USER MOD reduce.3.24.130724 H: found=0, std=0, add=902, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 904 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 Single : A 219 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 221 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 222 ASN : amide:sc= -1.09! C(o=-1.1!,f=-5.7!) USER MOD Single : A 226 TYR OH : rot 180:sc= 0 USER MOD Single : A 227 TYR OH : rot 15:sc= -0.397 USER MOD Single : A 230 SER OG : rot -11:sc= 0.23! USER MOD Single : A 236 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0115) USER MOD Single : A 240 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 244 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 252 GLN :FLIP amide:sc= 0 F(o=-1.6,f=0) USER MOD Single : A 254 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 255 SER OG : rot 180:sc= 0.0153 USER MOD Single : A 258 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 264 LYS NZ :NH3+ 161:sc= -0.0297 (180deg=-0.364) USER MOD Single : A 266 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 219 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 221 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 222 ASN : amide:sc= -1.02! C(o=-1!,f=-5.8!) USER MOD Single : B 226 TYR OH : rot 180:sc= 0 USER MOD Single : B 227 TYR OH : rot 15:sc= -0.376 USER MOD Single : B 230 SER OG : rot -12:sc= 0.507! USER MOD Single : B 236 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0146) USER MOD Single : B 240 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 244 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 252 GLN :FLIP amide:sc= 0 F(o=-1.6,f=0) USER MOD Single : B 254 ASN : amide:sc= -0.0121 X(o=-0.012,f=-0.012) USER MOD Single : B 255 SER OG : rot 180:sc= 0.011 USER MOD Single : B 258 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 264 LYS NZ :NH3+ 161:sc= -0.0491 (180deg=-0.382) USER MOD Single : B 266 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 219 3.995 17.513 -4.224 1.00 1.77 N ATOM 2 CA MET A 219 2.567 17.091 -4.179 1.00 1.15 C ATOM 3 C MET A 219 2.215 16.349 -5.470 1.00 1.04 C ATOM 4 O MET A 219 2.656 16.708 -6.543 1.00 1.10 O ATOM 5 CB MET A 219 1.673 18.324 -4.040 1.00 1.82 C ATOM 6 CG MET A 219 2.043 19.347 -5.115 1.00 2.31 C ATOM 7 SD MET A 219 1.008 20.821 -4.928 1.00 3.45 S ATOM 8 CE MET A 219 1.753 21.790 -6.262 1.00 3.82 C ATOM 0 HA MET A 219 2.410 16.432 -3.325 1.00 1.15 H new ATOM 0 HB2 MET A 219 0.625 18.040 -4.139 1.00 1.82 H new ATOM 0 HB3 MET A 219 1.792 18.763 -3.049 1.00 1.82 H new ATOM 0 HG2 MET A 219 3.096 19.616 -5.029 1.00 2.31 H new ATOM 0 HG3 MET A 219 1.904 18.915 -6.106 1.00 2.31 H new ATOM 0 HE1 MET A 219 1.258 22.759 -6.328 1.00 3.82 H new ATOM 0 HE2 MET A 219 2.813 21.938 -6.056 1.00 3.82 H new ATOM 0 HE3 MET A 219 1.637 21.258 -7.206 1.00 3.82 H new ATOM 18 N ILE A 220 1.422 15.316 -5.374 1.00 0.98 N ATOM 19 CA ILE A 220 1.039 14.551 -6.595 1.00 0.97 C ATOM 20 C ILE A 220 -0.147 15.249 -7.268 1.00 0.94 C ATOM 21 O ILE A 220 -1.229 15.321 -6.721 1.00 1.01 O ATOM 22 CB ILE A 220 0.639 13.122 -6.203 1.00 1.03 C ATOM 23 CG1 ILE A 220 1.865 12.366 -5.667 1.00 1.35 C ATOM 24 CG2 ILE A 220 0.097 12.392 -7.433 1.00 1.78 C ATOM 25 CD1 ILE A 220 2.359 12.999 -4.353 1.00 2.08 C ATOM 0 H ILE A 220 1.023 14.969 -4.502 1.00 0.98 H new ATOM 0 HA ILE A 220 1.883 14.510 -7.284 1.00 0.97 H new ATOM 0 HB ILE A 220 -0.127 13.164 -5.429 1.00 1.03 H new ATOM 0 HG12 ILE A 220 1.609 11.320 -5.500 1.00 1.35 H new ATOM 0 HG13 ILE A 220 2.663 12.384 -6.409 1.00 1.35 H new ATOM 0 HG21 ILE A 220 -0.188 11.377 -7.157 1.00 1.78 H new ATOM 0 HG22 ILE A 220 -0.775 12.922 -7.816 1.00 1.78 H new ATOM 0 HG23 ILE A 220 0.867 12.356 -8.204 1.00 1.78 H new ATOM 0 HD11 ILE A 220 3.227 12.450 -3.989 1.00 2.08 H new ATOM 0 HD12 ILE A 220 2.635 14.038 -4.531 1.00 2.08 H new ATOM 0 HD13 ILE A 220 1.565 12.957 -3.608 1.00 2.08 H new ATOM 37 N GLN A 221 0.049 15.775 -8.450 1.00 0.90 N ATOM 38 CA GLN A 221 -1.067 16.477 -9.151 1.00 0.92 C ATOM 39 C GLN A 221 -1.944 15.456 -9.882 1.00 0.83 C ATOM 40 O GLN A 221 -2.443 14.517 -9.294 1.00 0.85 O ATOM 41 CB GLN A 221 -0.489 17.468 -10.167 1.00 1.00 C ATOM 42 CG GLN A 221 0.400 18.483 -9.447 1.00 1.28 C ATOM 43 CD GLN A 221 1.222 19.255 -10.481 1.00 1.61 C ATOM 44 OE1 GLN A 221 2.186 18.741 -11.012 1.00 2.08 O ATOM 45 NE2 GLN A 221 0.878 20.475 -10.791 1.00 2.17 N ATOM 0 H GLN A 221 0.932 15.749 -8.959 1.00 0.90 H new ATOM 0 HA GLN A 221 -1.670 17.013 -8.418 1.00 0.92 H new ATOM 0 HB2 GLN A 221 0.089 16.935 -10.922 1.00 1.00 H new ATOM 0 HB3 GLN A 221 -1.297 17.982 -10.688 1.00 1.00 H new ATOM 0 HG2 GLN A 221 -0.212 19.171 -8.864 1.00 1.28 H new ATOM 0 HG3 GLN A 221 1.061 17.973 -8.747 1.00 1.28 H new ATOM 0 HE21 GLN A 221 0.068 20.906 -10.345 1.00 2.17 H new ATOM 0 HE22 GLN A 221 1.419 20.998 -11.480 1.00 2.17 H new ATOM 54 N ASN A 222 -2.136 15.637 -11.163 1.00 0.78 N ATOM 55 CA ASN A 222 -2.980 14.688 -11.948 1.00 0.73 C ATOM 56 C ASN A 222 -2.080 13.633 -12.600 1.00 0.63 C ATOM 57 O ASN A 222 -1.477 13.869 -13.628 1.00 0.65 O ATOM 58 CB ASN A 222 -3.726 15.468 -13.032 1.00 0.80 C ATOM 59 CG ASN A 222 -4.377 16.707 -12.413 1.00 0.93 C ATOM 60 OD1 ASN A 222 -4.298 16.917 -11.219 1.00 1.48 O ATOM 61 ND2 ASN A 222 -5.022 17.542 -13.182 1.00 1.39 N ATOM 0 H ASN A 222 -1.741 16.407 -11.703 1.00 0.78 H new ATOM 0 HA ASN A 222 -3.697 14.195 -11.292 1.00 0.73 H new ATOM 0 HB2 ASN A 222 -3.036 15.763 -13.822 1.00 0.80 H new ATOM 0 HB3 ASN A 222 -4.486 14.836 -13.492 1.00 0.80 H new ATOM 0 HD21 ASN A 222 -5.460 18.371 -12.780 1.00 1.39 H new ATOM 0 HD22 ASN A 222 -5.088 17.365 -14.184 1.00 1.39 H new ATOM 68 N PHE A 223 -1.985 12.472 -12.002 1.00 0.55 N ATOM 69 CA PHE A 223 -1.124 11.382 -12.566 1.00 0.46 C ATOM 70 C PHE A 223 -1.887 10.050 -12.511 1.00 0.39 C ATOM 71 O PHE A 223 -2.466 9.704 -11.501 1.00 0.38 O ATOM 72 CB PHE A 223 0.154 11.258 -11.718 1.00 0.46 C ATOM 73 CG PHE A 223 1.158 12.315 -12.119 1.00 0.53 C ATOM 74 CD1 PHE A 223 1.976 12.109 -13.245 1.00 0.54 C ATOM 75 CD2 PHE A 223 1.283 13.497 -11.363 1.00 0.64 C ATOM 76 CE1 PHE A 223 2.920 13.086 -13.618 1.00 0.64 C ATOM 77 CE2 PHE A 223 2.228 14.473 -11.735 1.00 0.72 C ATOM 78 CZ PHE A 223 3.047 14.267 -12.862 1.00 0.71 C ATOM 0 H PHE A 223 -2.471 12.229 -11.139 1.00 0.55 H new ATOM 0 HA PHE A 223 -0.866 11.619 -13.598 1.00 0.46 H new ATOM 0 HB2 PHE A 223 -0.092 11.363 -10.661 1.00 0.46 H new ATOM 0 HB3 PHE A 223 0.589 10.267 -11.847 1.00 0.46 H new ATOM 0 HD1 PHE A 223 1.880 11.202 -13.823 1.00 0.54 H new ATOM 0 HD2 PHE A 223 0.655 13.655 -10.499 1.00 0.64 H new ATOM 0 HE1 PHE A 223 3.546 12.929 -14.484 1.00 0.64 H new ATOM 0 HE2 PHE A 223 2.325 15.379 -11.156 1.00 0.72 H new ATOM 0 HZ PHE A 223 3.772 15.015 -13.146 1.00 0.71 H new ATOM 88 N ARG A 224 -1.869 9.290 -13.583 1.00 0.36 N ATOM 89 CA ARG A 224 -2.567 7.960 -13.596 1.00 0.31 C ATOM 90 C ARG A 224 -1.497 6.867 -13.636 1.00 0.26 C ATOM 91 O ARG A 224 -0.371 7.112 -14.025 1.00 0.29 O ATOM 92 CB ARG A 224 -3.471 7.857 -14.839 1.00 0.35 C ATOM 93 CG ARG A 224 -4.852 8.464 -14.535 1.00 1.00 C ATOM 94 CD ARG A 224 -5.618 7.599 -13.504 1.00 1.24 C ATOM 95 NE ARG A 224 -7.041 7.436 -13.938 1.00 1.82 N ATOM 96 CZ ARG A 224 -7.748 8.462 -14.335 1.00 2.36 C ATOM 97 NH1 ARG A 224 -7.275 9.673 -14.222 1.00 2.57 N ATOM 98 NH2 ARG A 224 -8.949 8.277 -14.811 1.00 3.26 N ATOM 0 H ARG A 224 -1.398 9.535 -14.454 1.00 0.36 H new ATOM 0 HA ARG A 224 -3.189 7.848 -12.708 1.00 0.31 H new ATOM 0 HB2 ARG A 224 -3.011 8.380 -15.678 1.00 0.35 H new ATOM 0 HB3 ARG A 224 -3.580 6.814 -15.135 1.00 0.35 H new ATOM 0 HG2 ARG A 224 -4.732 9.477 -14.150 1.00 1.00 H new ATOM 0 HG3 ARG A 224 -5.432 8.540 -15.455 1.00 1.00 H new ATOM 0 HD2 ARG A 224 -5.143 6.623 -13.410 1.00 1.24 H new ATOM 0 HD3 ARG A 224 -5.579 8.069 -12.521 1.00 1.24 H new ATOM 0 HE ARG A 224 -7.467 6.509 -13.924 1.00 1.82 H new ATOM 0 HH11 ARG A 224 -6.349 9.824 -13.822 1.00 2.57 H new ATOM 0 HH12 ARG A 224 -7.831 10.469 -14.534 1.00 2.57 H new ATOM 0 HH21 ARG A 224 -9.334 7.334 -14.872 1.00 3.26 H new ATOM 0 HH22 ARG A 224 -9.503 9.075 -15.121 1.00 3.26 H new ATOM 112 N VAL A 225 -1.824 5.668 -13.222 1.00 0.23 N ATOM 113 CA VAL A 225 -0.805 4.571 -13.220 1.00 0.20 C ATOM 114 C VAL A 225 -1.429 3.243 -13.652 1.00 0.20 C ATOM 115 O VAL A 225 -2.528 2.901 -13.260 1.00 0.22 O ATOM 116 CB VAL A 225 -0.248 4.416 -11.805 1.00 0.20 C ATOM 117 CG1 VAL A 225 0.768 3.270 -11.771 1.00 0.20 C ATOM 118 CG2 VAL A 225 0.436 5.717 -11.383 1.00 0.23 C ATOM 0 H VAL A 225 -2.749 5.401 -12.886 1.00 0.23 H new ATOM 0 HA VAL A 225 -0.013 4.830 -13.922 1.00 0.20 H new ATOM 0 HB VAL A 225 -1.064 4.193 -11.118 1.00 0.20 H new ATOM 0 HG11 VAL A 225 1.162 3.163 -10.760 1.00 0.20 H new ATOM 0 HG12 VAL A 225 0.280 2.342 -12.070 1.00 0.20 H new ATOM 0 HG13 VAL A 225 1.585 3.488 -12.458 1.00 0.20 H new ATOM 0 HG21 VAL A 225 0.834 5.608 -10.374 1.00 0.23 H new ATOM 0 HG22 VAL A 225 1.251 5.940 -12.072 1.00 0.23 H new ATOM 0 HG23 VAL A 225 -0.288 6.531 -11.402 1.00 0.23 H new ATOM 128 N TYR A 226 -0.708 2.479 -14.432 1.00 0.22 N ATOM 129 CA TYR A 226 -1.206 1.142 -14.878 1.00 0.25 C ATOM 130 C TYR A 226 -0.370 0.085 -14.154 1.00 0.26 C ATOM 131 O TYR A 226 0.750 0.343 -13.766 1.00 0.26 O ATOM 132 CB TYR A 226 -1.017 0.984 -16.392 1.00 0.32 C ATOM 133 CG TYR A 226 -2.028 1.828 -17.137 1.00 0.35 C ATOM 134 CD1 TYR A 226 -1.833 3.216 -17.261 1.00 0.43 C ATOM 135 CD2 TYR A 226 -3.156 1.222 -17.725 1.00 0.42 C ATOM 136 CE1 TYR A 226 -2.764 3.998 -17.971 1.00 0.50 C ATOM 137 CE2 TYR A 226 -4.089 2.004 -18.432 1.00 0.47 C ATOM 138 CZ TYR A 226 -3.893 3.392 -18.555 1.00 0.49 C ATOM 139 OH TYR A 226 -4.806 4.160 -19.250 1.00 0.58 O ATOM 0 H TYR A 226 0.217 2.728 -14.783 1.00 0.22 H new ATOM 0 HA TYR A 226 -2.267 1.036 -14.650 1.00 0.25 H new ATOM 0 HB2 TYR A 226 -0.007 1.282 -16.673 1.00 0.32 H new ATOM 0 HB3 TYR A 226 -1.130 -0.063 -16.672 1.00 0.32 H new ATOM 0 HD1 TYR A 226 -0.969 3.682 -16.811 1.00 0.43 H new ATOM 0 HD2 TYR A 226 -3.305 0.156 -17.633 1.00 0.42 H new ATOM 0 HE1 TYR A 226 -2.612 5.063 -18.068 1.00 0.50 H new ATOM 0 HE2 TYR A 226 -4.955 1.539 -18.880 1.00 0.47 H new ATOM 0 HH TYR A 226 -5.524 3.587 -19.590 1.00 0.58 H new ATOM 149 N TYR A 227 -0.886 -1.097 -13.955 1.00 0.28 N ATOM 150 CA TYR A 227 -0.076 -2.125 -13.235 1.00 0.32 C ATOM 151 C TYR A 227 -0.554 -3.532 -13.593 1.00 0.37 C ATOM 152 O TYR A 227 -1.712 -3.757 -13.887 1.00 0.39 O ATOM 153 CB TYR A 227 -0.214 -1.907 -11.726 1.00 0.31 C ATOM 154 CG TYR A 227 -1.670 -1.999 -11.321 1.00 0.31 C ATOM 155 CD1 TYR A 227 -2.566 -0.967 -11.664 1.00 0.28 C ATOM 156 CD2 TYR A 227 -2.130 -3.115 -10.594 1.00 0.38 C ATOM 157 CE1 TYR A 227 -3.921 -1.054 -11.283 1.00 0.31 C ATOM 158 CE2 TYR A 227 -3.482 -3.200 -10.214 1.00 0.41 C ATOM 159 CZ TYR A 227 -4.377 -2.170 -10.558 1.00 0.38 C ATOM 160 OH TYR A 227 -5.702 -2.255 -10.184 1.00 0.44 O ATOM 0 H TYR A 227 -1.815 -1.394 -14.253 1.00 0.28 H new ATOM 0 HA TYR A 227 0.968 -2.026 -13.533 1.00 0.32 H new ATOM 0 HB2 TYR A 227 0.370 -2.654 -11.187 1.00 0.31 H new ATOM 0 HB3 TYR A 227 0.187 -0.931 -11.453 1.00 0.31 H new ATOM 0 HD1 TYR A 227 -2.215 -0.109 -12.219 1.00 0.28 H new ATOM 0 HD2 TYR A 227 -1.444 -3.906 -10.328 1.00 0.38 H new ATOM 0 HE1 TYR A 227 -4.608 -0.264 -11.548 1.00 0.31 H new ATOM 0 HE2 TYR A 227 -3.833 -4.057 -9.658 1.00 0.41 H new ATOM 0 HH TYR A 227 -6.228 -1.601 -10.691 1.00 0.44 H new ATOM 170 N ARG A 228 0.343 -4.486 -13.565 1.00 0.43 N ATOM 171 CA ARG A 228 -0.035 -5.892 -13.900 1.00 0.49 C ATOM 172 C ARG A 228 -0.370 -6.650 -12.614 1.00 0.54 C ATOM 173 O ARG A 228 0.334 -6.560 -11.627 1.00 0.60 O ATOM 174 CB ARG A 228 1.139 -6.581 -14.613 1.00 0.55 C ATOM 175 CG ARG A 228 1.799 -5.593 -15.582 1.00 0.67 C ATOM 176 CD ARG A 228 2.631 -6.356 -16.617 1.00 0.73 C ATOM 177 NE ARG A 228 3.423 -7.434 -15.939 1.00 1.49 N ATOM 178 CZ ARG A 228 4.259 -7.166 -14.970 1.00 1.74 C ATOM 179 NH1 ARG A 228 4.555 -5.931 -14.673 1.00 1.49 N ATOM 180 NH2 ARG A 228 4.841 -8.143 -14.330 1.00 2.76 N ATOM 0 H ARG A 228 1.325 -4.350 -13.323 1.00 0.43 H new ATOM 0 HA ARG A 228 -0.906 -5.889 -14.556 1.00 0.49 H new ATOM 0 HB2 ARG A 228 1.867 -6.931 -13.882 1.00 0.55 H new ATOM 0 HB3 ARG A 228 0.785 -7.458 -15.156 1.00 0.55 H new ATOM 0 HG2 ARG A 228 1.036 -4.997 -16.083 1.00 0.67 H new ATOM 0 HG3 ARG A 228 2.434 -4.899 -15.031 1.00 0.67 H new ATOM 0 HD2 ARG A 228 1.977 -6.793 -17.372 1.00 0.73 H new ATOM 0 HD3 ARG A 228 3.302 -5.670 -17.135 1.00 0.73 H new ATOM 0 HE ARG A 228 3.307 -8.401 -16.242 1.00 1.49 H new ATOM 0 HH11 ARG A 228 4.133 -5.165 -15.198 1.00 1.49 H new ATOM 0 HH12 ARG A 228 5.208 -5.731 -13.915 1.00 1.49 H new ATOM 0 HH21 ARG A 228 4.643 -9.110 -14.586 1.00 2.76 H new ATOM 0 HH22 ARG A 228 5.494 -7.939 -13.573 1.00 2.76 H new ATOM 194 N ASP A 229 -1.444 -7.395 -12.618 1.00 0.58 N ATOM 195 CA ASP A 229 -1.840 -8.163 -11.398 1.00 0.66 C ATOM 196 C ASP A 229 -1.348 -9.609 -11.519 1.00 0.74 C ATOM 197 O ASP A 229 -0.822 -10.015 -12.538 1.00 0.76 O ATOM 198 CB ASP A 229 -3.369 -8.148 -11.272 1.00 0.72 C ATOM 199 CG ASP A 229 -3.775 -8.469 -9.831 1.00 1.41 C ATOM 200 OD1 ASP A 229 -3.848 -7.543 -9.038 1.00 2.23 O ATOM 201 OD2 ASP A 229 -4.004 -9.632 -9.545 1.00 2.07 O ATOM 0 H ASP A 229 -2.068 -7.506 -13.417 1.00 0.58 H new ATOM 0 HA ASP A 229 -1.394 -7.706 -10.515 1.00 0.66 H new ATOM 0 HB2 ASP A 229 -3.757 -7.171 -11.559 1.00 0.72 H new ATOM 0 HB3 ASP A 229 -3.806 -8.878 -11.954 1.00 0.72 H new ATOM 206 N SER A 230 -1.530 -10.393 -10.489 1.00 0.84 N ATOM 207 CA SER A 230 -1.089 -11.816 -10.542 1.00 0.97 C ATOM 208 C SER A 230 -2.200 -12.655 -11.175 1.00 1.04 C ATOM 209 O SER A 230 -2.009 -13.807 -11.513 1.00 1.17 O ATOM 210 CB SER A 230 -0.819 -12.318 -9.123 1.00 1.07 C ATOM 211 OG SER A 230 -0.678 -13.734 -9.145 1.00 1.80 O ATOM 0 H SER A 230 -1.966 -10.108 -9.612 1.00 0.84 H new ATOM 0 HA SER A 230 -0.178 -11.900 -11.134 1.00 0.97 H new ATOM 0 HB2 SER A 230 0.086 -11.857 -8.728 1.00 1.07 H new ATOM 0 HB3 SER A 230 -1.637 -12.033 -8.462 1.00 1.07 H new ATOM 0 HG SER A 230 -0.953 -14.077 -10.021 1.00 1.80 H new ATOM 217 N ARG A 231 -3.361 -12.079 -11.339 1.00 1.00 N ATOM 218 CA ARG A 231 -4.497 -12.827 -11.952 1.00 1.11 C ATOM 219 C ARG A 231 -4.458 -12.655 -13.472 1.00 1.14 C ATOM 220 O ARG A 231 -5.183 -13.305 -14.198 1.00 1.30 O ATOM 221 CB ARG A 231 -5.819 -12.278 -11.408 1.00 1.14 C ATOM 222 CG ARG A 231 -5.828 -12.392 -9.882 1.00 1.18 C ATOM 223 CD ARG A 231 -7.068 -11.693 -9.325 1.00 1.46 C ATOM 224 NE ARG A 231 -8.283 -12.495 -9.647 1.00 2.09 N ATOM 225 CZ ARG A 231 -9.407 -12.251 -9.030 1.00 2.67 C ATOM 226 NH1 ARG A 231 -9.460 -11.317 -8.120 1.00 2.80 N ATOM 227 NH2 ARG A 231 -10.475 -12.940 -9.322 1.00 3.63 N ATOM 0 H ARG A 231 -3.572 -11.117 -11.073 1.00 1.00 H new ATOM 0 HA ARG A 231 -4.414 -13.885 -11.705 1.00 1.11 H new ATOM 0 HB2 ARG A 231 -5.943 -11.237 -11.707 1.00 1.14 H new ATOM 0 HB3 ARG A 231 -6.657 -12.833 -11.830 1.00 1.14 H new ATOM 0 HG2 ARG A 231 -5.825 -13.441 -9.585 1.00 1.18 H new ATOM 0 HG3 ARG A 231 -4.926 -11.941 -9.468 1.00 1.18 H new ATOM 0 HD2 ARG A 231 -6.975 -11.572 -8.246 1.00 1.46 H new ATOM 0 HD3 ARG A 231 -7.156 -10.694 -9.751 1.00 1.46 H new ATOM 0 HE ARG A 231 -8.236 -13.234 -10.349 1.00 2.09 H new ATOM 0 HH11 ARG A 231 -8.624 -10.779 -7.892 1.00 2.80 H new ATOM 0 HH12 ARG A 231 -10.338 -11.125 -7.637 1.00 2.80 H new ATOM 0 HH21 ARG A 231 -10.432 -13.670 -10.033 1.00 3.63 H new ATOM 0 HH22 ARG A 231 -11.353 -12.749 -8.839 1.00 3.63 H new ATOM 241 N ASP A 232 -3.616 -11.780 -13.961 1.00 1.02 N ATOM 242 CA ASP A 232 -3.533 -11.565 -15.436 1.00 1.07 C ATOM 243 C ASP A 232 -2.154 -10.944 -15.780 1.00 0.94 C ATOM 244 O ASP A 232 -1.788 -9.954 -15.179 1.00 0.82 O ATOM 245 CB ASP A 232 -4.638 -10.588 -15.849 1.00 1.14 C ATOM 246 CG ASP A 232 -6.003 -11.172 -15.478 1.00 1.61 C ATOM 247 OD1 ASP A 232 -6.390 -12.155 -16.089 1.00 2.16 O ATOM 248 OD2 ASP A 232 -6.637 -10.626 -14.591 1.00 2.12 O ATOM 0 H ASP A 232 -2.984 -11.206 -13.403 1.00 1.02 H new ATOM 0 HA ASP A 232 -3.652 -12.512 -15.962 1.00 1.07 H new ATOM 0 HB2 ASP A 232 -4.494 -9.629 -15.352 1.00 1.14 H new ATOM 0 HB3 ASP A 232 -4.590 -10.401 -16.922 1.00 1.14 H new ATOM 253 N PRO A 233 -1.413 -11.513 -16.728 1.00 1.01 N ATOM 254 CA PRO A 233 -0.092 -10.955 -17.095 1.00 0.97 C ATOM 255 C PRO A 233 -0.261 -9.620 -17.840 1.00 0.85 C ATOM 256 O PRO A 233 0.691 -8.897 -18.054 1.00 0.83 O ATOM 257 CB PRO A 233 0.534 -12.019 -18.025 1.00 1.13 C ATOM 258 CG PRO A 233 -0.609 -12.982 -18.444 1.00 1.25 C ATOM 259 CD PRO A 233 -1.793 -12.730 -17.486 1.00 1.19 C ATOM 0 HA PRO A 233 0.529 -10.750 -16.223 1.00 0.97 H new ATOM 0 HB2 PRO A 233 0.984 -11.550 -18.900 1.00 1.13 H new ATOM 0 HB3 PRO A 233 1.327 -12.562 -17.511 1.00 1.13 H new ATOM 0 HG2 PRO A 233 -0.905 -12.801 -19.477 1.00 1.25 H new ATOM 0 HG3 PRO A 233 -0.280 -14.019 -18.384 1.00 1.25 H new ATOM 0 HD2 PRO A 233 -2.722 -12.580 -18.036 1.00 1.19 H new ATOM 0 HD3 PRO A 233 -1.951 -13.578 -16.820 1.00 1.19 H new ATOM 267 N VAL A 234 -1.460 -9.292 -18.243 1.00 0.84 N ATOM 268 CA VAL A 234 -1.675 -8.010 -18.977 1.00 0.80 C ATOM 269 C VAL A 234 -1.850 -6.870 -17.970 1.00 0.69 C ATOM 270 O VAL A 234 -2.097 -7.090 -16.801 1.00 0.72 O ATOM 271 CB VAL A 234 -2.917 -8.142 -19.869 1.00 0.90 C ATOM 272 CG1 VAL A 234 -4.032 -8.854 -19.099 1.00 1.74 C ATOM 273 CG2 VAL A 234 -3.406 -6.759 -20.323 1.00 1.75 C ATOM 0 H VAL A 234 -2.298 -9.855 -18.096 1.00 0.84 H new ATOM 0 HA VAL A 234 -0.813 -7.788 -19.606 1.00 0.80 H new ATOM 0 HB VAL A 234 -2.651 -8.725 -20.751 1.00 0.90 H new ATOM 0 HG11 VAL A 234 -4.912 -8.946 -19.735 1.00 1.74 H new ATOM 0 HG12 VAL A 234 -3.693 -9.847 -18.803 1.00 1.74 H new ATOM 0 HG13 VAL A 234 -4.286 -8.277 -18.210 1.00 1.74 H new ATOM 0 HG21 VAL A 234 -4.287 -6.874 -20.954 1.00 1.75 H new ATOM 0 HG22 VAL A 234 -3.661 -6.159 -19.450 1.00 1.75 H new ATOM 0 HG23 VAL A 234 -2.617 -6.262 -20.888 1.00 1.75 H new ATOM 283 N TRP A 235 -1.720 -5.652 -18.421 1.00 0.64 N ATOM 284 CA TRP A 235 -1.870 -4.489 -17.492 1.00 0.55 C ATOM 285 C TRP A 235 -3.302 -4.439 -16.958 1.00 0.53 C ATOM 286 O TRP A 235 -4.177 -5.139 -17.432 1.00 0.65 O ATOM 287 CB TRP A 235 -1.566 -3.183 -18.234 1.00 0.56 C ATOM 288 CG TRP A 235 -0.151 -3.196 -18.715 1.00 0.58 C ATOM 289 CD1 TRP A 235 0.245 -3.579 -19.950 1.00 0.65 C ATOM 290 CD2 TRP A 235 1.061 -2.820 -17.994 1.00 0.53 C ATOM 291 NE1 TRP A 235 1.620 -3.467 -20.037 1.00 0.66 N ATOM 292 CE2 TRP A 235 2.171 -3.001 -18.860 1.00 0.59 C ATOM 293 CE3 TRP A 235 1.303 -2.343 -16.685 1.00 0.47 C ATOM 294 CZ2 TRP A 235 3.481 -2.720 -18.443 1.00 0.59 C ATOM 295 CZ3 TRP A 235 2.620 -2.056 -16.261 1.00 0.47 C ATOM 296 CH2 TRP A 235 3.705 -2.245 -17.138 1.00 0.53 C ATOM 0 H TRP A 235 -1.517 -5.409 -19.391 1.00 0.64 H new ATOM 0 HA TRP A 235 -1.171 -4.607 -16.664 1.00 0.55 H new ATOM 0 HB2 TRP A 235 -2.246 -3.066 -19.078 1.00 0.56 H new ATOM 0 HB3 TRP A 235 -1.728 -2.331 -17.573 1.00 0.56 H new ATOM 0 HD1 TRP A 235 -0.408 -3.918 -20.741 1.00 0.65 H new ATOM 0 HE1 TRP A 235 2.162 -3.700 -20.869 1.00 0.66 H new ATOM 0 HE3 TRP A 235 0.476 -2.197 -16.005 1.00 0.47 H new ATOM 0 HZ2 TRP A 235 4.311 -2.867 -19.119 1.00 0.59 H new ATOM 0 HZ3 TRP A 235 2.795 -1.690 -15.260 1.00 0.47 H new ATOM 0 HH2 TRP A 235 4.710 -2.025 -16.809 1.00 0.53 H new ATOM 307 N LYS A 236 -3.547 -3.608 -15.972 1.00 0.45 N ATOM 308 CA LYS A 236 -4.921 -3.488 -15.386 1.00 0.45 C ATOM 309 C LYS A 236 -5.426 -2.056 -15.575 1.00 0.43 C ATOM 310 O LYS A 236 -4.666 -1.160 -15.884 1.00 0.67 O ATOM 311 CB LYS A 236 -4.860 -3.822 -13.892 1.00 0.46 C ATOM 312 CG LYS A 236 -6.275 -3.798 -13.293 1.00 0.81 C ATOM 313 CD LYS A 236 -6.304 -4.638 -12.012 1.00 0.73 C ATOM 314 CE LYS A 236 -7.577 -4.337 -11.218 1.00 1.09 C ATOM 315 NZ LYS A 236 -8.755 -4.887 -11.947 1.00 1.43 N ATOM 0 H LYS A 236 -2.847 -3.002 -15.544 1.00 0.45 H new ATOM 0 HA LYS A 236 -5.600 -4.179 -15.885 1.00 0.45 H new ATOM 0 HB2 LYS A 236 -4.411 -4.805 -13.748 1.00 0.46 H new ATOM 0 HB3 LYS A 236 -4.225 -3.103 -13.375 1.00 0.46 H new ATOM 0 HG2 LYS A 236 -6.571 -2.772 -13.074 1.00 0.81 H new ATOM 0 HG3 LYS A 236 -6.993 -4.190 -14.014 1.00 0.81 H new ATOM 0 HD2 LYS A 236 -6.263 -5.698 -12.261 1.00 0.73 H new ATOM 0 HD3 LYS A 236 -5.426 -4.420 -11.404 1.00 0.73 H new ATOM 0 HE2 LYS A 236 -7.512 -4.779 -10.224 1.00 1.09 H new ATOM 0 HE3 LYS A 236 -7.689 -3.261 -11.082 1.00 1.09 H new ATOM 0 HZ1 LYS A 236 -9.611 -4.759 -11.370 1.00 1.43 H new ATOM 0 HZ2 LYS A 236 -8.869 -4.386 -12.851 1.00 1.43 H new ATOM 0 HZ3 LYS A 236 -8.609 -5.900 -12.129 1.00 1.43 H new ATOM 329 N GLY A 237 -6.702 -1.837 -15.395 1.00 0.39 N ATOM 330 CA GLY A 237 -7.266 -0.465 -15.572 1.00 0.36 C ATOM 331 C GLY A 237 -6.353 0.573 -14.899 1.00 0.31 C ATOM 332 O GLY A 237 -5.472 0.211 -14.145 1.00 0.31 O ATOM 0 H GLY A 237 -7.381 -2.552 -15.132 1.00 0.39 H new ATOM 0 HA2 GLY A 237 -7.366 -0.239 -16.634 1.00 0.36 H new ATOM 0 HA3 GLY A 237 -8.266 -0.416 -15.140 1.00 0.36 H new ATOM 336 N PRO A 238 -6.579 1.844 -15.187 1.00 0.31 N ATOM 337 CA PRO A 238 -5.764 2.924 -14.597 1.00 0.29 C ATOM 338 C PRO A 238 -6.059 3.048 -13.097 1.00 0.24 C ATOM 339 O PRO A 238 -7.085 2.609 -12.614 1.00 0.27 O ATOM 340 CB PRO A 238 -6.205 4.201 -15.348 1.00 0.36 C ATOM 341 CG PRO A 238 -7.498 3.845 -16.135 1.00 0.41 C ATOM 342 CD PRO A 238 -7.639 2.307 -16.114 1.00 0.38 C ATOM 0 HA PRO A 238 -4.694 2.742 -14.693 1.00 0.29 H new ATOM 0 HB2 PRO A 238 -6.392 5.015 -14.647 1.00 0.36 H new ATOM 0 HB3 PRO A 238 -5.422 4.539 -16.027 1.00 0.36 H new ATOM 0 HG2 PRO A 238 -8.368 4.317 -15.679 1.00 0.41 H new ATOM 0 HG3 PRO A 238 -7.437 4.211 -17.160 1.00 0.41 H new ATOM 0 HD2 PRO A 238 -8.627 2.005 -15.768 1.00 0.38 H new ATOM 0 HD3 PRO A 238 -7.507 1.884 -17.110 1.00 0.38 H new ATOM 350 N ALA A 239 -5.166 3.659 -12.363 1.00 0.19 N ATOM 351 CA ALA A 239 -5.379 3.835 -10.897 1.00 0.18 C ATOM 352 C ALA A 239 -4.861 5.214 -10.475 1.00 0.17 C ATOM 353 O ALA A 239 -4.193 5.893 -11.230 1.00 0.19 O ATOM 354 CB ALA A 239 -4.619 2.747 -10.142 1.00 0.21 C ATOM 0 H ALA A 239 -4.292 4.046 -12.720 1.00 0.19 H new ATOM 0 HA ALA A 239 -6.442 3.760 -10.666 1.00 0.18 H new ATOM 0 HB1 ALA A 239 -4.773 2.873 -9.070 1.00 0.21 H new ATOM 0 HB2 ALA A 239 -4.986 1.767 -10.449 1.00 0.21 H new ATOM 0 HB3 ALA A 239 -3.555 2.823 -10.367 1.00 0.21 H new ATOM 360 N LYS A 240 -5.163 5.635 -9.274 1.00 0.19 N ATOM 361 CA LYS A 240 -4.689 6.974 -8.804 1.00 0.21 C ATOM 362 C LYS A 240 -3.353 6.828 -8.071 1.00 0.19 C ATOM 363 O LYS A 240 -3.148 5.905 -7.305 1.00 0.18 O ATOM 364 CB LYS A 240 -5.722 7.568 -7.846 1.00 0.27 C ATOM 365 CG LYS A 240 -7.036 7.808 -8.591 1.00 1.15 C ATOM 366 CD LYS A 240 -7.992 8.589 -7.687 1.00 1.43 C ATOM 367 CE LYS A 240 -9.271 8.921 -8.456 1.00 2.03 C ATOM 368 NZ LYS A 240 -10.214 9.642 -7.555 1.00 2.72 N ATOM 0 H LYS A 240 -5.717 5.110 -8.597 1.00 0.19 H new ATOM 0 HA LYS A 240 -4.559 7.629 -9.665 1.00 0.21 H new ATOM 0 HB2 LYS A 240 -5.886 6.891 -7.007 1.00 0.27 H new ATOM 0 HB3 LYS A 240 -5.351 8.505 -7.431 1.00 0.27 H new ATOM 0 HG2 LYS A 240 -6.850 8.364 -9.510 1.00 1.15 H new ATOM 0 HG3 LYS A 240 -7.484 6.857 -8.878 1.00 1.15 H new ATOM 0 HD2 LYS A 240 -8.231 8.002 -6.800 1.00 1.43 H new ATOM 0 HD3 LYS A 240 -7.515 9.506 -7.343 1.00 1.43 H new ATOM 0 HE2 LYS A 240 -9.037 9.537 -9.325 1.00 2.03 H new ATOM 0 HE3 LYS A 240 -9.733 8.007 -8.828 1.00 2.03 H new ATOM 0 HZ1 LYS A 240 -11.085 9.870 -8.075 1.00 2.72 H new ATOM 0 HZ2 LYS A 240 -10.445 9.039 -6.740 1.00 2.72 H new ATOM 0 HZ3 LYS A 240 -9.771 10.521 -7.221 1.00 2.72 H new ATOM 382 N LEU A 241 -2.445 7.744 -8.296 1.00 0.20 N ATOM 383 CA LEU A 241 -1.111 7.686 -7.623 1.00 0.20 C ATOM 384 C LEU A 241 -1.182 8.432 -6.284 1.00 0.22 C ATOM 385 O LEU A 241 -1.523 9.597 -6.237 1.00 0.29 O ATOM 386 CB LEU A 241 -0.072 8.354 -8.535 1.00 0.22 C ATOM 387 CG LEU A 241 1.261 8.541 -7.799 1.00 0.23 C ATOM 388 CD1 LEU A 241 1.708 7.217 -7.176 1.00 0.29 C ATOM 389 CD2 LEU A 241 2.317 9.016 -8.801 1.00 0.29 C ATOM 0 H LEU A 241 -2.572 8.538 -8.924 1.00 0.20 H new ATOM 0 HA LEU A 241 -0.828 6.650 -7.438 1.00 0.20 H new ATOM 0 HB2 LEU A 241 0.082 7.745 -9.426 1.00 0.22 H new ATOM 0 HB3 LEU A 241 -0.445 9.321 -8.871 1.00 0.22 H new ATOM 0 HG LEU A 241 1.138 9.279 -7.006 1.00 0.23 H new ATOM 0 HD11 LEU A 241 2.655 7.361 -6.656 1.00 0.29 H new ATOM 0 HD12 LEU A 241 0.953 6.875 -6.468 1.00 0.29 H new ATOM 0 HD13 LEU A 241 1.834 6.470 -7.960 1.00 0.29 H new ATOM 0 HD21 LEU A 241 3.269 9.152 -8.289 1.00 0.29 H new ATOM 0 HD22 LEU A 241 2.432 8.271 -9.589 1.00 0.29 H new ATOM 0 HD23 LEU A 241 2.002 9.963 -9.240 1.00 0.29 H new ATOM 401 N LEU A 242 -0.863 7.767 -5.196 1.00 0.22 N ATOM 402 CA LEU A 242 -0.912 8.426 -3.848 1.00 0.25 C ATOM 403 C LEU A 242 0.503 8.567 -3.271 1.00 0.25 C ATOM 404 O LEU A 242 1.067 9.643 -3.241 1.00 0.27 O ATOM 405 CB LEU A 242 -1.752 7.569 -2.899 1.00 0.26 C ATOM 406 CG LEU A 242 -3.044 7.134 -3.596 1.00 0.32 C ATOM 407 CD1 LEU A 242 -3.885 6.303 -2.625 1.00 0.30 C ATOM 408 CD2 LEU A 242 -3.835 8.374 -4.032 1.00 0.45 C ATOM 0 H LEU A 242 -0.569 6.790 -5.184 1.00 0.22 H new ATOM 0 HA LEU A 242 -1.355 9.416 -3.955 1.00 0.25 H new ATOM 0 HB2 LEU A 242 -1.184 6.693 -2.587 1.00 0.26 H new ATOM 0 HB3 LEU A 242 -1.987 8.134 -1.997 1.00 0.26 H new ATOM 0 HG LEU A 242 -2.803 6.535 -4.474 1.00 0.32 H new ATOM 0 HD11 LEU A 242 -4.806 5.991 -3.117 1.00 0.30 H new ATOM 0 HD12 LEU A 242 -3.321 5.422 -2.317 1.00 0.30 H new ATOM 0 HD13 LEU A 242 -4.127 6.903 -1.748 1.00 0.30 H new ATOM 0 HD21 LEU A 242 -4.754 8.063 -4.528 1.00 0.45 H new ATOM 0 HD22 LEU A 242 -4.080 8.975 -3.157 1.00 0.45 H new ATOM 0 HD23 LEU A 242 -3.233 8.966 -4.722 1.00 0.45 H new ATOM 420 N TRP A 243 1.075 7.490 -2.791 1.00 0.25 N ATOM 421 CA TRP A 243 2.443 7.561 -2.187 1.00 0.26 C ATOM 422 C TRP A 243 3.506 7.325 -3.271 1.00 0.22 C ATOM 423 O TRP A 243 3.326 6.525 -4.166 1.00 0.21 O ATOM 424 CB TRP A 243 2.560 6.471 -1.108 1.00 0.30 C ATOM 425 CG TRP A 243 3.648 6.805 -0.137 1.00 0.29 C ATOM 426 CD1 TRP A 243 3.578 7.781 0.792 1.00 0.31 C ATOM 427 CD2 TRP A 243 4.947 6.170 0.032 1.00 0.28 C ATOM 428 NE1 TRP A 243 4.755 7.798 1.514 1.00 0.31 N ATOM 429 CE2 TRP A 243 5.634 6.830 1.085 1.00 0.30 C ATOM 430 CE3 TRP A 243 5.597 5.101 -0.624 1.00 0.27 C ATOM 431 CZ2 TRP A 243 6.921 6.442 1.477 1.00 0.31 C ATOM 432 CZ3 TRP A 243 6.894 4.706 -0.231 1.00 0.28 C ATOM 433 CH2 TRP A 243 7.553 5.377 0.816 1.00 0.29 C ATOM 0 H TRP A 243 0.652 6.562 -2.791 1.00 0.25 H new ATOM 0 HA TRP A 243 2.601 8.545 -1.746 1.00 0.26 H new ATOM 0 HB2 TRP A 243 1.612 6.372 -0.580 1.00 0.30 H new ATOM 0 HB3 TRP A 243 2.766 5.509 -1.577 1.00 0.30 H new ATOM 0 HD1 TRP A 243 2.738 8.442 0.946 1.00 0.31 H new ATOM 0 HE1 TRP A 243 4.950 8.450 2.274 1.00 0.31 H new ATOM 0 HE3 TRP A 243 5.099 4.583 -1.430 1.00 0.27 H new ATOM 0 HZ2 TRP A 243 7.424 6.958 2.282 1.00 0.31 H new ATOM 0 HZ3 TRP A 243 7.383 3.886 -0.736 1.00 0.28 H new ATOM 0 HH2 TRP A 243 8.546 5.072 1.111 1.00 0.29 H new ATOM 444 N LYS A 244 4.619 8.008 -3.182 1.00 0.24 N ATOM 445 CA LYS A 244 5.707 7.823 -4.192 1.00 0.23 C ATOM 446 C LYS A 244 7.064 7.981 -3.500 1.00 0.24 C ATOM 447 O LYS A 244 7.354 9.007 -2.917 1.00 0.28 O ATOM 448 CB LYS A 244 5.570 8.880 -5.293 1.00 0.30 C ATOM 449 CG LYS A 244 6.598 8.614 -6.398 1.00 0.71 C ATOM 450 CD LYS A 244 6.535 9.737 -7.434 1.00 0.82 C ATOM 451 CE LYS A 244 7.730 9.623 -8.383 1.00 1.50 C ATOM 452 NZ LYS A 244 7.761 10.805 -9.288 1.00 2.32 N ATOM 0 H LYS A 244 4.823 8.689 -2.450 1.00 0.24 H new ATOM 0 HA LYS A 244 5.632 6.830 -4.635 1.00 0.23 H new ATOM 0 HB2 LYS A 244 4.562 8.858 -5.708 1.00 0.30 H new ATOM 0 HB3 LYS A 244 5.721 9.875 -4.875 1.00 0.30 H new ATOM 0 HG2 LYS A 244 7.599 8.554 -5.971 1.00 0.71 H new ATOM 0 HG3 LYS A 244 6.396 7.654 -6.874 1.00 0.71 H new ATOM 0 HD2 LYS A 244 5.603 9.676 -7.996 1.00 0.82 H new ATOM 0 HD3 LYS A 244 6.544 10.707 -6.936 1.00 0.82 H new ATOM 0 HE2 LYS A 244 8.657 9.564 -7.812 1.00 1.50 H new ATOM 0 HE3 LYS A 244 7.657 8.706 -8.968 1.00 1.50 H new ATOM 0 HZ1 LYS A 244 8.573 10.727 -9.933 1.00 2.32 H new ATOM 0 HZ2 LYS A 244 6.881 10.841 -9.842 1.00 2.32 H new ATOM 0 HZ3 LYS A 244 7.850 11.673 -8.722 1.00 2.32 H new ATOM 466 N GLY A 245 7.901 6.978 -3.559 1.00 0.23 N ATOM 467 CA GLY A 245 9.237 7.086 -2.900 1.00 0.26 C ATOM 468 C GLY A 245 10.234 6.136 -3.570 1.00 0.26 C ATOM 469 O GLY A 245 10.721 6.393 -4.653 1.00 0.27 O ATOM 0 H GLY A 245 7.719 6.093 -4.032 1.00 0.23 H new ATOM 0 HA2 GLY A 245 9.601 8.111 -2.964 1.00 0.26 H new ATOM 0 HA3 GLY A 245 9.149 6.845 -1.841 1.00 0.26 H new ATOM 473 N GLU A 246 10.548 5.045 -2.924 1.00 0.26 N ATOM 474 CA GLU A 246 11.521 4.079 -3.510 1.00 0.27 C ATOM 475 C GLU A 246 10.894 3.395 -4.726 1.00 0.24 C ATOM 476 O GLU A 246 10.019 3.938 -5.369 1.00 0.22 O ATOM 477 CB GLU A 246 11.883 3.024 -2.460 1.00 0.33 C ATOM 478 CG GLU A 246 12.428 3.711 -1.203 1.00 1.00 C ATOM 479 CD GLU A 246 12.438 2.716 -0.040 1.00 0.91 C ATOM 480 OE1 GLU A 246 11.426 2.609 0.634 1.00 1.39 O ATOM 481 OE2 GLU A 246 13.460 2.077 0.157 1.00 1.39 O ATOM 0 H GLU A 246 10.171 4.781 -2.014 1.00 0.26 H new ATOM 0 HA GLU A 246 12.421 4.611 -3.819 1.00 0.27 H new ATOM 0 HB2 GLU A 246 11.004 2.430 -2.209 1.00 0.33 H new ATOM 0 HB3 GLU A 246 12.628 2.337 -2.862 1.00 0.33 H new ATOM 0 HG2 GLU A 246 13.436 4.082 -1.387 1.00 1.00 H new ATOM 0 HG3 GLU A 246 11.812 4.574 -0.952 1.00 1.00 H new ATOM 488 N GLY A 247 11.331 2.206 -5.042 1.00 0.26 N ATOM 489 CA GLY A 247 10.754 1.487 -6.214 1.00 0.25 C ATOM 490 C GLY A 247 9.391 0.912 -5.828 1.00 0.25 C ATOM 491 O GLY A 247 9.118 -0.257 -6.019 1.00 0.29 O ATOM 0 H GLY A 247 12.062 1.702 -4.540 1.00 0.26 H new ATOM 0 HA2 GLY A 247 10.649 2.168 -7.058 1.00 0.25 H new ATOM 0 HA3 GLY A 247 11.423 0.687 -6.531 1.00 0.25 H new ATOM 495 N ALA A 248 8.533 1.731 -5.284 1.00 0.22 N ATOM 496 CA ALA A 248 7.181 1.259 -4.873 1.00 0.24 C ATOM 497 C ALA A 248 6.187 2.404 -5.054 1.00 0.21 C ATOM 498 O ALA A 248 6.552 3.563 -5.014 1.00 0.23 O ATOM 499 CB ALA A 248 7.212 0.837 -3.404 1.00 0.29 C ATOM 0 H ALA A 248 8.714 2.719 -5.105 1.00 0.22 H new ATOM 0 HA ALA A 248 6.883 0.407 -5.484 1.00 0.24 H new ATOM 0 HB1 ALA A 248 6.223 0.492 -3.104 1.00 0.29 H new ATOM 0 HB2 ALA A 248 7.933 0.030 -3.272 1.00 0.29 H new ATOM 0 HB3 ALA A 248 7.502 1.688 -2.787 1.00 0.29 H new ATOM 505 N VAL A 249 4.933 2.099 -5.256 1.00 0.19 N ATOM 506 CA VAL A 249 3.924 3.183 -5.443 1.00 0.18 C ATOM 507 C VAL A 249 2.577 2.744 -4.863 1.00 0.20 C ATOM 508 O VAL A 249 2.034 1.720 -5.226 1.00 0.22 O ATOM 509 CB VAL A 249 3.767 3.490 -6.939 1.00 0.17 C ATOM 510 CG1 VAL A 249 4.991 4.265 -7.431 1.00 0.31 C ATOM 511 CG2 VAL A 249 3.646 2.186 -7.736 1.00 0.30 C ATOM 0 H VAL A 249 4.564 1.149 -5.300 1.00 0.19 H new ATOM 0 HA VAL A 249 4.262 4.080 -4.924 1.00 0.18 H new ATOM 0 HB VAL A 249 2.866 4.086 -7.085 1.00 0.17 H new ATOM 0 HG11 VAL A 249 4.881 4.483 -8.493 1.00 0.31 H new ATOM 0 HG12 VAL A 249 5.078 5.199 -6.876 1.00 0.31 H new ATOM 0 HG13 VAL A 249 5.888 3.666 -7.275 1.00 0.31 H new ATOM 0 HG21 VAL A 249 3.535 2.416 -8.796 1.00 0.30 H new ATOM 0 HG22 VAL A 249 4.543 1.584 -7.587 1.00 0.30 H new ATOM 0 HG23 VAL A 249 2.774 1.629 -7.393 1.00 0.30 H new ATOM 521 N VAL A 250 2.024 3.519 -3.967 1.00 0.20 N ATOM 522 CA VAL A 250 0.700 3.158 -3.381 1.00 0.22 C ATOM 523 C VAL A 250 -0.384 3.721 -4.299 1.00 0.20 C ATOM 524 O VAL A 250 -0.308 4.854 -4.732 1.00 0.21 O ATOM 525 CB VAL A 250 0.562 3.761 -1.975 1.00 0.26 C ATOM 526 CG1 VAL A 250 -0.784 3.359 -1.369 1.00 0.26 C ATOM 527 CG2 VAL A 250 1.694 3.243 -1.076 1.00 0.29 C ATOM 0 H VAL A 250 2.432 4.386 -3.616 1.00 0.20 H new ATOM 0 HA VAL A 250 0.605 2.075 -3.297 1.00 0.22 H new ATOM 0 HB VAL A 250 0.620 4.847 -2.047 1.00 0.26 H new ATOM 0 HG11 VAL A 250 -0.877 3.789 -0.372 1.00 0.26 H new ATOM 0 HG12 VAL A 250 -1.592 3.728 -2.000 1.00 0.26 H new ATOM 0 HG13 VAL A 250 -0.843 2.273 -1.302 1.00 0.26 H new ATOM 0 HG21 VAL A 250 1.593 3.673 -0.079 1.00 0.29 H new ATOM 0 HG22 VAL A 250 1.638 2.156 -1.010 1.00 0.29 H new ATOM 0 HG23 VAL A 250 2.656 3.531 -1.500 1.00 0.29 H new ATOM 537 N ILE A 251 -1.380 2.934 -4.622 1.00 0.19 N ATOM 538 CA ILE A 251 -2.454 3.420 -5.539 1.00 0.18 C ATOM 539 C ILE A 251 -3.825 2.964 -5.040 1.00 0.20 C ATOM 540 O ILE A 251 -3.941 2.225 -4.083 1.00 0.23 O ATOM 541 CB ILE A 251 -2.214 2.840 -6.938 1.00 0.16 C ATOM 542 CG1 ILE A 251 -2.239 1.308 -6.867 1.00 0.18 C ATOM 543 CG2 ILE A 251 -0.852 3.308 -7.466 1.00 0.16 C ATOM 544 CD1 ILE A 251 -1.852 0.723 -8.227 1.00 0.18 C ATOM 0 H ILE A 251 -1.495 1.976 -4.290 1.00 0.19 H new ATOM 0 HA ILE A 251 -2.431 4.509 -5.570 1.00 0.18 H new ATOM 0 HB ILE A 251 -2.998 3.186 -7.612 1.00 0.16 H new ATOM 0 HG12 ILE A 251 -1.548 0.958 -6.100 1.00 0.18 H new ATOM 0 HG13 ILE A 251 -3.233 0.964 -6.582 1.00 0.18 H new ATOM 0 HG21 ILE A 251 -0.685 2.894 -8.460 1.00 0.16 H new ATOM 0 HG22 ILE A 251 -0.837 4.397 -7.519 1.00 0.16 H new ATOM 0 HG23 ILE A 251 -0.064 2.967 -6.794 1.00 0.16 H new ATOM 0 HD11 ILE A 251 -1.871 -0.366 -8.173 1.00 0.18 H new ATOM 0 HD12 ILE A 251 -2.560 1.061 -8.983 1.00 0.18 H new ATOM 0 HD13 ILE A 251 -0.849 1.056 -8.494 1.00 0.18 H new ATOM 556 N GLN A 252 -4.866 3.392 -5.703 1.00 0.20 N ATOM 557 CA GLN A 252 -6.244 2.980 -5.304 1.00 0.23 C ATOM 558 C GLN A 252 -7.095 2.841 -6.565 1.00 0.24 C ATOM 559 O GLN A 252 -7.450 3.818 -7.194 1.00 0.27 O ATOM 560 CB GLN A 252 -6.875 4.034 -4.387 1.00 0.28 C ATOM 561 CG GLN A 252 -8.202 3.505 -3.838 1.00 0.31 C ATOM 562 CD GLN A 252 -8.889 4.603 -3.023 1.00 0.97 C ATOM 563 OE1 GLN A 252 -8.792 4.590 -1.721 1.00 1.68 O flip ATOM 564 NE2 GLN A 252 -9.521 5.480 -3.577 1.00 1.81 N flip ATOM 0 H GLN A 252 -4.821 4.014 -6.510 1.00 0.20 H new ATOM 0 HA GLN A 252 -6.195 2.033 -4.767 1.00 0.23 H new ATOM 0 HB2 GLN A 252 -6.198 4.269 -3.566 1.00 0.28 H new ATOM 0 HB3 GLN A 252 -7.041 4.959 -4.939 1.00 0.28 H new ATOM 0 HG2 GLN A 252 -8.847 3.188 -4.658 1.00 0.31 H new ATOM 0 HG3 GLN A 252 -8.026 2.629 -3.213 1.00 0.31 H new ATOM 0 HE21 GLN A 252 -9.596 5.490 -4.594 1.00 1.81 H new ATOM 0 HE22 GLN A 252 -9.976 6.207 -3.025 1.00 1.81 H new ATOM 573 N ASP A 253 -7.436 1.639 -6.943 1.00 0.25 N ATOM 574 CA ASP A 253 -8.278 1.456 -8.161 1.00 0.30 C ATOM 575 C ASP A 253 -9.735 1.500 -7.719 1.00 0.32 C ATOM 576 O ASP A 253 -10.400 2.510 -7.845 1.00 0.36 O ATOM 577 CB ASP A 253 -7.961 0.107 -8.815 1.00 0.36 C ATOM 578 CG ASP A 253 -8.557 0.070 -10.224 1.00 0.49 C ATOM 579 OD1 ASP A 253 -8.203 0.928 -11.017 1.00 1.18 O ATOM 580 OD2 ASP A 253 -9.356 -0.814 -10.487 1.00 1.18 O ATOM 0 H ASP A 253 -7.170 0.779 -6.464 1.00 0.25 H new ATOM 0 HA ASP A 253 -8.079 2.240 -8.892 1.00 0.30 H new ATOM 0 HB2 ASP A 253 -6.882 -0.042 -8.861 1.00 0.36 H new ATOM 0 HB3 ASP A 253 -8.370 -0.705 -8.214 1.00 0.36 H new ATOM 585 N ASN A 254 -10.227 0.437 -7.157 1.00 0.33 N ATOM 586 CA ASN A 254 -11.625 0.450 -6.658 1.00 0.36 C ATOM 587 C ASN A 254 -11.597 1.152 -5.304 1.00 0.34 C ATOM 588 O ASN A 254 -10.929 2.153 -5.138 1.00 0.36 O ATOM 589 CB ASN A 254 -12.127 -0.986 -6.488 1.00 0.42 C ATOM 590 CG ASN A 254 -11.823 -1.787 -7.754 1.00 1.22 C ATOM 591 OD1 ASN A 254 -11.048 -2.724 -7.723 1.00 1.98 O ATOM 592 ND2 ASN A 254 -12.403 -1.457 -8.874 1.00 1.88 N ATOM 0 H ASN A 254 -9.723 -0.439 -7.021 1.00 0.33 H new ATOM 0 HA ASN A 254 -12.289 0.962 -7.354 1.00 0.36 H new ATOM 0 HB2 ASN A 254 -11.647 -1.451 -5.627 1.00 0.42 H new ATOM 0 HB3 ASN A 254 -13.199 -0.987 -6.293 1.00 0.42 H new ATOM 0 HD21 ASN A 254 -12.207 -1.985 -9.725 1.00 1.88 H new ATOM 0 HD22 ASN A 254 -13.053 -0.671 -8.900 1.00 1.88 H new ATOM 599 N SER A 255 -12.278 0.624 -4.324 1.00 0.35 N ATOM 600 CA SER A 255 -12.249 1.249 -2.967 1.00 0.37 C ATOM 601 C SER A 255 -11.297 0.436 -2.090 1.00 0.37 C ATOM 602 O SER A 255 -11.665 -0.061 -1.044 1.00 0.42 O ATOM 603 CB SER A 255 -13.652 1.226 -2.361 1.00 0.42 C ATOM 604 OG SER A 255 -14.221 -0.064 -2.544 1.00 1.39 O ATOM 0 H SER A 255 -12.854 -0.214 -4.402 1.00 0.35 H new ATOM 0 HA SER A 255 -11.912 2.283 -3.034 1.00 0.37 H new ATOM 0 HB2 SER A 255 -13.606 1.469 -1.299 1.00 0.42 H new ATOM 0 HB3 SER A 255 -14.278 1.983 -2.834 1.00 0.42 H new ATOM 0 HG SER A 255 -15.120 -0.083 -2.155 1.00 1.39 H new ATOM 610 N ASP A 256 -10.076 0.286 -2.528 1.00 0.34 N ATOM 611 CA ASP A 256 -9.084 -0.504 -1.744 1.00 0.37 C ATOM 612 C ASP A 256 -7.671 -0.060 -2.130 1.00 0.34 C ATOM 613 O ASP A 256 -7.294 -0.085 -3.284 1.00 0.31 O ATOM 614 CB ASP A 256 -9.254 -1.993 -2.057 1.00 0.41 C ATOM 615 CG ASP A 256 -10.503 -2.525 -1.353 1.00 0.47 C ATOM 616 OD1 ASP A 256 -10.760 -2.096 -0.240 1.00 1.12 O ATOM 617 OD2 ASP A 256 -11.181 -3.353 -1.937 1.00 1.12 O ATOM 0 H ASP A 256 -9.721 0.679 -3.400 1.00 0.34 H new ATOM 0 HA ASP A 256 -9.243 -0.339 -0.678 1.00 0.37 H new ATOM 0 HB2 ASP A 256 -9.340 -2.141 -3.133 1.00 0.41 H new ATOM 0 HB3 ASP A 256 -8.375 -2.547 -1.728 1.00 0.41 H new ATOM 622 N ILE A 257 -6.890 0.355 -1.170 1.00 0.35 N ATOM 623 CA ILE A 257 -5.500 0.808 -1.469 1.00 0.33 C ATOM 624 C ILE A 257 -4.534 -0.369 -1.305 1.00 0.34 C ATOM 625 O ILE A 257 -4.615 -1.120 -0.354 1.00 0.38 O ATOM 626 CB ILE A 257 -5.126 1.927 -0.496 1.00 0.36 C ATOM 627 CG1 ILE A 257 -6.266 2.949 -0.459 1.00 0.36 C ATOM 628 CG2 ILE A 257 -3.839 2.607 -0.965 1.00 0.34 C ATOM 629 CD1 ILE A 257 -5.848 4.166 0.372 1.00 0.47 C ATOM 0 H ILE A 257 -7.156 0.400 -0.186 1.00 0.35 H new ATOM 0 HA ILE A 257 -5.439 1.177 -2.493 1.00 0.33 H new ATOM 0 HB ILE A 257 -4.966 1.515 0.500 1.00 0.36 H new ATOM 0 HG12 ILE A 257 -6.521 3.260 -1.472 1.00 0.36 H new ATOM 0 HG13 ILE A 257 -7.160 2.495 -0.031 1.00 0.36 H new ATOM 0 HG21 ILE A 257 -3.575 3.404 -0.270 1.00 0.34 H new ATOM 0 HG22 ILE A 257 -3.033 1.874 -1.001 1.00 0.34 H new ATOM 0 HG23 ILE A 257 -3.991 3.028 -1.959 1.00 0.34 H new ATOM 0 HD11 ILE A 257 -6.663 4.889 0.394 1.00 0.47 H new ATOM 0 HD12 ILE A 257 -5.616 3.850 1.389 1.00 0.47 H new ATOM 0 HD13 ILE A 257 -4.967 4.627 -0.075 1.00 0.47 H new ATOM 641 N LYS A 258 -3.625 -0.538 -2.233 1.00 0.31 N ATOM 642 CA LYS A 258 -2.655 -1.673 -2.148 1.00 0.33 C ATOM 643 C LYS A 258 -1.262 -1.194 -2.565 1.00 0.30 C ATOM 644 O LYS A 258 -1.097 -0.103 -3.078 1.00 0.27 O ATOM 645 CB LYS A 258 -3.113 -2.794 -3.087 1.00 0.34 C ATOM 646 CG LYS A 258 -4.304 -3.526 -2.465 1.00 0.42 C ATOM 647 CD LYS A 258 -4.855 -4.550 -3.460 1.00 0.43 C ATOM 648 CE LYS A 258 -5.933 -5.394 -2.778 1.00 1.41 C ATOM 649 NZ LYS A 258 -6.412 -6.445 -3.720 1.00 2.11 N ATOM 0 H LYS A 258 -3.513 0.064 -3.049 1.00 0.31 H new ATOM 0 HA LYS A 258 -2.614 -2.043 -1.124 1.00 0.33 H new ATOM 0 HB2 LYS A 258 -3.393 -2.380 -4.056 1.00 0.34 H new ATOM 0 HB3 LYS A 258 -2.295 -3.492 -3.263 1.00 0.34 H new ATOM 0 HG2 LYS A 258 -3.997 -4.026 -1.546 1.00 0.42 H new ATOM 0 HG3 LYS A 258 -5.082 -2.812 -2.195 1.00 0.42 H new ATOM 0 HD2 LYS A 258 -5.272 -4.041 -4.329 1.00 0.43 H new ATOM 0 HD3 LYS A 258 -4.051 -5.191 -3.822 1.00 0.43 H new ATOM 0 HE2 LYS A 258 -5.532 -5.855 -1.875 1.00 1.41 H new ATOM 0 HE3 LYS A 258 -6.765 -4.761 -2.470 1.00 1.41 H new ATOM 0 HZ1 LYS A 258 -7.145 -7.019 -3.256 1.00 2.11 H new ATOM 0 HZ2 LYS A 258 -6.810 -5.995 -4.569 1.00 2.11 H new ATOM 0 HZ3 LYS A 258 -5.616 -7.056 -3.993 1.00 2.11 H new ATOM 663 N VAL A 259 -0.256 -2.007 -2.351 1.00 0.30 N ATOM 664 CA VAL A 259 1.138 -1.614 -2.733 1.00 0.28 C ATOM 665 C VAL A 259 1.516 -2.291 -4.053 1.00 0.28 C ATOM 666 O VAL A 259 1.189 -3.438 -4.288 1.00 0.31 O ATOM 667 CB VAL A 259 2.113 -2.058 -1.635 1.00 0.30 C ATOM 668 CG1 VAL A 259 3.427 -1.283 -1.765 1.00 0.28 C ATOM 669 CG2 VAL A 259 1.495 -1.779 -0.265 1.00 0.33 C ATOM 0 H VAL A 259 -0.340 -2.930 -1.926 1.00 0.30 H new ATOM 0 HA VAL A 259 1.190 -0.532 -2.851 1.00 0.28 H new ATOM 0 HB VAL A 259 2.311 -3.125 -1.739 1.00 0.30 H new ATOM 0 HG11 VAL A 259 4.116 -1.602 -0.983 1.00 0.28 H new ATOM 0 HG12 VAL A 259 3.870 -1.479 -2.741 1.00 0.28 H new ATOM 0 HG13 VAL A 259 3.231 -0.216 -1.663 1.00 0.28 H new ATOM 0 HG21 VAL A 259 2.186 -2.094 0.517 1.00 0.33 H new ATOM 0 HG22 VAL A 259 1.297 -0.712 -0.166 1.00 0.33 H new ATOM 0 HG23 VAL A 259 0.561 -2.332 -0.168 1.00 0.33 H new ATOM 679 N VAL A 260 2.215 -1.587 -4.910 1.00 0.26 N ATOM 680 CA VAL A 260 2.636 -2.172 -6.221 1.00 0.26 C ATOM 681 C VAL A 260 4.114 -1.796 -6.478 1.00 0.24 C ATOM 682 O VAL A 260 4.447 -0.630 -6.402 1.00 0.22 O ATOM 683 CB VAL A 260 1.768 -1.566 -7.329 1.00 0.27 C ATOM 684 CG1 VAL A 260 2.222 -2.092 -8.693 1.00 0.34 C ATOM 685 CG2 VAL A 260 0.307 -1.958 -7.099 1.00 0.29 C ATOM 0 H VAL A 260 2.514 -0.624 -4.756 1.00 0.26 H new ATOM 0 HA VAL A 260 2.522 -3.256 -6.207 1.00 0.26 H new ATOM 0 HB VAL A 260 1.868 -0.481 -7.310 1.00 0.27 H new ATOM 0 HG11 VAL A 260 1.601 -1.657 -9.476 1.00 0.34 H new ATOM 0 HG12 VAL A 260 3.263 -1.816 -8.861 1.00 0.34 H new ATOM 0 HG13 VAL A 260 2.126 -3.178 -8.715 1.00 0.34 H new ATOM 0 HG21 VAL A 260 -0.313 -1.528 -7.886 1.00 0.29 H new ATOM 0 HG22 VAL A 260 0.215 -3.044 -7.116 1.00 0.29 H new ATOM 0 HG23 VAL A 260 -0.023 -1.581 -6.131 1.00 0.29 H new ATOM 695 N PRO A 261 4.979 -2.757 -6.784 1.00 0.29 N ATOM 696 CA PRO A 261 6.390 -2.428 -7.054 1.00 0.30 C ATOM 697 C PRO A 261 6.470 -1.421 -8.210 1.00 0.25 C ATOM 698 O PRO A 261 5.651 -1.426 -9.107 1.00 0.24 O ATOM 699 CB PRO A 261 7.058 -3.770 -7.432 1.00 0.37 C ATOM 700 CG PRO A 261 5.984 -4.884 -7.272 1.00 0.42 C ATOM 701 CD PRO A 261 4.655 -4.200 -6.882 1.00 0.36 C ATOM 0 HA PRO A 261 6.887 -1.971 -6.199 1.00 0.30 H new ATOM 0 HB2 PRO A 261 7.430 -3.739 -8.456 1.00 0.37 H new ATOM 0 HB3 PRO A 261 7.915 -3.967 -6.788 1.00 0.37 H new ATOM 0 HG2 PRO A 261 5.869 -5.441 -8.202 1.00 0.42 H new ATOM 0 HG3 PRO A 261 6.285 -5.599 -6.507 1.00 0.42 H new ATOM 0 HD2 PRO A 261 3.884 -4.381 -7.631 1.00 0.36 H new ATOM 0 HD3 PRO A 261 4.277 -4.585 -5.935 1.00 0.36 H new ATOM 709 N ARG A 262 7.455 -0.569 -8.197 1.00 0.27 N ATOM 710 CA ARG A 262 7.591 0.431 -9.292 1.00 0.28 C ATOM 711 C ARG A 262 7.944 -0.288 -10.599 1.00 0.30 C ATOM 712 O ARG A 262 7.612 0.163 -11.678 1.00 0.35 O ATOM 713 CB ARG A 262 8.706 1.417 -8.933 1.00 0.35 C ATOM 714 CG ARG A 262 8.994 2.326 -10.130 1.00 0.59 C ATOM 715 CD ARG A 262 9.809 3.539 -9.676 1.00 1.04 C ATOM 716 NE ARG A 262 9.969 4.483 -10.819 1.00 1.77 N ATOM 717 CZ ARG A 262 10.365 5.708 -10.605 1.00 2.20 C ATOM 718 NH1 ARG A 262 10.602 6.116 -9.388 1.00 2.31 N ATOM 719 NH2 ARG A 262 10.520 6.527 -11.609 1.00 3.12 N ATOM 0 H ARG A 262 8.173 -0.521 -7.474 1.00 0.27 H new ATOM 0 HA ARG A 262 6.652 0.969 -9.419 1.00 0.28 H new ATOM 0 HB2 ARG A 262 8.412 2.016 -8.071 1.00 0.35 H new ATOM 0 HB3 ARG A 262 9.608 0.874 -8.651 1.00 0.35 H new ATOM 0 HG2 ARG A 262 9.541 1.774 -10.894 1.00 0.59 H new ATOM 0 HG3 ARG A 262 8.058 2.654 -10.583 1.00 0.59 H new ATOM 0 HD2 ARG A 262 9.309 4.037 -8.846 1.00 1.04 H new ATOM 0 HD3 ARG A 262 10.786 3.220 -9.314 1.00 1.04 H new ATOM 0 HE ARG A 262 9.769 4.171 -11.769 1.00 1.77 H new ATOM 0 HH11 ARG A 262 10.478 5.477 -8.603 1.00 2.31 H new ATOM 0 HH12 ARG A 262 10.911 7.074 -9.222 1.00 2.31 H new ATOM 0 HH21 ARG A 262 10.332 6.210 -12.560 1.00 3.12 H new ATOM 0 HH22 ARG A 262 10.829 7.485 -11.443 1.00 3.12 H new ATOM 733 N ARG A 263 8.635 -1.390 -10.507 1.00 0.34 N ATOM 734 CA ARG A 263 9.036 -2.134 -11.736 1.00 0.40 C ATOM 735 C ARG A 263 7.825 -2.817 -12.385 1.00 0.40 C ATOM 736 O ARG A 263 7.922 -3.337 -13.480 1.00 0.49 O ATOM 737 CB ARG A 263 10.091 -3.180 -11.366 1.00 0.48 C ATOM 738 CG ARG A 263 11.213 -2.505 -10.567 1.00 1.31 C ATOM 739 CD ARG A 263 12.453 -3.402 -10.550 1.00 1.59 C ATOM 740 NE ARG A 263 12.033 -4.826 -10.438 1.00 2.29 N ATOM 741 CZ ARG A 263 12.893 -5.781 -10.661 1.00 2.90 C ATOM 742 NH1 ARG A 263 14.130 -5.490 -10.961 1.00 3.07 N ATOM 743 NH2 ARG A 263 12.518 -7.028 -10.580 1.00 3.82 N ATOM 0 H ARG A 263 8.941 -1.810 -9.629 1.00 0.34 H new ATOM 0 HA ARG A 263 9.450 -1.428 -12.456 1.00 0.40 H new ATOM 0 HB2 ARG A 263 9.638 -3.978 -10.777 1.00 0.48 H new ATOM 0 HB3 ARG A 263 10.496 -3.640 -12.267 1.00 0.48 H new ATOM 0 HG2 ARG A 263 11.458 -1.540 -11.011 1.00 1.31 H new ATOM 0 HG3 ARG A 263 10.880 -2.311 -9.547 1.00 1.31 H new ATOM 0 HD2 ARG A 263 13.035 -3.254 -11.460 1.00 1.59 H new ATOM 0 HD3 ARG A 263 13.097 -3.135 -9.712 1.00 1.59 H new ATOM 0 HE ARG A 263 11.071 -5.055 -10.187 1.00 2.29 H new ATOM 0 HH11 ARG A 263 14.424 -4.515 -11.021 1.00 3.07 H new ATOM 0 HH12 ARG A 263 14.802 -6.237 -11.135 1.00 3.07 H new ATOM 0 HH21 ARG A 263 11.553 -7.256 -10.342 1.00 3.82 H new ATOM 0 HH22 ARG A 263 13.190 -7.775 -10.754 1.00 3.82 H new ATOM 757 N LYS A 264 6.685 -2.815 -11.733 1.00 0.36 N ATOM 758 CA LYS A 264 5.462 -3.460 -12.324 1.00 0.42 C ATOM 759 C LYS A 264 4.374 -2.400 -12.496 1.00 0.36 C ATOM 760 O LYS A 264 3.195 -2.700 -12.561 1.00 0.38 O ATOM 761 CB LYS A 264 4.954 -4.569 -11.394 1.00 0.54 C ATOM 762 CG LYS A 264 5.999 -5.690 -11.307 1.00 0.85 C ATOM 763 CD LYS A 264 5.340 -6.980 -10.807 1.00 0.95 C ATOM 764 CE LYS A 264 6.404 -8.067 -10.651 1.00 1.29 C ATOM 765 NZ LYS A 264 7.299 -7.725 -9.510 1.00 2.08 N ATOM 0 H LYS A 264 6.546 -2.394 -10.814 1.00 0.36 H new ATOM 0 HA LYS A 264 5.712 -3.896 -13.291 1.00 0.42 H new ATOM 0 HB2 LYS A 264 4.758 -4.163 -10.401 1.00 0.54 H new ATOM 0 HB3 LYS A 264 4.010 -4.966 -11.768 1.00 0.54 H new ATOM 0 HG2 LYS A 264 6.448 -5.857 -12.286 1.00 0.85 H new ATOM 0 HG3 LYS A 264 6.804 -5.397 -10.632 1.00 0.85 H new ATOM 0 HD2 LYS A 264 4.844 -6.802 -9.853 1.00 0.95 H new ATOM 0 HD3 LYS A 264 4.573 -7.305 -11.509 1.00 0.95 H new ATOM 0 HE2 LYS A 264 5.930 -9.033 -10.478 1.00 1.29 H new ATOM 0 HE3 LYS A 264 6.985 -8.157 -11.569 1.00 1.29 H new ATOM 0 HZ1 LYS A 264 7.803 -8.579 -9.196 1.00 2.08 H new ATOM 0 HZ2 LYS A 264 7.989 -7.008 -9.813 1.00 2.08 H new ATOM 0 HZ3 LYS A 264 6.731 -7.349 -8.724 1.00 2.08 H new ATOM 779 N ALA A 265 4.770 -1.156 -12.580 1.00 0.30 N ATOM 780 CA ALA A 265 3.785 -0.048 -12.753 1.00 0.27 C ATOM 781 C ALA A 265 4.349 0.976 -13.741 1.00 0.28 C ATOM 782 O ALA A 265 5.515 0.943 -14.083 1.00 0.32 O ATOM 783 CB ALA A 265 3.544 0.630 -11.399 1.00 0.27 C ATOM 0 H ALA A 265 5.745 -0.858 -12.536 1.00 0.30 H new ATOM 0 HA ALA A 265 2.845 -0.446 -13.134 1.00 0.27 H new ATOM 0 HB1 ALA A 265 2.825 1.440 -11.521 1.00 0.27 H new ATOM 0 HB2 ALA A 265 3.152 -0.100 -10.691 1.00 0.27 H new ATOM 0 HB3 ALA A 265 4.484 1.033 -11.021 1.00 0.27 H new ATOM 789 N LYS A 266 3.532 1.891 -14.197 1.00 0.26 N ATOM 790 CA LYS A 266 4.014 2.929 -15.164 1.00 0.30 C ATOM 791 C LYS A 266 3.397 4.278 -14.800 1.00 0.27 C ATOM 792 O LYS A 266 2.201 4.394 -14.616 1.00 0.25 O ATOM 793 CB LYS A 266 3.585 2.552 -16.585 1.00 0.35 C ATOM 794 CG LYS A 266 4.202 1.207 -16.975 1.00 0.43 C ATOM 795 CD LYS A 266 4.095 1.010 -18.493 1.00 0.50 C ATOM 796 CE LYS A 266 2.656 1.270 -18.960 1.00 1.09 C ATOM 797 NZ LYS A 266 2.432 0.603 -20.274 1.00 1.79 N ATOM 0 H LYS A 266 2.547 1.966 -13.941 1.00 0.26 H new ATOM 0 HA LYS A 266 5.101 2.989 -15.116 1.00 0.30 H new ATOM 0 HB2 LYS A 266 2.498 2.494 -16.643 1.00 0.35 H new ATOM 0 HB3 LYS A 266 3.901 3.324 -17.287 1.00 0.35 H new ATOM 0 HG2 LYS A 266 5.247 1.172 -16.667 1.00 0.43 H new ATOM 0 HG3 LYS A 266 3.690 0.397 -16.456 1.00 0.43 H new ATOM 0 HD2 LYS A 266 4.779 1.687 -19.004 1.00 0.50 H new ATOM 0 HD3 LYS A 266 4.394 -0.004 -18.758 1.00 0.50 H new ATOM 0 HE2 LYS A 266 1.949 0.891 -18.222 1.00 1.09 H new ATOM 0 HE3 LYS A 266 2.479 2.342 -19.049 1.00 1.09 H new ATOM 0 HZ1 LYS A 266 1.457 0.779 -20.591 1.00 1.79 H new ATOM 0 HZ2 LYS A 266 3.098 0.985 -20.975 1.00 1.79 H new ATOM 0 HZ3 LYS A 266 2.584 -0.421 -20.174 1.00 1.79 H new ATOM 811 N ILE A 267 4.206 5.300 -14.689 1.00 0.30 N ATOM 812 CA ILE A 267 3.669 6.649 -14.336 1.00 0.32 C ATOM 813 C ILE A 267 3.291 7.398 -15.617 1.00 0.37 C ATOM 814 O ILE A 267 4.143 7.831 -16.366 1.00 0.41 O ATOM 815 CB ILE A 267 4.745 7.441 -13.579 1.00 0.36 C ATOM 816 CG1 ILE A 267 5.323 6.564 -12.452 1.00 0.36 C ATOM 817 CG2 ILE A 267 4.149 8.748 -13.001 1.00 0.39 C ATOM 818 CD1 ILE A 267 4.200 6.039 -11.551 1.00 0.45 C ATOM 0 H ILE A 267 5.216 5.259 -14.828 1.00 0.30 H new ATOM 0 HA ILE A 267 2.786 6.538 -13.706 1.00 0.32 H new ATOM 0 HB ILE A 267 5.545 7.712 -14.268 1.00 0.36 H new ATOM 0 HG12 ILE A 267 5.874 5.727 -12.881 1.00 0.36 H new ATOM 0 HG13 ILE A 267 6.032 7.143 -11.860 1.00 0.36 H new ATOM 0 HG21 ILE A 267 4.925 9.297 -12.468 1.00 0.39 H new ATOM 0 HG22 ILE A 267 3.763 9.363 -13.814 1.00 0.39 H new ATOM 0 HG23 ILE A 267 3.339 8.505 -12.314 1.00 0.39 H new ATOM 0 HD11 ILE A 267 4.626 5.421 -10.760 1.00 0.45 H new ATOM 0 HD12 ILE A 267 3.667 6.880 -11.107 1.00 0.45 H new ATOM 0 HD13 ILE A 267 3.507 5.442 -12.144 1.00 0.45 H new ATOM 830 N ILE A 268 2.014 7.557 -15.870 1.00 0.39 N ATOM 831 CA ILE A 268 1.567 8.287 -17.099 1.00 0.45 C ATOM 832 C ILE A 268 1.147 9.701 -16.702 1.00 0.48 C ATOM 833 O ILE A 268 0.790 9.959 -15.571 1.00 0.47 O ATOM 834 CB ILE A 268 0.358 7.575 -17.730 1.00 0.48 C ATOM 835 CG1 ILE A 268 0.624 6.061 -17.880 1.00 0.50 C ATOM 836 CG2 ILE A 268 0.051 8.189 -19.101 1.00 0.56 C ATOM 837 CD1 ILE A 268 1.551 5.774 -19.072 1.00 0.57 C ATOM 0 H ILE A 268 1.260 7.212 -15.277 1.00 0.39 H new ATOM 0 HA ILE A 268 2.385 8.313 -17.819 1.00 0.45 H new ATOM 0 HB ILE A 268 -0.501 7.708 -17.072 1.00 0.48 H new ATOM 0 HG12 ILE A 268 1.074 5.676 -16.965 1.00 0.50 H new ATOM 0 HG13 ILE A 268 -0.321 5.535 -18.016 1.00 0.50 H new ATOM 0 HG21 ILE A 268 -0.806 7.681 -19.543 1.00 0.56 H new ATOM 0 HG22 ILE A 268 -0.176 9.248 -18.983 1.00 0.56 H new ATOM 0 HG23 ILE A 268 0.917 8.075 -19.753 1.00 0.56 H new ATOM 0 HD11 ILE A 268 1.719 4.700 -19.152 1.00 0.57 H new ATOM 0 HD12 ILE A 268 1.088 6.138 -19.989 1.00 0.57 H new ATOM 0 HD13 ILE A 268 2.504 6.281 -18.922 1.00 0.57 H new ATOM 849 N ARG A 269 1.184 10.619 -17.628 1.00 0.56 N ATOM 850 CA ARG A 269 0.782 12.024 -17.318 1.00 0.62 C ATOM 851 C ARG A 269 -0.691 12.216 -17.684 1.00 0.66 C ATOM 852 O ARG A 269 -1.138 11.796 -18.733 1.00 0.73 O ATOM 853 CB ARG A 269 1.651 12.986 -18.131 1.00 0.73 C ATOM 854 CG ARG A 269 3.109 12.524 -18.067 1.00 1.48 C ATOM 855 CD ARG A 269 4.027 13.629 -18.589 1.00 1.80 C ATOM 856 NE ARG A 269 5.440 13.158 -18.553 1.00 2.23 N ATOM 857 CZ ARG A 269 6.362 13.801 -19.217 1.00 2.82 C ATOM 858 NH1 ARG A 269 6.045 14.859 -19.913 1.00 3.12 N ATOM 859 NH2 ARG A 269 7.599 13.386 -19.186 1.00 3.63 N ATOM 0 H ARG A 269 1.477 10.457 -18.592 1.00 0.56 H new ATOM 0 HA ARG A 269 0.919 12.226 -16.256 1.00 0.62 H new ATOM 0 HB2 ARG A 269 1.311 13.015 -19.166 1.00 0.73 H new ATOM 0 HB3 ARG A 269 1.560 13.998 -17.737 1.00 0.73 H new ATOM 0 HG2 ARG A 269 3.375 12.272 -17.040 1.00 1.48 H new ATOM 0 HG3 ARG A 269 3.240 11.619 -18.661 1.00 1.48 H new ATOM 0 HD2 ARG A 269 3.748 13.898 -19.608 1.00 1.80 H new ATOM 0 HD3 ARG A 269 3.916 14.527 -17.981 1.00 1.80 H new ATOM 0 HE ARG A 269 5.687 12.332 -18.009 1.00 2.23 H new ATOM 0 HH11 ARG A 269 5.078 15.182 -19.938 1.00 3.12 H new ATOM 0 HH12 ARG A 269 6.764 15.362 -20.432 1.00 3.12 H new ATOM 0 HH21 ARG A 269 7.846 12.559 -18.643 1.00 3.63 H new ATOM 0 HH22 ARG A 269 8.319 13.889 -19.705 1.00 3.63 H new ATOM 873 N ASP A 270 -1.452 12.848 -16.832 1.00 0.67 N ATOM 874 CA ASP A 270 -2.898 13.063 -17.138 1.00 0.75 C ATOM 875 C ASP A 270 -3.063 14.350 -17.949 1.00 1.18 C ATOM 876 O ASP A 270 -2.684 15.395 -17.448 1.00 1.73 O ATOM 877 CB ASP A 270 -3.679 13.186 -15.830 1.00 0.91 C ATOM 878 CG ASP A 270 -3.667 11.844 -15.096 1.00 1.47 C ATOM 879 OD1 ASP A 270 -3.051 10.920 -15.601 1.00 2.05 O ATOM 880 OD2 ASP A 270 -4.270 11.766 -14.039 1.00 2.05 O ATOM 881 OXT ASP A 270 -3.568 14.268 -19.057 1.00 1.84 O ATOM 0 H ASP A 270 -1.137 13.225 -15.938 1.00 0.67 H new ATOM 0 HA ASP A 270 -3.277 12.219 -17.714 1.00 0.75 H new ATOM 0 HB2 ASP A 270 -3.236 13.959 -15.202 1.00 0.91 H new ATOM 0 HB3 ASP A 270 -4.705 13.491 -16.035 1.00 0.91 H new TER 886 ASP A 270 ATOM 887 N MET B 219 1.209 17.440 7.424 1.00 1.76 N ATOM 888 CA MET B 219 2.471 16.649 7.352 1.00 1.15 C ATOM 889 C MET B 219 2.571 15.737 8.575 1.00 1.04 C ATOM 890 O MET B 219 2.214 16.115 9.673 1.00 1.10 O ATOM 891 CB MET B 219 3.669 17.600 7.324 1.00 1.82 C ATOM 892 CG MET B 219 3.560 18.592 8.482 1.00 2.31 C ATOM 893 SD MET B 219 4.960 19.738 8.429 1.00 3.46 S ATOM 894 CE MET B 219 4.468 20.763 9.836 1.00 3.83 C ATOM 0 HA MET B 219 2.469 16.043 6.446 1.00 1.15 H new ATOM 0 HB2 MET B 219 4.598 17.034 7.402 1.00 1.82 H new ATOM 0 HB3 MET B 219 3.700 18.135 6.375 1.00 1.82 H new ATOM 0 HG2 MET B 219 2.622 19.144 8.415 1.00 2.31 H new ATOM 0 HG3 MET B 219 3.549 18.058 9.432 1.00 2.31 H new ATOM 0 HE1 MET B 219 5.206 21.551 9.987 1.00 3.83 H new ATOM 0 HE2 MET B 219 3.494 21.211 9.637 1.00 3.83 H new ATOM 0 HE3 MET B 219 4.407 20.146 10.732 1.00 3.83 H new ATOM 904 N ILE B 220 3.056 14.538 8.396 1.00 0.98 N ATOM 905 CA ILE B 220 3.182 13.601 9.548 1.00 0.97 C ATOM 906 C ILE B 220 4.492 13.893 10.286 1.00 0.94 C ATOM 907 O ILE B 220 5.569 13.711 9.751 1.00 1.01 O ATOM 908 CB ILE B 220 3.189 12.155 9.037 1.00 1.03 C ATOM 909 CG1 ILE B 220 1.820 11.808 8.431 1.00 1.36 C ATOM 910 CG2 ILE B 220 3.478 11.206 10.203 1.00 1.79 C ATOM 911 CD1 ILE B 220 1.556 12.656 7.172 1.00 2.08 C ATOM 0 H ILE B 220 3.371 14.167 7.500 1.00 0.98 H new ATOM 0 HA ILE B 220 2.340 13.735 10.226 1.00 0.97 H new ATOM 0 HB ILE B 220 3.959 12.049 8.273 1.00 1.03 H new ATOM 0 HG12 ILE B 220 1.786 10.749 8.177 1.00 1.36 H new ATOM 0 HG13 ILE B 220 1.035 11.984 9.166 1.00 1.36 H new ATOM 0 HG21 ILE B 220 3.483 10.177 9.842 1.00 1.79 H new ATOM 0 HG22 ILE B 220 4.450 11.445 10.634 1.00 1.79 H new ATOM 0 HG23 ILE B 220 2.706 11.319 10.964 1.00 1.79 H new ATOM 0 HD11 ILE B 220 0.582 12.397 6.756 1.00 2.08 H new ATOM 0 HD12 ILE B 220 1.568 13.713 7.436 1.00 2.08 H new ATOM 0 HD13 ILE B 220 2.331 12.459 6.431 1.00 2.08 H new ATOM 923 N GLN B 221 4.414 14.353 11.507 1.00 0.90 N ATOM 924 CA GLN B 221 5.656 14.663 12.273 1.00 0.92 C ATOM 925 C GLN B 221 6.202 13.386 12.917 1.00 0.83 C ATOM 926 O GLN B 221 6.443 12.397 12.253 1.00 0.85 O ATOM 927 CB GLN B 221 5.341 15.688 13.367 1.00 1.00 C ATOM 928 CG GLN B 221 4.782 16.963 12.734 1.00 1.28 C ATOM 929 CD GLN B 221 4.172 17.843 13.825 1.00 1.61 C ATOM 930 OE1 GLN B 221 3.090 17.570 14.305 1.00 2.08 O ATOM 931 NE2 GLN B 221 4.825 18.894 14.241 1.00 2.16 N ATOM 0 H GLN B 221 3.542 14.527 12.007 1.00 0.90 H new ATOM 0 HA GLN B 221 6.403 15.072 11.592 1.00 0.92 H new ATOM 0 HB2 GLN B 221 4.619 15.273 14.070 1.00 1.00 H new ATOM 0 HB3 GLN B 221 6.243 15.917 13.934 1.00 1.00 H new ATOM 0 HG2 GLN B 221 5.574 17.503 12.216 1.00 1.28 H new ATOM 0 HG3 GLN B 221 4.027 16.712 11.989 1.00 1.28 H new ATOM 0 HE21 GLN B 221 5.733 19.123 13.838 1.00 2.16 H new ATOM 0 HE22 GLN B 221 4.427 19.487 14.970 1.00 2.16 H new ATOM 940 N ASN B 222 6.400 13.402 14.210 1.00 0.78 N ATOM 941 CA ASN B 222 6.932 12.199 14.915 1.00 0.73 C ATOM 942 C ASN B 222 5.762 11.380 15.468 1.00 0.63 C ATOM 943 O ASN B 222 5.216 11.687 16.509 1.00 0.64 O ATOM 944 CB ASN B 222 7.831 12.654 16.066 1.00 0.80 C ATOM 945 CG ASN B 222 8.811 13.715 15.560 1.00 0.93 C ATOM 946 OD1 ASN B 222 8.828 14.034 14.387 1.00 1.48 O ATOM 947 ND2 ASN B 222 9.636 14.277 16.402 1.00 1.39 N ATOM 0 H ASN B 222 6.214 14.204 14.812 1.00 0.78 H new ATOM 0 HA ASN B 222 7.507 11.585 14.222 1.00 0.73 H new ATOM 0 HB2 ASN B 222 7.225 13.060 16.876 1.00 0.80 H new ATOM 0 HB3 ASN B 222 8.378 11.803 16.473 1.00 0.80 H new ATOM 0 HD21 ASN B 222 10.295 14.984 16.076 1.00 1.39 H new ATOM 0 HD22 ASN B 222 9.621 14.009 17.386 1.00 1.39 H new ATOM 954 N PHE B 223 5.372 10.341 14.771 1.00 0.55 N ATOM 955 CA PHE B 223 4.232 9.485 15.235 1.00 0.46 C ATOM 956 C PHE B 223 4.605 8.005 15.070 1.00 0.38 C ATOM 957 O PHE B 223 5.097 7.597 14.036 1.00 0.38 O ATOM 958 CB PHE B 223 2.993 9.786 14.373 1.00 0.46 C ATOM 959 CG PHE B 223 2.304 11.039 14.859 1.00 0.53 C ATOM 960 CD1 PHE B 223 1.428 10.974 15.960 1.00 0.54 C ATOM 961 CD2 PHE B 223 2.524 12.268 14.206 1.00 0.64 C ATOM 962 CE1 PHE B 223 0.775 12.137 16.411 1.00 0.64 C ATOM 963 CE2 PHE B 223 1.869 13.430 14.656 1.00 0.73 C ATOM 964 CZ PHE B 223 0.995 13.365 15.758 1.00 0.72 C ATOM 0 H PHE B 223 5.798 10.046 13.892 1.00 0.55 H new ATOM 0 HA PHE B 223 4.019 9.697 16.283 1.00 0.46 H new ATOM 0 HB2 PHE B 223 3.288 9.907 13.331 1.00 0.46 H new ATOM 0 HB3 PHE B 223 2.301 8.944 14.413 1.00 0.46 H new ATOM 0 HD1 PHE B 223 1.257 10.031 16.459 1.00 0.54 H new ATOM 0 HD2 PHE B 223 3.195 12.319 13.361 1.00 0.64 H new ATOM 0 HE1 PHE B 223 0.106 12.087 17.257 1.00 0.64 H new ATOM 0 HE2 PHE B 223 2.037 14.372 14.156 1.00 0.73 H new ATOM 0 HZ PHE B 223 0.493 14.257 16.103 1.00 0.72 H new ATOM 974 N ARG B 224 4.351 7.194 16.072 1.00 0.36 N ATOM 975 CA ARG B 224 4.661 5.728 15.974 1.00 0.30 C ATOM 976 C ARG B 224 3.333 4.969 15.914 1.00 0.26 C ATOM 977 O ARG B 224 2.306 5.480 16.317 1.00 0.28 O ATOM 978 CB ARG B 224 5.467 5.280 17.208 1.00 0.34 C ATOM 979 CG ARG B 224 6.969 5.510 16.966 1.00 1.00 C ATOM 980 CD ARG B 224 7.501 4.556 15.867 1.00 1.24 C ATOM 981 NE ARG B 224 8.814 3.975 16.294 1.00 1.82 N ATOM 982 CZ ARG B 224 9.761 4.733 16.782 1.00 2.35 C ATOM 983 NH1 ARG B 224 9.637 6.032 16.773 1.00 2.57 N ATOM 984 NH2 ARG B 224 10.852 4.190 17.247 1.00 3.26 N ATOM 0 H ARG B 224 3.940 7.486 16.959 1.00 0.36 H new ATOM 0 HA ARG B 224 5.254 5.524 15.083 1.00 0.30 H new ATOM 0 HB2 ARG B 224 5.142 5.837 18.087 1.00 0.34 H new ATOM 0 HB3 ARG B 224 5.280 4.226 17.412 1.00 0.34 H new ATOM 0 HG2 ARG B 224 7.140 6.545 16.670 1.00 1.00 H new ATOM 0 HG3 ARG B 224 7.520 5.348 17.892 1.00 1.00 H new ATOM 0 HD2 ARG B 224 6.781 3.758 15.685 1.00 1.24 H new ATOM 0 HD3 ARG B 224 7.620 5.097 14.929 1.00 1.24 H new ATOM 0 HE ARG B 224 8.972 2.971 16.203 1.00 1.82 H new ATOM 0 HH11 ARG B 224 8.798 6.462 16.384 1.00 2.57 H new ATOM 0 HH12 ARG B 224 10.379 6.618 17.155 1.00 2.57 H new ATOM 0 HH21 ARG B 224 10.965 3.176 17.229 1.00 3.26 H new ATOM 0 HH22 ARG B 224 11.592 4.779 17.628 1.00 3.26 H new ATOM 998 N VAL B 225 3.335 3.762 15.401 1.00 0.22 N ATOM 999 CA VAL B 225 2.057 2.989 15.299 1.00 0.20 C ATOM 1000 C VAL B 225 2.285 1.512 15.618 1.00 0.20 C ATOM 1001 O VAL B 225 3.261 0.916 15.204 1.00 0.22 O ATOM 1002 CB VAL B 225 1.520 3.108 13.871 1.00 0.20 C ATOM 1003 CG1 VAL B 225 0.233 2.290 13.734 1.00 0.20 C ATOM 1004 CG2 VAL B 225 1.229 4.576 13.560 1.00 0.23 C ATOM 0 H VAL B 225 4.163 3.280 15.050 1.00 0.22 H new ATOM 0 HA VAL B 225 1.344 3.396 16.016 1.00 0.20 H new ATOM 0 HB VAL B 225 2.264 2.727 13.171 1.00 0.20 H new ATOM 0 HG11 VAL B 225 -0.147 2.377 12.716 1.00 0.20 H new ATOM 0 HG12 VAL B 225 0.442 1.243 13.955 1.00 0.20 H new ATOM 0 HG13 VAL B 225 -0.514 2.667 14.433 1.00 0.20 H new ATOM 0 HG21 VAL B 225 0.846 4.664 12.543 1.00 0.23 H new ATOM 0 HG22 VAL B 225 0.486 4.956 14.261 1.00 0.23 H new ATOM 0 HG23 VAL B 225 2.147 5.157 13.653 1.00 0.23 H new ATOM 1014 N TYR B 226 1.361 0.913 16.325 1.00 0.22 N ATOM 1015 CA TYR B 226 1.464 -0.541 16.657 1.00 0.25 C ATOM 1016 C TYR B 226 0.396 -1.267 15.840 1.00 0.26 C ATOM 1017 O TYR B 226 -0.601 -0.683 15.469 1.00 0.26 O ATOM 1018 CB TYR B 226 1.195 -0.764 18.150 1.00 0.32 C ATOM 1019 CG TYR B 226 2.376 -0.294 18.971 1.00 0.35 C ATOM 1020 CD1 TYR B 226 2.562 1.081 19.213 1.00 0.42 C ATOM 1021 CD2 TYR B 226 3.279 -1.231 19.510 1.00 0.42 C ATOM 1022 CE1 TYR B 226 3.650 1.518 19.993 1.00 0.50 C ATOM 1023 CE2 TYR B 226 4.369 -0.793 20.287 1.00 0.48 C ATOM 1024 CZ TYR B 226 4.554 0.581 20.530 1.00 0.49 C ATOM 1025 OH TYR B 226 5.620 1.010 21.293 1.00 0.58 O ATOM 0 H TYR B 226 0.529 1.375 16.691 1.00 0.22 H new ATOM 0 HA TYR B 226 2.462 -0.914 16.427 1.00 0.25 H new ATOM 0 HB2 TYR B 226 0.297 -0.224 18.450 1.00 0.32 H new ATOM 0 HB3 TYR B 226 1.009 -1.821 18.339 1.00 0.32 H new ATOM 0 HD1 TYR B 226 1.870 1.800 18.800 1.00 0.42 H new ATOM 0 HD2 TYR B 226 3.136 -2.286 19.327 1.00 0.42 H new ATOM 0 HE1 TYR B 226 3.791 2.572 20.180 1.00 0.50 H new ATOM 0 HE2 TYR B 226 5.063 -1.512 20.697 1.00 0.48 H new ATOM 0 HH TYR B 226 6.145 0.236 21.587 1.00 0.58 H new ATOM 1035 N TYR B 227 0.575 -2.524 15.543 1.00 0.29 N ATOM 1036 CA TYR B 227 -0.461 -3.231 14.732 1.00 0.32 C ATOM 1037 C TYR B 227 -0.394 -4.739 14.968 1.00 0.38 C ATOM 1038 O TYR B 227 0.650 -5.294 15.248 1.00 0.39 O ATOM 1039 CB TYR B 227 -0.226 -2.936 13.246 1.00 0.31 C ATOM 1040 CG TYR B 227 1.161 -3.388 12.844 1.00 0.31 C ATOM 1041 CD1 TYR B 227 2.294 -2.672 13.280 1.00 0.28 C ATOM 1042 CD2 TYR B 227 1.321 -4.525 12.027 1.00 0.39 C ATOM 1043 CE1 TYR B 227 3.583 -3.093 12.899 1.00 0.32 C ATOM 1044 CE2 TYR B 227 2.610 -4.944 11.647 1.00 0.42 C ATOM 1045 CZ TYR B 227 3.740 -4.229 12.083 1.00 0.38 C ATOM 1046 OH TYR B 227 5.004 -4.641 11.709 1.00 0.44 O ATOM 0 H TYR B 227 1.379 -3.087 15.820 1.00 0.29 H new ATOM 0 HA TYR B 227 -1.447 -2.876 15.033 1.00 0.32 H new ATOM 0 HB2 TYR B 227 -0.974 -3.449 12.642 1.00 0.31 H new ATOM 0 HB3 TYR B 227 -0.339 -1.869 13.056 1.00 0.31 H new ATOM 0 HD1 TYR B 227 2.174 -1.800 13.906 1.00 0.28 H new ATOM 0 HD2 TYR B 227 0.454 -5.075 11.692 1.00 0.39 H new ATOM 0 HE1 TYR B 227 4.451 -2.544 13.233 1.00 0.32 H new ATOM 0 HE2 TYR B 227 2.731 -5.815 11.020 1.00 0.42 H new ATOM 0 HH TYR B 227 5.672 -4.198 12.272 1.00 0.44 H new ATOM 1056 N ARG B 228 -1.515 -5.406 14.855 1.00 0.43 N ATOM 1057 CA ARG B 228 -1.542 -6.884 15.068 1.00 0.50 C ATOM 1058 C ARG B 228 -1.388 -7.597 13.723 1.00 0.55 C ATOM 1059 O ARG B 228 -2.011 -7.238 12.744 1.00 0.61 O ATOM 1060 CB ARG B 228 -2.878 -7.283 15.713 1.00 0.56 C ATOM 1061 CG ARG B 228 -3.273 -6.235 16.760 1.00 0.67 C ATOM 1062 CD ARG B 228 -4.311 -6.825 17.720 1.00 0.73 C ATOM 1063 NE ARG B 228 -5.346 -7.586 16.947 1.00 1.49 N ATOM 1064 CZ ARG B 228 -6.049 -7.023 16.000 1.00 1.73 C ATOM 1065 NH1 ARG B 228 -5.990 -5.733 15.810 1.00 1.49 N ATOM 1066 NH2 ARG B 228 -6.855 -7.748 15.274 1.00 2.76 N ATOM 0 H ARG B 228 -2.416 -4.988 14.623 1.00 0.43 H new ATOM 0 HA ARG B 228 -0.722 -7.172 15.725 1.00 0.50 H new ATOM 0 HB2 ARG B 228 -3.653 -7.361 14.951 1.00 0.56 H new ATOM 0 HB3 ARG B 228 -2.790 -8.264 16.180 1.00 0.56 H new ATOM 0 HG2 ARG B 228 -2.392 -5.913 17.316 1.00 0.67 H new ATOM 0 HG3 ARG B 228 -3.680 -5.352 16.268 1.00 0.67 H new ATOM 0 HD2 ARG B 228 -3.822 -7.484 18.437 1.00 0.73 H new ATOM 0 HD3 ARG B 228 -4.785 -6.027 18.292 1.00 0.73 H new ATOM 0 HE ARG B 228 -5.506 -8.569 17.166 1.00 1.49 H new ATOM 0 HH11 ARG B 228 -5.392 -5.157 16.403 1.00 1.49 H new ATOM 0 HH12 ARG B 228 -6.542 -5.301 15.069 1.00 1.49 H new ATOM 0 HH21 ARG B 228 -6.935 -8.750 15.447 1.00 2.76 H new ATOM 0 HH22 ARG B 228 -7.406 -7.313 14.534 1.00 2.76 H new ATOM 1080 N ASP B 229 -0.558 -8.605 13.669 1.00 0.59 N ATOM 1081 CA ASP B 229 -0.351 -9.350 12.389 1.00 0.67 C ATOM 1082 C ASP B 229 -1.219 -10.612 12.382 1.00 0.75 C ATOM 1083 O ASP B 229 -1.865 -10.940 13.359 1.00 0.77 O ATOM 1084 CB ASP B 229 1.128 -9.742 12.274 1.00 0.73 C ATOM 1085 CG ASP B 229 1.472 -10.044 10.813 1.00 1.42 C ATOM 1086 OD1 ASP B 229 1.815 -9.114 10.101 1.00 2.23 O ATOM 1087 OD2 ASP B 229 1.385 -11.198 10.430 1.00 2.08 O ATOM 0 H ASP B 229 -0.011 -8.947 14.459 1.00 0.59 H new ATOM 0 HA ASP B 229 -0.632 -8.719 11.546 1.00 0.67 H new ATOM 0 HB2 ASP B 229 1.758 -8.934 12.646 1.00 0.73 H new ATOM 0 HB3 ASP B 229 1.331 -10.616 12.893 1.00 0.73 H new ATOM 1092 N SER B 230 -1.228 -11.328 11.289 1.00 0.85 N ATOM 1093 CA SER B 230 -2.040 -12.577 11.217 1.00 0.99 C ATOM 1094 C SER B 230 -1.218 -13.736 11.781 1.00 1.05 C ATOM 1095 O SER B 230 -1.722 -14.815 12.018 1.00 1.19 O ATOM 1096 CB SER B 230 -2.395 -12.870 9.758 1.00 1.08 C ATOM 1097 OG SER B 230 -2.914 -14.189 9.658 1.00 1.81 O ATOM 0 H SER B 230 -0.707 -11.101 10.442 1.00 0.85 H new ATOM 0 HA SER B 230 -2.956 -12.456 11.795 1.00 0.99 H new ATOM 0 HB2 SER B 230 -3.130 -12.149 9.398 1.00 1.08 H new ATOM 0 HB3 SER B 230 -1.511 -12.766 9.128 1.00 1.08 H new ATOM 0 HG SER B 230 -2.753 -14.668 10.498 1.00 1.81 H new ATOM 1103 N ARG B 231 0.052 -13.513 12.001 1.00 1.01 N ATOM 1104 CA ARG B 231 0.924 -14.590 12.553 1.00 1.12 C ATOM 1105 C ARG B 231 0.890 -14.539 14.082 1.00 1.15 C ATOM 1106 O ARG B 231 1.390 -15.420 14.754 1.00 1.31 O ATOM 1107 CB ARG B 231 2.359 -14.381 12.066 1.00 1.15 C ATOM 1108 CG ARG B 231 2.380 -14.367 10.536 1.00 1.19 C ATOM 1109 CD ARG B 231 3.781 -13.991 10.046 1.00 1.48 C ATOM 1110 NE ARG B 231 4.721 -15.118 10.306 1.00 2.10 N ATOM 1111 CZ ARG B 231 5.886 -15.142 9.719 1.00 2.68 C ATOM 1112 NH1 ARG B 231 6.218 -14.189 8.891 1.00 2.81 N ATOM 1113 NH2 ARG B 231 6.718 -16.119 9.955 1.00 3.64 N ATOM 0 H ARG B 231 0.524 -12.627 11.821 1.00 1.01 H new ATOM 0 HA ARG B 231 0.563 -15.561 12.215 1.00 1.12 H new ATOM 0 HB2 ARG B 231 2.753 -13.442 12.455 1.00 1.15 H new ATOM 0 HB3 ARG B 231 3.002 -15.177 12.442 1.00 1.15 H new ATOM 0 HG2 ARG B 231 2.099 -15.347 10.149 1.00 1.19 H new ATOM 0 HG3 ARG B 231 1.648 -13.653 10.159 1.00 1.19 H new ATOM 0 HD2 ARG B 231 3.756 -13.764 8.980 1.00 1.48 H new ATOM 0 HD3 ARG B 231 4.126 -13.091 10.556 1.00 1.48 H new ATOM 0 HE ARG B 231 4.454 -15.869 10.942 1.00 2.10 H new ATOM 0 HH11 ARG B 231 5.567 -13.427 8.703 1.00 2.81 H new ATOM 0 HH12 ARG B 231 7.129 -14.207 8.432 1.00 2.81 H new ATOM 0 HH21 ARG B 231 6.458 -16.866 10.599 1.00 3.64 H new ATOM 0 HH22 ARG B 231 7.628 -16.136 9.495 1.00 3.64 H new ATOM 1127 N ASP B 232 0.302 -13.512 14.640 1.00 1.03 N ATOM 1128 CA ASP B 232 0.238 -13.402 16.127 1.00 1.08 C ATOM 1129 C ASP B 232 -0.928 -12.460 16.517 1.00 0.95 C ATOM 1130 O ASP B 232 -0.993 -11.360 16.002 1.00 0.83 O ATOM 1131 CB ASP B 232 1.554 -12.802 16.629 1.00 1.15 C ATOM 1132 CG ASP B 232 2.719 -13.705 16.217 1.00 1.62 C ATOM 1133 OD1 ASP B 232 2.808 -14.802 16.743 1.00 2.16 O ATOM 1134 OD2 ASP B 232 3.505 -13.282 15.384 1.00 2.13 O ATOM 0 H ASP B 232 -0.136 -12.745 14.130 1.00 1.03 H new ATOM 0 HA ASP B 232 0.079 -14.385 16.569 1.00 1.08 H new ATOM 0 HB2 ASP B 232 1.691 -11.803 16.216 1.00 1.15 H new ATOM 0 HB3 ASP B 232 1.528 -12.697 17.714 1.00 1.15 H new ATOM 1139 N PRO B 233 -1.824 -12.880 17.407 1.00 1.03 N ATOM 1140 CA PRO B 233 -2.954 -12.014 17.814 1.00 0.98 C ATOM 1141 C PRO B 233 -2.450 -10.842 18.673 1.00 0.86 C ATOM 1142 O PRO B 233 -3.176 -9.906 18.944 1.00 0.84 O ATOM 1143 CB PRO B 233 -3.872 -12.939 18.645 1.00 1.15 C ATOM 1144 CG PRO B 233 -3.047 -14.209 18.985 1.00 1.27 C ATOM 1145 CD PRO B 233 -1.812 -14.212 18.060 1.00 1.21 C ATOM 0 HA PRO B 233 -3.471 -11.576 16.960 1.00 0.98 H new ATOM 0 HB2 PRO B 233 -4.202 -12.438 19.555 1.00 1.15 H new ATOM 0 HB3 PRO B 233 -4.768 -13.200 18.082 1.00 1.15 H new ATOM 0 HG2 PRO B 233 -2.744 -14.202 20.032 1.00 1.27 H new ATOM 0 HG3 PRO B 233 -3.644 -15.108 18.832 1.00 1.27 H new ATOM 0 HD2 PRO B 233 -0.894 -14.366 18.627 1.00 1.21 H new ATOM 0 HD3 PRO B 233 -1.871 -15.014 17.324 1.00 1.21 H new ATOM 1153 N VAL B 234 -1.221 -10.888 19.108 1.00 0.86 N ATOM 1154 CA VAL B 234 -0.685 -9.778 19.952 1.00 0.81 C ATOM 1155 C VAL B 234 -0.179 -8.649 19.048 1.00 0.70 C ATOM 1156 O VAL B 234 0.031 -8.832 17.866 1.00 0.73 O ATOM 1157 CB VAL B 234 0.450 -10.317 20.836 1.00 0.91 C ATOM 1158 CG1 VAL B 234 1.350 -11.239 20.010 1.00 1.74 C ATOM 1159 CG2 VAL B 234 1.280 -9.160 21.409 1.00 1.76 C ATOM 0 H VAL B 234 -0.564 -11.644 18.917 1.00 0.86 H new ATOM 0 HA VAL B 234 -1.472 -9.382 20.594 1.00 0.81 H new ATOM 0 HB VAL B 234 0.015 -10.877 21.664 1.00 0.91 H new ATOM 0 HG11 VAL B 234 2.155 -11.621 20.638 1.00 1.74 H new ATOM 0 HG12 VAL B 234 0.762 -12.073 19.627 1.00 1.74 H new ATOM 0 HG13 VAL B 234 1.775 -10.681 19.176 1.00 1.74 H new ATOM 0 HG21 VAL B 234 2.080 -9.560 22.033 1.00 1.76 H new ATOM 0 HG22 VAL B 234 1.712 -8.582 20.592 1.00 1.76 H new ATOM 0 HG23 VAL B 234 0.639 -8.515 22.010 1.00 1.76 H new ATOM 1169 N TRP B 235 0.015 -7.484 19.602 1.00 0.65 N ATOM 1170 CA TRP B 235 0.501 -6.335 18.779 1.00 0.56 C ATOM 1171 C TRP B 235 1.907 -6.634 18.257 1.00 0.54 C ATOM 1172 O TRP B 235 2.544 -7.581 18.675 1.00 0.66 O ATOM 1173 CB TRP B 235 0.540 -5.059 19.629 1.00 0.56 C ATOM 1174 CG TRP B 235 -0.838 -4.724 20.098 1.00 0.58 C ATOM 1175 CD1 TRP B 235 -1.358 -5.085 21.294 1.00 0.66 C ATOM 1176 CD2 TRP B 235 -1.880 -3.974 19.407 1.00 0.54 C ATOM 1177 NE1 TRP B 235 -2.654 -4.606 21.383 1.00 0.67 N ATOM 1178 CE2 TRP B 235 -3.024 -3.915 20.248 1.00 0.60 C ATOM 1179 CE3 TRP B 235 -1.947 -3.343 18.143 1.00 0.47 C ATOM 1180 CZ2 TRP B 235 -4.195 -3.253 19.850 1.00 0.60 C ATOM 1181 CZ3 TRP B 235 -3.122 -2.676 17.738 1.00 0.47 C ATOM 1182 CH2 TRP B 235 -4.245 -2.632 18.591 1.00 0.53 C ATOM 0 H TRP B 235 -0.141 -7.276 20.588 1.00 0.65 H new ATOM 0 HA TRP B 235 -0.180 -6.190 17.940 1.00 0.56 H new ATOM 0 HB2 TRP B 235 1.201 -5.200 20.484 1.00 0.56 H new ATOM 0 HB3 TRP B 235 0.946 -4.234 19.045 1.00 0.56 H new ATOM 0 HD1 TRP B 235 -0.845 -5.654 22.055 1.00 0.66 H new ATOM 0 HE1 TRP B 235 -3.262 -4.747 22.190 1.00 0.67 H new ATOM 0 HE3 TRP B 235 -1.092 -3.372 17.483 1.00 0.47 H new ATOM 0 HZ2 TRP B 235 -5.052 -3.221 20.507 1.00 0.60 H new ATOM 0 HZ3 TRP B 235 -3.162 -2.197 16.771 1.00 0.47 H new ATOM 0 HH2 TRP B 235 -5.143 -2.121 18.276 1.00 0.53 H new ATOM 1193 N LYS B 236 2.395 -5.824 17.349 1.00 0.46 N ATOM 1194 CA LYS B 236 3.766 -6.034 16.783 1.00 0.45 C ATOM 1195 C LYS B 236 4.636 -4.815 17.097 1.00 0.44 C ATOM 1196 O LYS B 236 4.140 -3.773 17.478 1.00 0.67 O ATOM 1197 CB LYS B 236 3.660 -6.216 15.266 1.00 0.47 C ATOM 1198 CG LYS B 236 5.046 -6.531 14.678 1.00 0.81 C ATOM 1199 CD LYS B 236 4.882 -7.240 13.328 1.00 0.73 C ATOM 1200 CE LYS B 236 6.211 -7.235 12.572 1.00 1.09 C ATOM 1201 NZ LYS B 236 7.172 -8.142 13.257 1.00 1.44 N ATOM 0 H LYS B 236 1.897 -5.018 16.972 1.00 0.46 H new ATOM 0 HA LYS B 236 4.217 -6.922 17.225 1.00 0.45 H new ATOM 0 HB2 LYS B 236 2.966 -7.024 15.036 1.00 0.47 H new ATOM 0 HB3 LYS B 236 3.259 -5.311 14.810 1.00 0.47 H new ATOM 0 HG2 LYS B 236 5.616 -5.611 14.550 1.00 0.81 H new ATOM 0 HG3 LYS B 236 5.609 -7.162 15.366 1.00 0.81 H new ATOM 0 HD2 LYS B 236 4.547 -8.265 13.484 1.00 0.73 H new ATOM 0 HD3 LYS B 236 4.115 -6.741 12.736 1.00 0.73 H new ATOM 0 HE2 LYS B 236 6.058 -7.560 11.543 1.00 1.09 H new ATOM 0 HE3 LYS B 236 6.615 -6.223 12.531 1.00 1.09 H new ATOM 0 HZ1 LYS B 236 8.047 -8.206 12.699 1.00 1.44 H new ATOM 0 HZ2 LYS B 236 7.391 -7.766 14.202 1.00 1.44 H new ATOM 0 HZ3 LYS B 236 6.751 -9.088 13.350 1.00 1.44 H new ATOM 1215 N GLY B 237 5.930 -4.939 16.943 1.00 0.40 N ATOM 1216 CA GLY B 237 6.839 -3.793 17.241 1.00 0.37 C ATOM 1217 C GLY B 237 6.262 -2.492 16.655 1.00 0.31 C ATOM 1218 O GLY B 237 5.339 -2.538 15.868 1.00 0.31 O ATOM 0 H GLY B 237 6.397 -5.788 16.623 1.00 0.40 H new ATOM 0 HA2 GLY B 237 6.966 -3.690 18.319 1.00 0.37 H new ATOM 0 HA3 GLY B 237 7.826 -3.983 16.821 1.00 0.37 H new ATOM 1222 N PRO B 238 6.816 -1.361 17.053 1.00 0.31 N ATOM 1223 CA PRO B 238 6.342 -0.054 16.554 1.00 0.29 C ATOM 1224 C PRO B 238 6.702 0.107 15.071 1.00 0.24 C ATOM 1225 O PRO B 238 7.584 -0.555 14.557 1.00 0.27 O ATOM 1226 CB PRO B 238 7.091 0.989 17.414 1.00 0.36 C ATOM 1227 CG PRO B 238 8.215 0.230 18.175 1.00 0.41 C ATOM 1228 CD PRO B 238 7.935 -1.282 18.021 1.00 0.38 C ATOM 0 HA PRO B 238 5.260 0.055 16.629 1.00 0.29 H new ATOM 0 HB2 PRO B 238 7.513 1.774 16.787 1.00 0.36 H new ATOM 0 HB3 PRO B 238 6.410 1.472 18.114 1.00 0.36 H new ATOM 0 HG2 PRO B 238 9.194 0.483 17.767 1.00 0.41 H new ATOM 0 HG3 PRO B 238 8.225 0.514 19.227 1.00 0.41 H new ATOM 0 HD2 PRO B 238 8.814 -1.812 17.654 1.00 0.38 H new ATOM 0 HD3 PRO B 238 7.665 -1.734 18.976 1.00 0.38 H new ATOM 1236 N ALA B 239 6.030 0.997 14.388 1.00 0.19 N ATOM 1237 CA ALA B 239 6.326 1.226 12.943 1.00 0.18 C ATOM 1238 C ALA B 239 6.213 2.724 12.640 1.00 0.17 C ATOM 1239 O ALA B 239 5.733 3.494 13.448 1.00 0.18 O ATOM 1240 CB ALA B 239 5.321 0.452 12.092 1.00 0.21 C ATOM 0 H ALA B 239 5.285 1.578 14.772 1.00 0.19 H new ATOM 0 HA ALA B 239 7.334 0.882 12.712 1.00 0.18 H new ATOM 0 HB1 ALA B 239 5.535 0.617 11.036 1.00 0.21 H new ATOM 0 HB2 ALA B 239 5.398 -0.612 12.316 1.00 0.21 H new ATOM 0 HB3 ALA B 239 4.312 0.798 12.316 1.00 0.21 H new ATOM 1246 N LYS B 240 6.652 3.143 11.483 1.00 0.18 N ATOM 1247 CA LYS B 240 6.573 4.594 11.126 1.00 0.21 C ATOM 1248 C LYS B 240 5.268 4.878 10.377 1.00 0.19 C ATOM 1249 O LYS B 240 4.843 4.111 9.532 1.00 0.18 O ATOM 1250 CB LYS B 240 7.756 4.959 10.229 1.00 0.27 C ATOM 1251 CG LYS B 240 9.064 4.772 10.998 1.00 1.15 C ATOM 1252 CD LYS B 240 10.220 5.331 10.170 1.00 1.44 C ATOM 1253 CE LYS B 240 11.519 5.238 10.972 1.00 2.03 C ATOM 1254 NZ LYS B 240 12.648 5.746 10.143 1.00 2.72 N ATOM 0 H LYS B 240 7.063 2.544 10.767 1.00 0.18 H new ATOM 0 HA LYS B 240 6.601 5.189 12.039 1.00 0.21 H new ATOM 0 HB2 LYS B 240 7.755 4.333 9.337 1.00 0.27 H new ATOM 0 HB3 LYS B 240 7.665 5.992 9.893 1.00 0.27 H new ATOM 0 HG2 LYS B 240 9.010 5.282 11.960 1.00 1.15 H new ATOM 0 HG3 LYS B 240 9.229 3.715 11.207 1.00 1.15 H new ATOM 0 HD2 LYS B 240 10.316 4.774 9.238 1.00 1.44 H new ATOM 0 HD3 LYS B 240 10.020 6.368 9.902 1.00 1.44 H new ATOM 0 HE2 LYS B 240 11.436 5.821 11.889 1.00 2.03 H new ATOM 0 HE3 LYS B 240 11.705 4.205 11.266 1.00 2.03 H new ATOM 0 HZ1 LYS B 240 13.533 5.684 10.686 1.00 2.72 H new ATOM 0 HZ2 LYS B 240 12.731 5.172 9.280 1.00 2.72 H new ATOM 0 HZ3 LYS B 240 12.470 6.737 9.884 1.00 2.72 H new ATOM 1268 N LEU B 241 4.638 5.986 10.676 1.00 0.20 N ATOM 1269 CA LEU B 241 3.357 6.350 9.992 1.00 0.20 C ATOM 1270 C LEU B 241 3.667 7.155 8.723 1.00 0.23 C ATOM 1271 O LEU B 241 4.313 8.182 8.777 1.00 0.30 O ATOM 1272 CB LEU B 241 2.514 7.198 10.953 1.00 0.23 C ATOM 1273 CG LEU B 241 1.304 7.802 10.229 1.00 0.24 C ATOM 1274 CD1 LEU B 241 0.531 6.704 9.492 1.00 0.29 C ATOM 1275 CD2 LEU B 241 0.387 8.464 11.262 1.00 0.30 C ATOM 0 H LEU B 241 4.958 6.661 11.371 1.00 0.20 H new ATOM 0 HA LEU B 241 2.809 5.450 9.715 1.00 0.20 H new ATOM 0 HB2 LEU B 241 2.175 6.582 11.786 1.00 0.23 H new ATOM 0 HB3 LEU B 241 3.126 7.995 11.374 1.00 0.23 H new ATOM 0 HG LEU B 241 1.647 8.541 9.504 1.00 0.24 H new ATOM 0 HD11 LEU B 241 -0.326 7.143 8.981 1.00 0.29 H new ATOM 0 HD12 LEU B 241 1.184 6.227 8.761 1.00 0.29 H new ATOM 0 HD13 LEU B 241 0.184 5.960 10.209 1.00 0.29 H new ATOM 0 HD21 LEU B 241 -0.477 8.897 10.757 1.00 0.30 H new ATOM 0 HD22 LEU B 241 0.051 7.717 11.981 1.00 0.30 H new ATOM 0 HD23 LEU B 241 0.934 9.250 11.783 1.00 0.30 H new ATOM 1287 N LEU B 242 3.212 6.692 7.580 1.00 0.22 N ATOM 1288 CA LEU B 242 3.476 7.420 6.295 1.00 0.26 C ATOM 1289 C LEU B 242 2.169 7.988 5.722 1.00 0.26 C ATOM 1290 O LEU B 242 1.920 9.176 5.782 1.00 0.28 O ATOM 1291 CB LEU B 242 4.080 6.445 5.279 1.00 0.27 C ATOM 1292 CG LEU B 242 5.185 5.621 5.942 1.00 0.32 C ATOM 1293 CD1 LEU B 242 5.796 4.673 4.908 1.00 0.31 C ATOM 1294 CD2 LEU B 242 6.270 6.558 6.487 1.00 0.45 C ATOM 0 H LEU B 242 2.666 5.836 7.482 1.00 0.22 H new ATOM 0 HA LEU B 242 4.166 8.240 6.491 1.00 0.26 H new ATOM 0 HB2 LEU B 242 3.305 5.784 4.891 1.00 0.27 H new ATOM 0 HB3 LEU B 242 4.485 6.995 4.430 1.00 0.27 H new ATOM 0 HG LEU B 242 4.765 5.042 6.765 1.00 0.32 H new ATOM 0 HD11 LEU B 242 6.584 4.083 5.376 1.00 0.31 H new ATOM 0 HD12 LEU B 242 5.024 4.006 4.524 1.00 0.31 H new ATOM 0 HD13 LEU B 242 6.216 5.253 4.086 1.00 0.31 H new ATOM 0 HD21 LEU B 242 7.056 5.969 6.959 1.00 0.45 H new ATOM 0 HD22 LEU B 242 6.694 7.139 5.668 1.00 0.45 H new ATOM 0 HD23 LEU B 242 5.832 7.233 7.222 1.00 0.45 H new ATOM 1306 N TRP B 243 1.341 7.152 5.149 1.00 0.26 N ATOM 1307 CA TRP B 243 0.061 7.642 4.546 1.00 0.27 C ATOM 1308 C TRP B 243 -1.056 7.618 5.600 1.00 0.23 C ATOM 1309 O TRP B 243 -1.126 6.729 6.425 1.00 0.22 O ATOM 1310 CB TRP B 243 -0.316 6.716 3.377 1.00 0.31 C ATOM 1311 CG TRP B 243 -1.245 7.412 2.433 1.00 0.30 C ATOM 1312 CD1 TRP B 243 -0.887 8.405 1.591 1.00 0.32 C ATOM 1313 CD2 TRP B 243 -2.663 7.174 2.204 1.00 0.29 C ATOM 1314 NE1 TRP B 243 -1.994 8.802 0.867 1.00 0.33 N ATOM 1315 CE2 TRP B 243 -3.115 8.077 1.207 1.00 0.31 C ATOM 1316 CE3 TRP B 243 -3.598 6.273 2.762 1.00 0.28 C ATOM 1317 CZ2 TRP B 243 -4.446 8.091 0.777 1.00 0.32 C ATOM 1318 CZ3 TRP B 243 -4.942 6.282 2.330 1.00 0.29 C ATOM 1319 CH2 TRP B 243 -5.363 7.190 1.341 1.00 0.31 C ATOM 0 H TRP B 243 1.496 6.147 5.072 1.00 0.26 H new ATOM 0 HA TRP B 243 0.188 8.664 4.190 1.00 0.27 H new ATOM 0 HB2 TRP B 243 0.584 6.405 2.847 1.00 0.31 H new ATOM 0 HB3 TRP B 243 -0.788 5.811 3.760 1.00 0.31 H new ATOM 0 HD1 TRP B 243 0.105 8.822 1.499 1.00 0.32 H new ATOM 0 HE1 TRP B 243 -1.983 9.542 0.165 1.00 0.33 H new ATOM 0 HE3 TRP B 243 -3.283 5.574 3.523 1.00 0.28 H new ATOM 0 HZ2 TRP B 243 -4.766 8.789 0.017 1.00 0.32 H new ATOM 0 HZ3 TRP B 243 -5.650 5.589 2.760 1.00 0.29 H new ATOM 0 HH2 TRP B 243 -6.393 7.194 1.015 1.00 0.31 H new ATOM 1330 N LYS B 244 -1.939 8.584 5.564 1.00 0.24 N ATOM 1331 CA LYS B 244 -3.065 8.620 6.549 1.00 0.24 C ATOM 1332 C LYS B 244 -4.307 9.200 5.867 1.00 0.25 C ATOM 1333 O LYS B 244 -4.291 10.308 5.371 1.00 0.29 O ATOM 1334 CB LYS B 244 -2.678 9.507 7.737 1.00 0.31 C ATOM 1335 CG LYS B 244 -3.771 9.442 8.809 1.00 0.72 C ATOM 1336 CD LYS B 244 -3.435 10.417 9.939 1.00 0.82 C ATOM 1337 CE LYS B 244 -4.644 10.556 10.867 1.00 1.51 C ATOM 1338 NZ LYS B 244 -4.379 11.625 11.871 1.00 2.33 N ATOM 0 H LYS B 244 -1.929 9.352 4.893 1.00 0.24 H new ATOM 0 HA LYS B 244 -3.274 7.611 6.904 1.00 0.24 H new ATOM 0 HB2 LYS B 244 -1.726 9.178 8.154 1.00 0.31 H new ATOM 0 HB3 LYS B 244 -2.542 10.536 7.405 1.00 0.31 H new ATOM 0 HG2 LYS B 244 -4.738 9.693 8.373 1.00 0.72 H new ATOM 0 HG3 LYS B 244 -3.851 8.428 9.201 1.00 0.72 H new ATOM 0 HD2 LYS B 244 -2.572 10.058 10.499 1.00 0.82 H new ATOM 0 HD3 LYS B 244 -3.165 11.389 9.527 1.00 0.82 H new ATOM 0 HE2 LYS B 244 -5.535 10.799 10.288 1.00 1.51 H new ATOM 0 HE3 LYS B 244 -4.840 9.610 11.371 1.00 1.51 H new ATOM 0 HZ1 LYS B 244 -5.200 11.720 12.502 1.00 2.33 H new ATOM 0 HZ2 LYS B 244 -3.539 11.375 12.431 1.00 2.33 H new ATOM 0 HZ3 LYS B 244 -4.212 12.527 11.382 1.00 2.33 H new ATOM 1352 N GLY B 245 -5.388 8.461 5.834 1.00 0.24 N ATOM 1353 CA GLY B 245 -6.624 8.983 5.179 1.00 0.27 C ATOM 1354 C GLY B 245 -7.859 8.291 5.759 1.00 0.26 C ATOM 1355 O GLY B 245 -8.290 8.581 6.857 1.00 0.28 O ATOM 0 H GLY B 245 -5.467 7.524 6.230 1.00 0.24 H new ATOM 0 HA2 GLY B 245 -6.697 10.060 5.329 1.00 0.27 H new ATOM 0 HA3 GLY B 245 -6.574 8.814 4.103 1.00 0.27 H new ATOM 1359 N GLU B 246 -8.439 7.384 5.021 1.00 0.27 N ATOM 1360 CA GLU B 246 -9.655 6.676 5.515 1.00 0.28 C ATOM 1361 C GLU B 246 -9.273 5.750 6.670 1.00 0.24 C ATOM 1362 O GLU B 246 -8.302 5.978 7.364 1.00 0.22 O ATOM 1363 CB GLU B 246 -10.260 5.849 4.376 1.00 0.33 C ATOM 1364 CG GLU B 246 -10.562 6.760 3.180 1.00 1.00 C ATOM 1365 CD GLU B 246 -10.809 5.903 1.936 1.00 0.92 C ATOM 1366 OE1 GLU B 246 -9.843 5.578 1.264 1.00 1.40 O ATOM 1367 OE2 GLU B 246 -11.958 5.588 1.677 1.00 1.40 O ATOM 0 H GLU B 246 -8.122 7.102 4.094 1.00 0.27 H new ATOM 0 HA GLU B 246 -10.385 7.407 5.863 1.00 0.28 H new ATOM 0 HB2 GLU B 246 -9.569 5.060 4.079 1.00 0.33 H new ATOM 0 HB3 GLU B 246 -11.174 5.361 4.714 1.00 0.33 H new ATOM 0 HG2 GLU B 246 -11.436 7.376 3.390 1.00 1.00 H new ATOM 0 HG3 GLU B 246 -9.728 7.440 3.007 1.00 1.00 H new ATOM 1374 N GLY B 247 -10.026 4.702 6.880 1.00 0.26 N ATOM 1375 CA GLY B 247 -9.700 3.761 7.990 1.00 0.25 C ATOM 1376 C GLY B 247 -8.532 2.869 7.562 1.00 0.25 C ATOM 1377 O GLY B 247 -8.593 1.659 7.653 1.00 0.29 O ATOM 0 H GLY B 247 -10.851 4.458 6.332 1.00 0.26 H new ATOM 0 HA2 GLY B 247 -9.438 4.317 8.890 1.00 0.25 H new ATOM 0 HA3 GLY B 247 -10.570 3.151 8.234 1.00 0.25 H new ATOM 1381 N ALA B 248 -7.469 3.464 7.096 1.00 0.22 N ATOM 1382 CA ALA B 248 -6.285 2.676 6.655 1.00 0.24 C ATOM 1383 C ALA B 248 -5.022 3.488 6.939 1.00 0.21 C ATOM 1384 O ALA B 248 -5.058 4.701 6.999 1.00 0.23 O ATOM 1385 CB ALA B 248 -6.388 2.398 5.153 1.00 0.29 C ATOM 0 H ALA B 248 -7.370 4.475 7.001 1.00 0.22 H new ATOM 0 HA ALA B 248 -6.246 1.729 7.193 1.00 0.24 H new ATOM 0 HB1 ALA B 248 -5.522 1.821 4.829 1.00 0.29 H new ATOM 0 HB2 ALA B 248 -7.297 1.832 4.949 1.00 0.29 H new ATOM 0 HB3 ALA B 248 -6.419 3.342 4.609 1.00 0.29 H new ATOM 1391 N VAL B 249 -3.905 2.836 7.120 1.00 0.20 N ATOM 1392 CA VAL B 249 -2.645 3.584 7.404 1.00 0.19 C ATOM 1393 C VAL B 249 -1.451 2.845 6.796 1.00 0.20 C ATOM 1394 O VAL B 249 -1.217 1.685 7.073 1.00 0.22 O ATOM 1395 CB VAL B 249 -2.454 3.714 8.923 1.00 0.18 C ATOM 1396 CG1 VAL B 249 -3.435 4.751 9.473 1.00 0.31 C ATOM 1397 CG2 VAL B 249 -2.715 2.366 9.605 1.00 0.30 C ATOM 0 H VAL B 249 -3.810 1.821 7.084 1.00 0.20 H new ATOM 0 HA VAL B 249 -2.712 4.578 6.961 1.00 0.19 H new ATOM 0 HB VAL B 249 -1.430 4.027 9.125 1.00 0.18 H new ATOM 0 HG11 VAL B 249 -3.300 4.844 10.551 1.00 0.31 H new ATOM 0 HG12 VAL B 249 -3.249 5.715 9.000 1.00 0.31 H new ATOM 0 HG13 VAL B 249 -4.456 4.434 9.261 1.00 0.31 H new ATOM 0 HG21 VAL B 249 -2.577 2.470 10.681 1.00 0.30 H new ATOM 0 HG22 VAL B 249 -3.737 2.046 9.400 1.00 0.30 H new ATOM 0 HG23 VAL B 249 -2.017 1.622 9.220 1.00 0.30 H new ATOM 1407 N VAL B 250 -0.684 3.510 5.972 1.00 0.21 N ATOM 1408 CA VAL B 250 0.508 2.848 5.365 1.00 0.23 C ATOM 1409 C VAL B 250 1.677 3.017 6.334 1.00 0.21 C ATOM 1410 O VAL B 250 1.899 4.090 6.863 1.00 0.22 O ATOM 1411 CB VAL B 250 0.846 3.503 4.017 1.00 0.27 C ATOM 1412 CG1 VAL B 250 2.048 2.799 3.386 1.00 0.27 C ATOM 1413 CG2 VAL B 250 -0.359 3.390 3.071 1.00 0.30 C ATOM 0 H VAL B 250 -0.831 4.480 5.694 1.00 0.21 H new ATOM 0 HA VAL B 250 0.307 1.791 5.189 1.00 0.23 H new ATOM 0 HB VAL B 250 1.085 4.554 4.182 1.00 0.27 H new ATOM 0 HG11 VAL B 250 2.284 3.267 2.430 1.00 0.27 H new ATOM 0 HG12 VAL B 250 2.908 2.880 4.051 1.00 0.27 H new ATOM 0 HG13 VAL B 250 1.811 1.747 3.226 1.00 0.27 H new ATOM 0 HG21 VAL B 250 -0.116 3.855 2.116 1.00 0.30 H new ATOM 0 HG22 VAL B 250 -0.599 2.339 2.912 1.00 0.30 H new ATOM 0 HG23 VAL B 250 -1.217 3.896 3.513 1.00 0.30 H new ATOM 1423 N ILE B 251 2.413 1.966 6.593 1.00 0.20 N ATOM 1424 CA ILE B 251 3.552 2.065 7.555 1.00 0.19 C ATOM 1425 C ILE B 251 4.761 1.293 7.026 1.00 0.20 C ATOM 1426 O ILE B 251 4.700 0.631 6.009 1.00 0.24 O ATOM 1427 CB ILE B 251 3.124 1.459 8.897 1.00 0.16 C ATOM 1428 CG1 ILE B 251 2.733 -0.011 8.694 1.00 0.19 C ATOM 1429 CG2 ILE B 251 1.925 2.236 9.457 1.00 0.17 C ATOM 1430 CD1 ILE B 251 2.163 -0.577 9.997 1.00 0.19 C ATOM 0 H ILE B 251 2.274 1.044 6.180 1.00 0.20 H new ATOM 0 HA ILE B 251 3.824 3.113 7.679 1.00 0.19 H new ATOM 0 HB ILE B 251 3.954 1.521 9.601 1.00 0.16 H new ATOM 0 HG12 ILE B 251 1.995 -0.094 7.896 1.00 0.19 H new ATOM 0 HG13 ILE B 251 3.603 -0.590 8.385 1.00 0.19 H new ATOM 0 HG21 ILE B 251 1.624 1.802 10.411 1.00 0.17 H new ATOM 0 HG22 ILE B 251 2.204 3.279 9.605 1.00 0.17 H new ATOM 0 HG23 ILE B 251 1.094 2.179 8.754 1.00 0.17 H new ATOM 0 HD11 ILE B 251 1.886 -1.621 9.850 1.00 0.19 H new ATOM 0 HD12 ILE B 251 2.915 -0.508 10.783 1.00 0.19 H new ATOM 0 HD13 ILE B 251 1.281 -0.005 10.287 1.00 0.19 H new ATOM 1442 N GLN B 252 5.860 1.365 7.729 1.00 0.20 N ATOM 1443 CA GLN B 252 7.086 0.626 7.304 1.00 0.23 C ATOM 1444 C GLN B 252 7.830 0.158 8.553 1.00 0.24 C ATOM 1445 O GLN B 252 8.418 0.947 9.266 1.00 0.27 O ATOM 1446 CB GLN B 252 8.006 1.539 6.484 1.00 0.28 C ATOM 1447 CG GLN B 252 9.154 0.714 5.898 1.00 0.31 C ATOM 1448 CD GLN B 252 10.136 1.646 5.184 1.00 0.98 C ATOM 1449 OE1 GLN B 252 10.077 1.766 3.885 1.00 1.69 O flip ATOM 1450 NE2 GLN B 252 10.967 2.268 5.815 1.00 1.81 N flip ATOM 0 H GLN B 252 5.962 1.908 8.586 1.00 0.20 H new ATOM 0 HA GLN B 252 6.797 -0.225 6.687 1.00 0.23 H new ATOM 0 HB2 GLN B 252 7.442 2.017 5.683 1.00 0.28 H new ATOM 0 HB3 GLN B 252 8.401 2.335 7.114 1.00 0.28 H new ATOM 0 HG2 GLN B 252 9.665 0.167 6.690 1.00 0.31 H new ATOM 0 HG3 GLN B 252 8.765 -0.027 5.199 1.00 0.31 H new ATOM 0 HE21 GLN B 252 11.013 2.174 6.830 1.00 1.81 H new ATOM 0 HE22 GLN B 252 11.619 2.884 5.330 1.00 1.81 H new ATOM 1459 N ASP B 253 7.821 -1.118 8.827 1.00 0.26 N ATOM 1460 CA ASP B 253 8.546 -1.622 10.030 1.00 0.30 C ATOM 1461 C ASP B 253 9.972 -1.942 9.600 1.00 0.32 C ATOM 1462 O ASP B 253 10.883 -1.167 9.817 1.00 0.35 O ATOM 1463 CB ASP B 253 7.856 -2.883 10.563 1.00 0.36 C ATOM 1464 CG ASP B 253 8.379 -3.196 11.967 1.00 0.49 C ATOM 1465 OD1 ASP B 253 8.250 -2.341 12.830 1.00 1.18 O ATOM 1466 OD2 ASP B 253 8.901 -4.282 12.156 1.00 1.18 O ATOM 0 H ASP B 253 7.346 -1.831 8.274 1.00 0.26 H new ATOM 0 HA ASP B 253 8.546 -0.876 10.825 1.00 0.30 H new ATOM 0 HB2 ASP B 253 6.776 -2.736 10.590 1.00 0.36 H new ATOM 0 HB3 ASP B 253 8.047 -3.724 9.896 1.00 0.36 H new ATOM 1471 N ASN B 254 10.173 -3.051 8.951 1.00 0.33 N ATOM 1472 CA ASN B 254 11.536 -3.379 8.463 1.00 0.37 C ATOM 1473 C ASN B 254 11.738 -2.588 7.175 1.00 0.34 C ATOM 1474 O ASN B 254 11.372 -1.432 7.092 1.00 0.37 O ATOM 1475 CB ASN B 254 11.634 -4.879 8.172 1.00 0.42 C ATOM 1476 CG ASN B 254 11.087 -5.667 9.364 1.00 1.22 C ATOM 1477 OD1 ASN B 254 10.088 -6.349 9.248 1.00 1.97 O ATOM 1478 ND2 ASN B 254 11.704 -5.601 10.511 1.00 1.89 N ATOM 0 H ASN B 254 9.454 -3.743 8.738 1.00 0.33 H new ATOM 0 HA ASN B 254 12.294 -3.127 9.205 1.00 0.37 H new ATOM 0 HB2 ASN B 254 11.070 -5.123 7.272 1.00 0.42 H new ATOM 0 HB3 ASN B 254 12.671 -5.157 7.984 1.00 0.42 H new ATOM 0 HD21 ASN B 254 11.348 -6.122 11.312 1.00 1.89 H new ATOM 0 HD22 ASN B 254 12.542 -5.028 10.607 1.00 1.89 H new ATOM 1485 N SER B 255 12.277 -3.200 6.157 1.00 0.35 N ATOM 1486 CA SER B 255 12.459 -2.481 4.858 1.00 0.37 C ATOM 1487 C SER B 255 11.347 -2.930 3.911 1.00 0.38 C ATOM 1488 O SER B 255 11.596 -3.420 2.827 1.00 0.43 O ATOM 1489 CB SER B 255 13.821 -2.837 4.259 1.00 0.42 C ATOM 1490 OG SER B 255 14.012 -4.244 4.333 1.00 1.38 O ATOM 0 H SER B 255 12.600 -4.167 6.165 1.00 0.35 H new ATOM 0 HA SER B 255 12.415 -1.403 5.011 1.00 0.37 H new ATOM 0 HB2 SER B 255 13.873 -2.505 3.222 1.00 0.42 H new ATOM 0 HB3 SER B 255 14.615 -2.321 4.799 1.00 0.42 H new ATOM 0 HG SER B 255 14.883 -4.477 3.949 1.00 1.38 H new ATOM 1496 N ASP B 256 10.120 -2.776 4.326 1.00 0.35 N ATOM 1497 CA ASP B 256 8.973 -3.199 3.472 1.00 0.38 C ATOM 1498 C ASP B 256 7.724 -2.419 3.887 1.00 0.34 C ATOM 1499 O ASP B 256 7.321 -2.435 5.034 1.00 0.31 O ATOM 1500 CB ASP B 256 8.723 -4.697 3.656 1.00 0.42 C ATOM 1501 CG ASP B 256 9.801 -5.491 2.914 1.00 0.47 C ATOM 1502 OD1 ASP B 256 10.196 -5.058 1.844 1.00 1.12 O ATOM 1503 OD2 ASP B 256 10.211 -6.518 3.429 1.00 1.12 O ATOM 0 H ASP B 256 9.860 -2.373 5.226 1.00 0.35 H new ATOM 0 HA ASP B 256 9.202 -2.997 2.425 1.00 0.38 H new ATOM 0 HB2 ASP B 256 8.735 -4.951 4.716 1.00 0.42 H new ATOM 0 HB3 ASP B 256 7.736 -4.961 3.276 1.00 0.42 H new ATOM 1508 N ILE B 257 7.113 -1.730 2.963 1.00 0.36 N ATOM 1509 CA ILE B 257 5.890 -0.940 3.291 1.00 0.34 C ATOM 1510 C ILE B 257 4.647 -1.791 3.022 1.00 0.35 C ATOM 1511 O ILE B 257 4.548 -2.457 2.009 1.00 0.39 O ATOM 1512 CB ILE B 257 5.862 0.313 2.416 1.00 0.37 C ATOM 1513 CG1 ILE B 257 7.237 0.985 2.474 1.00 0.37 C ATOM 1514 CG2 ILE B 257 4.795 1.278 2.935 1.00 0.35 C ATOM 1515 CD1 ILE B 257 7.192 2.333 1.749 1.00 0.48 C ATOM 0 H ILE B 257 7.409 -1.679 1.988 1.00 0.36 H new ATOM 0 HA ILE B 257 5.902 -0.651 4.342 1.00 0.34 H new ATOM 0 HB ILE B 257 5.625 0.042 1.387 1.00 0.37 H new ATOM 0 HG12 ILE B 257 7.536 1.131 3.512 1.00 0.37 H new ATOM 0 HG13 ILE B 257 7.986 0.340 2.014 1.00 0.37 H new ATOM 0 HG21 ILE B 257 4.777 2.171 2.310 1.00 0.35 H new ATOM 0 HG22 ILE B 257 3.819 0.793 2.904 1.00 0.35 H new ATOM 0 HG23 ILE B 257 5.027 1.559 3.962 1.00 0.35 H new ATOM 0 HD11 ILE B 257 8.174 2.804 1.795 1.00 0.48 H new ATOM 0 HD12 ILE B 257 6.913 2.177 0.707 1.00 0.48 H new ATOM 0 HD13 ILE B 257 6.457 2.979 2.228 1.00 0.48 H new ATOM 1527 N LYS B 258 3.699 -1.781 3.926 1.00 0.32 N ATOM 1528 CA LYS B 258 2.460 -2.596 3.738 1.00 0.34 C ATOM 1529 C LYS B 258 1.238 -1.791 4.188 1.00 0.30 C ATOM 1530 O LYS B 258 1.361 -0.742 4.791 1.00 0.28 O ATOM 1531 CB LYS B 258 2.569 -3.873 4.580 1.00 0.35 C ATOM 1532 CG LYS B 258 3.534 -4.848 3.902 1.00 0.43 C ATOM 1533 CD LYS B 258 3.758 -6.061 4.808 1.00 0.44 C ATOM 1534 CE LYS B 258 4.586 -7.109 4.063 1.00 1.42 C ATOM 1535 NZ LYS B 258 4.734 -8.324 4.915 1.00 2.13 N ATOM 0 H LYS B 258 3.731 -1.240 4.790 1.00 0.32 H new ATOM 0 HA LYS B 258 2.349 -2.855 2.685 1.00 0.34 H new ATOM 0 HB2 LYS B 258 2.923 -3.632 5.582 1.00 0.35 H new ATOM 0 HB3 LYS B 258 1.587 -4.334 4.691 1.00 0.35 H new ATOM 0 HG2 LYS B 258 3.129 -5.168 2.942 1.00 0.43 H new ATOM 0 HG3 LYS B 258 4.484 -4.353 3.698 1.00 0.43 H new ATOM 0 HD2 LYS B 258 4.272 -5.757 5.720 1.00 0.44 H new ATOM 0 HD3 LYS B 258 2.800 -6.485 5.109 1.00 0.44 H new ATOM 0 HE2 LYS B 258 4.102 -7.369 3.122 1.00 1.42 H new ATOM 0 HE3 LYS B 258 5.567 -6.704 3.815 1.00 1.42 H new ATOM 0 HZ1 LYS B 258 5.297 -9.037 4.408 1.00 2.13 H new ATOM 0 HZ2 LYS B 258 5.214 -8.070 5.802 1.00 2.13 H new ATOM 0 HZ3 LYS B 258 3.794 -8.714 5.130 1.00 2.13 H new ATOM 1549 N VAL B 259 0.056 -2.278 3.900 1.00 0.31 N ATOM 1550 CA VAL B 259 -1.189 -1.552 4.307 1.00 0.29 C ATOM 1551 C VAL B 259 -1.775 -2.206 5.561 1.00 0.28 C ATOM 1552 O VAL B 259 -1.778 -3.414 5.698 1.00 0.31 O ATOM 1553 CB VAL B 259 -2.216 -1.622 3.169 1.00 0.30 C ATOM 1554 CG1 VAL B 259 -3.274 -0.533 3.358 1.00 0.29 C ATOM 1555 CG2 VAL B 259 -1.506 -1.413 1.832 1.00 0.34 C ATOM 0 H VAL B 259 -0.101 -3.152 3.398 1.00 0.31 H new ATOM 0 HA VAL B 259 -0.949 -0.510 4.518 1.00 0.29 H new ATOM 0 HB VAL B 259 -2.699 -2.599 3.180 1.00 0.30 H new ATOM 0 HG11 VAL B 259 -4.001 -0.587 2.547 1.00 0.29 H new ATOM 0 HG12 VAL B 259 -3.782 -0.681 4.311 1.00 0.29 H new ATOM 0 HG13 VAL B 259 -2.794 0.446 3.350 1.00 0.29 H new ATOM 0 HG21 VAL B 259 -2.234 -1.462 1.022 1.00 0.34 H new ATOM 0 HG22 VAL B 259 -1.022 -0.436 1.826 1.00 0.34 H new ATOM 0 HG23 VAL B 259 -0.755 -2.191 1.693 1.00 0.34 H new ATOM 1565 N VAL B 260 -2.281 -1.411 6.472 1.00 0.26 N ATOM 1566 CA VAL B 260 -2.882 -1.963 7.724 1.00 0.27 C ATOM 1567 C VAL B 260 -4.209 -1.221 8.005 1.00 0.25 C ATOM 1568 O VAL B 260 -4.210 -0.006 8.030 1.00 0.22 O ATOM 1569 CB VAL B 260 -1.914 -1.710 8.886 1.00 0.28 C ATOM 1570 CG1 VAL B 260 -2.534 -2.202 10.197 1.00 0.34 C ATOM 1571 CG2 VAL B 260 -0.608 -2.464 8.631 1.00 0.29 C ATOM 0 H VAL B 260 -2.303 -0.394 6.400 1.00 0.26 H new ATOM 0 HA VAL B 260 -3.067 -3.032 7.617 1.00 0.27 H new ATOM 0 HB VAL B 260 -1.715 -0.641 8.961 1.00 0.28 H new ATOM 0 HG11 VAL B 260 -1.841 -2.019 11.018 1.00 0.34 H new ATOM 0 HG12 VAL B 260 -3.465 -1.667 10.382 1.00 0.34 H new ATOM 0 HG13 VAL B 260 -2.737 -3.270 10.125 1.00 0.34 H new ATOM 0 HG21 VAL B 260 0.082 -2.286 9.456 1.00 0.29 H new ATOM 0 HG22 VAL B 260 -0.813 -3.532 8.554 1.00 0.29 H new ATOM 0 HG23 VAL B 260 -0.161 -2.113 7.701 1.00 0.29 H new ATOM 1581 N PRO B 261 -5.311 -1.930 8.224 1.00 0.29 N ATOM 1582 CA PRO B 261 -6.587 -1.252 8.512 1.00 0.29 C ATOM 1583 C PRO B 261 -6.424 -0.360 9.749 1.00 0.24 C ATOM 1584 O PRO B 261 -5.663 -0.660 10.647 1.00 0.23 O ATOM 1585 CB PRO B 261 -7.605 -2.387 8.768 1.00 0.37 C ATOM 1586 CG PRO B 261 -6.870 -3.734 8.519 1.00 0.42 C ATOM 1587 CD PRO B 261 -5.393 -3.410 8.198 1.00 0.36 C ATOM 0 HA PRO B 261 -6.917 -0.608 7.696 1.00 0.29 H new ATOM 0 HB2 PRO B 261 -7.984 -2.340 9.789 1.00 0.37 H new ATOM 0 HB3 PRO B 261 -8.464 -2.290 8.104 1.00 0.37 H new ATOM 0 HG2 PRO B 261 -6.939 -4.375 9.398 1.00 0.42 H new ATOM 0 HG3 PRO B 261 -7.331 -4.275 7.693 1.00 0.42 H new ATOM 0 HD2 PRO B 261 -4.722 -3.855 8.933 1.00 0.36 H new ATOM 0 HD3 PRO B 261 -5.105 -3.804 7.223 1.00 0.36 H new ATOM 1595 N ARG B 262 -7.139 0.727 9.805 1.00 0.26 N ATOM 1596 CA ARG B 262 -7.030 1.633 10.981 1.00 0.27 C ATOM 1597 C ARG B 262 -7.602 0.934 12.220 1.00 0.29 C ATOM 1598 O ARG B 262 -7.192 1.188 13.335 1.00 0.34 O ATOM 1599 CB ARG B 262 -7.826 2.913 10.702 1.00 0.34 C ATOM 1600 CG ARG B 262 -7.890 3.766 11.972 1.00 0.59 C ATOM 1601 CD ARG B 262 -8.332 5.187 11.619 1.00 1.04 C ATOM 1602 NE ARG B 262 -8.263 6.042 12.838 1.00 1.76 N ATOM 1603 CZ ARG B 262 -8.305 7.342 12.729 1.00 2.19 C ATOM 1604 NH1 ARG B 262 -8.386 7.897 11.550 1.00 2.31 N ATOM 1605 NH2 ARG B 262 -8.260 8.087 13.800 1.00 3.11 N ATOM 0 H ARG B 262 -7.796 1.028 9.085 1.00 0.26 H new ATOM 0 HA ARG B 262 -5.984 1.882 11.159 1.00 0.27 H new ATOM 0 HB2 ARG B 262 -7.356 3.477 9.896 1.00 0.34 H new ATOM 0 HB3 ARG B 262 -8.833 2.662 10.370 1.00 0.34 H new ATOM 0 HG2 ARG B 262 -8.588 3.324 12.683 1.00 0.59 H new ATOM 0 HG3 ARG B 262 -6.913 3.789 12.456 1.00 0.59 H new ATOM 0 HD2 ARG B 262 -7.691 5.596 10.838 1.00 1.04 H new ATOM 0 HD3 ARG B 262 -9.348 5.177 11.225 1.00 1.04 H new ATOM 0 HE ARG B 262 -8.183 5.611 13.759 1.00 1.76 H new ATOM 0 HH11 ARG B 262 -8.417 7.315 10.713 1.00 2.31 H new ATOM 0 HH12 ARG B 262 -8.419 8.913 11.466 1.00 2.31 H new ATOM 0 HH21 ARG B 262 -8.192 7.653 14.721 1.00 3.11 H new ATOM 0 HH22 ARG B 262 -8.293 9.103 13.716 1.00 3.11 H new ATOM 1619 N ARG B 263 -8.564 0.075 12.029 1.00 0.33 N ATOM 1620 CA ARG B 263 -9.187 -0.630 13.187 1.00 0.39 C ATOM 1621 C ARG B 263 -8.226 -1.668 13.781 1.00 0.39 C ATOM 1622 O ARG B 263 -8.493 -2.230 14.826 1.00 0.48 O ATOM 1623 CB ARG B 263 -10.476 -1.314 12.723 1.00 0.47 C ATOM 1624 CG ARG B 263 -11.348 -0.295 11.979 1.00 1.31 C ATOM 1625 CD ARG B 263 -12.786 -0.816 11.879 1.00 1.59 C ATOM 1626 NE ARG B 263 -12.763 -2.286 11.646 1.00 2.29 N ATOM 1627 CZ ARG B 263 -13.857 -2.985 11.783 1.00 2.90 C ATOM 1628 NH1 ARG B 263 -14.976 -2.393 12.100 1.00 3.06 N ATOM 1629 NH2 ARG B 263 -13.832 -4.276 11.597 1.00 3.82 N ATOM 0 H ARG B 263 -8.948 -0.171 11.117 1.00 0.33 H new ATOM 0 HA ARG B 263 -9.414 0.100 13.964 1.00 0.39 H new ATOM 0 HB2 ARG B 263 -10.241 -2.155 12.070 1.00 0.47 H new ATOM 0 HB3 ARG B 263 -11.017 -1.717 13.579 1.00 0.47 H new ATOM 0 HG2 ARG B 263 -11.334 0.661 12.503 1.00 1.31 H new ATOM 0 HG3 ARG B 263 -10.946 -0.118 10.982 1.00 1.31 H new ATOM 0 HD2 ARG B 263 -13.331 -0.590 12.796 1.00 1.59 H new ATOM 0 HD3 ARG B 263 -13.310 -0.316 11.065 1.00 1.59 H new ATOM 0 HE ARG B 263 -11.893 -2.747 11.379 1.00 2.29 H new ATOM 0 HH11 ARG B 263 -14.997 -1.383 12.241 1.00 3.06 H new ATOM 0 HH12 ARG B 263 -15.830 -2.940 12.207 1.00 3.06 H new ATOM 0 HH21 ARG B 263 -12.958 -4.738 11.345 1.00 3.82 H new ATOM 0 HH22 ARG B 263 -14.686 -4.823 11.704 1.00 3.82 H new ATOM 1643 N LYS B 264 -7.110 -1.924 13.137 1.00 0.35 N ATOM 1644 CA LYS B 264 -6.125 -2.924 13.677 1.00 0.42 C ATOM 1645 C LYS B 264 -4.795 -2.219 13.947 1.00 0.35 C ATOM 1646 O LYS B 264 -3.745 -2.834 13.990 1.00 0.38 O ATOM 1647 CB LYS B 264 -5.911 -4.051 12.658 1.00 0.53 C ATOM 1648 CG LYS B 264 -7.218 -4.834 12.469 1.00 0.85 C ATOM 1649 CD LYS B 264 -6.919 -6.208 11.864 1.00 0.95 C ATOM 1650 CE LYS B 264 -8.234 -6.948 11.609 1.00 1.28 C ATOM 1651 NZ LYS B 264 -8.968 -6.282 10.496 1.00 2.08 N ATOM 0 H LYS B 264 -6.837 -1.484 12.259 1.00 0.35 H new ATOM 0 HA LYS B 264 -6.512 -3.352 14.602 1.00 0.42 H new ATOM 0 HB2 LYS B 264 -5.584 -3.635 11.705 1.00 0.53 H new ATOM 0 HB3 LYS B 264 -5.122 -4.720 13.002 1.00 0.53 H new ATOM 0 HG2 LYS B 264 -7.724 -4.951 13.427 1.00 0.85 H new ATOM 0 HG3 LYS B 264 -7.894 -4.279 11.818 1.00 0.85 H new ATOM 0 HD2 LYS B 264 -6.366 -6.095 10.932 1.00 0.95 H new ATOM 0 HD3 LYS B 264 -6.289 -6.786 12.540 1.00 0.95 H new ATOM 0 HE2 LYS B 264 -8.035 -7.990 11.356 1.00 1.28 H new ATOM 0 HE3 LYS B 264 -8.844 -6.950 12.512 1.00 1.28 H new ATOM 0 HZ1 LYS B 264 -9.675 -6.937 10.106 1.00 2.08 H new ATOM 0 HZ2 LYS B 264 -9.445 -5.431 10.855 1.00 2.08 H new ATOM 0 HZ3 LYS B 264 -8.296 -6.013 9.749 1.00 2.08 H new ATOM 1665 N ALA B 265 -4.843 -0.925 14.136 1.00 0.30 N ATOM 1666 CA ALA B 265 -3.598 -0.147 14.409 1.00 0.27 C ATOM 1667 C ALA B 265 -3.892 0.909 15.479 1.00 0.28 C ATOM 1668 O ALA B 265 -5.032 1.167 15.809 1.00 0.32 O ATOM 1669 CB ALA B 265 -3.143 0.548 13.121 1.00 0.26 C ATOM 0 H ALA B 265 -5.699 -0.370 14.113 1.00 0.30 H new ATOM 0 HA ALA B 265 -2.813 -0.817 14.759 1.00 0.27 H new ATOM 0 HB1 ALA B 265 -2.234 1.117 13.316 1.00 0.26 H new ATOM 0 HB2 ALA B 265 -2.945 -0.201 12.354 1.00 0.26 H new ATOM 0 HB3 ALA B 265 -3.926 1.223 12.775 1.00 0.26 H new ATOM 1675 N LYS B 266 -2.871 1.526 16.017 1.00 0.26 N ATOM 1676 CA LYS B 266 -3.081 2.573 17.067 1.00 0.29 C ATOM 1677 C LYS B 266 -2.111 3.728 16.823 1.00 0.27 C ATOM 1678 O LYS B 266 -0.924 3.526 16.657 1.00 0.25 O ATOM 1679 CB LYS B 266 -2.811 1.979 18.452 1.00 0.34 C ATOM 1680 CG LYS B 266 -3.781 0.826 18.721 1.00 0.42 C ATOM 1681 CD LYS B 266 -3.775 0.483 20.217 1.00 0.50 C ATOM 1682 CE LYS B 266 -2.333 0.303 20.713 1.00 1.09 C ATOM 1683 NZ LYS B 266 -2.336 -0.505 21.965 1.00 1.79 N ATOM 0 H LYS B 266 -1.896 1.350 15.774 1.00 0.26 H new ATOM 0 HA LYS B 266 -4.109 2.931 17.020 1.00 0.29 H new ATOM 0 HB2 LYS B 266 -1.783 1.622 18.510 1.00 0.34 H new ATOM 0 HB3 LYS B 266 -2.925 2.748 19.216 1.00 0.34 H new ATOM 0 HG2 LYS B 266 -4.787 1.103 18.406 1.00 0.42 H new ATOM 0 HG3 LYS B 266 -3.493 -0.048 18.137 1.00 0.42 H new ATOM 0 HD2 LYS B 266 -4.265 1.276 20.782 1.00 0.50 H new ATOM 0 HD3 LYS B 266 -4.344 -0.430 20.391 1.00 0.50 H new ATOM 0 HE2 LYS B 266 -1.733 -0.192 19.949 1.00 1.09 H new ATOM 0 HE3 LYS B 266 -1.876 1.275 20.896 1.00 1.09 H new ATOM 0 HZ1 LYS B 266 -1.360 -0.627 22.302 1.00 1.79 H new ATOM 0 HZ2 LYS B 266 -2.894 -0.015 22.693 1.00 1.79 H new ATOM 0 HZ3 LYS B 266 -2.756 -1.437 21.776 1.00 1.79 H new ATOM 1697 N ILE B 267 -2.606 4.937 16.797 1.00 0.30 N ATOM 1698 CA ILE B 267 -1.715 6.113 16.565 1.00 0.32 C ATOM 1699 C ILE B 267 -1.184 6.622 17.907 1.00 0.37 C ATOM 1700 O ILE B 267 -1.908 7.210 18.687 1.00 0.41 O ATOM 1701 CB ILE B 267 -2.514 7.227 15.873 1.00 0.36 C ATOM 1702 CG1 ILE B 267 -3.275 6.636 14.672 1.00 0.36 C ATOM 1703 CG2 ILE B 267 -1.569 8.364 15.414 1.00 0.39 C ATOM 1704 CD1 ILE B 267 -2.311 5.899 13.734 1.00 0.45 C ATOM 0 H ILE B 267 -3.592 5.162 16.927 1.00 0.30 H new ATOM 0 HA ILE B 267 -0.878 5.819 15.932 1.00 0.32 H new ATOM 0 HB ILE B 267 -3.231 7.649 16.578 1.00 0.36 H new ATOM 0 HG12 ILE B 267 -4.045 5.949 15.024 1.00 0.36 H new ATOM 0 HG13 ILE B 267 -3.783 7.433 14.128 1.00 0.36 H new ATOM 0 HG21 ILE B 267 -2.151 9.146 14.925 1.00 0.39 H new ATOM 0 HG22 ILE B 267 -1.055 8.782 16.280 1.00 0.39 H new ATOM 0 HG23 ILE B 267 -0.835 7.966 14.713 1.00 0.39 H new ATOM 0 HD11 ILE B 267 -2.867 5.488 12.891 1.00 0.45 H new ATOM 0 HD12 ILE B 267 -1.557 6.595 13.367 1.00 0.45 H new ATOM 0 HD13 ILE B 267 -1.823 5.089 14.277 1.00 0.45 H new ATOM 1716 N ILE B 268 0.079 6.407 18.180 1.00 0.38 N ATOM 1717 CA ILE B 268 0.673 6.883 19.470 1.00 0.45 C ATOM 1718 C ILE B 268 1.473 8.157 19.200 1.00 0.48 C ATOM 1719 O ILE B 268 1.918 8.399 18.096 1.00 0.47 O ATOM 1720 CB ILE B 268 1.625 5.819 20.044 1.00 0.48 C ATOM 1721 CG1 ILE B 268 0.954 4.429 20.060 1.00 0.50 C ATOM 1722 CG2 ILE B 268 2.047 6.212 21.464 1.00 0.55 C ATOM 1723 CD1 ILE B 268 -0.050 4.309 21.219 1.00 0.57 C ATOM 0 H ILE B 268 0.728 5.920 17.562 1.00 0.38 H new ATOM 0 HA ILE B 268 -0.128 7.072 20.185 1.00 0.45 H new ATOM 0 HB ILE B 268 2.507 5.765 19.405 1.00 0.48 H new ATOM 0 HG12 ILE B 268 0.442 4.259 19.113 1.00 0.50 H new ATOM 0 HG13 ILE B 268 1.716 3.655 20.154 1.00 0.50 H new ATOM 0 HG21 ILE B 268 2.721 5.455 21.866 1.00 0.55 H new ATOM 0 HG22 ILE B 268 2.557 7.175 21.439 1.00 0.55 H new ATOM 0 HG23 ILE B 268 1.164 6.285 22.099 1.00 0.55 H new ATOM 0 HD11 ILE B 268 -0.506 3.319 21.204 1.00 0.57 H new ATOM 0 HD12 ILE B 268 0.469 4.455 22.166 1.00 0.57 H new ATOM 0 HD13 ILE B 268 -0.825 5.068 21.109 1.00 0.57 H new ATOM 1735 N ARG B 269 1.659 8.971 20.200 1.00 0.56 N ATOM 1736 CA ARG B 269 2.437 10.233 20.015 1.00 0.62 C ATOM 1737 C ARG B 269 3.895 9.986 20.404 1.00 0.66 C ATOM 1738 O ARG B 269 4.181 9.375 21.415 1.00 0.73 O ATOM 1739 CB ARG B 269 1.838 11.328 20.903 1.00 0.73 C ATOM 1740 CG ARG B 269 0.311 11.286 20.792 1.00 1.49 C ATOM 1741 CD ARG B 269 -0.286 12.554 21.405 1.00 1.80 C ATOM 1742 NE ARG B 269 -1.773 12.491 21.320 1.00 2.22 N ATOM 1743 CZ ARG B 269 -2.504 13.303 22.032 1.00 2.82 C ATOM 1744 NH1 ARG B 269 -1.932 14.173 22.820 1.00 3.12 N ATOM 1745 NH2 ARG B 269 -3.806 13.246 21.959 1.00 3.62 N ATOM 0 H ARG B 269 1.305 8.818 21.144 1.00 0.56 H new ATOM 0 HA ARG B 269 2.392 10.550 18.973 1.00 0.62 H new ATOM 0 HB2 ARG B 269 2.144 11.181 21.939 1.00 0.73 H new ATOM 0 HB3 ARG B 269 2.210 12.306 20.597 1.00 0.73 H new ATOM 0 HG2 ARG B 269 0.015 11.202 19.746 1.00 1.49 H new ATOM 0 HG3 ARG B 269 -0.076 10.406 21.305 1.00 1.49 H new ATOM 0 HD2 ARG B 269 0.026 12.651 22.445 1.00 1.80 H new ATOM 0 HD3 ARG B 269 0.083 13.434 20.878 1.00 1.80 H new ATOM 0 HE ARG B 269 -2.219 11.812 20.704 1.00 2.22 H new ATOM 0 HH11 ARG B 269 -0.915 14.217 22.878 1.00 3.12 H new ATOM 0 HH12 ARG B 269 -2.503 14.809 23.377 1.00 3.12 H new ATOM 0 HH21 ARG B 269 -4.253 12.566 21.344 1.00 3.62 H new ATOM 0 HH22 ARG B 269 -4.376 13.882 22.517 1.00 3.62 H new ATOM 1759 N ASP B 270 4.823 10.453 19.615 1.00 0.67 N ATOM 1760 CA ASP B 270 6.263 10.240 19.945 1.00 0.74 C ATOM 1761 C ASP B 270 6.749 11.362 20.865 1.00 1.18 C ATOM 1762 O ASP B 270 6.682 12.508 20.453 1.00 1.73 O ATOM 1763 CB ASP B 270 7.086 10.251 18.656 1.00 0.90 C ATOM 1764 CG ASP B 270 6.732 9.029 17.810 1.00 1.47 C ATOM 1765 OD1 ASP B 270 5.873 8.270 18.230 1.00 2.05 O ATOM 1766 OD2 ASP B 270 7.323 8.873 16.754 1.00 2.04 O ATOM 1767 OXT ASP B 270 7.179 11.055 21.964 1.00 1.84 O ATOM 0 H ASP B 270 4.648 10.973 18.755 1.00 0.67 H new ATOM 0 HA ASP B 270 6.381 9.280 20.448 1.00 0.74 H new ATOM 0 HB2 ASP B 270 6.888 11.164 18.094 1.00 0.90 H new ATOM 0 HB3 ASP B 270 8.150 10.246 18.892 1.00 0.90 H new TER 1772 ASP B 270