USER MOD reduce.3.24.130724 H: found=0, std=0, add=661, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 660 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 65 LYS NZ :NH3+ -172:sc= 0.476 (180deg=0) USER MOD Set 1.2: A 124 GLN : amide:sc= 0.153 K(o=0.63,f=-2.9) USER MOD Set 2.1: A 62 HIS : no HE2:sc= -0.182 K(o=-0.39,f=-3.9) USER MOD Set 2.2: A 96 GLN : amide:sc= -0.213 X(o=-0.39,f=-0.89) USER MOD Single : A 58 SER OG : rot 89:sc= 0.759 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 ASN :FLIP amide:sc= -0.051 F(o=-0.71,f=-0.051) USER MOD Single : A 90 MET CE :methyl 176:sc= 0 (180deg=-0.016) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -173:sc= 0.241 (180deg=0.221) USER MOD Single : A 95 ASN : amide:sc= 1.04 K(o=1,f=-1) USER MOD Single : A 101 MET CE :methyl 176:sc= -5.54! (180deg=-5.77!) USER MOD Single : A 102 ASN : amide:sc= -0.398 X(o=-0.4,f=-0.0021) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0.74 USER MOD Single : A 108 ASN : amide:sc= 0 X(o=0,f=-0.0011) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 MET CE :methyl 148:sc= -0.404 (180deg=-1.12) USER MOD Single : A 112 ASN : amide:sc= 0.169 X(o=0.17,f=0) USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 TYR OH : rot 180:sc= -0.116 USER MOD Single : A 115 THR OG1 : rot 78:sc= 0.783 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0.00278 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 SER OG : rot 170:sc= 0.6 USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=-0.05) USER MOD Single : A 133 HIS : no HD1:sc= -0.109 X(o=-0.11,f=0.015) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ -171:sc= 1.06 (180deg=0.985) USER MOD ----------------------------------------------------------------- ATOM 113 N SER A 58 -7.500 10.342 -1.198 1.00 0.00 N ATOM 114 CA SER A 58 -6.844 10.931 -2.377 1.00 0.00 C ATOM 115 C SER A 58 -5.680 10.051 -2.880 1.00 0.00 C ATOM 116 O SER A 58 -5.665 8.839 -2.669 1.00 0.00 O ATOM 117 CB SER A 58 -6.419 12.374 -2.060 1.00 0.00 C ATOM 118 OG SER A 58 -6.092 13.093 -3.237 1.00 0.00 O ATOM 0 HA SER A 58 -7.554 10.969 -3.203 1.00 0.00 H new ATOM 0 HB2 SER A 58 -7.226 12.884 -1.534 1.00 0.00 H new ATOM 0 HB3 SER A 58 -5.559 12.362 -1.390 1.00 0.00 H new ATOM 0 HG SER A 58 -6.899 13.518 -3.596 1.00 0.00 H new ATOM 124 N ARG A 59 -4.729 10.647 -3.604 1.00 0.00 N ATOM 125 CA ARG A 59 -3.755 10.073 -4.548 1.00 0.00 C ATOM 126 C ARG A 59 -2.830 8.943 -4.083 1.00 0.00 C ATOM 127 O ARG A 59 -2.190 8.370 -4.964 1.00 0.00 O ATOM 128 CB ARG A 59 -2.932 11.239 -5.123 1.00 0.00 C ATOM 129 CG ARG A 59 -3.682 11.965 -6.261 1.00 0.00 C ATOM 130 CD ARG A 59 -3.264 13.431 -6.394 1.00 0.00 C ATOM 131 NE ARG A 59 -1.844 13.548 -6.772 1.00 0.00 N ATOM 132 CZ ARG A 59 -1.131 14.647 -6.915 1.00 0.00 C ATOM 133 NH1 ARG A 59 -1.645 15.835 -6.765 1.00 0.00 N ATOM 134 NH2 ARG A 59 0.132 14.563 -7.211 1.00 0.00 N ATOM 0 H ARG A 59 -4.606 11.657 -3.538 1.00 0.00 H new ATOM 0 HA ARG A 59 -4.367 9.547 -5.280 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -2.703 11.949 -4.328 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -1.980 10.862 -5.498 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -3.494 11.450 -7.203 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -4.755 11.911 -6.077 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -3.884 13.922 -7.144 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -3.436 13.948 -5.450 1.00 0.00 H new ATOM 0 HE ARG A 59 -1.353 12.671 -6.944 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -2.632 15.938 -6.529 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -1.060 16.662 -6.884 1.00 0.00 H new ATOM 0 HH21 ARG A 59 0.568 13.649 -7.332 1.00 0.00 H new ATOM 0 HH22 ARG A 59 0.687 15.411 -7.323 1.00 0.00 H new ATOM 148 N VAL A 60 -2.741 8.570 -2.798 1.00 0.00 N ATOM 149 CA VAL A 60 -2.004 7.353 -2.383 1.00 0.00 C ATOM 150 C VAL A 60 -2.913 6.162 -2.087 1.00 0.00 C ATOM 151 O VAL A 60 -3.918 6.268 -1.389 1.00 0.00 O ATOM 152 CB VAL A 60 -0.839 7.583 -1.407 1.00 0.00 C ATOM 153 CG1 VAL A 60 -1.042 8.246 -0.054 1.00 0.00 C ATOM 154 CG2 VAL A 60 -0.050 6.292 -1.200 1.00 0.00 C ATOM 0 H VAL A 60 -3.165 9.086 -2.027 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.460 7.043 -3.275 1.00 0.00 H new ATOM 0 HB VAL A 60 -0.314 8.366 -1.954 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -0.087 8.306 0.468 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -1.442 9.250 -0.197 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.743 7.658 0.538 1.00 0.00 H new ATOM 0 HG21 VAL A 60 0.771 6.474 -0.506 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -0.708 5.525 -0.791 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.351 5.954 -2.155 1.00 0.00 H new ATOM 164 N ILE A 61 -2.546 5.012 -2.649 1.00 0.00 N ATOM 165 CA ILE A 61 -3.115 3.677 -2.441 1.00 0.00 C ATOM 166 C ILE A 61 -2.067 2.833 -1.700 1.00 0.00 C ATOM 167 O ILE A 61 -0.873 3.092 -1.823 1.00 0.00 O ATOM 168 CB ILE A 61 -3.468 3.097 -3.828 1.00 0.00 C ATOM 169 CG1 ILE A 61 -4.604 3.897 -4.507 1.00 0.00 C ATOM 170 CG2 ILE A 61 -3.830 1.603 -3.820 1.00 0.00 C ATOM 171 CD1 ILE A 61 -4.497 3.813 -6.034 1.00 0.00 C ATOM 0 H ILE A 61 -1.778 4.985 -3.319 1.00 0.00 H new ATOM 0 HA ILE A 61 -4.024 3.693 -1.839 1.00 0.00 H new ATOM 0 HB ILE A 61 -2.548 3.195 -4.404 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -5.570 3.509 -4.185 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -4.558 4.940 -4.192 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.064 1.280 -4.834 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -2.986 1.026 -3.441 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.697 1.442 -3.179 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -5.307 4.384 -6.487 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -3.540 4.224 -6.355 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -4.568 2.771 -6.347 1.00 0.00 H new ATOM 183 N HIS A 62 -2.486 1.821 -0.946 1.00 0.00 N ATOM 184 CA HIS A 62 -1.611 0.909 -0.208 1.00 0.00 C ATOM 185 C HIS A 62 -1.874 -0.556 -0.592 1.00 0.00 C ATOM 186 O HIS A 62 -3.010 -0.950 -0.873 1.00 0.00 O ATOM 187 CB HIS A 62 -1.765 1.193 1.298 1.00 0.00 C ATOM 188 CG HIS A 62 -1.341 0.067 2.224 1.00 0.00 C ATOM 189 ND1 HIS A 62 -1.957 -1.159 2.374 1.00 0.00 N ATOM 190 CD2 HIS A 62 -0.323 0.116 3.136 1.00 0.00 C ATOM 191 CE1 HIS A 62 -1.301 -1.838 3.330 1.00 0.00 C ATOM 192 NE2 HIS A 62 -0.286 -1.108 3.819 1.00 0.00 N ATOM 0 H HIS A 62 -3.476 1.604 -0.826 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.569 1.084 -0.476 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -1.182 2.081 1.544 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.809 1.432 1.500 1.00 0.00 H new ATOM 0 HD1 HIS A 62 -2.767 -1.491 1.851 1.00 0.00 H new ATOM 0 HD2 HIS A 62 0.339 0.953 3.302 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -1.555 -2.834 3.660 1.00 0.00 H new ATOM 200 N ILE A 63 -0.805 -1.359 -0.566 1.00 0.00 N ATOM 201 CA ILE A 63 -0.730 -2.757 -1.007 1.00 0.00 C ATOM 202 C ILE A 63 -0.167 -3.637 0.126 1.00 0.00 C ATOM 203 O ILE A 63 0.762 -3.223 0.821 1.00 0.00 O ATOM 204 CB ILE A 63 0.158 -2.904 -2.279 1.00 0.00 C ATOM 205 CG1 ILE A 63 0.114 -1.678 -3.234 1.00 0.00 C ATOM 206 CG2 ILE A 63 -0.242 -4.197 -3.017 1.00 0.00 C ATOM 207 CD1 ILE A 63 1.007 -1.802 -4.481 1.00 0.00 C ATOM 0 H ILE A 63 0.092 -1.027 -0.212 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.739 -3.085 -1.257 1.00 0.00 H new ATOM 0 HB ILE A 63 1.194 -2.957 -1.945 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -0.916 -1.522 -3.555 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.412 -0.790 -2.677 1.00 0.00 H new ATOM 0 HG21 ILE A 63 0.373 -4.311 -3.910 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.090 -5.053 -2.360 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.292 -4.142 -3.304 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.912 -0.901 -5.088 1.00 0.00 H new ATOM 0 HD12 ILE A 63 2.046 -1.925 -4.174 1.00 0.00 H new ATOM 0 HD13 ILE A 63 0.697 -2.668 -5.066 1.00 0.00 H new ATOM 219 N ARG A 64 -0.674 -4.866 0.279 1.00 0.00 N ATOM 220 CA ARG A 64 -0.160 -5.937 1.166 1.00 0.00 C ATOM 221 C ARG A 64 0.190 -7.212 0.398 1.00 0.00 C ATOM 222 O ARG A 64 -0.097 -7.326 -0.797 1.00 0.00 O ATOM 223 CB ARG A 64 -1.088 -6.197 2.388 1.00 0.00 C ATOM 224 CG ARG A 64 -2.606 -6.041 2.187 1.00 0.00 C ATOM 225 CD ARG A 64 -3.392 -5.666 3.453 1.00 0.00 C ATOM 226 NE ARG A 64 -3.699 -6.819 4.320 1.00 0.00 N ATOM 227 CZ ARG A 64 -4.810 -7.533 4.348 1.00 0.00 C ATOM 228 NH1 ARG A 64 -5.785 -7.349 3.505 1.00 0.00 N ATOM 229 NH2 ARG A 64 -4.974 -8.447 5.255 1.00 0.00 N ATOM 0 H ARG A 64 -1.501 -5.165 -0.238 1.00 0.00 H new ATOM 0 HA ARG A 64 0.779 -5.571 1.581 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -0.900 -7.211 2.741 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -0.785 -5.520 3.187 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -2.781 -5.277 1.429 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -3.004 -6.977 1.794 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -2.819 -4.935 4.024 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -4.324 -5.182 3.162 1.00 0.00 H new ATOM 0 HE ARG A 64 -2.968 -7.098 4.974 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -5.708 -6.630 2.786 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -6.625 -7.924 3.564 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -4.244 -8.615 5.948 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -5.833 -8.997 5.275 1.00 0.00 H new ATOM 243 N LYS A 65 0.806 -8.177 1.097 1.00 0.00 N ATOM 244 CA LYS A 65 1.161 -9.528 0.607 1.00 0.00 C ATOM 245 C LYS A 65 2.243 -9.547 -0.484 1.00 0.00 C ATOM 246 O LYS A 65 2.374 -10.541 -1.201 1.00 0.00 O ATOM 247 CB LYS A 65 -0.092 -10.311 0.149 1.00 0.00 C ATOM 248 CG LYS A 65 -1.339 -10.158 1.030 1.00 0.00 C ATOM 249 CD LYS A 65 -1.226 -10.693 2.462 1.00 0.00 C ATOM 250 CE LYS A 65 -2.006 -12.005 2.664 1.00 0.00 C ATOM 251 NZ LYS A 65 -1.367 -13.179 2.010 1.00 0.00 N ATOM 0 H LYS A 65 1.086 -8.035 2.067 1.00 0.00 H new ATOM 0 HA LYS A 65 1.602 -10.031 1.468 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.345 -9.994 -0.863 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.164 -11.369 0.097 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -1.596 -9.100 1.079 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -2.170 -10.665 0.539 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -0.176 -10.858 2.703 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -1.599 -9.941 3.158 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -2.102 -12.201 3.732 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -3.015 -11.884 2.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -2.005 -13.998 2.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -1.175 -12.958 1.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -0.474 -13.402 2.493 1.00 0.00 H new ATOM 265 N LEU A 66 3.028 -8.472 -0.608 1.00 0.00 N ATOM 266 CA LEU A 66 4.208 -8.443 -1.490 1.00 0.00 C ATOM 267 C LEU A 66 5.184 -9.617 -1.192 1.00 0.00 C ATOM 268 O LEU A 66 5.226 -10.104 -0.061 1.00 0.00 O ATOM 269 CB LEU A 66 4.923 -7.074 -1.407 1.00 0.00 C ATOM 270 CG LEU A 66 4.546 -6.103 -2.539 1.00 0.00 C ATOM 271 CD1 LEU A 66 3.099 -5.617 -2.444 1.00 0.00 C ATOM 272 CD2 LEU A 66 5.467 -4.889 -2.484 1.00 0.00 C ATOM 0 H LEU A 66 2.868 -7.600 -0.104 1.00 0.00 H new ATOM 0 HA LEU A 66 3.858 -8.577 -2.513 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.687 -6.609 -0.450 1.00 0.00 H new ATOM 0 HB3 LEU A 66 6.001 -7.237 -1.425 1.00 0.00 H new ATOM 0 HG LEU A 66 4.655 -6.646 -3.478 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.889 -4.935 -3.268 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.424 -6.471 -2.499 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.951 -5.098 -1.497 1.00 0.00 H new ATOM 0 HD21 LEU A 66 5.205 -4.197 -3.284 1.00 0.00 H new ATOM 0 HD22 LEU A 66 5.355 -4.390 -1.521 1.00 0.00 H new ATOM 0 HD23 LEU A 66 6.501 -5.211 -2.607 1.00 0.00 H new ATOM 284 N PRO A 67 6.010 -10.056 -2.163 1.00 0.00 N ATOM 285 CA PRO A 67 7.041 -11.093 -2.002 1.00 0.00 C ATOM 286 C PRO A 67 7.957 -10.902 -0.784 1.00 0.00 C ATOM 287 O PRO A 67 8.064 -11.778 0.069 1.00 0.00 O ATOM 288 CB PRO A 67 7.856 -11.062 -3.303 1.00 0.00 C ATOM 289 CG PRO A 67 6.835 -10.609 -4.337 1.00 0.00 C ATOM 290 CD PRO A 67 5.946 -9.641 -3.553 1.00 0.00 C ATOM 0 HA PRO A 67 6.559 -12.053 -1.817 1.00 0.00 H new ATOM 0 HB2 PRO A 67 8.696 -10.371 -3.236 1.00 0.00 H new ATOM 0 HB3 PRO A 67 8.267 -12.042 -3.545 1.00 0.00 H new ATOM 0 HG2 PRO A 67 7.312 -10.119 -5.186 1.00 0.00 H new ATOM 0 HG3 PRO A 67 6.264 -11.449 -4.733 1.00 0.00 H new ATOM 0 HD2 PRO A 67 6.295 -8.615 -3.668 1.00 0.00 H new ATOM 0 HD3 PRO A 67 4.920 -9.672 -3.920 1.00 0.00 H new ATOM 298 N ILE A 68 8.627 -9.747 -0.759 1.00 0.00 N ATOM 299 CA ILE A 68 9.605 -9.209 0.203 1.00 0.00 C ATOM 300 C ILE A 68 9.890 -7.745 -0.162 1.00 0.00 C ATOM 301 O ILE A 68 9.770 -6.842 0.666 1.00 0.00 O ATOM 302 CB ILE A 68 10.959 -9.980 0.212 1.00 0.00 C ATOM 303 CG1 ILE A 68 11.369 -10.647 -1.128 1.00 0.00 C ATOM 304 CG2 ILE A 68 10.940 -11.015 1.337 1.00 0.00 C ATOM 305 CD1 ILE A 68 12.835 -11.090 -1.172 1.00 0.00 C ATOM 0 H ILE A 68 8.479 -9.075 -1.512 1.00 0.00 H new ATOM 0 HA ILE A 68 9.167 -9.314 1.195 1.00 0.00 H new ATOM 0 HB ILE A 68 11.724 -9.221 0.377 1.00 0.00 H new ATOM 0 HG12 ILE A 68 10.731 -11.514 -1.302 1.00 0.00 H new ATOM 0 HG13 ILE A 68 11.185 -9.947 -1.943 1.00 0.00 H new ATOM 0 HG21 ILE A 68 11.885 -11.558 1.348 1.00 0.00 H new ATOM 0 HG22 ILE A 68 10.800 -10.511 2.293 1.00 0.00 H new ATOM 0 HG23 ILE A 68 10.121 -11.716 1.173 1.00 0.00 H new ATOM 0 HD11 ILE A 68 13.048 -11.547 -2.138 1.00 0.00 H new ATOM 0 HD12 ILE A 68 13.481 -10.224 -1.030 1.00 0.00 H new ATOM 0 HD13 ILE A 68 13.020 -11.815 -0.379 1.00 0.00 H new ATOM 317 N ASP A 69 10.266 -7.540 -1.426 1.00 0.00 N ATOM 318 CA ASP A 69 10.761 -6.273 -1.989 1.00 0.00 C ATOM 319 C ASP A 69 10.376 -6.059 -3.474 1.00 0.00 C ATOM 320 O ASP A 69 10.542 -4.955 -3.992 1.00 0.00 O ATOM 321 CB ASP A 69 12.288 -6.260 -1.812 1.00 0.00 C ATOM 322 CG ASP A 69 12.937 -4.906 -2.156 1.00 0.00 C ATOM 323 OD1 ASP A 69 12.605 -3.896 -1.495 1.00 0.00 O ATOM 324 OD2 ASP A 69 13.849 -4.869 -3.018 1.00 0.00 O ATOM 0 H ASP A 69 10.234 -8.286 -2.121 1.00 0.00 H new ATOM 0 HA ASP A 69 10.289 -5.448 -1.456 1.00 0.00 H new ATOM 0 HB2 ASP A 69 12.528 -6.517 -0.780 1.00 0.00 H new ATOM 0 HB3 ASP A 69 12.725 -7.034 -2.443 1.00 0.00 H new ATOM 329 N VAL A 70 9.838 -7.091 -4.148 1.00 0.00 N ATOM 330 CA VAL A 70 9.441 -7.121 -5.575 1.00 0.00 C ATOM 331 C VAL A 70 10.456 -6.396 -6.478 1.00 0.00 C ATOM 332 O VAL A 70 11.666 -6.585 -6.319 1.00 0.00 O ATOM 333 CB VAL A 70 7.938 -6.747 -5.708 1.00 0.00 C ATOM 334 CG1 VAL A 70 7.547 -5.269 -5.570 1.00 0.00 C ATOM 335 CG2 VAL A 70 7.316 -7.304 -6.991 1.00 0.00 C ATOM 0 H VAL A 70 9.656 -7.982 -3.687 1.00 0.00 H new ATOM 0 HA VAL A 70 9.496 -8.132 -5.978 1.00 0.00 H new ATOM 0 HB VAL A 70 7.528 -7.227 -4.820 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.468 -5.166 -5.686 1.00 0.00 H new ATOM 0 HG12 VAL A 70 7.843 -4.905 -4.586 1.00 0.00 H new ATOM 0 HG13 VAL A 70 8.052 -4.686 -6.340 1.00 0.00 H new ATOM 0 HG21 VAL A 70 6.266 -7.017 -7.040 1.00 0.00 H new ATOM 0 HG22 VAL A 70 7.843 -6.901 -7.856 1.00 0.00 H new ATOM 0 HG23 VAL A 70 7.396 -8.391 -6.992 1.00 0.00 H new ATOM 345 N THR A 71 10.012 -5.589 -7.438 1.00 0.00 N ATOM 346 CA THR A 71 10.800 -4.495 -8.007 1.00 0.00 C ATOM 347 C THR A 71 9.880 -3.320 -8.308 1.00 0.00 C ATOM 348 O THR A 71 8.770 -3.469 -8.842 1.00 0.00 O ATOM 349 CB THR A 71 11.641 -4.937 -9.216 1.00 0.00 C ATOM 350 OG1 THR A 71 12.177 -3.804 -9.868 1.00 0.00 O ATOM 351 CG2 THR A 71 10.878 -5.758 -10.251 1.00 0.00 C ATOM 0 H THR A 71 9.083 -5.676 -7.849 1.00 0.00 H new ATOM 0 HA THR A 71 11.536 -4.170 -7.272 1.00 0.00 H new ATOM 0 HB THR A 71 12.419 -5.579 -8.804 1.00 0.00 H new ATOM 0 HG1 THR A 71 12.713 -4.092 -10.636 1.00 0.00 H new ATOM 0 HG21 THR A 71 11.548 -6.026 -11.068 1.00 0.00 H new ATOM 0 HG22 THR A 71 10.493 -6.665 -9.784 1.00 0.00 H new ATOM 0 HG23 THR A 71 10.047 -5.170 -10.641 1.00 0.00 H new ATOM 359 N GLU A 72 10.325 -2.127 -7.913 1.00 0.00 N ATOM 360 CA GLU A 72 9.539 -0.919 -8.108 1.00 0.00 C ATOM 361 C GLU A 72 9.243 -0.679 -9.596 1.00 0.00 C ATOM 362 O GLU A 72 8.167 -0.195 -9.922 1.00 0.00 O ATOM 363 CB GLU A 72 10.175 0.273 -7.365 1.00 0.00 C ATOM 364 CG GLU A 72 10.791 1.396 -8.217 1.00 0.00 C ATOM 365 CD GLU A 72 12.175 1.031 -8.793 1.00 0.00 C ATOM 366 OE1 GLU A 72 13.086 0.653 -8.016 1.00 0.00 O ATOM 367 OE2 GLU A 72 12.376 1.157 -10.024 1.00 0.00 O ATOM 0 H GLU A 72 11.225 -1.976 -7.457 1.00 0.00 H new ATOM 0 HA GLU A 72 8.557 -1.046 -7.652 1.00 0.00 H new ATOM 0 HB2 GLU A 72 9.412 0.716 -6.726 1.00 0.00 H new ATOM 0 HB3 GLU A 72 10.953 -0.117 -6.709 1.00 0.00 H new ATOM 0 HG2 GLU A 72 10.114 1.634 -9.038 1.00 0.00 H new ATOM 0 HG3 GLU A 72 10.883 2.296 -7.609 1.00 0.00 H new ATOM 374 N GLY A 73 10.134 -1.109 -10.498 1.00 0.00 N ATOM 375 CA GLY A 73 9.951 -1.054 -11.949 1.00 0.00 C ATOM 376 C GLY A 73 8.736 -1.849 -12.440 1.00 0.00 C ATOM 377 O GLY A 73 8.028 -1.400 -13.339 1.00 0.00 O ATOM 0 H GLY A 73 11.029 -1.517 -10.227 1.00 0.00 H new ATOM 0 HA2 GLY A 73 9.843 -0.013 -12.255 1.00 0.00 H new ATOM 0 HA3 GLY A 73 10.848 -1.438 -12.436 1.00 0.00 H new ATOM 381 N GLU A 74 8.443 -2.999 -11.823 1.00 0.00 N ATOM 382 CA GLU A 74 7.196 -3.744 -12.051 1.00 0.00 C ATOM 383 C GLU A 74 5.992 -2.954 -11.545 1.00 0.00 C ATOM 384 O GLU A 74 5.033 -2.740 -12.290 1.00 0.00 O ATOM 385 CB GLU A 74 7.239 -5.137 -11.391 1.00 0.00 C ATOM 386 CG GLU A 74 7.785 -6.179 -12.375 1.00 0.00 C ATOM 387 CD GLU A 74 7.756 -7.606 -11.788 1.00 0.00 C ATOM 388 OE1 GLU A 74 6.651 -8.130 -11.509 1.00 0.00 O ATOM 389 OE2 GLU A 74 8.835 -8.227 -11.634 1.00 0.00 O ATOM 0 H GLU A 74 9.066 -3.443 -11.148 1.00 0.00 H new ATOM 0 HA GLU A 74 7.093 -3.886 -13.127 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.866 -5.105 -10.500 1.00 0.00 H new ATOM 0 HB3 GLU A 74 6.239 -5.423 -11.066 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.197 -6.153 -13.292 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.809 -5.920 -12.645 1.00 0.00 H new ATOM 396 N VAL A 75 6.035 -2.504 -10.289 1.00 0.00 N ATOM 397 CA VAL A 75 4.878 -1.829 -9.664 1.00 0.00 C ATOM 398 C VAL A 75 4.515 -0.504 -10.369 1.00 0.00 C ATOM 399 O VAL A 75 3.342 -0.258 -10.656 1.00 0.00 O ATOM 400 CB VAL A 75 5.097 -1.685 -8.148 1.00 0.00 C ATOM 401 CG1 VAL A 75 3.911 -1.014 -7.454 1.00 0.00 C ATOM 402 CG2 VAL A 75 5.288 -3.072 -7.508 1.00 0.00 C ATOM 0 H VAL A 75 6.850 -2.590 -9.682 1.00 0.00 H new ATOM 0 HA VAL A 75 3.999 -2.459 -9.799 1.00 0.00 H new ATOM 0 HB VAL A 75 5.984 -1.064 -8.019 1.00 0.00 H new ATOM 0 HG11 VAL A 75 4.112 -0.935 -6.386 1.00 0.00 H new ATOM 0 HG12 VAL A 75 3.762 -0.018 -7.870 1.00 0.00 H new ATOM 0 HG13 VAL A 75 3.012 -1.611 -7.611 1.00 0.00 H new ATOM 0 HG21 VAL A 75 5.442 -2.959 -6.435 1.00 0.00 H new ATOM 0 HG22 VAL A 75 4.401 -3.680 -7.685 1.00 0.00 H new ATOM 0 HG23 VAL A 75 6.156 -3.560 -7.950 1.00 0.00 H new ATOM 412 N ILE A 76 5.489 0.330 -10.749 1.00 0.00 N ATOM 413 CA ILE A 76 5.238 1.567 -11.507 1.00 0.00 C ATOM 414 C ILE A 76 4.864 1.312 -12.962 1.00 0.00 C ATOM 415 O ILE A 76 4.040 2.048 -13.499 1.00 0.00 O ATOM 416 CB ILE A 76 6.421 2.542 -11.431 1.00 0.00 C ATOM 417 CG1 ILE A 76 7.725 2.051 -12.088 1.00 0.00 C ATOM 418 CG2 ILE A 76 6.674 2.874 -9.971 1.00 0.00 C ATOM 419 CD1 ILE A 76 7.888 2.600 -13.500 1.00 0.00 C ATOM 0 H ILE A 76 6.475 0.169 -10.541 1.00 0.00 H new ATOM 0 HA ILE A 76 4.377 2.028 -11.024 1.00 0.00 H new ATOM 0 HB ILE A 76 6.132 3.419 -12.010 1.00 0.00 H new ATOM 0 HG12 ILE A 76 8.576 2.356 -11.479 1.00 0.00 H new ATOM 0 HG13 ILE A 76 7.729 0.961 -12.119 1.00 0.00 H new ATOM 0 HG21 ILE A 76 7.512 3.567 -9.895 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.783 3.334 -9.543 1.00 0.00 H new ATOM 0 HG23 ILE A 76 6.908 1.960 -9.425 1.00 0.00 H new ATOM 0 HD11 ILE A 76 8.820 2.231 -13.929 1.00 0.00 H new ATOM 0 HD12 ILE A 76 7.050 2.273 -14.116 1.00 0.00 H new ATOM 0 HD13 ILE A 76 7.911 3.689 -13.466 1.00 0.00 H new ATOM 431 N SER A 77 5.390 0.256 -13.592 1.00 0.00 N ATOM 432 CA SER A 77 4.935 -0.164 -14.930 1.00 0.00 C ATOM 433 C SER A 77 3.463 -0.570 -14.901 1.00 0.00 C ATOM 434 O SER A 77 2.733 -0.374 -15.875 1.00 0.00 O ATOM 435 CB SER A 77 5.819 -1.297 -15.468 1.00 0.00 C ATOM 436 OG SER A 77 5.443 -1.689 -16.779 1.00 0.00 O ATOM 0 H SER A 77 6.131 -0.326 -13.201 1.00 0.00 H new ATOM 0 HA SER A 77 5.028 0.684 -15.609 1.00 0.00 H new ATOM 0 HB2 SER A 77 6.860 -0.974 -15.471 1.00 0.00 H new ATOM 0 HB3 SER A 77 5.754 -2.156 -14.800 1.00 0.00 H new ATOM 0 HG SER A 77 6.031 -2.411 -17.086 1.00 0.00 H new ATOM 442 N LEU A 78 2.995 -1.029 -13.737 1.00 0.00 N ATOM 443 CA LEU A 78 1.598 -1.323 -13.483 1.00 0.00 C ATOM 444 C LEU A 78 0.758 -0.123 -13.011 1.00 0.00 C ATOM 445 O LEU A 78 -0.465 -0.169 -13.118 1.00 0.00 O ATOM 446 CB LEU A 78 1.521 -2.503 -12.502 1.00 0.00 C ATOM 447 CG LEU A 78 1.770 -3.856 -13.177 1.00 0.00 C ATOM 448 CD1 LEU A 78 2.072 -4.921 -12.123 1.00 0.00 C ATOM 449 CD2 LEU A 78 0.519 -4.258 -13.956 1.00 0.00 C ATOM 0 H LEU A 78 3.597 -1.208 -12.933 1.00 0.00 H new ATOM 0 HA LEU A 78 1.143 -1.589 -14.437 1.00 0.00 H new ATOM 0 HB2 LEU A 78 2.254 -2.358 -11.709 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.539 -2.513 -12.030 1.00 0.00 H new ATOM 0 HG LEU A 78 2.622 -3.772 -13.851 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.247 -5.879 -12.613 1.00 0.00 H new ATOM 0 HD12 LEU A 78 2.960 -4.634 -11.560 1.00 0.00 H new ATOM 0 HD13 LEU A 78 1.224 -5.011 -11.444 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.686 -5.220 -14.441 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -0.326 -4.338 -13.272 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.303 -3.503 -14.712 1.00 0.00 H new ATOM 461 N GLY A 79 1.382 0.975 -12.568 1.00 0.00 N ATOM 462 CA GLY A 79 0.723 2.232 -12.237 1.00 0.00 C ATOM 463 C GLY A 79 0.668 3.220 -13.403 1.00 0.00 C ATOM 464 O GLY A 79 -0.152 4.135 -13.408 1.00 0.00 O ATOM 0 H GLY A 79 2.392 1.008 -12.428 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -0.293 2.023 -11.901 1.00 0.00 H new ATOM 0 HA3 GLY A 79 1.246 2.698 -11.401 1.00 0.00 H new ATOM 468 N LEU A 80 1.517 3.051 -14.412 1.00 0.00 N ATOM 469 CA LEU A 80 1.691 4.008 -15.496 1.00 0.00 C ATOM 470 C LEU A 80 0.482 4.231 -16.428 1.00 0.00 C ATOM 471 O LEU A 80 0.168 5.400 -16.671 1.00 0.00 O ATOM 472 CB LEU A 80 2.989 3.665 -16.257 1.00 0.00 C ATOM 473 CG LEU A 80 4.159 4.534 -15.782 1.00 0.00 C ATOM 474 CD1 LEU A 80 5.477 4.041 -16.372 1.00 0.00 C ATOM 475 CD2 LEU A 80 3.925 5.973 -16.226 1.00 0.00 C ATOM 0 H LEU A 80 2.114 2.229 -14.499 1.00 0.00 H new ATOM 0 HA LEU A 80 1.774 4.988 -15.025 1.00 0.00 H new ATOM 0 HB2 LEU A 80 3.232 2.613 -16.110 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.836 3.811 -17.326 1.00 0.00 H new ATOM 0 HG LEU A 80 4.217 4.474 -14.695 1.00 0.00 H new ATOM 0 HD11 LEU A 80 6.292 4.673 -16.020 1.00 0.00 H new ATOM 0 HD12 LEU A 80 5.654 3.012 -16.058 1.00 0.00 H new ATOM 0 HD13 LEU A 80 5.427 4.084 -17.460 1.00 0.00 H new ATOM 0 HD21 LEU A 80 4.754 6.596 -15.891 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.858 6.012 -17.313 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.996 6.341 -15.792 1.00 0.00 H new ATOM 487 N PRO A 81 -0.227 3.194 -16.928 1.00 0.00 N ATOM 488 CA PRO A 81 -1.409 3.329 -17.801 1.00 0.00 C ATOM 489 C PRO A 81 -2.592 4.148 -17.301 1.00 0.00 C ATOM 490 O PRO A 81 -3.552 4.342 -18.054 1.00 0.00 O ATOM 491 CB PRO A 81 -1.842 1.899 -18.140 1.00 0.00 C ATOM 492 CG PRO A 81 -0.565 1.080 -17.966 1.00 0.00 C ATOM 493 CD PRO A 81 0.140 1.788 -16.817 1.00 0.00 C ATOM 0 HA PRO A 81 -1.093 3.926 -18.657 1.00 0.00 H new ATOM 0 HB2 PRO A 81 -2.633 1.552 -17.475 1.00 0.00 H new ATOM 0 HB3 PRO A 81 -2.227 1.828 -19.157 1.00 0.00 H new ATOM 0 HG2 PRO A 81 -0.782 0.039 -17.726 1.00 0.00 H new ATOM 0 HG3 PRO A 81 0.041 1.079 -18.872 1.00 0.00 H new ATOM 0 HD2 PRO A 81 -0.171 1.378 -15.856 1.00 0.00 H new ATOM 0 HD3 PRO A 81 1.220 1.660 -16.884 1.00 0.00 H new ATOM 501 N PHE A 82 -2.547 4.642 -16.064 1.00 0.00 N ATOM 502 CA PHE A 82 -3.723 5.159 -15.380 1.00 0.00 C ATOM 503 C PHE A 82 -3.758 6.683 -15.309 1.00 0.00 C ATOM 504 O PHE A 82 -4.825 7.295 -15.378 1.00 0.00 O ATOM 505 CB PHE A 82 -3.790 4.542 -13.974 1.00 0.00 C ATOM 506 CG PHE A 82 -3.910 3.045 -14.060 1.00 0.00 C ATOM 507 CD1 PHE A 82 -2.804 2.235 -14.386 1.00 0.00 C ATOM 508 CD2 PHE A 82 -5.189 2.487 -13.950 1.00 0.00 C ATOM 509 CE1 PHE A 82 -3.007 0.872 -14.669 1.00 0.00 C ATOM 510 CE2 PHE A 82 -5.394 1.137 -14.255 1.00 0.00 C ATOM 511 CZ PHE A 82 -4.302 0.331 -14.616 1.00 0.00 C ATOM 0 H PHE A 82 -1.692 4.693 -15.511 1.00 0.00 H new ATOM 0 HA PHE A 82 -4.600 4.873 -15.961 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -2.896 4.809 -13.410 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -4.643 4.950 -13.432 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -1.810 2.656 -14.418 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -6.019 3.099 -13.629 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -2.168 0.242 -14.927 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -6.388 0.716 -14.213 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.459 -0.711 -14.854 1.00 0.00 H new ATOM 521 N GLY A 83 -2.575 7.281 -15.192 1.00 0.00 N ATOM 522 CA GLY A 83 -2.345 8.715 -15.188 1.00 0.00 C ATOM 523 C GLY A 83 -0.886 8.983 -15.507 1.00 0.00 C ATOM 524 O GLY A 83 -0.526 9.309 -16.640 1.00 0.00 O ATOM 0 H GLY A 83 -1.711 6.748 -15.093 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -2.986 9.201 -15.923 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -2.601 9.134 -14.215 1.00 0.00 H new ATOM 528 N LYS A 84 -0.040 8.797 -14.488 1.00 0.00 N ATOM 529 CA LYS A 84 1.419 8.807 -14.604 1.00 0.00 C ATOM 530 C LYS A 84 2.195 7.949 -13.599 1.00 0.00 C ATOM 531 O LYS A 84 3.393 7.745 -13.756 1.00 0.00 O ATOM 532 CB LYS A 84 1.857 10.285 -14.562 1.00 0.00 C ATOM 533 CG LYS A 84 3.280 10.584 -15.060 1.00 0.00 C ATOM 534 CD LYS A 84 3.575 9.982 -16.442 1.00 0.00 C ATOM 535 CE LYS A 84 2.669 10.487 -17.575 1.00 0.00 C ATOM 536 NZ LYS A 84 2.905 11.922 -17.893 1.00 0.00 N ATOM 0 H LYS A 84 -0.362 8.631 -13.534 1.00 0.00 H new ATOM 0 HA LYS A 84 1.674 8.323 -15.547 1.00 0.00 H new ATOM 0 HB2 LYS A 84 1.155 10.868 -15.159 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.772 10.639 -13.535 1.00 0.00 H new ATOM 0 HG2 LYS A 84 3.424 11.664 -15.103 1.00 0.00 H new ATOM 0 HG3 LYS A 84 4.000 10.195 -14.340 1.00 0.00 H new ATOM 0 HD2 LYS A 84 4.611 10.197 -16.702 1.00 0.00 H new ATOM 0 HD3 LYS A 84 3.481 8.898 -16.377 1.00 0.00 H new ATOM 0 HE2 LYS A 84 2.840 9.887 -18.469 1.00 0.00 H new ATOM 0 HE3 LYS A 84 1.626 10.347 -17.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 2.271 12.216 -18.663 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 2.716 12.500 -17.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 3.893 12.054 -18.189 1.00 0.00 H new ATOM 550 N VAL A 85 1.521 7.495 -12.539 1.00 0.00 N ATOM 551 CA VAL A 85 1.944 7.662 -11.139 1.00 0.00 C ATOM 552 C VAL A 85 2.784 8.943 -10.858 1.00 0.00 C ATOM 553 O VAL A 85 3.163 9.703 -11.738 1.00 0.00 O ATOM 554 CB VAL A 85 2.609 6.406 -10.545 1.00 0.00 C ATOM 555 CG1 VAL A 85 1.855 5.205 -10.008 1.00 0.00 C ATOM 556 CG2 VAL A 85 3.774 5.859 -11.389 1.00 0.00 C ATOM 0 H VAL A 85 0.641 6.987 -12.630 1.00 0.00 H new ATOM 0 HA VAL A 85 1.003 7.808 -10.609 1.00 0.00 H new ATOM 0 HB VAL A 85 2.881 6.931 -9.629 1.00 0.00 H new ATOM 0 HG11 VAL A 85 2.565 4.460 -9.649 1.00 0.00 H new ATOM 0 HG12 VAL A 85 1.210 5.518 -9.186 1.00 0.00 H new ATOM 0 HG13 VAL A 85 1.246 4.773 -10.802 1.00 0.00 H new ATOM 0 HG21 VAL A 85 4.190 4.975 -10.905 1.00 0.00 H new ATOM 0 HG22 VAL A 85 3.411 5.592 -12.381 1.00 0.00 H new ATOM 0 HG23 VAL A 85 4.548 6.621 -11.479 1.00 0.00 H new ATOM 566 N THR A 86 3.051 9.236 -9.591 1.00 0.00 N ATOM 567 CA THR A 86 4.099 10.187 -9.181 1.00 0.00 C ATOM 568 C THR A 86 5.110 9.562 -8.215 1.00 0.00 C ATOM 569 O THR A 86 6.280 9.947 -8.240 1.00 0.00 O ATOM 570 CB THR A 86 3.495 11.504 -8.676 1.00 0.00 C ATOM 571 OG1 THR A 86 4.466 12.526 -8.578 1.00 0.00 O ATOM 572 CG2 THR A 86 2.841 11.369 -7.306 1.00 0.00 C ATOM 0 H THR A 86 2.547 8.822 -8.807 1.00 0.00 H new ATOM 0 HA THR A 86 4.678 10.441 -10.069 1.00 0.00 H new ATOM 0 HB THR A 86 2.739 11.763 -9.417 1.00 0.00 H new ATOM 0 HG1 THR A 86 4.043 13.349 -8.255 1.00 0.00 H new ATOM 0 HG21 THR A 86 2.432 12.332 -7.002 1.00 0.00 H new ATOM 0 HG22 THR A 86 2.038 10.634 -7.357 1.00 0.00 H new ATOM 0 HG23 THR A 86 3.585 11.044 -6.578 1.00 0.00 H new ATOM 580 N ASN A 87 4.720 8.539 -7.436 1.00 0.00 N ATOM 581 CA ASN A 87 5.655 7.779 -6.601 1.00 0.00 C ATOM 582 C ASN A 87 5.155 6.408 -6.112 1.00 0.00 C ATOM 583 O ASN A 87 3.966 6.113 -6.092 1.00 0.00 O ATOM 584 CB ASN A 87 6.017 8.659 -5.373 1.00 0.00 C ATOM 585 CG ASN A 87 7.404 8.374 -4.828 1.00 0.00 C ATOM 586 OD1 ASN A 87 7.512 8.125 -3.544 1.00 0.00 O flip ATOM 587 ND2 ASN A 87 8.398 8.380 -5.539 1.00 0.00 N flip ATOM 0 H ASN A 87 3.753 8.220 -7.370 1.00 0.00 H new ATOM 0 HA ASN A 87 6.513 7.551 -7.234 1.00 0.00 H new ATOM 0 HB2 ASN A 87 5.952 9.710 -5.654 1.00 0.00 H new ATOM 0 HB3 ASN A 87 5.282 8.494 -4.585 1.00 0.00 H new ATOM 0 HD21 ASN A 87 8.310 8.574 -6.537 1.00 0.00 H new ATOM 0 HD22 ASN A 87 9.315 8.191 -5.135 1.00 0.00 H new ATOM 594 N LEU A 88 6.069 5.588 -5.600 1.00 0.00 N ATOM 595 CA LEU A 88 5.798 4.456 -4.708 1.00 0.00 C ATOM 596 C LEU A 88 6.839 4.302 -3.579 1.00 0.00 C ATOM 597 O LEU A 88 7.908 4.914 -3.604 1.00 0.00 O ATOM 598 CB LEU A 88 5.628 3.182 -5.544 1.00 0.00 C ATOM 599 CG LEU A 88 6.912 2.503 -6.034 1.00 0.00 C ATOM 600 CD1 LEU A 88 6.443 1.305 -6.844 1.00 0.00 C ATOM 601 CD2 LEU A 88 7.802 3.415 -6.879 1.00 0.00 C ATOM 0 H LEU A 88 7.063 5.696 -5.802 1.00 0.00 H new ATOM 0 HA LEU A 88 4.864 4.654 -4.182 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.066 2.460 -4.952 1.00 0.00 H new ATOM 0 HB3 LEU A 88 5.018 3.425 -6.414 1.00 0.00 H new ATOM 0 HG LEU A 88 7.537 2.224 -5.186 1.00 0.00 H new ATOM 0 HD11 LEU A 88 7.308 0.766 -7.230 1.00 0.00 H new ATOM 0 HD12 LEU A 88 5.857 0.642 -6.207 1.00 0.00 H new ATOM 0 HD13 LEU A 88 5.828 1.647 -7.676 1.00 0.00 H new ATOM 0 HD21 LEU A 88 8.692 2.868 -7.191 1.00 0.00 H new ATOM 0 HD22 LEU A 88 7.252 3.745 -7.760 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.098 4.283 -6.289 1.00 0.00 H new ATOM 613 N LEU A 89 6.508 3.475 -2.588 1.00 0.00 N ATOM 614 CA LEU A 89 7.271 3.171 -1.366 1.00 0.00 C ATOM 615 C LEU A 89 7.088 1.694 -1.031 1.00 0.00 C ATOM 616 O LEU A 89 6.032 1.132 -1.321 1.00 0.00 O ATOM 617 CB LEU A 89 6.781 4.123 -0.252 1.00 0.00 C ATOM 618 CG LEU A 89 6.715 3.691 1.224 1.00 0.00 C ATOM 619 CD1 LEU A 89 5.813 2.529 1.562 1.00 0.00 C ATOM 620 CD2 LEU A 89 8.069 3.599 1.925 1.00 0.00 C ATOM 0 H LEU A 89 5.630 2.956 -2.616 1.00 0.00 H new ATOM 0 HA LEU A 89 8.342 3.334 -1.490 1.00 0.00 H new ATOM 0 HB2 LEU A 89 7.418 5.007 -0.292 1.00 0.00 H new ATOM 0 HB3 LEU A 89 5.776 4.441 -0.531 1.00 0.00 H new ATOM 0 HG LEU A 89 6.198 4.548 1.655 1.00 0.00 H new ATOM 0 HD11 LEU A 89 5.861 2.331 2.633 1.00 0.00 H new ATOM 0 HD12 LEU A 89 4.787 2.771 1.284 1.00 0.00 H new ATOM 0 HD13 LEU A 89 6.138 1.645 1.014 1.00 0.00 H new ATOM 0 HD21 LEU A 89 7.923 3.288 2.959 1.00 0.00 H new ATOM 0 HD22 LEU A 89 8.696 2.869 1.412 1.00 0.00 H new ATOM 0 HD23 LEU A 89 8.556 4.574 1.905 1.00 0.00 H new ATOM 632 N MET A 90 8.076 1.082 -0.377 1.00 0.00 N ATOM 633 CA MET A 90 8.061 -0.335 0.004 1.00 0.00 C ATOM 634 C MET A 90 8.353 -0.508 1.494 1.00 0.00 C ATOM 635 O MET A 90 9.455 -0.223 1.962 1.00 0.00 O ATOM 636 CB MET A 90 9.012 -1.132 -0.904 1.00 0.00 C ATOM 637 CG MET A 90 8.597 -0.854 -2.350 1.00 0.00 C ATOM 638 SD MET A 90 8.919 -2.118 -3.584 1.00 0.00 S ATOM 639 CE MET A 90 7.566 -1.582 -4.649 1.00 0.00 C ATOM 0 H MET A 90 8.927 1.565 -0.091 1.00 0.00 H new ATOM 0 HA MET A 90 7.061 -0.742 -0.148 1.00 0.00 H new ATOM 0 HB2 MET A 90 10.046 -0.831 -0.736 1.00 0.00 H new ATOM 0 HB3 MET A 90 8.950 -2.198 -0.684 1.00 0.00 H new ATOM 0 HG2 MET A 90 7.527 -0.649 -2.355 1.00 0.00 H new ATOM 0 HG3 MET A 90 9.098 0.059 -2.670 1.00 0.00 H new ATOM 0 HE1 MET A 90 7.570 -2.171 -5.566 1.00 0.00 H new ATOM 0 HE2 MET A 90 6.617 -1.723 -4.131 1.00 0.00 H new ATOM 0 HE3 MET A 90 7.692 -0.528 -4.895 1.00 0.00 H new ATOM 649 N LEU A 91 7.338 -0.947 2.243 1.00 0.00 N ATOM 650 CA LEU A 91 7.434 -1.275 3.673 1.00 0.00 C ATOM 651 C LEU A 91 8.196 -2.596 3.889 1.00 0.00 C ATOM 652 O LEU A 91 7.622 -3.623 4.274 1.00 0.00 O ATOM 653 CB LEU A 91 6.038 -1.324 4.337 1.00 0.00 C ATOM 654 CG LEU A 91 5.161 -0.056 4.452 1.00 0.00 C ATOM 655 CD1 LEU A 91 5.980 1.192 4.761 1.00 0.00 C ATOM 656 CD2 LEU A 91 4.257 0.188 3.255 1.00 0.00 C ATOM 0 H LEU A 91 6.401 -1.089 1.864 1.00 0.00 H new ATOM 0 HA LEU A 91 8.000 -0.478 4.155 1.00 0.00 H new ATOM 0 HB2 LEU A 91 5.453 -2.067 3.795 1.00 0.00 H new ATOM 0 HB3 LEU A 91 6.180 -1.706 5.348 1.00 0.00 H new ATOM 0 HG LEU A 91 4.506 -0.260 5.299 1.00 0.00 H new ATOM 0 HD11 LEU A 91 5.317 2.054 4.831 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.503 1.059 5.708 1.00 0.00 H new ATOM 0 HD13 LEU A 91 6.706 1.357 3.965 1.00 0.00 H new ATOM 0 HD21 LEU A 91 3.677 1.096 3.417 1.00 0.00 H new ATOM 0 HD22 LEU A 91 4.865 0.301 2.357 1.00 0.00 H new ATOM 0 HD23 LEU A 91 3.581 -0.658 3.132 1.00 0.00 H new ATOM 668 N LYS A 92 9.513 -2.556 3.680 1.00 0.00 N ATOM 669 CA LYS A 92 10.428 -3.678 3.926 1.00 0.00 C ATOM 670 C LYS A 92 10.347 -4.134 5.385 1.00 0.00 C ATOM 671 O LYS A 92 10.443 -3.315 6.301 1.00 0.00 O ATOM 672 CB LYS A 92 11.868 -3.310 3.526 1.00 0.00 C ATOM 673 CG LYS A 92 11.981 -2.966 2.031 1.00 0.00 C ATOM 674 CD LYS A 92 13.425 -2.725 1.571 1.00 0.00 C ATOM 675 CE LYS A 92 14.212 -4.040 1.488 1.00 0.00 C ATOM 676 NZ LYS A 92 15.533 -3.837 0.840 1.00 0.00 N ATOM 0 H LYS A 92 9.987 -1.724 3.327 1.00 0.00 H new ATOM 0 HA LYS A 92 10.119 -4.516 3.301 1.00 0.00 H new ATOM 0 HB2 LYS A 92 12.203 -2.460 4.120 1.00 0.00 H new ATOM 0 HB3 LYS A 92 12.533 -4.142 3.758 1.00 0.00 H new ATOM 0 HG2 LYS A 92 11.551 -3.778 1.445 1.00 0.00 H new ATOM 0 HG3 LYS A 92 11.388 -2.075 1.824 1.00 0.00 H new ATOM 0 HD2 LYS A 92 13.422 -2.239 0.595 1.00 0.00 H new ATOM 0 HD3 LYS A 92 13.921 -2.045 2.264 1.00 0.00 H new ATOM 0 HE2 LYS A 92 14.354 -4.445 2.490 1.00 0.00 H new ATOM 0 HE3 LYS A 92 13.637 -4.776 0.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 16.042 -4.743 0.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 15.394 -3.473 -0.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 16.089 -3.153 1.392 1.00 0.00 H new ATOM 690 N GLY A 93 10.084 -5.423 5.590 1.00 0.00 N ATOM 691 CA GLY A 93 9.839 -6.040 6.900 1.00 0.00 C ATOM 692 C GLY A 93 8.361 -6.206 7.289 1.00 0.00 C ATOM 693 O GLY A 93 8.083 -6.884 8.281 1.00 0.00 O ATOM 0 H GLY A 93 10.033 -6.094 4.823 1.00 0.00 H new ATOM 0 HA2 GLY A 93 10.312 -7.022 6.914 1.00 0.00 H new ATOM 0 HA3 GLY A 93 10.332 -5.438 7.663 1.00 0.00 H new ATOM 697 N LYS A 94 7.408 -5.635 6.524 1.00 0.00 N ATOM 698 CA LYS A 94 5.955 -5.901 6.646 1.00 0.00 C ATOM 699 C LYS A 94 5.327 -6.497 5.375 1.00 0.00 C ATOM 700 O LYS A 94 4.175 -6.918 5.415 1.00 0.00 O ATOM 701 CB LYS A 94 5.144 -4.661 7.093 1.00 0.00 C ATOM 702 CG LYS A 94 5.584 -3.986 8.411 1.00 0.00 C ATOM 703 CD LYS A 94 6.341 -2.650 8.300 1.00 0.00 C ATOM 704 CE LYS A 94 7.761 -2.832 7.754 1.00 0.00 C ATOM 705 NZ LYS A 94 8.600 -1.617 7.903 1.00 0.00 N ATOM 0 H LYS A 94 7.628 -4.963 5.789 1.00 0.00 H new ATOM 0 HA LYS A 94 5.894 -6.653 7.432 1.00 0.00 H new ATOM 0 HB2 LYS A 94 5.191 -3.918 6.297 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.099 -4.955 7.193 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.694 -3.821 9.019 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.216 -4.688 8.955 1.00 0.00 H new ATOM 0 HD2 LYS A 94 5.787 -1.974 7.649 1.00 0.00 H new ATOM 0 HD3 LYS A 94 6.389 -2.179 9.282 1.00 0.00 H new ATOM 0 HE2 LYS A 94 8.240 -3.663 8.272 1.00 0.00 H new ATOM 0 HE3 LYS A 94 7.707 -3.102 6.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 9.506 -1.758 7.412 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.106 -0.801 7.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 8.777 -1.439 8.912 1.00 0.00 H new ATOM 719 N ASN A 95 6.070 -6.539 4.263 1.00 0.00 N ATOM 720 CA ASN A 95 5.617 -6.958 2.929 1.00 0.00 C ATOM 721 C ASN A 95 4.461 -6.093 2.392 1.00 0.00 C ATOM 722 O ASN A 95 3.513 -6.583 1.769 1.00 0.00 O ATOM 723 CB ASN A 95 5.297 -8.460 2.912 1.00 0.00 C ATOM 724 CG ASN A 95 6.512 -9.346 3.138 1.00 0.00 C ATOM 725 OD1 ASN A 95 7.295 -9.180 4.063 1.00 0.00 O ATOM 726 ND2 ASN A 95 6.709 -10.332 2.300 1.00 0.00 N ATOM 0 H ASN A 95 7.053 -6.268 4.268 1.00 0.00 H new ATOM 0 HA ASN A 95 6.441 -6.792 2.235 1.00 0.00 H new ATOM 0 HB2 ASN A 95 4.555 -8.673 3.681 1.00 0.00 H new ATOM 0 HB3 ASN A 95 4.845 -8.715 1.954 1.00 0.00 H new ATOM 0 HD21 ASN A 95 7.509 -10.953 2.422 1.00 0.00 H new ATOM 0 HD22 ASN A 95 6.062 -10.480 1.525 1.00 0.00 H new ATOM 733 N GLN A 96 4.547 -4.786 2.641 1.00 0.00 N ATOM 734 CA GLN A 96 3.547 -3.807 2.236 1.00 0.00 C ATOM 735 C GLN A 96 4.164 -2.713 1.335 1.00 0.00 C ATOM 736 O GLN A 96 5.385 -2.661 1.167 1.00 0.00 O ATOM 737 CB GLN A 96 2.865 -3.260 3.489 1.00 0.00 C ATOM 738 CG GLN A 96 2.090 -4.354 4.230 1.00 0.00 C ATOM 739 CD GLN A 96 1.754 -3.955 5.648 1.00 0.00 C ATOM 740 OE1 GLN A 96 1.795 -4.749 6.576 1.00 0.00 O ATOM 741 NE2 GLN A 96 1.396 -2.717 5.864 1.00 0.00 N ATOM 0 H GLN A 96 5.334 -4.373 3.142 1.00 0.00 H new ATOM 0 HA GLN A 96 2.782 -4.278 1.619 1.00 0.00 H new ATOM 0 HB2 GLN A 96 3.614 -2.830 4.154 1.00 0.00 H new ATOM 0 HB3 GLN A 96 2.185 -2.455 3.212 1.00 0.00 H new ATOM 0 HG2 GLN A 96 1.170 -4.575 3.689 1.00 0.00 H new ATOM 0 HG3 GLN A 96 2.680 -5.270 4.242 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.362 -2.054 5.090 1.00 0.00 H new ATOM 0 HE22 GLN A 96 1.151 -2.414 6.807 1.00 0.00 H new ATOM 750 N ALA A 97 3.355 -1.827 0.759 1.00 0.00 N ATOM 751 CA ALA A 97 3.780 -0.704 -0.095 1.00 0.00 C ATOM 752 C ALA A 97 2.699 0.373 -0.176 1.00 0.00 C ATOM 753 O ALA A 97 1.536 0.142 0.151 1.00 0.00 O ATOM 754 CB ALA A 97 4.048 -1.288 -1.495 1.00 0.00 C ATOM 0 H ALA A 97 2.342 -1.867 0.875 1.00 0.00 H new ATOM 0 HA ALA A 97 4.670 -0.231 0.319 1.00 0.00 H new ATOM 0 HB1 ALA A 97 4.367 -0.491 -2.167 1.00 0.00 H new ATOM 0 HB2 ALA A 97 4.831 -2.043 -1.430 1.00 0.00 H new ATOM 0 HB3 ALA A 97 3.136 -1.743 -1.880 1.00 0.00 H new ATOM 760 N PHE A 98 3.102 1.541 -0.664 1.00 0.00 N ATOM 761 CA PHE A 98 2.248 2.636 -1.110 1.00 0.00 C ATOM 762 C PHE A 98 2.473 2.817 -2.613 1.00 0.00 C ATOM 763 O PHE A 98 3.594 2.635 -3.085 1.00 0.00 O ATOM 764 CB PHE A 98 2.665 3.960 -0.449 1.00 0.00 C ATOM 765 CG PHE A 98 2.257 4.275 0.975 1.00 0.00 C ATOM 766 CD1 PHE A 98 2.022 3.262 1.924 1.00 0.00 C ATOM 767 CD2 PHE A 98 2.148 5.624 1.370 1.00 0.00 C ATOM 768 CE1 PHE A 98 1.652 3.595 3.230 1.00 0.00 C ATOM 769 CE2 PHE A 98 1.751 5.964 2.663 1.00 0.00 C ATOM 770 CZ PHE A 98 1.496 4.944 3.581 1.00 0.00 C ATOM 0 H PHE A 98 4.093 1.762 -0.765 1.00 0.00 H new ATOM 0 HA PHE A 98 1.214 2.401 -0.856 1.00 0.00 H new ATOM 0 HB2 PHE A 98 3.753 4.010 -0.489 1.00 0.00 H new ATOM 0 HB3 PHE A 98 2.285 4.766 -1.077 1.00 0.00 H new ATOM 0 HD1 PHE A 98 2.128 2.225 1.642 1.00 0.00 H new ATOM 0 HD2 PHE A 98 2.375 6.406 0.661 1.00 0.00 H new ATOM 0 HE1 PHE A 98 1.487 2.819 3.963 1.00 0.00 H new ATOM 0 HE2 PHE A 98 1.643 7.000 2.949 1.00 0.00 H new ATOM 0 HZ PHE A 98 1.173 5.198 4.580 1.00 0.00 H new ATOM 780 N ILE A 99 1.463 3.279 -3.343 1.00 0.00 N ATOM 781 CA ILE A 99 1.571 3.750 -4.724 1.00 0.00 C ATOM 782 C ILE A 99 0.789 5.069 -4.857 1.00 0.00 C ATOM 783 O ILE A 99 -0.440 5.103 -4.883 1.00 0.00 O ATOM 784 CB ILE A 99 1.235 2.613 -5.715 1.00 0.00 C ATOM 785 CG1 ILE A 99 1.474 3.086 -7.163 1.00 0.00 C ATOM 786 CG2 ILE A 99 -0.154 1.983 -5.507 1.00 0.00 C ATOM 787 CD1 ILE A 99 1.278 1.983 -8.214 1.00 0.00 C ATOM 0 H ILE A 99 0.512 3.339 -2.979 1.00 0.00 H new ATOM 0 HA ILE A 99 2.594 4.007 -5.001 1.00 0.00 H new ATOM 0 HB ILE A 99 1.921 1.793 -5.504 1.00 0.00 H new ATOM 0 HG12 ILE A 99 0.795 3.910 -7.383 1.00 0.00 H new ATOM 0 HG13 ILE A 99 2.488 3.478 -7.245 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.310 1.194 -6.243 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -0.215 1.561 -4.504 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -0.922 2.747 -5.626 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.463 2.390 -9.208 1.00 0.00 H new ATOM 0 HD12 ILE A 99 1.975 1.168 -8.020 1.00 0.00 H new ATOM 0 HD13 ILE A 99 0.256 1.607 -8.161 1.00 0.00 H new ATOM 799 N GLU A 100 1.528 6.177 -4.802 1.00 0.00 N ATOM 800 CA GLU A 100 1.074 7.559 -4.959 1.00 0.00 C ATOM 801 C GLU A 100 1.029 7.956 -6.435 1.00 0.00 C ATOM 802 O GLU A 100 1.981 7.780 -7.196 1.00 0.00 O ATOM 803 CB GLU A 100 2.019 8.498 -4.200 1.00 0.00 C ATOM 804 CG GLU A 100 1.552 9.967 -4.209 1.00 0.00 C ATOM 805 CD GLU A 100 2.622 10.959 -3.711 1.00 0.00 C ATOM 806 OE1 GLU A 100 3.837 10.719 -3.889 1.00 0.00 O ATOM 807 OE2 GLU A 100 2.250 11.981 -3.098 1.00 0.00 O ATOM 0 H GLU A 100 2.533 6.129 -4.634 1.00 0.00 H new ATOM 0 HA GLU A 100 0.066 7.640 -4.551 1.00 0.00 H new ATOM 0 HB2 GLU A 100 2.107 8.158 -3.168 1.00 0.00 H new ATOM 0 HB3 GLU A 100 3.014 8.437 -4.642 1.00 0.00 H new ATOM 0 HG2 GLU A 100 1.260 10.240 -5.223 1.00 0.00 H new ATOM 0 HG3 GLU A 100 0.663 10.061 -3.585 1.00 0.00 H new ATOM 814 N MET A 101 -0.079 8.547 -6.855 1.00 0.00 N ATOM 815 CA MET A 101 -0.337 8.804 -8.265 1.00 0.00 C ATOM 816 C MET A 101 -0.529 10.285 -8.605 1.00 0.00 C ATOM 817 O MET A 101 -0.801 11.117 -7.745 1.00 0.00 O ATOM 818 CB MET A 101 -1.404 7.790 -8.686 1.00 0.00 C ATOM 819 CG MET A 101 -2.313 8.167 -9.853 1.00 0.00 C ATOM 820 SD MET A 101 -1.525 8.128 -11.472 1.00 0.00 S ATOM 821 CE MET A 101 -1.178 6.353 -11.504 1.00 0.00 C ATOM 0 H MET A 101 -0.823 8.861 -6.231 1.00 0.00 H new ATOM 0 HA MET A 101 0.532 8.631 -8.900 1.00 0.00 H new ATOM 0 HB2 MET A 101 -0.900 6.857 -8.940 1.00 0.00 H new ATOM 0 HB3 MET A 101 -2.035 7.586 -7.821 1.00 0.00 H new ATOM 0 HG2 MET A 101 -3.166 7.489 -9.864 1.00 0.00 H new ATOM 0 HG3 MET A 101 -2.705 9.169 -9.680 1.00 0.00 H new ATOM 0 HE1 MET A 101 -0.744 6.084 -12.467 1.00 0.00 H new ATOM 0 HE2 MET A 101 -0.476 6.105 -10.708 1.00 0.00 H new ATOM 0 HE3 MET A 101 -2.105 5.798 -11.356 1.00 0.00 H new ATOM 831 N ASN A 102 -0.271 10.638 -9.868 1.00 0.00 N ATOM 832 CA ASN A 102 -0.199 12.022 -10.343 1.00 0.00 C ATOM 833 C ASN A 102 -1.555 12.760 -10.345 1.00 0.00 C ATOM 834 O ASN A 102 -1.576 13.990 -10.295 1.00 0.00 O ATOM 835 CB ASN A 102 0.464 11.902 -11.720 1.00 0.00 C ATOM 836 CG ASN A 102 0.149 12.966 -12.754 1.00 0.00 C ATOM 837 OD1 ASN A 102 0.464 14.138 -12.627 1.00 0.00 O ATOM 838 ND2 ASN A 102 -0.433 12.532 -13.851 1.00 0.00 N ATOM 0 H ASN A 102 -0.103 9.953 -10.605 1.00 0.00 H new ATOM 0 HA ASN A 102 0.378 12.658 -9.672 1.00 0.00 H new ATOM 0 HB2 ASN A 102 1.544 11.889 -11.571 1.00 0.00 H new ATOM 0 HB3 ASN A 102 0.189 10.935 -12.141 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -0.629 13.179 -14.615 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -0.689 11.548 -13.938 1.00 0.00 H new ATOM 845 N THR A 103 -2.677 12.034 -10.371 1.00 0.00 N ATOM 846 CA THR A 103 -4.034 12.608 -10.463 1.00 0.00 C ATOM 847 C THR A 103 -5.021 11.822 -9.596 1.00 0.00 C ATOM 848 O THR A 103 -4.883 10.613 -9.407 1.00 0.00 O ATOM 849 CB THR A 103 -4.524 12.743 -11.929 1.00 0.00 C ATOM 850 OG1 THR A 103 -5.524 11.813 -12.273 1.00 0.00 O ATOM 851 CG2 THR A 103 -3.424 12.602 -12.985 1.00 0.00 C ATOM 0 H THR A 103 -2.674 11.015 -10.328 1.00 0.00 H new ATOM 0 HA THR A 103 -3.983 13.623 -10.069 1.00 0.00 H new ATOM 0 HB THR A 103 -4.916 13.760 -11.942 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.791 11.950 -13.206 1.00 0.00 H new ATOM 0 HG21 THR A 103 -3.858 12.710 -13.979 1.00 0.00 H new ATOM 0 HG22 THR A 103 -2.671 13.375 -12.832 1.00 0.00 H new ATOM 0 HG23 THR A 103 -2.959 11.620 -12.897 1.00 0.00 H new ATOM 859 N GLU A 104 -6.021 12.516 -9.049 1.00 0.00 N ATOM 860 CA GLU A 104 -7.056 11.901 -8.204 1.00 0.00 C ATOM 861 C GLU A 104 -7.935 10.926 -8.997 1.00 0.00 C ATOM 862 O GLU A 104 -8.280 9.856 -8.500 1.00 0.00 O ATOM 863 CB GLU A 104 -7.926 12.982 -7.542 1.00 0.00 C ATOM 864 CG GLU A 104 -7.097 13.956 -6.693 1.00 0.00 C ATOM 865 CD GLU A 104 -8.006 14.859 -5.845 1.00 0.00 C ATOM 866 OE1 GLU A 104 -8.496 15.891 -6.365 1.00 0.00 O ATOM 867 OE2 GLU A 104 -8.233 14.538 -4.653 1.00 0.00 O ATOM 0 H GLU A 104 -6.139 13.521 -9.177 1.00 0.00 H new ATOM 0 HA GLU A 104 -6.545 11.331 -7.428 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -8.460 13.538 -8.313 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -8.679 12.506 -6.914 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -6.426 13.396 -6.042 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -6.473 14.570 -7.343 1.00 0.00 H new ATOM 874 N GLU A 105 -8.263 11.264 -10.248 1.00 0.00 N ATOM 875 CA GLU A 105 -9.063 10.406 -11.128 1.00 0.00 C ATOM 876 C GLU A 105 -8.299 9.178 -11.618 1.00 0.00 C ATOM 877 O GLU A 105 -8.854 8.079 -11.631 1.00 0.00 O ATOM 878 CB GLU A 105 -9.559 11.191 -12.354 1.00 0.00 C ATOM 879 CG GLU A 105 -10.613 12.258 -12.022 1.00 0.00 C ATOM 880 CD GLU A 105 -11.919 11.639 -11.486 1.00 0.00 C ATOM 881 OE1 GLU A 105 -12.725 11.124 -12.295 1.00 0.00 O ATOM 882 OE2 GLU A 105 -12.155 11.672 -10.253 1.00 0.00 O ATOM 0 H GLU A 105 -7.980 12.143 -10.680 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.905 10.067 -10.525 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.707 11.672 -12.835 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -9.979 10.491 -13.076 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -10.209 12.947 -11.281 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.830 12.842 -12.916 1.00 0.00 H new ATOM 889 N ALA A 106 -7.019 9.336 -11.969 1.00 0.00 N ATOM 890 CA ALA A 106 -6.132 8.220 -12.250 1.00 0.00 C ATOM 891 C ALA A 106 -6.108 7.248 -11.081 1.00 0.00 C ATOM 892 O ALA A 106 -6.313 6.064 -11.284 1.00 0.00 O ATOM 893 CB ALA A 106 -4.722 8.712 -12.539 1.00 0.00 C ATOM 0 H ALA A 106 -6.574 10.249 -12.065 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.511 7.704 -13.132 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -4.075 7.860 -12.747 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.738 9.375 -13.404 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -4.341 9.254 -11.674 1.00 0.00 H new ATOM 899 N ALA A 107 -5.891 7.717 -9.857 1.00 0.00 N ATOM 900 CA ALA A 107 -5.830 6.822 -8.713 1.00 0.00 C ATOM 901 C ALA A 107 -7.184 6.216 -8.329 1.00 0.00 C ATOM 902 O ALA A 107 -7.236 5.032 -8.007 1.00 0.00 O ATOM 903 CB ALA A 107 -5.238 7.588 -7.565 1.00 0.00 C ATOM 0 H ALA A 107 -5.756 8.703 -9.635 1.00 0.00 H new ATOM 0 HA ALA A 107 -5.208 5.967 -8.980 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -5.179 6.942 -6.689 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -4.238 7.929 -7.833 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -5.867 8.449 -7.339 1.00 0.00 H new ATOM 909 N ASN A 108 -8.287 6.965 -8.415 1.00 0.00 N ATOM 910 CA ASN A 108 -9.633 6.405 -8.285 1.00 0.00 C ATOM 911 C ASN A 108 -9.857 5.276 -9.303 1.00 0.00 C ATOM 912 O ASN A 108 -10.255 4.174 -8.923 1.00 0.00 O ATOM 913 CB ASN A 108 -10.661 7.539 -8.411 1.00 0.00 C ATOM 914 CG ASN A 108 -12.087 7.015 -8.381 1.00 0.00 C ATOM 915 OD1 ASN A 108 -12.706 6.770 -9.407 1.00 0.00 O ATOM 916 ND2 ASN A 108 -12.644 6.811 -7.209 1.00 0.00 N ATOM 0 H ASN A 108 -8.271 7.972 -8.576 1.00 0.00 H new ATOM 0 HA ASN A 108 -9.756 5.950 -7.302 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -10.518 8.251 -7.598 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -10.492 8.080 -9.342 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -13.595 6.447 -7.153 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -12.125 7.016 -6.355 1.00 0.00 H new ATOM 923 N THR A 109 -9.515 5.492 -10.575 1.00 0.00 N ATOM 924 CA THR A 109 -9.573 4.430 -11.578 1.00 0.00 C ATOM 925 C THR A 109 -8.549 3.327 -11.293 1.00 0.00 C ATOM 926 O THR A 109 -8.857 2.170 -11.543 1.00 0.00 O ATOM 927 CB THR A 109 -9.489 4.989 -13.015 1.00 0.00 C ATOM 928 OG1 THR A 109 -10.506 4.397 -13.796 1.00 0.00 O ATOM 929 CG2 THR A 109 -8.174 4.744 -13.757 1.00 0.00 C ATOM 0 H THR A 109 -9.196 6.392 -10.933 1.00 0.00 H new ATOM 0 HA THR A 109 -10.552 3.957 -11.503 1.00 0.00 H new ATOM 0 HB THR A 109 -9.587 6.068 -12.892 1.00 0.00 H new ATOM 0 HG1 THR A 109 -10.462 4.747 -14.710 1.00 0.00 H new ATOM 0 HG21 THR A 109 -8.232 5.181 -14.754 1.00 0.00 H new ATOM 0 HG22 THR A 109 -7.354 5.205 -13.206 1.00 0.00 H new ATOM 0 HG23 THR A 109 -7.998 3.672 -13.840 1.00 0.00 H new ATOM 937 N MET A 110 -7.377 3.632 -10.708 1.00 0.00 N ATOM 938 CA MET A 110 -6.296 2.683 -10.448 1.00 0.00 C ATOM 939 C MET A 110 -6.693 1.705 -9.336 1.00 0.00 C ATOM 940 O MET A 110 -6.538 0.497 -9.465 1.00 0.00 O ATOM 941 CB MET A 110 -4.953 3.389 -10.110 1.00 0.00 C ATOM 942 CG MET A 110 -3.811 2.476 -10.570 1.00 0.00 C ATOM 943 SD MET A 110 -2.150 3.163 -10.406 1.00 0.00 S ATOM 944 CE MET A 110 -2.195 3.500 -8.643 1.00 0.00 C ATOM 0 H MET A 110 -7.156 4.578 -10.396 1.00 0.00 H new ATOM 0 HA MET A 110 -6.134 2.123 -11.369 1.00 0.00 H new ATOM 0 HB2 MET A 110 -4.894 4.356 -10.610 1.00 0.00 H new ATOM 0 HB3 MET A 110 -4.881 3.580 -9.039 1.00 0.00 H new ATOM 0 HG2 MET A 110 -3.859 1.548 -10.000 1.00 0.00 H new ATOM 0 HG3 MET A 110 -3.976 2.216 -11.616 1.00 0.00 H new ATOM 0 HE1 MET A 110 -1.195 3.382 -8.224 1.00 0.00 H new ATOM 0 HE2 MET A 110 -2.541 4.520 -8.476 1.00 0.00 H new ATOM 0 HE3 MET A 110 -2.876 2.802 -8.156 1.00 0.00 H new ATOM 954 N VAL A 111 -7.259 2.222 -8.247 1.00 0.00 N ATOM 955 CA VAL A 111 -7.747 1.426 -7.114 1.00 0.00 C ATOM 956 C VAL A 111 -8.960 0.581 -7.497 1.00 0.00 C ATOM 957 O VAL A 111 -9.031 -0.591 -7.133 1.00 0.00 O ATOM 958 CB VAL A 111 -8.022 2.346 -5.912 1.00 0.00 C ATOM 959 CG1 VAL A 111 -9.403 2.975 -5.844 1.00 0.00 C ATOM 960 CG2 VAL A 111 -7.817 1.592 -4.598 1.00 0.00 C ATOM 0 H VAL A 111 -7.396 3.225 -8.122 1.00 0.00 H new ATOM 0 HA VAL A 111 -6.973 0.717 -6.822 1.00 0.00 H new ATOM 0 HB VAL A 111 -7.308 3.157 -6.059 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -9.475 3.600 -4.954 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -9.569 3.586 -6.731 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -10.158 2.190 -5.798 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -8.016 2.260 -3.760 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -8.499 0.743 -4.555 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -6.789 1.234 -4.540 1.00 0.00 H new ATOM 970 N ASN A 112 -9.891 1.143 -8.277 1.00 0.00 N ATOM 971 CA ASN A 112 -11.082 0.434 -8.744 1.00 0.00 C ATOM 972 C ASN A 112 -10.698 -0.663 -9.746 1.00 0.00 C ATOM 973 O ASN A 112 -11.109 -1.809 -9.586 1.00 0.00 O ATOM 974 CB ASN A 112 -12.085 1.439 -9.323 1.00 0.00 C ATOM 975 CG ASN A 112 -12.896 2.131 -8.233 1.00 0.00 C ATOM 976 OD1 ASN A 112 -14.082 1.883 -8.060 1.00 0.00 O ATOM 977 ND2 ASN A 112 -12.302 2.988 -7.433 1.00 0.00 N ATOM 0 H ASN A 112 -9.836 2.108 -8.602 1.00 0.00 H new ATOM 0 HA ASN A 112 -11.566 -0.067 -7.906 1.00 0.00 H new ATOM 0 HB2 ASN A 112 -11.551 2.188 -9.908 1.00 0.00 H new ATOM 0 HB3 ASN A 112 -12.761 0.924 -10.006 1.00 0.00 H new ATOM 0 HD21 ASN A 112 -12.829 3.435 -6.682 1.00 0.00 H new ATOM 0 HD22 ASN A 112 -11.314 3.206 -7.563 1.00 0.00 H new ATOM 984 N TYR A 113 -9.813 -0.346 -10.697 1.00 0.00 N ATOM 985 CA TYR A 113 -9.117 -1.303 -11.561 1.00 0.00 C ATOM 986 C TYR A 113 -8.532 -2.472 -10.766 1.00 0.00 C ATOM 987 O TYR A 113 -8.750 -3.620 -11.128 1.00 0.00 O ATOM 988 CB TYR A 113 -8.018 -0.573 -12.355 1.00 0.00 C ATOM 989 CG TYR A 113 -6.997 -1.473 -13.012 1.00 0.00 C ATOM 990 CD1 TYR A 113 -7.267 -1.986 -14.289 1.00 0.00 C ATOM 991 CD2 TYR A 113 -5.770 -1.750 -12.373 1.00 0.00 C ATOM 992 CE1 TYR A 113 -6.350 -2.860 -14.904 1.00 0.00 C ATOM 993 CE2 TYR A 113 -4.861 -2.646 -12.979 1.00 0.00 C ATOM 994 CZ TYR A 113 -5.150 -3.202 -14.242 1.00 0.00 C ATOM 995 OH TYR A 113 -4.239 -4.018 -14.842 1.00 0.00 O ATOM 0 H TYR A 113 -9.553 0.621 -10.893 1.00 0.00 H new ATOM 0 HA TYR A 113 -9.843 -1.727 -12.255 1.00 0.00 H new ATOM 0 HB2 TYR A 113 -8.491 0.036 -13.125 1.00 0.00 H new ATOM 0 HB3 TYR A 113 -7.498 0.110 -11.683 1.00 0.00 H new ATOM 0 HD1 TYR A 113 -8.178 -1.711 -14.800 1.00 0.00 H new ATOM 0 HD2 TYR A 113 -5.528 -1.282 -11.430 1.00 0.00 H new ATOM 0 HE1 TYR A 113 -6.564 -3.268 -15.881 1.00 0.00 H new ATOM 0 HE2 TYR A 113 -3.943 -2.906 -12.474 1.00 0.00 H new ATOM 0 HH TYR A 113 -3.472 -4.147 -14.245 1.00 0.00 H new ATOM 1005 N TYR A 114 -7.873 -2.221 -9.634 1.00 0.00 N ATOM 1006 CA TYR A 114 -7.218 -3.256 -8.846 1.00 0.00 C ATOM 1007 C TYR A 114 -8.184 -3.994 -7.929 1.00 0.00 C ATOM 1008 O TYR A 114 -7.908 -5.109 -7.487 1.00 0.00 O ATOM 1009 CB TYR A 114 -6.081 -2.648 -8.051 1.00 0.00 C ATOM 1010 CG TYR A 114 -4.812 -2.389 -8.825 1.00 0.00 C ATOM 1011 CD1 TYR A 114 -4.254 -3.388 -9.657 1.00 0.00 C ATOM 1012 CD2 TYR A 114 -4.121 -1.186 -8.581 1.00 0.00 C ATOM 1013 CE1 TYR A 114 -2.930 -3.210 -10.119 1.00 0.00 C ATOM 1014 CE2 TYR A 114 -2.818 -1.007 -9.062 1.00 0.00 C ATOM 1015 CZ TYR A 114 -2.206 -2.043 -9.788 1.00 0.00 C ATOM 1016 OH TYR A 114 -0.901 -1.914 -10.132 1.00 0.00 O ATOM 0 H TYR A 114 -7.780 -1.285 -9.239 1.00 0.00 H new ATOM 0 HA TYR A 114 -6.823 -3.999 -9.540 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -6.423 -1.706 -7.623 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -5.849 -3.311 -7.218 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -4.824 -4.263 -9.932 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -4.599 -0.397 -8.020 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -2.468 -3.972 -10.730 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -2.290 -0.083 -8.877 1.00 0.00 H new ATOM 0 HH TYR A 114 -0.566 -1.046 -9.824 1.00 0.00 H new ATOM 1026 N THR A 115 -9.352 -3.395 -7.716 1.00 0.00 N ATOM 1027 CA THR A 115 -10.478 -4.012 -7.037 1.00 0.00 C ATOM 1028 C THR A 115 -11.255 -4.936 -8.000 1.00 0.00 C ATOM 1029 O THR A 115 -12.023 -5.804 -7.581 1.00 0.00 O ATOM 1030 CB THR A 115 -11.335 -2.925 -6.352 1.00 0.00 C ATOM 1031 OG1 THR A 115 -10.545 -2.267 -5.380 1.00 0.00 O ATOM 1032 CG2 THR A 115 -12.566 -3.448 -5.611 1.00 0.00 C ATOM 0 H THR A 115 -9.543 -2.441 -8.021 1.00 0.00 H new ATOM 0 HA THR A 115 -10.129 -4.666 -6.238 1.00 0.00 H new ATOM 0 HB THR A 115 -11.677 -2.280 -7.161 1.00 0.00 H new ATOM 0 HG1 THR A 115 -9.943 -1.632 -5.822 1.00 0.00 H new ATOM 0 HG21 THR A 115 -13.104 -2.612 -5.163 1.00 0.00 H new ATOM 0 HG22 THR A 115 -13.220 -3.966 -6.312 1.00 0.00 H new ATOM 0 HG23 THR A 115 -12.253 -4.139 -4.828 1.00 0.00 H new ATOM 1040 N SER A 116 -10.992 -4.797 -9.305 1.00 0.00 N ATOM 1041 CA SER A 116 -11.571 -5.525 -10.445 1.00 0.00 C ATOM 1042 C SER A 116 -10.684 -6.677 -10.942 1.00 0.00 C ATOM 1043 O SER A 116 -11.137 -7.809 -11.105 1.00 0.00 O ATOM 1044 CB SER A 116 -11.728 -4.522 -11.603 1.00 0.00 C ATOM 1045 OG SER A 116 -13.020 -4.575 -12.187 1.00 0.00 O ATOM 0 H SER A 116 -10.307 -4.110 -9.620 1.00 0.00 H new ATOM 0 HA SER A 116 -12.517 -5.957 -10.118 1.00 0.00 H new ATOM 0 HB2 SER A 116 -11.538 -3.513 -11.236 1.00 0.00 H new ATOM 0 HB3 SER A 116 -10.978 -4.730 -12.366 1.00 0.00 H new ATOM 0 HG SER A 116 -13.077 -3.922 -12.916 1.00 0.00 H new ATOM 1051 N VAL A 117 -9.427 -6.350 -11.258 1.00 0.00 N ATOM 1052 CA VAL A 117 -8.524 -7.068 -12.174 1.00 0.00 C ATOM 1053 C VAL A 117 -8.010 -8.410 -11.631 1.00 0.00 C ATOM 1054 O VAL A 117 -7.825 -9.358 -12.389 1.00 0.00 O ATOM 1055 CB VAL A 117 -7.326 -6.143 -12.513 1.00 0.00 C ATOM 1056 CG1 VAL A 117 -6.438 -5.875 -11.327 1.00 0.00 C ATOM 1057 CG2 VAL A 117 -6.497 -6.670 -13.681 1.00 0.00 C ATOM 0 H VAL A 117 -8.981 -5.525 -10.857 1.00 0.00 H new ATOM 0 HA VAL A 117 -9.104 -7.315 -13.063 1.00 0.00 H new ATOM 0 HB VAL A 117 -7.774 -5.195 -12.812 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -5.618 -5.222 -11.627 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -7.018 -5.392 -10.540 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.035 -6.817 -10.954 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -5.671 -5.987 -13.878 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -6.102 -7.655 -13.432 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -7.125 -6.745 -14.568 1.00 0.00 H new ATOM 1067 N THR A 118 -7.769 -8.460 -10.315 1.00 0.00 N ATOM 1068 CA THR A 118 -6.513 -8.870 -9.635 1.00 0.00 C ATOM 1069 C THR A 118 -5.354 -9.349 -10.538 1.00 0.00 C ATOM 1070 O THR A 118 -5.487 -10.374 -11.208 1.00 0.00 O ATOM 1071 CB THR A 118 -6.729 -9.854 -8.471 1.00 0.00 C ATOM 1072 OG1 THR A 118 -8.037 -9.794 -7.941 1.00 0.00 O ATOM 1073 CG2 THR A 118 -5.795 -9.443 -7.331 1.00 0.00 C ATOM 0 H THR A 118 -8.490 -8.199 -9.642 1.00 0.00 H new ATOM 0 HA THR A 118 -6.179 -7.915 -9.230 1.00 0.00 H new ATOM 0 HB THR A 118 -6.544 -10.857 -8.855 1.00 0.00 H new ATOM 0 HG1 THR A 118 -8.123 -10.438 -7.207 1.00 0.00 H new ATOM 0 HG21 THR A 118 -5.926 -10.124 -6.490 1.00 0.00 H new ATOM 0 HG22 THR A 118 -4.761 -9.485 -7.674 1.00 0.00 H new ATOM 0 HG23 THR A 118 -6.031 -8.427 -7.015 1.00 0.00 H new ATOM 1081 N PRO A 119 -4.198 -8.646 -10.583 1.00 0.00 N ATOM 1082 CA PRO A 119 -3.154 -8.864 -11.596 1.00 0.00 C ATOM 1083 C PRO A 119 -2.311 -10.135 -11.335 1.00 0.00 C ATOM 1084 O PRO A 119 -1.672 -10.647 -12.254 1.00 0.00 O ATOM 1085 CB PRO A 119 -2.257 -7.609 -11.554 1.00 0.00 C ATOM 1086 CG PRO A 119 -2.897 -6.687 -10.521 1.00 0.00 C ATOM 1087 CD PRO A 119 -3.671 -7.666 -9.651 1.00 0.00 C ATOM 0 HA PRO A 119 -3.613 -9.019 -12.572 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -1.236 -7.865 -11.272 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -2.207 -7.129 -12.531 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -2.150 -6.136 -9.949 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -3.552 -5.949 -10.984 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -3.024 -8.133 -8.908 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -4.472 -7.165 -9.107 1.00 0.00 H new ATOM 1095 N VAL A 120 -2.343 -10.640 -10.088 1.00 0.00 N ATOM 1096 CA VAL A 120 -1.644 -11.807 -9.518 1.00 0.00 C ATOM 1097 C VAL A 120 -0.115 -11.680 -9.577 1.00 0.00 C ATOM 1098 O VAL A 120 0.501 -11.790 -10.634 1.00 0.00 O ATOM 1099 CB VAL A 120 -2.163 -13.117 -10.123 1.00 0.00 C ATOM 1100 CG1 VAL A 120 -1.710 -14.338 -9.327 1.00 0.00 C ATOM 1101 CG2 VAL A 120 -3.692 -13.134 -10.086 1.00 0.00 C ATOM 0 H VAL A 120 -2.922 -10.192 -9.378 1.00 0.00 H new ATOM 0 HA VAL A 120 -1.882 -11.833 -8.455 1.00 0.00 H new ATOM 0 HB VAL A 120 -1.769 -13.164 -11.138 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -2.102 -15.242 -9.793 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -0.621 -14.380 -9.313 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -2.083 -14.265 -8.306 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -4.056 -14.067 -10.517 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -4.032 -13.054 -9.053 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -4.079 -12.293 -10.661 1.00 0.00 H new ATOM 1111 N LEU A 121 0.491 -11.381 -8.421 1.00 0.00 N ATOM 1112 CA LEU A 121 1.827 -10.786 -8.311 1.00 0.00 C ATOM 1113 C LEU A 121 2.919 -11.739 -8.828 1.00 0.00 C ATOM 1114 O LEU A 121 3.543 -11.475 -9.860 1.00 0.00 O ATOM 1115 CB LEU A 121 2.036 -10.312 -6.858 1.00 0.00 C ATOM 1116 CG LEU A 121 3.154 -9.263 -6.713 1.00 0.00 C ATOM 1117 CD1 LEU A 121 2.963 -8.513 -5.395 1.00 0.00 C ATOM 1118 CD2 LEU A 121 4.535 -9.907 -6.741 1.00 0.00 C ATOM 0 H LEU A 121 0.054 -11.551 -7.515 1.00 0.00 H new ATOM 0 HA LEU A 121 1.907 -9.912 -8.957 1.00 0.00 H new ATOM 0 HB2 LEU A 121 1.103 -9.892 -6.483 1.00 0.00 H new ATOM 0 HB3 LEU A 121 2.272 -11.173 -6.233 1.00 0.00 H new ATOM 0 HG LEU A 121 3.092 -8.574 -7.555 1.00 0.00 H new ATOM 0 HD11 LEU A 121 3.750 -7.768 -5.283 1.00 0.00 H new ATOM 0 HD12 LEU A 121 1.992 -8.018 -5.396 1.00 0.00 H new ATOM 0 HD13 LEU A 121 3.010 -9.218 -4.565 1.00 0.00 H new ATOM 0 HD21 LEU A 121 5.298 -9.136 -6.636 1.00 0.00 H new ATOM 0 HD22 LEU A 121 4.622 -10.618 -5.919 1.00 0.00 H new ATOM 0 HD23 LEU A 121 4.674 -10.429 -7.688 1.00 0.00 H new ATOM 1130 N ARG A 122 3.127 -12.858 -8.123 1.00 0.00 N ATOM 1131 CA ARG A 122 3.949 -13.999 -8.562 1.00 0.00 C ATOM 1132 C ARG A 122 3.338 -15.312 -8.058 1.00 0.00 C ATOM 1133 O ARG A 122 3.885 -16.004 -7.199 1.00 0.00 O ATOM 1134 CB ARG A 122 5.430 -13.779 -8.160 1.00 0.00 C ATOM 1135 CG ARG A 122 6.416 -14.324 -9.207 1.00 0.00 C ATOM 1136 CD ARG A 122 6.296 -15.830 -9.484 1.00 0.00 C ATOM 1137 NE ARG A 122 7.235 -16.242 -10.546 1.00 0.00 N ATOM 1138 CZ ARG A 122 7.010 -17.036 -11.579 1.00 0.00 C ATOM 1139 NH1 ARG A 122 5.869 -17.639 -11.761 1.00 0.00 N ATOM 1140 NH2 ARG A 122 7.943 -17.242 -12.465 1.00 0.00 N ATOM 0 H ARG A 122 2.716 -13.001 -7.201 1.00 0.00 H new ATOM 0 HA ARG A 122 3.950 -14.073 -9.649 1.00 0.00 H new ATOM 0 HB2 ARG A 122 5.609 -12.713 -8.018 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.618 -14.264 -7.202 1.00 0.00 H new ATOM 0 HG2 ARG A 122 6.266 -13.784 -10.142 1.00 0.00 H new ATOM 0 HG3 ARG A 122 7.432 -14.110 -8.875 1.00 0.00 H new ATOM 0 HD2 ARG A 122 6.502 -16.390 -8.572 1.00 0.00 H new ATOM 0 HD3 ARG A 122 5.275 -16.070 -9.781 1.00 0.00 H new ATOM 0 HE ARG A 122 8.180 -15.865 -10.473 1.00 0.00 H new ATOM 0 HH11 ARG A 122 5.110 -17.506 -11.093 1.00 0.00 H new ATOM 0 HH12 ARG A 122 5.735 -18.244 -12.571 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.852 -16.790 -12.363 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.765 -17.855 -13.260 1.00 0.00 H new ATOM 1154 N GLY A 123 2.155 -15.636 -8.584 1.00 0.00 N ATOM 1155 CA GLY A 123 1.379 -16.833 -8.223 1.00 0.00 C ATOM 1156 C GLY A 123 0.461 -16.668 -6.997 1.00 0.00 C ATOM 1157 O GLY A 123 -0.046 -17.663 -6.478 1.00 0.00 O ATOM 0 H GLY A 123 1.695 -15.062 -9.291 1.00 0.00 H new ATOM 0 HA2 GLY A 123 0.769 -17.124 -9.078 1.00 0.00 H new ATOM 0 HA3 GLY A 123 2.072 -17.653 -8.032 1.00 0.00 H new ATOM 1161 N GLN A 124 0.241 -15.435 -6.522 1.00 0.00 N ATOM 1162 CA GLN A 124 -0.634 -15.074 -5.406 1.00 0.00 C ATOM 1163 C GLN A 124 -1.460 -13.828 -5.785 1.00 0.00 C ATOM 1164 O GLN A 124 -0.911 -12.926 -6.432 1.00 0.00 O ATOM 1165 CB GLN A 124 0.244 -14.789 -4.175 1.00 0.00 C ATOM 1166 CG GLN A 124 -0.583 -14.533 -2.906 1.00 0.00 C ATOM 1167 CD GLN A 124 0.200 -14.110 -1.659 1.00 0.00 C ATOM 1168 OE1 GLN A 124 -0.376 -13.863 -0.606 1.00 0.00 O ATOM 1169 NE2 GLN A 124 1.513 -14.002 -1.692 1.00 0.00 N ATOM 0 H GLN A 124 0.696 -14.619 -6.931 1.00 0.00 H new ATOM 0 HA GLN A 124 -1.324 -15.887 -5.179 1.00 0.00 H new ATOM 0 HB2 GLN A 124 0.911 -15.634 -4.005 1.00 0.00 H new ATOM 0 HB3 GLN A 124 0.873 -13.922 -4.375 1.00 0.00 H new ATOM 0 HG2 GLN A 124 -1.318 -13.759 -3.127 1.00 0.00 H new ATOM 0 HG3 GLN A 124 -1.137 -15.441 -2.670 1.00 0.00 H new ATOM 0 HE21 GLN A 124 2.020 -14.201 -2.555 1.00 0.00 H new ATOM 0 HE22 GLN A 124 2.023 -13.719 -0.855 1.00 0.00 H new ATOM 1178 N PRO A 125 -2.748 -13.737 -5.402 1.00 0.00 N ATOM 1179 CA PRO A 125 -3.558 -12.527 -5.564 1.00 0.00 C ATOM 1180 C PRO A 125 -2.931 -11.298 -4.881 1.00 0.00 C ATOM 1181 O PRO A 125 -2.020 -11.417 -4.059 1.00 0.00 O ATOM 1182 CB PRO A 125 -4.934 -12.867 -4.968 1.00 0.00 C ATOM 1183 CG PRO A 125 -4.988 -14.394 -5.009 1.00 0.00 C ATOM 1184 CD PRO A 125 -3.532 -14.782 -4.768 1.00 0.00 C ATOM 0 HA PRO A 125 -3.631 -12.249 -6.616 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -5.032 -12.491 -3.949 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -5.742 -12.423 -5.550 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -5.648 -14.798 -4.241 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -5.353 -14.762 -5.968 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -3.313 -14.846 -3.702 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -3.308 -15.758 -5.199 1.00 0.00 H new ATOM 1192 N ILE A 126 -3.435 -10.105 -5.199 1.00 0.00 N ATOM 1193 CA ILE A 126 -2.892 -8.820 -4.727 1.00 0.00 C ATOM 1194 C ILE A 126 -3.988 -8.006 -4.043 1.00 0.00 C ATOM 1195 O ILE A 126 -5.172 -8.105 -4.360 1.00 0.00 O ATOM 1196 CB ILE A 126 -2.163 -8.010 -5.820 1.00 0.00 C ATOM 1197 CG1 ILE A 126 -1.631 -8.940 -6.926 1.00 0.00 C ATOM 1198 CG2 ILE A 126 -1.028 -7.197 -5.155 1.00 0.00 C ATOM 1199 CD1 ILE A 126 -0.733 -8.265 -7.944 1.00 0.00 C ATOM 0 H ILE A 126 -4.249 -9.997 -5.804 1.00 0.00 H new ATOM 0 HA ILE A 126 -2.118 -9.053 -3.995 1.00 0.00 H new ATOM 0 HB ILE A 126 -2.857 -7.320 -6.300 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -1.080 -9.757 -6.461 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -2.479 -9.384 -7.448 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -0.502 -6.618 -5.914 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -1.452 -6.521 -4.412 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -0.329 -7.878 -4.669 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -0.407 -8.997 -8.683 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -1.283 -7.467 -8.442 1.00 0.00 H new ATOM 0 HD13 ILE A 126 0.138 -7.846 -7.440 1.00 0.00 H new ATOM 1211 N TYR A 127 -3.563 -7.259 -3.035 1.00 0.00 N ATOM 1212 CA TYR A 127 -4.403 -6.853 -1.915 1.00 0.00 C ATOM 1213 C TYR A 127 -4.288 -5.338 -1.728 1.00 0.00 C ATOM 1214 O TYR A 127 -3.344 -4.865 -1.093 1.00 0.00 O ATOM 1215 CB TYR A 127 -3.950 -7.586 -0.646 1.00 0.00 C ATOM 1216 CG TYR A 127 -4.273 -9.065 -0.480 1.00 0.00 C ATOM 1217 CD1 TYR A 127 -3.854 -10.043 -1.409 1.00 0.00 C ATOM 1218 CD2 TYR A 127 -4.869 -9.480 0.727 1.00 0.00 C ATOM 1219 CE1 TYR A 127 -4.072 -11.412 -1.151 1.00 0.00 C ATOM 1220 CE2 TYR A 127 -5.049 -10.846 1.011 1.00 0.00 C ATOM 1221 CZ TYR A 127 -4.663 -11.818 0.064 1.00 0.00 C ATOM 1222 OH TYR A 127 -4.806 -13.138 0.360 1.00 0.00 O ATOM 0 H TYR A 127 -2.606 -6.911 -2.970 1.00 0.00 H new ATOM 0 HA TYR A 127 -5.444 -7.109 -2.114 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -2.868 -7.478 -0.575 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -4.380 -7.060 0.206 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -3.364 -9.740 -2.322 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -5.192 -8.740 1.444 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -3.786 -12.151 -1.885 1.00 0.00 H new ATOM 0 HE2 TYR A 127 -5.482 -11.150 1.952 1.00 0.00 H new ATOM 0 HH TYR A 127 -5.232 -13.232 1.238 1.00 0.00 H new ATOM 1232 N ILE A 128 -5.218 -4.579 -2.310 1.00 0.00 N ATOM 1233 CA ILE A 128 -5.189 -3.115 -2.358 1.00 0.00 C ATOM 1234 C ILE A 128 -6.359 -2.467 -1.600 1.00 0.00 C ATOM 1235 O ILE A 128 -7.467 -3.010 -1.557 1.00 0.00 O ATOM 1236 CB ILE A 128 -5.098 -2.672 -3.844 1.00 0.00 C ATOM 1237 CG1 ILE A 128 -3.766 -1.929 -4.029 1.00 0.00 C ATOM 1238 CG2 ILE A 128 -6.304 -1.844 -4.334 1.00 0.00 C ATOM 1239 CD1 ILE A 128 -3.480 -1.485 -5.463 1.00 0.00 C ATOM 0 H ILE A 128 -6.035 -4.976 -2.774 1.00 0.00 H new ATOM 0 HA ILE A 128 -4.305 -2.757 -1.831 1.00 0.00 H new ATOM 0 HB ILE A 128 -5.130 -3.562 -4.472 1.00 0.00 H new ATOM 0 HG12 ILE A 128 -3.762 -1.051 -3.383 1.00 0.00 H new ATOM 0 HG13 ILE A 128 -2.955 -2.575 -3.694 1.00 0.00 H new ATOM 0 HG21 ILE A 128 -6.160 -1.576 -5.381 1.00 0.00 H new ATOM 0 HG22 ILE A 128 -7.215 -2.433 -4.232 1.00 0.00 H new ATOM 0 HG23 ILE A 128 -6.390 -0.937 -3.736 1.00 0.00 H new ATOM 0 HD11 ILE A 128 -2.520 -0.969 -5.500 1.00 0.00 H new ATOM 0 HD12 ILE A 128 -3.448 -2.358 -6.115 1.00 0.00 H new ATOM 0 HD13 ILE A 128 -4.267 -0.810 -5.799 1.00 0.00 H new ATOM 1251 N GLN A 129 -6.127 -1.255 -1.091 1.00 0.00 N ATOM 1252 CA GLN A 129 -7.148 -0.204 -0.948 1.00 0.00 C ATOM 1253 C GLN A 129 -6.476 1.177 -0.895 1.00 0.00 C ATOM 1254 O GLN A 129 -5.255 1.268 -0.764 1.00 0.00 O ATOM 1255 CB GLN A 129 -8.030 -0.452 0.300 1.00 0.00 C ATOM 1256 CG GLN A 129 -9.522 -0.312 -0.048 1.00 0.00 C ATOM 1257 CD GLN A 129 -10.447 -0.693 1.113 1.00 0.00 C ATOM 1258 OE1 GLN A 129 -10.350 -1.757 1.710 1.00 0.00 O ATOM 1259 NE2 GLN A 129 -11.398 0.144 1.470 1.00 0.00 N ATOM 0 H GLN A 129 -5.207 -0.967 -0.759 1.00 0.00 H new ATOM 0 HA GLN A 129 -7.804 -0.233 -1.818 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -7.836 -1.449 0.695 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -7.767 0.258 1.084 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.725 0.717 -0.344 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -9.749 -0.942 -0.908 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -11.499 1.037 0.988 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -12.034 -0.100 2.229 1.00 0.00 H new ATOM 1268 N PHE A 130 -7.241 2.271 -0.970 1.00 0.00 N ATOM 1269 CA PHE A 130 -6.708 3.619 -0.726 1.00 0.00 C ATOM 1270 C PHE A 130 -5.954 3.723 0.619 1.00 0.00 C ATOM 1271 O PHE A 130 -6.274 3.035 1.596 1.00 0.00 O ATOM 1272 CB PHE A 130 -7.831 4.659 -0.784 1.00 0.00 C ATOM 1273 CG PHE A 130 -8.147 5.246 -2.145 1.00 0.00 C ATOM 1274 CD1 PHE A 130 -7.140 5.884 -2.894 1.00 0.00 C ATOM 1275 CD2 PHE A 130 -9.472 5.252 -2.622 1.00 0.00 C ATOM 1276 CE1 PHE A 130 -7.452 6.519 -4.107 1.00 0.00 C ATOM 1277 CE2 PHE A 130 -9.786 5.915 -3.821 1.00 0.00 C ATOM 1278 CZ PHE A 130 -8.776 6.550 -4.565 1.00 0.00 C ATOM 0 H PHE A 130 -8.235 2.251 -1.198 1.00 0.00 H new ATOM 0 HA PHE A 130 -5.986 3.822 -1.517 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -8.739 4.201 -0.392 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -7.571 5.478 -0.113 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -6.122 5.885 -2.534 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -10.248 4.747 -2.066 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -6.670 6.985 -4.688 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -10.807 5.937 -4.172 1.00 0.00 H new ATOM 0 HZ PHE A 130 -9.020 7.060 -5.486 1.00 0.00 H new ATOM 1288 N SER A 131 -4.951 4.599 0.666 1.00 0.00 N ATOM 1289 CA SER A 131 -4.130 4.846 1.852 1.00 0.00 C ATOM 1290 C SER A 131 -4.908 5.584 2.962 1.00 0.00 C ATOM 1291 O SER A 131 -5.881 6.295 2.694 1.00 0.00 O ATOM 1292 CB SER A 131 -2.866 5.611 1.439 1.00 0.00 C ATOM 1293 OG SER A 131 -2.096 6.028 2.543 1.00 0.00 O ATOM 0 H SER A 131 -4.680 5.169 -0.136 1.00 0.00 H new ATOM 0 HA SER A 131 -3.843 3.886 2.280 1.00 0.00 H new ATOM 0 HB2 SER A 131 -2.257 4.976 0.795 1.00 0.00 H new ATOM 0 HB3 SER A 131 -3.150 6.483 0.850 1.00 0.00 H new ATOM 0 HG SER A 131 -1.231 6.365 2.230 1.00 0.00 H new ATOM 1299 N ASN A 132 -4.438 5.477 4.212 1.00 0.00 N ATOM 1300 CA ASN A 132 -4.811 6.357 5.326 1.00 0.00 C ATOM 1301 C ASN A 132 -4.388 7.827 5.098 1.00 0.00 C ATOM 1302 O ASN A 132 -4.869 8.727 5.795 1.00 0.00 O ATOM 1303 CB ASN A 132 -4.158 5.836 6.621 1.00 0.00 C ATOM 1304 CG ASN A 132 -4.703 4.500 7.093 1.00 0.00 C ATOM 1305 OD1 ASN A 132 -5.900 4.265 7.140 1.00 0.00 O ATOM 1306 ND2 ASN A 132 -3.841 3.603 7.513 1.00 0.00 N ATOM 0 H ASN A 132 -3.769 4.756 4.483 1.00 0.00 H new ATOM 0 HA ASN A 132 -5.898 6.342 5.401 1.00 0.00 H new ATOM 0 HB2 ASN A 132 -3.084 5.743 6.462 1.00 0.00 H new ATOM 0 HB3 ASN A 132 -4.301 6.574 7.410 1.00 0.00 H new ATOM 0 HD21 ASN A 132 -4.172 2.710 7.878 1.00 0.00 H new ATOM 0 HD22 ASN A 132 -2.841 3.799 7.474 1.00 0.00 H new ATOM 1313 N HIS A 133 -3.497 8.077 4.132 1.00 0.00 N ATOM 1314 CA HIS A 133 -2.888 9.364 3.798 1.00 0.00 C ATOM 1315 C HIS A 133 -3.260 9.803 2.364 1.00 0.00 C ATOM 1316 O HIS A 133 -3.996 9.116 1.651 1.00 0.00 O ATOM 1317 CB HIS A 133 -1.359 9.261 3.992 1.00 0.00 C ATOM 1318 CG HIS A 133 -0.935 8.494 5.229 1.00 0.00 C ATOM 1319 ND1 HIS A 133 -0.944 8.933 6.538 1.00 0.00 N ATOM 1320 CD2 HIS A 133 -0.543 7.182 5.242 1.00 0.00 C ATOM 1321 CE1 HIS A 133 -0.551 7.903 7.315 1.00 0.00 C ATOM 1322 NE2 HIS A 133 -0.275 6.827 6.565 1.00 0.00 N ATOM 0 H HIS A 133 -3.161 7.332 3.522 1.00 0.00 H new ATOM 0 HA HIS A 133 -3.275 10.134 4.465 1.00 0.00 H new ATOM 0 HB2 HIS A 133 -0.925 8.781 3.115 1.00 0.00 H new ATOM 0 HB3 HIS A 133 -0.943 10.267 4.043 1.00 0.00 H new ATOM 0 HD2 HIS A 133 -0.456 6.536 4.381 1.00 0.00 H new ATOM 0 HE1 HIS A 133 -0.470 7.940 8.391 1.00 0.00 H new ATOM 0 HE2 HIS A 133 0.065 5.924 6.897 1.00 0.00 H new ATOM 1330 N LYS A 134 -2.758 10.970 1.937 1.00 0.00 N ATOM 1331 CA LYS A 134 -3.097 11.643 0.660 1.00 0.00 C ATOM 1332 C LYS A 134 -1.860 12.089 -0.144 1.00 0.00 C ATOM 1333 O LYS A 134 -1.974 12.867 -1.089 1.00 0.00 O ATOM 1334 CB LYS A 134 -4.052 12.818 0.969 1.00 0.00 C ATOM 1335 CG LYS A 134 -5.403 12.332 1.532 1.00 0.00 C ATOM 1336 CD LYS A 134 -6.451 13.448 1.664 1.00 0.00 C ATOM 1337 CE LYS A 134 -6.077 14.455 2.758 1.00 0.00 C ATOM 1338 NZ LYS A 134 -7.126 15.498 2.921 1.00 0.00 N ATOM 0 H LYS A 134 -2.079 11.497 2.486 1.00 0.00 H new ATOM 0 HA LYS A 134 -3.595 10.924 0.009 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -3.581 13.489 1.687 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -4.224 13.394 0.060 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -5.797 11.550 0.883 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -5.238 11.882 2.511 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -6.551 13.967 0.711 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -7.423 13.009 1.891 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -5.934 13.931 3.703 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -5.127 14.928 2.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -6.841 16.163 3.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -7.245 16.014 2.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -8.026 15.047 3.183 1.00 0.00 H new ATOM 1352 N GLU A 135 -0.673 11.624 0.247 1.00 0.00 N ATOM 1353 CA GLU A 135 0.649 12.109 -0.178 1.00 0.00 C ATOM 1354 C GLU A 135 1.754 11.123 0.257 1.00 0.00 C ATOM 1355 O GLU A 135 1.605 10.440 1.275 1.00 0.00 O ATOM 1356 CB GLU A 135 0.890 13.495 0.462 1.00 0.00 C ATOM 1357 CG GLU A 135 2.185 14.183 0.005 1.00 0.00 C ATOM 1358 CD GLU A 135 2.271 15.623 0.550 1.00 0.00 C ATOM 1359 OE1 GLU A 135 2.782 15.818 1.681 1.00 0.00 O ATOM 1360 OE2 GLU A 135 1.839 16.573 -0.146 1.00 0.00 O ATOM 0 H GLU A 135 -0.600 10.852 0.909 1.00 0.00 H new ATOM 0 HA GLU A 135 0.679 12.188 -1.265 1.00 0.00 H new ATOM 0 HB2 GLU A 135 0.045 14.143 0.227 1.00 0.00 H new ATOM 0 HB3 GLU A 135 0.914 13.383 1.546 1.00 0.00 H new ATOM 0 HG2 GLU A 135 3.046 13.609 0.348 1.00 0.00 H new ATOM 0 HG3 GLU A 135 2.227 14.200 -1.084 1.00 0.00 H new ATOM 1367 N LEU A 136 2.861 11.052 -0.491 1.00 0.00 N ATOM 1368 CA LEU A 136 4.031 10.217 -0.188 1.00 0.00 C ATOM 1369 C LEU A 136 5.375 10.920 -0.487 1.00 0.00 C ATOM 1370 O LEU A 136 6.175 11.107 0.430 1.00 0.00 O ATOM 1371 CB LEU A 136 3.860 8.893 -0.946 1.00 0.00 C ATOM 1372 CG LEU A 136 5.064 7.953 -0.900 1.00 0.00 C ATOM 1373 CD1 LEU A 136 5.365 7.483 0.516 1.00 0.00 C ATOM 1374 CD2 LEU A 136 4.792 6.758 -1.806 1.00 0.00 C ATOM 0 H LEU A 136 2.972 11.590 -1.350 1.00 0.00 H new ATOM 0 HA LEU A 136 4.077 10.024 0.884 1.00 0.00 H new ATOM 0 HB2 LEU A 136 2.995 8.369 -0.538 1.00 0.00 H new ATOM 0 HB3 LEU A 136 3.635 9.117 -1.989 1.00 0.00 H new ATOM 0 HG LEU A 136 5.941 8.498 -1.249 1.00 0.00 H new ATOM 0 HD11 LEU A 136 6.228 6.817 0.503 1.00 0.00 H new ATOM 0 HD12 LEU A 136 5.582 8.345 1.147 1.00 0.00 H new ATOM 0 HD13 LEU A 136 4.501 6.950 0.914 1.00 0.00 H new ATOM 0 HD21 LEU A 136 5.645 6.080 -1.781 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.902 6.233 -1.459 1.00 0.00 H new ATOM 0 HD23 LEU A 136 4.634 7.104 -2.827 1.00 0.00 H new ATOM 1386 N LYS A 137 5.640 11.274 -1.757 1.00 0.00 N ATOM 1387 CA LYS A 137 6.825 11.977 -2.300 1.00 0.00 C ATOM 1388 C LYS A 137 8.154 11.781 -1.533 1.00 0.00 C ATOM 1389 O LYS A 137 8.700 12.720 -0.944 1.00 0.00 O ATOM 1390 CB LYS A 137 6.483 13.462 -2.544 1.00 0.00 C ATOM 1391 CG LYS A 137 5.982 14.207 -1.288 1.00 0.00 C ATOM 1392 CD LYS A 137 6.221 15.724 -1.327 1.00 0.00 C ATOM 1393 CE LYS A 137 7.702 16.141 -1.430 1.00 0.00 C ATOM 1394 NZ LYS A 137 8.553 15.528 -0.374 1.00 0.00 N ATOM 0 H LYS A 137 4.974 11.058 -2.499 1.00 0.00 H new ATOM 0 HA LYS A 137 7.044 11.490 -3.250 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.369 13.970 -2.926 1.00 0.00 H new ATOM 0 HB3 LYS A 137 5.720 13.526 -3.320 1.00 0.00 H new ATOM 0 HG2 LYS A 137 4.915 14.020 -1.168 1.00 0.00 H new ATOM 0 HG3 LYS A 137 6.478 13.793 -0.410 1.00 0.00 H new ATOM 0 HD2 LYS A 137 5.680 16.141 -2.176 1.00 0.00 H new ATOM 0 HD3 LYS A 137 5.794 16.168 -0.428 1.00 0.00 H new ATOM 0 HE2 LYS A 137 8.087 15.857 -2.409 1.00 0.00 H new ATOM 0 HE3 LYS A 137 7.774 17.227 -1.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 9.499 15.958 -0.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 8.121 15.691 0.558 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 8.634 14.505 -0.544 1.00 0.00 H new