USER MOD reduce.3.24.130724 H: found=0, std=0, add=739, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 740 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 218 LYS NZ :NH3+ 149:sc= 1.81 (180deg=-0.215) USER MOD Set 1.2: A 293 CYS SG : rot 44:sc= -3.78! USER MOD Set 1.3: A 295 THR OG1 : rot -146:sc= -2.81! USER MOD Set 2.1: A 223 TYR OH : rot -140:sc= -2.6! USER MOD Set 2.2: A 286 CYS SG : rot 58:sc= -2.57! USER MOD Set 3.1: A 234 THR OG1 : rot 180:sc= 0.85 USER MOD Set 3.2: A 270 THR OG1 : rot -104:sc= 0.964 USER MOD Set 4.1: A 230 LYS NZ :NH3+ -132:sc= 0.963 (180deg=-0.897) USER MOD Set 4.2: A 274 SER OG : rot 90:sc= 0.719 USER MOD Set 5.1: A 227 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000446) USER MOD Set 5.2: A 277 SER OG : rot 180:sc= 0 USER MOD Single : A 210 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 211 LYS NZ :NH3+ -158:sc= 1.25 (180deg=0.257) USER MOD Single : A 212 SER OG : rot 104:sc= -0.642 USER MOD Single : A 213 THR OG1 : rot 26:sc= -0.577 USER MOD Single : A 216 GLN :FLIP amide:sc= -0.527 F(o=-3.3!,f=-0.53) USER MOD Single : A 217 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 224 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 226 SER OG : rot 180:sc= 0 USER MOD Single : A 229 HIS : no HD1:sc= -0.127 X(o=-0.13,f=-0.13) USER MOD Single : A 240 HIS :FLIP no HE2:sc= 0.697 F(o=-2.5!,f=0.7) USER MOD Single : A 245 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.188) USER MOD Single : A 248 LYS NZ :NH3+ -115:sc= 1.26 (180deg=-0.117) USER MOD Single : A 249 ASN :FLIP amide:sc= -1.82 F(o=-3.1!,f=-1.8) USER MOD Single : A 251 GLN :FLIP amide:sc= 0 F(o=-1.6!,f=0) USER MOD Single : A 254 GLN : amide:sc= -1.4 K(o=-1.4,f=-4.3!) USER MOD Single : A 255 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 256 SER OG : rot 180:sc= 0.00323 USER MOD Single : A 258 SER OG : rot 180:sc= 0 USER MOD Single : A 259 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 260 TYR OH : rot 180:sc= 0 USER MOD Single : A 264 SER OG : rot 180:sc= 0 USER MOD Single : A 268 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 272 THR OG1 : rot 180:sc= 0 USER MOD Single : A 275 GLN : amide:sc= -0.879! X(o=-0.88!,f=-0.8) USER MOD Single : A 276 CYS SG : rot 160:sc= -4.63! USER MOD Single : A 284 TYR OH : rot 57:sc= 1.28 USER MOD Single : A 285 GLN :FLIP amide:sc= -13.5! C(o=-18!,f=-13!) USER MOD Single : A 292 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 294 SER OG : rot -80:sc= 1.25 USER MOD Single : A 300 LYS NZ :NH3+ 163:sc= -0.0534 (180deg=-0.245) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 208 7.989 -16.286 -2.404 1.00 3.09 N ATOM 2 CA ASP A 208 6.750 -15.474 -2.344 1.00 2.68 C ATOM 3 C ASP A 208 6.954 -14.265 -1.451 1.00 1.97 C ATOM 4 O ASP A 208 7.647 -14.350 -0.435 1.00 2.14 O ATOM 5 CB ASP A 208 5.614 -16.334 -1.789 1.00 3.41 C ATOM 6 CG ASP A 208 5.297 -17.525 -2.666 1.00 4.18 C ATOM 7 OD1 ASP A 208 5.941 -17.670 -3.726 1.00 4.71 O ATOM 8 OD2 ASP A 208 4.402 -18.317 -2.304 1.00 4.43 O ATOM 0 HA ASP A 208 6.500 -15.129 -3.347 1.00 2.68 H new ATOM 0 HB2 ASP A 208 5.883 -16.684 -0.792 1.00 3.41 H new ATOM 0 HB3 ASP A 208 4.720 -15.720 -1.681 1.00 3.41 H new ATOM 13 N GLU A 209 6.411 -13.125 -1.861 1.00 1.38 N ATOM 14 CA GLU A 209 6.572 -11.898 -1.100 1.00 0.90 C ATOM 15 C GLU A 209 5.780 -11.958 0.208 1.00 0.92 C ATOM 16 O GLU A 209 4.551 -11.889 0.212 1.00 1.33 O ATOM 17 CB GLU A 209 6.150 -10.672 -1.937 1.00 1.00 C ATOM 18 CG GLU A 209 4.722 -10.708 -2.487 1.00 0.81 C ATOM 19 CD GLU A 209 4.583 -11.519 -3.761 1.00 1.10 C ATOM 20 OE1 GLU A 209 5.607 -12.009 -4.278 1.00 1.51 O ATOM 21 OE2 GLU A 209 3.448 -11.659 -4.260 1.00 1.52 O ATOM 0 H GLU A 209 5.858 -13.027 -2.713 1.00 1.38 H new ATOM 0 HA GLU A 209 7.628 -11.793 -0.852 1.00 0.90 H new ATOM 0 HB2 GLU A 209 6.261 -9.779 -1.322 1.00 1.00 H new ATOM 0 HB3 GLU A 209 6.841 -10.571 -2.774 1.00 1.00 H new ATOM 0 HG2 GLU A 209 4.059 -11.123 -1.728 1.00 0.81 H new ATOM 0 HG3 GLU A 209 4.389 -9.688 -2.677 1.00 0.81 H new ATOM 28 N LYS A 210 6.495 -12.034 1.322 1.00 1.02 N ATOM 29 CA LYS A 210 5.866 -12.050 2.635 1.00 1.23 C ATOM 30 C LYS A 210 6.331 -10.848 3.439 1.00 1.22 C ATOM 31 O LYS A 210 5.572 -9.894 3.610 1.00 1.70 O ATOM 32 CB LYS A 210 6.173 -13.353 3.372 1.00 1.64 C ATOM 33 CG LYS A 210 5.605 -14.577 2.674 1.00 2.30 C ATOM 34 CD LYS A 210 5.755 -15.829 3.515 1.00 2.91 C ATOM 35 CE LYS A 210 5.154 -17.035 2.814 1.00 3.69 C ATOM 36 NZ LYS A 210 5.210 -18.254 3.657 1.00 4.13 N ATOM 0 H LYS A 210 7.513 -12.086 1.342 1.00 1.02 H new ATOM 0 HA LYS A 210 4.785 -11.992 2.509 1.00 1.23 H new ATOM 0 HB2 LYS A 210 7.253 -13.464 3.467 1.00 1.64 H new ATOM 0 HB3 LYS A 210 5.768 -13.297 4.382 1.00 1.64 H new ATOM 0 HG2 LYS A 210 4.550 -14.412 2.454 1.00 2.30 H new ATOM 0 HG3 LYS A 210 6.112 -14.718 1.719 1.00 2.30 H new ATOM 0 HD2 LYS A 210 6.811 -16.011 3.717 1.00 2.91 H new ATOM 0 HD3 LYS A 210 5.267 -15.684 4.479 1.00 2.91 H new ATOM 0 HE2 LYS A 210 4.117 -16.823 2.552 1.00 3.69 H new ATOM 0 HE3 LYS A 210 5.688 -17.215 1.881 1.00 3.69 H new ATOM 0 HZ1 LYS A 210 4.790 -19.053 3.141 1.00 4.13 H new ATOM 0 HZ2 LYS A 210 6.201 -18.473 3.886 1.00 4.13 H new ATOM 0 HZ3 LYS A 210 4.679 -18.093 4.537 1.00 4.13 H new ATOM 50 N LYS A 211 7.636 -10.770 3.683 1.00 0.88 N ATOM 51 CA LYS A 211 8.209 -9.525 4.167 1.00 0.88 C ATOM 52 C LYS A 211 8.361 -8.580 2.989 1.00 0.95 C ATOM 53 O LYS A 211 8.335 -9.009 1.832 1.00 1.30 O ATOM 54 CB LYS A 211 9.552 -9.720 4.884 1.00 1.13 C ATOM 55 CG LYS A 211 10.243 -8.402 5.250 1.00 1.10 C ATOM 56 CD LYS A 211 9.364 -7.507 6.129 1.00 0.94 C ATOM 57 CE LYS A 211 9.821 -6.043 6.107 1.00 0.58 C ATOM 58 NZ LYS A 211 11.277 -5.917 6.385 1.00 1.33 N ATOM 0 H LYS A 211 8.299 -11.534 3.557 1.00 0.88 H new ATOM 0 HA LYS A 211 7.534 -9.106 4.913 1.00 0.88 H new ATOM 0 HB2 LYS A 211 9.390 -10.301 5.792 1.00 1.13 H new ATOM 0 HB3 LYS A 211 10.215 -10.304 4.246 1.00 1.13 H new ATOM 0 HG2 LYS A 211 11.175 -8.616 5.772 1.00 1.10 H new ATOM 0 HG3 LYS A 211 10.505 -7.866 4.337 1.00 1.10 H new ATOM 0 HD2 LYS A 211 8.331 -7.568 5.788 1.00 0.94 H new ATOM 0 HD3 LYS A 211 9.383 -7.876 7.154 1.00 0.94 H new ATOM 0 HE2 LYS A 211 9.597 -5.606 5.134 1.00 0.58 H new ATOM 0 HE3 LYS A 211 9.259 -5.475 6.848 1.00 0.58 H new ATOM 0 HZ1 LYS A 211 11.483 -4.957 6.728 1.00 1.33 H new ATOM 0 HZ2 LYS A 211 11.553 -6.610 7.110 1.00 1.33 H new ATOM 0 HZ3 LYS A 211 11.814 -6.096 5.512 1.00 1.33 H new ATOM 72 N SER A 212 8.260 -7.303 3.277 1.00 1.04 N ATOM 73 CA SER A 212 8.143 -6.309 2.248 1.00 1.39 C ATOM 74 C SER A 212 9.380 -6.193 1.374 1.00 1.11 C ATOM 75 O SER A 212 10.428 -6.791 1.633 1.00 1.73 O ATOM 76 CB SER A 212 7.810 -4.958 2.871 1.00 1.91 C ATOM 77 OG SER A 212 7.190 -4.106 1.923 1.00 2.46 O ATOM 0 H SER A 212 8.257 -6.931 4.227 1.00 1.04 H new ATOM 0 HA SER A 212 7.335 -6.631 1.592 1.00 1.39 H new ATOM 0 HB2 SER A 212 7.149 -5.100 3.726 1.00 1.91 H new ATOM 0 HB3 SER A 212 8.721 -4.491 3.246 1.00 1.91 H new ATOM 0 HG SER A 212 6.228 -4.061 2.104 1.00 2.46 H new ATOM 83 N THR A 213 9.234 -5.332 0.389 1.00 0.75 N ATOM 84 CA THR A 213 10.292 -4.923 -0.507 1.00 0.42 C ATOM 85 C THR A 213 11.338 -4.109 0.270 1.00 0.62 C ATOM 86 O THR A 213 11.700 -4.460 1.394 1.00 1.59 O ATOM 87 CB THR A 213 9.650 -4.115 -1.656 1.00 0.48 C ATOM 88 OG1 THR A 213 10.625 -3.501 -2.507 1.00 1.20 O ATOM 89 CG2 THR A 213 8.731 -3.081 -1.089 1.00 0.93 C ATOM 0 H THR A 213 8.342 -4.882 0.184 1.00 0.75 H new ATOM 0 HA THR A 213 10.812 -5.781 -0.932 1.00 0.42 H new ATOM 0 HB THR A 213 9.087 -4.813 -2.275 1.00 0.48 H new ATOM 0 HG1 THR A 213 11.460 -4.013 -2.470 1.00 1.20 H new ATOM 0 HG21 THR A 213 8.279 -2.512 -1.901 1.00 0.93 H new ATOM 0 HG22 THR A 213 7.948 -3.569 -0.508 1.00 0.93 H new ATOM 0 HG23 THR A 213 9.295 -2.407 -0.444 1.00 0.93 H new ATOM 97 N ALA A 214 11.736 -2.980 -0.273 1.00 0.50 N ATOM 98 CA ALA A 214 12.620 -2.056 0.431 1.00 0.39 C ATOM 99 C ALA A 214 11.882 -1.328 1.541 1.00 0.25 C ATOM 100 O ALA A 214 12.211 -0.197 1.880 1.00 0.27 O ATOM 101 CB ALA A 214 13.205 -1.030 -0.508 1.00 0.48 C ATOM 0 H ALA A 214 11.463 -2.671 -1.206 1.00 0.50 H new ATOM 0 HA ALA A 214 13.423 -2.657 0.858 1.00 0.39 H new ATOM 0 HB1 ALA A 214 13.858 -0.358 0.049 1.00 0.48 H new ATOM 0 HB2 ALA A 214 13.780 -1.534 -1.285 1.00 0.48 H new ATOM 0 HB3 ALA A 214 12.400 -0.456 -0.967 1.00 0.48 H new ATOM 107 N PHE A 215 10.899 -1.979 2.119 1.00 0.25 N ATOM 108 CA PHE A 215 10.184 -1.423 3.231 1.00 0.18 C ATOM 109 C PHE A 215 10.745 -2.034 4.488 1.00 0.21 C ATOM 110 O PHE A 215 10.623 -3.240 4.710 1.00 0.28 O ATOM 111 CB PHE A 215 8.680 -1.702 3.128 1.00 0.20 C ATOM 112 CG PHE A 215 8.001 -1.087 1.911 1.00 0.23 C ATOM 113 CD1 PHE A 215 8.728 -0.664 0.809 1.00 0.41 C ATOM 114 CD2 PHE A 215 6.625 -0.923 1.872 1.00 0.26 C ATOM 115 CE1 PHE A 215 8.105 -0.104 -0.282 1.00 0.46 C ATOM 116 CE2 PHE A 215 6.006 -0.363 0.778 1.00 0.31 C ATOM 117 CZ PHE A 215 6.744 0.047 -0.298 1.00 0.35 C ATOM 0 H PHE A 215 10.578 -2.903 1.830 1.00 0.25 H new ATOM 0 HA PHE A 215 10.306 -0.340 3.240 1.00 0.18 H new ATOM 0 HB2 PHE A 215 8.525 -2.781 3.107 1.00 0.20 H new ATOM 0 HB3 PHE A 215 8.192 -1.327 4.028 1.00 0.20 H new ATOM 0 HD1 PHE A 215 9.802 -0.776 0.807 1.00 0.41 H new ATOM 0 HD2 PHE A 215 6.029 -1.240 2.715 1.00 0.26 H new ATOM 0 HE1 PHE A 215 8.692 0.218 -1.130 1.00 0.46 H new ATOM 0 HE2 PHE A 215 4.932 -0.247 0.769 1.00 0.31 H new ATOM 0 HZ PHE A 215 6.256 0.487 -1.155 1.00 0.35 H new ATOM 127 N GLN A 216 11.345 -1.184 5.293 1.00 0.18 N ATOM 128 CA GLN A 216 11.891 -1.561 6.579 1.00 0.21 C ATOM 129 C GLN A 216 10.863 -2.374 7.326 1.00 0.24 C ATOM 130 O GLN A 216 11.069 -3.545 7.640 1.00 0.31 O ATOM 131 CB GLN A 216 12.191 -0.285 7.340 1.00 0.20 C ATOM 132 CG GLN A 216 13.483 -0.326 8.136 1.00 0.25 C ATOM 133 CD GLN A 216 13.854 1.020 8.728 1.00 0.30 C ATOM 134 OE1 GLN A 216 13.112 2.055 8.369 1.00 0.92 O flip ATOM 135 NE2 GLN A 216 14.817 1.133 9.483 1.00 0.79 N flip ATOM 0 H GLN A 216 11.469 -0.197 5.069 1.00 0.18 H new ATOM 0 HA GLN A 216 12.798 -2.155 6.465 1.00 0.21 H new ATOM 0 HB2 GLN A 216 12.238 0.544 6.634 1.00 0.20 H new ATOM 0 HB3 GLN A 216 11.365 -0.078 8.020 1.00 0.20 H new ATOM 0 HG2 GLN A 216 13.386 -1.056 8.939 1.00 0.25 H new ATOM 0 HG3 GLN A 216 14.291 -0.668 7.490 1.00 0.25 H new ATOM 0 HE21 GLN A 216 15.365 0.311 9.737 1.00 0.79 H new ATOM 0 HE22 GLN A 216 15.068 2.049 9.856 1.00 0.79 H new ATOM 144 N LYS A 217 9.689 -1.792 7.417 1.00 0.20 N ATOM 145 CA LYS A 217 8.525 -2.498 7.866 1.00 0.22 C ATOM 146 C LYS A 217 7.324 -2.115 7.004 1.00 0.17 C ATOM 147 O LYS A 217 6.905 -0.968 7.026 1.00 0.17 O ATOM 148 CB LYS A 217 8.252 -2.156 9.322 1.00 0.28 C ATOM 149 CG LYS A 217 6.982 -2.780 9.837 1.00 0.36 C ATOM 150 CD LYS A 217 6.585 -2.195 11.177 1.00 0.59 C ATOM 151 CE LYS A 217 5.189 -2.643 11.583 1.00 1.26 C ATOM 152 NZ LYS A 217 4.797 -2.121 12.919 1.00 1.85 N ATOM 0 H LYS A 217 9.521 -0.814 7.180 1.00 0.20 H new ATOM 0 HA LYS A 217 8.696 -3.571 7.777 1.00 0.22 H new ATOM 0 HB2 LYS A 217 9.090 -2.491 9.933 1.00 0.28 H new ATOM 0 HB3 LYS A 217 8.190 -1.073 9.431 1.00 0.28 H new ATOM 0 HG2 LYS A 217 6.179 -2.623 9.117 1.00 0.36 H new ATOM 0 HG3 LYS A 217 7.117 -3.857 9.934 1.00 0.36 H new ATOM 0 HD2 LYS A 217 7.303 -2.502 11.937 1.00 0.59 H new ATOM 0 HD3 LYS A 217 6.620 -1.107 11.126 1.00 0.59 H new ATOM 0 HE2 LYS A 217 4.470 -2.304 10.837 1.00 1.26 H new ATOM 0 HE3 LYS A 217 5.148 -3.732 11.594 1.00 1.26 H new ATOM 0 HZ1 LYS A 217 3.839 -2.452 13.154 1.00 1.85 H new ATOM 0 HZ2 LYS A 217 5.467 -2.464 13.636 1.00 1.85 H new ATOM 0 HZ3 LYS A 217 4.810 -1.081 12.903 1.00 1.85 H new ATOM 166 N LYS A 218 6.641 -3.088 6.437 1.00 0.19 N ATOM 167 CA LYS A 218 5.341 -2.809 5.842 1.00 0.20 C ATOM 168 C LYS A 218 4.260 -3.183 6.859 1.00 0.18 C ATOM 169 O LYS A 218 4.485 -4.059 7.701 1.00 0.20 O ATOM 170 CB LYS A 218 5.156 -3.530 4.477 1.00 0.31 C ATOM 171 CG LYS A 218 3.996 -4.507 4.411 1.00 0.39 C ATOM 172 CD LYS A 218 4.375 -5.828 5.085 1.00 0.96 C ATOM 173 CE LYS A 218 3.211 -6.795 5.192 1.00 1.56 C ATOM 174 NZ LYS A 218 2.718 -7.226 3.864 1.00 2.42 N ATOM 0 H LYS A 218 6.950 -4.058 6.373 1.00 0.19 H new ATOM 0 HA LYS A 218 5.262 -1.747 5.612 1.00 0.20 H new ATOM 0 HB2 LYS A 218 5.019 -2.776 3.702 1.00 0.31 H new ATOM 0 HB3 LYS A 218 6.075 -4.066 4.241 1.00 0.31 H new ATOM 0 HG2 LYS A 218 3.122 -4.078 4.902 1.00 0.39 H new ATOM 0 HG3 LYS A 218 3.722 -4.687 3.371 1.00 0.39 H new ATOM 0 HD2 LYS A 218 5.181 -6.299 4.522 1.00 0.96 H new ATOM 0 HD3 LYS A 218 4.762 -5.622 6.083 1.00 0.96 H new ATOM 0 HE2 LYS A 218 3.519 -7.670 5.765 1.00 1.56 H new ATOM 0 HE3 LYS A 218 2.398 -6.323 5.744 1.00 1.56 H new ATOM 0 HZ1 LYS A 218 2.343 -8.194 3.930 1.00 2.42 H new ATOM 0 HZ2 LYS A 218 1.964 -6.583 3.548 1.00 2.42 H new ATOM 0 HZ3 LYS A 218 3.500 -7.204 3.179 1.00 2.42 H new ATOM 188 N LEU A 219 3.157 -2.437 6.877 1.00 0.16 N ATOM 189 CA LEU A 219 2.098 -2.662 7.863 1.00 0.16 C ATOM 190 C LEU A 219 1.542 -4.086 7.774 1.00 0.16 C ATOM 191 O LEU A 219 1.826 -4.805 6.820 1.00 0.17 O ATOM 192 CB LEU A 219 0.969 -1.643 7.712 1.00 0.20 C ATOM 193 CG LEU A 219 1.178 -0.326 8.463 1.00 0.66 C ATOM 194 CD1 LEU A 219 -0.058 0.552 8.355 1.00 1.20 C ATOM 195 CD2 LEU A 219 1.521 -0.584 9.923 1.00 1.62 C ATOM 0 H LEU A 219 2.972 -1.675 6.224 1.00 0.16 H new ATOM 0 HA LEU A 219 2.547 -2.532 8.848 1.00 0.16 H new ATOM 0 HB2 LEU A 219 0.839 -1.422 6.653 1.00 0.20 H new ATOM 0 HB3 LEU A 219 0.041 -2.098 8.059 1.00 0.20 H new ATOM 0 HG LEU A 219 2.016 0.197 8.003 1.00 0.66 H new ATOM 0 HD11 LEU A 219 0.109 1.484 8.895 1.00 1.20 H new ATOM 0 HD12 LEU A 219 -0.258 0.771 7.306 1.00 1.20 H new ATOM 0 HD13 LEU A 219 -0.913 0.031 8.786 1.00 1.20 H new ATOM 0 HD21 LEU A 219 1.665 0.367 10.436 1.00 1.62 H new ATOM 0 HD22 LEU A 219 0.707 -1.132 10.397 1.00 1.62 H new ATOM 0 HD23 LEU A 219 2.437 -1.171 9.983 1.00 1.62 H new ATOM 207 N GLU A 220 0.811 -4.504 8.809 1.00 0.17 N ATOM 208 CA GLU A 220 0.297 -5.875 8.911 1.00 0.20 C ATOM 209 C GLU A 220 -0.357 -6.344 7.609 1.00 0.19 C ATOM 210 O GLU A 220 -0.991 -5.559 6.912 1.00 0.19 O ATOM 211 CB GLU A 220 -0.728 -5.962 10.043 1.00 0.23 C ATOM 212 CG GLU A 220 -1.957 -5.091 9.816 1.00 0.24 C ATOM 213 CD GLU A 220 -2.996 -5.260 10.899 1.00 0.75 C ATOM 214 OE1 GLU A 220 -3.490 -6.392 11.082 1.00 1.43 O ATOM 215 OE2 GLU A 220 -3.338 -4.259 11.567 1.00 1.12 O ATOM 0 H GLU A 220 0.559 -3.907 9.597 1.00 0.17 H new ATOM 0 HA GLU A 220 1.148 -6.525 9.116 1.00 0.20 H new ATOM 0 HB2 GLU A 220 -1.043 -6.999 10.158 1.00 0.23 H new ATOM 0 HB3 GLU A 220 -0.251 -5.668 10.978 1.00 0.23 H new ATOM 0 HG2 GLU A 220 -1.653 -4.045 9.769 1.00 0.24 H new ATOM 0 HG3 GLU A 220 -2.400 -5.338 8.851 1.00 0.24 H new ATOM 222 N PRO A 221 -0.162 -7.626 7.242 1.00 0.22 N ATOM 223 CA PRO A 221 -0.692 -8.214 5.992 1.00 0.23 C ATOM 224 C PRO A 221 -2.215 -8.289 5.939 1.00 0.20 C ATOM 225 O PRO A 221 -2.763 -9.158 5.272 1.00 0.19 O ATOM 226 CB PRO A 221 -0.097 -9.623 5.972 1.00 0.29 C ATOM 227 CG PRO A 221 1.036 -9.587 6.939 1.00 0.57 C ATOM 228 CD PRO A 221 0.639 -8.600 7.995 1.00 0.26 C ATOM 0 HA PRO A 221 -0.422 -7.598 5.135 1.00 0.23 H new ATOM 0 HB2 PRO A 221 -0.839 -10.367 6.263 1.00 0.29 H new ATOM 0 HB3 PRO A 221 0.247 -9.890 4.973 1.00 0.29 H new ATOM 0 HG2 PRO A 221 1.213 -10.572 7.371 1.00 0.57 H new ATOM 0 HG3 PRO A 221 1.960 -9.284 6.448 1.00 0.57 H new ATOM 0 HD2 PRO A 221 0.062 -9.069 8.792 1.00 0.26 H new ATOM 0 HD3 PRO A 221 1.507 -8.135 8.462 1.00 0.26 H new ATOM 236 N ALA A 222 -2.868 -7.270 6.463 1.00 0.20 N ATOM 237 CA ALA A 222 -4.305 -7.119 6.346 1.00 0.19 C ATOM 238 C ALA A 222 -4.690 -5.676 6.618 1.00 0.15 C ATOM 239 O ALA A 222 -5.039 -5.309 7.743 1.00 0.17 O ATOM 240 CB ALA A 222 -5.044 -8.049 7.292 1.00 0.24 C ATOM 0 H ALA A 222 -2.414 -6.520 6.984 1.00 0.20 H new ATOM 0 HA ALA A 222 -4.594 -7.388 5.330 1.00 0.19 H new ATOM 0 HB1 ALA A 222 -6.119 -7.907 7.176 1.00 0.24 H new ATOM 0 HB2 ALA A 222 -4.787 -9.083 7.061 1.00 0.24 H new ATOM 0 HB3 ALA A 222 -4.758 -7.825 8.320 1.00 0.24 H new ATOM 246 N TYR A 223 -4.619 -4.859 5.585 1.00 0.12 N ATOM 247 CA TYR A 223 -4.987 -3.460 5.696 1.00 0.11 C ATOM 248 C TYR A 223 -6.503 -3.347 5.665 1.00 0.13 C ATOM 249 O TYR A 223 -7.160 -4.038 4.886 1.00 0.17 O ATOM 250 CB TYR A 223 -4.383 -2.641 4.549 1.00 0.12 C ATOM 251 CG TYR A 223 -2.874 -2.466 4.590 1.00 0.12 C ATOM 252 CD1 TYR A 223 -2.076 -3.413 5.210 1.00 0.16 C ATOM 253 CD2 TYR A 223 -2.250 -1.351 4.052 1.00 0.18 C ATOM 254 CE1 TYR A 223 -0.702 -3.256 5.289 1.00 0.18 C ATOM 255 CE2 TYR A 223 -0.878 -1.189 4.133 1.00 0.20 C ATOM 256 CZ TYR A 223 -0.107 -2.145 4.578 1.00 0.16 C ATOM 257 OH TYR A 223 1.252 -1.991 4.840 1.00 0.21 O ATOM 0 H TYR A 223 -4.308 -5.141 4.655 1.00 0.12 H new ATOM 0 HA TYR A 223 -4.599 -3.065 6.635 1.00 0.11 H new ATOM 0 HB2 TYR A 223 -4.650 -3.118 3.606 1.00 0.12 H new ATOM 0 HB3 TYR A 223 -4.845 -1.654 4.549 1.00 0.12 H new ATOM 0 HD1 TYR A 223 -2.534 -4.291 5.640 1.00 0.16 H new ATOM 0 HD2 TYR A 223 -2.845 -0.595 3.561 1.00 0.18 H new ATOM 0 HE1 TYR A 223 -0.095 -3.940 5.863 1.00 0.18 H new ATOM 0 HE2 TYR A 223 -0.436 -0.254 3.822 1.00 0.20 H new ATOM 0 HH TYR A 223 1.464 -1.037 4.920 1.00 0.21 H new ATOM 267 N GLN A 224 -7.061 -2.557 6.569 1.00 0.15 N ATOM 268 CA GLN A 224 -8.507 -2.434 6.667 1.00 0.18 C ATOM 269 C GLN A 224 -8.976 -1.049 6.232 1.00 0.17 C ATOM 270 O GLN A 224 -8.740 -0.054 6.921 1.00 0.22 O ATOM 271 CB GLN A 224 -8.972 -2.733 8.094 1.00 0.26 C ATOM 272 CG GLN A 224 -8.708 -4.167 8.530 1.00 0.34 C ATOM 273 CD GLN A 224 -9.152 -4.439 9.953 1.00 0.61 C ATOM 274 OE1 GLN A 224 -8.675 -3.808 10.895 1.00 1.42 O ATOM 275 NE2 GLN A 224 -10.065 -5.388 10.125 1.00 0.99 N ATOM 0 H GLN A 224 -6.539 -1.995 7.241 1.00 0.15 H new ATOM 0 HA GLN A 224 -8.953 -3.165 5.992 1.00 0.18 H new ATOM 0 HB2 GLN A 224 -8.468 -2.054 8.782 1.00 0.26 H new ATOM 0 HB3 GLN A 224 -10.040 -2.529 8.170 1.00 0.26 H new ATOM 0 HG2 GLN A 224 -9.227 -4.848 7.856 1.00 0.34 H new ATOM 0 HG3 GLN A 224 -7.643 -4.379 8.440 1.00 0.34 H new ATOM 0 HE21 GLN A 224 -10.437 -5.890 9.319 1.00 0.99 H new ATOM 0 HE22 GLN A 224 -10.394 -5.615 11.063 1.00 0.99 H new ATOM 284 N VAL A 225 -9.598 -0.991 5.057 1.00 0.16 N ATOM 285 CA VAL A 225 -10.101 0.259 4.515 1.00 0.18 C ATOM 286 C VAL A 225 -11.246 0.780 5.350 1.00 0.24 C ATOM 287 O VAL A 225 -12.279 0.130 5.434 1.00 0.30 O ATOM 288 CB VAL A 225 -10.663 0.101 3.084 1.00 0.28 C ATOM 289 CG1 VAL A 225 -10.856 1.464 2.432 1.00 0.77 C ATOM 290 CG2 VAL A 225 -9.791 -0.791 2.228 1.00 0.77 C ATOM 0 H VAL A 225 -9.764 -1.803 4.462 1.00 0.16 H new ATOM 0 HA VAL A 225 -9.248 0.938 4.515 1.00 0.18 H new ATOM 0 HB VAL A 225 -11.635 -0.386 3.165 1.00 0.28 H new ATOM 0 HG11 VAL A 225 -11.252 1.333 1.425 1.00 0.77 H new ATOM 0 HG12 VAL A 225 -11.556 2.054 3.023 1.00 0.77 H new ATOM 0 HG13 VAL A 225 -9.898 1.982 2.380 1.00 0.77 H new ATOM 0 HG21 VAL A 225 -10.224 -0.874 1.231 1.00 0.77 H new ATOM 0 HG22 VAL A 225 -8.792 -0.362 2.155 1.00 0.77 H new ATOM 0 HG23 VAL A 225 -9.729 -1.781 2.680 1.00 0.77 H new ATOM 300 N SER A 226 -11.201 2.052 5.653 1.00 0.26 N ATOM 301 CA SER A 226 -12.412 2.719 6.060 1.00 0.33 C ATOM 302 C SER A 226 -13.148 3.088 4.775 1.00 0.32 C ATOM 303 O SER A 226 -12.596 3.828 3.959 1.00 0.32 O ATOM 304 CB SER A 226 -12.087 3.959 6.882 1.00 0.42 C ATOM 305 OG SER A 226 -11.199 3.652 7.944 1.00 1.20 O ATOM 0 H SER A 226 -10.364 2.634 5.628 1.00 0.26 H new ATOM 0 HA SER A 226 -13.029 2.079 6.691 1.00 0.33 H new ATOM 0 HB2 SER A 226 -11.641 4.718 6.239 1.00 0.42 H new ATOM 0 HB3 SER A 226 -13.007 4.383 7.285 1.00 0.42 H new ATOM 0 HG SER A 226 -11.006 4.466 8.454 1.00 1.20 H new ATOM 311 N LYS A 227 -14.157 2.291 4.443 1.00 0.34 N ATOM 312 CA LYS A 227 -14.741 2.296 3.100 1.00 0.37 C ATOM 313 C LYS A 227 -14.998 3.708 2.582 1.00 0.42 C ATOM 314 O LYS A 227 -15.634 4.537 3.242 1.00 0.48 O ATOM 315 CB LYS A 227 -16.035 1.457 3.051 1.00 0.44 C ATOM 316 CG LYS A 227 -17.331 2.251 3.183 1.00 0.95 C ATOM 317 CD LYS A 227 -18.555 1.348 3.200 1.00 0.93 C ATOM 318 CE LYS A 227 -18.706 0.552 1.916 1.00 0.96 C ATOM 319 NZ LYS A 227 -19.096 1.408 0.764 1.00 1.54 N ATOM 0 H LYS A 227 -14.592 1.629 5.086 1.00 0.34 H new ATOM 0 HA LYS A 227 -14.005 1.838 2.439 1.00 0.37 H new ATOM 0 HB2 LYS A 227 -16.058 0.909 2.109 1.00 0.44 H new ATOM 0 HB3 LYS A 227 -15.999 0.716 3.850 1.00 0.44 H new ATOM 0 HG2 LYS A 227 -17.303 2.840 4.099 1.00 0.95 H new ATOM 0 HG3 LYS A 227 -17.411 2.954 2.354 1.00 0.95 H new ATOM 0 HD2 LYS A 227 -18.485 0.661 4.044 1.00 0.93 H new ATOM 0 HD3 LYS A 227 -19.448 1.954 3.356 1.00 0.93 H new ATOM 0 HE2 LYS A 227 -17.766 0.049 1.690 1.00 0.96 H new ATOM 0 HE3 LYS A 227 -19.457 -0.225 2.059 1.00 0.96 H new ATOM 0 HZ1 LYS A 227 -19.204 0.818 -0.086 1.00 1.54 H new ATOM 0 HZ2 LYS A 227 -19.998 1.882 0.973 1.00 1.54 H new ATOM 0 HZ3 LYS A 227 -18.360 2.123 0.598 1.00 1.54 H new ATOM 333 N GLY A 228 -14.431 3.986 1.414 1.00 0.46 N ATOM 334 CA GLY A 228 -14.591 5.284 0.784 1.00 0.57 C ATOM 335 C GLY A 228 -13.868 6.404 1.511 1.00 0.57 C ATOM 336 O GLY A 228 -13.773 7.520 1.001 1.00 0.70 O ATOM 0 H GLY A 228 -13.857 3.328 0.887 1.00 0.46 H new ATOM 0 HA2 GLY A 228 -14.223 5.230 -0.240 1.00 0.57 H new ATOM 0 HA3 GLY A 228 -15.653 5.524 0.729 1.00 0.57 H new ATOM 340 N HIS A 229 -13.305 6.092 2.668 1.00 0.47 N ATOM 341 CA HIS A 229 -12.553 7.071 3.444 1.00 0.53 C ATOM 342 C HIS A 229 -11.115 7.099 2.956 1.00 0.54 C ATOM 343 O HIS A 229 -10.272 7.809 3.508 1.00 1.02 O ATOM 344 CB HIS A 229 -12.611 6.723 4.935 1.00 0.55 C ATOM 345 CG HIS A 229 -12.087 7.797 5.844 1.00 1.32 C ATOM 346 ND1 HIS A 229 -12.649 9.052 5.934 1.00 1.94 N ATOM 347 CD2 HIS A 229 -11.050 7.790 6.716 1.00 2.31 C ATOM 348 CE1 HIS A 229 -11.982 9.769 6.819 1.00 2.66 C ATOM 349 NE2 HIS A 229 -11.009 9.027 7.307 1.00 2.89 N ATOM 0 H HIS A 229 -13.354 5.166 3.093 1.00 0.47 H new ATOM 0 HA HIS A 229 -12.994 8.059 3.310 1.00 0.53 H new ATOM 0 HB2 HIS A 229 -13.645 6.508 5.205 1.00 0.55 H new ATOM 0 HB3 HIS A 229 -12.040 5.810 5.105 1.00 0.55 H new ATOM 0 HD2 HIS A 229 -10.381 6.965 6.910 1.00 2.31 H new ATOM 0 HE1 HIS A 229 -12.197 10.790 7.096 1.00 2.66 H new ATOM 0 HE2 HIS A 229 -10.334 9.325 8.011 1.00 2.89 H new ATOM 358 N LYS A 230 -10.854 6.278 1.938 1.00 0.30 N ATOM 359 CA LYS A 230 -9.529 6.134 1.341 1.00 0.28 C ATOM 360 C LYS A 230 -8.602 5.393 2.295 1.00 0.24 C ATOM 361 O LYS A 230 -8.206 5.944 3.325 1.00 0.28 O ATOM 362 CB LYS A 230 -8.900 7.503 1.018 1.00 0.36 C ATOM 363 CG LYS A 230 -9.766 8.432 0.186 1.00 1.00 C ATOM 364 CD LYS A 230 -9.184 9.839 0.177 1.00 1.23 C ATOM 365 CE LYS A 230 -10.024 10.798 -0.647 1.00 1.65 C ATOM 366 NZ LYS A 230 -9.948 10.501 -2.101 1.00 2.24 N ATOM 0 H LYS A 230 -11.564 5.690 1.502 1.00 0.30 H new ATOM 0 HA LYS A 230 -9.652 5.573 0.415 1.00 0.28 H new ATOM 0 HB2 LYS A 230 -8.655 8.003 1.955 1.00 0.36 H new ATOM 0 HB3 LYS A 230 -7.961 7.338 0.490 1.00 0.36 H new ATOM 0 HG2 LYS A 230 -9.838 8.055 -0.834 1.00 1.00 H new ATOM 0 HG3 LYS A 230 -10.778 8.454 0.590 1.00 1.00 H new ATOM 0 HD2 LYS A 230 -9.112 10.208 1.200 1.00 1.23 H new ATOM 0 HD3 LYS A 230 -8.171 9.809 -0.223 1.00 1.23 H new ATOM 0 HE2 LYS A 230 -11.062 10.742 -0.320 1.00 1.65 H new ATOM 0 HE3 LYS A 230 -9.688 11.819 -0.468 1.00 1.65 H new ATOM 0 HZ1 LYS A 230 -9.764 11.380 -2.626 1.00 2.24 H new ATOM 0 HZ2 LYS A 230 -9.178 9.825 -2.277 1.00 2.24 H new ATOM 0 HZ3 LYS A 230 -10.849 10.090 -2.419 1.00 2.24 H new ATOM 380 N ILE A 231 -8.232 4.159 1.976 1.00 0.20 N ATOM 381 CA ILE A 231 -7.321 3.449 2.868 1.00 0.17 C ATOM 382 C ILE A 231 -5.868 3.772 2.528 1.00 0.16 C ATOM 383 O ILE A 231 -5.478 3.820 1.363 1.00 0.17 O ATOM 384 CB ILE A 231 -7.521 1.916 2.872 1.00 0.16 C ATOM 385 CG1 ILE A 231 -6.479 1.257 3.781 1.00 0.17 C ATOM 386 CG2 ILE A 231 -7.412 1.355 1.469 1.00 0.18 C ATOM 387 CD1 ILE A 231 -6.655 -0.229 3.940 1.00 0.19 C ATOM 0 H ILE A 231 -8.531 3.647 1.146 1.00 0.20 H new ATOM 0 HA ILE A 231 -7.560 3.803 3.871 1.00 0.17 H new ATOM 0 HB ILE A 231 -8.520 1.700 3.252 1.00 0.16 H new ATOM 0 HG12 ILE A 231 -5.485 1.453 3.379 1.00 0.17 H new ATOM 0 HG13 ILE A 231 -6.523 1.725 4.765 1.00 0.17 H new ATOM 0 HG21 ILE A 231 -7.556 0.275 1.497 1.00 0.18 H new ATOM 0 HG22 ILE A 231 -8.176 1.807 0.836 1.00 0.18 H new ATOM 0 HG23 ILE A 231 -6.425 1.579 1.063 1.00 0.18 H new ATOM 0 HD11 ILE A 231 -5.878 -0.619 4.598 1.00 0.19 H new ATOM 0 HD12 ILE A 231 -7.634 -0.435 4.372 1.00 0.19 H new ATOM 0 HD13 ILE A 231 -6.580 -0.711 2.965 1.00 0.19 H new ATOM 399 N ARG A 232 -5.101 4.077 3.562 1.00 0.17 N ATOM 400 CA ARG A 232 -3.708 4.464 3.415 1.00 0.17 C ATOM 401 C ARG A 232 -2.808 3.267 3.696 1.00 0.15 C ATOM 402 O ARG A 232 -2.952 2.614 4.731 1.00 0.19 O ATOM 403 CB ARG A 232 -3.402 5.604 4.392 1.00 0.22 C ATOM 404 CG ARG A 232 -4.453 6.705 4.380 1.00 0.34 C ATOM 405 CD ARG A 232 -4.313 7.643 5.573 1.00 0.77 C ATOM 406 NE ARG A 232 -3.225 8.612 5.414 1.00 1.44 N ATOM 407 CZ ARG A 232 -3.257 9.646 4.571 1.00 2.13 C ATOM 408 NH1 ARG A 232 -4.348 9.903 3.857 1.00 2.48 N ATOM 409 NH2 ARG A 232 -2.206 10.450 4.471 1.00 3.14 N ATOM 0 H ARG A 232 -5.428 4.063 4.528 1.00 0.17 H new ATOM 0 HA ARG A 232 -3.522 4.804 2.396 1.00 0.17 H new ATOM 0 HB2 ARG A 232 -3.323 5.198 5.400 1.00 0.22 H new ATOM 0 HB3 ARG A 232 -2.432 6.035 4.145 1.00 0.22 H new ATOM 0 HG2 ARG A 232 -4.367 7.278 3.457 1.00 0.34 H new ATOM 0 HG3 ARG A 232 -5.447 6.257 4.386 1.00 0.34 H new ATOM 0 HD2 ARG A 232 -5.251 8.179 5.719 1.00 0.77 H new ATOM 0 HD3 ARG A 232 -4.139 7.054 6.473 1.00 0.77 H new ATOM 0 HE ARG A 232 -2.389 8.488 5.985 1.00 1.44 H new ATOM 0 HH11 ARG A 232 -5.171 9.308 3.951 1.00 2.48 H new ATOM 0 HH12 ARG A 232 -4.363 10.696 3.215 1.00 2.48 H new ATOM 0 HH21 ARG A 232 -1.376 10.277 5.038 1.00 3.14 H new ATOM 0 HH22 ARG A 232 -2.228 11.241 3.827 1.00 3.14 H new ATOM 423 N LEU A 233 -1.893 2.957 2.785 1.00 0.13 N ATOM 424 CA LEU A 233 -1.014 1.829 2.987 1.00 0.14 C ATOM 425 C LEU A 233 0.299 2.320 3.556 1.00 0.13 C ATOM 426 O LEU A 233 1.179 2.750 2.821 1.00 0.13 O ATOM 427 CB LEU A 233 -0.795 1.069 1.669 1.00 0.15 C ATOM 428 CG LEU A 233 -1.936 0.129 1.241 1.00 0.17 C ATOM 429 CD1 LEU A 233 -3.214 0.897 0.938 1.00 0.18 C ATOM 430 CD2 LEU A 233 -1.525 -0.698 0.036 1.00 0.23 C ATOM 0 H LEU A 233 -1.747 3.467 1.914 1.00 0.13 H new ATOM 0 HA LEU A 233 -1.470 1.135 3.693 1.00 0.14 H new ATOM 0 HB2 LEU A 233 -0.632 1.797 0.874 1.00 0.15 H new ATOM 0 HB3 LEU A 233 0.120 0.483 1.757 1.00 0.15 H new ATOM 0 HG LEU A 233 -2.138 -0.539 2.078 1.00 0.17 H new ATOM 0 HD11 LEU A 233 -3.996 0.199 0.639 1.00 0.18 H new ATOM 0 HD12 LEU A 233 -3.532 1.439 1.828 1.00 0.18 H new ATOM 0 HD13 LEU A 233 -3.031 1.604 0.129 1.00 0.18 H new ATOM 0 HD21 LEU A 233 -2.345 -1.356 -0.251 1.00 0.23 H new ATOM 0 HD22 LEU A 233 -1.284 -0.035 -0.795 1.00 0.23 H new ATOM 0 HD23 LEU A 233 -0.650 -1.298 0.287 1.00 0.23 H new ATOM 442 N THR A 234 0.373 2.347 4.875 1.00 0.14 N ATOM 443 CA THR A 234 1.522 2.906 5.560 1.00 0.16 C ATOM 444 C THR A 234 2.599 1.859 5.794 1.00 0.16 C ATOM 445 O THR A 234 2.307 0.690 6.035 1.00 0.22 O ATOM 446 CB THR A 234 1.108 3.540 6.903 1.00 0.22 C ATOM 447 OG1 THR A 234 0.218 4.637 6.664 1.00 0.33 O ATOM 448 CG2 THR A 234 2.325 4.025 7.678 1.00 0.24 C ATOM 0 H THR A 234 -0.353 1.986 5.494 1.00 0.14 H new ATOM 0 HA THR A 234 1.934 3.681 4.914 1.00 0.16 H new ATOM 0 HB THR A 234 0.604 2.780 7.500 1.00 0.22 H new ATOM 0 HG1 THR A 234 -0.045 5.037 7.519 1.00 0.33 H new ATOM 0 HG21 THR A 234 2.003 4.468 8.621 1.00 0.24 H new ATOM 0 HG22 THR A 234 2.987 3.183 7.880 1.00 0.24 H new ATOM 0 HG23 THR A 234 2.857 4.772 7.089 1.00 0.24 H new ATOM 456 N VAL A 235 3.841 2.282 5.630 1.00 0.14 N ATOM 457 CA VAL A 235 5.001 1.427 5.805 1.00 0.14 C ATOM 458 C VAL A 235 6.170 2.240 6.346 1.00 0.14 C ATOM 459 O VAL A 235 6.339 3.400 5.988 1.00 0.16 O ATOM 460 CB VAL A 235 5.430 0.789 4.472 1.00 0.14 C ATOM 461 CG1 VAL A 235 4.334 -0.088 3.927 1.00 0.15 C ATOM 462 CG2 VAL A 235 5.769 1.864 3.464 1.00 0.14 C ATOM 0 H VAL A 235 4.074 3.240 5.369 1.00 0.14 H new ATOM 0 HA VAL A 235 4.726 0.640 6.507 1.00 0.14 H new ATOM 0 HB VAL A 235 6.313 0.176 4.655 1.00 0.14 H new ATOM 0 HG11 VAL A 235 4.657 -0.530 2.984 1.00 0.15 H new ATOM 0 HG12 VAL A 235 4.112 -0.880 4.642 1.00 0.15 H new ATOM 0 HG13 VAL A 235 3.439 0.510 3.760 1.00 0.15 H new ATOM 0 HG21 VAL A 235 6.071 1.400 2.525 1.00 0.14 H new ATOM 0 HG22 VAL A 235 4.894 2.492 3.294 1.00 0.14 H new ATOM 0 HG23 VAL A 235 6.586 2.476 3.846 1.00 0.14 H new ATOM 472 N GLU A 236 7.067 1.582 7.046 1.00 0.13 N ATOM 473 CA GLU A 236 8.323 2.193 7.406 1.00 0.13 C ATOM 474 C GLU A 236 9.318 1.815 6.330 1.00 0.13 C ATOM 475 O GLU A 236 9.589 0.639 6.134 1.00 0.17 O ATOM 476 CB GLU A 236 8.794 1.681 8.769 1.00 0.18 C ATOM 477 CG GLU A 236 9.931 2.487 9.370 1.00 0.29 C ATOM 478 CD GLU A 236 10.197 2.118 10.815 1.00 0.54 C ATOM 479 OE1 GLU A 236 9.313 2.340 11.667 1.00 1.05 O ATOM 480 OE2 GLU A 236 11.298 1.611 11.111 1.00 1.18 O ATOM 0 H GLU A 236 6.948 0.624 7.376 1.00 0.13 H new ATOM 0 HA GLU A 236 8.222 3.276 7.481 1.00 0.13 H new ATOM 0 HB2 GLU A 236 7.951 1.689 9.460 1.00 0.18 H new ATOM 0 HB3 GLU A 236 9.112 0.643 8.666 1.00 0.18 H new ATOM 0 HG2 GLU A 236 10.836 2.327 8.784 1.00 0.29 H new ATOM 0 HG3 GLU A 236 9.694 3.549 9.306 1.00 0.29 H new ATOM 487 N LEU A 237 9.684 2.764 5.493 1.00 0.13 N ATOM 488 CA LEU A 237 10.507 2.455 4.335 1.00 0.15 C ATOM 489 C LEU A 237 11.953 2.243 4.732 1.00 0.17 C ATOM 490 O LEU A 237 12.475 2.953 5.581 1.00 0.19 O ATOM 491 CB LEU A 237 10.428 3.574 3.306 1.00 0.17 C ATOM 492 CG LEU A 237 9.745 3.217 1.992 1.00 0.23 C ATOM 493 CD1 LEU A 237 9.612 4.455 1.136 1.00 0.44 C ATOM 494 CD2 LEU A 237 10.534 2.161 1.245 1.00 0.55 C ATOM 0 H LEU A 237 9.429 3.747 5.588 1.00 0.13 H new ATOM 0 HA LEU A 237 10.123 1.533 3.898 1.00 0.15 H new ATOM 0 HB2 LEU A 237 9.899 4.416 3.752 1.00 0.17 H new ATOM 0 HB3 LEU A 237 11.440 3.914 3.087 1.00 0.17 H new ATOM 0 HG LEU A 237 8.756 2.816 2.213 1.00 0.23 H new ATOM 0 HD11 LEU A 237 9.123 4.197 0.197 1.00 0.44 H new ATOM 0 HD12 LEU A 237 9.015 5.199 1.663 1.00 0.44 H new ATOM 0 HD13 LEU A 237 10.602 4.863 0.930 1.00 0.44 H new ATOM 0 HD21 LEU A 237 10.027 1.922 0.310 1.00 0.55 H new ATOM 0 HD22 LEU A 237 11.534 2.538 1.030 1.00 0.55 H new ATOM 0 HD23 LEU A 237 10.609 1.262 1.857 1.00 0.55 H new ATOM 506 N ALA A 238 12.619 1.343 4.031 1.00 0.19 N ATOM 507 CA ALA A 238 14.052 1.160 4.179 1.00 0.21 C ATOM 508 C ALA A 238 14.772 2.154 3.282 1.00 0.23 C ATOM 509 O ALA A 238 15.822 2.691 3.631 1.00 0.28 O ATOM 510 CB ALA A 238 14.433 -0.261 3.821 1.00 0.25 C ATOM 0 H ALA A 238 12.186 0.722 3.348 1.00 0.19 H new ATOM 0 HA ALA A 238 14.344 1.337 5.214 1.00 0.21 H new ATOM 0 HB1 ALA A 238 15.509 -0.389 3.935 1.00 0.25 H new ATOM 0 HB2 ALA A 238 13.913 -0.955 4.482 1.00 0.25 H new ATOM 0 HB3 ALA A 238 14.151 -0.464 2.788 1.00 0.25 H new ATOM 516 N ASP A 239 14.137 2.449 2.151 1.00 0.22 N ATOM 517 CA ASP A 239 14.639 3.452 1.212 1.00 0.25 C ATOM 518 C ASP A 239 14.472 4.850 1.787 1.00 0.25 C ATOM 519 O ASP A 239 15.262 5.749 1.501 1.00 0.34 O ATOM 520 CB ASP A 239 13.920 3.354 -0.135 1.00 0.31 C ATOM 521 CG ASP A 239 14.519 2.287 -1.039 1.00 0.63 C ATOM 522 OD1 ASP A 239 15.338 1.479 -0.555 1.00 1.28 O ATOM 523 OD2 ASP A 239 14.166 2.245 -2.238 1.00 1.19 O ATOM 0 H ASP A 239 13.267 2.004 1.860 1.00 0.22 H new ATOM 0 HA ASP A 239 15.699 3.257 1.052 1.00 0.25 H new ATOM 0 HB2 ASP A 239 12.866 3.132 0.035 1.00 0.31 H new ATOM 0 HB3 ASP A 239 13.966 4.320 -0.639 1.00 0.31 H new ATOM 528 N HIS A 240 13.445 4.996 2.622 1.00 0.27 N ATOM 529 CA HIS A 240 13.141 6.241 3.337 1.00 0.39 C ATOM 530 C HIS A 240 12.479 7.275 2.438 1.00 0.47 C ATOM 531 O HIS A 240 11.312 7.607 2.629 1.00 0.70 O ATOM 532 CB HIS A 240 14.393 6.843 3.994 1.00 0.46 C ATOM 533 CG HIS A 240 14.978 5.993 5.073 1.00 0.46 C ATOM 534 ND1 HIS A 240 14.658 4.745 5.480 1.00 0.56 N flip ATOM 535 CD2 HIS A 240 16.021 6.397 5.872 1.00 0.40 C flip ATOM 536 CE1 HIS A 240 15.504 4.423 6.509 1.00 0.57 C flip ATOM 537 NE2 HIS A 240 16.317 5.438 6.725 1.00 0.48 N flip ATOM 0 H HIS A 240 12.788 4.243 2.826 1.00 0.27 H new ATOM 0 HA HIS A 240 12.433 5.972 4.121 1.00 0.39 H new ATOM 0 HB2 HIS A 240 15.149 7.010 3.227 1.00 0.46 H new ATOM 0 HB3 HIS A 240 14.140 7.818 4.410 1.00 0.46 H new ATOM 0 HD1 HIS A 240 13.923 4.153 5.093 1.00 0.56 H new ATOM 0 HD2 HIS A 240 16.520 7.353 5.810 1.00 0.40 H new ATOM 0 HE1 HIS A 240 15.505 3.490 7.054 1.00 0.57 H new ATOM 546 N ASP A 241 13.219 7.807 1.478 1.00 0.41 N ATOM 547 CA ASP A 241 12.677 8.858 0.630 1.00 0.51 C ATOM 548 C ASP A 241 12.634 8.426 -0.824 1.00 0.44 C ATOM 549 O ASP A 241 13.011 9.171 -1.734 1.00 0.78 O ATOM 550 CB ASP A 241 13.473 10.155 0.787 1.00 0.80 C ATOM 551 CG ASP A 241 12.671 11.371 0.367 1.00 1.53 C ATOM 552 OD1 ASP A 241 11.465 11.223 0.072 1.00 2.22 O ATOM 553 OD2 ASP A 241 13.236 12.485 0.335 1.00 2.08 O ATOM 0 H ASP A 241 14.179 7.535 1.268 1.00 0.41 H new ATOM 0 HA ASP A 241 11.653 9.047 0.953 1.00 0.51 H new ATOM 0 HB2 ASP A 241 13.782 10.267 1.826 1.00 0.80 H new ATOM 0 HB3 ASP A 241 14.382 10.097 0.189 1.00 0.80 H new ATOM 558 N ALA A 242 12.077 7.252 -1.037 1.00 0.33 N ATOM 559 CA ALA A 242 11.867 6.739 -2.375 1.00 0.30 C ATOM 560 C ALA A 242 10.386 6.638 -2.678 1.00 0.24 C ATOM 561 O ALA A 242 9.569 6.424 -1.781 1.00 0.28 O ATOM 562 CB ALA A 242 12.517 5.385 -2.535 1.00 0.38 C ATOM 0 H ALA A 242 11.759 6.630 -0.294 1.00 0.33 H new ATOM 0 HA ALA A 242 12.325 7.433 -3.079 1.00 0.30 H new ATOM 0 HB1 ALA A 242 12.347 5.017 -3.547 1.00 0.38 H new ATOM 0 HB2 ALA A 242 13.589 5.472 -2.355 1.00 0.38 H new ATOM 0 HB3 ALA A 242 12.085 4.687 -1.818 1.00 0.38 H new ATOM 568 N GLU A 243 10.055 6.748 -3.947 1.00 0.26 N ATOM 569 CA GLU A 243 8.687 6.608 -4.395 1.00 0.30 C ATOM 570 C GLU A 243 8.271 5.155 -4.249 1.00 0.25 C ATOM 571 O GLU A 243 8.961 4.256 -4.733 1.00 0.25 O ATOM 572 CB GLU A 243 8.555 7.036 -5.860 1.00 0.39 C ATOM 573 CG GLU A 243 9.329 8.300 -6.222 1.00 0.67 C ATOM 574 CD GLU A 243 10.813 8.062 -6.442 1.00 1.10 C ATOM 575 OE1 GLU A 243 11.258 6.904 -6.308 1.00 1.64 O ATOM 576 OE2 GLU A 243 11.543 9.024 -6.755 1.00 1.56 O ATOM 0 H GLU A 243 10.724 6.936 -4.694 1.00 0.26 H new ATOM 0 HA GLU A 243 8.043 7.246 -3.790 1.00 0.30 H new ATOM 0 HB2 GLU A 243 8.898 6.220 -6.496 1.00 0.39 H new ATOM 0 HB3 GLU A 243 7.500 7.194 -6.086 1.00 0.39 H new ATOM 0 HG2 GLU A 243 8.901 8.732 -7.127 1.00 0.67 H new ATOM 0 HG3 GLU A 243 9.201 9.035 -5.427 1.00 0.67 H new ATOM 583 N VAL A 244 7.183 4.915 -3.548 1.00 0.24 N ATOM 584 CA VAL A 244 6.724 3.556 -3.346 1.00 0.21 C ATOM 585 C VAL A 244 5.622 3.197 -4.333 1.00 0.20 C ATOM 586 O VAL A 244 4.630 3.915 -4.464 1.00 0.23 O ATOM 587 CB VAL A 244 6.256 3.305 -1.892 1.00 0.22 C ATOM 588 CG1 VAL A 244 7.456 3.287 -0.961 1.00 0.24 C ATOM 589 CG2 VAL A 244 5.230 4.350 -1.427 1.00 0.27 C ATOM 0 H VAL A 244 6.605 5.634 -3.113 1.00 0.24 H new ATOM 0 HA VAL A 244 7.579 2.905 -3.529 1.00 0.21 H new ATOM 0 HB VAL A 244 5.760 2.335 -1.864 1.00 0.22 H new ATOM 0 HG11 VAL A 244 7.121 3.110 0.061 1.00 0.24 H new ATOM 0 HG12 VAL A 244 8.138 2.492 -1.262 1.00 0.24 H new ATOM 0 HG13 VAL A 244 7.971 4.246 -1.013 1.00 0.24 H new ATOM 0 HG21 VAL A 244 4.930 4.134 -0.402 1.00 0.27 H new ATOM 0 HG22 VAL A 244 5.676 5.343 -1.473 1.00 0.27 H new ATOM 0 HG23 VAL A 244 4.355 4.315 -2.076 1.00 0.27 H new ATOM 599 N LYS A 245 5.786 2.056 -4.986 1.00 0.18 N ATOM 600 CA LYS A 245 4.771 1.534 -5.886 1.00 0.19 C ATOM 601 C LYS A 245 4.055 0.384 -5.201 1.00 0.15 C ATOM 602 O LYS A 245 4.549 -0.168 -4.221 1.00 0.16 O ATOM 603 CB LYS A 245 5.380 1.070 -7.210 1.00 0.30 C ATOM 604 CG LYS A 245 5.908 2.197 -8.082 1.00 0.89 C ATOM 605 CD LYS A 245 4.896 3.325 -8.231 1.00 1.51 C ATOM 606 CE LYS A 245 5.250 4.248 -9.384 1.00 2.00 C ATOM 607 NZ LYS A 245 6.682 4.651 -9.368 1.00 2.79 N ATOM 0 H LYS A 245 6.618 1.472 -4.908 1.00 0.18 H new ATOM 0 HA LYS A 245 4.063 2.329 -6.118 1.00 0.19 H new ATOM 0 HB2 LYS A 245 6.194 0.377 -6.999 1.00 0.30 H new ATOM 0 HB3 LYS A 245 4.626 0.516 -7.769 1.00 0.30 H new ATOM 0 HG2 LYS A 245 6.828 2.590 -7.649 1.00 0.89 H new ATOM 0 HG3 LYS A 245 6.162 1.805 -9.067 1.00 0.89 H new ATOM 0 HD2 LYS A 245 3.903 2.905 -8.393 1.00 1.51 H new ATOM 0 HD3 LYS A 245 4.852 3.899 -7.305 1.00 1.51 H new ATOM 0 HE2 LYS A 245 5.026 3.749 -10.327 1.00 2.00 H new ATOM 0 HE3 LYS A 245 4.624 5.139 -9.338 1.00 2.00 H new ATOM 0 HZ1 LYS A 245 6.824 5.452 -10.016 1.00 2.79 H new ATOM 0 HZ2 LYS A 245 6.953 4.932 -8.404 1.00 2.79 H new ATOM 0 HZ3 LYS A 245 7.271 3.850 -9.673 1.00 2.79 H new ATOM 621 N TRP A 246 2.814 0.166 -5.535 1.00 0.14 N ATOM 622 CA TRP A 246 2.042 -0.795 -4.781 1.00 0.13 C ATOM 623 C TRP A 246 1.374 -1.762 -5.714 1.00 0.14 C ATOM 624 O TRP A 246 1.634 -1.745 -6.906 1.00 0.14 O ATOM 625 CB TRP A 246 1.079 -0.101 -3.800 1.00 0.14 C ATOM 626 CG TRP A 246 1.851 0.751 -2.828 1.00 0.12 C ATOM 627 CD1 TRP A 246 2.507 1.907 -3.129 1.00 0.14 C ATOM 628 CD2 TRP A 246 2.114 0.505 -1.434 1.00 0.11 C ATOM 629 NE1 TRP A 246 3.184 2.367 -2.043 1.00 0.15 N ATOM 630 CE2 TRP A 246 2.961 1.539 -0.989 1.00 0.12 C ATOM 631 CE3 TRP A 246 1.734 -0.478 -0.515 1.00 0.13 C ATOM 632 CZ2 TRP A 246 3.435 1.613 0.315 1.00 0.14 C ATOM 633 CZ3 TRP A 246 2.210 -0.382 0.786 1.00 0.15 C ATOM 634 CH2 TRP A 246 3.051 0.647 1.173 1.00 0.15 C ATOM 0 H TRP A 246 2.321 0.624 -6.302 1.00 0.14 H new ATOM 0 HA TRP A 246 2.710 -1.382 -4.150 1.00 0.13 H new ATOM 0 HB2 TRP A 246 0.369 0.516 -4.351 1.00 0.14 H new ATOM 0 HB3 TRP A 246 0.499 -0.848 -3.259 1.00 0.14 H new ATOM 0 HD1 TRP A 246 2.491 2.390 -4.095 1.00 0.14 H new ATOM 0 HE1 TRP A 246 3.768 3.203 -2.023 1.00 0.15 H new ATOM 0 HE3 TRP A 246 1.087 -1.291 -0.809 1.00 0.13 H new ATOM 0 HZ2 TRP A 246 4.087 2.415 0.629 1.00 0.14 H new ATOM 0 HZ3 TRP A 246 1.918 -1.126 1.512 1.00 0.15 H new ATOM 0 HH2 TRP A 246 3.410 0.677 2.191 1.00 0.15 H new ATOM 645 N LEU A 247 0.844 -2.803 -5.167 1.00 0.15 N ATOM 646 CA LEU A 247 0.386 -3.906 -5.969 1.00 0.14 C ATOM 647 C LEU A 247 -1.006 -4.296 -5.494 1.00 0.15 C ATOM 648 O LEU A 247 -1.247 -4.327 -4.311 1.00 0.16 O ATOM 649 CB LEU A 247 1.369 -5.068 -5.774 1.00 0.15 C ATOM 650 CG LEU A 247 2.252 -5.516 -6.947 1.00 0.16 C ATOM 651 CD1 LEU A 247 1.564 -6.612 -7.737 1.00 0.21 C ATOM 652 CD2 LEU A 247 2.639 -4.356 -7.847 1.00 0.17 C ATOM 0 H LEU A 247 0.713 -2.922 -4.162 1.00 0.15 H new ATOM 0 HA LEU A 247 0.339 -3.644 -7.026 1.00 0.14 H new ATOM 0 HB2 LEU A 247 2.031 -4.801 -4.950 1.00 0.15 H new ATOM 0 HB3 LEU A 247 0.791 -5.934 -5.451 1.00 0.15 H new ATOM 0 HG LEU A 247 3.177 -5.914 -6.529 1.00 0.16 H new ATOM 0 HD11 LEU A 247 2.202 -6.919 -8.565 1.00 0.21 H new ATOM 0 HD12 LEU A 247 1.377 -7.467 -7.087 1.00 0.21 H new ATOM 0 HD13 LEU A 247 0.617 -6.239 -8.128 1.00 0.21 H new ATOM 0 HD21 LEU A 247 3.263 -4.721 -8.663 1.00 0.17 H new ATOM 0 HD22 LEU A 247 1.739 -3.897 -8.256 1.00 0.17 H new ATOM 0 HD23 LEU A 247 3.193 -3.616 -7.269 1.00 0.17 H new ATOM 664 N LYS A 248 -1.861 -4.743 -6.377 1.00 0.19 N ATOM 665 CA LYS A 248 -3.062 -5.432 -5.932 1.00 0.25 C ATOM 666 C LYS A 248 -2.828 -6.885 -6.271 1.00 0.25 C ATOM 667 O LYS A 248 -1.949 -7.143 -7.088 1.00 0.21 O ATOM 668 CB LYS A 248 -4.345 -4.916 -6.602 1.00 0.34 C ATOM 669 CG LYS A 248 -5.569 -5.763 -6.261 1.00 0.77 C ATOM 670 CD LYS A 248 -6.875 -4.988 -6.356 1.00 0.95 C ATOM 671 CE LYS A 248 -7.193 -4.556 -7.773 1.00 1.57 C ATOM 672 NZ LYS A 248 -8.572 -4.011 -7.877 1.00 2.06 N ATOM 0 H LYS A 248 -1.760 -4.650 -7.388 1.00 0.19 H new ATOM 0 HA LYS A 248 -3.223 -5.264 -4.867 1.00 0.25 H new ATOM 0 HB2 LYS A 248 -4.523 -3.886 -6.292 1.00 0.34 H new ATOM 0 HB3 LYS A 248 -4.206 -4.904 -7.683 1.00 0.34 H new ATOM 0 HG2 LYS A 248 -5.611 -6.618 -6.935 1.00 0.77 H new ATOM 0 HG3 LYS A 248 -5.460 -6.158 -5.251 1.00 0.77 H new ATOM 0 HD2 LYS A 248 -7.689 -5.606 -5.977 1.00 0.95 H new ATOM 0 HD3 LYS A 248 -6.819 -4.108 -5.716 1.00 0.95 H new ATOM 0 HE2 LYS A 248 -6.476 -3.800 -8.094 1.00 1.57 H new ATOM 0 HE3 LYS A 248 -7.084 -5.406 -8.447 1.00 1.57 H new ATOM 0 HZ1 LYS A 248 -9.145 -4.630 -8.485 1.00 2.06 H new ATOM 0 HZ2 LYS A 248 -8.999 -3.964 -6.930 1.00 2.06 H new ATOM 0 HZ3 LYS A 248 -8.538 -3.057 -8.289 1.00 2.06 H new ATOM 686 N ASN A 249 -3.361 -7.815 -5.487 1.00 0.34 N ATOM 687 CA ASN A 249 -2.977 -9.220 -5.648 1.00 0.40 C ATOM 688 C ASN A 249 -2.898 -9.598 -7.129 1.00 0.35 C ATOM 689 O ASN A 249 -3.866 -9.454 -7.874 1.00 0.35 O ATOM 690 CB ASN A 249 -3.906 -10.174 -4.869 1.00 0.61 C ATOM 691 CG ASN A 249 -5.355 -10.180 -5.333 1.00 0.75 C ATOM 692 OD1 ASN A 249 -6.252 -9.757 -4.462 1.00 1.38 O flip ATOM 693 ND2 ASN A 249 -5.673 -10.596 -6.444 1.00 1.19 N flip ATOM 0 H ASN A 249 -4.043 -7.634 -4.751 1.00 0.34 H new ATOM 0 HA ASN A 249 -1.983 -9.334 -5.216 1.00 0.40 H new ATOM 0 HB2 ASN A 249 -3.511 -11.187 -4.948 1.00 0.61 H new ATOM 0 HB3 ASN A 249 -3.879 -9.902 -3.814 1.00 0.61 H new ATOM 0 HD21 ASN A 249 -4.955 -10.916 -7.094 1.00 1.19 H new ATOM 0 HD22 ASN A 249 -6.655 -10.622 -6.717 1.00 1.19 H new ATOM 700 N GLY A 250 -1.667 -9.816 -7.581 1.00 0.35 N ATOM 701 CA GLY A 250 -1.404 -10.037 -8.992 1.00 0.35 C ATOM 702 C GLY A 250 -1.233 -8.757 -9.807 1.00 0.33 C ATOM 703 O GLY A 250 -0.299 -8.658 -10.603 1.00 0.39 O ATOM 0 H GLY A 250 -0.838 -9.844 -6.987 1.00 0.35 H new ATOM 0 HA2 GLY A 250 -0.502 -10.640 -9.091 1.00 0.35 H new ATOM 0 HA3 GLY A 250 -2.224 -10.617 -9.416 1.00 0.35 H new ATOM 707 N GLN A 251 -2.163 -7.815 -9.675 1.00 0.30 N ATOM 708 CA GLN A 251 -2.145 -6.592 -10.488 1.00 0.36 C ATOM 709 C GLN A 251 -1.132 -5.580 -9.956 1.00 0.25 C ATOM 710 O GLN A 251 -1.079 -5.306 -8.763 1.00 0.28 O ATOM 711 CB GLN A 251 -3.531 -5.957 -10.516 1.00 0.52 C ATOM 712 CG GLN A 251 -3.673 -4.810 -11.506 1.00 1.28 C ATOM 713 CD GLN A 251 -5.095 -4.283 -11.599 1.00 2.00 C ATOM 714 OE1 GLN A 251 -6.028 -4.961 -10.949 1.00 2.77 O flip ATOM 715 NE2 GLN A 251 -5.353 -3.277 -12.262 1.00 2.59 N flip ATOM 0 H GLN A 251 -2.939 -7.870 -9.015 1.00 0.30 H new ATOM 0 HA GLN A 251 -1.850 -6.874 -11.499 1.00 0.36 H new ATOM 0 HB2 GLN A 251 -4.265 -6.725 -10.760 1.00 0.52 H new ATOM 0 HB3 GLN A 251 -3.771 -5.592 -9.517 1.00 0.52 H new ATOM 0 HG2 GLN A 251 -3.008 -3.998 -11.211 1.00 1.28 H new ATOM 0 HG3 GLN A 251 -3.350 -5.145 -12.492 1.00 1.28 H new ATOM 0 HE21 GLN A 251 -4.606 -2.782 -12.749 1.00 2.59 H new ATOM 0 HE22 GLN A 251 -6.314 -2.940 -12.324 1.00 2.59 H new ATOM 724 N GLU A 252 -0.351 -5.000 -10.846 1.00 0.26 N ATOM 725 CA GLU A 252 0.661 -4.033 -10.444 1.00 0.25 C ATOM 726 C GLU A 252 0.090 -2.626 -10.346 1.00 0.27 C ATOM 727 O GLU A 252 -0.730 -2.217 -11.172 1.00 0.32 O ATOM 728 CB GLU A 252 1.849 -4.091 -11.391 1.00 0.32 C ATOM 729 CG GLU A 252 2.506 -5.457 -11.393 1.00 0.60 C ATOM 730 CD GLU A 252 3.801 -5.493 -12.178 1.00 1.05 C ATOM 731 OE1 GLU A 252 4.244 -4.421 -12.639 1.00 1.49 O ATOM 732 OE2 GLU A 252 4.378 -6.591 -12.344 1.00 1.60 O ATOM 0 H GLU A 252 -0.394 -5.178 -11.849 1.00 0.26 H new ATOM 0 HA GLU A 252 1.007 -4.299 -9.445 1.00 0.25 H new ATOM 0 HB2 GLU A 252 1.520 -3.845 -12.401 1.00 0.32 H new ATOM 0 HB3 GLU A 252 2.581 -3.337 -11.101 1.00 0.32 H new ATOM 0 HG2 GLU A 252 2.703 -5.760 -10.365 1.00 0.60 H new ATOM 0 HG3 GLU A 252 1.813 -6.186 -11.813 1.00 0.60 H new ATOM 739 N ILE A 253 0.384 -1.977 -9.227 1.00 0.23 N ATOM 740 CA ILE A 253 -0.223 -0.704 -8.886 1.00 0.27 C ATOM 741 C ILE A 253 0.797 0.451 -8.844 1.00 0.28 C ATOM 742 O ILE A 253 1.773 0.437 -8.080 1.00 0.28 O ATOM 743 CB ILE A 253 -0.991 -0.867 -7.553 1.00 0.26 C ATOM 744 CG1 ILE A 253 -2.415 -1.343 -7.820 1.00 0.31 C ATOM 745 CG2 ILE A 253 -0.983 0.389 -6.704 1.00 0.28 C ATOM 746 CD1 ILE A 253 -3.142 -1.775 -6.570 1.00 0.33 C ATOM 0 H ILE A 253 1.049 -2.320 -8.534 1.00 0.23 H new ATOM 0 HA ILE A 253 -0.924 -0.423 -9.672 1.00 0.27 H new ATOM 0 HB ILE A 253 -0.465 -1.624 -6.972 1.00 0.26 H new ATOM 0 HG12 ILE A 253 -2.976 -0.540 -8.299 1.00 0.31 H new ATOM 0 HG13 ILE A 253 -2.387 -2.176 -8.522 1.00 0.31 H new ATOM 0 HG21 ILE A 253 -1.538 0.209 -5.783 1.00 0.28 H new ATOM 0 HG22 ILE A 253 0.045 0.658 -6.461 1.00 0.28 H new ATOM 0 HG23 ILE A 253 -1.450 1.204 -7.256 1.00 0.28 H new ATOM 0 HD11 ILE A 253 -4.149 -2.102 -6.829 1.00 0.33 H new ATOM 0 HD12 ILE A 253 -2.603 -2.598 -6.101 1.00 0.33 H new ATOM 0 HD13 ILE A 253 -3.200 -0.937 -5.875 1.00 0.33 H new ATOM 758 N GLN A 254 0.586 1.433 -9.707 1.00 0.36 N ATOM 759 CA GLN A 254 1.490 2.571 -9.800 1.00 0.43 C ATOM 760 C GLN A 254 1.085 3.685 -8.836 1.00 0.61 C ATOM 761 O GLN A 254 1.121 3.506 -7.620 1.00 1.42 O ATOM 762 CB GLN A 254 1.549 3.095 -11.237 1.00 0.70 C ATOM 763 CG GLN A 254 2.117 2.095 -12.233 1.00 1.00 C ATOM 764 CD GLN A 254 3.560 1.723 -11.945 1.00 1.75 C ATOM 765 OE1 GLN A 254 3.893 1.263 -10.854 1.00 2.63 O ATOM 766 NE2 GLN A 254 4.426 1.913 -12.925 1.00 2.21 N ATOM 0 H GLN A 254 -0.203 1.466 -10.353 1.00 0.36 H new ATOM 0 HA GLN A 254 2.485 2.230 -9.513 1.00 0.43 H new ATOM 0 HB2 GLN A 254 0.544 3.377 -11.552 1.00 0.70 H new ATOM 0 HB3 GLN A 254 2.156 4.000 -11.259 1.00 0.70 H new ATOM 0 HG2 GLN A 254 1.506 1.192 -12.221 1.00 1.00 H new ATOM 0 HG3 GLN A 254 2.049 2.513 -13.237 1.00 1.00 H new ATOM 0 HE21 GLN A 254 4.112 2.297 -13.816 1.00 2.21 H new ATOM 0 HE22 GLN A 254 5.409 1.676 -12.790 1.00 2.21 H new ATOM 775 N MET A 255 0.756 4.851 -9.384 1.00 0.59 N ATOM 776 CA MET A 255 0.424 6.017 -8.577 1.00 0.61 C ATOM 777 C MET A 255 -0.560 6.910 -9.321 1.00 0.65 C ATOM 778 O MET A 255 -0.599 6.901 -10.554 1.00 0.95 O ATOM 779 CB MET A 255 1.691 6.809 -8.236 1.00 0.95 C ATOM 780 CG MET A 255 2.410 7.365 -9.455 1.00 1.58 C ATOM 781 SD MET A 255 3.938 8.227 -9.037 1.00 2.30 S ATOM 782 CE MET A 255 4.482 8.741 -10.665 1.00 2.61 C ATOM 0 H MET A 255 0.713 5.012 -10.390 1.00 0.59 H new ATOM 0 HA MET A 255 -0.037 5.675 -7.651 1.00 0.61 H new ATOM 0 HB2 MET A 255 1.426 7.633 -7.574 1.00 0.95 H new ATOM 0 HB3 MET A 255 2.375 6.164 -7.684 1.00 0.95 H new ATOM 0 HG2 MET A 255 2.636 6.549 -10.141 1.00 1.58 H new ATOM 0 HG3 MET A 255 1.745 8.050 -9.982 1.00 1.58 H new ATOM 0 HE1 MET A 255 5.420 9.290 -10.579 1.00 2.61 H new ATOM 0 HE2 MET A 255 4.632 7.863 -11.293 1.00 2.61 H new ATOM 0 HE3 MET A 255 3.726 9.384 -11.115 1.00 2.61 H new ATOM 792 N SER A 256 -1.394 7.624 -8.575 1.00 0.57 N ATOM 793 CA SER A 256 -2.403 8.484 -9.169 1.00 0.69 C ATOM 794 C SER A 256 -2.995 9.415 -8.112 1.00 1.00 C ATOM 795 O SER A 256 -2.647 9.329 -6.934 1.00 1.47 O ATOM 796 CB SER A 256 -3.514 7.638 -9.803 1.00 0.76 C ATOM 797 OG SER A 256 -4.260 8.384 -10.746 1.00 1.64 O ATOM 0 H SER A 256 -1.389 7.622 -7.555 1.00 0.57 H new ATOM 0 HA SER A 256 -1.932 9.087 -9.945 1.00 0.69 H new ATOM 0 HB2 SER A 256 -3.076 6.767 -10.291 1.00 0.76 H new ATOM 0 HB3 SER A 256 -4.179 7.266 -9.024 1.00 0.76 H new ATOM 0 HG SER A 256 -4.959 7.816 -11.133 1.00 1.64 H new ATOM 803 N GLY A 257 -3.873 10.310 -8.545 1.00 1.01 N ATOM 804 CA GLY A 257 -4.507 11.236 -7.631 1.00 1.41 C ATOM 805 C GLY A 257 -5.784 10.678 -7.037 1.00 1.28 C ATOM 806 O GLY A 257 -6.101 10.931 -5.880 1.00 1.69 O ATOM 0 H GLY A 257 -4.158 10.410 -9.519 1.00 1.01 H new ATOM 0 HA2 GLY A 257 -3.813 11.482 -6.827 1.00 1.41 H new ATOM 0 HA3 GLY A 257 -4.729 12.165 -8.156 1.00 1.41 H new ATOM 810 N SER A 258 -6.565 9.991 -7.858 1.00 1.07 N ATOM 811 CA SER A 258 -7.853 9.467 -7.419 1.00 0.96 C ATOM 812 C SER A 258 -7.718 8.062 -6.824 1.00 0.74 C ATOM 813 O SER A 258 -8.718 7.435 -6.465 1.00 1.14 O ATOM 814 CB SER A 258 -8.832 9.451 -8.591 1.00 1.08 C ATOM 815 OG SER A 258 -8.942 10.736 -9.180 1.00 1.77 O ATOM 0 H SER A 258 -6.332 9.783 -8.829 1.00 1.07 H new ATOM 0 HA SER A 258 -8.234 10.122 -6.635 1.00 0.96 H new ATOM 0 HB2 SER A 258 -8.498 8.732 -9.339 1.00 1.08 H new ATOM 0 HB3 SER A 258 -9.812 9.120 -8.246 1.00 1.08 H new ATOM 0 HG SER A 258 -9.573 10.700 -9.929 1.00 1.77 H new ATOM 821 N LYS A 259 -6.483 7.574 -6.747 1.00 0.51 N ATOM 822 CA LYS A 259 -6.187 6.237 -6.232 1.00 0.37 C ATOM 823 C LYS A 259 -4.687 6.001 -6.297 1.00 0.33 C ATOM 824 O LYS A 259 -4.007 6.691 -7.046 1.00 0.45 O ATOM 825 CB LYS A 259 -6.923 5.165 -7.038 1.00 0.48 C ATOM 826 CG LYS A 259 -6.570 5.142 -8.516 1.00 1.11 C ATOM 827 CD LYS A 259 -7.456 4.167 -9.275 1.00 1.59 C ATOM 828 CE LYS A 259 -8.922 4.565 -9.195 1.00 2.02 C ATOM 829 NZ LYS A 259 -9.823 3.469 -9.638 1.00 2.41 N ATOM 0 H LYS A 259 -5.656 8.094 -7.040 1.00 0.51 H new ATOM 0 HA LYS A 259 -6.527 6.172 -5.199 1.00 0.37 H new ATOM 0 HB2 LYS A 259 -6.702 4.188 -6.608 1.00 0.48 H new ATOM 0 HB3 LYS A 259 -7.997 5.323 -6.935 1.00 0.48 H new ATOM 0 HG2 LYS A 259 -6.682 6.142 -8.935 1.00 1.11 H new ATOM 0 HG3 LYS A 259 -5.524 4.860 -8.639 1.00 1.11 H new ATOM 0 HD2 LYS A 259 -7.145 4.129 -10.319 1.00 1.59 H new ATOM 0 HD3 LYS A 259 -7.328 3.164 -8.867 1.00 1.59 H new ATOM 0 HE2 LYS A 259 -9.166 4.843 -8.170 1.00 2.02 H new ATOM 0 HE3 LYS A 259 -9.092 5.446 -9.813 1.00 2.02 H new ATOM 0 HZ1 LYS A 259 -10.812 3.783 -9.567 1.00 2.41 H new ATOM 0 HZ2 LYS A 259 -9.608 3.220 -10.625 1.00 2.41 H new ATOM 0 HZ3 LYS A 259 -9.680 2.636 -9.032 1.00 2.41 H new ATOM 843 N TYR A 260 -4.169 5.051 -5.512 1.00 0.24 N ATOM 844 CA TYR A 260 -2.734 4.770 -5.506 1.00 0.27 C ATOM 845 C TYR A 260 -1.950 6.056 -5.231 1.00 0.27 C ATOM 846 O TYR A 260 -1.045 6.419 -5.977 1.00 0.29 O ATOM 847 CB TYR A 260 -2.293 4.159 -6.845 1.00 0.33 C ATOM 848 CG TYR A 260 -3.241 3.112 -7.399 1.00 0.43 C ATOM 849 CD1 TYR A 260 -3.877 2.190 -6.569 1.00 0.29 C ATOM 850 CD2 TYR A 260 -3.507 3.055 -8.762 1.00 0.84 C ATOM 851 CE1 TYR A 260 -4.747 1.248 -7.087 1.00 0.52 C ATOM 852 CE2 TYR A 260 -4.377 2.117 -9.283 1.00 1.11 C ATOM 853 CZ TYR A 260 -4.994 1.217 -8.442 1.00 0.95 C ATOM 854 OH TYR A 260 -5.864 0.282 -8.958 1.00 1.24 O ATOM 0 H TYR A 260 -4.718 4.470 -4.879 1.00 0.24 H new ATOM 0 HA TYR A 260 -2.527 4.049 -4.715 1.00 0.27 H new ATOM 0 HB2 TYR A 260 -2.186 4.959 -7.578 1.00 0.33 H new ATOM 0 HB3 TYR A 260 -1.308 3.709 -6.718 1.00 0.33 H new ATOM 0 HD1 TYR A 260 -3.688 2.212 -5.506 1.00 0.29 H new ATOM 0 HD2 TYR A 260 -3.025 3.757 -9.426 1.00 0.84 H new ATOM 0 HE1 TYR A 260 -5.231 0.539 -6.432 1.00 0.52 H new ATOM 0 HE2 TYR A 260 -4.573 2.089 -10.345 1.00 1.11 H new ATOM 0 HH TYR A 260 -5.928 0.396 -9.929 1.00 1.24 H new ATOM 864 N ILE A 261 -2.366 6.781 -4.207 1.00 0.26 N ATOM 865 CA ILE A 261 -1.767 8.065 -3.886 1.00 0.27 C ATOM 866 C ILE A 261 -0.504 7.868 -3.057 1.00 0.28 C ATOM 867 O ILE A 261 -0.550 7.300 -1.971 1.00 0.35 O ATOM 868 CB ILE A 261 -2.754 8.941 -3.089 1.00 0.29 C ATOM 869 CG1 ILE A 261 -4.042 9.163 -3.882 1.00 0.32 C ATOM 870 CG2 ILE A 261 -2.120 10.270 -2.719 1.00 0.33 C ATOM 871 CD1 ILE A 261 -5.115 9.884 -3.095 1.00 0.39 C ATOM 0 H ILE A 261 -3.120 6.500 -3.581 1.00 0.26 H new ATOM 0 HA ILE A 261 -1.517 8.562 -4.824 1.00 0.27 H new ATOM 0 HB ILE A 261 -3.004 8.415 -2.168 1.00 0.29 H new ATOM 0 HG12 ILE A 261 -3.813 9.737 -4.780 1.00 0.32 H new ATOM 0 HG13 ILE A 261 -4.429 8.198 -4.210 1.00 0.32 H new ATOM 0 HG21 ILE A 261 -2.835 10.871 -2.157 1.00 0.33 H new ATOM 0 HG22 ILE A 261 -1.235 10.093 -2.107 1.00 0.33 H new ATOM 0 HG23 ILE A 261 -1.833 10.802 -3.626 1.00 0.33 H new ATOM 0 HD11 ILE A 261 -6.001 10.008 -3.717 1.00 0.39 H new ATOM 0 HD12 ILE A 261 -5.372 9.301 -2.211 1.00 0.39 H new ATOM 0 HD13 ILE A 261 -4.746 10.863 -2.789 1.00 0.39 H new ATOM 883 N PHE A 262 0.619 8.341 -3.562 1.00 0.30 N ATOM 884 CA PHE A 262 1.873 8.212 -2.841 1.00 0.32 C ATOM 885 C PHE A 262 1.973 9.258 -1.731 1.00 0.30 C ATOM 886 O PHE A 262 1.796 10.454 -1.964 1.00 0.37 O ATOM 887 CB PHE A 262 3.066 8.305 -3.807 1.00 0.46 C ATOM 888 CG PHE A 262 3.083 9.540 -4.664 1.00 0.63 C ATOM 889 CD1 PHE A 262 2.450 9.547 -5.897 1.00 0.84 C ATOM 890 CD2 PHE A 262 3.729 10.691 -4.240 1.00 0.87 C ATOM 891 CE1 PHE A 262 2.458 10.679 -6.688 1.00 1.09 C ATOM 892 CE2 PHE A 262 3.742 11.824 -5.028 1.00 1.13 C ATOM 893 CZ PHE A 262 3.105 11.819 -6.254 1.00 1.18 C ATOM 0 H PHE A 262 0.690 8.815 -4.462 1.00 0.30 H new ATOM 0 HA PHE A 262 1.899 7.229 -2.371 1.00 0.32 H new ATOM 0 HB2 PHE A 262 3.989 8.268 -3.228 1.00 0.46 H new ATOM 0 HB3 PHE A 262 3.061 7.429 -4.455 1.00 0.46 H new ATOM 0 HD1 PHE A 262 1.945 8.657 -6.243 1.00 0.84 H new ATOM 0 HD2 PHE A 262 4.228 10.701 -3.282 1.00 0.87 H new ATOM 0 HE1 PHE A 262 1.958 10.673 -7.646 1.00 1.09 H new ATOM 0 HE2 PHE A 262 4.250 12.714 -4.687 1.00 1.13 H new ATOM 0 HZ PHE A 262 3.113 12.705 -6.872 1.00 1.18 H new ATOM 903 N GLU A 263 2.211 8.794 -0.515 1.00 0.26 N ATOM 904 CA GLU A 263 2.314 9.673 0.636 1.00 0.30 C ATOM 905 C GLU A 263 3.634 9.429 1.355 1.00 0.28 C ATOM 906 O GLU A 263 4.031 8.278 1.577 1.00 0.33 O ATOM 907 CB GLU A 263 1.134 9.448 1.586 1.00 0.37 C ATOM 908 CG GLU A 263 1.122 10.391 2.777 1.00 0.56 C ATOM 909 CD GLU A 263 1.059 11.847 2.363 1.00 1.07 C ATOM 910 OE1 GLU A 263 0.090 12.232 1.678 1.00 1.79 O ATOM 911 OE2 GLU A 263 1.986 12.610 2.704 1.00 1.73 O ATOM 0 H GLU A 263 2.337 7.805 -0.300 1.00 0.26 H new ATOM 0 HA GLU A 263 2.285 10.708 0.296 1.00 0.30 H new ATOM 0 HB2 GLU A 263 0.204 9.566 1.030 1.00 0.37 H new ATOM 0 HB3 GLU A 263 1.161 8.420 1.948 1.00 0.37 H new ATOM 0 HG2 GLU A 263 0.266 10.159 3.411 1.00 0.56 H new ATOM 0 HG3 GLU A 263 2.017 10.225 3.377 1.00 0.56 H new ATOM 918 N SER A 264 4.352 10.507 1.620 1.00 0.34 N ATOM 919 CA SER A 264 5.680 10.422 2.198 1.00 0.36 C ATOM 920 C SER A 264 5.688 10.986 3.619 1.00 0.34 C ATOM 921 O SER A 264 5.333 12.147 3.829 1.00 0.39 O ATOM 922 CB SER A 264 6.646 11.208 1.314 1.00 0.46 C ATOM 923 OG SER A 264 6.347 11.006 -0.063 1.00 1.41 O ATOM 0 H SER A 264 4.033 11.459 1.442 1.00 0.34 H new ATOM 0 HA SER A 264 5.988 9.378 2.251 1.00 0.36 H new ATOM 0 HB2 SER A 264 6.583 12.270 1.553 1.00 0.46 H new ATOM 0 HB3 SER A 264 7.670 10.895 1.518 1.00 0.46 H new ATOM 0 HG SER A 264 6.975 11.519 -0.613 1.00 1.41 H new ATOM 929 N ILE A 265 6.045 10.156 4.595 1.00 0.31 N ATOM 930 CA ILE A 265 6.055 10.582 5.990 1.00 0.34 C ATOM 931 C ILE A 265 7.354 10.166 6.684 1.00 0.38 C ATOM 932 O ILE A 265 7.417 9.095 7.293 1.00 0.42 O ATOM 933 CB ILE A 265 4.860 9.981 6.772 1.00 0.42 C ATOM 934 CG1 ILE A 265 3.547 10.185 6.003 1.00 0.82 C ATOM 935 CG2 ILE A 265 4.763 10.607 8.156 1.00 0.73 C ATOM 936 CD1 ILE A 265 2.346 9.538 6.659 1.00 1.31 C ATOM 0 H ILE A 265 6.330 9.188 4.446 1.00 0.31 H new ATOM 0 HA ILE A 265 5.974 11.669 5.988 1.00 0.34 H new ATOM 0 HB ILE A 265 5.030 8.910 6.883 1.00 0.42 H new ATOM 0 HG12 ILE A 265 3.360 11.254 5.899 1.00 0.82 H new ATOM 0 HG13 ILE A 265 3.660 9.782 4.997 1.00 0.82 H new ATOM 0 HG21 ILE A 265 3.919 10.174 8.693 1.00 0.73 H new ATOM 0 HG22 ILE A 265 5.682 10.413 8.708 1.00 0.73 H new ATOM 0 HG23 ILE A 265 4.618 11.683 8.059 1.00 0.73 H new ATOM 0 HD11 ILE A 265 1.457 9.726 6.057 1.00 1.31 H new ATOM 0 HD12 ILE A 265 2.510 8.463 6.738 1.00 1.31 H new ATOM 0 HD13 ILE A 265 2.205 9.958 7.655 1.00 1.31 H new ATOM 948 N GLY A 266 8.337 11.067 6.683 1.00 0.48 N ATOM 949 CA GLY A 266 9.579 10.858 7.424 1.00 0.65 C ATOM 950 C GLY A 266 10.134 9.447 7.315 1.00 0.86 C ATOM 951 O GLY A 266 10.079 8.689 8.289 1.00 1.93 O ATOM 0 H GLY A 266 8.296 11.951 6.175 1.00 0.48 H new ATOM 0 HA2 GLY A 266 10.329 11.561 7.062 1.00 0.65 H new ATOM 0 HA3 GLY A 266 9.406 11.089 8.475 1.00 0.65 H new ATOM 955 N ALA A 267 10.521 9.063 6.096 1.00 0.48 N ATOM 956 CA ALA A 267 10.957 7.695 5.780 1.00 0.39 C ATOM 957 C ALA A 267 9.765 6.772 5.625 1.00 0.30 C ATOM 958 O ALA A 267 9.711 5.980 4.692 1.00 0.32 O ATOM 959 CB ALA A 267 11.910 7.125 6.819 1.00 0.44 C ATOM 0 H ALA A 267 10.542 9.693 5.294 1.00 0.48 H new ATOM 0 HA ALA A 267 11.498 7.758 4.836 1.00 0.39 H new ATOM 0 HB1 ALA A 267 12.198 6.113 6.533 1.00 0.44 H new ATOM 0 HB2 ALA A 267 12.800 7.752 6.879 1.00 0.44 H new ATOM 0 HB3 ALA A 267 11.417 7.101 7.791 1.00 0.44 H new ATOM 965 N LYS A 268 8.803 6.877 6.524 1.00 0.26 N ATOM 966 CA LYS A 268 7.618 6.051 6.435 1.00 0.25 C ATOM 967 C LYS A 268 6.806 6.456 5.218 1.00 0.29 C ATOM 968 O LYS A 268 6.638 7.639 4.926 1.00 0.47 O ATOM 969 CB LYS A 268 6.789 6.150 7.712 1.00 0.28 C ATOM 970 CG LYS A 268 7.527 5.643 8.941 1.00 0.30 C ATOM 971 CD LYS A 268 6.698 5.808 10.199 1.00 0.41 C ATOM 972 CE LYS A 268 6.358 7.265 10.456 1.00 1.20 C ATOM 973 NZ LYS A 268 5.523 7.432 11.671 1.00 2.00 N ATOM 0 H LYS A 268 8.820 7.520 7.316 1.00 0.26 H new ATOM 0 HA LYS A 268 7.918 5.009 6.323 1.00 0.25 H new ATOM 0 HB2 LYS A 268 6.500 7.189 7.871 1.00 0.28 H new ATOM 0 HB3 LYS A 268 5.869 5.579 7.586 1.00 0.28 H new ATOM 0 HG2 LYS A 268 7.779 4.591 8.806 1.00 0.30 H new ATOM 0 HG3 LYS A 268 8.467 6.184 9.051 1.00 0.30 H new ATOM 0 HD2 LYS A 268 5.779 5.230 10.108 1.00 0.41 H new ATOM 0 HD3 LYS A 268 7.245 5.405 11.052 1.00 0.41 H new ATOM 0 HE2 LYS A 268 7.278 7.839 10.566 1.00 1.20 H new ATOM 0 HE3 LYS A 268 5.830 7.672 9.594 1.00 1.20 H new ATOM 0 HZ1 LYS A 268 5.313 8.441 11.812 1.00 2.00 H new ATOM 0 HZ2 LYS A 268 4.633 6.906 11.556 1.00 2.00 H new ATOM 0 HZ3 LYS A 268 6.037 7.067 12.498 1.00 2.00 H new ATOM 987 N ARG A 269 6.415 5.481 4.436 1.00 0.16 N ATOM 988 CA ARG A 269 5.741 5.755 3.192 1.00 0.16 C ATOM 989 C ARG A 269 4.344 5.180 3.205 1.00 0.18 C ATOM 990 O ARG A 269 4.063 4.240 3.936 1.00 0.17 O ATOM 991 CB ARG A 269 6.539 5.214 2.014 1.00 0.20 C ATOM 992 CG ARG A 269 6.678 6.210 0.876 1.00 0.53 C ATOM 993 CD ARG A 269 7.637 7.333 1.233 1.00 0.79 C ATOM 994 NE ARG A 269 7.977 8.142 0.065 1.00 0.69 N ATOM 995 CZ ARG A 269 8.903 9.099 0.061 1.00 0.97 C ATOM 996 NH1 ARG A 269 9.611 9.356 1.150 1.00 1.85 N ATOM 997 NH2 ARG A 269 9.134 9.793 -1.043 1.00 1.17 N ATOM 0 H ARG A 269 6.552 4.491 4.639 1.00 0.16 H new ATOM 0 HA ARG A 269 5.663 6.836 3.078 1.00 0.16 H new ATOM 0 HB2 ARG A 269 7.532 4.925 2.358 1.00 0.20 H new ATOM 0 HB3 ARG A 269 6.056 4.311 1.641 1.00 0.20 H new ATOM 0 HG2 ARG A 269 7.034 5.696 -0.017 1.00 0.53 H new ATOM 0 HG3 ARG A 269 5.700 6.628 0.635 1.00 0.53 H new ATOM 0 HD2 ARG A 269 7.187 7.967 1.997 1.00 0.79 H new ATOM 0 HD3 ARG A 269 8.546 6.913 1.662 1.00 0.79 H new ATOM 0 HE ARG A 269 7.473 7.962 -0.803 1.00 0.69 H new ATOM 0 HH11 ARG A 269 9.449 8.819 2.002 1.00 1.85 H new ATOM 0 HH12 ARG A 269 10.318 10.091 1.137 1.00 1.85 H new ATOM 0 HH21 ARG A 269 8.603 9.595 -1.891 1.00 1.17 H new ATOM 0 HH22 ARG A 269 9.843 10.526 -1.046 1.00 1.17 H new ATOM 1011 N THR A 270 3.433 5.856 2.543 1.00 0.18 N ATOM 1012 CA THR A 270 2.043 5.454 2.579 1.00 0.18 C ATOM 1013 C THR A 270 1.418 5.489 1.192 1.00 0.19 C ATOM 1014 O THR A 270 1.591 6.451 0.449 1.00 0.22 O ATOM 1015 CB THR A 270 1.239 6.361 3.538 1.00 0.20 C ATOM 1016 OG1 THR A 270 1.724 6.200 4.879 1.00 0.25 O ATOM 1017 CG2 THR A 270 -0.249 6.048 3.492 1.00 0.24 C ATOM 0 H THR A 270 3.626 6.682 1.976 1.00 0.18 H new ATOM 0 HA THR A 270 2.009 4.428 2.944 1.00 0.18 H new ATOM 0 HB THR A 270 1.376 7.393 3.214 1.00 0.20 H new ATOM 0 HG1 THR A 270 1.095 5.650 5.391 1.00 0.25 H new ATOM 0 HG21 THR A 270 -0.781 6.706 4.179 1.00 0.24 H new ATOM 0 HG22 THR A 270 -0.622 6.203 2.480 1.00 0.24 H new ATOM 0 HG23 THR A 270 -0.412 5.011 3.784 1.00 0.24 H new ATOM 1025 N LEU A 271 0.647 4.462 0.877 1.00 0.17 N ATOM 1026 CA LEU A 271 -0.110 4.445 -0.357 1.00 0.17 C ATOM 1027 C LEU A 271 -1.568 4.756 -0.051 1.00 0.16 C ATOM 1028 O LEU A 271 -2.298 3.897 0.428 1.00 0.17 O ATOM 1029 CB LEU A 271 0.000 3.078 -1.038 1.00 0.20 C ATOM 1030 CG LEU A 271 -0.510 2.989 -2.484 1.00 0.26 C ATOM 1031 CD1 LEU A 271 -2.024 2.840 -2.540 1.00 0.56 C ATOM 1032 CD2 LEU A 271 -0.054 4.201 -3.281 1.00 0.49 C ATOM 0 H LEU A 271 0.531 3.632 1.459 1.00 0.17 H new ATOM 0 HA LEU A 271 0.294 5.198 -1.034 1.00 0.17 H new ATOM 0 HB2 LEU A 271 1.047 2.774 -1.026 1.00 0.20 H new ATOM 0 HB3 LEU A 271 -0.549 2.353 -0.437 1.00 0.20 H new ATOM 0 HG LEU A 271 -0.081 2.094 -2.934 1.00 0.26 H new ATOM 0 HD11 LEU A 271 -2.346 2.780 -3.580 1.00 0.56 H new ATOM 0 HD12 LEU A 271 -2.320 1.931 -2.016 1.00 0.56 H new ATOM 0 HD13 LEU A 271 -2.492 3.702 -2.064 1.00 0.56 H new ATOM 0 HD21 LEU A 271 -0.423 4.124 -4.304 1.00 0.49 H new ATOM 0 HD22 LEU A 271 -0.447 5.108 -2.821 1.00 0.49 H new ATOM 0 HD23 LEU A 271 1.035 4.241 -3.290 1.00 0.49 H new ATOM 1044 N THR A 272 -1.995 5.970 -0.307 1.00 0.18 N ATOM 1045 CA THR A 272 -3.371 6.335 -0.051 1.00 0.21 C ATOM 1046 C THR A 272 -4.257 5.898 -1.214 1.00 0.22 C ATOM 1047 O THR A 272 -4.157 6.413 -2.326 1.00 0.29 O ATOM 1048 CB THR A 272 -3.508 7.849 0.188 1.00 0.27 C ATOM 1049 OG1 THR A 272 -2.499 8.281 1.108 1.00 0.33 O ATOM 1050 CG2 THR A 272 -4.879 8.188 0.752 1.00 0.30 C ATOM 0 H THR A 272 -1.416 6.718 -0.689 1.00 0.18 H new ATOM 0 HA THR A 272 -3.696 5.821 0.854 1.00 0.21 H new ATOM 0 HB THR A 272 -3.388 8.360 -0.767 1.00 0.27 H new ATOM 0 HG1 THR A 272 -2.585 9.245 1.259 1.00 0.33 H new ATOM 0 HG21 THR A 272 -4.951 9.264 0.912 1.00 0.30 H new ATOM 0 HG22 THR A 272 -5.650 7.874 0.048 1.00 0.30 H new ATOM 0 HG23 THR A 272 -5.021 7.670 1.700 1.00 0.30 H new ATOM 1058 N ILE A 273 -5.084 4.903 -0.975 1.00 0.23 N ATOM 1059 CA ILE A 273 -5.953 4.389 -2.012 1.00 0.26 C ATOM 1060 C ILE A 273 -7.365 4.938 -1.829 1.00 0.28 C ATOM 1061 O ILE A 273 -7.939 4.896 -0.730 1.00 0.27 O ATOM 1062 CB ILE A 273 -5.929 2.830 -2.065 1.00 0.31 C ATOM 1063 CG1 ILE A 273 -5.695 2.350 -3.500 1.00 0.41 C ATOM 1064 CG2 ILE A 273 -7.205 2.206 -1.516 1.00 0.32 C ATOM 1065 CD1 ILE A 273 -6.834 2.656 -4.447 1.00 0.86 C ATOM 0 H ILE A 273 -5.173 4.434 -0.073 1.00 0.23 H new ATOM 0 HA ILE A 273 -5.581 4.731 -2.978 1.00 0.26 H new ATOM 0 HB ILE A 273 -5.106 2.506 -1.428 1.00 0.31 H new ATOM 0 HG12 ILE A 273 -4.785 2.812 -3.882 1.00 0.41 H new ATOM 0 HG13 ILE A 273 -5.526 1.273 -3.488 1.00 0.41 H new ATOM 0 HG21 ILE A 273 -7.134 1.120 -1.577 1.00 0.32 H new ATOM 0 HG22 ILE A 273 -7.337 2.503 -0.476 1.00 0.32 H new ATOM 0 HG23 ILE A 273 -8.058 2.547 -2.102 1.00 0.32 H new ATOM 0 HD11 ILE A 273 -6.590 2.284 -5.442 1.00 0.86 H new ATOM 0 HD12 ILE A 273 -7.743 2.171 -4.091 1.00 0.86 H new ATOM 0 HD13 ILE A 273 -6.991 3.734 -4.491 1.00 0.86 H new ATOM 1077 N SER A 274 -7.869 5.536 -2.898 1.00 0.33 N ATOM 1078 CA SER A 274 -9.190 6.132 -2.915 1.00 0.39 C ATOM 1079 C SER A 274 -10.087 5.331 -3.845 1.00 0.45 C ATOM 1080 O SER A 274 -9.582 4.645 -4.735 1.00 0.50 O ATOM 1081 CB SER A 274 -9.105 7.581 -3.388 1.00 0.52 C ATOM 1082 OG SER A 274 -8.185 8.319 -2.602 1.00 1.13 O ATOM 0 H SER A 274 -7.367 5.620 -3.782 1.00 0.33 H new ATOM 0 HA SER A 274 -9.607 6.120 -1.908 1.00 0.39 H new ATOM 0 HB2 SER A 274 -8.799 7.608 -4.434 1.00 0.52 H new ATOM 0 HB3 SER A 274 -10.090 8.044 -3.332 1.00 0.52 H new ATOM 0 HG SER A 274 -7.292 8.258 -3.001 1.00 1.13 H new ATOM 1088 N GLN A 275 -11.397 5.364 -3.595 1.00 0.51 N ATOM 1089 CA GLN A 275 -12.354 4.575 -4.372 1.00 0.62 C ATOM 1090 C GLN A 275 -12.045 3.102 -4.187 1.00 0.62 C ATOM 1091 O GLN A 275 -11.632 2.408 -5.117 1.00 0.74 O ATOM 1092 CB GLN A 275 -12.309 4.944 -5.854 1.00 0.75 C ATOM 1093 CG GLN A 275 -12.361 6.435 -6.111 1.00 0.90 C ATOM 1094 CD GLN A 275 -12.253 6.754 -7.583 1.00 1.53 C ATOM 1095 OE1 GLN A 275 -13.173 6.496 -8.357 1.00 2.14 O ATOM 1096 NE2 GLN A 275 -11.113 7.278 -7.990 1.00 2.27 N ATOM 0 H GLN A 275 -11.820 5.930 -2.859 1.00 0.51 H new ATOM 0 HA GLN A 275 -13.360 4.791 -4.012 1.00 0.62 H new ATOM 0 HB2 GLN A 275 -11.396 4.540 -6.292 1.00 0.75 H new ATOM 0 HB3 GLN A 275 -13.146 4.467 -6.364 1.00 0.75 H new ATOM 0 HG2 GLN A 275 -13.294 6.839 -5.719 1.00 0.90 H new ATOM 0 HG3 GLN A 275 -11.550 6.925 -5.572 1.00 0.90 H new ATOM 0 HE21 GLN A 275 -10.374 7.477 -7.316 1.00 2.27 H new ATOM 0 HE22 GLN A 275 -10.971 7.484 -8.979 1.00 2.27 H new ATOM 1105 N CYS A 276 -12.156 2.663 -2.952 1.00 0.60 N ATOM 1106 CA CYS A 276 -11.806 1.325 -2.569 1.00 0.69 C ATOM 1107 C CYS A 276 -12.470 1.065 -1.250 1.00 0.75 C ATOM 1108 O CYS A 276 -12.322 1.848 -0.308 1.00 1.27 O ATOM 1109 CB CYS A 276 -10.286 1.184 -2.448 1.00 0.80 C ATOM 1110 SG CYS A 276 -9.719 -0.459 -1.963 1.00 2.00 S ATOM 0 H CYS A 276 -12.497 3.237 -2.181 1.00 0.60 H new ATOM 0 HA CYS A 276 -12.137 0.604 -3.317 1.00 0.69 H new ATOM 0 HB2 CYS A 276 -9.833 1.442 -3.405 1.00 0.80 H new ATOM 0 HB3 CYS A 276 -9.924 1.909 -1.719 1.00 0.80 H new ATOM 0 HG CYS A 276 -8.470 -0.602 -2.294 1.00 2.00 H new ATOM 1116 N SER A 277 -13.394 0.147 -1.263 1.00 0.54 N ATOM 1117 CA SER A 277 -14.240 -0.043 -0.129 1.00 0.52 C ATOM 1118 C SER A 277 -14.753 -1.478 -0.101 1.00 0.48 C ATOM 1119 O SER A 277 -13.988 -2.408 -0.348 1.00 0.47 O ATOM 1120 CB SER A 277 -15.395 0.954 -0.188 1.00 0.56 C ATOM 1121 OG SER A 277 -16.079 0.870 -1.425 1.00 0.63 O ATOM 0 H SER A 277 -13.577 -0.479 -2.047 1.00 0.54 H new ATOM 0 HA SER A 277 -13.677 0.132 0.788 1.00 0.52 H new ATOM 0 HB2 SER A 277 -16.090 0.759 0.629 1.00 0.56 H new ATOM 0 HB3 SER A 277 -15.014 1.965 -0.048 1.00 0.56 H new ATOM 0 HG SER A 277 -16.815 1.517 -1.437 1.00 0.63 H new ATOM 1127 N LEU A 278 -16.052 -1.656 0.152 1.00 0.51 N ATOM 1128 CA LEU A 278 -16.655 -2.985 0.236 1.00 0.54 C ATOM 1129 C LEU A 278 -16.794 -3.649 -1.137 1.00 0.58 C ATOM 1130 O LEU A 278 -17.784 -4.332 -1.408 1.00 0.71 O ATOM 1131 CB LEU A 278 -18.030 -2.907 0.907 1.00 0.63 C ATOM 1132 CG LEU A 278 -18.093 -3.451 2.336 1.00 0.78 C ATOM 1133 CD1 LEU A 278 -17.626 -4.898 2.374 1.00 1.22 C ATOM 1134 CD2 LEU A 278 -17.260 -2.594 3.273 1.00 0.79 C ATOM 0 H LEU A 278 -16.708 -0.890 0.303 1.00 0.51 H new ATOM 0 HA LEU A 278 -15.984 -3.598 0.837 1.00 0.54 H new ATOM 0 HB2 LEU A 278 -18.352 -1.866 0.918 1.00 0.63 H new ATOM 0 HB3 LEU A 278 -18.746 -3.456 0.295 1.00 0.63 H new ATOM 0 HG LEU A 278 -19.129 -3.415 2.673 1.00 0.78 H new ATOM 0 HD11 LEU A 278 -17.677 -5.270 3.397 1.00 1.22 H new ATOM 0 HD12 LEU A 278 -18.268 -5.504 1.735 1.00 1.22 H new ATOM 0 HD13 LEU A 278 -16.598 -4.958 2.017 1.00 1.22 H new ATOM 0 HD21 LEU A 278 -17.318 -2.998 4.284 1.00 0.79 H new ATOM 0 HD22 LEU A 278 -16.222 -2.595 2.941 1.00 0.79 H new ATOM 0 HD23 LEU A 278 -17.641 -1.573 3.268 1.00 0.79 H new ATOM 1146 N ALA A 279 -15.774 -3.511 -1.966 1.00 0.53 N ATOM 1147 CA ALA A 279 -15.760 -4.133 -3.278 1.00 0.61 C ATOM 1148 C ALA A 279 -14.331 -4.450 -3.694 1.00 0.58 C ATOM 1149 O ALA A 279 -14.043 -5.551 -4.158 1.00 0.62 O ATOM 1150 CB ALA A 279 -16.436 -3.241 -4.309 1.00 0.71 C ATOM 0 H ALA A 279 -14.938 -2.968 -1.751 1.00 0.53 H new ATOM 0 HA ALA A 279 -16.321 -5.066 -3.223 1.00 0.61 H new ATOM 0 HB1 ALA A 279 -16.413 -3.729 -5.283 1.00 0.71 H new ATOM 0 HB2 ALA A 279 -17.471 -3.066 -4.016 1.00 0.71 H new ATOM 0 HB3 ALA A 279 -15.909 -2.289 -4.367 1.00 0.71 H new ATOM 1156 N ASP A 280 -13.427 -3.493 -3.491 1.00 0.56 N ATOM 1157 CA ASP A 280 -12.021 -3.693 -3.840 1.00 0.59 C ATOM 1158 C ASP A 280 -11.299 -4.497 -2.755 1.00 0.50 C ATOM 1159 O ASP A 280 -10.112 -4.797 -2.873 1.00 0.70 O ATOM 1160 CB ASP A 280 -11.333 -2.348 -4.051 1.00 0.70 C ATOM 1161 CG ASP A 280 -10.109 -2.442 -4.943 1.00 1.21 C ATOM 1162 OD1 ASP A 280 -9.874 -3.528 -5.508 1.00 1.77 O ATOM 1163 OD2 ASP A 280 -9.353 -1.451 -5.049 1.00 1.84 O ATOM 0 H ASP A 280 -13.640 -2.579 -3.090 1.00 0.56 H new ATOM 0 HA ASP A 280 -11.976 -4.260 -4.770 1.00 0.59 H new ATOM 0 HB2 ASP A 280 -12.043 -1.648 -4.491 1.00 0.70 H new ATOM 0 HB3 ASP A 280 -11.040 -1.940 -3.084 1.00 0.70 H new ATOM 1168 N ASP A 281 -12.056 -4.889 -1.734 1.00 0.37 N ATOM 1169 CA ASP A 281 -11.565 -5.751 -0.661 1.00 0.33 C ATOM 1170 C ASP A 281 -10.925 -7.006 -1.256 1.00 0.34 C ATOM 1171 O ASP A 281 -11.577 -7.757 -1.989 1.00 0.43 O ATOM 1172 CB ASP A 281 -12.747 -6.116 0.256 1.00 0.40 C ATOM 1173 CG ASP A 281 -12.392 -7.056 1.395 1.00 0.52 C ATOM 1174 OD1 ASP A 281 -11.952 -8.195 1.121 1.00 0.81 O ATOM 1175 OD2 ASP A 281 -12.488 -6.642 2.571 1.00 1.12 O ATOM 0 H ASP A 281 -13.033 -4.616 -1.626 1.00 0.37 H new ATOM 0 HA ASP A 281 -10.806 -5.232 -0.076 1.00 0.33 H new ATOM 0 HB2 ASP A 281 -13.163 -5.199 0.674 1.00 0.40 H new ATOM 0 HB3 ASP A 281 -13.530 -6.575 -0.347 1.00 0.40 H new ATOM 1180 N ALA A 282 -9.627 -7.170 -1.015 1.00 0.31 N ATOM 1181 CA ALA A 282 -8.853 -8.255 -1.613 1.00 0.37 C ATOM 1182 C ALA A 282 -7.450 -8.306 -1.008 1.00 0.35 C ATOM 1183 O ALA A 282 -7.299 -8.633 0.166 1.00 0.58 O ATOM 1184 CB ALA A 282 -8.791 -8.095 -3.130 1.00 0.48 C ATOM 0 H ALA A 282 -9.085 -6.559 -0.404 1.00 0.31 H new ATOM 0 HA ALA A 282 -9.350 -9.200 -1.394 1.00 0.37 H new ATOM 0 HB1 ALA A 282 -8.211 -8.912 -3.559 1.00 0.48 H new ATOM 0 HB2 ALA A 282 -9.801 -8.114 -3.539 1.00 0.48 H new ATOM 0 HB3 ALA A 282 -8.317 -7.145 -3.377 1.00 0.48 H new ATOM 1190 N ALA A 283 -6.433 -7.921 -1.781 1.00 0.22 N ATOM 1191 CA ALA A 283 -5.072 -7.826 -1.261 1.00 0.17 C ATOM 1192 C ALA A 283 -4.282 -6.764 -2.018 1.00 0.15 C ATOM 1193 O ALA A 283 -4.296 -6.748 -3.250 1.00 0.19 O ATOM 1194 CB ALA A 283 -4.362 -9.169 -1.337 1.00 0.22 C ATOM 0 H ALA A 283 -6.527 -7.671 -2.765 1.00 0.22 H new ATOM 0 HA ALA A 283 -5.133 -7.534 -0.213 1.00 0.17 H new ATOM 0 HB1 ALA A 283 -3.351 -9.069 -0.943 1.00 0.22 H new ATOM 0 HB2 ALA A 283 -4.910 -9.904 -0.747 1.00 0.22 H new ATOM 0 HB3 ALA A 283 -4.316 -9.498 -2.375 1.00 0.22 H new ATOM 1200 N TYR A 284 -3.494 -5.975 -1.291 1.00 0.12 N ATOM 1201 CA TYR A 284 -2.580 -5.023 -1.922 1.00 0.13 C ATOM 1202 C TYR A 284 -1.146 -5.284 -1.464 1.00 0.14 C ATOM 1203 O TYR A 284 -0.815 -5.100 -0.298 1.00 0.16 O ATOM 1204 CB TYR A 284 -2.944 -3.549 -1.621 1.00 0.15 C ATOM 1205 CG TYR A 284 -3.992 -2.921 -2.529 1.00 0.19 C ATOM 1206 CD1 TYR A 284 -5.055 -3.662 -3.026 1.00 0.22 C ATOM 1207 CD2 TYR A 284 -3.906 -1.571 -2.903 1.00 0.26 C ATOM 1208 CE1 TYR A 284 -5.999 -3.085 -3.856 1.00 0.29 C ATOM 1209 CE2 TYR A 284 -4.844 -1.003 -3.733 1.00 0.32 C ATOM 1210 CZ TYR A 284 -5.886 -1.758 -4.207 1.00 0.35 C ATOM 1211 OH TYR A 284 -6.806 -1.185 -5.046 1.00 0.41 O ATOM 0 H TYR A 284 -3.469 -5.975 -0.271 1.00 0.12 H new ATOM 0 HA TYR A 284 -2.671 -5.175 -2.998 1.00 0.13 H new ATOM 0 HB2 TYR A 284 -3.299 -3.486 -0.592 1.00 0.15 H new ATOM 0 HB3 TYR A 284 -2.034 -2.951 -1.682 1.00 0.15 H new ATOM 0 HD1 TYR A 284 -5.146 -4.705 -2.761 1.00 0.22 H new ATOM 0 HD2 TYR A 284 -3.090 -0.968 -2.533 1.00 0.26 H new ATOM 0 HE1 TYR A 284 -6.824 -3.674 -4.228 1.00 0.29 H new ATOM 0 HE2 TYR A 284 -4.760 0.037 -4.011 1.00 0.32 H new ATOM 0 HH TYR A 284 -7.704 -1.294 -4.670 1.00 0.41 H new ATOM 1221 N GLN A 285 -0.280 -5.614 -2.409 1.00 0.13 N ATOM 1222 CA GLN A 285 1.133 -5.759 -2.132 1.00 0.13 C ATOM 1223 C GLN A 285 1.834 -4.403 -2.117 1.00 0.12 C ATOM 1224 O GLN A 285 1.334 -3.417 -2.660 1.00 0.13 O ATOM 1225 CB GLN A 285 1.830 -6.686 -3.135 1.00 0.12 C ATOM 1226 CG GLN A 285 1.310 -8.111 -3.136 1.00 0.15 C ATOM 1227 CD GLN A 285 0.111 -8.294 -4.035 1.00 0.21 C ATOM 1228 OE1 GLN A 285 -0.129 -7.327 -4.904 1.00 0.29 O flip ATOM 1229 NE2 GLN A 285 -0.575 -9.306 -3.966 1.00 0.18 N flip ATOM 0 H GLN A 285 -0.538 -5.787 -3.381 1.00 0.13 H new ATOM 0 HA GLN A 285 1.207 -6.213 -1.144 1.00 0.13 H new ATOM 0 HB2 GLN A 285 1.716 -6.270 -4.136 1.00 0.12 H new ATOM 0 HB3 GLN A 285 2.898 -6.702 -2.916 1.00 0.12 H new ATOM 0 HG2 GLN A 285 2.106 -8.783 -3.457 1.00 0.15 H new ATOM 0 HG3 GLN A 285 1.043 -8.396 -2.119 1.00 0.15 H new ATOM 0 HE21 GLN A 285 -0.353 -10.027 -3.279 1.00 0.18 H new ATOM 0 HE22 GLN A 285 -1.369 -9.428 -4.595 1.00 0.18 H new ATOM 1238 N CYS A 286 2.957 -4.373 -1.431 1.00 0.14 N ATOM 1239 CA CYS A 286 3.737 -3.159 -1.212 1.00 0.19 C ATOM 1240 C CYS A 286 5.058 -3.242 -1.962 1.00 0.19 C ATOM 1241 O CYS A 286 5.677 -4.297 -1.940 1.00 0.20 O ATOM 1242 CB CYS A 286 4.038 -3.079 0.257 1.00 0.28 C ATOM 1243 SG CYS A 286 2.709 -3.673 1.331 1.00 1.00 S ATOM 0 H CYS A 286 3.366 -5.202 -1.000 1.00 0.14 H new ATOM 0 HA CYS A 286 3.180 -2.290 -1.562 1.00 0.19 H new ATOM 0 HB2 CYS A 286 4.939 -3.657 0.462 1.00 0.28 H new ATOM 0 HB3 CYS A 286 4.259 -2.043 0.513 1.00 0.28 H new ATOM 0 HG CYS A 286 2.424 -4.905 1.028 1.00 1.00 H new ATOM 1249 N VAL A 287 5.405 -2.253 -2.792 1.00 0.20 N ATOM 1250 CA VAL A 287 6.496 -2.503 -3.728 1.00 0.21 C ATOM 1251 C VAL A 287 7.424 -1.302 -4.010 1.00 0.22 C ATOM 1252 O VAL A 287 7.002 -0.161 -4.184 1.00 0.24 O ATOM 1253 CB VAL A 287 5.923 -3.102 -5.053 1.00 0.21 C ATOM 1254 CG1 VAL A 287 4.437 -3.429 -4.885 1.00 0.18 C ATOM 1255 CG2 VAL A 287 6.146 -2.195 -6.259 1.00 0.27 C ATOM 0 H VAL A 287 4.976 -1.329 -2.835 1.00 0.20 H new ATOM 0 HA VAL A 287 7.148 -3.223 -3.234 1.00 0.21 H new ATOM 0 HB VAL A 287 6.474 -4.021 -5.254 1.00 0.21 H new ATOM 0 HG11 VAL A 287 4.049 -3.846 -5.814 1.00 0.18 H new ATOM 0 HG12 VAL A 287 4.313 -4.155 -4.082 1.00 0.18 H new ATOM 0 HG13 VAL A 287 3.890 -2.519 -4.639 1.00 0.18 H new ATOM 0 HG21 VAL A 287 5.727 -2.664 -7.149 1.00 0.27 H new ATOM 0 HG22 VAL A 287 5.656 -1.236 -6.089 1.00 0.27 H new ATOM 0 HG23 VAL A 287 7.215 -2.036 -6.402 1.00 0.27 H new ATOM 1265 N VAL A 288 8.709 -1.605 -4.122 1.00 0.24 N ATOM 1266 CA VAL A 288 9.709 -0.635 -4.541 1.00 0.26 C ATOM 1267 C VAL A 288 10.756 -1.326 -5.404 1.00 0.33 C ATOM 1268 O VAL A 288 11.273 -2.385 -5.038 1.00 0.37 O ATOM 1269 CB VAL A 288 10.392 0.063 -3.342 1.00 0.27 C ATOM 1270 CG1 VAL A 288 11.729 0.657 -3.735 1.00 0.31 C ATOM 1271 CG2 VAL A 288 9.505 1.160 -2.798 1.00 0.36 C ATOM 0 H VAL A 288 9.088 -2.531 -3.925 1.00 0.24 H new ATOM 0 HA VAL A 288 9.198 0.138 -5.115 1.00 0.26 H new ATOM 0 HB VAL A 288 10.558 -0.694 -2.575 1.00 0.27 H new ATOM 0 HG11 VAL A 288 12.181 1.140 -2.869 1.00 0.31 H new ATOM 0 HG12 VAL A 288 12.387 -0.134 -4.094 1.00 0.31 H new ATOM 0 HG13 VAL A 288 11.582 1.393 -4.525 1.00 0.31 H new ATOM 0 HG21 VAL A 288 9.999 1.642 -1.954 1.00 0.36 H new ATOM 0 HG22 VAL A 288 9.318 1.897 -3.579 1.00 0.36 H new ATOM 0 HG23 VAL A 288 8.558 0.732 -2.468 1.00 0.36 H new ATOM 1281 N GLY A 289 10.995 -0.768 -6.582 1.00 0.43 N ATOM 1282 CA GLY A 289 11.924 -1.365 -7.518 1.00 0.57 C ATOM 1283 C GLY A 289 11.460 -2.727 -7.994 1.00 0.73 C ATOM 1284 O GLY A 289 12.254 -3.664 -8.089 1.00 1.51 O ATOM 0 H GLY A 289 10.558 0.094 -6.908 1.00 0.43 H new ATOM 0 HA2 GLY A 289 12.047 -0.705 -8.376 1.00 0.57 H new ATOM 0 HA3 GLY A 289 12.902 -1.460 -7.046 1.00 0.57 H new ATOM 1288 N GLY A 290 10.164 -2.851 -8.255 1.00 0.41 N ATOM 1289 CA GLY A 290 9.609 -4.119 -8.697 1.00 0.41 C ATOM 1290 C GLY A 290 9.296 -5.060 -7.547 1.00 0.37 C ATOM 1291 O GLY A 290 8.321 -5.808 -7.599 1.00 0.64 O ATOM 0 H GLY A 290 9.485 -2.095 -8.168 1.00 0.41 H new ATOM 0 HA2 GLY A 290 8.698 -3.933 -9.266 1.00 0.41 H new ATOM 0 HA3 GLY A 290 10.314 -4.602 -9.374 1.00 0.41 H new ATOM 1295 N GLU A 291 10.136 -5.039 -6.522 1.00 0.27 N ATOM 1296 CA GLU A 291 9.961 -5.911 -5.368 1.00 0.22 C ATOM 1297 C GLU A 291 8.673 -5.584 -4.625 1.00 0.16 C ATOM 1298 O GLU A 291 8.458 -4.440 -4.251 1.00 0.19 O ATOM 1299 CB GLU A 291 11.161 -5.783 -4.437 1.00 0.26 C ATOM 1300 CG GLU A 291 12.423 -6.381 -5.025 1.00 0.53 C ATOM 1301 CD GLU A 291 12.323 -7.879 -5.244 1.00 1.48 C ATOM 1302 OE1 GLU A 291 11.451 -8.325 -6.022 1.00 2.11 O ATOM 1303 OE2 GLU A 291 13.118 -8.619 -4.633 1.00 2.19 O ATOM 0 H GLU A 291 10.949 -4.425 -6.466 1.00 0.27 H new ATOM 0 HA GLU A 291 9.891 -6.940 -5.720 1.00 0.22 H new ATOM 0 HB2 GLU A 291 11.332 -4.730 -4.214 1.00 0.26 H new ATOM 0 HB3 GLU A 291 10.936 -6.276 -3.491 1.00 0.26 H new ATOM 0 HG2 GLU A 291 12.640 -5.894 -5.976 1.00 0.53 H new ATOM 0 HG3 GLU A 291 13.261 -6.172 -4.361 1.00 0.53 H new ATOM 1310 N LYS A 292 7.826 -6.589 -4.434 1.00 0.18 N ATOM 1311 CA LYS A 292 6.532 -6.412 -3.771 1.00 0.16 C ATOM 1312 C LYS A 292 6.476 -7.152 -2.431 1.00 0.17 C ATOM 1313 O LYS A 292 7.416 -7.851 -2.045 1.00 0.29 O ATOM 1314 CB LYS A 292 5.402 -6.877 -4.691 1.00 0.18 C ATOM 1315 CG LYS A 292 5.643 -8.224 -5.334 1.00 0.23 C ATOM 1316 CD LYS A 292 4.553 -8.542 -6.332 1.00 0.29 C ATOM 1317 CE LYS A 292 4.976 -9.665 -7.265 1.00 0.49 C ATOM 1318 NZ LYS A 292 3.873 -10.093 -8.163 1.00 1.33 N ATOM 0 H LYS A 292 8.012 -7.547 -4.732 1.00 0.18 H new ATOM 0 HA LYS A 292 6.406 -5.350 -3.561 1.00 0.16 H new ATOM 0 HB2 LYS A 292 4.476 -6.921 -4.118 1.00 0.18 H new ATOM 0 HB3 LYS A 292 5.257 -6.133 -5.475 1.00 0.18 H new ATOM 0 HG2 LYS A 292 6.612 -8.226 -5.833 1.00 0.23 H new ATOM 0 HG3 LYS A 292 5.678 -8.998 -4.567 1.00 0.23 H new ATOM 0 HD2 LYS A 292 3.644 -8.827 -5.803 1.00 0.29 H new ATOM 0 HD3 LYS A 292 4.317 -7.651 -6.914 1.00 0.29 H new ATOM 0 HE2 LYS A 292 5.824 -9.336 -7.865 1.00 0.49 H new ATOM 0 HE3 LYS A 292 5.314 -10.517 -6.675 1.00 0.49 H new ATOM 0 HZ1 LYS A 292 4.206 -10.860 -8.781 1.00 1.33 H new ATOM 0 HZ2 LYS A 292 3.072 -10.432 -7.592 1.00 1.33 H new ATOM 0 HZ3 LYS A 292 3.567 -9.287 -8.745 1.00 1.33 H new ATOM 1332 N CYS A 293 5.378 -6.938 -1.720 1.00 0.16 N ATOM 1333 CA CYS A 293 5.126 -7.540 -0.417 1.00 0.18 C ATOM 1334 C CYS A 293 3.644 -7.758 -0.281 1.00 0.15 C ATOM 1335 O CYS A 293 2.893 -6.799 -0.360 1.00 0.14 O ATOM 1336 CB CYS A 293 5.539 -6.614 0.715 1.00 0.28 C ATOM 1337 SG CYS A 293 5.201 -7.297 2.347 1.00 1.55 S ATOM 0 H CYS A 293 4.623 -6.330 -2.038 1.00 0.16 H new ATOM 0 HA CYS A 293 5.697 -8.467 -0.355 1.00 0.18 H new ATOM 0 HB2 CYS A 293 6.605 -6.400 0.631 1.00 0.28 H new ATOM 0 HB3 CYS A 293 5.014 -5.665 0.609 1.00 0.28 H new ATOM 0 HG CYS A 293 5.569 -8.543 2.380 1.00 1.55 H new ATOM 1343 N SER A 294 3.203 -8.984 -0.106 1.00 0.17 N ATOM 1344 CA SER A 294 1.778 -9.234 -0.126 1.00 0.18 C ATOM 1345 C SER A 294 1.124 -8.865 1.196 1.00 0.17 C ATOM 1346 O SER A 294 1.625 -9.179 2.278 1.00 0.20 O ATOM 1347 CB SER A 294 1.480 -10.690 -0.498 1.00 0.27 C ATOM 1348 OG SER A 294 1.932 -11.587 0.504 1.00 0.61 O ATOM 0 H SER A 294 3.791 -9.803 0.048 1.00 0.17 H new ATOM 0 HA SER A 294 1.346 -8.593 -0.894 1.00 0.18 H new ATOM 0 HB2 SER A 294 0.407 -10.817 -0.644 1.00 0.27 H new ATOM 0 HB3 SER A 294 1.961 -10.930 -1.446 1.00 0.27 H new ATOM 0 HG SER A 294 2.897 -11.728 0.406 1.00 0.61 H new ATOM 1354 N THR A 295 0.023 -8.146 1.083 1.00 0.17 N ATOM 1355 CA THR A 295 -0.735 -7.695 2.224 1.00 0.15 C ATOM 1356 C THR A 295 -2.215 -7.742 1.871 1.00 0.15 C ATOM 1357 O THR A 295 -2.608 -7.351 0.769 1.00 0.15 O ATOM 1358 CB THR A 295 -0.300 -6.266 2.651 1.00 0.18 C ATOM 1359 OG1 THR A 295 0.270 -6.299 3.961 1.00 0.29 O ATOM 1360 CG2 THR A 295 -1.450 -5.276 2.635 1.00 0.20 C ATOM 0 H THR A 295 -0.370 -7.859 0.187 1.00 0.17 H new ATOM 0 HA THR A 295 -0.546 -8.350 3.074 1.00 0.15 H new ATOM 0 HB THR A 295 0.438 -5.931 1.922 1.00 0.18 H new ATOM 0 HG1 THR A 295 0.053 -5.468 4.433 1.00 0.29 H new ATOM 0 HG21 THR A 295 -1.089 -4.294 2.942 1.00 0.20 H new ATOM 0 HG22 THR A 295 -1.862 -5.213 1.628 1.00 0.20 H new ATOM 0 HG23 THR A 295 -2.226 -5.609 3.324 1.00 0.20 H new ATOM 1368 N GLU A 296 -3.008 -8.354 2.729 1.00 0.15 N ATOM 1369 CA GLU A 296 -4.415 -8.531 2.442 1.00 0.15 C ATOM 1370 C GLU A 296 -5.155 -7.229 2.668 1.00 0.14 C ATOM 1371 O GLU A 296 -4.726 -6.385 3.457 1.00 0.19 O ATOM 1372 CB GLU A 296 -4.996 -9.647 3.298 1.00 0.18 C ATOM 1373 CG GLU A 296 -4.147 -10.898 3.275 1.00 0.22 C ATOM 1374 CD GLU A 296 -4.791 -12.058 4.003 1.00 0.34 C ATOM 1375 OE1 GLU A 296 -4.863 -12.017 5.248 1.00 0.76 O ATOM 1376 OE2 GLU A 296 -5.244 -13.010 3.331 1.00 0.96 O ATOM 0 H GLU A 296 -2.703 -8.734 3.625 1.00 0.15 H new ATOM 0 HA GLU A 296 -4.532 -8.817 1.397 1.00 0.15 H new ATOM 0 HB2 GLU A 296 -5.095 -9.298 4.326 1.00 0.18 H new ATOM 0 HB3 GLU A 296 -5.999 -9.886 2.945 1.00 0.18 H new ATOM 0 HG2 GLU A 296 -3.958 -11.184 2.240 1.00 0.22 H new ATOM 0 HG3 GLU A 296 -3.179 -10.683 3.728 1.00 0.22 H new ATOM 1383 N LEU A 297 -6.206 -7.024 1.907 1.00 0.15 N ATOM 1384 CA LEU A 297 -6.965 -5.803 1.984 1.00 0.15 C ATOM 1385 C LEU A 297 -8.399 -6.099 2.379 1.00 0.15 C ATOM 1386 O LEU A 297 -9.174 -6.646 1.590 1.00 0.23 O ATOM 1387 CB LEU A 297 -6.921 -5.073 0.644 1.00 0.22 C ATOM 1388 CG LEU A 297 -7.618 -3.719 0.637 1.00 0.21 C ATOM 1389 CD1 LEU A 297 -7.066 -2.859 1.761 1.00 0.26 C ATOM 1390 CD2 LEU A 297 -7.429 -3.035 -0.704 1.00 0.29 C ATOM 0 H LEU A 297 -6.555 -7.695 1.223 1.00 0.15 H new ATOM 0 HA LEU A 297 -6.523 -5.161 2.746 1.00 0.15 H new ATOM 0 HB2 LEU A 297 -5.879 -4.932 0.356 1.00 0.22 H new ATOM 0 HB3 LEU A 297 -7.379 -5.707 -0.115 1.00 0.22 H new ATOM 0 HG LEU A 297 -8.687 -3.864 0.795 1.00 0.21 H new ATOM 0 HD11 LEU A 297 -7.565 -1.890 1.756 1.00 0.26 H new ATOM 0 HD12 LEU A 297 -7.242 -3.353 2.717 1.00 0.26 H new ATOM 0 HD13 LEU A 297 -5.995 -2.717 1.618 1.00 0.26 H new ATOM 0 HD21 LEU A 297 -7.933 -2.068 -0.694 1.00 0.29 H new ATOM 0 HD22 LEU A 297 -6.365 -2.888 -0.891 1.00 0.29 H new ATOM 0 HD23 LEU A 297 -7.853 -3.657 -1.493 1.00 0.29 H new ATOM 1402 N PHE A 298 -8.742 -5.695 3.586 1.00 0.14 N ATOM 1403 CA PHE A 298 -10.085 -5.850 4.109 1.00 0.19 C ATOM 1404 C PHE A 298 -10.686 -4.476 4.336 1.00 0.19 C ATOM 1405 O PHE A 298 -9.956 -3.506 4.493 1.00 0.24 O ATOM 1406 CB PHE A 298 -10.076 -6.642 5.421 1.00 0.26 C ATOM 1407 CG PHE A 298 -9.641 -8.076 5.274 1.00 0.28 C ATOM 1408 CD1 PHE A 298 -8.315 -8.400 5.039 1.00 0.25 C ATOM 1409 CD2 PHE A 298 -10.566 -9.101 5.373 1.00 0.50 C ATOM 1410 CE1 PHE A 298 -7.922 -9.717 4.906 1.00 0.32 C ATOM 1411 CE2 PHE A 298 -10.178 -10.421 5.240 1.00 0.58 C ATOM 1412 CZ PHE A 298 -8.855 -10.729 5.007 1.00 0.45 C ATOM 0 H PHE A 298 -8.094 -5.248 4.235 1.00 0.14 H new ATOM 0 HA PHE A 298 -10.685 -6.405 3.388 1.00 0.19 H new ATOM 0 HB2 PHE A 298 -9.413 -6.144 6.128 1.00 0.26 H new ATOM 0 HB3 PHE A 298 -11.077 -6.620 5.852 1.00 0.26 H new ATOM 0 HD1 PHE A 298 -7.580 -7.613 4.959 1.00 0.25 H new ATOM 0 HD2 PHE A 298 -11.604 -8.866 5.557 1.00 0.50 H new ATOM 0 HE1 PHE A 298 -6.885 -9.955 4.723 1.00 0.32 H new ATOM 0 HE2 PHE A 298 -10.911 -11.210 5.319 1.00 0.58 H new ATOM 0 HZ PHE A 298 -8.549 -11.760 4.904 1.00 0.45 H new ATOM 1422 N VAL A 299 -11.986 -4.349 4.186 1.00 0.28 N ATOM 1423 CA VAL A 299 -12.609 -3.042 4.275 1.00 0.28 C ATOM 1424 C VAL A 299 -13.703 -2.992 5.344 1.00 0.32 C ATOM 1425 O VAL A 299 -14.542 -3.893 5.450 1.00 0.40 O ATOM 1426 CB VAL A 299 -13.188 -2.609 2.918 1.00 0.33 C ATOM 1427 CG1 VAL A 299 -14.130 -3.660 2.372 1.00 0.44 C ATOM 1428 CG2 VAL A 299 -13.885 -1.265 3.034 1.00 0.35 C ATOM 0 H VAL A 299 -12.627 -5.121 4.004 1.00 0.28 H new ATOM 0 HA VAL A 299 -11.823 -2.345 4.566 1.00 0.28 H new ATOM 0 HB VAL A 299 -12.361 -2.502 2.216 1.00 0.33 H new ATOM 0 HG11 VAL A 299 -14.526 -3.330 1.412 1.00 0.44 H new ATOM 0 HG12 VAL A 299 -13.591 -4.598 2.239 1.00 0.44 H new ATOM 0 HG13 VAL A 299 -14.952 -3.810 3.071 1.00 0.44 H new ATOM 0 HG21 VAL A 299 -14.287 -0.978 2.062 1.00 0.35 H new ATOM 0 HG22 VAL A 299 -14.698 -1.338 3.756 1.00 0.35 H new ATOM 0 HG23 VAL A 299 -13.171 -0.512 3.367 1.00 0.35 H new ATOM 1438 N LYS A 300 -13.732 -1.888 6.075 1.00 0.33 N ATOM 1439 CA LYS A 300 -14.774 -1.631 7.046 1.00 0.41 C ATOM 1440 C LYS A 300 -15.721 -0.582 6.487 1.00 0.40 C ATOM 1441 O LYS A 300 -15.281 0.383 5.864 1.00 0.37 O ATOM 1442 CB LYS A 300 -14.169 -1.142 8.362 1.00 0.48 C ATOM 1443 CG LYS A 300 -15.134 -1.206 9.532 1.00 1.17 C ATOM 1444 CD LYS A 300 -14.479 -0.735 10.819 1.00 1.72 C ATOM 1445 CE LYS A 300 -15.404 -0.917 12.011 1.00 2.32 C ATOM 1446 NZ LYS A 300 -15.728 -2.350 12.257 1.00 3.03 N ATOM 0 H LYS A 300 -13.033 -1.148 6.009 1.00 0.33 H new ATOM 0 HA LYS A 300 -15.320 -2.554 7.243 1.00 0.41 H new ATOM 0 HB2 LYS A 300 -13.289 -1.742 8.594 1.00 0.48 H new ATOM 0 HB3 LYS A 300 -13.830 -0.114 8.237 1.00 0.48 H new ATOM 0 HG2 LYS A 300 -16.007 -0.589 9.319 1.00 1.17 H new ATOM 0 HG3 LYS A 300 -15.490 -2.229 9.656 1.00 1.17 H new ATOM 0 HD2 LYS A 300 -13.556 -1.291 10.984 1.00 1.72 H new ATOM 0 HD3 LYS A 300 -14.205 0.316 10.726 1.00 1.72 H new ATOM 0 HE2 LYS A 300 -14.936 -0.494 12.900 1.00 2.32 H new ATOM 0 HE3 LYS A 300 -16.326 -0.361 11.841 1.00 2.32 H new ATOM 0 HZ1 LYS A 300 -16.109 -2.460 13.218 1.00 3.03 H new ATOM 0 HZ2 LYS A 300 -16.436 -2.670 11.565 1.00 3.03 H new ATOM 0 HZ3 LYS A 300 -14.865 -2.923 12.159 1.00 3.03 H new ATOM 1460 N GLU A 301 -17.014 -0.790 6.668 1.00 0.50 N ATOM 1461 CA GLU A 301 -18.005 0.148 6.166 1.00 0.57 C ATOM 1462 C GLU A 301 -17.928 1.467 6.930 1.00 0.65 C ATOM 1463 O GLU A 301 -18.280 2.516 6.353 1.00 1.41 O ATOM 1464 CB GLU A 301 -19.409 -0.437 6.295 1.00 0.83 C ATOM 1465 CG GLU A 301 -19.681 -1.579 5.336 1.00 0.66 C ATOM 1466 CD GLU A 301 -20.998 -2.263 5.609 1.00 0.90 C ATOM 1467 OE1 GLU A 301 -22.039 -1.576 5.611 1.00 1.44 O ATOM 1468 OE2 GLU A 301 -20.998 -3.491 5.836 1.00 1.21 O ATOM 1469 OXT GLU A 301 -17.520 1.446 8.112 1.00 1.20 O ATOM 0 H GLU A 301 -17.402 -1.597 7.157 1.00 0.50 H new ATOM 0 HA GLU A 301 -17.793 0.334 5.113 1.00 0.57 H new ATOM 0 HB2 GLU A 301 -19.555 -0.789 7.316 1.00 0.83 H new ATOM 0 HB3 GLU A 301 -20.140 0.353 6.123 1.00 0.83 H new ATOM 0 HG2 GLU A 301 -19.678 -1.199 4.314 1.00 0.66 H new ATOM 0 HG3 GLU A 301 -18.875 -2.309 5.408 1.00 0.66 H new TER 1476 GLU A 301