USER MOD reduce.3.24.130724 H: found=0, std=0, add=661, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 660 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 65 LYS NZ :NH3+ 157:sc= 0.183 (180deg=-0.00555) USER MOD Set 1.2: A 124 GLN : amide:sc= 0.175 K(o=0.36,f=-2.1) USER MOD Set 2.1: A 101 MET CE :methyl 170:sc= -4.55! (180deg=-4.81!) USER MOD Set 2.2: A 110 MET CE :methyl 179:sc= -1.07 (180deg=-1.09) USER MOD Set 3.1: A 62 HIS : no HE2:sc= -0.196 K(o=-0.36,f=-3.3) USER MOD Set 3.2: A 96 GLN : amide:sc= -0.167 X(o=-0.36,f=-0.16) USER MOD Single : A 58 SER OG : rot 93:sc= 1.54 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 88:sc= 1.18 USER MOD Single : A 84 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0139) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0.00949 USER MOD Single : A 87 ASN : amide:sc= 0.215 K(o=0.21,f=-2.6!) USER MOD Single : A 90 MET CE :methyl -157:sc= -0.588 (180deg=-1.73) USER MOD Single : A 92 LYS NZ :NH3+ -158:sc= 1.12 (180deg=0.736) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= 1.03 K(o=1,f=-0.51) USER MOD Single : A 102 ASN :FLIP amide:sc= -5.79! C(o=-7.4!,f=-5.8!) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.45 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= 0.204 X(o=0.2,f=-0.0014) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 172:sc= 0.974 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 SER OG : rot 180:sc= 0.113 USER MOD Single : A 132 ASN : amide:sc=-0.00277 X(o=-0.0028,f=-0.13) USER MOD Single : A 133 HIS : no HD1:sc= -0.432 X(o=-0.43,f=0.033) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 113 N SER A 58 -6.690 9.868 -0.839 1.00 0.00 N ATOM 114 CA SER A 58 -5.696 10.544 -1.696 1.00 0.00 C ATOM 115 C SER A 58 -5.384 9.762 -2.985 1.00 0.00 C ATOM 116 O SER A 58 -5.880 8.654 -3.179 1.00 0.00 O ATOM 117 CB SER A 58 -4.430 10.726 -0.855 1.00 0.00 C ATOM 118 OG SER A 58 -3.399 11.385 -1.563 1.00 0.00 O ATOM 0 HA SER A 58 -6.099 11.501 -2.027 1.00 0.00 H new ATOM 0 HB2 SER A 58 -4.672 11.296 0.042 1.00 0.00 H new ATOM 0 HB3 SER A 58 -4.073 9.750 -0.525 1.00 0.00 H new ATOM 0 HG SER A 58 -3.450 12.349 -1.393 1.00 0.00 H new ATOM 124 N ARG A 59 -4.525 10.313 -3.861 1.00 0.00 N ATOM 125 CA ARG A 59 -3.912 9.597 -4.996 1.00 0.00 C ATOM 126 C ARG A 59 -2.834 8.584 -4.575 1.00 0.00 C ATOM 127 O ARG A 59 -2.296 7.900 -5.455 1.00 0.00 O ATOM 128 CB ARG A 59 -3.290 10.534 -6.048 1.00 0.00 C ATOM 129 CG ARG A 59 -3.970 11.877 -6.353 1.00 0.00 C ATOM 130 CD ARG A 59 -3.413 13.031 -5.507 1.00 0.00 C ATOM 131 NE ARG A 59 -1.973 13.242 -5.763 1.00 0.00 N ATOM 132 CZ ARG A 59 -1.388 14.115 -6.556 1.00 0.00 C ATOM 133 NH1 ARG A 59 -2.043 15.035 -7.210 1.00 0.00 N ATOM 134 NH2 ARG A 59 -0.099 14.065 -6.693 1.00 0.00 N ATOM 0 H ARG A 59 -4.231 11.288 -3.799 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.755 9.065 -5.436 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.269 10.748 -5.733 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -3.226 9.979 -6.984 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.842 12.112 -7.410 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.041 11.786 -6.174 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.962 13.946 -5.731 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -3.568 12.817 -4.450 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.343 12.623 -5.253 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -3.057 15.101 -7.119 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -1.541 15.688 -7.812 1.00 0.00 H new ATOM 0 HH21 ARG A 59 0.440 13.359 -6.191 1.00 0.00 H new ATOM 0 HH22 ARG A 59 0.375 14.731 -7.302 1.00 0.00 H new ATOM 148 N VAL A 60 -2.514 8.464 -3.278 1.00 0.00 N ATOM 149 CA VAL A 60 -1.771 7.300 -2.780 1.00 0.00 C ATOM 150 C VAL A 60 -2.704 6.129 -2.462 1.00 0.00 C ATOM 151 O VAL A 60 -3.717 6.269 -1.776 1.00 0.00 O ATOM 152 CB VAL A 60 -0.713 7.595 -1.704 1.00 0.00 C ATOM 153 CG1 VAL A 60 -1.097 8.308 -0.408 1.00 0.00 C ATOM 154 CG2 VAL A 60 0.016 6.301 -1.368 1.00 0.00 C ATOM 0 H VAL A 60 -2.755 9.151 -2.563 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.145 6.978 -3.612 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.104 8.356 -2.192 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.213 8.423 0.220 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.507 9.291 -0.641 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.845 7.720 0.123 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.770 6.496 -0.605 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.698 5.568 -0.993 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.499 5.912 -2.265 1.00 0.00 H new ATOM 164 N ILE A 61 -2.345 4.949 -2.965 1.00 0.00 N ATOM 165 CA ILE A 61 -2.915 3.629 -2.660 1.00 0.00 C ATOM 166 C ILE A 61 -1.864 2.835 -1.883 1.00 0.00 C ATOM 167 O ILE A 61 -0.674 2.962 -2.159 1.00 0.00 O ATOM 168 CB ILE A 61 -3.288 2.944 -3.992 1.00 0.00 C ATOM 169 CG1 ILE A 61 -4.465 3.679 -4.668 1.00 0.00 C ATOM 170 CG2 ILE A 61 -3.626 1.447 -3.871 1.00 0.00 C ATOM 171 CD1 ILE A 61 -4.436 3.470 -6.177 1.00 0.00 C ATOM 0 H ILE A 61 -1.591 4.881 -3.649 1.00 0.00 H new ATOM 0 HA ILE A 61 -3.817 3.699 -2.052 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.388 3.008 -4.604 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.409 3.313 -4.263 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.413 4.744 -4.442 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -3.876 1.050 -4.855 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.765 0.911 -3.471 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.477 1.319 -3.202 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.274 3.997 -6.633 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.501 3.858 -6.580 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.512 2.405 -6.398 1.00 0.00 H new ATOM 183 N HIS A 62 -2.281 2.003 -0.933 1.00 0.00 N ATOM 184 CA HIS A 62 -1.427 1.063 -0.207 1.00 0.00 C ATOM 185 C HIS A 62 -1.716 -0.379 -0.649 1.00 0.00 C ATOM 186 O HIS A 62 -2.835 -0.727 -1.036 1.00 0.00 O ATOM 187 CB HIS A 62 -1.587 1.309 1.303 1.00 0.00 C ATOM 188 CG HIS A 62 -1.163 0.179 2.216 1.00 0.00 C ATOM 189 ND1 HIS A 62 -1.780 -1.049 2.343 1.00 0.00 N ATOM 190 CD2 HIS A 62 -0.177 0.231 3.163 1.00 0.00 C ATOM 191 CE1 HIS A 62 -1.138 -1.736 3.304 1.00 0.00 C ATOM 192 NE2 HIS A 62 -0.146 -0.999 3.828 1.00 0.00 N ATOM 0 H HIS A 62 -3.256 1.962 -0.636 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.376 1.227 -0.444 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -1.012 2.196 1.568 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.634 1.536 1.503 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -2.581 -1.377 1.803 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.466 1.075 3.362 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -1.386 -2.741 3.612 1.00 0.00 H new ATOM 200 N ILE A 63 -0.693 -1.229 -0.574 1.00 0.00 N ATOM 201 CA ILE A 63 -0.688 -2.611 -1.058 1.00 0.00 C ATOM 202 C ILE A 63 -0.224 -3.540 0.077 1.00 0.00 C ATOM 203 O ILE A 63 0.692 -3.187 0.819 1.00 0.00 O ATOM 204 CB ILE A 63 0.223 -2.748 -2.313 1.00 0.00 C ATOM 205 CG1 ILE A 63 0.087 -1.558 -3.304 1.00 0.00 C ATOM 206 CG2 ILE A 63 -0.074 -4.079 -3.023 1.00 0.00 C ATOM 207 CD1 ILE A 63 0.980 -1.640 -4.548 1.00 0.00 C ATOM 0 H ILE A 63 0.197 -0.961 -0.155 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.696 -2.898 -1.357 1.00 0.00 H new ATOM 0 HB ILE A 63 1.255 -2.733 -1.963 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.952 -1.491 -3.626 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.316 -0.635 -2.772 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.565 -4.173 -3.901 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.122 -4.907 -2.341 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.119 -4.102 -3.330 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.811 -0.765 -5.175 1.00 0.00 H new ATOM 0 HD12 ILE A 63 2.026 -1.672 -4.243 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.738 -2.542 -5.111 1.00 0.00 H new ATOM 219 N ARG A 64 -0.818 -4.734 0.186 1.00 0.00 N ATOM 220 CA ARG A 64 -0.376 -5.920 0.960 1.00 0.00 C ATOM 221 C ARG A 64 -0.269 -7.127 0.018 1.00 0.00 C ATOM 222 O ARG A 64 -0.733 -7.070 -1.119 1.00 0.00 O ATOM 223 CB ARG A 64 -1.279 -6.222 2.201 1.00 0.00 C ATOM 224 CG ARG A 64 -2.611 -5.444 2.260 1.00 0.00 C ATOM 225 CD ARG A 64 -3.554 -5.850 3.403 1.00 0.00 C ATOM 226 NE ARG A 64 -4.953 -5.536 3.041 1.00 0.00 N ATOM 227 CZ ARG A 64 -6.039 -6.234 3.322 1.00 0.00 C ATOM 228 NH1 ARG A 64 -6.059 -7.195 4.201 1.00 0.00 N ATOM 229 NH2 ARG A 64 -7.152 -5.978 2.699 1.00 0.00 N ATOM 0 H ARG A 64 -1.694 -4.920 -0.302 1.00 0.00 H new ATOM 0 HA ARG A 64 0.607 -5.700 1.377 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -1.501 -7.289 2.216 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -0.710 -6.002 3.104 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.389 -4.381 2.354 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -3.134 -5.578 1.313 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -3.453 -6.916 3.607 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -3.279 -5.323 4.317 1.00 0.00 H new ATOM 0 HE ARG A 64 -5.097 -4.677 2.510 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -5.209 -7.439 4.709 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -6.925 -7.704 4.381 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -7.185 -5.240 1.996 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -7.992 -6.515 2.914 1.00 0.00 H new ATOM 243 N LYS A 65 0.308 -8.235 0.490 1.00 0.00 N ATOM 244 CA LYS A 65 0.434 -9.510 -0.266 1.00 0.00 C ATOM 245 C LYS A 65 1.321 -9.410 -1.515 1.00 0.00 C ATOM 246 O LYS A 65 1.249 -10.258 -2.404 1.00 0.00 O ATOM 247 CB LYS A 65 -0.957 -10.098 -0.600 1.00 0.00 C ATOM 248 CG LYS A 65 -1.987 -10.039 0.524 1.00 0.00 C ATOM 249 CD LYS A 65 -1.619 -10.755 1.823 1.00 0.00 C ATOM 250 CE LYS A 65 -2.202 -12.181 1.905 1.00 0.00 C ATOM 251 NZ LYS A 65 -1.832 -13.043 0.745 1.00 0.00 N ATOM 0 H LYS A 65 0.712 -8.285 1.425 1.00 0.00 H new ATOM 0 HA LYS A 65 0.952 -10.201 0.399 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -1.358 -9.567 -1.464 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -0.829 -11.139 -0.897 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -2.181 -8.991 0.755 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -2.921 -10.462 0.154 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -0.534 -10.806 1.910 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.980 -10.171 2.669 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -1.856 -12.654 2.824 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -3.288 -12.118 1.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -1.902 -14.044 1.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -2.479 -12.855 -0.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -0.856 -12.832 0.453 1.00 0.00 H new ATOM 265 N LEU A 66 2.188 -8.396 -1.575 1.00 0.00 N ATOM 266 CA LEU A 66 3.329 -8.361 -2.495 1.00 0.00 C ATOM 267 C LEU A 66 4.329 -9.491 -2.175 1.00 0.00 C ATOM 268 O LEU A 66 4.268 -10.092 -1.094 1.00 0.00 O ATOM 269 CB LEU A 66 4.034 -6.988 -2.369 1.00 0.00 C ATOM 270 CG LEU A 66 3.277 -5.826 -3.025 1.00 0.00 C ATOM 271 CD1 LEU A 66 4.058 -4.532 -2.884 1.00 0.00 C ATOM 272 CD2 LEU A 66 3.179 -6.029 -4.529 1.00 0.00 C ATOM 0 H LEU A 66 2.118 -7.569 -0.982 1.00 0.00 H new ATOM 0 HA LEU A 66 2.968 -8.506 -3.513 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.177 -6.762 -1.312 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.025 -7.059 -2.817 1.00 0.00 H new ATOM 0 HG LEU A 66 2.301 -5.786 -2.541 1.00 0.00 H new ATOM 0 HD11 LEU A 66 3.505 -3.720 -3.356 1.00 0.00 H new ATOM 0 HD12 LEU A 66 4.202 -4.307 -1.827 1.00 0.00 H new ATOM 0 HD13 LEU A 66 5.029 -4.638 -3.368 1.00 0.00 H new ATOM 0 HD21 LEU A 66 2.639 -5.194 -4.974 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.181 -6.082 -4.955 1.00 0.00 H new ATOM 0 HD23 LEU A 66 2.647 -6.957 -4.737 1.00 0.00 H new ATOM 284 N PRO A 67 5.298 -9.763 -3.064 1.00 0.00 N ATOM 285 CA PRO A 67 6.552 -10.417 -2.697 1.00 0.00 C ATOM 286 C PRO A 67 7.314 -9.715 -1.557 1.00 0.00 C ATOM 287 O PRO A 67 7.009 -8.599 -1.127 1.00 0.00 O ATOM 288 CB PRO A 67 7.404 -10.454 -3.972 1.00 0.00 C ATOM 289 CG PRO A 67 6.371 -10.336 -5.085 1.00 0.00 C ATOM 290 CD PRO A 67 5.273 -9.462 -4.483 1.00 0.00 C ATOM 0 HA PRO A 67 6.335 -11.412 -2.309 1.00 0.00 H new ATOM 0 HB2 PRO A 67 8.122 -9.634 -4.000 1.00 0.00 H new ATOM 0 HB3 PRO A 67 7.974 -11.380 -4.048 1.00 0.00 H new ATOM 0 HG2 PRO A 67 6.798 -9.881 -5.979 1.00 0.00 H new ATOM 0 HG3 PRO A 67 5.987 -11.313 -5.378 1.00 0.00 H new ATOM 0 HD2 PRO A 67 5.463 -8.405 -4.667 1.00 0.00 H new ATOM 0 HD3 PRO A 67 4.301 -9.691 -4.919 1.00 0.00 H new ATOM 298 N ILE A 68 8.366 -10.390 -1.112 1.00 0.00 N ATOM 299 CA ILE A 68 9.290 -10.006 -0.024 1.00 0.00 C ATOM 300 C ILE A 68 10.365 -9.006 -0.465 1.00 0.00 C ATOM 301 O ILE A 68 11.034 -8.374 0.353 1.00 0.00 O ATOM 302 CB ILE A 68 9.983 -11.282 0.511 1.00 0.00 C ATOM 303 CG1 ILE A 68 10.767 -12.024 -0.601 1.00 0.00 C ATOM 304 CG2 ILE A 68 8.912 -12.185 1.139 1.00 0.00 C ATOM 305 CD1 ILE A 68 11.436 -13.332 -0.162 1.00 0.00 C ATOM 0 H ILE A 68 8.625 -11.287 -1.524 1.00 0.00 H new ATOM 0 HA ILE A 68 8.695 -9.515 0.746 1.00 0.00 H new ATOM 0 HB ILE A 68 10.720 -11.003 1.264 1.00 0.00 H new ATOM 0 HG12 ILE A 68 10.084 -12.241 -1.423 1.00 0.00 H new ATOM 0 HG13 ILE A 68 11.534 -11.355 -0.992 1.00 0.00 H new ATOM 0 HG21 ILE A 68 9.380 -13.092 1.523 1.00 0.00 H new ATOM 0 HG22 ILE A 68 8.423 -11.655 1.956 1.00 0.00 H new ATOM 0 HG23 ILE A 68 8.172 -12.451 0.384 1.00 0.00 H new ATOM 0 HD11 ILE A 68 11.959 -13.775 -1.009 1.00 0.00 H new ATOM 0 HD12 ILE A 68 12.149 -13.126 0.637 1.00 0.00 H new ATOM 0 HD13 ILE A 68 10.677 -14.026 0.199 1.00 0.00 H new ATOM 317 N ASP A 69 10.568 -8.924 -1.776 1.00 0.00 N ATOM 318 CA ASP A 69 11.711 -8.313 -2.463 1.00 0.00 C ATOM 319 C ASP A 69 11.329 -7.626 -3.787 1.00 0.00 C ATOM 320 O ASP A 69 12.214 -7.299 -4.583 1.00 0.00 O ATOM 321 CB ASP A 69 12.791 -9.384 -2.700 1.00 0.00 C ATOM 322 CG ASP A 69 12.410 -10.444 -3.761 1.00 0.00 C ATOM 323 OD1 ASP A 69 11.210 -10.796 -3.896 1.00 0.00 O ATOM 324 OD2 ASP A 69 13.325 -10.949 -4.456 1.00 0.00 O ATOM 0 H ASP A 69 9.893 -9.309 -2.437 1.00 0.00 H new ATOM 0 HA ASP A 69 12.097 -7.524 -1.817 1.00 0.00 H new ATOM 0 HB2 ASP A 69 13.713 -8.892 -3.009 1.00 0.00 H new ATOM 0 HB3 ASP A 69 13.000 -9.889 -1.757 1.00 0.00 H new ATOM 329 N VAL A 70 10.029 -7.429 -4.054 1.00 0.00 N ATOM 330 CA VAL A 70 9.556 -6.815 -5.305 1.00 0.00 C ATOM 331 C VAL A 70 10.186 -5.440 -5.568 1.00 0.00 C ATOM 332 O VAL A 70 10.543 -4.715 -4.634 1.00 0.00 O ATOM 333 CB VAL A 70 8.017 -6.775 -5.322 1.00 0.00 C ATOM 334 CG1 VAL A 70 7.391 -5.430 -4.958 1.00 0.00 C ATOM 335 CG2 VAL A 70 7.494 -7.192 -6.690 1.00 0.00 C ATOM 0 H VAL A 70 9.279 -7.689 -3.413 1.00 0.00 H new ATOM 0 HA VAL A 70 9.888 -7.441 -6.133 1.00 0.00 H new ATOM 0 HB VAL A 70 7.720 -7.474 -4.540 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.305 -5.511 -5.000 1.00 0.00 H new ATOM 0 HG12 VAL A 70 7.695 -5.148 -3.950 1.00 0.00 H new ATOM 0 HG13 VAL A 70 7.726 -4.670 -5.664 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.404 -7.159 -6.688 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.876 -6.510 -7.449 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.826 -8.206 -6.913 1.00 0.00 H new ATOM 345 N THR A 71 10.317 -5.068 -6.842 1.00 0.00 N ATOM 346 CA THR A 71 11.033 -3.852 -7.260 1.00 0.00 C ATOM 347 C THR A 71 10.104 -2.694 -7.603 1.00 0.00 C ATOM 348 O THR A 71 8.993 -2.866 -8.110 1.00 0.00 O ATOM 349 CB THR A 71 12.035 -4.161 -8.390 1.00 0.00 C ATOM 350 OG1 THR A 71 12.779 -3.002 -8.703 1.00 0.00 O ATOM 351 CG2 THR A 71 11.396 -4.660 -9.688 1.00 0.00 C ATOM 0 H THR A 71 9.929 -5.601 -7.620 1.00 0.00 H new ATOM 0 HA THR A 71 11.604 -3.511 -6.397 1.00 0.00 H new ATOM 0 HB THR A 71 12.660 -4.965 -8.001 1.00 0.00 H new ATOM 0 HG1 THR A 71 13.415 -3.205 -9.420 1.00 0.00 H new ATOM 0 HG21 THR A 71 12.174 -4.852 -10.426 1.00 0.00 H new ATOM 0 HG22 THR A 71 10.846 -5.581 -9.492 1.00 0.00 H new ATOM 0 HG23 THR A 71 10.711 -3.903 -10.071 1.00 0.00 H new ATOM 359 N GLU A 72 10.603 -1.489 -7.347 1.00 0.00 N ATOM 360 CA GLU A 72 9.962 -0.225 -7.685 1.00 0.00 C ATOM 361 C GLU A 72 9.523 -0.194 -9.158 1.00 0.00 C ATOM 362 O GLU A 72 8.396 0.207 -9.443 1.00 0.00 O ATOM 363 CB GLU A 72 10.920 0.927 -7.324 1.00 0.00 C ATOM 364 CG GLU A 72 10.721 2.190 -8.172 1.00 0.00 C ATOM 365 CD GLU A 72 11.661 3.360 -7.801 1.00 0.00 C ATOM 366 OE1 GLU A 72 12.529 3.226 -6.905 1.00 0.00 O ATOM 367 OE2 GLU A 72 11.552 4.436 -8.440 1.00 0.00 O ATOM 0 H GLU A 72 11.501 -1.362 -6.880 1.00 0.00 H new ATOM 0 HA GLU A 72 9.047 -0.107 -7.105 1.00 0.00 H new ATOM 0 HB2 GLU A 72 10.786 1.182 -6.273 1.00 0.00 H new ATOM 0 HB3 GLU A 72 11.947 0.582 -7.440 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.872 1.937 -9.221 1.00 0.00 H new ATOM 0 HG3 GLU A 72 9.688 2.523 -8.070 1.00 0.00 H new ATOM 374 N GLY A 73 10.381 -0.649 -10.078 1.00 0.00 N ATOM 375 CA GLY A 73 10.104 -0.661 -11.519 1.00 0.00 C ATOM 376 C GLY A 73 8.853 -1.463 -11.890 1.00 0.00 C ATOM 377 O GLY A 73 8.109 -1.071 -12.784 1.00 0.00 O ATOM 0 H GLY A 73 11.299 -1.024 -9.840 1.00 0.00 H new ATOM 0 HA2 GLY A 73 9.986 0.365 -11.868 1.00 0.00 H new ATOM 0 HA3 GLY A 73 10.963 -1.079 -12.043 1.00 0.00 H new ATOM 381 N GLU A 74 8.583 -2.556 -11.177 1.00 0.00 N ATOM 382 CA GLU A 74 7.372 -3.375 -11.336 1.00 0.00 C ATOM 383 C GLU A 74 6.142 -2.704 -10.739 1.00 0.00 C ATOM 384 O GLU A 74 5.096 -2.654 -11.386 1.00 0.00 O ATOM 385 CB GLU A 74 7.603 -4.764 -10.721 1.00 0.00 C ATOM 386 CG GLU A 74 8.460 -5.607 -11.672 1.00 0.00 C ATOM 387 CD GLU A 74 7.641 -6.192 -12.838 1.00 0.00 C ATOM 388 OE1 GLU A 74 7.010 -7.262 -12.660 1.00 0.00 O ATOM 389 OE2 GLU A 74 7.637 -5.596 -13.944 1.00 0.00 O ATOM 0 H GLU A 74 9.212 -2.908 -10.455 1.00 0.00 H new ATOM 0 HA GLU A 74 7.175 -3.486 -12.402 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.099 -4.668 -9.755 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.648 -5.257 -10.541 1.00 0.00 H new ATOM 0 HG2 GLU A 74 9.267 -4.992 -12.071 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.924 -6.420 -11.114 1.00 0.00 H new ATOM 396 N VAL A 75 6.273 -2.134 -9.543 1.00 0.00 N ATOM 397 CA VAL A 75 5.183 -1.408 -8.874 1.00 0.00 C ATOM 398 C VAL A 75 4.723 -0.209 -9.712 1.00 0.00 C ATOM 399 O VAL A 75 3.540 -0.099 -10.034 1.00 0.00 O ATOM 400 CB VAL A 75 5.599 -1.041 -7.439 1.00 0.00 C ATOM 401 CG1 VAL A 75 4.557 -0.194 -6.703 1.00 0.00 C ATOM 402 CG2 VAL A 75 5.808 -2.346 -6.659 1.00 0.00 C ATOM 0 H VAL A 75 7.139 -2.160 -9.005 1.00 0.00 H new ATOM 0 HA VAL A 75 4.310 -2.055 -8.790 1.00 0.00 H new ATOM 0 HB VAL A 75 6.508 -0.443 -7.502 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.914 0.029 -5.697 1.00 0.00 H new ATOM 0 HG12 VAL A 75 4.396 0.737 -7.246 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.618 -0.745 -6.641 1.00 0.00 H new ATOM 0 HG21 VAL A 75 6.104 -2.115 -5.636 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.879 -2.916 -6.648 1.00 0.00 H new ATOM 0 HG23 VAL A 75 6.589 -2.935 -7.139 1.00 0.00 H new ATOM 412 N ILE A 76 5.634 0.665 -10.150 1.00 0.00 N ATOM 413 CA ILE A 76 5.278 1.818 -10.986 1.00 0.00 C ATOM 414 C ILE A 76 4.830 1.423 -12.393 1.00 0.00 C ATOM 415 O ILE A 76 3.949 2.083 -12.942 1.00 0.00 O ATOM 416 CB ILE A 76 6.404 2.868 -11.024 1.00 0.00 C ATOM 417 CG1 ILE A 76 7.682 2.446 -11.784 1.00 0.00 C ATOM 418 CG2 ILE A 76 6.751 3.250 -9.591 1.00 0.00 C ATOM 419 CD1 ILE A 76 7.660 2.901 -13.245 1.00 0.00 C ATOM 0 H ILE A 76 6.629 0.596 -9.939 1.00 0.00 H new ATOM 0 HA ILE A 76 4.413 2.278 -10.508 1.00 0.00 H new ATOM 0 HB ILE A 76 6.016 3.713 -11.593 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.555 2.868 -11.286 1.00 0.00 H new ATOM 0 HG13 ILE A 76 7.786 1.362 -11.744 1.00 0.00 H new ATOM 0 HG21 ILE A 76 7.548 3.994 -9.595 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.870 3.665 -9.102 1.00 0.00 H new ATOM 0 HG23 ILE A 76 7.084 2.365 -9.049 1.00 0.00 H new ATOM 0 HD11 ILE A 76 8.578 2.582 -13.739 1.00 0.00 H new ATOM 0 HD12 ILE A 76 6.802 2.458 -13.751 1.00 0.00 H new ATOM 0 HD13 ILE A 76 7.584 3.988 -13.287 1.00 0.00 H new ATOM 431 N SER A 77 5.338 0.318 -12.957 1.00 0.00 N ATOM 432 CA SER A 77 4.828 -0.160 -14.257 1.00 0.00 C ATOM 433 C SER A 77 3.444 -0.799 -14.138 1.00 0.00 C ATOM 434 O SER A 77 2.725 -0.884 -15.134 1.00 0.00 O ATOM 435 CB SER A 77 5.785 -1.126 -14.957 1.00 0.00 C ATOM 436 OG SER A 77 7.037 -0.508 -15.191 1.00 0.00 O ATOM 0 H SER A 77 6.081 -0.250 -12.550 1.00 0.00 H new ATOM 0 HA SER A 77 4.746 0.735 -14.874 1.00 0.00 H new ATOM 0 HB2 SER A 77 5.923 -2.017 -14.345 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.353 -1.453 -15.903 1.00 0.00 H new ATOM 0 HG SER A 77 7.614 -0.631 -14.409 1.00 0.00 H new ATOM 442 N LEU A 78 3.031 -1.157 -12.920 1.00 0.00 N ATOM 443 CA LEU A 78 1.648 -1.491 -12.589 1.00 0.00 C ATOM 444 C LEU A 78 0.798 -0.265 -12.223 1.00 0.00 C ATOM 445 O LEU A 78 -0.430 -0.332 -12.267 1.00 0.00 O ATOM 446 CB LEU A 78 1.643 -2.537 -11.458 1.00 0.00 C ATOM 447 CG LEU A 78 1.895 -3.958 -11.983 1.00 0.00 C ATOM 448 CD1 LEU A 78 2.304 -4.875 -10.828 1.00 0.00 C ATOM 449 CD2 LEU A 78 0.634 -4.508 -12.650 1.00 0.00 C ATOM 0 H LEU A 78 3.663 -1.223 -12.122 1.00 0.00 H new ATOM 0 HA LEU A 78 1.181 -1.907 -13.482 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.408 -2.281 -10.725 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.684 -2.507 -10.941 1.00 0.00 H new ATOM 0 HG LEU A 78 2.699 -3.921 -12.718 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.481 -5.881 -11.208 1.00 0.00 H new ATOM 0 HD12 LEU A 78 3.216 -4.495 -10.367 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.507 -4.903 -10.085 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.827 -5.516 -13.018 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.179 -4.536 -11.924 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.354 -3.865 -13.484 1.00 0.00 H new ATOM 461 N GLY A 79 1.431 0.874 -11.940 1.00 0.00 N ATOM 462 CA GLY A 79 0.774 2.174 -11.821 1.00 0.00 C ATOM 463 C GLY A 79 0.397 2.786 -13.172 1.00 0.00 C ATOM 464 O GLY A 79 -0.568 3.540 -13.291 1.00 0.00 O ATOM 0 H GLY A 79 2.438 0.918 -11.784 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.126 2.065 -11.215 1.00 0.00 H new ATOM 0 HA3 GLY A 79 1.434 2.860 -11.290 1.00 0.00 H new ATOM 468 N LEU A 80 1.204 2.531 -14.197 1.00 0.00 N ATOM 469 CA LEU A 80 1.227 3.379 -15.384 1.00 0.00 C ATOM 470 C LEU A 80 0.144 3.213 -16.469 1.00 0.00 C ATOM 471 O LEU A 80 -0.029 4.173 -17.229 1.00 0.00 O ATOM 472 CB LEU A 80 2.641 3.367 -15.974 1.00 0.00 C ATOM 473 CG LEU A 80 3.542 4.419 -15.309 1.00 0.00 C ATOM 474 CD1 LEU A 80 4.983 4.201 -15.773 1.00 0.00 C ATOM 475 CD2 LEU A 80 3.081 5.835 -15.666 1.00 0.00 C ATOM 0 H LEU A 80 1.851 1.743 -14.230 1.00 0.00 H new ATOM 0 HA LEU A 80 0.940 4.357 -14.998 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.081 2.378 -15.846 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.590 3.557 -17.046 1.00 0.00 H new ATOM 0 HG LEU A 80 3.481 4.310 -14.226 1.00 0.00 H new ATOM 0 HD11 LEU A 80 5.632 4.943 -15.307 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.310 3.202 -15.486 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.036 4.303 -16.857 1.00 0.00 H new ATOM 0 HD21 LEU A 80 3.734 6.563 -15.184 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.123 5.970 -16.747 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.057 5.982 -15.322 1.00 0.00 H new ATOM 487 N PRO A 81 -0.640 2.121 -16.560 1.00 0.00 N ATOM 488 CA PRO A 81 -1.805 2.063 -17.451 1.00 0.00 C ATOM 489 C PRO A 81 -2.916 3.079 -17.187 1.00 0.00 C ATOM 490 O PRO A 81 -3.862 3.128 -17.979 1.00 0.00 O ATOM 491 CB PRO A 81 -2.328 0.625 -17.377 1.00 0.00 C ATOM 492 CG PRO A 81 -1.144 -0.182 -16.850 1.00 0.00 C ATOM 493 CD PRO A 81 -0.401 0.815 -15.967 1.00 0.00 C ATOM 0 HA PRO A 81 -1.474 2.346 -18.450 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -3.188 0.549 -16.712 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -2.649 0.268 -18.356 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -1.472 -1.054 -16.284 1.00 0.00 H new ATOM 0 HG3 PRO A 81 -0.514 -0.548 -17.661 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -0.767 0.778 -14.941 1.00 0.00 H new ATOM 0 HD3 PRO A 81 0.665 0.590 -15.933 1.00 0.00 H new ATOM 501 N PHE A 82 -2.820 3.890 -16.124 1.00 0.00 N ATOM 502 CA PHE A 82 -3.948 4.682 -15.638 1.00 0.00 C ATOM 503 C PHE A 82 -3.721 6.194 -15.623 1.00 0.00 C ATOM 504 O PHE A 82 -4.614 6.940 -16.029 1.00 0.00 O ATOM 505 CB PHE A 82 -4.366 4.174 -14.251 1.00 0.00 C ATOM 506 CG PHE A 82 -4.509 2.670 -14.226 1.00 0.00 C ATOM 507 CD1 PHE A 82 -5.680 2.066 -14.712 1.00 0.00 C ATOM 508 CD2 PHE A 82 -3.419 1.881 -13.830 1.00 0.00 C ATOM 509 CE1 PHE A 82 -5.763 0.668 -14.807 1.00 0.00 C ATOM 510 CE2 PHE A 82 -3.501 0.480 -13.916 1.00 0.00 C ATOM 511 CZ PHE A 82 -4.670 -0.120 -14.412 1.00 0.00 C ATOM 0 H PHE A 82 -1.963 4.012 -15.584 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.753 4.538 -16.359 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -3.625 4.481 -13.513 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -5.312 4.634 -13.965 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -6.518 2.678 -15.013 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -2.519 2.349 -13.460 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -6.662 0.201 -15.182 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -2.669 -0.132 -13.602 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.729 -1.196 -14.490 1.00 0.00 H new ATOM 521 N GLY A 83 -2.552 6.660 -15.169 1.00 0.00 N ATOM 522 CA GLY A 83 -2.219 8.074 -15.107 1.00 0.00 C ATOM 523 C GLY A 83 -0.759 8.347 -15.454 1.00 0.00 C ATOM 524 O GLY A 83 -0.272 8.063 -16.549 1.00 0.00 O ATOM 0 H GLY A 83 -1.806 6.052 -14.832 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -2.861 8.625 -15.794 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -2.427 8.449 -14.105 1.00 0.00 H new ATOM 528 N LYS A 84 -0.082 8.899 -14.457 1.00 0.00 N ATOM 529 CA LYS A 84 1.318 9.299 -14.371 1.00 0.00 C ATOM 530 C LYS A 84 1.684 9.084 -12.904 1.00 0.00 C ATOM 531 O LYS A 84 0.933 9.528 -12.038 1.00 0.00 O ATOM 532 CB LYS A 84 1.410 10.778 -14.809 1.00 0.00 C ATOM 533 CG LYS A 84 2.766 11.208 -15.386 1.00 0.00 C ATOM 534 CD LYS A 84 3.176 10.437 -16.652 1.00 0.00 C ATOM 535 CE LYS A 84 4.503 10.939 -17.242 1.00 0.00 C ATOM 536 NZ LYS A 84 4.383 12.298 -17.838 1.00 0.00 N ATOM 0 H LYS A 84 -0.561 9.103 -13.580 1.00 0.00 H new ATOM 0 HA LYS A 84 2.001 8.739 -15.010 1.00 0.00 H new ATOM 0 HB2 LYS A 84 0.639 10.967 -15.556 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.183 11.409 -13.950 1.00 0.00 H new ATOM 0 HG2 LYS A 84 2.731 12.273 -15.616 1.00 0.00 H new ATOM 0 HG3 LYS A 84 3.534 11.072 -14.624 1.00 0.00 H new ATOM 0 HD2 LYS A 84 3.265 9.377 -16.415 1.00 0.00 H new ATOM 0 HD3 LYS A 84 2.390 10.531 -17.401 1.00 0.00 H new ATOM 0 HE2 LYS A 84 5.262 10.954 -16.460 1.00 0.00 H new ATOM 0 HE3 LYS A 84 4.845 10.240 -18.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 5.285 12.563 -18.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 3.631 12.297 -18.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 4.149 12.984 -17.093 1.00 0.00 H new ATOM 550 N VAL A 85 2.689 8.272 -12.588 1.00 0.00 N ATOM 551 CA VAL A 85 2.804 7.681 -11.231 1.00 0.00 C ATOM 552 C VAL A 85 4.210 7.902 -10.708 1.00 0.00 C ATOM 553 O VAL A 85 5.122 7.096 -10.888 1.00 0.00 O ATOM 554 CB VAL A 85 2.230 6.252 -11.130 1.00 0.00 C ATOM 555 CG1 VAL A 85 2.144 5.712 -9.695 1.00 0.00 C ATOM 556 CG2 VAL A 85 1.064 6.081 -12.091 1.00 0.00 C ATOM 0 H VAL A 85 3.432 8.003 -13.233 1.00 0.00 H new ATOM 0 HA VAL A 85 2.147 8.207 -10.538 1.00 0.00 H new ATOM 0 HB VAL A 85 2.945 5.520 -11.506 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.731 4.703 -9.710 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.141 5.689 -9.254 1.00 0.00 H new ATOM 0 HG13 VAL A 85 1.499 6.359 -9.101 1.00 0.00 H new ATOM 0 HG21 VAL A 85 0.670 5.068 -12.008 1.00 0.00 H new ATOM 0 HG22 VAL A 85 0.280 6.797 -11.843 1.00 0.00 H new ATOM 0 HG23 VAL A 85 1.405 6.255 -13.112 1.00 0.00 H new ATOM 566 N THR A 86 4.372 9.110 -10.178 1.00 0.00 N ATOM 567 CA THR A 86 5.631 9.794 -9.896 1.00 0.00 C ATOM 568 C THR A 86 6.281 9.319 -8.609 1.00 0.00 C ATOM 569 O THR A 86 7.480 9.546 -8.429 1.00 0.00 O ATOM 570 CB THR A 86 5.393 11.310 -9.790 1.00 0.00 C ATOM 571 OG1 THR A 86 4.385 11.583 -8.840 1.00 0.00 O ATOM 572 CG2 THR A 86 4.912 11.889 -11.122 1.00 0.00 C ATOM 0 H THR A 86 3.568 9.679 -9.915 1.00 0.00 H new ATOM 0 HA THR A 86 6.303 9.561 -10.722 1.00 0.00 H new ATOM 0 HB THR A 86 6.343 11.760 -9.500 1.00 0.00 H new ATOM 0 HG1 THR A 86 4.245 12.551 -8.781 1.00 0.00 H new ATOM 0 HG21 THR A 86 4.752 12.962 -11.016 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.664 11.708 -11.890 1.00 0.00 H new ATOM 0 HG23 THR A 86 3.976 11.410 -11.410 1.00 0.00 H new ATOM 580 N ASN A 87 5.535 8.629 -7.730 1.00 0.00 N ATOM 581 CA ASN A 87 6.134 8.017 -6.550 1.00 0.00 C ATOM 582 C ASN A 87 5.561 6.645 -6.156 1.00 0.00 C ATOM 583 O ASN A 87 4.434 6.279 -6.482 1.00 0.00 O ATOM 584 CB ASN A 87 6.110 9.033 -5.381 1.00 0.00 C ATOM 585 CG ASN A 87 7.354 8.988 -4.504 1.00 0.00 C ATOM 586 OD1 ASN A 87 8.248 8.172 -4.676 1.00 0.00 O ATOM 587 ND2 ASN A 87 7.461 9.876 -3.546 1.00 0.00 N ATOM 0 H ASN A 87 4.529 8.486 -7.819 1.00 0.00 H new ATOM 0 HA ASN A 87 7.166 7.780 -6.810 1.00 0.00 H new ATOM 0 HB2 ASN A 87 5.999 10.038 -5.787 1.00 0.00 H new ATOM 0 HB3 ASN A 87 5.233 8.841 -4.762 1.00 0.00 H new ATOM 0 HD21 ASN A 87 8.287 9.884 -2.948 1.00 0.00 H new ATOM 0 HD22 ASN A 87 6.718 10.559 -3.398 1.00 0.00 H new ATOM 594 N LEU A 88 6.359 5.894 -5.403 1.00 0.00 N ATOM 595 CA LEU A 88 6.014 4.677 -4.676 1.00 0.00 C ATOM 596 C LEU A 88 6.803 4.599 -3.361 1.00 0.00 C ATOM 597 O LEU A 88 7.719 5.390 -3.111 1.00 0.00 O ATOM 598 CB LEU A 88 6.219 3.450 -5.599 1.00 0.00 C ATOM 599 CG LEU A 88 7.651 2.881 -5.777 1.00 0.00 C ATOM 600 CD1 LEU A 88 8.750 3.918 -5.995 1.00 0.00 C ATOM 601 CD2 LEU A 88 8.128 1.964 -4.656 1.00 0.00 C ATOM 0 H LEU A 88 7.341 6.140 -5.276 1.00 0.00 H new ATOM 0 HA LEU A 88 4.962 4.687 -4.392 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.588 2.645 -5.223 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.843 3.714 -6.588 1.00 0.00 H new ATOM 0 HG LEU A 88 7.509 2.306 -6.692 1.00 0.00 H new ATOM 0 HD11 LEU A 88 9.709 3.413 -6.107 1.00 0.00 H new ATOM 0 HD12 LEU A 88 8.535 4.493 -6.896 1.00 0.00 H new ATOM 0 HD13 LEU A 88 8.792 4.590 -5.138 1.00 0.00 H new ATOM 0 HD21 LEU A 88 9.139 1.619 -4.873 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.126 2.511 -3.713 1.00 0.00 H new ATOM 0 HD23 LEU A 88 7.460 1.106 -4.579 1.00 0.00 H new ATOM 613 N LEU A 89 6.447 3.650 -2.502 1.00 0.00 N ATOM 614 CA LEU A 89 7.164 3.353 -1.261 1.00 0.00 C ATOM 615 C LEU A 89 7.044 1.869 -0.938 1.00 0.00 C ATOM 616 O LEU A 89 6.096 1.218 -1.370 1.00 0.00 O ATOM 617 CB LEU A 89 6.686 4.353 -0.204 1.00 0.00 C ATOM 618 CG LEU A 89 6.510 3.922 1.250 1.00 0.00 C ATOM 619 CD1 LEU A 89 5.926 5.140 1.951 1.00 0.00 C ATOM 620 CD2 LEU A 89 5.519 2.819 1.512 1.00 0.00 C ATOM 0 H LEU A 89 5.635 3.051 -2.650 1.00 0.00 H new ATOM 0 HA LEU A 89 8.242 3.498 -1.327 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.389 5.186 -0.209 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.726 4.743 -0.542 1.00 0.00 H new ATOM 0 HG LEU A 89 7.481 3.555 1.583 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.769 4.912 3.005 1.00 0.00 H new ATOM 0 HD12 LEU A 89 6.617 5.978 1.860 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.974 5.403 1.491 1.00 0.00 H new ATOM 0 HD21 LEU A 89 5.486 2.605 2.580 1.00 0.00 H new ATOM 0 HD22 LEU A 89 4.531 3.130 1.174 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.822 1.922 0.972 1.00 0.00 H new ATOM 632 N MET A 90 8.005 1.334 -0.182 1.00 0.00 N ATOM 633 CA MET A 90 8.172 -0.108 0.006 1.00 0.00 C ATOM 634 C MET A 90 8.358 -0.461 1.490 1.00 0.00 C ATOM 635 O MET A 90 9.472 -0.421 2.016 1.00 0.00 O ATOM 636 CB MET A 90 9.318 -0.610 -0.891 1.00 0.00 C ATOM 637 CG MET A 90 9.169 -0.132 -2.346 1.00 0.00 C ATOM 638 SD MET A 90 10.008 -1.163 -3.570 1.00 0.00 S ATOM 639 CE MET A 90 8.521 -1.650 -4.480 1.00 0.00 C ATOM 0 H MET A 90 8.694 1.894 0.320 1.00 0.00 H new ATOM 0 HA MET A 90 7.264 -0.627 -0.302 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.270 -0.260 -0.491 1.00 0.00 H new ATOM 0 HB3 MET A 90 9.344 -1.699 -0.869 1.00 0.00 H new ATOM 0 HG2 MET A 90 8.108 -0.089 -2.593 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.555 0.885 -2.421 1.00 0.00 H new ATOM 0 HE1 MET A 90 8.710 -2.581 -5.014 1.00 0.00 H new ATOM 0 HE2 MET A 90 7.697 -1.793 -3.781 1.00 0.00 H new ATOM 0 HE3 MET A 90 8.259 -0.869 -5.194 1.00 0.00 H new ATOM 649 N LEU A 91 7.259 -0.805 2.174 1.00 0.00 N ATOM 650 CA LEU A 91 7.264 -1.372 3.532 1.00 0.00 C ATOM 651 C LEU A 91 7.706 -2.850 3.499 1.00 0.00 C ATOM 652 O LEU A 91 6.937 -3.777 3.783 1.00 0.00 O ATOM 653 CB LEU A 91 5.891 -1.221 4.227 1.00 0.00 C ATOM 654 CG LEU A 91 5.225 0.157 4.422 1.00 0.00 C ATOM 655 CD1 LEU A 91 6.212 1.305 4.620 1.00 0.00 C ATOM 656 CD2 LEU A 91 4.197 0.432 3.332 1.00 0.00 C ATOM 0 H LEU A 91 6.320 -0.695 1.791 1.00 0.00 H new ATOM 0 HA LEU A 91 7.985 -0.806 4.122 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.186 -1.836 3.668 1.00 0.00 H new ATOM 0 HB3 LEU A 91 5.988 -1.667 5.217 1.00 0.00 H new ATOM 0 HG LEU A 91 4.689 0.105 5.369 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.664 2.238 4.750 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.819 1.115 5.505 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.859 1.383 3.746 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.745 1.410 3.497 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.687 0.418 2.358 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.423 -0.335 3.360 1.00 0.00 H new ATOM 668 N LYS A 92 8.980 -3.062 3.139 1.00 0.00 N ATOM 669 CA LYS A 92 9.569 -4.366 2.816 1.00 0.00 C ATOM 670 C LYS A 92 9.410 -5.407 3.936 1.00 0.00 C ATOM 671 O LYS A 92 9.176 -6.584 3.660 1.00 0.00 O ATOM 672 CB LYS A 92 11.045 -4.145 2.432 1.00 0.00 C ATOM 673 CG LYS A 92 11.655 -5.353 1.704 1.00 0.00 C ATOM 674 CD LYS A 92 13.157 -5.134 1.459 1.00 0.00 C ATOM 675 CE LYS A 92 13.795 -6.210 0.568 1.00 0.00 C ATOM 676 NZ LYS A 92 13.656 -7.579 1.136 1.00 0.00 N ATOM 0 H LYS A 92 9.653 -2.299 3.062 1.00 0.00 H new ATOM 0 HA LYS A 92 9.024 -4.793 1.974 1.00 0.00 H new ATOM 0 HB2 LYS A 92 11.122 -3.264 1.794 1.00 0.00 H new ATOM 0 HB3 LYS A 92 11.624 -3.938 3.332 1.00 0.00 H new ATOM 0 HG2 LYS A 92 11.505 -6.255 2.297 1.00 0.00 H new ATOM 0 HG3 LYS A 92 11.145 -5.508 0.753 1.00 0.00 H new ATOM 0 HD2 LYS A 92 13.303 -4.157 0.997 1.00 0.00 H new ATOM 0 HD3 LYS A 92 13.674 -5.114 2.418 1.00 0.00 H new ATOM 0 HE2 LYS A 92 13.332 -6.181 -0.418 1.00 0.00 H new ATOM 0 HE3 LYS A 92 14.852 -5.983 0.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 14.386 -8.199 0.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 13.769 -7.539 2.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 12.715 -7.957 0.905 1.00 0.00 H new ATOM 690 N GLY A 93 9.457 -4.957 5.192 1.00 0.00 N ATOM 691 CA GLY A 93 9.317 -5.781 6.400 1.00 0.00 C ATOM 692 C GLY A 93 7.954 -6.470 6.595 1.00 0.00 C ATOM 693 O GLY A 93 7.861 -7.400 7.398 1.00 0.00 O ATOM 0 H GLY A 93 9.599 -3.970 5.406 1.00 0.00 H new ATOM 0 HA2 GLY A 93 10.090 -6.549 6.383 1.00 0.00 H new ATOM 0 HA3 GLY A 93 9.511 -5.152 7.269 1.00 0.00 H new ATOM 697 N LYS A 94 6.901 -6.028 5.886 1.00 0.00 N ATOM 698 CA LYS A 94 5.513 -6.529 6.019 1.00 0.00 C ATOM 699 C LYS A 94 4.896 -7.030 4.706 1.00 0.00 C ATOM 700 O LYS A 94 3.705 -7.325 4.679 1.00 0.00 O ATOM 701 CB LYS A 94 4.627 -5.442 6.670 1.00 0.00 C ATOM 702 CG LYS A 94 4.992 -5.173 8.146 1.00 0.00 C ATOM 703 CD LYS A 94 4.822 -3.711 8.572 1.00 0.00 C ATOM 704 CE LYS A 94 6.008 -2.872 8.073 1.00 0.00 C ATOM 705 NZ LYS A 94 5.968 -1.492 8.629 1.00 0.00 N ATOM 0 H LYS A 94 6.989 -5.293 5.185 1.00 0.00 H new ATOM 0 HA LYS A 94 5.560 -7.407 6.663 1.00 0.00 H new ATOM 0 HB2 LYS A 94 4.722 -4.516 6.103 1.00 0.00 H new ATOM 0 HB3 LYS A 94 3.582 -5.748 6.609 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.371 -5.801 8.784 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.027 -5.472 8.314 1.00 0.00 H new ATOM 0 HD2 LYS A 94 3.891 -3.313 8.169 1.00 0.00 H new ATOM 0 HD3 LYS A 94 4.753 -3.647 9.658 1.00 0.00 H new ATOM 0 HE2 LYS A 94 6.943 -3.354 8.359 1.00 0.00 H new ATOM 0 HE3 LYS A 94 5.992 -2.828 6.984 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 6.782 -0.951 8.273 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 5.086 -1.025 8.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 6.008 -1.535 9.667 1.00 0.00 H new ATOM 719 N ASN A 95 5.674 -7.116 3.619 1.00 0.00 N ATOM 720 CA ASN A 95 5.182 -7.345 2.249 1.00 0.00 C ATOM 721 C ASN A 95 4.195 -6.247 1.795 1.00 0.00 C ATOM 722 O ASN A 95 3.234 -6.521 1.065 1.00 0.00 O ATOM 723 CB ASN A 95 4.592 -8.762 2.092 1.00 0.00 C ATOM 724 CG ASN A 95 5.609 -9.885 2.234 1.00 0.00 C ATOM 725 OD1 ASN A 95 6.322 -10.015 3.217 1.00 0.00 O ATOM 726 ND2 ASN A 95 5.685 -10.766 1.264 1.00 0.00 N ATOM 0 H ASN A 95 6.689 -7.026 3.666 1.00 0.00 H new ATOM 0 HA ASN A 95 6.041 -7.280 1.582 1.00 0.00 H new ATOM 0 HB2 ASN A 95 3.809 -8.901 2.837 1.00 0.00 H new ATOM 0 HB3 ASN A 95 4.118 -8.839 1.113 1.00 0.00 H new ATOM 0 HD21 ASN A 95 6.335 -11.549 1.336 1.00 0.00 H new ATOM 0 HD22 ASN A 95 5.094 -10.668 0.438 1.00 0.00 H new ATOM 733 N GLN A 96 4.406 -5.002 2.242 1.00 0.00 N ATOM 734 CA GLN A 96 3.505 -3.888 1.986 1.00 0.00 C ATOM 735 C GLN A 96 4.190 -2.764 1.170 1.00 0.00 C ATOM 736 O GLN A 96 5.414 -2.726 1.044 1.00 0.00 O ATOM 737 CB GLN A 96 2.936 -3.427 3.331 1.00 0.00 C ATOM 738 CG GLN A 96 1.880 -4.414 3.848 1.00 0.00 C ATOM 739 CD GLN A 96 1.469 -4.138 5.283 1.00 0.00 C ATOM 740 OE1 GLN A 96 1.226 -5.029 6.084 1.00 0.00 O ATOM 741 NE2 GLN A 96 1.344 -2.891 5.653 1.00 0.00 N ATOM 0 H GLN A 96 5.221 -4.744 2.799 1.00 0.00 H new ATOM 0 HA GLN A 96 2.676 -4.202 1.352 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.742 -3.337 4.059 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.492 -2.437 3.222 1.00 0.00 H new ATOM 0 HG2 GLN A 96 1.000 -4.366 3.207 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.272 -5.429 3.776 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.544 -2.140 4.992 1.00 0.00 H new ATOM 0 HE22 GLN A 96 1.046 -2.668 6.603 1.00 0.00 H new ATOM 750 N ALA A 97 3.414 -1.841 0.597 1.00 0.00 N ATOM 751 CA ALA A 97 3.884 -0.715 -0.226 1.00 0.00 C ATOM 752 C ALA A 97 2.851 0.423 -0.274 1.00 0.00 C ATOM 753 O ALA A 97 1.692 0.228 0.088 1.00 0.00 O ATOM 754 CB ALA A 97 4.117 -1.237 -1.661 1.00 0.00 C ATOM 0 H ALA A 97 2.399 -1.855 0.695 1.00 0.00 H new ATOM 0 HA ALA A 97 4.801 -0.319 0.211 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.466 -0.421 -2.293 1.00 0.00 H new ATOM 0 HB2 ALA A 97 4.866 -2.028 -1.643 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.183 -1.631 -2.061 1.00 0.00 H new ATOM 760 N PHE A 98 3.261 1.580 -0.799 1.00 0.00 N ATOM 761 CA PHE A 98 2.398 2.648 -1.320 1.00 0.00 C ATOM 762 C PHE A 98 2.643 2.776 -2.836 1.00 0.00 C ATOM 763 O PHE A 98 3.746 2.488 -3.311 1.00 0.00 O ATOM 764 CB PHE A 98 2.746 4.019 -0.728 1.00 0.00 C ATOM 765 CG PHE A 98 2.354 4.361 0.698 1.00 0.00 C ATOM 766 CD1 PHE A 98 2.010 3.379 1.646 1.00 0.00 C ATOM 767 CD2 PHE A 98 2.359 5.718 1.085 1.00 0.00 C ATOM 768 CE1 PHE A 98 1.688 3.749 2.955 1.00 0.00 C ATOM 769 CE2 PHE A 98 2.007 6.095 2.379 1.00 0.00 C ATOM 770 CZ PHE A 98 1.679 5.104 3.301 1.00 0.00 C ATOM 0 H PHE A 98 4.251 1.811 -0.877 1.00 0.00 H new ATOM 0 HA PHE A 98 1.372 2.385 -1.064 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.827 4.137 -0.802 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.298 4.773 -1.375 1.00 0.00 H new ATOM 0 HD1 PHE A 98 1.995 2.337 1.361 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.640 6.475 0.368 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.449 2.996 3.692 1.00 0.00 H new ATOM 0 HE2 PHE A 98 1.989 7.137 2.662 1.00 0.00 H new ATOM 0 HZ PHE A 98 1.411 5.389 4.308 1.00 0.00 H new ATOM 780 N ILE A 99 1.689 3.335 -3.582 1.00 0.00 N ATOM 781 CA ILE A 99 1.873 3.839 -4.945 1.00 0.00 C ATOM 782 C ILE A 99 1.080 5.150 -5.110 1.00 0.00 C ATOM 783 O ILE A 99 -0.118 5.197 -4.841 1.00 0.00 O ATOM 784 CB ILE A 99 1.539 2.721 -5.957 1.00 0.00 C ATOM 785 CG1 ILE A 99 1.845 3.211 -7.378 1.00 0.00 C ATOM 786 CG2 ILE A 99 0.109 2.176 -5.828 1.00 0.00 C ATOM 787 CD1 ILE A 99 1.798 2.088 -8.419 1.00 0.00 C ATOM 0 H ILE A 99 0.734 3.454 -3.243 1.00 0.00 H new ATOM 0 HA ILE A 99 2.911 4.102 -5.149 1.00 0.00 H new ATOM 0 HB ILE A 99 2.177 1.868 -5.725 1.00 0.00 H new ATOM 0 HG12 ILE A 99 1.128 3.984 -7.653 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.832 3.672 -7.393 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.051 1.395 -6.571 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -0.034 1.762 -4.830 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.604 2.984 -5.991 1.00 0.00 H new ATOM 0 HD11 ILE A 99 2.023 2.496 -9.405 1.00 0.00 H new ATOM 0 HD12 ILE A 99 2.535 1.326 -8.165 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.803 1.642 -8.429 1.00 0.00 H new ATOM 799 N GLU A 100 1.769 6.234 -5.470 1.00 0.00 N ATOM 800 CA GLU A 100 1.293 7.629 -5.486 1.00 0.00 C ATOM 801 C GLU A 100 1.352 8.212 -6.879 1.00 0.00 C ATOM 802 O GLU A 100 2.396 8.236 -7.547 1.00 0.00 O ATOM 803 CB GLU A 100 2.113 8.512 -4.526 1.00 0.00 C ATOM 804 CG GLU A 100 2.112 10.043 -4.790 1.00 0.00 C ATOM 805 CD GLU A 100 0.741 10.733 -4.697 1.00 0.00 C ATOM 806 OE1 GLU A 100 -0.192 10.158 -4.106 1.00 0.00 O ATOM 807 OE2 GLU A 100 0.613 11.878 -5.187 1.00 0.00 O ATOM 0 H GLU A 100 2.738 6.162 -5.779 1.00 0.00 H new ATOM 0 HA GLU A 100 0.256 7.614 -5.152 1.00 0.00 H new ATOM 0 HB2 GLU A 100 1.743 8.344 -3.514 1.00 0.00 H new ATOM 0 HB3 GLU A 100 3.146 8.166 -4.549 1.00 0.00 H new ATOM 0 HG2 GLU A 100 2.786 10.517 -4.077 1.00 0.00 H new ATOM 0 HG3 GLU A 100 2.522 10.222 -5.784 1.00 0.00 H new ATOM 814 N MET A 101 0.193 8.714 -7.287 1.00 0.00 N ATOM 815 CA MET A 101 -0.037 9.077 -8.680 1.00 0.00 C ATOM 816 C MET A 101 -0.585 10.490 -8.875 1.00 0.00 C ATOM 817 O MET A 101 -1.092 11.140 -7.969 1.00 0.00 O ATOM 818 CB MET A 101 -0.810 7.966 -9.395 1.00 0.00 C ATOM 819 CG MET A 101 -1.717 7.097 -8.531 1.00 0.00 C ATOM 820 SD MET A 101 -2.747 5.955 -9.473 1.00 0.00 S ATOM 821 CE MET A 101 -1.668 5.506 -10.847 1.00 0.00 C ATOM 0 H MET A 101 -0.604 8.879 -6.672 1.00 0.00 H new ATOM 0 HA MET A 101 0.932 9.146 -9.175 1.00 0.00 H new ATOM 0 HB2 MET A 101 -1.419 8.423 -10.175 1.00 0.00 H new ATOM 0 HB3 MET A 101 -0.090 7.316 -9.893 1.00 0.00 H new ATOM 0 HG2 MET A 101 -1.102 6.527 -7.835 1.00 0.00 H new ATOM 0 HG3 MET A 101 -2.360 7.742 -7.933 1.00 0.00 H new ATOM 0 HE1 MET A 101 -2.110 4.678 -11.401 1.00 0.00 H new ATOM 0 HE2 MET A 101 -1.547 6.363 -11.510 1.00 0.00 H new ATOM 0 HE3 MET A 101 -0.694 5.205 -10.461 1.00 0.00 H new ATOM 831 N ASN A 102 -0.417 10.994 -10.092 1.00 0.00 N ATOM 832 CA ASN A 102 -0.530 12.411 -10.436 1.00 0.00 C ATOM 833 C ASN A 102 -1.966 12.972 -10.419 1.00 0.00 C ATOM 834 O ASN A 102 -2.142 14.189 -10.339 1.00 0.00 O ATOM 835 CB ASN A 102 0.119 12.580 -11.823 1.00 0.00 C ATOM 836 CG ASN A 102 -0.798 12.246 -12.988 1.00 0.00 C ATOM 837 OD1 ASN A 102 -1.427 11.092 -12.985 1.00 0.00 O flip ATOM 838 ND2 ASN A 102 -0.924 13.007 -13.933 1.00 0.00 N flip ATOM 0 H ASN A 102 -0.190 10.409 -10.896 1.00 0.00 H new ATOM 0 HA ASN A 102 -0.021 12.993 -9.667 1.00 0.00 H new ATOM 0 HB2 ASN A 102 0.460 13.610 -11.928 1.00 0.00 H new ATOM 0 HB3 ASN A 102 1.003 11.944 -11.878 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -0.436 13.903 -13.935 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -1.518 12.748 -14.721 1.00 0.00 H new ATOM 845 N THR A 103 -2.984 12.107 -10.517 1.00 0.00 N ATOM 846 CA THR A 103 -4.403 12.479 -10.634 1.00 0.00 C ATOM 847 C THR A 103 -5.282 11.570 -9.768 1.00 0.00 C ATOM 848 O THR A 103 -5.109 10.345 -9.702 1.00 0.00 O ATOM 849 CB THR A 103 -4.920 12.517 -12.095 1.00 0.00 C ATOM 850 OG1 THR A 103 -5.188 11.234 -12.604 1.00 0.00 O ATOM 851 CG2 THR A 103 -3.998 13.198 -13.118 1.00 0.00 C ATOM 0 H THR A 103 -2.840 11.097 -10.517 1.00 0.00 H new ATOM 0 HA THR A 103 -4.474 13.502 -10.263 1.00 0.00 H new ATOM 0 HB THR A 103 -5.824 13.118 -11.991 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.513 11.309 -13.526 1.00 0.00 H new ATOM 0 HG21 THR A 103 -4.462 13.165 -14.104 1.00 0.00 H new ATOM 0 HG22 THR A 103 -3.836 14.236 -12.827 1.00 0.00 H new ATOM 0 HG23 THR A 103 -3.041 12.677 -13.149 1.00 0.00 H new ATOM 859 N GLU A 104 -6.252 12.191 -9.092 1.00 0.00 N ATOM 860 CA GLU A 104 -7.261 11.491 -8.287 1.00 0.00 C ATOM 861 C GLU A 104 -8.071 10.512 -9.143 1.00 0.00 C ATOM 862 O GLU A 104 -8.430 9.434 -8.674 1.00 0.00 O ATOM 863 CB GLU A 104 -8.204 12.509 -7.622 1.00 0.00 C ATOM 864 CG GLU A 104 -7.509 13.414 -6.597 1.00 0.00 C ATOM 865 CD GLU A 104 -8.480 14.488 -6.064 1.00 0.00 C ATOM 866 OE1 GLU A 104 -9.193 14.227 -5.065 1.00 0.00 O ATOM 867 OE2 GLU A 104 -8.535 15.602 -6.640 1.00 0.00 O ATOM 0 H GLU A 104 -6.362 13.205 -9.087 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.742 10.921 -7.516 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.657 13.131 -8.395 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -9.015 11.972 -7.129 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -7.136 12.812 -5.768 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.645 13.895 -7.057 1.00 0.00 H new ATOM 874 N GLU A 105 -8.328 10.857 -10.410 1.00 0.00 N ATOM 875 CA GLU A 105 -9.093 10.018 -11.331 1.00 0.00 C ATOM 876 C GLU A 105 -8.331 8.788 -11.823 1.00 0.00 C ATOM 877 O GLU A 105 -8.935 7.711 -11.871 1.00 0.00 O ATOM 878 CB GLU A 105 -9.574 10.829 -12.544 1.00 0.00 C ATOM 879 CG GLU A 105 -10.609 11.898 -12.174 1.00 0.00 C ATOM 880 CD GLU A 105 -11.085 12.658 -13.428 1.00 0.00 C ATOM 881 OE1 GLU A 105 -10.429 13.654 -13.827 1.00 0.00 O ATOM 882 OE2 GLU A 105 -12.120 12.268 -14.023 1.00 0.00 O ATOM 0 H GLU A 105 -8.008 11.732 -10.825 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.945 9.661 -10.752 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.717 11.308 -13.017 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -10.006 10.151 -13.280 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -11.461 11.430 -11.682 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.175 12.599 -11.461 1.00 0.00 H new ATOM 889 N ALA A 106 -7.029 8.896 -12.128 1.00 0.00 N ATOM 890 CA ALA A 106 -6.205 7.714 -12.370 1.00 0.00 C ATOM 891 C ALA A 106 -6.279 6.790 -11.171 1.00 0.00 C ATOM 892 O ALA A 106 -6.600 5.623 -11.326 1.00 0.00 O ATOM 893 CB ALA A 106 -4.744 8.066 -12.630 1.00 0.00 C ATOM 0 H ALA A 106 -6.533 9.783 -12.211 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.597 7.226 -13.262 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -4.175 7.153 -12.804 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.675 8.709 -13.508 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.336 8.588 -11.765 1.00 0.00 H new ATOM 899 N ALA A 107 -6.019 7.288 -9.964 1.00 0.00 N ATOM 900 CA ALA A 107 -5.999 6.395 -8.815 1.00 0.00 C ATOM 901 C ALA A 107 -7.355 5.814 -8.412 1.00 0.00 C ATOM 902 O ALA A 107 -7.425 4.644 -8.052 1.00 0.00 O ATOM 903 CB ALA A 107 -5.394 7.151 -7.672 1.00 0.00 C ATOM 0 H ALA A 107 -5.826 8.269 -9.762 1.00 0.00 H new ATOM 0 HA ALA A 107 -5.411 5.521 -9.096 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.362 6.512 -6.789 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -4.382 7.458 -7.934 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -5.998 8.033 -7.459 1.00 0.00 H new ATOM 909 N ASN A 108 -8.437 6.583 -8.512 1.00 0.00 N ATOM 910 CA ASN A 108 -9.800 6.075 -8.366 1.00 0.00 C ATOM 911 C ASN A 108 -10.063 4.933 -9.360 1.00 0.00 C ATOM 912 O ASN A 108 -10.426 3.827 -8.946 1.00 0.00 O ATOM 913 CB ASN A 108 -10.765 7.254 -8.534 1.00 0.00 C ATOM 914 CG ASN A 108 -12.221 6.814 -8.480 1.00 0.00 C ATOM 915 OD1 ASN A 108 -12.836 6.491 -9.486 1.00 0.00 O ATOM 916 ND2 ASN A 108 -12.815 6.772 -7.311 1.00 0.00 N ATOM 0 H ASN A 108 -8.392 7.585 -8.698 1.00 0.00 H new ATOM 0 HA ASN A 108 -9.952 5.643 -7.377 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -10.579 7.988 -7.750 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -10.571 7.748 -9.486 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -13.787 6.470 -7.243 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -12.305 7.041 -6.470 1.00 0.00 H new ATOM 923 N THR A 109 -9.794 5.154 -10.650 1.00 0.00 N ATOM 924 CA THR A 109 -9.894 4.089 -11.650 1.00 0.00 C ATOM 925 C THR A 109 -8.925 2.946 -11.344 1.00 0.00 C ATOM 926 O THR A 109 -9.273 1.795 -11.579 1.00 0.00 O ATOM 927 CB THR A 109 -9.760 4.643 -13.085 1.00 0.00 C ATOM 928 OG1 THR A 109 -10.789 4.099 -13.881 1.00 0.00 O ATOM 929 CG2 THR A 109 -8.451 4.348 -13.812 1.00 0.00 C ATOM 0 H THR A 109 -9.506 6.058 -11.025 1.00 0.00 H new ATOM 0 HA THR A 109 -10.894 3.659 -11.591 1.00 0.00 H new ATOM 0 HB THR A 109 -9.808 5.724 -12.956 1.00 0.00 H new ATOM 0 HG1 THR A 109 -10.714 4.446 -14.794 1.00 0.00 H new ATOM 0 HG21 THR A 109 -8.481 4.789 -14.808 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.619 4.774 -13.251 1.00 0.00 H new ATOM 0 HG23 THR A 109 -8.317 3.270 -13.897 1.00 0.00 H new ATOM 937 N MET A 110 -7.750 3.216 -10.751 1.00 0.00 N ATOM 938 CA MET A 110 -6.717 2.217 -10.502 1.00 0.00 C ATOM 939 C MET A 110 -7.097 1.276 -9.359 1.00 0.00 C ATOM 940 O MET A 110 -7.055 0.056 -9.488 1.00 0.00 O ATOM 941 CB MET A 110 -5.318 2.827 -10.227 1.00 0.00 C ATOM 942 CG MET A 110 -4.335 1.768 -10.715 1.00 0.00 C ATOM 943 SD MET A 110 -2.579 2.141 -10.607 1.00 0.00 S ATOM 944 CE MET A 110 -2.452 2.501 -8.853 1.00 0.00 C ATOM 0 H MET A 110 -7.495 4.150 -10.430 1.00 0.00 H new ATOM 0 HA MET A 110 -6.650 1.648 -11.429 1.00 0.00 H new ATOM 0 HB2 MET A 110 -5.184 3.768 -10.760 1.00 0.00 H new ATOM 0 HB3 MET A 110 -5.179 3.039 -9.167 1.00 0.00 H new ATOM 0 HG2 MET A 110 -4.519 0.854 -10.150 1.00 0.00 H new ATOM 0 HG3 MET A 110 -4.568 1.550 -11.757 1.00 0.00 H new ATOM 0 HE1 MET A 110 -1.417 2.737 -8.604 1.00 0.00 H new ATOM 0 HE2 MET A 110 -3.088 3.352 -8.609 1.00 0.00 H new ATOM 0 HE3 MET A 110 -2.774 1.632 -8.279 1.00 0.00 H new ATOM 954 N VAL A 111 -7.503 1.838 -8.225 1.00 0.00 N ATOM 955 CA VAL A 111 -7.937 1.088 -7.045 1.00 0.00 C ATOM 956 C VAL A 111 -9.194 0.259 -7.348 1.00 0.00 C ATOM 957 O VAL A 111 -9.321 -0.861 -6.863 1.00 0.00 O ATOM 958 CB VAL A 111 -8.113 2.070 -5.872 1.00 0.00 C ATOM 959 CG1 VAL A 111 -9.508 2.648 -5.761 1.00 0.00 C ATOM 960 CG2 VAL A 111 -7.747 1.447 -4.530 1.00 0.00 C ATOM 0 H VAL A 111 -7.541 2.849 -8.095 1.00 0.00 H new ATOM 0 HA VAL A 111 -7.178 0.360 -6.757 1.00 0.00 H new ATOM 0 HB VAL A 111 -7.422 2.880 -6.106 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.553 3.330 -4.912 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.751 3.190 -6.675 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.226 1.841 -5.616 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -7.889 2.181 -3.737 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -8.386 0.584 -4.343 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.704 1.130 -4.548 1.00 0.00 H new ATOM 970 N ASN A 112 -10.102 0.778 -8.192 1.00 0.00 N ATOM 971 CA ASN A 112 -11.317 0.084 -8.630 1.00 0.00 C ATOM 972 C ASN A 112 -11.017 -1.003 -9.677 1.00 0.00 C ATOM 973 O ASN A 112 -11.520 -2.120 -9.577 1.00 0.00 O ATOM 974 CB ASN A 112 -12.315 1.112 -9.175 1.00 0.00 C ATOM 975 CG ASN A 112 -13.065 1.829 -8.057 1.00 0.00 C ATOM 976 OD1 ASN A 112 -14.232 1.567 -7.801 1.00 0.00 O ATOM 977 ND2 ASN A 112 -12.430 2.726 -7.338 1.00 0.00 N ATOM 0 H ASN A 112 -10.007 1.710 -8.595 1.00 0.00 H new ATOM 0 HA ASN A 112 -11.751 -0.426 -7.770 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -11.785 1.845 -9.784 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -13.030 0.612 -9.829 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -12.910 3.199 -6.572 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -11.457 2.950 -7.545 1.00 0.00 H new ATOM 984 N TYR A 113 -10.128 -0.717 -10.634 1.00 0.00 N ATOM 985 CA TYR A 113 -9.505 -1.712 -11.514 1.00 0.00 C ATOM 986 C TYR A 113 -8.974 -2.890 -10.682 1.00 0.00 C ATOM 987 O TYR A 113 -9.436 -4.016 -10.815 1.00 0.00 O ATOM 988 CB TYR A 113 -8.424 -1.006 -12.360 1.00 0.00 C ATOM 989 CG TYR A 113 -7.536 -1.917 -13.160 1.00 0.00 C ATOM 990 CD1 TYR A 113 -6.340 -2.406 -12.603 1.00 0.00 C ATOM 991 CD2 TYR A 113 -7.908 -2.256 -14.474 1.00 0.00 C ATOM 992 CE1 TYR A 113 -5.587 -3.343 -13.331 1.00 0.00 C ATOM 993 CE2 TYR A 113 -7.107 -3.131 -15.230 1.00 0.00 C ATOM 994 CZ TYR A 113 -5.946 -3.691 -14.653 1.00 0.00 C ATOM 995 OH TYR A 113 -5.165 -4.546 -15.366 1.00 0.00 O ATOM 0 H TYR A 113 -9.814 0.235 -10.823 1.00 0.00 H new ATOM 0 HA TYR A 113 -10.229 -2.142 -12.206 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -8.916 -0.314 -13.043 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -7.799 -0.409 -11.696 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -6.007 -2.067 -11.633 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -8.810 -1.844 -14.903 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -4.723 -3.803 -12.875 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -7.379 -3.373 -16.247 1.00 0.00 H new ATOM 0 HH TYR A 113 -5.554 -4.680 -16.255 1.00 0.00 H new ATOM 1005 N TYR A 114 -8.165 -2.645 -9.660 1.00 0.00 N ATOM 1006 CA TYR A 114 -7.587 -3.623 -8.746 1.00 0.00 C ATOM 1007 C TYR A 114 -8.559 -4.072 -7.659 1.00 0.00 C ATOM 1008 O TYR A 114 -8.156 -4.708 -6.682 1.00 0.00 O ATOM 1009 CB TYR A 114 -6.316 -3.034 -8.134 1.00 0.00 C ATOM 1010 CG TYR A 114 -5.182 -2.867 -9.103 1.00 0.00 C ATOM 1011 CD1 TYR A 114 -4.816 -3.963 -9.902 1.00 0.00 C ATOM 1012 CD2 TYR A 114 -4.457 -1.663 -9.144 1.00 0.00 C ATOM 1013 CE1 TYR A 114 -3.666 -3.880 -10.698 1.00 0.00 C ATOM 1014 CE2 TYR A 114 -3.332 -1.566 -9.989 1.00 0.00 C ATOM 1015 CZ TYR A 114 -2.941 -2.673 -10.772 1.00 0.00 C ATOM 1016 OH TYR A 114 -1.904 -2.584 -11.639 1.00 0.00 O ATOM 0 H TYR A 114 -7.875 -1.694 -9.432 1.00 0.00 H new ATOM 0 HA TYR A 114 -7.349 -4.520 -9.318 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -6.553 -2.063 -7.699 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -5.988 -3.677 -7.317 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -5.416 -4.861 -9.903 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -4.758 -0.823 -8.536 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -3.334 -4.743 -11.256 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -2.770 -0.645 -10.037 1.00 0.00 H new ATOM 0 HH TYR A 114 -1.582 -1.659 -11.670 1.00 0.00 H new ATOM 1026 N THR A 115 -9.848 -3.796 -7.873 1.00 0.00 N ATOM 1027 CA THR A 115 -10.937 -4.422 -7.124 1.00 0.00 C ATOM 1028 C THR A 115 -11.895 -5.234 -8.008 1.00 0.00 C ATOM 1029 O THR A 115 -12.679 -6.043 -7.511 1.00 0.00 O ATOM 1030 CB THR A 115 -11.608 -3.456 -6.126 1.00 0.00 C ATOM 1031 OG1 THR A 115 -11.854 -4.121 -4.904 1.00 0.00 O ATOM 1032 CG2 THR A 115 -12.933 -2.819 -6.546 1.00 0.00 C ATOM 0 H THR A 115 -10.166 -3.128 -8.575 1.00 0.00 H new ATOM 0 HA THR A 115 -10.483 -5.181 -6.487 1.00 0.00 H new ATOM 0 HB THR A 115 -10.885 -2.643 -6.058 1.00 0.00 H new ATOM 0 HG1 THR A 115 -12.279 -3.502 -4.274 1.00 0.00 H new ATOM 0 HG21 THR A 115 -13.290 -2.165 -5.751 1.00 0.00 H new ATOM 0 HG22 THR A 115 -12.785 -2.237 -7.456 1.00 0.00 H new ATOM 0 HG23 THR A 115 -13.670 -3.601 -6.731 1.00 0.00 H new ATOM 1040 N SER A 116 -11.753 -5.097 -9.331 1.00 0.00 N ATOM 1041 CA SER A 116 -12.256 -6.019 -10.360 1.00 0.00 C ATOM 1042 C SER A 116 -11.277 -7.168 -10.607 1.00 0.00 C ATOM 1043 O SER A 116 -11.671 -8.316 -10.818 1.00 0.00 O ATOM 1044 CB SER A 116 -12.348 -5.272 -11.701 1.00 0.00 C ATOM 1045 OG SER A 116 -13.671 -4.831 -11.977 1.00 0.00 O ATOM 0 H SER A 116 -11.260 -4.301 -9.735 1.00 0.00 H new ATOM 0 HA SER A 116 -13.218 -6.396 -10.012 1.00 0.00 H new ATOM 0 HB2 SER A 116 -11.676 -4.414 -11.684 1.00 0.00 H new ATOM 0 HB3 SER A 116 -12.009 -5.926 -12.504 1.00 0.00 H new ATOM 0 HG SER A 116 -13.686 -4.360 -12.836 1.00 0.00 H new ATOM 1051 N VAL A 117 -9.995 -6.809 -10.673 1.00 0.00 N ATOM 1052 CA VAL A 117 -9.010 -7.423 -11.563 1.00 0.00 C ATOM 1053 C VAL A 117 -7.911 -8.154 -10.781 1.00 0.00 C ATOM 1054 O VAL A 117 -7.729 -9.358 -10.962 1.00 0.00 O ATOM 1055 CB VAL A 117 -8.429 -6.317 -12.473 1.00 0.00 C ATOM 1056 CG1 VAL A 117 -7.359 -6.836 -13.376 1.00 0.00 C ATOM 1057 CG2 VAL A 117 -9.449 -5.693 -13.438 1.00 0.00 C ATOM 0 H VAL A 117 -9.603 -6.065 -10.095 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.494 -8.184 -12.175 1.00 0.00 H new ATOM 0 HB VAL A 117 -8.068 -5.583 -11.753 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -6.981 -6.024 -13.996 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.545 -7.245 -12.778 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -7.769 -7.619 -14.014 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -8.960 -4.927 -14.039 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -9.851 -6.466 -14.093 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -10.261 -5.243 -12.868 1.00 0.00 H new ATOM 1067 N THR A 118 -7.209 -7.424 -9.906 1.00 0.00 N ATOM 1068 CA THR A 118 -6.011 -7.831 -9.128 1.00 0.00 C ATOM 1069 C THR A 118 -4.754 -7.983 -10.023 1.00 0.00 C ATOM 1070 O THR A 118 -4.856 -8.561 -11.106 1.00 0.00 O ATOM 1071 CB THR A 118 -6.271 -9.114 -8.305 1.00 0.00 C ATOM 1072 OG1 THR A 118 -7.505 -9.022 -7.617 1.00 0.00 O ATOM 1073 CG2 THR A 118 -5.226 -9.322 -7.217 1.00 0.00 C ATOM 0 H THR A 118 -7.475 -6.461 -9.701 1.00 0.00 H new ATOM 0 HA THR A 118 -5.808 -7.023 -8.425 1.00 0.00 H new ATOM 0 HB THR A 118 -6.252 -9.932 -9.026 1.00 0.00 H new ATOM 0 HG1 THR A 118 -7.655 -9.843 -7.103 1.00 0.00 H new ATOM 0 HG21 THR A 118 -5.451 -10.235 -6.666 1.00 0.00 H new ATOM 0 HG22 THR A 118 -4.239 -9.406 -7.672 1.00 0.00 H new ATOM 0 HG23 THR A 118 -5.239 -8.473 -6.533 1.00 0.00 H new ATOM 1081 N PRO A 119 -3.561 -7.472 -9.638 1.00 0.00 N ATOM 1082 CA PRO A 119 -2.367 -7.534 -10.495 1.00 0.00 C ATOM 1083 C PRO A 119 -1.684 -8.907 -10.556 1.00 0.00 C ATOM 1084 O PRO A 119 -0.980 -9.183 -11.525 1.00 0.00 O ATOM 1085 CB PRO A 119 -1.401 -6.476 -9.955 1.00 0.00 C ATOM 1086 CG PRO A 119 -1.822 -6.242 -8.508 1.00 0.00 C ATOM 1087 CD PRO A 119 -3.258 -6.756 -8.405 1.00 0.00 C ATOM 0 HA PRO A 119 -2.671 -7.348 -11.525 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -0.369 -6.821 -10.013 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -1.462 -5.555 -10.536 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -1.166 -6.774 -7.819 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -1.766 -5.184 -8.250 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -3.368 -7.414 -7.543 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -3.952 -5.927 -8.263 1.00 0.00 H new ATOM 1095 N VAL A 120 -1.906 -9.753 -9.537 1.00 0.00 N ATOM 1096 CA VAL A 120 -1.460 -11.155 -9.353 1.00 0.00 C ATOM 1097 C VAL A 120 -0.053 -11.422 -9.905 1.00 0.00 C ATOM 1098 O VAL A 120 0.174 -11.768 -11.066 1.00 0.00 O ATOM 1099 CB VAL A 120 -2.472 -12.155 -9.892 1.00 0.00 C ATOM 1100 CG1 VAL A 120 -2.230 -13.544 -9.308 1.00 0.00 C ATOM 1101 CG2 VAL A 120 -3.916 -11.752 -9.583 1.00 0.00 C ATOM 0 H VAL A 120 -2.458 -9.446 -8.736 1.00 0.00 H new ATOM 0 HA VAL A 120 -1.397 -11.302 -8.275 1.00 0.00 H new ATOM 0 HB VAL A 120 -2.334 -12.167 -10.973 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -2.966 -14.241 -9.709 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -1.228 -13.881 -9.575 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -2.322 -13.503 -8.223 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.597 -12.499 -9.990 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -4.052 -11.686 -8.504 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -4.128 -10.783 -10.036 1.00 0.00 H new ATOM 1111 N LEU A 121 0.916 -11.204 -9.027 1.00 0.00 N ATOM 1112 CA LEU A 121 2.121 -10.460 -9.401 1.00 0.00 C ATOM 1113 C LEU A 121 3.265 -11.444 -9.691 1.00 0.00 C ATOM 1114 O LEU A 121 3.652 -11.611 -10.847 1.00 0.00 O ATOM 1115 CB LEU A 121 2.327 -9.363 -8.330 1.00 0.00 C ATOM 1116 CG LEU A 121 3.537 -8.409 -8.494 1.00 0.00 C ATOM 1117 CD1 LEU A 121 3.529 -7.396 -7.345 1.00 0.00 C ATOM 1118 CD2 LEU A 121 4.909 -9.081 -8.485 1.00 0.00 C ATOM 0 H LEU A 121 0.897 -11.526 -8.059 1.00 0.00 H new ATOM 0 HA LEU A 121 2.053 -9.915 -10.343 1.00 0.00 H new ATOM 0 HB2 LEU A 121 1.423 -8.754 -8.296 1.00 0.00 H new ATOM 0 HB3 LEU A 121 2.417 -9.854 -7.361 1.00 0.00 H new ATOM 0 HG LEU A 121 3.409 -7.959 -9.478 1.00 0.00 H new ATOM 0 HD11 LEU A 121 4.377 -6.719 -7.451 1.00 0.00 H new ATOM 0 HD12 LEU A 121 2.602 -6.823 -7.371 1.00 0.00 H new ATOM 0 HD13 LEU A 121 3.602 -7.924 -6.394 1.00 0.00 H new ATOM 0 HD21 LEU A 121 5.685 -8.325 -8.606 1.00 0.00 H new ATOM 0 HD22 LEU A 121 5.053 -9.601 -7.538 1.00 0.00 H new ATOM 0 HD23 LEU A 121 4.969 -9.797 -9.305 1.00 0.00 H new ATOM 1130 N ARG A 122 3.736 -12.173 -8.668 1.00 0.00 N ATOM 1131 CA ARG A 122 4.494 -13.434 -8.844 1.00 0.00 C ATOM 1132 C ARG A 122 3.596 -14.668 -9.015 1.00 0.00 C ATOM 1133 O ARG A 122 4.088 -15.760 -9.294 1.00 0.00 O ATOM 1134 CB ARG A 122 5.515 -13.622 -7.704 1.00 0.00 C ATOM 1135 CG ARG A 122 4.980 -13.741 -6.264 1.00 0.00 C ATOM 1136 CD ARG A 122 4.122 -14.976 -5.950 1.00 0.00 C ATOM 1137 NE ARG A 122 4.353 -15.445 -4.570 1.00 0.00 N ATOM 1138 CZ ARG A 122 3.829 -16.501 -3.971 1.00 0.00 C ATOM 1139 NH1 ARG A 122 2.894 -17.233 -4.503 1.00 0.00 N ATOM 1140 NH2 ARG A 122 4.256 -16.850 -2.793 1.00 0.00 N ATOM 0 H ARG A 122 3.605 -11.909 -7.691 1.00 0.00 H new ATOM 0 HA ARG A 122 5.040 -13.340 -9.783 1.00 0.00 H new ATOM 0 HB2 ARG A 122 6.094 -14.520 -7.920 1.00 0.00 H new ATOM 0 HB3 ARG A 122 6.207 -12.781 -7.734 1.00 0.00 H new ATOM 0 HG2 ARG A 122 5.831 -13.735 -5.583 1.00 0.00 H new ATOM 0 HG3 ARG A 122 4.390 -12.851 -6.045 1.00 0.00 H new ATOM 0 HD2 ARG A 122 3.068 -14.734 -6.084 1.00 0.00 H new ATOM 0 HD3 ARG A 122 4.357 -15.775 -6.653 1.00 0.00 H new ATOM 0 HE ARG A 122 4.996 -14.886 -4.009 1.00 0.00 H new ATOM 0 HH11 ARG A 122 2.530 -17.002 -5.427 1.00 0.00 H new ATOM 0 HH12 ARG A 122 2.526 -18.038 -3.996 1.00 0.00 H new ATOM 0 HH21 ARG A 122 4.991 -16.310 -2.336 1.00 0.00 H new ATOM 0 HH22 ARG A 122 3.856 -17.664 -2.326 1.00 0.00 H new ATOM 1154 N GLY A 123 2.290 -14.500 -8.790 1.00 0.00 N ATOM 1155 CA GLY A 123 1.316 -15.577 -8.616 1.00 0.00 C ATOM 1156 C GLY A 123 0.783 -15.684 -7.183 1.00 0.00 C ATOM 1157 O GLY A 123 0.909 -16.748 -6.573 1.00 0.00 O ATOM 0 H GLY A 123 1.868 -13.574 -8.722 1.00 0.00 H new ATOM 0 HA2 GLY A 123 0.480 -15.415 -9.296 1.00 0.00 H new ATOM 0 HA3 GLY A 123 1.777 -16.524 -8.897 1.00 0.00 H new ATOM 1161 N GLN A 124 0.224 -14.604 -6.612 1.00 0.00 N ATOM 1162 CA GLN A 124 -0.731 -14.685 -5.508 1.00 0.00 C ATOM 1163 C GLN A 124 -1.817 -13.593 -5.572 1.00 0.00 C ATOM 1164 O GLN A 124 -1.607 -12.597 -6.263 1.00 0.00 O ATOM 1165 CB GLN A 124 -0.010 -14.694 -4.148 1.00 0.00 C ATOM 1166 CG GLN A 124 0.440 -13.325 -3.607 1.00 0.00 C ATOM 1167 CD GLN A 124 1.053 -13.440 -2.210 1.00 0.00 C ATOM 1168 OE1 GLN A 124 0.366 -13.513 -1.199 1.00 0.00 O ATOM 1169 NE2 GLN A 124 2.364 -13.473 -2.094 1.00 0.00 N ATOM 0 H GLN A 124 0.426 -13.649 -6.909 1.00 0.00 H new ATOM 0 HA GLN A 124 -1.254 -15.635 -5.617 1.00 0.00 H new ATOM 0 HB2 GLN A 124 -0.672 -15.152 -3.413 1.00 0.00 H new ATOM 0 HB3 GLN A 124 0.868 -15.335 -4.230 1.00 0.00 H new ATOM 0 HG2 GLN A 124 1.169 -12.886 -4.289 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -0.414 -12.648 -3.575 1.00 0.00 H new ATOM 0 HE21 GLN A 124 2.951 -13.413 -2.926 1.00 0.00 H new ATOM 0 HE22 GLN A 124 2.792 -13.558 -1.172 1.00 0.00 H new ATOM 1178 N PRO A 125 -2.957 -13.719 -4.863 1.00 0.00 N ATOM 1179 CA PRO A 125 -3.916 -12.627 -4.682 1.00 0.00 C ATOM 1180 C PRO A 125 -3.282 -11.414 -3.970 1.00 0.00 C ATOM 1181 O PRO A 125 -3.092 -11.416 -2.751 1.00 0.00 O ATOM 1182 CB PRO A 125 -5.091 -13.225 -3.895 1.00 0.00 C ATOM 1183 CG PRO A 125 -4.976 -14.726 -4.148 1.00 0.00 C ATOM 1184 CD PRO A 125 -3.468 -14.935 -4.246 1.00 0.00 C ATOM 0 HA PRO A 125 -4.255 -12.234 -5.641 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -5.020 -12.992 -2.833 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -6.046 -12.833 -4.244 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -5.414 -15.308 -3.337 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -5.486 -15.022 -5.064 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -3.027 -15.093 -3.262 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -3.230 -15.813 -4.847 1.00 0.00 H new ATOM 1192 N ILE A 126 -2.905 -10.388 -4.740 1.00 0.00 N ATOM 1193 CA ILE A 126 -2.331 -9.132 -4.227 1.00 0.00 C ATOM 1194 C ILE A 126 -3.468 -8.264 -3.666 1.00 0.00 C ATOM 1195 O ILE A 126 -4.542 -8.197 -4.263 1.00 0.00 O ATOM 1196 CB ILE A 126 -1.524 -8.371 -5.306 1.00 0.00 C ATOM 1197 CG1 ILE A 126 -0.814 -9.280 -6.336 1.00 0.00 C ATOM 1198 CG2 ILE A 126 -0.505 -7.428 -4.652 1.00 0.00 C ATOM 1199 CD1 ILE A 126 0.162 -10.310 -5.776 1.00 0.00 C ATOM 0 H ILE A 126 -2.990 -10.404 -5.756 1.00 0.00 H new ATOM 0 HA ILE A 126 -1.622 -9.370 -3.434 1.00 0.00 H new ATOM 0 HB ILE A 126 -2.263 -7.800 -5.868 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -1.577 -9.808 -6.908 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -0.274 -8.644 -7.037 1.00 0.00 H new ATOM 0 HG21 ILE A 126 0.053 -6.902 -5.426 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -1.028 -6.705 -4.026 1.00 0.00 H new ATOM 0 HG23 ILE A 126 0.185 -8.007 -4.038 1.00 0.00 H new ATOM 0 HD11 ILE A 126 0.594 -10.885 -6.595 1.00 0.00 H new ATOM 0 HD12 ILE A 126 0.957 -9.800 -5.232 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -0.367 -10.982 -5.100 1.00 0.00 H new ATOM 1211 N TYR A 127 -3.285 -7.609 -2.524 1.00 0.00 N ATOM 1212 CA TYR A 127 -4.355 -6.864 -1.845 1.00 0.00 C ATOM 1213 C TYR A 127 -4.110 -5.355 -1.944 1.00 0.00 C ATOM 1214 O TYR A 127 -3.035 -4.884 -1.581 1.00 0.00 O ATOM 1215 CB TYR A 127 -4.418 -7.288 -0.370 1.00 0.00 C ATOM 1216 CG TYR A 127 -4.950 -8.661 0.007 1.00 0.00 C ATOM 1217 CD1 TYR A 127 -5.350 -9.627 -0.940 1.00 0.00 C ATOM 1218 CD2 TYR A 127 -4.992 -8.983 1.378 1.00 0.00 C ATOM 1219 CE1 TYR A 127 -5.803 -10.892 -0.514 1.00 0.00 C ATOM 1220 CE2 TYR A 127 -5.439 -10.244 1.808 1.00 0.00 C ATOM 1221 CZ TYR A 127 -5.848 -11.206 0.860 1.00 0.00 C ATOM 1222 OH TYR A 127 -6.257 -12.432 1.280 1.00 0.00 O ATOM 0 H TYR A 127 -2.390 -7.576 -2.037 1.00 0.00 H new ATOM 0 HA TYR A 127 -5.304 -7.091 -2.331 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -3.408 -7.211 0.032 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -5.027 -6.550 0.153 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -5.309 -9.397 -1.994 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -4.677 -8.252 2.107 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -6.117 -11.624 -1.243 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -5.469 -10.476 2.862 1.00 0.00 H new ATOM 0 HH TYR A 127 -6.223 -12.471 2.259 1.00 0.00 H new ATOM 1232 N ILE A 128 -5.105 -4.584 -2.389 1.00 0.00 N ATOM 1233 CA ILE A 128 -5.043 -3.120 -2.516 1.00 0.00 C ATOM 1234 C ILE A 128 -6.149 -2.426 -1.701 1.00 0.00 C ATOM 1235 O ILE A 128 -7.246 -2.968 -1.541 1.00 0.00 O ATOM 1236 CB ILE A 128 -5.058 -2.751 -4.032 1.00 0.00 C ATOM 1237 CG1 ILE A 128 -3.686 -2.148 -4.396 1.00 0.00 C ATOM 1238 CG2 ILE A 128 -6.221 -1.829 -4.438 1.00 0.00 C ATOM 1239 CD1 ILE A 128 -3.530 -1.738 -5.865 1.00 0.00 C ATOM 0 H ILE A 128 -6.004 -4.969 -2.680 1.00 0.00 H new ATOM 0 HA ILE A 128 -4.113 -2.748 -2.086 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.232 -3.663 -4.603 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -3.512 -1.273 -3.769 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -2.910 -2.874 -4.152 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -6.162 -1.618 -5.506 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -7.169 -2.320 -4.216 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -6.157 -0.895 -3.880 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -2.534 -1.325 -6.024 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.667 -2.611 -6.503 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.278 -0.986 -6.114 1.00 0.00 H new ATOM 1251 N GLN A 129 -5.878 -1.199 -1.246 1.00 0.00 N ATOM 1252 CA GLN A 129 -6.865 -0.177 -0.865 1.00 0.00 C ATOM 1253 C GLN A 129 -6.229 1.218 -0.917 1.00 0.00 C ATOM 1254 O GLN A 129 -5.010 1.354 -0.843 1.00 0.00 O ATOM 1255 CB GLN A 129 -7.401 -0.440 0.556 1.00 0.00 C ATOM 1256 CG GLN A 129 -8.882 -0.847 0.560 1.00 0.00 C ATOM 1257 CD GLN A 129 -9.299 -1.384 1.924 1.00 0.00 C ATOM 1258 OE1 GLN A 129 -9.165 -0.730 2.950 1.00 0.00 O ATOM 1259 NE2 GLN A 129 -9.782 -2.604 2.007 1.00 0.00 N ATOM 0 H GLN A 129 -4.919 -0.873 -1.127 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.694 -0.226 -1.571 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -6.810 -1.227 1.024 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.273 0.457 1.161 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.499 0.013 0.300 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -9.056 -1.607 -0.202 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -9.901 -3.164 1.163 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -10.038 -2.990 2.916 1.00 0.00 H new ATOM 1268 N PHE A 130 -7.040 2.274 -0.988 1.00 0.00 N ATOM 1269 CA PHE A 130 -6.544 3.648 -0.842 1.00 0.00 C ATOM 1270 C PHE A 130 -5.756 3.852 0.467 1.00 0.00 C ATOM 1271 O PHE A 130 -6.092 3.292 1.518 1.00 0.00 O ATOM 1272 CB PHE A 130 -7.702 4.650 -0.907 1.00 0.00 C ATOM 1273 CG PHE A 130 -8.081 5.160 -2.283 1.00 0.00 C ATOM 1274 CD1 PHE A 130 -7.096 5.674 -3.151 1.00 0.00 C ATOM 1275 CD2 PHE A 130 -9.436 5.235 -2.650 1.00 0.00 C ATOM 1276 CE1 PHE A 130 -7.470 6.235 -4.385 1.00 0.00 C ATOM 1277 CE2 PHE A 130 -9.809 5.824 -3.873 1.00 0.00 C ATOM 1278 CZ PHE A 130 -8.823 6.326 -4.738 1.00 0.00 C ATOM 0 H PHE A 130 -8.045 2.207 -1.146 1.00 0.00 H new ATOM 0 HA PHE A 130 -5.860 3.824 -1.673 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -8.581 4.184 -0.462 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -7.446 5.507 -0.284 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -6.054 5.637 -2.868 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -10.194 4.839 -1.991 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -6.712 6.597 -5.063 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -10.852 5.890 -4.146 1.00 0.00 H new ATOM 0 HZ PHE A 130 -9.107 6.782 -5.675 1.00 0.00 H new ATOM 1288 N SER A 131 -4.710 4.681 0.410 1.00 0.00 N ATOM 1289 CA SER A 131 -3.952 5.076 1.596 1.00 0.00 C ATOM 1290 C SER A 131 -4.739 6.072 2.456 1.00 0.00 C ATOM 1291 O SER A 131 -5.495 6.898 1.937 1.00 0.00 O ATOM 1292 CB SER A 131 -2.581 5.630 1.210 1.00 0.00 C ATOM 1293 OG SER A 131 -1.921 6.227 2.306 1.00 0.00 O ATOM 0 H SER A 131 -4.367 5.095 -0.457 1.00 0.00 H new ATOM 0 HA SER A 131 -3.790 4.184 2.201 1.00 0.00 H new ATOM 0 HB2 SER A 131 -1.964 4.825 0.811 1.00 0.00 H new ATOM 0 HB3 SER A 131 -2.699 6.365 0.414 1.00 0.00 H new ATOM 0 HG SER A 131 -1.048 6.566 2.017 1.00 0.00 H new ATOM 1299 N ASN A 132 -4.547 6.004 3.777 1.00 0.00 N ATOM 1300 CA ASN A 132 -5.148 6.939 4.729 1.00 0.00 C ATOM 1301 C ASN A 132 -4.395 8.291 4.846 1.00 0.00 C ATOM 1302 O ASN A 132 -4.924 9.226 5.455 1.00 0.00 O ATOM 1303 CB ASN A 132 -5.347 6.226 6.081 1.00 0.00 C ATOM 1304 CG ASN A 132 -4.052 5.942 6.825 1.00 0.00 C ATOM 1305 OD1 ASN A 132 -3.460 6.822 7.436 1.00 0.00 O ATOM 1306 ND2 ASN A 132 -3.583 4.713 6.822 1.00 0.00 N ATOM 0 H ASN A 132 -3.965 5.292 4.218 1.00 0.00 H new ATOM 0 HA ASN A 132 -6.125 7.232 4.344 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -5.990 6.839 6.712 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -5.870 5.285 5.911 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -2.726 4.493 7.329 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -4.077 3.980 6.313 1.00 0.00 H new ATOM 1313 N HIS A 133 -3.204 8.430 4.250 1.00 0.00 N ATOM 1314 CA HIS A 133 -2.449 9.697 4.181 1.00 0.00 C ATOM 1315 C HIS A 133 -2.908 10.599 3.014 1.00 0.00 C ATOM 1316 O HIS A 133 -3.799 10.248 2.236 1.00 0.00 O ATOM 1317 CB HIS A 133 -0.940 9.403 4.075 1.00 0.00 C ATOM 1318 CG HIS A 133 -0.422 8.560 5.214 1.00 0.00 C ATOM 1319 ND1 HIS A 133 -0.195 8.947 6.519 1.00 0.00 N ATOM 1320 CD2 HIS A 133 -0.144 7.228 5.133 1.00 0.00 C ATOM 1321 CE1 HIS A 133 0.216 7.861 7.203 1.00 0.00 C ATOM 1322 NE2 HIS A 133 0.290 6.796 6.390 1.00 0.00 N ATOM 0 H HIS A 133 -2.726 7.654 3.793 1.00 0.00 H new ATOM 0 HA HIS A 133 -2.651 10.247 5.100 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -0.740 8.893 3.133 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -0.393 10.345 4.050 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -0.242 6.613 4.251 1.00 0.00 H new ATOM 0 HE1 HIS A 133 0.452 7.849 8.257 1.00 0.00 H new ATOM 0 HE2 HIS A 133 0.601 5.857 6.640 1.00 0.00 H new ATOM 1330 N LYS A 134 -2.273 11.770 2.886 1.00 0.00 N ATOM 1331 CA LYS A 134 -2.420 12.737 1.786 1.00 0.00 C ATOM 1332 C LYS A 134 -1.117 12.815 0.985 1.00 0.00 C ATOM 1333 O LYS A 134 -0.183 13.514 1.383 1.00 0.00 O ATOM 1334 CB LYS A 134 -2.856 14.110 2.337 1.00 0.00 C ATOM 1335 CG LYS A 134 -4.254 14.108 2.979 1.00 0.00 C ATOM 1336 CD LYS A 134 -5.385 13.972 1.949 1.00 0.00 C ATOM 1337 CE LYS A 134 -6.730 13.877 2.669 1.00 0.00 C ATOM 1338 NZ LYS A 134 -7.859 13.825 1.707 1.00 0.00 N ATOM 0 H LYS A 134 -1.604 12.089 3.587 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.203 12.404 1.105 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -2.128 14.442 3.077 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -2.840 14.838 1.526 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -4.319 13.287 3.693 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -4.391 15.031 3.542 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -5.382 14.829 1.276 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -5.227 13.085 1.336 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -6.745 12.987 3.298 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -6.852 14.736 3.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -8.757 13.761 2.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -7.858 14.686 1.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -7.755 12.992 1.094 1.00 0.00 H new ATOM 1352 N GLU A 135 -1.058 12.081 -0.128 1.00 0.00 N ATOM 1353 CA GLU A 135 0.091 11.936 -1.018 1.00 0.00 C ATOM 1354 C GLU A 135 1.317 11.314 -0.308 1.00 0.00 C ATOM 1355 O GLU A 135 1.239 10.838 0.830 1.00 0.00 O ATOM 1356 CB GLU A 135 0.384 13.253 -1.773 1.00 0.00 C ATOM 1357 CG GLU A 135 -0.801 13.789 -2.596 1.00 0.00 C ATOM 1358 CD GLU A 135 -1.832 14.586 -1.767 1.00 0.00 C ATOM 1359 OE1 GLU A 135 -1.517 15.725 -1.345 1.00 0.00 O ATOM 1360 OE2 GLU A 135 -2.972 14.102 -1.571 1.00 0.00 O ATOM 0 H GLU A 135 -1.861 11.540 -0.450 1.00 0.00 H new ATOM 0 HA GLU A 135 -0.168 11.208 -1.787 1.00 0.00 H new ATOM 0 HB2 GLU A 135 0.683 14.013 -1.051 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.232 13.095 -2.439 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -0.418 14.428 -3.392 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -1.306 12.950 -3.076 1.00 0.00 H new ATOM 1367 N LEU A 136 2.443 11.241 -1.019 1.00 0.00 N ATOM 1368 CA LEU A 136 3.662 10.524 -0.644 1.00 0.00 C ATOM 1369 C LEU A 136 4.907 11.383 -0.906 1.00 0.00 C ATOM 1370 O LEU A 136 5.398 11.465 -2.038 1.00 0.00 O ATOM 1371 CB LEU A 136 3.669 9.192 -1.405 1.00 0.00 C ATOM 1372 CG LEU A 136 4.941 8.350 -1.281 1.00 0.00 C ATOM 1373 CD1 LEU A 136 5.302 8.062 0.165 1.00 0.00 C ATOM 1374 CD2 LEU A 136 4.738 7.040 -2.027 1.00 0.00 C ATOM 0 H LEU A 136 2.534 11.707 -1.922 1.00 0.00 H new ATOM 0 HA LEU A 136 3.682 10.314 0.425 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.827 8.594 -1.057 1.00 0.00 H new ATOM 0 HB3 LEU A 136 3.497 9.400 -2.461 1.00 0.00 H new ATOM 0 HG LEU A 136 5.765 8.918 -1.713 1.00 0.00 H new ATOM 0 HD11 LEU A 136 6.211 7.462 0.200 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.466 9.001 0.693 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.488 7.516 0.641 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.639 6.431 -1.945 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.896 6.501 -1.593 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.534 7.247 -3.078 1.00 0.00 H new ATOM 1386 N LYS A 137 5.422 12.012 0.155 1.00 0.00 N ATOM 1387 CA LYS A 137 6.648 12.819 0.161 1.00 0.00 C ATOM 1388 C LYS A 137 7.823 11.987 0.690 1.00 0.00 C ATOM 1389 O LYS A 137 7.871 11.621 1.865 1.00 0.00 O ATOM 1390 CB LYS A 137 6.411 14.106 0.972 1.00 0.00 C ATOM 1391 CG LYS A 137 7.536 15.128 0.755 1.00 0.00 C ATOM 1392 CD LYS A 137 7.250 16.434 1.513 1.00 0.00 C ATOM 1393 CE LYS A 137 8.335 17.497 1.287 1.00 0.00 C ATOM 1394 NZ LYS A 137 8.259 18.109 -0.066 1.00 0.00 N ATOM 0 H LYS A 137 4.978 11.972 1.072 1.00 0.00 H new ATOM 0 HA LYS A 137 6.909 13.119 -0.854 1.00 0.00 H new ATOM 0 HB2 LYS A 137 5.457 14.548 0.683 1.00 0.00 H new ATOM 0 HB3 LYS A 137 6.341 13.861 2.032 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.483 14.708 1.093 1.00 0.00 H new ATOM 0 HG3 LYS A 137 7.641 15.337 -0.310 1.00 0.00 H new ATOM 0 HD2 LYS A 137 6.286 16.831 1.195 1.00 0.00 H new ATOM 0 HD3 LYS A 137 7.171 16.221 2.579 1.00 0.00 H new ATOM 0 HE2 LYS A 137 8.237 18.278 2.041 1.00 0.00 H new ATOM 0 HE3 LYS A 137 9.317 17.044 1.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 9.012 18.819 -0.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 8.379 17.370 -0.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 7.333 18.566 -0.189 1.00 0.00 H new