USER MOD reduce.3.24.130724 H: found=0, std=0, add=1327, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1324 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 151 GLN : amide:sc= 0.598 K(o=0.5,f=-0.37) USER MOD Set 1.2: A 155 GLN : amide:sc= -0.0945 X(o=0.5,f=0.6) USER MOD Set 2.1: A 120 THR OG1 : rot -55:sc= 1.73 USER MOD Set 2.2: A 134 SER OG : rot 180:sc= 1.05 USER MOD Set 3.1: A 92 HIS : no HE2:sc= 0.251 K(o=-1.2,f=-11!) USER MOD Set 3.2: A 94 MET CE :methyl 165:sc= -1.09 (180deg=-1.77) USER MOD Set 3.3: A 121 GLN : amide:sc= -0.407 X(o=-1.2,f=-1.6) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= 0.203 X(o=0.2,f=-0.0054) USER MOD Single : A 20 MET CE :methyl -178:sc= -0.696 (180deg=-0.722) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.35 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 HIS : no HE2:sc= 0.66 K(o=0.66,f=-2.5!) USER MOD Single : A 33 GLN : amide:sc= 0.654 K(o=0.65,f=-0.036) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 TYR OH : rot 30:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot 177:sc= -0.0265 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 45 CYS SG : rot -33:sc= -0.0542 USER MOD Single : A 48 HIS : no HD1:sc= -0.0969 X(o=-0.097,f=-0.37) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0818) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot -144:sc= 1.31 USER MOD Single : A 62 ASN : amide:sc= 0 X(o=0,f=-0.22) USER MOD Single : A 63 TYR OH : rot 180:sc=-0.00151 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= 0.401 USER MOD Single : A 72 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 ASN : amide:sc= 0.539 K(o=0.54,f=-8.2!) USER MOD Single : A 87 ASN : amide:sc= -0.127 K(o=-0.13,f=-1.6!) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 104 GLN : amide:sc= 1.04 K(o=1,f=0) USER MOD Single : A 113 HIS : no HE2:sc=-0.00826 K(o=-0.0083,f=-3.5!) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 124 MET CE :methyl -175:sc= 0 (180deg=-0.0247) USER MOD Single : A 136 SER OG : rot -127:sc= 1.24 USER MOD Single : A 138 CYS SG : rot 12:sc= 1.04 USER MOD Single : A 139 SER OG : rot 180:sc= 0.0521 USER MOD Single : A 147 SER OG : rot 73:sc= 0.503 USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 MET CE :methyl -164:sc= -0.668 (180deg=-0.956) USER MOD Single : A 161 SER OG : rot -80:sc= -0.0329 USER MOD Single : A 163 MET CE :methyl -177:sc= -1.42 (180deg=-1.46) USER MOD Single : A 166 MET CE :methyl -152:sc= -0.241 (180deg=-1.25) USER MOD Single : A 169 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 128 N TRP A 9 -3.528 18.064 10.001 1.00 1.28 N ATOM 129 CA TRP A 9 -3.864 17.239 8.832 1.00 1.26 C ATOM 130 C TRP A 9 -4.120 15.805 9.283 1.00 1.23 C ATOM 131 O TRP A 9 -5.148 15.226 8.948 1.00 1.20 O ATOM 132 CB TRP A 9 -2.724 17.297 7.799 1.00 1.36 C ATOM 133 CG TRP A 9 -2.929 16.596 6.487 1.00 1.38 C ATOM 134 CD1 TRP A 9 -3.152 15.274 6.306 1.00 1.99 C ATOM 135 CD2 TRP A 9 -2.854 17.165 5.138 1.00 1.85 C ATOM 136 NE1 TRP A 9 -3.271 14.994 4.959 1.00 1.71 N ATOM 137 CE2 TRP A 9 -3.081 16.121 4.190 1.00 1.63 C ATOM 138 CE3 TRP A 9 -2.592 18.453 4.618 1.00 3.16 C ATOM 139 CZ2 TRP A 9 -3.064 16.345 2.805 1.00 2.34 C ATOM 140 CZ3 TRP A 9 -2.566 18.688 3.229 1.00 4.16 C ATOM 141 CH2 TRP A 9 -2.805 17.638 2.323 1.00 3.70 C ATOM 0 HA TRP A 9 -4.767 17.624 8.358 1.00 1.26 H new ATOM 0 HB2 TRP A 9 -2.516 18.346 7.589 1.00 1.36 H new ATOM 0 HB3 TRP A 9 -1.830 16.882 8.264 1.00 1.36 H new ATOM 0 HD1 TRP A 9 -3.226 14.544 7.099 1.00 1.99 H new ATOM 0 HE1 TRP A 9 -3.474 14.069 4.581 1.00 1.71 H new ATOM 0 HE3 TRP A 9 -2.408 19.272 5.298 1.00 3.16 H new ATOM 0 HZ2 TRP A 9 -3.248 15.532 2.118 1.00 2.34 H new ATOM 0 HZ3 TRP A 9 -2.361 19.681 2.857 1.00 4.16 H new ATOM 0 HH2 TRP A 9 -2.789 17.826 1.260 1.00 3.70 H new ATOM 152 N ARG A 10 -3.224 15.257 10.111 1.00 1.27 N ATOM 153 CA ARG A 10 -3.332 13.907 10.670 1.00 1.26 C ATOM 154 C ARG A 10 -4.586 13.782 11.546 1.00 1.21 C ATOM 155 O ARG A 10 -5.338 12.824 11.410 1.00 1.20 O ATOM 156 CB ARG A 10 -2.021 13.589 11.416 1.00 1.29 C ATOM 157 CG ARG A 10 -1.913 12.130 11.874 1.00 1.37 C ATOM 158 CD ARG A 10 -2.328 11.857 13.322 1.00 2.55 C ATOM 159 NE ARG A 10 -1.277 12.285 14.263 1.00 2.10 N ATOM 160 CZ ARG A 10 -1.251 12.043 15.568 1.00 2.97 C ATOM 161 NH1 ARG A 10 -2.250 11.448 16.187 1.00 4.45 N ATOM 162 NH2 ARG A 10 -0.199 12.396 16.274 1.00 3.32 N ATOM 0 H ARG A 10 -2.386 15.751 10.417 1.00 1.27 H new ATOM 0 HA ARG A 10 -3.457 13.165 9.882 1.00 1.26 H new ATOM 0 HB2 ARG A 10 -1.178 13.820 10.765 1.00 1.29 H new ATOM 0 HB3 ARG A 10 -1.941 14.241 12.286 1.00 1.29 H new ATOM 0 HG2 ARG A 10 -2.528 11.516 11.217 1.00 1.37 H new ATOM 0 HG3 ARG A 10 -0.882 11.803 11.743 1.00 1.37 H new ATOM 0 HD2 ARG A 10 -3.256 12.384 13.544 1.00 2.55 H new ATOM 0 HD3 ARG A 10 -2.527 10.793 13.453 1.00 2.55 H new ATOM 0 HE ARG A 10 -0.497 12.816 13.875 1.00 2.10 H new ATOM 0 HH11 ARG A 10 -3.075 11.158 15.662 1.00 4.45 H new ATOM 0 HH12 ARG A 10 -2.198 11.277 17.191 1.00 4.45 H new ATOM 0 HH21 ARG A 10 0.591 12.853 15.818 1.00 3.32 H new ATOM 0 HH22 ARG A 10 -0.173 12.213 17.277 1.00 3.32 H new ATOM 176 N ARG A 11 -4.882 14.791 12.371 1.00 1.21 N ATOM 177 CA ARG A 11 -6.100 14.865 13.191 1.00 1.20 C ATOM 178 C ARG A 11 -7.377 14.879 12.334 1.00 1.15 C ATOM 179 O ARG A 11 -8.298 14.103 12.597 1.00 1.16 O ATOM 180 CB ARG A 11 -6.001 16.090 14.121 1.00 1.25 C ATOM 181 CG ARG A 11 -7.229 16.207 15.029 1.00 1.54 C ATOM 182 CD ARG A 11 -7.045 17.234 16.153 1.00 1.87 C ATOM 183 NE ARG A 11 -8.279 17.384 16.949 1.00 2.17 N ATOM 184 CZ ARG A 11 -8.791 16.516 17.818 1.00 3.30 C ATOM 185 NH1 ARG A 11 -8.203 15.375 18.114 1.00 4.66 N ATOM 186 NH2 ARG A 11 -9.932 16.792 18.412 1.00 3.55 N ATOM 0 H ARG A 11 -4.270 15.598 12.492 1.00 1.21 H new ATOM 0 HA ARG A 11 -6.174 13.965 13.802 1.00 1.20 H new ATOM 0 HB2 ARG A 11 -5.102 16.012 14.732 1.00 1.25 H new ATOM 0 HB3 ARG A 11 -5.902 16.995 13.522 1.00 1.25 H new ATOM 0 HG2 ARG A 11 -8.094 16.486 14.427 1.00 1.54 H new ATOM 0 HG3 ARG A 11 -7.445 15.232 15.466 1.00 1.54 H new ATOM 0 HD2 ARG A 11 -6.226 16.923 16.802 1.00 1.87 H new ATOM 0 HD3 ARG A 11 -6.765 18.197 15.726 1.00 1.87 H new ATOM 0 HE ARG A 11 -8.798 18.252 16.818 1.00 2.17 H new ATOM 0 HH11 ARG A 11 -7.319 15.127 17.671 1.00 4.66 H new ATOM 0 HH12 ARG A 11 -8.632 14.740 18.787 1.00 4.66 H new ATOM 0 HH21 ARG A 11 -10.417 17.665 18.205 1.00 3.55 H new ATOM 0 HH22 ARG A 11 -10.332 16.133 19.080 1.00 3.55 H new ATOM 200 N THR A 12 -7.408 15.702 11.277 1.00 1.12 N ATOM 201 CA THR A 12 -8.520 15.802 10.309 1.00 1.09 C ATOM 202 C THR A 12 -8.714 14.481 9.576 1.00 1.07 C ATOM 203 O THR A 12 -9.834 13.997 9.460 1.00 1.07 O ATOM 204 CB THR A 12 -8.260 16.948 9.319 1.00 1.09 C ATOM 205 OG1 THR A 12 -8.192 18.159 10.039 1.00 1.10 O ATOM 206 CG2 THR A 12 -9.369 17.083 8.274 1.00 1.09 C ATOM 0 H THR A 12 -6.640 16.337 11.061 1.00 1.12 H new ATOM 0 HA THR A 12 -9.439 16.021 10.853 1.00 1.09 H new ATOM 0 HB THR A 12 -7.328 16.727 8.799 1.00 1.09 H new ATOM 0 HG1 THR A 12 -8.025 18.899 9.419 1.00 1.10 H new ATOM 0 HG21 THR A 12 -9.135 17.907 7.600 1.00 1.09 H new ATOM 0 HG22 THR A 12 -9.445 16.158 7.703 1.00 1.09 H new ATOM 0 HG23 THR A 12 -10.317 17.280 8.773 1.00 1.09 H new ATOM 214 N MET A 13 -7.619 13.870 9.128 1.00 1.05 N ATOM 215 CA MET A 13 -7.604 12.573 8.452 1.00 1.00 C ATOM 216 C MET A 13 -8.098 11.457 9.366 1.00 1.07 C ATOM 217 O MET A 13 -8.938 10.672 8.944 1.00 1.08 O ATOM 218 CB MET A 13 -6.194 12.302 7.900 1.00 0.92 C ATOM 219 CG MET A 13 -5.947 13.128 6.629 1.00 0.97 C ATOM 220 SD MET A 13 -7.041 12.752 5.230 1.00 1.76 S ATOM 221 CE MET A 13 -7.195 14.415 4.527 1.00 1.94 C ATOM 0 H MET A 13 -6.689 14.276 9.228 1.00 1.05 H new ATOM 0 HA MET A 13 -8.299 12.599 7.613 1.00 1.00 H new ATOM 0 HB2 MET A 13 -5.448 12.552 8.654 1.00 0.92 H new ATOM 0 HB3 MET A 13 -6.081 11.241 7.679 1.00 0.92 H new ATOM 0 HG2 MET A 13 -6.052 14.184 6.877 1.00 0.97 H new ATOM 0 HG3 MET A 13 -4.915 12.976 6.312 1.00 0.97 H new ATOM 0 HE1 MET A 13 -7.839 14.380 3.648 1.00 1.94 H new ATOM 0 HE2 MET A 13 -7.629 15.085 5.269 1.00 1.94 H new ATOM 0 HE3 MET A 13 -6.209 14.781 4.240 1.00 1.94 H new ATOM 231 N LEU A 14 -7.677 11.415 10.630 1.00 1.15 N ATOM 232 CA LEU A 14 -8.143 10.428 11.608 1.00 1.27 C ATOM 233 C LEU A 14 -9.654 10.557 11.867 1.00 1.24 C ATOM 234 O LEU A 14 -10.359 9.548 11.923 1.00 1.29 O ATOM 235 CB LEU A 14 -7.282 10.578 12.875 1.00 1.38 C ATOM 236 CG LEU A 14 -7.512 9.533 13.984 1.00 2.27 C ATOM 237 CD1 LEU A 14 -7.604 8.094 13.461 1.00 3.87 C ATOM 238 CD2 LEU A 14 -6.343 9.612 14.981 1.00 1.86 C ATOM 0 H LEU A 14 -6.995 12.072 11.009 1.00 1.15 H new ATOM 0 HA LEU A 14 -8.019 9.415 11.224 1.00 1.27 H new ATOM 0 HB2 LEU A 14 -6.233 10.541 12.582 1.00 1.38 H new ATOM 0 HB3 LEU A 14 -7.461 11.568 13.295 1.00 1.38 H new ATOM 0 HG LEU A 14 -8.469 9.768 14.449 1.00 2.27 H new ATOM 0 HD11 LEU A 14 -7.766 7.413 14.296 1.00 3.87 H new ATOM 0 HD12 LEU A 14 -8.435 8.014 12.761 1.00 3.87 H new ATOM 0 HD13 LEU A 14 -6.676 7.831 12.954 1.00 3.87 H new ATOM 0 HD21 LEU A 14 -6.490 8.878 15.773 1.00 1.86 H new ATOM 0 HD22 LEU A 14 -5.407 9.403 14.462 1.00 1.86 H new ATOM 0 HD23 LEU A 14 -6.302 10.611 15.415 1.00 1.86 H new ATOM 250 N LEU A 15 -10.178 11.785 11.934 1.00 1.19 N ATOM 251 CA LEU A 15 -11.611 12.059 12.076 1.00 1.18 C ATOM 252 C LEU A 15 -12.388 11.634 10.810 1.00 1.14 C ATOM 253 O LEU A 15 -13.436 10.995 10.919 1.00 1.19 O ATOM 254 CB LEU A 15 -11.746 13.552 12.462 1.00 1.14 C ATOM 255 CG LEU A 15 -13.000 13.992 13.244 1.00 1.15 C ATOM 256 CD1 LEU A 15 -14.268 13.915 12.396 1.00 1.19 C ATOM 257 CD2 LEU A 15 -13.195 13.206 14.549 1.00 1.20 C ATOM 0 H LEU A 15 -9.609 12.630 11.890 1.00 1.19 H new ATOM 0 HA LEU A 15 -12.070 11.464 12.866 1.00 1.18 H new ATOM 0 HB2 LEU A 15 -10.872 13.823 13.054 1.00 1.14 H new ATOM 0 HB3 LEU A 15 -11.703 14.138 11.544 1.00 1.14 H new ATOM 0 HG LEU A 15 -12.823 15.035 13.506 1.00 1.15 H new ATOM 0 HD11 LEU A 15 -15.124 14.235 12.991 1.00 1.19 H new ATOM 0 HD12 LEU A 15 -14.166 14.567 11.528 1.00 1.19 H new ATOM 0 HD13 LEU A 15 -14.421 12.889 12.063 1.00 1.19 H new ATOM 0 HD21 LEU A 15 -14.093 13.559 15.056 1.00 1.20 H new ATOM 0 HD22 LEU A 15 -13.300 12.145 14.322 1.00 1.20 H new ATOM 0 HD23 LEU A 15 -12.331 13.355 15.196 1.00 1.20 H new ATOM 269 N ARG A 16 -11.836 11.868 9.611 1.00 1.08 N ATOM 270 CA ARG A 16 -12.367 11.334 8.343 1.00 1.07 C ATOM 271 C ARG A 16 -12.367 9.796 8.323 1.00 1.10 C ATOM 272 O ARG A 16 -13.391 9.195 7.996 1.00 1.14 O ATOM 273 CB ARG A 16 -11.539 11.853 7.158 1.00 1.02 C ATOM 274 CG ARG A 16 -11.799 13.324 6.800 1.00 1.04 C ATOM 275 CD ARG A 16 -10.596 13.870 6.018 1.00 0.85 C ATOM 276 NE ARG A 16 -10.966 14.978 5.119 1.00 1.06 N ATOM 277 CZ ARG A 16 -11.093 14.910 3.796 1.00 1.53 C ATOM 278 NH1 ARG A 16 -10.951 13.791 3.120 1.00 2.97 N ATOM 279 NH2 ARG A 16 -11.370 15.997 3.111 1.00 2.28 N ATOM 0 H ARG A 16 -10.999 12.439 9.490 1.00 1.08 H new ATOM 0 HA ARG A 16 -13.398 11.678 8.257 1.00 1.07 H new ATOM 0 HB2 ARG A 16 -10.481 11.729 7.388 1.00 1.02 H new ATOM 0 HB3 ARG A 16 -11.750 11.236 6.285 1.00 1.02 H new ATOM 0 HG2 ARG A 16 -12.707 13.411 6.203 1.00 1.04 H new ATOM 0 HG3 ARG A 16 -11.956 13.910 7.706 1.00 1.04 H new ATOM 0 HD2 ARG A 16 -9.836 14.213 6.720 1.00 0.85 H new ATOM 0 HD3 ARG A 16 -10.150 13.065 5.434 1.00 0.85 H new ATOM 0 HE ARG A 16 -11.142 15.884 5.553 1.00 1.06 H new ATOM 0 HH11 ARG A 16 -10.734 12.923 3.610 1.00 2.97 H new ATOM 0 HH12 ARG A 16 -11.058 13.791 2.106 1.00 2.97 H new ATOM 0 HH21 ARG A 16 -11.487 16.888 3.594 1.00 2.28 H new ATOM 0 HH22 ARG A 16 -11.468 15.950 2.097 1.00 2.28 H new ATOM 293 N PHE A 17 -11.271 9.140 8.730 1.00 1.12 N ATOM 294 CA PHE A 17 -11.141 7.677 8.783 1.00 1.18 C ATOM 295 C PHE A 17 -12.137 7.041 9.767 1.00 1.30 C ATOM 296 O PHE A 17 -12.674 5.971 9.485 1.00 1.36 O ATOM 297 CB PHE A 17 -9.693 7.273 9.103 1.00 1.18 C ATOM 298 CG PHE A 17 -8.711 7.370 7.944 1.00 1.05 C ATOM 299 CD1 PHE A 17 -8.907 6.617 6.769 1.00 2.28 C ATOM 300 CD2 PHE A 17 -7.557 8.164 8.062 1.00 1.34 C ATOM 301 CE1 PHE A 17 -7.958 6.666 5.730 1.00 2.20 C ATOM 302 CE2 PHE A 17 -6.607 8.217 7.029 1.00 1.38 C ATOM 303 CZ PHE A 17 -6.808 7.465 5.861 1.00 0.91 C ATOM 0 H PHE A 17 -10.429 9.625 9.039 1.00 1.12 H new ATOM 0 HA PHE A 17 -11.391 7.289 7.796 1.00 1.18 H new ATOM 0 HB2 PHE A 17 -9.331 7.902 9.916 1.00 1.18 H new ATOM 0 HB3 PHE A 17 -9.694 6.247 9.470 1.00 1.18 H new ATOM 0 HD1 PHE A 17 -9.788 6.001 6.665 1.00 2.28 H new ATOM 0 HD2 PHE A 17 -7.399 8.742 8.961 1.00 1.34 H new ATOM 0 HE1 PHE A 17 -8.114 6.089 4.831 1.00 2.20 H new ATOM 0 HE2 PHE A 17 -5.726 8.833 7.133 1.00 1.38 H new ATOM 0 HZ PHE A 17 -6.080 7.500 5.064 1.00 0.91 H new ATOM 313 N GLN A 18 -12.441 7.720 10.877 1.00 1.35 N ATOM 314 CA GLN A 18 -13.513 7.326 11.799 1.00 1.47 C ATOM 315 C GLN A 18 -14.902 7.387 11.134 1.00 1.56 C ATOM 316 O GLN A 18 -15.738 6.522 11.400 1.00 1.76 O ATOM 317 CB GLN A 18 -13.410 8.215 13.054 1.00 1.55 C ATOM 318 CG GLN A 18 -14.375 7.856 14.202 1.00 2.04 C ATOM 319 CD GLN A 18 -15.697 8.632 14.174 1.00 3.49 C ATOM 320 OE1 GLN A 18 -15.820 9.725 14.711 1.00 3.58 O ATOM 321 NE2 GLN A 18 -16.739 8.108 13.562 1.00 5.09 N ATOM 0 H GLN A 18 -11.947 8.565 11.164 1.00 1.35 H new ATOM 0 HA GLN A 18 -13.390 6.282 12.089 1.00 1.47 H new ATOM 0 HB2 GLN A 18 -12.389 8.164 13.432 1.00 1.55 H new ATOM 0 HB3 GLN A 18 -13.590 9.249 12.761 1.00 1.55 H new ATOM 0 HG2 GLN A 18 -14.592 6.789 14.160 1.00 2.04 H new ATOM 0 HG3 GLN A 18 -13.877 8.043 15.153 1.00 2.04 H new ATOM 0 HE21 GLN A 18 -16.659 7.198 13.108 1.00 5.09 H new ATOM 0 HE22 GLN A 18 -17.626 8.612 13.542 1.00 5.09 H new ATOM 330 N ARG A 19 -15.154 8.371 10.256 1.00 1.46 N ATOM 331 CA ARG A 19 -16.443 8.577 9.572 1.00 1.53 C ATOM 332 C ARG A 19 -16.750 7.593 8.428 1.00 1.52 C ATOM 333 O ARG A 19 -17.913 7.503 8.027 1.00 1.63 O ATOM 334 CB ARG A 19 -16.522 10.021 9.028 1.00 1.51 C ATOM 335 CG ARG A 19 -17.448 10.919 9.859 1.00 1.54 C ATOM 336 CD ARG A 19 -16.842 11.267 11.223 1.00 1.25 C ATOM 337 NE ARG A 19 -17.741 12.124 12.018 1.00 1.22 N ATOM 338 CZ ARG A 19 -17.964 13.424 11.855 1.00 2.23 C ATOM 339 NH1 ARG A 19 -17.367 14.130 10.916 1.00 3.94 N ATOM 340 NH2 ARG A 19 -18.811 14.043 12.648 1.00 2.72 N ATOM 0 H ARG A 19 -14.451 9.062 9.995 1.00 1.46 H new ATOM 0 HA ARG A 19 -17.198 8.389 10.335 1.00 1.53 H new ATOM 0 HB2 ARG A 19 -15.522 10.454 9.012 1.00 1.51 H new ATOM 0 HB3 ARG A 19 -16.875 9.997 7.997 1.00 1.51 H new ATOM 0 HG2 ARG A 19 -17.652 11.837 9.308 1.00 1.54 H new ATOM 0 HG3 ARG A 19 -18.404 10.416 10.005 1.00 1.54 H new ATOM 0 HD2 ARG A 19 -16.634 10.349 11.773 1.00 1.25 H new ATOM 0 HD3 ARG A 19 -15.889 11.775 11.078 1.00 1.25 H new ATOM 0 HE ARG A 19 -18.248 11.669 12.777 1.00 1.22 H new ATOM 0 HH11 ARG A 19 -16.707 13.680 10.282 1.00 3.94 H new ATOM 0 HH12 ARG A 19 -17.565 15.126 10.823 1.00 3.94 H new ATOM 0 HH21 ARG A 19 -19.293 13.525 13.383 1.00 2.72 H new ATOM 0 HH22 ARG A 19 -18.986 15.041 12.528 1.00 2.72 H new ATOM 354 N MET A 20 -15.756 6.880 7.883 1.00 1.42 N ATOM 355 CA MET A 20 -15.873 6.101 6.629 1.00 1.43 C ATOM 356 C MET A 20 -17.061 5.133 6.552 1.00 1.91 C ATOM 357 O MET A 20 -17.649 4.987 5.482 1.00 3.74 O ATOM 358 CB MET A 20 -14.576 5.309 6.383 1.00 1.28 C ATOM 359 CG MET A 20 -13.372 6.228 6.182 1.00 1.07 C ATOM 360 SD MET A 20 -13.532 7.453 4.868 1.00 1.15 S ATOM 361 CE MET A 20 -11.921 8.237 5.030 1.00 0.77 C ATOM 0 H MET A 20 -14.828 6.823 8.304 1.00 1.42 H new ATOM 0 HA MET A 20 -16.051 6.851 5.858 1.00 1.43 H new ATOM 0 HB2 MET A 20 -14.390 4.647 7.229 1.00 1.28 H new ATOM 0 HB3 MET A 20 -14.699 4.676 5.504 1.00 1.28 H new ATOM 0 HG2 MET A 20 -13.177 6.750 7.119 1.00 1.07 H new ATOM 0 HG3 MET A 20 -12.498 5.611 5.973 1.00 1.07 H new ATOM 0 HE1 MET A 20 -11.842 9.056 4.315 1.00 0.77 H new ATOM 0 HE2 MET A 20 -11.806 8.626 6.042 1.00 0.77 H new ATOM 0 HE3 MET A 20 -11.138 7.505 4.831 1.00 0.77 H new ATOM 371 N GLU A 21 -17.374 4.435 7.651 1.00 1.09 N ATOM 372 CA GLU A 21 -18.488 3.476 7.789 1.00 1.22 C ATOM 373 C GLU A 21 -18.322 2.187 6.954 1.00 1.23 C ATOM 374 O GLU A 21 -19.081 1.231 7.141 1.00 1.43 O ATOM 375 CB GLU A 21 -19.839 4.154 7.473 1.00 1.26 C ATOM 376 CG GLU A 21 -20.984 3.597 8.332 1.00 2.17 C ATOM 377 CD GLU A 21 -22.288 4.375 8.100 1.00 2.55 C ATOM 378 OE1 GLU A 21 -23.023 4.062 7.133 1.00 3.80 O ATOM 379 OE2 GLU A 21 -22.598 5.296 8.894 1.00 2.36 O ATOM 0 H GLU A 21 -16.834 4.525 8.512 1.00 1.09 H new ATOM 0 HA GLU A 21 -18.472 3.160 8.832 1.00 1.22 H new ATOM 0 HB2 GLU A 21 -19.752 5.228 7.639 1.00 1.26 H new ATOM 0 HB3 GLU A 21 -20.076 4.013 6.419 1.00 1.26 H new ATOM 0 HG2 GLU A 21 -21.140 2.544 8.095 1.00 2.17 H new ATOM 0 HG3 GLU A 21 -20.709 3.650 9.386 1.00 2.17 H new ATOM 386 N THR A 22 -17.330 2.142 6.049 1.00 1.11 N ATOM 387 CA THR A 22 -17.002 0.997 5.191 1.00 1.15 C ATOM 388 C THR A 22 -15.494 0.821 5.079 1.00 1.02 C ATOM 389 O THR A 22 -14.747 1.794 4.948 1.00 0.95 O ATOM 390 CB THR A 22 -17.611 1.157 3.789 1.00 1.21 C ATOM 391 OG1 THR A 22 -17.003 2.226 3.099 1.00 1.08 O ATOM 392 CG2 THR A 22 -19.118 1.417 3.819 1.00 1.37 C ATOM 0 H THR A 22 -16.711 2.937 5.891 1.00 1.11 H new ATOM 0 HA THR A 22 -17.431 0.109 5.655 1.00 1.15 H new ATOM 0 HB THR A 22 -17.430 0.210 3.280 1.00 1.21 H new ATOM 0 HG1 THR A 22 -17.403 2.310 2.208 1.00 1.08 H new ATOM 0 HG21 THR A 22 -19.490 1.521 2.800 1.00 1.37 H new ATOM 0 HG22 THR A 22 -19.622 0.582 4.305 1.00 1.37 H new ATOM 0 HG23 THR A 22 -19.318 2.334 4.373 1.00 1.37 H new ATOM 400 N ALA A 23 -15.042 -0.436 5.049 1.00 1.02 N ATOM 401 CA ALA A 23 -13.648 -0.800 4.767 1.00 0.97 C ATOM 402 C ALA A 23 -13.206 -0.299 3.380 1.00 1.00 C ATOM 403 O ALA A 23 -12.043 0.042 3.171 1.00 1.00 O ATOM 404 CB ALA A 23 -13.534 -2.326 4.881 1.00 1.03 C ATOM 0 H ALA A 23 -15.642 -1.242 5.222 1.00 1.02 H new ATOM 0 HA ALA A 23 -12.982 -0.323 5.486 1.00 0.97 H new ATOM 0 HB1 ALA A 23 -12.508 -2.630 4.677 1.00 1.03 H new ATOM 0 HB2 ALA A 23 -13.811 -2.637 5.888 1.00 1.03 H new ATOM 0 HB3 ALA A 23 -14.202 -2.796 4.159 1.00 1.03 H new ATOM 410 N GLU A 24 -14.163 -0.225 2.451 1.00 1.09 N ATOM 411 CA GLU A 24 -13.982 0.263 1.088 1.00 1.18 C ATOM 412 C GLU A 24 -13.565 1.738 1.089 1.00 1.15 C ATOM 413 O GLU A 24 -12.565 2.087 0.462 1.00 1.19 O ATOM 414 CB GLU A 24 -15.253 0.057 0.243 1.00 1.30 C ATOM 415 CG GLU A 24 -15.880 -1.338 0.385 1.00 1.38 C ATOM 416 CD GLU A 24 -17.027 -1.555 -0.613 1.00 1.49 C ATOM 417 OE1 GLU A 24 -18.039 -0.817 -0.556 1.00 1.67 O ATOM 418 OE2 GLU A 24 -16.938 -2.485 -1.450 1.00 2.58 O ATOM 0 H GLU A 24 -15.122 -0.516 2.639 1.00 1.09 H new ATOM 0 HA GLU A 24 -13.182 -0.320 0.632 1.00 1.18 H new ATOM 0 HB2 GLU A 24 -15.991 0.806 0.528 1.00 1.30 H new ATOM 0 HB3 GLU A 24 -15.011 0.230 -0.806 1.00 1.30 H new ATOM 0 HG2 GLU A 24 -15.114 -2.098 0.229 1.00 1.38 H new ATOM 0 HG3 GLU A 24 -16.254 -1.466 1.401 1.00 1.38 H new ATOM 425 N GLU A 25 -14.272 2.616 1.817 1.00 1.09 N ATOM 426 CA GLU A 25 -13.932 4.040 1.785 1.00 1.15 C ATOM 427 C GLU A 25 -12.593 4.349 2.476 1.00 0.93 C ATOM 428 O GLU A 25 -11.905 5.286 2.071 1.00 0.88 O ATOM 429 CB GLU A 25 -15.071 4.970 2.222 1.00 1.38 C ATOM 430 CG GLU A 25 -14.868 6.388 1.641 1.00 1.85 C ATOM 431 CD GLU A 25 -16.115 6.932 0.938 1.00 2.90 C ATOM 432 OE1 GLU A 25 -17.023 7.468 1.617 1.00 3.09 O ATOM 433 OE2 GLU A 25 -16.166 6.849 -0.312 1.00 4.19 O ATOM 0 H GLU A 25 -15.060 2.372 2.417 1.00 1.09 H new ATOM 0 HA GLU A 25 -13.787 4.271 0.730 1.00 1.15 H new ATOM 0 HB2 GLU A 25 -16.026 4.567 1.886 1.00 1.38 H new ATOM 0 HB3 GLU A 25 -15.111 5.019 3.310 1.00 1.38 H new ATOM 0 HG2 GLU A 25 -14.586 7.067 2.446 1.00 1.85 H new ATOM 0 HG3 GLU A 25 -14.038 6.370 0.934 1.00 1.85 H new ATOM 440 N VAL A 26 -12.179 3.549 3.468 1.00 0.81 N ATOM 441 CA VAL A 26 -10.836 3.673 4.078 1.00 0.69 C ATOM 442 C VAL A 26 -9.725 3.513 3.018 1.00 0.71 C ATOM 443 O VAL A 26 -8.776 4.297 3.021 1.00 0.69 O ATOM 444 CB VAL A 26 -10.623 2.672 5.239 1.00 0.64 C ATOM 445 CG1 VAL A 26 -9.224 2.793 5.848 1.00 0.55 C ATOM 446 CG2 VAL A 26 -11.638 2.868 6.380 1.00 0.69 C ATOM 0 H VAL A 26 -12.751 2.806 3.870 1.00 0.81 H new ATOM 0 HA VAL A 26 -10.776 4.677 4.498 1.00 0.69 H new ATOM 0 HB VAL A 26 -10.758 1.688 4.790 1.00 0.64 H new ATOM 0 HG11 VAL A 26 -9.117 2.073 6.659 1.00 0.55 H new ATOM 0 HG12 VAL A 26 -8.475 2.591 5.082 1.00 0.55 H new ATOM 0 HG13 VAL A 26 -9.082 3.801 6.237 1.00 0.55 H new ATOM 0 HG21 VAL A 26 -11.444 2.141 7.168 1.00 0.69 H new ATOM 0 HG22 VAL A 26 -11.541 3.876 6.784 1.00 0.69 H new ATOM 0 HG23 VAL A 26 -12.648 2.727 5.996 1.00 0.69 H new ATOM 456 N TYR A 27 -9.840 2.554 2.085 1.00 0.80 N ATOM 457 CA TYR A 27 -8.896 2.435 0.958 1.00 0.82 C ATOM 458 C TYR A 27 -9.181 3.452 -0.180 1.00 0.82 C ATOM 459 O TYR A 27 -8.270 3.912 -0.867 1.00 0.81 O ATOM 460 CB TYR A 27 -8.773 0.974 0.470 1.00 0.99 C ATOM 461 CG TYR A 27 -9.462 0.641 -0.842 1.00 1.18 C ATOM 462 CD1 TYR A 27 -8.851 0.948 -2.075 1.00 2.88 C ATOM 463 CD2 TYR A 27 -10.728 0.033 -0.828 1.00 1.90 C ATOM 464 CE1 TYR A 27 -9.524 0.695 -3.284 1.00 3.07 C ATOM 465 CE2 TYR A 27 -11.422 -0.206 -2.028 1.00 1.93 C ATOM 466 CZ TYR A 27 -10.821 0.127 -3.264 1.00 1.59 C ATOM 467 OH TYR A 27 -11.492 -0.098 -4.429 1.00 1.80 O ATOM 0 H TYR A 27 -10.577 1.849 2.088 1.00 0.80 H new ATOM 0 HA TYR A 27 -7.912 2.713 1.335 1.00 0.82 H new ATOM 0 HB2 TYR A 27 -7.714 0.735 0.370 1.00 0.99 H new ATOM 0 HB3 TYR A 27 -9.176 0.320 1.243 1.00 0.99 H new ATOM 0 HD1 TYR A 27 -7.861 1.380 -2.091 1.00 2.88 H new ATOM 0 HD2 TYR A 27 -11.173 -0.254 0.113 1.00 1.90 H new ATOM 0 HE1 TYR A 27 -9.052 0.934 -4.226 1.00 3.07 H new ATOM 0 HE2 TYR A 27 -12.410 -0.642 -2.005 1.00 1.93 H new ATOM 0 HH TYR A 27 -12.367 -0.493 -4.232 1.00 1.80 H new ATOM 477 N HIS A 28 -10.445 3.820 -0.394 1.00 0.86 N ATOM 478 CA HIS A 28 -10.861 4.824 -1.381 1.00 0.88 C ATOM 479 C HIS A 28 -10.283 6.214 -1.068 1.00 0.76 C ATOM 480 O HIS A 28 -9.764 6.847 -1.976 1.00 0.77 O ATOM 481 CB HIS A 28 -12.393 4.881 -1.422 1.00 0.95 C ATOM 482 CG HIS A 28 -13.032 5.703 -2.514 1.00 1.14 C ATOM 483 ND1 HIS A 28 -14.211 6.411 -2.396 1.00 1.33 N ATOM 484 CD2 HIS A 28 -12.631 5.809 -3.821 1.00 1.26 C ATOM 485 CE1 HIS A 28 -14.507 6.928 -3.600 1.00 1.53 C ATOM 486 NE2 HIS A 28 -13.571 6.591 -4.506 1.00 1.48 N ATOM 0 H HIS A 28 -11.227 3.421 0.124 1.00 0.86 H new ATOM 0 HA HIS A 28 -10.471 4.529 -2.355 1.00 0.88 H new ATOM 0 HB2 HIS A 28 -12.765 3.860 -1.508 1.00 0.95 H new ATOM 0 HB3 HIS A 28 -12.741 5.267 -0.464 1.00 0.95 H new ATOM 0 HD1 HIS A 28 -14.761 6.522 -1.544 1.00 1.33 H new ATOM 0 HD2 HIS A 28 -11.744 5.366 -4.249 1.00 1.26 H new ATOM 0 HE1 HIS A 28 -15.377 7.532 -3.812 1.00 1.53 H new ATOM 494 N GLU A 29 -10.317 6.679 0.188 1.00 0.68 N ATOM 495 CA GLU A 29 -9.769 7.980 0.612 1.00 0.59 C ATOM 496 C GLU A 29 -8.292 8.119 0.219 1.00 0.52 C ATOM 497 O GLU A 29 -7.862 9.132 -0.341 1.00 0.53 O ATOM 498 CB GLU A 29 -9.926 8.079 2.144 1.00 0.75 C ATOM 499 CG GLU A 29 -9.231 9.254 2.856 1.00 1.11 C ATOM 500 CD GLU A 29 -9.988 10.582 2.711 1.00 1.10 C ATOM 501 OE1 GLU A 29 -10.137 11.086 1.575 1.00 2.26 O ATOM 502 OE2 GLU A 29 -10.422 11.143 3.744 1.00 2.04 O ATOM 0 H GLU A 29 -10.734 6.152 0.956 1.00 0.68 H new ATOM 0 HA GLU A 29 -10.310 8.785 0.115 1.00 0.59 H new ATOM 0 HB2 GLU A 29 -10.991 8.131 2.370 1.00 0.75 H new ATOM 0 HB3 GLU A 29 -9.553 7.153 2.581 1.00 0.75 H new ATOM 0 HG2 GLU A 29 -9.125 9.017 3.915 1.00 1.11 H new ATOM 0 HG3 GLU A 29 -8.225 9.371 2.453 1.00 1.11 H new ATOM 509 N ILE A 30 -7.504 7.078 0.495 1.00 0.52 N ATOM 510 CA ILE A 30 -6.055 7.119 0.236 1.00 0.53 C ATOM 511 C ILE A 30 -5.732 7.051 -1.269 1.00 0.62 C ATOM 512 O ILE A 30 -4.806 7.718 -1.732 1.00 0.68 O ATOM 513 CB ILE A 30 -5.320 6.079 1.106 1.00 0.58 C ATOM 514 CG1 ILE A 30 -5.669 4.635 0.719 1.00 0.71 C ATOM 515 CG2 ILE A 30 -5.660 6.325 2.591 1.00 0.54 C ATOM 516 CD1 ILE A 30 -4.983 3.573 1.573 1.00 0.81 C ATOM 0 H ILE A 30 -7.837 6.201 0.895 1.00 0.52 H new ATOM 0 HA ILE A 30 -5.667 8.090 0.544 1.00 0.53 H new ATOM 0 HB ILE A 30 -4.250 6.203 0.937 1.00 0.58 H new ATOM 0 HG12 ILE A 30 -6.748 4.502 0.793 1.00 0.71 H new ATOM 0 HG13 ILE A 30 -5.399 4.476 -0.325 1.00 0.71 H new ATOM 0 HG21 ILE A 30 -5.142 5.592 3.209 1.00 0.54 H new ATOM 0 HG22 ILE A 30 -5.343 7.328 2.876 1.00 0.54 H new ATOM 0 HG23 ILE A 30 -6.736 6.229 2.739 1.00 0.54 H new ATOM 0 HD11 ILE A 30 -5.284 2.582 1.233 1.00 0.81 H new ATOM 0 HD12 ILE A 30 -3.902 3.675 1.481 1.00 0.81 H new ATOM 0 HD13 ILE A 30 -5.272 3.702 2.616 1.00 0.81 H new ATOM 528 N GLU A 31 -6.557 6.349 -2.050 1.00 0.68 N ATOM 529 CA GLU A 31 -6.520 6.324 -3.517 1.00 0.74 C ATOM 530 C GLU A 31 -7.026 7.636 -4.140 1.00 0.64 C ATOM 531 O GLU A 31 -6.429 8.112 -5.102 1.00 0.67 O ATOM 532 CB GLU A 31 -7.317 5.095 -3.980 1.00 0.83 C ATOM 533 CG GLU A 31 -7.755 5.016 -5.456 1.00 1.98 C ATOM 534 CD GLU A 31 -7.109 3.854 -6.221 1.00 2.84 C ATOM 535 OE1 GLU A 31 -7.284 2.690 -5.793 1.00 3.36 O ATOM 536 OE2 GLU A 31 -6.477 4.109 -7.274 1.00 4.12 O ATOM 0 H GLU A 31 -7.296 5.761 -1.666 1.00 0.68 H new ATOM 0 HA GLU A 31 -5.490 6.241 -3.863 1.00 0.74 H new ATOM 0 HB2 GLU A 31 -6.718 4.211 -3.764 1.00 0.83 H new ATOM 0 HB3 GLU A 31 -8.214 5.030 -3.364 1.00 0.83 H new ATOM 0 HG2 GLU A 31 -8.839 4.913 -5.501 1.00 1.98 H new ATOM 0 HG3 GLU A 31 -7.503 5.953 -5.953 1.00 1.98 H new ATOM 543 N LEU A 32 -8.071 8.269 -3.602 1.00 0.60 N ATOM 544 CA LEU A 32 -8.558 9.580 -4.042 1.00 0.64 C ATOM 545 C LEU A 32 -7.452 10.633 -3.929 1.00 0.68 C ATOM 546 O LEU A 32 -7.241 11.401 -4.866 1.00 0.74 O ATOM 547 CB LEU A 32 -9.794 9.973 -3.205 1.00 0.70 C ATOM 548 CG LEU A 32 -11.121 9.325 -3.647 1.00 0.84 C ATOM 549 CD1 LEU A 32 -12.198 9.656 -2.604 1.00 0.99 C ATOM 550 CD2 LEU A 32 -11.577 9.818 -5.030 1.00 0.95 C ATOM 0 H LEU A 32 -8.614 7.877 -2.833 1.00 0.60 H new ATOM 0 HA LEU A 32 -8.849 9.525 -5.091 1.00 0.64 H new ATOM 0 HB2 LEU A 32 -9.607 9.707 -2.165 1.00 0.70 H new ATOM 0 HB3 LEU A 32 -9.908 11.056 -3.242 1.00 0.70 H new ATOM 0 HG LEU A 32 -10.967 8.249 -3.722 1.00 0.84 H new ATOM 0 HD11 LEU A 32 -13.144 9.204 -2.902 1.00 0.99 H new ATOM 0 HD12 LEU A 32 -11.898 9.262 -1.633 1.00 0.99 H new ATOM 0 HD13 LEU A 32 -12.318 10.737 -2.535 1.00 0.99 H new ATOM 0 HD21 LEU A 32 -12.516 9.333 -5.298 1.00 0.95 H new ATOM 0 HD22 LEU A 32 -11.721 10.898 -5.002 1.00 0.95 H new ATOM 0 HD23 LEU A 32 -10.818 9.573 -5.772 1.00 0.95 H new ATOM 562 N GLN A 33 -6.694 10.625 -2.830 1.00 0.71 N ATOM 563 CA GLN A 33 -5.538 11.505 -2.660 1.00 0.85 C ATOM 564 C GLN A 33 -4.420 11.210 -3.680 1.00 0.85 C ATOM 565 O GLN A 33 -3.756 12.147 -4.117 1.00 1.00 O ATOM 566 CB GLN A 33 -5.050 11.400 -1.203 1.00 0.93 C ATOM 567 CG GLN A 33 -3.853 12.302 -0.850 1.00 0.95 C ATOM 568 CD GLN A 33 -4.126 13.794 -1.057 1.00 2.41 C ATOM 569 OE1 GLN A 33 -4.530 14.514 -0.153 1.00 3.29 O ATOM 570 NE2 GLN A 33 -3.932 14.316 -2.251 1.00 3.47 N ATOM 0 H GLN A 33 -6.865 10.009 -2.035 1.00 0.71 H new ATOM 0 HA GLN A 33 -5.839 12.533 -2.861 1.00 0.85 H new ATOM 0 HB2 GLN A 33 -5.879 11.646 -0.540 1.00 0.93 H new ATOM 0 HB3 GLN A 33 -4.777 10.364 -1.001 1.00 0.93 H new ATOM 0 HG2 GLN A 33 -3.576 12.133 0.191 1.00 0.95 H new ATOM 0 HG3 GLN A 33 -2.997 12.010 -1.459 1.00 0.95 H new ATOM 0 HE21 GLN A 33 -3.596 13.730 -3.015 1.00 3.47 H new ATOM 0 HE22 GLN A 33 -4.118 15.306 -2.411 1.00 3.47 H new ATOM 579 N ALA A 34 -4.230 9.960 -4.113 1.00 0.76 N ATOM 580 CA ALA A 34 -3.294 9.595 -5.186 1.00 0.79 C ATOM 581 C ALA A 34 -3.783 10.006 -6.587 1.00 0.67 C ATOM 582 O ALA A 34 -3.013 10.525 -7.395 1.00 0.70 O ATOM 583 CB ALA A 34 -3.047 8.088 -5.099 1.00 0.84 C ATOM 0 H ALA A 34 -4.728 9.160 -3.724 1.00 0.76 H new ATOM 0 HA ALA A 34 -2.365 10.146 -5.042 1.00 0.79 H new ATOM 0 HB1 ALA A 34 -2.354 7.787 -5.885 1.00 0.84 H new ATOM 0 HB2 ALA A 34 -2.620 7.845 -4.126 1.00 0.84 H new ATOM 0 HB3 ALA A 34 -3.991 7.557 -5.224 1.00 0.84 H new ATOM 589 N GLN A 35 -5.070 9.796 -6.871 1.00 0.60 N ATOM 590 CA GLN A 35 -5.733 10.174 -8.123 1.00 0.59 C ATOM 591 C GLN A 35 -5.720 11.699 -8.315 1.00 0.65 C ATOM 592 O GLN A 35 -5.552 12.176 -9.436 1.00 0.67 O ATOM 593 CB GLN A 35 -7.174 9.627 -8.130 1.00 0.67 C ATOM 594 CG GLN A 35 -7.275 8.086 -8.109 1.00 0.81 C ATOM 595 CD GLN A 35 -7.651 7.480 -9.463 1.00 1.61 C ATOM 596 OE1 GLN A 35 -8.802 7.505 -9.886 1.00 1.94 O ATOM 597 NE2 GLN A 35 -6.722 6.914 -10.208 1.00 3.08 N ATOM 0 H GLN A 35 -5.703 9.342 -6.212 1.00 0.60 H new ATOM 0 HA GLN A 35 -5.186 9.736 -8.958 1.00 0.59 H new ATOM 0 HB2 GLN A 35 -7.704 10.025 -7.265 1.00 0.67 H new ATOM 0 HB3 GLN A 35 -7.686 10.000 -9.017 1.00 0.67 H new ATOM 0 HG2 GLN A 35 -6.320 7.672 -7.787 1.00 0.81 H new ATOM 0 HG3 GLN A 35 -8.017 7.789 -7.368 1.00 0.81 H new ATOM 0 HE21 GLN A 35 -5.757 6.879 -9.880 1.00 3.08 H new ATOM 0 HE22 GLN A 35 -6.969 6.511 -11.112 1.00 3.08 H new ATOM 606 N GLN A 36 -5.834 12.472 -7.227 1.00 0.71 N ATOM 607 CA GLN A 36 -5.694 13.934 -7.217 1.00 0.80 C ATOM 608 C GLN A 36 -4.310 14.411 -7.697 1.00 0.76 C ATOM 609 O GLN A 36 -4.204 15.526 -8.214 1.00 0.85 O ATOM 610 CB GLN A 36 -5.998 14.453 -5.798 1.00 0.93 C ATOM 611 CG GLN A 36 -7.503 14.563 -5.502 1.00 1.22 C ATOM 612 CD GLN A 36 -8.151 15.788 -6.153 1.00 1.60 C ATOM 613 OE1 GLN A 36 -8.084 16.903 -5.650 1.00 1.63 O ATOM 614 NE2 GLN A 36 -8.788 15.645 -7.300 1.00 2.61 N ATOM 0 H GLN A 36 -6.032 12.087 -6.304 1.00 0.71 H new ATOM 0 HA GLN A 36 -6.410 14.346 -7.928 1.00 0.80 H new ATOM 0 HB2 GLN A 36 -5.539 13.786 -5.068 1.00 0.93 H new ATOM 0 HB3 GLN A 36 -5.537 15.432 -5.670 1.00 0.93 H new ATOM 0 HG2 GLN A 36 -8.004 13.662 -5.856 1.00 1.22 H new ATOM 0 HG3 GLN A 36 -7.653 14.609 -4.423 1.00 1.22 H new ATOM 0 HE21 GLN A 36 -8.855 14.725 -7.735 1.00 2.61 H new ATOM 0 HE22 GLN A 36 -9.213 16.455 -7.751 1.00 2.61 H new ATOM 623 N LEU A 37 -3.264 13.580 -7.567 1.00 0.70 N ATOM 624 CA LEU A 37 -1.916 13.862 -8.081 1.00 0.74 C ATOM 625 C LEU A 37 -1.673 13.268 -9.484 1.00 0.75 C ATOM 626 O LEU A 37 -0.598 13.471 -10.050 1.00 0.88 O ATOM 627 CB LEU A 37 -0.876 13.318 -7.080 1.00 0.74 C ATOM 628 CG LEU A 37 -1.061 13.759 -5.614 1.00 0.69 C ATOM 629 CD1 LEU A 37 0.036 13.134 -4.745 1.00 0.97 C ATOM 630 CD2 LEU A 37 -1.085 15.283 -5.446 1.00 1.22 C ATOM 0 H LEU A 37 -3.333 12.679 -7.094 1.00 0.70 H new ATOM 0 HA LEU A 37 -1.817 14.943 -8.185 1.00 0.74 H new ATOM 0 HB2 LEU A 37 -0.898 12.229 -7.118 1.00 0.74 H new ATOM 0 HB3 LEU A 37 0.115 13.628 -7.411 1.00 0.74 H new ATOM 0 HG LEU A 37 -2.038 13.402 -5.287 1.00 0.69 H new ATOM 0 HD11 LEU A 37 -0.097 13.447 -3.710 1.00 0.97 H new ATOM 0 HD12 LEU A 37 -0.026 12.047 -4.806 1.00 0.97 H new ATOM 0 HD13 LEU A 37 1.013 13.462 -5.100 1.00 0.97 H new ATOM 0 HD21 LEU A 37 -1.218 15.531 -4.393 1.00 1.22 H new ATOM 0 HD22 LEU A 37 -0.144 15.703 -5.802 1.00 1.22 H new ATOM 0 HD23 LEU A 37 -1.910 15.700 -6.024 1.00 1.22 H new ATOM 642 N GLU A 38 -2.662 12.572 -10.059 1.00 0.68 N ATOM 643 CA GLU A 38 -2.635 11.963 -11.396 1.00 0.69 C ATOM 644 C GLU A 38 -1.469 10.959 -11.583 1.00 0.71 C ATOM 645 O GLU A 38 -0.858 10.875 -12.649 1.00 0.87 O ATOM 646 CB GLU A 38 -2.705 13.067 -12.474 1.00 0.88 C ATOM 647 CG GLU A 38 -3.291 12.572 -13.805 1.00 1.51 C ATOM 648 CD GLU A 38 -3.465 13.733 -14.795 1.00 1.71 C ATOM 649 OE1 GLU A 38 -4.529 14.397 -14.777 1.00 2.96 O ATOM 650 OE2 GLU A 38 -2.543 13.988 -15.609 1.00 2.24 O ATOM 0 H GLU A 38 -3.548 12.410 -9.580 1.00 0.68 H new ATOM 0 HA GLU A 38 -3.523 11.342 -11.514 1.00 0.69 H new ATOM 0 HB2 GLU A 38 -3.311 13.893 -12.101 1.00 0.88 H new ATOM 0 HB3 GLU A 38 -1.704 13.460 -12.649 1.00 0.88 H new ATOM 0 HG2 GLU A 38 -2.635 11.816 -14.237 1.00 1.51 H new ATOM 0 HG3 GLU A 38 -4.254 12.094 -13.627 1.00 1.51 H new ATOM 657 N TYR A 39 -1.127 10.201 -10.530 1.00 0.71 N ATOM 658 CA TYR A 39 0.003 9.257 -10.538 1.00 0.80 C ATOM 659 C TYR A 39 -0.192 8.098 -11.541 1.00 0.70 C ATOM 660 O TYR A 39 0.612 7.937 -12.463 1.00 0.68 O ATOM 661 CB TYR A 39 0.215 8.723 -9.105 1.00 0.93 C ATOM 662 CG TYR A 39 1.215 9.471 -8.234 1.00 1.14 C ATOM 663 CD1 TYR A 39 1.392 10.866 -8.344 1.00 2.55 C ATOM 664 CD2 TYR A 39 1.979 8.754 -7.292 1.00 1.48 C ATOM 665 CE1 TYR A 39 2.324 11.535 -7.527 1.00 2.78 C ATOM 666 CE2 TYR A 39 2.916 9.413 -6.473 1.00 1.57 C ATOM 667 CZ TYR A 39 3.088 10.809 -6.585 1.00 1.67 C ATOM 668 OH TYR A 39 3.989 11.447 -5.788 1.00 1.97 O ATOM 0 H TYR A 39 -1.630 10.225 -9.643 1.00 0.71 H new ATOM 0 HA TYR A 39 0.892 9.792 -10.872 1.00 0.80 H new ATOM 0 HB2 TYR A 39 -0.748 8.726 -8.595 1.00 0.93 H new ATOM 0 HB3 TYR A 39 0.536 7.683 -9.174 1.00 0.93 H new ATOM 0 HD1 TYR A 39 0.808 11.425 -9.060 1.00 2.55 H new ATOM 0 HD2 TYR A 39 1.844 7.687 -7.197 1.00 1.48 H new ATOM 0 HE1 TYR A 39 2.455 12.603 -7.620 1.00 2.78 H new ATOM 0 HE2 TYR A 39 3.502 8.851 -5.761 1.00 1.57 H new ATOM 0 HH TYR A 39 3.687 12.365 -5.623 1.00 1.97 H new ATOM 678 N ASP A 40 -1.261 7.317 -11.335 1.00 0.70 N ATOM 679 CA ASP A 40 -1.678 6.061 -11.985 1.00 0.70 C ATOM 680 C ASP A 40 -2.761 5.418 -11.090 1.00 0.87 C ATOM 681 O ASP A 40 -3.903 5.877 -11.085 1.00 1.33 O ATOM 682 CB ASP A 40 -0.490 5.119 -12.294 1.00 0.67 C ATOM 683 CG ASP A 40 -0.901 3.790 -12.946 1.00 0.95 C ATOM 684 OD1 ASP A 40 -1.550 3.834 -14.016 1.00 1.85 O ATOM 685 OD2 ASP A 40 -0.525 2.728 -12.397 1.00 1.78 O ATOM 0 H ASP A 40 -1.939 7.582 -10.621 1.00 0.70 H new ATOM 0 HA ASP A 40 -2.098 6.269 -12.969 1.00 0.70 H new ATOM 0 HB2 ASP A 40 0.208 5.635 -12.953 1.00 0.67 H new ATOM 0 HB3 ASP A 40 0.044 4.908 -11.367 1.00 0.67 H new ATOM 690 N TYR A 41 -2.392 4.419 -10.283 1.00 0.61 N ATOM 691 CA TYR A 41 -3.269 3.667 -9.380 1.00 0.80 C ATOM 692 C TYR A 41 -2.658 3.472 -7.975 1.00 0.74 C ATOM 693 O TYR A 41 -1.462 3.682 -7.750 1.00 0.61 O ATOM 694 CB TYR A 41 -3.571 2.297 -10.005 1.00 0.93 C ATOM 695 CG TYR A 41 -4.307 2.305 -11.335 1.00 1.07 C ATOM 696 CD1 TYR A 41 -5.588 2.883 -11.432 1.00 3.07 C ATOM 697 CD2 TYR A 41 -3.740 1.676 -12.461 1.00 1.39 C ATOM 698 CE1 TYR A 41 -6.306 2.822 -12.642 1.00 3.23 C ATOM 699 CE2 TYR A 41 -4.443 1.624 -13.677 1.00 1.34 C ATOM 700 CZ TYR A 41 -5.735 2.186 -13.768 1.00 1.39 C ATOM 701 OH TYR A 41 -6.431 2.095 -14.937 1.00 1.55 O ATOM 0 H TYR A 41 -1.425 4.097 -10.239 1.00 0.61 H new ATOM 0 HA TYR A 41 -4.183 4.247 -9.250 1.00 0.80 H new ATOM 0 HB2 TYR A 41 -2.627 1.769 -10.141 1.00 0.93 H new ATOM 0 HB3 TYR A 41 -4.160 1.720 -9.293 1.00 0.93 H new ATOM 0 HD1 TYR A 41 -6.022 3.375 -10.574 1.00 3.07 H new ATOM 0 HD2 TYR A 41 -2.759 1.231 -12.389 1.00 1.39 H new ATOM 0 HE1 TYR A 41 -7.291 3.260 -12.710 1.00 3.23 H new ATOM 0 HE2 TYR A 41 -3.995 1.155 -14.541 1.00 1.34 H new ATOM 0 HH TYR A 41 -5.888 1.628 -15.606 1.00 1.55 H new ATOM 711 N TYR A 42 -3.486 3.033 -7.029 1.00 0.86 N ATOM 712 CA TYR A 42 -3.118 2.692 -5.650 1.00 0.80 C ATOM 713 C TYR A 42 -3.254 1.183 -5.410 1.00 0.76 C ATOM 714 O TYR A 42 -4.049 0.513 -6.068 1.00 0.76 O ATOM 715 CB TYR A 42 -4.080 3.416 -4.698 1.00 0.81 C ATOM 716 CG TYR A 42 -3.502 3.762 -3.346 1.00 2.89 C ATOM 717 CD1 TYR A 42 -3.488 2.839 -2.282 1.00 3.85 C ATOM 718 CD2 TYR A 42 -3.008 5.058 -3.151 1.00 4.68 C ATOM 719 CE1 TYR A 42 -2.943 3.212 -1.040 1.00 5.93 C ATOM 720 CE2 TYR A 42 -2.528 5.460 -1.898 1.00 6.78 C ATOM 721 CZ TYR A 42 -2.472 4.530 -0.841 1.00 7.28 C ATOM 722 OH TYR A 42 -1.989 4.919 0.371 1.00 9.42 O ATOM 0 H TYR A 42 -4.481 2.898 -7.209 1.00 0.86 H new ATOM 0 HA TYR A 42 -2.084 2.991 -5.476 1.00 0.80 H new ATOM 0 HB2 TYR A 42 -4.418 4.335 -5.177 1.00 0.81 H new ATOM 0 HB3 TYR A 42 -4.960 2.790 -4.551 1.00 0.81 H new ATOM 0 HD1 TYR A 42 -3.894 1.848 -2.419 1.00 3.85 H new ATOM 0 HD2 TYR A 42 -2.997 5.755 -3.976 1.00 4.68 H new ATOM 0 HE1 TYR A 42 -2.884 2.491 -0.238 1.00 5.93 H new ATOM 0 HE2 TYR A 42 -2.202 6.478 -1.743 1.00 6.78 H new ATOM 0 HH TYR A 42 -1.664 5.842 0.313 1.00 9.42 H new ATOM 732 N SER A 43 -2.543 0.642 -4.427 1.00 0.77 N ATOM 733 CA SER A 43 -2.755 -0.725 -3.949 1.00 0.79 C ATOM 734 C SER A 43 -2.618 -0.809 -2.424 1.00 0.80 C ATOM 735 O SER A 43 -1.752 -0.165 -1.827 1.00 0.80 O ATOM 736 CB SER A 43 -1.761 -1.667 -4.632 1.00 0.94 C ATOM 737 OG SER A 43 -2.154 -3.016 -4.452 1.00 1.26 O ATOM 0 H SER A 43 -1.800 1.139 -3.936 1.00 0.77 H new ATOM 0 HA SER A 43 -3.771 -1.028 -4.204 1.00 0.79 H new ATOM 0 HB2 SER A 43 -1.705 -1.437 -5.696 1.00 0.94 H new ATOM 0 HB3 SER A 43 -0.764 -1.514 -4.220 1.00 0.94 H new ATOM 0 HG SER A 43 -1.510 -3.606 -4.896 1.00 1.26 H new ATOM 743 N LEU A 44 -3.472 -1.610 -1.785 1.00 0.85 N ATOM 744 CA LEU A 44 -3.455 -1.890 -0.350 1.00 0.95 C ATOM 745 C LEU A 44 -3.714 -3.381 -0.139 1.00 0.78 C ATOM 746 O LEU A 44 -4.536 -3.977 -0.836 1.00 0.80 O ATOM 747 CB LEU A 44 -4.492 -0.985 0.352 1.00 1.35 C ATOM 748 CG LEU A 44 -4.632 -1.229 1.875 1.00 1.50 C ATOM 749 CD1 LEU A 44 -4.820 0.092 2.633 1.00 2.06 C ATOM 750 CD2 LEU A 44 -5.795 -2.162 2.218 1.00 1.52 C ATOM 0 H LEU A 44 -4.223 -2.100 -2.272 1.00 0.85 H new ATOM 0 HA LEU A 44 -2.485 -1.664 0.093 1.00 0.95 H new ATOM 0 HB2 LEU A 44 -4.216 0.057 0.188 1.00 1.35 H new ATOM 0 HB3 LEU A 44 -5.464 -1.136 -0.118 1.00 1.35 H new ATOM 0 HG LEU A 44 -3.703 -1.708 2.186 1.00 1.50 H new ATOM 0 HD11 LEU A 44 -4.915 -0.111 3.700 1.00 2.06 H new ATOM 0 HD12 LEU A 44 -3.957 0.736 2.462 1.00 2.06 H new ATOM 0 HD13 LEU A 44 -5.721 0.591 2.277 1.00 2.06 H new ATOM 0 HD21 LEU A 44 -5.846 -2.298 3.298 1.00 1.52 H new ATOM 0 HD22 LEU A 44 -6.728 -1.726 1.862 1.00 1.52 H new ATOM 0 HD23 LEU A 44 -5.640 -3.128 1.738 1.00 1.52 H new ATOM 762 N CYS A 45 -3.046 -3.982 0.844 1.00 0.70 N ATOM 763 CA CYS A 45 -3.303 -5.351 1.278 1.00 0.58 C ATOM 764 C CYS A 45 -3.245 -5.484 2.807 1.00 0.67 C ATOM 765 O CYS A 45 -2.529 -4.743 3.486 1.00 0.79 O ATOM 766 CB CYS A 45 -2.391 -6.329 0.517 1.00 0.60 C ATOM 767 SG CYS A 45 -0.651 -6.076 0.954 1.00 2.60 S ATOM 0 H CYS A 45 -2.301 -3.524 1.368 1.00 0.70 H new ATOM 0 HA CYS A 45 -4.326 -5.625 1.020 1.00 0.58 H new ATOM 0 HB2 CYS A 45 -2.681 -7.354 0.746 1.00 0.60 H new ATOM 0 HB3 CYS A 45 -2.523 -6.193 -0.556 1.00 0.60 H new ATOM 0 HG CYS A 45 -0.444 -4.816 1.199 1.00 2.60 H new ATOM 773 N VAL A 46 -4.044 -6.406 3.342 1.00 0.70 N ATOM 774 CA VAL A 46 -4.258 -6.594 4.787 1.00 0.86 C ATOM 775 C VAL A 46 -3.991 -8.049 5.175 1.00 0.96 C ATOM 776 O VAL A 46 -4.309 -8.964 4.415 1.00 0.97 O ATOM 777 CB VAL A 46 -5.678 -6.124 5.212 1.00 0.99 C ATOM 778 CG1 VAL A 46 -6.729 -7.240 5.331 1.00 1.30 C ATOM 779 CG2 VAL A 46 -5.618 -5.359 6.544 1.00 2.26 C ATOM 0 H VAL A 46 -4.577 -7.063 2.772 1.00 0.70 H new ATOM 0 HA VAL A 46 -3.548 -5.970 5.330 1.00 0.86 H new ATOM 0 HB VAL A 46 -6.005 -5.479 4.396 1.00 0.99 H new ATOM 0 HG11 VAL A 46 -7.684 -6.810 5.632 1.00 1.30 H new ATOM 0 HG12 VAL A 46 -6.843 -7.737 4.368 1.00 1.30 H new ATOM 0 HG13 VAL A 46 -6.406 -7.966 6.078 1.00 1.30 H new ATOM 0 HG21 VAL A 46 -6.621 -5.038 6.825 1.00 2.26 H new ATOM 0 HG22 VAL A 46 -5.215 -6.010 7.320 1.00 2.26 H new ATOM 0 HG23 VAL A 46 -4.975 -4.486 6.433 1.00 2.26 H new ATOM 789 N ARG A 47 -3.419 -8.241 6.365 1.00 1.08 N ATOM 790 CA ARG A 47 -3.123 -9.539 6.971 1.00 1.17 C ATOM 791 C ARG A 47 -3.552 -9.532 8.444 1.00 1.20 C ATOM 792 O ARG A 47 -3.237 -8.616 9.205 1.00 1.25 O ATOM 793 CB ARG A 47 -1.618 -9.835 6.867 1.00 1.33 C ATOM 794 CG ARG A 47 -1.138 -10.200 5.452 1.00 1.67 C ATOM 795 CD ARG A 47 0.355 -10.558 5.535 1.00 1.56 C ATOM 796 NE ARG A 47 0.925 -11.086 4.282 1.00 2.66 N ATOM 797 CZ ARG A 47 0.780 -12.310 3.792 1.00 2.63 C ATOM 798 NH1 ARG A 47 -0.137 -13.148 4.230 1.00 3.05 N ATOM 799 NH2 ARG A 47 1.598 -12.712 2.846 1.00 3.76 N ATOM 0 H ARG A 47 -3.137 -7.461 6.958 1.00 1.08 H new ATOM 0 HA ARG A 47 -3.675 -10.315 6.440 1.00 1.17 H new ATOM 0 HB2 ARG A 47 -1.064 -8.962 7.211 1.00 1.33 H new ATOM 0 HB3 ARG A 47 -1.374 -10.655 7.543 1.00 1.33 H new ATOM 0 HG2 ARG A 47 -1.710 -11.041 5.060 1.00 1.67 H new ATOM 0 HG3 ARG A 47 -1.292 -9.364 4.770 1.00 1.67 H new ATOM 0 HD2 ARG A 47 0.914 -9.669 5.828 1.00 1.56 H new ATOM 0 HD3 ARG A 47 0.496 -11.297 6.324 1.00 1.56 H new ATOM 0 HE ARG A 47 1.492 -10.440 3.733 1.00 2.66 H new ATOM 0 HH11 ARG A 47 -0.772 -12.865 4.976 1.00 3.05 H new ATOM 0 HH12 ARG A 47 -0.212 -14.080 3.823 1.00 3.05 H new ATOM 0 HH21 ARG A 47 2.327 -12.087 2.502 1.00 3.76 H new ATOM 0 HH22 ARG A 47 1.504 -13.649 2.455 1.00 3.76 H new ATOM 813 N HIS A 48 -4.254 -10.578 8.863 1.00 1.27 N ATOM 814 CA HIS A 48 -4.778 -10.714 10.224 1.00 1.33 C ATOM 815 C HIS A 48 -4.592 -12.174 10.711 1.00 1.30 C ATOM 816 O HIS A 48 -5.282 -13.081 10.226 1.00 1.33 O ATOM 817 CB HIS A 48 -6.231 -10.197 10.269 1.00 1.50 C ATOM 818 CG HIS A 48 -7.236 -10.849 9.345 1.00 2.11 C ATOM 819 ND1 HIS A 48 -8.381 -11.494 9.748 1.00 2.62 N ATOM 820 CD2 HIS A 48 -7.275 -10.790 7.975 1.00 3.65 C ATOM 821 CE1 HIS A 48 -9.082 -11.832 8.655 1.00 4.02 C ATOM 822 NE2 HIS A 48 -8.446 -11.424 7.541 1.00 4.67 N ATOM 0 H HIS A 48 -4.481 -11.369 8.261 1.00 1.27 H new ATOM 0 HA HIS A 48 -4.220 -10.096 10.928 1.00 1.33 H new ATOM 0 HB2 HIS A 48 -6.595 -10.306 11.291 1.00 1.50 H new ATOM 0 HB3 HIS A 48 -6.215 -9.130 10.048 1.00 1.50 H new ATOM 0 HD2 HIS A 48 -6.530 -10.333 7.340 1.00 3.65 H new ATOM 0 HE1 HIS A 48 -10.025 -12.358 8.667 1.00 4.02 H new ATOM 0 HE2 HIS A 48 -8.754 -11.551 6.577 1.00 4.67 H new ATOM 830 N PRO A 49 -3.627 -12.446 11.618 1.00 1.31 N ATOM 831 CA PRO A 49 -3.255 -13.804 12.014 1.00 1.34 C ATOM 832 C PRO A 49 -4.256 -14.382 13.031 1.00 1.35 C ATOM 833 O PRO A 49 -3.955 -14.527 14.215 1.00 1.52 O ATOM 834 CB PRO A 49 -1.816 -13.685 12.536 1.00 1.41 C ATOM 835 CG PRO A 49 -1.776 -12.279 13.131 1.00 1.44 C ATOM 836 CD PRO A 49 -2.677 -11.491 12.181 1.00 1.36 C ATOM 0 HA PRO A 49 -3.292 -14.516 11.190 1.00 1.34 H new ATOM 0 HB2 PRO A 49 -1.595 -14.446 13.285 1.00 1.41 H new ATOM 0 HB3 PRO A 49 -1.086 -13.804 11.735 1.00 1.41 H new ATOM 0 HG2 PRO A 49 -2.151 -12.261 14.154 1.00 1.44 H new ATOM 0 HG3 PRO A 49 -0.763 -11.878 13.156 1.00 1.44 H new ATOM 0 HD2 PRO A 49 -3.198 -10.694 12.712 1.00 1.36 H new ATOM 0 HD3 PRO A 49 -2.090 -11.018 11.393 1.00 1.36 H new ATOM 844 N VAL A 50 -5.468 -14.701 12.563 1.00 1.37 N ATOM 845 CA VAL A 50 -6.559 -15.226 13.412 1.00 1.40 C ATOM 846 C VAL A 50 -6.217 -16.630 13.947 1.00 1.44 C ATOM 847 O VAL A 50 -5.780 -17.476 13.163 1.00 1.46 O ATOM 848 CB VAL A 50 -7.925 -15.298 12.689 1.00 1.43 C ATOM 849 CG1 VAL A 50 -9.084 -15.472 13.687 1.00 1.62 C ATOM 850 CG2 VAL A 50 -8.204 -14.035 11.876 1.00 1.43 C ATOM 0 H VAL A 50 -5.727 -14.604 11.581 1.00 1.37 H new ATOM 0 HA VAL A 50 -6.650 -14.514 14.232 1.00 1.40 H new ATOM 0 HB VAL A 50 -7.865 -16.161 12.026 1.00 1.43 H new ATOM 0 HG11 VAL A 50 -10.028 -15.519 13.144 1.00 1.62 H new ATOM 0 HG12 VAL A 50 -8.944 -16.394 14.250 1.00 1.62 H new ATOM 0 HG13 VAL A 50 -9.102 -14.626 14.374 1.00 1.62 H new ATOM 0 HG21 VAL A 50 -9.172 -14.126 11.384 1.00 1.43 H new ATOM 0 HG22 VAL A 50 -8.213 -13.170 12.539 1.00 1.43 H new ATOM 0 HG23 VAL A 50 -7.425 -13.907 11.124 1.00 1.43 H new ATOM 860 N PRO A 51 -6.435 -16.909 15.250 1.00 1.50 N ATOM 861 CA PRO A 51 -6.248 -18.238 15.823 1.00 1.55 C ATOM 862 C PRO A 51 -7.500 -19.129 15.717 1.00 1.62 C ATOM 863 O PRO A 51 -7.381 -20.351 15.646 1.00 1.67 O ATOM 864 CB PRO A 51 -5.848 -17.971 17.276 1.00 1.63 C ATOM 865 CG PRO A 51 -6.531 -16.651 17.632 1.00 1.68 C ATOM 866 CD PRO A 51 -6.706 -15.928 16.294 1.00 1.56 C ATOM 0 HA PRO A 51 -5.491 -18.803 15.279 1.00 1.55 H new ATOM 0 HB2 PRO A 51 -6.178 -18.777 17.932 1.00 1.63 H new ATOM 0 HB3 PRO A 51 -4.766 -17.897 17.381 1.00 1.63 H new ATOM 0 HG2 PRO A 51 -7.492 -16.821 18.118 1.00 1.68 H new ATOM 0 HG3 PRO A 51 -5.924 -16.065 18.322 1.00 1.68 H new ATOM 0 HD2 PRO A 51 -7.716 -15.530 16.198 1.00 1.56 H new ATOM 0 HD3 PRO A 51 -6.022 -15.083 16.218 1.00 1.56 H new ATOM 874 N PHE A 52 -8.695 -18.526 15.683 1.00 1.69 N ATOM 875 CA PHE A 52 -10.000 -19.198 15.595 1.00 1.84 C ATOM 876 C PHE A 52 -10.431 -19.587 14.164 1.00 1.92 C ATOM 877 O PHE A 52 -11.404 -20.330 14.008 1.00 2.16 O ATOM 878 CB PHE A 52 -11.060 -18.289 16.241 1.00 1.98 C ATOM 879 CG PHE A 52 -10.927 -18.158 17.746 1.00 2.02 C ATOM 880 CD1 PHE A 52 -11.551 -19.097 18.589 1.00 2.01 C ATOM 881 CD2 PHE A 52 -10.180 -17.106 18.307 1.00 3.41 C ATOM 882 CE1 PHE A 52 -11.430 -18.984 19.985 1.00 2.12 C ATOM 883 CE2 PHE A 52 -10.055 -16.995 19.704 1.00 3.51 C ATOM 884 CZ PHE A 52 -10.683 -17.933 20.544 1.00 2.29 C ATOM 0 H PHE A 52 -8.784 -17.510 15.718 1.00 1.69 H new ATOM 0 HA PHE A 52 -9.904 -20.145 16.127 1.00 1.84 H new ATOM 0 HB2 PHE A 52 -10.995 -17.297 15.793 1.00 1.98 H new ATOM 0 HB3 PHE A 52 -12.050 -18.680 16.007 1.00 1.98 H new ATOM 0 HD1 PHE A 52 -12.124 -19.907 18.162 1.00 2.01 H new ATOM 0 HD2 PHE A 52 -9.702 -16.382 17.664 1.00 3.41 H new ATOM 0 HE1 PHE A 52 -11.912 -19.705 20.628 1.00 2.12 H new ATOM 0 HE2 PHE A 52 -9.477 -16.189 20.132 1.00 3.51 H new ATOM 0 HZ PHE A 52 -10.591 -17.845 21.617 1.00 2.29 H new ATOM 894 N THR A 53 -9.731 -19.106 13.126 1.00 1.75 N ATOM 895 CA THR A 53 -10.006 -19.394 11.704 1.00 1.78 C ATOM 896 C THR A 53 -8.712 -19.433 10.901 1.00 1.68 C ATOM 897 O THR A 53 -7.686 -18.940 11.368 1.00 1.64 O ATOM 898 CB THR A 53 -11.044 -18.407 11.136 1.00 1.84 C ATOM 899 OG1 THR A 53 -11.828 -19.128 10.212 1.00 2.11 O ATOM 900 CG2 THR A 53 -10.502 -17.175 10.413 1.00 1.77 C ATOM 0 H THR A 53 -8.932 -18.486 13.254 1.00 1.75 H new ATOM 0 HA THR A 53 -10.449 -20.386 11.622 1.00 1.78 H new ATOM 0 HB THR A 53 -11.581 -18.014 12.000 1.00 1.84 H new ATOM 0 HG1 THR A 53 -12.506 -18.535 9.826 1.00 2.11 H new ATOM 0 HG21 THR A 53 -11.334 -16.564 10.063 1.00 1.77 H new ATOM 0 HG22 THR A 53 -9.887 -16.592 11.098 1.00 1.77 H new ATOM 0 HG23 THR A 53 -9.898 -17.489 9.561 1.00 1.77 H new ATOM 908 N ARG A 54 -8.743 -20.000 9.690 1.00 1.73 N ATOM 909 CA ARG A 54 -7.563 -20.035 8.812 1.00 1.64 C ATOM 910 C ARG A 54 -7.173 -18.599 8.393 1.00 1.45 C ATOM 911 O ARG A 54 -8.035 -17.877 7.877 1.00 1.44 O ATOM 912 CB ARG A 54 -7.812 -20.909 7.572 1.00 1.86 C ATOM 913 CG ARG A 54 -8.145 -22.382 7.869 1.00 2.26 C ATOM 914 CD ARG A 54 -7.015 -23.117 8.606 1.00 2.34 C ATOM 915 NE ARG A 54 -7.283 -24.564 8.703 1.00 2.84 N ATOM 916 CZ ARG A 54 -7.990 -25.190 9.637 1.00 4.06 C ATOM 917 NH1 ARG A 54 -8.570 -24.549 10.632 1.00 5.25 N ATOM 918 NH2 ARG A 54 -8.127 -26.498 9.580 1.00 4.46 N ATOM 0 H ARG A 54 -9.572 -20.442 9.293 1.00 1.73 H new ATOM 0 HA ARG A 54 -6.739 -20.480 9.369 1.00 1.64 H new ATOM 0 HB2 ARG A 54 -8.632 -20.475 6.999 1.00 1.86 H new ATOM 0 HB3 ARG A 54 -6.926 -20.873 6.938 1.00 1.86 H new ATOM 0 HG2 ARG A 54 -9.054 -22.429 8.469 1.00 2.26 H new ATOM 0 HG3 ARG A 54 -8.355 -22.897 6.932 1.00 2.26 H new ATOM 0 HD2 ARG A 54 -6.073 -22.955 8.083 1.00 2.34 H new ATOM 0 HD3 ARG A 54 -6.900 -22.700 9.606 1.00 2.34 H new ATOM 0 HE ARG A 54 -6.880 -25.149 7.971 1.00 2.84 H new ATOM 0 HH11 ARG A 54 -8.484 -23.535 10.704 1.00 5.25 H new ATOM 0 HH12 ARG A 54 -9.105 -25.067 11.329 1.00 5.25 H new ATOM 0 HH21 ARG A 54 -7.692 -27.024 8.822 1.00 4.46 H new ATOM 0 HH22 ARG A 54 -8.668 -26.986 10.294 1.00 4.46 H new ATOM 932 N PRO A 55 -5.914 -18.169 8.607 1.00 1.41 N ATOM 933 CA PRO A 55 -5.488 -16.788 8.403 1.00 1.28 C ATOM 934 C PRO A 55 -5.399 -16.454 6.910 1.00 1.17 C ATOM 935 O PRO A 55 -5.220 -17.334 6.067 1.00 1.21 O ATOM 936 CB PRO A 55 -4.149 -16.657 9.133 1.00 1.47 C ATOM 937 CG PRO A 55 -3.572 -18.070 9.071 1.00 1.67 C ATOM 938 CD PRO A 55 -4.812 -18.965 9.124 1.00 1.61 C ATOM 0 HA PRO A 55 -6.204 -16.070 8.802 1.00 1.28 H new ATOM 0 HB2 PRO A 55 -3.495 -15.934 8.646 1.00 1.47 H new ATOM 0 HB3 PRO A 55 -4.283 -16.323 10.162 1.00 1.47 H new ATOM 0 HG2 PRO A 55 -3.000 -18.230 8.157 1.00 1.67 H new ATOM 0 HG3 PRO A 55 -2.900 -18.266 9.906 1.00 1.67 H new ATOM 0 HD2 PRO A 55 -4.668 -19.864 8.525 1.00 1.61 H new ATOM 0 HD3 PRO A 55 -5.013 -19.290 10.145 1.00 1.61 H new ATOM 946 N LYS A 56 -5.565 -15.168 6.590 1.00 1.17 N ATOM 947 CA LYS A 56 -5.840 -14.683 5.230 1.00 1.16 C ATOM 948 C LYS A 56 -4.827 -13.630 4.734 1.00 1.12 C ATOM 949 O LYS A 56 -4.064 -13.046 5.511 1.00 1.29 O ATOM 950 CB LYS A 56 -7.254 -14.058 5.219 1.00 1.58 C ATOM 951 CG LYS A 56 -8.419 -14.960 5.662 1.00 1.75 C ATOM 952 CD LYS A 56 -8.667 -16.135 4.703 1.00 2.11 C ATOM 953 CE LYS A 56 -9.922 -16.937 5.081 1.00 2.92 C ATOM 954 NZ LYS A 56 -11.177 -16.159 4.895 1.00 4.11 N ATOM 0 H LYS A 56 -5.512 -14.419 7.280 1.00 1.17 H new ATOM 0 HA LYS A 56 -5.760 -15.537 4.557 1.00 1.16 H new ATOM 0 HB2 LYS A 56 -7.241 -13.180 5.864 1.00 1.58 H new ATOM 0 HB3 LYS A 56 -7.462 -13.708 4.208 1.00 1.58 H new ATOM 0 HG2 LYS A 56 -8.211 -15.349 6.659 1.00 1.75 H new ATOM 0 HG3 LYS A 56 -9.327 -14.361 5.737 1.00 1.75 H new ATOM 0 HD2 LYS A 56 -8.772 -15.756 3.686 1.00 2.11 H new ATOM 0 HD3 LYS A 56 -7.800 -16.796 4.709 1.00 2.11 H new ATOM 0 HE2 LYS A 56 -9.967 -17.842 4.475 1.00 2.92 H new ATOM 0 HE3 LYS A 56 -9.846 -17.254 6.121 1.00 2.92 H new ATOM 0 HZ1 LYS A 56 -11.996 -16.791 4.999 1.00 4.11 H new ATOM 0 HZ2 LYS A 56 -11.228 -15.406 5.610 1.00 4.11 H new ATOM 0 HZ3 LYS A 56 -11.185 -15.736 3.945 1.00 4.11 H new ATOM 968 N VAL A 57 -4.912 -13.318 3.439 1.00 1.02 N ATOM 969 CA VAL A 57 -4.538 -12.015 2.868 1.00 0.95 C ATOM 970 C VAL A 57 -5.704 -11.500 2.016 1.00 0.87 C ATOM 971 O VAL A 57 -6.309 -12.269 1.267 1.00 0.88 O ATOM 972 CB VAL A 57 -3.205 -12.071 2.081 1.00 1.05 C ATOM 973 CG1 VAL A 57 -3.244 -13.004 0.860 1.00 1.50 C ATOM 974 CG2 VAL A 57 -2.740 -10.672 1.639 1.00 2.53 C ATOM 0 H VAL A 57 -5.250 -13.978 2.739 1.00 1.02 H new ATOM 0 HA VAL A 57 -4.353 -11.311 3.679 1.00 0.95 H new ATOM 0 HB VAL A 57 -2.486 -12.487 2.787 1.00 1.05 H new ATOM 0 HG11 VAL A 57 -2.275 -12.990 0.360 1.00 1.50 H new ATOM 0 HG12 VAL A 57 -3.470 -14.019 1.185 1.00 1.50 H new ATOM 0 HG13 VAL A 57 -4.014 -12.665 0.167 1.00 1.50 H new ATOM 0 HG21 VAL A 57 -1.802 -10.757 1.091 1.00 2.53 H new ATOM 0 HG22 VAL A 57 -3.497 -10.223 0.996 1.00 2.53 H new ATOM 0 HG23 VAL A 57 -2.591 -10.044 2.517 1.00 2.53 H new ATOM 984 N ALA A 58 -6.022 -10.209 2.135 1.00 0.82 N ATOM 985 CA ALA A 58 -6.951 -9.504 1.246 1.00 0.78 C ATOM 986 C ALA A 58 -6.226 -8.338 0.566 1.00 0.72 C ATOM 987 O ALA A 58 -5.380 -7.693 1.192 1.00 0.73 O ATOM 988 CB ALA A 58 -8.170 -9.008 2.036 1.00 0.86 C ATOM 0 H ALA A 58 -5.634 -9.612 2.866 1.00 0.82 H new ATOM 0 HA ALA A 58 -7.306 -10.190 0.477 1.00 0.78 H new ATOM 0 HB1 ALA A 58 -8.851 -8.486 1.364 1.00 0.86 H new ATOM 0 HB2 ALA A 58 -8.683 -9.858 2.485 1.00 0.86 H new ATOM 0 HB3 ALA A 58 -7.842 -8.326 2.821 1.00 0.86 H new ATOM 994 N PHE A 59 -6.576 -8.077 -0.694 1.00 0.70 N ATOM 995 CA PHE A 59 -5.981 -7.053 -1.553 1.00 0.64 C ATOM 996 C PHE A 59 -7.070 -6.170 -2.197 1.00 0.71 C ATOM 997 O PHE A 59 -8.149 -6.645 -2.556 1.00 0.85 O ATOM 998 CB PHE A 59 -5.047 -7.719 -2.591 1.00 0.54 C ATOM 999 CG PHE A 59 -5.507 -9.048 -3.188 1.00 0.53 C ATOM 1000 CD1 PHE A 59 -6.629 -9.100 -4.041 1.00 2.02 C ATOM 1001 CD2 PHE A 59 -4.808 -10.242 -2.904 1.00 1.68 C ATOM 1002 CE1 PHE A 59 -7.065 -10.328 -4.574 1.00 2.13 C ATOM 1003 CE2 PHE A 59 -5.249 -11.470 -3.430 1.00 1.67 C ATOM 1004 CZ PHE A 59 -6.382 -11.515 -4.260 1.00 0.86 C ATOM 0 H PHE A 59 -7.316 -8.598 -1.165 1.00 0.70 H new ATOM 0 HA PHE A 59 -5.369 -6.382 -0.950 1.00 0.64 H new ATOM 0 HB2 PHE A 59 -4.894 -7.015 -3.409 1.00 0.54 H new ATOM 0 HB3 PHE A 59 -4.076 -7.877 -2.121 1.00 0.54 H new ATOM 0 HD1 PHE A 59 -7.158 -8.191 -4.287 1.00 2.02 H new ATOM 0 HD2 PHE A 59 -3.928 -10.212 -2.278 1.00 1.68 H new ATOM 0 HE1 PHE A 59 -7.926 -10.358 -5.225 1.00 2.13 H new ATOM 0 HE2 PHE A 59 -4.716 -12.380 -3.196 1.00 1.67 H new ATOM 0 HZ PHE A 59 -6.727 -12.459 -4.655 1.00 0.86 H new ATOM 1014 N TYR A 60 -6.775 -4.876 -2.337 1.00 0.73 N ATOM 1015 CA TYR A 60 -7.663 -3.835 -2.873 1.00 0.88 C ATOM 1016 C TYR A 60 -6.885 -2.889 -3.803 1.00 0.81 C ATOM 1017 O TYR A 60 -5.813 -2.395 -3.433 1.00 0.79 O ATOM 1018 CB TYR A 60 -8.274 -3.025 -1.716 1.00 1.13 C ATOM 1019 CG TYR A 60 -9.056 -3.852 -0.716 1.00 1.16 C ATOM 1020 CD1 TYR A 60 -10.259 -4.468 -1.106 1.00 1.50 C ATOM 1021 CD2 TYR A 60 -8.568 -4.029 0.595 1.00 2.80 C ATOM 1022 CE1 TYR A 60 -10.974 -5.265 -0.195 1.00 1.56 C ATOM 1023 CE2 TYR A 60 -9.288 -4.812 1.519 1.00 2.81 C ATOM 1024 CZ TYR A 60 -10.494 -5.436 1.124 1.00 1.24 C ATOM 1025 OH TYR A 60 -11.196 -6.203 2.005 1.00 1.29 O ATOM 0 H TYR A 60 -5.865 -4.504 -2.067 1.00 0.73 H new ATOM 0 HA TYR A 60 -8.457 -4.317 -3.443 1.00 0.88 H new ATOM 0 HB2 TYR A 60 -7.473 -2.504 -1.191 1.00 1.13 H new ATOM 0 HB3 TYR A 60 -8.932 -2.262 -2.131 1.00 1.13 H new ATOM 0 HD1 TYR A 60 -10.635 -4.328 -2.109 1.00 1.50 H new ATOM 0 HD2 TYR A 60 -7.640 -3.563 0.892 1.00 2.80 H new ATOM 0 HE1 TYR A 60 -11.890 -5.747 -0.503 1.00 1.56 H new ATOM 0 HE2 TYR A 60 -8.920 -4.935 2.527 1.00 2.81 H new ATOM 0 HH TYR A 60 -10.731 -6.220 2.867 1.00 1.29 H new ATOM 1035 N THR A 61 -7.426 -2.618 -5.000 1.00 0.79 N ATOM 1036 CA THR A 61 -6.789 -1.793 -6.041 1.00 0.77 C ATOM 1037 C THR A 61 -7.740 -1.465 -7.190 1.00 0.78 C ATOM 1038 O THR A 61 -8.682 -2.203 -7.481 1.00 0.81 O ATOM 1039 CB THR A 61 -5.486 -2.435 -6.545 1.00 0.81 C ATOM 1040 OG1 THR A 61 -4.888 -1.586 -7.485 1.00 1.11 O ATOM 1041 CG2 THR A 61 -5.668 -3.784 -7.229 1.00 0.84 C ATOM 0 H THR A 61 -8.340 -2.974 -5.279 1.00 0.79 H new ATOM 0 HA THR A 61 -6.530 -0.842 -5.575 1.00 0.77 H new ATOM 0 HB THR A 61 -4.878 -2.590 -5.654 1.00 0.81 H new ATOM 0 HG1 THR A 61 -4.458 -2.122 -8.183 1.00 1.11 H new ATOM 0 HG21 THR A 61 -4.698 -4.162 -7.552 1.00 0.84 H new ATOM 0 HG22 THR A 61 -6.118 -4.489 -6.530 1.00 0.84 H new ATOM 0 HG23 THR A 61 -6.319 -3.668 -8.096 1.00 0.84 H new ATOM 1049 N ASN A 62 -7.452 -0.345 -7.845 1.00 0.81 N ATOM 1050 CA ASN A 62 -8.096 0.175 -9.053 1.00 0.93 C ATOM 1051 C ASN A 62 -7.386 -0.284 -10.356 1.00 0.85 C ATOM 1052 O ASN A 62 -7.731 0.166 -11.450 1.00 0.89 O ATOM 1053 CB ASN A 62 -8.101 1.699 -8.873 1.00 1.09 C ATOM 1054 CG ASN A 62 -8.958 2.519 -9.830 1.00 1.69 C ATOM 1055 OD1 ASN A 62 -9.852 2.035 -10.514 1.00 2.08 O ATOM 1056 ND2 ASN A 62 -8.732 3.821 -9.838 1.00 2.47 N ATOM 0 H ASN A 62 -6.706 0.272 -7.523 1.00 0.81 H new ATOM 0 HA ASN A 62 -9.108 -0.213 -9.170 1.00 0.93 H new ATOM 0 HB2 ASN A 62 -8.430 1.916 -7.857 1.00 1.09 H new ATOM 0 HB3 ASN A 62 -7.073 2.051 -8.957 1.00 1.09 H new ATOM 0 HD21 ASN A 62 -9.305 4.434 -10.418 1.00 2.47 H new ATOM 0 HD22 ASN A 62 -7.985 4.212 -9.264 1.00 2.47 H new ATOM 1063 N TYR A 63 -6.389 -1.180 -10.266 1.00 0.79 N ATOM 1064 CA TYR A 63 -5.642 -1.728 -11.413 1.00 0.78 C ATOM 1065 C TYR A 63 -6.537 -2.338 -12.525 1.00 0.81 C ATOM 1066 O TYR A 63 -7.632 -2.834 -12.230 1.00 0.84 O ATOM 1067 CB TYR A 63 -4.696 -2.840 -10.922 1.00 0.75 C ATOM 1068 CG TYR A 63 -3.489 -2.490 -10.075 1.00 0.71 C ATOM 1069 CD1 TYR A 63 -2.999 -1.175 -9.955 1.00 2.32 C ATOM 1070 CD2 TYR A 63 -2.846 -3.537 -9.387 1.00 1.56 C ATOM 1071 CE1 TYR A 63 -1.892 -0.899 -9.129 1.00 2.28 C ATOM 1072 CE2 TYR A 63 -1.738 -3.269 -8.566 1.00 1.59 C ATOM 1073 CZ TYR A 63 -1.243 -1.950 -8.447 1.00 0.63 C ATOM 1074 OH TYR A 63 -0.137 -1.691 -7.697 1.00 0.67 O ATOM 0 H TYR A 63 -6.071 -1.553 -9.371 1.00 0.79 H new ATOM 0 HA TYR A 63 -5.108 -0.882 -11.846 1.00 0.78 H new ATOM 0 HB2 TYR A 63 -5.297 -3.549 -10.352 1.00 0.75 H new ATOM 0 HB3 TYR A 63 -4.331 -3.368 -11.803 1.00 0.75 H new ATOM 0 HD1 TYR A 63 -3.475 -0.373 -10.500 1.00 2.32 H new ATOM 0 HD2 TYR A 63 -3.206 -4.550 -9.491 1.00 1.56 H new ATOM 0 HE1 TYR A 63 -1.540 0.116 -9.018 1.00 2.28 H new ATOM 0 HE2 TYR A 63 -1.263 -4.073 -8.024 1.00 1.59 H new ATOM 0 HH TYR A 63 0.187 -2.523 -7.293 1.00 0.67 H new ATOM 1084 N PRO A 64 -6.056 -2.369 -13.789 1.00 0.80 N ATOM 1085 CA PRO A 64 -6.754 -2.986 -14.911 1.00 0.77 C ATOM 1086 C PRO A 64 -6.902 -4.493 -14.700 1.00 0.78 C ATOM 1087 O PRO A 64 -5.974 -5.160 -14.237 1.00 0.75 O ATOM 1088 CB PRO A 64 -5.935 -2.659 -16.168 1.00 0.76 C ATOM 1089 CG PRO A 64 -4.546 -2.304 -15.641 1.00 0.78 C ATOM 1090 CD PRO A 64 -4.834 -1.738 -14.258 1.00 0.85 C ATOM 0 HA PRO A 64 -7.768 -2.599 -15.009 1.00 0.77 H new ATOM 0 HB2 PRO A 64 -5.895 -3.510 -16.848 1.00 0.76 H new ATOM 0 HB3 PRO A 64 -6.373 -1.829 -16.722 1.00 0.76 H new ATOM 0 HG2 PRO A 64 -3.898 -3.179 -15.591 1.00 0.78 H new ATOM 0 HG3 PRO A 64 -4.047 -1.574 -16.279 1.00 0.78 H new ATOM 0 HD2 PRO A 64 -4.008 -1.943 -13.577 1.00 0.85 H new ATOM 0 HD3 PRO A 64 -4.951 -0.655 -14.301 1.00 0.85 H new ATOM 1098 N GLU A 65 -8.062 -5.043 -15.074 1.00 0.81 N ATOM 1099 CA GLU A 65 -8.401 -6.450 -14.840 1.00 0.83 C ATOM 1100 C GLU A 65 -7.421 -7.423 -15.516 1.00 0.81 C ATOM 1101 O GLU A 65 -7.222 -8.530 -15.025 1.00 0.82 O ATOM 1102 CB GLU A 65 -9.848 -6.716 -15.294 1.00 0.88 C ATOM 1103 CG GLU A 65 -10.016 -6.823 -16.817 1.00 0.90 C ATOM 1104 CD GLU A 65 -11.496 -6.958 -17.209 1.00 1.04 C ATOM 1105 OE1 GLU A 65 -12.061 -8.071 -17.087 1.00 1.85 O ATOM 1106 OE2 GLU A 65 -12.101 -5.955 -17.656 1.00 2.26 O ATOM 0 H GLU A 65 -8.797 -4.520 -15.551 1.00 0.81 H new ATOM 0 HA GLU A 65 -8.316 -6.635 -13.769 1.00 0.83 H new ATOM 0 HB2 GLU A 65 -10.198 -7.640 -14.835 1.00 0.88 H new ATOM 0 HB3 GLU A 65 -10.487 -5.914 -14.924 1.00 0.88 H new ATOM 0 HG2 GLU A 65 -9.590 -5.940 -17.295 1.00 0.90 H new ATOM 0 HG3 GLU A 65 -9.460 -7.685 -17.186 1.00 0.90 H new ATOM 1113 N ALA A 66 -6.766 -7.011 -16.607 1.00 0.80 N ATOM 1114 CA ALA A 66 -5.768 -7.815 -17.312 1.00 0.79 C ATOM 1115 C ALA A 66 -4.503 -8.052 -16.466 1.00 0.71 C ATOM 1116 O ALA A 66 -3.936 -9.144 -16.503 1.00 0.71 O ATOM 1117 CB ALA A 66 -5.449 -7.114 -18.637 1.00 0.80 C ATOM 0 H ALA A 66 -6.918 -6.095 -17.029 1.00 0.80 H new ATOM 0 HA ALA A 66 -6.172 -8.808 -17.506 1.00 0.79 H new ATOM 0 HB1 ALA A 66 -4.706 -7.693 -19.185 1.00 0.80 H new ATOM 0 HB2 ALA A 66 -6.358 -7.033 -19.234 1.00 0.80 H new ATOM 0 HB3 ALA A 66 -5.057 -6.117 -18.436 1.00 0.80 H new ATOM 1123 N TRP A 67 -4.109 -7.068 -15.649 1.00 0.66 N ATOM 1124 CA TRP A 67 -3.011 -7.199 -14.687 1.00 0.59 C ATOM 1125 C TRP A 67 -3.464 -7.960 -13.435 1.00 0.59 C ATOM 1126 O TRP A 67 -2.760 -8.846 -12.952 1.00 0.58 O ATOM 1127 CB TRP A 67 -2.485 -5.801 -14.324 1.00 0.54 C ATOM 1128 CG TRP A 67 -1.425 -5.738 -13.262 1.00 0.52 C ATOM 1129 CD1 TRP A 67 -1.400 -4.825 -12.266 1.00 0.60 C ATOM 1130 CD2 TRP A 67 -0.256 -6.596 -13.036 1.00 0.55 C ATOM 1131 NE1 TRP A 67 -0.343 -5.077 -11.419 1.00 0.64 N ATOM 1132 CE2 TRP A 67 0.385 -6.171 -11.829 1.00 0.63 C ATOM 1133 CE3 TRP A 67 0.333 -7.695 -13.710 1.00 0.61 C ATOM 1134 CZ2 TRP A 67 1.507 -6.821 -11.296 1.00 0.78 C ATOM 1135 CZ3 TRP A 67 1.448 -8.361 -13.171 1.00 0.75 C ATOM 1136 CH2 TRP A 67 2.023 -7.939 -11.968 1.00 0.86 C ATOM 0 H TRP A 67 -4.550 -6.148 -15.638 1.00 0.66 H new ATOM 0 HA TRP A 67 -2.205 -7.776 -15.141 1.00 0.59 H new ATOM 0 HB2 TRP A 67 -2.089 -5.340 -15.229 1.00 0.54 H new ATOM 0 HB3 TRP A 67 -3.329 -5.193 -14.000 1.00 0.54 H new ATOM 0 HD1 TRP A 67 -2.106 -4.016 -12.151 1.00 0.60 H new ATOM 0 HE1 TRP A 67 -0.127 -4.522 -10.591 1.00 0.64 H new ATOM 0 HE3 TRP A 67 -0.081 -8.026 -14.651 1.00 0.61 H new ATOM 0 HZ2 TRP A 67 1.966 -6.467 -10.384 1.00 0.78 H new ATOM 0 HZ3 TRP A 67 1.866 -9.209 -13.693 1.00 0.75 H new ATOM 0 HH2 TRP A 67 2.865 -8.475 -11.556 1.00 0.86 H new ATOM 1147 N VAL A 68 -4.663 -7.640 -12.944 1.00 0.64 N ATOM 1148 CA VAL A 68 -5.233 -8.226 -11.718 1.00 0.69 C ATOM 1149 C VAL A 68 -5.533 -9.720 -11.900 1.00 0.77 C ATOM 1150 O VAL A 68 -5.224 -10.521 -11.018 1.00 0.78 O ATOM 1151 CB VAL A 68 -6.503 -7.457 -11.291 1.00 0.74 C ATOM 1152 CG1 VAL A 68 -7.204 -8.063 -10.070 1.00 0.85 C ATOM 1153 CG2 VAL A 68 -6.173 -5.997 -10.945 1.00 0.71 C ATOM 0 H VAL A 68 -5.277 -6.958 -13.389 1.00 0.64 H new ATOM 0 HA VAL A 68 -4.491 -8.134 -10.925 1.00 0.69 H new ATOM 0 HB VAL A 68 -7.171 -7.523 -12.150 1.00 0.74 H new ATOM 0 HG11 VAL A 68 -8.087 -7.472 -9.827 1.00 0.85 H new ATOM 0 HG12 VAL A 68 -7.503 -9.087 -10.293 1.00 0.85 H new ATOM 0 HG13 VAL A 68 -6.521 -8.061 -9.220 1.00 0.85 H new ATOM 0 HG21 VAL A 68 -7.085 -5.479 -10.648 1.00 0.71 H new ATOM 0 HG22 VAL A 68 -5.456 -5.971 -10.124 1.00 0.71 H new ATOM 0 HG23 VAL A 68 -5.744 -5.504 -11.817 1.00 0.71 H new ATOM 1163 N SER A 69 -6.100 -10.111 -13.045 1.00 0.84 N ATOM 1164 CA SER A 69 -6.348 -11.523 -13.368 1.00 0.96 C ATOM 1165 C SER A 69 -5.036 -12.285 -13.564 1.00 0.94 C ATOM 1166 O SER A 69 -4.868 -13.351 -12.987 1.00 0.99 O ATOM 1167 CB SER A 69 -7.230 -11.641 -14.620 1.00 1.06 C ATOM 1168 OG SER A 69 -7.695 -12.973 -14.799 1.00 1.18 O ATOM 0 H SER A 69 -6.400 -9.462 -13.773 1.00 0.84 H new ATOM 0 HA SER A 69 -6.874 -11.972 -12.526 1.00 0.96 H new ATOM 0 HB2 SER A 69 -8.081 -10.965 -14.534 1.00 1.06 H new ATOM 0 HB3 SER A 69 -6.663 -11.330 -15.498 1.00 1.06 H new ATOM 0 HG SER A 69 -8.255 -13.019 -15.602 1.00 1.18 H new ATOM 1174 N TYR A 70 -4.062 -11.730 -14.294 1.00 0.87 N ATOM 1175 CA TYR A 70 -2.751 -12.353 -14.510 1.00 0.88 C ATOM 1176 C TYR A 70 -2.007 -12.626 -13.189 1.00 0.85 C ATOM 1177 O TYR A 70 -1.487 -13.725 -12.999 1.00 0.92 O ATOM 1178 CB TYR A 70 -1.966 -11.449 -15.465 1.00 0.83 C ATOM 1179 CG TYR A 70 -0.593 -11.953 -15.836 1.00 0.85 C ATOM 1180 CD1 TYR A 70 -0.454 -13.087 -16.656 1.00 2.24 C ATOM 1181 CD2 TYR A 70 0.545 -11.271 -15.380 1.00 1.92 C ATOM 1182 CE1 TYR A 70 0.828 -13.551 -17.007 1.00 2.37 C ATOM 1183 CE2 TYR A 70 1.828 -11.706 -15.750 1.00 1.85 C ATOM 1184 CZ TYR A 70 1.977 -12.854 -16.562 1.00 0.97 C ATOM 1185 OH TYR A 70 3.222 -13.285 -16.912 1.00 1.06 O ATOM 0 H TYR A 70 -4.163 -10.826 -14.756 1.00 0.87 H new ATOM 0 HA TYR A 70 -2.871 -13.339 -14.959 1.00 0.88 H new ATOM 0 HB2 TYR A 70 -2.547 -11.318 -16.378 1.00 0.83 H new ATOM 0 HB3 TYR A 70 -1.864 -10.465 -15.008 1.00 0.83 H new ATOM 0 HD1 TYR A 70 -1.332 -13.603 -17.017 1.00 2.24 H new ATOM 0 HD2 TYR A 70 0.434 -10.407 -14.741 1.00 1.92 H new ATOM 0 HE1 TYR A 70 0.935 -14.437 -17.615 1.00 2.37 H new ATOM 0 HE2 TYR A 70 2.700 -11.164 -15.415 1.00 1.85 H new ATOM 0 HH TYR A 70 3.896 -12.690 -16.521 1.00 1.06 H new ATOM 1195 N TYR A 71 -2.042 -11.686 -12.238 1.00 0.78 N ATOM 1196 CA TYR A 71 -1.512 -11.871 -10.879 1.00 0.80 C ATOM 1197 C TYR A 71 -2.177 -13.037 -10.131 1.00 0.89 C ATOM 1198 O TYR A 71 -1.482 -13.857 -9.530 1.00 0.95 O ATOM 1199 CB TYR A 71 -1.646 -10.549 -10.099 1.00 0.76 C ATOM 1200 CG TYR A 71 -1.663 -10.675 -8.580 1.00 1.35 C ATOM 1201 CD1 TYR A 71 -0.467 -10.733 -7.839 1.00 1.98 C ATOM 1202 CD2 TYR A 71 -2.899 -10.717 -7.902 1.00 2.76 C ATOM 1203 CE1 TYR A 71 -0.504 -10.777 -6.432 1.00 2.51 C ATOM 1204 CE2 TYR A 71 -2.941 -10.714 -6.496 1.00 3.35 C ATOM 1205 CZ TYR A 71 -1.741 -10.667 -5.760 1.00 2.78 C ATOM 1206 OH TYR A 71 -1.795 -10.480 -4.412 1.00 3.48 O ATOM 0 H TYR A 71 -2.445 -10.761 -12.391 1.00 0.78 H new ATOM 0 HA TYR A 71 -0.459 -12.140 -10.961 1.00 0.80 H new ATOM 0 HB2 TYR A 71 -0.820 -9.897 -10.382 1.00 0.76 H new ATOM 0 HB3 TYR A 71 -2.565 -10.054 -10.414 1.00 0.76 H new ATOM 0 HD1 TYR A 71 0.483 -10.744 -8.352 1.00 1.98 H new ATOM 0 HD2 TYR A 71 -3.819 -10.752 -8.466 1.00 2.76 H new ATOM 0 HE1 TYR A 71 0.410 -10.894 -5.869 1.00 2.51 H new ATOM 0 HE2 TYR A 71 -3.890 -10.748 -5.982 1.00 3.35 H new ATOM 0 HH TYR A 71 -2.731 -10.426 -4.126 1.00 3.48 H new ATOM 1216 N GLN A 72 -3.508 -13.129 -10.177 1.00 0.94 N ATOM 1217 CA GLN A 72 -4.262 -14.192 -9.506 1.00 1.07 C ATOM 1218 C GLN A 72 -4.113 -15.553 -10.205 1.00 1.19 C ATOM 1219 O GLN A 72 -3.975 -16.578 -9.543 1.00 1.27 O ATOM 1220 CB GLN A 72 -5.743 -13.779 -9.403 1.00 1.12 C ATOM 1221 CG GLN A 72 -5.994 -12.771 -8.267 1.00 1.12 C ATOM 1222 CD GLN A 72 -7.450 -12.780 -7.798 1.00 1.56 C ATOM 1223 OE1 GLN A 72 -7.870 -13.617 -7.008 1.00 1.58 O ATOM 1224 NE2 GLN A 72 -8.281 -11.868 -8.260 1.00 2.81 N ATOM 0 H GLN A 72 -4.096 -12.466 -10.682 1.00 0.94 H new ATOM 0 HA GLN A 72 -3.848 -14.320 -8.506 1.00 1.07 H new ATOM 0 HB2 GLN A 72 -6.062 -13.342 -10.349 1.00 1.12 H new ATOM 0 HB3 GLN A 72 -6.354 -14.666 -9.239 1.00 1.12 H new ATOM 0 HG2 GLN A 72 -5.342 -13.004 -7.426 1.00 1.12 H new ATOM 0 HG3 GLN A 72 -5.730 -11.770 -8.607 1.00 1.12 H new ATOM 0 HE21 GLN A 72 -7.950 -11.163 -8.918 1.00 2.81 H new ATOM 0 HE22 GLN A 72 -9.256 -11.867 -7.959 1.00 2.81 H new ATOM 1233 N ALA A 73 -4.130 -15.572 -11.537 1.00 1.21 N ATOM 1234 CA ALA A 73 -4.194 -16.781 -12.361 1.00 1.32 C ATOM 1235 C ALA A 73 -2.867 -17.563 -12.385 1.00 1.33 C ATOM 1236 O ALA A 73 -2.866 -18.794 -12.371 1.00 1.40 O ATOM 1237 CB ALA A 73 -4.658 -16.365 -13.765 1.00 1.43 C ATOM 0 H ALA A 73 -4.099 -14.717 -12.093 1.00 1.21 H new ATOM 0 HA ALA A 73 -4.909 -17.479 -11.926 1.00 1.32 H new ATOM 0 HB1 ALA A 73 -4.716 -17.246 -14.405 1.00 1.43 H new ATOM 0 HB2 ALA A 73 -5.641 -15.898 -13.700 1.00 1.43 H new ATOM 0 HB3 ALA A 73 -3.947 -15.655 -14.188 1.00 1.43 H new ATOM 1243 N LYS A 74 -1.735 -16.850 -12.438 1.00 1.26 N ATOM 1244 CA LYS A 74 -0.379 -17.409 -12.314 1.00 1.28 C ATOM 1245 C LYS A 74 0.121 -17.470 -10.854 1.00 1.20 C ATOM 1246 O LYS A 74 1.205 -17.995 -10.596 1.00 1.25 O ATOM 1247 CB LYS A 74 0.551 -16.561 -13.199 1.00 1.33 C ATOM 1248 CG LYS A 74 0.748 -17.083 -14.627 1.00 1.27 C ATOM 1249 CD LYS A 74 -0.496 -17.497 -15.425 1.00 1.53 C ATOM 1250 CE LYS A 74 -1.338 -16.286 -15.838 1.00 2.04 C ATOM 1251 NZ LYS A 74 -2.542 -16.701 -16.607 1.00 2.46 N ATOM 0 H LYS A 74 -1.735 -15.839 -12.572 1.00 1.26 H new ATOM 0 HA LYS A 74 -0.387 -18.447 -12.647 1.00 1.28 H new ATOM 0 HB2 LYS A 74 0.152 -15.548 -13.251 1.00 1.33 H new ATOM 0 HB3 LYS A 74 1.526 -16.495 -12.716 1.00 1.33 H new ATOM 0 HG2 LYS A 74 1.267 -16.311 -15.195 1.00 1.27 H new ATOM 0 HG3 LYS A 74 1.414 -17.944 -14.578 1.00 1.27 H new ATOM 0 HD2 LYS A 74 -0.190 -18.047 -16.315 1.00 1.53 H new ATOM 0 HD3 LYS A 74 -1.104 -18.174 -14.825 1.00 1.53 H new ATOM 0 HE2 LYS A 74 -1.644 -15.733 -14.950 1.00 2.04 H new ATOM 0 HE3 LYS A 74 -0.734 -15.609 -16.442 1.00 2.04 H new ATOM 0 HZ1 LYS A 74 -3.092 -15.859 -16.872 1.00 2.46 H new ATOM 0 HZ2 LYS A 74 -2.248 -17.207 -17.466 1.00 2.46 H new ATOM 0 HZ3 LYS A 74 -3.130 -17.327 -16.021 1.00 2.46 H new ATOM 1265 N ASN A 75 -0.647 -16.926 -9.902 1.00 1.09 N ATOM 1266 CA ASN A 75 -0.361 -16.898 -8.462 1.00 0.99 C ATOM 1267 C ASN A 75 0.957 -16.158 -8.142 1.00 0.82 C ATOM 1268 O ASN A 75 1.847 -16.680 -7.463 1.00 0.78 O ATOM 1269 CB ASN A 75 -0.438 -18.310 -7.853 1.00 1.19 C ATOM 1270 CG ASN A 75 -1.770 -19.006 -8.117 1.00 1.45 C ATOM 1271 OD1 ASN A 75 -1.889 -19.839 -9.007 1.00 1.90 O ATOM 1272 ND2 ASN A 75 -2.805 -18.688 -7.358 1.00 2.14 N ATOM 0 H ASN A 75 -1.531 -16.470 -10.127 1.00 1.09 H new ATOM 0 HA ASN A 75 -1.141 -16.311 -7.977 1.00 0.99 H new ATOM 0 HB2 ASN A 75 0.370 -18.919 -8.260 1.00 1.19 H new ATOM 0 HB3 ASN A 75 -0.277 -18.244 -6.777 1.00 1.19 H new ATOM 0 HD21 ASN A 75 -3.708 -19.137 -7.512 1.00 2.14 H new ATOM 0 HD22 ASN A 75 -2.701 -17.994 -6.618 1.00 2.14 H new ATOM 1279 N PHE A 76 1.081 -14.914 -8.622 1.00 0.77 N ATOM 1280 CA PHE A 76 2.261 -14.060 -8.439 1.00 0.68 C ATOM 1281 C PHE A 76 2.518 -13.680 -6.968 1.00 0.55 C ATOM 1282 O PHE A 76 3.612 -13.227 -6.642 1.00 0.55 O ATOM 1283 CB PHE A 76 2.125 -12.821 -9.335 1.00 0.68 C ATOM 1284 CG PHE A 76 2.667 -12.999 -10.739 1.00 0.77 C ATOM 1285 CD1 PHE A 76 1.864 -13.523 -11.769 1.00 1.97 C ATOM 1286 CD2 PHE A 76 3.989 -12.615 -11.020 1.00 1.35 C ATOM 1287 CE1 PHE A 76 2.382 -13.639 -13.072 1.00 2.03 C ATOM 1288 CE2 PHE A 76 4.508 -12.737 -12.320 1.00 1.37 C ATOM 1289 CZ PHE A 76 3.703 -13.252 -13.347 1.00 0.95 C ATOM 0 H PHE A 76 0.344 -14.462 -9.163 1.00 0.77 H new ATOM 0 HA PHE A 76 3.140 -14.632 -8.737 1.00 0.68 H new ATOM 0 HB2 PHE A 76 1.072 -12.547 -9.398 1.00 0.68 H new ATOM 0 HB3 PHE A 76 2.644 -11.987 -8.862 1.00 0.68 H new ATOM 0 HD1 PHE A 76 0.852 -13.836 -11.560 1.00 1.97 H new ATOM 0 HD2 PHE A 76 4.612 -12.223 -10.230 1.00 1.35 H new ATOM 0 HE1 PHE A 76 1.760 -14.028 -13.865 1.00 2.03 H new ATOM 0 HE2 PHE A 76 5.524 -12.435 -12.528 1.00 1.37 H new ATOM 0 HZ PHE A 76 4.099 -13.351 -14.347 1.00 0.95 H new ATOM 1299 N LEU A 77 1.584 -13.981 -6.055 1.00 0.51 N ATOM 1300 CA LEU A 77 1.799 -13.931 -4.605 1.00 0.50 C ATOM 1301 C LEU A 77 3.013 -14.757 -4.129 1.00 0.51 C ATOM 1302 O LEU A 77 3.539 -14.498 -3.049 1.00 0.58 O ATOM 1303 CB LEU A 77 0.523 -14.390 -3.867 1.00 0.56 C ATOM 1304 CG LEU A 77 -0.670 -13.432 -4.016 1.00 0.69 C ATOM 1305 CD1 LEU A 77 -1.628 -13.858 -5.139 1.00 1.50 C ATOM 1306 CD2 LEU A 77 -1.494 -13.307 -2.730 1.00 0.92 C ATOM 0 H LEU A 77 0.640 -14.271 -6.310 1.00 0.51 H new ATOM 0 HA LEU A 77 2.023 -12.892 -4.363 1.00 0.50 H new ATOM 0 HB2 LEU A 77 0.234 -15.373 -4.240 1.00 0.56 H new ATOM 0 HB3 LEU A 77 0.751 -14.506 -2.808 1.00 0.56 H new ATOM 0 HG LEU A 77 -0.218 -12.470 -4.257 1.00 0.69 H new ATOM 0 HD11 LEU A 77 -2.453 -13.148 -5.202 1.00 1.50 H new ATOM 0 HD12 LEU A 77 -1.091 -13.876 -6.088 1.00 1.50 H new ATOM 0 HD13 LEU A 77 -2.020 -14.852 -4.925 1.00 1.50 H new ATOM 0 HD21 LEU A 77 -2.323 -12.618 -2.894 1.00 0.92 H new ATOM 0 HD22 LEU A 77 -1.885 -14.286 -2.452 1.00 0.92 H new ATOM 0 HD23 LEU A 77 -0.861 -12.928 -1.928 1.00 0.92 H new ATOM 1318 N ALA A 78 3.493 -15.715 -4.930 1.00 0.51 N ATOM 1319 CA ALA A 78 4.732 -16.447 -4.671 1.00 0.58 C ATOM 1320 C ALA A 78 6.009 -15.596 -4.852 1.00 0.56 C ATOM 1321 O ALA A 78 7.046 -15.938 -4.280 1.00 0.62 O ATOM 1322 CB ALA A 78 4.748 -17.655 -5.614 1.00 0.70 C ATOM 0 H ALA A 78 3.023 -16.006 -5.787 1.00 0.51 H new ATOM 0 HA ALA A 78 4.744 -16.750 -3.624 1.00 0.58 H new ATOM 0 HB1 ALA A 78 5.660 -18.230 -5.453 1.00 0.70 H new ATOM 0 HB2 ALA A 78 3.881 -18.285 -5.414 1.00 0.70 H new ATOM 0 HB3 ALA A 78 4.715 -17.310 -6.648 1.00 0.70 H new ATOM 1328 N ILE A 79 5.958 -14.516 -5.649 1.00 0.54 N ATOM 1329 CA ILE A 79 7.135 -13.712 -6.046 1.00 0.63 C ATOM 1330 C ILE A 79 7.012 -12.214 -5.715 1.00 0.68 C ATOM 1331 O ILE A 79 8.037 -11.539 -5.620 1.00 0.73 O ATOM 1332 CB ILE A 79 7.516 -13.969 -7.532 1.00 0.71 C ATOM 1333 CG1 ILE A 79 6.594 -13.320 -8.589 1.00 0.74 C ATOM 1334 CG2 ILE A 79 7.575 -15.482 -7.817 1.00 0.71 C ATOM 1335 CD1 ILE A 79 6.923 -11.853 -8.899 1.00 1.09 C ATOM 0 H ILE A 79 5.085 -14.168 -6.044 1.00 0.54 H new ATOM 0 HA ILE A 79 7.962 -14.059 -5.427 1.00 0.63 H new ATOM 0 HB ILE A 79 8.489 -13.488 -7.637 1.00 0.71 H new ATOM 0 HG12 ILE A 79 6.656 -13.897 -9.512 1.00 0.74 H new ATOM 0 HG13 ILE A 79 5.563 -13.383 -8.242 1.00 0.74 H new ATOM 0 HG21 ILE A 79 7.843 -15.645 -8.861 1.00 0.71 H new ATOM 0 HG22 ILE A 79 8.324 -15.945 -7.174 1.00 0.71 H new ATOM 0 HG23 ILE A 79 6.600 -15.928 -7.618 1.00 0.71 H new ATOM 0 HD11 ILE A 79 6.229 -11.475 -9.650 1.00 1.09 H new ATOM 0 HD12 ILE A 79 6.832 -11.260 -7.989 1.00 1.09 H new ATOM 0 HD13 ILE A 79 7.942 -11.781 -9.278 1.00 1.09 H new ATOM 1347 N ASP A 80 5.804 -11.698 -5.459 1.00 0.69 N ATOM 1348 CA ASP A 80 5.567 -10.371 -4.873 1.00 0.76 C ATOM 1349 C ASP A 80 6.321 -10.229 -3.528 1.00 0.59 C ATOM 1350 O ASP A 80 6.031 -10.987 -2.595 1.00 0.57 O ATOM 1351 CB ASP A 80 4.058 -10.154 -4.633 1.00 0.95 C ATOM 1352 CG ASP A 80 3.352 -9.468 -5.809 1.00 1.80 C ATOM 1353 OD1 ASP A 80 2.927 -10.167 -6.754 1.00 3.54 O ATOM 1354 OD2 ASP A 80 3.196 -8.226 -5.738 1.00 1.95 O ATOM 0 H ASP A 80 4.941 -12.204 -5.658 1.00 0.69 H new ATOM 0 HA ASP A 80 5.936 -9.621 -5.573 1.00 0.76 H new ATOM 0 HB2 ASP A 80 3.584 -11.118 -4.445 1.00 0.95 H new ATOM 0 HB3 ASP A 80 3.922 -9.552 -3.735 1.00 0.95 H new ATOM 1359 N PRO A 81 7.252 -9.264 -3.380 1.00 0.61 N ATOM 1360 CA PRO A 81 8.005 -9.075 -2.145 1.00 0.58 C ATOM 1361 C PRO A 81 7.259 -8.193 -1.133 1.00 0.60 C ATOM 1362 O PRO A 81 7.549 -8.264 0.058 1.00 0.75 O ATOM 1363 CB PRO A 81 9.318 -8.430 -2.597 1.00 0.68 C ATOM 1364 CG PRO A 81 8.901 -7.573 -3.793 1.00 0.71 C ATOM 1365 CD PRO A 81 7.711 -8.324 -4.393 1.00 0.85 C ATOM 0 HA PRO A 81 8.162 -10.017 -1.620 1.00 0.58 H new ATOM 0 HB2 PRO A 81 9.762 -7.826 -1.806 1.00 0.68 H new ATOM 0 HB3 PRO A 81 10.057 -9.180 -2.879 1.00 0.68 H new ATOM 0 HG2 PRO A 81 8.622 -6.566 -3.484 1.00 0.71 H new ATOM 0 HG3 PRO A 81 9.713 -7.472 -4.513 1.00 0.71 H new ATOM 0 HD2 PRO A 81 6.915 -7.631 -4.667 1.00 0.85 H new ATOM 0 HD3 PRO A 81 8.004 -8.848 -5.303 1.00 0.85 H new ATOM 1373 N VAL A 82 6.283 -7.391 -1.582 1.00 0.59 N ATOM 1374 CA VAL A 82 5.540 -6.438 -0.734 1.00 0.74 C ATOM 1375 C VAL A 82 4.654 -7.144 0.305 1.00 0.80 C ATOM 1376 O VAL A 82 4.312 -6.552 1.324 1.00 1.12 O ATOM 1377 CB VAL A 82 4.698 -5.466 -1.601 1.00 0.86 C ATOM 1378 CG1 VAL A 82 3.811 -4.508 -0.794 1.00 2.61 C ATOM 1379 CG2 VAL A 82 5.616 -4.677 -2.542 1.00 1.94 C ATOM 0 H VAL A 82 5.981 -7.383 -2.556 1.00 0.59 H new ATOM 0 HA VAL A 82 6.283 -5.862 -0.182 1.00 0.74 H new ATOM 0 HB VAL A 82 4.012 -6.089 -2.174 1.00 0.86 H new ATOM 0 HG11 VAL A 82 3.257 -3.864 -1.476 1.00 2.61 H new ATOM 0 HG12 VAL A 82 3.111 -5.083 -0.189 1.00 2.61 H new ATOM 0 HG13 VAL A 82 4.435 -3.896 -0.143 1.00 2.61 H new ATOM 0 HG21 VAL A 82 5.018 -3.996 -3.148 1.00 1.94 H new ATOM 0 HG22 VAL A 82 6.334 -4.104 -1.955 1.00 1.94 H new ATOM 0 HG23 VAL A 82 6.150 -5.369 -3.194 1.00 1.94 H new ATOM 1389 N LEU A 83 4.331 -8.426 0.097 1.00 0.67 N ATOM 1390 CA LEU A 83 3.539 -9.224 1.038 1.00 0.75 C ATOM 1391 C LEU A 83 4.390 -10.035 2.034 1.00 0.80 C ATOM 1392 O LEU A 83 3.823 -10.799 2.818 1.00 0.97 O ATOM 1393 CB LEU A 83 2.491 -10.045 0.258 1.00 0.74 C ATOM 1394 CG LEU A 83 2.993 -11.029 -0.820 1.00 0.66 C ATOM 1395 CD1 LEU A 83 3.856 -12.172 -0.267 1.00 0.77 C ATOM 1396 CD2 LEU A 83 1.763 -11.618 -1.525 1.00 0.86 C ATOM 0 H LEU A 83 4.615 -8.942 -0.736 1.00 0.67 H new ATOM 0 HA LEU A 83 2.995 -8.547 1.697 1.00 0.75 H new ATOM 0 HB2 LEU A 83 1.907 -10.613 0.982 1.00 0.74 H new ATOM 0 HB3 LEU A 83 1.809 -9.344 -0.223 1.00 0.74 H new ATOM 0 HG LEU A 83 3.635 -10.471 -1.502 1.00 0.66 H new ATOM 0 HD11 LEU A 83 4.170 -12.820 -1.086 1.00 0.77 H new ATOM 0 HD12 LEU A 83 4.736 -11.758 0.226 1.00 0.77 H new ATOM 0 HD13 LEU A 83 3.276 -12.751 0.452 1.00 0.77 H new ATOM 0 HD21 LEU A 83 2.086 -12.319 -2.295 1.00 0.86 H new ATOM 0 HD22 LEU A 83 1.141 -12.139 -0.797 1.00 0.86 H new ATOM 0 HD23 LEU A 83 1.188 -10.814 -1.985 1.00 0.86 H new ATOM 1408 N ASN A 84 5.721 -9.884 2.004 1.00 0.74 N ATOM 1409 CA ASN A 84 6.681 -10.649 2.810 1.00 0.75 C ATOM 1410 C ASN A 84 7.468 -9.756 3.794 1.00 0.65 C ATOM 1411 O ASN A 84 8.300 -8.973 3.330 1.00 0.60 O ATOM 1412 CB ASN A 84 7.676 -11.337 1.859 1.00 0.83 C ATOM 1413 CG ASN A 84 8.607 -12.313 2.590 1.00 1.39 C ATOM 1414 OD1 ASN A 84 8.647 -12.369 3.813 1.00 2.32 O ATOM 1415 ND2 ASN A 84 9.405 -13.091 1.885 1.00 1.56 N ATOM 0 H ASN A 84 6.174 -9.202 1.396 1.00 0.74 H new ATOM 0 HA ASN A 84 6.121 -11.375 3.400 1.00 0.75 H new ATOM 0 HB2 ASN A 84 7.124 -11.875 1.088 1.00 0.83 H new ATOM 0 HB3 ASN A 84 8.274 -10.579 1.353 1.00 0.83 H new ATOM 0 HD21 ASN A 84 10.045 -13.729 2.359 1.00 1.56 H new ATOM 0 HD22 ASN A 84 9.382 -13.055 0.866 1.00 1.56 H new ATOM 1422 N PRO A 85 7.319 -9.915 5.129 1.00 0.70 N ATOM 1423 CA PRO A 85 8.011 -9.084 6.118 1.00 0.76 C ATOM 1424 C PRO A 85 9.546 -9.216 6.099 1.00 0.80 C ATOM 1425 O PRO A 85 10.222 -8.317 6.598 1.00 0.93 O ATOM 1426 CB PRO A 85 7.429 -9.499 7.475 1.00 0.92 C ATOM 1427 CG PRO A 85 6.983 -10.940 7.247 1.00 0.89 C ATOM 1428 CD PRO A 85 6.485 -10.901 5.805 1.00 0.82 C ATOM 0 HA PRO A 85 7.846 -8.030 5.893 1.00 0.76 H new ATOM 0 HB2 PRO A 85 8.173 -9.430 8.269 1.00 0.92 H new ATOM 0 HB3 PRO A 85 6.594 -8.862 7.765 1.00 0.92 H new ATOM 0 HG2 PRO A 85 7.804 -11.645 7.375 1.00 0.89 H new ATOM 0 HG3 PRO A 85 6.197 -11.237 7.941 1.00 0.89 H new ATOM 0 HD2 PRO A 85 6.574 -11.879 5.333 1.00 0.82 H new ATOM 0 HD3 PRO A 85 5.433 -10.620 5.761 1.00 0.82 H new ATOM 1436 N GLU A 86 10.113 -10.280 5.509 1.00 0.82 N ATOM 1437 CA GLU A 86 11.569 -10.475 5.405 1.00 1.00 C ATOM 1438 C GLU A 86 12.271 -9.389 4.567 1.00 0.92 C ATOM 1439 O GLU A 86 13.444 -9.092 4.798 1.00 1.07 O ATOM 1440 CB GLU A 86 11.880 -11.837 4.760 1.00 1.20 C ATOM 1441 CG GLU A 86 11.411 -13.045 5.579 1.00 1.43 C ATOM 1442 CD GLU A 86 11.741 -14.359 4.851 1.00 2.38 C ATOM 1443 OE1 GLU A 86 11.214 -14.595 3.737 1.00 3.19 O ATOM 1444 OE2 GLU A 86 12.532 -15.169 5.393 1.00 3.54 O ATOM 0 H GLU A 86 9.571 -11.035 5.088 1.00 0.82 H new ATOM 0 HA GLU A 86 11.948 -10.420 6.426 1.00 1.00 H new ATOM 0 HB2 GLU A 86 11.411 -11.876 3.777 1.00 1.20 H new ATOM 0 HB3 GLU A 86 12.956 -11.915 4.604 1.00 1.20 H new ATOM 0 HG2 GLU A 86 11.891 -13.035 6.557 1.00 1.43 H new ATOM 0 HG3 GLU A 86 10.337 -12.979 5.751 1.00 1.43 H new ATOM 1451 N ASN A 87 11.576 -8.801 3.583 1.00 0.72 N ATOM 1452 CA ASN A 87 12.165 -7.846 2.634 1.00 0.72 C ATOM 1453 C ASN A 87 12.260 -6.410 3.199 1.00 0.72 C ATOM 1454 O ASN A 87 13.078 -5.610 2.739 1.00 0.79 O ATOM 1455 CB ASN A 87 11.350 -7.907 1.323 1.00 0.67 C ATOM 1456 CG ASN A 87 12.230 -7.806 0.078 1.00 1.06 C ATOM 1457 OD1 ASN A 87 12.126 -6.885 -0.717 1.00 2.29 O ATOM 1458 ND2 ASN A 87 13.112 -8.765 -0.145 1.00 1.63 N ATOM 0 H ASN A 87 10.584 -8.976 3.422 1.00 0.72 H new ATOM 0 HA ASN A 87 13.199 -8.132 2.440 1.00 0.72 H new ATOM 0 HB2 ASN A 87 10.789 -8.841 1.292 1.00 0.67 H new ATOM 0 HB3 ASN A 87 10.621 -7.097 1.315 1.00 0.67 H new ATOM 0 HD21 ASN A 87 13.701 -8.733 -0.977 1.00 1.63 H new ATOM 0 HD22 ASN A 87 13.204 -9.537 0.515 1.00 1.63 H new ATOM 1465 N PHE A 88 11.446 -6.089 4.214 1.00 0.71 N ATOM 1466 CA PHE A 88 11.300 -4.763 4.826 1.00 0.76 C ATOM 1467 C PHE A 88 12.389 -4.522 5.883 1.00 0.88 C ATOM 1468 O PHE A 88 12.140 -4.545 7.088 1.00 1.01 O ATOM 1469 CB PHE A 88 9.880 -4.639 5.405 1.00 0.74 C ATOM 1470 CG PHE A 88 8.796 -4.690 4.350 1.00 0.65 C ATOM 1471 CD1 PHE A 88 8.331 -5.927 3.871 1.00 1.88 C ATOM 1472 CD2 PHE A 88 8.273 -3.499 3.826 1.00 1.68 C ATOM 1473 CE1 PHE A 88 7.347 -5.988 2.866 1.00 1.88 C ATOM 1474 CE2 PHE A 88 7.265 -3.549 2.851 1.00 1.66 C ATOM 1475 CZ PHE A 88 6.805 -4.786 2.374 1.00 0.56 C ATOM 0 H PHE A 88 10.841 -6.784 4.652 1.00 0.71 H new ATOM 0 HA PHE A 88 11.434 -3.987 4.072 1.00 0.76 H new ATOM 0 HB2 PHE A 88 9.717 -5.443 6.123 1.00 0.74 H new ATOM 0 HB3 PHE A 88 9.800 -3.700 5.953 1.00 0.74 H new ATOM 0 HD1 PHE A 88 8.734 -6.842 4.279 1.00 1.88 H new ATOM 0 HD2 PHE A 88 8.645 -2.546 4.172 1.00 1.68 H new ATOM 0 HE1 PHE A 88 7.014 -6.940 2.480 1.00 1.88 H new ATOM 0 HE2 PHE A 88 6.842 -2.633 2.467 1.00 1.66 H new ATOM 0 HZ PHE A 88 6.029 -4.816 1.623 1.00 0.56 H new ATOM 1485 N SER A 89 13.622 -4.290 5.431 1.00 0.87 N ATOM 1486 CA SER A 89 14.820 -4.337 6.295 1.00 1.01 C ATOM 1487 C SER A 89 14.927 -3.155 7.279 1.00 1.02 C ATOM 1488 O SER A 89 15.621 -3.253 8.294 1.00 1.18 O ATOM 1489 CB SER A 89 16.087 -4.418 5.426 1.00 1.04 C ATOM 1490 OG SER A 89 16.151 -5.638 4.692 1.00 1.08 O ATOM 0 H SER A 89 13.827 -4.064 4.458 1.00 0.87 H new ATOM 0 HA SER A 89 14.721 -5.232 6.909 1.00 1.01 H new ATOM 0 HB2 SER A 89 16.107 -3.576 4.734 1.00 1.04 H new ATOM 0 HB3 SER A 89 16.969 -4.329 6.061 1.00 1.04 H new ATOM 0 HG SER A 89 16.968 -5.652 4.151 1.00 1.08 H new ATOM 1496 N GLN A 90 14.210 -2.055 7.018 1.00 0.91 N ATOM 1497 CA GLN A 90 14.030 -0.920 7.936 1.00 1.00 C ATOM 1498 C GLN A 90 12.543 -0.510 8.040 1.00 0.95 C ATOM 1499 O GLN A 90 12.230 0.664 8.243 1.00 1.00 O ATOM 1500 CB GLN A 90 14.943 0.253 7.512 1.00 1.10 C ATOM 1501 CG GLN A 90 16.442 -0.075 7.643 1.00 1.18 C ATOM 1502 CD GLN A 90 17.321 1.162 7.449 1.00 1.59 C ATOM 1503 OE1 GLN A 90 17.804 1.772 8.396 1.00 2.35 O ATOM 1504 NE2 GLN A 90 17.555 1.597 6.225 1.00 2.59 N ATOM 0 H GLN A 90 13.722 -1.925 6.132 1.00 0.91 H new ATOM 0 HA GLN A 90 14.330 -1.224 8.939 1.00 1.00 H new ATOM 0 HB2 GLN A 90 14.724 0.522 6.478 1.00 1.10 H new ATOM 0 HB3 GLN A 90 14.713 1.125 8.124 1.00 1.10 H new ATOM 0 HG2 GLN A 90 16.634 -0.505 8.626 1.00 1.18 H new ATOM 0 HG3 GLN A 90 16.713 -0.831 6.906 1.00 1.18 H new ATOM 0 HE21 GLN A 90 17.162 1.103 5.424 1.00 2.59 H new ATOM 0 HE22 GLN A 90 18.129 2.427 6.080 1.00 2.59 H new ATOM 1513 N GLY A 91 11.603 -1.461 7.868 1.00 0.86 N ATOM 1514 CA GLY A 91 10.159 -1.197 7.971 1.00 0.85 C ATOM 1515 C GLY A 91 9.551 -0.532 6.730 1.00 0.77 C ATOM 1516 O GLY A 91 8.437 -0.019 6.789 1.00 0.85 O ATOM 0 H GLY A 91 11.827 -2.433 7.654 1.00 0.86 H new ATOM 0 HA2 GLY A 91 9.641 -2.138 8.155 1.00 0.85 H new ATOM 0 HA3 GLY A 91 9.979 -0.559 8.836 1.00 0.85 H new ATOM 1520 N HIS A 92 10.286 -0.502 5.619 1.00 0.68 N ATOM 1521 CA HIS A 92 9.983 0.259 4.407 1.00 0.68 C ATOM 1522 C HIS A 92 10.474 -0.495 3.151 1.00 0.61 C ATOM 1523 O HIS A 92 11.357 -1.354 3.262 1.00 0.62 O ATOM 1524 CB HIS A 92 10.669 1.630 4.543 1.00 0.83 C ATOM 1525 CG HIS A 92 10.503 2.496 3.325 1.00 0.83 C ATOM 1526 ND1 HIS A 92 9.321 3.028 2.878 1.00 0.89 N ATOM 1527 CD2 HIS A 92 11.451 2.756 2.374 1.00 0.82 C ATOM 1528 CE1 HIS A 92 9.537 3.577 1.674 1.00 0.86 C ATOM 1529 NE2 HIS A 92 10.830 3.446 1.329 1.00 0.81 N ATOM 0 H HIS A 92 11.152 -1.034 5.535 1.00 0.68 H new ATOM 0 HA HIS A 92 8.907 0.389 4.292 1.00 0.68 H new ATOM 0 HB2 HIS A 92 10.260 2.150 5.409 1.00 0.83 H new ATOM 0 HB3 HIS A 92 11.732 1.481 4.733 1.00 0.83 H new ATOM 0 HD1 HIS A 92 8.431 3.009 3.376 1.00 0.89 H new ATOM 0 HD2 HIS A 92 12.493 2.478 2.422 1.00 0.82 H new ATOM 0 HE1 HIS A 92 8.781 4.055 1.069 1.00 0.86 H new ATOM 1537 N LEU A 93 9.931 -0.175 1.963 1.00 0.61 N ATOM 1538 CA LEU A 93 10.342 -0.779 0.690 1.00 0.61 C ATOM 1539 C LEU A 93 10.229 0.195 -0.498 1.00 0.58 C ATOM 1540 O LEU A 93 9.301 0.999 -0.584 1.00 0.58 O ATOM 1541 CB LEU A 93 9.526 -2.071 0.461 1.00 0.64 C ATOM 1542 CG LEU A 93 10.292 -3.184 -0.272 1.00 0.75 C ATOM 1543 CD1 LEU A 93 11.320 -3.810 0.675 1.00 1.33 C ATOM 1544 CD2 LEU A 93 9.330 -4.276 -0.757 1.00 1.45 C ATOM 0 H LEU A 93 9.188 0.517 1.862 1.00 0.61 H new ATOM 0 HA LEU A 93 11.401 -1.029 0.753 1.00 0.61 H new ATOM 0 HB2 LEU A 93 9.192 -2.451 1.426 1.00 0.64 H new ATOM 0 HB3 LEU A 93 8.631 -1.825 -0.111 1.00 0.64 H new ATOM 0 HG LEU A 93 10.795 -2.745 -1.134 1.00 0.75 H new ATOM 0 HD11 LEU A 93 11.862 -4.599 0.154 1.00 1.33 H new ATOM 0 HD12 LEU A 93 12.022 -3.045 1.007 1.00 1.33 H new ATOM 0 HD13 LEU A 93 10.808 -4.232 1.540 1.00 1.33 H new ATOM 0 HD21 LEU A 93 9.893 -5.054 -1.273 1.00 1.45 H new ATOM 0 HD22 LEU A 93 8.811 -4.710 0.098 1.00 1.45 H new ATOM 0 HD23 LEU A 93 8.601 -3.841 -1.441 1.00 1.45 H new ATOM 1556 N MET A 94 11.162 0.081 -1.446 1.00 0.55 N ATOM 1557 CA MET A 94 11.189 0.833 -2.711 1.00 0.47 C ATOM 1558 C MET A 94 11.205 -0.108 -3.915 1.00 0.48 C ATOM 1559 O MET A 94 11.579 -1.274 -3.791 1.00 0.74 O ATOM 1560 CB MET A 94 12.441 1.714 -2.764 1.00 0.57 C ATOM 1561 CG MET A 94 12.340 2.885 -1.794 1.00 0.75 C ATOM 1562 SD MET A 94 13.800 3.939 -1.845 1.00 0.79 S ATOM 1563 CE MET A 94 13.163 5.221 -0.758 1.00 0.82 C ATOM 0 H MET A 94 11.950 -0.560 -1.354 1.00 0.55 H new ATOM 0 HA MET A 94 10.289 1.446 -2.752 1.00 0.47 H new ATOM 0 HB2 MET A 94 13.319 1.115 -2.523 1.00 0.57 H new ATOM 0 HB3 MET A 94 12.580 2.090 -3.777 1.00 0.57 H new ATOM 0 HG2 MET A 94 11.457 3.478 -2.034 1.00 0.75 H new ATOM 0 HG3 MET A 94 12.203 2.505 -0.782 1.00 0.75 H new ATOM 0 HE1 MET A 94 13.984 5.856 -0.424 1.00 0.82 H new ATOM 0 HE2 MET A 94 12.433 5.825 -1.297 1.00 0.82 H new ATOM 0 HE3 MET A 94 12.686 4.761 0.107 1.00 0.82 H new ATOM 1573 N TRP A 95 10.818 0.403 -5.086 1.00 0.50 N ATOM 1574 CA TRP A 95 10.837 -0.352 -6.337 1.00 0.47 C ATOM 1575 C TRP A 95 12.136 -0.027 -7.099 1.00 0.54 C ATOM 1576 O TRP A 95 12.334 1.100 -7.559 1.00 0.62 O ATOM 1577 CB TRP A 95 9.593 -0.015 -7.189 1.00 0.46 C ATOM 1578 CG TRP A 95 8.204 -0.220 -6.632 1.00 0.53 C ATOM 1579 CD1 TRP A 95 7.831 -0.263 -5.330 1.00 0.64 C ATOM 1580 CD2 TRP A 95 6.952 -0.341 -7.385 1.00 0.62 C ATOM 1581 NE1 TRP A 95 6.460 -0.349 -5.228 1.00 0.81 N ATOM 1582 CE2 TRP A 95 5.860 -0.360 -6.466 1.00 0.83 C ATOM 1583 CE3 TRP A 95 6.628 -0.410 -8.759 1.00 0.59 C ATOM 1584 CZ2 TRP A 95 4.521 -0.390 -6.884 1.00 1.01 C ATOM 1585 CZ3 TRP A 95 5.288 -0.463 -9.191 1.00 0.77 C ATOM 1586 CH2 TRP A 95 4.234 -0.443 -8.258 1.00 0.97 C ATOM 0 H TRP A 95 10.480 1.360 -5.191 1.00 0.50 H new ATOM 0 HA TRP A 95 10.809 -1.420 -6.122 1.00 0.47 H new ATOM 0 HB2 TRP A 95 9.673 1.034 -7.475 1.00 0.46 H new ATOM 0 HB3 TRP A 95 9.662 -0.601 -8.105 1.00 0.46 H new ATOM 0 HD1 TRP A 95 8.512 -0.234 -4.492 1.00 0.64 H new ATOM 0 HE1 TRP A 95 5.953 -0.398 -4.344 1.00 0.81 H new ATOM 0 HE3 TRP A 95 7.422 -0.422 -9.491 1.00 0.59 H new ATOM 0 HZ2 TRP A 95 3.721 -0.373 -6.159 1.00 1.01 H new ATOM 0 HZ3 TRP A 95 5.068 -0.519 -10.247 1.00 0.77 H new ATOM 0 HH2 TRP A 95 3.209 -0.468 -8.597 1.00 0.97 H new ATOM 1597 N ASN A 96 13.014 -1.022 -7.234 1.00 0.59 N ATOM 1598 CA ASN A 96 14.297 -0.940 -7.945 1.00 0.68 C ATOM 1599 C ASN A 96 14.445 -2.148 -8.883 1.00 0.57 C ATOM 1600 O ASN A 96 13.866 -3.202 -8.625 1.00 0.52 O ATOM 1601 CB ASN A 96 15.459 -0.896 -6.935 1.00 0.90 C ATOM 1602 CG ASN A 96 15.429 0.338 -6.035 1.00 1.60 C ATOM 1603 OD1 ASN A 96 14.737 0.380 -5.024 1.00 3.07 O ATOM 1604 ND2 ASN A 96 16.182 1.373 -6.365 1.00 1.60 N ATOM 0 H ASN A 96 12.847 -1.946 -6.836 1.00 0.59 H new ATOM 0 HA ASN A 96 14.322 -0.027 -8.539 1.00 0.68 H new ATOM 0 HB2 ASN A 96 15.426 -1.791 -6.314 1.00 0.90 H new ATOM 0 HB3 ASN A 96 16.404 -0.919 -7.477 1.00 0.90 H new ATOM 0 HD21 ASN A 96 16.188 2.207 -5.778 1.00 1.60 H new ATOM 0 HD22 ASN A 96 16.758 1.337 -7.206 1.00 1.60 H new ATOM 1611 N ASP A 97 15.249 -2.034 -9.942 1.00 0.62 N ATOM 1612 CA ASP A 97 15.500 -3.145 -10.879 1.00 0.54 C ATOM 1613 C ASP A 97 16.194 -4.341 -10.194 1.00 0.56 C ATOM 1614 O ASP A 97 15.955 -5.494 -10.550 1.00 0.55 O ATOM 1615 CB ASP A 97 16.322 -2.634 -12.071 1.00 0.57 C ATOM 1616 CG ASP A 97 15.617 -1.475 -12.788 1.00 1.04 C ATOM 1617 OD1 ASP A 97 14.555 -1.704 -13.411 1.00 1.96 O ATOM 1618 OD2 ASP A 97 16.092 -0.321 -12.683 1.00 1.99 O ATOM 0 H ASP A 97 15.745 -1.175 -10.179 1.00 0.62 H new ATOM 0 HA ASP A 97 14.538 -3.512 -11.237 1.00 0.54 H new ATOM 0 HB2 ASP A 97 17.302 -2.306 -11.724 1.00 0.57 H new ATOM 0 HB3 ASP A 97 16.490 -3.450 -12.774 1.00 0.57 H new ATOM 1623 N ASP A 98 17.013 -4.062 -9.174 1.00 0.65 N ATOM 1624 CA ASP A 98 17.648 -5.043 -8.287 1.00 0.75 C ATOM 1625 C ASP A 98 16.637 -5.756 -7.366 1.00 0.69 C ATOM 1626 O ASP A 98 16.707 -6.972 -7.188 1.00 0.76 O ATOM 1627 CB ASP A 98 18.681 -4.308 -7.423 1.00 0.90 C ATOM 1628 CG ASP A 98 19.860 -3.772 -8.248 1.00 1.49 C ATOM 1629 OD1 ASP A 98 20.807 -4.549 -8.519 1.00 2.92 O ATOM 1630 OD2 ASP A 98 19.842 -2.570 -8.607 1.00 2.14 O ATOM 0 H ASP A 98 17.263 -3.103 -8.933 1.00 0.65 H new ATOM 0 HA ASP A 98 18.112 -5.809 -8.908 1.00 0.75 H new ATOM 0 HB2 ASP A 98 18.196 -3.479 -6.907 1.00 0.90 H new ATOM 0 HB3 ASP A 98 19.056 -4.985 -6.656 1.00 0.90 H new ATOM 1635 N LEU A 99 15.673 -5.011 -6.810 1.00 0.60 N ATOM 1636 CA LEU A 99 14.562 -5.534 -6.002 1.00 0.59 C ATOM 1637 C LEU A 99 13.692 -6.464 -6.869 1.00 0.55 C ATOM 1638 O LEU A 99 13.357 -7.582 -6.475 1.00 0.69 O ATOM 1639 CB LEU A 99 13.776 -4.315 -5.461 1.00 0.60 C ATOM 1640 CG LEU A 99 12.855 -4.498 -4.238 1.00 0.68 C ATOM 1641 CD1 LEU A 99 11.931 -5.716 -4.287 1.00 1.96 C ATOM 1642 CD2 LEU A 99 13.668 -4.487 -2.942 1.00 1.37 C ATOM 0 H LEU A 99 15.643 -3.997 -6.913 1.00 0.60 H new ATOM 0 HA LEU A 99 14.912 -6.130 -5.159 1.00 0.59 H new ATOM 0 HB2 LEU A 99 14.502 -3.540 -5.213 1.00 0.60 H new ATOM 0 HB3 LEU A 99 13.165 -3.930 -6.277 1.00 0.60 H new ATOM 0 HG LEU A 99 12.183 -3.640 -4.266 1.00 0.68 H new ATOM 0 HD11 LEU A 99 11.327 -5.751 -3.380 1.00 1.96 H new ATOM 0 HD12 LEU A 99 11.277 -5.642 -5.156 1.00 1.96 H new ATOM 0 HD13 LEU A 99 12.530 -6.624 -4.360 1.00 1.96 H new ATOM 0 HD21 LEU A 99 12.999 -4.618 -2.092 1.00 1.37 H new ATOM 0 HD22 LEU A 99 14.394 -5.300 -2.961 1.00 1.37 H new ATOM 0 HD23 LEU A 99 14.192 -3.536 -2.849 1.00 1.37 H new ATOM 1654 N PHE A 100 13.405 -6.024 -8.097 1.00 0.46 N ATOM 1655 CA PHE A 100 12.613 -6.726 -9.103 1.00 0.53 C ATOM 1656 C PHE A 100 13.420 -7.809 -9.861 1.00 0.59 C ATOM 1657 O PHE A 100 12.924 -8.375 -10.833 1.00 0.65 O ATOM 1658 CB PHE A 100 11.983 -5.683 -10.050 1.00 0.60 C ATOM 1659 CG PHE A 100 10.725 -4.983 -9.543 1.00 0.79 C ATOM 1660 CD1 PHE A 100 10.676 -4.345 -8.288 1.00 1.36 C ATOM 1661 CD2 PHE A 100 9.575 -4.958 -10.356 1.00 1.65 C ATOM 1662 CE1 PHE A 100 9.502 -3.700 -7.858 1.00 1.43 C ATOM 1663 CE2 PHE A 100 8.411 -4.297 -9.941 1.00 1.85 C ATOM 1664 CZ PHE A 100 8.375 -3.658 -8.694 1.00 1.26 C ATOM 0 H PHE A 100 13.738 -5.120 -8.431 1.00 0.46 H new ATOM 0 HA PHE A 100 11.819 -7.280 -8.601 1.00 0.53 H new ATOM 0 HB2 PHE A 100 12.733 -4.923 -10.269 1.00 0.60 H new ATOM 0 HB3 PHE A 100 11.744 -6.176 -10.992 1.00 0.60 H new ATOM 0 HD1 PHE A 100 11.548 -4.351 -7.650 1.00 1.36 H new ATOM 0 HD2 PHE A 100 9.591 -5.456 -11.314 1.00 1.65 H new ATOM 0 HE1 PHE A 100 9.468 -3.236 -6.883 1.00 1.43 H new ATOM 0 HE2 PHE A 100 7.542 -4.280 -10.582 1.00 1.85 H new ATOM 0 HZ PHE A 100 7.484 -3.136 -8.378 1.00 1.26 H new ATOM 1674 N SER A 101 14.650 -8.127 -9.444 1.00 0.68 N ATOM 1675 CA SER A 101 15.537 -9.062 -10.160 1.00 0.84 C ATOM 1676 C SER A 101 15.051 -10.527 -10.107 1.00 0.96 C ATOM 1677 O SER A 101 15.207 -11.261 -11.086 1.00 1.15 O ATOM 1678 CB SER A 101 16.968 -8.924 -9.622 1.00 0.99 C ATOM 1679 OG SER A 101 17.893 -9.685 -10.385 1.00 1.16 O ATOM 0 H SER A 101 15.065 -7.743 -8.595 1.00 0.68 H new ATOM 0 HA SER A 101 15.518 -8.790 -11.215 1.00 0.84 H new ATOM 0 HB2 SER A 101 17.262 -7.874 -9.636 1.00 0.99 H new ATOM 0 HB3 SER A 101 16.999 -9.250 -8.582 1.00 0.99 H new ATOM 0 HG SER A 101 18.793 -9.572 -10.015 1.00 1.16 H new ATOM 1685 N GLU A 102 14.387 -10.955 -9.023 1.00 0.91 N ATOM 1686 CA GLU A 102 13.622 -12.215 -9.011 1.00 1.00 C ATOM 1687 C GLU A 102 12.187 -12.005 -9.533 1.00 1.01 C ATOM 1688 O GLU A 102 11.650 -12.862 -10.235 1.00 1.23 O ATOM 1689 CB GLU A 102 13.645 -12.837 -7.605 1.00 0.98 C ATOM 1690 CG GLU A 102 13.037 -14.249 -7.599 1.00 2.39 C ATOM 1691 CD GLU A 102 13.382 -15.027 -6.317 1.00 2.39 C ATOM 1692 OE1 GLU A 102 13.129 -14.518 -5.200 1.00 2.53 O ATOM 1693 OE2 GLU A 102 13.897 -16.166 -6.420 1.00 3.10 O ATOM 0 H GLU A 102 14.363 -10.446 -8.139 1.00 0.91 H new ATOM 0 HA GLU A 102 14.099 -12.919 -9.693 1.00 1.00 H new ATOM 0 HB2 GLU A 102 14.672 -12.881 -7.243 1.00 0.98 H new ATOM 0 HB3 GLU A 102 13.092 -12.199 -6.916 1.00 0.98 H new ATOM 0 HG2 GLU A 102 11.954 -14.176 -7.697 1.00 2.39 H new ATOM 0 HG3 GLU A 102 13.399 -14.802 -8.466 1.00 2.39 H new ATOM 1700 N ALA A 103 11.582 -10.838 -9.275 1.00 0.79 N ATOM 1701 CA ALA A 103 10.254 -10.456 -9.765 1.00 0.75 C ATOM 1702 C ALA A 103 10.236 -10.025 -11.251 1.00 0.67 C ATOM 1703 O ALA A 103 9.392 -9.229 -11.647 1.00 0.70 O ATOM 1704 CB ALA A 103 9.662 -9.387 -8.825 1.00 0.74 C ATOM 0 H ALA A 103 12.017 -10.114 -8.703 1.00 0.79 H new ATOM 0 HA ALA A 103 9.619 -11.342 -9.745 1.00 0.75 H new ATOM 0 HB1 ALA A 103 8.674 -9.096 -9.181 1.00 0.74 H new ATOM 0 HB2 ALA A 103 9.579 -9.794 -7.817 1.00 0.74 H new ATOM 0 HB3 ALA A 103 10.314 -8.514 -8.811 1.00 0.74 H new ATOM 1710 N GLN A 104 11.137 -10.534 -12.097 1.00 0.67 N ATOM 1711 CA GLN A 104 11.237 -10.166 -13.518 1.00 0.64 C ATOM 1712 C GLN A 104 9.952 -10.374 -14.354 1.00 0.60 C ATOM 1713 O GLN A 104 9.652 -9.486 -15.159 1.00 0.57 O ATOM 1714 CB GLN A 104 12.424 -10.896 -14.172 1.00 0.75 C ATOM 1715 CG GLN A 104 13.744 -10.139 -13.966 1.00 0.73 C ATOM 1716 CD GLN A 104 14.921 -10.873 -14.613 1.00 0.84 C ATOM 1717 OE1 GLN A 104 15.126 -10.834 -15.821 1.00 0.81 O ATOM 1718 NE2 GLN A 104 15.727 -11.584 -13.853 1.00 1.36 N ATOM 0 H GLN A 104 11.830 -11.225 -11.811 1.00 0.67 H new ATOM 0 HA GLN A 104 11.397 -9.088 -13.519 1.00 0.64 H new ATOM 0 HB2 GLN A 104 12.510 -11.898 -13.752 1.00 0.75 H new ATOM 0 HB3 GLN A 104 12.235 -11.013 -15.239 1.00 0.75 H new ATOM 0 HG2 GLN A 104 13.661 -9.139 -14.391 1.00 0.73 H new ATOM 0 HG3 GLN A 104 13.932 -10.018 -12.899 1.00 0.73 H new ATOM 0 HE21 GLN A 104 15.572 -11.628 -12.846 1.00 1.36 H new ATOM 0 HE22 GLN A 104 16.507 -12.091 -14.271 1.00 1.36 H new ATOM 1727 N PRO A 105 9.166 -11.466 -14.204 1.00 0.64 N ATOM 1728 CA PRO A 105 7.933 -11.625 -14.975 1.00 0.61 C ATOM 1729 C PRO A 105 6.801 -10.729 -14.451 1.00 0.57 C ATOM 1730 O PRO A 105 5.865 -10.436 -15.194 1.00 0.54 O ATOM 1731 CB PRO A 105 7.600 -13.117 -14.907 1.00 0.72 C ATOM 1732 CG PRO A 105 8.205 -13.579 -13.584 1.00 0.81 C ATOM 1733 CD PRO A 105 9.383 -12.634 -13.351 1.00 0.77 C ATOM 0 HA PRO A 105 8.060 -11.304 -16.009 1.00 0.61 H new ATOM 0 HB2 PRO A 105 6.523 -13.286 -14.932 1.00 0.72 H new ATOM 0 HB3 PRO A 105 8.028 -13.659 -15.751 1.00 0.72 H new ATOM 0 HG2 PRO A 105 7.480 -13.517 -12.773 1.00 0.81 H new ATOM 0 HG3 PRO A 105 8.534 -14.617 -13.639 1.00 0.81 H new ATOM 0 HD2 PRO A 105 9.442 -12.341 -12.303 1.00 0.77 H new ATOM 0 HD3 PRO A 105 10.325 -13.123 -13.598 1.00 0.77 H new ATOM 1741 N LEU A 106 6.910 -10.235 -13.209 1.00 0.60 N ATOM 1742 CA LEU A 106 6.067 -9.162 -12.684 1.00 0.59 C ATOM 1743 C LEU A 106 6.541 -7.812 -13.220 1.00 0.46 C ATOM 1744 O LEU A 106 5.707 -7.000 -13.602 1.00 0.41 O ATOM 1745 CB LEU A 106 6.046 -9.246 -11.147 1.00 0.74 C ATOM 1746 CG LEU A 106 5.394 -8.036 -10.445 1.00 0.80 C ATOM 1747 CD1 LEU A 106 4.579 -8.505 -9.233 1.00 1.46 C ATOM 1748 CD2 LEU A 106 6.437 -7.000 -10.004 1.00 1.68 C ATOM 0 H LEU A 106 7.596 -10.577 -12.536 1.00 0.60 H new ATOM 0 HA LEU A 106 5.038 -9.274 -13.024 1.00 0.59 H new ATOM 0 HB2 LEU A 106 5.513 -10.150 -10.853 1.00 0.74 H new ATOM 0 HB3 LEU A 106 7.070 -9.349 -10.788 1.00 0.74 H new ATOM 0 HG LEU A 106 4.733 -7.556 -11.166 1.00 0.80 H new ATOM 0 HD11 LEU A 106 4.123 -7.643 -8.745 1.00 1.46 H new ATOM 0 HD12 LEU A 106 3.798 -9.190 -9.563 1.00 1.46 H new ATOM 0 HD13 LEU A 106 5.236 -9.015 -8.528 1.00 1.46 H new ATOM 0 HD21 LEU A 106 5.936 -6.165 -9.514 1.00 1.68 H new ATOM 0 HD22 LEU A 106 7.137 -7.462 -9.308 1.00 1.68 H new ATOM 0 HD23 LEU A 106 6.980 -6.636 -10.876 1.00 1.68 H new ATOM 1760 N TRP A 107 7.855 -7.582 -13.311 1.00 0.50 N ATOM 1761 CA TRP A 107 8.435 -6.343 -13.822 1.00 0.54 C ATOM 1762 C TRP A 107 7.961 -6.092 -15.257 1.00 0.54 C ATOM 1763 O TRP A 107 7.439 -5.023 -15.556 1.00 0.52 O ATOM 1764 CB TRP A 107 9.972 -6.409 -13.740 1.00 0.73 C ATOM 1765 CG TRP A 107 10.752 -5.131 -13.931 1.00 0.72 C ATOM 1766 CD1 TRP A 107 12.102 -5.095 -14.022 1.00 0.82 C ATOM 1767 CD2 TRP A 107 10.317 -3.733 -14.094 1.00 1.02 C ATOM 1768 NE1 TRP A 107 12.526 -3.809 -14.278 1.00 1.08 N ATOM 1769 CE2 TRP A 107 11.466 -2.946 -14.417 1.00 1.21 C ATOM 1770 CE3 TRP A 107 9.090 -3.027 -14.028 1.00 1.38 C ATOM 1771 CZ2 TRP A 107 11.392 -1.589 -14.765 1.00 1.62 C ATOM 1772 CZ3 TRP A 107 9.003 -1.666 -14.372 1.00 1.79 C ATOM 1773 CH2 TRP A 107 10.145 -0.949 -14.762 1.00 1.88 C ATOM 0 H TRP A 107 8.555 -8.267 -13.025 1.00 0.50 H new ATOM 0 HA TRP A 107 8.100 -5.507 -13.208 1.00 0.54 H new ATOM 0 HB2 TRP A 107 10.236 -6.818 -12.765 1.00 0.73 H new ATOM 0 HB3 TRP A 107 10.315 -7.123 -14.488 1.00 0.73 H new ATOM 0 HD1 TRP A 107 12.752 -5.950 -13.910 1.00 0.82 H new ATOM 0 HE1 TRP A 107 13.505 -3.532 -14.355 1.00 1.08 H new ATOM 0 HE3 TRP A 107 8.200 -3.547 -13.706 1.00 1.38 H new ATOM 0 HZ2 TRP A 107 12.285 -1.044 -15.032 1.00 1.62 H new ATOM 0 HZ3 TRP A 107 8.046 -1.167 -14.336 1.00 1.79 H new ATOM 0 HH2 TRP A 107 10.064 0.087 -15.057 1.00 1.88 H new ATOM 1784 N GLU A 108 8.058 -7.104 -16.124 1.00 0.61 N ATOM 1785 CA GLU A 108 7.633 -6.992 -17.520 1.00 0.71 C ATOM 1786 C GLU A 108 6.124 -6.732 -17.637 1.00 0.61 C ATOM 1787 O GLU A 108 5.700 -5.823 -18.357 1.00 0.59 O ATOM 1788 CB GLU A 108 8.056 -8.265 -18.278 1.00 0.90 C ATOM 1789 CG GLU A 108 7.632 -8.336 -19.756 1.00 1.28 C ATOM 1790 CD GLU A 108 8.282 -7.314 -20.709 1.00 1.87 C ATOM 1791 OE1 GLU A 108 8.890 -6.310 -20.273 1.00 2.55 O ATOM 1792 OE2 GLU A 108 8.171 -7.514 -21.941 1.00 3.02 O ATOM 0 H GLU A 108 8.432 -8.020 -15.878 1.00 0.61 H new ATOM 0 HA GLU A 108 8.124 -6.131 -17.973 1.00 0.71 H new ATOM 0 HB2 GLU A 108 9.141 -8.352 -18.226 1.00 0.90 H new ATOM 0 HB3 GLU A 108 7.642 -9.129 -17.759 1.00 0.90 H new ATOM 0 HG2 GLU A 108 7.854 -9.337 -20.127 1.00 1.28 H new ATOM 0 HG3 GLU A 108 6.551 -8.210 -19.807 1.00 1.28 H new ATOM 1799 N ALA A 109 5.307 -7.491 -16.903 1.00 0.58 N ATOM 1800 CA ALA A 109 3.855 -7.336 -16.891 1.00 0.58 C ATOM 1801 C ALA A 109 3.414 -5.965 -16.354 1.00 0.47 C ATOM 1802 O ALA A 109 2.577 -5.299 -16.961 1.00 0.48 O ATOM 1803 CB ALA A 109 3.267 -8.497 -16.093 1.00 0.65 C ATOM 0 H ALA A 109 5.641 -8.238 -16.294 1.00 0.58 H new ATOM 0 HA ALA A 109 3.474 -7.366 -17.912 1.00 0.58 H new ATOM 0 HB1 ALA A 109 2.181 -8.407 -16.067 1.00 0.65 H new ATOM 0 HB2 ALA A 109 3.542 -9.440 -16.566 1.00 0.65 H new ATOM 0 HB3 ALA A 109 3.657 -8.474 -15.076 1.00 0.65 H new ATOM 1809 N ALA A 110 3.991 -5.514 -15.243 1.00 0.40 N ATOM 1810 CA ALA A 110 3.718 -4.209 -14.645 1.00 0.36 C ATOM 1811 C ALA A 110 4.116 -3.060 -15.583 1.00 0.36 C ATOM 1812 O ALA A 110 3.320 -2.147 -15.820 1.00 0.42 O ATOM 1813 CB ALA A 110 4.458 -4.165 -13.301 1.00 0.36 C ATOM 0 H ALA A 110 4.678 -6.058 -14.721 1.00 0.40 H new ATOM 0 HA ALA A 110 2.649 -4.075 -14.479 1.00 0.36 H new ATOM 0 HB1 ALA A 110 4.280 -3.204 -12.819 1.00 0.36 H new ATOM 0 HB2 ALA A 110 4.093 -4.966 -12.658 1.00 0.36 H new ATOM 0 HB3 ALA A 110 5.527 -4.294 -13.470 1.00 0.36 H new ATOM 1819 N ARG A 111 5.305 -3.155 -16.195 1.00 0.40 N ATOM 1820 CA ARG A 111 5.810 -2.217 -17.206 1.00 0.48 C ATOM 1821 C ARG A 111 4.873 -2.126 -18.415 1.00 0.48 C ATOM 1822 O ARG A 111 4.631 -1.025 -18.908 1.00 0.52 O ATOM 1823 CB ARG A 111 7.246 -2.642 -17.592 1.00 0.62 C ATOM 1824 CG ARG A 111 7.838 -2.014 -18.868 1.00 1.14 C ATOM 1825 CD ARG A 111 7.916 -3.062 -19.989 1.00 2.27 C ATOM 1826 NE ARG A 111 8.214 -2.456 -21.297 1.00 3.17 N ATOM 1827 CZ ARG A 111 8.658 -3.100 -22.371 1.00 3.95 C ATOM 1828 NH1 ARG A 111 8.967 -4.380 -22.351 1.00 4.15 N ATOM 1829 NH2 ARG A 111 8.793 -2.449 -23.507 1.00 5.03 N ATOM 0 H ARG A 111 5.961 -3.910 -15.994 1.00 0.40 H new ATOM 0 HA ARG A 111 5.842 -1.209 -16.793 1.00 0.48 H new ATOM 0 HB2 ARG A 111 7.906 -2.403 -16.758 1.00 0.62 H new ATOM 0 HB3 ARG A 111 7.259 -3.726 -17.709 1.00 0.62 H new ATOM 0 HG2 ARG A 111 7.222 -1.174 -19.188 1.00 1.14 H new ATOM 0 HG3 ARG A 111 8.832 -1.619 -18.660 1.00 1.14 H new ATOM 0 HD2 ARG A 111 8.686 -3.795 -19.746 1.00 2.27 H new ATOM 0 HD3 ARG A 111 6.970 -3.601 -20.047 1.00 2.27 H new ATOM 0 HE ARG A 111 8.066 -1.451 -21.387 1.00 3.17 H new ATOM 0 HH11 ARG A 111 8.869 -4.915 -21.488 1.00 4.15 H new ATOM 0 HH12 ARG A 111 9.305 -4.836 -23.198 1.00 4.15 H new ATOM 0 HH21 ARG A 111 8.557 -1.458 -23.558 1.00 5.03 H new ATOM 0 HH22 ARG A 111 9.133 -2.936 -24.336 1.00 5.03 H new ATOM 1843 N ALA A 112 4.311 -3.250 -18.860 1.00 0.49 N ATOM 1844 CA ALA A 112 3.349 -3.315 -19.960 1.00 0.54 C ATOM 1845 C ALA A 112 2.007 -2.660 -19.589 1.00 0.51 C ATOM 1846 O ALA A 112 1.455 -1.877 -20.361 1.00 0.56 O ATOM 1847 CB ALA A 112 3.170 -4.791 -20.338 1.00 0.62 C ATOM 0 H ALA A 112 4.517 -4.163 -18.455 1.00 0.49 H new ATOM 0 HA ALA A 112 3.728 -2.753 -20.814 1.00 0.54 H new ATOM 0 HB1 ALA A 112 2.456 -4.873 -21.158 1.00 0.62 H new ATOM 0 HB2 ALA A 112 4.129 -5.206 -20.649 1.00 0.62 H new ATOM 0 HB3 ALA A 112 2.797 -5.345 -19.476 1.00 0.62 H new ATOM 1853 N HIS A 113 1.488 -2.974 -18.401 1.00 0.47 N ATOM 1854 CA HIS A 113 0.203 -2.474 -17.896 1.00 0.49 C ATOM 1855 C HIS A 113 0.196 -0.990 -17.451 1.00 0.50 C ATOM 1856 O HIS A 113 -0.887 -0.440 -17.228 1.00 0.53 O ATOM 1857 CB HIS A 113 -0.305 -3.433 -16.808 1.00 0.47 C ATOM 1858 CG HIS A 113 -0.797 -4.739 -17.388 1.00 0.50 C ATOM 1859 ND1 HIS A 113 -0.108 -5.927 -17.422 1.00 0.52 N ATOM 1860 CD2 HIS A 113 -2.016 -4.972 -17.971 1.00 0.56 C ATOM 1861 CE1 HIS A 113 -0.883 -6.852 -18.011 1.00 0.58 C ATOM 1862 NE2 HIS A 113 -2.062 -6.314 -18.372 1.00 0.61 N ATOM 0 H HIS A 113 1.959 -3.598 -17.746 1.00 0.47 H new ATOM 0 HA HIS A 113 -0.493 -2.465 -18.735 1.00 0.49 H new ATOM 0 HB2 HIS A 113 0.497 -3.632 -16.097 1.00 0.47 H new ATOM 0 HB3 HIS A 113 -1.113 -2.956 -16.253 1.00 0.47 H new ATOM 0 HD1 HIS A 113 0.833 -6.081 -17.061 1.00 0.52 H new ATOM 0 HD2 HIS A 113 -2.805 -4.246 -18.099 1.00 0.56 H new ATOM 0 HE1 HIS A 113 -0.600 -7.882 -18.172 1.00 0.58 H new ATOM 1870 N GLY A 114 1.362 -0.333 -17.326 1.00 0.49 N ATOM 1871 CA GLY A 114 1.472 1.106 -16.992 1.00 0.54 C ATOM 1872 C GLY A 114 2.087 1.425 -15.628 1.00 0.51 C ATOM 1873 O GLY A 114 2.323 2.593 -15.319 1.00 0.56 O ATOM 0 H GLY A 114 2.266 -0.787 -17.454 1.00 0.49 H new ATOM 0 HA2 GLY A 114 2.069 1.594 -17.762 1.00 0.54 H new ATOM 0 HA3 GLY A 114 0.476 1.547 -17.033 1.00 0.54 H new ATOM 1877 N LEU A 115 2.396 0.407 -14.825 1.00 0.47 N ATOM 1878 CA LEU A 115 2.958 0.522 -13.482 1.00 0.46 C ATOM 1879 C LEU A 115 4.496 0.625 -13.575 1.00 0.51 C ATOM 1880 O LEU A 115 5.219 -0.303 -13.205 1.00 0.92 O ATOM 1881 CB LEU A 115 2.492 -0.683 -12.636 1.00 0.50 C ATOM 1882 CG LEU A 115 0.979 -0.849 -12.362 1.00 0.57 C ATOM 1883 CD1 LEU A 115 0.147 -1.296 -13.576 1.00 0.86 C ATOM 1884 CD2 LEU A 115 0.829 -1.908 -11.261 1.00 1.02 C ATOM 0 H LEU A 115 2.255 -0.563 -15.107 1.00 0.47 H new ATOM 0 HA LEU A 115 2.605 1.427 -12.988 1.00 0.46 H new ATOM 0 HB2 LEU A 115 2.841 -1.590 -13.130 1.00 0.50 H new ATOM 0 HB3 LEU A 115 3.000 -0.628 -11.673 1.00 0.50 H new ATOM 0 HG LEU A 115 0.597 0.133 -12.082 1.00 0.57 H new ATOM 0 HD11 LEU A 115 -0.900 -1.385 -13.287 1.00 0.86 H new ATOM 0 HD12 LEU A 115 0.242 -0.559 -14.373 1.00 0.86 H new ATOM 0 HD13 LEU A 115 0.509 -2.261 -13.930 1.00 0.86 H new ATOM 0 HD21 LEU A 115 -0.228 -2.054 -11.038 1.00 1.02 H new ATOM 0 HD22 LEU A 115 1.262 -2.849 -11.600 1.00 1.02 H new ATOM 0 HD23 LEU A 115 1.346 -1.574 -10.362 1.00 1.02 H new ATOM 1896 N ARG A 116 5.003 1.733 -14.138 1.00 0.49 N ATOM 1897 CA ARG A 116 6.423 1.887 -14.508 1.00 0.52 C ATOM 1898 C ARG A 116 7.335 1.842 -13.270 1.00 0.56 C ATOM 1899 O ARG A 116 8.320 1.115 -13.265 1.00 0.92 O ATOM 1900 CB ARG A 116 6.669 3.206 -15.260 1.00 0.62 C ATOM 1901 CG ARG A 116 6.248 3.347 -16.737 1.00 0.89 C ATOM 1902 CD ARG A 116 5.243 2.364 -17.361 1.00 1.26 C ATOM 1903 NE ARG A 116 4.314 3.090 -18.247 1.00 1.89 N ATOM 1904 CZ ARG A 116 3.768 2.699 -19.392 1.00 2.55 C ATOM 1905 NH1 ARG A 116 3.964 1.509 -19.915 1.00 3.21 N ATOM 1906 NH2 ARG A 116 2.965 3.523 -20.028 1.00 3.13 N ATOM 0 H ARG A 116 4.437 2.554 -14.352 1.00 0.49 H new ATOM 0 HA ARG A 116 6.665 1.050 -15.163 1.00 0.52 H new ATOM 0 HB2 ARG A 116 6.163 3.995 -14.703 1.00 0.62 H new ATOM 0 HB3 ARG A 116 7.738 3.414 -15.207 1.00 0.62 H new ATOM 0 HG2 ARG A 116 5.836 4.349 -16.860 1.00 0.89 H new ATOM 0 HG3 ARG A 116 7.157 3.301 -17.336 1.00 0.89 H new ATOM 0 HD2 ARG A 116 5.774 1.598 -17.926 1.00 1.26 H new ATOM 0 HD3 ARG A 116 4.686 1.853 -16.576 1.00 1.26 H new ATOM 0 HE ARG A 116 4.054 4.026 -17.936 1.00 1.89 H new ATOM 0 HH11 ARG A 116 4.561 0.834 -19.437 1.00 3.21 H new ATOM 0 HH12 ARG A 116 3.519 1.261 -20.799 1.00 3.21 H new ATOM 0 HH21 ARG A 116 2.770 4.446 -19.640 1.00 3.13 H new ATOM 0 HH22 ARG A 116 2.537 3.239 -20.909 1.00 3.13 H new ATOM 1920 N ARG A 117 7.018 2.619 -12.231 1.00 0.47 N ATOM 1921 CA ARG A 117 7.703 2.669 -10.924 1.00 0.40 C ATOM 1922 C ARG A 117 6.647 2.935 -9.837 1.00 0.53 C ATOM 1923 O ARG A 117 5.503 3.281 -10.141 1.00 0.76 O ATOM 1924 CB ARG A 117 8.792 3.772 -10.920 1.00 0.61 C ATOM 1925 CG ARG A 117 10.268 3.325 -10.972 1.00 1.04 C ATOM 1926 CD ARG A 117 10.691 2.484 -12.185 1.00 0.81 C ATOM 1927 NE ARG A 117 12.143 2.576 -12.435 1.00 1.86 N ATOM 1928 CZ ARG A 117 13.011 1.581 -12.601 1.00 2.20 C ATOM 1929 NH1 ARG A 117 12.667 0.312 -12.553 1.00 2.74 N ATOM 1930 NH2 ARG A 117 14.275 1.850 -12.834 1.00 3.09 N ATOM 0 H ARG A 117 6.233 3.269 -12.275 1.00 0.47 H new ATOM 0 HA ARG A 117 8.202 1.720 -10.727 1.00 0.40 H new ATOM 0 HB2 ARG A 117 8.610 4.426 -11.773 1.00 0.61 H new ATOM 0 HB3 ARG A 117 8.656 4.374 -10.022 1.00 0.61 H new ATOM 0 HG2 ARG A 117 10.895 4.216 -10.940 1.00 1.04 H new ATOM 0 HG3 ARG A 117 10.482 2.753 -10.070 1.00 1.04 H new ATOM 0 HD2 ARG A 117 10.416 1.442 -12.019 1.00 0.81 H new ATOM 0 HD3 ARG A 117 10.148 2.821 -13.068 1.00 0.81 H new ATOM 0 HE ARG A 117 12.529 3.519 -12.487 1.00 1.86 H new ATOM 0 HH11 ARG A 117 11.695 0.053 -12.382 1.00 2.74 H new ATOM 0 HH12 ARG A 117 13.372 -0.413 -12.687 1.00 2.74 H new ATOM 0 HH21 ARG A 117 14.589 2.819 -12.887 1.00 3.09 H new ATOM 0 HH22 ARG A 117 14.943 1.090 -12.962 1.00 3.09 H new ATOM 1944 N GLY A 118 7.018 2.788 -8.566 1.00 0.51 N ATOM 1945 CA GLY A 118 6.102 2.998 -7.442 1.00 0.64 C ATOM 1946 C GLY A 118 6.807 3.277 -6.123 1.00 0.68 C ATOM 1947 O GLY A 118 7.973 3.665 -6.102 1.00 0.95 O ATOM 0 H GLY A 118 7.961 2.520 -8.285 1.00 0.51 H new ATOM 0 HA2 GLY A 118 5.441 3.833 -7.674 1.00 0.64 H new ATOM 0 HA3 GLY A 118 5.473 2.115 -7.328 1.00 0.64 H new ATOM 1951 N VAL A 119 6.063 3.144 -5.031 1.00 0.52 N ATOM 1952 CA VAL A 119 6.524 3.277 -3.632 1.00 0.53 C ATOM 1953 C VAL A 119 5.729 2.302 -2.764 1.00 0.56 C ATOM 1954 O VAL A 119 4.599 1.985 -3.129 1.00 0.65 O ATOM 1955 CB VAL A 119 6.353 4.714 -3.075 1.00 0.61 C ATOM 1956 CG1 VAL A 119 7.344 5.684 -3.725 1.00 0.92 C ATOM 1957 CG2 VAL A 119 4.939 5.278 -3.265 1.00 0.68 C ATOM 0 H VAL A 119 5.068 2.929 -5.088 1.00 0.52 H new ATOM 0 HA VAL A 119 7.590 3.052 -3.611 1.00 0.53 H new ATOM 0 HB VAL A 119 6.547 4.626 -2.006 1.00 0.61 H new ATOM 0 HG11 VAL A 119 7.199 6.683 -3.313 1.00 0.92 H new ATOM 0 HG12 VAL A 119 8.363 5.353 -3.523 1.00 0.92 H new ATOM 0 HG13 VAL A 119 7.177 5.708 -4.802 1.00 0.92 H new ATOM 0 HG21 VAL A 119 4.891 6.286 -2.853 1.00 0.68 H new ATOM 0 HG22 VAL A 119 4.699 5.309 -4.328 1.00 0.68 H new ATOM 0 HG23 VAL A 119 4.221 4.640 -2.750 1.00 0.68 H new ATOM 1967 N THR A 120 6.289 1.843 -1.636 1.00 0.54 N ATOM 1968 CA THR A 120 5.682 0.821 -0.764 1.00 0.53 C ATOM 1969 C THR A 120 5.893 1.168 0.714 1.00 0.60 C ATOM 1970 O THR A 120 6.915 1.738 1.093 1.00 0.68 O ATOM 1971 CB THR A 120 6.262 -0.553 -1.130 1.00 0.50 C ATOM 1972 OG1 THR A 120 5.852 -0.887 -2.434 1.00 0.51 O ATOM 1973 CG2 THR A 120 5.829 -1.699 -0.222 1.00 0.57 C ATOM 0 H THR A 120 7.191 2.175 -1.296 1.00 0.54 H new ATOM 0 HA THR A 120 4.604 0.792 -0.920 1.00 0.53 H new ATOM 0 HB THR A 120 7.342 -0.446 -1.025 1.00 0.50 H new ATOM 0 HG1 THR A 120 4.875 -0.842 -2.491 1.00 0.51 H new ATOM 0 HG21 THR A 120 6.290 -2.626 -0.561 1.00 0.57 H new ATOM 0 HG22 THR A 120 6.143 -1.491 0.801 1.00 0.57 H new ATOM 0 HG23 THR A 120 4.744 -1.800 -0.256 1.00 0.57 H new ATOM 1981 N GLN A 121 4.925 0.830 1.567 1.00 0.61 N ATOM 1982 CA GLN A 121 5.024 0.949 3.025 1.00 0.63 C ATOM 1983 C GLN A 121 4.521 -0.301 3.751 1.00 0.73 C ATOM 1984 O GLN A 121 3.742 -1.087 3.216 1.00 0.82 O ATOM 1985 CB GLN A 121 4.259 2.190 3.542 1.00 0.50 C ATOM 1986 CG GLN A 121 5.189 3.313 4.030 1.00 1.28 C ATOM 1987 CD GLN A 121 6.182 2.854 5.095 1.00 2.09 C ATOM 1988 OE1 GLN A 121 7.357 2.680 4.825 1.00 3.07 O ATOM 1989 NE2 GLN A 121 5.758 2.567 6.305 1.00 2.94 N ATOM 0 H GLN A 121 4.028 0.457 1.257 1.00 0.61 H new ATOM 0 HA GLN A 121 6.085 1.063 3.246 1.00 0.63 H new ATOM 0 HB2 GLN A 121 3.622 2.575 2.745 1.00 0.50 H new ATOM 0 HB3 GLN A 121 3.602 1.890 4.358 1.00 0.50 H new ATOM 0 HG2 GLN A 121 5.739 3.715 3.179 1.00 1.28 H new ATOM 0 HG3 GLN A 121 4.585 4.126 4.432 1.00 1.28 H new ATOM 0 HE21 GLN A 121 4.777 2.707 6.548 1.00 2.94 H new ATOM 0 HE22 GLN A 121 6.410 2.205 7.001 1.00 2.94 H new ATOM 1998 N TYR A 122 4.953 -0.428 5.009 1.00 0.79 N ATOM 1999 CA TYR A 122 4.691 -1.536 5.930 1.00 0.85 C ATOM 2000 C TYR A 122 4.453 -1.008 7.352 1.00 0.73 C ATOM 2001 O TYR A 122 5.064 -0.013 7.755 1.00 0.78 O ATOM 2002 CB TYR A 122 5.906 -2.489 5.858 1.00 1.07 C ATOM 2003 CG TYR A 122 6.246 -3.366 7.058 1.00 1.08 C ATOM 2004 CD1 TYR A 122 6.802 -2.799 8.224 1.00 2.23 C ATOM 2005 CD2 TYR A 122 6.111 -4.765 6.975 1.00 1.56 C ATOM 2006 CE1 TYR A 122 7.167 -3.610 9.315 1.00 2.24 C ATOM 2007 CE2 TYR A 122 6.467 -5.583 8.063 1.00 1.67 C ATOM 2008 CZ TYR A 122 6.996 -5.010 9.239 1.00 1.25 C ATOM 2009 OH TYR A 122 7.356 -5.810 10.281 1.00 1.37 O ATOM 0 H TYR A 122 5.535 0.291 5.440 1.00 0.79 H new ATOM 0 HA TYR A 122 3.787 -2.076 5.650 1.00 0.85 H new ATOM 0 HB2 TYR A 122 5.753 -3.149 5.004 1.00 1.07 H new ATOM 0 HB3 TYR A 122 6.784 -1.882 5.638 1.00 1.07 H new ATOM 0 HD1 TYR A 122 6.949 -1.731 8.280 1.00 2.23 H new ATOM 0 HD2 TYR A 122 5.731 -5.214 6.069 1.00 1.56 H new ATOM 0 HE1 TYR A 122 7.577 -3.163 10.208 1.00 2.24 H new ATOM 0 HE2 TYR A 122 6.335 -6.653 7.998 1.00 1.67 H new ATOM 0 HH TYR A 122 7.167 -6.745 10.056 1.00 1.37 H new ATOM 2019 N LEU A 123 3.613 -1.695 8.136 1.00 0.70 N ATOM 2020 CA LEU A 123 3.503 -1.465 9.580 1.00 0.67 C ATOM 2021 C LEU A 123 2.982 -2.704 10.320 1.00 0.70 C ATOM 2022 O LEU A 123 2.060 -3.372 9.851 1.00 0.73 O ATOM 2023 CB LEU A 123 2.620 -0.228 9.844 1.00 0.69 C ATOM 2024 CG LEU A 123 2.798 0.381 11.247 1.00 0.82 C ATOM 2025 CD1 LEU A 123 4.176 1.045 11.416 1.00 1.62 C ATOM 2026 CD2 LEU A 123 1.710 1.433 11.465 1.00 1.80 C ATOM 0 H LEU A 123 2.992 -2.425 7.787 1.00 0.70 H new ATOM 0 HA LEU A 123 4.500 -1.271 9.975 1.00 0.67 H new ATOM 0 HB2 LEU A 123 2.846 0.533 9.097 1.00 0.69 H new ATOM 0 HB3 LEU A 123 1.574 -0.505 9.710 1.00 0.69 H new ATOM 0 HG LEU A 123 2.722 -0.423 11.979 1.00 0.82 H new ATOM 0 HD11 LEU A 123 4.259 1.461 12.420 1.00 1.62 H new ATOM 0 HD12 LEU A 123 4.959 0.302 11.266 1.00 1.62 H new ATOM 0 HD13 LEU A 123 4.288 1.843 10.682 1.00 1.62 H new ATOM 0 HD21 LEU A 123 1.823 1.874 12.456 1.00 1.80 H new ATOM 0 HD22 LEU A 123 1.801 2.213 10.709 1.00 1.80 H new ATOM 0 HD23 LEU A 123 0.729 0.964 11.387 1.00 1.80 H new ATOM 2038 N MET A 124 3.560 -2.963 11.496 1.00 0.82 N ATOM 2039 CA MET A 124 3.287 -4.102 12.385 1.00 0.90 C ATOM 2040 C MET A 124 2.638 -3.561 13.671 1.00 0.93 C ATOM 2041 O MET A 124 3.221 -2.695 14.332 1.00 1.03 O ATOM 2042 CB MET A 124 4.650 -4.763 12.689 1.00 0.99 C ATOM 2043 CG MET A 124 4.624 -6.210 13.200 1.00 1.20 C ATOM 2044 SD MET A 124 3.617 -6.573 14.661 1.00 1.71 S ATOM 2045 CE MET A 124 2.325 -7.561 13.864 1.00 1.30 C ATOM 0 H MET A 124 4.276 -2.346 11.879 1.00 0.82 H new ATOM 0 HA MET A 124 2.612 -4.832 11.938 1.00 0.90 H new ATOM 0 HB2 MET A 124 5.250 -4.736 11.779 1.00 0.99 H new ATOM 0 HB3 MET A 124 5.165 -4.151 13.430 1.00 0.99 H new ATOM 0 HG2 MET A 124 4.275 -6.846 12.387 1.00 1.20 H new ATOM 0 HG3 MET A 124 5.650 -6.506 13.419 1.00 1.20 H new ATOM 0 HE1 MET A 124 1.553 -7.807 14.593 1.00 1.30 H new ATOM 0 HE2 MET A 124 1.883 -6.991 13.047 1.00 1.30 H new ATOM 0 HE3 MET A 124 2.760 -8.480 13.472 1.00 1.30 H new ATOM 2055 N LEU A 125 1.444 -4.044 14.036 1.00 0.95 N ATOM 2056 CA LEU A 125 0.755 -3.681 15.284 1.00 1.03 C ATOM 2057 C LEU A 125 0.813 -4.865 16.273 1.00 1.07 C ATOM 2058 O LEU A 125 0.332 -5.949 15.922 1.00 1.01 O ATOM 2059 CB LEU A 125 -0.713 -3.290 15.000 1.00 1.21 C ATOM 2060 CG LEU A 125 -0.946 -1.818 14.595 1.00 1.29 C ATOM 2061 CD1 LEU A 125 -0.276 -1.435 13.268 1.00 2.53 C ATOM 2062 CD2 LEU A 125 -2.458 -1.559 14.499 1.00 1.76 C ATOM 0 H LEU A 125 0.920 -4.708 13.465 1.00 0.95 H new ATOM 0 HA LEU A 125 1.257 -2.821 15.727 1.00 1.03 H new ATOM 0 HB2 LEU A 125 -1.094 -3.931 14.205 1.00 1.21 H new ATOM 0 HB3 LEU A 125 -1.305 -3.501 15.891 1.00 1.21 H new ATOM 0 HG LEU A 125 -0.487 -1.198 15.365 1.00 1.29 H new ATOM 0 HD11 LEU A 125 -0.481 -0.388 13.046 1.00 2.53 H new ATOM 0 HD12 LEU A 125 0.801 -1.585 13.347 1.00 2.53 H new ATOM 0 HD13 LEU A 125 -0.671 -2.060 12.467 1.00 2.53 H new ATOM 0 HD21 LEU A 125 -2.632 -0.522 14.213 1.00 1.76 H new ATOM 0 HD22 LEU A 125 -2.893 -2.220 13.749 1.00 1.76 H new ATOM 0 HD23 LEU A 125 -2.922 -1.752 15.466 1.00 1.76 H new ATOM 2074 N PRO A 126 1.297 -4.671 17.522 1.00 1.32 N ATOM 2075 CA PRO A 126 1.355 -5.729 18.538 1.00 1.42 C ATOM 2076 C PRO A 126 -0.041 -6.170 19.013 1.00 1.38 C ATOM 2077 O PRO A 126 -0.184 -7.260 19.565 1.00 1.45 O ATOM 2078 CB PRO A 126 2.179 -5.139 19.688 1.00 1.77 C ATOM 2079 CG PRO A 126 1.886 -3.644 19.595 1.00 1.82 C ATOM 2080 CD PRO A 126 1.781 -3.416 18.088 1.00 1.56 C ATOM 0 HA PRO A 126 1.807 -6.634 18.133 1.00 1.42 H new ATOM 0 HB2 PRO A 126 1.877 -5.549 20.652 1.00 1.77 H new ATOM 0 HB3 PRO A 126 3.242 -5.349 19.571 1.00 1.77 H new ATOM 0 HG2 PRO A 126 0.962 -3.380 20.110 1.00 1.82 H new ATOM 0 HG3 PRO A 126 2.682 -3.047 20.041 1.00 1.82 H new ATOM 0 HD2 PRO A 126 1.096 -2.598 17.864 1.00 1.56 H new ATOM 0 HD3 PRO A 126 2.749 -3.146 17.666 1.00 1.56 H new ATOM 2088 N GLU A 127 -1.075 -5.361 18.746 1.00 1.43 N ATOM 2089 CA GLU A 127 -2.496 -5.687 18.921 1.00 1.61 C ATOM 2090 C GLU A 127 -3.012 -6.732 17.894 1.00 1.67 C ATOM 2091 O GLU A 127 -4.200 -7.058 17.883 1.00 2.38 O ATOM 2092 CB GLU A 127 -3.272 -4.355 18.883 1.00 2.09 C ATOM 2093 CG GLU A 127 -4.671 -4.414 19.513 1.00 1.83 C ATOM 2094 CD GLU A 127 -5.198 -3.007 19.840 1.00 2.22 C ATOM 2095 OE1 GLU A 127 -5.273 -2.151 18.926 1.00 2.81 O ATOM 2096 OE2 GLU A 127 -5.553 -2.749 21.015 1.00 3.05 O ATOM 0 H GLU A 127 -0.936 -4.417 18.385 1.00 1.43 H new ATOM 0 HA GLU A 127 -2.654 -6.179 19.881 1.00 1.61 H new ATOM 0 HB2 GLU A 127 -2.687 -3.594 19.399 1.00 2.09 H new ATOM 0 HB3 GLU A 127 -3.368 -4.035 17.846 1.00 2.09 H new ATOM 0 HG2 GLU A 127 -5.359 -4.912 18.830 1.00 1.83 H new ATOM 0 HG3 GLU A 127 -4.637 -5.012 20.423 1.00 1.83 H new ATOM 2103 N ARG A 128 -2.115 -7.262 17.042 1.00 1.81 N ATOM 2104 CA ARG A 128 -2.256 -8.427 16.148 1.00 2.05 C ATOM 2105 C ARG A 128 -2.864 -8.055 14.789 1.00 1.31 C ATOM 2106 O ARG A 128 -3.818 -8.679 14.316 1.00 1.84 O ATOM 2107 CB ARG A 128 -2.948 -9.642 16.807 1.00 3.10 C ATOM 2108 CG ARG A 128 -2.220 -10.102 18.077 1.00 4.38 C ATOM 2109 CD ARG A 128 -2.857 -11.376 18.638 1.00 4.89 C ATOM 2110 NE ARG A 128 -2.153 -11.821 19.851 1.00 6.10 N ATOM 2111 CZ ARG A 128 -2.335 -12.969 20.493 1.00 6.69 C ATOM 2112 NH1 ARG A 128 -3.219 -13.860 20.093 1.00 6.62 N ATOM 2113 NH2 ARG A 128 -1.617 -13.237 21.562 1.00 7.89 N ATOM 0 H ARG A 128 -1.187 -6.847 16.954 1.00 1.81 H new ATOM 0 HA ARG A 128 -1.238 -8.762 15.948 1.00 2.05 H new ATOM 0 HB2 ARG A 128 -3.978 -9.383 17.054 1.00 3.10 H new ATOM 0 HB3 ARG A 128 -2.989 -10.466 16.094 1.00 3.10 H new ATOM 0 HG2 ARG A 128 -1.169 -10.284 17.853 1.00 4.38 H new ATOM 0 HG3 ARG A 128 -2.254 -9.312 18.827 1.00 4.38 H new ATOM 0 HD2 ARG A 128 -3.907 -11.193 18.868 1.00 4.89 H new ATOM 0 HD3 ARG A 128 -2.828 -12.164 17.886 1.00 4.89 H new ATOM 0 HE ARG A 128 -1.456 -11.184 20.237 1.00 6.10 H new ATOM 0 HH11 ARG A 128 -3.789 -13.678 19.267 1.00 6.62 H new ATOM 0 HH12 ARG A 128 -3.334 -14.732 20.609 1.00 6.62 H new ATOM 0 HH21 ARG A 128 -0.925 -12.565 21.893 1.00 7.89 H new ATOM 0 HH22 ARG A 128 -1.752 -14.117 22.060 1.00 7.89 H new ATOM 2127 N ALA A 129 -2.279 -7.045 14.141 1.00 1.89 N ATOM 2128 CA ALA A 129 -2.602 -6.655 12.768 1.00 1.74 C ATOM 2129 C ALA A 129 -1.344 -6.288 11.971 1.00 1.55 C ATOM 2130 O ALA A 129 -0.347 -5.824 12.530 1.00 1.83 O ATOM 2131 CB ALA A 129 -3.600 -5.496 12.796 1.00 2.52 C ATOM 0 H ALA A 129 -1.554 -6.465 14.564 1.00 1.89 H new ATOM 0 HA ALA A 129 -3.055 -7.506 12.259 1.00 1.74 H new ATOM 0 HB1 ALA A 129 -3.844 -5.201 11.775 1.00 2.52 H new ATOM 0 HB2 ALA A 129 -4.508 -5.810 13.310 1.00 2.52 H new ATOM 0 HB3 ALA A 129 -3.160 -4.649 13.323 1.00 2.52 H new ATOM 2137 N LEU A 130 -1.405 -6.492 10.657 1.00 1.29 N ATOM 2138 CA LEU A 130 -0.295 -6.280 9.735 1.00 1.20 C ATOM 2139 C LEU A 130 -0.863 -5.821 8.386 1.00 1.16 C ATOM 2140 O LEU A 130 -1.848 -6.378 7.900 1.00 1.11 O ATOM 2141 CB LEU A 130 0.492 -7.606 9.653 1.00 1.10 C ATOM 2142 CG LEU A 130 1.854 -7.518 8.944 1.00 1.21 C ATOM 2143 CD1 LEU A 130 2.878 -6.748 9.780 1.00 2.05 C ATOM 2144 CD2 LEU A 130 2.429 -8.920 8.730 1.00 1.83 C ATOM 0 H LEU A 130 -2.252 -6.819 10.193 1.00 1.29 H new ATOM 0 HA LEU A 130 0.392 -5.501 10.067 1.00 1.20 H new ATOM 0 HB2 LEU A 130 0.651 -7.978 10.665 1.00 1.10 H new ATOM 0 HB3 LEU A 130 -0.122 -8.343 9.135 1.00 1.10 H new ATOM 0 HG LEU A 130 1.680 -7.005 7.998 1.00 1.21 H new ATOM 0 HD11 LEU A 130 3.827 -6.707 9.246 1.00 2.05 H new ATOM 0 HD12 LEU A 130 2.517 -5.735 9.955 1.00 2.05 H new ATOM 0 HD13 LEU A 130 3.021 -7.253 10.736 1.00 2.05 H new ATOM 0 HD21 LEU A 130 3.393 -8.845 8.227 1.00 1.83 H new ATOM 0 HD22 LEU A 130 2.560 -9.411 9.694 1.00 1.83 H new ATOM 0 HD23 LEU A 130 1.744 -9.504 8.116 1.00 1.83 H new ATOM 2156 N GLY A 131 -0.281 -4.783 7.788 1.00 1.21 N ATOM 2157 CA GLY A 131 -0.810 -4.182 6.560 1.00 1.09 C ATOM 2158 C GLY A 131 0.252 -3.438 5.771 1.00 1.03 C ATOM 2159 O GLY A 131 1.128 -2.790 6.349 1.00 1.15 O ATOM 0 H GLY A 131 0.566 -4.335 8.137 1.00 1.21 H new ATOM 0 HA2 GLY A 131 -1.242 -4.963 5.934 1.00 1.09 H new ATOM 0 HA3 GLY A 131 -1.617 -3.495 6.814 1.00 1.09 H new ATOM 2163 N PHE A 132 0.151 -3.541 4.448 1.00 0.96 N ATOM 2164 CA PHE A 132 1.103 -2.969 3.500 1.00 0.94 C ATOM 2165 C PHE A 132 0.342 -2.213 2.401 1.00 0.90 C ATOM 2166 O PHE A 132 -0.748 -2.623 1.992 1.00 0.97 O ATOM 2167 CB PHE A 132 2.006 -4.071 2.902 1.00 1.06 C ATOM 2168 CG PHE A 132 2.363 -5.248 3.804 1.00 1.42 C ATOM 2169 CD1 PHE A 132 2.968 -5.049 5.059 1.00 2.88 C ATOM 2170 CD2 PHE A 132 2.089 -6.563 3.383 1.00 1.90 C ATOM 2171 CE1 PHE A 132 3.274 -6.144 5.886 1.00 3.66 C ATOM 2172 CE2 PHE A 132 2.437 -7.660 4.190 1.00 2.70 C ATOM 2173 CZ PHE A 132 3.034 -7.452 5.441 1.00 3.28 C ATOM 0 H PHE A 132 -0.616 -4.038 3.994 1.00 0.96 H new ATOM 0 HA PHE A 132 1.751 -2.264 4.022 1.00 0.94 H new ATOM 0 HB2 PHE A 132 1.514 -4.465 2.013 1.00 1.06 H new ATOM 0 HB3 PHE A 132 2.934 -3.605 2.573 1.00 1.06 H new ATOM 0 HD1 PHE A 132 3.199 -4.047 5.389 1.00 2.88 H new ATOM 0 HD2 PHE A 132 1.607 -6.731 2.431 1.00 1.90 H new ATOM 0 HE1 PHE A 132 3.695 -5.977 6.867 1.00 3.66 H new ATOM 0 HE2 PHE A 132 2.244 -8.665 3.845 1.00 2.70 H new ATOM 0 HZ PHE A 132 3.308 -8.295 6.059 1.00 3.28 H new ATOM 2183 N LEU A 133 0.916 -1.117 1.902 1.00 0.84 N ATOM 2184 CA LEU A 133 0.315 -0.303 0.838 1.00 0.75 C ATOM 2185 C LEU A 133 1.357 0.210 -0.145 1.00 0.72 C ATOM 2186 O LEU A 133 2.541 0.269 0.173 1.00 0.73 O ATOM 2187 CB LEU A 133 -0.597 0.798 1.416 1.00 0.74 C ATOM 2188 CG LEU A 133 0.058 1.973 2.178 1.00 0.84 C ATOM 2189 CD1 LEU A 133 0.828 2.969 1.293 1.00 1.73 C ATOM 2190 CD2 LEU A 133 -1.070 2.740 2.877 1.00 1.25 C ATOM 0 H LEU A 133 1.817 -0.765 2.225 1.00 0.84 H new ATOM 0 HA LEU A 133 -0.338 -0.948 0.249 1.00 0.75 H new ATOM 0 HB2 LEU A 133 -1.173 1.218 0.592 1.00 0.74 H new ATOM 0 HB3 LEU A 133 -1.307 0.320 2.091 1.00 0.74 H new ATOM 0 HG LEU A 133 0.792 1.542 2.859 1.00 0.84 H new ATOM 0 HD11 LEU A 133 1.252 3.757 1.916 1.00 1.73 H new ATOM 0 HD12 LEU A 133 1.631 2.447 0.772 1.00 1.73 H new ATOM 0 HD13 LEU A 133 0.148 3.409 0.564 1.00 1.73 H new ATOM 0 HD21 LEU A 133 -0.650 3.581 3.429 1.00 1.25 H new ATOM 0 HD22 LEU A 133 -1.774 3.110 2.132 1.00 1.25 H new ATOM 0 HD23 LEU A 133 -1.588 2.075 3.568 1.00 1.25 H new ATOM 2202 N SER A 134 0.919 0.556 -1.349 1.00 0.74 N ATOM 2203 CA SER A 134 1.770 1.072 -2.419 1.00 0.77 C ATOM 2204 C SER A 134 1.039 2.083 -3.315 1.00 0.84 C ATOM 2205 O SER A 134 -0.134 1.890 -3.649 1.00 0.91 O ATOM 2206 CB SER A 134 2.273 -0.087 -3.297 1.00 0.79 C ATOM 2207 OG SER A 134 3.103 -0.986 -2.579 1.00 1.40 O ATOM 0 H SER A 134 -0.062 0.484 -1.617 1.00 0.74 H new ATOM 0 HA SER A 134 2.604 1.583 -1.938 1.00 0.77 H new ATOM 0 HB2 SER A 134 1.419 -0.630 -3.703 1.00 0.79 H new ATOM 0 HB3 SER A 134 2.826 0.316 -4.145 1.00 0.79 H new ATOM 0 HG SER A 134 3.398 -1.706 -3.175 1.00 1.40 H new ATOM 2213 N PHE A 135 1.744 3.129 -3.768 1.00 0.86 N ATOM 2214 CA PHE A 135 1.313 3.930 -4.919 1.00 0.87 C ATOM 2215 C PHE A 135 2.079 3.433 -6.158 1.00 0.67 C ATOM 2216 O PHE A 135 3.283 3.166 -6.090 1.00 0.49 O ATOM 2217 CB PHE A 135 1.577 5.446 -4.773 1.00 1.01 C ATOM 2218 CG PHE A 135 1.049 6.283 -3.610 1.00 1.37 C ATOM 2219 CD1 PHE A 135 0.690 5.752 -2.355 1.00 1.78 C ATOM 2220 CD2 PHE A 135 1.030 7.682 -3.782 1.00 2.73 C ATOM 2221 CE1 PHE A 135 0.389 6.617 -1.284 1.00 2.12 C ATOM 2222 CE2 PHE A 135 0.686 8.542 -2.727 1.00 3.18 C ATOM 2223 CZ PHE A 135 0.380 8.009 -1.467 1.00 2.39 C ATOM 0 H PHE A 135 2.621 3.441 -3.350 1.00 0.86 H new ATOM 0 HA PHE A 135 0.233 3.805 -5.002 1.00 0.87 H new ATOM 0 HB2 PHE A 135 2.660 5.571 -4.775 1.00 1.01 H new ATOM 0 HB3 PHE A 135 1.201 5.913 -5.683 1.00 1.01 H new ATOM 0 HD1 PHE A 135 0.646 4.682 -2.214 1.00 1.78 H new ATOM 0 HD2 PHE A 135 1.285 8.101 -4.744 1.00 2.73 H new ATOM 0 HE1 PHE A 135 0.163 6.205 -0.312 1.00 2.12 H new ATOM 0 HE2 PHE A 135 0.657 9.610 -2.885 1.00 3.18 H new ATOM 0 HZ PHE A 135 0.139 8.664 -0.643 1.00 2.39 H new ATOM 2233 N SER A 136 1.395 3.378 -7.294 1.00 0.79 N ATOM 2234 CA SER A 136 1.990 3.247 -8.634 1.00 0.70 C ATOM 2235 C SER A 136 2.276 4.636 -9.249 1.00 0.75 C ATOM 2236 O SER A 136 1.892 5.651 -8.667 1.00 1.23 O ATOM 2237 CB SER A 136 0.997 2.478 -9.516 1.00 1.07 C ATOM 2238 OG SER A 136 1.545 2.161 -10.780 1.00 1.73 O ATOM 0 H SER A 136 0.376 3.424 -7.317 1.00 0.79 H new ATOM 0 HA SER A 136 2.939 2.714 -8.566 1.00 0.70 H new ATOM 0 HB2 SER A 136 0.699 1.560 -9.010 1.00 1.07 H new ATOM 0 HB3 SER A 136 0.095 3.075 -9.651 1.00 1.07 H new ATOM 0 HG SER A 136 0.941 2.473 -11.486 1.00 1.73 H new ATOM 2244 N ARG A 137 2.897 4.684 -10.439 1.00 0.58 N ATOM 2245 CA ARG A 137 2.977 5.834 -11.363 1.00 0.60 C ATOM 2246 C ARG A 137 3.680 5.482 -12.679 1.00 0.54 C ATOM 2247 O ARG A 137 4.579 4.636 -12.722 1.00 0.49 O ATOM 2248 CB ARG A 137 3.561 7.122 -10.737 1.00 0.81 C ATOM 2249 CG ARG A 137 4.979 6.935 -10.191 1.00 1.52 C ATOM 2250 CD ARG A 137 5.394 8.102 -9.286 1.00 1.87 C ATOM 2251 NE ARG A 137 6.645 7.763 -8.587 1.00 3.22 N ATOM 2252 CZ ARG A 137 6.750 6.905 -7.579 1.00 4.51 C ATOM 2253 NH1 ARG A 137 5.682 6.427 -6.972 1.00 4.86 N ATOM 2254 NH2 ARG A 137 7.940 6.499 -7.194 1.00 6.23 N ATOM 0 H ARG A 137 3.389 3.870 -10.808 1.00 0.58 H new ATOM 0 HA ARG A 137 1.937 6.067 -11.591 1.00 0.60 H new ATOM 0 HB2 ARG A 137 3.568 7.912 -11.487 1.00 0.81 H new ATOM 0 HB3 ARG A 137 2.908 7.455 -9.930 1.00 0.81 H new ATOM 0 HG2 ARG A 137 5.034 6.002 -9.630 1.00 1.52 H new ATOM 0 HG3 ARG A 137 5.681 6.850 -11.021 1.00 1.52 H new ATOM 0 HD2 ARG A 137 5.531 9.006 -9.880 1.00 1.87 H new ATOM 0 HD3 ARG A 137 4.606 8.312 -8.562 1.00 1.87 H new ATOM 0 HE ARG A 137 7.499 8.224 -8.902 1.00 3.22 H new ATOM 0 HH11 ARG A 137 4.752 6.715 -7.275 1.00 4.86 H new ATOM 0 HH12 ARG A 137 5.786 5.769 -6.200 1.00 4.86 H new ATOM 0 HH21 ARG A 137 8.775 6.843 -7.669 1.00 6.23 H new ATOM 0 HH22 ARG A 137 8.028 5.840 -6.420 1.00 6.23 H new ATOM 2268 N CYS A 138 3.311 6.182 -13.756 1.00 0.66 N ATOM 2269 CA CYS A 138 4.064 6.182 -15.023 1.00 0.86 C ATOM 2270 C CYS A 138 5.425 6.917 -14.938 1.00 0.91 C ATOM 2271 O CYS A 138 6.255 6.767 -15.831 1.00 1.12 O ATOM 2272 CB CYS A 138 3.169 6.738 -16.146 1.00 1.19 C ATOM 2273 SG CYS A 138 2.238 5.390 -16.928 1.00 2.77 S ATOM 0 H CYS A 138 2.477 6.769 -13.778 1.00 0.66 H new ATOM 0 HA CYS A 138 4.328 5.149 -15.252 1.00 0.86 H new ATOM 0 HB2 CYS A 138 2.480 7.478 -15.739 1.00 1.19 H new ATOM 0 HB3 CYS A 138 3.781 7.247 -16.891 1.00 1.19 H new ATOM 0 HG CYS A 138 2.340 4.315 -16.204 1.00 2.77 H new ATOM 2279 N SER A 139 5.693 7.680 -13.876 1.00 0.84 N ATOM 2280 CA SER A 139 6.994 8.319 -13.609 1.00 0.97 C ATOM 2281 C SER A 139 8.071 7.270 -13.258 1.00 0.98 C ATOM 2282 O SER A 139 8.244 6.883 -12.102 1.00 1.17 O ATOM 2283 CB SER A 139 6.865 9.385 -12.502 1.00 1.02 C ATOM 2284 OG SER A 139 5.538 9.883 -12.349 1.00 1.62 O ATOM 0 H SER A 139 4.997 7.879 -13.157 1.00 0.84 H new ATOM 0 HA SER A 139 7.315 8.823 -14.521 1.00 0.97 H new ATOM 0 HB2 SER A 139 7.196 8.958 -11.556 1.00 1.02 H new ATOM 0 HB3 SER A 139 7.533 10.216 -12.728 1.00 1.02 H new ATOM 0 HG SER A 139 5.520 10.552 -11.633 1.00 1.62 H new ATOM 2290 N ALA A 140 8.834 6.833 -14.264 1.00 0.88 N ATOM 2291 CA ALA A 140 9.860 5.780 -14.174 1.00 0.89 C ATOM 2292 C ALA A 140 11.151 6.196 -13.429 1.00 0.91 C ATOM 2293 O ALA A 140 12.081 5.394 -13.303 1.00 1.11 O ATOM 2294 CB ALA A 140 10.160 5.320 -15.609 1.00 0.97 C ATOM 0 H ALA A 140 8.753 7.217 -15.205 1.00 0.88 H new ATOM 0 HA ALA A 140 9.465 4.968 -13.564 1.00 0.89 H new ATOM 0 HB1 ALA A 140 10.918 4.537 -15.589 1.00 0.97 H new ATOM 0 HB2 ALA A 140 9.249 4.932 -16.064 1.00 0.97 H new ATOM 0 HB3 ALA A 140 10.526 6.165 -16.193 1.00 0.97 H new ATOM 2300 N ARG A 141 11.214 7.448 -12.964 1.00 0.90 N ATOM 2301 CA ARG A 141 12.381 8.089 -12.354 1.00 1.05 C ATOM 2302 C ARG A 141 12.870 7.419 -11.051 1.00 1.00 C ATOM 2303 O ARG A 141 12.133 6.694 -10.379 1.00 0.99 O ATOM 2304 CB ARG A 141 12.132 9.614 -12.253 1.00 1.31 C ATOM 2305 CG ARG A 141 11.604 10.149 -10.915 1.00 2.58 C ATOM 2306 CD ARG A 141 10.363 9.423 -10.381 1.00 4.39 C ATOM 2307 NE ARG A 141 10.525 9.182 -8.934 1.00 6.86 N ATOM 2308 CZ ARG A 141 9.898 9.761 -7.919 1.00 8.68 C ATOM 2309 NH1 ARG A 141 8.890 10.592 -8.083 1.00 8.84 N ATOM 2310 NH2 ARG A 141 10.296 9.494 -6.696 1.00 10.76 N ATOM 0 H ARG A 141 10.409 8.073 -13.006 1.00 0.90 H new ATOM 0 HA ARG A 141 13.237 7.938 -13.011 1.00 1.05 H new ATOM 0 HB2 ARG A 141 13.069 10.125 -12.476 1.00 1.31 H new ATOM 0 HB3 ARG A 141 11.423 9.893 -13.032 1.00 1.31 H new ATOM 0 HG2 ARG A 141 12.398 10.078 -10.172 1.00 2.58 H new ATOM 0 HG3 ARG A 141 11.368 11.207 -11.030 1.00 2.58 H new ATOM 0 HD2 ARG A 141 9.470 10.021 -10.564 1.00 4.39 H new ATOM 0 HD3 ARG A 141 10.226 8.478 -10.906 1.00 4.39 H new ATOM 0 HE ARG A 141 11.213 8.473 -8.680 1.00 6.86 H new ATOM 0 HH11 ARG A 141 8.560 10.815 -9.022 1.00 8.84 H new ATOM 0 HH12 ARG A 141 8.439 11.013 -7.271 1.00 8.84 H new ATOM 0 HH21 ARG A 141 11.074 8.852 -6.541 1.00 10.76 H new ATOM 0 HH22 ARG A 141 9.828 9.929 -5.901 1.00 10.76 H new ATOM 2324 N GLU A 142 14.123 7.697 -10.698 1.00 1.02 N ATOM 2325 CA GLU A 142 14.836 7.182 -9.516 1.00 1.00 C ATOM 2326 C GLU A 142 14.197 7.630 -8.180 1.00 0.93 C ATOM 2327 O GLU A 142 13.365 8.542 -8.141 1.00 0.86 O ATOM 2328 CB GLU A 142 16.318 7.588 -9.653 1.00 1.06 C ATOM 2329 CG GLU A 142 17.285 6.919 -8.658 1.00 1.81 C ATOM 2330 CD GLU A 142 17.849 7.866 -7.580 1.00 3.18 C ATOM 2331 OE1 GLU A 142 17.180 8.854 -7.198 1.00 4.17 O ATOM 2332 OE2 GLU A 142 18.981 7.613 -7.104 1.00 3.99 O ATOM 0 H GLU A 142 14.706 8.321 -11.255 1.00 1.02 H new ATOM 0 HA GLU A 142 14.759 6.095 -9.483 1.00 1.00 H new ATOM 0 HB2 GLU A 142 16.648 7.355 -10.665 1.00 1.06 H new ATOM 0 HB3 GLU A 142 16.393 8.669 -9.534 1.00 1.06 H new ATOM 0 HG2 GLU A 142 16.768 6.096 -8.166 1.00 1.81 H new ATOM 0 HG3 GLU A 142 18.116 6.486 -9.214 1.00 1.81 H new ATOM 2339 N ILE A 143 14.558 6.970 -7.070 1.00 1.07 N ATOM 2340 CA ILE A 143 14.165 7.372 -5.709 1.00 1.04 C ATOM 2341 C ILE A 143 15.412 7.580 -4.807 1.00 1.11 C ATOM 2342 O ILE A 143 16.136 6.604 -4.577 1.00 1.18 O ATOM 2343 CB ILE A 143 13.220 6.326 -5.065 1.00 1.01 C ATOM 2344 CG1 ILE A 143 12.103 5.804 -6.000 1.00 1.11 C ATOM 2345 CG2 ILE A 143 12.613 6.989 -3.824 1.00 1.11 C ATOM 2346 CD1 ILE A 143 11.140 4.836 -5.301 1.00 2.05 C ATOM 0 H ILE A 143 15.138 6.131 -7.091 1.00 1.07 H new ATOM 0 HA ILE A 143 13.630 8.318 -5.793 1.00 1.04 H new ATOM 0 HB ILE A 143 13.805 5.439 -4.823 1.00 1.01 H new ATOM 0 HG12 ILE A 143 11.538 6.651 -6.390 1.00 1.11 H new ATOM 0 HG13 ILE A 143 12.557 5.302 -6.855 1.00 1.11 H new ATOM 0 HG21 ILE A 143 11.937 6.290 -3.332 1.00 1.11 H new ATOM 0 HG22 ILE A 143 13.410 7.269 -3.135 1.00 1.11 H new ATOM 0 HG23 ILE A 143 12.060 7.880 -4.121 1.00 1.11 H new ATOM 0 HD11 ILE A 143 10.380 4.505 -6.008 1.00 2.05 H new ATOM 0 HD12 ILE A 143 11.695 3.972 -4.934 1.00 2.05 H new ATOM 0 HD13 ILE A 143 10.660 5.342 -4.463 1.00 2.05 H new ATOM 2358 N PRO A 144 15.644 8.791 -4.245 1.00 1.20 N ATOM 2359 CA PRO A 144 16.764 9.074 -3.337 1.00 1.31 C ATOM 2360 C PRO A 144 16.427 8.975 -1.831 1.00 1.40 C ATOM 2361 O PRO A 144 17.343 8.999 -1.011 1.00 2.67 O ATOM 2362 CB PRO A 144 17.188 10.498 -3.710 1.00 1.54 C ATOM 2363 CG PRO A 144 15.873 11.176 -4.089 1.00 1.55 C ATOM 2364 CD PRO A 144 15.033 10.043 -4.684 1.00 1.32 C ATOM 0 HA PRO A 144 17.546 8.325 -3.462 1.00 1.31 H new ATOM 0 HB2 PRO A 144 17.674 11.003 -2.875 1.00 1.54 H new ATOM 0 HB3 PRO A 144 17.895 10.502 -4.540 1.00 1.54 H new ATOM 0 HG2 PRO A 144 15.387 11.620 -3.220 1.00 1.55 H new ATOM 0 HG3 PRO A 144 16.030 11.978 -4.810 1.00 1.55 H new ATOM 0 HD2 PRO A 144 13.999 10.109 -4.345 1.00 1.32 H new ATOM 0 HD3 PRO A 144 15.016 10.104 -5.772 1.00 1.32 H new ATOM 2372 N ILE A 145 15.143 8.862 -1.454 1.00 0.98 N ATOM 2373 CA ILE A 145 14.626 8.845 -0.055 1.00 0.86 C ATOM 2374 C ILE A 145 13.142 8.441 0.023 1.00 1.04 C ATOM 2375 O ILE A 145 12.773 7.731 0.953 1.00 1.84 O ATOM 2376 CB ILE A 145 14.916 10.188 0.683 1.00 0.73 C ATOM 2377 CG1 ILE A 145 14.486 10.201 2.174 1.00 0.72 C ATOM 2378 CG2 ILE A 145 14.400 11.438 -0.053 1.00 0.88 C ATOM 2379 CD1 ILE A 145 13.049 10.643 2.518 1.00 0.87 C ATOM 0 H ILE A 145 14.393 8.775 -2.140 1.00 0.98 H new ATOM 0 HA ILE A 145 15.176 8.066 0.473 1.00 0.86 H new ATOM 0 HB ILE A 145 16.004 10.244 0.670 1.00 0.73 H new ATOM 0 HG12 ILE A 145 14.628 9.195 2.569 1.00 0.72 H new ATOM 0 HG13 ILE A 145 15.172 10.855 2.712 1.00 0.72 H new ATOM 0 HG21 ILE A 145 14.643 12.328 0.527 1.00 0.88 H new ATOM 0 HG22 ILE A 145 14.872 11.504 -1.033 1.00 0.88 H new ATOM 0 HG23 ILE A 145 13.319 11.368 -0.175 1.00 0.88 H new ATOM 0 HD11 ILE A 145 12.903 10.598 3.597 1.00 0.87 H new ATOM 0 HD12 ILE A 145 12.890 11.664 2.172 1.00 0.87 H new ATOM 0 HD13 ILE A 145 12.337 9.979 2.028 1.00 0.87 H new ATOM 2391 N LEU A 146 12.369 8.868 -0.990 1.00 0.79 N ATOM 2392 CA LEU A 146 10.938 8.705 -1.373 1.00 0.82 C ATOM 2393 C LEU A 146 10.415 10.032 -1.949 1.00 0.74 C ATOM 2394 O LEU A 146 9.540 10.036 -2.808 1.00 0.95 O ATOM 2395 CB LEU A 146 9.977 8.195 -0.265 1.00 0.96 C ATOM 2396 CG LEU A 146 8.963 7.150 -0.770 1.00 0.84 C ATOM 2397 CD1 LEU A 146 9.640 5.824 -1.109 1.00 2.03 C ATOM 2398 CD2 LEU A 146 7.952 6.803 0.318 1.00 1.86 C ATOM 0 H LEU A 146 12.818 9.449 -1.698 1.00 0.79 H new ATOM 0 HA LEU A 146 10.936 7.905 -2.114 1.00 0.82 H new ATOM 0 HB2 LEU A 146 10.564 7.760 0.543 1.00 0.96 H new ATOM 0 HB3 LEU A 146 9.436 9.043 0.155 1.00 0.96 H new ATOM 0 HG LEU A 146 8.494 7.597 -1.646 1.00 0.84 H new ATOM 0 HD11 LEU A 146 8.892 5.113 -1.461 1.00 2.03 H new ATOM 0 HD12 LEU A 146 10.384 5.984 -1.889 1.00 2.03 H new ATOM 0 HD13 LEU A 146 10.127 5.426 -0.219 1.00 2.03 H new ATOM 0 HD21 LEU A 146 7.247 6.064 -0.063 1.00 1.86 H new ATOM 0 HD22 LEU A 146 8.474 6.395 1.183 1.00 1.86 H new ATOM 0 HD23 LEU A 146 7.411 7.702 0.612 1.00 1.86 H new ATOM 2410 N SER A 147 11.002 11.126 -1.454 1.00 0.66 N ATOM 2411 CA SER A 147 10.486 12.496 -1.282 1.00 0.62 C ATOM 2412 C SER A 147 9.969 12.528 0.168 1.00 0.69 C ATOM 2413 O SER A 147 9.119 11.713 0.523 1.00 0.77 O ATOM 2414 CB SER A 147 9.398 12.923 -2.286 1.00 0.67 C ATOM 2415 OG SER A 147 9.802 12.709 -3.631 1.00 1.31 O ATOM 0 H SER A 147 11.965 11.070 -1.124 1.00 0.66 H new ATOM 0 HA SER A 147 11.278 13.219 -1.480 1.00 0.62 H new ATOM 0 HB2 SER A 147 8.483 12.364 -2.089 1.00 0.67 H new ATOM 0 HB3 SER A 147 9.165 13.978 -2.141 1.00 0.67 H new ATOM 0 HG SER A 147 9.791 11.749 -3.827 1.00 1.31 H new ATOM 2421 N ASP A 148 10.519 13.360 1.058 1.00 0.79 N ATOM 2422 CA ASP A 148 10.237 13.246 2.502 1.00 0.93 C ATOM 2423 C ASP A 148 8.766 13.536 2.853 1.00 0.88 C ATOM 2424 O ASP A 148 8.228 12.961 3.798 1.00 0.92 O ATOM 2425 CB ASP A 148 11.204 14.104 3.326 1.00 1.20 C ATOM 2426 CG ASP A 148 11.071 13.832 4.838 1.00 3.06 C ATOM 2427 OD1 ASP A 148 11.298 12.676 5.274 1.00 4.71 O ATOM 2428 OD2 ASP A 148 10.771 14.792 5.588 1.00 3.59 O ATOM 0 H ASP A 148 11.158 14.116 0.812 1.00 0.79 H new ATOM 0 HA ASP A 148 10.406 12.203 2.771 1.00 0.93 H new ATOM 0 HB2 ASP A 148 12.227 13.902 3.010 1.00 1.20 H new ATOM 0 HB3 ASP A 148 11.011 15.159 3.129 1.00 1.20 H new ATOM 2433 N GLU A 149 8.085 14.377 2.072 1.00 0.83 N ATOM 2434 CA GLU A 149 6.635 14.517 2.171 1.00 0.88 C ATOM 2435 C GLU A 149 5.919 13.219 1.768 1.00 0.89 C ATOM 2436 O GLU A 149 4.970 12.832 2.441 1.00 1.03 O ATOM 2437 CB GLU A 149 6.108 15.749 1.410 1.00 0.93 C ATOM 2438 CG GLU A 149 6.254 15.777 -0.122 1.00 2.14 C ATOM 2439 CD GLU A 149 7.623 16.300 -0.583 1.00 3.87 C ATOM 2440 OE1 GLU A 149 8.640 15.609 -0.350 1.00 5.22 O ATOM 2441 OE2 GLU A 149 7.683 17.394 -1.191 1.00 4.77 O ATOM 0 H GLU A 149 8.517 14.971 1.364 1.00 0.83 H new ATOM 0 HA GLU A 149 6.399 14.697 3.220 1.00 0.88 H new ATOM 0 HB2 GLU A 149 5.049 15.857 1.645 1.00 0.93 H new ATOM 0 HB3 GLU A 149 6.615 16.628 1.809 1.00 0.93 H new ATOM 0 HG2 GLU A 149 6.104 14.771 -0.515 1.00 2.14 H new ATOM 0 HG3 GLU A 149 5.470 16.405 -0.545 1.00 2.14 H new ATOM 2448 N LEU A 150 6.389 12.485 0.749 1.00 0.84 N ATOM 2449 CA LEU A 150 5.804 11.198 0.368 1.00 0.83 C ATOM 2450 C LEU A 150 6.148 10.103 1.384 1.00 0.81 C ATOM 2451 O LEU A 150 5.271 9.301 1.674 1.00 0.83 O ATOM 2452 CB LEU A 150 6.206 10.833 -1.080 1.00 0.83 C ATOM 2453 CG LEU A 150 5.587 9.529 -1.643 1.00 1.06 C ATOM 2454 CD1 LEU A 150 4.054 9.469 -1.572 1.00 1.50 C ATOM 2455 CD2 LEU A 150 5.995 9.350 -3.114 1.00 1.90 C ATOM 0 H LEU A 150 7.181 12.767 0.171 1.00 0.84 H new ATOM 0 HA LEU A 150 4.718 11.286 0.384 1.00 0.83 H new ATOM 0 HB2 LEU A 150 5.925 11.658 -1.734 1.00 0.83 H new ATOM 0 HB3 LEU A 150 7.292 10.746 -1.125 1.00 0.83 H new ATOM 0 HG LEU A 150 5.974 8.732 -1.007 1.00 1.06 H new ATOM 0 HD11 LEU A 150 3.707 8.523 -1.987 1.00 1.50 H new ATOM 0 HD12 LEU A 150 3.735 9.548 -0.533 1.00 1.50 H new ATOM 0 HD13 LEU A 150 3.631 10.294 -2.145 1.00 1.50 H new ATOM 0 HD21 LEU A 150 5.557 8.431 -3.504 1.00 1.90 H new ATOM 0 HD22 LEU A 150 5.637 10.199 -3.697 1.00 1.90 H new ATOM 0 HD23 LEU A 150 7.081 9.293 -3.186 1.00 1.90 H new ATOM 2467 N GLN A 151 7.358 10.049 1.961 1.00 0.80 N ATOM 2468 CA GLN A 151 7.679 9.040 2.993 1.00 0.79 C ATOM 2469 C GLN A 151 6.794 9.222 4.234 1.00 0.72 C ATOM 2470 O GLN A 151 6.218 8.253 4.728 1.00 0.70 O ATOM 2471 CB GLN A 151 9.188 8.935 3.295 1.00 0.98 C ATOM 2472 CG GLN A 151 9.792 9.899 4.324 1.00 0.75 C ATOM 2473 CD GLN A 151 9.724 9.485 5.796 1.00 1.36 C ATOM 2474 OE1 GLN A 151 9.151 8.479 6.199 1.00 1.95 O ATOM 2475 NE2 GLN A 151 10.346 10.263 6.655 1.00 2.12 N ATOM 0 H GLN A 151 8.125 10.682 1.737 1.00 0.80 H new ATOM 0 HA GLN A 151 7.432 8.060 2.584 1.00 0.79 H new ATOM 0 HB2 GLN A 151 9.390 7.919 3.633 1.00 0.98 H new ATOM 0 HB3 GLN A 151 9.725 9.071 2.356 1.00 0.98 H new ATOM 0 HG2 GLN A 151 10.839 10.056 4.065 1.00 0.75 H new ATOM 0 HG3 GLN A 151 9.290 10.861 4.220 1.00 0.75 H new ATOM 0 HE21 GLN A 151 10.825 11.102 6.329 1.00 2.12 H new ATOM 0 HE22 GLN A 151 10.349 10.027 7.647 1.00 2.12 H new ATOM 2484 N LEU A 152 6.616 10.471 4.694 1.00 0.71 N ATOM 2485 CA LEU A 152 5.802 10.786 5.867 1.00 0.71 C ATOM 2486 C LEU A 152 4.312 10.629 5.577 1.00 0.65 C ATOM 2487 O LEU A 152 3.617 10.027 6.393 1.00 0.64 O ATOM 2488 CB LEU A 152 6.118 12.204 6.381 1.00 0.75 C ATOM 2489 CG LEU A 152 7.499 12.354 7.054 1.00 0.85 C ATOM 2490 CD1 LEU A 152 7.699 13.822 7.457 1.00 0.96 C ATOM 2491 CD2 LEU A 152 7.635 11.474 8.310 1.00 0.98 C ATOM 0 H LEU A 152 7.037 11.291 4.257 1.00 0.71 H new ATOM 0 HA LEU A 152 6.057 10.071 6.649 1.00 0.71 H new ATOM 0 HB2 LEU A 152 6.059 12.900 5.544 1.00 0.75 H new ATOM 0 HB3 LEU A 152 5.348 12.497 7.094 1.00 0.75 H new ATOM 0 HG LEU A 152 8.254 12.033 6.337 1.00 0.85 H new ATOM 0 HD11 LEU A 152 8.672 13.939 7.934 1.00 0.96 H new ATOM 0 HD12 LEU A 152 7.652 14.453 6.569 1.00 0.96 H new ATOM 0 HD13 LEU A 152 6.915 14.118 8.155 1.00 0.96 H new ATOM 0 HD21 LEU A 152 8.623 11.615 8.747 1.00 0.98 H new ATOM 0 HD22 LEU A 152 6.873 11.757 9.036 1.00 0.98 H new ATOM 0 HD23 LEU A 152 7.505 10.427 8.036 1.00 0.98 H new ATOM 2503 N LYS A 153 3.808 11.095 4.425 1.00 0.63 N ATOM 2504 CA LYS A 153 2.423 10.800 4.039 1.00 0.64 C ATOM 2505 C LYS A 153 2.201 9.290 3.869 1.00 0.62 C ATOM 2506 O LYS A 153 1.203 8.794 4.368 1.00 0.64 O ATOM 2507 CB LYS A 153 1.946 11.601 2.810 1.00 0.71 C ATOM 2508 CG LYS A 153 1.276 12.958 3.135 1.00 1.28 C ATOM 2509 CD LYS A 153 2.134 14.213 2.896 1.00 2.41 C ATOM 2510 CE LYS A 153 3.157 14.515 4.001 1.00 3.92 C ATOM 2511 NZ LYS A 153 2.552 15.184 5.183 1.00 4.68 N ATOM 0 H LYS A 153 4.327 11.666 3.758 1.00 0.63 H new ATOM 0 HA LYS A 153 1.796 11.137 4.864 1.00 0.64 H new ATOM 0 HB2 LYS A 153 2.801 11.782 2.158 1.00 0.71 H new ATOM 0 HB3 LYS A 153 1.240 10.990 2.248 1.00 0.71 H new ATOM 0 HG2 LYS A 153 0.369 13.044 2.537 1.00 1.28 H new ATOM 0 HG3 LYS A 153 0.969 12.947 4.181 1.00 1.28 H new ATOM 0 HD2 LYS A 153 2.665 14.098 1.951 1.00 2.41 H new ATOM 0 HD3 LYS A 153 1.473 15.073 2.788 1.00 2.41 H new ATOM 0 HE2 LYS A 153 3.627 13.584 4.318 1.00 3.92 H new ATOM 0 HE3 LYS A 153 3.946 15.149 3.595 1.00 3.92 H new ATOM 0 HZ1 LYS A 153 3.288 15.363 5.895 1.00 4.68 H new ATOM 0 HZ2 LYS A 153 2.126 16.087 4.891 1.00 4.68 H new ATOM 0 HZ3 LYS A 153 1.818 14.571 5.591 1.00 4.68 H new ATOM 2525 N MET A 154 3.121 8.519 3.282 1.00 0.60 N ATOM 2526 CA MET A 154 2.989 7.051 3.190 1.00 0.60 C ATOM 2527 C MET A 154 2.935 6.396 4.577 1.00 0.60 C ATOM 2528 O MET A 154 2.078 5.546 4.825 1.00 0.60 O ATOM 2529 CB MET A 154 4.148 6.456 2.374 1.00 0.62 C ATOM 2530 CG MET A 154 4.000 6.684 0.867 1.00 1.34 C ATOM 2531 SD MET A 154 3.111 5.386 -0.021 1.00 1.99 S ATOM 2532 CE MET A 154 4.313 4.042 0.071 1.00 0.90 C ATOM 0 H MET A 154 3.974 8.885 2.859 1.00 0.60 H new ATOM 0 HA MET A 154 2.047 6.841 2.683 1.00 0.60 H new ATOM 0 HB2 MET A 154 5.086 6.896 2.712 1.00 0.62 H new ATOM 0 HB3 MET A 154 4.210 5.385 2.569 1.00 0.62 H new ATOM 0 HG2 MET A 154 3.484 7.631 0.707 1.00 1.34 H new ATOM 0 HG3 MET A 154 4.994 6.785 0.431 1.00 1.34 H new ATOM 0 HE1 MET A 154 4.055 3.273 -0.657 1.00 0.90 H new ATOM 0 HE2 MET A 154 5.309 4.429 -0.147 1.00 0.90 H new ATOM 0 HE3 MET A 154 4.302 3.612 1.073 1.00 0.90 H new ATOM 2542 N GLN A 155 3.826 6.799 5.486 1.00 0.63 N ATOM 2543 CA GLN A 155 3.887 6.277 6.856 1.00 0.65 C ATOM 2544 C GLN A 155 2.622 6.623 7.669 1.00 0.63 C ATOM 2545 O GLN A 155 2.108 5.780 8.406 1.00 0.65 O ATOM 2546 CB GLN A 155 5.181 6.786 7.514 1.00 0.72 C ATOM 2547 CG GLN A 155 5.596 5.939 8.728 1.00 0.99 C ATOM 2548 CD GLN A 155 6.842 6.465 9.453 1.00 1.54 C ATOM 2549 OE1 GLN A 155 6.943 6.406 10.673 1.00 2.03 O ATOM 2550 NE2 GLN A 155 7.840 6.993 8.768 1.00 2.77 N ATOM 0 H GLN A 155 4.535 7.506 5.290 1.00 0.63 H new ATOM 0 HA GLN A 155 3.911 5.188 6.831 1.00 0.65 H new ATOM 0 HB2 GLN A 155 5.986 6.780 6.779 1.00 0.72 H new ATOM 0 HB3 GLN A 155 5.043 7.821 7.827 1.00 0.72 H new ATOM 0 HG2 GLN A 155 4.766 5.900 9.433 1.00 0.99 H new ATOM 0 HG3 GLN A 155 5.783 4.917 8.399 1.00 0.99 H new ATOM 0 HE21 GLN A 155 7.784 7.055 7.751 1.00 2.77 H new ATOM 0 HE22 GLN A 155 8.667 7.338 9.255 1.00 2.77 H new ATOM 2559 N LEU A 156 2.075 7.829 7.478 1.00 0.61 N ATOM 2560 CA LEU A 156 0.770 8.253 7.997 1.00 0.59 C ATOM 2561 C LEU A 156 -0.342 7.385 7.402 1.00 0.54 C ATOM 2562 O LEU A 156 -1.099 6.754 8.138 1.00 0.52 O ATOM 2563 CB LEU A 156 0.615 9.766 7.700 1.00 0.65 C ATOM 2564 CG LEU A 156 -0.751 10.462 7.903 1.00 0.78 C ATOM 2565 CD1 LEU A 156 -1.694 10.343 6.694 1.00 1.57 C ATOM 2566 CD2 LEU A 156 -1.488 10.010 9.163 1.00 1.70 C ATOM 0 H LEU A 156 2.543 8.559 6.941 1.00 0.61 H new ATOM 0 HA LEU A 156 0.697 8.114 9.076 1.00 0.59 H new ATOM 0 HB2 LEU A 156 1.341 10.293 8.319 1.00 0.65 H new ATOM 0 HB3 LEU A 156 0.907 9.923 6.662 1.00 0.65 H new ATOM 0 HG LEU A 156 -0.481 11.511 8.021 1.00 0.78 H new ATOM 0 HD11 LEU A 156 -2.631 10.855 6.912 1.00 1.57 H new ATOM 0 HD12 LEU A 156 -1.226 10.798 5.821 1.00 1.57 H new ATOM 0 HD13 LEU A 156 -1.894 9.291 6.491 1.00 1.57 H new ATOM 0 HD21 LEU A 156 -2.437 10.540 9.239 1.00 1.70 H new ATOM 0 HD22 LEU A 156 -1.675 8.937 9.110 1.00 1.70 H new ATOM 0 HD23 LEU A 156 -0.878 10.229 10.040 1.00 1.70 H new ATOM 2578 N LEU A 157 -0.424 7.307 6.074 1.00 0.53 N ATOM 2579 CA LEU A 157 -1.487 6.594 5.375 1.00 0.51 C ATOM 2580 C LEU A 157 -1.496 5.128 5.786 1.00 0.51 C ATOM 2581 O LEU A 157 -2.559 4.632 6.145 1.00 0.51 O ATOM 2582 CB LEU A 157 -1.354 6.793 3.850 1.00 0.52 C ATOM 2583 CG LEU A 157 -1.640 8.241 3.385 1.00 0.76 C ATOM 2584 CD1 LEU A 157 -1.105 8.462 1.963 1.00 2.38 C ATOM 2585 CD2 LEU A 157 -3.128 8.588 3.415 1.00 1.73 C ATOM 0 H LEU A 157 0.254 7.743 5.449 1.00 0.53 H new ATOM 0 HA LEU A 157 -2.455 7.007 5.660 1.00 0.51 H new ATOM 0 HB2 LEU A 157 -0.346 6.514 3.543 1.00 0.52 H new ATOM 0 HB3 LEU A 157 -2.041 6.115 3.343 1.00 0.52 H new ATOM 0 HG LEU A 157 -1.128 8.897 4.089 1.00 0.76 H new ATOM 0 HD11 LEU A 157 -1.314 9.485 1.651 1.00 2.38 H new ATOM 0 HD12 LEU A 157 -0.029 8.291 1.949 1.00 2.38 H new ATOM 0 HD13 LEU A 157 -1.592 7.767 1.279 1.00 2.38 H new ATOM 0 HD21 LEU A 157 -3.269 9.615 3.079 1.00 1.73 H new ATOM 0 HD22 LEU A 157 -3.673 7.912 2.755 1.00 1.73 H new ATOM 0 HD23 LEU A 157 -3.505 8.484 4.432 1.00 1.73 H new ATOM 2597 N VAL A 158 -0.339 4.463 5.841 1.00 0.51 N ATOM 2598 CA VAL A 158 -0.285 3.069 6.304 1.00 0.52 C ATOM 2599 C VAL A 158 -0.728 2.916 7.760 1.00 0.49 C ATOM 2600 O VAL A 158 -1.528 2.025 8.013 1.00 0.51 O ATOM 2601 CB VAL A 158 1.041 2.337 5.985 1.00 0.60 C ATOM 2602 CG1 VAL A 158 2.185 2.636 6.961 1.00 0.66 C ATOM 2603 CG2 VAL A 158 0.826 0.814 5.928 1.00 0.66 C ATOM 0 H VAL A 158 0.563 4.858 5.575 1.00 0.51 H new ATOM 0 HA VAL A 158 -1.026 2.544 5.702 1.00 0.52 H new ATOM 0 HB VAL A 158 1.343 2.725 5.012 1.00 0.60 H new ATOM 0 HG11 VAL A 158 3.074 2.081 6.661 1.00 0.66 H new ATOM 0 HG12 VAL A 158 2.403 3.704 6.950 1.00 0.66 H new ATOM 0 HG13 VAL A 158 1.893 2.336 7.967 1.00 0.66 H new ATOM 0 HG21 VAL A 158 1.772 0.321 5.702 1.00 0.66 H new ATOM 0 HG22 VAL A 158 0.454 0.463 6.891 1.00 0.66 H new ATOM 0 HG23 VAL A 158 0.099 0.578 5.151 1.00 0.66 H new ATOM 2613 N ARG A 159 -0.295 3.765 8.712 1.00 0.49 N ATOM 2614 CA ARG A 159 -0.752 3.616 10.108 1.00 0.54 C ATOM 2615 C ARG A 159 -2.257 3.811 10.244 1.00 0.51 C ATOM 2616 O ARG A 159 -2.939 3.023 10.900 1.00 0.54 O ATOM 2617 CB ARG A 159 0.073 4.455 11.117 1.00 0.71 C ATOM 2618 CG ARG A 159 -0.353 5.907 11.438 1.00 1.30 C ATOM 2619 CD ARG A 159 -1.486 6.123 12.454 1.00 1.35 C ATOM 2620 NE ARG A 159 -1.147 5.642 13.803 1.00 1.94 N ATOM 2621 CZ ARG A 159 -1.793 5.980 14.913 1.00 2.94 C ATOM 2622 NH1 ARG A 159 -2.829 6.792 14.897 1.00 3.66 N ATOM 2623 NH2 ARG A 159 -1.395 5.502 16.073 1.00 3.85 N ATOM 0 H ARG A 159 0.350 4.538 8.549 1.00 0.49 H new ATOM 0 HA ARG A 159 -0.556 2.580 10.384 1.00 0.54 H new ATOM 0 HB2 ARG A 159 0.091 3.906 12.058 1.00 0.71 H new ATOM 0 HB3 ARG A 159 1.098 4.491 10.749 1.00 0.71 H new ATOM 0 HG2 ARG A 159 0.526 6.439 11.801 1.00 1.30 H new ATOM 0 HG3 ARG A 159 -0.649 6.382 10.503 1.00 1.30 H new ATOM 0 HD2 ARG A 159 -1.726 7.185 12.502 1.00 1.35 H new ATOM 0 HD3 ARG A 159 -2.382 5.610 12.106 1.00 1.35 H new ATOM 0 HE ARG A 159 -0.358 5.002 13.892 1.00 1.94 H new ATOM 0 HH11 ARG A 159 -3.158 7.182 14.014 1.00 3.66 H new ATOM 0 HH12 ARG A 159 -3.303 7.031 15.768 1.00 3.66 H new ATOM 0 HH21 ARG A 159 -0.593 4.874 16.118 1.00 3.85 H new ATOM 0 HH22 ARG A 159 -1.889 5.760 16.927 1.00 3.85 H new ATOM 2637 N GLU A 160 -2.765 4.865 9.613 1.00 0.47 N ATOM 2638 CA GLU A 160 -4.116 5.354 9.852 1.00 0.47 C ATOM 2639 C GLU A 160 -5.136 4.540 9.045 1.00 0.51 C ATOM 2640 O GLU A 160 -6.179 4.167 9.575 1.00 0.60 O ATOM 2641 CB GLU A 160 -4.142 6.853 9.500 1.00 0.61 C ATOM 2642 CG GLU A 160 -5.067 7.717 10.360 1.00 1.50 C ATOM 2643 CD GLU A 160 -4.327 8.371 11.535 1.00 1.76 C ATOM 2644 OE1 GLU A 160 -4.005 7.682 12.526 1.00 3.09 O ATOM 2645 OE2 GLU A 160 -4.057 9.586 11.461 1.00 2.42 O ATOM 0 H GLU A 160 -2.248 5.405 8.919 1.00 0.47 H new ATOM 0 HA GLU A 160 -4.396 5.232 10.898 1.00 0.47 H new ATOM 0 HB2 GLU A 160 -3.128 7.245 9.582 1.00 0.61 H new ATOM 0 HB3 GLU A 160 -4.441 6.958 8.457 1.00 0.61 H new ATOM 0 HG2 GLU A 160 -5.517 8.492 9.740 1.00 1.50 H new ATOM 0 HG3 GLU A 160 -5.882 7.103 10.743 1.00 1.50 H new ATOM 2652 N SER A 161 -4.813 4.182 7.798 1.00 0.51 N ATOM 2653 CA SER A 161 -5.640 3.288 6.981 1.00 0.59 C ATOM 2654 C SER A 161 -5.681 1.868 7.553 1.00 0.59 C ATOM 2655 O SER A 161 -6.772 1.322 7.716 1.00 0.64 O ATOM 2656 CB SER A 161 -5.134 3.256 5.534 1.00 0.71 C ATOM 2657 OG SER A 161 -5.982 2.468 4.718 1.00 1.34 O ATOM 0 H SER A 161 -3.969 4.505 7.326 1.00 0.51 H new ATOM 0 HA SER A 161 -6.655 3.684 6.996 1.00 0.59 H new ATOM 0 HB2 SER A 161 -5.084 4.271 5.140 1.00 0.71 H new ATOM 0 HB3 SER A 161 -4.121 2.854 5.508 1.00 0.71 H new ATOM 0 HG SER A 161 -5.770 1.520 4.846 1.00 1.34 H new ATOM 2663 N LEU A 162 -4.525 1.279 7.915 1.00 0.60 N ATOM 2664 CA LEU A 162 -4.457 -0.088 8.452 1.00 0.71 C ATOM 2665 C LEU A 162 -5.359 -0.197 9.674 1.00 0.72 C ATOM 2666 O LEU A 162 -6.245 -1.049 9.702 1.00 0.83 O ATOM 2667 CB LEU A 162 -2.984 -0.420 8.772 1.00 0.82 C ATOM 2668 CG LEU A 162 -2.613 -1.813 9.328 1.00 1.20 C ATOM 2669 CD1 LEU A 162 -1.079 -1.902 9.359 1.00 1.60 C ATOM 2670 CD2 LEU A 162 -3.100 -2.078 10.762 1.00 2.76 C ATOM 0 H LEU A 162 -3.617 1.738 7.843 1.00 0.60 H new ATOM 0 HA LEU A 162 -4.814 -0.815 7.723 1.00 0.71 H new ATOM 0 HB2 LEU A 162 -2.411 -0.273 7.856 1.00 0.82 H new ATOM 0 HB3 LEU A 162 -2.633 0.321 9.490 1.00 0.82 H new ATOM 0 HG LEU A 162 -3.095 -2.546 8.681 1.00 1.20 H new ATOM 0 HD11 LEU A 162 -0.779 -2.875 9.747 1.00 1.60 H new ATOM 0 HD12 LEU A 162 -0.687 -1.777 8.350 1.00 1.60 H new ATOM 0 HD13 LEU A 162 -0.682 -1.117 10.002 1.00 1.60 H new ATOM 0 HD21 LEU A 162 -2.796 -3.078 11.071 1.00 2.76 H new ATOM 0 HD22 LEU A 162 -2.663 -1.341 11.436 1.00 2.76 H new ATOM 0 HD23 LEU A 162 -4.187 -2.003 10.797 1.00 2.76 H new ATOM 2682 N MET A 163 -5.195 0.695 10.653 1.00 0.68 N ATOM 2683 CA MET A 163 -5.951 0.617 11.899 1.00 0.79 C ATOM 2684 C MET A 163 -7.446 0.869 11.685 1.00 0.71 C ATOM 2685 O MET A 163 -8.262 0.173 12.286 1.00 0.77 O ATOM 2686 CB MET A 163 -5.324 1.499 12.982 1.00 0.97 C ATOM 2687 CG MET A 163 -5.657 2.976 12.873 1.00 0.93 C ATOM 2688 SD MET A 163 -4.943 3.929 14.220 1.00 1.69 S ATOM 2689 CE MET A 163 -5.694 5.467 13.690 1.00 1.04 C ATOM 0 H MET A 163 -4.544 1.479 10.604 1.00 0.68 H new ATOM 0 HA MET A 163 -5.888 -0.407 12.268 1.00 0.79 H new ATOM 0 HB2 MET A 163 -5.650 1.139 13.958 1.00 0.97 H new ATOM 0 HB3 MET A 163 -4.241 1.382 12.944 1.00 0.97 H new ATOM 0 HG2 MET A 163 -5.289 3.361 11.922 1.00 0.93 H new ATOM 0 HG3 MET A 163 -6.739 3.104 12.872 1.00 0.93 H new ATOM 0 HE1 MET A 163 -5.366 6.276 14.343 1.00 1.04 H new ATOM 0 HE2 MET A 163 -5.394 5.684 12.665 1.00 1.04 H new ATOM 0 HE3 MET A 163 -6.779 5.378 13.740 1.00 1.04 H new ATOM 2699 N ALA A 164 -7.816 1.829 10.829 1.00 0.62 N ATOM 2700 CA ALA A 164 -9.214 2.147 10.542 1.00 0.59 C ATOM 2701 C ALA A 164 -9.920 0.985 9.841 1.00 0.62 C ATOM 2702 O ALA A 164 -11.023 0.609 10.241 1.00 0.66 O ATOM 2703 CB ALA A 164 -9.277 3.434 9.697 1.00 0.56 C ATOM 0 H ALA A 164 -7.150 2.407 10.316 1.00 0.62 H new ATOM 0 HA ALA A 164 -9.740 2.312 11.482 1.00 0.59 H new ATOM 0 HB1 ALA A 164 -10.317 3.676 9.480 1.00 0.56 H new ATOM 0 HB2 ALA A 164 -8.821 4.255 10.250 1.00 0.56 H new ATOM 0 HB3 ALA A 164 -8.737 3.282 8.762 1.00 0.56 H new ATOM 2709 N LEU A 165 -9.267 0.381 8.843 1.00 0.63 N ATOM 2710 CA LEU A 165 -9.801 -0.748 8.079 1.00 0.72 C ATOM 2711 C LEU A 165 -9.899 -1.988 8.975 1.00 0.81 C ATOM 2712 O LEU A 165 -10.931 -2.658 8.989 1.00 0.86 O ATOM 2713 CB LEU A 165 -8.926 -0.950 6.822 1.00 0.75 C ATOM 2714 CG LEU A 165 -9.626 -1.597 5.610 1.00 0.97 C ATOM 2715 CD1 LEU A 165 -8.734 -1.436 4.369 1.00 2.31 C ATOM 2716 CD2 LEU A 165 -9.942 -3.083 5.821 1.00 2.21 C ATOM 0 H LEU A 165 -8.337 0.669 8.539 1.00 0.63 H new ATOM 0 HA LEU A 165 -10.817 -0.551 7.736 1.00 0.72 H new ATOM 0 HB2 LEU A 165 -8.535 0.020 6.516 1.00 0.75 H new ATOM 0 HB3 LEU A 165 -8.070 -1.567 7.094 1.00 0.75 H new ATOM 0 HG LEU A 165 -10.579 -1.086 5.476 1.00 0.97 H new ATOM 0 HD11 LEU A 165 -9.223 -1.891 3.508 1.00 2.31 H new ATOM 0 HD12 LEU A 165 -8.569 -0.376 4.174 1.00 2.31 H new ATOM 0 HD13 LEU A 165 -7.776 -1.926 4.543 1.00 2.31 H new ATOM 0 HD21 LEU A 165 -10.434 -3.480 4.933 1.00 2.21 H new ATOM 0 HD22 LEU A 165 -9.016 -3.630 5.998 1.00 2.21 H new ATOM 0 HD23 LEU A 165 -10.601 -3.196 6.682 1.00 2.21 H new ATOM 2728 N MET A 166 -8.880 -2.231 9.808 1.00 0.84 N ATOM 2729 CA MET A 166 -8.898 -3.310 10.803 1.00 0.96 C ATOM 2730 C MET A 166 -10.066 -3.153 11.777 1.00 0.93 C ATOM 2731 O MET A 166 -10.824 -4.102 11.973 1.00 1.00 O ATOM 2732 CB MET A 166 -7.574 -3.352 11.578 1.00 1.04 C ATOM 2733 CG MET A 166 -6.443 -4.004 10.776 1.00 2.18 C ATOM 2734 SD MET A 166 -6.641 -5.745 10.303 1.00 3.05 S ATOM 2735 CE MET A 166 -7.134 -6.460 11.890 1.00 1.79 C ATOM 0 H MET A 166 -8.019 -1.684 9.811 1.00 0.84 H new ATOM 0 HA MET A 166 -9.027 -4.249 10.265 1.00 0.96 H new ATOM 0 HB2 MET A 166 -7.284 -2.337 11.850 1.00 1.04 H new ATOM 0 HB3 MET A 166 -7.719 -3.902 12.508 1.00 1.04 H new ATOM 0 HG2 MET A 166 -6.299 -3.423 9.865 1.00 2.18 H new ATOM 0 HG3 MET A 166 -5.525 -3.917 11.358 1.00 2.18 H new ATOM 0 HE1 MET A 166 -6.825 -7.505 11.930 1.00 1.79 H new ATOM 0 HE2 MET A 166 -6.657 -5.909 12.701 1.00 1.79 H new ATOM 0 HE3 MET A 166 -8.217 -6.397 11.996 1.00 1.79 H new ATOM 2745 N ARG A 167 -10.252 -1.957 12.351 1.00 0.86 N ATOM 2746 CA ARG A 167 -11.361 -1.669 13.269 1.00 0.88 C ATOM 2747 C ARG A 167 -12.754 -1.772 12.636 1.00 0.81 C ATOM 2748 O ARG A 167 -13.740 -1.971 13.347 1.00 0.88 O ATOM 2749 CB ARG A 167 -11.171 -0.296 13.949 1.00 0.95 C ATOM 2750 CG ARG A 167 -10.560 -0.402 15.355 1.00 1.29 C ATOM 2751 CD ARG A 167 -11.336 -1.396 16.238 1.00 2.16 C ATOM 2752 NE ARG A 167 -11.433 -1.001 17.650 1.00 2.27 N ATOM 2753 CZ ARG A 167 -12.249 -1.581 18.526 1.00 3.32 C ATOM 2754 NH1 ARG A 167 -12.953 -2.652 18.215 1.00 4.37 N ATOM 2755 NH2 ARG A 167 -12.376 -1.084 19.737 1.00 3.83 N ATOM 0 H ARG A 167 -9.636 -1.160 12.191 1.00 0.86 H new ATOM 0 HA ARG A 167 -11.323 -2.457 14.021 1.00 0.88 H new ATOM 0 HB2 ARG A 167 -10.529 0.326 13.326 1.00 0.95 H new ATOM 0 HB3 ARG A 167 -12.136 0.207 14.015 1.00 0.95 H new ATOM 0 HG2 ARG A 167 -9.520 -0.719 15.277 1.00 1.29 H new ATOM 0 HG3 ARG A 167 -10.559 0.581 15.827 1.00 1.29 H new ATOM 0 HD2 ARG A 167 -12.342 -1.513 15.835 1.00 2.16 H new ATOM 0 HD3 ARG A 167 -10.853 -2.371 16.178 1.00 2.16 H new ATOM 0 HE ARG A 167 -10.840 -0.238 17.977 1.00 2.27 H new ATOM 0 HH11 ARG A 167 -12.880 -3.057 17.282 1.00 4.37 H new ATOM 0 HH12 ARG A 167 -13.571 -3.075 18.908 1.00 4.37 H new ATOM 0 HH21 ARG A 167 -11.849 -0.253 20.005 1.00 3.83 H new ATOM 0 HH22 ARG A 167 -13.002 -1.529 20.408 1.00 3.83 H new ATOM 2769 N LEU A 168 -12.844 -1.647 11.313 1.00 0.76 N ATOM 2770 CA LEU A 168 -14.089 -1.797 10.554 1.00 0.83 C ATOM 2771 C LEU A 168 -14.489 -3.269 10.331 1.00 1.03 C ATOM 2772 O LEU A 168 -15.676 -3.555 10.167 1.00 1.26 O ATOM 2773 CB LEU A 168 -13.960 -0.987 9.247 1.00 0.78 C ATOM 2774 CG LEU A 168 -15.086 0.055 9.106 1.00 0.80 C ATOM 2775 CD1 LEU A 168 -14.610 1.228 8.244 1.00 1.96 C ATOM 2776 CD2 LEU A 168 -16.345 -0.598 8.527 1.00 1.44 C ATOM 0 H LEU A 168 -12.038 -1.434 10.725 1.00 0.76 H new ATOM 0 HA LEU A 168 -14.917 -1.394 11.137 1.00 0.83 H new ATOM 0 HB2 LEU A 168 -12.994 -0.483 9.226 1.00 0.78 H new ATOM 0 HB3 LEU A 168 -13.984 -1.666 8.395 1.00 0.78 H new ATOM 0 HG LEU A 168 -15.341 0.446 10.091 1.00 0.80 H new ATOM 0 HD11 LEU A 168 -15.413 1.960 8.150 1.00 1.96 H new ATOM 0 HD12 LEU A 168 -13.745 1.697 8.713 1.00 1.96 H new ATOM 0 HD13 LEU A 168 -14.333 0.864 7.255 1.00 1.96 H new ATOM 0 HD21 LEU A 168 -17.132 0.150 8.433 1.00 1.44 H new ATOM 0 HD22 LEU A 168 -16.120 -1.014 7.545 1.00 1.44 H new ATOM 0 HD23 LEU A 168 -16.679 -1.395 9.191 1.00 1.44 H new ATOM 2788 N ASN A 169 -13.538 -4.207 10.392 1.00 1.07 N ATOM 2789 CA ASN A 169 -13.811 -5.651 10.386 1.00 1.37 C ATOM 2790 C ASN A 169 -13.856 -6.261 11.804 1.00 1.40 C ATOM 2791 O ASN A 169 -14.745 -7.062 12.093 1.00 1.71 O ATOM 2792 CB ASN A 169 -12.751 -6.367 9.532 1.00 1.62 C ATOM 2793 CG ASN A 169 -13.050 -6.265 8.039 1.00 1.98 C ATOM 2794 OD1 ASN A 169 -12.832 -5.240 7.404 1.00 2.43 O ATOM 2795 ND2 ASN A 169 -13.571 -7.316 7.428 1.00 2.95 N ATOM 0 H ASN A 169 -12.544 -3.984 10.448 1.00 1.07 H new ATOM 0 HA ASN A 169 -14.802 -5.794 9.956 1.00 1.37 H new ATOM 0 HB2 ASN A 169 -11.771 -5.935 9.735 1.00 1.62 H new ATOM 0 HB3 ASN A 169 -12.703 -7.417 9.820 1.00 1.62 H new ATOM 0 HD21 ASN A 169 -13.789 -7.271 6.433 1.00 2.95 H new ATOM 0 HD22 ASN A 169 -13.754 -8.172 7.952 1.00 2.95 H new