USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1052 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 130 ASN : amide:sc= -0.109 K(o=1.4,f=-0.43) USER MOD Set 1.2: A 133 ASN : amide:sc= 1.54 K(o=1.4,f=-0.43) USER MOD Set 2.1: A 88 ASN : amide:sc= 0.24 X(o=0.5,f=0.23) USER MOD Set 2.2: A 142 TYR OH : rot 180:sc= 0.262 USER MOD Set 3.1: A 40 HIS : no HE2:sc= 1.65 K(o=1.4,f=-8.8!) USER MOD Set 3.2: A 179 HIS : no HE2:sc= -0.288 K(o=1.4,f=-4.4!) USER MOD Single : A 32 THR OG1 : rot -29:sc= 0.194 USER MOD Single : A 33 THR OG1 : rot 178:sc= 1.25 USER MOD Single : A 34 THR OG1 : rot 45:sc= 1.04 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -160:sc= 0 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 162:sc= 1.83 (180deg=1.49) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 168:sc= -1.38 (180deg=-1.68) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 ASN : amide:sc= 0.636 K(o=0.64,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 TYR OH : rot 180:sc= 0.111 USER MOD Single : A 64 ASN : amide:sc= 0.664 K(o=0.66,f=-0.62) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 1.05 (180deg=1.05) USER MOD Single : A 72 ASN : amide:sc= -0.472 K(o=-0.47,f=-4.6!) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 84 THR OG1 : rot -24:sc= 0.94 USER MOD Single : A 85 ASN : amide:sc= -1.01 X(o=-1,f=-1.2) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 94 ASN : amide:sc= 1.22 K(o=1.2,f=-0.0026) USER MOD Single : A 96 GLN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -0.488 X(o=-0.49,f=-0.26) USER MOD Single : A 105 GLN : amide:sc=-0.00964 X(o=-0.0096,f=-0.0096) USER MOD Single : A 106 THR OG1 : rot 180:sc= -0.482 USER MOD Single : A 108 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.024) USER MOD Single : A 110 SER OG : rot 170:sc= 0.397 USER MOD Single : A 113 MET CE :methyl -152:sc= 0 (180deg=-0.165) USER MOD Single : A 116 THR OG1 : rot 180:sc= -0.383 USER MOD Single : A 118 MET CE :methyl -146:sc= -0.321 (180deg=-2.73!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 LYS NZ :NH3+ -165:sc= 1.21 (180deg=1.11) USER MOD Single : A 122 THR OG1 : rot 180:sc= -0.192 USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ -149:sc= 1.52 (180deg=0.299) USER MOD Single : A 139 TYR OH : rot 4:sc= 0.972 USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 145 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 146 SER OG : rot 180:sc=-0.00834 USER MOD Single : A 162 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 173 ASN : amide:sc= 0.0333 K(o=0.033,f=-3.2!) USER MOD Single : A 181 TYR OH : rot 180:sc= 0 USER MOD Single : A 183 LYS NZ :NH3+ 160:sc=-0.00634 (180deg=-0.557) USER MOD Single : A 184 ASN : amide:sc= -0.124 K(o=-0.12,f=-0.65) USER MOD Single : A 185 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 167 N THR A 32 -0.598 -20.610 -1.725 1.00 1.21 N ATOM 168 CA THR A 32 0.196 -19.448 -2.163 1.00 1.00 C ATOM 169 C THR A 32 1.637 -19.811 -2.572 1.00 0.93 C ATOM 170 O THR A 32 2.101 -20.945 -2.415 1.00 1.07 O ATOM 171 CB THR A 32 0.217 -18.355 -1.066 1.00 1.06 C ATOM 172 OG1 THR A 32 0.515 -18.892 0.207 1.00 1.27 O ATOM 173 CG2 THR A 32 -1.116 -17.620 -0.942 1.00 1.08 C ATOM 0 HA THR A 32 -0.298 -19.064 -3.056 1.00 1.00 H new ATOM 0 HB THR A 32 0.995 -17.659 -1.381 1.00 1.06 H new ATOM 0 HG1 THR A 32 0.200 -19.819 0.253 1.00 1.27 H new ATOM 0 HG21 THR A 32 -1.044 -16.866 -0.159 1.00 1.08 H new ATOM 0 HG22 THR A 32 -1.355 -17.137 -1.890 1.00 1.08 H new ATOM 0 HG23 THR A 32 -1.902 -18.332 -0.689 1.00 1.08 H new ATOM 181 N THR A 33 2.361 -18.834 -3.122 1.00 0.83 N ATOM 182 CA THR A 33 3.784 -18.902 -3.508 1.00 0.79 C ATOM 183 C THR A 33 4.693 -18.049 -2.613 1.00 0.73 C ATOM 184 O THR A 33 5.903 -18.002 -2.820 1.00 1.09 O ATOM 185 CB THR A 33 3.969 -18.508 -4.985 1.00 0.86 C ATOM 186 OG1 THR A 33 3.475 -17.214 -5.246 1.00 1.29 O ATOM 187 CG2 THR A 33 3.222 -19.461 -5.916 1.00 1.23 C ATOM 0 H THR A 33 1.954 -17.921 -3.324 1.00 0.83 H new ATOM 0 HA THR A 33 4.088 -19.939 -3.370 1.00 0.79 H new ATOM 0 HB THR A 33 5.043 -18.551 -5.169 1.00 0.86 H new ATOM 0 HG1 THR A 33 3.642 -16.983 -6.184 1.00 1.29 H new ATOM 0 HG21 THR A 33 3.374 -19.153 -6.950 1.00 1.23 H new ATOM 0 HG22 THR A 33 3.600 -20.474 -5.779 1.00 1.23 H new ATOM 0 HG23 THR A 33 2.157 -19.437 -5.683 1.00 1.23 H new ATOM 195 N THR A 34 4.129 -17.340 -1.629 1.00 0.77 N ATOM 196 CA THR A 34 4.841 -16.440 -0.700 1.00 0.71 C ATOM 197 C THR A 34 3.969 -16.105 0.525 1.00 0.61 C ATOM 198 O THR A 34 2.744 -16.217 0.470 1.00 0.73 O ATOM 199 CB THR A 34 5.306 -15.197 -1.493 1.00 0.89 C ATOM 200 OG1 THR A 34 6.599 -15.467 -1.991 1.00 1.87 O ATOM 201 CG2 THR A 34 5.396 -13.867 -0.759 1.00 1.14 C ATOM 0 H THR A 34 3.126 -17.375 -1.447 1.00 0.77 H new ATOM 0 HA THR A 34 5.725 -16.927 -0.290 1.00 0.71 H new ATOM 0 HB THR A 34 4.523 -15.056 -2.239 1.00 0.89 H new ATOM 0 HG1 THR A 34 6.623 -16.372 -2.367 1.00 1.87 H new ATOM 0 HG21 THR A 34 5.736 -13.094 -1.448 1.00 1.14 H new ATOM 0 HG22 THR A 34 4.414 -13.600 -0.369 1.00 1.14 H new ATOM 0 HG23 THR A 34 6.103 -13.954 0.066 1.00 1.14 H new ATOM 209 N THR A 35 4.595 -15.702 1.637 1.00 0.60 N ATOM 210 CA THR A 35 3.982 -15.519 2.975 1.00 0.57 C ATOM 211 C THR A 35 3.915 -14.069 3.481 1.00 0.52 C ATOM 212 O THR A 35 3.309 -13.820 4.527 1.00 0.53 O ATOM 213 CB THR A 35 4.738 -16.368 4.012 1.00 0.74 C ATOM 214 OG1 THR A 35 6.128 -16.177 3.878 1.00 0.88 O ATOM 215 CG2 THR A 35 4.453 -17.858 3.845 1.00 0.93 C ATOM 0 H THR A 35 5.591 -15.482 1.637 1.00 0.60 H new ATOM 0 HA THR A 35 2.948 -15.841 2.854 1.00 0.57 H new ATOM 0 HB THR A 35 4.393 -16.045 4.994 1.00 0.74 H new ATOM 0 HG1 THR A 35 6.599 -16.721 4.544 1.00 0.88 H new ATOM 0 HG21 THR A 35 5.006 -18.421 4.597 1.00 0.93 H new ATOM 0 HG22 THR A 35 3.385 -18.040 3.968 1.00 0.93 H new ATOM 0 HG23 THR A 35 4.763 -18.179 2.851 1.00 0.93 H new ATOM 223 N SER A 36 4.510 -13.111 2.766 1.00 0.54 N ATOM 224 CA SER A 36 4.509 -11.673 3.054 1.00 0.53 C ATOM 225 C SER A 36 4.558 -10.817 1.778 1.00 0.48 C ATOM 226 O SER A 36 4.873 -11.295 0.688 1.00 0.57 O ATOM 227 CB SER A 36 5.692 -11.326 3.968 1.00 0.66 C ATOM 228 OG SER A 36 6.936 -11.522 3.322 1.00 1.72 O ATOM 0 H SER A 36 5.037 -13.330 1.920 1.00 0.54 H new ATOM 0 HA SER A 36 3.570 -11.442 3.557 1.00 0.53 H new ATOM 0 HB2 SER A 36 5.610 -10.288 4.289 1.00 0.66 H new ATOM 0 HB3 SER A 36 5.649 -11.942 4.866 1.00 0.66 H new ATOM 0 HG SER A 36 7.644 -11.604 3.994 1.00 1.72 H new ATOM 234 N VAL A 37 4.275 -9.525 1.923 1.00 0.42 N ATOM 235 CA VAL A 37 4.305 -8.505 0.865 1.00 0.37 C ATOM 236 C VAL A 37 5.052 -7.259 1.348 1.00 0.37 C ATOM 237 O VAL A 37 4.828 -6.810 2.471 1.00 0.44 O ATOM 238 CB VAL A 37 2.882 -8.194 0.374 1.00 0.35 C ATOM 239 CG1 VAL A 37 1.970 -7.708 1.492 1.00 0.34 C ATOM 240 CG2 VAL A 37 2.863 -7.187 -0.781 1.00 0.37 C ATOM 0 H VAL A 37 4.004 -9.136 2.826 1.00 0.42 H new ATOM 0 HA VAL A 37 4.854 -8.891 0.007 1.00 0.37 H new ATOM 0 HB VAL A 37 2.496 -9.144 0.006 1.00 0.35 H new ATOM 0 HG11 VAL A 37 0.978 -7.503 1.089 1.00 0.34 H new ATOM 0 HG12 VAL A 37 1.898 -8.476 2.262 1.00 0.34 H new ATOM 0 HG13 VAL A 37 2.381 -6.796 1.926 1.00 0.34 H new ATOM 0 HG21 VAL A 37 1.833 -7.004 -1.088 1.00 0.37 H new ATOM 0 HG22 VAL A 37 3.316 -6.251 -0.455 1.00 0.37 H new ATOM 0 HG23 VAL A 37 3.427 -7.589 -1.623 1.00 0.37 H new ATOM 250 N THR A 38 5.918 -6.673 0.514 1.00 0.41 N ATOM 251 CA THR A 38 6.626 -5.421 0.851 1.00 0.41 C ATOM 252 C THR A 38 6.021 -4.238 0.097 1.00 0.39 C ATOM 253 O THR A 38 6.114 -4.143 -1.126 1.00 0.47 O ATOM 254 CB THR A 38 8.142 -5.514 0.629 1.00 0.50 C ATOM 255 OG1 THR A 38 8.652 -6.689 1.218 1.00 0.68 O ATOM 256 CG2 THR A 38 8.910 -4.359 1.266 1.00 0.52 C ATOM 0 H THR A 38 6.150 -7.045 -0.407 1.00 0.41 H new ATOM 0 HA THR A 38 6.487 -5.256 1.919 1.00 0.41 H new ATOM 0 HB THR A 38 8.277 -5.496 -0.452 1.00 0.50 H new ATOM 0 HG1 THR A 38 9.619 -6.737 1.068 1.00 0.68 H new ATOM 0 HG21 THR A 38 9.976 -4.481 1.074 1.00 0.52 H new ATOM 0 HG22 THR A 38 8.570 -3.416 0.838 1.00 0.52 H new ATOM 0 HG23 THR A 38 8.733 -4.354 2.342 1.00 0.52 H new ATOM 264 N VAL A 39 5.382 -3.322 0.822 1.00 0.36 N ATOM 265 CA VAL A 39 4.788 -2.091 0.281 1.00 0.38 C ATOM 266 C VAL A 39 5.799 -0.942 0.382 1.00 0.41 C ATOM 267 O VAL A 39 6.354 -0.668 1.443 1.00 0.47 O ATOM 268 CB VAL A 39 3.411 -1.798 0.920 1.00 0.40 C ATOM 269 CG1 VAL A 39 3.374 -2.039 2.429 1.00 0.52 C ATOM 270 CG2 VAL A 39 2.885 -0.399 0.575 1.00 0.42 C ATOM 0 H VAL A 39 5.257 -3.414 1.830 1.00 0.36 H new ATOM 0 HA VAL A 39 4.572 -2.218 -0.780 1.00 0.38 H new ATOM 0 HB VAL A 39 2.736 -2.526 0.470 1.00 0.40 H new ATOM 0 HG11 VAL A 39 2.378 -1.813 2.809 1.00 0.52 H new ATOM 0 HG12 VAL A 39 3.614 -3.082 2.637 1.00 0.52 H new ATOM 0 HG13 VAL A 39 4.104 -1.394 2.918 1.00 0.52 H new ATOM 0 HG21 VAL A 39 1.916 -0.247 1.050 1.00 0.42 H new ATOM 0 HG22 VAL A 39 3.587 0.353 0.935 1.00 0.42 H new ATOM 0 HG23 VAL A 39 2.778 -0.307 -0.506 1.00 0.42 H new ATOM 280 N HIS A 40 6.056 -0.295 -0.751 1.00 0.45 N ATOM 281 CA HIS A 40 7.010 0.816 -0.925 1.00 0.51 C ATOM 282 C HIS A 40 6.262 2.168 -1.065 1.00 0.72 C ATOM 283 O HIS A 40 5.053 2.214 -0.833 1.00 1.73 O ATOM 284 CB HIS A 40 7.919 0.468 -2.119 1.00 0.51 C ATOM 285 CG HIS A 40 8.717 -0.810 -1.940 1.00 0.51 C ATOM 286 ND1 HIS A 40 9.991 -0.915 -1.432 1.00 0.60 N ATOM 287 CD2 HIS A 40 8.310 -2.083 -2.232 1.00 0.51 C ATOM 288 CE1 HIS A 40 10.345 -2.209 -1.420 1.00 0.65 C ATOM 289 NE2 HIS A 40 9.359 -2.971 -1.930 1.00 0.59 N ATOM 0 H HIS A 40 5.585 -0.538 -1.622 1.00 0.45 H new ATOM 0 HA HIS A 40 7.643 0.943 -0.047 1.00 0.51 H new ATOM 0 HB2 HIS A 40 7.305 0.377 -3.015 1.00 0.51 H new ATOM 0 HB3 HIS A 40 8.610 1.294 -2.288 1.00 0.51 H new ATOM 0 HD1 HIS A 40 10.571 -0.137 -1.117 1.00 0.60 H new ATOM 0 HD2 HIS A 40 7.344 -2.360 -2.628 1.00 0.51 H new ATOM 0 HE1 HIS A 40 11.288 -2.586 -1.053 1.00 0.65 H new ATOM 297 N LYS A 41 6.926 3.282 -1.427 1.00 0.73 N ATOM 298 CA LYS A 41 6.244 4.554 -1.775 1.00 0.76 C ATOM 299 C LYS A 41 6.990 5.393 -2.819 1.00 0.76 C ATOM 300 O LYS A 41 8.150 5.749 -2.613 1.00 0.87 O ATOM 301 CB LYS A 41 6.011 5.383 -0.497 1.00 0.96 C ATOM 302 CG LYS A 41 5.297 6.730 -0.740 1.00 1.41 C ATOM 303 CD LYS A 41 3.885 6.642 -1.344 1.00 1.03 C ATOM 304 CE LYS A 41 3.372 8.062 -1.613 1.00 0.71 C ATOM 305 NZ LYS A 41 1.928 8.080 -1.932 1.00 1.16 N ATOM 0 H LYS A 41 7.943 3.331 -1.488 1.00 0.73 H new ATOM 0 HA LYS A 41 5.293 4.281 -2.233 1.00 0.76 H new ATOM 0 HB2 LYS A 41 5.421 4.792 0.203 1.00 0.96 H new ATOM 0 HB3 LYS A 41 6.973 5.575 -0.021 1.00 0.96 H new ATOM 0 HG2 LYS A 41 5.233 7.262 0.209 1.00 1.41 H new ATOM 0 HG3 LYS A 41 5.918 7.334 -1.402 1.00 1.41 H new ATOM 0 HD2 LYS A 41 3.906 6.067 -2.270 1.00 1.03 H new ATOM 0 HD3 LYS A 41 3.214 6.122 -0.660 1.00 1.03 H new ATOM 0 HE2 LYS A 41 3.558 8.686 -0.739 1.00 0.71 H new ATOM 0 HE3 LYS A 41 3.931 8.498 -2.441 1.00 0.71 H new ATOM 0 HZ1 LYS A 41 1.557 9.044 -1.808 1.00 1.16 H new ATOM 0 HZ2 LYS A 41 1.786 7.779 -2.917 1.00 1.16 H new ATOM 0 HZ3 LYS A 41 1.424 7.430 -1.296 1.00 1.16 H new ATOM 319 N LEU A 42 6.286 5.785 -3.889 1.00 0.66 N ATOM 320 CA LEU A 42 6.789 6.674 -4.946 1.00 0.62 C ATOM 321 C LEU A 42 5.987 7.985 -5.069 1.00 0.52 C ATOM 322 O LEU A 42 4.831 8.064 -4.652 1.00 0.49 O ATOM 323 CB LEU A 42 6.770 5.959 -6.315 1.00 0.69 C ATOM 324 CG LEU A 42 7.460 4.593 -6.450 1.00 0.78 C ATOM 325 CD1 LEU A 42 7.639 4.300 -7.943 1.00 0.93 C ATOM 326 CD2 LEU A 42 8.838 4.496 -5.805 1.00 0.74 C ATOM 0 H LEU A 42 5.324 5.485 -4.048 1.00 0.66 H new ATOM 0 HA LEU A 42 7.809 6.928 -4.658 1.00 0.62 H new ATOM 0 HB2 LEU A 42 5.727 5.831 -6.605 1.00 0.69 H new ATOM 0 HB3 LEU A 42 7.224 6.631 -7.044 1.00 0.69 H new ATOM 0 HG LEU A 42 6.819 3.881 -5.930 1.00 0.78 H new ATOM 0 HD11 LEU A 42 8.128 3.334 -8.068 1.00 0.93 H new ATOM 0 HD12 LEU A 42 6.664 4.279 -8.429 1.00 0.93 H new ATOM 0 HD13 LEU A 42 8.253 5.079 -8.395 1.00 0.93 H new ATOM 0 HD21 LEU A 42 9.240 3.494 -5.955 1.00 0.74 H new ATOM 0 HD22 LEU A 42 9.505 5.227 -6.261 1.00 0.74 H new ATOM 0 HD23 LEU A 42 8.755 4.697 -4.737 1.00 0.74 H new ATOM 338 N LEU A 43 6.606 8.988 -5.701 1.00 0.56 N ATOM 339 CA LEU A 43 6.024 10.256 -6.181 1.00 0.61 C ATOM 340 C LEU A 43 6.721 10.682 -7.487 1.00 0.60 C ATOM 341 O LEU A 43 7.797 10.179 -7.813 1.00 0.57 O ATOM 342 CB LEU A 43 6.181 11.371 -5.124 1.00 0.81 C ATOM 343 CG LEU A 43 5.312 11.256 -3.857 1.00 0.70 C ATOM 344 CD1 LEU A 43 5.535 12.497 -2.994 1.00 1.44 C ATOM 345 CD2 LEU A 43 3.815 11.205 -4.160 1.00 0.99 C ATOM 0 H LEU A 43 7.603 8.935 -5.908 1.00 0.56 H new ATOM 0 HA LEU A 43 4.961 10.100 -6.363 1.00 0.61 H new ATOM 0 HB2 LEU A 43 7.226 11.403 -4.817 1.00 0.81 H new ATOM 0 HB3 LEU A 43 5.960 12.325 -5.602 1.00 0.81 H new ATOM 0 HG LEU A 43 5.605 10.330 -3.362 1.00 0.70 H new ATOM 0 HD11 LEU A 43 4.925 12.428 -2.093 1.00 1.44 H new ATOM 0 HD12 LEU A 43 6.587 12.563 -2.716 1.00 1.44 H new ATOM 0 HD13 LEU A 43 5.252 13.387 -3.556 1.00 1.44 H new ATOM 0 HD21 LEU A 43 3.257 11.124 -3.227 1.00 0.99 H new ATOM 0 HD22 LEU A 43 3.518 12.115 -4.682 1.00 0.99 H new ATOM 0 HD23 LEU A 43 3.600 10.340 -4.787 1.00 0.99 H new ATOM 357 N ALA A 44 6.136 11.627 -8.224 1.00 0.76 N ATOM 358 CA ALA A 44 6.802 12.270 -9.360 1.00 0.74 C ATOM 359 C ALA A 44 7.667 13.469 -8.926 1.00 0.76 C ATOM 360 O ALA A 44 7.516 13.973 -7.810 1.00 0.80 O ATOM 361 CB ALA A 44 5.740 12.676 -10.378 1.00 0.77 C ATOM 0 H ALA A 44 5.190 11.968 -8.052 1.00 0.76 H new ATOM 0 HA ALA A 44 7.492 11.561 -9.817 1.00 0.74 H new ATOM 0 HB1 ALA A 44 6.219 13.157 -11.231 1.00 0.77 H new ATOM 0 HB2 ALA A 44 5.202 11.790 -10.715 1.00 0.77 H new ATOM 0 HB3 ALA A 44 5.040 13.372 -9.915 1.00 0.77 H new ATOM 367 N THR A 45 8.548 13.965 -9.800 1.00 0.81 N ATOM 368 CA THR A 45 9.377 15.157 -9.528 1.00 0.85 C ATOM 369 C THR A 45 8.709 16.473 -9.940 1.00 0.84 C ATOM 370 O THR A 45 8.855 17.465 -9.222 1.00 0.89 O ATOM 371 CB THR A 45 10.774 15.035 -10.157 1.00 0.92 C ATOM 372 OG1 THR A 45 10.688 14.872 -11.555 1.00 0.97 O ATOM 373 CG2 THR A 45 11.562 13.855 -9.583 1.00 1.02 C ATOM 0 H THR A 45 8.711 13.555 -10.720 1.00 0.81 H new ATOM 0 HA THR A 45 9.488 15.192 -8.444 1.00 0.85 H new ATOM 0 HB THR A 45 11.296 15.962 -9.919 1.00 0.92 H new ATOM 0 HG1 THR A 45 11.590 14.798 -11.932 1.00 0.97 H new ATOM 0 HG21 THR A 45 12.543 13.808 -10.057 1.00 1.02 H new ATOM 0 HG22 THR A 45 11.684 13.988 -8.508 1.00 1.02 H new ATOM 0 HG23 THR A 45 11.021 12.928 -9.775 1.00 1.02 H new ATOM 381 N ASP A 46 7.946 16.504 -11.041 1.00 0.85 N ATOM 382 CA ASP A 46 7.151 17.669 -11.478 1.00 0.89 C ATOM 383 C ASP A 46 5.790 17.240 -12.071 1.00 1.02 C ATOM 384 O ASP A 46 5.417 17.620 -13.185 1.00 1.34 O ATOM 385 CB ASP A 46 7.981 18.575 -12.413 1.00 0.99 C ATOM 386 CG ASP A 46 7.343 19.955 -12.634 1.00 1.21 C ATOM 387 OD1 ASP A 46 6.827 20.565 -11.664 1.00 2.11 O ATOM 388 OD2 ASP A 46 7.401 20.481 -13.774 1.00 2.06 O ATOM 0 H ASP A 46 7.860 15.705 -11.669 1.00 0.85 H new ATOM 0 HA ASP A 46 6.905 18.273 -10.605 1.00 0.89 H new ATOM 0 HB2 ASP A 46 8.978 18.705 -11.993 1.00 0.99 H new ATOM 0 HB3 ASP A 46 8.103 18.079 -13.376 1.00 0.99 H new ATOM 393 N GLY A 47 5.061 16.395 -11.331 1.00 0.96 N ATOM 394 CA GLY A 47 3.688 15.975 -11.653 1.00 1.05 C ATOM 395 C GLY A 47 3.538 14.837 -12.672 1.00 0.99 C ATOM 396 O GLY A 47 2.448 14.596 -13.192 1.00 1.13 O ATOM 0 H GLY A 47 5.416 15.974 -10.472 1.00 0.96 H new ATOM 0 HA2 GLY A 47 3.199 15.670 -10.728 1.00 1.05 H new ATOM 0 HA3 GLY A 47 3.146 16.843 -12.029 1.00 1.05 H new ATOM 400 N ASP A 48 4.618 14.119 -12.962 1.00 0.84 N ATOM 401 CA ASP A 48 4.716 13.021 -13.937 1.00 0.77 C ATOM 402 C ASP A 48 3.996 11.708 -13.542 1.00 0.68 C ATOM 403 O ASP A 48 4.251 10.662 -14.142 1.00 0.70 O ATOM 404 CB ASP A 48 6.205 12.754 -14.239 1.00 0.78 C ATOM 405 CG ASP A 48 6.998 14.046 -14.472 1.00 0.99 C ATOM 406 OD1 ASP A 48 7.418 14.694 -13.486 1.00 1.47 O ATOM 407 OD2 ASP A 48 7.186 14.434 -15.650 1.00 2.40 O ATOM 0 H ASP A 48 5.509 14.294 -12.497 1.00 0.84 H new ATOM 0 HA ASP A 48 4.182 13.359 -14.825 1.00 0.77 H new ATOM 0 HB2 ASP A 48 6.648 12.204 -13.408 1.00 0.78 H new ATOM 0 HB3 ASP A 48 6.285 12.118 -15.121 1.00 0.78 H new ATOM 412 N MET A 49 3.088 11.706 -12.552 1.00 0.64 N ATOM 413 CA MET A 49 2.426 10.463 -12.118 1.00 0.65 C ATOM 414 C MET A 49 1.611 9.800 -13.235 1.00 0.69 C ATOM 415 O MET A 49 1.504 8.580 -13.244 1.00 0.73 O ATOM 416 CB MET A 49 1.530 10.671 -10.885 1.00 0.64 C ATOM 417 CG MET A 49 2.272 10.986 -9.582 1.00 0.61 C ATOM 418 SD MET A 49 2.781 9.589 -8.530 1.00 0.77 S ATOM 419 CE MET A 49 4.027 8.750 -9.525 1.00 0.75 C ATOM 0 H MET A 49 2.798 12.540 -12.042 1.00 0.64 H new ATOM 0 HA MET A 49 3.242 9.793 -11.846 1.00 0.65 H new ATOM 0 HB2 MET A 49 0.836 11.485 -11.094 1.00 0.64 H new ATOM 0 HB3 MET A 49 0.932 9.772 -10.735 1.00 0.64 H new ATOM 0 HG2 MET A 49 3.166 11.556 -9.836 1.00 0.61 H new ATOM 0 HG3 MET A 49 1.636 11.640 -8.985 1.00 0.61 H new ATOM 0 HE1 MET A 49 4.554 8.021 -8.909 1.00 0.75 H new ATOM 0 HE2 MET A 49 3.544 8.240 -10.358 1.00 0.75 H new ATOM 0 HE3 MET A 49 4.738 9.481 -9.910 1.00 0.75 H new ATOM 429 N ASP A 50 1.097 10.558 -14.208 1.00 0.71 N ATOM 430 CA ASP A 50 0.315 10.021 -15.332 1.00 0.77 C ATOM 431 C ASP A 50 1.149 9.139 -16.286 1.00 0.75 C ATOM 432 O ASP A 50 0.658 8.108 -16.763 1.00 0.95 O ATOM 433 CB ASP A 50 -0.332 11.175 -16.113 1.00 0.85 C ATOM 434 CG ASP A 50 -1.194 12.092 -15.244 1.00 1.15 C ATOM 435 OD1 ASP A 50 -0.652 13.089 -14.710 1.00 2.15 O ATOM 436 OD2 ASP A 50 -2.419 11.844 -15.109 1.00 2.05 O ATOM 0 H ASP A 50 1.211 11.571 -14.240 1.00 0.71 H new ATOM 0 HA ASP A 50 -0.454 9.377 -14.904 1.00 0.77 H new ATOM 0 HB2 ASP A 50 0.451 11.767 -16.586 1.00 0.85 H new ATOM 0 HB3 ASP A 50 -0.947 10.762 -16.913 1.00 0.85 H new ATOM 441 N LYS A 51 2.416 9.486 -16.566 1.00 0.62 N ATOM 442 CA LYS A 51 3.324 8.646 -17.355 1.00 0.67 C ATOM 443 C LYS A 51 3.972 7.540 -16.523 1.00 0.64 C ATOM 444 O LYS A 51 4.004 6.411 -17.009 1.00 0.70 O ATOM 445 CB LYS A 51 4.287 9.512 -18.170 1.00 0.77 C ATOM 446 CG LYS A 51 5.222 10.389 -17.333 1.00 0.79 C ATOM 447 CD LYS A 51 5.837 11.519 -18.161 1.00 0.98 C ATOM 448 CE LYS A 51 6.785 10.968 -19.220 1.00 2.11 C ATOM 449 NZ LYS A 51 7.456 12.052 -19.971 1.00 2.45 N ATOM 0 H LYS A 51 2.838 10.359 -16.250 1.00 0.62 H new ATOM 0 HA LYS A 51 2.742 8.091 -18.091 1.00 0.67 H new ATOM 0 HB2 LYS A 51 4.891 8.862 -18.804 1.00 0.77 H new ATOM 0 HB3 LYS A 51 3.706 10.153 -18.833 1.00 0.77 H new ATOM 0 HG2 LYS A 51 4.669 10.813 -16.495 1.00 0.79 H new ATOM 0 HG3 LYS A 51 6.017 9.773 -16.912 1.00 0.79 H new ATOM 0 HD2 LYS A 51 5.046 12.095 -18.641 1.00 0.98 H new ATOM 0 HD3 LYS A 51 6.376 12.203 -17.505 1.00 0.98 H new ATOM 0 HE2 LYS A 51 7.535 10.337 -18.744 1.00 2.11 H new ATOM 0 HE3 LYS A 51 6.229 10.336 -19.912 1.00 2.11 H new ATOM 0 HZ1 LYS A 51 8.093 11.639 -20.682 1.00 2.45 H new ATOM 0 HZ2 LYS A 51 6.741 12.639 -20.446 1.00 2.45 H new ATOM 0 HZ3 LYS A 51 8.007 12.640 -19.314 1.00 2.45 H new ATOM 463 N ILE A 52 4.359 7.790 -15.264 1.00 0.58 N ATOM 464 CA ILE A 52 4.756 6.742 -14.307 1.00 0.57 C ATOM 465 C ILE A 52 3.650 5.674 -14.174 1.00 0.61 C ATOM 466 O ILE A 52 3.931 4.489 -14.310 1.00 0.69 O ATOM 467 CB ILE A 52 5.122 7.361 -12.936 1.00 0.52 C ATOM 468 CG1 ILE A 52 6.338 8.308 -13.085 1.00 0.55 C ATOM 469 CG2 ILE A 52 5.425 6.251 -11.906 1.00 0.50 C ATOM 470 CD1 ILE A 52 6.744 9.091 -11.840 1.00 0.54 C ATOM 0 H ILE A 52 4.406 8.732 -14.876 1.00 0.58 H new ATOM 0 HA ILE A 52 5.647 6.244 -14.690 1.00 0.57 H new ATOM 0 HB ILE A 52 4.271 7.940 -12.577 1.00 0.52 H new ATOM 0 HG12 ILE A 52 7.194 7.717 -13.411 1.00 0.55 H new ATOM 0 HG13 ILE A 52 6.121 9.020 -13.881 1.00 0.55 H new ATOM 0 HG21 ILE A 52 5.680 6.704 -10.948 1.00 0.50 H new ATOM 0 HG22 ILE A 52 4.547 5.617 -11.785 1.00 0.50 H new ATOM 0 HG23 ILE A 52 6.262 5.648 -12.257 1.00 0.50 H new ATOM 0 HD11 ILE A 52 7.606 9.718 -12.069 1.00 0.54 H new ATOM 0 HD12 ILE A 52 5.914 9.720 -11.519 1.00 0.54 H new ATOM 0 HD13 ILE A 52 7.003 8.396 -11.041 1.00 0.54 H new ATOM 482 N ALA A 53 2.380 6.048 -13.992 1.00 0.63 N ATOM 483 CA ALA A 53 1.262 5.100 -13.897 1.00 0.74 C ATOM 484 C ALA A 53 1.112 4.234 -15.163 1.00 0.83 C ATOM 485 O ALA A 53 0.806 3.044 -15.057 1.00 0.92 O ATOM 486 CB ALA A 53 -0.025 5.884 -13.608 1.00 0.79 C ATOM 0 H ALA A 53 2.095 7.024 -13.906 1.00 0.63 H new ATOM 0 HA ALA A 53 1.466 4.406 -13.082 1.00 0.74 H new ATOM 0 HB1 ALA A 53 -0.864 5.192 -13.535 1.00 0.79 H new ATOM 0 HB2 ALA A 53 0.082 6.425 -12.668 1.00 0.79 H new ATOM 0 HB3 ALA A 53 -0.209 6.593 -14.416 1.00 0.79 H new ATOM 492 N ASN A 54 1.397 4.805 -16.338 1.00 0.84 N ATOM 493 CA ASN A 54 1.464 4.085 -17.611 1.00 0.93 C ATOM 494 C ASN A 54 2.701 3.162 -17.712 1.00 0.98 C ATOM 495 O ASN A 54 2.595 2.068 -18.267 1.00 1.13 O ATOM 496 CB ASN A 54 1.394 5.106 -18.761 1.00 0.89 C ATOM 497 CG ASN A 54 -0.022 5.451 -19.188 1.00 0.92 C ATOM 498 OD1 ASN A 54 -0.502 5.004 -20.220 1.00 0.98 O ATOM 499 ND2 ASN A 54 -0.736 6.252 -18.438 1.00 0.97 N ATOM 0 H ASN A 54 1.591 5.802 -16.431 1.00 0.84 H new ATOM 0 HA ASN A 54 0.610 3.412 -17.680 1.00 0.93 H new ATOM 0 HB2 ASN A 54 1.904 6.019 -18.455 1.00 0.89 H new ATOM 0 HB3 ASN A 54 1.936 4.710 -19.620 1.00 0.89 H new ATOM 0 HD21 ASN A 54 -1.686 6.499 -18.716 1.00 0.97 H new ATOM 0 HD22 ASN A 54 -0.343 6.629 -17.576 1.00 0.97 H new ATOM 506 N GLU A 55 3.854 3.543 -17.141 1.00 0.90 N ATOM 507 CA GLU A 55 5.033 2.663 -17.013 1.00 0.98 C ATOM 508 C GLU A 55 4.750 1.437 -16.132 1.00 1.07 C ATOM 509 O GLU A 55 5.254 0.349 -16.417 1.00 1.32 O ATOM 510 CB GLU A 55 6.247 3.403 -16.429 1.00 0.97 C ATOM 511 CG GLU A 55 6.848 4.484 -17.331 1.00 0.93 C ATOM 512 CD GLU A 55 7.286 3.938 -18.688 1.00 1.03 C ATOM 513 OE1 GLU A 55 8.292 3.186 -18.754 1.00 2.05 O ATOM 514 OE2 GLU A 55 6.625 4.243 -19.707 1.00 1.85 O ATOM 0 H GLU A 55 3.999 4.475 -16.752 1.00 0.90 H new ATOM 0 HA GLU A 55 5.259 2.336 -18.028 1.00 0.98 H new ATOM 0 HB2 GLU A 55 5.953 3.862 -15.485 1.00 0.97 H new ATOM 0 HB3 GLU A 55 7.022 2.672 -16.200 1.00 0.97 H new ATOM 0 HG2 GLU A 55 6.114 5.276 -17.482 1.00 0.93 H new ATOM 0 HG3 GLU A 55 7.705 4.935 -16.831 1.00 0.93 H new ATOM 521 N LEU A 56 3.942 1.598 -15.075 1.00 0.92 N ATOM 522 CA LEU A 56 3.612 0.505 -14.159 1.00 0.96 C ATOM 523 C LEU A 56 2.486 -0.397 -14.677 1.00 1.06 C ATOM 524 O LEU A 56 2.583 -1.614 -14.540 1.00 1.13 O ATOM 525 CB LEU A 56 3.280 1.035 -12.753 1.00 0.91 C ATOM 526 CG LEU A 56 4.317 1.965 -12.090 1.00 0.87 C ATOM 527 CD1 LEU A 56 4.001 2.068 -10.605 1.00 0.85 C ATOM 528 CD2 LEU A 56 5.777 1.532 -12.226 1.00 0.82 C ATOM 0 H LEU A 56 3.502 2.486 -14.834 1.00 0.92 H new ATOM 0 HA LEU A 56 4.506 -0.115 -14.097 1.00 0.96 H new ATOM 0 HB2 LEU A 56 2.332 1.570 -12.808 1.00 0.91 H new ATOM 0 HB3 LEU A 56 3.125 0.179 -12.097 1.00 0.91 H new ATOM 0 HG LEU A 56 4.230 2.914 -12.620 1.00 0.87 H new ATOM 0 HD11 LEU A 56 4.727 2.723 -10.123 1.00 0.85 H new ATOM 0 HD12 LEU A 56 2.999 2.477 -10.474 1.00 0.85 H new ATOM 0 HD13 LEU A 56 4.050 1.077 -10.153 1.00 0.85 H new ATOM 0 HD21 LEU A 56 6.419 2.256 -11.725 1.00 0.82 H new ATOM 0 HD22 LEU A 56 5.910 0.551 -11.769 1.00 0.82 H new ATOM 0 HD23 LEU A 56 6.044 1.480 -13.281 1.00 0.82 H new ATOM 540 N GLU A 57 1.423 0.153 -15.276 1.00 1.11 N ATOM 541 CA GLU A 57 0.255 -0.643 -15.705 1.00 1.27 C ATOM 542 C GLU A 57 0.563 -1.601 -16.876 1.00 1.39 C ATOM 543 O GLU A 57 -0.074 -2.653 -17.001 1.00 1.50 O ATOM 544 CB GLU A 57 -0.957 0.270 -15.997 1.00 1.32 C ATOM 545 CG GLU A 57 -0.892 0.963 -17.364 1.00 1.33 C ATOM 546 CD GLU A 57 -1.936 2.073 -17.579 1.00 2.04 C ATOM 547 OE1 GLU A 57 -2.804 2.333 -16.702 1.00 3.34 O ATOM 548 OE2 GLU A 57 -1.879 2.696 -18.667 1.00 2.42 O ATOM 0 H GLU A 57 1.343 1.150 -15.477 1.00 1.11 H new ATOM 0 HA GLU A 57 -0.007 -1.291 -14.869 1.00 1.27 H new ATOM 0 HB2 GLU A 57 -1.869 -0.324 -15.944 1.00 1.32 H new ATOM 0 HB3 GLU A 57 -1.025 1.029 -15.218 1.00 1.32 H new ATOM 0 HG2 GLU A 57 0.103 1.390 -17.491 1.00 1.33 H new ATOM 0 HG3 GLU A 57 -1.018 0.211 -18.143 1.00 1.33 H new ATOM 555 N THR A 58 1.573 -1.278 -17.696 1.00 1.40 N ATOM 556 CA THR A 58 2.064 -2.143 -18.786 1.00 1.55 C ATOM 557 C THR A 58 2.969 -3.289 -18.287 1.00 1.44 C ATOM 558 O THR A 58 3.182 -4.268 -19.008 1.00 1.52 O ATOM 559 CB THR A 58 2.735 -1.277 -19.872 1.00 1.71 C ATOM 560 OG1 THR A 58 2.735 -1.932 -21.117 1.00 2.09 O ATOM 561 CG2 THR A 58 4.173 -0.881 -19.555 1.00 1.57 C ATOM 0 H THR A 58 2.081 -0.397 -17.622 1.00 1.40 H new ATOM 0 HA THR A 58 1.207 -2.647 -19.232 1.00 1.55 H new ATOM 0 HB THR A 58 2.133 -0.369 -19.904 1.00 1.71 H new ATOM 0 HG1 THR A 58 3.165 -1.361 -21.787 1.00 2.09 H new ATOM 0 HG21 THR A 58 4.571 -0.274 -20.368 1.00 1.57 H new ATOM 0 HG22 THR A 58 4.197 -0.307 -18.629 1.00 1.57 H new ATOM 0 HG23 THR A 58 4.781 -1.779 -19.441 1.00 1.57 H new ATOM 569 N GLY A 59 3.475 -3.184 -17.047 1.00 1.32 N ATOM 570 CA GLY A 59 4.302 -4.171 -16.339 1.00 1.22 C ATOM 571 C GLY A 59 3.492 -5.213 -15.546 1.00 1.14 C ATOM 572 O GLY A 59 2.317 -5.005 -15.226 1.00 1.18 O ATOM 0 H GLY A 59 3.306 -2.355 -16.478 1.00 1.32 H new ATOM 0 HA2 GLY A 59 4.931 -4.689 -17.063 1.00 1.22 H new ATOM 0 HA3 GLY A 59 4.969 -3.647 -15.655 1.00 1.22 H new ATOM 576 N ASN A 60 4.123 -6.324 -15.154 1.00 1.07 N ATOM 577 CA ASN A 60 3.554 -7.350 -14.255 1.00 0.98 C ATOM 578 C ASN A 60 3.828 -7.046 -12.768 1.00 0.79 C ATOM 579 O ASN A 60 4.034 -7.946 -11.945 1.00 0.78 O ATOM 580 CB ASN A 60 3.981 -8.768 -14.671 1.00 1.13 C ATOM 581 CG ASN A 60 3.624 -9.077 -16.113 1.00 1.57 C ATOM 582 OD1 ASN A 60 2.510 -9.478 -16.424 1.00 2.32 O ATOM 583 ND2 ASN A 60 4.511 -8.852 -17.044 1.00 2.07 N ATOM 0 H ASN A 60 5.071 -6.547 -15.458 1.00 1.07 H new ATOM 0 HA ASN A 60 2.470 -7.311 -14.365 1.00 0.98 H new ATOM 0 HB2 ASN A 60 5.057 -8.876 -14.534 1.00 1.13 H new ATOM 0 HB3 ASN A 60 3.502 -9.496 -14.016 1.00 1.13 H new ATOM 0 HD21 ASN A 60 4.274 -9.010 -18.023 1.00 2.07 H new ATOM 0 HD22 ASN A 60 5.441 -8.518 -16.792 1.00 2.07 H new ATOM 590 N TYR A 61 3.854 -5.764 -12.405 1.00 0.73 N ATOM 591 CA TYR A 61 4.138 -5.310 -11.044 1.00 0.64 C ATOM 592 C TYR A 61 2.973 -5.547 -10.062 1.00 0.66 C ATOM 593 O TYR A 61 3.090 -5.269 -8.867 1.00 0.73 O ATOM 594 CB TYR A 61 4.613 -3.856 -11.070 1.00 0.62 C ATOM 595 CG TYR A 61 5.715 -3.489 -12.054 1.00 0.63 C ATOM 596 CD1 TYR A 61 6.757 -4.384 -12.371 1.00 1.82 C ATOM 597 CD2 TYR A 61 5.712 -2.202 -12.621 1.00 1.98 C ATOM 598 CE1 TYR A 61 7.787 -3.984 -13.242 1.00 1.77 C ATOM 599 CE2 TYR A 61 6.758 -1.787 -13.468 1.00 2.07 C ATOM 600 CZ TYR A 61 7.812 -2.676 -13.765 1.00 0.75 C ATOM 601 OH TYR A 61 8.892 -2.275 -14.483 1.00 0.84 O ATOM 0 H TYR A 61 3.676 -5.001 -13.058 1.00 0.73 H new ATOM 0 HA TYR A 61 4.947 -5.926 -10.651 1.00 0.64 H new ATOM 0 HB2 TYR A 61 3.750 -3.225 -11.282 1.00 0.62 H new ATOM 0 HB3 TYR A 61 4.958 -3.598 -10.069 1.00 0.62 H new ATOM 0 HD1 TYR A 61 6.765 -5.377 -11.945 1.00 1.82 H new ATOM 0 HD2 TYR A 61 4.899 -1.525 -12.405 1.00 1.98 H new ATOM 0 HE1 TYR A 61 8.564 -4.684 -13.512 1.00 1.77 H new ATOM 0 HE2 TYR A 61 6.753 -0.792 -13.888 1.00 2.07 H new ATOM 0 HH TYR A 61 8.763 -1.349 -14.778 1.00 0.84 H new ATOM 611 N ALA A 62 1.861 -6.125 -10.529 1.00 0.72 N ATOM 612 CA ALA A 62 0.806 -6.647 -9.661 1.00 0.77 C ATOM 613 C ALA A 62 1.373 -7.699 -8.678 1.00 0.72 C ATOM 614 O ALA A 62 0.891 -7.793 -7.547 1.00 0.80 O ATOM 615 CB ALA A 62 -0.298 -7.238 -10.546 1.00 0.92 C ATOM 0 H ALA A 62 1.669 -6.243 -11.524 1.00 0.72 H new ATOM 0 HA ALA A 62 0.389 -5.844 -9.054 1.00 0.77 H new ATOM 0 HB1 ALA A 62 -1.096 -7.633 -9.917 1.00 0.92 H new ATOM 0 HB2 ALA A 62 -0.700 -6.460 -11.195 1.00 0.92 H new ATOM 0 HB3 ALA A 62 0.115 -8.041 -11.156 1.00 0.92 H new ATOM 621 N GLY A 63 2.429 -8.428 -9.081 1.00 0.66 N ATOM 622 CA GLY A 63 3.217 -9.295 -8.190 1.00 0.63 C ATOM 623 C GLY A 63 4.646 -8.785 -7.959 1.00 0.53 C ATOM 624 O GLY A 63 5.114 -8.682 -6.826 1.00 0.54 O ATOM 0 H GLY A 63 2.762 -8.431 -10.045 1.00 0.66 H new ATOM 0 HA2 GLY A 63 2.708 -9.377 -7.230 1.00 0.63 H new ATOM 0 HA3 GLY A 63 3.260 -10.298 -8.615 1.00 0.63 H new ATOM 628 N ASN A 64 5.343 -8.461 -9.051 1.00 0.79 N ATOM 629 CA ASN A 64 6.780 -8.163 -9.065 1.00 0.87 C ATOM 630 C ASN A 64 7.145 -6.776 -8.512 1.00 0.71 C ATOM 631 O ASN A 64 6.338 -5.843 -8.544 1.00 0.86 O ATOM 632 CB ASN A 64 7.270 -8.259 -10.520 1.00 1.64 C ATOM 633 CG ASN A 64 7.207 -9.637 -11.097 1.00 1.42 C ATOM 634 OD1 ASN A 64 8.102 -10.448 -10.909 1.00 2.44 O ATOM 635 ND2 ASN A 64 6.184 -9.923 -11.847 1.00 1.88 N ATOM 0 H ASN A 64 4.914 -8.397 -9.974 1.00 0.79 H new ATOM 0 HA ASN A 64 7.262 -8.888 -8.409 1.00 0.87 H new ATOM 0 HB2 ASN A 64 6.671 -7.590 -11.138 1.00 1.64 H new ATOM 0 HB3 ASN A 64 8.299 -7.903 -10.570 1.00 1.64 H new ATOM 0 HD21 ASN A 64 6.118 -10.839 -12.291 1.00 1.88 H new ATOM 0 HD22 ASN A 64 5.448 -9.232 -11.991 1.00 1.88 H new ATOM 642 N LYS A 65 8.403 -6.601 -8.084 1.00 0.63 N ATOM 643 CA LYS A 65 8.958 -5.259 -7.829 1.00 0.58 C ATOM 644 C LYS A 65 9.160 -4.508 -9.149 1.00 0.58 C ATOM 645 O LYS A 65 9.247 -5.117 -10.217 1.00 0.71 O ATOM 646 CB LYS A 65 10.234 -5.302 -6.967 1.00 0.63 C ATOM 647 CG LYS A 65 11.439 -6.097 -7.508 1.00 1.08 C ATOM 648 CD LYS A 65 12.427 -5.319 -8.392 1.00 2.13 C ATOM 649 CE LYS A 65 13.134 -4.191 -7.621 1.00 1.86 C ATOM 650 NZ LYS A 65 13.985 -3.366 -8.510 1.00 3.42 N ATOM 0 H LYS A 65 9.055 -7.366 -7.907 1.00 0.63 H new ATOM 0 HA LYS A 65 8.231 -4.702 -7.238 1.00 0.58 H new ATOM 0 HB2 LYS A 65 10.559 -4.275 -6.797 1.00 0.63 H new ATOM 0 HB3 LYS A 65 9.968 -5.717 -5.995 1.00 0.63 H new ATOM 0 HG2 LYS A 65 11.988 -6.506 -6.660 1.00 1.08 H new ATOM 0 HG3 LYS A 65 11.061 -6.944 -8.081 1.00 1.08 H new ATOM 0 HD2 LYS A 65 13.173 -6.006 -8.792 1.00 2.13 H new ATOM 0 HD3 LYS A 65 11.894 -4.896 -9.244 1.00 2.13 H new ATOM 0 HE2 LYS A 65 12.389 -3.557 -7.140 1.00 1.86 H new ATOM 0 HE3 LYS A 65 13.746 -4.621 -6.828 1.00 1.86 H new ATOM 0 HZ1 LYS A 65 14.444 -2.617 -7.954 1.00 3.42 H new ATOM 0 HZ2 LYS A 65 14.712 -3.966 -8.950 1.00 3.42 H new ATOM 0 HZ3 LYS A 65 13.397 -2.935 -9.252 1.00 3.42 H new ATOM 664 N VAL A 66 9.253 -3.184 -9.071 1.00 0.53 N ATOM 665 CA VAL A 66 9.460 -2.335 -10.264 1.00 0.54 C ATOM 666 C VAL A 66 10.852 -2.584 -10.858 1.00 0.65 C ATOM 667 O VAL A 66 11.851 -2.508 -10.140 1.00 0.76 O ATOM 668 CB VAL A 66 9.233 -0.839 -9.975 1.00 0.55 C ATOM 669 CG1 VAL A 66 9.544 0.032 -11.200 1.00 0.65 C ATOM 670 CG2 VAL A 66 7.765 -0.589 -9.618 1.00 0.49 C ATOM 0 H VAL A 66 9.189 -2.664 -8.196 1.00 0.53 H new ATOM 0 HA VAL A 66 8.708 -2.620 -11.000 1.00 0.54 H new ATOM 0 HB VAL A 66 9.898 -0.576 -9.152 1.00 0.55 H new ATOM 0 HG11 VAL A 66 9.371 1.080 -10.955 1.00 0.65 H new ATOM 0 HG12 VAL A 66 10.586 -0.106 -11.490 1.00 0.65 H new ATOM 0 HG13 VAL A 66 8.896 -0.259 -12.027 1.00 0.65 H new ATOM 0 HG21 VAL A 66 7.615 0.472 -9.416 1.00 0.49 H new ATOM 0 HG22 VAL A 66 7.131 -0.892 -10.451 1.00 0.49 H new ATOM 0 HG23 VAL A 66 7.502 -1.168 -8.733 1.00 0.49 H new ATOM 680 N GLY A 67 10.939 -2.886 -12.157 1.00 0.74 N ATOM 681 CA GLY A 67 12.211 -3.212 -12.815 1.00 0.87 C ATOM 682 C GLY A 67 13.127 -1.997 -12.996 1.00 0.83 C ATOM 683 O GLY A 67 14.304 -2.028 -12.621 1.00 0.91 O ATOM 0 H GLY A 67 10.133 -2.912 -12.782 1.00 0.74 H new ATOM 0 HA2 GLY A 67 12.733 -3.968 -12.228 1.00 0.87 H new ATOM 0 HA3 GLY A 67 12.005 -3.652 -13.791 1.00 0.87 H new ATOM 687 N VAL A 68 12.570 -0.902 -13.523 1.00 0.87 N ATOM 688 CA VAL A 68 13.279 0.359 -13.797 1.00 1.01 C ATOM 689 C VAL A 68 12.418 1.551 -13.372 1.00 0.79 C ATOM 690 O VAL A 68 11.260 1.651 -13.782 1.00 0.79 O ATOM 691 CB VAL A 68 13.659 0.468 -15.294 1.00 1.45 C ATOM 692 CG1 VAL A 68 14.411 1.768 -15.604 1.00 1.74 C ATOM 693 CG2 VAL A 68 14.558 -0.691 -15.752 1.00 2.06 C ATOM 0 H VAL A 68 11.584 -0.864 -13.780 1.00 0.87 H new ATOM 0 HA VAL A 68 14.201 0.367 -13.216 1.00 1.01 H new ATOM 0 HB VAL A 68 12.709 0.442 -15.828 1.00 1.45 H new ATOM 0 HG11 VAL A 68 14.657 1.802 -16.665 1.00 1.74 H new ATOM 0 HG12 VAL A 68 13.782 2.621 -15.350 1.00 1.74 H new ATOM 0 HG13 VAL A 68 15.329 1.806 -15.017 1.00 1.74 H new ATOM 0 HG21 VAL A 68 14.797 -0.570 -16.809 1.00 2.06 H new ATOM 0 HG22 VAL A 68 15.479 -0.690 -15.169 1.00 2.06 H new ATOM 0 HG23 VAL A 68 14.036 -1.637 -15.604 1.00 2.06 H new ATOM 703 N LEU A 69 12.975 2.460 -12.567 1.00 0.79 N ATOM 704 CA LEU A 69 12.369 3.755 -12.263 1.00 0.69 C ATOM 705 C LEU A 69 12.736 4.790 -13.341 1.00 0.75 C ATOM 706 O LEU A 69 13.873 4.799 -13.824 1.00 0.95 O ATOM 707 CB LEU A 69 12.814 4.265 -10.879 1.00 0.86 C ATOM 708 CG LEU A 69 12.276 3.455 -9.691 1.00 0.89 C ATOM 709 CD1 LEU A 69 12.782 4.054 -8.377 1.00 1.14 C ATOM 710 CD2 LEU A 69 10.751 3.443 -9.638 1.00 0.78 C ATOM 0 H LEU A 69 13.871 2.313 -12.103 1.00 0.79 H new ATOM 0 HA LEU A 69 11.287 3.620 -12.251 1.00 0.69 H new ATOM 0 HB2 LEU A 69 13.903 4.262 -10.839 1.00 0.86 H new ATOM 0 HB3 LEU A 69 12.494 5.301 -10.769 1.00 0.86 H new ATOM 0 HG LEU A 69 12.633 2.434 -9.825 1.00 0.89 H new ATOM 0 HD11 LEU A 69 12.395 3.473 -7.540 1.00 1.14 H new ATOM 0 HD12 LEU A 69 13.872 4.031 -8.362 1.00 1.14 H new ATOM 0 HD13 LEU A 69 12.440 5.085 -8.292 1.00 1.14 H new ATOM 0 HD21 LEU A 69 10.421 2.857 -8.780 1.00 0.78 H new ATOM 0 HD22 LEU A 69 10.382 4.464 -9.543 1.00 0.78 H new ATOM 0 HD23 LEU A 69 10.359 2.999 -10.553 1.00 0.78 H new ATOM 722 N PRO A 70 11.815 5.701 -13.694 1.00 0.63 N ATOM 723 CA PRO A 70 12.125 6.817 -14.580 1.00 0.67 C ATOM 724 C PRO A 70 12.942 7.906 -13.868 1.00 0.72 C ATOM 725 O PRO A 70 12.949 8.006 -12.638 1.00 0.70 O ATOM 726 CB PRO A 70 10.763 7.322 -15.044 1.00 0.60 C ATOM 727 CG PRO A 70 9.813 6.993 -13.909 1.00 0.50 C ATOM 728 CD PRO A 70 10.426 5.754 -13.254 1.00 0.50 C ATOM 0 HA PRO A 70 12.753 6.516 -15.419 1.00 0.67 H new ATOM 0 HB2 PRO A 70 10.786 8.394 -15.241 1.00 0.60 H new ATOM 0 HB3 PRO A 70 10.456 6.834 -15.969 1.00 0.60 H new ATOM 0 HG2 PRO A 70 9.735 7.820 -13.203 1.00 0.50 H new ATOM 0 HG3 PRO A 70 8.807 6.792 -14.277 1.00 0.50 H new ATOM 0 HD2 PRO A 70 10.365 5.818 -12.168 1.00 0.50 H new ATOM 0 HD3 PRO A 70 9.890 4.852 -13.550 1.00 0.50 H new ATOM 736 N ALA A 71 13.583 8.787 -14.638 1.00 0.82 N ATOM 737 CA ALA A 71 14.271 9.970 -14.109 1.00 0.92 C ATOM 738 C ALA A 71 13.298 10.996 -13.485 1.00 0.90 C ATOM 739 O ALA A 71 13.709 11.824 -12.671 1.00 1.08 O ATOM 740 CB ALA A 71 15.103 10.591 -15.237 1.00 1.05 C ATOM 0 H ALA A 71 13.641 8.701 -15.653 1.00 0.82 H new ATOM 0 HA ALA A 71 14.925 9.661 -13.294 1.00 0.92 H new ATOM 0 HB1 ALA A 71 15.623 11.473 -14.863 1.00 1.05 H new ATOM 0 HB2 ALA A 71 15.833 9.864 -15.594 1.00 1.05 H new ATOM 0 HB3 ALA A 71 14.446 10.878 -16.058 1.00 1.05 H new ATOM 746 N ASN A 72 12.007 10.917 -13.829 1.00 0.79 N ATOM 747 CA ASN A 72 10.920 11.720 -13.260 1.00 0.80 C ATOM 748 C ASN A 72 10.278 11.137 -11.978 1.00 0.65 C ATOM 749 O ASN A 72 9.378 11.762 -11.417 1.00 0.71 O ATOM 750 CB ASN A 72 9.907 12.050 -14.372 1.00 0.87 C ATOM 751 CG ASN A 72 9.191 10.845 -14.960 1.00 0.85 C ATOM 752 OD1 ASN A 72 8.951 9.860 -14.293 1.00 1.94 O ATOM 753 ND2 ASN A 72 8.849 10.859 -16.225 1.00 1.71 N ATOM 0 H ASN A 72 11.678 10.265 -14.541 1.00 0.79 H new ATOM 0 HA ASN A 72 11.354 12.649 -12.891 1.00 0.80 H new ATOM 0 HB2 ASN A 72 9.162 12.739 -13.973 1.00 0.87 H new ATOM 0 HB3 ASN A 72 10.427 12.573 -15.174 1.00 0.87 H new ATOM 0 HD21 ASN A 72 8.387 10.048 -16.637 1.00 1.71 H new ATOM 0 HD22 ASN A 72 9.045 11.680 -16.797 1.00 1.71 H new ATOM 760 N ALA A 73 10.740 9.980 -11.488 1.00 0.54 N ATOM 761 CA ALA A 73 10.280 9.357 -10.237 1.00 0.51 C ATOM 762 C ALA A 73 11.202 9.614 -9.015 1.00 0.56 C ATOM 763 O ALA A 73 12.432 9.678 -9.128 1.00 0.57 O ATOM 764 CB ALA A 73 10.069 7.862 -10.497 1.00 0.49 C ATOM 0 H ALA A 73 11.462 9.436 -11.961 1.00 0.54 H new ATOM 0 HA ALA A 73 9.340 9.830 -9.953 1.00 0.51 H new ATOM 0 HB1 ALA A 73 9.727 7.378 -9.582 1.00 0.49 H new ATOM 0 HB2 ALA A 73 9.320 7.731 -11.278 1.00 0.49 H new ATOM 0 HB3 ALA A 73 11.009 7.412 -10.816 1.00 0.49 H new ATOM 770 N LYS A 74 10.598 9.721 -7.822 1.00 0.65 N ATOM 771 CA LYS A 74 11.208 9.977 -6.506 1.00 0.88 C ATOM 772 C LYS A 74 10.714 8.974 -5.447 1.00 0.75 C ATOM 773 O LYS A 74 9.572 8.521 -5.514 1.00 0.62 O ATOM 774 CB LYS A 74 10.882 11.446 -6.167 1.00 1.26 C ATOM 775 CG LYS A 74 10.853 11.807 -4.673 1.00 0.92 C ATOM 776 CD LYS A 74 10.641 13.315 -4.490 1.00 1.08 C ATOM 777 CE LYS A 74 9.255 13.824 -4.916 1.00 1.63 C ATOM 778 NZ LYS A 74 9.196 15.309 -4.919 1.00 2.49 N ATOM 0 H LYS A 74 9.586 9.623 -7.745 1.00 0.65 H new ATOM 0 HA LYS A 74 12.288 9.832 -6.522 1.00 0.88 H new ATOM 0 HB2 LYS A 74 11.617 12.083 -6.659 1.00 1.26 H new ATOM 0 HB3 LYS A 74 9.911 11.690 -6.597 1.00 1.26 H new ATOM 0 HG2 LYS A 74 10.053 11.258 -4.175 1.00 0.92 H new ATOM 0 HG3 LYS A 74 11.788 11.505 -4.201 1.00 0.92 H new ATOM 0 HD2 LYS A 74 10.799 13.566 -3.441 1.00 1.08 H new ATOM 0 HD3 LYS A 74 11.401 13.847 -5.063 1.00 1.08 H new ATOM 0 HE2 LYS A 74 9.018 13.448 -5.911 1.00 1.63 H new ATOM 0 HE3 LYS A 74 8.498 13.430 -4.238 1.00 1.63 H new ATOM 0 HZ1 LYS A 74 8.247 15.618 -5.211 1.00 2.49 H new ATOM 0 HZ2 LYS A 74 9.398 15.666 -3.963 1.00 2.49 H new ATOM 0 HZ3 LYS A 74 9.902 15.683 -5.585 1.00 2.49 H new ATOM 792 N GLU A 75 11.564 8.653 -4.464 1.00 0.88 N ATOM 793 CA GLU A 75 11.318 7.641 -3.416 1.00 0.91 C ATOM 794 C GLU A 75 11.437 8.221 -1.987 1.00 0.89 C ATOM 795 O GLU A 75 12.392 8.944 -1.683 1.00 0.95 O ATOM 796 CB GLU A 75 12.323 6.478 -3.552 1.00 1.16 C ATOM 797 CG GLU A 75 12.402 5.785 -4.920 1.00 1.14 C ATOM 798 CD GLU A 75 13.510 4.720 -4.909 1.00 1.14 C ATOM 799 OE1 GLU A 75 13.231 3.563 -4.513 1.00 1.66 O ATOM 800 OE2 GLU A 75 14.676 5.009 -5.278 1.00 2.26 O ATOM 0 H GLU A 75 12.474 9.103 -4.368 1.00 0.88 H new ATOM 0 HA GLU A 75 10.296 7.291 -3.560 1.00 0.91 H new ATOM 0 HB2 GLU A 75 13.315 6.856 -3.305 1.00 1.16 H new ATOM 0 HB3 GLU A 75 12.074 5.725 -2.804 1.00 1.16 H new ATOM 0 HG2 GLU A 75 11.444 5.322 -5.158 1.00 1.14 H new ATOM 0 HG3 GLU A 75 12.602 6.521 -5.698 1.00 1.14 H new ATOM 807 N ILE A 76 10.522 7.852 -1.080 1.00 0.84 N ATOM 808 CA ILE A 76 10.448 8.348 0.316 1.00 0.79 C ATOM 809 C ILE A 76 10.058 7.237 1.306 1.00 0.76 C ATOM 810 O ILE A 76 9.287 6.351 0.951 1.00 0.86 O ATOM 811 CB ILE A 76 9.439 9.523 0.447 1.00 0.71 C ATOM 812 CG1 ILE A 76 8.036 9.147 -0.100 1.00 0.73 C ATOM 813 CG2 ILE A 76 9.996 10.812 -0.185 1.00 0.73 C ATOM 814 CD1 ILE A 76 7.009 10.282 -0.092 1.00 0.76 C ATOM 0 H ILE A 76 9.787 7.179 -1.297 1.00 0.84 H new ATOM 0 HA ILE A 76 11.449 8.701 0.566 1.00 0.79 H new ATOM 0 HB ILE A 76 9.305 9.725 1.510 1.00 0.71 H new ATOM 0 HG12 ILE A 76 8.147 8.786 -1.122 1.00 0.73 H new ATOM 0 HG13 ILE A 76 7.643 8.319 0.490 1.00 0.73 H new ATOM 0 HG21 ILE A 76 9.267 11.615 -0.077 1.00 0.73 H new ATOM 0 HG22 ILE A 76 10.922 11.093 0.317 1.00 0.73 H new ATOM 0 HG23 ILE A 76 10.194 10.642 -1.243 1.00 0.73 H new ATOM 0 HD11 ILE A 76 6.063 9.919 -0.493 1.00 0.76 H new ATOM 0 HD12 ILE A 76 6.860 10.631 0.930 1.00 0.76 H new ATOM 0 HD13 ILE A 76 7.372 11.105 -0.707 1.00 0.76 H new ATOM 826 N ALA A 77 10.529 7.304 2.557 1.00 0.67 N ATOM 827 CA ALA A 77 10.089 6.463 3.685 1.00 0.62 C ATOM 828 C ALA A 77 9.256 7.269 4.708 1.00 0.58 C ATOM 829 O ALA A 77 9.214 8.500 4.651 1.00 0.66 O ATOM 830 CB ALA A 77 11.301 5.772 4.336 1.00 0.60 C ATOM 0 H ALA A 77 11.254 7.969 2.825 1.00 0.67 H new ATOM 0 HA ALA A 77 9.429 5.686 3.299 1.00 0.62 H new ATOM 0 HB1 ALA A 77 10.964 5.154 5.168 1.00 0.60 H new ATOM 0 HB2 ALA A 77 11.802 5.146 3.598 1.00 0.60 H new ATOM 0 HB3 ALA A 77 11.996 6.527 4.704 1.00 0.60 H new ATOM 836 N GLY A 78 8.617 6.590 5.665 1.00 0.57 N ATOM 837 CA GLY A 78 7.871 7.212 6.765 1.00 0.58 C ATOM 838 C GLY A 78 6.417 7.582 6.451 1.00 0.60 C ATOM 839 O GLY A 78 5.851 8.433 7.138 1.00 0.68 O ATOM 0 H GLY A 78 8.603 5.571 5.698 1.00 0.57 H new ATOM 0 HA2 GLY A 78 7.878 6.531 7.616 1.00 0.58 H new ATOM 0 HA3 GLY A 78 8.399 8.114 7.074 1.00 0.58 H new ATOM 843 N VAL A 79 5.810 6.967 5.431 1.00 0.60 N ATOM 844 CA VAL A 79 4.359 7.040 5.159 1.00 0.57 C ATOM 845 C VAL A 79 3.632 5.933 5.929 1.00 0.39 C ATOM 846 O VAL A 79 4.203 4.869 6.162 1.00 0.34 O ATOM 847 CB VAL A 79 4.065 6.983 3.642 1.00 0.72 C ATOM 848 CG1 VAL A 79 4.466 5.660 2.986 1.00 1.01 C ATOM 849 CG2 VAL A 79 2.595 7.261 3.331 1.00 0.57 C ATOM 0 H VAL A 79 6.316 6.393 4.756 1.00 0.60 H new ATOM 0 HA VAL A 79 3.982 8.001 5.509 1.00 0.57 H new ATOM 0 HB VAL A 79 4.687 7.771 3.217 1.00 0.72 H new ATOM 0 HG11 VAL A 79 4.229 5.695 1.923 1.00 1.01 H new ATOM 0 HG12 VAL A 79 5.536 5.500 3.115 1.00 1.01 H new ATOM 0 HG13 VAL A 79 3.918 4.842 3.453 1.00 1.01 H new ATOM 0 HG21 VAL A 79 2.435 7.211 2.254 1.00 0.57 H new ATOM 0 HG22 VAL A 79 1.971 6.516 3.826 1.00 0.57 H new ATOM 0 HG23 VAL A 79 2.329 8.255 3.691 1.00 0.57 H new ATOM 859 N MET A 80 2.380 6.183 6.320 1.00 0.44 N ATOM 860 CA MET A 80 1.501 5.219 6.986 1.00 0.38 C ATOM 861 C MET A 80 0.383 4.721 6.062 1.00 0.35 C ATOM 862 O MET A 80 -0.268 5.510 5.374 1.00 0.41 O ATOM 863 CB MET A 80 0.934 5.862 8.259 1.00 0.46 C ATOM 864 CG MET A 80 -0.058 4.958 9.002 1.00 0.45 C ATOM 865 SD MET A 80 0.594 3.330 9.464 1.00 0.50 S ATOM 866 CE MET A 80 0.188 3.335 11.225 1.00 0.54 C ATOM 0 H MET A 80 1.936 7.090 6.177 1.00 0.44 H new ATOM 0 HA MET A 80 2.085 4.338 7.253 1.00 0.38 H new ATOM 0 HB2 MET A 80 1.757 6.115 8.928 1.00 0.46 H new ATOM 0 HB3 MET A 80 0.438 6.796 7.996 1.00 0.46 H new ATOM 0 HG2 MET A 80 -0.389 5.471 9.905 1.00 0.45 H new ATOM 0 HG3 MET A 80 -0.938 4.816 8.375 1.00 0.45 H new ATOM 0 HE1 MET A 80 0.519 2.400 11.677 1.00 0.54 H new ATOM 0 HE2 MET A 80 0.689 4.172 11.712 1.00 0.54 H new ATOM 0 HE3 MET A 80 -0.890 3.436 11.350 1.00 0.54 H new ATOM 876 N PHE A 81 0.110 3.417 6.102 1.00 0.31 N ATOM 877 CA PHE A 81 -1.014 2.775 5.417 1.00 0.30 C ATOM 878 C PHE A 81 -1.664 1.665 6.259 1.00 0.33 C ATOM 879 O PHE A 81 -1.034 1.079 7.143 1.00 0.39 O ATOM 880 CB PHE A 81 -0.606 2.264 4.024 1.00 0.34 C ATOM 881 CG PHE A 81 0.855 1.942 3.847 1.00 0.37 C ATOM 882 CD1 PHE A 81 1.381 0.816 4.497 1.00 1.57 C ATOM 883 CD2 PHE A 81 1.685 2.752 3.044 1.00 1.59 C ATOM 884 CE1 PHE A 81 2.723 0.478 4.320 1.00 1.58 C ATOM 885 CE2 PHE A 81 3.014 2.361 2.812 1.00 1.75 C ATOM 886 CZ PHE A 81 3.521 1.215 3.442 1.00 0.88 C ATOM 0 H PHE A 81 0.682 2.757 6.628 1.00 0.31 H new ATOM 0 HA PHE A 81 -1.775 3.543 5.280 1.00 0.30 H new ATOM 0 HB2 PHE A 81 -1.186 1.368 3.802 1.00 0.34 H new ATOM 0 HB3 PHE A 81 -0.885 3.016 3.286 1.00 0.34 H new ATOM 0 HD1 PHE A 81 0.749 0.213 5.132 1.00 1.57 H new ATOM 0 HD2 PHE A 81 1.302 3.665 2.612 1.00 1.59 H new ATOM 0 HE1 PHE A 81 3.145 -0.355 4.863 1.00 1.58 H new ATOM 0 HE2 PHE A 81 3.643 2.940 2.152 1.00 1.75 H new ATOM 0 HZ PHE A 81 4.536 0.900 3.247 1.00 0.88 H new ATOM 896 N VAL A 82 -2.931 1.376 5.944 1.00 0.32 N ATOM 897 CA VAL A 82 -3.778 0.334 6.552 1.00 0.31 C ATOM 898 C VAL A 82 -4.267 -0.647 5.463 1.00 0.27 C ATOM 899 O VAL A 82 -4.513 -0.223 4.329 1.00 0.25 O ATOM 900 CB VAL A 82 -4.965 0.947 7.332 1.00 0.35 C ATOM 901 CG1 VAL A 82 -4.534 2.114 8.235 1.00 0.40 C ATOM 902 CG2 VAL A 82 -6.090 1.497 6.451 1.00 0.35 C ATOM 0 H VAL A 82 -3.425 1.891 5.216 1.00 0.32 H new ATOM 0 HA VAL A 82 -3.178 -0.218 7.275 1.00 0.31 H new ATOM 0 HB VAL A 82 -5.332 0.099 7.910 1.00 0.35 H new ATOM 0 HG11 VAL A 82 -5.404 2.508 8.760 1.00 0.40 H new ATOM 0 HG12 VAL A 82 -3.801 1.761 8.961 1.00 0.40 H new ATOM 0 HG13 VAL A 82 -4.090 2.901 7.625 1.00 0.40 H new ATOM 0 HG21 VAL A 82 -6.879 1.907 7.082 1.00 0.35 H new ATOM 0 HG22 VAL A 82 -5.696 2.283 5.806 1.00 0.35 H new ATOM 0 HG23 VAL A 82 -6.497 0.694 5.837 1.00 0.35 H new ATOM 912 N TRP A 83 -4.448 -1.937 5.772 1.00 0.28 N ATOM 913 CA TRP A 83 -5.114 -2.904 4.878 1.00 0.26 C ATOM 914 C TRP A 83 -6.640 -2.968 5.085 1.00 0.28 C ATOM 915 O TRP A 83 -7.168 -2.807 6.188 1.00 0.33 O ATOM 916 CB TRP A 83 -4.484 -4.304 4.992 1.00 0.25 C ATOM 917 CG TRP A 83 -3.300 -4.585 4.107 1.00 0.26 C ATOM 918 CD1 TRP A 83 -2.126 -3.916 4.112 1.00 0.30 C ATOM 919 CD2 TRP A 83 -3.127 -5.666 3.133 1.00 0.24 C ATOM 920 NE1 TRP A 83 -1.266 -4.469 3.179 1.00 0.31 N ATOM 921 CE2 TRP A 83 -1.825 -5.565 2.555 1.00 0.27 C ATOM 922 CE3 TRP A 83 -3.928 -6.747 2.704 1.00 0.23 C ATOM 923 CZ2 TRP A 83 -1.350 -6.481 1.597 1.00 0.28 C ATOM 924 CZ3 TRP A 83 -3.448 -7.691 1.777 1.00 0.24 C ATOM 925 CH2 TRP A 83 -2.160 -7.573 1.228 1.00 0.27 C ATOM 0 H TRP A 83 -4.136 -2.346 6.653 1.00 0.28 H new ATOM 0 HA TRP A 83 -4.953 -2.536 3.865 1.00 0.26 H new ATOM 0 HB2 TRP A 83 -4.179 -4.457 6.027 1.00 0.25 H new ATOM 0 HB3 TRP A 83 -5.255 -5.043 4.774 1.00 0.25 H new ATOM 0 HD1 TRP A 83 -1.893 -3.075 4.749 1.00 0.30 H new ATOM 0 HE1 TRP A 83 -0.333 -4.110 2.977 1.00 0.31 H new ATOM 0 HE3 TRP A 83 -4.929 -6.851 3.095 1.00 0.23 H new ATOM 0 HZ2 TRP A 83 -0.376 -6.348 1.150 1.00 0.28 H new ATOM 0 HZ3 TRP A 83 -4.078 -8.517 1.484 1.00 0.24 H new ATOM 0 HH2 TRP A 83 -1.795 -8.312 0.530 1.00 0.27 H new ATOM 936 N THR A 84 -7.350 -3.247 3.992 1.00 0.28 N ATOM 937 CA THR A 84 -8.810 -3.405 3.906 1.00 0.32 C ATOM 938 C THR A 84 -9.218 -4.516 2.927 1.00 0.34 C ATOM 939 O THR A 84 -8.399 -5.000 2.141 1.00 0.34 O ATOM 940 CB THR A 84 -9.490 -2.103 3.426 1.00 0.34 C ATOM 941 OG1 THR A 84 -8.968 -1.708 2.184 1.00 0.35 O ATOM 942 CG2 THR A 84 -9.364 -0.903 4.357 1.00 0.37 C ATOM 0 H THR A 84 -6.899 -3.377 3.087 1.00 0.28 H new ATOM 0 HA THR A 84 -9.135 -3.662 4.914 1.00 0.32 H new ATOM 0 HB THR A 84 -10.546 -2.370 3.382 1.00 0.34 H new ATOM 0 HG1 THR A 84 -8.068 -2.079 2.075 1.00 0.35 H new ATOM 0 HG21 THR A 84 -9.878 -0.047 3.919 1.00 0.37 H new ATOM 0 HG22 THR A 84 -9.813 -1.142 5.321 1.00 0.37 H new ATOM 0 HG23 THR A 84 -8.311 -0.661 4.498 1.00 0.37 H new ATOM 950 N ASN A 85 -10.493 -4.912 2.936 1.00 0.42 N ATOM 951 CA ASN A 85 -11.089 -5.770 1.901 1.00 0.50 C ATOM 952 C ASN A 85 -11.667 -4.970 0.718 1.00 0.55 C ATOM 953 O ASN A 85 -11.722 -3.741 0.744 1.00 0.55 O ATOM 954 CB ASN A 85 -12.088 -6.761 2.532 1.00 0.62 C ATOM 955 CG ASN A 85 -11.426 -8.041 3.012 1.00 0.65 C ATOM 956 OD1 ASN A 85 -11.671 -8.519 4.105 1.00 1.90 O ATOM 957 ND2 ASN A 85 -10.606 -8.671 2.205 1.00 0.93 N ATOM 0 H ASN A 85 -11.150 -4.645 3.669 1.00 0.42 H new ATOM 0 HA ASN A 85 -10.291 -6.364 1.455 1.00 0.50 H new ATOM 0 HB2 ASN A 85 -12.588 -6.279 3.372 1.00 0.62 H new ATOM 0 HB3 ASN A 85 -12.858 -7.008 1.801 1.00 0.62 H new ATOM 0 HD21 ASN A 85 -10.181 -9.552 2.495 1.00 0.93 H new ATOM 0 HD22 ASN A 85 -10.393 -8.280 1.287 1.00 0.93 H new ATOM 964 N THR A 86 -12.099 -5.669 -0.338 1.00 0.68 N ATOM 965 CA THR A 86 -12.639 -5.064 -1.577 1.00 0.82 C ATOM 966 C THR A 86 -13.846 -4.159 -1.335 1.00 0.85 C ATOM 967 O THR A 86 -14.016 -3.172 -2.052 1.00 0.93 O ATOM 968 CB THR A 86 -13.019 -6.136 -2.615 1.00 1.02 C ATOM 969 OG1 THR A 86 -13.818 -7.153 -2.056 1.00 1.49 O ATOM 970 CG2 THR A 86 -11.772 -6.793 -3.178 1.00 1.50 C ATOM 0 H THR A 86 -12.086 -6.689 -0.363 1.00 0.68 H new ATOM 0 HA THR A 86 -11.829 -4.446 -1.964 1.00 0.82 H new ATOM 0 HB THR A 86 -13.579 -5.624 -3.397 1.00 1.02 H new ATOM 0 HG1 THR A 86 -14.039 -7.812 -2.747 1.00 1.49 H new ATOM 0 HG21 THR A 86 -12.058 -7.548 -3.910 1.00 1.50 H new ATOM 0 HG22 THR A 86 -11.149 -6.039 -3.659 1.00 1.50 H new ATOM 0 HG23 THR A 86 -11.213 -7.264 -2.370 1.00 1.50 H new ATOM 978 N ASN A 87 -14.614 -4.426 -0.277 1.00 0.85 N ATOM 979 CA ASN A 87 -15.722 -3.574 0.192 1.00 0.93 C ATOM 980 C ASN A 87 -15.293 -2.505 1.228 1.00 0.73 C ATOM 981 O ASN A 87 -16.113 -2.021 2.011 1.00 0.80 O ATOM 982 CB ASN A 87 -16.907 -4.444 0.653 1.00 1.29 C ATOM 983 CG ASN A 87 -17.587 -5.230 -0.461 1.00 1.84 C ATOM 984 OD1 ASN A 87 -17.179 -5.254 -1.614 1.00 2.38 O ATOM 985 ND2 ASN A 87 -18.682 -5.879 -0.152 1.00 2.33 N ATOM 0 H ASN A 87 -14.484 -5.260 0.295 1.00 0.85 H new ATOM 0 HA ASN A 87 -16.061 -2.982 -0.658 1.00 0.93 H new ATOM 0 HB2 ASN A 87 -16.554 -5.144 1.411 1.00 1.29 H new ATOM 0 HB3 ASN A 87 -17.647 -3.803 1.132 1.00 1.29 H new ATOM 0 HD21 ASN A 87 -19.187 -6.399 -0.870 1.00 2.33 H new ATOM 0 HD22 ASN A 87 -19.030 -5.865 0.807 1.00 2.33 H new ATOM 992 N ASN A 88 -14.013 -2.117 1.230 1.00 0.57 N ATOM 993 CA ASN A 88 -13.406 -1.027 2.014 1.00 0.49 C ATOM 994 C ASN A 88 -13.534 -1.171 3.549 1.00 0.54 C ATOM 995 O ASN A 88 -13.548 -0.169 4.265 1.00 0.58 O ATOM 996 CB ASN A 88 -13.838 0.369 1.495 1.00 0.49 C ATOM 997 CG ASN A 88 -14.356 0.407 0.067 1.00 0.49 C ATOM 998 OD1 ASN A 88 -15.553 0.336 -0.175 1.00 0.59 O ATOM 999 ND2 ASN A 88 -13.496 0.481 -0.918 1.00 0.45 N ATOM 0 H ASN A 88 -13.323 -2.587 0.644 1.00 0.57 H new ATOM 0 HA ASN A 88 -12.334 -1.120 1.840 1.00 0.49 H new ATOM 0 HB2 ASN A 88 -14.614 0.758 2.154 1.00 0.49 H new ATOM 0 HB3 ASN A 88 -12.986 1.045 1.572 1.00 0.49 H new ATOM 0 HD21 ASN A 88 -13.825 0.479 -1.883 1.00 0.45 H new ATOM 0 HD22 ASN A 88 -12.497 0.540 -0.720 1.00 0.45 H new ATOM 1006 N GLU A 89 -13.678 -2.396 4.066 1.00 0.54 N ATOM 1007 CA GLU A 89 -13.717 -2.678 5.513 1.00 0.56 C ATOM 1008 C GLU A 89 -12.291 -2.771 6.053 1.00 0.46 C ATOM 1009 O GLU A 89 -11.454 -3.405 5.411 1.00 0.40 O ATOM 1010 CB GLU A 89 -14.417 -4.026 5.811 1.00 0.60 C ATOM 1011 CG GLU A 89 -15.906 -3.864 6.137 1.00 0.72 C ATOM 1012 CD GLU A 89 -16.499 -5.072 6.879 1.00 1.04 C ATOM 1013 OE1 GLU A 89 -16.703 -6.161 6.288 1.00 1.94 O ATOM 1014 OE2 GLU A 89 -16.794 -4.896 8.088 1.00 1.83 O ATOM 0 H GLU A 89 -13.772 -3.232 3.489 1.00 0.54 H new ATOM 0 HA GLU A 89 -14.272 -1.869 5.988 1.00 0.56 H new ATOM 0 HB2 GLU A 89 -14.308 -4.685 4.949 1.00 0.60 H new ATOM 0 HB3 GLU A 89 -13.917 -4.512 6.649 1.00 0.60 H new ATOM 0 HG2 GLU A 89 -16.043 -2.970 6.745 1.00 0.72 H new ATOM 0 HG3 GLU A 89 -16.459 -3.708 5.211 1.00 0.72 H new ATOM 1021 N ILE A 90 -12.023 -2.222 7.243 1.00 0.48 N ATOM 1022 CA ILE A 90 -10.717 -2.369 7.891 1.00 0.45 C ATOM 1023 C ILE A 90 -10.587 -3.767 8.479 1.00 0.44 C ATOM 1024 O ILE A 90 -11.445 -4.214 9.246 1.00 0.50 O ATOM 1025 CB ILE A 90 -10.420 -1.312 8.968 1.00 0.49 C ATOM 1026 CG1 ILE A 90 -10.782 0.096 8.475 1.00 0.50 C ATOM 1027 CG2 ILE A 90 -8.921 -1.393 9.325 1.00 0.49 C ATOM 1028 CD1 ILE A 90 -10.458 1.177 9.501 1.00 0.57 C ATOM 0 H ILE A 90 -12.695 -1.671 7.777 1.00 0.48 H new ATOM 0 HA ILE A 90 -9.974 -2.210 7.110 1.00 0.45 H new ATOM 0 HB ILE A 90 -11.027 -1.510 9.852 1.00 0.49 H new ATOM 0 HG12 ILE A 90 -10.242 0.304 7.551 1.00 0.50 H new ATOM 0 HG13 ILE A 90 -11.845 0.132 8.238 1.00 0.50 H new ATOM 0 HG21 ILE A 90 -8.688 -0.651 10.088 1.00 0.49 H new ATOM 0 HG22 ILE A 90 -8.691 -2.388 9.705 1.00 0.49 H new ATOM 0 HG23 ILE A 90 -8.324 -1.197 8.434 1.00 0.49 H new ATOM 0 HD11 ILE A 90 -10.734 2.153 9.101 1.00 0.57 H new ATOM 0 HD12 ILE A 90 -11.018 0.989 10.417 1.00 0.57 H new ATOM 0 HD13 ILE A 90 -9.390 1.163 9.719 1.00 0.57 H new ATOM 1040 N ILE A 91 -9.483 -4.422 8.137 1.00 0.37 N ATOM 1041 CA ILE A 91 -9.163 -5.776 8.583 1.00 0.36 C ATOM 1042 C ILE A 91 -7.835 -5.902 9.341 1.00 0.36 C ATOM 1043 O ILE A 91 -6.912 -5.092 9.225 1.00 0.36 O ATOM 1044 CB ILE A 91 -9.273 -6.788 7.426 1.00 0.35 C ATOM 1045 CG1 ILE A 91 -8.214 -6.588 6.324 1.00 0.34 C ATOM 1046 CG2 ILE A 91 -10.649 -6.697 6.778 1.00 0.41 C ATOM 1047 CD1 ILE A 91 -7.862 -7.903 5.630 1.00 0.63 C ATOM 0 H ILE A 91 -8.770 -4.019 7.529 1.00 0.37 H new ATOM 0 HA ILE A 91 -9.922 -6.024 9.325 1.00 0.36 H new ATOM 0 HB ILE A 91 -9.106 -7.766 7.876 1.00 0.35 H new ATOM 0 HG12 ILE A 91 -8.586 -5.876 5.587 1.00 0.34 H new ATOM 0 HG13 ILE A 91 -7.314 -6.154 6.759 1.00 0.34 H new ATOM 0 HG21 ILE A 91 -10.715 -7.417 5.962 1.00 0.41 H new ATOM 0 HG22 ILE A 91 -11.416 -6.918 7.520 1.00 0.41 H new ATOM 0 HG23 ILE A 91 -10.802 -5.691 6.388 1.00 0.41 H new ATOM 0 HD11 ILE A 91 -7.113 -7.719 4.860 1.00 0.63 H new ATOM 0 HD12 ILE A 91 -7.465 -8.606 6.362 1.00 0.63 H new ATOM 0 HD13 ILE A 91 -8.757 -8.324 5.172 1.00 0.63 H new ATOM 1059 N ASP A 92 -7.782 -6.944 10.156 1.00 0.39 N ATOM 1060 CA ASP A 92 -6.577 -7.474 10.799 1.00 0.42 C ATOM 1061 C ASP A 92 -5.876 -8.489 9.867 1.00 0.41 C ATOM 1062 O ASP A 92 -6.462 -9.002 8.914 1.00 0.40 O ATOM 1063 CB ASP A 92 -6.984 -8.070 12.162 1.00 0.46 C ATOM 1064 CG ASP A 92 -5.919 -8.980 12.776 1.00 0.68 C ATOM 1065 OD1 ASP A 92 -4.782 -8.512 13.019 1.00 1.34 O ATOM 1066 OD2 ASP A 92 -6.189 -10.192 12.923 1.00 1.66 O ATOM 0 H ASP A 92 -8.618 -7.474 10.403 1.00 0.39 H new ATOM 0 HA ASP A 92 -5.846 -6.687 10.982 1.00 0.42 H new ATOM 0 HB2 ASP A 92 -7.198 -7.257 12.855 1.00 0.46 H new ATOM 0 HB3 ASP A 92 -7.907 -8.636 12.040 1.00 0.46 H new ATOM 1071 N GLU A 93 -4.618 -8.817 10.161 1.00 0.43 N ATOM 1072 CA GLU A 93 -3.748 -9.710 9.378 1.00 0.42 C ATOM 1073 C GLU A 93 -4.192 -11.190 9.328 1.00 0.42 C ATOM 1074 O GLU A 93 -3.508 -12.004 8.709 1.00 0.56 O ATOM 1075 CB GLU A 93 -2.302 -9.549 9.878 1.00 0.55 C ATOM 1076 CG GLU A 93 -2.054 -10.144 11.276 1.00 0.69 C ATOM 1077 CD GLU A 93 -0.965 -9.382 12.036 1.00 1.41 C ATOM 1078 OE1 GLU A 93 0.092 -9.046 11.451 1.00 2.03 O ATOM 1079 OE2 GLU A 93 -1.165 -9.067 13.235 1.00 2.65 O ATOM 0 H GLU A 93 -4.150 -8.452 10.991 1.00 0.43 H new ATOM 0 HA GLU A 93 -3.826 -9.399 8.336 1.00 0.42 H new ATOM 0 HB2 GLU A 93 -1.627 -10.025 9.167 1.00 0.55 H new ATOM 0 HB3 GLU A 93 -2.050 -8.489 9.896 1.00 0.55 H new ATOM 0 HG2 GLU A 93 -2.981 -10.121 11.850 1.00 0.69 H new ATOM 0 HG3 GLU A 93 -1.765 -11.190 11.179 1.00 0.69 H new ATOM 1086 N ASN A 94 -5.333 -11.528 9.947 1.00 0.52 N ATOM 1087 CA ASN A 94 -6.056 -12.803 9.864 1.00 0.56 C ATOM 1088 C ASN A 94 -7.364 -12.715 9.031 1.00 0.54 C ATOM 1089 O ASN A 94 -8.182 -13.643 9.016 1.00 0.63 O ATOM 1090 CB ASN A 94 -6.352 -13.276 11.294 1.00 0.76 C ATOM 1091 CG ASN A 94 -5.124 -13.515 12.146 1.00 1.54 C ATOM 1092 OD1 ASN A 94 -4.571 -14.603 12.187 1.00 3.21 O ATOM 1093 ND2 ASN A 94 -4.689 -12.529 12.889 1.00 1.38 N ATOM 0 H ASN A 94 -5.808 -10.868 10.563 1.00 0.52 H new ATOM 0 HA ASN A 94 -5.425 -13.520 9.339 1.00 0.56 H new ATOM 0 HB2 ASN A 94 -6.980 -12.533 11.786 1.00 0.76 H new ATOM 0 HB3 ASN A 94 -6.929 -14.199 11.245 1.00 0.76 H new ATOM 0 HD21 ASN A 94 -3.887 -12.669 13.503 1.00 1.38 H new ATOM 0 HD22 ASN A 94 -5.152 -11.621 12.853 1.00 1.38 H new ATOM 1100 N GLY A 95 -7.642 -11.565 8.403 1.00 0.55 N ATOM 1101 CA GLY A 95 -8.869 -11.306 7.639 1.00 0.59 C ATOM 1102 C GLY A 95 -10.104 -11.052 8.510 1.00 0.62 C ATOM 1103 O GLY A 95 -11.211 -10.926 7.984 1.00 0.68 O ATOM 0 H GLY A 95 -7.004 -10.769 8.413 1.00 0.55 H new ATOM 0 HA2 GLY A 95 -8.708 -10.442 6.994 1.00 0.59 H new ATOM 0 HA3 GLY A 95 -9.066 -12.157 6.987 1.00 0.59 H new ATOM 1107 N GLN A 96 -9.929 -10.961 9.833 1.00 0.60 N ATOM 1108 CA GLN A 96 -10.973 -10.503 10.743 1.00 0.63 C ATOM 1109 C GLN A 96 -11.227 -9.015 10.509 1.00 0.57 C ATOM 1110 O GLN A 96 -10.295 -8.235 10.334 1.00 0.52 O ATOM 1111 CB GLN A 96 -10.589 -10.784 12.203 1.00 0.69 C ATOM 1112 CG GLN A 96 -11.646 -10.227 13.168 1.00 0.81 C ATOM 1113 CD GLN A 96 -11.514 -10.720 14.599 1.00 1.24 C ATOM 1114 OE1 GLN A 96 -10.654 -11.518 14.960 1.00 2.05 O ATOM 1115 NE2 GLN A 96 -12.397 -10.256 15.449 1.00 1.55 N ATOM 0 H GLN A 96 -9.055 -11.205 10.299 1.00 0.60 H new ATOM 0 HA GLN A 96 -11.893 -11.052 10.543 1.00 0.63 H new ATOM 0 HB2 GLN A 96 -10.483 -11.858 12.355 1.00 0.69 H new ATOM 0 HB3 GLN A 96 -9.620 -10.335 12.421 1.00 0.69 H new ATOM 0 HG2 GLN A 96 -11.585 -9.139 13.165 1.00 0.81 H new ATOM 0 HG3 GLN A 96 -12.636 -10.492 12.795 1.00 0.81 H new ATOM 0 HE21 GLN A 96 -13.107 -9.593 15.136 1.00 1.55 H new ATOM 0 HE22 GLN A 96 -12.375 -10.558 16.423 1.00 1.55 H new ATOM 1124 N THR A 97 -12.491 -8.617 10.532 1.00 0.61 N ATOM 1125 CA THR A 97 -12.930 -7.248 10.270 1.00 0.58 C ATOM 1126 C THR A 97 -13.239 -6.520 11.574 1.00 0.62 C ATOM 1127 O THR A 97 -13.804 -7.097 12.507 1.00 0.77 O ATOM 1128 CB THR A 97 -14.114 -7.227 9.304 1.00 0.65 C ATOM 1129 OG1 THR A 97 -15.211 -7.973 9.807 1.00 0.95 O ATOM 1130 CG2 THR A 97 -13.763 -7.761 7.911 1.00 0.81 C ATOM 0 H THR A 97 -13.262 -9.252 10.739 1.00 0.61 H new ATOM 0 HA THR A 97 -12.115 -6.711 9.785 1.00 0.58 H new ATOM 0 HB THR A 97 -14.387 -6.176 9.212 1.00 0.65 H new ATOM 0 HG1 THR A 97 -15.952 -7.938 9.166 1.00 0.95 H new ATOM 0 HG21 THR A 97 -14.645 -7.720 7.273 1.00 0.81 H new ATOM 0 HG22 THR A 97 -12.972 -7.151 7.476 1.00 0.81 H new ATOM 0 HG23 THR A 97 -13.422 -8.793 7.992 1.00 0.81 H new ATOM 1138 N LEU A 98 -12.852 -5.248 11.655 1.00 0.54 N ATOM 1139 CA LEU A 98 -12.840 -4.470 12.902 1.00 0.60 C ATOM 1140 C LEU A 98 -14.178 -3.776 13.230 1.00 0.73 C ATOM 1141 O LEU A 98 -14.341 -3.237 14.330 1.00 0.93 O ATOM 1142 CB LEU A 98 -11.677 -3.463 12.811 1.00 0.60 C ATOM 1143 CG LEU A 98 -10.264 -4.015 13.094 1.00 0.57 C ATOM 1144 CD1 LEU A 98 -10.071 -4.396 14.557 1.00 0.56 C ATOM 1145 CD2 LEU A 98 -9.834 -5.213 12.255 1.00 0.51 C ATOM 0 H LEU A 98 -12.532 -4.717 10.845 1.00 0.54 H new ATOM 0 HA LEU A 98 -12.695 -5.158 13.735 1.00 0.60 H new ATOM 0 HB2 LEU A 98 -11.680 -3.028 11.811 1.00 0.60 H new ATOM 0 HB3 LEU A 98 -11.873 -2.651 13.512 1.00 0.60 H new ATOM 0 HG LEU A 98 -9.633 -3.172 12.813 1.00 0.57 H new ATOM 0 HD11 LEU A 98 -9.061 -4.779 14.703 1.00 0.56 H new ATOM 0 HD12 LEU A 98 -10.221 -3.517 15.185 1.00 0.56 H new ATOM 0 HD13 LEU A 98 -10.793 -5.165 14.831 1.00 0.56 H new ATOM 0 HD21 LEU A 98 -8.826 -5.514 12.540 1.00 0.51 H new ATOM 0 HD22 LEU A 98 -10.522 -6.042 12.424 1.00 0.51 H new ATOM 0 HD23 LEU A 98 -9.846 -4.941 11.199 1.00 0.51 H new ATOM 1157 N GLY A 99 -15.121 -3.772 12.284 1.00 0.68 N ATOM 1158 CA GLY A 99 -16.389 -3.044 12.368 1.00 0.77 C ATOM 1159 C GLY A 99 -16.297 -1.600 11.862 1.00 0.81 C ATOM 1160 O GLY A 99 -17.122 -0.770 12.249 1.00 0.94 O ATOM 0 H GLY A 99 -15.020 -4.291 11.412 1.00 0.68 H new ATOM 0 HA2 GLY A 99 -17.144 -3.576 11.790 1.00 0.77 H new ATOM 0 HA3 GLY A 99 -16.727 -3.037 13.404 1.00 0.77 H new ATOM 1164 N VAL A 100 -15.297 -1.285 11.026 1.00 0.73 N ATOM 1165 CA VAL A 100 -15.018 0.056 10.488 1.00 0.73 C ATOM 1166 C VAL A 100 -14.840 -0.029 8.969 1.00 0.70 C ATOM 1167 O VAL A 100 -14.346 -1.033 8.449 1.00 0.70 O ATOM 1168 CB VAL A 100 -13.777 0.687 11.166 1.00 0.74 C ATOM 1169 CG1 VAL A 100 -13.497 2.133 10.717 1.00 1.08 C ATOM 1170 CG2 VAL A 100 -13.913 0.723 12.697 1.00 1.25 C ATOM 0 H VAL A 100 -14.634 -1.985 10.693 1.00 0.73 H new ATOM 0 HA VAL A 100 -15.865 0.706 10.707 1.00 0.73 H new ATOM 0 HB VAL A 100 -12.954 0.042 10.857 1.00 0.74 H new ATOM 0 HG11 VAL A 100 -12.614 2.510 11.233 1.00 1.08 H new ATOM 0 HG12 VAL A 100 -13.325 2.153 9.641 1.00 1.08 H new ATOM 0 HG13 VAL A 100 -14.354 2.762 10.959 1.00 1.08 H new ATOM 0 HG21 VAL A 100 -13.020 1.173 13.131 1.00 1.25 H new ATOM 0 HG22 VAL A 100 -14.787 1.314 12.971 1.00 1.25 H new ATOM 0 HG23 VAL A 100 -14.028 -0.292 13.076 1.00 1.25 H new ATOM 1180 N ASN A 101 -15.223 1.030 8.260 1.00 0.70 N ATOM 1181 CA ASN A 101 -15.040 1.222 6.824 1.00 0.60 C ATOM 1182 C ASN A 101 -14.366 2.568 6.509 1.00 0.56 C ATOM 1183 O ASN A 101 -14.394 3.502 7.319 1.00 0.62 O ATOM 1184 CB ASN A 101 -16.416 1.121 6.152 1.00 0.73 C ATOM 1185 CG ASN A 101 -16.845 -0.287 5.834 1.00 2.32 C ATOM 1186 OD1 ASN A 101 -17.586 -0.941 6.555 1.00 4.18 O ATOM 1187 ND2 ASN A 101 -16.396 -0.801 4.725 1.00 2.13 N ATOM 0 H ASN A 101 -15.696 1.821 8.697 1.00 0.70 H new ATOM 0 HA ASN A 101 -14.375 0.450 6.436 1.00 0.60 H new ATOM 0 HB2 ASN A 101 -17.161 1.577 6.804 1.00 0.73 H new ATOM 0 HB3 ASN A 101 -16.401 1.702 5.230 1.00 0.73 H new ATOM 0 HD21 ASN A 101 -16.662 -1.749 4.458 1.00 2.13 H new ATOM 0 HD22 ASN A 101 -15.778 -0.256 4.124 1.00 2.13 H new ATOM 1194 N ILE A 102 -13.773 2.664 5.314 1.00 0.51 N ATOM 1195 CA ILE A 102 -13.043 3.847 4.826 1.00 0.49 C ATOM 1196 C ILE A 102 -13.504 4.222 3.403 1.00 0.50 C ATOM 1197 O ILE A 102 -13.469 3.388 2.500 1.00 0.57 O ATOM 1198 CB ILE A 102 -11.509 3.617 4.896 1.00 0.43 C ATOM 1199 CG1 ILE A 102 -11.027 3.260 6.324 1.00 0.41 C ATOM 1200 CG2 ILE A 102 -10.804 4.896 4.423 1.00 0.44 C ATOM 1201 CD1 ILE A 102 -9.550 2.834 6.401 1.00 0.38 C ATOM 0 H ILE A 102 -13.786 1.901 4.638 1.00 0.51 H new ATOM 0 HA ILE A 102 -13.274 4.690 5.477 1.00 0.49 H new ATOM 0 HB ILE A 102 -11.264 2.770 4.255 1.00 0.43 H new ATOM 0 HG12 ILE A 102 -11.180 4.122 6.973 1.00 0.41 H new ATOM 0 HG13 ILE A 102 -11.647 2.453 6.714 1.00 0.41 H new ATOM 0 HG21 ILE A 102 -9.724 4.753 4.465 1.00 0.44 H new ATOM 0 HG22 ILE A 102 -11.101 5.117 3.398 1.00 0.44 H new ATOM 0 HG23 ILE A 102 -11.086 5.727 5.070 1.00 0.44 H new ATOM 0 HD11 ILE A 102 -9.292 2.601 7.434 1.00 0.38 H new ATOM 0 HD12 ILE A 102 -9.393 1.952 5.780 1.00 0.38 H new ATOM 0 HD13 ILE A 102 -8.918 3.647 6.043 1.00 0.38 H new ATOM 1213 N ASP A 103 -13.886 5.485 3.173 1.00 0.58 N ATOM 1214 CA ASP A 103 -14.234 5.977 1.826 1.00 0.58 C ATOM 1215 C ASP A 103 -12.995 5.989 0.901 1.00 0.51 C ATOM 1216 O ASP A 103 -11.948 6.474 1.341 1.00 0.51 O ATOM 1217 CB ASP A 103 -14.783 7.409 1.895 1.00 0.67 C ATOM 1218 CG ASP A 103 -15.753 7.704 0.759 1.00 0.83 C ATOM 1219 OD1 ASP A 103 -15.249 8.039 -0.337 1.00 1.60 O ATOM 1220 OD2 ASP A 103 -16.988 7.580 0.949 1.00 1.85 O ATOM 0 H ASP A 103 -13.963 6.191 3.905 1.00 0.58 H new ATOM 0 HA ASP A 103 -14.990 5.301 1.426 1.00 0.58 H new ATOM 0 HB2 ASP A 103 -15.287 7.558 2.850 1.00 0.67 H new ATOM 0 HB3 ASP A 103 -13.955 8.117 1.858 1.00 0.67 H new ATOM 1225 N PRO A 104 -13.050 5.556 -0.379 1.00 0.52 N ATOM 1226 CA PRO A 104 -11.868 5.601 -1.247 1.00 0.51 C ATOM 1227 C PRO A 104 -11.466 7.034 -1.631 1.00 0.56 C ATOM 1228 O PRO A 104 -10.316 7.264 -2.003 1.00 0.62 O ATOM 1229 CB PRO A 104 -12.217 4.724 -2.451 1.00 0.51 C ATOM 1230 CG PRO A 104 -13.735 4.817 -2.552 1.00 0.60 C ATOM 1231 CD PRO A 104 -14.217 5.098 -1.128 1.00 0.57 C ATOM 0 HA PRO A 104 -10.982 5.224 -0.736 1.00 0.51 H new ATOM 0 HB2 PRO A 104 -11.734 5.084 -3.360 1.00 0.51 H new ATOM 0 HB3 PRO A 104 -11.890 3.695 -2.303 1.00 0.51 H new ATOM 0 HG2 PRO A 104 -14.036 5.613 -3.233 1.00 0.60 H new ATOM 0 HG3 PRO A 104 -14.161 3.890 -2.936 1.00 0.60 H new ATOM 0 HD2 PRO A 104 -15.001 5.855 -1.126 1.00 0.57 H new ATOM 0 HD3 PRO A 104 -14.640 4.200 -0.677 1.00 0.57 H new ATOM 1239 N GLN A 105 -12.392 7.990 -1.522 1.00 0.61 N ATOM 1240 CA GLN A 105 -12.215 9.387 -1.921 1.00 0.67 C ATOM 1241 C GLN A 105 -11.821 10.290 -0.744 1.00 0.71 C ATOM 1242 O GLN A 105 -10.924 11.124 -0.865 1.00 0.78 O ATOM 1243 CB GLN A 105 -13.526 9.872 -2.549 1.00 0.72 C ATOM 1244 CG GLN A 105 -14.032 8.964 -3.668 1.00 0.70 C ATOM 1245 CD GLN A 105 -13.041 8.809 -4.812 1.00 0.72 C ATOM 1246 OE1 GLN A 105 -12.774 9.725 -5.582 1.00 1.12 O ATOM 1247 NE2 GLN A 105 -12.417 7.662 -4.931 1.00 0.78 N ATOM 0 H GLN A 105 -13.319 7.805 -1.139 1.00 0.61 H new ATOM 0 HA GLN A 105 -11.396 9.444 -2.638 1.00 0.67 H new ATOM 0 HB2 GLN A 105 -14.289 9.941 -1.773 1.00 0.72 H new ATOM 0 HB3 GLN A 105 -13.381 10.878 -2.944 1.00 0.72 H new ATOM 0 HG2 GLN A 105 -14.256 7.981 -3.255 1.00 0.70 H new ATOM 0 HG3 GLN A 105 -14.967 9.366 -4.058 1.00 0.70 H new ATOM 0 HE21 GLN A 105 -12.634 6.895 -4.294 1.00 0.78 H new ATOM 0 HE22 GLN A 105 -11.715 7.537 -5.660 1.00 0.78 H new ATOM 1256 N THR A 106 -12.486 10.105 0.402 1.00 0.71 N ATOM 1257 CA THR A 106 -12.275 10.913 1.623 1.00 0.78 C ATOM 1258 C THR A 106 -11.139 10.378 2.492 1.00 0.72 C ATOM 1259 O THR A 106 -10.542 11.133 3.262 1.00 0.78 O ATOM 1260 CB THR A 106 -13.563 11.027 2.469 1.00 0.87 C ATOM 1261 OG1 THR A 106 -13.774 9.900 3.286 1.00 0.83 O ATOM 1262 CG2 THR A 106 -14.795 11.243 1.596 1.00 0.89 C ATOM 0 H THR A 106 -13.197 9.382 0.516 1.00 0.71 H new ATOM 0 HA THR A 106 -11.995 11.906 1.272 1.00 0.78 H new ATOM 0 HB THR A 106 -13.416 11.897 3.109 1.00 0.87 H new ATOM 0 HG1 THR A 106 -14.598 10.020 3.802 1.00 0.83 H new ATOM 0 HG21 THR A 106 -15.680 11.318 2.228 1.00 0.89 H new ATOM 0 HG22 THR A 106 -14.679 12.163 1.024 1.00 0.89 H new ATOM 0 HG23 THR A 106 -14.908 10.402 0.912 1.00 0.89 H new ATOM 1270 N PHE A 107 -10.847 9.074 2.385 1.00 0.62 N ATOM 1271 CA PHE A 107 -9.923 8.333 3.261 1.00 0.58 C ATOM 1272 C PHE A 107 -10.243 8.497 4.771 1.00 0.62 C ATOM 1273 O PHE A 107 -9.367 8.336 5.627 1.00 0.63 O ATOM 1274 CB PHE A 107 -8.452 8.645 2.893 1.00 0.59 C ATOM 1275 CG PHE A 107 -7.798 7.929 1.714 1.00 0.48 C ATOM 1276 CD1 PHE A 107 -8.454 6.994 0.883 1.00 1.64 C ATOM 1277 CD2 PHE A 107 -6.427 8.167 1.502 1.00 1.51 C ATOM 1278 CE1 PHE A 107 -7.727 6.268 -0.068 1.00 1.63 C ATOM 1279 CE2 PHE A 107 -5.713 7.477 0.510 1.00 1.52 C ATOM 1280 CZ PHE A 107 -6.358 6.504 -0.264 1.00 0.50 C ATOM 0 H PHE A 107 -11.261 8.485 1.662 1.00 0.62 H new ATOM 0 HA PHE A 107 -10.076 7.270 3.077 1.00 0.58 H new ATOM 0 HB2 PHE A 107 -8.385 9.716 2.701 1.00 0.59 H new ATOM 0 HB3 PHE A 107 -7.845 8.440 3.775 1.00 0.59 H new ATOM 0 HD1 PHE A 107 -9.518 6.839 0.981 1.00 1.64 H new ATOM 0 HD2 PHE A 107 -5.915 8.894 2.114 1.00 1.51 H new ATOM 0 HE1 PHE A 107 -8.227 5.515 -0.659 1.00 1.63 H new ATOM 0 HE2 PHE A 107 -4.669 7.696 0.344 1.00 1.52 H new ATOM 0 HZ PHE A 107 -5.807 5.942 -1.004 1.00 0.50 H new ATOM 1290 N LYS A 108 -11.500 8.813 5.122 1.00 0.69 N ATOM 1291 CA LYS A 108 -11.938 9.043 6.511 1.00 0.73 C ATOM 1292 C LYS A 108 -12.700 7.834 7.070 1.00 0.65 C ATOM 1293 O LYS A 108 -13.232 7.011 6.319 1.00 0.63 O ATOM 1294 CB LYS A 108 -12.657 10.405 6.617 1.00 0.85 C ATOM 1295 CG LYS A 108 -14.186 10.351 6.472 1.00 0.92 C ATOM 1296 CD LYS A 108 -14.884 10.496 7.834 1.00 1.25 C ATOM 1297 CE LYS A 108 -16.355 10.085 7.794 1.00 1.48 C ATOM 1298 NZ LYS A 108 -17.121 10.872 6.806 1.00 2.41 N ATOM 0 H LYS A 108 -12.252 8.918 4.441 1.00 0.69 H new ATOM 0 HA LYS A 108 -11.075 9.123 7.172 1.00 0.73 H new ATOM 0 HB2 LYS A 108 -12.415 10.851 7.582 1.00 0.85 H new ATOM 0 HB3 LYS A 108 -12.259 11.069 5.850 1.00 0.85 H new ATOM 0 HG2 LYS A 108 -14.518 11.146 5.805 1.00 0.92 H new ATOM 0 HG3 LYS A 108 -14.476 9.407 6.011 1.00 0.92 H new ATOM 0 HD2 LYS A 108 -14.361 9.887 8.571 1.00 1.25 H new ATOM 0 HD3 LYS A 108 -14.810 11.531 8.166 1.00 1.25 H new ATOM 0 HE2 LYS A 108 -16.429 9.025 7.550 1.00 1.48 H new ATOM 0 HE3 LYS A 108 -16.795 10.216 8.782 1.00 1.48 H new ATOM 0 HZ1 LYS A 108 -18.123 10.598 6.846 1.00 2.41 H new ATOM 0 HZ2 LYS A 108 -17.030 11.885 7.023 1.00 2.41 H new ATOM 0 HZ3 LYS A 108 -16.750 10.688 5.852 1.00 2.41 H new ATOM 1312 N LEU A 109 -12.745 7.713 8.391 1.00 0.69 N ATOM 1313 CA LEU A 109 -13.218 6.530 9.117 1.00 0.68 C ATOM 1314 C LEU A 109 -14.700 6.620 9.512 1.00 0.72 C ATOM 1315 O LEU A 109 -15.195 7.688 9.874 1.00 0.75 O ATOM 1316 CB LEU A 109 -12.328 6.361 10.363 1.00 0.69 C ATOM 1317 CG LEU A 109 -10.862 6.026 10.041 1.00 0.65 C ATOM 1318 CD1 LEU A 109 -9.926 6.466 11.160 1.00 0.69 C ATOM 1319 CD2 LEU A 109 -10.698 4.525 9.881 1.00 0.60 C ATOM 0 H LEU A 109 -12.443 8.462 9.014 1.00 0.69 H new ATOM 0 HA LEU A 109 -13.144 5.662 8.461 1.00 0.68 H new ATOM 0 HB2 LEU A 109 -12.360 7.280 10.948 1.00 0.69 H new ATOM 0 HB3 LEU A 109 -12.742 5.570 10.989 1.00 0.69 H new ATOM 0 HG LEU A 109 -10.609 6.554 9.122 1.00 0.65 H new ATOM 0 HD11 LEU A 109 -8.899 6.212 10.896 1.00 0.69 H new ATOM 0 HD12 LEU A 109 -10.009 7.544 11.301 1.00 0.69 H new ATOM 0 HD13 LEU A 109 -10.199 5.957 12.084 1.00 0.69 H new ATOM 0 HD21 LEU A 109 -9.657 4.295 9.653 1.00 0.60 H new ATOM 0 HD22 LEU A 109 -10.985 4.027 10.807 1.00 0.60 H new ATOM 0 HD23 LEU A 109 -11.334 4.174 9.068 1.00 0.60 H new ATOM 1331 N SER A 110 -15.400 5.481 9.536 1.00 0.74 N ATOM 1332 CA SER A 110 -16.792 5.390 10.017 1.00 0.77 C ATOM 1333 C SER A 110 -16.944 5.529 11.545 1.00 0.85 C ATOM 1334 O SER A 110 -18.069 5.633 12.037 1.00 1.08 O ATOM 1335 CB SER A 110 -17.440 4.091 9.518 1.00 0.84 C ATOM 1336 OG SER A 110 -16.749 2.954 10.005 1.00 1.33 O ATOM 0 H SER A 110 -15.019 4.589 9.222 1.00 0.74 H new ATOM 0 HA SER A 110 -17.315 6.249 9.596 1.00 0.77 H new ATOM 0 HB2 SER A 110 -18.480 4.053 9.841 1.00 0.84 H new ATOM 0 HB3 SER A 110 -17.444 4.079 8.428 1.00 0.84 H new ATOM 0 HG SER A 110 -17.269 2.147 9.810 1.00 1.33 H new ATOM 1342 N GLY A 111 -15.830 5.557 12.288 1.00 0.83 N ATOM 1343 CA GLY A 111 -15.713 5.725 13.744 1.00 0.87 C ATOM 1344 C GLY A 111 -14.270 6.096 14.128 1.00 0.81 C ATOM 1345 O GLY A 111 -13.524 6.576 13.273 1.00 0.81 O ATOM 0 H GLY A 111 -14.913 5.455 11.852 1.00 0.83 H new ATOM 0 HA2 GLY A 111 -16.397 6.503 14.083 1.00 0.87 H new ATOM 0 HA3 GLY A 111 -16.004 4.803 14.247 1.00 0.87 H new ATOM 1349 N ALA A 112 -13.845 5.874 15.376 1.00 0.85 N ATOM 1350 CA ALA A 112 -12.442 6.058 15.780 1.00 0.81 C ATOM 1351 C ALA A 112 -11.552 4.862 15.369 1.00 0.76 C ATOM 1352 O ALA A 112 -12.063 3.791 15.023 1.00 0.85 O ATOM 1353 CB ALA A 112 -12.384 6.331 17.288 1.00 1.01 C ATOM 0 H ALA A 112 -14.456 5.564 16.131 1.00 0.85 H new ATOM 0 HA ALA A 112 -12.035 6.919 15.250 1.00 0.81 H new ATOM 0 HB1 ALA A 112 -11.347 6.468 17.593 1.00 1.01 H new ATOM 0 HB2 ALA A 112 -12.952 7.233 17.517 1.00 1.01 H new ATOM 0 HB3 ALA A 112 -12.812 5.486 17.827 1.00 1.01 H new ATOM 1359 N MET A 113 -10.225 5.029 15.435 1.00 0.76 N ATOM 1360 CA MET A 113 -9.221 4.024 15.042 1.00 0.80 C ATOM 1361 C MET A 113 -9.445 2.629 15.682 1.00 0.85 C ATOM 1362 O MET A 113 -9.834 2.537 16.854 1.00 1.03 O ATOM 1363 CB MET A 113 -7.807 4.539 15.394 1.00 0.97 C ATOM 1364 CG MET A 113 -7.101 5.209 14.207 1.00 1.05 C ATOM 1365 SD MET A 113 -6.278 4.033 13.090 1.00 1.68 S ATOM 1366 CE MET A 113 -5.919 5.100 11.674 1.00 1.05 C ATOM 0 H MET A 113 -9.804 5.894 15.774 1.00 0.76 H new ATOM 0 HA MET A 113 -9.327 3.887 13.966 1.00 0.80 H new ATOM 0 HB2 MET A 113 -7.880 5.251 16.216 1.00 0.97 H new ATOM 0 HB3 MET A 113 -7.200 3.705 15.747 1.00 0.97 H new ATOM 0 HG2 MET A 113 -7.831 5.786 13.639 1.00 1.05 H new ATOM 0 HG3 MET A 113 -6.362 5.915 14.586 1.00 1.05 H new ATOM 0 HE1 MET A 113 -5.890 4.500 10.764 1.00 1.05 H new ATOM 0 HE2 MET A 113 -6.696 5.859 11.584 1.00 1.05 H new ATOM 0 HE3 MET A 113 -4.954 5.585 11.819 1.00 1.05 H new ATOM 1376 N PRO A 114 -9.174 1.531 14.949 1.00 0.74 N ATOM 1377 CA PRO A 114 -9.240 0.161 15.464 1.00 0.68 C ATOM 1378 C PRO A 114 -8.035 -0.256 16.328 1.00 0.68 C ATOM 1379 O PRO A 114 -6.972 0.367 16.291 1.00 0.79 O ATOM 1380 CB PRO A 114 -9.322 -0.721 14.222 1.00 0.67 C ATOM 1381 CG PRO A 114 -8.491 0.068 13.219 1.00 0.73 C ATOM 1382 CD PRO A 114 -8.885 1.497 13.523 1.00 0.79 C ATOM 0 HA PRO A 114 -10.095 0.066 16.133 1.00 0.68 H new ATOM 0 HB2 PRO A 114 -8.912 -1.715 14.400 1.00 0.67 H new ATOM 0 HB3 PRO A 114 -10.350 -0.856 13.884 1.00 0.67 H new ATOM 0 HG2 PRO A 114 -7.423 -0.097 13.358 1.00 0.73 H new ATOM 0 HG3 PRO A 114 -8.725 -0.208 12.191 1.00 0.73 H new ATOM 0 HD2 PRO A 114 -8.080 2.187 13.270 1.00 0.79 H new ATOM 0 HD3 PRO A 114 -9.756 1.796 12.940 1.00 0.79 H new ATOM 1390 N ALA A 115 -8.194 -1.365 17.054 1.00 0.69 N ATOM 1391 CA ALA A 115 -7.218 -1.935 17.985 1.00 0.74 C ATOM 1392 C ALA A 115 -6.137 -2.822 17.334 1.00 0.71 C ATOM 1393 O ALA A 115 -4.944 -2.615 17.563 1.00 1.13 O ATOM 1394 CB ALA A 115 -8.023 -2.748 19.003 1.00 0.86 C ATOM 0 H ALA A 115 -9.050 -1.917 17.006 1.00 0.69 H new ATOM 0 HA ALA A 115 -6.656 -1.116 18.434 1.00 0.74 H new ATOM 0 HB1 ALA A 115 -7.344 -3.199 19.727 1.00 0.86 H new ATOM 0 HB2 ALA A 115 -8.722 -2.092 19.521 1.00 0.86 H new ATOM 0 HB3 ALA A 115 -8.576 -3.532 18.486 1.00 0.86 H new ATOM 1400 N THR A 116 -6.541 -3.815 16.532 1.00 0.57 N ATOM 1401 CA THR A 116 -5.670 -4.894 16.005 1.00 0.53 C ATOM 1402 C THR A 116 -5.378 -4.798 14.503 1.00 0.42 C ATOM 1403 O THR A 116 -4.620 -5.614 13.973 1.00 0.52 O ATOM 1404 CB THR A 116 -6.296 -6.270 16.291 1.00 0.72 C ATOM 1405 OG1 THR A 116 -7.555 -6.323 15.673 1.00 0.87 O ATOM 1406 CG2 THR A 116 -6.519 -6.531 17.779 1.00 0.96 C ATOM 0 H THR A 116 -7.508 -3.900 16.218 1.00 0.57 H new ATOM 0 HA THR A 116 -4.719 -4.771 16.524 1.00 0.53 H new ATOM 0 HB THR A 116 -5.601 -7.019 15.911 1.00 0.72 H new ATOM 0 HG1 THR A 116 -7.967 -7.195 15.844 1.00 0.87 H new ATOM 0 HG21 THR A 116 -6.963 -7.518 17.913 1.00 0.96 H new ATOM 0 HG22 THR A 116 -5.564 -6.488 18.303 1.00 0.96 H new ATOM 0 HG23 THR A 116 -7.190 -5.774 18.185 1.00 0.96 H new ATOM 1414 N ALA A 117 -5.974 -3.814 13.817 1.00 0.42 N ATOM 1415 CA ALA A 117 -5.929 -3.652 12.359 1.00 0.36 C ATOM 1416 C ALA A 117 -4.510 -3.705 11.765 1.00 0.33 C ATOM 1417 O ALA A 117 -3.531 -3.291 12.388 1.00 0.39 O ATOM 1418 CB ALA A 117 -6.586 -2.320 11.980 1.00 0.41 C ATOM 0 H ALA A 117 -6.519 -3.085 14.278 1.00 0.42 H new ATOM 0 HA ALA A 117 -6.470 -4.499 11.938 1.00 0.36 H new ATOM 0 HB1 ALA A 117 -6.555 -2.194 10.898 1.00 0.41 H new ATOM 0 HB2 ALA A 117 -7.623 -2.317 12.317 1.00 0.41 H new ATOM 0 HB3 ALA A 117 -6.048 -1.500 12.456 1.00 0.41 H new ATOM 1424 N MET A 118 -4.417 -4.153 10.516 1.00 0.30 N ATOM 1425 CA MET A 118 -3.164 -4.267 9.770 1.00 0.34 C ATOM 1426 C MET A 118 -2.681 -2.886 9.279 1.00 0.42 C ATOM 1427 O MET A 118 -3.067 -2.446 8.195 1.00 0.41 O ATOM 1428 CB MET A 118 -3.421 -5.308 8.669 1.00 0.33 C ATOM 1429 CG MET A 118 -2.266 -5.486 7.690 1.00 0.51 C ATOM 1430 SD MET A 118 -2.395 -6.974 6.662 1.00 1.79 S ATOM 1431 CE MET A 118 -0.750 -7.698 6.909 1.00 0.58 C ATOM 0 H MET A 118 -5.231 -4.455 9.980 1.00 0.30 H new ATOM 0 HA MET A 118 -2.332 -4.613 10.384 1.00 0.34 H new ATOM 0 HB2 MET A 118 -3.636 -6.269 9.137 1.00 0.33 H new ATOM 0 HB3 MET A 118 -4.312 -5.018 8.112 1.00 0.33 H new ATOM 0 HG2 MET A 118 -2.215 -4.612 7.041 1.00 0.51 H new ATOM 0 HG3 MET A 118 -1.331 -5.523 8.249 1.00 0.51 H new ATOM 0 HE1 MET A 118 -0.430 -8.195 5.993 1.00 0.58 H new ATOM 0 HE2 MET A 118 -0.040 -6.910 7.161 1.00 0.58 H new ATOM 0 HE3 MET A 118 -0.790 -8.424 7.721 1.00 0.58 H new ATOM 1441 N LYS A 119 -1.879 -2.176 10.090 1.00 0.58 N ATOM 1442 CA LYS A 119 -1.383 -0.804 9.841 1.00 0.69 C ATOM 1443 C LYS A 119 0.029 -0.546 10.382 1.00 0.87 C ATOM 1444 O LYS A 119 0.279 -0.702 11.582 1.00 1.32 O ATOM 1445 CB LYS A 119 -2.376 0.204 10.429 1.00 0.71 C ATOM 1446 CG LYS A 119 -2.605 0.135 11.951 1.00 0.84 C ATOM 1447 CD LYS A 119 -3.962 0.775 12.262 1.00 0.92 C ATOM 1448 CE LYS A 119 -4.350 0.772 13.752 1.00 1.16 C ATOM 1449 NZ LYS A 119 -3.336 1.382 14.644 1.00 1.42 N ATOM 0 H LYS A 119 -1.542 -2.555 10.975 1.00 0.58 H new ATOM 0 HA LYS A 119 -1.308 -0.683 8.760 1.00 0.69 H new ATOM 0 HB2 LYS A 119 -2.031 1.208 10.181 1.00 0.71 H new ATOM 0 HB3 LYS A 119 -3.337 0.066 9.933 1.00 0.71 H new ATOM 0 HG2 LYS A 119 -2.586 -0.900 12.291 1.00 0.84 H new ATOM 0 HG3 LYS A 119 -1.808 0.659 12.479 1.00 0.84 H new ATOM 0 HD2 LYS A 119 -3.953 1.805 11.905 1.00 0.92 H new ATOM 0 HD3 LYS A 119 -4.733 0.250 11.699 1.00 0.92 H new ATOM 0 HE2 LYS A 119 -5.292 1.307 13.872 1.00 1.16 H new ATOM 0 HE3 LYS A 119 -4.525 -0.256 14.069 1.00 1.16 H new ATOM 0 HZ1 LYS A 119 -3.670 1.342 15.628 1.00 1.42 H new ATOM 0 HZ2 LYS A 119 -2.441 0.859 14.561 1.00 1.42 H new ATOM 0 HZ3 LYS A 119 -3.184 2.374 14.370 1.00 1.42 H new ATOM 1463 N LYS A 120 0.950 -0.130 9.506 1.00 0.58 N ATOM 1464 CA LYS A 120 2.400 -0.045 9.790 1.00 0.57 C ATOM 1465 C LYS A 120 3.126 0.811 8.734 1.00 0.40 C ATOM 1466 O LYS A 120 2.730 0.798 7.571 1.00 0.68 O ATOM 1467 CB LYS A 120 2.900 -1.511 9.883 1.00 1.05 C ATOM 1468 CG LYS A 120 4.355 -1.730 10.301 1.00 1.03 C ATOM 1469 CD LYS A 120 5.291 -1.825 9.093 1.00 1.04 C ATOM 1470 CE LYS A 120 6.751 -1.884 9.537 1.00 1.23 C ATOM 1471 NZ LYS A 120 7.208 -0.579 10.061 1.00 2.84 N ATOM 0 H LYS A 120 0.711 0.164 8.559 1.00 0.58 H new ATOM 0 HA LYS A 120 2.614 0.468 10.728 1.00 0.57 H new ATOM 0 HB2 LYS A 120 2.262 -2.041 10.591 1.00 1.05 H new ATOM 0 HB3 LYS A 120 2.754 -1.980 8.910 1.00 1.05 H new ATOM 0 HG2 LYS A 120 4.675 -0.910 10.944 1.00 1.03 H new ATOM 0 HG3 LYS A 120 4.429 -2.644 10.890 1.00 1.03 H new ATOM 0 HD2 LYS A 120 5.048 -2.713 8.509 1.00 1.04 H new ATOM 0 HD3 LYS A 120 5.139 -0.964 8.442 1.00 1.04 H new ATOM 0 HE2 LYS A 120 6.869 -2.648 10.306 1.00 1.23 H new ATOM 0 HE3 LYS A 120 7.377 -2.180 8.695 1.00 1.23 H new ATOM 0 HZ1 LYS A 120 8.247 -0.571 10.115 1.00 2.84 H new ATOM 0 HZ2 LYS A 120 6.889 0.181 9.427 1.00 2.84 H new ATOM 0 HZ3 LYS A 120 6.811 -0.428 11.010 1.00 2.84 H new ATOM 1485 N LEU A 121 4.162 1.563 9.127 1.00 0.38 N ATOM 1486 CA LEU A 121 4.841 2.575 8.287 1.00 0.38 C ATOM 1487 C LEU A 121 6.046 2.052 7.479 1.00 0.39 C ATOM 1488 O LEU A 121 6.691 1.090 7.899 1.00 0.42 O ATOM 1489 CB LEU A 121 5.328 3.758 9.144 1.00 0.38 C ATOM 1490 CG LEU A 121 4.212 4.605 9.771 1.00 0.39 C ATOM 1491 CD1 LEU A 121 3.768 4.106 11.141 1.00 0.48 C ATOM 1492 CD2 LEU A 121 4.691 6.045 9.932 1.00 0.44 C ATOM 0 H LEU A 121 4.566 1.487 10.060 1.00 0.38 H new ATOM 0 HA LEU A 121 4.078 2.879 7.570 1.00 0.38 H new ATOM 0 HB2 LEU A 121 5.963 3.373 9.942 1.00 0.38 H new ATOM 0 HB3 LEU A 121 5.950 4.404 8.525 1.00 0.38 H new ATOM 0 HG LEU A 121 3.361 4.532 9.094 1.00 0.39 H new ATOM 0 HD11 LEU A 121 2.978 4.751 11.525 1.00 0.48 H new ATOM 0 HD12 LEU A 121 3.393 3.086 11.053 1.00 0.48 H new ATOM 0 HD13 LEU A 121 4.615 4.123 11.827 1.00 0.48 H new ATOM 0 HD21 LEU A 121 3.897 6.645 10.377 1.00 0.44 H new ATOM 0 HD22 LEU A 121 5.568 6.066 10.579 1.00 0.44 H new ATOM 0 HD23 LEU A 121 4.950 6.454 8.955 1.00 0.44 H new ATOM 1504 N THR A 122 6.427 2.722 6.378 1.00 0.38 N ATOM 1505 CA THR A 122 7.707 2.428 5.682 1.00 0.41 C ATOM 1506 C THR A 122 8.939 2.928 6.454 1.00 0.43 C ATOM 1507 O THR A 122 8.940 4.020 7.027 1.00 0.48 O ATOM 1508 CB THR A 122 7.767 2.864 4.206 1.00 0.47 C ATOM 1509 OG1 THR A 122 7.619 4.246 4.020 1.00 0.58 O ATOM 1510 CG2 THR A 122 6.701 2.212 3.337 1.00 0.58 C ATOM 0 H THR A 122 5.877 3.466 5.948 1.00 0.38 H new ATOM 0 HA THR A 122 7.735 1.338 5.666 1.00 0.41 H new ATOM 0 HB THR A 122 8.764 2.541 3.906 1.00 0.47 H new ATOM 0 HG1 THR A 122 7.668 4.455 3.064 1.00 0.58 H new ATOM 0 HG21 THR A 122 6.803 2.565 2.311 1.00 0.58 H new ATOM 0 HG22 THR A 122 6.823 1.129 3.362 1.00 0.58 H new ATOM 0 HG23 THR A 122 5.713 2.475 3.715 1.00 0.58 H new ATOM 1518 N GLU A 123 10.006 2.122 6.469 1.00 0.42 N ATOM 1519 CA GLU A 123 11.196 2.308 7.334 1.00 0.49 C ATOM 1520 C GLU A 123 12.393 3.023 6.693 1.00 0.58 C ATOM 1521 O GLU A 123 12.920 4.000 7.236 1.00 0.74 O ATOM 1522 CB GLU A 123 11.660 0.962 7.946 1.00 0.55 C ATOM 1523 CG GLU A 123 11.356 -0.276 7.095 1.00 0.69 C ATOM 1524 CD GLU A 123 12.011 -1.568 7.596 1.00 1.16 C ATOM 1525 OE1 GLU A 123 11.427 -2.267 8.459 1.00 2.46 O ATOM 1526 OE2 GLU A 123 13.084 -1.939 7.063 1.00 1.55 O ATOM 0 H GLU A 123 10.076 1.300 5.869 1.00 0.42 H new ATOM 0 HA GLU A 123 10.841 2.985 8.111 1.00 0.49 H new ATOM 0 HB2 GLU A 123 12.735 1.010 8.119 1.00 0.55 H new ATOM 0 HB3 GLU A 123 11.186 0.840 8.920 1.00 0.55 H new ATOM 0 HG2 GLU A 123 10.276 -0.421 7.060 1.00 0.69 H new ATOM 0 HG3 GLU A 123 11.686 -0.089 6.073 1.00 0.69 H new ATOM 1533 N ALA A 124 12.855 2.500 5.563 1.00 0.59 N ATOM 1534 CA ALA A 124 14.003 3.017 4.815 1.00 0.78 C ATOM 1535 C ALA A 124 13.836 2.759 3.312 1.00 0.86 C ATOM 1536 O ALA A 124 14.094 3.650 2.496 1.00 1.25 O ATOM 1537 CB ALA A 124 15.277 2.356 5.359 1.00 0.91 C ATOM 0 H ALA A 124 12.432 1.681 5.127 1.00 0.59 H new ATOM 0 HA ALA A 124 14.074 4.097 4.945 1.00 0.78 H new ATOM 0 HB1 ALA A 124 16.143 2.730 4.813 1.00 0.91 H new ATOM 0 HB2 ALA A 124 15.386 2.592 6.417 1.00 0.91 H new ATOM 0 HB3 ALA A 124 15.208 1.275 5.234 1.00 0.91 H new ATOM 1543 N GLU A 125 13.330 1.570 2.965 1.00 0.85 N ATOM 1544 CA GLU A 125 12.996 1.190 1.585 1.00 1.32 C ATOM 1545 C GLU A 125 11.505 0.925 1.361 1.00 1.45 C ATOM 1546 O GLU A 125 11.019 1.061 0.238 1.00 2.41 O ATOM 1547 CB GLU A 125 13.764 -0.081 1.225 1.00 1.57 C ATOM 1548 CG GLU A 125 15.241 0.146 0.898 1.00 1.82 C ATOM 1549 CD GLU A 125 15.922 -1.165 0.488 1.00 2.71 C ATOM 1550 OE1 GLU A 125 15.246 -2.075 -0.060 1.00 3.80 O ATOM 1551 OE2 GLU A 125 17.157 -1.285 0.669 1.00 3.38 O ATOM 0 H GLU A 125 13.138 0.833 3.644 1.00 0.85 H new ATOM 0 HA GLU A 125 13.272 2.035 0.954 1.00 1.32 H new ATOM 0 HB2 GLU A 125 13.692 -0.783 2.056 1.00 1.57 H new ATOM 0 HB3 GLU A 125 13.283 -0.552 0.368 1.00 1.57 H new ATOM 0 HG2 GLU A 125 15.331 0.874 0.092 1.00 1.82 H new ATOM 0 HG3 GLU A 125 15.748 0.567 1.766 1.00 1.82 H new ATOM 1558 N GLY A 126 10.779 0.536 2.405 1.00 0.67 N ATOM 1559 CA GLY A 126 9.408 0.044 2.324 1.00 0.58 C ATOM 1560 C GLY A 126 8.935 -0.468 3.686 1.00 0.50 C ATOM 1561 O GLY A 126 9.540 -0.132 4.700 1.00 0.60 O ATOM 0 H GLY A 126 11.140 0.555 3.359 1.00 0.67 H new ATOM 0 HA2 GLY A 126 8.750 0.842 1.982 1.00 0.58 H new ATOM 0 HA3 GLY A 126 9.347 -0.757 1.588 1.00 0.58 H new ATOM 1565 N ALA A 127 7.859 -1.248 3.724 1.00 0.41 N ATOM 1566 CA ALA A 127 7.334 -1.945 4.899 1.00 0.37 C ATOM 1567 C ALA A 127 6.915 -3.375 4.534 1.00 0.37 C ATOM 1568 O ALA A 127 6.151 -3.562 3.584 1.00 0.36 O ATOM 1569 CB ALA A 127 6.117 -1.186 5.441 1.00 0.34 C ATOM 0 H ALA A 127 7.297 -1.422 2.891 1.00 0.41 H new ATOM 0 HA ALA A 127 8.116 -1.988 5.658 1.00 0.37 H new ATOM 0 HB1 ALA A 127 5.725 -1.704 6.316 1.00 0.34 H new ATOM 0 HB2 ALA A 127 6.414 -0.175 5.721 1.00 0.34 H new ATOM 0 HB3 ALA A 127 5.346 -1.138 4.672 1.00 0.34 H new ATOM 1575 N LYS A 128 7.346 -4.379 5.304 1.00 0.41 N ATOM 1576 CA LYS A 128 6.855 -5.759 5.168 1.00 0.39 C ATOM 1577 C LYS A 128 5.522 -5.941 5.904 1.00 0.41 C ATOM 1578 O LYS A 128 5.390 -5.517 7.051 1.00 0.48 O ATOM 1579 CB LYS A 128 7.911 -6.745 5.691 1.00 0.43 C ATOM 1580 CG LYS A 128 7.684 -8.158 5.133 1.00 1.06 C ATOM 1581 CD LYS A 128 8.413 -9.232 5.946 1.00 0.97 C ATOM 1582 CE LYS A 128 7.645 -9.564 7.232 1.00 1.34 C ATOM 1583 NZ LYS A 128 8.475 -10.356 8.161 1.00 1.77 N ATOM 0 H LYS A 128 8.044 -4.261 6.039 1.00 0.41 H new ATOM 0 HA LYS A 128 6.679 -5.965 4.112 1.00 0.39 H new ATOM 0 HB2 LYS A 128 8.906 -6.397 5.412 1.00 0.43 H new ATOM 0 HB3 LYS A 128 7.877 -6.773 6.780 1.00 0.43 H new ATOM 0 HG2 LYS A 128 6.616 -8.375 5.125 1.00 1.06 H new ATOM 0 HG3 LYS A 128 8.025 -8.196 4.098 1.00 1.06 H new ATOM 0 HD2 LYS A 128 8.528 -10.133 5.344 1.00 0.97 H new ATOM 0 HD3 LYS A 128 9.416 -8.886 6.196 1.00 0.97 H new ATOM 0 HE2 LYS A 128 7.330 -8.641 7.719 1.00 1.34 H new ATOM 0 HE3 LYS A 128 6.740 -10.119 6.985 1.00 1.34 H new ATOM 0 HZ1 LYS A 128 7.930 -10.565 9.021 1.00 1.77 H new ATOM 0 HZ2 LYS A 128 8.755 -11.247 7.703 1.00 1.77 H new ATOM 0 HZ3 LYS A 128 9.326 -9.814 8.414 1.00 1.77 H new ATOM 1597 N PHE A 129 4.558 -6.599 5.267 1.00 0.43 N ATOM 1598 CA PHE A 129 3.254 -6.999 5.811 1.00 0.49 C ATOM 1599 C PHE A 129 3.120 -8.527 5.666 1.00 0.50 C ATOM 1600 O PHE A 129 3.391 -9.077 4.601 1.00 0.48 O ATOM 1601 CB PHE A 129 2.132 -6.232 5.076 1.00 0.50 C ATOM 1602 CG PHE A 129 1.855 -4.811 5.567 1.00 0.49 C ATOM 1603 CD1 PHE A 129 2.879 -3.848 5.660 1.00 1.89 C ATOM 1604 CD2 PHE A 129 0.549 -4.442 5.946 1.00 1.95 C ATOM 1605 CE1 PHE A 129 2.619 -2.582 6.207 1.00 1.80 C ATOM 1606 CE2 PHE A 129 0.282 -3.163 6.471 1.00 2.06 C ATOM 1607 CZ PHE A 129 1.322 -2.235 6.606 1.00 0.59 C ATOM 0 H PHE A 129 4.669 -6.888 4.295 1.00 0.43 H new ATOM 0 HA PHE A 129 3.170 -6.748 6.868 1.00 0.49 H new ATOM 0 HB2 PHE A 129 2.385 -6.186 4.017 1.00 0.50 H new ATOM 0 HB3 PHE A 129 1.211 -6.809 5.159 1.00 0.50 H new ATOM 0 HD1 PHE A 129 3.872 -4.086 5.308 1.00 1.89 H new ATOM 0 HD2 PHE A 129 -0.259 -5.150 5.832 1.00 1.95 H new ATOM 0 HE1 PHE A 129 3.424 -1.871 6.321 1.00 1.80 H new ATOM 0 HE2 PHE A 129 -0.722 -2.899 6.769 1.00 2.06 H new ATOM 0 HZ PHE A 129 1.125 -1.256 7.016 1.00 0.59 H new ATOM 1617 N ASN A 130 2.736 -9.235 6.730 1.00 0.62 N ATOM 1618 CA ASN A 130 2.636 -10.704 6.763 1.00 0.65 C ATOM 1619 C ASN A 130 1.274 -11.163 6.220 1.00 0.61 C ATOM 1620 O ASN A 130 0.235 -10.798 6.766 1.00 0.80 O ATOM 1621 CB ASN A 130 2.856 -11.117 8.234 1.00 0.87 C ATOM 1622 CG ASN A 130 2.349 -12.491 8.646 1.00 1.35 C ATOM 1623 OD1 ASN A 130 1.738 -12.652 9.696 1.00 3.20 O ATOM 1624 ND2 ASN A 130 2.602 -13.524 7.885 1.00 1.17 N ATOM 0 H ASN A 130 2.479 -8.798 7.615 1.00 0.62 H new ATOM 0 HA ASN A 130 3.382 -11.180 6.126 1.00 0.65 H new ATOM 0 HB2 ASN A 130 3.925 -11.073 8.442 1.00 0.87 H new ATOM 0 HB3 ASN A 130 2.376 -10.373 8.871 1.00 0.87 H new ATOM 0 HD21 ASN A 130 2.291 -14.454 8.167 1.00 1.17 H new ATOM 0 HD22 ASN A 130 3.110 -13.400 7.009 1.00 1.17 H new ATOM 1631 N THR A 131 1.274 -11.990 5.169 1.00 0.52 N ATOM 1632 CA THR A 131 0.057 -12.447 4.478 1.00 0.50 C ATOM 1633 C THR A 131 -0.288 -13.924 4.696 1.00 0.51 C ATOM 1634 O THR A 131 -1.360 -14.367 4.282 1.00 0.56 O ATOM 1635 CB THR A 131 0.079 -12.103 2.980 1.00 0.53 C ATOM 1636 OG1 THR A 131 1.231 -12.614 2.356 1.00 0.55 O ATOM 1637 CG2 THR A 131 0.076 -10.593 2.751 1.00 0.57 C ATOM 0 H THR A 131 2.131 -12.368 4.766 1.00 0.52 H new ATOM 0 HA THR A 131 -0.748 -11.885 4.952 1.00 0.50 H new ATOM 0 HB THR A 131 -0.818 -12.552 2.554 1.00 0.53 H new ATOM 0 HG1 THR A 131 1.218 -12.382 1.404 1.00 0.55 H new ATOM 0 HG21 THR A 131 0.092 -10.387 1.681 1.00 0.57 H new ATOM 0 HG22 THR A 131 -0.823 -10.160 3.190 1.00 0.57 H new ATOM 0 HG23 THR A 131 0.957 -10.152 3.218 1.00 0.57 H new ATOM 1645 N ALA A 132 0.555 -14.681 5.407 1.00 0.51 N ATOM 1646 CA ALA A 132 0.371 -16.109 5.707 1.00 0.51 C ATOM 1647 C ALA A 132 -0.945 -16.457 6.435 1.00 0.55 C ATOM 1648 O ALA A 132 -1.356 -17.619 6.446 1.00 0.70 O ATOM 1649 CB ALA A 132 1.543 -16.554 6.584 1.00 0.55 C ATOM 0 H ALA A 132 1.416 -14.304 5.804 1.00 0.51 H new ATOM 0 HA ALA A 132 0.327 -16.627 4.749 1.00 0.51 H new ATOM 0 HB1 ALA A 132 1.436 -17.612 6.825 1.00 0.55 H new ATOM 0 HB2 ALA A 132 2.479 -16.397 6.048 1.00 0.55 H new ATOM 0 HB3 ALA A 132 1.550 -15.971 7.505 1.00 0.55 H new ATOM 1655 N ASN A 133 -1.584 -15.474 7.074 1.00 0.57 N ATOM 1656 CA ASN A 133 -2.836 -15.635 7.821 1.00 0.66 C ATOM 1657 C ASN A 133 -4.061 -15.053 7.101 1.00 0.66 C ATOM 1658 O ASN A 133 -5.182 -15.200 7.576 1.00 0.85 O ATOM 1659 CB ASN A 133 -2.701 -15.117 9.263 1.00 0.89 C ATOM 1660 CG ASN A 133 -1.315 -14.674 9.674 1.00 0.98 C ATOM 1661 OD1 ASN A 133 -0.492 -15.458 10.126 1.00 1.50 O ATOM 1662 ND2 ASN A 133 -1.005 -13.421 9.439 1.00 2.37 N ATOM 0 H ASN A 133 -1.235 -14.516 7.087 1.00 0.57 H new ATOM 0 HA ASN A 133 -3.023 -16.708 7.874 1.00 0.66 H new ATOM 0 HB2 ASN A 133 -3.384 -14.278 9.393 1.00 0.89 H new ATOM 0 HB3 ASN A 133 -3.028 -15.903 9.944 1.00 0.89 H new ATOM 0 HD21 ASN A 133 -0.062 -13.084 9.633 1.00 2.37 H new ATOM 0 HD22 ASN A 133 -1.707 -12.784 9.062 1.00 2.37 H new ATOM 1669 N LEU A 134 -3.882 -14.400 5.953 1.00 0.53 N ATOM 1670 CA LEU A 134 -4.999 -14.051 5.093 1.00 0.50 C ATOM 1671 C LEU A 134 -5.442 -15.250 4.243 1.00 0.56 C ATOM 1672 O LEU A 134 -4.599 -15.994 3.731 1.00 0.63 O ATOM 1673 CB LEU A 134 -4.648 -12.855 4.200 1.00 0.47 C ATOM 1674 CG LEU A 134 -4.627 -11.478 4.875 1.00 0.48 C ATOM 1675 CD1 LEU A 134 -5.597 -11.332 6.044 1.00 0.55 C ATOM 1676 CD2 LEU A 134 -3.223 -11.106 5.308 1.00 0.45 C ATOM 0 H LEU A 134 -2.971 -14.104 5.602 1.00 0.53 H new ATOM 0 HA LEU A 134 -5.834 -13.767 5.733 1.00 0.50 H new ATOM 0 HB2 LEU A 134 -3.667 -13.034 3.760 1.00 0.47 H new ATOM 0 HB3 LEU A 134 -5.364 -12.821 3.379 1.00 0.47 H new ATOM 0 HG LEU A 134 -4.973 -10.782 4.111 1.00 0.48 H new ATOM 0 HD11 LEU A 134 -5.515 -10.328 6.461 1.00 0.55 H new ATOM 0 HD12 LEU A 134 -6.616 -11.498 5.694 1.00 0.55 H new ATOM 0 HD13 LEU A 134 -5.353 -12.065 6.813 1.00 0.55 H new ATOM 0 HD21 LEU A 134 -3.237 -10.125 5.784 1.00 0.45 H new ATOM 0 HD22 LEU A 134 -2.852 -11.847 6.016 1.00 0.45 H new ATOM 0 HD23 LEU A 134 -2.569 -11.077 4.436 1.00 0.45 H new ATOM 1688 N PRO A 135 -6.757 -15.421 4.028 1.00 0.58 N ATOM 1689 CA PRO A 135 -7.276 -16.370 3.055 1.00 0.65 C ATOM 1690 C PRO A 135 -7.106 -15.838 1.626 1.00 0.65 C ATOM 1691 O PRO A 135 -6.837 -14.652 1.396 1.00 0.59 O ATOM 1692 CB PRO A 135 -8.746 -16.564 3.420 1.00 0.70 C ATOM 1693 CG PRO A 135 -9.132 -15.204 4.005 1.00 0.64 C ATOM 1694 CD PRO A 135 -7.845 -14.696 4.667 1.00 0.57 C ATOM 0 HA PRO A 135 -6.738 -17.318 3.081 1.00 0.65 H new ATOM 0 HB2 PRO A 135 -9.350 -16.815 2.548 1.00 0.70 H new ATOM 0 HB3 PRO A 135 -8.881 -17.368 4.143 1.00 0.70 H new ATOM 0 HG2 PRO A 135 -9.476 -14.521 3.229 1.00 0.64 H new ATOM 0 HG3 PRO A 135 -9.941 -15.298 4.729 1.00 0.64 H new ATOM 0 HD2 PRO A 135 -7.732 -13.621 4.529 1.00 0.57 H new ATOM 0 HD3 PRO A 135 -7.859 -14.880 5.741 1.00 0.57 H new ATOM 1702 N ALA A 136 -7.322 -16.721 0.656 1.00 0.75 N ATOM 1703 CA ALA A 136 -7.255 -16.455 -0.768 1.00 0.77 C ATOM 1704 C ALA A 136 -8.428 -15.560 -1.182 1.00 0.79 C ATOM 1705 O ALA A 136 -9.524 -16.043 -1.481 1.00 0.97 O ATOM 1706 CB ALA A 136 -7.279 -17.811 -1.477 1.00 0.84 C ATOM 0 H ALA A 136 -7.561 -17.692 0.858 1.00 0.75 H new ATOM 0 HA ALA A 136 -6.345 -15.921 -1.041 1.00 0.77 H new ATOM 0 HB1 ALA A 136 -7.230 -17.659 -2.555 1.00 0.84 H new ATOM 0 HB2 ALA A 136 -6.424 -18.405 -1.155 1.00 0.84 H new ATOM 0 HB3 ALA A 136 -8.200 -18.336 -1.226 1.00 0.84 H new ATOM 1712 N ALA A 137 -8.193 -14.251 -1.163 1.00 0.70 N ATOM 1713 CA ALA A 137 -9.130 -13.242 -1.625 1.00 0.73 C ATOM 1714 C ALA A 137 -8.386 -12.022 -2.219 1.00 0.74 C ATOM 1715 O ALA A 137 -7.148 -11.987 -2.256 1.00 0.74 O ATOM 1716 CB ALA A 137 -10.022 -12.844 -0.439 1.00 0.70 C ATOM 0 H ALA A 137 -7.319 -13.856 -0.815 1.00 0.70 H new ATOM 0 HA ALA A 137 -9.750 -13.643 -2.427 1.00 0.73 H new ATOM 0 HB1 ALA A 137 -10.736 -12.086 -0.759 1.00 0.70 H new ATOM 0 HB2 ALA A 137 -10.560 -13.720 -0.078 1.00 0.70 H new ATOM 0 HB3 ALA A 137 -9.403 -12.443 0.363 1.00 0.70 H new ATOM 1722 N LYS A 138 -9.138 -11.007 -2.656 1.00 0.79 N ATOM 1723 CA LYS A 138 -8.634 -9.677 -3.031 1.00 0.81 C ATOM 1724 C LYS A 138 -8.792 -8.687 -1.869 1.00 0.67 C ATOM 1725 O LYS A 138 -9.653 -8.843 -0.998 1.00 0.70 O ATOM 1726 CB LYS A 138 -9.289 -9.218 -4.347 1.00 1.06 C ATOM 1727 CG LYS A 138 -8.799 -10.108 -5.509 1.00 1.19 C ATOM 1728 CD LYS A 138 -9.448 -9.793 -6.859 1.00 1.57 C ATOM 1729 CE LYS A 138 -8.792 -8.568 -7.499 1.00 2.90 C ATOM 1730 NZ LYS A 138 -7.587 -8.921 -8.289 1.00 4.64 N ATOM 0 H LYS A 138 -10.149 -11.089 -2.763 1.00 0.79 H new ATOM 0 HA LYS A 138 -7.562 -9.725 -3.225 1.00 0.81 H new ATOM 0 HB2 LYS A 138 -10.374 -9.276 -4.264 1.00 1.06 H new ATOM 0 HB3 LYS A 138 -9.040 -8.175 -4.544 1.00 1.06 H new ATOM 0 HG2 LYS A 138 -7.719 -9.999 -5.604 1.00 1.19 H new ATOM 0 HG3 LYS A 138 -8.994 -11.151 -5.260 1.00 1.19 H new ATOM 0 HD2 LYS A 138 -9.353 -10.652 -7.523 1.00 1.57 H new ATOM 0 HD3 LYS A 138 -10.514 -9.612 -6.723 1.00 1.57 H new ATOM 0 HE2 LYS A 138 -9.514 -8.069 -8.145 1.00 2.90 H new ATOM 0 HE3 LYS A 138 -8.517 -7.857 -6.720 1.00 2.90 H new ATOM 0 HZ1 LYS A 138 -6.909 -8.133 -8.259 1.00 4.64 H new ATOM 0 HZ2 LYS A 138 -7.146 -9.773 -7.887 1.00 4.64 H new ATOM 0 HZ3 LYS A 138 -7.860 -9.105 -9.275 1.00 4.64 H new ATOM 1744 N TYR A 139 -7.942 -7.667 -1.852 1.00 0.56 N ATOM 1745 CA TYR A 139 -7.744 -6.721 -0.747 1.00 0.45 C ATOM 1746 C TYR A 139 -7.412 -5.329 -1.304 1.00 0.43 C ATOM 1747 O TYR A 139 -7.154 -5.169 -2.502 1.00 0.54 O ATOM 1748 CB TYR A 139 -6.598 -7.228 0.155 1.00 0.38 C ATOM 1749 CG TYR A 139 -6.837 -8.579 0.798 1.00 0.39 C ATOM 1750 CD1 TYR A 139 -6.439 -9.758 0.137 1.00 0.44 C ATOM 1751 CD2 TYR A 139 -7.465 -8.656 2.055 1.00 0.40 C ATOM 1752 CE1 TYR A 139 -6.706 -11.012 0.714 1.00 0.47 C ATOM 1753 CE2 TYR A 139 -7.724 -9.914 2.631 1.00 0.43 C ATOM 1754 CZ TYR A 139 -7.360 -11.089 1.955 1.00 0.44 C ATOM 1755 OH TYR A 139 -7.678 -12.287 2.504 1.00 0.48 O ATOM 0 H TYR A 139 -7.338 -7.462 -2.648 1.00 0.56 H new ATOM 0 HA TYR A 139 -8.658 -6.647 -0.158 1.00 0.45 H new ATOM 0 HB2 TYR A 139 -5.686 -7.282 -0.439 1.00 0.38 H new ATOM 0 HB3 TYR A 139 -6.424 -6.494 0.942 1.00 0.38 H new ATOM 0 HD1 TYR A 139 -5.929 -9.698 -0.813 1.00 0.44 H new ATOM 0 HD2 TYR A 139 -7.747 -7.753 2.576 1.00 0.40 H new ATOM 0 HE1 TYR A 139 -6.408 -11.916 0.203 1.00 0.47 H new ATOM 0 HE2 TYR A 139 -8.204 -9.975 3.596 1.00 0.43 H new ATOM 0 HH TYR A 139 -7.328 -13.008 1.940 1.00 0.48 H new ATOM 1765 N LYS A 140 -7.403 -4.318 -0.430 1.00 0.35 N ATOM 1766 CA LYS A 140 -6.983 -2.946 -0.774 1.00 0.35 C ATOM 1767 C LYS A 140 -6.132 -2.282 0.311 1.00 0.29 C ATOM 1768 O LYS A 140 -6.389 -2.478 1.498 1.00 0.40 O ATOM 1769 CB LYS A 140 -8.188 -2.051 -1.122 1.00 0.45 C ATOM 1770 CG LYS A 140 -8.934 -2.474 -2.387 1.00 0.53 C ATOM 1771 CD LYS A 140 -10.003 -1.440 -2.756 1.00 0.65 C ATOM 1772 CE LYS A 140 -10.843 -2.049 -3.876 1.00 0.78 C ATOM 1773 NZ LYS A 140 -11.775 -1.073 -4.488 1.00 1.74 N ATOM 0 H LYS A 140 -7.688 -4.424 0.544 1.00 0.35 H new ATOM 0 HA LYS A 140 -6.353 -3.051 -1.657 1.00 0.35 H new ATOM 0 HB2 LYS A 140 -8.885 -2.055 -0.284 1.00 0.45 H new ATOM 0 HB3 LYS A 140 -7.842 -1.025 -1.243 1.00 0.45 H new ATOM 0 HG2 LYS A 140 -8.229 -2.586 -3.211 1.00 0.53 H new ATOM 0 HG3 LYS A 140 -9.400 -3.447 -2.232 1.00 0.53 H new ATOM 0 HD2 LYS A 140 -10.625 -1.203 -1.893 1.00 0.65 H new ATOM 0 HD3 LYS A 140 -9.542 -0.508 -3.083 1.00 0.65 H new ATOM 0 HE2 LYS A 140 -10.181 -2.445 -4.646 1.00 0.78 H new ATOM 0 HE3 LYS A 140 -11.412 -2.890 -3.481 1.00 0.78 H new ATOM 0 HZ1 LYS A 140 -12.320 -1.539 -5.242 1.00 1.74 H new ATOM 0 HZ2 LYS A 140 -12.426 -0.713 -3.762 1.00 1.74 H new ATOM 0 HZ3 LYS A 140 -11.234 -0.282 -4.891 1.00 1.74 H new ATOM 1787 N ILE A 141 -5.175 -1.446 -0.090 1.00 0.34 N ATOM 1788 CA ILE A 141 -4.356 -0.619 0.815 1.00 0.31 C ATOM 1789 C ILE A 141 -4.831 0.840 0.770 1.00 0.31 C ATOM 1790 O ILE A 141 -5.067 1.386 -0.309 1.00 0.35 O ATOM 1791 CB ILE A 141 -2.841 -0.737 0.515 1.00 0.32 C ATOM 1792 CG1 ILE A 141 -2.320 -2.192 0.564 1.00 0.41 C ATOM 1793 CG2 ILE A 141 -2.024 0.070 1.538 1.00 0.28 C ATOM 1794 CD1 ILE A 141 -2.388 -2.890 -0.794 1.00 0.45 C ATOM 0 H ILE A 141 -4.937 -1.317 -1.073 1.00 0.34 H new ATOM 0 HA ILE A 141 -4.493 -0.998 1.828 1.00 0.31 H new ATOM 0 HB ILE A 141 -2.716 -0.351 -0.497 1.00 0.32 H new ATOM 0 HG12 ILE A 141 -1.289 -2.192 0.917 1.00 0.41 H new ATOM 0 HG13 ILE A 141 -2.905 -2.759 1.289 1.00 0.41 H new ATOM 0 HG21 ILE A 141 -0.962 -0.025 1.312 1.00 0.28 H new ATOM 0 HG22 ILE A 141 -2.314 1.120 1.488 1.00 0.28 H new ATOM 0 HG23 ILE A 141 -2.217 -0.312 2.540 1.00 0.28 H new ATOM 0 HD11 ILE A 141 -2.010 -3.908 -0.699 1.00 0.45 H new ATOM 0 HD12 ILE A 141 -3.422 -2.918 -1.137 1.00 0.45 H new ATOM 0 HD13 ILE A 141 -1.781 -2.343 -1.515 1.00 0.45 H new ATOM 1806 N TYR A 142 -4.939 1.463 1.946 1.00 0.29 N ATOM 1807 CA TYR A 142 -5.356 2.854 2.152 1.00 0.31 C ATOM 1808 C TYR A 142 -4.238 3.641 2.848 1.00 0.34 C ATOM 1809 O TYR A 142 -3.740 3.212 3.887 1.00 0.33 O ATOM 1810 CB TYR A 142 -6.655 2.861 2.969 1.00 0.31 C ATOM 1811 CG TYR A 142 -7.901 2.662 2.136 1.00 0.30 C ATOM 1812 CD1 TYR A 142 -8.197 1.417 1.545 1.00 1.82 C ATOM 1813 CD2 TYR A 142 -8.775 3.746 1.961 1.00 1.72 C ATOM 1814 CE1 TYR A 142 -9.362 1.260 0.772 1.00 1.81 C ATOM 1815 CE2 TYR A 142 -9.956 3.582 1.223 1.00 1.74 C ATOM 1816 CZ TYR A 142 -10.248 2.344 0.622 1.00 0.35 C ATOM 1817 OH TYR A 142 -11.390 2.204 -0.091 1.00 0.44 O ATOM 0 H TYR A 142 -4.728 0.989 2.824 1.00 0.29 H new ATOM 0 HA TYR A 142 -5.544 3.341 1.195 1.00 0.31 H new ATOM 0 HB2 TYR A 142 -6.604 2.075 3.722 1.00 0.31 H new ATOM 0 HB3 TYR A 142 -6.733 3.809 3.502 1.00 0.31 H new ATOM 0 HD1 TYR A 142 -7.528 0.581 1.686 1.00 1.82 H new ATOM 0 HD2 TYR A 142 -8.538 4.706 2.395 1.00 1.72 H new ATOM 0 HE1 TYR A 142 -9.575 0.314 0.297 1.00 1.81 H new ATOM 0 HE2 TYR A 142 -10.643 4.408 1.116 1.00 1.74 H new ATOM 0 HH TYR A 142 -11.882 3.051 -0.090 1.00 0.44 H new ATOM 1827 N GLU A 143 -3.835 4.791 2.297 1.00 0.48 N ATOM 1828 CA GLU A 143 -2.766 5.634 2.857 1.00 0.49 C ATOM 1829 C GLU A 143 -3.346 6.619 3.881 1.00 0.53 C ATOM 1830 O GLU A 143 -4.058 7.555 3.518 1.00 0.71 O ATOM 1831 CB GLU A 143 -2.014 6.346 1.719 1.00 0.55 C ATOM 1832 CG GLU A 143 -0.782 7.110 2.222 1.00 0.65 C ATOM 1833 CD GLU A 143 -0.072 7.859 1.088 1.00 0.78 C ATOM 1834 OE1 GLU A 143 0.591 7.210 0.250 1.00 1.77 O ATOM 1835 OE2 GLU A 143 -0.166 9.113 1.032 1.00 1.92 O ATOM 0 H GLU A 143 -4.244 5.169 1.442 1.00 0.48 H new ATOM 0 HA GLU A 143 -2.045 5.011 3.387 1.00 0.49 H new ATOM 0 HB2 GLU A 143 -1.704 5.611 0.976 1.00 0.55 H new ATOM 0 HB3 GLU A 143 -2.690 7.040 1.219 1.00 0.55 H new ATOM 0 HG2 GLU A 143 -1.084 7.819 2.992 1.00 0.65 H new ATOM 0 HG3 GLU A 143 -0.086 6.411 2.687 1.00 0.65 H new ATOM 1842 N ILE A 144 -3.047 6.419 5.167 1.00 0.56 N ATOM 1843 CA ILE A 144 -3.624 7.188 6.278 1.00 0.57 C ATOM 1844 C ILE A 144 -2.497 7.957 6.978 1.00 0.61 C ATOM 1845 O ILE A 144 -1.924 7.490 7.960 1.00 0.66 O ATOM 1846 CB ILE A 144 -4.405 6.244 7.229 1.00 0.60 C ATOM 1847 CG1 ILE A 144 -5.458 5.355 6.520 1.00 0.63 C ATOM 1848 CG2 ILE A 144 -5.073 7.044 8.359 1.00 0.64 C ATOM 1849 CD1 ILE A 144 -6.574 6.081 5.760 1.00 0.62 C ATOM 0 H ILE A 144 -2.385 5.706 5.473 1.00 0.56 H new ATOM 0 HA ILE A 144 -4.347 7.918 5.915 1.00 0.57 H new ATOM 0 HB ILE A 144 -3.658 5.564 7.640 1.00 0.60 H new ATOM 0 HG12 ILE A 144 -4.936 4.704 5.818 1.00 0.63 H new ATOM 0 HG13 ILE A 144 -5.920 4.712 7.269 1.00 0.63 H new ATOM 0 HG21 ILE A 144 -5.616 6.363 9.015 1.00 0.64 H new ATOM 0 HG22 ILE A 144 -4.310 7.570 8.933 1.00 0.64 H new ATOM 0 HG23 ILE A 144 -5.768 7.767 7.931 1.00 0.64 H new ATOM 0 HD11 ILE A 144 -7.244 5.348 5.310 1.00 0.62 H new ATOM 0 HD12 ILE A 144 -7.136 6.710 6.451 1.00 0.62 H new ATOM 0 HD13 ILE A 144 -6.137 6.702 4.978 1.00 0.62 H new ATOM 1861 N HIS A 145 -2.187 9.168 6.507 1.00 0.86 N ATOM 1862 CA HIS A 145 -1.102 9.997 7.061 1.00 0.93 C ATOM 1863 C HIS A 145 -1.608 11.005 8.113 1.00 1.09 C ATOM 1864 O HIS A 145 -1.242 12.183 8.113 1.00 1.83 O ATOM 1865 CB HIS A 145 -0.178 10.547 5.962 1.00 1.73 C ATOM 1866 CG HIS A 145 -0.774 11.473 4.931 1.00 1.68 C ATOM 1867 ND1 HIS A 145 -0.476 12.809 4.786 1.00 2.48 N ATOM 1868 CD2 HIS A 145 -1.465 11.097 3.812 1.00 2.78 C ATOM 1869 CE1 HIS A 145 -0.968 13.228 3.611 1.00 3.56 C ATOM 1870 NE2 HIS A 145 -1.571 12.213 2.966 1.00 3.82 N ATOM 0 H HIS A 145 -2.680 9.606 5.729 1.00 0.86 H new ATOM 0 HA HIS A 145 -0.440 9.357 7.644 1.00 0.93 H new ATOM 0 HB2 HIS A 145 0.643 11.074 6.449 1.00 1.73 H new ATOM 0 HB3 HIS A 145 0.257 9.697 5.436 1.00 1.73 H new ATOM 0 HD2 HIS A 145 -1.861 10.112 3.613 1.00 2.78 H new ATOM 0 HE1 HIS A 145 -0.891 14.238 3.236 1.00 3.56 H new ATOM 0 HE2 HIS A 145 -2.015 12.247 2.048 1.00 3.82 H new ATOM 1878 N SER A 146 -2.479 10.533 9.011 1.00 0.90 N ATOM 1879 CA SER A 146 -2.933 11.234 10.227 1.00 1.14 C ATOM 1880 C SER A 146 -2.091 10.882 11.466 1.00 1.17 C ATOM 1881 O SER A 146 -2.030 11.665 12.416 1.00 1.47 O ATOM 1882 CB SER A 146 -4.416 10.924 10.473 1.00 1.32 C ATOM 1883 OG SER A 146 -4.644 9.531 10.481 1.00 1.75 O ATOM 0 H SER A 146 -2.908 9.613 8.910 1.00 0.90 H new ATOM 0 HA SER A 146 -2.802 12.303 10.060 1.00 1.14 H new ATOM 0 HB2 SER A 146 -4.729 11.353 11.425 1.00 1.32 H new ATOM 0 HB3 SER A 146 -5.023 11.392 9.698 1.00 1.32 H new ATOM 0 HG SER A 146 -5.595 9.356 10.641 1.00 1.75 H new ATOM 2086 N LYS A 162 -1.791 13.683 -2.562 1.00 1.25 N ATOM 2087 CA LYS A 162 -2.647 12.615 -2.012 1.00 1.18 C ATOM 2088 C LYS A 162 -2.623 11.336 -2.853 1.00 0.94 C ATOM 2089 O LYS A 162 -2.734 11.368 -4.081 1.00 1.03 O ATOM 2090 CB LYS A 162 -4.076 13.129 -1.734 1.00 1.38 C ATOM 2091 CG LYS A 162 -5.012 13.238 -2.951 1.00 1.58 C ATOM 2092 CD LYS A 162 -5.862 11.969 -3.149 1.00 1.47 C ATOM 2093 CE LYS A 162 -6.693 11.988 -4.431 1.00 1.60 C ATOM 2094 NZ LYS A 162 -7.813 12.955 -4.360 1.00 2.22 N ATOM 0 HA LYS A 162 -2.220 12.328 -1.051 1.00 1.18 H new ATOM 0 HB2 LYS A 162 -4.541 12.467 -1.003 1.00 1.38 H new ATOM 0 HB3 LYS A 162 -4.001 14.113 -1.271 1.00 1.38 H new ATOM 0 HG2 LYS A 162 -5.670 14.098 -2.825 1.00 1.58 H new ATOM 0 HG3 LYS A 162 -4.419 13.419 -3.848 1.00 1.58 H new ATOM 0 HD2 LYS A 162 -5.205 11.099 -3.164 1.00 1.47 H new ATOM 0 HD3 LYS A 162 -6.529 11.850 -2.295 1.00 1.47 H new ATOM 0 HE2 LYS A 162 -6.050 12.241 -5.274 1.00 1.60 H new ATOM 0 HE3 LYS A 162 -7.089 10.990 -4.620 1.00 1.60 H new ATOM 0 HZ1 LYS A 162 -8.348 12.933 -5.252 1.00 2.22 H new ATOM 0 HZ2 LYS A 162 -8.442 12.700 -3.572 1.00 2.22 H new ATOM 0 HZ3 LYS A 162 -7.436 13.912 -4.206 1.00 2.22 H new ATOM 2108 N ALA A 163 -2.539 10.199 -2.173 1.00 0.86 N ATOM 2109 CA ALA A 163 -2.585 8.882 -2.790 1.00 0.75 C ATOM 2110 C ALA A 163 -4.013 8.364 -2.977 1.00 0.62 C ATOM 2111 O ALA A 163 -4.957 8.791 -2.312 1.00 0.67 O ATOM 2112 CB ALA A 163 -1.736 7.912 -1.966 1.00 0.97 C ATOM 0 H ALA A 163 -2.435 10.167 -1.159 1.00 0.86 H new ATOM 0 HA ALA A 163 -2.171 8.963 -3.795 1.00 0.75 H new ATOM 0 HB1 ALA A 163 -1.766 6.923 -2.423 1.00 0.97 H new ATOM 0 HB2 ALA A 163 -0.706 8.266 -1.935 1.00 0.97 H new ATOM 0 HB3 ALA A 163 -2.130 7.855 -0.951 1.00 0.97 H new ATOM 2118 N VAL A 164 -4.145 7.402 -3.886 1.00 0.59 N ATOM 2119 CA VAL A 164 -5.400 6.720 -4.216 1.00 0.52 C ATOM 2120 C VAL A 164 -5.283 5.230 -3.864 1.00 0.49 C ATOM 2121 O VAL A 164 -4.178 4.681 -3.953 1.00 0.55 O ATOM 2122 CB VAL A 164 -5.824 6.999 -5.669 1.00 0.51 C ATOM 2123 CG1 VAL A 164 -6.324 8.440 -5.771 1.00 0.60 C ATOM 2124 CG2 VAL A 164 -4.683 6.817 -6.670 1.00 0.75 C ATOM 0 H VAL A 164 -3.355 7.061 -4.434 1.00 0.59 H new ATOM 0 HA VAL A 164 -6.213 7.121 -3.610 1.00 0.52 H new ATOM 0 HB VAL A 164 -6.603 6.279 -5.919 1.00 0.51 H new ATOM 0 HG11 VAL A 164 -6.627 8.648 -6.797 1.00 0.60 H new ATOM 0 HG12 VAL A 164 -7.177 8.577 -5.106 1.00 0.60 H new ATOM 0 HG13 VAL A 164 -5.525 9.124 -5.483 1.00 0.60 H new ATOM 0 HG21 VAL A 164 -5.045 7.028 -7.676 1.00 0.75 H new ATOM 0 HG22 VAL A 164 -3.871 7.502 -6.425 1.00 0.75 H new ATOM 0 HG23 VAL A 164 -4.318 5.791 -6.623 1.00 0.75 H new ATOM 2134 N PRO A 165 -6.366 4.577 -3.402 1.00 0.44 N ATOM 2135 CA PRO A 165 -6.283 3.244 -2.803 1.00 0.43 C ATOM 2136 C PRO A 165 -5.930 2.156 -3.828 1.00 0.44 C ATOM 2137 O PRO A 165 -6.419 2.168 -4.960 1.00 0.61 O ATOM 2138 CB PRO A 165 -7.618 3.034 -2.082 1.00 0.44 C ATOM 2139 CG PRO A 165 -8.593 3.919 -2.859 1.00 0.46 C ATOM 2140 CD PRO A 165 -7.730 5.086 -3.341 1.00 0.45 C ATOM 0 HA PRO A 165 -5.462 3.167 -2.091 1.00 0.43 H new ATOM 0 HB2 PRO A 165 -7.924 1.988 -2.102 1.00 0.44 H new ATOM 0 HB3 PRO A 165 -7.558 3.328 -1.034 1.00 0.44 H new ATOM 0 HG2 PRO A 165 -9.040 3.382 -3.695 1.00 0.46 H new ATOM 0 HG3 PRO A 165 -9.411 4.262 -2.226 1.00 0.46 H new ATOM 0 HD2 PRO A 165 -8.060 5.437 -4.319 1.00 0.45 H new ATOM 0 HD3 PRO A 165 -7.801 5.932 -2.658 1.00 0.45 H new ATOM 2148 N ILE A 166 -5.071 1.215 -3.422 1.00 0.42 N ATOM 2149 CA ILE A 166 -4.430 0.232 -4.313 1.00 0.44 C ATOM 2150 C ILE A 166 -5.056 -1.153 -4.149 1.00 0.57 C ATOM 2151 O ILE A 166 -5.139 -1.652 -3.029 1.00 0.73 O ATOM 2152 CB ILE A 166 -2.896 0.157 -4.091 1.00 0.59 C ATOM 2153 CG1 ILE A 166 -2.216 1.541 -3.965 1.00 0.76 C ATOM 2154 CG2 ILE A 166 -2.238 -0.622 -5.244 1.00 0.63 C ATOM 2155 CD1 ILE A 166 -2.078 1.994 -2.503 1.00 1.25 C ATOM 0 H ILE A 166 -4.794 1.110 -2.446 1.00 0.42 H new ATOM 0 HA ILE A 166 -4.602 0.575 -5.333 1.00 0.44 H new ATOM 0 HB ILE A 166 -2.753 -0.356 -3.140 1.00 0.59 H new ATOM 0 HG12 ILE A 166 -1.229 1.501 -4.425 1.00 0.76 H new ATOM 0 HG13 ILE A 166 -2.796 2.280 -4.518 1.00 0.76 H new ATOM 0 HG21 ILE A 166 -1.161 -0.671 -5.082 1.00 0.63 H new ATOM 0 HG22 ILE A 166 -2.646 -1.632 -5.280 1.00 0.63 H new ATOM 0 HG23 ILE A 166 -2.440 -0.115 -6.188 1.00 0.63 H new ATOM 0 HD11 ILE A 166 -1.595 2.971 -2.469 1.00 1.25 H new ATOM 0 HD12 ILE A 166 -3.066 2.062 -2.048 1.00 1.25 H new ATOM 0 HD13 ILE A 166 -1.475 1.271 -1.954 1.00 1.25 H new ATOM 2167 N GLU A 167 -5.448 -1.789 -5.253 1.00 0.61 N ATOM 2168 CA GLU A 167 -6.006 -3.148 -5.302 1.00 0.70 C ATOM 2169 C GLU A 167 -4.919 -4.230 -5.460 1.00 0.73 C ATOM 2170 O GLU A 167 -4.015 -4.129 -6.301 1.00 0.82 O ATOM 2171 CB GLU A 167 -7.107 -3.185 -6.381 1.00 0.88 C ATOM 2172 CG GLU A 167 -7.560 -4.575 -6.866 1.00 1.70 C ATOM 2173 CD GLU A 167 -6.707 -5.139 -8.015 1.00 3.28 C ATOM 2174 OE1 GLU A 167 -6.225 -4.373 -8.888 1.00 4.05 O ATOM 2175 OE2 GLU A 167 -6.528 -6.376 -8.101 1.00 4.57 O ATOM 0 H GLU A 167 -5.385 -1.358 -6.175 1.00 0.61 H new ATOM 0 HA GLU A 167 -6.467 -3.395 -4.346 1.00 0.70 H new ATOM 0 HB2 GLU A 167 -7.980 -2.660 -5.993 1.00 0.88 H new ATOM 0 HB3 GLU A 167 -6.754 -2.622 -7.245 1.00 0.88 H new ATOM 0 HG2 GLU A 167 -7.529 -5.270 -6.027 1.00 1.70 H new ATOM 0 HG3 GLU A 167 -8.598 -4.515 -7.192 1.00 1.70 H new ATOM 2182 N ILE A 168 -5.026 -5.286 -4.648 1.00 0.67 N ATOM 2183 CA ILE A 168 -4.065 -6.388 -4.544 1.00 0.66 C ATOM 2184 C ILE A 168 -4.784 -7.738 -4.352 1.00 0.65 C ATOM 2185 O ILE A 168 -5.918 -7.803 -3.874 1.00 0.61 O ATOM 2186 CB ILE A 168 -3.050 -6.060 -3.418 1.00 0.56 C ATOM 2187 CG1 ILE A 168 -1.789 -6.936 -3.531 1.00 0.64 C ATOM 2188 CG2 ILE A 168 -3.685 -6.169 -2.020 1.00 0.45 C ATOM 2189 CD1 ILE A 168 -0.656 -6.524 -2.585 1.00 0.61 C ATOM 0 H ILE A 168 -5.820 -5.401 -4.018 1.00 0.67 H new ATOM 0 HA ILE A 168 -3.507 -6.492 -5.474 1.00 0.66 H new ATOM 0 HB ILE A 168 -2.748 -5.021 -3.551 1.00 0.56 H new ATOM 0 HG12 ILE A 168 -2.060 -7.972 -3.327 1.00 0.64 H new ATOM 0 HG13 ILE A 168 -1.423 -6.898 -4.557 1.00 0.64 H new ATOM 0 HG21 ILE A 168 -2.939 -5.931 -1.262 1.00 0.45 H new ATOM 0 HG22 ILE A 168 -4.517 -5.469 -1.943 1.00 0.45 H new ATOM 0 HG23 ILE A 168 -4.050 -7.184 -1.864 1.00 0.45 H new ATOM 0 HD11 ILE A 168 0.196 -7.190 -2.726 1.00 0.61 H new ATOM 0 HD12 ILE A 168 -0.355 -5.499 -2.802 1.00 0.61 H new ATOM 0 HD13 ILE A 168 -1.001 -6.590 -1.553 1.00 0.61 H new ATOM 2201 N GLU A 169 -4.118 -8.832 -4.707 1.00 0.78 N ATOM 2202 CA GLU A 169 -4.567 -10.215 -4.487 1.00 0.74 C ATOM 2203 C GLU A 169 -3.423 -11.050 -3.891 1.00 0.73 C ATOM 2204 O GLU A 169 -2.253 -10.751 -4.147 1.00 0.83 O ATOM 2205 CB GLU A 169 -5.060 -10.780 -5.827 1.00 0.88 C ATOM 2206 CG GLU A 169 -5.857 -12.088 -5.709 1.00 1.00 C ATOM 2207 CD GLU A 169 -6.438 -12.538 -7.059 1.00 1.12 C ATOM 2208 OE1 GLU A 169 -6.476 -11.732 -8.024 1.00 2.03 O ATOM 2209 OE2 GLU A 169 -6.801 -13.730 -7.192 1.00 1.95 O ATOM 0 H GLU A 169 -3.213 -8.784 -5.175 1.00 0.78 H new ATOM 0 HA GLU A 169 -5.389 -10.248 -3.772 1.00 0.74 H new ATOM 0 HB2 GLU A 169 -5.684 -10.031 -6.316 1.00 0.88 H new ATOM 0 HB3 GLU A 169 -4.200 -10.950 -6.474 1.00 0.88 H new ATOM 0 HG2 GLU A 169 -5.210 -12.871 -5.315 1.00 1.00 H new ATOM 0 HG3 GLU A 169 -6.668 -11.954 -4.993 1.00 1.00 H new ATOM 2216 N LEU A 170 -3.730 -12.098 -3.118 1.00 0.68 N ATOM 2217 CA LEU A 170 -2.695 -12.932 -2.485 1.00 0.72 C ATOM 2218 C LEU A 170 -1.762 -13.614 -3.507 1.00 0.77 C ATOM 2219 O LEU A 170 -2.146 -13.793 -4.670 1.00 0.80 O ATOM 2220 CB LEU A 170 -3.338 -13.968 -1.544 1.00 0.71 C ATOM 2221 CG LEU A 170 -3.918 -13.429 -0.222 1.00 0.73 C ATOM 2222 CD1 LEU A 170 -3.629 -14.424 0.894 1.00 0.90 C ATOM 2223 CD2 LEU A 170 -3.391 -12.073 0.266 1.00 0.94 C ATOM 0 H LEU A 170 -4.686 -12.391 -2.914 1.00 0.68 H new ATOM 0 HA LEU A 170 -2.066 -12.263 -1.898 1.00 0.72 H new ATOM 0 HB2 LEU A 170 -4.137 -14.472 -2.087 1.00 0.71 H new ATOM 0 HB3 LEU A 170 -2.589 -14.723 -1.305 1.00 0.71 H new ATOM 0 HG LEU A 170 -4.976 -13.290 -0.446 1.00 0.73 H new ATOM 0 HD11 LEU A 170 -4.037 -14.047 1.832 1.00 0.90 H new ATOM 0 HD12 LEU A 170 -4.091 -15.382 0.656 1.00 0.90 H new ATOM 0 HD13 LEU A 170 -2.552 -14.556 0.994 1.00 0.90 H new ATOM 0 HD21 LEU A 170 -3.879 -11.809 1.204 1.00 0.94 H new ATOM 0 HD22 LEU A 170 -2.314 -12.136 0.422 1.00 0.94 H new ATOM 0 HD23 LEU A 170 -3.605 -11.309 -0.481 1.00 0.94 H new ATOM 2235 N PRO A 171 -0.526 -13.983 -3.110 1.00 0.86 N ATOM 2236 CA PRO A 171 0.487 -14.430 -4.053 1.00 0.92 C ATOM 2237 C PRO A 171 0.226 -15.862 -4.525 1.00 0.91 C ATOM 2238 O PRO A 171 0.591 -16.831 -3.869 1.00 0.99 O ATOM 2239 CB PRO A 171 1.828 -14.264 -3.330 1.00 1.01 C ATOM 2240 CG PRO A 171 1.456 -14.472 -1.866 1.00 1.03 C ATOM 2241 CD PRO A 171 0.047 -13.896 -1.769 1.00 1.00 C ATOM 0 HA PRO A 171 0.478 -13.842 -4.971 1.00 0.92 H new ATOM 0 HB2 PRO A 171 2.562 -14.996 -3.668 1.00 1.01 H new ATOM 0 HB3 PRO A 171 2.259 -13.278 -3.501 1.00 1.01 H new ATOM 0 HG2 PRO A 171 1.478 -15.527 -1.593 1.00 1.03 H new ATOM 0 HG3 PRO A 171 2.147 -13.956 -1.199 1.00 1.03 H new ATOM 0 HD2 PRO A 171 -0.554 -14.457 -1.053 1.00 1.00 H new ATOM 0 HD3 PRO A 171 0.073 -12.862 -1.424 1.00 1.00 H new ATOM 2249 N LEU A 172 -0.410 -15.978 -5.686 1.00 0.90 N ATOM 2250 CA LEU A 172 -0.539 -17.180 -6.502 1.00 0.90 C ATOM 2251 C LEU A 172 0.010 -16.768 -7.877 1.00 0.92 C ATOM 2252 O LEU A 172 -0.691 -16.692 -8.889 1.00 1.14 O ATOM 2253 CB LEU A 172 -1.995 -17.668 -6.464 1.00 1.00 C ATOM 2254 CG LEU A 172 -2.230 -19.019 -7.160 1.00 1.11 C ATOM 2255 CD1 LEU A 172 -1.306 -20.110 -6.617 1.00 2.30 C ATOM 2256 CD2 LEU A 172 -3.675 -19.445 -6.927 1.00 2.26 C ATOM 0 H LEU A 172 -0.881 -15.179 -6.111 1.00 0.90 H new ATOM 0 HA LEU A 172 0.023 -18.047 -6.154 1.00 0.90 H new ATOM 0 HB2 LEU A 172 -2.311 -17.749 -5.424 1.00 1.00 H new ATOM 0 HB3 LEU A 172 -2.630 -16.916 -6.933 1.00 1.00 H new ATOM 0 HG LEU A 172 -2.019 -18.893 -8.222 1.00 1.11 H new ATOM 0 HD11 LEU A 172 -1.506 -21.047 -7.136 1.00 2.30 H new ATOM 0 HD12 LEU A 172 -0.268 -19.820 -6.777 1.00 2.30 H new ATOM 0 HD13 LEU A 172 -1.485 -20.241 -5.550 1.00 2.30 H new ATOM 0 HD21 LEU A 172 -3.855 -20.402 -7.416 1.00 2.26 H new ATOM 0 HD22 LEU A 172 -3.857 -19.544 -5.857 1.00 2.26 H new ATOM 0 HD23 LEU A 172 -4.347 -18.694 -7.342 1.00 2.26 H new ATOM 2268 N ASN A 173 1.278 -16.356 -7.813 1.00 1.06 N ATOM 2269 CA ASN A 173 2.046 -15.639 -8.822 1.00 1.18 C ATOM 2270 C ASN A 173 3.477 -16.204 -8.870 1.00 1.26 C ATOM 2271 O ASN A 173 4.004 -16.624 -7.837 1.00 2.08 O ATOM 2272 CB ASN A 173 2.098 -14.153 -8.405 1.00 1.42 C ATOM 2273 CG ASN A 173 0.777 -13.405 -8.419 1.00 2.15 C ATOM 2274 OD1 ASN A 173 -0.122 -13.602 -7.605 1.00 3.86 O ATOM 2275 ND2 ASN A 173 0.661 -12.441 -9.292 1.00 1.62 N ATOM 0 H ASN A 173 1.838 -16.533 -6.979 1.00 1.06 H new ATOM 0 HA ASN A 173 1.586 -15.748 -9.804 1.00 1.18 H new ATOM 0 HB2 ASN A 173 2.514 -14.094 -7.399 1.00 1.42 H new ATOM 0 HB3 ASN A 173 2.792 -13.635 -9.068 1.00 1.42 H new ATOM 0 HD21 ASN A 173 -0.174 -11.855 -9.297 1.00 1.62 H new ATOM 0 HD22 ASN A 173 1.405 -12.274 -9.969 1.00 1.62 H new ATOM 2282 N ASP A 174 4.149 -16.136 -10.020 1.00 1.08 N ATOM 2283 CA ASP A 174 5.495 -16.702 -10.228 1.00 1.20 C ATOM 2284 C ASP A 174 6.628 -15.782 -9.726 1.00 1.14 C ATOM 2285 O ASP A 174 7.649 -15.583 -10.396 1.00 1.48 O ATOM 2286 CB ASP A 174 5.662 -17.116 -11.701 1.00 1.39 C ATOM 2287 CG ASP A 174 6.497 -18.391 -11.838 1.00 2.23 C ATOM 2288 OD1 ASP A 174 6.076 -19.435 -11.284 1.00 3.35 O ATOM 2289 OD2 ASP A 174 7.518 -18.408 -12.565 1.00 2.76 O ATOM 0 H ASP A 174 3.772 -15.680 -10.851 1.00 1.08 H new ATOM 0 HA ASP A 174 5.583 -17.596 -9.611 1.00 1.20 H new ATOM 0 HB2 ASP A 174 4.681 -17.274 -12.148 1.00 1.39 H new ATOM 0 HB3 ASP A 174 6.139 -16.307 -12.255 1.00 1.39 H new ATOM 2294 N VAL A 175 6.423 -15.159 -8.563 1.00 1.00 N ATOM 2295 CA VAL A 175 7.323 -14.182 -7.951 1.00 0.95 C ATOM 2296 C VAL A 175 7.986 -14.744 -6.698 1.00 1.05 C ATOM 2297 O VAL A 175 7.359 -15.417 -5.880 1.00 1.20 O ATOM 2298 CB VAL A 175 6.643 -12.822 -7.723 1.00 0.82 C ATOM 2299 CG1 VAL A 175 6.006 -12.301 -9.017 1.00 0.95 C ATOM 2300 CG2 VAL A 175 5.590 -12.819 -6.621 1.00 0.59 C ATOM 0 H VAL A 175 5.590 -15.330 -8.000 1.00 1.00 H new ATOM 0 HA VAL A 175 8.126 -13.986 -8.662 1.00 0.95 H new ATOM 0 HB VAL A 175 7.448 -12.164 -7.397 1.00 0.82 H new ATOM 0 HG11 VAL A 175 5.532 -11.338 -8.827 1.00 0.95 H new ATOM 0 HG12 VAL A 175 6.776 -12.183 -9.780 1.00 0.95 H new ATOM 0 HG13 VAL A 175 5.257 -13.012 -9.365 1.00 0.95 H new ATOM 0 HG21 VAL A 175 5.163 -11.821 -6.529 1.00 0.59 H new ATOM 0 HG22 VAL A 175 4.802 -13.530 -6.869 1.00 0.59 H new ATOM 0 HG23 VAL A 175 6.052 -13.105 -5.676 1.00 0.59 H new ATOM 2310 N VAL A 176 9.274 -14.449 -6.553 1.00 1.09 N ATOM 2311 CA VAL A 176 10.123 -14.796 -5.400 1.00 1.28 C ATOM 2312 C VAL A 176 9.540 -14.299 -4.083 1.00 0.93 C ATOM 2313 O VAL A 176 9.443 -15.019 -3.087 1.00 1.03 O ATOM 2314 CB VAL A 176 11.507 -14.170 -5.645 1.00 1.70 C ATOM 2315 CG1 VAL A 176 11.544 -12.649 -5.873 1.00 3.69 C ATOM 2316 CG2 VAL A 176 12.524 -14.578 -4.578 1.00 3.08 C ATOM 0 H VAL A 176 9.788 -13.935 -7.269 1.00 1.09 H new ATOM 0 HA VAL A 176 10.190 -15.881 -5.313 1.00 1.28 H new ATOM 0 HB VAL A 176 11.793 -14.597 -6.606 1.00 1.70 H new ATOM 0 HG11 VAL A 176 12.574 -12.330 -6.034 1.00 3.69 H new ATOM 0 HG12 VAL A 176 10.946 -12.398 -6.749 1.00 3.69 H new ATOM 0 HG13 VAL A 176 11.139 -12.140 -4.998 1.00 3.69 H new ATOM 0 HG21 VAL A 176 13.485 -14.111 -4.794 1.00 3.08 H new ATOM 0 HG22 VAL A 176 12.174 -14.252 -3.598 1.00 3.08 H new ATOM 0 HG23 VAL A 176 12.638 -15.662 -4.580 1.00 3.08 H new ATOM 2326 N ASP A 177 9.134 -13.043 -4.134 1.00 0.73 N ATOM 2327 CA ASP A 177 8.437 -12.294 -3.091 1.00 0.63 C ATOM 2328 C ASP A 177 7.575 -11.176 -3.711 1.00 0.51 C ATOM 2329 O ASP A 177 7.889 -10.679 -4.798 1.00 0.61 O ATOM 2330 CB ASP A 177 9.472 -11.727 -2.101 1.00 1.03 C ATOM 2331 CG ASP A 177 8.996 -11.812 -0.653 1.00 2.04 C ATOM 2332 OD1 ASP A 177 8.891 -12.945 -0.133 1.00 3.23 O ATOM 2333 OD2 ASP A 177 8.775 -10.751 -0.028 1.00 2.84 O ATOM 0 H ASP A 177 9.292 -12.473 -4.965 1.00 0.73 H new ATOM 0 HA ASP A 177 7.763 -12.958 -2.550 1.00 0.63 H new ATOM 0 HB2 ASP A 177 10.409 -12.274 -2.206 1.00 1.03 H new ATOM 0 HB3 ASP A 177 9.680 -10.687 -2.352 1.00 1.03 H new ATOM 2338 N ALA A 178 6.496 -10.779 -3.029 1.00 0.41 N ATOM 2339 CA ALA A 178 5.503 -9.830 -3.542 1.00 0.36 C ATOM 2340 C ALA A 178 5.807 -8.377 -3.136 1.00 0.37 C ATOM 2341 O ALA A 178 6.351 -8.140 -2.050 1.00 0.43 O ATOM 2342 CB ALA A 178 4.123 -10.269 -3.040 1.00 0.38 C ATOM 0 H ALA A 178 6.285 -11.114 -2.089 1.00 0.41 H new ATOM 0 HA ALA A 178 5.533 -9.842 -4.632 1.00 0.36 H new ATOM 0 HB1 ALA A 178 3.365 -9.578 -3.409 1.00 0.38 H new ATOM 0 HB2 ALA A 178 3.906 -11.273 -3.404 1.00 0.38 H new ATOM 0 HB3 ALA A 178 4.115 -10.268 -1.950 1.00 0.38 H new ATOM 2348 N HIS A 179 5.426 -7.398 -3.970 1.00 0.36 N ATOM 2349 CA HIS A 179 5.582 -5.971 -3.649 1.00 0.36 C ATOM 2350 C HIS A 179 4.399 -5.078 -4.054 1.00 0.36 C ATOM 2351 O HIS A 179 3.524 -5.466 -4.836 1.00 0.41 O ATOM 2352 CB HIS A 179 6.876 -5.396 -4.254 1.00 0.38 C ATOM 2353 CG HIS A 179 8.128 -6.161 -3.935 1.00 0.41 C ATOM 2354 ND1 HIS A 179 9.096 -5.766 -3.046 1.00 0.46 N ATOM 2355 CD2 HIS A 179 8.559 -7.322 -4.520 1.00 0.46 C ATOM 2356 CE1 HIS A 179 10.096 -6.657 -3.098 1.00 0.53 C ATOM 2357 NE2 HIS A 179 9.814 -7.636 -3.980 1.00 0.55 N ATOM 0 H HIS A 179 5.003 -7.572 -4.882 1.00 0.36 H new ATOM 0 HA HIS A 179 5.626 -5.952 -2.560 1.00 0.36 H new ATOM 0 HB2 HIS A 179 6.763 -5.352 -5.337 1.00 0.38 H new ATOM 0 HB3 HIS A 179 6.997 -4.371 -3.904 1.00 0.38 H new ATOM 0 HD1 HIS A 179 9.061 -4.939 -2.450 1.00 0.46 H new ATOM 0 HD2 HIS A 179 8.026 -7.894 -5.265 1.00 0.46 H new ATOM 0 HE1 HIS A 179 11.002 -6.598 -2.514 1.00 0.53 H new ATOM 2365 N VAL A 180 4.414 -3.845 -3.534 1.00 0.36 N ATOM 2366 CA VAL A 180 3.488 -2.751 -3.872 1.00 0.42 C ATOM 2367 C VAL A 180 4.253 -1.446 -4.092 1.00 0.51 C ATOM 2368 O VAL A 180 5.142 -1.122 -3.309 1.00 0.51 O ATOM 2369 CB VAL A 180 2.432 -2.496 -2.777 1.00 0.42 C ATOM 2370 CG1 VAL A 180 1.134 -1.980 -3.395 1.00 0.61 C ATOM 2371 CG2 VAL A 180 2.128 -3.701 -1.887 1.00 0.39 C ATOM 0 H VAL A 180 5.102 -3.567 -2.834 1.00 0.36 H new ATOM 0 HA VAL A 180 2.979 -3.067 -4.783 1.00 0.42 H new ATOM 0 HB VAL A 180 2.877 -1.743 -2.126 1.00 0.42 H new ATOM 0 HG11 VAL A 180 0.400 -1.806 -2.608 1.00 0.61 H new ATOM 0 HG12 VAL A 180 1.328 -1.047 -3.923 1.00 0.61 H new ATOM 0 HG13 VAL A 180 0.746 -2.719 -4.096 1.00 0.61 H new ATOM 0 HG21 VAL A 180 1.375 -3.427 -1.148 1.00 0.39 H new ATOM 0 HG22 VAL A 180 1.753 -4.521 -2.500 1.00 0.39 H new ATOM 0 HG23 VAL A 180 3.039 -4.016 -1.378 1.00 0.39 H new ATOM 2381 N TYR A 181 3.863 -0.675 -5.102 1.00 0.65 N ATOM 2382 CA TYR A 181 4.426 0.631 -5.464 1.00 0.72 C ATOM 2383 C TYR A 181 3.277 1.650 -5.654 1.00 0.73 C ATOM 2384 O TYR A 181 2.819 1.876 -6.779 1.00 0.79 O ATOM 2385 CB TYR A 181 5.328 0.454 -6.692 1.00 0.80 C ATOM 2386 CG TYR A 181 6.709 -0.092 -6.351 1.00 0.92 C ATOM 2387 CD1 TYR A 181 6.916 -1.465 -6.093 1.00 1.70 C ATOM 2388 CD2 TYR A 181 7.796 0.795 -6.267 1.00 2.47 C ATOM 2389 CE1 TYR A 181 8.196 -1.944 -5.736 1.00 1.63 C ATOM 2390 CE2 TYR A 181 9.079 0.326 -5.937 1.00 2.73 C ATOM 2391 CZ TYR A 181 9.282 -1.041 -5.663 1.00 1.40 C ATOM 2392 OH TYR A 181 10.535 -1.453 -5.339 1.00 1.72 O ATOM 0 H TYR A 181 3.106 -0.955 -5.726 1.00 0.65 H new ATOM 0 HA TYR A 181 5.056 1.037 -4.672 1.00 0.72 H new ATOM 0 HB2 TYR A 181 4.842 -0.220 -7.397 1.00 0.80 H new ATOM 0 HB3 TYR A 181 5.439 1.415 -7.195 1.00 0.80 H new ATOM 0 HD1 TYR A 181 6.088 -2.155 -6.169 1.00 1.70 H new ATOM 0 HD2 TYR A 181 7.644 1.847 -6.458 1.00 2.47 H new ATOM 0 HE1 TYR A 181 8.344 -2.992 -5.520 1.00 1.63 H new ATOM 0 HE2 TYR A 181 9.910 1.014 -5.893 1.00 2.73 H new ATOM 0 HH TYR A 181 11.143 -0.685 -5.343 1.00 1.72 H new ATOM 2402 N PRO A 182 2.751 2.222 -4.550 1.00 0.69 N ATOM 2403 CA PRO A 182 1.698 3.237 -4.549 1.00 0.68 C ATOM 2404 C PRO A 182 2.185 4.597 -5.066 1.00 0.65 C ATOM 2405 O PRO A 182 3.382 4.901 -5.056 1.00 0.80 O ATOM 2406 CB PRO A 182 1.201 3.308 -3.105 1.00 0.68 C ATOM 2407 CG PRO A 182 2.424 2.923 -2.287 1.00 0.77 C ATOM 2408 CD PRO A 182 3.098 1.885 -3.181 1.00 0.71 C ATOM 0 HA PRO A 182 0.894 2.967 -5.234 1.00 0.68 H new ATOM 0 HB2 PRO A 182 0.847 4.307 -2.851 1.00 0.68 H new ATOM 0 HB3 PRO A 182 0.371 2.623 -2.932 1.00 0.68 H new ATOM 0 HG2 PRO A 182 3.072 3.779 -2.097 1.00 0.77 H new ATOM 0 HG3 PRO A 182 2.151 2.508 -1.317 1.00 0.77 H new ATOM 0 HD2 PRO A 182 4.179 1.898 -3.042 1.00 0.71 H new ATOM 0 HD3 PRO A 182 2.757 0.880 -2.932 1.00 0.71 H new ATOM 2416 N LYS A 183 1.220 5.421 -5.489 1.00 0.60 N ATOM 2417 CA LYS A 183 1.407 6.655 -6.266 1.00 0.59 C ATOM 2418 C LYS A 183 0.745 7.880 -5.601 1.00 0.90 C ATOM 2419 O LYS A 183 0.538 7.914 -4.389 1.00 1.86 O ATOM 2420 CB LYS A 183 0.875 6.370 -7.693 1.00 0.53 C ATOM 2421 CG LYS A 183 1.624 5.235 -8.417 1.00 0.69 C ATOM 2422 CD LYS A 183 1.215 5.086 -9.894 1.00 1.33 C ATOM 2423 CE LYS A 183 -0.014 4.197 -10.157 1.00 1.37 C ATOM 2424 NZ LYS A 183 -1.297 4.776 -9.689 1.00 2.30 N ATOM 0 H LYS A 183 0.237 5.237 -5.289 1.00 0.60 H new ATOM 0 HA LYS A 183 2.462 6.924 -6.311 1.00 0.59 H new ATOM 0 HB2 LYS A 183 -0.183 6.115 -7.633 1.00 0.53 H new ATOM 0 HB3 LYS A 183 0.950 7.280 -8.288 1.00 0.53 H new ATOM 0 HG2 LYS A 183 2.696 5.422 -8.360 1.00 0.69 H new ATOM 0 HG3 LYS A 183 1.436 4.295 -7.898 1.00 0.69 H new ATOM 0 HD2 LYS A 183 1.017 6.078 -10.299 1.00 1.33 H new ATOM 0 HD3 LYS A 183 2.061 4.679 -10.447 1.00 1.33 H new ATOM 0 HE2 LYS A 183 -0.085 4.003 -11.227 1.00 1.37 H new ATOM 0 HE3 LYS A 183 0.137 3.235 -9.668 1.00 1.37 H new ATOM 0 HZ1 LYS A 183 -2.087 4.313 -10.182 1.00 2.30 H new ATOM 0 HZ2 LYS A 183 -1.392 4.626 -8.664 1.00 2.30 H new ATOM 0 HZ3 LYS A 183 -1.312 5.796 -9.893 1.00 2.30 H new ATOM 2438 N ASN A 184 0.459 8.899 -6.408 0.49 0.51 N ATOM 2439 CA ASN A 184 -0.256 10.151 -6.143 0.49 0.61 C ATOM 2440 C ASN A 184 -1.084 10.502 -7.400 0.49 0.58 C ATOM 2441 O ASN A 184 -0.887 9.908 -8.464 0.49 0.64 O ATOM 2442 CB ASN A 184 0.806 11.219 -5.799 0.49 1.01 C ATOM 2443 CG ASN A 184 0.344 12.659 -5.755 0.49 2.12 C ATOM 2444 OD1 ASN A 184 -0.724 13.000 -5.280 0.49 3.31 O ATOM 2445 ND2 ASN A 184 1.167 13.571 -6.195 0.49 2.89 N ATOM 0 H ASN A 184 0.759 8.864 -7.382 0.49 0.51 H new ATOM 0 HA ASN A 184 -0.950 10.081 -5.306 0.49 0.61 H new ATOM 0 HB2 ASN A 184 1.234 10.971 -4.828 0.49 1.01 H new ATOM 0 HB3 ASN A 184 1.611 11.144 -6.530 0.49 1.01 H new ATOM 0 HD21 ASN A 184 0.913 14.557 -6.139 0.49 2.89 H new ATOM 0 HD22 ASN A 184 2.065 13.298 -6.595 0.49 2.89 H new ATOM 2452 N THR A 185 -2.010 11.454 -7.290 0.49 0.69 N ATOM 2453 CA THR A 185 -2.786 11.968 -8.436 0.49 0.84 C ATOM 2454 C THR A 185 -3.078 13.471 -8.344 0.49 1.12 C ATOM 2455 O THR A 185 -3.056 14.164 -9.360 0.49 2.40 O ATOM 2456 CB THR A 185 -4.072 11.140 -8.609 0.49 0.85 C ATOM 2457 OG1 THR A 185 -4.731 11.416 -9.827 0.49 1.22 O ATOM 2458 CG2 THR A 185 -5.082 11.284 -7.474 0.49 0.87 C ATOM 0 H THR A 185 -2.250 11.897 -6.403 0.49 0.69 H new ATOM 0 HA THR A 185 -2.170 11.852 -9.328 0.49 0.84 H new ATOM 0 HB THR A 185 -3.708 10.113 -8.601 0.49 0.85 H new ATOM 0 HG1 THR A 185 -5.540 10.867 -9.893 0.49 1.22 H new ATOM 0 HG21 THR A 185 -5.955 10.665 -7.683 0.49 0.87 H new ATOM 0 HG22 THR A 185 -4.625 10.963 -6.538 0.49 0.87 H new ATOM 0 HG23 THR A 185 -5.388 12.327 -7.390 0.49 0.87 H new