new ATOM 0 HD3 PRO A 91 -12.633 2.102 7.334 1.00 10.45 H new ATOM 1482 N VAL A 92 -12.528 2.887 1.763 1.00 12.22 N ATOM 1483 CA VAL A 92 -11.794 2.468 0.552 1.00 12.45 C ATOM 1484 C VAL A 92 -10.437 3.186 0.519 1.00 52.44 C ATOM 1485 O VAL A 92 -9.434 2.644 0.061 1.00 21.52 O ATOM 1486 CB VAL A 92 -12.612 2.775 -0.755 1.00 43.33 C ATOM 1487 CG1 VAL A 92 -11.860 2.323 -2.039 1.00 53.41 C ATOM 1488 CG2 VAL A 92 -14.011 2.128 -0.672 1.00 41.44 C ATOM 0 H VAL A 92 -13.294 3.534 1.579 1.00 12.22 H new ATOM 0 HA VAL A 92 -11.642 1.389 0.589 1.00 12.45 H new ATOM 0 HB VAL A 92 -12.729 3.856 -0.826 1.00 43.33 H new ATOM 0 HG11 VAL A 92 -12.464 2.556 -2.916 1.00 53.41 H new ATOM 0 HG12 VAL A 92 -10.907 2.847 -2.106 1.00 53.41 H new ATOM 0 HG13 VAL A 92 -11.681 1.249 -1.997 1.00 53.41 H new ATOM 0 HG21 VAL A 92 -14.568 2.348 -1.583 1.00 41.44 H new ATOM 0 HG22 VAL A 92 -13.907 1.049 -0.562 1.00 41.44 H new ATOM 0 HG23 VAL A 92 -14.548 2.530 0.187 1.00 41.44 H new ATOM 1498 N PHE A 93 -10.431 4.429 1.015 1.00 73.11 N ATOM 1499 CA PHE A 93 -9.211 5.218 1.198 1.00 24.23 C ATOM 1500 C PHE A 93 -9.023 5.478 2.692 1.00 25.33 C ATOM 1501 O PHE A 93 -9.824 6.192 3.306 1.00 32.31 O ATOM 1502 CB PHE A 93 -9.302 6.552 0.426 1.00 43.32 C ATOM 1503 CG PHE A 93 -9.503 6.417 -1.076 1.00 2.40 C ATOM 1504 CD1 PHE A 93 -8.873 5.409 -1.797 1.00 21.35 C ATOM 1505 CD2 PHE A 93 -10.312 7.308 -1.767 1.00 11.12 C ATOM 1506 CE1 PHE A 93 -9.050 5.293 -3.147 1.00 53.31 C ATOM 1507 CE2 PHE A 93 -10.488 7.190 -3.126 1.00 41.14 C ATOM 1508 CZ PHE A 93 -9.858 6.183 -3.813 1.00 63.10 C ATOM 0 H PHE A 93 -11.279 4.917 1.302 1.00 73.11 H new ATOM 0 HA PHE A 93 -8.356 4.667 0.806 1.00 24.23 H new ATOM 0 HB2 PHE A 93 -10.126 7.135 0.836 1.00 43.32 H new ATOM 0 HB3 PHE A 93 -8.389 7.120 0.605 1.00 43.32 H new ATOM 0 HD1 PHE A 93 -8.234 4.707 -1.282 1.00 21.35 H new ATOM 0 HD2 PHE A 93 -10.809 8.103 -1.231 1.00 11.12 H new ATOM 0 HE1 PHE A 93 -8.555 4.502 -3.691 1.00 53.31 H new ATOM 0 HE2 PHE A 93 -11.121 7.889 -3.652 1.00 41.14 H new ATOM 0 HZ PHE A 93 -9.998 6.090 -4.880 1.00 63.10 H new ATOM 1518 N VAL A 94 -7.983 4.871 3.264 1.00 42.20 N ATOM 1519 CA VAL A 94 -7.682 4.952 4.703 1.00 34.52 C ATOM 1520 C VAL A 94 -6.395 5.770 4.906 1.00 51.20 C ATOM 1521 O VAL A 94 -5.527 5.771 4.031 1.00 33.44 O ATOM 1522 CB VAL A 94 -7.498 3.513 5.318 1.00 3.50 C ATOM 1523 CG1 VAL A 94 -7.462 3.577 6.852 1.00 31.53 C ATOM 1524 CG2 VAL A 94 -8.591 2.533 4.832 1.00 40.54 C ATOM 0 H VAL A 94 -7.317 4.303 2.741 1.00 42.20 H new ATOM 0 HA VAL A 94 -8.516 5.438 5.210 1.00 34.52 H new ATOM 0 HB VAL A 94 -6.541 3.129 4.966 1.00 3.50 H new ATOM 0 HG11 VAL A 94 -7.334 2.572 7.255 1.00 31.53 H new ATOM 0 HG12 VAL A 94 -6.630 4.204 7.171 1.00 31.53 H new ATOM 0 HG13 VAL A 94 -8.397 4.000 7.221 1.00 31.53 H new ATOM 0 HG21 VAL A 94 -8.426 1.553 5.280 1.00 40.54 H new ATOM 0 HG22 VAL A 94 -9.572 2.907 5.127 1.00 40.54 H new ATOM 0 HG23 VAL A 94 -8.546 2.448 3.746 1.00 40.54 H new ATOM 1534 N LYS A 95 -6.277 6.458 6.056 1.00 21.20 N ATOM 1535 CA LYS A 95 -5.083 7.253 6.396 1.00 43.44 C ATOM 1536 C LYS A 95 -4.841 7.280 7.909 1.00 73.01 C ATOM 1537 O LYS A 95 -5.624 6.732 8.695 1.00 24.33 O ATOM 1538 CB LYS A 95 -5.208 8.698 5.872 1.00 42.33 C ATOM 1539 CG LYS A 95 -6.328 9.538 6.536 1.00 33.42 C ATOM 1540 CD LYS A 95 -6.219 11.038 6.187 1.00 71.01 C ATOM 1541 CE LYS A 95 -4.938 11.676 6.756 1.00 14.32 C ATOM 1542 NZ LYS A 95 -4.760 13.072 6.289 1.00 34.23 N ATOM 0 H LYS A 95 -7.003 6.479 6.773 1.00 21.20 H new ATOM 0 HA LYS A 95 -4.233 6.771 5.913 1.00 43.44 H new ATOM 0 HB2 LYS A 95 -4.256 9.207 6.021 1.00 42.33 H new ATOM 0 HB3 LYS A 95 -5.387 8.665 4.797 1.00 42.33 H new ATOM 0 HG2 LYS A 95 -7.300 9.162 6.216 1.00 33.42 H new ATOM 0 HG3 LYS A 95 -6.279 9.414 7.618 1.00 33.42 H new ATOM 0 HD2 LYS A 95 -6.233 11.159 5.104 1.00 71.01 H new ATOM 0 HD3 LYS A 95 -7.090 11.564 6.578 1.00 71.01 H new ATOM 0 HE2 LYS A 95 -4.978 11.660 7.845 1.00 14.32 H new ATOM 0 HE3 LYS A 95 -4.074 11.081 6.460 1.00 14.32 H new ATOM 0 HZ1 LYS A 95 -4.123 13.577 6.938 1.00 34.23 H new ATOM 0 HZ2 LYS A 95 -4.349 13.069 5.334 1.00 34.23 H new ATOM 0 HZ3 LYS A 95 -5.683 13.551 6.267 1.00 34.23 H new ATOM 1556 N GLY A 96 -3.733 7.926 8.292 1.00 71.33 N ATOM 1557 CA GLY A 96 -3.367 8.140 9.686 1.00 42.32 C ATOM 1558 C GLY A 96 -1.987 7.587 9.963 1.00 40.20 C ATOM 1559 O GLY A 96 -1.156 7.539 9.056 1.00 2.43 O ATOM 0 H GLY A 96 -3.062 8.317 7.631 1.00 71.33 H new ATOM 0 HA2 GLY A 96 -3.391 9.205 9.915 1.00 42.32 H new ATOM 0 HA3 GLY A 96 -4.096 7.658 10.337 1.00 42.32 H new ATOM 1563 N SER A 97 -1.737 7.166 11.209 1.00 4.31 N ATOM 1564 CA SER A 97 -0.489 6.466 11.571 1.00 43.41 C ATOM 1565 C SER A 97 -0.507 5.039 10.961 1.00 54.02 C ATOM 1566 O SER A 97 -1.564 4.587 10.514 1.00 4.42 O ATOM 1567 CB SER A 97 -0.356 6.426 13.113 1.00 33.34 C ATOM 1568 OG SER A 97 0.906 5.940 13.518 1.00 63.42 O ATOM 0 H SER A 97 -2.382 7.296 11.988 1.00 4.31 H new ATOM 0 HA SER A 97 0.376 6.994 11.170 1.00 43.41 H new ATOM 0 HB2 SER A 97 -0.507 7.427 13.517 1.00 33.34 H new ATOM 0 HB3 SER A 97 -1.140 5.793 13.529 1.00 33.34 H new ATOM 0 HG SER A 97 0.954 5.931 14.497 1.00 63.42 H new ATOM 1574 N LEU A 98 0.650 4.337 10.947 1.00 51.10 N ATOM 1575 CA LEU A 98 0.751 2.972 10.358 1.00 51.51 C ATOM 1576 C LEU A 98 -0.255 2.006 11.019 1.00 44.30 C ATOM 1577 O LEU A 98 -1.014 1.310 10.331 1.00 0.44 O ATOM 1578 CB LEU A 98 2.199 2.421 10.497 1.00 62.24 C ATOM 1579 CG LEU A 98 2.450 0.968 9.956 1.00 73.20 C ATOM 1580 CD1 LEU A 98 2.109 0.836 8.454 1.00 74.34 C ATOM 1581 CD2 LEU A 98 3.896 0.516 10.235 1.00 74.33 C ATOM 0 H LEU A 98 1.526 4.688 11.334 1.00 51.10 H new ATOM 0 HA LEU A 98 0.506 3.046 9.299 1.00 51.51 H new ATOM 0 HB2 LEU A 98 2.874 3.100 9.977 1.00 62.24 H new ATOM 0 HB3 LEU A 98 2.473 2.445 11.552 1.00 62.24 H new ATOM 0 HG LEU A 98 1.773 0.306 10.497 1.00 73.20 H new ATOM 0 HD11 LEU A 98 2.299 -0.186 8.126 1.00 74.34 H new ATOM 0 HD12 LEU A 98 1.058 1.078 8.297 1.00 74.34 H new ATOM 0 HD13 LEU A 98 2.730 1.523 7.878 1.00 74.34 H new ATOM 0 HD21 LEU A 98 4.042 -0.493 9.850 1.00 74.33 H new ATOM 0 HD22 LEU A 98 4.591 1.196 9.743 1.00 74.33 H new ATOM 0 HD23 LEU A 98 4.079 0.525 11.309 1.00 74.33 H new ATOM 1593 N GLU A 99 -0.265 2.020 12.358 1.00 24.04 N ATOM 1594 CA GLU A 99 -1.145 1.164 13.169 1.00 50.33 C ATOM 1595 C GLU A 99 -2.610 1.637 13.097 1.00 52.13 C ATOM 1596 O GLU A 99 -3.519 0.820 13.007 1.00 43.14 O ATOM 1597 CB GLU A 99 -0.654 1.151 14.632 1.00 55.50 C ATOM 1598 CG GLU A 99 0.804 0.680 14.788 1.00 74.12 C ATOM 1599 CD GLU A 99 1.269 0.649 16.247 1.00 32.11 C ATOM 1600 OE1 GLU A 99 0.804 -0.231 16.999 1.00 64.30 O ATOM 1601 OE2 GLU A 99 2.101 1.491 16.654 1.00 1.10 O ATOM 0 H GLU A 99 0.339 2.627 12.913 1.00 24.04 H new ATOM 0 HA GLU A 99 -1.106 0.152 12.766 1.00 50.33 H new ATOM 0 HB2 GLU A 99 -0.750 2.154 15.048 1.00 55.50 H new ATOM 0 HB3 GLU A 99 -1.302 0.500 15.218 1.00 55.50 H new ATOM 0 HG2 GLU A 99 0.906 -0.317 14.358 1.00 74.12 H new ATOM 0 HG3 GLU A 99 1.457 1.341 14.218 1.00 74.12 H new ATOM 1608 N SER A 100 -2.811 2.966 13.105 1.00 42.25 N ATOM 1609 CA SER A 100 -4.150 3.584 13.086 1.00 23.22 C ATOM 1610 C SER A 100 -4.919 3.238 11.796 1.00 21.24 C ATOM 1611 O SER A 100 -6.074 2.778 11.835 1.00 55.02 O ATOM 1612 CB SER A 100 -4.006 5.107 13.233 1.00 52.35 C ATOM 1613 OG SER A 100 -3.381 5.435 14.458 1.00 53.14 O ATOM 0 H SER A 100 -2.049 3.644 13.125 1.00 42.25 H new ATOM 0 HA SER A 100 -4.726 3.186 13.921 1.00 23.22 H new ATOM 0 HB2 SER A 100 -3.421 5.504 12.403 1.00 52.35 H new ATOM 0 HB3 SER A 100 -4.988 5.576 13.183 1.00 52.35 H new ATOM 0 HG SER A 100 -3.297 6.409 14.532 1.00 53.14 H new ATOM 1619 N ALA A 101 -4.235 3.437 10.664 1.00 55.33 N ATOM 1620 CA ALA A 101 -4.760 3.150 9.326 1.00 41.11 C ATOM 1621 C ALA A 101 -5.043 1.647 9.154 1.00 40.41 C ATOM 1622 O ALA A 101 -5.947 1.262 8.414 1.00 43.24 O ATOM 1623 CB ALA A 101 -3.777 3.654 8.261 1.00 31.44 C ATOM 0 H ALA A 101 -3.285 3.808 10.653 1.00 55.33 H new ATOM 0 HA ALA A 101 -5.707 3.676 9.202 1.00 41.11 H new ATOM 0 HB1 ALA A 101 -4.173 3.438 7.269 1.00 31.44 H new ATOM 0 HB2 ALA A 101 -3.642 4.730 8.371 1.00 31.44 H new ATOM 0 HB3 ALA A 101 -2.817 3.153 8.386 1.00 31.44 H new ATOM 1629 N ALA A 102 -4.268 0.817 9.871 1.00 71.42 N ATOM 1630 CA ALA A 102 -4.439 -0.638 9.885 1.00 43.25 C ATOM 1631 C ALA A 102 -5.772 -1.034 10.538 1.00 4.34 C ATOM 1632 O ALA A 102 -6.513 -1.855 9.995 1.00 21.41 O ATOM 1633 CB ALA A 102 -3.279 -1.267 10.641 1.00 52.33 C ATOM 0 H ALA A 102 -3.501 1.143 10.460 1.00 71.42 H new ATOM 0 HA ALA A 102 -4.452 -1.000 8.857 1.00 43.25 H new ATOM 0 HB1 ALA A 102 -3.399 -2.350 10.656 1.00 52.33 H new ATOM 0 HB2 ALA A 102 -2.342 -1.013 10.146 1.00 52.33 H new ATOM 0 HB3 ALA A 102 -3.264 -0.890 11.663 1.00 52.33 H new ATOM 1639 N GLU A 103 -6.057 -0.412 11.701 1.00 60.30 N ATOM 1640 CA GLU A 103 -7.282 -0.671 12.487 1.00 55.42 C ATOM 1641 C GLU A 103 -8.538 -0.323 11.673 1.00 60.23 C ATOM 1642 O GLU A 103 -9.479 -1.117 11.602 1.00 40.11 O ATOM 1643 CB GLU A 103 -7.250 0.140 13.811 1.00 61.33 C ATOM 1644 CG GLU A 103 -6.007 -0.142 14.676 1.00 44.33 C ATOM 1645 CD GLU A 103 -5.986 0.644 15.986 1.00 32.23 C ATOM 1646 OE1 GLU A 103 -5.523 1.800 15.990 1.00 50.13 O ATOM 1647 OE2 GLU A 103 -6.456 0.113 17.015 1.00 62.31 O ATOM 0 H GLU A 103 -5.443 0.285 12.122 1.00 60.30 H new ATOM 0 HA GLU A 103 -7.319 -1.734 12.727 1.00 55.42 H new ATOM 0 HB2 GLU A 103 -7.286 1.204 13.577 1.00 61.33 H new ATOM 0 HB3 GLU A 103 -8.145 -0.089 14.390 1.00 61.33 H new ATOM 0 HG2 GLU A 103 -5.964 -1.208 14.900 1.00 44.33 H new ATOM 0 HG3 GLU A 103 -5.112 0.099 14.102 1.00 44.33 H new ATOM 1654 N GLN A 104 -8.501 0.853 11.021 1.00 22.13 N ATOM 1655 CA GLN A 104 -9.613 1.369 10.197 1.00 1.40 C ATOM 1656 C GLN A 104 -9.841 0.497 8.942 1.00 32.42 C ATOM 1657 O GLN A 104 -10.987 0.235 8.567 1.00 54.30 O ATOM 1658 CB GLN A 104 -9.326 2.836 9.792 1.00 54.40 C ATOM 1659 CG GLN A 104 -9.177 3.811 10.973 1.00 33.31 C ATOM 1660 CD GLN A 104 -8.661 5.183 10.536 1.00 1.12 C ATOM 1661 OE1 GLN A 104 -9.434 6.079 10.197 1.00 15.21 O ATOM 1662 NE2 GLN A 104 -7.349 5.355 10.533 1.00 33.51 N ATOM 0 H GLN A 104 -7.695 1.477 11.050 1.00 22.13 H new ATOM 0 HA GLN A 104 -10.525 1.330 10.792 1.00 1.40 H new ATOM 0 HB2 GLN A 104 -8.412 2.863 9.199 1.00 54.40 H new ATOM 0 HB3 GLN A 104 -10.134 3.186 9.149 1.00 54.40 H new ATOM 0 HG2 GLN A 104 -10.142 3.929 11.467 1.00 33.31 H new ATOM 0 HG3 GLN A 104 -8.493 3.386 11.707 1.00 33.31 H new ATOM 0 HE21 GLN A 104 -6.734 4.593 10.819 1.00 33.51 H new ATOM 0 HE22 GLN A 104 -6.953 6.249 10.244 1.00 33.51 H new ATOM 1671 N ALA A 105 -8.736 0.036 8.323 1.00 33.21 N ATOM 1672 CA ALA A 105 -8.781 -0.820 7.116 1.00 73.10 C ATOM 1673 C ALA A 105 -9.168 -2.273 7.465 1.00 63.53 C ATOM 1674 O ALA A 105 -9.619 -3.021 6.595 1.00 1.10 O ATOM 1675 CB ALA A 105 -7.428 -0.780 6.393 1.00 64.22 C ATOM 0 H ALA A 105 -7.790 0.244 8.642 1.00 33.21 H new ATOM 0 HA ALA A 105 -9.551 -0.428 6.452 1.00 73.10 H new ATOM 0 HB1 ALA A 105 -7.470 -1.413 5.506 1.00 64.22 H new ATOM 0 HB2 ALA A 105 -7.204 0.245 6.097 1.00 64.22 H new ATOM 0 HB3 ALA A 105 -6.647 -1.144 7.061 1.00 64.22 H new ATOM 1681 N GLY A 106 -8.982 -2.650 8.747 1.00 32.50 N ATOM 1682 CA GLY A 106 -9.329 -3.989 9.234 1.00 1.40 C ATOM 1683 C GLY A 106 -8.262 -5.025 8.915 1.00 22.22 C ATOM 1684 O GLY A 106 -8.578 -6.170 8.582 1.00 4.23 O ATOM 0 H GLY A 106 -8.591 -2.037 9.462 1.00 32.50 H new ATOM 0 HA2 GLY A 106 -9.481 -3.951 10.313 1.00 1.40 H new ATOM 0 HA3 GLY A 106 -10.275 -4.299 8.790 1.00 1.40 H new ATOM 1688 N ILE A 107 -6.991 -4.610 9.020 1.00 12.43 N ATOM 1689 CA ILE A 107 -5.816 -5.468 8.767 1.00 23.42 C ATOM 1690 C ILE A 107 -5.099 -5.755 10.109 1.00 54.41 C ATOM 1691 O ILE A 107 -5.124 -4.905 11.011 1.00 50.10 O ATOM 1692 CB ILE A 107 -4.808 -4.764 7.780 1.00 1.04 C ATOM 1693 CG1 ILE A 107 -5.541 -4.055 6.607 1.00 63.12 C ATOM 1694 CG2 ILE A 107 -3.781 -5.771 7.217 1.00 51.03 C ATOM 1695 CD1 ILE A 107 -4.624 -3.193 5.752 1.00 11.23 C ATOM 0 H ILE A 107 -6.743 -3.657 9.286 1.00 12.43 H new ATOM 0 HA ILE A 107 -6.155 -6.399 8.312 1.00 23.42 H new ATOM 0 HB ILE A 107 -4.282 -4.007 8.361 1.00 1.04 H new ATOM 0 HG12 ILE A 107 -6.012 -4.808 5.975 1.00 63.12 H new ATOM 0 HG13 ILE A 107 -6.339 -3.433 7.011 1.00 63.12 H new ATOM 0 HG21 ILE A 107 -3.100 -5.256 6.540 1.00 51.03 H new ATOM 0 HG22 ILE A 107 -3.214 -6.210 8.038 1.00 51.03 H new ATOM 0 HG23 ILE A 107 -4.304 -6.559 6.675 1.00 51.03 H new ATOM 0 HD11 ILE A 107 -5.202 -2.729 4.953 1.00 11.23 H new ATOM 0 HD12 ILE A 107 -4.172 -2.418 6.371 1.00 11.23 H new ATOM 0 HD13 ILE A 107 -3.840 -3.814 5.319 1.00 11.23 H new ATOM 1707 N VAL A 108 -4.455 -6.933 10.232 1.00 73.14 N ATOM 1708 CA VAL A 108 -3.709 -7.315 11.454 1.00 14.21 C ATOM 1709 C VAL A 108 -2.440 -6.438 11.576 1.00 21.55 C ATOM 1710 O VAL A 108 -1.472 -6.610 10.804 1.00 31.40 O ATOM 1711 CB VAL A 108 -3.323 -8.845 11.443 1.00 4.10 C ATOM 1712 CG1 VAL A 108 -2.607 -9.287 12.739 1.00 11.10 C ATOM 1713 CG2 VAL A 108 -4.556 -9.726 11.154 1.00 51.35 C ATOM 0 H VAL A 108 -4.435 -7.641 9.498 1.00 73.14 H new ATOM 0 HA VAL A 108 -4.353 -7.149 12.318 1.00 14.21 H new ATOM 0 HB VAL A 108 -2.608 -8.984 10.632 1.00 4.10 H new ATOM 0 HG11 VAL A 108 -2.365 -10.348 12.677 1.00 11.10 H new ATOM 0 HG12 VAL A 108 -1.689 -8.712 12.862 1.00 11.10 H new ATOM 0 HG13 VAL A 108 -3.261 -9.114 13.593 1.00 11.10 H new ATOM 0 HG21 VAL A 108 -4.261 -10.775 11.152 1.00 51.35 H new ATOM 0 HG22 VAL A 108 -5.309 -9.562 11.925 1.00 51.35 H new ATOM 0 HG23 VAL A 108 -4.970 -9.464 10.180 1.00 51.35 H new ATOM 1723 N VAL A 109 -2.491 -5.481 12.535 1.00 65.12 N ATOM 1724 CA VAL A 109 -1.402 -4.515 12.821 1.00 23.41 C ATOM 1725 C VAL A 109 -0.049 -5.236 13.008 1.00 32.42 C ATOM 1726 O VAL A 109 0.976 -4.797 12.487 1.00 72.33 O ATOM 1727 CB VAL A 109 -1.731 -3.657 14.112 1.00 71.13 C ATOM 1728 CG1 VAL A 109 -0.572 -2.701 14.491 1.00 61.42 C ATOM 1729 CG2 VAL A 109 -3.050 -2.864 13.936 1.00 41.24 C ATOM 0 H VAL A 109 -3.302 -5.357 13.141 1.00 65.12 H new ATOM 0 HA VAL A 109 -1.326 -3.848 11.962 1.00 23.41 H new ATOM 0 HB VAL A 109 -1.856 -4.363 14.933 1.00 71.13 H new ATOM 0 HG11 VAL A 109 -0.844 -2.134 15.382 1.00 61.42 H new ATOM 0 HG12 VAL A 109 0.328 -3.282 14.692 1.00 61.42 H new ATOM 0 HG13 VAL A 109 -0.384 -2.013 13.667 1.00 61.42 H new ATOM 0 HG21 VAL A 109 -3.250 -2.285 14.838 1.00 41.24 H new ATOM 0 HG22 VAL A 109 -2.958 -2.190 13.085 1.00 41.24 H new ATOM 0 HG23 VAL A 109 -3.872 -3.559 13.762 1.00 41.24 H new ATOM 1739 N ASP A 110 -0.107 -6.372 13.717 1.00 33.24 N ATOM 1740 CA ASP A 110 1.056 -7.211 14.061 1.00 50.22 C ATOM 1741 C ASP A 110 1.839 -7.642 12.811 1.00 2.10 C ATOM 1742 O ASP A 110 3.063 -7.491 12.763 1.00 11.51 O ATOM 1743 CB ASP A 110 0.567 -8.457 14.850 1.00 50.32 C ATOM 1744 CG ASP A 110 1.708 -9.289 15.460 1.00 74.44 C ATOM 1745 OD1 ASP A 110 2.208 -10.222 14.806 1.00 3.24 O ATOM 1746 OD2 ASP A 110 2.083 -9.027 16.622 1.00 71.14 O ATOM 0 H ASP A 110 -0.985 -6.745 14.078 1.00 33.24 H new ATOM 0 HA ASP A 110 1.736 -6.623 14.678 1.00 50.22 H new ATOM 0 HB2 ASP A 110 -0.101 -8.132 15.648 1.00 50.32 H new ATOM 0 HB3 ASP A 110 -0.018 -9.092 14.184 1.00 50.32 H new ATOM 1751 N GLU A 111 1.109 -8.141 11.799 1.00 61.12 N ATOM 1752 CA GLU A 111 1.717 -8.668 10.570 1.00 22.15 C ATOM 1753 C GLU A 111 2.301 -7.542 9.703 1.00 54.12 C ATOM 1754 O GLU A 111 3.451 -7.636 9.259 1.00 42.31 O ATOM 1755 CB GLU A 111 0.694 -9.490 9.746 1.00 42.34 C ATOM 1756 CG GLU A 111 0.140 -10.739 10.457 1.00 11.51 C ATOM 1757 CD GLU A 111 1.234 -11.721 10.920 1.00 73.45 C ATOM 1758 OE1 GLU A 111 1.949 -12.279 10.063 1.00 3.52 O ATOM 1759 OE2 GLU A 111 1.385 -11.936 12.137 1.00 22.42 O ATOM 0 H GLU A 111 0.090 -8.189 11.811 1.00 61.12 H new ATOM 0 HA GLU A 111 2.531 -9.326 10.874 1.00 22.15 H new ATOM 0 HB2 GLU A 111 -0.141 -8.841 9.480 1.00 42.34 H new ATOM 0 HB3 GLU A 111 1.166 -9.800 8.814 1.00 42.34 H new ATOM 0 HG2 GLU A 111 -0.445 -10.425 11.322 1.00 11.51 H new ATOM 0 HG3 GLU A 111 -0.541 -11.258 9.783 1.00 11.51 H new ATOM 1766 N LEU A 112 1.509 -6.475 9.469 1.00 25.35 N ATOM 1767 CA LEU A 112 1.910 -5.406 8.532 1.00 53.13 C ATOM 1768 C LEU A 112 3.076 -4.562 9.066 1.00 23.12 C ATOM 1769 O LEU A 112 3.941 -4.168 8.291 1.00 53.14 O ATOM 1770 CB LEU A 112 0.701 -4.532 8.122 1.00 25.23 C ATOM 1771 CG LEU A 112 -0.073 -3.791 9.270 1.00 53.42 C ATOM 1772 CD1 LEU A 112 0.497 -2.388 9.581 1.00 1.15 C ATOM 1773 CD2 LEU A 112 -1.561 -3.714 8.953 1.00 23.34 C ATOM 0 H LEU A 112 0.600 -6.332 9.909 1.00 25.35 H new ATOM 0 HA LEU A 112 2.279 -5.897 7.631 1.00 53.13 H new ATOM 0 HB2 LEU A 112 1.052 -3.782 7.413 1.00 25.23 H new ATOM 0 HB3 LEU A 112 -0.009 -5.166 7.591 1.00 25.23 H new ATOM 0 HG LEU A 112 0.068 -4.386 10.173 1.00 53.42 H new ATOM 0 HD11 LEU A 112 -0.082 -1.930 10.383 1.00 1.15 H new ATOM 0 HD12 LEU A 112 1.538 -2.479 9.891 1.00 1.15 H new ATOM 0 HD13 LEU A 112 0.437 -1.765 8.689 1.00 1.15 H new ATOM 0 HD21 LEU A 112 -2.079 -3.197 9.761 1.00 23.34 H new ATOM 0 HD22 LEU A 112 -1.707 -3.168 8.021 1.00 23.34 H new ATOM 0 HD23 LEU A 112 -1.964 -4.722 8.850 1.00 23.34 H new ATOM 1785 N VAL A 113 3.103 -4.306 10.388 1.00 61.21 N ATOM 1786 CA VAL A 113 4.202 -3.548 11.018 1.00 42.34 C ATOM 1787 C VAL A 113 5.525 -4.313 10.850 1.00 3.42 C ATOM 1788 O VAL A 113 6.554 -3.700 10.568 1.00 64.04 O ATOM 1789 CB VAL A 113 3.926 -3.220 12.536 1.00 43.22 C ATOM 1790 CG1 VAL A 113 5.180 -2.630 13.228 1.00 44.22 C ATOM 1791 CG2 VAL A 113 2.728 -2.247 12.674 1.00 14.42 C ATOM 0 H VAL A 113 2.379 -4.612 11.039 1.00 61.21 H new ATOM 0 HA VAL A 113 4.272 -2.587 10.508 1.00 42.34 H new ATOM 0 HB VAL A 113 3.679 -4.157 13.035 1.00 43.22 H new ATOM 0 HG11 VAL A 113 4.953 -2.416 14.272 1.00 44.22 H new ATOM 0 HG12 VAL A 113 5.997 -3.349 13.174 1.00 44.22 H new ATOM 0 HG13 VAL A 113 5.474 -1.709 12.725 1.00 44.22 H new ATOM 0 HG21 VAL A 113 2.553 -2.033 13.728 1.00 14.42 H new ATOM 0 HG22 VAL A 113 2.950 -1.319 12.147 1.00 14.42 H new ATOM 0 HG23 VAL A 113 1.837 -2.704 12.244 1.00 14.42 H new ATOM 1801 N GLN A 114 5.462 -5.660 10.980 1.00 40.54 N ATOM 1802 CA GLN A 114 6.611 -6.543 10.723 1.00 45.14 C ATOM 1803 C GLN A 114 7.108 -6.371 9.280 1.00 43.41 C ATOM 1804 O GLN A 114 8.254 -5.996 9.076 1.00 74.30 O ATOM 1805 CB GLN A 114 6.266 -8.034 11.005 1.00 21.20 C ATOM 1806 CG GLN A 114 6.099 -8.392 12.496 1.00 44.03 C ATOM 1807 CD GLN A 114 7.382 -8.225 13.315 1.00 72.14 C ATOM 1808 OE1 GLN A 114 8.185 -9.147 13.450 1.00 54.12 O ATOM 1809 NE2 GLN A 114 7.594 -7.039 13.849 1.00 1.24 N ATOM 0 H GLN A 114 4.617 -6.156 11.264 1.00 40.54 H new ATOM 0 HA GLN A 114 7.408 -6.254 11.408 1.00 45.14 H new ATOM 0 HB2 GLN A 114 5.343 -8.283 10.481 1.00 21.20 H new ATOM 0 HB3 GLN A 114 7.052 -8.660 10.582 1.00 21.20 H new ATOM 0 HG2 GLN A 114 5.319 -7.764 12.926 1.00 44.03 H new ATOM 0 HG3 GLN A 114 5.758 -9.424 12.577 1.00 44.03 H new ATOM 0 HE21 GLN A 114 6.911 -6.293 13.721 1.00 1.24 H new ATOM 0 HE22 GLN A 114 8.441 -6.868 14.390 1.00 1.24 H new ATOM 1818 N THR A 115 6.220 -6.591 8.287 1.00 70.25 N ATOM 1819 CA THR A 115 6.619 -6.569 6.865 1.00 61.33 C ATOM 1820 C THR A 115 7.074 -5.158 6.403 1.00 11.44 C ATOM 1821 O THR A 115 7.844 -5.046 5.453 1.00 72.10 O ATOM 1822 CB THR A 115 5.497 -7.132 5.915 1.00 44.13 C ATOM 1823 OG1 THR A 115 6.021 -7.375 4.596 1.00 4.25 O ATOM 1824 CG2 THR A 115 4.289 -6.195 5.793 1.00 62.13 C ATOM 0 H THR A 115 5.231 -6.784 8.442 1.00 70.25 H new ATOM 0 HA THR A 115 7.477 -7.236 6.788 1.00 61.33 H new ATOM 0 HB THR A 115 5.161 -8.063 6.371 1.00 44.13 H new ATOM 0 HG1 THR A 115 5.645 -6.722 3.969 1.00 4.25 H new ATOM 0 HG21 THR A 115 3.551 -6.638 5.125 1.00 62.13 H new ATOM 0 HG22 THR A 115 3.844 -6.044 6.777 1.00 62.13 H new ATOM 0 HG23 THR A 115 4.612 -5.235 5.390 1.00 62.13 H new ATOM 1832 N VAL A 116 6.602 -4.098 7.098 1.00 23.41 N ATOM 1833 CA VAL A 116 6.999 -2.701 6.817 1.00 54.41 C ATOM 1834 C VAL A 116 8.394 -2.396 7.407 1.00 2.10 C ATOM 1835 O VAL A 116 9.225 -1.827 6.715 1.00 41.54 O ATOM 1836 CB VAL A 116 5.915 -1.670 7.346 1.00 33.03 C ATOM 1837 CG1 VAL A 116 6.445 -0.211 7.387 1.00 51.51 C ATOM 1838 CG2 VAL A 116 4.626 -1.747 6.483 1.00 24.42 C ATOM 0 H VAL A 116 5.937 -4.187 7.867 1.00 23.41 H new ATOM 0 HA VAL A 116 7.057 -2.585 5.735 1.00 54.41 H new ATOM 0 HB VAL A 116 5.684 -1.956 8.372 1.00 33.03 H new ATOM 0 HG11 VAL A 116 5.661 0.450 7.757 1.00 51.51 H new ATOM 0 HG12 VAL A 116 7.309 -0.156 8.050 1.00 51.51 H new ATOM 0 HG13 VAL A 116 6.737 0.098 6.384 1.00 51.51 H new ATOM 0 HG21 VAL A 116 3.893 -1.034 6.859 1.00 24.42 H new ATOM 0 HG22 VAL A 116 4.867 -1.508 5.447 1.00 24.42 H new ATOM 0 HG23 VAL A 116 4.212 -2.754 6.536 1.00 24.42 H new ATOM 1848 N LYS A 117 8.647 -2.797 8.670 1.00 21.31 N ATOM 1849 CA LYS A 117 9.938 -2.507 9.353 1.00 44.32 C ATOM 1850 C LYS A 117 11.071 -3.393 8.793 1.00 4.33 C ATOM 1851 O LYS A 117 12.236 -2.984 8.780 1.00 50.34 O ATOM 1852 CB LYS A 117 9.804 -2.672 10.895 1.00 2.11 C ATOM 1853 CG LYS A 117 9.573 -4.123 11.390 1.00 13.52 C ATOM 1854 CD LYS A 117 9.161 -4.208 12.877 1.00 30.23 C ATOM 1855 CE LYS A 117 10.276 -3.788 13.855 1.00 63.13 C ATOM 1856 NZ LYS A 117 11.415 -4.745 13.871 1.00 11.14 N ATOM 0 H LYS A 117 7.982 -3.320 9.240 1.00 21.31 H new ATOM 0 HA LYS A 117 10.198 -1.468 9.152 1.00 44.32 H new ATOM 0 HB2 LYS A 117 10.708 -2.285 11.365 1.00 2.11 H new ATOM 0 HB3 LYS A 117 8.976 -2.052 11.239 1.00 2.11 H new ATOM 0 HG2 LYS A 117 8.799 -4.588 10.779 1.00 13.52 H new ATOM 0 HG3 LYS A 117 10.486 -4.699 11.240 1.00 13.52 H new ATOM 0 HD2 LYS A 117 8.289 -3.574 13.040 1.00 30.23 H new ATOM 0 HD3 LYS A 117 8.858 -5.230 13.103 1.00 30.23 H new ATOM 0 HE2 LYS A 117 10.642 -2.799 13.580 1.00 63.13 H new ATOM 0 HE3 LYS A 117 9.861 -3.706 14.860 1.00 63.13 H new ATOM 0 HZ1 LYS A 117 12.136 -4.416 14.544 1.00 11.14 H new ATOM 0 HZ2 LYS A 117 11.075 -5.684 14.160 1.00 11.14 H new ATOM 0 HZ3 LYS A 117 11.831 -4.805 12.920 1.00 11.14 H new ATOM 1870 N ASN A 118 10.704 -4.605 8.322 1.00 75.23 N ATOM 1871 CA ASN A 118 11.638 -5.529 7.646 1.00 52.34 C ATOM 1872 C ASN A 118 11.991 -4.971 6.269 1.00 10.10 C ATOM 1873 O ASN A 118 13.166 -4.957 5.889 1.00 3.43 O ATOM 1874 CB ASN A 118 11.034 -6.952 7.505 1.00 23.42 C ATOM 1875 CG ASN A 118 10.806 -7.649 8.849 1.00 15.21 C ATOM 1876 OD1 ASN A 118 11.567 -7.472 9.802 1.00 25.21 O ATOM 1877 ND2 ASN A 118 9.757 -8.450 8.939 1.00 11.12 N ATOM 0 H ASN A 118 9.754 -4.969 8.400 1.00 75.23 H new ATOM 0 HA ASN A 118 12.538 -5.613 8.255 1.00 52.34 H new ATOM 0 HB2 ASN A 118 10.085 -6.885 6.973 1.00 23.42 H new ATOM 0 HB3 ASN A 118 11.700 -7.563 6.895 1.00 23.42 H new ATOM 0 HD21 ASN A 118 9.562 -8.939 9.813 1.00 11.12 H new ATOM 0 HD22 ASN A 118 9.143 -8.579 8.135 1.00 11.12 H new ATOM 1884 N TYR A 119 10.943 -4.492 5.545 1.00 2.33 N ATOM 1885 CA TYR A 119 11.094 -3.810 4.248 1.00 54.55 C ATOM 1886 C TYR A 119 12.082 -2.655 4.392 1.00 15.35 C ATOM 1887 O TYR A 119 13.164 -2.702 3.817 1.00 25.31 O ATOM 1888 CB TYR A 119 9.720 -3.309 3.718 1.00 25.40 C ATOM 1889 CG TYR A 119 9.761 -2.484 2.420 1.00 0.22 C ATOM 1890 CD1 TYR A 119 10.168 -3.051 1.206 1.00 44.12 C ATOM 1891 CD2 TYR A 119 9.377 -1.137 2.407 1.00 64.31 C ATOM 1892 CE1 TYR A 119 10.184 -2.310 0.037 1.00 14.34 C ATOM 1893 CE2 TYR A 119 9.393 -0.397 1.241 1.00 41.21 C ATOM 1894 CZ TYR A 119 9.804 -0.986 0.059 1.00 75.23 C ATOM 1895 OH TYR A 119 9.815 -0.248 -1.110 1.00 64.35 O ATOM 0 H TYR A 119 9.974 -4.572 5.852 1.00 2.33 H new ATOM 0 HA TYR A 119 11.484 -4.519 3.518 1.00 54.55 H new ATOM 0 HB2 TYR A 119 9.078 -4.174 3.555 1.00 25.40 H new ATOM 0 HB3 TYR A 119 9.251 -2.705 4.495 1.00 25.40 H new ATOM 0 HD1 TYR A 119 10.475 -4.086 1.181 1.00 44.12 H new ATOM 0 HD2 TYR A 119 9.062 -0.668 3.327 1.00 64.31 H new ATOM 0 HE1 TYR A 119 10.494 -2.769 -0.890 1.00 14.34 H new ATOM 0 HE2 TYR A 119 9.086 0.638 1.252 1.00 41.21 H new ATOM 0 HH TYR A 119 10.026 0.687 -0.905 1.00 64.35 H new ATOM 1905 N GLN A 120 11.733 -1.697 5.272 1.00 72.52 N ATOM 1906 CA GLN A 120 12.518 -0.483 5.515 1.00 25.44 C ATOM 1907 C GLN A 120 13.961 -0.795 5.965 1.00 62.43 C ATOM 1908 O GLN A 120 14.882 -0.005 5.700 1.00 20.40 O ATOM 1909 CB GLN A 120 11.808 0.433 6.557 1.00 33.35 C ATOM 1910 CG GLN A 120 10.456 1.019 6.077 1.00 63.22 C ATOM 1911 CD GLN A 120 9.867 2.081 7.015 1.00 13.33 C ATOM 1912 OE1 GLN A 120 10.052 2.036 8.228 1.00 32.12 O ATOM 1913 NE2 GLN A 120 9.161 3.050 6.451 1.00 1.20 N ATOM 0 H GLN A 120 10.886 -1.750 5.839 1.00 72.52 H new ATOM 0 HA GLN A 120 12.585 0.046 4.565 1.00 25.44 H new ATOM 0 HB2 GLN A 120 11.639 -0.138 7.470 1.00 33.35 H new ATOM 0 HB3 GLN A 120 12.476 1.255 6.815 1.00 33.35 H new ATOM 0 HG2 GLN A 120 10.593 1.458 5.089 1.00 63.22 H new ATOM 0 HG3 GLN A 120 9.738 0.206 5.969 1.00 63.22 H new ATOM 0 HE21 GLN A 120 9.025 3.060 5.440 1.00 1.20 H new ATOM 0 HE22 GLN A 120 8.754 3.786 7.028 1.00 1.20 H new ATOM 1922 N GLY A 121 14.138 -1.965 6.605 1.00 51.14 N ATOM 1923 CA GLY A 121 15.438 -2.416 7.066 1.00 60.44 C ATOM 1924 C GLY A 121 16.348 -2.845 5.928 1.00 74.12 C ATOM 1925 O GLY A 121 17.462 -2.332 5.796 1.00 52.11 O ATOM 0 H GLY A 121 13.378 -2.614 6.811 1.00 51.14 H new ATOM 0 HA2 GLY A 121 15.918 -1.614 7.627 1.00 60.44 H new ATOM 0 HA3 GLY A 121 15.305 -3.251 7.754 1.00 60.44 H new ATOM 1929 N TYR A 122 15.873 -3.778 5.076 1.00 51.25 N ATOM 1930 CA TYR A 122 16.707 -4.329 3.992 1.00 5.45 C ATOM 1931 C TYR A 122 16.890 -3.342 2.827 1.00 60.34 C ATOM 1932 O TYR A 122 17.828 -3.489 2.032 1.00 54.32 O ATOM 1933 CB TYR A 122 16.206 -5.720 3.521 1.00 55.22 C ATOM 1934 CG TYR A 122 14.780 -5.854 2.940 1.00 14.40 C ATOM 1935 CD1 TYR A 122 14.367 -5.159 1.795 1.00 10.53 C ATOM 1936 CD2 TYR A 122 13.865 -6.742 3.507 1.00 21.15 C ATOM 1937 CE1 TYR A 122 13.105 -5.341 1.257 1.00 0.54 C ATOM 1938 CE2 TYR A 122 12.615 -6.932 2.967 1.00 42.12 C ATOM 1939 CZ TYR A 122 12.238 -6.234 1.844 1.00 62.33 C ATOM 1940 OH TYR A 122 10.984 -6.436 1.308 1.00 51.41 O ATOM 0 H TYR A 122 14.928 -4.160 5.118 1.00 51.25 H new ATOM 0 HA TYR A 122 17.701 -4.483 4.413 1.00 5.45 H new ATOM 0 HB2 TYR A 122 16.903 -6.080 2.764 1.00 55.22 H new ATOM 0 HB3 TYR A 122 16.279 -6.399 4.370 1.00 55.22 H new ATOM 0 HD1 TYR A 122 15.048 -4.467 1.323 1.00 10.53 H new ATOM 0 HD2 TYR A 122 14.146 -7.294 4.392 1.00 21.15 H new ATOM 0 HE1 TYR A 122 12.802 -4.785 0.382 1.00 0.54 H new ATOM 0 HE2 TYR A 122 11.929 -7.629 3.425 1.00 42.12 H new ATOM 0 HH TYR A 122 10.502 -7.099 1.845 1.00 51.41 H new ATOM 1950 N VAL A 123 15.986 -2.345 2.737 1.00 72.01 N ATOM 1951 CA VAL A 123 16.107 -1.239 1.771 1.00 54.25 C ATOM 1952 C VAL A 123 17.403 -0.447 2.035 1.00 10.52 C ATOM 1953 O VAL A 123 18.198 -0.223 1.116 1.00 45.34 O ATOM 1954 CB VAL A 123 14.855 -0.274 1.822 1.00 30.23 C ATOM 1955 CG1 VAL A 123 15.085 1.001 0.980 1.00 74.11 C ATOM 1956 CG2 VAL A 123 13.569 -0.994 1.354 1.00 15.45 C ATOM 0 H VAL A 123 15.157 -2.286 3.329 1.00 72.01 H new ATOM 0 HA VAL A 123 16.145 -1.673 0.772 1.00 54.25 H new ATOM 0 HB VAL A 123 14.726 0.023 2.863 1.00 30.23 H new ATOM 0 HG11 VAL A 123 14.204 1.640 1.039 1.00 74.11 H new ATOM 0 HG12 VAL A 123 15.951 1.540 1.365 1.00 74.11 H new ATOM 0 HG13 VAL A 123 15.263 0.724 -0.059 1.00 74.11 H new ATOM 0 HG21 VAL A 123 12.727 -0.303 1.401 1.00 15.45 H new ATOM 0 HG22 VAL A 123 13.698 -1.339 0.328 1.00 15.45 H new ATOM 0 HG23 VAL A 123 13.374 -1.848 2.002 1.00 15.45 H new ATOM 1966 N GLN A 124 17.617 -0.059 3.308 1.00 41.14 N ATOM 1967 CA GLN A 124 18.798 0.736 3.709 1.00 73.53 C ATOM 1968 C GLN A 124 20.064 -0.137 3.849 1.00 53.24 C ATOM 1969 O GLN A 124 21.181 0.389 3.856 1.00 72.14 O ATOM 1970 CB GLN A 124 18.510 1.526 5.007 1.00 65.21 C ATOM 1971 CG GLN A 124 18.138 0.670 6.230 1.00 64.24 C ATOM 1972 CD GLN A 124 17.791 1.494 7.474 1.00 12.23 C ATOM 1973 OE1 GLN A 124 17.281 2.614 7.378 1.00 4.03 O ATOM 1974 NE2 GLN A 124 18.066 0.951 8.645 1.00 72.04 N ATOM 0 H GLN A 124 16.987 -0.283 4.078 1.00 41.14 H new ATOM 0 HA GLN A 124 18.997 1.452 2.912 1.00 73.53 H new ATOM 0 HB2 GLN A 124 19.390 2.120 5.254 1.00 65.21 H new ATOM 0 HB3 GLN A 124 17.697 2.226 4.814 1.00 65.21 H new ATOM 0 HG2 GLN A 124 17.288 0.037 5.975 1.00 64.24 H new ATOM 0 HG3 GLN A 124 18.970 0.006 6.465 1.00 64.24 H new ATOM 0 HE21 GLN A 124 18.488 0.023 8.691 1.00 72.04 H new ATOM 0 HE22 GLN A 124 17.857 1.459 9.504 1.00 72.04 H new ATOM 1983 N ASP A 125 19.882 -1.464 3.976 1.00 31.42 N ATOM 1984 CA ASP A 125 20.999 -2.436 3.898 1.00 25.34 C ATOM 1985 C ASP A 125 21.471 -2.610 2.444 1.00 33.43 C ATOM 1986 O ASP A 125 22.620 -3.006 2.206 1.00 50.10 O ATOM 1987 CB ASP A 125 20.580 -3.812 4.480 1.00 35.45 C ATOM 1988 CG ASP A 125 20.576 -3.860 6.018 1.00 3.11 C ATOM 1989 OD1 ASP A 125 21.607 -3.533 6.636 1.00 52.14 O ATOM 1990 OD2 ASP A 125 19.561 -4.255 6.618 1.00 14.51 O ATOM 0 H ASP A 125 18.970 -1.893 4.134 1.00 31.42 H new ATOM 0 HA ASP A 125 21.822 -2.040 4.493 1.00 25.34 H new ATOM 0 HB2 ASP A 125 19.584 -4.062 4.115 1.00 35.45 H new ATOM 0 HB3 ASP A 125 21.259 -4.577 4.104 1.00 35.45 H new ATOM 1995 N GLY A 126 20.580 -2.310 1.481 1.00 42.51 N ATOM 1996 CA GLY A 126 20.921 -2.362 0.061 1.00 75.54 C ATOM 1997 C GLY A 126 20.847 -3.766 -0.529 1.00 53.10 C ATOM 1998 O GLY A 126 21.701 -4.147 -1.342 1.00 32.21 O ATOM 0 H GLY A 126 19.618 -2.029 1.669 1.00 42.51 H new ATOM 0 HA2 GLY A 126 20.246 -1.708 -0.491 1.00 75.54 H new ATOM 0 HA3 GLY A 126 21.929 -1.970 -0.078 1.00 75.54 H new ATOM 2002 N HIS A 127 19.817 -4.527 -0.118 1.00 12.42 N ATOM 2003 CA HIS A 127 19.565 -5.900 -0.598 1.00 53.33 C ATOM 2004 C HIS A 127 18.141 -6.310 -0.193 1.00 63.24 C ATOM 2005 O HIS A 127 17.866 -6.427 0.997 1.00 45.42 O ATOM 2006 CB HIS A 127 20.620 -6.875 0.021 1.00 33.44 C ATOM 2007 CG HIS A 127 20.459 -8.340 -0.328 1.00 1.10 C ATOM 2008 ND1 HIS A 127 21.124 -8.940 -1.375 1.00 0.11 N ATOM 2009 CD2 HIS A 127 19.762 -9.336 0.282 1.00 52.24 C ATOM 2010 CE1 HIS A 127 20.845 -10.227 -1.392 1.00 24.13 C ATOM 2011 NE2 HIS A 127 20.024 -10.491 -0.399 1.00 22.15 N ATOM 0 H HIS A 127 19.129 -4.204 0.563 1.00 12.42 H new ATOM 0 HA HIS A 127 19.655 -5.944 -1.683 1.00 53.33 H new ATOM 0 HB2 HIS A 127 21.612 -6.554 -0.297 1.00 33.44 H new ATOM 0 HB3 HIS A 127 20.585 -6.775 1.106 1.00 33.44 H new ATOM 0 HD2 HIS A 127 19.120 -9.233 1.145 1.00 52.24 H new ATOM 0 HE1 HIS A 127 21.227 -10.945 -2.102 1.00 24.13 H new ATOM 0 HE2 HIS A 127 19.644 -11.410 -0.174 1.00 22.15 H new ATOM 2020 N ASP A 128 17.242 -6.527 -1.173 1.00 51.41 N ATOM 2021 CA ASP A 128 15.856 -6.966 -0.889 1.00 51.51 C ATOM 2022 C ASP A 128 15.839 -8.425 -0.405 1.00 4.45 C ATOM 2023 O ASP A 128 16.734 -9.206 -0.740 1.00 52.53 O ATOM 2024 CB ASP A 128 14.932 -6.806 -2.126 1.00 5.52 C ATOM 2025 CG ASP A 128 15.286 -7.760 -3.276 1.00 3.12 C ATOM 2026 OD1 ASP A 128 16.305 -7.519 -3.953 1.00 63.21 O ATOM 2027 OD2 ASP A 128 14.571 -8.770 -3.481 1.00 32.03 O ATOM 0 H ASP A 128 17.447 -6.407 -2.165 1.00 51.41 H new ATOM 0 HA ASP A 128 15.470 -6.322 -0.099 1.00 51.51 H new ATOM 0 HB2 ASP A 128 13.899 -6.979 -1.824 1.00 5.52 H new ATOM 0 HB3 ASP A 128 14.991 -5.778 -2.484 1.00 5.52 H new ATOM 2032 N HIS A 129 14.826 -8.781 0.404 1.00 72.34 N ATOM 2033 CA HIS A 129 14.647 -10.160 0.911 1.00 70.10 C ATOM 2034 C HIS A 129 13.383 -10.778 0.307 1.00 5.45 C ATOM 2035 O HIS A 129 13.446 -11.816 -0.364 1.00 30.30 O ATOM 2036 CB HIS A 129 14.577 -10.189 2.467 1.00 3.31 C ATOM 2037 CG HIS A 129 15.879 -9.898 3.177 1.00 23.01 C ATOM 2038 ND1 HIS A 129 16.134 -10.305 4.468 1.00 72.40 N ATOM 2039 CD2 HIS A 129 16.987 -9.222 2.787 1.00 2.43 C ATOM 2040 CE1 HIS A 129 17.328 -9.892 4.830 1.00 42.43 C ATOM 2041 NE2 HIS A 129 17.861 -9.236 3.829 1.00 20.03 N ATOM 0 H HIS A 129 14.111 -8.129 0.725 1.00 72.34 H new ATOM 0 HA HIS A 129 15.513 -10.749 0.608 1.00 70.10 H new ATOM 0 HB2 HIS A 129 13.833 -9.463 2.795 1.00 3.31 H new ATOM 0 HB3 HIS A 129 14.223 -11.171 2.780 1.00 3.31 H new ATOM 0 HD2 HIS A 129 17.147 -8.757 1.825 1.00 2.43 H new ATOM 0 HE1 HIS A 129 17.791 -10.064 5.790 1.00 42.43 H new ATOM 0 HE2 HIS A 129 18.785 -8.804 3.831 1.00 20.03 H new ATOM 2113 N ASP A 134 15.801 -4.095 -7.145 1.00 61.44 N ATOM 2114 CA ASP A 134 17.111 -3.434 -6.933 1.00 34.21 C ATOM 2115 C ASP A 134 17.051 -2.400 -5.780 1.00 14.54 C ATOM 2116 O ASP A 134 16.042 -1.694 -5.648 1.00 73.25 O ATOM 2117 CB ASP A 134 17.598 -2.714 -8.219 1.00 63.44 C ATOM 2118 CG ASP A 134 17.833 -3.647 -9.412 1.00 25.23 C ATOM 2119 OD1 ASP A 134 18.701 -4.537 -9.320 1.00 60.34 O ATOM 2120 OD2 ASP A 134 17.159 -3.487 -10.455 1.00 54.15 O ATOM 0 HA ASP A 134 17.814 -4.225 -6.670 1.00 34.21 H new ATOM 0 HB2 ASP A 134 16.862 -1.961 -8.501 1.00 63.44 H new ATOM 0 HB3 ASP A 134 18.525 -2.186 -7.997 1.00 63.44 H new ATOM 2125 N PRO A 135 18.136 -2.302 -4.930 1.00 32.43 N ATOM 2126 CA PRO A 135 18.220 -1.323 -3.805 1.00 62.23 C ATOM 2127 C PRO A 135 18.035 0.144 -4.244 1.00 74.15 C ATOM 2128 O PRO A 135 17.558 0.980 -3.464 1.00 11.22 O ATOM 2129 CB PRO A 135 19.638 -1.565 -3.220 1.00 2.20 C ATOM 2130 CG PRO A 135 20.389 -2.316 -4.283 1.00 11.04 C ATOM 2131 CD PRO A 135 19.353 -3.166 -4.971 1.00 3.21 C ATOM 0 HA PRO A 135 17.417 -1.475 -3.084 1.00 62.23 H new ATOM 0 HB2 PRO A 135 20.131 -0.622 -2.983 1.00 2.20 H new ATOM 0 HB3 PRO A 135 19.588 -2.139 -2.295 1.00 2.20 H new ATOM 0 HG2 PRO A 135 20.867 -1.633 -4.985 1.00 11.04 H new ATOM 0 HG3 PRO A 135 21.178 -2.930 -3.849 1.00 11.04 H new ATOM 0 HD2 PRO A 135 19.643 -3.408 -5.993 1.00 3.21 H new ATOM 0 HD3 PRO A 135 19.196 -4.111 -4.452 1.00 3.21 H new ATOM 2139 N LYS A 136 18.402 0.427 -5.500 1.00 35.23 N ATOM 2140 CA LYS A 136 18.270 1.764 -6.101 1.00 53.01 C ATOM 2141 C LYS A 136 16.780 2.131 -6.322 1.00 13.41 C ATOM 2142 O LYS A 136 16.427 3.309 -6.381 1.00 4.31 O ATOM 2143 CB LYS A 136 19.059 1.810 -7.439 1.00 65.01 C ATOM 2144 CG LYS A 136 18.406 1.025 -8.604 1.00 20.23 C ATOM 2145 CD LYS A 136 19.337 0.827 -9.826 1.00 44.23 C ATOM 2146 CE LYS A 136 20.400 -0.261 -9.598 1.00 30.11 C ATOM 2147 NZ LYS A 136 21.229 -0.496 -10.812 1.00 13.44 N ATOM 0 H LYS A 136 18.801 -0.267 -6.132 1.00 35.23 H new ATOM 0 HA LYS A 136 18.688 2.502 -5.417 1.00 53.01 H new ATOM 0 HB2 LYS A 136 19.175 2.851 -7.741 1.00 65.01 H new ATOM 0 HB3 LYS A 136 20.060 1.414 -7.268 1.00 65.01 H new ATOM 0 HG2 LYS A 136 18.089 0.048 -8.239 1.00 20.23 H new ATOM 0 HG3 LYS A 136 17.507 1.552 -8.926 1.00 20.23 H new ATOM 0 HD2 LYS A 136 18.735 0.564 -10.696 1.00 44.23 H new ATOM 0 HD3 LYS A 136 19.833 1.770 -10.055 1.00 44.23 H new ATOM 0 HE2 LYS A 136 21.045 0.031 -8.770 1.00 30.11 H new ATOM 0 HE3 LYS A 136 19.910 -1.191 -9.308 1.00 30.11 H new ATOM 0 HZ1 LYS A 136 21.932 -1.236 -10.614 1.00 13.44 H new ATOM 0 HZ2 LYS A 136 20.618 -0.800 -11.596 1.00 13.44 H new ATOM 0 HZ3 LYS A 136 21.717 0.384 -11.075 1.00 13.44 H new ATOM 2161 N TYR A 137 15.921 1.102 -6.466 1.00 70.13 N ATOM 2162 CA TYR A 137 14.461 1.268 -6.656 1.00 32.03 C ATOM 2163 C TYR A 137 13.700 1.015 -5.343 1.00 33.51 C ATOM 2164 O TYR A 137 12.520 1.362 -5.233 1.00 52.43 O ATOM 2165 CB TYR A 137 13.954 0.305 -7.761 1.00 44.01 C ATOM 2166 CG TYR A 137 14.592 0.543 -9.137 1.00 63.23 C ATOM 2167 CD1 TYR A 137 14.545 1.804 -9.735 1.00 14.15 C ATOM 2168 CD2 TYR A 137 15.243 -0.480 -9.828 1.00 44.42 C ATOM 2169 CE1 TYR A 137 15.123 2.030 -10.967 1.00 61.24 C ATOM 2170 CE2 TYR A 137 15.822 -0.258 -11.060 1.00 71.21 C ATOM 2171 CZ TYR A 137 15.759 0.999 -11.626 1.00 72.40 C ATOM 2172 OH TYR A 137 16.335 1.231 -12.855 1.00 42.34 O ATOM 0 H TYR A 137 16.219 0.127 -6.454 1.00 70.13 H new ATOM 0 HA TYR A 137 14.273 2.296 -6.964 1.00 32.03 H new ATOM 0 HB2 TYR A 137 14.152 -0.722 -7.453 1.00 44.01 H new ATOM 0 HB3 TYR A 137 12.873 0.408 -7.850 1.00 44.01 H new ATOM 0 HD1 TYR A 137 14.048 2.616 -9.225 1.00 14.15 H new ATOM 0 HD2 TYR A 137 15.294 -1.465 -9.389 1.00 44.42 H new ATOM 0 HE1 TYR A 137 15.078 3.012 -11.414 1.00 61.24 H new ATOM 0 HE2 TYR A 137 16.322 -1.063 -11.579 1.00 71.21 H new ATOM 0 HH TYR A 137 16.743 0.404 -13.186 1.00 42.34 H new ATOM 2182 N LEU A 138 14.366 0.365 -4.375 1.00 13.35 N ATOM 2183 CA LEU A 138 13.827 0.187 -3.016 1.00 2.53 C ATOM 2184 C LEU A 138 13.791 1.552 -2.301 1.00 24.55 C ATOM 2185 O LEU A 138 14.788 2.278 -2.309 1.00 11.14 O ATOM 2186 CB LEU A 138 14.697 -0.809 -2.204 1.00 61.14 C ATOM 2187 CG LEU A 138 14.688 -2.310 -2.633 1.00 11.45 C ATOM 2188 CD1 LEU A 138 15.635 -3.139 -1.730 1.00 70.12 C ATOM 2189 CD2 LEU A 138 13.258 -2.900 -2.632 1.00 10.12 C ATOM 0 H LEU A 138 15.288 -0.050 -4.510 1.00 13.35 H new ATOM 0 HA LEU A 138 12.818 -0.220 -3.088 1.00 2.53 H new ATOM 0 HB2 LEU A 138 15.728 -0.458 -2.240 1.00 61.14 H new ATOM 0 HB3 LEU A 138 14.379 -0.758 -1.163 1.00 61.14 H new ATOM 0 HG LEU A 138 15.055 -2.364 -3.658 1.00 11.45 H new ATOM 0 HD11 LEU A 138 15.616 -4.183 -2.044 1.00 70.12 H new ATOM 0 HD12 LEU A 138 16.651 -2.753 -1.816 1.00 70.12 H new ATOM 0 HD13 LEU A 138 15.306 -3.066 -0.693 1.00 70.12 H new ATOM 0 HD21 LEU A 138 13.296 -3.946 -2.936 1.00 10.12 H new ATOM 0 HD22 LEU A 138 12.836 -2.829 -1.630 1.00 10.12 H new ATOM 0 HD23 LEU A 138 12.634 -2.342 -3.329 1.00 10.12 H new ATOM 2201 N HIS A 139 12.657 1.879 -1.671 1.00 31.12 N ATOM 2202 CA HIS A 139 12.432 3.187 -1.025 1.00 43.01 C ATOM 2203 C HIS A 139 11.544 3.003 0.214 1.00 23.13 C ATOM 2204 O HIS A 139 10.487 2.377 0.117 1.00 11.41 O ATOM 2205 CB HIS A 139 11.764 4.155 -2.044 1.00 14.34 C ATOM 2206 CG HIS A 139 11.295 5.472 -1.477 1.00 50.42 C ATOM 2207 ND1 HIS A 139 9.965 5.808 -1.376 1.00 73.20 N ATOM 2208 CD2 HIS A 139 11.985 6.533 -0.994 1.00 20.41 C ATOM 2209 CE1 HIS A 139 9.860 7.013 -0.863 1.00 73.05 C ATOM 2210 NE2 HIS A 139 11.070 7.476 -0.620 1.00 45.32 N ATOM 0 H HIS A 139 11.863 1.244 -1.592 1.00 31.12 H new ATOM 0 HA HIS A 139 13.383 3.614 -0.707 1.00 43.01 H new ATOM 0 HB2 HIS A 139 12.474 4.357 -2.846 1.00 14.34 H new ATOM 0 HB3 HIS A 139 10.910 3.648 -2.494 1.00 14.34 H new ATOM 0 HD2 HIS A 139 13.059 6.618 -0.919 1.00 20.41 H new ATOM 0 HE1 HIS A 139 8.935 7.537 -0.672 1.00 73.05 H new ATOM 0 HE2 HIS A 139 11.287 8.388 -0.219 1.00 45.32 H new ATOM 2219 N GLN A 140 11.966 3.551 1.373 1.00 45.23 N ATOM 2220 CA GLN A 140 11.157 3.493 2.605 1.00 15.44 C ATOM 2221 C GLN A 140 10.045 4.548 2.555 1.00 62.12 C ATOM 2222 O GLN A 140 10.167 5.560 1.857 1.00 25.03 O ATOM 2223 CB GLN A 140 11.996 3.705 3.900 1.00 24.33 C ATOM 2224 CG GLN A 140 13.171 2.720 4.100 1.00 65.13 C ATOM 2225 CD GLN A 140 14.506 3.174 3.526 1.00 11.23 C ATOM 2226 OE1 GLN A 140 14.573 3.905 2.548 1.00 14.25 O ATOM 2227 NE2 GLN A 140 15.589 2.711 4.122 1.00 44.44 N ATOM 0 H GLN A 140 12.857 4.036 1.480 1.00 45.23 H new ATOM 0 HA GLN A 140 10.736 2.489 2.647 1.00 15.44 H new ATOM 0 HB2 GLN A 140 12.393 4.720 3.893 1.00 24.33 H new ATOM 0 HB3 GLN A 140 11.330 3.629 4.760 1.00 24.33 H new ATOM 0 HG2 GLN A 140 13.296 2.541 5.168 1.00 65.13 H new ATOM 0 HG3 GLN A 140 12.905 1.766 3.646 1.00 65.13 H new ATOM 0 HE21 GLN A 140 15.502 2.103 4.936 1.00 44.44 H new ATOM 0 HE22 GLN A 140 16.512 2.961 3.768 1.00 44.44 H new ATOM 2236 N PHE A 141 8.984 4.290 3.319 1.00 45.21 N ATOM 2237 CA PHE A 141 7.829 5.182 3.430 1.00 43.42 C ATOM 2238 C PHE A 141 8.219 6.516 4.103 1.00 40.23 C ATOM 2239 O PHE A 141 8.732 6.530 5.232 1.00 23.13 O ATOM 2240 CB PHE A 141 6.711 4.477 4.222 1.00 33.43 C ATOM 2241 CG PHE A 141 6.308 3.124 3.636 1.00 2.24 C ATOM 2242 CD1 PHE A 141 5.505 3.048 2.497 1.00 20.25 C ATOM 2243 CD2 PHE A 141 6.729 1.929 4.225 1.00 24.43 C ATOM 2244 CE1 PHE A 141 5.141 1.825 1.971 1.00 65.31 C ATOM 2245 CE2 PHE A 141 6.362 0.711 3.700 1.00 42.12 C ATOM 2246 CZ PHE A 141 5.567 0.657 2.572 1.00 74.00 C ATOM 0 H PHE A 141 8.901 3.446 3.885 1.00 45.21 H new ATOM 0 HA PHE A 141 7.467 5.415 2.429 1.00 43.42 H new ATOM 0 HB2 PHE A 141 7.040 4.335 5.251 1.00 33.43 H new ATOM 0 HB3 PHE A 141 5.835 5.125 4.254 1.00 33.43 H new ATOM 0 HD1 PHE A 141 5.165 3.956 2.022 1.00 20.25 H new ATOM 0 HD2 PHE A 141 7.352 1.962 5.106 1.00 24.43 H new ATOM 0 HE1 PHE A 141 4.522 1.781 1.087 1.00 65.31 H new ATOM 0 HE2 PHE A 141 6.696 -0.202 4.170 1.00 42.12 H new ATOM 0 HZ PHE A 141 5.278 -0.299 2.160 1.00 74.00 H new ATOM 2256 N GLU A 142 7.987 7.614 3.368 1.00 54.24 N ATOM 2257 CA GLU A 142 8.284 8.987 3.801 1.00 21.45 C ATOM 2258 C GLU A 142 7.209 9.532 4.756 1.00 0.02 C ATOM 2259 O GLU A 142 6.058 9.084 4.744 1.00 41.31 O ATOM 2260 CB GLU A 142 8.370 9.902 2.558 1.00 73.41 C ATOM 2261 CG GLU A 142 9.534 9.607 1.603 1.00 71.35 C ATOM 2262 CD GLU A 142 10.903 9.829 2.251 1.00 14.13 C ATOM 2263 OE1 GLU A 142 11.179 10.967 2.682 1.00 40.51 O ATOM 2264 OE2 GLU A 142 11.707 8.885 2.323 1.00 21.44 O ATOM 0 H GLU A 142 7.578 7.570 2.435 1.00 54.24 H new ATOM 0 HA GLU A 142 9.233 8.973 4.337 1.00 21.45 H new ATOM 0 HB2 GLU A 142 7.436 9.820 2.002 1.00 73.41 H new ATOM 0 HB3 GLU A 142 8.451 10.936 2.894 1.00 73.41 H new ATOM 0 HG2 GLU A 142 9.463 8.575 1.259 1.00 71.35 H new ATOM 0 HG3 GLU A 142 9.446 10.244 0.723 1.00 71.35 H new ATOM 2271 N GLY A 143 7.598 10.532 5.565 1.00 54.15 N ATOM 2272 CA GLY A 143 6.675 11.188 6.489 1.00 32.20 C ATOM 2273 C GLY A 143 6.178 10.257 7.590 1.00 14.43 C ATOM 2274 O GLY A 143 6.854 9.285 7.945 1.00 54.54 O ATOM 0 H GLY A 143 8.549 10.900 5.593 1.00 54.15 H new ATOM 0 HA2 GLY A 143 7.171 12.046 6.942 1.00 32.20 H new ATOM 0 HA3 GLY A 143 5.821 11.571 5.931 1.00 32.20 H new ATOM 2278 N GLU A 144 4.979 10.550 8.116 1.00 71.11 N ATOM 2279 CA GLU A 144 4.366 9.791 9.226 1.00 65.43 C ATOM 2280 C GLU A 144 3.041 9.142 8.786 1.00 34.02 C ATOM 2281 O GLU A 144 2.709 8.037 9.220 1.00 14.43 O ATOM 2282 CB GLU A 144 4.110 10.739 10.426 1.00 41.13 C ATOM 2283 CG GLU A 144 5.367 11.456 10.960 1.00 62.45 C ATOM 2284 CD GLU A 144 5.055 12.453 12.087 1.00 22.20 C ATOM 2285 OE1 GLU A 144 4.721 13.619 11.778 1.00 61.25 O ATOM 2286 OE2 GLU A 144 5.118 12.070 13.272 1.00 1.44 O ATOM 0 H GLU A 144 4.402 11.323 7.785 1.00 71.11 H new ATOM 0 HA GLU A 144 5.054 8.999 9.522 1.00 65.43 H new ATOM 0 HB2 GLU A 144 3.379 11.490 10.128 1.00 41.13 H new ATOM 0 HB3 GLU A 144 3.664 10.164 11.237 1.00 41.13 H new ATOM 0 HG2 GLU A 144 6.075 10.712 11.326 1.00 62.45 H new ATOM 0 HG3 GLU A 144 5.854 11.984 10.140 1.00 62.45 H new ATOM 2293 N THR A 145 2.286 9.847 7.930 1.00 11.10 N ATOM 2294 CA THR A 145 0.935 9.431 7.541 1.00 31.33 C ATOM 2295 C THR A 145 0.974 8.393 6.399 1.00 22.40 C ATOM 2296 O THR A 145 1.444 8.685 5.299 1.00 41.21 O ATOM 2297 CB THR A 145 0.082 10.666 7.125 1.00 52.14 C ATOM 2298 OG1 THR A 145 0.153 11.665 8.157 1.00 65.12 O ATOM 2299 CG2 THR A 145 -1.390 10.298 6.885 1.00 31.41 C ATOM 0 H THR A 145 2.594 10.715 7.492 1.00 11.10 H new ATOM 0 HA THR A 145 0.469 8.959 8.406 1.00 31.33 H new ATOM 0 HB THR A 145 0.490 11.048 6.189 1.00 52.14 H new ATOM 0 HG1 THR A 145 -0.382 12.444 7.896 1.00 65.12 H new ATOM 0 HG21 THR A 145 -1.946 11.190 6.597 1.00 31.41 H new ATOM 0 HG22 THR A 145 -1.455 9.557 6.088 1.00 31.41 H new ATOM 0 HG23 THR A 145 -1.815 9.885 7.799 1.00 31.41 H new ATOM 2307 N PHE A 146 0.501 7.177 6.700 1.00 61.44 N ATOM 2308 CA PHE A 146 0.329 6.099 5.718 1.00 62.33 C ATOM 2309 C PHE A 146 -1.089 6.156 5.134 1.00 14.55 C ATOM 2310 O PHE A 146 -2.055 6.368 5.873 1.00 53.54 O ATOM 2311 CB PHE A 146 0.561 4.718 6.385 1.00 3.11 C ATOM 2312 CG PHE A 146 2.017 4.415 6.722 1.00 52.20 C ATOM 2313 CD1 PHE A 146 2.660 5.043 7.793 1.00 13.02 C ATOM 2314 CD2 PHE A 146 2.737 3.484 5.977 1.00 22.34 C ATOM 2315 CE1 PHE A 146 3.977 4.754 8.096 1.00 12.12 C ATOM 2316 CE2 PHE A 146 4.045 3.195 6.285 1.00 43.11 C ATOM 2317 CZ PHE A 146 4.668 3.822 7.343 1.00 62.43 C ATOM 0 H PHE A 146 0.223 6.911 7.645 1.00 61.44 H new ATOM 0 HA PHE A 146 1.059 6.231 4.920 1.00 62.33 H new ATOM 0 HB2 PHE A 146 -0.029 4.667 7.300 1.00 3.11 H new ATOM 0 HB3 PHE A 146 0.186 3.940 5.720 1.00 3.11 H new ATOM 0 HD1 PHE A 146 2.121 5.763 8.391 1.00 13.02 H new ATOM 0 HD2 PHE A 146 2.261 2.983 5.147 1.00 22.34 H new ATOM 0 HE1 PHE A 146 4.466 5.255 8.919 1.00 12.12 H new ATOM 0 HE2 PHE A 146 4.588 2.472 5.694 1.00 43.11 H new ATOM 0 HZ PHE A 146 5.694 3.586 7.583 1.00 62.43 H new ATOM 2327 N TYR A 147 -1.195 5.988 3.807 1.00 74.14 N ATOM 2328 CA TYR A 147 -2.478 5.832 3.107 1.00 21.32 C ATOM 2329 C TYR A 147 -2.614 4.385 2.613 1.00 60.23 C ATOM 2330 O TYR A 147 -1.853 3.936 1.747 1.00 11.35 O ATOM 2331 CB TYR A 147 -2.607 6.849 1.939 1.00 53.11 C ATOM 2332 CG TYR A 147 -2.893 8.289 2.408 1.00 74.12 C ATOM 2333 CD1 TYR A 147 -1.893 9.077 2.980 1.00 44.22 C ATOM 2334 CD2 TYR A 147 -4.168 8.856 2.280 1.00 12.34 C ATOM 2335 CE1 TYR A 147 -2.153 10.365 3.403 1.00 11.42 C ATOM 2336 CE2 TYR A 147 -4.425 10.150 2.703 1.00 30.15 C ATOM 2337 CZ TYR A 147 -3.411 10.900 3.263 1.00 70.12 C ATOM 2338 OH TYR A 147 -3.657 12.192 3.690 1.00 33.12 O ATOM 0 H TYR A 147 -0.387 5.956 3.186 1.00 74.14 H new ATOM 0 HA TYR A 147 -3.292 6.043 3.800 1.00 21.32 H new ATOM 0 HB2 TYR A 147 -1.685 6.841 1.357 1.00 53.11 H new ATOM 0 HB3 TYR A 147 -3.407 6.526 1.273 1.00 53.11 H new ATOM 0 HD1 TYR A 147 -0.898 8.672 3.094 1.00 44.22 H new ATOM 0 HD2 TYR A 147 -4.966 8.273 1.843 1.00 12.34 H new ATOM 0 HE1 TYR A 147 -1.364 10.955 3.846 1.00 11.42 H new ATOM 0 HE2 TYR A 147 -5.414 10.570 2.595 1.00 30.15 H new ATOM 0 HH TYR A 147 -4.595 12.420 3.519 1.00 33.12 H new ATOM 2348 N ILE A 148 -3.574 3.658 3.207 1.00 43.01 N ATOM 2349 CA ILE A 148 -3.881 2.265 2.861 1.00 22.22 C ATOM 2350 C ILE A 148 -5.124 2.243 1.953 1.00 74.54 C ATOM 2351 O ILE A 148 -6.217 2.638 2.369 1.00 45.33 O ATOM 2352 CB ILE A 148 -4.110 1.388 4.150 1.00 53.53 C ATOM 2353 CG1 ILE A 148 -2.814 1.370 5.032 1.00 3.13 C ATOM 2354 CG2 ILE A 148 -4.555 -0.048 3.781 1.00 42.41 C ATOM 2355 CD1 ILE A 148 -2.896 0.504 6.284 1.00 42.21 C ATOM 0 H ILE A 148 -4.165 4.028 3.951 1.00 43.01 H new ATOM 0 HA ILE A 148 -3.032 1.833 2.331 1.00 22.22 H new ATOM 0 HB ILE A 148 -4.915 1.838 4.731 1.00 53.53 H new ATOM 0 HG12 ILE A 148 -1.982 1.020 4.421 1.00 3.13 H new ATOM 0 HG13 ILE A 148 -2.582 2.392 5.331 1.00 3.13 H new ATOM 0 HG21 ILE A 148 -4.705 -0.628 4.692 1.00 42.41 H new ATOM 0 HG22 ILE A 148 -5.488 -0.007 3.220 1.00 42.41 H new ATOM 0 HG23 ILE A 148 -3.786 -0.522 3.171 1.00 42.41 H new ATOM 0 HD11 ILE A 148 -1.952 0.558 6.826 1.00 42.21 H new ATOM 0 HD12 ILE A 148 -3.702 0.864 6.923 1.00 42.21 H new ATOM 0 HD13 ILE A 148 -3.093 -0.530 5.999 1.00 42.21 H new ATOM 2367 N ILE A 149 -4.935 1.798 0.706 1.00 33.23 N ATOM 2368 CA ILE A 149 -5.978 1.811 -0.331 1.00 11.02 C ATOM 2369 C ILE A 149 -6.536 0.395 -0.521 1.00 13.31 C ATOM 2370 O ILE A 149 -5.780 -0.529 -0.832 1.00 53.13 O ATOM 2371 CB ILE A 149 -5.404 2.340 -1.698 1.00 4.45 C ATOM 2372 CG1 ILE A 149 -4.661 3.701 -1.500 1.00 44.42 C ATOM 2373 CG2 ILE A 149 -6.513 2.452 -2.773 1.00 12.23 C ATOM 2374 CD1 ILE A 149 -5.473 4.801 -0.837 1.00 63.05 C ATOM 0 H ILE A 149 -4.047 1.415 0.383 1.00 33.23 H new ATOM 0 HA ILE A 149 -6.775 2.480 -0.008 1.00 11.02 H new ATOM 0 HB ILE A 149 -4.678 1.612 -2.059 1.00 4.45 H new ATOM 0 HG12 ILE A 149 -3.767 3.523 -0.902 1.00 44.42 H new ATOM 0 HG13 ILE A 149 -4.327 4.057 -2.474 1.00 44.42 H new ATOM 0 HG21 ILE A 149 -6.082 2.820 -3.704 1.00 12.23 H new ATOM 0 HG22 ILE A 149 -6.957 1.471 -2.942 1.00 12.23 H new ATOM 0 HG23 ILE A 149 -7.283 3.144 -2.431 1.00 12.23 H new ATOM 0 HD11 ILE A 149 -4.863 5.700 -0.748 1.00 63.05 H new ATOM 0 HD12 ILE A 149 -6.354 5.018 -1.441 1.00 63.05 H new ATOM 0 HD13 ILE A 149 -5.785 4.475 0.155 1.00 63.05 H new ATOM 2386 N GLU A 150 -7.853 0.239 -0.336 1.00 74.34 N ATOM 2387 CA GLU A 150 -8.539 -1.035 -0.543 1.00 3.45 C ATOM 2388 C GLU A 150 -8.665 -1.347 -2.046 1.00 25.14 C ATOM 2389 O GLU A 150 -9.227 -0.554 -2.822 1.00 13.41 O ATOM 2390 CB GLU A 150 -9.953 -1.030 0.098 1.00 35.04 C ATOM 2391 CG GLU A 150 -10.707 -2.371 -0.078 1.00 73.21 C ATOM 2392 CD GLU A 150 -12.106 -2.395 0.540 1.00 53.34 C ATOM 2393 OE1 GLU A 150 -12.214 -2.497 1.781 1.00 34.53 O ATOM 2394 OE2 GLU A 150 -13.108 -2.353 -0.213 1.00 72.25 O ATOM 0 H GLU A 150 -8.470 0.995 -0.039 1.00 74.34 H new ATOM 0 HA GLU A 150 -7.939 -1.806 -0.060 1.00 3.45 H new ATOM 0 HB2 GLU A 150 -9.862 -0.809 1.161 1.00 35.04 H new ATOM 0 HB3 GLU A 150 -10.543 -0.228 -0.345 1.00 35.04 H new ATOM 0 HG2 GLU A 150 -10.789 -2.590 -1.142 1.00 73.21 H new ATOM 0 HG3 GLU A 150 -10.113 -3.169 0.367 1.00 73.21 H new ATOM 2401 N GLN A 151 -8.113 -2.494 -2.439 1.00 2.52 N ATOM 2402 CA GLN A 151 -8.370 -3.121 -3.732 1.00 10.21 C ATOM 2403 C GLN A 151 -9.083 -4.450 -3.486 1.00 15.14 C ATOM 2404 O GLN A 151 -8.460 -5.451 -3.122 1.00 64.12 O ATOM 2405 CB GLN A 151 -7.048 -3.328 -4.515 1.00 61.42 C ATOM 2406 CG GLN A 151 -6.373 -2.029 -5.022 1.00 25.40 C ATOM 2407 CD GLN A 151 -7.157 -1.297 -6.129 1.00 10.21 C ATOM 2408 OE1 GLN A 151 -8.389 -1.334 -6.196 1.00 71.04 O ATOM 2409 NE2 GLN A 151 -6.443 -0.634 -7.025 1.00 12.30 N ATOM 0 H GLN A 151 -7.463 -3.022 -1.856 1.00 2.52 H new ATOM 0 HA GLN A 151 -9.002 -2.476 -4.341 1.00 10.21 H new ATOM 0 HB2 GLN A 151 -6.344 -3.858 -3.874 1.00 61.42 H new ATOM 0 HB3 GLN A 151 -7.248 -3.973 -5.371 1.00 61.42 H new ATOM 0 HG2 GLN A 151 -6.238 -1.351 -4.179 1.00 25.40 H new ATOM 0 HG3 GLN A 151 -5.379 -2.273 -5.397 1.00 25.40 H new ATOM 0 HE21 GLN A 151 -5.426 -0.615 -6.953 1.00 12.30 H new ATOM 0 HE22 GLN A 151 -6.910 -0.142 -7.787 1.00 12.30 H new ATOM 2418 N ARG A 152 -10.407 -4.428 -3.663 1.00 25.13 N ATOM 2419 CA ARG A 152 -11.268 -5.620 -3.594 1.00 21.34 C ATOM 2420 C ARG A 152 -11.142 -6.395 -4.931 1.00 62.00 C ATOM 2421 O ARG A 152 -10.466 -5.925 -5.858 1.00 54.03 O ATOM 2422 CB ARG A 152 -12.740 -5.151 -3.335 1.00 15.42 C ATOM 2423 CG ARG A 152 -13.718 -6.244 -2.832 1.00 72.35 C ATOM 2424 CD ARG A 152 -13.492 -6.633 -1.361 1.00 1.40 C ATOM 2425 NE ARG A 152 -13.706 -5.496 -0.432 1.00 21.01 N ATOM 2426 CZ ARG A 152 -14.355 -5.569 0.748 1.00 33.25 C ATOM 2427 NH1 ARG A 152 -14.883 -6.717 1.175 1.00 51.24 N ATOM 2428 NH2 ARG A 152 -14.470 -4.479 1.489 1.00 32.22 N ATOM 0 H ARG A 152 -10.922 -3.570 -3.861 1.00 25.13 H new ATOM 0 HA ARG A 152 -10.970 -6.284 -2.783 1.00 21.34 H new ATOM 0 HB2 ARG A 152 -12.720 -4.343 -2.604 1.00 15.42 H new ATOM 0 HB3 ARG A 152 -13.136 -4.733 -4.261 1.00 15.42 H new ATOM 0 HG2 ARG A 152 -14.742 -5.890 -2.954 1.00 72.35 H new ATOM 0 HG3 ARG A 152 -13.612 -7.132 -3.456 1.00 72.35 H new ATOM 0 HD2 ARG A 152 -14.168 -7.446 -1.096 1.00 1.40 H new ATOM 0 HD3 ARG A 152 -12.476 -7.010 -1.240 1.00 1.40 H new ATOM 0 HE ARG A 152 -13.333 -4.588 -0.708 1.00 21.01 H new ATOM 0 HH11 ARG A 152 -14.800 -7.560 0.606 1.00 51.24 H new ATOM 0 HH12 ARG A 152 -15.370 -6.752 2.070 1.00 51.24 H new ATOM 0 HH21 ARG A 152 -14.070 -3.598 1.166 1.00 32.22 H new ATOM 0 HH22 ARG A 152 -14.958 -4.520 2.384 1.00 32.22 H new ATOM 2442 N LEU A 153 -11.765 -7.582 -5.039 1.00 13.13 N ATOM 2443 CA LEU A 153 -11.924 -8.251 -6.346 1.00 42.33 C ATOM 2444 C LEU A 153 -12.936 -7.488 -7.225 1.00 44.52 C ATOM 2445 O LEU A 153 -13.637 -6.576 -6.751 1.00 70.45 O ATOM 2446 CB LEU A 153 -12.351 -9.738 -6.187 1.00 61.15 C ATOM 2447 CG LEU A 153 -11.255 -10.714 -5.656 1.00 2.12 C ATOM 2448 CD1 LEU A 153 -11.780 -12.160 -5.644 1.00 41.53 C ATOM 2449 CD2 LEU A 153 -9.948 -10.601 -6.482 1.00 31.14 C ATOM 0 H LEU A 153 -12.162 -8.093 -4.251 1.00 13.13 H new ATOM 0 HA LEU A 153 -10.952 -8.241 -6.839 1.00 42.33 H new ATOM 0 HB2 LEU A 153 -13.204 -9.779 -5.510 1.00 61.15 H new ATOM 0 HB3 LEU A 153 -12.694 -10.102 -7.155 1.00 61.15 H new ATOM 0 HG LEU A 153 -11.018 -10.428 -4.631 1.00 2.12 H new ATOM 0 HD11 LEU A 153 -11.002 -12.826 -5.271 1.00 41.53 H new ATOM 0 HD12 LEU A 153 -12.654 -12.224 -4.996 1.00 41.53 H new ATOM 0 HD13 LEU A 153 -12.056 -12.455 -6.656 1.00 41.53 H new ATOM 0 HD21 LEU A 153 -9.206 -11.294 -6.086 1.00 31.14 H new ATOM 0 HD22 LEU A 153 -10.154 -10.846 -7.524 1.00 31.14 H new ATOM 0 HD23 LEU A 153 -9.564 -9.583 -6.418 1.00 31.14 H new