USER MOD reduce.3.24.130724 H: found=0, std=0, add=654, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 655 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 234 ASN : amide:sc= -0.375 X(o=-1.1,f=-1.1) USER MOD Set 1.2: A 263 ASN : amide:sc= -1.03 K(o=-1.1,f=-2.8!) USER MOD Set 1.3: A 289 SER OG : rot 28:sc= 0.323 USER MOD Set 2.1: A 272 ASN : amide:sc= 0.111 X(o=-0.14,f=0.15) USER MOD Set 2.2: A 274 TYR OH : rot 30:sc= 0.00807 USER MOD Set 2.3: A 287 THR OG1 : rot -93:sc= -0.257 USER MOD Set 3.1: A 246 SER OG : rot 180:sc= -0.0041 USER MOD Set 3.2: A 309 HIS : no HE2:sc= 0.126 K(o=0.12,f=-0.59) USER MOD Set 4.1: A 233 ASN : amide:sc= 0.117 X(o=0.23,f=0.012) USER MOD Set 4.2: A 235 THR OG1 : rot 108:sc= 0.11 USER MOD Set 4.3: A 265 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 239 GLN :FLIP amide:sc= 0 F(o=-1.7,f=0) USER MOD Single : A 247 THR OG1 : rot 180:sc= 0.142 USER MOD Single : A 249 GLN : amide:sc= -0.386 K(o=-0.39,f=-1) USER MOD Single : A 255 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0685) USER MOD Single : A 256 GLN : amide:sc= 0.134 X(o=0.13,f=0) USER MOD Single : A 261 LYS NZ :NH3+ 176:sc= 0.281 (180deg=0.267) USER MOD Single : A 262 THR OG1 : rot 180:sc= 0 USER MOD Single : A 264 LYS NZ :NH3+ -167:sc=-0.00547 (180deg=-0.111) USER MOD Single : A 266 THR OG1 : rot 180:sc= 0 USER MOD Single : A 268 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 270 MET CE :methyl 166:sc= -2.28! (180deg=-2.44!) USER MOD Single : A 275 THR OG1 : rot 42:sc= 0.164 USER MOD Single : A 277 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 279 THR OG1 : rot 180:sc= -0.0949 USER MOD Single : A 281 LYS NZ :NH3+ -166:sc= -0.0299 (180deg=-0.234) USER MOD Single : A 283 LYS NZ :NH3+ 140:sc= 0.306 (180deg=0) USER MOD Single : A 295 SER OG : rot 180:sc= -0.496 USER MOD Single : A 297 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 306 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 311 ASN :FLIP amide:sc=-0.00191 F(o=-0.94,f=-0.0019) USER MOD Single : A 314 LYS NZ :NH3+ 166:sc= -0.0161 (180deg=-0.216) USER MOD Single : A 316 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 79 N ASN A 233 2.098 15.103 -4.670 1.00 52.03 N ATOM 80 CA ASN A 233 2.570 13.725 -4.569 1.00 43.13 C ATOM 81 C ASN A 233 1.458 12.826 -4.040 1.00 33.41 C ATOM 82 O ASN A 233 1.037 12.962 -2.883 1.00 21.10 O ATOM 83 CB ASN A 233 3.813 13.662 -3.643 1.00 31.43 C ATOM 84 CG ASN A 233 4.211 12.244 -3.192 1.00 1.13 C ATOM 85 OD1 ASN A 233 4.930 11.531 -3.895 1.00 13.21 O ATOM 86 ND2 ASN A 233 3.756 11.849 -1.995 1.00 4.32 N ATOM 0 HA ASN A 233 2.855 13.370 -5.559 1.00 43.13 H new ATOM 0 HB2 ASN A 233 4.658 14.114 -4.162 1.00 31.43 H new ATOM 0 HB3 ASN A 233 3.621 14.269 -2.758 1.00 31.43 H new ATOM 0 HD21 ASN A 233 4.003 10.927 -1.634 1.00 4.32 H new ATOM 0 HD22 ASN A 233 3.163 12.470 -1.445 1.00 4.32 H new ATOM 93 N ASN A 234 0.935 11.958 -4.901 1.00 53.45 N ATOM 94 CA ASN A 234 0.102 10.862 -4.430 1.00 11.30 C ATOM 95 C ASN A 234 0.953 9.624 -4.162 1.00 51.43 C ATOM 96 O ASN A 234 1.426 8.961 -5.086 1.00 60.01 O ATOM 97 CB ASN A 234 -1.019 10.526 -5.447 1.00 21.14 C ATOM 98 CG ASN A 234 -0.685 10.921 -6.890 1.00 53.12 C ATOM 99 OD1 ASN A 234 -1.067 11.995 -7.347 1.00 64.05 O ATOM 100 ND2 ASN A 234 0.047 10.076 -7.615 1.00 63.12 N ATOM 0 H ASN A 234 1.071 11.992 -5.911 1.00 53.45 H new ATOM 0 HA ASN A 234 -0.369 11.180 -3.500 1.00 11.30 H new ATOM 0 HB2 ASN A 234 -1.220 9.455 -5.411 1.00 21.14 H new ATOM 0 HB3 ASN A 234 -1.935 11.033 -5.144 1.00 21.14 H new ATOM 0 HD21 ASN A 234 0.303 10.315 -8.573 1.00 63.12 H new ATOM 0 HD22 ASN A 234 0.352 9.190 -7.212 1.00 63.12 H new ATOM 107 N THR A 235 1.168 9.348 -2.884 1.00 55.25 N ATOM 108 CA THR A 235 1.693 8.073 -2.407 1.00 3.53 C ATOM 109 C THR A 235 0.980 7.727 -1.093 1.00 13.31 C ATOM 110 O THR A 235 0.642 8.637 -0.336 1.00 50.44 O ATOM 111 CB THR A 235 3.241 8.121 -2.196 1.00 31.23 C ATOM 112 OG1 THR A 235 3.895 8.700 -3.337 1.00 21.11 O ATOM 113 CG2 THR A 235 3.822 6.726 -1.982 1.00 22.52 C ATOM 0 H THR A 235 0.980 10.014 -2.135 1.00 55.25 H new ATOM 0 HA THR A 235 1.505 7.305 -3.158 1.00 3.53 H new ATOM 0 HB THR A 235 3.415 8.730 -1.309 1.00 31.23 H new ATOM 0 HG1 THR A 235 4.225 9.593 -3.106 1.00 21.11 H new ATOM 0 HG21 THR A 235 4.900 6.799 -1.839 1.00 22.52 H new ATOM 0 HG22 THR A 235 3.368 6.274 -1.100 1.00 22.52 H new ATOM 0 HG23 THR A 235 3.613 6.107 -2.854 1.00 22.52 H new ATOM 121 N ILE A 236 0.716 6.451 -0.820 1.00 51.23 N ATOM 122 CA ILE A 236 0.314 6.049 0.523 1.00 2.21 C ATOM 123 C ILE A 236 1.296 5.002 1.047 1.00 63.11 C ATOM 124 O ILE A 236 1.813 4.195 0.270 1.00 35.54 O ATOM 125 CB ILE A 236 -1.172 5.535 0.637 1.00 50.05 C ATOM 126 CG1 ILE A 236 -1.413 4.196 -0.071 1.00 73.41 C ATOM 127 CG2 ILE A 236 -2.159 6.568 0.118 1.00 1.13 C ATOM 128 CD1 ILE A 236 -1.535 3.025 0.879 1.00 35.34 C ATOM 0 H ILE A 236 0.772 5.691 -1.498 1.00 51.23 H new ATOM 0 HA ILE A 236 0.344 6.947 1.140 1.00 2.21 H new ATOM 0 HB ILE A 236 -1.338 5.374 1.702 1.00 50.05 H new ATOM 0 HG12 ILE A 236 -2.323 4.267 -0.666 1.00 73.41 H new ATOM 0 HG13 ILE A 236 -0.593 4.008 -0.764 1.00 73.41 H new ATOM 0 HG21 ILE A 236 -3.174 6.181 0.211 1.00 1.13 H new ATOM 0 HG22 ILE A 236 -2.065 7.485 0.700 1.00 1.13 H new ATOM 0 HG23 ILE A 236 -1.947 6.780 -0.930 1.00 1.13 H new ATOM 0 HD11 ILE A 236 -1.704 2.111 0.310 1.00 35.34 H new ATOM 0 HD12 ILE A 236 -0.616 2.928 1.457 1.00 35.34 H new ATOM 0 HD13 ILE A 236 -2.373 3.191 1.556 1.00 35.34 H new ATOM 140 N PHE A 237 1.573 5.045 2.346 1.00 75.22 N ATOM 141 CA PHE A 237 2.453 4.073 2.988 1.00 54.13 C ATOM 142 C PHE A 237 1.619 3.084 3.768 1.00 1.12 C ATOM 143 O PHE A 237 0.672 3.468 4.423 1.00 5.01 O ATOM 144 CB PHE A 237 3.443 4.752 3.949 1.00 71.41 C ATOM 145 CG PHE A 237 4.847 4.178 3.931 1.00 31.31 C ATOM 146 CD1 PHE A 237 5.082 2.827 4.169 1.00 75.24 C ATOM 147 CD2 PHE A 237 5.937 4.996 3.665 1.00 24.30 C ATOM 148 CE1 PHE A 237 6.364 2.312 4.142 1.00 50.03 C ATOM 149 CE2 PHE A 237 7.220 4.485 3.637 1.00 61.21 C ATOM 150 CZ PHE A 237 7.434 3.141 3.876 1.00 64.44 C ATOM 0 H PHE A 237 1.197 5.749 2.981 1.00 75.22 H new ATOM 0 HA PHE A 237 3.022 3.569 2.207 1.00 54.13 H new ATOM 0 HB2 PHE A 237 3.497 5.812 3.703 1.00 71.41 H new ATOM 0 HB3 PHE A 237 3.050 4.680 4.963 1.00 71.41 H new ATOM 0 HD1 PHE A 237 4.250 2.171 4.378 1.00 75.24 H new ATOM 0 HD2 PHE A 237 5.779 6.048 3.477 1.00 24.30 H new ATOM 0 HE1 PHE A 237 6.528 1.261 4.329 1.00 50.03 H new ATOM 0 HE2 PHE A 237 8.056 5.136 3.428 1.00 61.21 H new ATOM 0 HZ PHE A 237 8.437 2.740 3.855 1.00 64.44 H new ATOM 160 N VAL A 238 1.952 1.821 3.667 1.00 53.05 N ATOM 161 CA VAL A 238 1.292 0.787 4.433 1.00 62.34 C ATOM 162 C VAL A 238 2.271 -0.079 5.205 1.00 43.24 C ATOM 163 O VAL A 238 3.384 -0.363 4.748 1.00 45.54 O ATOM 164 CB VAL A 238 0.300 -0.081 3.617 1.00 43.25 C ATOM 165 CG1 VAL A 238 -1.100 0.393 3.859 1.00 33.12 C ATOM 166 CG2 VAL A 238 0.572 -0.023 2.129 1.00 54.41 C ATOM 0 H VAL A 238 2.689 1.478 3.051 1.00 53.05 H new ATOM 0 HA VAL A 238 0.684 1.334 5.154 1.00 62.34 H new ATOM 0 HB VAL A 238 0.430 -1.111 3.949 1.00 43.25 H new ATOM 0 HG11 VAL A 238 -1.796 -0.219 3.284 1.00 33.12 H new ATOM 0 HG12 VAL A 238 -1.334 0.309 4.920 1.00 33.12 H new ATOM 0 HG13 VAL A 238 -1.190 1.434 3.549 1.00 33.12 H new ATOM 0 HG21 VAL A 238 -0.150 -0.648 1.603 1.00 54.41 H new ATOM 0 HG22 VAL A 238 0.482 1.007 1.783 1.00 54.41 H new ATOM 0 HG23 VAL A 238 1.580 -0.386 1.929 1.00 54.41 H new ATOM 176 N GLN A 239 1.828 -0.471 6.392 1.00 31.52 N ATOM 177 CA GLN A 239 2.619 -1.241 7.335 1.00 61.32 C ATOM 178 C GLN A 239 1.870 -2.489 7.757 1.00 61.12 C ATOM 179 O GLN A 239 0.651 -2.479 7.800 1.00 62.21 O ATOM 180 CB GLN A 239 2.909 -0.407 8.591 1.00 31.43 C ATOM 181 CG GLN A 239 4.099 0.533 8.480 1.00 55.40 C ATOM 182 CD GLN A 239 5.451 -0.143 8.732 1.00 43.20 C ATOM 183 OE1 GLN A 239 5.561 -1.447 8.466 1.00 1.21 O flip ATOM 184 NE2 GLN A 239 6.389 0.503 9.190 1.00 34.30 N flip ATOM 0 H GLN A 239 0.890 -0.257 6.730 1.00 31.52 H new ATOM 0 HA GLN A 239 3.553 -1.516 6.844 1.00 61.32 H new ATOM 0 HB2 GLN A 239 2.023 0.180 8.831 1.00 31.43 H new ATOM 0 HB3 GLN A 239 3.078 -1.085 9.428 1.00 31.43 H new ATOM 0 HG2 GLN A 239 4.106 0.978 7.485 1.00 55.40 H new ATOM 0 HG3 GLN A 239 3.973 1.348 9.193 1.00 55.40 H new ATOM 0 HE21 GLN A 239 6.277 1.498 9.384 1.00 34.30 H new ATOM 0 HE22 GLN A 239 7.281 0.045 9.377 1.00 34.30 H new ATOM 193 N GLY A 240 2.606 -3.564 8.027 1.00 13.33 N ATOM 194 CA GLY A 240 2.008 -4.778 8.558 1.00 54.13 C ATOM 195 C GLY A 240 1.607 -5.774 7.481 1.00 12.54 C ATOM 196 O GLY A 240 0.742 -6.621 7.699 1.00 62.24 O ATOM 0 H GLY A 240 3.615 -3.616 7.886 1.00 13.33 H new ATOM 0 HA2 GLY A 240 2.714 -5.254 9.239 1.00 54.13 H new ATOM 0 HA3 GLY A 240 1.128 -4.514 9.145 1.00 54.13 H new ATOM 200 N LEU A 241 2.223 -5.657 6.307 1.00 14.25 N ATOM 201 CA LEU A 241 1.986 -6.593 5.213 1.00 72.53 C ATOM 202 C LEU A 241 3.287 -7.339 4.957 1.00 34.11 C ATOM 203 O LEU A 241 4.010 -7.055 3.995 1.00 50.23 O ATOM 204 CB LEU A 241 1.495 -5.880 3.918 1.00 74.21 C ATOM 205 CG LEU A 241 0.591 -4.660 4.130 1.00 30.31 C ATOM 206 CD1 LEU A 241 1.423 -3.399 4.208 1.00 23.22 C ATOM 207 CD2 LEU A 241 -0.431 -4.534 3.022 1.00 73.31 C ATOM 0 H LEU A 241 2.893 -4.919 6.089 1.00 14.25 H new ATOM 0 HA LEU A 241 1.191 -7.282 5.496 1.00 72.53 H new ATOM 0 HB2 LEU A 241 2.368 -5.567 3.345 1.00 74.21 H new ATOM 0 HB3 LEU A 241 0.957 -6.606 3.308 1.00 74.21 H new ATOM 0 HG LEU A 241 0.058 -4.799 5.071 1.00 30.31 H new ATOM 0 HD11 LEU A 241 0.769 -2.540 4.359 1.00 23.22 H new ATOM 0 HD12 LEU A 241 2.121 -3.474 5.042 1.00 23.22 H new ATOM 0 HD13 LEU A 241 1.980 -3.272 3.280 1.00 23.22 H new ATOM 0 HD21 LEU A 241 -1.056 -3.659 3.202 1.00 73.31 H new ATOM 0 HD22 LEU A 241 0.081 -4.424 2.066 1.00 73.31 H new ATOM 0 HD23 LEU A 241 -1.055 -5.428 2.999 1.00 73.31 H new ATOM 219 N GLY A 242 3.593 -8.278 5.846 1.00 32.24 N ATOM 220 CA GLY A 242 4.889 -8.918 5.821 1.00 5.41 C ATOM 221 C GLY A 242 4.818 -10.418 5.888 1.00 73.12 C ATOM 222 O GLY A 242 4.817 -11.082 4.855 1.00 24.33 O ATOM 0 H GLY A 242 2.966 -8.605 6.581 1.00 32.24 H new ATOM 0 HA2 GLY A 242 5.412 -8.627 4.910 1.00 5.41 H new ATOM 0 HA3 GLY A 242 5.482 -8.552 6.659 1.00 5.41 H new ATOM 226 N GLU A 243 4.773 -10.958 7.098 1.00 63.33 N ATOM 227 CA GLU A 243 4.869 -12.403 7.292 1.00 32.03 C ATOM 228 C GLU A 243 3.567 -13.108 6.913 1.00 43.12 C ATOM 229 O GLU A 243 2.525 -12.913 7.549 1.00 24.32 O ATOM 230 CB GLU A 243 5.246 -12.745 8.741 1.00 34.21 C ATOM 231 CG GLU A 243 6.647 -12.317 9.153 1.00 15.11 C ATOM 232 CD GLU A 243 6.979 -12.720 10.579 1.00 42.41 C ATOM 233 OE1 GLU A 243 7.296 -13.911 10.799 1.00 51.43 O ATOM 234 OE2 GLU A 243 6.934 -11.847 11.471 1.00 51.32 O ATOM 0 H GLU A 243 4.671 -10.421 7.959 1.00 63.33 H new ATOM 0 HA GLU A 243 5.658 -12.761 6.631 1.00 32.03 H new ATOM 0 HB2 GLU A 243 4.526 -12.274 9.410 1.00 34.21 H new ATOM 0 HB3 GLU A 243 5.154 -13.822 8.881 1.00 34.21 H new ATOM 0 HG2 GLU A 243 7.374 -12.762 8.474 1.00 15.11 H new ATOM 0 HG3 GLU A 243 6.738 -11.235 9.053 1.00 15.11 H new ATOM 241 N GLY A 244 3.642 -13.906 5.844 1.00 54.14 N ATOM 242 CA GLY A 244 2.475 -14.608 5.349 1.00 53.42 C ATOM 243 C GLY A 244 1.737 -13.800 4.307 1.00 53.13 C ATOM 244 O GLY A 244 0.557 -14.034 4.054 1.00 55.32 O ATOM 0 H GLY A 244 4.497 -14.075 5.314 1.00 54.14 H new ATOM 0 HA2 GLY A 244 2.779 -15.563 4.921 1.00 53.42 H new ATOM 0 HA3 GLY A 244 1.805 -14.830 6.179 1.00 53.42 H new ATOM 248 N VAL A 245 2.442 -12.833 3.710 1.00 72.22 N ATOM 249 CA VAL A 245 1.843 -11.899 2.782 1.00 22.43 C ATOM 250 C VAL A 245 1.724 -12.551 1.409 1.00 73.31 C ATOM 251 O VAL A 245 2.455 -13.498 1.085 1.00 55.12 O ATOM 252 CB VAL A 245 2.643 -10.562 2.699 1.00 14.03 C ATOM 253 CG1 VAL A 245 3.656 -10.463 1.564 1.00 33.53 C ATOM 254 CG2 VAL A 245 1.715 -9.394 2.694 1.00 12.23 C ATOM 0 H VAL A 245 3.440 -12.685 3.863 1.00 72.22 H new ATOM 0 HA VAL A 245 0.848 -11.645 3.148 1.00 22.43 H new ATOM 0 HB VAL A 245 3.254 -10.550 3.602 1.00 14.03 H new ATOM 0 HG11 VAL A 245 4.152 -9.493 1.603 1.00 33.53 H new ATOM 0 HG12 VAL A 245 4.398 -11.255 1.668 1.00 33.53 H new ATOM 0 HG13 VAL A 245 3.143 -10.570 0.608 1.00 33.53 H new ATOM 0 HG21 VAL A 245 2.292 -8.471 2.636 1.00 12.23 H new ATOM 0 HG22 VAL A 245 1.050 -9.461 1.833 1.00 12.23 H new ATOM 0 HG23 VAL A 245 1.124 -9.395 3.610 1.00 12.23 H new ATOM 264 N SER A 246 0.739 -12.109 0.664 1.00 54.13 N ATOM 265 CA SER A 246 0.585 -12.519 -0.709 1.00 12.41 C ATOM 266 C SER A 246 1.364 -11.564 -1.638 1.00 14.35 C ATOM 267 O SER A 246 1.865 -10.522 -1.204 1.00 70.11 O ATOM 268 CB SER A 246 -0.900 -12.578 -1.059 1.00 13.42 C ATOM 269 OG SER A 246 -1.620 -13.365 -0.122 1.00 4.55 O ATOM 0 H SER A 246 0.025 -11.458 0.992 1.00 54.13 H new ATOM 0 HA SER A 246 1.001 -13.516 -0.849 1.00 12.41 H new ATOM 0 HB2 SER A 246 -1.311 -11.569 -1.081 1.00 13.42 H new ATOM 0 HB3 SER A 246 -1.024 -12.995 -2.059 1.00 13.42 H new ATOM 0 HG SER A 246 -2.568 -13.384 -0.370 1.00 4.55 H new ATOM 275 N THR A 247 1.463 -11.965 -2.897 1.00 41.02 N ATOM 276 CA THR A 247 2.218 -11.293 -3.982 1.00 41.54 C ATOM 277 C THR A 247 1.668 -9.889 -4.354 1.00 0.22 C ATOM 278 O THR A 247 0.963 -9.265 -3.565 1.00 51.54 O ATOM 279 CB THR A 247 2.234 -12.180 -5.244 1.00 3.25 C ATOM 280 OG1 THR A 247 1.714 -13.482 -4.926 1.00 22.13 O ATOM 281 CG2 THR A 247 3.651 -12.323 -5.818 1.00 64.23 C ATOM 0 H THR A 247 0.999 -12.813 -3.222 1.00 41.02 H new ATOM 0 HA THR A 247 3.227 -11.146 -3.596 1.00 41.54 H new ATOM 0 HB THR A 247 1.610 -11.700 -5.998 1.00 3.25 H new ATOM 0 HG1 THR A 247 1.723 -14.043 -5.729 1.00 22.13 H new ATOM 0 HG21 THR A 247 3.622 -12.955 -6.706 1.00 64.23 H new ATOM 0 HG22 THR A 247 4.036 -11.339 -6.085 1.00 64.23 H new ATOM 0 HG23 THR A 247 4.302 -12.777 -5.071 1.00 64.23 H new ATOM 289 N ASP A 248 2.119 -9.352 -5.518 1.00 14.41 N ATOM 290 CA ASP A 248 1.668 -8.049 -6.138 1.00 62.52 C ATOM 291 C ASP A 248 0.125 -7.803 -6.093 1.00 71.15 C ATOM 292 O ASP A 248 -0.336 -6.698 -6.368 1.00 72.03 O ATOM 293 CB ASP A 248 2.132 -7.972 -7.599 1.00 31.24 C ATOM 294 CG ASP A 248 3.604 -8.286 -7.780 1.00 42.12 C ATOM 295 OD1 ASP A 248 4.440 -7.378 -7.614 1.00 75.51 O ATOM 296 OD2 ASP A 248 3.919 -9.458 -8.080 1.00 63.01 O ATOM 0 H ASP A 248 2.831 -9.819 -6.080 1.00 14.41 H new ATOM 0 HA ASP A 248 2.127 -7.271 -5.528 1.00 62.52 H new ATOM 0 HB2 ASP A 248 1.543 -8.668 -8.197 1.00 31.24 H new ATOM 0 HB3 ASP A 248 1.931 -6.972 -7.984 1.00 31.24 H new ATOM 301 N GLN A 249 -0.651 -8.859 -5.795 1.00 44.43 N ATOM 302 CA GLN A 249 -2.100 -8.839 -5.515 1.00 33.12 C ATOM 303 C GLN A 249 -2.546 -7.721 -4.508 1.00 51.23 C ATOM 304 O GLN A 249 -3.737 -7.459 -4.398 1.00 73.54 O ATOM 305 CB GLN A 249 -2.481 -10.213 -4.925 1.00 4.33 C ATOM 306 CG GLN A 249 -2.152 -10.357 -3.426 1.00 54.24 C ATOM 307 CD GLN A 249 -3.389 -10.435 -2.550 1.00 42.35 C ATOM 308 OE1 GLN A 249 -4.426 -10.957 -2.953 1.00 74.24 O ATOM 309 NE2 GLN A 249 -3.289 -9.877 -1.355 1.00 31.53 N ATOM 0 H GLN A 249 -0.265 -9.801 -5.740 1.00 44.43 H new ATOM 0 HA GLN A 249 -2.608 -8.623 -6.455 1.00 33.12 H new ATOM 0 HB2 GLN A 249 -3.549 -10.378 -5.071 1.00 4.33 H new ATOM 0 HB3 GLN A 249 -1.959 -10.994 -5.479 1.00 4.33 H new ATOM 0 HG2 GLN A 249 -1.551 -11.254 -3.277 1.00 54.24 H new ATOM 0 HG3 GLN A 249 -1.544 -9.509 -3.111 1.00 54.24 H new ATOM 0 HE21 GLN A 249 -2.408 -9.455 -1.061 1.00 31.53 H new ATOM 0 HE22 GLN A 249 -4.093 -9.869 -0.727 1.00 31.53 H new ATOM 318 N VAL A 250 -1.621 -7.183 -3.679 1.00 64.43 N ATOM 319 CA VAL A 250 -1.947 -6.107 -2.713 1.00 60.23 C ATOM 320 C VAL A 250 -2.563 -4.889 -3.453 1.00 2.20 C ATOM 321 O VAL A 250 -3.389 -4.187 -2.910 1.00 33.23 O ATOM 322 CB VAL A 250 -0.738 -5.571 -1.908 1.00 12.23 C ATOM 323 CG1 VAL A 250 -1.182 -5.118 -0.541 1.00 23.20 C ATOM 324 CG2 VAL A 250 0.357 -6.570 -1.740 1.00 44.04 C ATOM 0 H VAL A 250 -0.644 -7.476 -3.660 1.00 64.43 H new ATOM 0 HA VAL A 250 -2.641 -6.572 -2.014 1.00 60.23 H new ATOM 0 HB VAL A 250 -0.341 -4.739 -2.489 1.00 12.23 H new ATOM 0 HG11 VAL A 250 -0.323 -4.743 0.015 1.00 23.20 H new ATOM 0 HG12 VAL A 250 -1.922 -4.324 -0.643 1.00 23.20 H new ATOM 0 HG13 VAL A 250 -1.623 -5.958 -0.005 1.00 23.20 H new ATOM 0 HG21 VAL A 250 1.170 -6.125 -1.167 1.00 44.04 H new ATOM 0 HG22 VAL A 250 -0.025 -7.443 -1.211 1.00 44.04 H new ATOM 0 HG23 VAL A 250 0.727 -6.873 -2.720 1.00 44.04 H new ATOM 334 N GLY A 251 -2.149 -4.660 -4.711 1.00 61.22 N ATOM 335 CA GLY A 251 -2.768 -3.644 -5.558 1.00 43.53 C ATOM 336 C GLY A 251 -4.259 -3.882 -5.828 1.00 22.32 C ATOM 337 O GLY A 251 -5.019 -2.934 -5.873 1.00 12.32 O ATOM 0 H GLY A 251 -1.387 -5.169 -5.158 1.00 61.22 H new ATOM 0 HA2 GLY A 251 -2.646 -2.669 -5.087 1.00 43.53 H new ATOM 0 HA3 GLY A 251 -2.238 -3.607 -6.510 1.00 43.53 H new ATOM 341 N GLU A 252 -4.657 -5.157 -5.964 1.00 5.52 N ATOM 342 CA GLU A 252 -6.075 -5.573 -6.089 1.00 43.00 C ATOM 343 C GLU A 252 -6.871 -5.310 -4.778 1.00 74.03 C ATOM 344 O GLU A 252 -8.071 -4.961 -4.797 1.00 44.33 O ATOM 345 CB GLU A 252 -6.139 -7.074 -6.437 1.00 22.52 C ATOM 346 CG GLU A 252 -7.527 -7.598 -6.800 1.00 53.44 C ATOM 347 CD GLU A 252 -7.834 -7.448 -8.274 1.00 54.43 C ATOM 348 OE1 GLU A 252 -8.363 -6.390 -8.682 1.00 2.23 O ATOM 349 OE2 GLU A 252 -7.547 -8.397 -9.032 1.00 45.45 O ATOM 0 H GLU A 252 -4.003 -5.939 -5.991 1.00 5.52 H new ATOM 0 HA GLU A 252 -6.531 -4.980 -6.882 1.00 43.00 H new ATOM 0 HB2 GLU A 252 -5.466 -7.266 -7.272 1.00 22.52 H new ATOM 0 HB3 GLU A 252 -5.764 -7.644 -5.587 1.00 22.52 H new ATOM 0 HG2 GLU A 252 -7.599 -8.649 -6.522 1.00 53.44 H new ATOM 0 HG3 GLU A 252 -8.278 -7.062 -6.219 1.00 53.44 H new ATOM 356 N PHE A 253 -6.181 -5.491 -3.643 1.00 43.43 N ATOM 357 CA PHE A 253 -6.695 -5.167 -2.313 1.00 54.52 C ATOM 358 C PHE A 253 -7.105 -3.684 -2.222 1.00 23.20 C ATOM 359 O PHE A 253 -8.164 -3.369 -1.702 1.00 31.20 O ATOM 360 CB PHE A 253 -5.623 -5.541 -1.243 1.00 31.31 C ATOM 361 CG PHE A 253 -5.820 -4.964 0.134 1.00 15.44 C ATOM 362 CD1 PHE A 253 -7.040 -5.060 0.796 1.00 20.52 C ATOM 363 CD2 PHE A 253 -4.773 -4.312 0.765 1.00 71.52 C ATOM 364 CE1 PHE A 253 -7.209 -4.504 2.044 1.00 31.14 C ATOM 365 CE2 PHE A 253 -4.939 -3.758 2.018 1.00 23.24 C ATOM 366 CZ PHE A 253 -6.157 -3.854 2.661 1.00 52.12 C ATOM 0 H PHE A 253 -5.235 -5.873 -3.628 1.00 43.43 H new ATOM 0 HA PHE A 253 -7.595 -5.751 -2.121 1.00 54.52 H new ATOM 0 HB2 PHE A 253 -5.591 -6.627 -1.157 1.00 31.31 H new ATOM 0 HB3 PHE A 253 -4.648 -5.222 -1.611 1.00 31.31 H new ATOM 0 HD1 PHE A 253 -7.864 -5.576 0.326 1.00 20.52 H new ATOM 0 HD2 PHE A 253 -3.816 -4.236 0.271 1.00 71.52 H new ATOM 0 HE1 PHE A 253 -8.165 -4.576 2.542 1.00 31.14 H new ATOM 0 HE2 PHE A 253 -4.115 -3.249 2.496 1.00 23.24 H new ATOM 0 HZ PHE A 253 -6.287 -3.423 3.643 1.00 52.12 H new ATOM 376 N PHE A 254 -6.278 -2.791 -2.740 1.00 45.12 N ATOM 377 CA PHE A 254 -6.611 -1.368 -2.749 1.00 23.43 C ATOM 378 C PHE A 254 -7.604 -1.017 -3.882 1.00 2.54 C ATOM 379 O PHE A 254 -8.324 -0.030 -3.789 1.00 5.24 O ATOM 380 CB PHE A 254 -5.346 -0.520 -2.860 1.00 60.15 C ATOM 381 CG PHE A 254 -4.478 -0.559 -1.636 1.00 55.45 C ATOM 382 CD1 PHE A 254 -4.646 0.356 -0.615 1.00 75.52 C ATOM 383 CD2 PHE A 254 -3.479 -1.505 -1.518 1.00 22.33 C ATOM 384 CE1 PHE A 254 -3.840 0.315 0.504 1.00 63.24 C ATOM 385 CE2 PHE A 254 -2.670 -1.546 -0.409 1.00 51.13 C ATOM 386 CZ PHE A 254 -2.850 -0.638 0.602 1.00 32.54 C ATOM 0 H PHE A 254 -5.376 -3.019 -3.158 1.00 45.12 H new ATOM 0 HA PHE A 254 -7.102 -1.141 -1.803 1.00 23.43 H new ATOM 0 HB2 PHE A 254 -4.765 -0.862 -3.716 1.00 60.15 H new ATOM 0 HB3 PHE A 254 -5.630 0.513 -3.060 1.00 60.15 H new ATOM 0 HD1 PHE A 254 -5.415 1.110 -0.693 1.00 75.52 H new ATOM 0 HD2 PHE A 254 -3.332 -2.224 -2.310 1.00 22.33 H new ATOM 0 HE1 PHE A 254 -3.985 1.029 1.302 1.00 63.24 H new ATOM 0 HE2 PHE A 254 -1.893 -2.292 -0.334 1.00 51.13 H new ATOM 0 HZ PHE A 254 -2.216 -0.670 1.475 1.00 32.54 H new ATOM 396 N LYS A 255 -7.626 -1.844 -4.949 1.00 64.21 N ATOM 397 CA LYS A 255 -8.568 -1.710 -6.084 1.00 53.03 C ATOM 398 C LYS A 255 -10.032 -1.915 -5.644 1.00 12.44 C ATOM 399 O LYS A 255 -10.960 -1.417 -6.298 1.00 73.13 O ATOM 400 CB LYS A 255 -8.198 -2.736 -7.180 1.00 23.34 C ATOM 401 CG LYS A 255 -9.171 -2.856 -8.360 1.00 44.53 C ATOM 402 CD LYS A 255 -9.093 -1.681 -9.324 1.00 33.42 C ATOM 403 CE LYS A 255 -10.381 -1.520 -10.122 1.00 24.34 C ATOM 404 NZ LYS A 255 -10.740 -2.762 -10.856 1.00 11.23 N ATOM 0 H LYS A 255 -6.985 -2.631 -5.049 1.00 64.21 H new ATOM 0 HA LYS A 255 -8.484 -0.696 -6.476 1.00 53.03 H new ATOM 0 HB2 LYS A 255 -7.215 -2.476 -7.573 1.00 23.34 H new ATOM 0 HB3 LYS A 255 -8.105 -3.716 -6.713 1.00 23.34 H new ATOM 0 HG2 LYS A 255 -8.961 -3.778 -8.903 1.00 44.53 H new ATOM 0 HG3 LYS A 255 -10.188 -2.936 -7.977 1.00 44.53 H new ATOM 0 HD2 LYS A 255 -8.893 -0.766 -8.767 1.00 33.42 H new ATOM 0 HD3 LYS A 255 -8.257 -1.826 -10.008 1.00 33.42 H new ATOM 0 HE2 LYS A 255 -11.194 -1.249 -9.448 1.00 24.34 H new ATOM 0 HE3 LYS A 255 -10.268 -0.700 -10.831 1.00 24.34 H new ATOM 0 HZ1 LYS A 255 -11.553 -2.575 -11.477 1.00 11.23 H new ATOM 0 HZ2 LYS A 255 -9.930 -3.073 -11.429 1.00 11.23 H new ATOM 0 HZ3 LYS A 255 -10.989 -3.508 -10.175 1.00 11.23 H new ATOM 418 N GLN A 256 -10.243 -2.628 -4.523 1.00 50.52 N ATOM 419 CA GLN A 256 -11.601 -2.825 -3.994 1.00 11.44 C ATOM 420 C GLN A 256 -12.255 -1.476 -3.586 1.00 55.12 C ATOM 421 O GLN A 256 -13.480 -1.362 -3.587 1.00 31.31 O ATOM 422 CB GLN A 256 -11.599 -3.839 -2.826 1.00 53.43 C ATOM 423 CG GLN A 256 -11.303 -3.261 -1.445 1.00 10.00 C ATOM 424 CD GLN A 256 -11.401 -4.295 -0.348 1.00 52.04 C ATOM 425 OE1 GLN A 256 -12.467 -4.502 0.227 1.00 30.52 O ATOM 426 NE2 GLN A 256 -10.294 -4.947 -0.044 1.00 63.23 N ATOM 0 H GLN A 256 -9.504 -3.069 -3.976 1.00 50.52 H new ATOM 0 HA GLN A 256 -12.212 -3.246 -4.792 1.00 11.44 H new ATOM 0 HB2 GLN A 256 -12.572 -4.329 -2.793 1.00 53.43 H new ATOM 0 HB3 GLN A 256 -10.861 -4.611 -3.042 1.00 53.43 H new ATOM 0 HG2 GLN A 256 -10.302 -2.829 -1.443 1.00 10.00 H new ATOM 0 HG3 GLN A 256 -12.001 -2.450 -1.238 1.00 10.00 H new ATOM 0 HE21 GLN A 256 -9.429 -4.745 -0.546 1.00 63.23 H new ATOM 0 HE22 GLN A 256 -10.304 -5.653 0.693 1.00 63.23 H new ATOM 435 N ILE A 257 -11.432 -0.453 -3.275 1.00 75.53 N ATOM 436 CA ILE A 257 -11.925 0.915 -3.098 1.00 54.01 C ATOM 437 C ILE A 257 -11.120 1.864 -4.012 1.00 33.43 C ATOM 438 O ILE A 257 -10.296 2.648 -3.530 1.00 52.44 O ATOM 439 CB ILE A 257 -11.809 1.457 -1.631 1.00 64.23 C ATOM 440 CG1 ILE A 257 -12.142 0.399 -0.543 1.00 53.05 C ATOM 441 CG2 ILE A 257 -12.711 2.685 -1.463 1.00 73.54 C ATOM 442 CD1 ILE A 257 -13.601 -0.027 -0.449 1.00 62.00 C ATOM 0 H ILE A 257 -10.426 -0.555 -3.143 1.00 75.53 H new ATOM 0 HA ILE A 257 -12.985 0.885 -3.351 1.00 54.01 H new ATOM 0 HB ILE A 257 -10.763 1.726 -1.481 1.00 64.23 H new ATOM 0 HG12 ILE A 257 -11.537 -0.488 -0.730 1.00 53.05 H new ATOM 0 HG13 ILE A 257 -11.837 0.795 0.426 1.00 53.05 H new ATOM 0 HG21 ILE A 257 -12.629 3.060 -0.443 1.00 73.54 H new ATOM 0 HG22 ILE A 257 -12.401 3.462 -2.161 1.00 73.54 H new ATOM 0 HG23 ILE A 257 -13.745 2.407 -1.665 1.00 73.54 H new ATOM 0 HD11 ILE A 257 -13.714 -0.767 0.343 1.00 62.00 H new ATOM 0 HD12 ILE A 257 -14.220 0.842 -0.225 1.00 62.00 H new ATOM 0 HD13 ILE A 257 -13.915 -0.461 -1.398 1.00 62.00 H new ATOM 454 N GLY A 258 -11.275 1.741 -5.328 1.00 74.55 N ATOM 455 CA GLY A 258 -10.691 2.737 -6.211 1.00 21.23 C ATOM 456 C GLY A 258 -10.195 2.192 -7.535 1.00 14.34 C ATOM 457 O GLY A 258 -10.358 1.016 -7.840 1.00 74.22 O ATOM 0 H GLY A 258 -11.783 0.987 -5.791 1.00 74.55 H new ATOM 0 HA2 GLY A 258 -11.434 3.510 -6.407 1.00 21.23 H new ATOM 0 HA3 GLY A 258 -9.859 3.217 -5.696 1.00 21.23 H new ATOM 461 N ILE A 259 -9.603 3.079 -8.326 1.00 53.40 N ATOM 462 CA ILE A 259 -9.000 2.727 -9.608 1.00 0.21 C ATOM 463 C ILE A 259 -7.471 2.742 -9.481 1.00 24.20 C ATOM 464 O ILE A 259 -6.909 3.622 -8.818 1.00 34.20 O ATOM 465 CB ILE A 259 -9.498 3.688 -10.750 1.00 54.24 C ATOM 466 CG1 ILE A 259 -10.967 3.388 -11.099 1.00 52.34 C ATOM 467 CG2 ILE A 259 -8.636 3.626 -12.018 1.00 14.33 C ATOM 468 CD1 ILE A 259 -11.964 4.326 -10.442 1.00 32.42 C ATOM 0 H ILE A 259 -9.527 4.070 -8.095 1.00 53.40 H new ATOM 0 HA ILE A 259 -9.312 1.719 -9.883 1.00 0.21 H new ATOM 0 HB ILE A 259 -9.407 4.701 -10.358 1.00 54.24 H new ATOM 0 HG12 ILE A 259 -11.091 3.443 -12.181 1.00 52.34 H new ATOM 0 HG13 ILE A 259 -11.198 2.365 -10.803 1.00 52.34 H new ATOM 0 HG21 ILE A 259 -9.036 4.313 -12.764 1.00 14.33 H new ATOM 0 HG22 ILE A 259 -7.612 3.909 -11.776 1.00 14.33 H new ATOM 0 HG23 ILE A 259 -8.647 2.611 -12.416 1.00 14.33 H new ATOM 0 HD11 ILE A 259 -12.975 4.048 -10.738 1.00 32.42 H new ATOM 0 HD12 ILE A 259 -11.871 4.255 -9.358 1.00 32.42 H new ATOM 0 HD13 ILE A 259 -11.762 5.350 -10.757 1.00 32.42 H new ATOM 480 N ILE A 260 -6.819 1.741 -10.093 1.00 53.24 N ATOM 481 CA ILE A 260 -5.355 1.662 -10.133 1.00 13.52 C ATOM 482 C ILE A 260 -4.792 2.803 -10.975 1.00 4.24 C ATOM 483 O ILE A 260 -5.040 2.892 -12.182 1.00 3.23 O ATOM 484 CB ILE A 260 -4.868 0.293 -10.710 1.00 33.31 C ATOM 485 CG1 ILE A 260 -5.405 -0.886 -9.882 1.00 50.22 C ATOM 486 CG2 ILE A 260 -3.342 0.210 -10.797 1.00 62.11 C ATOM 487 CD1 ILE A 260 -5.155 -0.767 -8.393 1.00 44.02 C ATOM 0 H ILE A 260 -7.289 0.971 -10.569 1.00 53.24 H new ATOM 0 HA ILE A 260 -4.991 1.747 -9.109 1.00 13.52 H new ATOM 0 HB ILE A 260 -5.268 0.228 -11.722 1.00 33.31 H new ATOM 0 HG12 ILE A 260 -6.478 -0.976 -10.052 1.00 50.22 H new ATOM 0 HG13 ILE A 260 -4.947 -1.807 -10.243 1.00 50.22 H new ATOM 0 HG21 ILE A 260 -3.053 -0.759 -11.204 1.00 62.11 H new ATOM 0 HG22 ILE A 260 -2.971 1.002 -11.448 1.00 62.11 H new ATOM 0 HG23 ILE A 260 -2.914 0.328 -9.802 1.00 62.11 H new ATOM 0 HD11 ILE A 260 -5.565 -1.639 -7.884 1.00 44.02 H new ATOM 0 HD12 ILE A 260 -4.082 -0.710 -8.208 1.00 44.02 H new ATOM 0 HD13 ILE A 260 -5.637 0.134 -8.014 1.00 44.02 H new ATOM 499 N LYS A 261 -4.041 3.670 -10.319 1.00 43.15 N ATOM 500 CA LYS A 261 -3.489 4.841 -10.961 1.00 72.40 C ATOM 501 C LYS A 261 -2.061 4.590 -11.427 1.00 1.34 C ATOM 502 O LYS A 261 -1.260 3.946 -10.737 1.00 11.32 O ATOM 503 CB LYS A 261 -3.511 6.024 -9.994 1.00 35.43 C ATOM 504 CG LYS A 261 -3.176 7.363 -10.644 1.00 15.24 C ATOM 505 CD LYS A 261 -2.248 8.200 -9.780 1.00 2.14 C ATOM 506 CE LYS A 261 -2.193 9.652 -10.250 1.00 30.13 C ATOM 507 NZ LYS A 261 -3.463 10.385 -9.989 1.00 1.05 N ATOM 0 H LYS A 261 -3.800 3.580 -9.332 1.00 43.15 H new ATOM 0 HA LYS A 261 -4.101 5.068 -11.834 1.00 72.40 H new ATOM 0 HB2 LYS A 261 -4.499 6.090 -9.539 1.00 35.43 H new ATOM 0 HB3 LYS A 261 -2.801 5.835 -9.189 1.00 35.43 H new ATOM 0 HG2 LYS A 261 -2.709 7.188 -11.613 1.00 15.24 H new ATOM 0 HG3 LYS A 261 -4.097 7.917 -10.829 1.00 15.24 H new ATOM 0 HD2 LYS A 261 -2.586 8.166 -8.744 1.00 2.14 H new ATOM 0 HD3 LYS A 261 -1.246 7.772 -9.803 1.00 2.14 H new ATOM 0 HE2 LYS A 261 -1.372 10.163 -9.746 1.00 30.13 H new ATOM 0 HE3 LYS A 261 -1.976 9.677 -11.318 1.00 30.13 H new ATOM 0 HZ1 LYS A 261 -3.351 11.382 -10.264 1.00 1.05 H new ATOM 0 HZ2 LYS A 261 -4.231 9.957 -10.544 1.00 1.05 H new ATOM 0 HZ3 LYS A 261 -3.694 10.329 -8.977 1.00 1.05 H new ATOM 521 N THR A 262 -1.767 5.091 -12.609 1.00 41.24 N ATOM 522 CA THR A 262 -0.409 5.200 -13.081 1.00 21.20 C ATOM 523 C THR A 262 0.164 6.535 -12.582 1.00 71.23 C ATOM 524 O THR A 262 -0.354 7.607 -12.916 1.00 65.54 O ATOM 525 CB THR A 262 -0.374 5.134 -14.624 1.00 20.02 C ATOM 526 OG1 THR A 262 -1.076 3.968 -15.079 1.00 52.32 O ATOM 527 CG2 THR A 262 1.048 5.095 -15.155 1.00 43.22 C ATOM 0 H THR A 262 -2.466 5.434 -13.268 1.00 41.24 H new ATOM 0 HA THR A 262 0.192 4.374 -12.700 1.00 21.20 H new ATOM 0 HB THR A 262 -0.856 6.036 -15.001 1.00 20.02 H new ATOM 0 HG1 THR A 262 -1.052 3.933 -16.058 1.00 52.32 H new ATOM 0 HG21 THR A 262 1.029 5.049 -16.244 1.00 43.22 H new ATOM 0 HG22 THR A 262 1.579 5.993 -14.839 1.00 43.22 H new ATOM 0 HG23 THR A 262 1.559 4.215 -14.764 1.00 43.22 H new ATOM 535 N ASN A 263 1.210 6.459 -11.758 1.00 52.42 N ATOM 536 CA ASN A 263 1.816 7.651 -11.160 1.00 24.04 C ATOM 537 C ASN A 263 2.713 8.340 -12.177 1.00 30.00 C ATOM 538 O ASN A 263 3.541 7.698 -12.782 1.00 42.21 O ATOM 539 CB ASN A 263 2.640 7.270 -9.925 1.00 75.24 C ATOM 540 CG ASN A 263 2.750 8.387 -8.895 1.00 4.04 C ATOM 541 OD1 ASN A 263 2.731 9.576 -9.224 1.00 14.02 O ATOM 542 ND2 ASN A 263 2.882 8.007 -7.632 1.00 52.23 N ATOM 0 H ASN A 263 1.657 5.582 -11.489 1.00 52.42 H new ATOM 0 HA ASN A 263 1.020 8.331 -10.857 1.00 24.04 H new ATOM 0 HB2 ASN A 263 2.190 6.396 -9.454 1.00 75.24 H new ATOM 0 HB3 ASN A 263 3.642 6.980 -10.242 1.00 75.24 H new ATOM 0 HD21 ASN A 263 2.972 8.707 -6.896 1.00 52.23 H new ATOM 0 HD22 ASN A 263 2.894 7.015 -7.397 1.00 52.23 H new ATOM 549 N LYS A 264 2.562 9.649 -12.313 1.00 61.34 N ATOM 550 CA LYS A 264 3.282 10.444 -13.317 1.00 23.35 C ATOM 551 C LYS A 264 4.745 10.741 -12.951 1.00 31.32 C ATOM 552 O LYS A 264 5.495 11.243 -13.791 1.00 75.20 O ATOM 553 CB LYS A 264 2.515 11.742 -13.586 1.00 2.35 C ATOM 554 CG LYS A 264 1.404 11.573 -14.620 1.00 61.10 C ATOM 555 CD LYS A 264 1.878 11.915 -16.030 1.00 13.22 C ATOM 556 CE LYS A 264 1.988 13.424 -16.262 1.00 72.24 C ATOM 557 NZ LYS A 264 0.655 14.098 -16.284 1.00 71.13 N ATOM 0 H LYS A 264 1.933 10.201 -11.729 1.00 61.34 H new ATOM 0 HA LYS A 264 3.329 9.838 -14.222 1.00 23.35 H new ATOM 0 HB2 LYS A 264 2.084 12.103 -12.652 1.00 2.35 H new ATOM 0 HB3 LYS A 264 3.212 12.505 -13.931 1.00 2.35 H new ATOM 0 HG2 LYS A 264 1.042 10.545 -14.599 1.00 61.10 H new ATOM 0 HG3 LYS A 264 0.562 12.213 -14.355 1.00 61.10 H new ATOM 0 HD2 LYS A 264 2.849 11.452 -16.206 1.00 13.22 H new ATOM 0 HD3 LYS A 264 1.186 11.489 -16.756 1.00 13.22 H new ATOM 0 HE2 LYS A 264 2.602 13.865 -15.477 1.00 72.24 H new ATOM 0 HE3 LYS A 264 2.500 13.607 -17.207 1.00 72.24 H new ATOM 0 HZ1 LYS A 264 0.760 15.063 -16.658 1.00 71.13 H new ATOM 0 HZ2 LYS A 264 0.004 13.560 -16.891 1.00 71.13 H new ATOM 0 HZ3 LYS A 264 0.272 14.141 -15.318 1.00 71.13 H new ATOM 571 N LYS A 265 5.144 10.442 -11.703 1.00 21.34 N ATOM 572 CA LYS A 265 6.533 10.635 -11.264 1.00 64.11 C ATOM 573 C LYS A 265 7.493 9.622 -11.934 1.00 71.44 C ATOM 574 O LYS A 265 8.659 9.930 -12.171 1.00 4.41 O ATOM 575 CB LYS A 265 6.633 10.546 -9.723 1.00 42.53 C ATOM 576 CG LYS A 265 6.306 9.174 -9.136 1.00 51.52 C ATOM 577 CD LYS A 265 6.475 9.142 -7.627 1.00 35.02 C ATOM 578 CE LYS A 265 6.289 7.743 -7.066 1.00 32.14 C ATOM 579 NZ LYS A 265 6.540 7.693 -5.597 1.00 31.31 N ATOM 0 H LYS A 265 4.525 10.067 -10.984 1.00 21.34 H new ATOM 0 HA LYS A 265 6.841 11.633 -11.577 1.00 64.11 H new ATOM 0 HB2 LYS A 265 7.644 10.822 -9.422 1.00 42.53 H new ATOM 0 HB3 LYS A 265 5.958 11.282 -9.286 1.00 42.53 H new ATOM 0 HG2 LYS A 265 5.281 8.906 -9.391 1.00 51.52 H new ATOM 0 HG3 LYS A 265 6.953 8.423 -9.589 1.00 51.52 H new ATOM 0 HD2 LYS A 265 7.467 9.509 -7.365 1.00 35.02 H new ATOM 0 HD3 LYS A 265 5.753 9.817 -7.166 1.00 35.02 H new ATOM 0 HE2 LYS A 265 5.275 7.401 -7.272 1.00 32.14 H new ATOM 0 HE3 LYS A 265 6.966 7.056 -7.573 1.00 32.14 H new ATOM 0 HZ1 LYS A 265 6.402 6.721 -5.254 1.00 31.31 H new ATOM 0 HZ2 LYS A 265 7.516 7.994 -5.401 1.00 31.31 H new ATOM 0 HZ3 LYS A 265 5.877 8.329 -5.110 1.00 31.31 H new ATOM 593 N THR A 266 6.987 8.418 -12.234 1.00 41.13 N ATOM 594 CA THR A 266 7.790 7.363 -12.847 1.00 24.33 C ATOM 595 C THR A 266 7.145 6.857 -14.156 1.00 75.14 C ATOM 596 O THR A 266 7.843 6.487 -15.100 1.00 73.12 O ATOM 597 CB THR A 266 8.055 6.201 -11.827 1.00 51.30 C ATOM 598 OG1 THR A 266 8.693 5.084 -12.456 1.00 74.23 O ATOM 599 CG2 THR A 266 6.781 5.734 -11.116 1.00 31.01 C ATOM 0 H THR A 266 6.017 8.154 -12.059 1.00 41.13 H new ATOM 0 HA THR A 266 8.759 7.783 -13.117 1.00 24.33 H new ATOM 0 HB THR A 266 8.724 6.616 -11.073 1.00 51.30 H new ATOM 0 HG1 THR A 266 8.845 4.378 -11.793 1.00 74.23 H new ATOM 0 HG21 THR A 266 7.025 4.929 -10.423 1.00 31.01 H new ATOM 0 HG22 THR A 266 6.345 6.568 -10.565 1.00 31.01 H new ATOM 0 HG23 THR A 266 6.064 5.373 -11.854 1.00 31.01 H new ATOM 607 N GLY A 267 5.807 6.891 -14.207 1.00 34.41 N ATOM 608 CA GLY A 267 5.054 6.423 -15.369 1.00 31.34 C ATOM 609 C GLY A 267 4.699 4.943 -15.277 1.00 11.13 C ATOM 610 O GLY A 267 4.191 4.357 -16.231 1.00 34.32 O ATOM 0 H GLY A 267 5.223 7.242 -13.448 1.00 34.41 H new ATOM 0 HA2 GLY A 267 4.139 7.008 -15.465 1.00 31.34 H new ATOM 0 HA3 GLY A 267 5.639 6.598 -16.272 1.00 31.34 H new ATOM 614 N LYS A 268 4.995 4.347 -14.122 1.00 11.21 N ATOM 615 CA LYS A 268 4.617 2.974 -13.810 1.00 15.44 C ATOM 616 C LYS A 268 3.337 2.902 -12.954 1.00 5.15 C ATOM 617 O LYS A 268 3.026 3.847 -12.214 1.00 22.44 O ATOM 618 CB LYS A 268 5.777 2.247 -13.114 1.00 63.34 C ATOM 619 CG LYS A 268 6.764 1.624 -14.090 1.00 75.54 C ATOM 620 CD LYS A 268 7.818 0.778 -13.383 1.00 74.43 C ATOM 621 CE LYS A 268 8.606 -0.071 -14.374 1.00 11.32 C ATOM 622 NZ LYS A 268 9.627 -0.906 -13.699 1.00 13.31 N ATOM 0 H LYS A 268 5.508 4.810 -13.372 1.00 11.21 H new ATOM 0 HA LYS A 268 4.398 2.473 -14.753 1.00 15.44 H new ATOM 0 HB2 LYS A 268 6.306 2.951 -12.472 1.00 63.34 H new ATOM 0 HB3 LYS A 268 5.374 1.468 -12.468 1.00 63.34 H new ATOM 0 HG2 LYS A 268 6.223 1.004 -14.805 1.00 75.54 H new ATOM 0 HG3 LYS A 268 7.256 2.413 -14.660 1.00 75.54 H new ATOM 0 HD2 LYS A 268 8.500 1.428 -12.835 1.00 74.43 H new ATOM 0 HD3 LYS A 268 7.336 0.131 -12.650 1.00 74.43 H new ATOM 0 HE2 LYS A 268 7.920 -0.713 -14.927 1.00 11.32 H new ATOM 0 HE3 LYS A 268 9.092 0.579 -15.102 1.00 11.32 H new ATOM 0 HZ1 LYS A 268 10.140 -1.468 -14.408 1.00 13.31 H new ATOM 0 HZ2 LYS A 268 10.297 -0.293 -13.192 1.00 13.31 H new ATOM 0 HZ3 LYS A 268 9.162 -1.544 -13.023 1.00 13.31 H new ATOM 636 N PRO A 269 2.560 1.786 -13.070 1.00 73.40 N ATOM 637 CA PRO A 269 1.421 1.481 -12.172 1.00 22.10 C ATOM 638 C PRO A 269 1.872 1.210 -10.731 1.00 21.04 C ATOM 639 O PRO A 269 3.024 0.823 -10.494 1.00 14.31 O ATOM 640 CB PRO A 269 0.800 0.220 -12.784 1.00 31.24 C ATOM 641 CG PRO A 269 1.900 -0.404 -13.565 1.00 34.50 C ATOM 642 CD PRO A 269 2.707 0.741 -14.108 1.00 41.12 C ATOM 0 HA PRO A 269 0.727 2.319 -12.103 1.00 22.10 H new ATOM 0 HB2 PRO A 269 0.431 -0.455 -12.011 1.00 31.24 H new ATOM 0 HB3 PRO A 269 -0.048 0.467 -13.423 1.00 31.24 H new ATOM 0 HG2 PRO A 269 2.511 -1.050 -12.935 1.00 34.50 H new ATOM 0 HG3 PRO A 269 1.507 -1.024 -14.371 1.00 34.50 H new ATOM 0 HD2 PRO A 269 3.751 0.463 -14.254 1.00 41.12 H new ATOM 0 HD3 PRO A 269 2.329 1.077 -15.073 1.00 41.12 H new ATOM 650 N MET A 270 0.970 1.447 -9.780 1.00 11.02 N ATOM 651 CA MET A 270 1.292 1.388 -8.355 1.00 60.43 C ATOM 652 C MET A 270 1.542 -0.032 -7.833 1.00 14.13 C ATOM 653 O MET A 270 0.610 -0.771 -7.537 1.00 34.44 O ATOM 654 CB MET A 270 0.127 1.998 -7.561 1.00 64.42 C ATOM 655 CG MET A 270 -1.269 1.649 -8.089 1.00 62.21 C ATOM 656 SD MET A 270 -2.547 1.619 -6.820 1.00 11.24 S ATOM 657 CE MET A 270 -2.346 -0.033 -6.150 1.00 41.01 C ATOM 0 H MET A 270 -0.003 1.685 -9.975 1.00 11.02 H new ATOM 0 HA MET A 270 2.220 1.944 -8.222 1.00 60.43 H new ATOM 0 HB2 MET A 270 0.200 1.667 -6.525 1.00 64.42 H new ATOM 0 HB3 MET A 270 0.237 3.082 -7.558 1.00 64.42 H new ATOM 0 HG2 MET A 270 -1.548 2.373 -8.854 1.00 62.21 H new ATOM 0 HG3 MET A 270 -1.229 0.673 -8.573 1.00 62.21 H new ATOM 0 HE1 MET A 270 -2.887 -0.111 -5.207 1.00 41.01 H new ATOM 0 HE2 MET A 270 -2.741 -0.763 -6.857 1.00 41.01 H new ATOM 0 HE3 MET A 270 -1.288 -0.230 -5.979 1.00 41.01 H new ATOM 667 N ILE A 271 2.822 -0.380 -7.712 1.00 1.44 N ATOM 668 CA ILE A 271 3.293 -1.533 -6.942 1.00 31.41 C ATOM 669 C ILE A 271 4.631 -1.146 -6.301 1.00 24.20 C ATOM 670 O ILE A 271 5.587 -0.872 -7.035 1.00 1.34 O ATOM 671 CB ILE A 271 3.501 -2.816 -7.839 1.00 30.01 C ATOM 672 CG1 ILE A 271 2.173 -3.393 -8.386 1.00 33.14 C ATOM 673 CG2 ILE A 271 4.279 -3.921 -7.102 1.00 40.42 C ATOM 674 CD1 ILE A 271 1.213 -3.920 -7.330 1.00 62.41 C ATOM 0 H ILE A 271 3.578 0.142 -8.156 1.00 1.44 H new ATOM 0 HA ILE A 271 2.539 -1.784 -6.196 1.00 31.41 H new ATOM 0 HB ILE A 271 4.094 -2.475 -8.688 1.00 30.01 H new ATOM 0 HG12 ILE A 271 1.667 -2.616 -8.959 1.00 33.14 H new ATOM 0 HG13 ILE A 271 2.405 -4.201 -9.079 1.00 33.14 H new ATOM 0 HG21 ILE A 271 4.397 -4.783 -7.759 1.00 40.42 H new ATOM 0 HG22 ILE A 271 5.261 -3.545 -6.816 1.00 40.42 H new ATOM 0 HG23 ILE A 271 3.730 -4.218 -6.209 1.00 40.42 H new ATOM 0 HD11 ILE A 271 0.314 -4.302 -7.814 1.00 62.41 H new ATOM 0 HD12 ILE A 271 1.693 -4.723 -6.770 1.00 62.41 H new ATOM 0 HD13 ILE A 271 0.943 -3.113 -6.648 1.00 62.41 H new ATOM 686 N ASN A 272 4.709 -1.054 -4.972 1.00 3.01 N ATOM 687 CA ASN A 272 6.012 -1.098 -4.288 1.00 62.33 C ATOM 688 C ASN A 272 5.985 -2.117 -3.162 1.00 74.02 C ATOM 689 O ASN A 272 5.231 -1.953 -2.205 1.00 64.21 O ATOM 690 CB ASN A 272 6.454 0.265 -3.737 1.00 31.12 C ATOM 691 CG ASN A 272 6.720 1.304 -4.813 1.00 64.45 C ATOM 692 OD1 ASN A 272 7.832 1.417 -5.321 1.00 43.34 O ATOM 693 ND2 ASN A 272 5.708 2.095 -5.138 1.00 53.23 N ATOM 0 H ASN A 272 3.904 -0.950 -4.354 1.00 3.01 H new ATOM 0 HA ASN A 272 6.742 -1.391 -5.043 1.00 62.33 H new ATOM 0 HB2 ASN A 272 5.684 0.642 -3.064 1.00 31.12 H new ATOM 0 HB3 ASN A 272 7.358 0.131 -3.143 1.00 31.12 H new ATOM 0 HD21 ASN A 272 5.838 2.830 -5.833 1.00 53.23 H new ATOM 0 HD22 ASN A 272 4.799 1.969 -4.693 1.00 53.23 H new ATOM 700 N LEU A 273 6.801 -3.157 -3.269 1.00 23.14 N ATOM 701 CA LEU A 273 6.866 -4.188 -2.239 1.00 45.31 C ATOM 702 C LEU A 273 8.239 -4.161 -1.563 1.00 41.14 C ATOM 703 O LEU A 273 9.253 -4.483 -2.187 1.00 5.13 O ATOM 704 CB LEU A 273 6.602 -5.558 -2.885 1.00 4.25 C ATOM 705 CG LEU A 273 5.570 -6.475 -2.200 1.00 73.25 C ATOM 706 CD1 LEU A 273 5.996 -6.852 -0.790 1.00 63.22 C ATOM 707 CD2 LEU A 273 4.184 -5.841 -2.182 1.00 24.34 C ATOM 0 H LEU A 273 7.428 -3.310 -4.059 1.00 23.14 H new ATOM 0 HA LEU A 273 6.109 -4.003 -1.477 1.00 45.31 H new ATOM 0 HB2 LEU A 273 6.275 -5.390 -3.911 1.00 4.25 H new ATOM 0 HB3 LEU A 273 7.549 -6.095 -2.936 1.00 4.25 H new ATOM 0 HG LEU A 273 5.521 -7.389 -2.792 1.00 73.25 H new ATOM 0 HD11 LEU A 273 5.241 -7.499 -0.343 1.00 63.22 H new ATOM 0 HD12 LEU A 273 6.950 -7.379 -0.827 1.00 63.22 H new ATOM 0 HD13 LEU A 273 6.103 -5.949 -0.189 1.00 63.22 H new ATOM 0 HD21 LEU A 273 3.482 -6.515 -1.692 1.00 24.34 H new ATOM 0 HD22 LEU A 273 4.222 -4.898 -1.637 1.00 24.34 H new ATOM 0 HD23 LEU A 273 3.855 -5.656 -3.205 1.00 24.34 H new ATOM 719 N TYR A 274 8.270 -3.755 -0.296 1.00 43.51 N ATOM 720 CA TYR A 274 9.514 -3.686 0.467 1.00 73.00 C ATOM 721 C TYR A 274 9.625 -4.865 1.436 1.00 15.15 C ATOM 722 O TYR A 274 8.857 -4.966 2.432 1.00 41.52 O ATOM 723 CB TYR A 274 9.613 -2.365 1.239 1.00 53.13 C ATOM 724 CG TYR A 274 9.397 -1.115 0.410 1.00 0.33 C ATOM 725 CD1 TYR A 274 10.280 -0.766 -0.602 1.00 23.51 C ATOM 726 CD2 TYR A 274 8.307 -0.285 0.644 1.00 71.22 C ATOM 727 CE1 TYR A 274 10.084 0.375 -1.355 1.00 63.32 C ATOM 728 CE2 TYR A 274 8.104 0.856 -0.103 1.00 52.53 C ATOM 729 CZ TYR A 274 8.995 1.183 -1.102 1.00 70.21 C ATOM 730 OH TYR A 274 8.798 2.324 -1.851 1.00 31.23 O ATOM 0 H TYR A 274 7.443 -3.467 0.227 1.00 43.51 H new ATOM 0 HA TYR A 274 10.339 -3.737 -0.243 1.00 73.00 H new ATOM 0 HB2 TYR A 274 8.880 -2.378 2.045 1.00 53.13 H new ATOM 0 HB3 TYR A 274 10.597 -2.307 1.704 1.00 53.13 H new ATOM 0 HD1 TYR A 274 11.133 -1.396 -0.804 1.00 23.51 H new ATOM 0 HD2 TYR A 274 7.606 -0.538 1.425 1.00 71.22 H new ATOM 0 HE1 TYR A 274 10.781 0.634 -2.139 1.00 63.32 H new ATOM 0 HE2 TYR A 274 7.252 1.490 0.094 1.00 52.53 H new ATOM 0 HH TYR A 274 9.165 2.192 -2.750 1.00 31.23 H new ATOM 740 N THR A 275 10.601 -5.739 1.141 1.00 24.10 N ATOM 741 CA THR A 275 10.863 -6.964 1.902 1.00 60.52 C ATOM 742 C THR A 275 12.376 -7.215 2.006 1.00 20.02 C ATOM 743 O THR A 275 13.057 -7.285 0.976 1.00 23.15 O ATOM 744 CB THR A 275 10.203 -8.203 1.228 1.00 21.10 C ATOM 745 OG1 THR A 275 10.531 -8.247 -0.169 1.00 3.44 O ATOM 746 CG2 THR A 275 8.689 -8.208 1.382 1.00 65.45 C ATOM 0 H THR A 275 11.238 -5.609 0.355 1.00 24.10 H new ATOM 0 HA THR A 275 10.435 -6.826 2.895 1.00 60.52 H new ATOM 0 HB THR A 275 10.599 -9.083 1.735 1.00 21.10 H new ATOM 0 HG1 THR A 275 11.475 -8.014 -0.291 1.00 3.44 H new ATOM 0 HG21 THR A 275 8.277 -9.092 0.895 1.00 65.45 H new ATOM 0 HG22 THR A 275 8.431 -8.223 2.441 1.00 65.45 H new ATOM 0 HG23 THR A 275 8.273 -7.312 0.920 1.00 65.45 H new ATOM 754 N ASP A 276 12.914 -7.325 3.229 1.00 53.31 N ATOM 755 CA ASP A 276 14.355 -7.571 3.406 1.00 33.24 C ATOM 756 C ASP A 276 14.684 -9.064 3.344 1.00 45.24 C ATOM 757 O ASP A 276 14.285 -9.836 4.206 1.00 34.40 O ATOM 758 CB ASP A 276 14.843 -6.992 4.729 1.00 52.41 C ATOM 759 CG ASP A 276 16.306 -6.618 4.686 1.00 2.35 C ATOM 760 OD1 ASP A 276 17.145 -7.477 4.986 1.00 14.21 O ATOM 761 OD2 ASP A 276 16.608 -5.452 4.344 1.00 22.32 O ATOM 0 H ASP A 276 12.385 -7.249 4.098 1.00 53.31 H new ATOM 0 HA ASP A 276 14.870 -7.073 2.585 1.00 33.24 H new ATOM 0 HB2 ASP A 276 14.252 -6.110 4.977 1.00 52.41 H new ATOM 0 HB3 ASP A 276 14.679 -7.720 5.524 1.00 52.41 H new ATOM 766 N LYS A 277 15.391 -9.465 2.299 1.00 71.13 N ATOM 767 CA LYS A 277 15.843 -10.855 2.142 1.00 64.33 C ATOM 768 C LYS A 277 17.189 -11.130 2.822 1.00 40.13 C ATOM 769 O LYS A 277 17.597 -12.289 2.929 1.00 31.24 O ATOM 770 CB LYS A 277 15.864 -11.255 0.664 1.00 62.41 C ATOM 771 CG LYS A 277 14.592 -11.974 0.177 1.00 55.33 C ATOM 772 CD LYS A 277 13.298 -11.240 0.556 1.00 71.44 C ATOM 773 CE LYS A 277 12.270 -11.262 -0.568 1.00 11.32 C ATOM 774 NZ LYS A 277 11.786 -12.634 -0.892 1.00 75.21 N ATOM 0 H LYS A 277 15.670 -8.848 1.536 1.00 71.13 H new ATOM 0 HA LYS A 277 15.116 -11.483 2.658 1.00 64.33 H new ATOM 0 HB2 LYS A 277 16.013 -10.359 0.061 1.00 62.41 H new ATOM 0 HB3 LYS A 277 16.722 -11.904 0.489 1.00 62.41 H new ATOM 0 HG2 LYS A 277 14.636 -12.082 -0.907 1.00 55.33 H new ATOM 0 HG3 LYS A 277 14.568 -12.980 0.597 1.00 55.33 H new ATOM 0 HD2 LYS A 277 12.869 -11.700 1.446 1.00 71.44 H new ATOM 0 HD3 LYS A 277 13.531 -10.206 0.812 1.00 71.44 H new ATOM 0 HE2 LYS A 277 11.420 -10.640 -0.287 1.00 11.32 H new ATOM 0 HE3 LYS A 277 12.708 -10.817 -1.462 1.00 11.32 H new ATOM 0 HZ1 LYS A 277 11.090 -12.583 -1.663 1.00 75.21 H new ATOM 0 HZ2 LYS A 277 12.589 -13.224 -1.189 1.00 75.21 H new ATOM 0 HZ3 LYS A 277 11.341 -13.053 -0.051 1.00 75.21 H new ATOM 788 N ASP A 278 17.882 -10.067 3.258 1.00 4.15 N ATOM 789 CA ASP A 278 19.174 -10.205 3.950 1.00 42.22 C ATOM 790 C ASP A 278 18.953 -10.668 5.396 1.00 41.42 C ATOM 791 O ASP A 278 19.803 -11.337 5.988 1.00 34.10 O ATOM 792 CB ASP A 278 19.949 -8.886 3.936 1.00 61.32 C ATOM 793 CG ASP A 278 21.430 -9.079 3.653 1.00 41.14 C ATOM 794 OD1 ASP A 278 22.213 -9.265 4.613 1.00 32.31 O ATOM 795 OD2 ASP A 278 21.816 -9.032 2.463 1.00 12.04 O ATOM 0 H ASP A 278 17.570 -9.103 3.144 1.00 4.15 H new ATOM 0 HA ASP A 278 19.763 -10.953 3.420 1.00 42.22 H new ATOM 0 HB2 ASP A 278 19.522 -8.226 3.181 1.00 61.32 H new ATOM 0 HB3 ASP A 278 19.829 -8.389 4.898 1.00 61.32 H new ATOM 800 N THR A 279 17.794 -10.302 5.952 1.00 21.41 N ATOM 801 CA THR A 279 17.338 -10.852 7.224 1.00 63.01 C ATOM 802 C THR A 279 16.513 -12.118 6.971 1.00 14.22 C ATOM 803 O THR A 279 16.341 -12.953 7.860 1.00 14.12 O ATOM 804 CB THR A 279 16.473 -9.833 8.005 1.00 70.21 C ATOM 805 OG1 THR A 279 15.369 -9.400 7.195 1.00 42.11 O ATOM 806 CG2 THR A 279 17.298 -8.627 8.431 1.00 44.32 C ATOM 0 H THR A 279 17.155 -9.624 5.536 1.00 21.41 H new ATOM 0 HA THR A 279 18.219 -11.087 7.822 1.00 63.01 H new ATOM 0 HB THR A 279 16.096 -10.328 8.900 1.00 70.21 H new ATOM 0 HG1 THR A 279 14.827 -8.757 7.698 1.00 42.11 H new ATOM 0 HG21 THR A 279 16.665 -7.928 8.977 1.00 44.32 H new ATOM 0 HG22 THR A 279 18.116 -8.954 9.073 1.00 44.32 H new ATOM 0 HG23 THR A 279 17.705 -8.134 7.548 1.00 44.32 H new ATOM 814 N GLY A 280 15.987 -12.229 5.748 1.00 43.51 N ATOM 815 CA GLY A 280 15.276 -13.420 5.318 1.00 51.52 C ATOM 816 C GLY A 280 13.775 -13.260 5.400 1.00 4.10 C ATOM 817 O GLY A 280 13.043 -13.780 4.555 1.00 51.54 O ATOM 0 H GLY A 280 16.045 -11.498 5.039 1.00 43.51 H new ATOM 0 HA2 GLY A 280 15.557 -13.656 4.292 1.00 51.52 H new ATOM 0 HA3 GLY A 280 15.582 -14.265 5.935 1.00 51.52 H new ATOM 821 N LYS A 281 13.319 -12.537 6.416 1.00 12.00 N ATOM 822 CA LYS A 281 11.900 -12.309 6.611 1.00 14.14 C ATOM 823 C LYS A 281 11.478 -10.952 6.053 1.00 33.12 C ATOM 824 O LYS A 281 12.214 -9.971 6.182 1.00 32.41 O ATOM 825 CB LYS A 281 11.526 -12.395 8.095 1.00 0.21 C ATOM 826 CG LYS A 281 11.601 -13.801 8.664 1.00 23.55 C ATOM 827 CD LYS A 281 10.529 -14.026 9.720 1.00 14.23 C ATOM 828 CE LYS A 281 10.524 -15.460 10.235 1.00 74.31 C ATOM 829 NZ LYS A 281 10.276 -16.457 9.150 1.00 24.40 N ATOM 0 H LYS A 281 13.917 -12.099 7.117 1.00 12.00 H new ATOM 0 HA LYS A 281 11.369 -13.092 6.069 1.00 14.14 H new ATOM 0 HB2 LYS A 281 12.190 -11.746 8.666 1.00 0.21 H new ATOM 0 HB3 LYS A 281 10.514 -12.012 8.228 1.00 0.21 H new ATOM 0 HG2 LYS A 281 11.482 -14.528 7.861 1.00 23.55 H new ATOM 0 HG3 LYS A 281 12.586 -13.967 9.101 1.00 23.55 H new ATOM 0 HD2 LYS A 281 10.692 -13.343 10.553 1.00 14.23 H new ATOM 0 HD3 LYS A 281 9.552 -13.789 9.300 1.00 14.23 H new ATOM 0 HE2 LYS A 281 11.481 -15.675 10.710 1.00 74.31 H new ATOM 0 HE3 LYS A 281 9.757 -15.564 11.002 1.00 74.31 H new ATOM 0 HZ1 LYS A 281 10.047 -17.380 9.572 1.00 24.40 H new ATOM 0 HZ2 LYS A 281 9.480 -16.138 8.561 1.00 24.40 H new ATOM 0 HZ3 LYS A 281 11.128 -16.548 8.561 1.00 24.40 H new ATOM 843 N PRO A 282 10.271 -10.888 5.433 1.00 61.51 N ATOM 844 CA PRO A 282 9.701 -9.644 4.892 1.00 33.22 C ATOM 845 C PRO A 282 9.565 -8.513 5.924 1.00 13.10 C ATOM 846 O PRO A 282 9.122 -8.730 7.055 1.00 63.22 O ATOM 847 CB PRO A 282 8.318 -10.072 4.380 1.00 54.23 C ATOM 848 CG PRO A 282 8.057 -11.419 4.949 1.00 22.34 C ATOM 849 CD PRO A 282 9.389 -12.042 5.164 1.00 3.22 C ATOM 0 HA PRO A 282 10.353 -9.223 4.127 1.00 33.22 H new ATOM 0 HB2 PRO A 282 7.552 -9.363 4.694 1.00 54.23 H new ATOM 0 HB3 PRO A 282 8.299 -10.101 3.291 1.00 54.23 H new ATOM 0 HG2 PRO A 282 7.505 -11.346 5.886 1.00 22.34 H new ATOM 0 HG3 PRO A 282 7.452 -12.019 4.269 1.00 22.34 H new ATOM 0 HD2 PRO A 282 9.375 -12.740 6.001 1.00 3.22 H new ATOM 0 HD3 PRO A 282 9.716 -12.602 4.288 1.00 3.22 H new ATOM 857 N LYS A 283 9.967 -7.310 5.490 1.00 12.51 N ATOM 858 CA LYS A 283 9.913 -6.081 6.297 1.00 30.14 C ATOM 859 C LYS A 283 8.483 -5.691 6.652 1.00 42.11 C ATOM 860 O LYS A 283 8.219 -5.197 7.747 1.00 33.21 O ATOM 861 CB LYS A 283 10.576 -4.934 5.529 1.00 64.40 C ATOM 862 CG LYS A 283 12.012 -4.661 5.944 1.00 62.14 C ATOM 863 CD LYS A 283 12.737 -3.806 4.911 1.00 64.32 C ATOM 864 CE LYS A 283 14.075 -3.299 5.437 1.00 0.30 C ATOM 865 NZ LYS A 283 14.974 -2.843 4.340 1.00 44.05 N ATOM 0 H LYS A 283 10.345 -7.160 4.554 1.00 12.51 H new ATOM 0 HA LYS A 283 10.447 -6.274 7.228 1.00 30.14 H new ATOM 0 HB2 LYS A 283 10.554 -5.163 4.464 1.00 64.40 H new ATOM 0 HB3 LYS A 283 9.989 -4.027 5.672 1.00 64.40 H new ATOM 0 HG2 LYS A 283 12.023 -4.155 6.910 1.00 62.14 H new ATOM 0 HG3 LYS A 283 12.541 -5.605 6.073 1.00 62.14 H new ATOM 0 HD2 LYS A 283 12.900 -4.390 4.005 1.00 64.32 H new ATOM 0 HD3 LYS A 283 12.110 -2.958 4.635 1.00 64.32 H new ATOM 0 HE2 LYS A 283 13.903 -2.475 6.130 1.00 0.30 H new ATOM 0 HE3 LYS A 283 14.566 -4.092 6.001 1.00 0.30 H new ATOM 0 HZ1 LYS A 283 15.472 -1.979 4.636 1.00 44.05 H new ATOM 0 HZ2 LYS A 283 15.668 -3.588 4.128 1.00 44.05 H new ATOM 0 HZ3 LYS A 283 14.410 -2.643 3.489 1.00 44.05 H new ATOM 879 N GLY A 284 7.571 -5.918 5.712 1.00 44.51 N ATOM 880 CA GLY A 284 6.174 -5.632 5.952 1.00 3.55 C ATOM 881 C GLY A 284 5.769 -4.270 5.463 1.00 25.14 C ATOM 882 O GLY A 284 4.777 -3.709 5.941 1.00 62.41 O ATOM 0 H GLY A 284 7.778 -6.296 4.787 1.00 44.51 H new ATOM 0 HA2 GLY A 284 5.563 -6.387 5.458 1.00 3.55 H new ATOM 0 HA3 GLY A 284 5.971 -5.705 7.020 1.00 3.55 H new ATOM 886 N GLU A 285 6.516 -3.743 4.494 1.00 51.45 N ATOM 887 CA GLU A 285 6.326 -2.371 4.065 1.00 72.12 C ATOM 888 C GLU A 285 5.904 -2.342 2.606 1.00 72.24 C ATOM 889 O GLU A 285 6.334 -3.175 1.812 1.00 41.55 O ATOM 890 CB GLU A 285 7.633 -1.593 4.301 1.00 71.22 C ATOM 891 CG GLU A 285 7.947 -1.315 5.770 1.00 21.50 C ATOM 892 CD GLU A 285 9.415 -0.993 6.007 1.00 74.13 C ATOM 893 OE1 GLU A 285 9.919 -0.009 5.422 1.00 72.32 O ATOM 894 OE2 GLU A 285 10.072 -1.740 6.763 1.00 14.30 O ATOM 0 H GLU A 285 7.252 -4.246 3.998 1.00 51.45 H new ATOM 0 HA GLU A 285 5.533 -1.895 4.642 1.00 72.12 H new ATOM 0 HB2 GLU A 285 8.459 -2.155 3.866 1.00 71.22 H new ATOM 0 HB3 GLU A 285 7.577 -0.644 3.768 1.00 71.22 H new ATOM 0 HG2 GLU A 285 7.336 -0.481 6.116 1.00 21.50 H new ATOM 0 HG3 GLU A 285 7.669 -2.183 6.367 1.00 21.50 H new ATOM 901 N ALA A 286 5.019 -1.419 2.271 1.00 13.31 N ATOM 902 CA ALA A 286 4.564 -1.244 0.898 1.00 63.54 C ATOM 903 C ALA A 286 4.156 0.205 0.650 1.00 12.24 C ATOM 904 O ALA A 286 3.795 0.910 1.586 1.00 2.10 O ATOM 905 CB ALA A 286 3.395 -2.187 0.606 1.00 14.21 C ATOM 0 H ALA A 286 4.596 -0.772 2.937 1.00 13.31 H new ATOM 0 HA ALA A 286 5.386 -1.488 0.225 1.00 63.54 H new ATOM 0 HB1 ALA A 286 3.063 -2.047 -0.423 1.00 14.21 H new ATOM 0 HB2 ALA A 286 3.716 -3.219 0.747 1.00 14.21 H new ATOM 0 HB3 ALA A 286 2.572 -1.967 1.286 1.00 14.21 H new ATOM 911 N THR A 287 4.238 0.659 -0.599 1.00 43.51 N ATOM 912 CA THR A 287 3.644 1.940 -0.989 1.00 25.34 C ATOM 913 C THR A 287 2.890 1.785 -2.306 1.00 71.13 C ATOM 914 O THR A 287 3.369 1.114 -3.232 1.00 50.13 O ATOM 915 CB THR A 287 4.675 3.102 -1.133 1.00 33.43 C ATOM 916 OG1 THR A 287 5.793 2.709 -1.918 1.00 12.11 O ATOM 917 CG2 THR A 287 5.162 3.618 0.213 1.00 2.23 C ATOM 0 H THR A 287 4.707 0.163 -1.357 1.00 43.51 H new ATOM 0 HA THR A 287 2.970 2.212 -0.177 1.00 25.34 H new ATOM 0 HB THR A 287 4.146 3.911 -1.637 1.00 33.43 H new ATOM 0 HG1 THR A 287 6.502 2.373 -1.332 1.00 12.11 H new ATOM 0 HG21 THR A 287 5.877 4.425 0.056 1.00 2.23 H new ATOM 0 HG22 THR A 287 4.314 3.991 0.788 1.00 2.23 H new ATOM 0 HG23 THR A 287 5.644 2.808 0.761 1.00 2.23 H new ATOM 925 N VAL A 288 1.701 2.381 -2.378 1.00 2.24 N ATOM 926 CA VAL A 288 0.861 2.332 -3.586 1.00 35.43 C ATOM 927 C VAL A 288 0.220 3.718 -3.846 1.00 20.14 C ATOM 928 O VAL A 288 0.029 4.498 -2.924 1.00 21.32 O ATOM 929 CB VAL A 288 -0.242 1.203 -3.564 1.00 22.10 C ATOM 930 CG1 VAL A 288 0.312 -0.205 -3.263 1.00 4.42 C ATOM 931 CG2 VAL A 288 -1.371 1.527 -2.604 1.00 33.01 C ATOM 0 H VAL A 288 1.290 2.910 -1.609 1.00 2.24 H new ATOM 0 HA VAL A 288 1.528 2.070 -4.407 1.00 35.43 H new ATOM 0 HB VAL A 288 -0.634 1.183 -4.581 1.00 22.10 H new ATOM 0 HG11 VAL A 288 -0.506 -0.926 -3.265 1.00 4.42 H new ATOM 0 HG12 VAL A 288 1.040 -0.480 -4.026 1.00 4.42 H new ATOM 0 HG13 VAL A 288 0.793 -0.205 -2.285 1.00 4.42 H new ATOM 0 HG21 VAL A 288 -2.106 0.723 -2.622 1.00 33.01 H new ATOM 0 HG22 VAL A 288 -0.972 1.631 -1.595 1.00 33.01 H new ATOM 0 HG23 VAL A 288 -1.847 2.460 -2.904 1.00 33.01 H new ATOM 941 N SER A 289 -0.032 4.039 -5.108 1.00 44.14 N ATOM 942 CA SER A 289 -0.526 5.359 -5.510 1.00 51.13 C ATOM 943 C SER A 289 -2.012 5.352 -5.889 1.00 0.20 C ATOM 944 O SER A 289 -2.397 4.736 -6.878 1.00 55.42 O ATOM 945 CB SER A 289 0.270 5.853 -6.715 1.00 40.25 C ATOM 946 OG SER A 289 -0.103 7.169 -7.066 1.00 52.05 O ATOM 0 H SER A 289 0.099 3.394 -5.887 1.00 44.14 H new ATOM 0 HA SER A 289 -0.401 6.016 -4.649 1.00 51.13 H new ATOM 0 HB2 SER A 289 1.336 5.822 -6.488 1.00 40.25 H new ATOM 0 HB3 SER A 289 0.105 5.187 -7.562 1.00 40.25 H new ATOM 0 HG SER A 289 -0.425 7.641 -6.270 1.00 52.05 H new ATOM 952 N PHE A 290 -2.828 6.099 -5.147 1.00 31.50 N ATOM 953 CA PHE A 290 -4.233 6.290 -5.524 1.00 12.31 C ATOM 954 C PHE A 290 -4.387 7.437 -6.525 1.00 14.35 C ATOM 955 O PHE A 290 -3.499 8.291 -6.645 1.00 2.30 O ATOM 956 CB PHE A 290 -5.118 6.542 -4.297 1.00 33.23 C ATOM 957 CG PHE A 290 -5.716 5.285 -3.728 1.00 62.33 C ATOM 958 CD1 PHE A 290 -6.549 4.493 -4.509 1.00 53.30 C ATOM 959 CD2 PHE A 290 -5.450 4.889 -2.426 1.00 2.13 C ATOM 960 CE1 PHE A 290 -7.102 3.335 -4.004 1.00 71.23 C ATOM 961 CE2 PHE A 290 -6.003 3.730 -1.917 1.00 71.33 C ATOM 962 CZ PHE A 290 -6.829 2.952 -2.706 1.00 10.22 C ATOM 0 H PHE A 290 -2.548 6.578 -4.291 1.00 31.50 H new ATOM 0 HA PHE A 290 -4.563 5.366 -5.999 1.00 12.31 H new ATOM 0 HB2 PHE A 290 -4.527 7.036 -3.526 1.00 33.23 H new ATOM 0 HB3 PHE A 290 -5.921 7.227 -4.571 1.00 33.23 H new ATOM 0 HD1 PHE A 290 -6.766 4.788 -5.525 1.00 53.30 H new ATOM 0 HD2 PHE A 290 -4.805 5.492 -1.804 1.00 2.13 H new ATOM 0 HE1 PHE A 290 -7.747 2.729 -4.623 1.00 71.23 H new ATOM 0 HE2 PHE A 290 -5.790 3.431 -0.901 1.00 71.33 H new ATOM 0 HZ PHE A 290 -7.260 2.046 -2.308 1.00 10.22 H new ATOM 972 N ASP A 291 -5.515 7.442 -7.247 1.00 74.30 N ATOM 973 CA ASP A 291 -5.773 8.458 -8.267 1.00 14.23 C ATOM 974 C ASP A 291 -6.246 9.748 -7.608 1.00 20.43 C ATOM 975 O ASP A 291 -5.723 10.828 -7.908 1.00 3.31 O ATOM 976 CB ASP A 291 -6.808 7.966 -9.295 1.00 63.22 C ATOM 977 CG ASP A 291 -6.944 8.904 -10.488 1.00 23.42 C ATOM 978 OD1 ASP A 291 -5.908 9.236 -11.113 1.00 43.54 O ATOM 979 OD2 ASP A 291 -8.079 9.293 -10.813 1.00 24.42 O ATOM 0 H ASP A 291 -6.260 6.754 -7.142 1.00 74.30 H new ATOM 0 HA ASP A 291 -4.842 8.652 -8.800 1.00 14.23 H new ATOM 0 HB2 ASP A 291 -6.521 6.975 -9.648 1.00 63.22 H new ATOM 0 HB3 ASP A 291 -7.777 7.862 -8.807 1.00 63.22 H new ATOM 984 N ASP A 292 -7.194 9.630 -6.684 1.00 41.04 N ATOM 985 CA ASP A 292 -7.733 10.800 -6.013 1.00 5.51 C ATOM 986 C ASP A 292 -6.932 11.104 -4.735 1.00 3.43 C ATOM 987 O ASP A 292 -6.623 10.194 -3.959 1.00 53.30 O ATOM 988 CB ASP A 292 -9.206 10.591 -5.632 1.00 63.52 C ATOM 989 CG ASP A 292 -10.066 9.987 -6.727 1.00 11.32 C ATOM 990 OD1 ASP A 292 -10.594 10.751 -7.556 1.00 24.41 O ATOM 991 OD2 ASP A 292 -10.234 8.749 -6.727 1.00 73.42 O ATOM 0 H ASP A 292 -7.600 8.743 -6.387 1.00 41.04 H new ATOM 0 HA ASP A 292 -7.657 11.637 -6.707 1.00 5.51 H new ATOM 0 HB2 ASP A 292 -9.252 9.945 -4.755 1.00 63.52 H new ATOM 0 HB3 ASP A 292 -9.632 11.552 -5.343 1.00 63.52 H new ATOM 996 N PRO A 293 -6.588 12.390 -4.496 1.00 52.35 N ATOM 997 CA PRO A 293 -6.042 12.834 -3.203 1.00 31.41 C ATOM 998 C PRO A 293 -6.990 12.687 -1.968 1.00 73.10 C ATOM 999 O PRO A 293 -6.490 12.318 -0.903 1.00 5.14 O ATOM 1000 CB PRO A 293 -5.646 14.301 -3.412 1.00 61.20 C ATOM 1001 CG PRO A 293 -6.102 14.702 -4.782 1.00 65.24 C ATOM 1002 CD PRO A 293 -6.628 13.477 -5.498 1.00 53.42 C ATOM 0 HA PRO A 293 -5.208 12.183 -2.942 1.00 31.41 H new ATOM 0 HB2 PRO A 293 -6.108 14.934 -2.654 1.00 61.20 H new ATOM 0 HB3 PRO A 293 -4.567 14.424 -3.316 1.00 61.20 H new ATOM 0 HG2 PRO A 293 -6.880 15.462 -4.713 1.00 65.24 H new ATOM 0 HG3 PRO A 293 -5.276 15.141 -5.342 1.00 65.24 H new ATOM 0 HD2 PRO A 293 -7.643 13.640 -5.861 1.00 53.42 H new ATOM 0 HD3 PRO A 293 -6.014 13.235 -6.365 1.00 53.42 H new ATOM 1010 N PRO A 294 -8.347 12.979 -2.025 1.00 63.33 N ATOM 1011 CA PRO A 294 -9.234 12.802 -0.847 1.00 15.20 C ATOM 1012 C PRO A 294 -9.445 11.326 -0.451 1.00 50.40 C ATOM 1013 O PRO A 294 -9.690 11.021 0.720 1.00 43.53 O ATOM 1014 CB PRO A 294 -10.552 13.430 -1.287 1.00 23.12 C ATOM 1015 CG PRO A 294 -10.563 13.344 -2.761 1.00 22.31 C ATOM 1016 CD PRO A 294 -9.139 13.501 -3.177 1.00 2.11 C ATOM 0 HA PRO A 294 -8.799 13.260 0.041 1.00 15.20 H new ATOM 0 HB2 PRO A 294 -11.401 12.899 -0.857 1.00 23.12 H new ATOM 0 HB3 PRO A 294 -10.622 14.466 -0.955 1.00 23.12 H new ATOM 0 HG2 PRO A 294 -10.967 12.389 -3.096 1.00 22.31 H new ATOM 0 HG3 PRO A 294 -11.188 14.124 -3.196 1.00 22.31 H new ATOM 0 HD2 PRO A 294 -8.929 12.941 -4.088 1.00 2.11 H new ATOM 0 HD3 PRO A 294 -8.899 14.544 -3.382 1.00 2.11 H new ATOM 1024 N SER A 295 -9.372 10.430 -1.440 1.00 41.50 N ATOM 1025 CA SER A 295 -9.515 8.993 -1.228 1.00 22.13 C ATOM 1026 C SER A 295 -8.395 8.417 -0.339 1.00 10.31 C ATOM 1027 O SER A 295 -8.590 7.391 0.293 1.00 75.45 O ATOM 1028 CB SER A 295 -9.532 8.255 -2.567 1.00 51.40 C ATOM 1029 OG SER A 295 -10.621 8.675 -3.364 1.00 41.42 O ATOM 0 H SER A 295 -9.211 10.686 -2.414 1.00 41.50 H new ATOM 0 HA SER A 295 -10.463 8.844 -0.710 1.00 22.13 H new ATOM 0 HB2 SER A 295 -8.597 8.436 -3.098 1.00 51.40 H new ATOM 0 HB3 SER A 295 -9.597 7.181 -2.393 1.00 51.40 H new ATOM 0 HG SER A 295 -10.609 8.190 -4.216 1.00 41.42 H new ATOM 1035 N ALA A 296 -7.220 9.071 -0.315 1.00 4.42 N ATOM 1036 CA ALA A 296 -6.076 8.599 0.463 1.00 70.12 C ATOM 1037 C ALA A 296 -6.276 8.815 1.972 1.00 61.14 C ATOM 1038 O ALA A 296 -6.053 7.903 2.770 1.00 61.11 O ATOM 1039 CB ALA A 296 -4.818 9.305 -0.011 1.00 24.31 C ATOM 0 H ALA A 296 -7.044 9.933 -0.831 1.00 4.42 H new ATOM 0 HA ALA A 296 -5.979 7.525 0.304 1.00 70.12 H new ATOM 0 HB1 ALA A 296 -3.964 8.954 0.568 1.00 24.31 H new ATOM 0 HB2 ALA A 296 -4.655 9.088 -1.067 1.00 24.31 H new ATOM 0 HB3 ALA A 296 -4.931 10.381 0.125 1.00 24.31 H new ATOM 1045 N LYS A 297 -6.744 10.017 2.347 1.00 1.25 N ATOM 1046 CA LYS A 297 -6.986 10.366 3.755 1.00 62.22 C ATOM 1047 C LYS A 297 -8.209 9.623 4.315 1.00 21.52 C ATOM 1048 O LYS A 297 -8.245 9.240 5.494 1.00 2.11 O ATOM 1049 CB LYS A 297 -7.101 11.908 3.936 1.00 54.05 C ATOM 1050 CG LYS A 297 -8.157 12.634 3.085 1.00 54.34 C ATOM 1051 CD LYS A 297 -9.532 12.719 3.764 1.00 14.43 C ATOM 1052 CE LYS A 297 -9.563 13.736 4.903 1.00 12.23 C ATOM 1053 NZ LYS A 297 -10.874 13.735 5.615 1.00 3.30 N ATOM 0 H LYS A 297 -6.963 10.766 1.690 1.00 1.25 H new ATOM 0 HA LYS A 297 -6.125 10.037 4.337 1.00 62.22 H new ATOM 0 HB2 LYS A 297 -7.314 12.111 4.986 1.00 54.05 H new ATOM 0 HB3 LYS A 297 -6.128 12.348 3.717 1.00 54.05 H new ATOM 0 HG2 LYS A 297 -7.806 13.642 2.865 1.00 54.34 H new ATOM 0 HG3 LYS A 297 -8.262 12.118 2.131 1.00 54.34 H new ATOM 0 HD2 LYS A 297 -10.284 12.987 3.022 1.00 14.43 H new ATOM 0 HD3 LYS A 297 -9.803 11.737 4.151 1.00 14.43 H new ATOM 0 HE2 LYS A 297 -8.765 13.512 5.611 1.00 12.23 H new ATOM 0 HE3 LYS A 297 -9.366 14.732 4.506 1.00 12.23 H new ATOM 0 HZ1 LYS A 297 -10.854 14.439 6.380 1.00 3.30 H new ATOM 0 HZ2 LYS A 297 -11.633 13.974 4.945 1.00 3.30 H new ATOM 0 HZ3 LYS A 297 -11.050 12.792 6.016 1.00 3.30 H new ATOM 1067 N ALA A 298 -9.182 9.388 3.438 1.00 32.43 N ATOM 1068 CA ALA A 298 -10.392 8.682 3.802 1.00 75.15 C ATOM 1069 C ALA A 298 -10.118 7.186 3.949 1.00 43.13 C ATOM 1070 O ALA A 298 -10.738 6.529 4.767 1.00 11.41 O ATOM 1071 CB ALA A 298 -11.458 8.949 2.761 1.00 63.31 C ATOM 0 H ALA A 298 -9.148 9.683 2.462 1.00 32.43 H new ATOM 0 HA ALA A 298 -10.748 9.043 4.767 1.00 75.15 H new ATOM 0 HB1 ALA A 298 -12.371 8.419 3.031 1.00 63.31 H new ATOM 0 HB2 ALA A 298 -11.660 10.019 2.713 1.00 63.31 H new ATOM 0 HB3 ALA A 298 -11.111 8.601 1.788 1.00 63.31 H new ATOM 1077 N ALA A 299 -9.150 6.668 3.178 1.00 54.34 N ATOM 1078 CA ALA A 299 -8.691 5.287 3.324 1.00 12.44 C ATOM 1079 C ALA A 299 -7.966 5.082 4.657 1.00 32.52 C ATOM 1080 O ALA A 299 -8.021 4.014 5.228 1.00 70.34 O ATOM 1081 CB ALA A 299 -7.795 4.879 2.167 1.00 31.43 C ATOM 0 H ALA A 299 -8.671 7.191 2.445 1.00 54.34 H new ATOM 0 HA ALA A 299 -9.574 4.648 3.313 1.00 12.44 H new ATOM 0 HB1 ALA A 299 -7.470 3.848 2.304 1.00 31.43 H new ATOM 0 HB2 ALA A 299 -8.348 4.964 1.231 1.00 31.43 H new ATOM 0 HB3 ALA A 299 -6.923 5.533 2.134 1.00 31.43 H new ATOM 1087 N ILE A 300 -7.302 6.123 5.150 1.00 43.42 N ATOM 1088 CA ILE A 300 -6.695 6.077 6.484 1.00 35.31 C ATOM 1089 C ILE A 300 -7.785 6.001 7.580 1.00 53.55 C ATOM 1090 O ILE A 300 -7.602 5.332 8.598 1.00 10.12 O ATOM 1091 CB ILE A 300 -5.755 7.298 6.737 1.00 44.02 C ATOM 1092 CG1 ILE A 300 -4.690 7.377 5.637 1.00 44.52 C ATOM 1093 CG2 ILE A 300 -5.081 7.189 8.108 1.00 1.23 C ATOM 1094 CD1 ILE A 300 -3.824 8.619 5.686 1.00 43.55 C ATOM 0 H ILE A 300 -7.169 7.004 4.654 1.00 43.42 H new ATOM 0 HA ILE A 300 -6.085 5.175 6.531 1.00 35.31 H new ATOM 0 HB ILE A 300 -6.358 8.206 6.719 1.00 44.02 H new ATOM 0 HG12 ILE A 300 -4.048 6.499 5.708 1.00 44.52 H new ATOM 0 HG13 ILE A 300 -5.185 7.333 4.667 1.00 44.52 H new ATOM 0 HG21 ILE A 300 -4.431 8.050 8.263 1.00 1.23 H new ATOM 0 HG22 ILE A 300 -5.843 7.165 8.887 1.00 1.23 H new ATOM 0 HG23 ILE A 300 -4.489 6.275 8.151 1.00 1.23 H new ATOM 0 HD11 ILE A 300 -3.100 8.590 4.872 1.00 43.55 H new ATOM 0 HD12 ILE A 300 -4.451 9.504 5.582 1.00 43.55 H new ATOM 0 HD13 ILE A 300 -3.297 8.658 6.639 1.00 43.55 H new ATOM 1106 N ASP A 301 -8.929 6.661 7.353 1.00 14.41 N ATOM 1107 CA ASP A 301 -10.002 6.669 8.355 1.00 14.10 C ATOM 1108 C ASP A 301 -10.850 5.363 8.400 1.00 40.44 C ATOM 1109 O ASP A 301 -10.899 4.710 9.441 1.00 62.40 O ATOM 1110 CB ASP A 301 -10.909 7.880 8.074 1.00 35.34 C ATOM 1111 CG ASP A 301 -11.975 8.120 9.139 1.00 73.42 C ATOM 1112 OD1 ASP A 301 -11.678 8.829 10.126 1.00 3.31 O ATOM 1113 OD2 ASP A 301 -13.113 7.629 8.975 1.00 63.22 O ATOM 0 H ASP A 301 -9.133 7.186 6.503 1.00 14.41 H new ATOM 0 HA ASP A 301 -9.530 6.736 9.335 1.00 14.10 H new ATOM 0 HB2 ASP A 301 -10.289 8.772 7.988 1.00 35.34 H new ATOM 0 HB3 ASP A 301 -11.399 7.738 7.111 1.00 35.34 H new ATOM 1118 N TRP A 302 -11.516 4.981 7.294 1.00 12.10 N ATOM 1119 CA TRP A 302 -12.344 3.748 7.291 1.00 40.10 C ATOM 1120 C TRP A 302 -11.617 2.463 6.860 1.00 55.35 C ATOM 1121 O TRP A 302 -11.917 1.388 7.377 1.00 73.41 O ATOM 1122 CB TRP A 302 -13.699 3.895 6.558 1.00 31.23 C ATOM 1123 CG TRP A 302 -13.751 4.876 5.427 1.00 12.24 C ATOM 1124 CD1 TRP A 302 -14.239 6.152 5.486 1.00 62.10 C ATOM 1125 CD2 TRP A 302 -13.333 4.665 4.074 1.00 12.21 C ATOM 1126 NE1 TRP A 302 -14.143 6.748 4.257 1.00 21.22 N ATOM 1127 CE2 TRP A 302 -13.590 5.859 3.373 1.00 74.11 C ATOM 1128 CE3 TRP A 302 -12.765 3.593 3.384 1.00 52.23 C ATOM 1129 CZ2 TRP A 302 -13.289 6.008 2.029 1.00 1.44 C ATOM 1130 CZ3 TRP A 302 -12.470 3.746 2.049 1.00 5.11 C ATOM 1131 CH2 TRP A 302 -12.733 4.947 1.383 1.00 73.35 C ATOM 0 H TRP A 302 -11.503 5.489 6.410 1.00 12.10 H new ATOM 0 HA TRP A 302 -12.562 3.622 8.351 1.00 40.10 H new ATOM 0 HB2 TRP A 302 -13.985 2.916 6.173 1.00 31.23 H new ATOM 0 HB3 TRP A 302 -14.453 4.181 7.291 1.00 31.23 H new ATOM 0 HD1 TRP A 302 -14.641 6.621 6.372 1.00 62.10 H new ATOM 0 HE1 TRP A 302 -14.436 7.700 4.035 1.00 21.22 H new ATOM 0 HE3 TRP A 302 -12.561 2.660 3.889 1.00 52.23 H new ATOM 0 HZ2 TRP A 302 -13.489 6.935 1.511 1.00 1.44 H new ATOM 0 HZ3 TRP A 302 -12.028 2.924 1.506 1.00 5.11 H new ATOM 0 HH2 TRP A 302 -12.490 5.034 0.334 1.00 73.35 H new ATOM 1142 N PHE A 303 -10.679 2.562 5.904 1.00 71.23 N ATOM 1143 CA PHE A 303 -10.088 1.372 5.258 1.00 72.22 C ATOM 1144 C PHE A 303 -8.952 0.813 6.120 1.00 41.51 C ATOM 1145 O PHE A 303 -8.575 -0.356 5.998 1.00 4.51 O ATOM 1146 CB PHE A 303 -9.622 1.779 3.847 1.00 44.14 C ATOM 1147 CG PHE A 303 -9.113 0.703 2.920 1.00 65.11 C ATOM 1148 CD1 PHE A 303 -9.962 -0.260 2.392 1.00 2.32 C ATOM 1149 CD2 PHE A 303 -7.787 0.712 2.512 1.00 64.33 C ATOM 1150 CE1 PHE A 303 -9.491 -1.192 1.473 1.00 45.43 C ATOM 1151 CE2 PHE A 303 -7.316 -0.220 1.611 1.00 22.42 C ATOM 1152 CZ PHE A 303 -8.164 -1.166 1.084 1.00 14.02 C ATOM 0 H PHE A 303 -10.313 3.450 5.560 1.00 71.23 H new ATOM 0 HA PHE A 303 -10.821 0.571 5.162 1.00 72.22 H new ATOM 0 HB2 PHE A 303 -10.457 2.275 3.352 1.00 44.14 H new ATOM 0 HB3 PHE A 303 -8.831 2.521 3.960 1.00 44.14 H new ATOM 0 HD1 PHE A 303 -10.998 -0.286 2.697 1.00 2.32 H new ATOM 0 HD2 PHE A 303 -7.114 1.459 2.906 1.00 64.33 H new ATOM 0 HE1 PHE A 303 -10.160 -1.934 1.064 1.00 45.43 H new ATOM 0 HE2 PHE A 303 -6.277 -0.207 1.318 1.00 22.42 H new ATOM 0 HZ PHE A 303 -7.795 -1.886 0.369 1.00 14.02 H new ATOM 1162 N ASP A 304 -8.460 1.657 7.016 1.00 41.15 N ATOM 1163 CA ASP A 304 -7.465 1.278 8.007 1.00 4.33 C ATOM 1164 C ASP A 304 -8.152 1.119 9.383 1.00 62.22 C ATOM 1165 O ASP A 304 -9.381 1.180 9.473 1.00 42.24 O ATOM 1166 CB ASP A 304 -6.355 2.343 8.041 1.00 1.21 C ATOM 1167 CG ASP A 304 -5.048 1.822 8.600 1.00 54.44 C ATOM 1168 OD1 ASP A 304 -4.541 0.834 8.055 1.00 60.25 O ATOM 1169 OD2 ASP A 304 -4.533 2.398 9.581 1.00 34.11 O ATOM 0 H ASP A 304 -8.744 2.635 7.075 1.00 41.15 H new ATOM 0 HA ASP A 304 -7.008 0.323 7.748 1.00 4.33 H new ATOM 0 HB2 ASP A 304 -6.188 2.717 7.031 1.00 1.21 H new ATOM 0 HB3 ASP A 304 -6.689 3.188 8.643 1.00 1.21 H new ATOM 1174 N GLY A 305 -7.365 0.890 10.443 1.00 41.33 N ATOM 1175 CA GLY A 305 -7.932 0.679 11.773 1.00 60.30 C ATOM 1176 C GLY A 305 -8.273 -0.778 12.030 1.00 10.44 C ATOM 1177 O GLY A 305 -8.974 -1.103 12.993 1.00 75.42 O ATOM 0 H GLY A 305 -6.347 0.847 10.403 1.00 41.33 H new ATOM 0 HA2 GLY A 305 -7.223 1.022 12.526 1.00 60.30 H new ATOM 0 HA3 GLY A 305 -8.831 1.285 11.882 1.00 60.30 H new ATOM 1181 N LYS A 306 -7.774 -1.652 11.163 1.00 14.23 N ATOM 1182 CA LYS A 306 -8.076 -3.074 11.221 1.00 70.41 C ATOM 1183 C LYS A 306 -6.793 -3.897 11.011 1.00 52.14 C ATOM 1184 O LYS A 306 -5.683 -3.388 11.205 1.00 34.33 O ATOM 1185 CB LYS A 306 -9.161 -3.422 10.169 1.00 20.35 C ATOM 1186 CG LYS A 306 -8.764 -3.156 8.717 1.00 33.43 C ATOM 1187 CD LYS A 306 -9.862 -3.589 7.760 1.00 11.23 C ATOM 1188 CE LYS A 306 -9.388 -3.583 6.317 1.00 63.34 C ATOM 1189 NZ LYS A 306 -10.459 -4.031 5.385 1.00 21.21 N ATOM 0 H LYS A 306 -7.148 -1.393 10.400 1.00 14.23 H new ATOM 0 HA LYS A 306 -8.470 -3.325 12.206 1.00 70.41 H new ATOM 0 HB2 LYS A 306 -9.420 -4.476 10.272 1.00 20.35 H new ATOM 0 HB3 LYS A 306 -10.061 -2.849 10.394 1.00 20.35 H new ATOM 0 HG2 LYS A 306 -8.558 -2.094 8.582 1.00 33.43 H new ATOM 0 HG3 LYS A 306 -7.843 -3.691 8.485 1.00 33.43 H new ATOM 0 HD2 LYS A 306 -10.203 -4.590 8.026 1.00 11.23 H new ATOM 0 HD3 LYS A 306 -10.718 -2.923 7.864 1.00 11.23 H new ATOM 0 HE2 LYS A 306 -9.065 -2.578 6.044 1.00 63.34 H new ATOM 0 HE3 LYS A 306 -8.521 -4.236 6.216 1.00 63.34 H new ATOM 0 HZ1 LYS A 306 -10.100 -4.014 4.409 1.00 21.21 H new ATOM 0 HZ2 LYS A 306 -10.750 -4.999 5.630 1.00 21.21 H new ATOM 0 HZ3 LYS A 306 -11.277 -3.393 5.464 1.00 21.21 H new ATOM 1203 N GLU A 307 -6.947 -5.169 10.649 1.00 14.31 N ATOM 1204 CA GLU A 307 -5.812 -6.033 10.378 1.00 21.10 C ATOM 1205 C GLU A 307 -5.861 -6.614 8.956 1.00 72.43 C ATOM 1206 O GLU A 307 -6.933 -6.870 8.393 1.00 32.21 O ATOM 1207 CB GLU A 307 -5.726 -7.156 11.430 1.00 53.23 C ATOM 1208 CG GLU A 307 -7.021 -7.935 11.617 1.00 11.12 C ATOM 1209 CD GLU A 307 -6.897 -9.045 12.637 1.00 30.21 C ATOM 1210 OE1 GLU A 307 -6.858 -8.744 13.848 1.00 72.42 O ATOM 1211 OE2 GLU A 307 -6.840 -10.220 12.223 1.00 63.31 O ATOM 0 H GLU A 307 -7.854 -5.621 10.538 1.00 14.31 H new ATOM 0 HA GLU A 307 -4.910 -5.424 10.445 1.00 21.10 H new ATOM 0 HB2 GLU A 307 -4.936 -7.849 11.141 1.00 53.23 H new ATOM 0 HB3 GLU A 307 -5.435 -6.721 12.386 1.00 53.23 H new ATOM 0 HG2 GLU A 307 -7.810 -7.250 11.927 1.00 11.12 H new ATOM 0 HG3 GLU A 307 -7.325 -8.360 10.660 1.00 11.12 H new ATOM 1218 N PHE A 308 -4.676 -6.774 8.389 1.00 32.51 N ATOM 1219 CA PHE A 308 -4.464 -7.453 7.119 1.00 41.35 C ATOM 1220 C PHE A 308 -3.647 -8.715 7.393 1.00 62.54 C ATOM 1221 O PHE A 308 -2.502 -8.626 7.853 1.00 30.43 O ATOM 1222 CB PHE A 308 -3.739 -6.498 6.130 1.00 2.31 C ATOM 1223 CG PHE A 308 -3.282 -7.102 4.810 1.00 31.25 C ATOM 1224 CD1 PHE A 308 -4.116 -7.148 3.699 1.00 21.12 C ATOM 1225 CD2 PHE A 308 -1.993 -7.599 4.683 1.00 32.44 C ATOM 1226 CE1 PHE A 308 -3.665 -7.684 2.493 1.00 71.24 C ATOM 1227 CE2 PHE A 308 -1.546 -8.132 3.493 1.00 41.40 C ATOM 1228 CZ PHE A 308 -2.373 -8.180 2.395 1.00 10.22 C ATOM 0 H PHE A 308 -3.813 -6.427 8.809 1.00 32.51 H new ATOM 0 HA PHE A 308 -5.411 -7.735 6.659 1.00 41.35 H new ATOM 0 HB2 PHE A 308 -4.406 -5.665 5.910 1.00 2.31 H new ATOM 0 HB3 PHE A 308 -2.867 -6.083 6.635 1.00 2.31 H new ATOM 0 HD1 PHE A 308 -5.123 -6.765 3.770 1.00 21.12 H new ATOM 0 HD2 PHE A 308 -1.327 -7.568 5.533 1.00 32.44 H new ATOM 0 HE1 PHE A 308 -4.321 -7.713 1.636 1.00 71.24 H new ATOM 0 HE2 PHE A 308 -0.539 -8.515 3.422 1.00 41.40 H new ATOM 0 HZ PHE A 308 -2.020 -8.600 1.465 1.00 10.22 H new ATOM 1238 N HIS A 309 -4.279 -9.880 7.147 1.00 11.45 N ATOM 1239 CA HIS A 309 -3.677 -11.229 7.323 1.00 51.21 C ATOM 1240 C HIS A 309 -3.330 -11.537 8.793 1.00 11.11 C ATOM 1241 O HIS A 309 -2.430 -12.334 9.074 1.00 53.52 O ATOM 1242 CB HIS A 309 -2.412 -11.411 6.451 1.00 32.45 C ATOM 1243 CG HIS A 309 -2.650 -11.573 4.975 1.00 70.14 C ATOM 1244 ND1 HIS A 309 -1.668 -12.019 4.125 1.00 13.33 N ATOM 1245 CD2 HIS A 309 -3.731 -11.324 4.194 1.00 73.41 C ATOM 1246 CE1 HIS A 309 -2.127 -12.032 2.889 1.00 45.33 C ATOM 1247 NE2 HIS A 309 -3.381 -11.621 2.898 1.00 22.35 N ATOM 0 H HIS A 309 -5.242 -9.917 6.813 1.00 11.45 H new ATOM 0 HA HIS A 309 -4.441 -11.935 6.998 1.00 51.21 H new ATOM 0 HB2 HIS A 309 -1.763 -10.549 6.602 1.00 32.45 H new ATOM 0 HB3 HIS A 309 -1.869 -12.285 6.810 1.00 32.45 H new ATOM 0 HD1 HIS A 309 -0.728 -12.297 4.407 1.00 13.33 H new ATOM 0 HD2 HIS A 309 -4.691 -10.959 4.529 1.00 73.41 H new ATOM 0 HE1 HIS A 309 -1.569 -12.330 2.014 1.00 45.33 H new ATOM 1256 N GLY A 310 -4.081 -10.935 9.722 1.00 23.11 N ATOM 1257 CA GLY A 310 -3.844 -11.145 11.151 1.00 35.20 C ATOM 1258 C GLY A 310 -2.824 -10.186 11.763 1.00 71.52 C ATOM 1259 O GLY A 310 -2.571 -10.235 12.969 1.00 15.44 O ATOM 0 H GLY A 310 -4.853 -10.303 9.510 1.00 23.11 H new ATOM 0 HA2 GLY A 310 -4.789 -11.041 11.684 1.00 35.20 H new ATOM 0 HA3 GLY A 310 -3.502 -12.168 11.305 1.00 35.20 H new ATOM 1263 N ASN A 311 -2.232 -9.327 10.934 1.00 21.21 N ATOM 1264 CA ASN A 311 -1.253 -8.336 11.385 1.00 33.45 C ATOM 1265 C ASN A 311 -1.829 -6.940 11.255 1.00 54.03 C ATOM 1266 O ASN A 311 -2.548 -6.666 10.312 1.00 71.12 O ATOM 1267 CB ASN A 311 0.054 -8.428 10.576 1.00 35.21 C ATOM 1268 CG ASN A 311 0.870 -9.690 10.838 1.00 13.42 C ATOM 1269 OD1 ASN A 311 0.850 -10.187 12.073 1.00 50.14 O flip ATOM 1270 ND2 ASN A 311 1.536 -10.203 9.938 1.00 1.40 N flip ATOM 0 H ASN A 311 -2.417 -9.298 9.931 1.00 21.21 H new ATOM 0 HA ASN A 311 -1.026 -8.546 12.430 1.00 33.45 H new ATOM 0 HB2 ASN A 311 -0.186 -8.379 9.514 1.00 35.21 H new ATOM 0 HB3 ASN A 311 0.670 -7.558 10.804 1.00 35.21 H new ATOM 0 HD21 ASN A 311 1.528 -9.796 9.003 1.00 1.40 H new ATOM 0 HD22 ASN A 311 2.095 -11.035 10.128 1.00 1.40 H new ATOM 1277 N ILE A 312 -1.487 -6.061 12.193 1.00 71.20 N ATOM 1278 CA ILE A 312 -2.046 -4.705 12.236 1.00 14.41 C ATOM 1279 C ILE A 312 -1.512 -3.870 11.062 1.00 54.02 C ATOM 1280 O ILE A 312 -0.301 -3.822 10.823 1.00 42.41 O ATOM 1281 CB ILE A 312 -1.730 -4.008 13.600 1.00 12.33 C ATOM 1282 CG1 ILE A 312 -2.314 -4.824 14.777 1.00 21.31 C ATOM 1283 CG2 ILE A 312 -2.242 -2.561 13.647 1.00 53.40 C ATOM 1284 CD1 ILE A 312 -3.828 -4.994 14.761 1.00 34.21 C ATOM 0 H ILE A 312 -0.822 -6.262 12.940 1.00 71.20 H new ATOM 0 HA ILE A 312 -3.130 -4.781 12.144 1.00 14.41 H new ATOM 0 HB ILE A 312 -0.645 -3.971 13.696 1.00 12.33 H new ATOM 0 HG12 ILE A 312 -1.854 -5.812 14.777 1.00 21.31 H new ATOM 0 HG13 ILE A 312 -2.029 -4.340 15.711 1.00 21.31 H new ATOM 0 HG21 ILE A 312 -1.999 -2.120 14.614 1.00 53.40 H new ATOM 0 HG22 ILE A 312 -1.769 -1.982 12.854 1.00 53.40 H new ATOM 0 HG23 ILE A 312 -3.323 -2.553 13.506 1.00 53.40 H new ATOM 0 HD11 ILE A 312 -4.138 -5.580 15.627 1.00 34.21 H new ATOM 0 HD12 ILE A 312 -4.305 -4.014 14.797 1.00 34.21 H new ATOM 0 HD13 ILE A 312 -4.127 -5.510 13.848 1.00 34.21 H new ATOM 1296 N ILE A 313 -2.427 -3.232 10.340 1.00 65.54 N ATOM 1297 CA ILE A 313 -2.078 -2.471 9.156 1.00 74.20 C ATOM 1298 C ILE A 313 -2.221 -0.975 9.449 1.00 22.13 C ATOM 1299 O ILE A 313 -3.042 -0.575 10.285 1.00 65.40 O ATOM 1300 CB ILE A 313 -2.933 -2.929 7.917 1.00 2.14 C ATOM 1301 CG1 ILE A 313 -2.479 -2.221 6.622 1.00 15.45 C ATOM 1302 CG2 ILE A 313 -4.435 -2.731 8.160 1.00 74.41 C ATOM 1303 CD1 ILE A 313 -3.148 -2.722 5.357 1.00 12.21 C ATOM 0 H ILE A 313 -3.423 -3.230 10.560 1.00 65.54 H new ATOM 0 HA ILE A 313 -1.037 -2.662 8.895 1.00 74.20 H new ATOM 0 HB ILE A 313 -2.761 -3.997 7.787 1.00 2.14 H new ATOM 0 HG12 ILE A 313 -2.673 -1.153 6.721 1.00 15.45 H new ATOM 0 HG13 ILE A 313 -1.401 -2.340 6.518 1.00 15.45 H new ATOM 0 HG21 ILE A 313 -4.992 -3.059 7.282 1.00 74.41 H new ATOM 0 HG22 ILE A 313 -4.744 -3.317 9.025 1.00 74.41 H new ATOM 0 HG23 ILE A 313 -4.638 -1.676 8.345 1.00 74.41 H new ATOM 0 HD11 ILE A 313 -2.767 -2.167 4.500 1.00 12.21 H new ATOM 0 HD12 ILE A 313 -2.933 -3.783 5.227 1.00 12.21 H new ATOM 0 HD13 ILE A 313 -4.226 -2.577 5.433 1.00 12.21 H new ATOM 1315 N LYS A 314 -1.346 -0.170 8.837 1.00 14.04 N ATOM 1316 CA LYS A 314 -1.432 1.284 8.959 1.00 31.01 C ATOM 1317 C LYS A 314 -1.243 1.965 7.606 1.00 54.24 C ATOM 1318 O LYS A 314 -0.254 1.732 6.929 1.00 4.23 O ATOM 1319 CB LYS A 314 -0.381 1.828 9.932 1.00 43.23 C ATOM 1320 CG LYS A 314 -0.766 3.188 10.491 1.00 34.42 C ATOM 1321 CD LYS A 314 0.332 3.798 11.344 1.00 11.52 C ATOM 1322 CE LYS A 314 -0.113 5.133 11.931 1.00 31.42 C ATOM 1323 NZ LYS A 314 -1.254 4.980 12.878 1.00 14.31 N ATOM 0 H LYS A 314 -0.576 -0.501 8.256 1.00 14.04 H new ATOM 0 HA LYS A 314 -2.428 1.506 9.343 1.00 31.01 H new ATOM 0 HB2 LYS A 314 -0.249 1.123 10.753 1.00 43.23 H new ATOM 0 HB3 LYS A 314 0.579 1.905 9.421 1.00 43.23 H new ATOM 0 HG2 LYS A 314 -0.999 3.863 9.667 1.00 34.42 H new ATOM 0 HG3 LYS A 314 -1.673 3.088 11.088 1.00 34.42 H new ATOM 0 HD2 LYS A 314 0.596 3.112 12.149 1.00 11.52 H new ATOM 0 HD3 LYS A 314 1.229 3.942 10.741 1.00 11.52 H new ATOM 0 HE2 LYS A 314 0.726 5.598 12.448 1.00 31.42 H new ATOM 0 HE3 LYS A 314 -0.402 5.805 11.123 1.00 31.42 H new ATOM 0 HZ1 LYS A 314 -1.370 5.856 13.427 1.00 14.31 H new ATOM 0 HZ2 LYS A 314 -2.125 4.789 12.344 1.00 14.31 H new ATOM 0 HZ3 LYS A 314 -1.064 4.189 13.525 1.00 14.31 H new ATOM 1337 N VAL A 315 -2.178 2.840 7.252 1.00 41.42 N ATOM 1338 CA VAL A 315 -2.086 3.647 6.037 1.00 12.54 C ATOM 1339 C VAL A 315 -1.681 5.088 6.409 1.00 53.21 C ATOM 1340 O VAL A 315 -2.182 5.665 7.371 1.00 51.15 O ATOM 1341 CB VAL A 315 -3.431 3.672 5.234 1.00 45.23 C ATOM 1342 CG1 VAL A 315 -3.269 4.377 3.894 1.00 71.44 C ATOM 1343 CG2 VAL A 315 -3.995 2.274 5.011 1.00 43.11 C ATOM 0 H VAL A 315 -3.022 3.011 7.798 1.00 41.42 H new ATOM 0 HA VAL A 315 -1.332 3.191 5.396 1.00 12.54 H new ATOM 0 HB VAL A 315 -4.139 4.232 5.845 1.00 45.23 H new ATOM 0 HG11 VAL A 315 -4.222 4.375 3.364 1.00 71.44 H new ATOM 0 HG12 VAL A 315 -2.948 5.405 4.060 1.00 71.44 H new ATOM 0 HG13 VAL A 315 -2.521 3.856 3.297 1.00 71.44 H new ATOM 0 HG21 VAL A 315 -4.927 2.343 4.450 1.00 43.11 H new ATOM 0 HG22 VAL A 315 -3.277 1.677 4.449 1.00 43.11 H new ATOM 0 HG23 VAL A 315 -4.185 1.800 5.974 1.00 43.11 H new ATOM 1353 N SER A 316 -0.714 5.620 5.663 1.00 63.52 N ATOM 1354 CA SER A 316 -0.210 6.983 5.828 1.00 12.41 C ATOM 1355 C SER A 316 -0.136 7.659 4.470 1.00 21.33 C ATOM 1356 O SER A 316 -0.384 7.035 3.453 1.00 33.42 O ATOM 1357 CB SER A 316 1.189 7.012 6.449 1.00 14.31 C ATOM 1358 OG SER A 316 1.332 6.046 7.478 1.00 74.41 O ATOM 0 H SER A 316 -0.250 5.107 4.913 1.00 63.52 H new ATOM 0 HA SER A 316 -0.897 7.503 6.496 1.00 12.41 H new ATOM 0 HB2 SER A 316 1.934 6.830 5.674 1.00 14.31 H new ATOM 0 HB3 SER A 316 1.386 8.005 6.853 1.00 14.31 H new ATOM 0 HG SER A 316 2.238 6.094 7.848 1.00 74.41 H new ATOM 1364 N PHE A 317 0.175 8.947 4.476 1.00 24.30 N ATOM 1365 CA PHE A 317 0.401 9.718 3.249 1.00 72.44 C ATOM 1366 C PHE A 317 1.832 9.569 2.697 1.00 32.41 C ATOM 1367 O PHE A 317 2.170 10.180 1.671 1.00 11.42 O ATOM 1368 CB PHE A 317 0.123 11.174 3.538 1.00 51.14 C ATOM 1369 CG PHE A 317 -1.143 11.672 2.911 1.00 75.12 C ATOM 1370 CD1 PHE A 317 -2.364 11.206 3.360 1.00 33.21 C ATOM 1371 CD2 PHE A 317 -1.120 12.586 1.872 1.00 21.41 C ATOM 1372 CE1 PHE A 317 -3.538 11.639 2.795 1.00 72.33 C ATOM 1373 CE2 PHE A 317 -2.299 13.028 1.299 1.00 23.32 C ATOM 1374 CZ PHE A 317 -3.512 12.550 1.763 1.00 41.20 C ATOM 0 H PHE A 317 0.279 9.494 5.331 1.00 24.30 H new ATOM 0 HA PHE A 317 -0.272 9.328 2.485 1.00 72.44 H new ATOM 0 HB2 PHE A 317 0.067 11.319 4.617 1.00 51.14 H new ATOM 0 HB3 PHE A 317 0.959 11.774 3.179 1.00 51.14 H new ATOM 0 HD1 PHE A 317 -2.395 10.490 4.168 1.00 33.21 H new ATOM 0 HD2 PHE A 317 -0.174 12.957 1.506 1.00 21.41 H new ATOM 0 HE1 PHE A 317 -4.483 11.265 3.160 1.00 72.33 H new ATOM 0 HE2 PHE A 317 -2.273 13.745 0.491 1.00 23.32 H new ATOM 0 HZ PHE A 317 -4.435 12.890 1.317 1.00 41.20 H new ATOM 1384 N ALA A 318 2.663 8.788 3.414 1.00 2.15 N ATOM 1385 CA ALA A 318 4.040 8.438 3.006 1.00 0.12 C ATOM 1386 C ALA A 318 4.973 9.659 2.898 1.00 35.20 C ATOM 1387 O ALA A 318 4.677 10.747 3.412 1.00 1.00 O ATOM 1388 CB ALA A 318 4.025 7.645 1.692 1.00 21.23 C ATOM 0 H ALA A 318 2.393 8.375 4.307 1.00 2.15 H new ATOM 0 HA ALA A 318 4.449 7.813 3.799 1.00 0.12 H new ATOM 0 HB1 ALA A 318 5.047 7.395 1.406 1.00 21.23 H new ATOM 0 HB2 ALA A 318 3.452 6.728 1.827 1.00 21.23 H new ATOM 0 HB3 ALA A 318 3.566 8.248 0.908 1.00 21.23 H new