USER MOD reduce.3.24.130724 H: found=0, std=0, add=942, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 943 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 8 LYS NZ :NH3+ 178:sc= -1.04 (180deg=-1.06) USER MOD Set 1.2: A 35 THR OG1 : rot 180:sc= 0 USER MOD Set 1.3: A 50 ASN : amide:sc= -3.56! C(o=-4.6!,f=-5.9!) USER MOD Single : A 15 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= -0.251 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 27 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 28 GLN : amide:sc= -0.339 K(o=-0.34,f=-3.2!) USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 GLN : amide:sc=-0.00753 X(o=-0.0075,f=0) USER MOD Single : A 42 GLN : amide:sc= -0.0052 K(o=-0.0052,f=-0.82) USER MOD Single : A 44 MET CE :methyl -153:sc= -0.594 (180deg=-1.18) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 MET CE :methyl 165:sc= -9.29! (180deg=-12!) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 HIS : no HE2:sc= -10.8! C(o=-11!,f=-17!) USER MOD Single : A 53 HIS : no HD1:sc= -1.49! C(o=-1.5!,f=-2.8!) USER MOD Single : A 57 SER OG : rot 180:sc= -0.938! USER MOD Single : A 60 ASN : amide:sc= -16.3! C(o=-16!,f=-20!) USER MOD Single : A 61 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 MET CE :methyl 172:sc= -2.17! (180deg=-2.43!) USER MOD Single : A 71 GLN : amide:sc=-0.00641 X(o=-0.0064,f=-0.26) USER MOD Single : A 76 ASN : amide:sc= -0.451 K(o=-0.45,f=-2.8!) USER MOD Single : A 79 THR OG1 : rot 140:sc= -1.66! USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 180:sc= -0.638! USER MOD Single : A 90 GLN : amide:sc= -0.375 K(o=-0.37,f=-3!) USER MOD Single : A 97 GLN : amide:sc= -0.124 X(o=-0.12,f=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 ASN : amide:sc= -1.03 K(o=-1,f=-0.1) USER MOD Single : A 106 ASN : amide:sc= -0.368 X(o=-0.37,f=-0.28) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0.0652 USER MOD Single : A 116 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.208) USER MOD Single : A 117 MET CE :methyl 143:sc= -0.147 (180deg=-0.301) USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 95 N ILE A 7 -2.755 -9.402 -10.296 1.00 0.00 N ATOM 96 CA ILE A 7 -2.579 -8.120 -9.633 1.00 0.00 C ATOM 97 C ILE A 7 -3.752 -7.877 -8.682 1.00 0.00 C ATOM 98 O ILE A 7 -4.897 -8.182 -9.011 1.00 0.00 O ATOM 99 CB ILE A 7 -2.383 -7.007 -10.664 1.00 0.00 C ATOM 100 CG1 ILE A 7 -1.326 -7.397 -11.698 1.00 0.00 C ATOM 101 CG2 ILE A 7 -2.051 -5.679 -9.980 1.00 0.00 C ATOM 102 CD1 ILE A 7 -1.978 -7.978 -12.956 1.00 0.00 C ATOM 0 HA ILE A 7 -1.673 -8.126 -9.027 1.00 0.00 H new ATOM 0 HB ILE A 7 -3.322 -6.869 -11.200 1.00 0.00 H new ATOM 0 HG12 ILE A 7 -0.731 -6.523 -11.963 1.00 0.00 H new ATOM 0 HG13 ILE A 7 -0.643 -8.129 -11.267 1.00 0.00 H new ATOM 0 HG21 ILE A 7 -1.917 -4.904 -10.735 1.00 0.00 H new ATOM 0 HG22 ILE A 7 -2.867 -5.399 -9.314 1.00 0.00 H new ATOM 0 HG23 ILE A 7 -1.133 -5.787 -9.403 1.00 0.00 H new ATOM 0 HD11 ILE A 7 -1.205 -8.247 -13.675 1.00 0.00 H new ATOM 0 HD12 ILE A 7 -2.552 -8.866 -12.691 1.00 0.00 H new ATOM 0 HD13 ILE A 7 -2.642 -7.235 -13.398 1.00 0.00 H new ATOM 114 N LYS A 8 -3.426 -7.331 -7.519 1.00 0.00 N ATOM 115 CA LYS A 8 -4.439 -7.043 -6.517 1.00 0.00 C ATOM 116 C LYS A 8 -4.002 -5.834 -5.690 1.00 0.00 C ATOM 117 O LYS A 8 -2.826 -5.697 -5.356 1.00 0.00 O ATOM 118 CB LYS A 8 -4.732 -8.290 -5.678 1.00 0.00 C ATOM 119 CG LYS A 8 -6.128 -8.838 -5.980 1.00 0.00 C ATOM 120 CD LYS A 8 -7.211 -7.919 -5.416 1.00 0.00 C ATOM 121 CE LYS A 8 -7.132 -7.849 -3.890 1.00 0.00 C ATOM 122 NZ LYS A 8 -8.385 -8.346 -3.281 1.00 0.00 N ATOM 0 H LYS A 8 -2.475 -7.081 -7.248 1.00 0.00 H new ATOM 0 HA LYS A 8 -5.383 -6.779 -6.994 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -3.984 -9.056 -5.885 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -4.654 -8.046 -4.618 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -6.257 -8.940 -7.058 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -6.232 -9.835 -5.551 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -7.099 -6.919 -5.836 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -8.194 -8.282 -5.716 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -6.289 -8.443 -3.536 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -6.952 -6.821 -3.576 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -8.300 -8.323 -2.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -9.178 -7.742 -3.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -8.559 -9.323 -3.592 1.00 0.00 H new ATOM 136 N VAL A 9 -4.973 -4.986 -5.380 1.00 0.00 N ATOM 137 CA VAL A 9 -4.704 -3.792 -4.598 1.00 0.00 C ATOM 138 C VAL A 9 -5.636 -3.760 -3.386 1.00 0.00 C ATOM 139 O VAL A 9 -6.834 -4.011 -3.514 1.00 0.00 O ATOM 140 CB VAL A 9 -4.827 -2.549 -5.481 1.00 0.00 C ATOM 141 CG1 VAL A 9 -3.450 -2.051 -5.924 1.00 0.00 C ATOM 142 CG2 VAL A 9 -5.727 -2.821 -6.688 1.00 0.00 C ATOM 0 H VAL A 9 -5.948 -5.103 -5.657 1.00 0.00 H new ATOM 0 HA VAL A 9 -3.682 -3.805 -4.220 1.00 0.00 H new ATOM 0 HB VAL A 9 -5.292 -1.762 -4.887 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -3.567 -1.167 -6.550 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -2.855 -1.798 -5.046 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -2.945 -2.833 -6.491 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -5.798 -1.921 -7.299 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -5.304 -3.631 -7.282 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -6.722 -3.105 -6.344 1.00 0.00 H new ATOM 152 N LEU A 10 -5.052 -3.449 -2.238 1.00 0.00 N ATOM 153 CA LEU A 10 -5.817 -3.382 -1.004 1.00 0.00 C ATOM 154 C LEU A 10 -5.819 -1.941 -0.489 1.00 0.00 C ATOM 155 O LEU A 10 -4.761 -1.367 -0.235 1.00 0.00 O ATOM 156 CB LEU A 10 -5.287 -4.397 0.011 1.00 0.00 C ATOM 157 CG LEU A 10 -5.220 -3.921 1.463 1.00 0.00 C ATOM 158 CD1 LEU A 10 -3.996 -3.031 1.692 1.00 0.00 C ATOM 159 CD2 LEU A 10 -6.519 -3.224 1.873 1.00 0.00 C ATOM 0 H LEU A 10 -4.059 -3.241 -2.136 1.00 0.00 H new ATOM 0 HA LEU A 10 -6.856 -3.659 -1.184 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -5.917 -5.285 -0.031 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.287 -4.701 -0.297 1.00 0.00 H new ATOM 0 HG LEU A 10 -5.108 -4.796 2.104 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -3.972 -2.706 2.732 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.090 -3.593 1.466 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -4.053 -2.159 1.041 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -6.444 -2.896 2.910 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -6.687 -2.360 1.230 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -7.352 -3.919 1.772 1.00 0.00 H new ATOM 171 N ILE A 11 -7.020 -1.398 -0.351 1.00 0.00 N ATOM 172 CA ILE A 11 -7.174 -0.036 0.129 1.00 0.00 C ATOM 173 C ILE A 11 -7.918 -0.051 1.465 1.00 0.00 C ATOM 174 O ILE A 11 -9.147 0.009 1.498 1.00 0.00 O ATOM 175 CB ILE A 11 -7.843 0.836 -0.937 1.00 0.00 C ATOM 176 CG1 ILE A 11 -9.121 0.178 -1.459 1.00 0.00 C ATOM 177 CG2 ILE A 11 -6.865 1.167 -2.067 1.00 0.00 C ATOM 178 CD1 ILE A 11 -8.818 -0.756 -2.633 1.00 0.00 C ATOM 0 H ILE A 11 -7.895 -1.877 -0.563 1.00 0.00 H new ATOM 0 HA ILE A 11 -6.199 0.415 0.312 1.00 0.00 H new ATOM 0 HB ILE A 11 -8.132 1.780 -0.475 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -9.599 -0.384 -0.656 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -9.827 0.946 -1.774 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -7.365 1.787 -2.811 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -6.009 1.706 -1.661 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -6.523 0.244 -2.535 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -9.744 -1.211 -2.985 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -8.363 -0.186 -3.443 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -8.131 -1.537 -2.308 1.00 0.00 H new ATOM 190 N VAL A 12 -7.143 -0.132 2.537 1.00 0.00 N ATOM 191 CA VAL A 12 -7.713 -0.156 3.873 1.00 0.00 C ATOM 192 C VAL A 12 -7.110 0.981 4.701 1.00 0.00 C ATOM 193 O VAL A 12 -5.905 1.220 4.648 1.00 0.00 O ATOM 194 CB VAL A 12 -7.504 -1.533 4.507 1.00 0.00 C ATOM 195 CG1 VAL A 12 -6.054 -1.713 4.961 1.00 0.00 C ATOM 196 CG2 VAL A 12 -8.475 -1.756 5.668 1.00 0.00 C ATOM 0 H VAL A 12 -6.125 -0.182 2.507 1.00 0.00 H new ATOM 0 HA VAL A 12 -8.790 0.008 3.831 1.00 0.00 H new ATOM 0 HB VAL A 12 -7.713 -2.287 3.748 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -5.933 -2.700 5.408 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -5.390 -1.619 4.102 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -5.806 -0.948 5.697 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -8.305 -2.742 6.100 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -8.313 -0.993 6.429 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -9.500 -1.692 5.303 1.00 0.00 H new ATOM 206 N ASP A 13 -7.976 1.651 5.447 1.00 0.00 N ATOM 207 CA ASP A 13 -7.543 2.756 6.286 1.00 0.00 C ATOM 208 C ASP A 13 -8.414 2.808 7.543 1.00 0.00 C ATOM 209 O ASP A 13 -9.408 2.090 7.644 1.00 0.00 O ATOM 210 CB ASP A 13 -7.690 4.091 5.554 1.00 0.00 C ATOM 211 CG ASP A 13 -7.107 4.122 4.140 1.00 0.00 C ATOM 212 OD1 ASP A 13 -7.376 3.154 3.394 1.00 0.00 O ATOM 213 OD2 ASP A 13 -6.407 5.111 3.835 1.00 0.00 O ATOM 0 H ASP A 13 -8.975 1.450 5.488 1.00 0.00 H new ATOM 0 HA ASP A 13 -6.495 2.597 6.541 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -8.749 4.343 5.500 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -7.207 4.868 6.147 1.00 0.00 H new ATOM 218 N ASP A 14 -8.008 3.664 8.469 1.00 0.00 N ATOM 219 CA ASP A 14 -8.737 3.818 9.716 1.00 0.00 C ATOM 220 C ASP A 14 -10.025 4.603 9.454 1.00 0.00 C ATOM 221 O ASP A 14 -10.983 4.504 10.219 1.00 0.00 O ATOM 222 CB ASP A 14 -7.912 4.593 10.745 1.00 0.00 C ATOM 223 CG ASP A 14 -8.068 4.117 12.191 1.00 0.00 C ATOM 224 OD1 ASP A 14 -8.068 2.882 12.384 1.00 0.00 O ATOM 225 OD2 ASP A 14 -8.185 4.998 13.069 1.00 0.00 O ATOM 0 H ASP A 14 -7.184 4.258 8.381 1.00 0.00 H new ATOM 0 HA ASP A 14 -8.955 2.823 10.105 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -6.860 4.527 10.468 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -8.190 5.646 10.693 1.00 0.00 H new ATOM 230 N GLN A 15 -10.006 5.364 8.370 1.00 0.00 N ATOM 231 CA GLN A 15 -11.159 6.165 7.998 1.00 0.00 C ATOM 232 C GLN A 15 -11.364 6.129 6.482 1.00 0.00 C ATOM 233 O GLN A 15 -10.401 6.207 5.720 1.00 0.00 O ATOM 234 CB GLN A 15 -11.013 7.604 8.497 1.00 0.00 C ATOM 235 CG GLN A 15 -12.307 8.093 9.150 1.00 0.00 C ATOM 236 CD GLN A 15 -12.011 8.895 10.418 1.00 0.00 C ATOM 237 OE1 GLN A 15 -11.790 8.354 11.489 1.00 0.00 O ATOM 238 NE2 GLN A 15 -12.020 10.213 10.239 1.00 0.00 N ATOM 0 H GLN A 15 -9.210 5.443 7.737 1.00 0.00 H new ATOM 0 HA GLN A 15 -12.041 5.738 8.475 1.00 0.00 H new ATOM 0 HB2 GLN A 15 -10.195 7.662 9.215 1.00 0.00 H new ATOM 0 HB3 GLN A 15 -10.753 8.257 7.664 1.00 0.00 H new ATOM 0 HG2 GLN A 15 -12.863 8.712 8.446 1.00 0.00 H new ATOM 0 HG3 GLN A 15 -12.940 7.240 9.394 1.00 0.00 H new ATOM 0 HE21 GLN A 15 -12.212 10.601 9.315 1.00 0.00 H new ATOM 0 HE22 GLN A 15 -11.835 10.836 11.025 1.00 0.00 H new ATOM 247 N VAL A 16 -12.623 6.009 6.089 1.00 0.00 N ATOM 248 CA VAL A 16 -12.967 5.961 4.678 1.00 0.00 C ATOM 249 C VAL A 16 -12.299 7.133 3.956 1.00 0.00 C ATOM 250 O VAL A 16 -11.607 6.936 2.957 1.00 0.00 O ATOM 251 CB VAL A 16 -14.488 5.944 4.510 1.00 0.00 C ATOM 252 CG1 VAL A 16 -15.018 4.510 4.459 1.00 0.00 C ATOM 253 CG2 VAL A 16 -15.171 6.742 5.622 1.00 0.00 C ATOM 0 H VAL A 16 -13.419 5.943 6.724 1.00 0.00 H new ATOM 0 HA VAL A 16 -12.593 5.043 4.224 1.00 0.00 H new ATOM 0 HB VAL A 16 -14.726 6.423 3.560 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -16.101 4.527 4.339 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -14.568 3.985 3.616 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -14.763 3.995 5.385 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -16.251 6.714 5.479 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -14.921 6.305 6.589 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -14.828 7.776 5.591 1.00 0.00 H new ATOM 263 N THR A 17 -12.527 8.323 4.488 1.00 0.00 N ATOM 264 CA THR A 17 -11.956 9.526 3.906 1.00 0.00 C ATOM 265 C THR A 17 -10.536 9.253 3.406 1.00 0.00 C ATOM 266 O THR A 17 -10.217 9.528 2.249 1.00 0.00 O ATOM 267 CB THR A 17 -12.028 10.638 4.954 1.00 0.00 C ATOM 268 OG1 THR A 17 -11.257 10.140 6.043 1.00 0.00 O ATOM 269 CG2 THR A 17 -13.434 10.804 5.537 1.00 0.00 C ATOM 0 H THR A 17 -13.100 8.481 5.317 1.00 0.00 H new ATOM 0 HA THR A 17 -12.519 9.848 3.030 1.00 0.00 H new ATOM 0 HB THR A 17 -11.707 11.579 4.507 1.00 0.00 H new ATOM 0 HG1 THR A 17 -11.249 10.800 6.767 1.00 0.00 H new ATOM 0 HG21 THR A 17 -13.429 11.606 6.275 1.00 0.00 H new ATOM 0 HG22 THR A 17 -14.133 11.051 4.738 1.00 0.00 H new ATOM 0 HG23 THR A 17 -13.742 9.874 6.014 1.00 0.00 H new ATOM 277 N SER A 18 -9.720 8.717 4.302 1.00 0.00 N ATOM 278 CA SER A 18 -8.341 8.404 3.966 1.00 0.00 C ATOM 279 C SER A 18 -8.299 7.328 2.880 1.00 0.00 C ATOM 280 O SER A 18 -7.659 7.511 1.845 1.00 0.00 O ATOM 281 CB SER A 18 -7.565 7.943 5.201 1.00 0.00 C ATOM 282 OG SER A 18 -7.427 8.984 6.164 1.00 0.00 O ATOM 0 H SER A 18 -9.987 8.492 5.260 1.00 0.00 H new ATOM 0 HA SER A 18 -7.866 9.310 3.589 1.00 0.00 H new ATOM 0 HB2 SER A 18 -8.077 7.095 5.655 1.00 0.00 H new ATOM 0 HB3 SER A 18 -6.577 7.595 4.899 1.00 0.00 H new ATOM 0 HG SER A 18 -6.928 8.650 6.938 1.00 0.00 H new ATOM 288 N ARG A 19 -8.987 6.229 3.152 1.00 0.00 N ATOM 289 CA ARG A 19 -9.037 5.124 2.210 1.00 0.00 C ATOM 290 C ARG A 19 -9.732 5.557 0.918 1.00 0.00 C ATOM 291 O ARG A 19 -9.087 5.712 -0.117 1.00 0.00 O ATOM 292 CB ARG A 19 -9.780 3.926 2.805 1.00 0.00 C ATOM 293 CG ARG A 19 -9.540 2.664 1.973 1.00 0.00 C ATOM 294 CD ARG A 19 -10.505 2.597 0.788 1.00 0.00 C ATOM 295 NE ARG A 19 -11.892 2.421 1.273 1.00 0.00 N ATOM 296 CZ ARG A 19 -12.853 1.791 0.586 1.00 0.00 C ATOM 297 NH1 ARG A 19 -12.585 1.272 -0.620 1.00 0.00 N ATOM 298 NH2 ARG A 19 -14.083 1.678 1.104 1.00 0.00 N ATOM 0 H ARG A 19 -9.515 6.080 4.012 1.00 0.00 H new ATOM 0 HA ARG A 19 -8.011 4.829 1.992 1.00 0.00 H new ATOM 0 HB2 ARG A 19 -9.447 3.759 3.829 1.00 0.00 H new ATOM 0 HB3 ARG A 19 -10.848 4.140 2.848 1.00 0.00 H new ATOM 0 HG2 ARG A 19 -8.512 2.653 1.611 1.00 0.00 H new ATOM 0 HG3 ARG A 19 -9.666 1.781 2.600 1.00 0.00 H new ATOM 0 HD2 ARG A 19 -10.431 3.509 0.196 1.00 0.00 H new ATOM 0 HD3 ARG A 19 -10.232 1.769 0.133 1.00 0.00 H new ATOM 0 HE ARG A 19 -12.131 2.804 2.188 1.00 0.00 H new ATOM 0 HH11 ARG A 19 -11.648 1.357 -1.015 1.00 0.00 H new ATOM 0 HH12 ARG A 19 -13.318 0.792 -1.143 1.00 0.00 H new ATOM 0 HH21 ARG A 19 -14.288 2.072 2.022 1.00 0.00 H new ATOM 0 HH22 ARG A 19 -14.815 1.198 0.580 1.00 0.00 H new ATOM 312 N LEU A 20 -11.041 5.741 1.021 1.00 0.00 N ATOM 313 CA LEU A 20 -11.831 6.153 -0.126 1.00 0.00 C ATOM 314 C LEU A 20 -11.041 7.177 -0.943 1.00 0.00 C ATOM 315 O LEU A 20 -11.182 7.247 -2.163 1.00 0.00 O ATOM 316 CB LEU A 20 -13.206 6.653 0.323 1.00 0.00 C ATOM 317 CG LEU A 20 -13.531 8.110 -0.012 1.00 0.00 C ATOM 318 CD1 LEU A 20 -14.947 8.473 0.439 1.00 0.00 C ATOM 319 CD2 LEU A 20 -12.482 9.056 0.576 1.00 0.00 C ATOM 0 H LEU A 20 -11.573 5.612 1.881 1.00 0.00 H new ATOM 0 HA LEU A 20 -12.024 5.303 -0.781 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -13.967 6.018 -0.130 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -13.283 6.523 1.402 1.00 0.00 H new ATOM 0 HG LEU A 20 -13.498 8.227 -1.095 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -15.153 9.514 0.189 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -15.666 7.829 -0.067 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -15.032 8.335 1.517 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -12.737 10.085 0.323 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -12.458 8.944 1.660 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -11.502 8.814 0.165 1.00 0.00 H new ATOM 331 N LEU A 21 -10.225 7.948 -0.237 1.00 0.00 N ATOM 332 CA LEU A 21 -9.412 8.965 -0.882 1.00 0.00 C ATOM 333 C LEU A 21 -8.363 8.289 -1.768 1.00 0.00 C ATOM 334 O LEU A 21 -8.236 8.618 -2.946 1.00 0.00 O ATOM 335 CB LEU A 21 -8.816 9.914 0.159 1.00 0.00 C ATOM 336 CG LEU A 21 -9.661 11.141 0.508 1.00 0.00 C ATOM 337 CD1 LEU A 21 -9.227 11.742 1.848 1.00 0.00 C ATOM 338 CD2 LEU A 21 -9.622 12.172 -0.621 1.00 0.00 C ATOM 0 H LEU A 21 -10.110 7.888 0.775 1.00 0.00 H new ATOM 0 HA LEU A 21 -10.027 9.587 -1.533 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -8.634 9.350 1.074 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -7.846 10.256 -0.203 1.00 0.00 H new ATOM 0 HG LEU A 21 -10.698 10.822 0.618 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -9.843 12.613 2.073 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -9.348 10.999 2.636 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -8.181 12.043 1.790 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -10.231 13.034 -0.348 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -8.593 12.492 -0.786 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -10.015 11.726 -1.535 1.00 0.00 H new ATOM 350 N LEU A 22 -7.642 7.354 -1.167 1.00 0.00 N ATOM 351 CA LEU A 22 -6.609 6.628 -1.886 1.00 0.00 C ATOM 352 C LEU A 22 -7.265 5.677 -2.889 1.00 0.00 C ATOM 353 O LEU A 22 -6.842 5.594 -4.041 1.00 0.00 O ATOM 354 CB LEU A 22 -5.662 5.933 -0.908 1.00 0.00 C ATOM 355 CG LEU A 22 -6.318 5.005 0.117 1.00 0.00 C ATOM 356 CD1 LEU A 22 -6.847 3.735 -0.554 1.00 0.00 C ATOM 357 CD2 LEU A 22 -5.358 4.690 1.266 1.00 0.00 C ATOM 0 H LEU A 22 -7.753 7.082 -0.190 1.00 0.00 H new ATOM 0 HA LEU A 22 -5.988 7.317 -2.458 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -4.939 5.354 -1.483 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -5.102 6.698 -0.370 1.00 0.00 H new ATOM 0 HG LEU A 22 -7.175 5.523 0.548 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -7.308 3.092 0.196 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -7.588 4.003 -1.307 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -6.022 3.204 -1.029 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -5.849 4.029 1.980 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -4.467 4.201 0.872 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -5.073 5.616 1.766 1.00 0.00 H new ATOM 369 N GLY A 23 -8.287 4.980 -2.414 1.00 0.00 N ATOM 370 CA GLY A 23 -9.006 4.037 -3.253 1.00 0.00 C ATOM 371 C GLY A 23 -9.570 4.729 -4.496 1.00 0.00 C ATOM 372 O GLY A 23 -9.682 4.115 -5.557 1.00 0.00 O ATOM 0 H GLY A 23 -8.634 5.050 -1.457 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -8.338 3.229 -3.553 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -9.818 3.584 -2.684 1.00 0.00 H new ATOM 376 N ASP A 24 -9.909 5.998 -4.325 1.00 0.00 N ATOM 377 CA ASP A 24 -10.459 6.781 -5.420 1.00 0.00 C ATOM 378 C ASP A 24 -9.332 7.167 -6.380 1.00 0.00 C ATOM 379 O ASP A 24 -9.470 7.023 -7.594 1.00 0.00 O ATOM 380 CB ASP A 24 -11.105 8.069 -4.906 1.00 0.00 C ATOM 381 CG ASP A 24 -12.603 7.968 -4.612 1.00 0.00 C ATOM 382 OD1 ASP A 24 -13.300 7.327 -5.429 1.00 0.00 O ATOM 383 OD2 ASP A 24 -13.019 8.535 -3.579 1.00 0.00 O ATOM 0 H ASP A 24 -9.814 6.504 -3.445 1.00 0.00 H new ATOM 0 HA ASP A 24 -11.213 6.176 -5.923 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -10.591 8.377 -3.995 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -10.947 8.856 -5.643 1.00 0.00 H new ATOM 388 N ALA A 25 -8.244 7.651 -5.801 1.00 0.00 N ATOM 389 CA ALA A 25 -7.095 8.060 -6.590 1.00 0.00 C ATOM 390 C ALA A 25 -6.458 6.825 -7.232 1.00 0.00 C ATOM 391 O ALA A 25 -6.166 6.824 -8.427 1.00 0.00 O ATOM 392 CB ALA A 25 -6.112 8.829 -5.703 1.00 0.00 C ATOM 0 H ALA A 25 -8.134 7.769 -4.794 1.00 0.00 H new ATOM 0 HA ALA A 25 -7.400 8.730 -7.394 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -5.250 9.135 -6.296 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -6.604 9.712 -5.295 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -5.781 8.188 -4.886 1.00 0.00 H new ATOM 398 N LEU A 26 -6.260 5.806 -6.409 1.00 0.00 N ATOM 399 CA LEU A 26 -5.663 4.569 -6.881 1.00 0.00 C ATOM 400 C LEU A 26 -6.480 4.029 -8.057 1.00 0.00 C ATOM 401 O LEU A 26 -5.934 3.761 -9.127 1.00 0.00 O ATOM 402 CB LEU A 26 -5.511 3.573 -5.730 1.00 0.00 C ATOM 403 CG LEU A 26 -4.253 3.725 -4.873 1.00 0.00 C ATOM 404 CD1 LEU A 26 -3.027 4.002 -5.744 1.00 0.00 C ATOM 405 CD2 LEU A 26 -4.448 4.796 -3.799 1.00 0.00 C ATOM 0 H LEU A 26 -6.502 5.812 -5.418 1.00 0.00 H new ATOM 0 HA LEU A 26 -4.654 4.751 -7.250 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -6.382 3.663 -5.081 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -5.525 2.565 -6.144 1.00 0.00 H new ATOM 0 HG LEU A 26 -4.074 2.781 -4.357 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -2.146 4.106 -5.110 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -2.879 3.174 -6.438 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -3.180 4.923 -6.306 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.539 4.884 -3.204 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -4.665 5.753 -4.274 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -5.279 4.516 -3.152 1.00 0.00 H new ATOM 417 N GLN A 27 -7.775 3.887 -7.820 1.00 0.00 N ATOM 418 CA GLN A 27 -8.673 3.384 -8.846 1.00 0.00 C ATOM 419 C GLN A 27 -8.627 4.286 -10.080 1.00 0.00 C ATOM 420 O GLN A 27 -8.774 3.812 -11.206 1.00 0.00 O ATOM 421 CB GLN A 27 -10.102 3.259 -8.311 1.00 0.00 C ATOM 422 CG GLN A 27 -10.765 4.633 -8.194 1.00 0.00 C ATOM 423 CD GLN A 27 -12.284 4.499 -8.062 1.00 0.00 C ATOM 424 OE1 GLN A 27 -12.827 3.416 -7.922 1.00 0.00 O ATOM 425 NE2 GLN A 27 -12.936 5.657 -8.114 1.00 0.00 N ATOM 0 H GLN A 27 -8.225 4.111 -6.932 1.00 0.00 H new ATOM 0 HA GLN A 27 -8.340 2.387 -9.136 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -10.688 2.623 -8.975 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -10.088 2.774 -7.335 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -10.366 5.161 -7.328 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -10.524 5.233 -9.071 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -12.419 6.528 -8.233 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -13.953 5.674 -8.035 1.00 0.00 H new ATOM 434 N GLN A 28 -8.422 5.571 -9.828 1.00 0.00 N ATOM 435 CA GLN A 28 -8.354 6.543 -10.905 1.00 0.00 C ATOM 436 C GLN A 28 -7.012 6.437 -11.632 1.00 0.00 C ATOM 437 O GLN A 28 -6.835 7.014 -12.703 1.00 0.00 O ATOM 438 CB GLN A 28 -8.582 7.961 -10.377 1.00 0.00 C ATOM 439 CG GLN A 28 -8.977 8.911 -11.511 1.00 0.00 C ATOM 440 CD GLN A 28 -7.935 10.019 -11.685 1.00 0.00 C ATOM 441 OE1 GLN A 28 -6.933 10.079 -10.992 1.00 0.00 O ATOM 442 NE2 GLN A 28 -8.229 10.891 -12.646 1.00 0.00 N ATOM 0 H GLN A 28 -8.301 5.961 -8.893 1.00 0.00 H new ATOM 0 HA GLN A 28 -9.149 6.324 -11.618 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -9.365 7.949 -9.618 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -7.675 8.323 -9.893 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -9.077 8.351 -12.441 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -9.951 9.352 -11.298 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -9.085 10.782 -13.189 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -7.598 11.669 -12.840 1.00 0.00 H new ATOM 451 N LEU A 29 -6.100 5.696 -11.020 1.00 0.00 N ATOM 452 CA LEU A 29 -4.780 5.508 -11.595 1.00 0.00 C ATOM 453 C LEU A 29 -4.845 4.416 -12.665 1.00 0.00 C ATOM 454 O LEU A 29 -4.363 4.605 -13.780 1.00 0.00 O ATOM 455 CB LEU A 29 -3.751 5.231 -10.497 1.00 0.00 C ATOM 456 CG LEU A 29 -3.385 3.763 -10.275 1.00 0.00 C ATOM 457 CD1 LEU A 29 -2.409 3.273 -11.346 1.00 0.00 C ATOM 458 CD2 LEU A 29 -2.843 3.540 -8.861 1.00 0.00 C ATOM 0 H LEU A 29 -6.250 5.219 -10.131 1.00 0.00 H new ATOM 0 HA LEU A 29 -4.447 6.421 -12.089 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -2.840 5.780 -10.734 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -4.132 5.635 -9.559 1.00 0.00 H new ATOM 0 HG LEU A 29 -4.293 3.167 -10.370 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.165 2.226 -11.165 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -2.868 3.374 -12.330 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.498 3.870 -11.308 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.591 2.488 -8.730 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.951 4.148 -8.713 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -3.601 3.825 -8.132 1.00 0.00 H new ATOM 470 N GLY A 30 -5.446 3.297 -12.287 1.00 0.00 N ATOM 471 CA GLY A 30 -5.581 2.175 -13.200 1.00 0.00 C ATOM 472 C GLY A 30 -5.237 0.857 -12.503 1.00 0.00 C ATOM 473 O GLY A 30 -4.433 0.074 -13.009 1.00 0.00 O ATOM 0 H GLY A 30 -5.845 3.144 -11.361 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -6.601 2.133 -13.582 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -4.925 2.319 -14.058 1.00 0.00 H new ATOM 477 N PHE A 31 -5.863 0.652 -11.354 1.00 0.00 N ATOM 478 CA PHE A 31 -5.634 -0.559 -10.583 1.00 0.00 C ATOM 479 C PHE A 31 -6.348 -1.755 -11.215 1.00 0.00 C ATOM 480 O PHE A 31 -7.285 -1.583 -11.993 1.00 0.00 O ATOM 481 CB PHE A 31 -6.211 -0.316 -9.187 1.00 0.00 C ATOM 482 CG PHE A 31 -5.176 0.137 -8.156 1.00 0.00 C ATOM 483 CD1 PHE A 31 -3.937 0.525 -8.561 1.00 0.00 C ATOM 484 CD2 PHE A 31 -5.493 0.150 -6.833 1.00 0.00 C ATOM 485 CE1 PHE A 31 -2.975 0.945 -7.605 1.00 0.00 C ATOM 486 CE2 PHE A 31 -4.531 0.570 -5.877 1.00 0.00 C ATOM 487 CZ PHE A 31 -3.293 0.958 -6.282 1.00 0.00 C ATOM 0 H PHE A 31 -6.528 1.303 -10.938 1.00 0.00 H new ATOM 0 HA PHE A 31 -4.568 -0.783 -10.550 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -6.995 0.438 -9.255 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -6.682 -1.234 -8.835 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -3.685 0.514 -9.611 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -6.476 -0.159 -6.510 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -1.992 1.254 -7.928 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -4.783 0.581 -4.827 1.00 0.00 H new ATOM 0 HZ PHE A 31 -2.562 1.277 -5.554 1.00 0.00 H new ATOM 497 N LYS A 32 -5.877 -2.941 -10.857 1.00 0.00 N ATOM 498 CA LYS A 32 -6.458 -4.166 -11.381 1.00 0.00 C ATOM 499 C LYS A 32 -7.726 -4.501 -10.592 1.00 0.00 C ATOM 500 O LYS A 32 -8.823 -4.515 -11.149 1.00 0.00 O ATOM 501 CB LYS A 32 -5.422 -5.291 -11.385 1.00 0.00 C ATOM 502 CG LYS A 32 -4.657 -5.327 -12.710 1.00 0.00 C ATOM 503 CD LYS A 32 -3.523 -4.299 -12.715 1.00 0.00 C ATOM 504 CE LYS A 32 -2.439 -4.685 -13.723 1.00 0.00 C ATOM 505 NZ LYS A 32 -1.902 -3.480 -14.394 1.00 0.00 N ATOM 0 H LYS A 32 -5.100 -3.080 -10.211 1.00 0.00 H new ATOM 0 HA LYS A 32 -6.754 -4.033 -12.421 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -4.723 -5.149 -10.561 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -5.918 -6.248 -11.221 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -4.249 -6.325 -12.872 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -5.340 -5.124 -13.535 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -3.921 -3.315 -12.962 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -3.089 -4.226 -11.718 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -1.633 -5.215 -13.215 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -2.851 -5.369 -14.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -1.167 -3.760 -15.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -2.670 -2.990 -14.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -1.490 -2.842 -13.684 1.00 0.00 H new ATOM 519 N GLN A 33 -7.534 -4.762 -9.307 1.00 0.00 N ATOM 520 CA GLN A 33 -8.648 -5.095 -8.437 1.00 0.00 C ATOM 521 C GLN A 33 -8.505 -4.378 -7.092 1.00 0.00 C ATOM 522 O GLN A 33 -7.607 -4.687 -6.312 1.00 0.00 O ATOM 523 CB GLN A 33 -8.756 -6.609 -8.241 1.00 0.00 C ATOM 524 CG GLN A 33 -10.109 -7.130 -8.731 1.00 0.00 C ATOM 525 CD GLN A 33 -11.137 -7.136 -7.598 1.00 0.00 C ATOM 526 OE1 GLN A 33 -11.041 -7.888 -6.642 1.00 0.00 O ATOM 527 NE2 GLN A 33 -12.125 -6.260 -7.758 1.00 0.00 N ATOM 0 H GLN A 33 -6.623 -4.749 -8.848 1.00 0.00 H new ATOM 0 HA GLN A 33 -9.568 -4.755 -8.912 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -7.952 -7.108 -8.783 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -8.629 -6.853 -7.186 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -10.468 -6.506 -9.549 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -9.993 -8.139 -9.127 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -12.146 -5.660 -8.582 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -12.862 -6.189 -7.056 1.00 0.00 H new ATOM 536 N ILE A 34 -9.405 -3.432 -6.864 1.00 0.00 N ATOM 537 CA ILE A 34 -9.391 -2.668 -5.628 1.00 0.00 C ATOM 538 C ILE A 34 -10.150 -3.441 -4.547 1.00 0.00 C ATOM 539 O ILE A 34 -11.255 -3.925 -4.786 1.00 0.00 O ATOM 540 CB ILE A 34 -9.928 -1.256 -5.866 1.00 0.00 C ATOM 541 CG1 ILE A 34 -8.783 -0.253 -6.024 1.00 0.00 C ATOM 542 CG2 ILE A 34 -10.901 -0.845 -4.758 1.00 0.00 C ATOM 543 CD1 ILE A 34 -9.262 1.174 -5.752 1.00 0.00 C ATOM 0 H ILE A 34 -10.148 -3.177 -7.514 1.00 0.00 H new ATOM 0 HA ILE A 34 -8.369 -2.540 -5.270 1.00 0.00 H new ATOM 0 HB ILE A 34 -10.487 -1.257 -6.802 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -7.976 -0.506 -5.337 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.375 -0.317 -7.033 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -11.268 0.163 -4.951 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -11.741 -1.539 -4.736 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -10.388 -0.866 -3.797 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -8.429 1.866 -5.871 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -10.053 1.433 -6.456 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -9.647 1.241 -4.734 1.00 0.00 H new ATOM 555 N THR A 35 -9.525 -3.531 -3.382 1.00 0.00 N ATOM 556 CA THR A 35 -10.128 -4.238 -2.263 1.00 0.00 C ATOM 557 C THR A 35 -9.942 -3.443 -0.970 1.00 0.00 C ATOM 558 O THR A 35 -8.820 -3.284 -0.491 1.00 0.00 O ATOM 559 CB THR A 35 -9.520 -5.640 -2.207 1.00 0.00 C ATOM 560 OG1 THR A 35 -10.636 -6.492 -1.961 1.00 0.00 O ATOM 561 CG2 THR A 35 -8.621 -5.842 -0.985 1.00 0.00 C ATOM 0 H THR A 35 -8.609 -3.127 -3.188 1.00 0.00 H new ATOM 0 HA THR A 35 -11.205 -4.341 -2.393 1.00 0.00 H new ATOM 0 HB THR A 35 -8.944 -5.822 -3.114 1.00 0.00 H new ATOM 0 HG1 THR A 35 -10.333 -7.422 -1.911 1.00 0.00 H new ATOM 0 HG21 THR A 35 -8.216 -6.854 -0.995 1.00 0.00 H new ATOM 0 HG22 THR A 35 -7.802 -5.123 -1.013 1.00 0.00 H new ATOM 0 HG23 THR A 35 -9.204 -5.693 -0.076 1.00 0.00 H new ATOM 569 N ALA A 36 -11.058 -2.965 -0.440 1.00 0.00 N ATOM 570 CA ALA A 36 -11.033 -2.191 0.789 1.00 0.00 C ATOM 571 C ALA A 36 -11.375 -3.104 1.969 1.00 0.00 C ATOM 572 O ALA A 36 -12.099 -4.085 1.809 1.00 0.00 O ATOM 573 CB ALA A 36 -11.997 -1.009 0.668 1.00 0.00 C ATOM 0 H ALA A 36 -11.987 -3.099 -0.840 1.00 0.00 H new ATOM 0 HA ALA A 36 -10.038 -1.783 0.965 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -11.978 -0.428 1.590 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -11.694 -0.376 -0.166 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -13.007 -1.380 0.493 1.00 0.00 H new ATOM 579 N ALA A 37 -10.838 -2.747 3.126 1.00 0.00 N ATOM 580 CA ALA A 37 -11.076 -3.522 4.332 1.00 0.00 C ATOM 581 C ALA A 37 -11.320 -2.570 5.505 1.00 0.00 C ATOM 582 O ALA A 37 -11.338 -1.353 5.327 1.00 0.00 O ATOM 583 CB ALA A 37 -9.893 -4.459 4.579 1.00 0.00 C ATOM 0 H ALA A 37 -10.239 -1.932 3.254 1.00 0.00 H new ATOM 0 HA ALA A 37 -11.965 -4.142 4.220 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -10.072 -5.040 5.484 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -9.780 -5.134 3.731 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.983 -3.872 4.699 1.00 0.00 H new ATOM 589 N GLY A 38 -11.501 -3.160 6.677 1.00 0.00 N ATOM 590 CA GLY A 38 -11.744 -2.380 7.879 1.00 0.00 C ATOM 591 C GLY A 38 -10.562 -1.455 8.179 1.00 0.00 C ATOM 592 O GLY A 38 -10.729 -0.241 8.279 1.00 0.00 O ATOM 0 H GLY A 38 -11.484 -4.170 6.820 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -12.651 -1.789 7.756 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -11.911 -3.049 8.723 1.00 0.00 H new ATOM 596 N ASP A 39 -9.394 -2.066 8.315 1.00 0.00 N ATOM 597 CA ASP A 39 -8.184 -1.312 8.602 1.00 0.00 C ATOM 598 C ASP A 39 -7.010 -2.282 8.753 1.00 0.00 C ATOM 599 O ASP A 39 -7.206 -3.493 8.839 1.00 0.00 O ATOM 600 CB ASP A 39 -8.321 -0.529 9.909 1.00 0.00 C ATOM 601 CG ASP A 39 -9.333 -1.102 10.904 1.00 0.00 C ATOM 602 OD1 ASP A 39 -9.074 -2.221 11.395 1.00 0.00 O ATOM 603 OD2 ASP A 39 -10.342 -0.407 11.149 1.00 0.00 O ATOM 0 H ASP A 39 -9.259 -3.074 8.232 1.00 0.00 H new ATOM 0 HA ASP A 39 -8.016 -0.616 7.780 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -7.345 -0.484 10.392 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -8.607 0.496 9.673 1.00 0.00 H new ATOM 608 N GLY A 40 -5.813 -1.711 8.777 1.00 0.00 N ATOM 609 CA GLY A 40 -4.607 -2.509 8.916 1.00 0.00 C ATOM 610 C GLY A 40 -4.880 -3.978 8.587 1.00 0.00 C ATOM 611 O GLY A 40 -5.131 -4.323 7.432 1.00 0.00 O ATOM 0 H GLY A 40 -5.654 -0.706 8.703 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -3.833 -2.122 8.254 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -4.227 -2.425 9.934 1.00 0.00 H new ATOM 615 N GLU A 41 -4.822 -4.804 9.621 1.00 0.00 N ATOM 616 CA GLU A 41 -5.060 -6.227 9.455 1.00 0.00 C ATOM 617 C GLU A 41 -6.375 -6.463 8.711 1.00 0.00 C ATOM 618 O GLU A 41 -6.405 -7.169 7.703 1.00 0.00 O ATOM 619 CB GLU A 41 -5.059 -6.945 10.807 1.00 0.00 C ATOM 620 CG GLU A 41 -6.354 -6.670 11.574 1.00 0.00 C ATOM 621 CD GLU A 41 -6.326 -7.334 12.952 1.00 0.00 C ATOM 622 OE1 GLU A 41 -5.329 -8.038 13.223 1.00 0.00 O ATOM 623 OE2 GLU A 41 -7.303 -7.123 13.703 1.00 0.00 O ATOM 0 H GLU A 41 -4.614 -4.515 10.577 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.248 -6.643 8.858 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -4.944 -8.018 10.653 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -4.205 -6.614 11.398 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -6.493 -5.595 11.687 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -7.205 -7.043 11.004 1.00 0.00 H new ATOM 630 N GLN A 42 -7.432 -5.859 9.235 1.00 0.00 N ATOM 631 CA GLN A 42 -8.747 -5.994 8.633 1.00 0.00 C ATOM 632 C GLN A 42 -8.634 -5.999 7.106 1.00 0.00 C ATOM 633 O GLN A 42 -9.457 -6.604 6.422 1.00 0.00 O ATOM 634 CB GLN A 42 -9.684 -4.883 9.109 1.00 0.00 C ATOM 635 CG GLN A 42 -10.745 -5.433 10.065 1.00 0.00 C ATOM 636 CD GLN A 42 -11.994 -5.878 9.302 1.00 0.00 C ATOM 637 OE1 GLN A 42 -11.965 -6.142 8.112 1.00 0.00 O ATOM 638 NE2 GLN A 42 -13.091 -5.945 10.052 1.00 0.00 N ATOM 0 H GLN A 42 -7.404 -5.275 10.071 1.00 0.00 H new ATOM 0 HA GLN A 42 -9.174 -6.945 8.950 1.00 0.00 H new ATOM 0 HB2 GLN A 42 -9.107 -4.105 9.609 1.00 0.00 H new ATOM 0 HB3 GLN A 42 -10.169 -4.418 8.250 1.00 0.00 H new ATOM 0 HG2 GLN A 42 -10.336 -6.276 10.622 1.00 0.00 H new ATOM 0 HG3 GLN A 42 -11.013 -4.669 10.794 1.00 0.00 H new ATOM 0 HE21 GLN A 42 -13.046 -5.710 11.044 1.00 0.00 H new ATOM 0 HE22 GLN A 42 -13.977 -6.231 9.635 1.00 0.00 H new ATOM 647 N GLY A 43 -7.607 -5.319 6.619 1.00 0.00 N ATOM 648 CA GLY A 43 -7.376 -5.238 5.187 1.00 0.00 C ATOM 649 C GLY A 43 -6.159 -6.071 4.780 1.00 0.00 C ATOM 650 O GLY A 43 -6.208 -6.810 3.798 1.00 0.00 O ATOM 0 H GLY A 43 -6.926 -4.819 7.190 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -8.258 -5.591 4.652 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -7.223 -4.198 4.898 1.00 0.00 H new ATOM 654 N MET A 44 -5.094 -5.924 5.555 1.00 0.00 N ATOM 655 CA MET A 44 -3.867 -6.654 5.288 1.00 0.00 C ATOM 656 C MET A 44 -4.128 -8.161 5.223 1.00 0.00 C ATOM 657 O MET A 44 -3.726 -8.822 4.266 1.00 0.00 O ATOM 658 CB MET A 44 -2.847 -6.360 6.391 1.00 0.00 C ATOM 659 CG MET A 44 -2.028 -7.608 6.726 1.00 0.00 C ATOM 660 SD MET A 44 -1.165 -8.181 5.273 1.00 0.00 S ATOM 661 CE MET A 44 -0.248 -9.543 5.972 1.00 0.00 C ATOM 0 H MET A 44 -5.056 -5.310 6.368 1.00 0.00 H new ATOM 0 HA MET A 44 -3.476 -6.330 4.323 1.00 0.00 H new ATOM 0 HB2 MET A 44 -2.181 -5.558 6.071 1.00 0.00 H new ATOM 0 HB3 MET A 44 -3.363 -6.008 7.284 1.00 0.00 H new ATOM 0 HG2 MET A 44 -1.314 -7.382 7.518 1.00 0.00 H new ATOM 0 HG3 MET A 44 -2.684 -8.393 7.103 1.00 0.00 H new ATOM 0 HE1 MET A 44 0.659 -9.707 5.391 1.00 0.00 H new ATOM 0 HE2 MET A 44 0.019 -9.311 7.003 1.00 0.00 H new ATOM 0 HE3 MET A 44 -0.861 -10.444 5.950 1.00 0.00 H new ATOM 671 N LYS A 45 -4.799 -8.657 6.250 1.00 0.00 N ATOM 672 CA LYS A 45 -5.119 -10.074 6.322 1.00 0.00 C ATOM 673 C LYS A 45 -5.895 -10.480 5.067 1.00 0.00 C ATOM 674 O LYS A 45 -5.706 -11.577 4.544 1.00 0.00 O ATOM 675 CB LYS A 45 -5.849 -10.393 7.627 1.00 0.00 C ATOM 676 CG LYS A 45 -5.213 -9.655 8.806 1.00 0.00 C ATOM 677 CD LYS A 45 -4.965 -10.605 9.980 1.00 0.00 C ATOM 678 CE LYS A 45 -6.283 -11.013 10.643 1.00 0.00 C ATOM 679 NZ LYS A 45 -6.026 -11.839 11.843 1.00 0.00 N ATOM 0 H LYS A 45 -5.131 -8.104 7.040 1.00 0.00 H new ATOM 0 HA LYS A 45 -4.207 -10.671 6.341 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -6.898 -10.110 7.539 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -5.823 -11.467 7.809 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -4.271 -9.205 8.492 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -5.864 -8.841 9.124 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -4.440 -11.493 9.629 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -4.319 -10.122 10.713 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -6.848 -10.123 10.921 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -6.896 -11.571 9.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -6.931 -12.107 12.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -5.506 -12.697 11.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -5.460 -11.294 12.525 1.00 0.00 H new ATOM 693 N ILE A 46 -6.753 -9.575 4.621 1.00 0.00 N ATOM 694 CA ILE A 46 -7.559 -9.824 3.438 1.00 0.00 C ATOM 695 C ILE A 46 -6.637 -10.089 2.246 1.00 0.00 C ATOM 696 O ILE A 46 -6.870 -11.014 1.470 1.00 0.00 O ATOM 697 CB ILE A 46 -8.546 -8.679 3.210 1.00 0.00 C ATOM 698 CG1 ILE A 46 -9.896 -8.980 3.865 1.00 0.00 C ATOM 699 CG2 ILE A 46 -8.690 -8.368 1.719 1.00 0.00 C ATOM 700 CD1 ILE A 46 -9.707 -9.660 5.222 1.00 0.00 C ATOM 0 H ILE A 46 -6.908 -8.667 5.058 1.00 0.00 H new ATOM 0 HA ILE A 46 -8.170 -10.716 3.574 1.00 0.00 H new ATOM 0 HB ILE A 46 -8.148 -7.785 3.689 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -10.457 -8.054 3.993 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -10.486 -9.622 3.211 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -9.398 -7.550 1.585 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -7.721 -8.080 1.312 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -9.054 -9.252 1.196 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -10.682 -9.863 5.666 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -9.167 -10.597 5.087 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -9.137 -9.005 5.881 1.00 0.00 H new ATOM 712 N MET A 47 -5.610 -9.260 2.137 1.00 0.00 N ATOM 713 CA MET A 47 -4.653 -9.392 1.053 1.00 0.00 C ATOM 714 C MET A 47 -3.846 -10.685 1.188 1.00 0.00 C ATOM 715 O MET A 47 -3.470 -11.294 0.187 1.00 0.00 O ATOM 716 CB MET A 47 -3.701 -8.194 1.061 1.00 0.00 C ATOM 717 CG MET A 47 -4.389 -6.944 0.511 1.00 0.00 C ATOM 718 SD MET A 47 -4.505 -7.044 -1.268 1.00 0.00 S ATOM 719 CE MET A 47 -2.977 -6.242 -1.724 1.00 0.00 C ATOM 0 H MET A 47 -5.420 -8.494 2.783 1.00 0.00 H new ATOM 0 HA MET A 47 -5.202 -9.424 0.112 1.00 0.00 H new ATOM 0 HB2 MET A 47 -3.356 -8.006 2.078 1.00 0.00 H new ATOM 0 HB3 MET A 47 -2.819 -8.422 0.462 1.00 0.00 H new ATOM 0 HG2 MET A 47 -5.385 -6.847 0.944 1.00 0.00 H new ATOM 0 HG3 MET A 47 -3.828 -6.054 0.798 1.00 0.00 H new ATOM 0 HE1 MET A 47 -2.756 -6.448 -2.771 1.00 0.00 H new ATOM 0 HE2 MET A 47 -3.073 -5.166 -1.579 1.00 0.00 H new ATOM 0 HE3 MET A 47 -2.167 -6.621 -1.101 1.00 0.00 H new ATOM 729 N ALA A 48 -3.605 -11.067 2.433 1.00 0.00 N ATOM 730 CA ALA A 48 -2.849 -12.276 2.713 1.00 0.00 C ATOM 731 C ALA A 48 -3.600 -13.483 2.145 1.00 0.00 C ATOM 732 O ALA A 48 -3.008 -14.327 1.473 1.00 0.00 O ATOM 733 CB ALA A 48 -2.611 -12.394 4.220 1.00 0.00 C ATOM 0 H ALA A 48 -3.920 -10.560 3.260 1.00 0.00 H new ATOM 0 HA ALA A 48 -1.872 -12.238 2.232 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -2.044 -13.301 4.429 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -2.050 -11.527 4.569 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -3.569 -12.438 4.737 1.00 0.00 H new ATOM 739 N GLN A 49 -4.891 -13.527 2.437 1.00 0.00 N ATOM 740 CA GLN A 49 -5.728 -14.616 1.963 1.00 0.00 C ATOM 741 C GLN A 49 -5.810 -14.598 0.435 1.00 0.00 C ATOM 742 O GLN A 49 -5.355 -15.531 -0.225 1.00 0.00 O ATOM 743 CB GLN A 49 -7.124 -14.546 2.587 1.00 0.00 C ATOM 744 CG GLN A 49 -7.037 -14.355 4.103 1.00 0.00 C ATOM 745 CD GLN A 49 -7.376 -15.653 4.840 1.00 0.00 C ATOM 746 OE1 GLN A 49 -8.527 -15.984 5.069 1.00 0.00 O ATOM 747 NE2 GLN A 49 -6.310 -16.366 5.195 1.00 0.00 N ATOM 0 H GLN A 49 -5.378 -12.826 2.996 1.00 0.00 H new ATOM 0 HA GLN A 49 -5.274 -15.557 2.272 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -7.683 -13.722 2.144 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -7.673 -15.461 2.363 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -6.033 -14.030 4.375 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -7.723 -13.567 4.414 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -5.374 -16.029 4.971 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -6.429 -17.249 5.691 1.00 0.00 H new ATOM 756 N ASN A 50 -6.392 -13.526 -0.082 1.00 0.00 N ATOM 757 CA ASN A 50 -6.539 -13.375 -1.520 1.00 0.00 C ATOM 758 C ASN A 50 -5.211 -12.903 -2.116 1.00 0.00 C ATOM 759 O ASN A 50 -4.217 -12.776 -1.404 1.00 0.00 O ATOM 760 CB ASN A 50 -7.606 -12.332 -1.858 1.00 0.00 C ATOM 761 CG ASN A 50 -8.532 -12.088 -0.664 1.00 0.00 C ATOM 762 OD1 ASN A 50 -8.793 -12.967 0.142 1.00 0.00 O ATOM 763 ND2 ASN A 50 -9.011 -10.849 -0.596 1.00 0.00 N ATOM 0 H ASN A 50 -6.767 -12.754 0.469 1.00 0.00 H new ATOM 0 HA ASN A 50 -6.835 -14.340 -1.933 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -7.127 -11.397 -2.148 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -8.191 -12.669 -2.714 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -9.638 -10.585 0.165 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -8.752 -10.162 -1.304 1.00 0.00 H new ATOM 770 N PRO A 51 -5.240 -12.649 -3.452 1.00 0.00 N ATOM 771 CA PRO A 51 -4.051 -12.194 -4.152 1.00 0.00 C ATOM 772 C PRO A 51 -3.762 -10.723 -3.843 1.00 0.00 C ATOM 773 O PRO A 51 -4.684 -9.920 -3.707 1.00 0.00 O ATOM 774 CB PRO A 51 -4.340 -12.446 -5.623 1.00 0.00 C ATOM 775 CG PRO A 51 -5.849 -12.597 -5.731 1.00 0.00 C ATOM 776 CD PRO A 51 -6.400 -12.787 -4.328 1.00 0.00 C ATOM 0 HA PRO A 51 -3.151 -12.723 -3.840 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -3.985 -11.619 -6.238 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -3.831 -13.344 -5.973 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -6.288 -11.715 -6.197 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -6.103 -13.450 -6.360 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -7.161 -12.042 -4.097 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -6.867 -13.765 -4.215 1.00 0.00 H new ATOM 784 N HIS A 52 -2.477 -10.414 -3.741 1.00 0.00 N ATOM 785 CA HIS A 52 -2.055 -9.055 -3.451 1.00 0.00 C ATOM 786 C HIS A 52 -0.851 -8.694 -4.323 1.00 0.00 C ATOM 787 O HIS A 52 0.005 -9.537 -4.586 1.00 0.00 O ATOM 788 CB HIS A 52 -1.779 -8.879 -1.957 1.00 0.00 C ATOM 789 CG HIS A 52 -0.932 -9.974 -1.356 1.00 0.00 C ATOM 790 ND1 HIS A 52 -0.835 -10.184 0.009 1.00 0.00 N ATOM 791 CD2 HIS A 52 -0.145 -10.919 -1.947 1.00 0.00 C ATOM 792 CE1 HIS A 52 -0.024 -11.211 0.217 1.00 0.00 C ATOM 793 NE2 HIS A 52 0.404 -11.664 -0.996 1.00 0.00 N ATOM 0 H HIS A 52 -1.715 -11.082 -3.854 1.00 0.00 H new ATOM 0 HA HIS A 52 -2.859 -8.361 -3.697 1.00 0.00 H new ATOM 0 HB2 HIS A 52 -1.282 -7.922 -1.800 1.00 0.00 H new ATOM 0 HB3 HIS A 52 -2.729 -8.836 -1.425 1.00 0.00 H new ATOM 0 HD1 HIS A 52 -1.307 -9.641 0.732 1.00 0.00 H new ATOM 0 HD2 HIS A 52 0.006 -11.040 -3.010 1.00 0.00 H new ATOM 0 HE1 HIS A 52 0.250 -11.618 1.179 1.00 0.00 H new ATOM 802 N HIS A 53 -0.823 -7.440 -4.749 1.00 0.00 N ATOM 803 CA HIS A 53 0.262 -6.957 -5.587 1.00 0.00 C ATOM 804 C HIS A 53 0.717 -5.581 -5.094 1.00 0.00 C ATOM 805 O HIS A 53 1.911 -5.286 -5.083 1.00 0.00 O ATOM 806 CB HIS A 53 -0.150 -6.952 -7.060 1.00 0.00 C ATOM 807 CG HIS A 53 1.011 -6.850 -8.021 1.00 0.00 C ATOM 808 ND1 HIS A 53 1.134 -5.822 -8.940 1.00 0.00 N ATOM 809 CD2 HIS A 53 2.097 -7.655 -8.195 1.00 0.00 C ATOM 810 CE1 HIS A 53 2.248 -6.011 -9.632 1.00 0.00 C ATOM 811 NE2 HIS A 53 2.844 -7.148 -9.169 1.00 0.00 N ATOM 0 H HIS A 53 -1.535 -6.743 -4.530 1.00 0.00 H new ATOM 0 HA HIS A 53 1.114 -7.633 -5.511 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -0.707 -7.864 -7.274 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -0.828 -6.116 -7.235 1.00 0.00 H new ATOM 0 HD2 HIS A 53 2.313 -8.553 -7.636 1.00 0.00 H new ATOM 0 HE1 HIS A 53 2.619 -5.377 -10.423 1.00 0.00 H new ATOM 0 HE2 HIS A 53 3.719 -7.543 -9.514 1.00 0.00 H new ATOM 820 N LEU A 54 -0.259 -4.778 -4.699 1.00 0.00 N ATOM 821 CA LEU A 54 0.026 -3.441 -4.206 1.00 0.00 C ATOM 822 C LEU A 54 -0.936 -3.106 -3.064 1.00 0.00 C ATOM 823 O LEU A 54 -2.148 -3.047 -3.266 1.00 0.00 O ATOM 824 CB LEU A 54 -0.005 -2.429 -5.353 1.00 0.00 C ATOM 825 CG LEU A 54 0.455 -1.011 -5.010 1.00 0.00 C ATOM 826 CD1 LEU A 54 1.710 -0.635 -5.801 1.00 0.00 C ATOM 827 CD2 LEU A 54 -0.676 -0.002 -5.216 1.00 0.00 C ATOM 0 H LEU A 54 -1.248 -5.027 -4.710 1.00 0.00 H new ATOM 0 HA LEU A 54 1.035 -3.394 -3.797 1.00 0.00 H new ATOM 0 HB2 LEU A 54 0.621 -2.807 -6.161 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -1.024 -2.376 -5.737 1.00 0.00 H new ATOM 0 HG LEU A 54 0.721 -0.985 -3.953 1.00 0.00 H new ATOM 0 HD11 LEU A 54 2.016 0.378 -5.538 1.00 0.00 H new ATOM 0 HD12 LEU A 54 2.514 -1.331 -5.560 1.00 0.00 H new ATOM 0 HD13 LEU A 54 1.495 -0.684 -6.869 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -0.322 0.998 -4.965 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -0.997 -0.022 -6.258 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -1.517 -0.261 -4.572 1.00 0.00 H new ATOM 839 N VAL A 55 -0.360 -2.896 -1.890 1.00 0.00 N ATOM 840 CA VAL A 55 -1.151 -2.569 -0.716 1.00 0.00 C ATOM 841 C VAL A 55 -1.129 -1.055 -0.497 1.00 0.00 C ATOM 842 O VAL A 55 -0.087 -0.417 -0.643 1.00 0.00 O ATOM 843 CB VAL A 55 -0.641 -3.354 0.494 1.00 0.00 C ATOM 844 CG1 VAL A 55 -1.022 -2.656 1.801 1.00 0.00 C ATOM 845 CG2 VAL A 55 -1.158 -4.794 0.471 1.00 0.00 C ATOM 0 H VAL A 55 0.646 -2.946 -1.726 1.00 0.00 H new ATOM 0 HA VAL A 55 -2.191 -2.862 -0.863 1.00 0.00 H new ATOM 0 HB VAL A 55 0.447 -3.387 0.437 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -0.647 -3.235 2.645 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -0.583 -1.658 1.822 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -2.107 -2.577 1.868 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -0.781 -5.330 1.342 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -2.248 -4.790 0.492 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -0.814 -5.290 -0.437 1.00 0.00 H new ATOM 855 N ILE A 56 -2.293 -0.523 -0.153 1.00 0.00 N ATOM 856 CA ILE A 56 -2.421 0.905 0.087 1.00 0.00 C ATOM 857 C ILE A 56 -3.327 1.135 1.299 1.00 0.00 C ATOM 858 O ILE A 56 -4.497 0.756 1.284 1.00 0.00 O ATOM 859 CB ILE A 56 -2.895 1.621 -1.180 1.00 0.00 C ATOM 860 CG1 ILE A 56 -3.967 0.804 -1.902 1.00 0.00 C ATOM 861 CG2 ILE A 56 -1.714 1.954 -2.094 1.00 0.00 C ATOM 862 CD1 ILE A 56 -3.357 -0.427 -2.577 1.00 0.00 C ATOM 0 H ILE A 56 -3.155 -1.055 -0.035 1.00 0.00 H new ATOM 0 HA ILE A 56 -1.451 1.340 0.327 1.00 0.00 H new ATOM 0 HB ILE A 56 -3.353 2.566 -0.889 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -4.732 0.492 -1.191 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -4.461 1.425 -2.649 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -2.077 2.462 -2.987 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -1.017 2.604 -1.565 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -1.206 1.034 -2.382 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -4.141 -0.990 -3.083 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -2.610 -0.110 -3.305 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -2.885 -1.058 -1.824 1.00 0.00 H new ATOM 874 N SER A 57 -2.752 1.756 2.318 1.00 0.00 N ATOM 875 CA SER A 57 -3.493 2.040 3.535 1.00 0.00 C ATOM 876 C SER A 57 -3.071 3.399 4.098 1.00 0.00 C ATOM 877 O SER A 57 -2.283 4.113 3.481 1.00 0.00 O ATOM 878 CB SER A 57 -3.279 0.943 4.580 1.00 0.00 C ATOM 879 OG SER A 57 -3.494 1.419 5.906 1.00 0.00 O ATOM 0 H SER A 57 -1.782 2.070 2.326 1.00 0.00 H new ATOM 0 HA SER A 57 -4.555 2.068 3.290 1.00 0.00 H new ATOM 0 HB2 SER A 57 -3.957 0.113 4.378 1.00 0.00 H new ATOM 0 HB3 SER A 57 -2.264 0.554 4.495 1.00 0.00 H new ATOM 0 HG SER A 57 -3.349 0.689 6.543 1.00 0.00 H new ATOM 885 N ASP A 58 -3.616 3.715 5.265 1.00 0.00 N ATOM 886 CA ASP A 58 -3.305 4.976 5.918 1.00 0.00 C ATOM 887 C ASP A 58 -2.055 4.803 6.783 1.00 0.00 C ATOM 888 O ASP A 58 -1.573 3.686 6.966 1.00 0.00 O ATOM 889 CB ASP A 58 -4.452 5.421 6.827 1.00 0.00 C ATOM 890 CG ASP A 58 -5.010 4.331 7.745 1.00 0.00 C ATOM 891 OD1 ASP A 58 -4.658 3.156 7.509 1.00 0.00 O ATOM 892 OD2 ASP A 58 -5.776 4.699 8.662 1.00 0.00 O ATOM 0 H ASP A 58 -4.270 3.120 5.774 1.00 0.00 H new ATOM 0 HA ASP A 58 -3.145 5.727 5.144 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -4.106 6.252 7.443 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -5.262 5.801 6.205 1.00 0.00 H new ATOM 897 N PHE A 59 -1.567 5.925 7.292 1.00 0.00 N ATOM 898 CA PHE A 59 -0.383 5.911 8.133 1.00 0.00 C ATOM 899 C PHE A 59 -0.744 5.585 9.584 1.00 0.00 C ATOM 900 O PHE A 59 0.129 5.263 10.388 1.00 0.00 O ATOM 901 CB PHE A 59 0.223 7.314 8.075 1.00 0.00 C ATOM 902 CG PHE A 59 1.584 7.376 7.379 1.00 0.00 C ATOM 903 CD1 PHE A 59 2.553 6.476 7.698 1.00 0.00 C ATOM 904 CD2 PHE A 59 1.825 8.329 6.439 1.00 0.00 C ATOM 905 CE1 PHE A 59 3.816 6.534 7.051 1.00 0.00 C ATOM 906 CE2 PHE A 59 3.088 8.387 5.793 1.00 0.00 C ATOM 907 CZ PHE A 59 4.057 7.488 6.113 1.00 0.00 C ATOM 0 H PHE A 59 -1.970 6.849 7.138 1.00 0.00 H new ATOM 0 HA PHE A 59 0.314 5.151 7.780 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -0.470 7.977 7.556 1.00 0.00 H new ATOM 0 HB3 PHE A 59 0.328 7.695 9.091 1.00 0.00 H new ATOM 0 HD1 PHE A 59 2.362 5.718 8.443 1.00 0.00 H new ATOM 0 HD2 PHE A 59 1.055 9.042 6.184 1.00 0.00 H new ATOM 0 HE1 PHE A 59 4.585 5.820 7.304 1.00 0.00 H new ATOM 0 HE2 PHE A 59 3.279 9.145 5.048 1.00 0.00 H new ATOM 0 HZ PHE A 59 5.018 7.532 5.622 1.00 0.00 H new ATOM 917 N ASN A 60 -2.034 5.678 9.874 1.00 0.00 N ATOM 918 CA ASN A 60 -2.522 5.398 11.214 1.00 0.00 C ATOM 919 C ASN A 60 -1.789 4.176 11.772 1.00 0.00 C ATOM 920 O ASN A 60 -1.051 3.507 11.052 1.00 0.00 O ATOM 921 CB ASN A 60 -4.020 5.085 11.200 1.00 0.00 C ATOM 922 CG ASN A 60 -4.293 3.737 10.530 1.00 0.00 C ATOM 923 OD1 ASN A 60 -3.603 3.319 9.615 1.00 0.00 O ATOM 924 ND2 ASN A 60 -5.335 3.083 11.036 1.00 0.00 N ATOM 0 H ASN A 60 -2.756 5.943 9.204 1.00 0.00 H new ATOM 0 HA ASN A 60 -2.344 6.279 11.830 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -4.402 5.071 12.221 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -4.555 5.873 10.670 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -5.599 2.173 10.657 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -5.870 3.491 11.803 1.00 0.00 H new ATOM 931 N MET A 61 -2.020 3.923 13.052 1.00 0.00 N ATOM 932 CA MET A 61 -1.391 2.793 13.717 1.00 0.00 C ATOM 933 C MET A 61 -2.409 1.688 14.002 1.00 0.00 C ATOM 934 O MET A 61 -2.739 1.425 15.157 1.00 0.00 O ATOM 935 CB MET A 61 -0.761 3.259 15.031 1.00 0.00 C ATOM 936 CG MET A 61 -1.839 3.603 16.063 1.00 0.00 C ATOM 937 SD MET A 61 -1.359 5.054 16.985 1.00 0.00 S ATOM 938 CE MET A 61 -2.748 6.118 16.632 1.00 0.00 C ATOM 0 H MET A 61 -2.634 4.480 13.646 1.00 0.00 H new ATOM 0 HA MET A 61 -0.622 2.391 13.058 1.00 0.00 H new ATOM 0 HB2 MET A 61 -0.111 2.477 15.425 1.00 0.00 H new ATOM 0 HB3 MET A 61 -0.135 4.132 14.849 1.00 0.00 H new ATOM 0 HG2 MET A 61 -2.791 3.779 15.562 1.00 0.00 H new ATOM 0 HG3 MET A 61 -1.986 2.763 16.742 1.00 0.00 H new ATOM 0 HE1 MET A 61 -2.610 7.075 17.135 1.00 0.00 H new ATOM 0 HE2 MET A 61 -2.818 6.280 15.556 1.00 0.00 H new ATOM 0 HE3 MET A 61 -3.665 5.650 16.989 1.00 0.00 H new ATOM 948 N PRO A 62 -2.892 1.054 12.899 1.00 0.00 N ATOM 949 CA PRO A 62 -3.868 -0.017 13.019 1.00 0.00 C ATOM 950 C PRO A 62 -3.208 -1.305 13.514 1.00 0.00 C ATOM 951 O PRO A 62 -2.131 -1.268 14.109 1.00 0.00 O ATOM 952 CB PRO A 62 -4.474 -0.154 11.632 1.00 0.00 C ATOM 953 CG PRO A 62 -3.496 0.519 10.682 1.00 0.00 C ATOM 954 CD PRO A 62 -2.525 1.339 11.516 1.00 0.00 C ATOM 0 HA PRO A 62 -4.641 0.198 13.757 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -4.615 -1.202 11.369 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -5.454 0.321 11.585 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -2.960 -0.227 10.095 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -4.027 1.158 9.977 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -1.492 1.055 11.314 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -2.613 2.403 11.294 1.00 0.00 H new ATOM 962 N LYS A 63 -3.880 -2.416 13.250 1.00 0.00 N ATOM 963 CA LYS A 63 -3.373 -3.714 13.661 1.00 0.00 C ATOM 964 C LYS A 63 -2.041 -3.982 12.959 1.00 0.00 C ATOM 965 O LYS A 63 -1.171 -4.657 13.507 1.00 0.00 O ATOM 966 CB LYS A 63 -4.424 -4.800 13.421 1.00 0.00 C ATOM 967 CG LYS A 63 -5.364 -4.929 14.621 1.00 0.00 C ATOM 968 CD LYS A 63 -4.999 -6.142 15.477 1.00 0.00 C ATOM 969 CE LYS A 63 -3.505 -6.458 15.371 1.00 0.00 C ATOM 970 NZ LYS A 63 -3.010 -7.057 16.631 1.00 0.00 N ATOM 0 H LYS A 63 -4.772 -2.444 12.756 1.00 0.00 H new ATOM 0 HA LYS A 63 -3.176 -3.724 14.733 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -5.000 -4.562 12.527 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -3.930 -5.754 13.237 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -5.313 -4.024 15.226 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -6.393 -5.022 14.273 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -5.261 -5.949 16.517 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -5.581 -7.006 15.157 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -3.331 -7.144 14.542 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -2.949 -5.546 15.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -1.995 -7.265 16.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -3.159 -6.390 17.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -3.528 -7.938 16.824 1.00 0.00 H new ATOM 984 N MET A 64 -1.922 -3.439 11.756 1.00 0.00 N ATOM 985 CA MET A 64 -0.710 -3.610 10.974 1.00 0.00 C ATOM 986 C MET A 64 -0.462 -2.398 10.074 1.00 0.00 C ATOM 987 O MET A 64 -1.309 -2.046 9.254 1.00 0.00 O ATOM 988 CB MET A 64 -0.832 -4.869 10.112 1.00 0.00 C ATOM 989 CG MET A 64 -1.397 -6.036 10.925 1.00 0.00 C ATOM 990 SD MET A 64 -1.113 -7.573 10.063 1.00 0.00 S ATOM 991 CE MET A 64 0.612 -7.828 10.441 1.00 0.00 C ATOM 0 H MET A 64 -2.646 -2.880 11.304 1.00 0.00 H new ATOM 0 HA MET A 64 0.131 -3.708 11.660 1.00 0.00 H new ATOM 0 HB2 MET A 64 -1.479 -4.668 9.258 1.00 0.00 H new ATOM 0 HB3 MET A 64 0.146 -5.138 9.714 1.00 0.00 H new ATOM 0 HG2 MET A 64 -0.926 -6.068 11.907 1.00 0.00 H new ATOM 0 HG3 MET A 64 -2.465 -5.893 11.088 1.00 0.00 H new ATOM 0 HE1 MET A 64 0.917 -8.817 10.098 1.00 0.00 H new ATOM 0 HE2 MET A 64 1.211 -7.069 9.938 1.00 0.00 H new ATOM 0 HE3 MET A 64 0.763 -7.755 11.518 1.00 0.00 H new ATOM 1001 N ASP A 65 0.702 -1.793 10.257 1.00 0.00 N ATOM 1002 CA ASP A 65 1.072 -0.628 9.471 1.00 0.00 C ATOM 1003 C ASP A 65 2.422 -0.880 8.797 1.00 0.00 C ATOM 1004 O ASP A 65 3.079 -1.882 9.072 1.00 0.00 O ATOM 1005 CB ASP A 65 1.211 0.611 10.358 1.00 0.00 C ATOM 1006 CG ASP A 65 1.156 1.948 9.614 1.00 0.00 C ATOM 1007 OD1 ASP A 65 0.032 2.340 9.236 1.00 0.00 O ATOM 1008 OD2 ASP A 65 2.240 2.546 9.441 1.00 0.00 O ATOM 0 H ASP A 65 1.402 -2.088 10.938 1.00 0.00 H new ATOM 0 HA ASP A 65 0.290 -0.458 8.731 1.00 0.00 H new ATOM 0 HB2 ASP A 65 0.418 0.595 11.105 1.00 0.00 H new ATOM 0 HB3 ASP A 65 2.157 0.550 10.896 1.00 0.00 H new ATOM 1013 N GLY A 66 2.794 0.046 7.926 1.00 0.00 N ATOM 1014 CA GLY A 66 4.054 -0.064 7.209 1.00 0.00 C ATOM 1015 C GLY A 66 5.057 -0.914 7.991 1.00 0.00 C ATOM 1016 O GLY A 66 5.800 -1.699 7.405 1.00 0.00 O ATOM 0 H GLY A 66 2.246 0.876 7.700 1.00 0.00 H new ATOM 0 HA2 GLY A 66 3.881 -0.509 6.229 1.00 0.00 H new ATOM 0 HA3 GLY A 66 4.468 0.930 7.040 1.00 0.00 H new ATOM 1020 N LEU A 67 5.046 -0.728 9.303 1.00 0.00 N ATOM 1021 CA LEU A 67 5.945 -1.469 10.172 1.00 0.00 C ATOM 1022 C LEU A 67 5.475 -2.922 10.266 1.00 0.00 C ATOM 1023 O LEU A 67 6.175 -3.833 9.829 1.00 0.00 O ATOM 1024 CB LEU A 67 6.072 -0.774 11.528 1.00 0.00 C ATOM 1025 CG LEU A 67 6.587 0.666 11.499 1.00 0.00 C ATOM 1026 CD1 LEU A 67 8.013 0.729 10.947 1.00 0.00 C ATOM 1027 CD2 LEU A 67 5.631 1.574 10.721 1.00 0.00 C ATOM 0 H LEU A 67 4.429 -0.075 9.785 1.00 0.00 H new ATOM 0 HA LEU A 67 6.951 -1.487 9.754 1.00 0.00 H new ATOM 0 HB2 LEU A 67 5.094 -0.779 12.009 1.00 0.00 H new ATOM 0 HB3 LEU A 67 6.739 -1.365 12.155 1.00 0.00 H new ATOM 0 HG LEU A 67 6.622 1.036 12.524 1.00 0.00 H new ATOM 0 HD11 LEU A 67 8.354 1.764 10.938 1.00 0.00 H new ATOM 0 HD12 LEU A 67 8.674 0.135 11.578 1.00 0.00 H new ATOM 0 HD13 LEU A 67 8.028 0.333 9.932 1.00 0.00 H new ATOM 0 HD21 LEU A 67 6.020 2.592 10.715 1.00 0.00 H new ATOM 0 HD22 LEU A 67 5.541 1.214 9.696 1.00 0.00 H new ATOM 0 HD23 LEU A 67 4.650 1.563 11.197 1.00 0.00 H new ATOM 1039 N GLY A 68 4.293 -3.091 10.841 1.00 0.00 N ATOM 1040 CA GLY A 68 3.722 -4.418 10.999 1.00 0.00 C ATOM 1041 C GLY A 68 3.520 -5.093 9.641 1.00 0.00 C ATOM 1042 O GLY A 68 3.763 -6.291 9.497 1.00 0.00 O ATOM 0 H GLY A 68 3.716 -2.332 11.203 1.00 0.00 H new ATOM 0 HA2 GLY A 68 4.378 -5.029 11.619 1.00 0.00 H new ATOM 0 HA3 GLY A 68 2.767 -4.347 11.520 1.00 0.00 H new ATOM 1046 N LEU A 69 3.078 -4.296 8.679 1.00 0.00 N ATOM 1047 CA LEU A 69 2.841 -4.802 7.338 1.00 0.00 C ATOM 1048 C LEU A 69 4.120 -5.458 6.812 1.00 0.00 C ATOM 1049 O LEU A 69 4.083 -6.574 6.296 1.00 0.00 O ATOM 1050 CB LEU A 69 2.302 -3.692 6.433 1.00 0.00 C ATOM 1051 CG LEU A 69 0.860 -3.861 5.950 1.00 0.00 C ATOM 1052 CD1 LEU A 69 -0.110 -3.925 7.132 1.00 0.00 C ATOM 1053 CD2 LEU A 69 0.482 -2.761 4.957 1.00 0.00 C ATOM 0 H LEU A 69 2.878 -3.303 8.802 1.00 0.00 H new ATOM 0 HA LEU A 69 2.069 -5.572 7.352 1.00 0.00 H new ATOM 0 HB2 LEU A 69 2.376 -2.746 6.969 1.00 0.00 H new ATOM 0 HB3 LEU A 69 2.950 -3.616 5.560 1.00 0.00 H new ATOM 0 HG LEU A 69 0.786 -4.811 5.421 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -1.128 -4.045 6.761 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.147 -4.772 7.768 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -0.041 -3.003 7.710 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -0.548 -2.905 4.629 1.00 0.00 H new ATOM 0 HD22 LEU A 69 0.577 -1.788 5.438 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.147 -2.806 4.094 1.00 0.00 H new ATOM 1065 N LEU A 70 5.220 -4.735 6.960 1.00 0.00 N ATOM 1066 CA LEU A 70 6.509 -5.233 6.506 1.00 0.00 C ATOM 1067 C LEU A 70 6.809 -6.564 7.197 1.00 0.00 C ATOM 1068 O LEU A 70 6.799 -7.616 6.559 1.00 0.00 O ATOM 1069 CB LEU A 70 7.594 -4.174 6.710 1.00 0.00 C ATOM 1070 CG LEU A 70 8.982 -4.523 6.167 1.00 0.00 C ATOM 1071 CD1 LEU A 70 10.021 -3.497 6.621 1.00 0.00 C ATOM 1072 CD2 LEU A 70 9.378 -5.949 6.552 1.00 0.00 C ATOM 0 H LEU A 70 5.246 -3.809 7.387 1.00 0.00 H new ATOM 0 HA LEU A 70 6.486 -5.429 5.434 1.00 0.00 H new ATOM 0 HB2 LEU A 70 7.264 -3.248 6.239 1.00 0.00 H new ATOM 0 HB3 LEU A 70 7.683 -3.974 7.778 1.00 0.00 H new ATOM 0 HG LEU A 70 8.944 -4.483 5.078 1.00 0.00 H new ATOM 0 HD11 LEU A 70 10.998 -3.768 6.222 1.00 0.00 H new ATOM 0 HD12 LEU A 70 9.741 -2.509 6.255 1.00 0.00 H new ATOM 0 HD13 LEU A 70 10.065 -3.482 7.710 1.00 0.00 H new ATOM 0 HD21 LEU A 70 10.368 -6.172 6.154 1.00 0.00 H new ATOM 0 HD22 LEU A 70 9.394 -6.041 7.638 1.00 0.00 H new ATOM 0 HD23 LEU A 70 8.654 -6.652 6.139 1.00 0.00 H new ATOM 1084 N GLN A 71 7.070 -6.474 8.493 1.00 0.00 N ATOM 1085 CA GLN A 71 7.374 -7.659 9.279 1.00 0.00 C ATOM 1086 C GLN A 71 6.409 -8.792 8.923 1.00 0.00 C ATOM 1087 O GLN A 71 6.778 -9.965 8.976 1.00 0.00 O ATOM 1088 CB GLN A 71 7.328 -7.350 10.777 1.00 0.00 C ATOM 1089 CG GLN A 71 8.160 -6.109 11.106 1.00 0.00 C ATOM 1090 CD GLN A 71 8.753 -6.204 12.513 1.00 0.00 C ATOM 1091 OE1 GLN A 71 9.373 -7.184 12.888 1.00 0.00 O ATOM 1092 NE2 GLN A 71 8.528 -5.132 13.268 1.00 0.00 N ATOM 0 H GLN A 71 7.077 -5.600 9.019 1.00 0.00 H new ATOM 0 HA GLN A 71 8.387 -7.981 9.039 1.00 0.00 H new ATOM 0 HB2 GLN A 71 6.295 -7.193 11.088 1.00 0.00 H new ATOM 0 HB3 GLN A 71 7.704 -8.204 11.340 1.00 0.00 H new ATOM 0 HG2 GLN A 71 8.962 -6.000 10.376 1.00 0.00 H new ATOM 0 HG3 GLN A 71 7.537 -5.218 11.030 1.00 0.00 H new ATOM 0 HE21 GLN A 71 8.000 -4.344 12.891 1.00 0.00 H new ATOM 0 HE22 GLN A 71 8.883 -5.098 14.224 1.00 0.00 H new ATOM 1101 N ALA A 72 5.194 -8.404 8.569 1.00 0.00 N ATOM 1102 CA ALA A 72 4.174 -9.373 8.206 1.00 0.00 C ATOM 1103 C ALA A 72 4.602 -10.103 6.931 1.00 0.00 C ATOM 1104 O ALA A 72 4.570 -11.331 6.874 1.00 0.00 O ATOM 1105 CB ALA A 72 2.828 -8.663 8.046 1.00 0.00 C ATOM 0 H ALA A 72 4.892 -7.431 8.526 1.00 0.00 H new ATOM 0 HA ALA A 72 4.057 -10.120 8.992 1.00 0.00 H new ATOM 0 HB1 ALA A 72 2.063 -9.390 7.774 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.555 -8.184 8.986 1.00 0.00 H new ATOM 0 HB3 ALA A 72 2.906 -7.908 7.264 1.00 0.00 H new ATOM 1111 N VAL A 73 4.995 -9.316 5.939 1.00 0.00 N ATOM 1112 CA VAL A 73 5.428 -9.871 4.670 1.00 0.00 C ATOM 1113 C VAL A 73 6.629 -10.791 4.904 1.00 0.00 C ATOM 1114 O VAL A 73 6.631 -11.940 4.463 1.00 0.00 O ATOM 1115 CB VAL A 73 5.725 -8.745 3.679 1.00 0.00 C ATOM 1116 CG1 VAL A 73 4.848 -7.523 3.961 1.00 0.00 C ATOM 1117 CG2 VAL A 73 7.208 -8.372 3.698 1.00 0.00 C ATOM 0 H VAL A 73 5.022 -8.298 5.990 1.00 0.00 H new ATOM 0 HA VAL A 73 4.635 -10.474 4.228 1.00 0.00 H new ATOM 0 HB VAL A 73 5.485 -9.107 2.679 1.00 0.00 H new ATOM 0 HG11 VAL A 73 5.078 -6.736 3.243 1.00 0.00 H new ATOM 0 HG12 VAL A 73 3.798 -7.800 3.871 1.00 0.00 H new ATOM 0 HG13 VAL A 73 5.042 -7.161 4.971 1.00 0.00 H new ATOM 0 HG21 VAL A 73 7.390 -7.569 2.984 1.00 0.00 H new ATOM 0 HG22 VAL A 73 7.487 -8.039 4.698 1.00 0.00 H new ATOM 0 HG23 VAL A 73 7.806 -9.242 3.426 1.00 0.00 H new ATOM 1127 N ARG A 74 7.620 -10.252 5.598 1.00 0.00 N ATOM 1128 CA ARG A 74 8.824 -11.010 5.896 1.00 0.00 C ATOM 1129 C ARG A 74 8.472 -12.468 6.196 1.00 0.00 C ATOM 1130 O ARG A 74 9.269 -13.368 5.939 1.00 0.00 O ATOM 1131 CB ARG A 74 9.567 -10.414 7.094 1.00 0.00 C ATOM 1132 CG ARG A 74 9.902 -8.941 6.854 1.00 0.00 C ATOM 1133 CD ARG A 74 10.234 -8.688 5.382 1.00 0.00 C ATOM 1134 NE ARG A 74 11.409 -9.492 4.981 1.00 0.00 N ATOM 1135 CZ ARG A 74 11.814 -9.650 3.714 1.00 0.00 C ATOM 1136 NH1 ARG A 74 11.142 -9.060 2.717 1.00 0.00 N ATOM 1137 NH2 ARG A 74 12.892 -10.400 3.444 1.00 0.00 N ATOM 0 H ARG A 74 7.614 -9.299 5.963 1.00 0.00 H new ATOM 0 HA ARG A 74 9.472 -10.962 5.021 1.00 0.00 H new ATOM 0 HB2 ARG A 74 8.955 -10.510 7.991 1.00 0.00 H new ATOM 0 HB3 ARG A 74 10.484 -10.975 7.273 1.00 0.00 H new ATOM 0 HG2 ARG A 74 9.058 -8.319 7.152 1.00 0.00 H new ATOM 0 HG3 ARG A 74 10.748 -8.650 7.477 1.00 0.00 H new ATOM 0 HD2 ARG A 74 9.378 -8.945 4.759 1.00 0.00 H new ATOM 0 HD3 ARG A 74 10.437 -7.629 5.224 1.00 0.00 H new ATOM 0 HE ARG A 74 11.944 -9.955 5.715 1.00 0.00 H new ATOM 0 HH11 ARG A 74 10.321 -8.490 2.922 1.00 0.00 H new ATOM 0 HH12 ARG A 74 11.451 -9.181 1.752 1.00 0.00 H new ATOM 0 HH21 ARG A 74 13.403 -10.850 4.203 1.00 0.00 H new ATOM 0 HH22 ARG A 74 13.201 -10.521 2.479 1.00 0.00 H new ATOM 1151 N ALA A 75 7.277 -12.656 6.738 1.00 0.00 N ATOM 1152 CA ALA A 75 6.810 -13.989 7.075 1.00 0.00 C ATOM 1153 C ALA A 75 6.184 -14.634 5.838 1.00 0.00 C ATOM 1154 O ALA A 75 6.536 -15.755 5.472 1.00 0.00 O ATOM 1155 CB ALA A 75 5.830 -13.906 8.249 1.00 0.00 C ATOM 0 H ALA A 75 6.619 -11.907 6.952 1.00 0.00 H new ATOM 0 HA ALA A 75 7.642 -14.619 7.389 1.00 0.00 H new ATOM 0 HB1 ALA A 75 5.480 -14.907 8.502 1.00 0.00 H new ATOM 0 HB2 ALA A 75 6.332 -13.469 9.112 1.00 0.00 H new ATOM 0 HB3 ALA A 75 4.980 -13.284 7.970 1.00 0.00 H new ATOM 1161 N ASN A 76 5.265 -13.900 5.227 1.00 0.00 N ATOM 1162 CA ASN A 76 4.586 -14.387 4.038 1.00 0.00 C ATOM 1163 C ASN A 76 5.280 -13.826 2.795 1.00 0.00 C ATOM 1164 O ASN A 76 5.404 -12.612 2.643 1.00 0.00 O ATOM 1165 CB ASN A 76 3.127 -13.930 4.012 1.00 0.00 C ATOM 1166 CG ASN A 76 2.177 -15.120 4.167 1.00 0.00 C ATOM 1167 OD1 ASN A 76 2.584 -16.244 4.411 1.00 0.00 O ATOM 1168 ND2 ASN A 76 0.893 -14.811 4.012 1.00 0.00 N ATOM 0 H ASN A 76 4.975 -12.971 5.533 1.00 0.00 H new ATOM 0 HA ASN A 76 4.622 -15.476 4.050 1.00 0.00 H new ATOM 0 HB2 ASN A 76 2.952 -13.214 4.815 1.00 0.00 H new ATOM 0 HB3 ASN A 76 2.920 -13.415 3.074 1.00 0.00 H new ATOM 0 HD21 ASN A 76 0.180 -15.536 4.096 1.00 0.00 H new ATOM 0 HD22 ASN A 76 0.621 -13.849 3.809 1.00 0.00 H new ATOM 1175 N PRO A 77 5.725 -14.762 1.914 1.00 0.00 N ATOM 1176 CA PRO A 77 6.403 -14.374 0.689 1.00 0.00 C ATOM 1177 C PRO A 77 5.409 -13.829 -0.339 1.00 0.00 C ATOM 1178 O PRO A 77 5.805 -13.199 -1.319 1.00 0.00 O ATOM 1179 CB PRO A 77 7.114 -15.632 0.217 1.00 0.00 C ATOM 1180 CG PRO A 77 6.436 -16.788 0.934 1.00 0.00 C ATOM 1181 CD PRO A 77 5.594 -16.209 2.060 1.00 0.00 C ATOM 0 HA PRO A 77 7.115 -13.563 0.842 1.00 0.00 H new ATOM 0 HB2 PRO A 77 7.035 -15.743 -0.864 1.00 0.00 H new ATOM 0 HB3 PRO A 77 8.177 -15.593 0.457 1.00 0.00 H new ATOM 0 HG2 PRO A 77 5.811 -17.353 0.242 1.00 0.00 H new ATOM 0 HG3 PRO A 77 7.179 -17.480 1.330 1.00 0.00 H new ATOM 0 HD2 PRO A 77 4.553 -16.523 1.978 1.00 0.00 H new ATOM 0 HD3 PRO A 77 5.952 -16.543 3.034 1.00 0.00 H new ATOM 1189 N ALA A 78 4.135 -14.091 -0.080 1.00 0.00 N ATOM 1190 CA ALA A 78 3.082 -13.634 -0.970 1.00 0.00 C ATOM 1191 C ALA A 78 3.056 -12.104 -0.982 1.00 0.00 C ATOM 1192 O ALA A 78 2.993 -11.489 -2.044 1.00 0.00 O ATOM 1193 CB ALA A 78 1.746 -14.236 -0.531 1.00 0.00 C ATOM 0 H ALA A 78 3.810 -14.614 0.733 1.00 0.00 H new ATOM 0 HA ALA A 78 3.271 -13.968 -1.990 1.00 0.00 H new ATOM 0 HB1 ALA A 78 0.956 -13.893 -1.199 1.00 0.00 H new ATOM 0 HB2 ALA A 78 1.807 -15.324 -0.569 1.00 0.00 H new ATOM 0 HB3 ALA A 78 1.522 -13.921 0.488 1.00 0.00 H new ATOM 1199 N THR A 79 3.107 -11.535 0.214 1.00 0.00 N ATOM 1200 CA THR A 79 3.091 -10.089 0.355 1.00 0.00 C ATOM 1201 C THR A 79 4.517 -9.533 0.323 1.00 0.00 C ATOM 1202 O THR A 79 4.724 -8.363 0.006 1.00 0.00 O ATOM 1203 CB THR A 79 2.336 -9.748 1.641 1.00 0.00 C ATOM 1204 OG1 THR A 79 2.899 -8.506 2.056 1.00 0.00 O ATOM 1205 CG2 THR A 79 2.665 -10.707 2.786 1.00 0.00 C ATOM 0 H THR A 79 3.159 -12.049 1.093 1.00 0.00 H new ATOM 0 HA THR A 79 2.573 -9.617 -0.479 1.00 0.00 H new ATOM 0 HB THR A 79 1.264 -9.769 1.447 1.00 0.00 H new ATOM 0 HG1 THR A 79 2.189 -7.922 2.394 1.00 0.00 H new ATOM 0 HG21 THR A 79 2.102 -10.420 3.674 1.00 0.00 H new ATOM 0 HG22 THR A 79 2.395 -11.723 2.498 1.00 0.00 H new ATOM 0 HG23 THR A 79 3.732 -10.663 3.002 1.00 0.00 H new ATOM 1213 N LYS A 80 5.463 -10.401 0.655 1.00 0.00 N ATOM 1214 CA LYS A 80 6.862 -10.011 0.667 1.00 0.00 C ATOM 1215 C LYS A 80 7.248 -9.462 -0.708 1.00 0.00 C ATOM 1216 O LYS A 80 8.222 -8.722 -0.833 1.00 0.00 O ATOM 1217 CB LYS A 80 7.738 -11.177 1.132 1.00 0.00 C ATOM 1218 CG LYS A 80 8.378 -11.891 -0.061 1.00 0.00 C ATOM 1219 CD LYS A 80 9.515 -11.058 -0.653 1.00 0.00 C ATOM 1220 CE LYS A 80 10.770 -11.908 -0.855 1.00 0.00 C ATOM 1221 NZ LYS A 80 11.899 -11.362 -0.067 1.00 0.00 N ATOM 0 H LYS A 80 5.288 -11.371 0.917 1.00 0.00 H new ATOM 0 HA LYS A 80 7.028 -9.210 1.387 1.00 0.00 H new ATOM 0 HB2 LYS A 80 8.516 -10.808 1.800 1.00 0.00 H new ATOM 0 HB3 LYS A 80 7.136 -11.884 1.703 1.00 0.00 H new ATOM 0 HG2 LYS A 80 8.760 -12.862 0.254 1.00 0.00 H new ATOM 0 HG3 LYS A 80 7.623 -12.078 -0.825 1.00 0.00 H new ATOM 0 HD2 LYS A 80 9.201 -10.634 -1.607 1.00 0.00 H new ATOM 0 HD3 LYS A 80 9.741 -10.222 0.009 1.00 0.00 H new ATOM 0 HE2 LYS A 80 10.572 -12.937 -0.553 1.00 0.00 H new ATOM 0 HE3 LYS A 80 11.034 -11.931 -1.912 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 12.743 -11.951 -0.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 12.098 -10.388 -0.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 11.650 -11.363 0.943 1.00 0.00 H new ATOM 1235 N LYS A 81 6.464 -9.847 -1.704 1.00 0.00 N ATOM 1236 CA LYS A 81 6.710 -9.403 -3.064 1.00 0.00 C ATOM 1237 C LYS A 81 5.711 -8.302 -3.426 1.00 0.00 C ATOM 1238 O LYS A 81 5.716 -7.797 -4.548 1.00 0.00 O ATOM 1239 CB LYS A 81 6.692 -10.591 -4.028 1.00 0.00 C ATOM 1240 CG LYS A 81 5.355 -10.677 -4.768 1.00 0.00 C ATOM 1241 CD LYS A 81 5.091 -12.101 -5.261 1.00 0.00 C ATOM 1242 CE LYS A 81 4.092 -12.819 -4.353 1.00 0.00 C ATOM 1243 NZ LYS A 81 3.701 -14.121 -4.938 1.00 0.00 N ATOM 0 H LYS A 81 5.658 -10.462 -1.595 1.00 0.00 H new ATOM 0 HA LYS A 81 7.707 -8.970 -3.148 1.00 0.00 H new ATOM 0 HB2 LYS A 81 7.504 -10.492 -4.748 1.00 0.00 H new ATOM 0 HB3 LYS A 81 6.866 -11.515 -3.476 1.00 0.00 H new ATOM 0 HG2 LYS A 81 4.548 -10.362 -4.106 1.00 0.00 H new ATOM 0 HG3 LYS A 81 5.359 -9.990 -5.614 1.00 0.00 H new ATOM 0 HD2 LYS A 81 4.705 -12.071 -6.280 1.00 0.00 H new ATOM 0 HD3 LYS A 81 6.027 -12.659 -5.291 1.00 0.00 H new ATOM 0 HE2 LYS A 81 4.533 -12.974 -3.368 1.00 0.00 H new ATOM 0 HE3 LYS A 81 3.208 -12.197 -4.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 3.022 -14.595 -4.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 3.261 -13.966 -5.867 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 4.545 -14.719 -5.050 1.00 0.00 H new ATOM 1257 N ALA A 82 4.877 -7.962 -2.454 1.00 0.00 N ATOM 1258 CA ALA A 82 3.873 -6.930 -2.657 1.00 0.00 C ATOM 1259 C ALA A 82 4.339 -5.634 -1.990 1.00 0.00 C ATOM 1260 O ALA A 82 4.997 -5.669 -0.951 1.00 0.00 O ATOM 1261 CB ALA A 82 2.527 -7.414 -2.114 1.00 0.00 C ATOM 0 H ALA A 82 4.876 -8.382 -1.525 1.00 0.00 H new ATOM 0 HA ALA A 82 3.741 -6.725 -3.720 1.00 0.00 H new ATOM 0 HB1 ALA A 82 1.774 -6.641 -2.266 1.00 0.00 H new ATOM 0 HB2 ALA A 82 2.227 -8.321 -2.640 1.00 0.00 H new ATOM 0 HB3 ALA A 82 2.619 -7.626 -1.049 1.00 0.00 H new ATOM 1267 N ALA A 83 3.979 -4.523 -2.614 1.00 0.00 N ATOM 1268 CA ALA A 83 4.351 -3.219 -2.094 1.00 0.00 C ATOM 1269 C ALA A 83 3.247 -2.710 -1.165 1.00 0.00 C ATOM 1270 O ALA A 83 2.181 -3.316 -1.072 1.00 0.00 O ATOM 1271 CB ALA A 83 4.619 -2.262 -3.258 1.00 0.00 C ATOM 0 H ALA A 83 3.433 -4.499 -3.475 1.00 0.00 H new ATOM 0 HA ALA A 83 5.268 -3.288 -1.509 1.00 0.00 H new ATOM 0 HB1 ALA A 83 4.898 -1.283 -2.868 1.00 0.00 H new ATOM 0 HB2 ALA A 83 5.431 -2.653 -3.871 1.00 0.00 H new ATOM 0 HB3 ALA A 83 3.719 -2.167 -3.866 1.00 0.00 H new ATOM 1277 N PHE A 84 3.541 -1.603 -0.499 1.00 0.00 N ATOM 1278 CA PHE A 84 2.587 -1.006 0.420 1.00 0.00 C ATOM 1279 C PHE A 84 2.738 0.516 0.457 1.00 0.00 C ATOM 1280 O PHE A 84 3.854 1.030 0.514 1.00 0.00 O ATOM 1281 CB PHE A 84 2.891 -1.570 1.809 1.00 0.00 C ATOM 1282 CG PHE A 84 3.790 -2.808 1.795 1.00 0.00 C ATOM 1283 CD1 PHE A 84 3.272 -4.021 1.467 1.00 0.00 C ATOM 1284 CD2 PHE A 84 5.108 -2.694 2.110 1.00 0.00 C ATOM 1285 CE1 PHE A 84 4.106 -5.170 1.453 1.00 0.00 C ATOM 1286 CE2 PHE A 84 5.943 -3.843 2.097 1.00 0.00 C ATOM 1287 CZ PHE A 84 5.424 -5.057 1.768 1.00 0.00 C ATOM 0 H PHE A 84 4.427 -1.104 -0.578 1.00 0.00 H new ATOM 0 HA PHE A 84 1.570 -1.235 0.101 1.00 0.00 H new ATOM 0 HB2 PHE A 84 3.368 -0.794 2.408 1.00 0.00 H new ATOM 0 HB3 PHE A 84 1.952 -1.821 2.301 1.00 0.00 H new ATOM 0 HD1 PHE A 84 2.225 -4.111 1.217 1.00 0.00 H new ATOM 0 HD2 PHE A 84 5.520 -1.730 2.370 1.00 0.00 H new ATOM 0 HE1 PHE A 84 3.694 -6.134 1.192 1.00 0.00 H new ATOM 0 HE2 PHE A 84 6.990 -3.753 2.348 1.00 0.00 H new ATOM 0 HZ PHE A 84 6.059 -5.931 1.757 1.00 0.00 H new ATOM 1297 N ILE A 85 1.600 1.193 0.422 1.00 0.00 N ATOM 1298 CA ILE A 85 1.592 2.646 0.449 1.00 0.00 C ATOM 1299 C ILE A 85 1.064 3.122 1.804 1.00 0.00 C ATOM 1300 O ILE A 85 0.034 2.643 2.276 1.00 0.00 O ATOM 1301 CB ILE A 85 0.814 3.201 -0.745 1.00 0.00 C ATOM 1302 CG1 ILE A 85 1.293 2.568 -2.053 1.00 0.00 C ATOM 1303 CG2 ILE A 85 0.888 4.729 -0.786 1.00 0.00 C ATOM 1304 CD1 ILE A 85 0.587 3.197 -3.256 1.00 0.00 C ATOM 0 H ILE A 85 0.677 0.762 0.375 1.00 0.00 H new ATOM 0 HA ILE A 85 2.605 3.035 0.346 1.00 0.00 H new ATOM 0 HB ILE A 85 -0.236 2.933 -0.623 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.371 2.697 -2.151 1.00 0.00 H new ATOM 0 HG13 ILE A 85 1.101 1.495 -2.034 1.00 0.00 H new ATOM 0 HG21 ILE A 85 0.327 5.098 -1.645 1.00 0.00 H new ATOM 0 HG22 ILE A 85 0.461 5.139 0.130 1.00 0.00 H new ATOM 0 HG23 ILE A 85 1.929 5.041 -0.872 1.00 0.00 H new ATOM 0 HD11 ILE A 85 0.945 2.730 -4.173 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -0.489 3.045 -3.167 1.00 0.00 H new ATOM 0 HD13 ILE A 85 0.801 4.265 -3.286 1.00 0.00 H new ATOM 1316 N ILE A 86 1.792 4.061 2.391 1.00 0.00 N ATOM 1317 CA ILE A 86 1.408 4.607 3.681 1.00 0.00 C ATOM 1318 C ILE A 86 1.322 6.132 3.579 1.00 0.00 C ATOM 1319 O ILE A 86 2.341 6.808 3.447 1.00 0.00 O ATOM 1320 CB ILE A 86 2.359 4.117 4.775 1.00 0.00 C ATOM 1321 CG1 ILE A 86 2.740 2.652 4.553 1.00 0.00 C ATOM 1322 CG2 ILE A 86 1.764 4.352 6.165 1.00 0.00 C ATOM 1323 CD1 ILE A 86 1.532 1.735 4.757 1.00 0.00 C ATOM 0 H ILE A 86 2.645 4.457 1.997 1.00 0.00 H new ATOM 0 HA ILE A 86 0.419 4.249 3.967 1.00 0.00 H new ATOM 0 HB ILE A 86 3.278 4.701 4.717 1.00 0.00 H new ATOM 0 HG12 ILE A 86 3.133 2.523 3.544 1.00 0.00 H new ATOM 0 HG13 ILE A 86 3.535 2.371 5.243 1.00 0.00 H new ATOM 0 HG21 ILE A 86 2.460 3.995 6.924 1.00 0.00 H new ATOM 0 HG22 ILE A 86 1.586 5.418 6.309 1.00 0.00 H new ATOM 0 HG23 ILE A 86 0.822 3.811 6.254 1.00 0.00 H new ATOM 0 HD11 ILE A 86 1.830 0.699 4.593 1.00 0.00 H new ATOM 0 HD12 ILE A 86 1.157 1.848 5.774 1.00 0.00 H new ATOM 0 HD13 ILE A 86 0.748 2.003 4.049 1.00 0.00 H new ATOM 1335 N LEU A 87 0.095 6.629 3.645 1.00 0.00 N ATOM 1336 CA LEU A 87 -0.137 8.060 3.561 1.00 0.00 C ATOM 1337 C LEU A 87 -0.840 8.534 4.835 1.00 0.00 C ATOM 1338 O LEU A 87 -1.379 7.725 5.588 1.00 0.00 O ATOM 1339 CB LEU A 87 -0.894 8.406 2.277 1.00 0.00 C ATOM 1340 CG LEU A 87 -2.415 8.515 2.403 1.00 0.00 C ATOM 1341 CD1 LEU A 87 -3.015 7.215 2.944 1.00 0.00 C ATOM 1342 CD2 LEU A 87 -2.809 9.724 3.253 1.00 0.00 C ATOM 0 H LEU A 87 -0.748 6.066 3.756 1.00 0.00 H new ATOM 0 HA LEU A 87 0.810 8.596 3.500 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -0.512 9.354 1.898 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -0.665 7.648 1.528 1.00 0.00 H new ATOM 0 HG LEU A 87 -2.830 8.672 1.407 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -4.097 7.319 3.024 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.779 6.395 2.266 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -2.597 7.003 3.928 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.895 9.778 3.327 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -2.382 9.622 4.251 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -2.431 10.634 2.788 1.00 0.00 H new ATOM 1354 N THR A 88 -0.810 9.843 5.037 1.00 0.00 N ATOM 1355 CA THR A 88 -1.436 10.433 6.207 1.00 0.00 C ATOM 1356 C THR A 88 -2.141 11.740 5.833 1.00 0.00 C ATOM 1357 O THR A 88 -2.042 12.198 4.696 1.00 0.00 O ATOM 1358 CB THR A 88 -0.361 10.610 7.282 1.00 0.00 C ATOM 1359 OG1 THR A 88 -0.938 11.533 8.202 1.00 0.00 O ATOM 1360 CG2 THR A 88 0.878 11.335 6.755 1.00 0.00 C ATOM 0 H THR A 88 -0.362 10.511 4.410 1.00 0.00 H new ATOM 0 HA THR A 88 -2.213 9.783 6.608 1.00 0.00 H new ATOM 0 HB THR A 88 -0.073 9.634 7.672 1.00 0.00 H new ATOM 0 HG1 THR A 88 -0.308 11.703 8.933 1.00 0.00 H new ATOM 0 HG21 THR A 88 1.610 11.435 7.557 1.00 0.00 H new ATOM 0 HG22 THR A 88 1.313 10.763 5.936 1.00 0.00 H new ATOM 0 HG23 THR A 88 0.595 12.325 6.396 1.00 0.00 H new ATOM 1368 N ALA A 89 -2.837 12.301 6.811 1.00 0.00 N ATOM 1369 CA ALA A 89 -3.557 13.544 6.598 1.00 0.00 C ATOM 1370 C ALA A 89 -2.560 14.661 6.288 1.00 0.00 C ATOM 1371 O ALA A 89 -2.946 15.737 5.834 1.00 0.00 O ATOM 1372 CB ALA A 89 -4.415 13.853 7.827 1.00 0.00 C ATOM 0 H ALA A 89 -2.917 11.917 7.753 1.00 0.00 H new ATOM 0 HA ALA A 89 -4.228 13.457 5.744 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -4.956 14.786 7.668 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -5.127 13.043 7.986 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -3.774 13.950 8.703 1.00 0.00 H new ATOM 1378 N GLN A 90 -1.293 14.366 6.544 1.00 0.00 N ATOM 1379 CA GLN A 90 -0.236 15.333 6.297 1.00 0.00 C ATOM 1380 C GLN A 90 0.808 14.746 5.346 1.00 0.00 C ATOM 1381 O GLN A 90 0.702 14.900 4.129 1.00 0.00 O ATOM 1382 CB GLN A 90 0.410 15.785 7.608 1.00 0.00 C ATOM 1383 CG GLN A 90 -0.537 16.682 8.406 1.00 0.00 C ATOM 1384 CD GLN A 90 0.183 17.937 8.902 1.00 0.00 C ATOM 1385 OE1 GLN A 90 1.369 18.128 8.689 1.00 0.00 O ATOM 1386 NE2 GLN A 90 -0.598 18.779 9.574 1.00 0.00 N ATOM 0 H GLN A 90 -0.975 13.472 6.919 1.00 0.00 H new ATOM 0 HA GLN A 90 -0.676 16.211 5.825 1.00 0.00 H new ATOM 0 HB2 GLN A 90 0.679 14.913 8.204 1.00 0.00 H new ATOM 0 HB3 GLN A 90 1.334 16.323 7.396 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -1.385 16.967 7.783 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -0.938 16.129 9.255 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -1.583 18.557 9.716 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -0.211 19.646 9.947 1.00 0.00 H new ATOM 1395 N GLY A 91 1.793 14.083 5.935 1.00 0.00 N ATOM 1396 CA GLY A 91 2.856 13.472 5.154 1.00 0.00 C ATOM 1397 C GLY A 91 4.018 13.043 6.051 1.00 0.00 C ATOM 1398 O GLY A 91 4.452 13.802 6.916 1.00 0.00 O ATOM 0 H GLY A 91 1.877 13.956 6.943 1.00 0.00 H new ATOM 0 HA2 GLY A 91 2.467 12.606 4.618 1.00 0.00 H new ATOM 0 HA3 GLY A 91 3.212 14.178 4.404 1.00 0.00 H new ATOM 1402 N ASP A 92 4.490 11.828 5.813 1.00 0.00 N ATOM 1403 CA ASP A 92 5.594 11.289 6.589 1.00 0.00 C ATOM 1404 C ASP A 92 6.524 10.499 5.665 1.00 0.00 C ATOM 1405 O ASP A 92 6.463 9.271 5.622 1.00 0.00 O ATOM 1406 CB ASP A 92 5.091 10.341 7.678 1.00 0.00 C ATOM 1407 CG ASP A 92 4.022 10.927 8.603 1.00 0.00 C ATOM 1408 OD1 ASP A 92 3.999 12.170 8.727 1.00 0.00 O ATOM 1409 OD2 ASP A 92 3.253 10.118 9.165 1.00 0.00 O ATOM 0 H ASP A 92 4.128 11.202 5.094 1.00 0.00 H new ATOM 0 HA ASP A 92 6.119 12.124 7.053 1.00 0.00 H new ATOM 0 HB2 ASP A 92 4.688 9.447 7.202 1.00 0.00 H new ATOM 0 HB3 ASP A 92 5.940 10.025 8.284 1.00 0.00 H new ATOM 1414 N ARG A 93 7.360 11.235 4.950 1.00 0.00 N ATOM 1415 CA ARG A 93 8.301 10.618 4.029 1.00 0.00 C ATOM 1416 C ARG A 93 9.277 9.719 4.791 1.00 0.00 C ATOM 1417 O ARG A 93 9.663 8.660 4.300 1.00 0.00 O ATOM 1418 CB ARG A 93 9.090 11.677 3.256 1.00 0.00 C ATOM 1419 CG ARG A 93 8.265 12.236 2.096 1.00 0.00 C ATOM 1420 CD ARG A 93 8.686 13.669 1.765 1.00 0.00 C ATOM 1421 NE ARG A 93 7.798 14.630 2.457 1.00 0.00 N ATOM 1422 CZ ARG A 93 7.887 15.962 2.328 1.00 0.00 C ATOM 1423 NH1 ARG A 93 8.824 16.497 1.535 1.00 0.00 N ATOM 1424 NH2 ARG A 93 7.039 16.756 2.995 1.00 0.00 N ATOM 0 H ARG A 93 7.406 12.253 4.989 1.00 0.00 H new ATOM 0 HA ARG A 93 7.728 10.020 3.321 1.00 0.00 H new ATOM 0 HB2 ARG A 93 9.374 12.487 3.928 1.00 0.00 H new ATOM 0 HB3 ARG A 93 10.013 11.241 2.874 1.00 0.00 H new ATOM 0 HG2 ARG A 93 8.391 11.604 1.217 1.00 0.00 H new ATOM 0 HG3 ARG A 93 7.206 12.215 2.354 1.00 0.00 H new ATOM 0 HD2 ARG A 93 9.720 13.833 2.069 1.00 0.00 H new ATOM 0 HD3 ARG A 93 8.641 13.830 0.688 1.00 0.00 H new ATOM 0 HE ARG A 93 7.074 14.256 3.070 1.00 0.00 H new ATOM 0 HH11 ARG A 93 9.470 15.891 1.029 1.00 0.00 H new ATOM 0 HH12 ARG A 93 8.891 17.510 1.437 1.00 0.00 H new ATOM 0 HH21 ARG A 93 6.327 16.347 3.600 1.00 0.00 H new ATOM 0 HH22 ARG A 93 7.106 17.769 2.898 1.00 0.00 H new ATOM 1438 N ALA A 94 9.647 10.175 5.979 1.00 0.00 N ATOM 1439 CA ALA A 94 10.570 9.425 6.813 1.00 0.00 C ATOM 1440 C ALA A 94 9.909 8.117 7.251 1.00 0.00 C ATOM 1441 O ALA A 94 10.552 7.069 7.277 1.00 0.00 O ATOM 1442 CB ALA A 94 11.000 10.288 8.002 1.00 0.00 C ATOM 0 H ALA A 94 9.324 11.054 6.383 1.00 0.00 H new ATOM 0 HA ALA A 94 11.470 9.168 6.254 1.00 0.00 H new ATOM 0 HB1 ALA A 94 11.693 9.726 8.628 1.00 0.00 H new ATOM 0 HB2 ALA A 94 11.491 11.190 7.638 1.00 0.00 H new ATOM 0 HB3 ALA A 94 10.123 10.563 8.588 1.00 0.00 H new ATOM 1448 N LEU A 95 8.631 8.220 7.585 1.00 0.00 N ATOM 1449 CA LEU A 95 7.874 7.059 8.020 1.00 0.00 C ATOM 1450 C LEU A 95 7.887 6.002 6.913 1.00 0.00 C ATOM 1451 O LEU A 95 8.188 4.837 7.166 1.00 0.00 O ATOM 1452 CB LEU A 95 6.469 7.469 8.462 1.00 0.00 C ATOM 1453 CG LEU A 95 6.370 8.181 9.813 1.00 0.00 C ATOM 1454 CD1 LEU A 95 6.156 7.176 10.948 1.00 0.00 C ATOM 1455 CD2 LEU A 95 7.595 9.066 10.057 1.00 0.00 C ATOM 0 H LEU A 95 8.100 9.091 7.563 1.00 0.00 H new ATOM 0 HA LEU A 95 8.339 6.609 8.897 1.00 0.00 H new ATOM 0 HB2 LEU A 95 6.046 8.121 7.698 1.00 0.00 H new ATOM 0 HB3 LEU A 95 5.846 6.575 8.499 1.00 0.00 H new ATOM 0 HG LEU A 95 5.498 8.835 9.791 1.00 0.00 H new ATOM 0 HD11 LEU A 95 6.089 7.708 11.897 1.00 0.00 H new ATOM 0 HD12 LEU A 95 5.232 6.624 10.776 1.00 0.00 H new ATOM 0 HD13 LEU A 95 6.994 6.480 10.981 1.00 0.00 H new ATOM 0 HD21 LEU A 95 7.500 9.561 11.024 1.00 0.00 H new ATOM 0 HD22 LEU A 95 8.495 8.451 10.051 1.00 0.00 H new ATOM 0 HD23 LEU A 95 7.664 9.817 9.270 1.00 0.00 H new ATOM 1467 N VAL A 96 7.556 6.449 5.711 1.00 0.00 N ATOM 1468 CA VAL A 96 7.526 5.557 4.563 1.00 0.00 C ATOM 1469 C VAL A 96 8.932 5.012 4.310 1.00 0.00 C ATOM 1470 O VAL A 96 9.144 3.800 4.321 1.00 0.00 O ATOM 1471 CB VAL A 96 6.938 6.283 3.352 1.00 0.00 C ATOM 1472 CG1 VAL A 96 7.686 5.906 2.071 1.00 0.00 C ATOM 1473 CG2 VAL A 96 5.440 6.000 3.216 1.00 0.00 C ATOM 0 H VAL A 96 7.306 7.417 5.506 1.00 0.00 H new ATOM 0 HA VAL A 96 6.877 4.703 4.759 1.00 0.00 H new ATOM 0 HB VAL A 96 7.063 7.354 3.510 1.00 0.00 H new ATOM 0 HG11 VAL A 96 7.248 6.436 1.225 1.00 0.00 H new ATOM 0 HG12 VAL A 96 8.736 6.182 2.168 1.00 0.00 H new ATOM 0 HG13 VAL A 96 7.607 4.831 1.906 1.00 0.00 H new ATOM 0 HG21 VAL A 96 5.047 6.528 2.347 1.00 0.00 H new ATOM 0 HG22 VAL A 96 5.282 4.929 3.091 1.00 0.00 H new ATOM 0 HG23 VAL A 96 4.922 6.341 4.113 1.00 0.00 H new ATOM 1483 N GLN A 97 9.858 5.933 4.086 1.00 0.00 N ATOM 1484 CA GLN A 97 11.239 5.559 3.830 1.00 0.00 C ATOM 1485 C GLN A 97 11.745 4.616 4.922 1.00 0.00 C ATOM 1486 O GLN A 97 12.642 3.809 4.684 1.00 0.00 O ATOM 1487 CB GLN A 97 12.130 6.798 3.719 1.00 0.00 C ATOM 1488 CG GLN A 97 11.763 7.630 2.488 1.00 0.00 C ATOM 1489 CD GLN A 97 12.988 7.871 1.604 1.00 0.00 C ATOM 1490 OE1 GLN A 97 13.391 8.995 1.350 1.00 0.00 O ATOM 1491 NE2 GLN A 97 13.557 6.757 1.151 1.00 0.00 N ATOM 0 H GLN A 97 9.679 6.937 4.076 1.00 0.00 H new ATOM 0 HA GLN A 97 11.282 5.034 2.876 1.00 0.00 H new ATOM 0 HB2 GLN A 97 12.026 7.406 4.617 1.00 0.00 H new ATOM 0 HB3 GLN A 97 13.175 6.494 3.659 1.00 0.00 H new ATOM 0 HG2 GLN A 97 10.992 7.116 1.914 1.00 0.00 H new ATOM 0 HG3 GLN A 97 11.343 8.586 2.802 1.00 0.00 H new ATOM 0 HE21 GLN A 97 13.169 5.848 1.402 1.00 0.00 H new ATOM 0 HE22 GLN A 97 14.381 6.812 0.553 1.00 0.00 H new ATOM 1500 N LYS A 98 11.148 4.748 6.098 1.00 0.00 N ATOM 1501 CA LYS A 98 11.527 3.917 7.228 1.00 0.00 C ATOM 1502 C LYS A 98 11.070 2.479 6.974 1.00 0.00 C ATOM 1503 O LYS A 98 11.849 1.540 7.127 1.00 0.00 O ATOM 1504 CB LYS A 98 10.992 4.511 8.532 1.00 0.00 C ATOM 1505 CG LYS A 98 12.082 5.299 9.262 1.00 0.00 C ATOM 1506 CD LYS A 98 11.469 6.357 10.182 1.00 0.00 C ATOM 1507 CE LYS A 98 12.507 6.892 11.171 1.00 0.00 C ATOM 1508 NZ LYS A 98 12.460 6.126 12.436 1.00 0.00 N ATOM 0 H LYS A 98 10.404 5.418 6.292 1.00 0.00 H new ATOM 0 HA LYS A 98 12.611 3.893 7.337 1.00 0.00 H new ATOM 0 HB2 LYS A 98 10.147 5.165 8.318 1.00 0.00 H new ATOM 0 HB3 LYS A 98 10.623 3.712 9.175 1.00 0.00 H new ATOM 0 HG2 LYS A 98 12.699 4.617 9.847 1.00 0.00 H new ATOM 0 HG3 LYS A 98 12.737 5.779 8.535 1.00 0.00 H new ATOM 0 HD2 LYS A 98 11.074 7.178 9.585 1.00 0.00 H new ATOM 0 HD3 LYS A 98 10.629 5.927 10.728 1.00 0.00 H new ATOM 0 HE2 LYS A 98 13.503 6.823 10.734 1.00 0.00 H new ATOM 0 HE3 LYS A 98 12.318 7.947 11.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 13.170 6.502 13.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 11.514 6.213 12.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 12.662 5.124 12.243 1.00 0.00 H new ATOM 1522 N ALA A 99 9.808 2.352 6.589 1.00 0.00 N ATOM 1523 CA ALA A 99 9.238 1.045 6.313 1.00 0.00 C ATOM 1524 C ALA A 99 10.093 0.332 5.263 1.00 0.00 C ATOM 1525 O ALA A 99 10.535 -0.795 5.479 1.00 0.00 O ATOM 1526 CB ALA A 99 7.783 1.205 5.869 1.00 0.00 C ATOM 0 H ALA A 99 9.165 3.133 6.462 1.00 0.00 H new ATOM 0 HA ALA A 99 9.238 0.429 7.212 1.00 0.00 H new ATOM 0 HB1 ALA A 99 7.356 0.224 5.662 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.212 1.690 6.661 1.00 0.00 H new ATOM 0 HB3 ALA A 99 7.743 1.816 4.967 1.00 0.00 H new ATOM 1532 N ALA A 100 10.299 1.019 4.149 1.00 0.00 N ATOM 1533 CA ALA A 100 11.092 0.466 3.065 1.00 0.00 C ATOM 1534 C ALA A 100 12.460 0.042 3.604 1.00 0.00 C ATOM 1535 O ALA A 100 12.922 -1.066 3.336 1.00 0.00 O ATOM 1536 CB ALA A 100 11.204 1.493 1.937 1.00 0.00 C ATOM 0 H ALA A 100 9.930 1.954 3.974 1.00 0.00 H new ATOM 0 HA ALA A 100 10.610 -0.420 2.652 1.00 0.00 H new ATOM 0 HB1 ALA A 100 11.799 1.077 1.124 1.00 0.00 H new ATOM 0 HB2 ALA A 100 10.208 1.739 1.569 1.00 0.00 H new ATOM 0 HB3 ALA A 100 11.685 2.396 2.313 1.00 0.00 H new ATOM 1542 N ALA A 101 13.070 0.947 4.356 1.00 0.00 N ATOM 1543 CA ALA A 101 14.376 0.682 4.936 1.00 0.00 C ATOM 1544 C ALA A 101 14.271 -0.507 5.895 1.00 0.00 C ATOM 1545 O ALA A 101 15.103 -1.412 5.859 1.00 0.00 O ATOM 1546 CB ALA A 101 14.895 1.944 5.627 1.00 0.00 C ATOM 0 H ALA A 101 12.684 1.865 4.577 1.00 0.00 H new ATOM 0 HA ALA A 101 15.094 0.418 4.160 1.00 0.00 H new ATOM 0 HB1 ALA A 101 15.874 1.744 6.062 1.00 0.00 H new ATOM 0 HB2 ALA A 101 14.979 2.750 4.898 1.00 0.00 H new ATOM 0 HB3 ALA A 101 14.202 2.239 6.415 1.00 0.00 H new ATOM 1552 N LEU A 102 13.242 -0.465 6.728 1.00 0.00 N ATOM 1553 CA LEU A 102 13.018 -1.527 7.693 1.00 0.00 C ATOM 1554 C LEU A 102 13.297 -2.878 7.034 1.00 0.00 C ATOM 1555 O LEU A 102 14.084 -3.673 7.546 1.00 0.00 O ATOM 1556 CB LEU A 102 11.616 -1.415 8.297 1.00 0.00 C ATOM 1557 CG LEU A 102 11.347 -0.167 9.141 1.00 0.00 C ATOM 1558 CD1 LEU A 102 10.614 -0.528 10.435 1.00 0.00 C ATOM 1559 CD2 LEU A 102 12.642 0.601 9.412 1.00 0.00 C ATOM 0 H LEU A 102 12.554 0.288 6.755 1.00 0.00 H new ATOM 0 HA LEU A 102 13.710 -1.432 8.530 1.00 0.00 H new ATOM 0 HB2 LEU A 102 10.889 -1.444 7.485 1.00 0.00 H new ATOM 0 HB3 LEU A 102 11.438 -2.294 8.917 1.00 0.00 H new ATOM 0 HG LEU A 102 10.693 0.495 8.573 1.00 0.00 H new ATOM 0 HD11 LEU A 102 10.435 0.377 11.016 1.00 0.00 H new ATOM 0 HD12 LEU A 102 9.661 -0.999 10.194 1.00 0.00 H new ATOM 0 HD13 LEU A 102 11.223 -1.219 11.018 1.00 0.00 H new ATOM 0 HD21 LEU A 102 12.423 1.483 10.014 1.00 0.00 H new ATOM 0 HD22 LEU A 102 13.340 -0.041 9.950 1.00 0.00 H new ATOM 0 HD23 LEU A 102 13.087 0.909 8.466 1.00 0.00 H new ATOM 1571 N GLY A 103 12.636 -3.099 5.907 1.00 0.00 N ATOM 1572 CA GLY A 103 12.803 -4.340 5.171 1.00 0.00 C ATOM 1573 C GLY A 103 11.561 -4.653 4.334 1.00 0.00 C ATOM 1574 O GLY A 103 11.148 -5.808 4.236 1.00 0.00 O ATOM 0 H GLY A 103 11.983 -2.438 5.486 1.00 0.00 H new ATOM 0 HA2 GLY A 103 13.675 -4.267 4.521 1.00 0.00 H new ATOM 0 HA3 GLY A 103 12.992 -5.157 5.867 1.00 0.00 H new ATOM 1578 N ALA A 104 11.000 -3.603 3.752 1.00 0.00 N ATOM 1579 CA ALA A 104 9.814 -3.751 2.925 1.00 0.00 C ATOM 1580 C ALA A 104 10.231 -3.886 1.460 1.00 0.00 C ATOM 1581 O ALA A 104 11.320 -3.458 1.079 1.00 0.00 O ATOM 1582 CB ALA A 104 8.878 -2.563 3.158 1.00 0.00 C ATOM 0 H ALA A 104 11.345 -2.647 3.837 1.00 0.00 H new ATOM 0 HA ALA A 104 9.268 -4.655 3.196 1.00 0.00 H new ATOM 0 HB1 ALA A 104 7.988 -2.674 2.538 1.00 0.00 H new ATOM 0 HB2 ALA A 104 8.587 -2.530 4.208 1.00 0.00 H new ATOM 0 HB3 ALA A 104 9.391 -1.638 2.894 1.00 0.00 H new ATOM 1588 N ASN A 105 9.343 -4.480 0.677 1.00 0.00 N ATOM 1589 CA ASN A 105 9.605 -4.676 -0.739 1.00 0.00 C ATOM 1590 C ASN A 105 9.544 -3.327 -1.457 1.00 0.00 C ATOM 1591 O ASN A 105 10.446 -2.982 -2.218 1.00 0.00 O ATOM 1592 CB ASN A 105 8.560 -5.597 -1.371 1.00 0.00 C ATOM 1593 CG ASN A 105 9.023 -6.094 -2.742 1.00 0.00 C ATOM 1594 OD1 ASN A 105 9.470 -7.218 -2.904 1.00 0.00 O ATOM 1595 ND2 ASN A 105 8.894 -5.197 -3.714 1.00 0.00 N ATOM 0 H ASN A 105 8.441 -4.832 0.996 1.00 0.00 H new ATOM 0 HA ASN A 105 10.591 -5.129 -0.839 1.00 0.00 H new ATOM 0 HB2 ASN A 105 8.376 -6.448 -0.715 1.00 0.00 H new ATOM 0 HB3 ASN A 105 7.615 -5.064 -1.474 1.00 0.00 H new ATOM 0 HD21 ASN A 105 9.177 -5.432 -4.665 1.00 0.00 H new ATOM 0 HD22 ASN A 105 8.512 -4.274 -3.509 1.00 0.00 H new ATOM 1602 N ASN A 106 8.468 -2.599 -1.189 1.00 0.00 N ATOM 1603 CA ASN A 106 8.276 -1.295 -1.799 1.00 0.00 C ATOM 1604 C ASN A 106 7.157 -0.554 -1.067 1.00 0.00 C ATOM 1605 O ASN A 106 6.003 -0.983 -1.091 1.00 0.00 O ATOM 1606 CB ASN A 106 7.873 -1.429 -3.269 1.00 0.00 C ATOM 1607 CG ASN A 106 9.010 -0.986 -4.193 1.00 0.00 C ATOM 1608 OD1 ASN A 106 9.886 -1.754 -4.554 1.00 0.00 O ATOM 1609 ND2 ASN A 106 8.947 0.293 -4.552 1.00 0.00 N ATOM 0 H ASN A 106 7.721 -2.889 -0.558 1.00 0.00 H new ATOM 0 HA ASN A 106 9.217 -0.749 -1.732 1.00 0.00 H new ATOM 0 HB2 ASN A 106 7.608 -2.464 -3.484 1.00 0.00 H new ATOM 0 HB3 ASN A 106 6.986 -0.826 -3.463 1.00 0.00 H new ATOM 0 HD21 ASN A 106 9.660 0.686 -5.166 1.00 0.00 H new ATOM 0 HD22 ASN A 106 8.185 0.881 -4.213 1.00 0.00 H new ATOM 1616 N VAL A 107 7.533 0.547 -0.434 1.00 0.00 N ATOM 1617 CA VAL A 107 6.575 1.352 0.304 1.00 0.00 C ATOM 1618 C VAL A 107 6.651 2.801 -0.182 1.00 0.00 C ATOM 1619 O VAL A 107 7.733 3.380 -0.249 1.00 0.00 O ATOM 1620 CB VAL A 107 6.821 1.212 1.808 1.00 0.00 C ATOM 1621 CG1 VAL A 107 8.240 1.653 2.174 1.00 0.00 C ATOM 1622 CG2 VAL A 107 5.780 1.995 2.609 1.00 0.00 C ATOM 0 H VAL A 107 8.489 0.901 -0.417 1.00 0.00 H new ATOM 0 HA VAL A 107 5.560 1.000 0.121 1.00 0.00 H new ATOM 0 HB VAL A 107 6.720 0.158 2.068 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.389 1.544 3.248 1.00 0.00 H new ATOM 0 HG12 VAL A 107 8.962 1.033 1.642 1.00 0.00 H new ATOM 0 HG13 VAL A 107 8.381 2.697 1.892 1.00 0.00 H new ATOM 0 HG21 VAL A 107 5.978 1.879 3.675 1.00 0.00 H new ATOM 0 HG22 VAL A 107 5.835 3.051 2.343 1.00 0.00 H new ATOM 0 HG23 VAL A 107 4.784 1.615 2.381 1.00 0.00 H new ATOM 1632 N LEU A 108 5.487 3.343 -0.508 1.00 0.00 N ATOM 1633 CA LEU A 108 5.408 4.713 -0.986 1.00 0.00 C ATOM 1634 C LEU A 108 4.471 5.512 -0.078 1.00 0.00 C ATOM 1635 O LEU A 108 3.532 4.959 0.491 1.00 0.00 O ATOM 1636 CB LEU A 108 5.007 4.744 -2.462 1.00 0.00 C ATOM 1637 CG LEU A 108 6.111 4.398 -3.464 1.00 0.00 C ATOM 1638 CD1 LEU A 108 7.430 5.072 -3.081 1.00 0.00 C ATOM 1639 CD2 LEU A 108 6.263 2.883 -3.613 1.00 0.00 C ATOM 0 H LEU A 108 4.591 2.859 -0.451 1.00 0.00 H new ATOM 0 HA LEU A 108 6.387 5.191 -0.935 1.00 0.00 H new ATOM 0 HB2 LEU A 108 4.180 4.049 -2.608 1.00 0.00 H new ATOM 0 HB3 LEU A 108 4.631 5.740 -2.695 1.00 0.00 H new ATOM 0 HG LEU A 108 5.821 4.789 -4.439 1.00 0.00 H new ATOM 0 HD11 LEU A 108 8.198 4.810 -3.809 1.00 0.00 H new ATOM 0 HD12 LEU A 108 7.296 6.154 -3.069 1.00 0.00 H new ATOM 0 HD13 LEU A 108 7.738 4.733 -2.092 1.00 0.00 H new ATOM 0 HD21 LEU A 108 7.054 2.666 -4.331 1.00 0.00 H new ATOM 0 HD22 LEU A 108 6.519 2.446 -2.648 1.00 0.00 H new ATOM 0 HD23 LEU A 108 5.325 2.456 -3.967 1.00 0.00 H new ATOM 1651 N ALA A 109 4.760 6.801 0.029 1.00 0.00 N ATOM 1652 CA ALA A 109 3.955 7.681 0.859 1.00 0.00 C ATOM 1653 C ALA A 109 3.177 8.648 -0.037 1.00 0.00 C ATOM 1654 O ALA A 109 3.407 8.702 -1.244 1.00 0.00 O ATOM 1655 CB ALA A 109 4.857 8.409 1.857 1.00 0.00 C ATOM 0 H ALA A 109 5.540 7.257 -0.445 1.00 0.00 H new ATOM 0 HA ALA A 109 3.229 7.107 1.435 1.00 0.00 H new ATOM 0 HB1 ALA A 109 4.253 9.069 2.479 1.00 0.00 H new ATOM 0 HB2 ALA A 109 5.365 7.679 2.488 1.00 0.00 H new ATOM 0 HB3 ALA A 109 5.597 8.998 1.316 1.00 0.00 H new ATOM 1661 N LYS A 110 2.272 9.387 0.589 1.00 0.00 N ATOM 1662 CA LYS A 110 1.460 10.348 -0.135 1.00 0.00 C ATOM 1663 C LYS A 110 1.483 11.689 0.603 1.00 0.00 C ATOM 1664 O LYS A 110 0.462 12.128 1.132 1.00 0.00 O ATOM 1665 CB LYS A 110 0.051 9.795 -0.363 1.00 0.00 C ATOM 1666 CG LYS A 110 -0.335 9.869 -1.842 1.00 0.00 C ATOM 1667 CD LYS A 110 -1.797 9.465 -2.047 1.00 0.00 C ATOM 1668 CE LYS A 110 -2.544 10.515 -2.872 1.00 0.00 C ATOM 1669 NZ LYS A 110 -3.928 10.067 -3.148 1.00 0.00 N ATOM 0 H LYS A 110 2.084 9.339 1.590 1.00 0.00 H new ATOM 0 HA LYS A 110 1.873 10.524 -1.128 1.00 0.00 H new ATOM 0 HB2 LYS A 110 0.003 8.761 -0.022 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -0.666 10.360 0.232 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -0.178 10.882 -2.212 1.00 0.00 H new ATOM 0 HG3 LYS A 110 0.313 9.213 -2.424 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -1.844 8.500 -2.551 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -2.284 9.343 -1.079 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -2.562 11.463 -2.335 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -2.018 10.691 -3.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -4.422 10.790 -3.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -3.904 9.173 -3.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -4.432 9.922 -2.250 1.00 0.00 H new ATOM 1683 N PRO A 111 2.689 12.317 0.614 1.00 0.00 N ATOM 1684 CA PRO A 111 2.858 13.598 1.278 1.00 0.00 C ATOM 1685 C PRO A 111 2.237 14.728 0.455 1.00 0.00 C ATOM 1686 O PRO A 111 1.396 14.483 -0.408 1.00 0.00 O ATOM 1687 CB PRO A 111 4.359 13.752 1.460 1.00 0.00 C ATOM 1688 CG PRO A 111 5.000 12.778 0.483 1.00 0.00 C ATOM 1689 CD PRO A 111 3.918 11.827 -0.002 1.00 0.00 C ATOM 0 HA PRO A 111 2.347 13.644 2.240 1.00 0.00 H new ATOM 0 HB2 PRO A 111 4.674 14.775 1.255 1.00 0.00 H new ATOM 0 HB3 PRO A 111 4.653 13.527 2.485 1.00 0.00 H new ATOM 0 HG2 PRO A 111 5.442 13.314 -0.357 1.00 0.00 H new ATOM 0 HG3 PRO A 111 5.805 12.226 0.967 1.00 0.00 H new ATOM 0 HD2 PRO A 111 3.845 11.832 -1.090 1.00 0.00 H new ATOM 0 HD3 PRO A 111 4.129 10.801 0.298 1.00 0.00 H new ATOM 1697 N PHE A 112 2.677 15.943 0.751 1.00 0.00 N ATOM 1698 CA PHE A 112 2.175 17.112 0.049 1.00 0.00 C ATOM 1699 C PHE A 112 3.085 17.479 -1.125 1.00 0.00 C ATOM 1700 O PHE A 112 3.047 18.607 -1.616 1.00 0.00 O ATOM 1701 CB PHE A 112 2.168 18.267 1.052 1.00 0.00 C ATOM 1702 CG PHE A 112 0.805 18.520 1.699 1.00 0.00 C ATOM 1703 CD1 PHE A 112 0.402 17.765 2.757 1.00 0.00 C ATOM 1704 CD2 PHE A 112 -0.006 19.501 1.216 1.00 0.00 C ATOM 1705 CE1 PHE A 112 -0.862 18.001 3.357 1.00 0.00 C ATOM 1706 CE2 PHE A 112 -1.271 19.736 1.816 1.00 0.00 C ATOM 1707 CZ PHE A 112 -1.672 18.980 2.874 1.00 0.00 C ATOM 0 H PHE A 112 3.375 16.143 1.467 1.00 0.00 H new ATOM 0 HA PHE A 112 1.180 16.909 -0.346 1.00 0.00 H new ATOM 0 HB2 PHE A 112 2.898 18.059 1.835 1.00 0.00 H new ATOM 0 HB3 PHE A 112 2.493 19.176 0.546 1.00 0.00 H new ATOM 0 HD1 PHE A 112 1.044 16.986 3.140 1.00 0.00 H new ATOM 0 HD2 PHE A 112 0.313 20.101 0.376 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -1.181 17.403 4.198 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -1.915 20.514 1.433 1.00 0.00 H new ATOM 0 HZ PHE A 112 -2.635 19.158 3.330 1.00 0.00 H new ATOM 1717 N THR A 113 3.880 16.505 -1.543 1.00 0.00 N ATOM 1718 CA THR A 113 4.798 16.711 -2.651 1.00 0.00 C ATOM 1719 C THR A 113 4.538 15.685 -3.757 1.00 0.00 C ATOM 1720 O THR A 113 5.013 14.553 -3.682 1.00 0.00 O ATOM 1721 CB THR A 113 6.224 16.662 -2.100 1.00 0.00 C ATOM 1722 OG1 THR A 113 7.030 16.399 -3.245 1.00 0.00 O ATOM 1723 CG2 THR A 113 6.459 15.453 -1.193 1.00 0.00 C ATOM 0 H THR A 113 3.908 15.571 -1.134 1.00 0.00 H new ATOM 0 HA THR A 113 4.647 17.686 -3.113 1.00 0.00 H new ATOM 0 HB THR A 113 6.431 17.577 -1.546 1.00 0.00 H new ATOM 0 HG1 THR A 113 7.972 16.353 -2.978 1.00 0.00 H new ATOM 0 HG21 THR A 113 7.486 15.466 -0.829 1.00 0.00 H new ATOM 0 HG22 THR A 113 5.773 15.494 -0.347 1.00 0.00 H new ATOM 0 HG23 THR A 113 6.285 14.536 -1.756 1.00 0.00 H new ATOM 1731 N ILE A 114 3.785 16.119 -4.756 1.00 0.00 N ATOM 1732 CA ILE A 114 3.456 15.252 -5.876 1.00 0.00 C ATOM 1733 C ILE A 114 4.742 14.640 -6.436 1.00 0.00 C ATOM 1734 O ILE A 114 4.716 13.555 -7.014 1.00 0.00 O ATOM 1735 CB ILE A 114 2.632 16.012 -6.918 1.00 0.00 C ATOM 1736 CG1 ILE A 114 3.443 17.156 -7.530 1.00 0.00 C ATOM 1737 CG2 ILE A 114 1.311 16.502 -6.321 1.00 0.00 C ATOM 1738 CD1 ILE A 114 3.732 16.892 -9.009 1.00 0.00 C ATOM 0 H ILE A 114 3.393 17.059 -4.814 1.00 0.00 H new ATOM 0 HA ILE A 114 2.826 14.426 -5.546 1.00 0.00 H new ATOM 0 HB ILE A 114 2.385 15.324 -7.726 1.00 0.00 H new ATOM 0 HG12 ILE A 114 2.895 18.092 -7.424 1.00 0.00 H new ATOM 0 HG13 ILE A 114 4.381 17.273 -6.987 1.00 0.00 H new ATOM 0 HG21 ILE A 114 0.745 17.039 -7.082 1.00 0.00 H new ATOM 0 HG22 ILE A 114 0.731 15.648 -5.972 1.00 0.00 H new ATOM 0 HG23 ILE A 114 1.515 17.169 -5.483 1.00 0.00 H new ATOM 0 HD11 ILE A 114 4.310 17.720 -9.420 1.00 0.00 H new ATOM 0 HD12 ILE A 114 4.301 15.968 -9.109 1.00 0.00 H new ATOM 0 HD13 ILE A 114 2.792 16.800 -9.553 1.00 0.00 H new ATOM 1750 N GLU A 115 5.835 15.363 -6.245 1.00 0.00 N ATOM 1751 CA GLU A 115 7.128 14.905 -6.724 1.00 0.00 C ATOM 1752 C GLU A 115 7.536 13.618 -6.002 1.00 0.00 C ATOM 1753 O GLU A 115 8.071 12.700 -6.620 1.00 0.00 O ATOM 1754 CB GLU A 115 8.193 15.991 -6.553 1.00 0.00 C ATOM 1755 CG GLU A 115 8.735 16.445 -7.909 1.00 0.00 C ATOM 1756 CD GLU A 115 9.616 17.688 -7.759 1.00 0.00 C ATOM 1757 OE1 GLU A 115 10.564 17.615 -6.948 1.00 0.00 O ATOM 1758 OE2 GLU A 115 9.321 18.681 -8.458 1.00 0.00 O ATOM 0 H GLU A 115 5.852 16.263 -5.765 1.00 0.00 H new ATOM 0 HA GLU A 115 7.044 14.690 -7.789 1.00 0.00 H new ATOM 0 HB2 GLU A 115 7.767 16.843 -6.024 1.00 0.00 H new ATOM 0 HB3 GLU A 115 9.010 15.611 -5.940 1.00 0.00 H new ATOM 0 HG2 GLU A 115 9.311 15.639 -8.363 1.00 0.00 H new ATOM 0 HG3 GLU A 115 7.906 16.662 -8.582 1.00 0.00 H new ATOM 1765 N LYS A 116 7.267 13.595 -4.705 1.00 0.00 N ATOM 1766 CA LYS A 116 7.599 12.437 -3.893 1.00 0.00 C ATOM 1767 C LYS A 116 6.594 11.318 -4.174 1.00 0.00 C ATOM 1768 O LYS A 116 6.978 10.218 -4.569 1.00 0.00 O ATOM 1769 CB LYS A 116 7.689 12.826 -2.417 1.00 0.00 C ATOM 1770 CG LYS A 116 8.762 12.005 -1.698 1.00 0.00 C ATOM 1771 CD LYS A 116 8.253 10.599 -1.375 1.00 0.00 C ATOM 1772 CE LYS A 116 9.416 9.623 -1.188 1.00 0.00 C ATOM 1773 NZ LYS A 116 9.624 8.823 -2.416 1.00 0.00 N ATOM 0 H LYS A 116 6.823 14.360 -4.196 1.00 0.00 H new ATOM 0 HA LYS A 116 8.585 12.055 -4.159 1.00 0.00 H new ATOM 0 HB2 LYS A 116 7.920 13.888 -2.330 1.00 0.00 H new ATOM 0 HB3 LYS A 116 6.723 12.669 -1.936 1.00 0.00 H new ATOM 0 HG2 LYS A 116 9.653 11.938 -2.322 1.00 0.00 H new ATOM 0 HG3 LYS A 116 9.055 12.510 -0.777 1.00 0.00 H new ATOM 0 HD2 LYS A 116 7.648 10.627 -0.469 1.00 0.00 H new ATOM 0 HD3 LYS A 116 7.606 10.249 -2.179 1.00 0.00 H new ATOM 0 HE2 LYS A 116 10.325 10.174 -0.947 1.00 0.00 H new ATOM 0 HE3 LYS A 116 9.212 8.961 -0.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 10.546 8.344 -2.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 8.869 8.113 -2.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 9.604 9.449 -3.246 1.00 0.00 H new ATOM 1787 N MET A 117 5.326 11.636 -3.959 1.00 0.00 N ATOM 1788 CA MET A 117 4.263 10.672 -4.184 1.00 0.00 C ATOM 1789 C MET A 117 4.315 10.121 -5.610 1.00 0.00 C ATOM 1790 O MET A 117 4.353 8.908 -5.810 1.00 0.00 O ATOM 1791 CB MET A 117 2.909 11.339 -3.942 1.00 0.00 C ATOM 1792 CG MET A 117 1.770 10.491 -4.513 1.00 0.00 C ATOM 1793 SD MET A 117 1.254 11.144 -6.091 1.00 0.00 S ATOM 1794 CE MET A 117 0.347 12.583 -5.551 1.00 0.00 C ATOM 0 H MET A 117 5.011 12.549 -3.631 1.00 0.00 H new ATOM 0 HA MET A 117 4.397 9.842 -3.490 1.00 0.00 H new ATOM 0 HB2 MET A 117 2.758 11.485 -2.873 1.00 0.00 H new ATOM 0 HB3 MET A 117 2.898 12.327 -4.403 1.00 0.00 H new ATOM 0 HG2 MET A 117 2.097 9.458 -4.627 1.00 0.00 H new ATOM 0 HG3 MET A 117 0.928 10.484 -3.820 1.00 0.00 H new ATOM 0 HE1 MET A 117 0.512 13.401 -6.252 1.00 0.00 H new ATOM 0 HE2 MET A 117 -0.717 12.349 -5.511 1.00 0.00 H new ATOM 0 HE3 MET A 117 0.691 12.879 -4.560 1.00 0.00 H new ATOM 1804 N LYS A 118 4.316 11.039 -6.565 1.00 0.00 N ATOM 1805 CA LYS A 118 4.362 10.661 -7.967 1.00 0.00 C ATOM 1806 C LYS A 118 5.609 9.813 -8.221 1.00 0.00 C ATOM 1807 O LYS A 118 5.508 8.670 -8.665 1.00 0.00 O ATOM 1808 CB LYS A 118 4.269 11.900 -8.860 1.00 0.00 C ATOM 1809 CG LYS A 118 3.973 11.511 -10.309 1.00 0.00 C ATOM 1810 CD LYS A 118 3.093 12.561 -10.991 1.00 0.00 C ATOM 1811 CE LYS A 118 1.624 12.381 -10.603 1.00 0.00 C ATOM 1812 NZ LYS A 118 0.995 13.692 -10.332 1.00 0.00 N ATOM 0 H LYS A 118 4.286 12.044 -6.395 1.00 0.00 H new ATOM 0 HA LYS A 118 3.499 10.046 -8.224 1.00 0.00 H new ATOM 0 HB2 LYS A 118 3.485 12.561 -8.490 1.00 0.00 H new ATOM 0 HB3 LYS A 118 5.205 12.457 -8.813 1.00 0.00 H new ATOM 0 HG2 LYS A 118 4.908 11.403 -10.858 1.00 0.00 H new ATOM 0 HG3 LYS A 118 3.475 10.542 -10.334 1.00 0.00 H new ATOM 0 HD2 LYS A 118 3.427 13.559 -10.709 1.00 0.00 H new ATOM 0 HD3 LYS A 118 3.199 12.483 -12.073 1.00 0.00 H new ATOM 0 HE2 LYS A 118 1.089 11.874 -11.406 1.00 0.00 H new ATOM 0 HE3 LYS A 118 1.550 11.746 -9.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -0.002 13.551 -10.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 1.495 14.162 -9.551 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 1.049 14.286 -11.184 1.00 0.00 H new ATOM 1826 N ALA A 119 6.758 10.405 -7.928 1.00 0.00 N ATOM 1827 CA ALA A 119 8.024 9.717 -8.119 1.00 0.00 C ATOM 1828 C ALA A 119 8.002 8.394 -7.352 1.00 0.00 C ATOM 1829 O ALA A 119 8.557 7.397 -7.810 1.00 0.00 O ATOM 1830 CB ALA A 119 9.172 10.629 -7.677 1.00 0.00 C ATOM 0 H ALA A 119 6.839 11.353 -7.560 1.00 0.00 H new ATOM 0 HA ALA A 119 8.179 9.484 -9.172 1.00 0.00 H new ATOM 0 HB1 ALA A 119 10.122 10.114 -7.820 1.00 0.00 H new ATOM 0 HB2 ALA A 119 9.161 11.542 -8.272 1.00 0.00 H new ATOM 0 HB3 ALA A 119 9.051 10.881 -6.624 1.00 0.00 H new ATOM 1836 N ALA A 120 7.355 8.428 -6.196 1.00 0.00 N ATOM 1837 CA ALA A 120 7.253 7.243 -5.361 1.00 0.00 C ATOM 1838 C ALA A 120 6.611 6.110 -6.166 1.00 0.00 C ATOM 1839 O ALA A 120 7.181 5.025 -6.279 1.00 0.00 O ATOM 1840 CB ALA A 120 6.463 7.577 -4.094 1.00 0.00 C ATOM 0 H ALA A 120 6.896 9.257 -5.818 1.00 0.00 H new ATOM 0 HA ALA A 120 8.242 6.907 -5.050 1.00 0.00 H new ATOM 0 HB1 ALA A 120 6.387 6.688 -3.468 1.00 0.00 H new ATOM 0 HB2 ALA A 120 6.975 8.366 -3.543 1.00 0.00 H new ATOM 0 HB3 ALA A 120 5.463 7.915 -4.367 1.00 0.00 H new ATOM 1846 N ILE A 121 5.436 6.401 -6.703 1.00 0.00 N ATOM 1847 CA ILE A 121 4.712 5.420 -7.493 1.00 0.00 C ATOM 1848 C ILE A 121 5.603 4.935 -8.637 1.00 0.00 C ATOM 1849 O ILE A 121 5.641 3.742 -8.937 1.00 0.00 O ATOM 1850 CB ILE A 121 3.370 5.992 -7.959 1.00 0.00 C ATOM 1851 CG1 ILE A 121 3.443 6.439 -9.420 1.00 0.00 C ATOM 1852 CG2 ILE A 121 2.906 7.121 -7.035 1.00 0.00 C ATOM 1853 CD1 ILE A 121 2.060 6.834 -9.941 1.00 0.00 C ATOM 0 H ILE A 121 4.967 7.302 -6.607 1.00 0.00 H new ATOM 0 HA ILE A 121 4.468 4.548 -6.887 1.00 0.00 H new ATOM 0 HB ILE A 121 2.622 5.201 -7.902 1.00 0.00 H new ATOM 0 HG12 ILE A 121 4.125 7.284 -9.512 1.00 0.00 H new ATOM 0 HG13 ILE A 121 3.849 5.633 -10.031 1.00 0.00 H new ATOM 0 HG21 ILE A 121 1.951 7.510 -7.387 1.00 0.00 H new ATOM 0 HG22 ILE A 121 2.790 6.737 -6.022 1.00 0.00 H new ATOM 0 HG23 ILE A 121 3.647 7.921 -7.037 1.00 0.00 H new ATOM 0 HD11 ILE A 121 2.139 7.148 -10.982 1.00 0.00 H new ATOM 0 HD12 ILE A 121 1.387 5.980 -9.870 1.00 0.00 H new ATOM 0 HD13 ILE A 121 1.667 7.656 -9.343 1.00 0.00 H new ATOM 1865 N GLU A 122 6.299 5.883 -9.247 1.00 0.00 N ATOM 1866 CA GLU A 122 7.189 5.567 -10.351 1.00 0.00 C ATOM 1867 C GLU A 122 8.216 4.518 -9.922 1.00 0.00 C ATOM 1868 O GLU A 122 8.803 3.838 -10.762 1.00 0.00 O ATOM 1869 CB GLU A 122 7.878 6.827 -10.877 1.00 0.00 C ATOM 1870 CG GLU A 122 6.857 7.813 -11.450 1.00 0.00 C ATOM 1871 CD GLU A 122 7.511 8.751 -12.467 1.00 0.00 C ATOM 1872 OE1 GLU A 122 8.504 9.404 -12.079 1.00 0.00 O ATOM 1873 OE2 GLU A 122 7.003 8.793 -13.607 1.00 0.00 O ATOM 0 H GLU A 122 6.264 6.871 -8.997 1.00 0.00 H new ATOM 0 HA GLU A 122 6.594 5.152 -11.164 1.00 0.00 H new ATOM 0 HB2 GLU A 122 8.436 7.304 -10.071 1.00 0.00 H new ATOM 0 HB3 GLU A 122 8.599 6.556 -11.648 1.00 0.00 H new ATOM 0 HG2 GLU A 122 6.044 7.265 -11.926 1.00 0.00 H new ATOM 0 HG3 GLU A 122 6.417 8.397 -10.642 1.00 0.00 H new ATOM 1880 N ALA A 123 8.402 4.419 -8.614 1.00 0.00 N ATOM 1881 CA ALA A 123 9.349 3.465 -8.063 1.00 0.00 C ATOM 1882 C ALA A 123 8.642 2.129 -7.827 1.00 0.00 C ATOM 1883 O ALA A 123 9.202 1.069 -8.102 1.00 0.00 O ATOM 1884 CB ALA A 123 9.961 4.034 -6.782 1.00 0.00 C ATOM 0 H ALA A 123 7.913 4.984 -7.920 1.00 0.00 H new ATOM 0 HA ALA A 123 10.165 3.287 -8.763 1.00 0.00 H new ATOM 0 HB1 ALA A 123 10.671 3.318 -6.369 1.00 0.00 H new ATOM 0 HB2 ALA A 123 10.477 4.967 -7.008 1.00 0.00 H new ATOM 0 HB3 ALA A 123 9.172 4.223 -6.054 1.00 0.00 H new ATOM 1890 N VAL A 124 7.421 2.223 -7.320 1.00 0.00 N ATOM 1891 CA VAL A 124 6.630 1.036 -7.044 1.00 0.00 C ATOM 1892 C VAL A 124 6.332 0.310 -8.359 1.00 0.00 C ATOM 1893 O VAL A 124 6.227 -0.914 -8.385 1.00 0.00 O ATOM 1894 CB VAL A 124 5.366 1.416 -6.272 1.00 0.00 C ATOM 1895 CG1 VAL A 124 4.157 1.499 -7.207 1.00 0.00 C ATOM 1896 CG2 VAL A 124 5.107 0.436 -5.127 1.00 0.00 C ATOM 0 H VAL A 124 6.960 3.104 -7.093 1.00 0.00 H new ATOM 0 HA VAL A 124 7.186 0.346 -6.410 1.00 0.00 H new ATOM 0 HB VAL A 124 5.523 2.404 -5.838 1.00 0.00 H new ATOM 0 HG11 VAL A 124 3.271 1.771 -6.633 1.00 0.00 H new ATOM 0 HG12 VAL A 124 4.340 2.254 -7.972 1.00 0.00 H new ATOM 0 HG13 VAL A 124 3.998 0.531 -7.683 1.00 0.00 H new ATOM 0 HG21 VAL A 124 4.202 0.729 -4.595 1.00 0.00 H new ATOM 0 HG22 VAL A 124 4.981 -0.569 -5.530 1.00 0.00 H new ATOM 0 HG23 VAL A 124 5.953 0.448 -4.439 1.00 0.00 H new ATOM 1906 N PHE A 125 6.206 1.097 -9.417 1.00 0.00 N ATOM 1907 CA PHE A 125 5.922 0.546 -10.730 1.00 0.00 C ATOM 1908 C PHE A 125 7.217 0.219 -11.478 1.00 0.00 C ATOM 1909 O PHE A 125 7.319 -0.824 -12.123 1.00 0.00 O ATOM 1910 CB PHE A 125 5.153 1.615 -11.509 1.00 0.00 C ATOM 1911 CG PHE A 125 3.785 1.956 -10.913 1.00 0.00 C ATOM 1912 CD1 PHE A 125 2.845 0.984 -10.770 1.00 0.00 C ATOM 1913 CD2 PHE A 125 3.511 3.230 -10.526 1.00 0.00 C ATOM 1914 CE1 PHE A 125 1.576 1.300 -10.217 1.00 0.00 C ATOM 1915 CE2 PHE A 125 2.242 3.545 -9.973 1.00 0.00 C ATOM 1916 CZ PHE A 125 1.301 2.574 -9.830 1.00 0.00 C ATOM 0 H PHE A 125 6.296 2.113 -9.391 1.00 0.00 H new ATOM 0 HA PHE A 125 5.348 -0.375 -10.630 1.00 0.00 H new ATOM 0 HB2 PHE A 125 5.755 2.522 -11.552 1.00 0.00 H new ATOM 0 HB3 PHE A 125 5.016 1.274 -12.535 1.00 0.00 H new ATOM 0 HD1 PHE A 125 3.064 -0.028 -11.077 1.00 0.00 H new ATOM 0 HD2 PHE A 125 4.258 4.002 -10.639 1.00 0.00 H new ATOM 0 HE1 PHE A 125 0.829 0.528 -10.104 1.00 0.00 H new ATOM 0 HE2 PHE A 125 2.024 4.557 -9.666 1.00 0.00 H new ATOM 0 HZ PHE A 125 0.336 2.815 -9.409 1.00 0.00 H new