USER MOD reduce.3.24.130724 H: found=0, std=0, add=953, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 953 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 12 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 MET CE :methyl -170:sc= -0.848 (180deg=-1.38) USER MOD Single : A 34 LYS NZ :NH3+ 154:sc= -0.11 (180deg=-0.512) USER MOD Single : A 35 TYR OH : rot 151:sc= 0.588 USER MOD Single : A 39 GLN : amide:sc= -0.334 X(o=-0.33,f=-0.35) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 47 SER OG : rot 180:sc= 0.575 USER MOD Single : A 49 LYS NZ :NH3+ 168:sc=-0.00306 (180deg=-0.0956) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 GLN :FLIP amide:sc= -0.905 F(o=-1.7,f=-0.9) USER MOD Single : A 59 GLN : amide:sc= -0.232 X(o=-0.23,f=-0.045) USER MOD Single : A 61 TYR OH : rot 180:sc= -0.499 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl 164:sc= 0 (180deg=-0.296) USER MOD Single : A 79 ASN : amide:sc= -0.132 X(o=-0.13,f=-0.052) USER MOD Single : A 80 SER OG : rot 180:sc= -0.139 USER MOD Single : A 88 GLN :FLIP amide:sc= -0.0044 F(o=-0.69,f=-0.0044) USER MOD Single : A 96 LYS NZ :NH3+ 161:sc= 0.00415 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 78:sc= 0.247 USER MOD Single : A 101 GLN :FLIP amide:sc= -0.0826 F(o=-1.1,f=-0.083) USER MOD Single : A 106 ASN : amide:sc= -0.0774 K(o=-0.077,f=-3.6!) USER MOD Single : A 108 GLN : amide:sc= -0.159 X(o=-0.16,f=-0.0076) USER MOD Single : A 119 SER OG : rot 110:sc= -1.14 USER MOD Single : A 122 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 125 CYS SG : rot -29:sc= 0.317 USER MOD ----------------------------------------------------------------- ATOM 81 N ILE A 6 6.483 -1.877 -12.995 1.00 24.51 N ATOM 82 CA ILE A 6 7.851 -2.379 -13.057 1.00 14.11 C ATOM 83 C ILE A 6 8.647 -1.957 -11.827 1.00 20.53 C ATOM 84 O ILE A 6 9.588 -2.638 -11.421 1.00 23.40 O ATOM 85 CB ILE A 6 8.576 -1.880 -14.320 1.00 45.23 C ATOM 86 CG1 ILE A 6 8.394 -0.369 -14.476 1.00 44.31 C ATOM 87 CG2 ILE A 6 8.061 -2.611 -15.551 1.00 12.31 C ATOM 88 CD1 ILE A 6 9.221 0.227 -15.594 1.00 51.40 C ATOM 0 HA ILE A 6 7.788 -3.467 -13.090 1.00 14.11 H new ATOM 0 HB ILE A 6 9.641 -2.090 -14.216 1.00 45.23 H new ATOM 0 HG12 ILE A 6 7.341 -0.155 -14.660 1.00 44.31 H new ATOM 0 HG13 ILE A 6 8.659 0.120 -13.538 1.00 44.31 H new ATOM 0 HG21 ILE A 6 8.583 -2.247 -16.436 1.00 12.31 H new ATOM 0 HG22 ILE A 6 8.238 -3.681 -15.440 1.00 12.31 H new ATOM 0 HG23 ILE A 6 6.992 -2.430 -15.661 1.00 12.31 H new ATOM 0 HD11 ILE A 6 9.042 1.301 -15.646 1.00 51.40 H new ATOM 0 HD12 ILE A 6 10.278 0.044 -15.402 1.00 51.40 H new ATOM 0 HD13 ILE A 6 8.939 -0.234 -16.541 1.00 51.40 H new ATOM 100 N ALA A 7 8.262 -0.831 -11.236 1.00 55.14 N ATOM 101 CA ALA A 7 8.937 -0.320 -10.050 1.00 31.41 C ATOM 102 C ALA A 7 8.960 -1.365 -8.939 1.00 50.02 C ATOM 103 O ALA A 7 9.952 -1.504 -8.225 1.00 61.21 O ATOM 104 CB ALA A 7 8.261 0.954 -9.565 1.00 30.41 C ATOM 0 H ALA A 7 7.485 -0.255 -11.560 1.00 55.14 H new ATOM 0 HA ALA A 7 9.968 -0.091 -10.319 1.00 31.41 H new ATOM 0 HB1 ALA A 7 8.776 1.324 -8.679 1.00 30.41 H new ATOM 0 HB2 ALA A 7 8.302 1.709 -10.350 1.00 30.41 H new ATOM 0 HB3 ALA A 7 7.221 0.743 -9.318 1.00 30.41 H new ATOM 110 N GLY A 8 7.859 -2.097 -8.799 1.00 21.44 N ATOM 111 CA GLY A 8 7.774 -3.119 -7.772 1.00 22.51 C ATOM 112 C GLY A 8 8.531 -4.379 -8.144 1.00 32.22 C ATOM 113 O GLY A 8 9.055 -5.076 -7.274 1.00 44.52 O ATOM 0 H GLY A 8 7.025 -2.001 -9.378 1.00 21.44 H new ATOM 0 HA2 GLY A 8 8.170 -2.724 -6.837 1.00 22.51 H new ATOM 0 HA3 GLY A 8 6.727 -3.366 -7.596 1.00 22.51 H new ATOM 117 N ILE A 9 8.586 -4.674 -9.438 1.00 43.33 N ATOM 118 CA ILE A 9 9.284 -5.858 -9.922 1.00 73.55 C ATOM 119 C ILE A 9 10.795 -5.661 -9.883 1.00 43.04 C ATOM 120 O ILE A 9 11.546 -6.590 -9.582 1.00 3.43 O ATOM 121 CB ILE A 9 8.861 -6.213 -11.360 1.00 55.43 C ATOM 122 CG1 ILE A 9 7.401 -6.671 -11.387 1.00 50.14 C ATOM 123 CG2 ILE A 9 9.770 -7.291 -11.930 1.00 5.40 C ATOM 124 CD1 ILE A 9 6.411 -5.531 -11.487 1.00 25.12 C ATOM 0 H ILE A 9 8.155 -4.109 -10.170 1.00 43.33 H new ATOM 0 HA ILE A 9 9.010 -6.678 -9.258 1.00 73.55 H new ATOM 0 HB ILE A 9 8.955 -5.322 -11.980 1.00 55.43 H new ATOM 0 HG12 ILE A 9 7.255 -7.343 -12.233 1.00 50.14 H new ATOM 0 HG13 ILE A 9 7.192 -7.245 -10.484 1.00 50.14 H new ATOM 0 HG21 ILE A 9 9.458 -7.530 -12.946 1.00 5.40 H new ATOM 0 HG22 ILE A 9 10.799 -6.931 -11.942 1.00 5.40 H new ATOM 0 HG23 ILE A 9 9.706 -8.186 -11.311 1.00 5.40 H new ATOM 0 HD11 ILE A 9 5.397 -5.930 -11.501 1.00 25.12 H new ATOM 0 HD12 ILE A 9 6.529 -4.870 -10.628 1.00 25.12 H new ATOM 0 HD13 ILE A 9 6.593 -4.970 -12.404 1.00 25.12 H new ATOM 136 N LEU A 10 11.235 -4.445 -10.189 1.00 25.43 N ATOM 137 CA LEU A 10 12.659 -4.124 -10.187 1.00 35.11 C ATOM 138 C LEU A 10 13.164 -3.896 -8.766 1.00 35.53 C ATOM 139 O LEU A 10 14.298 -4.244 -8.434 1.00 74.14 O ATOM 140 CB LEU A 10 12.922 -2.882 -11.039 1.00 40.52 C ATOM 141 CG LEU A 10 12.667 -1.535 -10.360 1.00 61.41 C ATOM 142 CD1 LEU A 10 13.906 -1.073 -9.609 1.00 21.51 C ATOM 143 CD2 LEU A 10 12.243 -0.493 -11.384 1.00 73.25 C ATOM 0 H LEU A 10 10.627 -3.666 -10.441 1.00 25.43 H new ATOM 0 HA LEU A 10 13.198 -4.970 -10.613 1.00 35.11 H new ATOM 0 HB2 LEU A 10 13.960 -2.908 -11.372 1.00 40.52 H new ATOM 0 HB3 LEU A 10 12.299 -2.940 -11.932 1.00 40.52 H new ATOM 0 HG LEU A 10 11.857 -1.660 -9.642 1.00 61.41 H new ATOM 0 HD11 LEU A 10 13.706 -0.113 -9.132 1.00 21.51 H new ATOM 0 HD12 LEU A 10 14.166 -1.809 -8.848 1.00 21.51 H new ATOM 0 HD13 LEU A 10 14.736 -0.965 -10.308 1.00 21.51 H new ATOM 0 HD21 LEU A 10 12.066 0.459 -10.883 1.00 73.25 H new ATOM 0 HD22 LEU A 10 13.031 -0.371 -12.127 1.00 73.25 H new ATOM 0 HD23 LEU A 10 11.327 -0.819 -11.877 1.00 73.25 H new ATOM 155 N THR A 11 12.313 -3.312 -7.927 1.00 42.25 N ATOM 156 CA THR A 11 12.672 -3.039 -6.542 1.00 2.44 C ATOM 157 C THR A 11 12.629 -4.310 -5.702 1.00 1.13 C ATOM 158 O THR A 11 13.342 -4.432 -4.706 1.00 3.22 O ATOM 159 CB THR A 11 11.734 -1.990 -5.914 1.00 71.44 C ATOM 160 OG1 THR A 11 12.331 -1.442 -4.734 1.00 44.13 O ATOM 161 CG2 THR A 11 10.388 -2.608 -5.567 1.00 53.13 C ATOM 0 H THR A 11 11.370 -3.019 -8.184 1.00 42.25 H new ATOM 0 HA THR A 11 13.689 -2.647 -6.551 1.00 2.44 H new ATOM 0 HB THR A 11 11.575 -1.195 -6.642 1.00 71.44 H new ATOM 0 HG1 THR A 11 11.729 -0.775 -4.342 1.00 44.13 H new ATOM 0 HG21 THR A 11 9.742 -1.849 -5.125 1.00 53.13 H new ATOM 0 HG22 THR A 11 9.923 -2.998 -6.472 1.00 53.13 H new ATOM 0 HG23 THR A 11 10.533 -3.420 -4.855 1.00 53.13 H new ATOM 169 N SER A 12 11.789 -5.255 -6.110 1.00 35.21 N ATOM 170 CA SER A 12 11.650 -6.517 -5.392 1.00 64.24 C ATOM 171 C SER A 12 12.752 -7.493 -5.793 1.00 24.30 C ATOM 172 O SER A 12 13.582 -7.884 -4.971 1.00 32.22 O ATOM 173 CB SER A 12 10.279 -7.137 -5.668 1.00 22.32 C ATOM 174 OG SER A 12 10.078 -8.299 -4.882 1.00 13.04 O ATOM 0 H SER A 12 11.194 -5.171 -6.934 1.00 35.21 H new ATOM 0 HA SER A 12 11.740 -6.312 -4.325 1.00 64.24 H new ATOM 0 HB2 SER A 12 9.497 -6.409 -5.453 1.00 22.32 H new ATOM 0 HB3 SER A 12 10.197 -7.390 -6.725 1.00 22.32 H new ATOM 0 HG SER A 12 9.194 -8.676 -5.075 1.00 13.04 H new ATOM 180 N THR A 13 12.755 -7.884 -7.064 1.00 30.23 N ATOM 181 CA THR A 13 13.753 -8.815 -7.575 1.00 31.20 C ATOM 182 C THR A 13 14.424 -8.267 -8.829 1.00 25.40 C ATOM 183 O THR A 13 13.756 -7.934 -9.808 1.00 32.44 O ATOM 184 CB THR A 13 13.129 -10.186 -7.898 1.00 20.13 C ATOM 185 OG1 THR A 13 12.132 -10.512 -6.923 1.00 54.13 O ATOM 186 CG2 THR A 13 14.194 -11.272 -7.924 1.00 34.41 C ATOM 0 H THR A 13 12.077 -7.570 -7.758 1.00 30.23 H new ATOM 0 HA THR A 13 14.500 -8.940 -6.791 1.00 31.20 H new ATOM 0 HB THR A 13 12.667 -10.128 -8.884 1.00 20.13 H new ATOM 0 HG1 THR A 13 11.739 -11.384 -7.136 1.00 54.13 H new ATOM 0 HG21 THR A 13 13.730 -12.231 -8.154 1.00 34.41 H new ATOM 0 HG22 THR A 13 14.936 -11.036 -8.687 1.00 34.41 H new ATOM 0 HG23 THR A 13 14.680 -11.328 -6.950 1.00 34.41 H new ATOM 194 N ARG A 14 15.750 -8.177 -8.793 1.00 71.14 N ATOM 195 CA ARG A 14 16.512 -7.669 -9.928 1.00 11.13 C ATOM 196 C ARG A 14 17.254 -8.799 -10.634 1.00 63.33 C ATOM 197 O ARG A 14 18.273 -9.289 -10.145 1.00 70.35 O ATOM 198 CB ARG A 14 17.506 -6.602 -9.465 1.00 22.42 C ATOM 199 CG ARG A 14 18.305 -7.007 -8.237 1.00 2.13 C ATOM 200 CD ARG A 14 19.720 -6.453 -8.286 1.00 5.45 C ATOM 201 NE ARG A 14 20.260 -6.211 -6.950 1.00 61.31 N ATOM 202 CZ ARG A 14 20.750 -7.169 -6.171 1.00 65.35 C ATOM 203 NH1 ARG A 14 20.769 -8.426 -6.593 1.00 63.21 N ATOM 204 NH2 ARG A 14 21.224 -6.871 -4.968 1.00 52.23 N ATOM 0 H ARG A 14 16.318 -8.449 -7.991 1.00 71.14 H new ATOM 0 HA ARG A 14 15.812 -7.222 -10.633 1.00 11.13 H new ATOM 0 HB2 ARG A 14 18.195 -6.381 -10.280 1.00 22.42 H new ATOM 0 HB3 ARG A 14 16.964 -5.682 -9.248 1.00 22.42 H new ATOM 0 HG2 ARG A 14 17.803 -6.646 -7.339 1.00 2.13 H new ATOM 0 HG3 ARG A 14 18.341 -8.094 -8.167 1.00 2.13 H new ATOM 0 HD2 ARG A 14 20.365 -7.153 -8.816 1.00 5.45 H new ATOM 0 HD3 ARG A 14 19.725 -5.522 -8.853 1.00 5.45 H new ATOM 0 HE ARG A 14 20.261 -5.254 -6.596 1.00 61.31 H new ATOM 0 HH11 ARG A 14 20.407 -8.659 -7.518 1.00 63.21 H new ATOM 0 HH12 ARG A 14 21.146 -9.160 -5.993 1.00 63.21 H new ATOM 0 HH21 ARG A 14 21.212 -5.905 -4.640 1.00 52.23 H new ATOM 0 HH22 ARG A 14 21.600 -7.608 -4.371 1.00 52.23 H new ATOM 218 N THR A 15 16.737 -9.210 -11.788 1.00 32.21 N ATOM 219 CA THR A 15 17.349 -10.283 -12.561 1.00 33.50 C ATOM 220 C THR A 15 17.327 -9.968 -14.052 1.00 73.53 C ATOM 221 O THR A 15 16.260 -9.819 -14.649 1.00 32.41 O ATOM 222 CB THR A 15 16.634 -11.627 -12.321 1.00 50.30 C ATOM 223 OG1 THR A 15 16.478 -11.854 -10.916 1.00 30.41 O ATOM 224 CG2 THR A 15 17.416 -12.774 -12.942 1.00 72.32 C ATOM 0 H THR A 15 15.895 -8.815 -12.208 1.00 32.21 H new ATOM 0 HA THR A 15 18.383 -10.365 -12.225 1.00 33.50 H new ATOM 0 HB THR A 15 15.652 -11.581 -12.792 1.00 50.30 H new ATOM 0 HG1 THR A 15 16.022 -12.709 -10.771 1.00 30.41 H new ATOM 0 HG21 THR A 15 16.892 -13.712 -12.760 1.00 72.32 H new ATOM 0 HG22 THR A 15 17.508 -12.612 -14.016 1.00 72.32 H new ATOM 0 HG23 THR A 15 18.409 -12.821 -12.496 1.00 72.32 H new ATOM 232 N ILE A 16 18.510 -9.869 -14.649 1.00 32.12 N ATOM 233 CA ILE A 16 18.625 -9.574 -16.071 1.00 41.44 C ATOM 234 C ILE A 16 19.088 -10.799 -16.852 1.00 21.23 C ATOM 235 O ILE A 16 20.113 -11.400 -16.532 1.00 45.03 O ATOM 236 CB ILE A 16 19.606 -8.415 -16.328 1.00 5.30 C ATOM 237 CG1 ILE A 16 19.169 -7.167 -15.558 1.00 53.13 C ATOM 238 CG2 ILE A 16 19.700 -8.119 -17.818 1.00 35.35 C ATOM 239 CD1 ILE A 16 19.708 -7.108 -14.146 1.00 40.33 C ATOM 0 H ILE A 16 19.402 -9.989 -14.169 1.00 32.12 H new ATOM 0 HA ILE A 16 17.632 -9.282 -16.413 1.00 41.44 H new ATOM 0 HB ILE A 16 20.594 -8.710 -15.974 1.00 5.30 H new ATOM 0 HG12 ILE A 16 19.498 -6.281 -16.101 1.00 53.13 H new ATOM 0 HG13 ILE A 16 18.080 -7.134 -15.524 1.00 53.13 H new ATOM 0 HG21 ILE A 16 20.397 -7.297 -17.982 1.00 35.35 H new ATOM 0 HG22 ILE A 16 20.054 -9.006 -18.344 1.00 35.35 H new ATOM 0 HG23 ILE A 16 18.716 -7.841 -18.197 1.00 35.35 H new ATOM 0 HD11 ILE A 16 19.358 -6.197 -13.661 1.00 40.33 H new ATOM 0 HD12 ILE A 16 19.358 -7.975 -13.586 1.00 40.33 H new ATOM 0 HD13 ILE A 16 20.798 -7.109 -14.172 1.00 40.33 H new ATOM 251 N ALA A 17 18.326 -11.163 -17.878 1.00 31.33 N ATOM 252 CA ALA A 17 18.660 -12.315 -18.707 1.00 11.14 C ATOM 253 C ALA A 17 18.959 -11.891 -20.141 1.00 0.25 C ATOM 254 O ALA A 17 18.167 -11.187 -20.769 1.00 2.34 O ATOM 255 CB ALA A 17 17.527 -13.331 -18.680 1.00 4.41 C ATOM 0 H ALA A 17 17.473 -10.677 -18.155 1.00 31.33 H new ATOM 0 HA ALA A 17 19.558 -12.778 -18.298 1.00 11.14 H new ATOM 0 HB1 ALA A 17 17.790 -14.186 -19.303 1.00 4.41 H new ATOM 0 HB2 ALA A 17 17.363 -13.666 -17.656 1.00 4.41 H new ATOM 0 HB3 ALA A 17 16.616 -12.870 -19.062 1.00 4.41 H new ATOM 261 N LEU A 18 20.106 -12.323 -20.653 1.00 50.40 N ATOM 262 CA LEU A 18 20.510 -11.987 -22.014 1.00 23.01 C ATOM 263 C LEU A 18 20.165 -13.117 -22.979 1.00 5.12 C ATOM 264 O LEU A 18 20.400 -14.290 -22.687 1.00 43.24 O ATOM 265 CB LEU A 18 22.012 -11.698 -22.064 1.00 73.44 C ATOM 266 CG LEU A 18 22.434 -10.479 -22.885 1.00 74.22 C ATOM 267 CD1 LEU A 18 22.054 -10.662 -24.346 1.00 61.35 C ATOM 268 CD2 LEU A 18 21.803 -9.214 -22.323 1.00 50.40 C ATOM 0 H LEU A 18 20.772 -12.906 -20.147 1.00 50.40 H new ATOM 0 HA LEU A 18 19.964 -11.094 -22.319 1.00 23.01 H new ATOM 0 HB2 LEU A 18 22.370 -11.565 -21.043 1.00 73.44 H new ATOM 0 HB3 LEU A 18 22.517 -12.575 -22.468 1.00 73.44 H new ATOM 0 HG LEU A 18 23.518 -10.380 -22.822 1.00 74.22 H new ATOM 0 HD11 LEU A 18 22.362 -9.785 -24.915 1.00 61.35 H new ATOM 0 HD12 LEU A 18 22.553 -11.546 -24.744 1.00 61.35 H new ATOM 0 HD13 LEU A 18 20.974 -10.787 -24.428 1.00 61.35 H new ATOM 0 HD21 LEU A 18 22.114 -8.356 -22.919 1.00 50.40 H new ATOM 0 HD22 LEU A 18 20.717 -9.304 -22.355 1.00 50.40 H new ATOM 0 HD23 LEU A 18 22.125 -9.074 -21.291 1.00 50.40 H new ATOM 280 N VAL A 19 19.609 -12.756 -24.130 1.00 54.55 N ATOM 281 CA VAL A 19 19.234 -13.738 -25.140 1.00 64.43 C ATOM 282 C VAL A 19 20.209 -13.720 -26.312 1.00 61.34 C ATOM 283 O VAL A 19 20.461 -12.674 -26.908 1.00 3.43 O ATOM 284 CB VAL A 19 17.809 -13.486 -25.668 1.00 24.31 C ATOM 285 CG1 VAL A 19 17.375 -14.613 -26.592 1.00 60.53 C ATOM 286 CG2 VAL A 19 16.834 -13.328 -24.512 1.00 32.15 C ATOM 0 H VAL A 19 19.408 -11.790 -24.387 1.00 54.55 H new ATOM 0 HA VAL A 19 19.267 -14.715 -24.658 1.00 64.43 H new ATOM 0 HB VAL A 19 17.811 -12.559 -26.241 1.00 24.31 H new ATOM 0 HG11 VAL A 19 16.366 -14.418 -26.955 1.00 60.53 H new ATOM 0 HG12 VAL A 19 18.060 -14.674 -27.438 1.00 60.53 H new ATOM 0 HG13 VAL A 19 17.388 -15.556 -26.046 1.00 60.53 H new ATOM 0 HG21 VAL A 19 15.832 -13.151 -24.903 1.00 32.15 H new ATOM 0 HG22 VAL A 19 16.833 -14.237 -23.910 1.00 32.15 H new ATOM 0 HG23 VAL A 19 17.137 -12.483 -23.893 1.00 32.15 H new ATOM 296 N GLY A 20 20.755 -14.888 -26.639 1.00 52.15 N ATOM 297 CA GLY A 20 21.696 -14.985 -27.740 1.00 11.41 C ATOM 298 C GLY A 20 23.047 -14.386 -27.402 1.00 20.44 C ATOM 299 O GLY A 20 23.635 -13.668 -28.209 1.00 60.04 O ATOM 0 H GLY A 20 20.562 -15.768 -26.161 1.00 52.15 H new ATOM 0 HA2 GLY A 20 21.824 -16.032 -28.013 1.00 11.41 H new ATOM 0 HA3 GLY A 20 21.284 -14.476 -28.612 1.00 11.41 H new ATOM 303 N ALA A 21 23.540 -14.682 -26.203 1.00 52.22 N ATOM 304 CA ALA A 21 24.830 -14.168 -25.760 1.00 60.31 C ATOM 305 C ALA A 21 25.977 -14.970 -26.365 1.00 22.51 C ATOM 306 O ALA A 21 26.356 -16.019 -25.844 1.00 22.41 O ATOM 307 CB ALA A 21 24.913 -14.189 -24.241 1.00 14.31 C ATOM 0 H ALA A 21 23.065 -15.275 -25.522 1.00 52.22 H new ATOM 0 HA ALA A 21 24.920 -13.138 -26.104 1.00 60.31 H new ATOM 0 HB1 ALA A 21 25.882 -13.802 -23.924 1.00 14.31 H new ATOM 0 HB2 ALA A 21 24.120 -13.567 -23.825 1.00 14.31 H new ATOM 0 HB3 ALA A 21 24.796 -15.212 -23.884 1.00 14.31 H new ATOM 313 N SER A 22 26.526 -14.471 -27.468 1.00 13.33 N ATOM 314 CA SER A 22 27.627 -15.144 -28.146 1.00 42.32 C ATOM 315 C SER A 22 28.942 -14.405 -27.912 1.00 74.34 C ATOM 316 O SER A 22 29.021 -13.506 -27.075 1.00 53.15 O ATOM 317 CB SER A 22 27.345 -15.244 -29.646 1.00 40.35 C ATOM 318 OG SER A 22 26.026 -15.702 -29.888 1.00 21.41 O ATOM 0 H SER A 22 26.226 -13.603 -27.911 1.00 13.33 H new ATOM 0 HA SER A 22 27.716 -16.149 -27.733 1.00 42.32 H new ATOM 0 HB2 SER A 22 27.486 -14.268 -30.111 1.00 40.35 H new ATOM 0 HB3 SER A 22 28.060 -15.924 -30.109 1.00 40.35 H new ATOM 0 HG SER A 22 25.870 -15.756 -30.854 1.00 21.41 H new ATOM 324 N ASP A 23 29.971 -14.792 -28.658 1.00 73.11 N ATOM 325 CA ASP A 23 31.282 -14.167 -28.534 1.00 64.11 C ATOM 326 C ASP A 23 31.454 -13.055 -29.564 1.00 61.23 C ATOM 327 O ASP A 23 32.496 -12.949 -30.212 1.00 0.03 O ATOM 328 CB ASP A 23 32.387 -15.212 -28.704 1.00 13.41 C ATOM 329 CG ASP A 23 32.295 -15.941 -30.030 1.00 32.13 C ATOM 330 OD1 ASP A 23 32.847 -15.431 -31.027 1.00 12.14 O ATOM 331 OD2 ASP A 23 31.670 -17.022 -30.071 1.00 11.15 O ATOM 0 H ASP A 23 29.922 -15.535 -29.355 1.00 73.11 H new ATOM 0 HA ASP A 23 31.356 -13.730 -27.538 1.00 64.11 H new ATOM 0 HB2 ASP A 23 33.359 -14.725 -28.627 1.00 13.41 H new ATOM 0 HB3 ASP A 23 32.328 -15.935 -27.890 1.00 13.41 H new ATOM 336 N LYS A 24 30.424 -12.229 -29.712 1.00 45.52 N ATOM 337 CA LYS A 24 30.460 -11.124 -30.663 1.00 50.13 C ATOM 338 C LYS A 24 30.532 -9.784 -29.938 1.00 45.23 C ATOM 339 O LYS A 24 29.523 -9.112 -29.722 1.00 65.15 O ATOM 340 CB LYS A 24 29.225 -11.161 -31.566 1.00 72.20 C ATOM 341 CG LYS A 24 29.320 -12.183 -32.686 1.00 22.25 C ATOM 342 CD LYS A 24 30.308 -11.748 -33.755 1.00 24.42 C ATOM 343 CE LYS A 24 30.283 -12.687 -34.952 1.00 4.44 C ATOM 344 NZ LYS A 24 31.617 -12.787 -35.606 1.00 4.12 N ATOM 0 H LYS A 24 29.554 -12.304 -29.185 1.00 45.52 H new ATOM 0 HA LYS A 24 31.355 -11.234 -31.276 1.00 50.13 H new ATOM 0 HB2 LYS A 24 28.347 -11.381 -30.958 1.00 72.20 H new ATOM 0 HB3 LYS A 24 29.073 -10.173 -31.999 1.00 72.20 H new ATOM 0 HG2 LYS A 24 29.626 -13.146 -32.276 1.00 22.25 H new ATOM 0 HG3 LYS A 24 28.337 -12.325 -33.134 1.00 22.25 H new ATOM 0 HD2 LYS A 24 30.071 -10.735 -34.081 1.00 24.42 H new ATOM 0 HD3 LYS A 24 31.313 -11.720 -33.334 1.00 24.42 H new ATOM 0 HE2 LYS A 24 29.961 -13.677 -34.630 1.00 4.44 H new ATOM 0 HE3 LYS A 24 29.549 -12.333 -35.676 1.00 4.44 H new ATOM 0 HZ1 LYS A 24 31.558 -13.436 -36.417 1.00 4.12 H new ATOM 0 HZ2 LYS A 24 31.913 -11.846 -35.936 1.00 4.12 H new ATOM 0 HZ3 LYS A 24 32.312 -13.149 -34.923 1.00 4.12 H new ATOM 358 N PRO A 25 31.754 -9.383 -29.554 1.00 35.32 N ATOM 359 CA PRO A 25 31.987 -8.119 -28.849 1.00 74.22 C ATOM 360 C PRO A 25 31.764 -6.906 -29.746 1.00 32.11 C ATOM 361 O PRO A 25 31.811 -5.765 -29.286 1.00 33.23 O ATOM 362 CB PRO A 25 33.456 -8.212 -28.431 1.00 20.13 C ATOM 363 CG PRO A 25 34.073 -9.143 -29.417 1.00 53.30 C ATOM 364 CD PRO A 25 33.001 -10.133 -29.778 1.00 33.51 C ATOM 0 HA PRO A 25 31.300 -7.985 -28.014 1.00 74.22 H new ATOM 0 HB2 PRO A 25 33.937 -7.234 -28.455 1.00 20.13 H new ATOM 0 HB3 PRO A 25 33.555 -8.591 -27.414 1.00 20.13 H new ATOM 0 HG2 PRO A 25 34.419 -8.604 -30.299 1.00 53.30 H new ATOM 0 HG3 PRO A 25 34.940 -9.646 -28.989 1.00 53.30 H new ATOM 0 HD2 PRO A 25 33.091 -10.463 -30.813 1.00 33.51 H new ATOM 0 HD3 PRO A 25 33.051 -11.025 -29.154 1.00 33.51 H new ATOM 372 N ASP A 26 31.521 -7.160 -31.027 1.00 50.10 N ATOM 373 CA ASP A 26 31.289 -6.088 -31.988 1.00 62.13 C ATOM 374 C ASP A 26 29.796 -5.878 -32.218 1.00 12.31 C ATOM 375 O ASP A 26 29.385 -5.348 -33.251 1.00 21.23 O ATOM 376 CB ASP A 26 31.982 -6.405 -33.314 1.00 41.25 C ATOM 377 CG ASP A 26 32.024 -5.209 -34.246 1.00 32.31 C ATOM 378 OD1 ASP A 26 32.236 -4.081 -33.754 1.00 50.22 O ATOM 379 OD2 ASP A 26 31.845 -5.402 -35.466 1.00 62.25 O ATOM 0 H ASP A 26 31.480 -8.099 -31.424 1.00 50.10 H new ATOM 0 HA ASP A 26 31.708 -5.169 -31.578 1.00 62.13 H new ATOM 0 HB2 ASP A 26 32.999 -6.744 -33.117 1.00 41.25 H new ATOM 0 HB3 ASP A 26 31.461 -7.227 -33.805 1.00 41.25 H new ATOM 384 N ARG A 27 28.988 -6.297 -31.249 1.00 45.11 N ATOM 385 CA ARG A 27 27.541 -6.157 -31.347 1.00 14.52 C ATOM 386 C ARG A 27 26.975 -5.474 -30.104 1.00 65.34 C ATOM 387 O ARG A 27 27.602 -5.441 -29.045 1.00 70.20 O ATOM 388 CB ARG A 27 26.885 -7.526 -31.532 1.00 64.41 C ATOM 389 CG ARG A 27 26.821 -7.980 -32.981 1.00 53.44 C ATOM 390 CD ARG A 27 26.280 -9.396 -33.099 1.00 31.04 C ATOM 391 NE ARG A 27 26.406 -9.919 -34.456 1.00 73.33 N ATOM 392 CZ ARG A 27 25.650 -9.517 -35.472 1.00 10.01 C ATOM 393 NH1 ARG A 27 24.720 -8.591 -35.284 1.00 74.13 N ATOM 394 NH2 ARG A 27 25.825 -10.041 -36.679 1.00 14.44 N ATOM 0 H ARG A 27 29.312 -6.736 -30.387 1.00 45.11 H new ATOM 0 HA ARG A 27 27.320 -5.536 -32.215 1.00 14.52 H new ATOM 0 HB2 ARG A 27 27.438 -8.266 -30.953 1.00 64.41 H new ATOM 0 HB3 ARG A 27 25.874 -7.493 -31.125 1.00 64.41 H new ATOM 0 HG2 ARG A 27 26.187 -7.299 -33.549 1.00 53.44 H new ATOM 0 HG3 ARG A 27 27.816 -7.932 -33.423 1.00 53.44 H new ATOM 0 HD2 ARG A 27 26.816 -10.047 -32.408 1.00 31.04 H new ATOM 0 HD3 ARG A 27 25.232 -9.409 -32.801 1.00 31.04 H new ATOM 0 HE ARG A 27 27.113 -10.632 -34.634 1.00 73.33 H new ATOM 0 HH11 ARG A 27 24.584 -8.186 -34.358 1.00 74.13 H new ATOM 0 HH12 ARG A 27 24.141 -8.284 -36.065 1.00 74.13 H new ATOM 0 HH21 ARG A 27 26.540 -10.753 -36.827 1.00 14.44 H new ATOM 0 HH22 ARG A 27 25.244 -9.732 -37.458 1.00 14.44 H new ATOM 408 N PRO A 28 25.763 -4.916 -30.235 1.00 50.04 N ATOM 409 CA PRO A 28 25.087 -4.224 -29.134 1.00 33.30 C ATOM 410 C PRO A 28 24.635 -5.183 -28.038 1.00 33.21 C ATOM 411 O PRO A 28 24.380 -4.772 -26.906 1.00 44.40 O ATOM 412 CB PRO A 28 23.876 -3.578 -29.811 1.00 50.54 C ATOM 413 CG PRO A 28 23.614 -4.425 -31.009 1.00 5.53 C ATOM 414 CD PRO A 28 24.959 -4.917 -31.469 1.00 35.42 C ATOM 0 HA PRO A 28 25.744 -3.512 -28.636 1.00 33.30 H new ATOM 0 HB2 PRO A 28 23.014 -3.558 -29.144 1.00 50.54 H new ATOM 0 HB3 PRO A 28 24.084 -2.546 -30.094 1.00 50.54 H new ATOM 0 HG2 PRO A 28 22.957 -5.259 -30.762 1.00 5.53 H new ATOM 0 HG3 PRO A 28 23.119 -3.851 -31.792 1.00 5.53 H new ATOM 0 HD2 PRO A 28 24.894 -5.914 -31.906 1.00 35.42 H new ATOM 0 HD3 PRO A 28 25.388 -4.263 -32.229 1.00 35.42 H new ATOM 422 N SER A 29 24.537 -6.464 -28.381 1.00 41.43 N ATOM 423 CA SER A 29 24.112 -7.481 -27.427 1.00 3.23 C ATOM 424 C SER A 29 25.226 -7.789 -26.430 1.00 73.53 C ATOM 425 O SER A 29 24.969 -8.260 -25.322 1.00 2.33 O ATOM 426 CB SER A 29 23.700 -8.759 -28.160 1.00 43.53 C ATOM 427 OG SER A 29 22.498 -8.565 -28.885 1.00 60.31 O ATOM 0 H SER A 29 24.746 -6.822 -29.313 1.00 41.43 H new ATOM 0 HA SER A 29 23.253 -7.093 -26.879 1.00 3.23 H new ATOM 0 HB2 SER A 29 24.494 -9.064 -28.841 1.00 43.53 H new ATOM 0 HB3 SER A 29 23.569 -9.568 -27.441 1.00 43.53 H new ATOM 0 HG SER A 29 22.256 -9.395 -29.346 1.00 60.31 H new ATOM 433 N TYR A 30 26.463 -7.521 -26.834 1.00 34.54 N ATOM 434 CA TYR A 30 27.617 -7.772 -25.978 1.00 74.44 C ATOM 435 C TYR A 30 27.916 -6.562 -25.099 1.00 23.20 C ATOM 436 O TYR A 30 28.095 -6.690 -23.888 1.00 33.14 O ATOM 437 CB TYR A 30 28.842 -8.116 -26.827 1.00 52.12 C ATOM 438 CG TYR A 30 29.846 -8.993 -26.114 1.00 2.52 C ATOM 439 CD1 TYR A 30 30.667 -8.475 -25.119 1.00 61.35 C ATOM 440 CD2 TYR A 30 29.973 -10.339 -26.434 1.00 4.22 C ATOM 441 CE1 TYR A 30 31.587 -9.272 -24.466 1.00 35.42 C ATOM 442 CE2 TYR A 30 30.889 -11.144 -25.784 1.00 41.13 C ATOM 443 CZ TYR A 30 31.694 -10.606 -24.802 1.00 13.05 C ATOM 444 OH TYR A 30 32.607 -11.404 -24.152 1.00 4.23 O ATOM 0 H TYR A 30 26.692 -7.130 -27.748 1.00 34.54 H new ATOM 0 HA TYR A 30 27.382 -8.618 -25.332 1.00 74.44 H new ATOM 0 HB2 TYR A 30 28.514 -8.619 -27.736 1.00 52.12 H new ATOM 0 HB3 TYR A 30 29.332 -7.192 -27.133 1.00 52.12 H new ATOM 0 HD1 TYR A 30 30.584 -7.432 -24.852 1.00 61.35 H new ATOM 0 HD2 TYR A 30 29.345 -10.763 -27.204 1.00 4.22 H new ATOM 0 HE1 TYR A 30 32.219 -8.853 -23.697 1.00 35.42 H new ATOM 0 HE2 TYR A 30 30.974 -12.189 -26.044 1.00 41.13 H new ATOM 0 HH TYR A 30 32.555 -12.316 -24.506 1.00 4.23 H new ATOM 454 N ARG A 31 27.969 -5.388 -25.718 1.00 44.44 N ATOM 455 CA ARG A 31 28.248 -4.154 -24.994 1.00 12.44 C ATOM 456 C ARG A 31 27.276 -3.975 -23.830 1.00 65.34 C ATOM 457 O ARG A 31 27.638 -3.439 -22.783 1.00 14.31 O ATOM 458 CB ARG A 31 28.158 -2.952 -25.936 1.00 75.02 C ATOM 459 CG ARG A 31 26.731 -2.539 -26.261 1.00 4.40 C ATOM 460 CD ARG A 31 26.696 -1.422 -27.293 1.00 24.12 C ATOM 461 NE ARG A 31 26.494 -0.114 -26.677 1.00 2.53 N ATOM 462 CZ ARG A 31 27.485 0.645 -26.221 1.00 52.32 C ATOM 463 NH1 ARG A 31 28.740 0.228 -26.313 1.00 11.03 N ATOM 464 NH2 ARG A 31 27.221 1.825 -25.673 1.00 73.42 N ATOM 0 H ARG A 31 27.822 -5.265 -26.720 1.00 44.44 H new ATOM 0 HA ARG A 31 29.260 -4.218 -24.594 1.00 12.44 H new ATOM 0 HB2 ARG A 31 28.678 -2.107 -25.484 1.00 75.02 H new ATOM 0 HB3 ARG A 31 28.679 -3.188 -26.864 1.00 75.02 H new ATOM 0 HG2 ARG A 31 26.178 -3.400 -26.636 1.00 4.40 H new ATOM 0 HG3 ARG A 31 26.230 -2.211 -25.351 1.00 4.40 H new ATOM 0 HD2 ARG A 31 27.630 -1.418 -27.854 1.00 24.12 H new ATOM 0 HD3 ARG A 31 25.896 -1.614 -28.008 1.00 24.12 H new ATOM 0 HE ARG A 31 25.540 0.237 -26.592 1.00 2.53 H new ATOM 0 HH11 ARG A 31 28.947 -0.677 -26.735 1.00 11.03 H new ATOM 0 HH12 ARG A 31 29.499 0.813 -25.962 1.00 11.03 H new ATOM 0 HH21 ARG A 31 26.257 2.150 -25.602 1.00 73.42 H new ATOM 0 HH22 ARG A 31 27.982 2.407 -25.323 1.00 73.42 H new ATOM 478 N VAL A 32 26.042 -4.429 -24.022 1.00 53.44 N ATOM 479 CA VAL A 32 25.018 -4.320 -22.990 1.00 2.13 C ATOM 480 C VAL A 32 25.216 -5.375 -21.907 1.00 74.02 C ATOM 481 O VAL A 32 24.888 -5.152 -20.742 1.00 73.32 O ATOM 482 CB VAL A 32 23.604 -4.467 -23.583 1.00 4.00 C ATOM 483 CG1 VAL A 32 23.305 -3.323 -24.540 1.00 11.14 C ATOM 484 CG2 VAL A 32 23.458 -5.810 -24.282 1.00 53.13 C ATOM 0 H VAL A 32 25.727 -4.876 -24.883 1.00 53.44 H new ATOM 0 HA VAL A 32 25.117 -3.328 -22.550 1.00 2.13 H new ATOM 0 HB VAL A 32 22.880 -4.426 -22.769 1.00 4.00 H new ATOM 0 HG11 VAL A 32 22.302 -3.444 -24.949 1.00 11.14 H new ATOM 0 HG12 VAL A 32 23.367 -2.375 -24.005 1.00 11.14 H new ATOM 0 HG13 VAL A 32 24.031 -3.329 -25.353 1.00 11.14 H new ATOM 0 HG21 VAL A 32 22.453 -5.898 -24.695 1.00 53.13 H new ATOM 0 HG22 VAL A 32 24.189 -5.883 -25.087 1.00 53.13 H new ATOM 0 HG23 VAL A 32 23.627 -6.614 -23.565 1.00 53.13 H new ATOM 494 N MET A 33 25.754 -6.525 -22.300 1.00 41.34 N ATOM 495 CA MET A 33 25.997 -7.615 -21.362 1.00 40.45 C ATOM 496 C MET A 33 27.050 -7.220 -20.332 1.00 21.42 C ATOM 497 O MET A 33 26.755 -7.098 -19.143 1.00 12.52 O ATOM 498 CB MET A 33 26.445 -8.871 -22.112 1.00 43.41 C ATOM 499 CG MET A 33 26.492 -10.115 -21.240 1.00 52.20 C ATOM 500 SD MET A 33 27.538 -11.410 -21.932 1.00 45.52 S ATOM 501 CE MET A 33 26.970 -11.432 -23.631 1.00 25.12 C ATOM 0 H MET A 33 26.030 -6.726 -23.261 1.00 41.34 H new ATOM 0 HA MET A 33 25.064 -7.827 -20.839 1.00 40.45 H new ATOM 0 HB2 MET A 33 25.766 -9.048 -22.946 1.00 43.41 H new ATOM 0 HB3 MET A 33 27.434 -8.697 -22.537 1.00 43.41 H new ATOM 0 HG2 MET A 33 26.861 -9.846 -20.250 1.00 52.20 H new ATOM 0 HG3 MET A 33 25.481 -10.501 -21.110 1.00 52.20 H new ATOM 0 HE1 MET A 33 27.391 -12.296 -24.144 1.00 25.12 H new ATOM 0 HE2 MET A 33 25.882 -11.493 -23.650 1.00 25.12 H new ATOM 0 HE3 MET A 33 27.291 -10.520 -24.134 1.00 25.12 H new ATOM 511 N LYS A 34 28.280 -7.024 -20.795 1.00 11.44 N ATOM 512 CA LYS A 34 29.378 -6.642 -19.914 1.00 35.22 C ATOM 513 C LYS A 34 29.058 -5.346 -19.175 1.00 74.45 C ATOM 514 O LYS A 34 29.603 -5.080 -18.104 1.00 34.41 O ATOM 515 CB LYS A 34 30.670 -6.478 -20.717 1.00 31.40 C ATOM 516 CG LYS A 34 31.928 -6.718 -19.900 1.00 70.15 C ATOM 517 CD LYS A 34 32.376 -5.456 -19.182 1.00 75.02 C ATOM 518 CE LYS A 34 33.881 -5.444 -18.962 1.00 55.24 C ATOM 519 NZ LYS A 34 34.628 -5.347 -20.247 1.00 31.12 N ATOM 0 H LYS A 34 28.542 -7.123 -21.776 1.00 11.44 H new ATOM 0 HA LYS A 34 29.513 -7.435 -19.178 1.00 35.22 H new ATOM 0 HB2 LYS A 34 30.655 -7.171 -21.558 1.00 31.40 H new ATOM 0 HB3 LYS A 34 30.704 -5.471 -21.134 1.00 31.40 H new ATOM 0 HG2 LYS A 34 31.744 -7.507 -19.171 1.00 70.15 H new ATOM 0 HG3 LYS A 34 32.726 -7.068 -20.554 1.00 70.15 H new ATOM 0 HD2 LYS A 34 32.086 -4.582 -19.765 1.00 75.02 H new ATOM 0 HD3 LYS A 34 31.866 -5.382 -18.221 1.00 75.02 H new ATOM 0 HE2 LYS A 34 34.148 -4.603 -18.322 1.00 55.24 H new ATOM 0 HE3 LYS A 34 34.179 -6.351 -18.436 1.00 55.24 H new ATOM 0 HZ1 LYS A 34 35.557 -4.911 -20.077 1.00 31.12 H new ATOM 0 HZ2 LYS A 34 34.760 -6.299 -20.645 1.00 31.12 H new ATOM 0 HZ3 LYS A 34 34.090 -4.763 -20.918 1.00 31.12 H new ATOM 533 N TYR A 35 28.171 -4.545 -19.754 1.00 54.22 N ATOM 534 CA TYR A 35 27.779 -3.276 -19.151 1.00 60.32 C ATOM 535 C TYR A 35 26.977 -3.505 -17.874 1.00 3.05 C ATOM 536 O TYR A 35 27.227 -2.870 -16.848 1.00 32.33 O ATOM 537 CB TYR A 35 26.957 -2.449 -20.141 1.00 60.22 C ATOM 538 CG TYR A 35 25.935 -1.553 -19.479 1.00 51.03 C ATOM 539 CD1 TYR A 35 26.330 -0.492 -18.674 1.00 52.33 C ATOM 540 CD2 TYR A 35 24.574 -1.767 -19.660 1.00 31.11 C ATOM 541 CE1 TYR A 35 25.399 0.329 -18.067 1.00 42.11 C ATOM 542 CE2 TYR A 35 23.636 -0.950 -19.058 1.00 22.52 C ATOM 543 CZ TYR A 35 24.054 0.096 -18.262 1.00 32.20 C ATOM 544 OH TYR A 35 23.124 0.912 -17.660 1.00 52.10 O ATOM 0 H TYR A 35 27.710 -4.751 -20.640 1.00 54.22 H new ATOM 0 HA TYR A 35 28.686 -2.728 -18.896 1.00 60.32 H new ATOM 0 HB2 TYR A 35 27.632 -1.836 -20.738 1.00 60.22 H new ATOM 0 HB3 TYR A 35 26.446 -3.123 -20.828 1.00 60.22 H new ATOM 0 HD1 TYR A 35 27.383 -0.306 -18.520 1.00 52.33 H new ATOM 0 HD2 TYR A 35 24.244 -2.586 -20.282 1.00 31.11 H new ATOM 0 HE1 TYR A 35 25.723 1.149 -17.443 1.00 42.11 H new ATOM 0 HE2 TYR A 35 22.582 -1.129 -19.210 1.00 22.52 H new ATOM 0 HH TYR A 35 22.313 0.945 -18.209 1.00 52.10 H new ATOM 554 N LEU A 36 26.013 -4.416 -17.943 1.00 64.41 N ATOM 555 CA LEU A 36 25.174 -4.731 -16.792 1.00 72.44 C ATOM 556 C LEU A 36 25.967 -5.485 -15.730 1.00 11.04 C ATOM 557 O LEU A 36 25.678 -5.384 -14.536 1.00 61.43 O ATOM 558 CB LEU A 36 23.967 -5.563 -17.229 1.00 54.05 C ATOM 559 CG LEU A 36 22.868 -4.809 -17.979 1.00 15.45 C ATOM 560 CD1 LEU A 36 21.798 -5.772 -18.469 1.00 13.13 C ATOM 561 CD2 LEU A 36 22.255 -3.736 -17.089 1.00 23.40 C ATOM 0 H LEU A 36 25.793 -4.950 -18.784 1.00 64.41 H new ATOM 0 HA LEU A 36 24.825 -3.793 -16.361 1.00 72.44 H new ATOM 0 HB2 LEU A 36 24.321 -6.375 -17.864 1.00 54.05 H new ATOM 0 HB3 LEU A 36 23.526 -6.021 -16.343 1.00 54.05 H new ATOM 0 HG LEU A 36 23.315 -4.323 -18.846 1.00 15.45 H new ATOM 0 HD11 LEU A 36 21.025 -5.217 -19.000 1.00 13.13 H new ATOM 0 HD12 LEU A 36 22.247 -6.503 -19.142 1.00 13.13 H new ATOM 0 HD13 LEU A 36 21.354 -6.287 -17.617 1.00 13.13 H new ATOM 0 HD21 LEU A 36 21.475 -3.209 -17.639 1.00 23.40 H new ATOM 0 HD22 LEU A 36 21.823 -4.201 -16.203 1.00 23.40 H new ATOM 0 HD23 LEU A 36 23.027 -3.028 -16.788 1.00 23.40 H new ATOM 573 N LEU A 37 26.969 -6.238 -16.170 1.00 33.13 N ATOM 574 CA LEU A 37 27.806 -7.008 -15.256 1.00 42.51 C ATOM 575 C LEU A 37 28.676 -6.086 -14.408 1.00 4.42 C ATOM 576 O LEU A 37 28.767 -6.248 -13.191 1.00 5.12 O ATOM 577 CB LEU A 37 28.688 -7.982 -16.039 1.00 50.22 C ATOM 578 CG LEU A 37 28.122 -9.388 -16.238 1.00 73.22 C ATOM 579 CD1 LEU A 37 29.072 -10.233 -17.073 1.00 54.10 C ATOM 580 CD2 LEU A 37 27.856 -10.051 -14.895 1.00 21.25 C ATOM 0 H LEU A 37 27.222 -6.332 -17.154 1.00 33.13 H new ATOM 0 HA LEU A 37 27.152 -7.573 -14.592 1.00 42.51 H new ATOM 0 HB2 LEU A 37 28.889 -7.551 -17.020 1.00 50.22 H new ATOM 0 HB3 LEU A 37 29.646 -8.067 -15.526 1.00 50.22 H new ATOM 0 HG LEU A 37 27.176 -9.305 -16.773 1.00 73.22 H new ATOM 0 HD11 LEU A 37 28.652 -11.230 -17.204 1.00 54.10 H new ATOM 0 HD12 LEU A 37 29.212 -9.767 -18.048 1.00 54.10 H new ATOM 0 HD13 LEU A 37 30.034 -10.308 -16.566 1.00 54.10 H new ATOM 0 HD21 LEU A 37 27.453 -11.051 -15.056 1.00 21.25 H new ATOM 0 HD22 LEU A 37 28.787 -10.121 -14.333 1.00 21.25 H new ATOM 0 HD23 LEU A 37 27.136 -9.457 -14.332 1.00 21.25 H new ATOM 592 N ASP A 38 29.312 -5.117 -15.058 1.00 61.31 N ATOM 593 CA ASP A 38 30.172 -4.167 -14.363 1.00 45.33 C ATOM 594 C ASP A 38 29.357 -3.277 -13.430 1.00 40.02 C ATOM 595 O ASP A 38 29.784 -2.974 -12.316 1.00 62.35 O ATOM 596 CB ASP A 38 30.936 -3.306 -15.371 1.00 53.21 C ATOM 597 CG ASP A 38 32.368 -3.766 -15.559 1.00 31.44 C ATOM 598 OD1 ASP A 38 32.654 -4.947 -15.270 1.00 24.33 O ATOM 599 OD2 ASP A 38 33.202 -2.946 -15.995 1.00 60.31 O ATOM 0 H ASP A 38 29.248 -4.969 -16.065 1.00 61.31 H new ATOM 0 HA ASP A 38 30.886 -4.732 -13.764 1.00 45.33 H new ATOM 0 HB2 ASP A 38 30.420 -3.332 -16.331 1.00 53.21 H new ATOM 0 HB3 ASP A 38 30.932 -2.269 -15.035 1.00 53.21 H new ATOM 604 N GLN A 39 28.183 -2.861 -13.894 1.00 32.24 N ATOM 605 CA GLN A 39 27.309 -2.005 -13.101 1.00 0.34 C ATOM 606 C GLN A 39 26.985 -2.652 -11.758 1.00 53.31 C ATOM 607 O GLN A 39 26.677 -1.965 -10.785 1.00 35.00 O ATOM 608 CB GLN A 39 26.017 -1.712 -13.865 1.00 15.25 C ATOM 609 CG GLN A 39 26.133 -0.546 -14.833 1.00 62.23 C ATOM 610 CD GLN A 39 26.567 0.737 -14.153 1.00 12.12 C ATOM 611 OE1 GLN A 39 26.011 1.127 -13.125 1.00 40.05 O ATOM 612 NE2 GLN A 39 27.565 1.402 -14.723 1.00 72.00 N ATOM 0 H GLN A 39 27.815 -3.103 -14.814 1.00 32.24 H new ATOM 0 HA GLN A 39 27.833 -1.067 -12.914 1.00 0.34 H new ATOM 0 HB2 GLN A 39 25.721 -2.604 -14.418 1.00 15.25 H new ATOM 0 HB3 GLN A 39 25.222 -1.502 -13.150 1.00 15.25 H new ATOM 0 HG2 GLN A 39 26.849 -0.798 -15.615 1.00 62.23 H new ATOM 0 HG3 GLN A 39 25.171 -0.387 -15.321 1.00 62.23 H new ATOM 0 HE21 GLN A 39 27.997 1.043 -15.574 1.00 72.00 H new ATOM 0 HE22 GLN A 39 27.900 2.272 -14.310 1.00 72.00 H new ATOM 621 N GLY A 40 27.056 -3.979 -11.714 1.00 0.35 N ATOM 622 CA GLY A 40 26.767 -4.696 -10.486 1.00 33.33 C ATOM 623 C GLY A 40 25.375 -5.297 -10.479 1.00 51.43 C ATOM 624 O GLY A 40 24.688 -5.277 -9.458 1.00 33.42 O ATOM 0 H GLY A 40 27.308 -4.570 -12.506 1.00 0.35 H new ATOM 0 HA2 GLY A 40 27.502 -5.489 -10.350 1.00 33.33 H new ATOM 0 HA3 GLY A 40 26.870 -4.017 -9.640 1.00 33.33 H new ATOM 628 N TYR A 41 24.957 -5.830 -11.622 1.00 1.31 N ATOM 629 CA TYR A 41 23.636 -6.435 -11.745 1.00 41.53 C ATOM 630 C TYR A 41 23.746 -7.915 -12.097 1.00 55.03 C ATOM 631 O TYR A 41 24.731 -8.353 -12.693 1.00 13.53 O ATOM 632 CB TYR A 41 22.815 -5.705 -12.810 1.00 44.01 C ATOM 633 CG TYR A 41 22.373 -4.321 -12.391 1.00 20.31 C ATOM 634 CD1 TYR A 41 23.239 -3.238 -12.478 1.00 54.33 C ATOM 635 CD2 TYR A 41 21.090 -4.097 -11.907 1.00 22.44 C ATOM 636 CE1 TYR A 41 22.839 -1.972 -12.096 1.00 1.31 C ATOM 637 CE2 TYR A 41 20.682 -2.835 -11.523 1.00 53.33 C ATOM 638 CZ TYR A 41 21.560 -1.775 -11.620 1.00 33.25 C ATOM 639 OH TYR A 41 21.157 -0.516 -11.237 1.00 60.13 O ATOM 0 H TYR A 41 25.514 -5.855 -12.476 1.00 1.31 H new ATOM 0 HA TYR A 41 23.132 -6.346 -10.783 1.00 41.53 H new ATOM 0 HB2 TYR A 41 23.406 -5.628 -13.723 1.00 44.01 H new ATOM 0 HB3 TYR A 41 21.935 -6.301 -13.050 1.00 44.01 H new ATOM 0 HD1 TYR A 41 24.242 -3.388 -12.850 1.00 54.33 H new ATOM 0 HD2 TYR A 41 20.400 -4.924 -11.830 1.00 22.44 H new ATOM 0 HE1 TYR A 41 23.525 -1.141 -12.170 1.00 1.31 H new ATOM 0 HE2 TYR A 41 19.681 -2.678 -11.149 1.00 53.33 H new ATOM 0 HH TYR A 41 20.228 -0.550 -10.927 1.00 60.13 H new ATOM 649 N HIS A 42 22.726 -8.682 -11.725 1.00 54.02 N ATOM 650 CA HIS A 42 22.705 -10.114 -12.002 1.00 50.11 C ATOM 651 C HIS A 42 22.452 -10.377 -13.483 1.00 61.25 C ATOM 652 O HIS A 42 21.329 -10.236 -13.967 1.00 14.13 O ATOM 653 CB HIS A 42 21.631 -10.802 -11.159 1.00 61.41 C ATOM 654 CG HIS A 42 22.133 -11.298 -9.838 1.00 1.21 C ATOM 655 ND1 HIS A 42 22.942 -10.547 -9.011 1.00 31.53 N ATOM 656 CD2 HIS A 42 21.935 -12.476 -9.201 1.00 2.53 C ATOM 657 CE1 HIS A 42 23.221 -11.243 -7.923 1.00 2.12 C ATOM 658 NE2 HIS A 42 22.622 -12.416 -8.013 1.00 71.41 N ATOM 0 H HIS A 42 21.903 -8.336 -11.231 1.00 54.02 H new ATOM 0 HA HIS A 42 23.680 -10.524 -11.740 1.00 50.11 H new ATOM 0 HB2 HIS A 42 20.812 -10.103 -10.988 1.00 61.41 H new ATOM 0 HB3 HIS A 42 21.222 -11.641 -11.721 1.00 61.41 H new ATOM 0 HD2 HIS A 42 21.347 -13.308 -9.560 1.00 2.53 H new ATOM 0 HE1 HIS A 42 23.835 -10.909 -7.100 1.00 2.12 H new ATOM 0 HE2 HIS A 42 22.663 -13.158 -7.314 1.00 71.41 H new ATOM 666 N VAL A 43 23.504 -10.760 -14.200 1.00 24.03 N ATOM 667 CA VAL A 43 23.396 -11.043 -15.626 1.00 24.31 C ATOM 668 C VAL A 43 23.346 -12.545 -15.886 1.00 14.34 C ATOM 669 O VAL A 43 24.179 -13.300 -15.385 1.00 3.13 O ATOM 670 CB VAL A 43 24.576 -10.437 -16.409 1.00 70.53 C ATOM 671 CG1 VAL A 43 24.414 -10.692 -17.900 1.00 51.12 C ATOM 672 CG2 VAL A 43 24.695 -8.948 -16.124 1.00 65.02 C ATOM 0 H VAL A 43 24.441 -10.881 -13.816 1.00 24.03 H new ATOM 0 HA VAL A 43 22.468 -10.586 -15.970 1.00 24.31 H new ATOM 0 HB VAL A 43 25.495 -10.921 -16.080 1.00 70.53 H new ATOM 0 HG11 VAL A 43 25.257 -10.257 -18.437 1.00 51.12 H new ATOM 0 HG12 VAL A 43 24.382 -11.766 -18.084 1.00 51.12 H new ATOM 0 HG13 VAL A 43 23.487 -10.236 -18.248 1.00 51.12 H new ATOM 0 HG21 VAL A 43 25.534 -8.536 -16.685 1.00 65.02 H new ATOM 0 HG22 VAL A 43 23.776 -8.445 -16.424 1.00 65.02 H new ATOM 0 HG23 VAL A 43 24.861 -8.794 -15.058 1.00 65.02 H new ATOM 682 N ILE A 44 22.363 -12.971 -16.672 1.00 12.42 N ATOM 683 CA ILE A 44 22.204 -14.382 -16.999 1.00 64.04 C ATOM 684 C ILE A 44 22.114 -14.589 -18.507 1.00 74.54 C ATOM 685 O ILE A 44 21.037 -14.802 -19.066 1.00 43.22 O ATOM 686 CB ILE A 44 20.949 -14.977 -16.334 1.00 63.02 C ATOM 687 CG1 ILE A 44 20.907 -14.605 -14.851 1.00 14.22 C ATOM 688 CG2 ILE A 44 20.924 -16.488 -16.508 1.00 31.33 C ATOM 689 CD1 ILE A 44 19.664 -15.094 -14.141 1.00 12.04 C ATOM 0 H ILE A 44 21.665 -12.359 -17.094 1.00 12.42 H new ATOM 0 HA ILE A 44 23.085 -14.896 -16.616 1.00 64.04 H new ATOM 0 HB ILE A 44 20.066 -14.561 -16.819 1.00 63.02 H new ATOM 0 HG12 ILE A 44 21.785 -15.019 -14.356 1.00 14.22 H new ATOM 0 HG13 ILE A 44 20.968 -13.521 -14.755 1.00 14.22 H new ATOM 0 HG21 ILE A 44 20.031 -16.894 -16.033 1.00 31.33 H new ATOM 0 HG22 ILE A 44 20.912 -16.732 -17.570 1.00 31.33 H new ATOM 0 HG23 ILE A 44 21.811 -16.922 -16.046 1.00 31.33 H new ATOM 0 HD11 ILE A 44 19.702 -14.795 -13.094 1.00 12.04 H new ATOM 0 HD12 ILE A 44 18.782 -14.660 -14.611 1.00 12.04 H new ATOM 0 HD13 ILE A 44 19.612 -16.181 -14.206 1.00 12.04 H new ATOM 701 N PRO A 45 23.270 -14.529 -19.184 1.00 4.33 N ATOM 702 CA PRO A 45 23.348 -14.710 -20.636 1.00 45.23 C ATOM 703 C PRO A 45 23.065 -16.148 -21.057 1.00 54.44 C ATOM 704 O PRO A 45 23.690 -17.085 -20.562 1.00 64.15 O ATOM 705 CB PRO A 45 24.795 -14.333 -20.963 1.00 45.45 C ATOM 706 CG PRO A 45 25.547 -14.585 -19.702 1.00 41.32 C ATOM 707 CD PRO A 45 24.591 -14.279 -18.582 1.00 61.24 C ATOM 0 HA PRO A 45 22.607 -14.108 -21.162 1.00 45.23 H new ATOM 0 HB2 PRO A 45 25.185 -14.935 -21.784 1.00 45.45 H new ATOM 0 HB3 PRO A 45 24.873 -13.290 -21.268 1.00 45.45 H new ATOM 0 HG2 PRO A 45 25.889 -15.619 -19.652 1.00 41.32 H new ATOM 0 HG3 PRO A 45 26.433 -13.953 -19.643 1.00 41.32 H new ATOM 0 HD2 PRO A 45 24.766 -14.919 -17.718 1.00 61.24 H new ATOM 0 HD3 PRO A 45 24.689 -13.249 -18.240 1.00 61.24 H new ATOM 715 N VAL A 46 22.117 -16.315 -21.975 1.00 2.33 N ATOM 716 CA VAL A 46 21.752 -17.639 -22.464 1.00 15.33 C ATOM 717 C VAL A 46 21.931 -17.735 -23.975 1.00 35.34 C ATOM 718 O VAL A 46 21.336 -16.967 -24.731 1.00 3.01 O ATOM 719 CB VAL A 46 20.294 -17.986 -22.107 1.00 52.23 C ATOM 720 CG1 VAL A 46 19.954 -19.397 -22.563 1.00 51.43 C ATOM 721 CG2 VAL A 46 20.059 -17.829 -20.612 1.00 45.15 C ATOM 0 H VAL A 46 21.589 -15.550 -22.394 1.00 2.33 H new ATOM 0 HA VAL A 46 22.417 -18.352 -21.977 1.00 15.33 H new ATOM 0 HB VAL A 46 19.636 -17.292 -22.630 1.00 52.23 H new ATOM 0 HG11 VAL A 46 18.920 -19.624 -22.302 1.00 51.43 H new ATOM 0 HG12 VAL A 46 20.081 -19.471 -23.643 1.00 51.43 H new ATOM 0 HG13 VAL A 46 20.617 -20.108 -22.071 1.00 51.43 H new ATOM 0 HG21 VAL A 46 19.024 -18.078 -20.378 1.00 45.15 H new ATOM 0 HG22 VAL A 46 20.725 -18.498 -20.067 1.00 45.15 H new ATOM 0 HG23 VAL A 46 20.259 -16.799 -20.318 1.00 45.15 H new ATOM 731 N SER A 47 22.753 -18.685 -24.408 1.00 43.00 N ATOM 732 CA SER A 47 23.014 -18.881 -25.829 1.00 53.44 C ATOM 733 C SER A 47 23.244 -20.356 -26.142 1.00 32.25 C ATOM 734 O SER A 47 23.674 -21.137 -25.292 1.00 41.14 O ATOM 735 CB SER A 47 24.229 -18.060 -26.264 1.00 65.14 C ATOM 736 OG SER A 47 25.016 -18.772 -27.204 1.00 33.30 O ATOM 0 H SER A 47 23.250 -19.331 -23.795 1.00 43.00 H new ATOM 0 HA SER A 47 22.138 -18.543 -26.383 1.00 53.44 H new ATOM 0 HB2 SER A 47 23.898 -17.118 -26.702 1.00 65.14 H new ATOM 0 HB3 SER A 47 24.834 -17.811 -25.393 1.00 65.14 H new ATOM 0 HG SER A 47 25.786 -18.225 -27.467 1.00 33.30 H new ATOM 742 N PRO A 48 22.950 -20.749 -27.390 1.00 42.30 N ATOM 743 CA PRO A 48 23.117 -22.132 -27.845 1.00 21.33 C ATOM 744 C PRO A 48 24.584 -22.532 -27.959 1.00 42.11 C ATOM 745 O PRO A 48 24.905 -23.701 -28.175 1.00 3.22 O ATOM 746 CB PRO A 48 22.453 -22.135 -29.224 1.00 20.01 C ATOM 747 CG PRO A 48 22.541 -20.723 -29.689 1.00 41.45 C ATOM 748 CD PRO A 48 22.433 -19.872 -28.454 1.00 43.12 C ATOM 0 HA PRO A 48 22.682 -22.846 -27.146 1.00 21.33 H new ATOM 0 HB2 PRO A 48 22.966 -22.810 -29.909 1.00 20.01 H new ATOM 0 HB3 PRO A 48 21.417 -22.468 -29.164 1.00 20.01 H new ATOM 0 HG2 PRO A 48 23.483 -20.541 -30.207 1.00 41.45 H new ATOM 0 HG3 PRO A 48 21.741 -20.493 -30.392 1.00 41.45 H new ATOM 0 HD2 PRO A 48 23.021 -18.958 -28.543 1.00 43.12 H new ATOM 0 HD3 PRO A 48 21.403 -19.571 -28.262 1.00 43.12 H new ATOM 756 N LYS A 49 25.472 -21.554 -27.813 1.00 60.20 N ATOM 757 CA LYS A 49 26.906 -21.803 -27.898 1.00 62.30 C ATOM 758 C LYS A 49 27.541 -21.806 -26.511 1.00 61.11 C ATOM 759 O LYS A 49 28.506 -22.528 -26.260 1.00 71.45 O ATOM 760 CB LYS A 49 27.577 -20.745 -28.776 1.00 4.52 C ATOM 761 CG LYS A 49 28.764 -21.271 -29.564 1.00 61.20 C ATOM 762 CD LYS A 49 29.493 -20.152 -30.289 1.00 74.34 C ATOM 763 CE LYS A 49 30.520 -20.699 -31.268 1.00 63.13 C ATOM 764 NZ LYS A 49 29.877 -21.317 -32.461 1.00 33.14 N ATOM 0 H LYS A 49 25.223 -20.581 -27.635 1.00 60.20 H new ATOM 0 HA LYS A 49 27.053 -22.785 -28.347 1.00 62.30 H new ATOM 0 HB2 LYS A 49 26.840 -20.342 -29.471 1.00 4.52 H new ATOM 0 HB3 LYS A 49 27.907 -19.919 -28.146 1.00 4.52 H new ATOM 0 HG2 LYS A 49 29.454 -21.778 -28.889 1.00 61.20 H new ATOM 0 HG3 LYS A 49 28.422 -22.012 -30.287 1.00 61.20 H new ATOM 0 HD2 LYS A 49 28.772 -19.533 -30.824 1.00 74.34 H new ATOM 0 HD3 LYS A 49 29.988 -19.508 -29.562 1.00 74.34 H new ATOM 0 HE2 LYS A 49 31.181 -19.894 -31.588 1.00 63.13 H new ATOM 0 HE3 LYS A 49 31.141 -21.440 -30.766 1.00 63.13 H new ATOM 0 HZ1 LYS A 49 30.596 -21.493 -33.191 1.00 33.14 H new ATOM 0 HZ2 LYS A 49 29.433 -22.217 -32.189 1.00 33.14 H new ATOM 0 HZ3 LYS A 49 29.152 -20.673 -32.837 1.00 33.14 H new ATOM 778 N VAL A 50 26.993 -20.995 -25.612 1.00 55.44 N ATOM 779 CA VAL A 50 27.504 -20.906 -24.250 1.00 12.41 C ATOM 780 C VAL A 50 26.916 -22.003 -23.370 1.00 24.22 C ATOM 781 O VAL A 50 27.201 -22.073 -22.175 1.00 21.34 O ATOM 782 CB VAL A 50 27.190 -19.535 -23.621 1.00 34.21 C ATOM 783 CG1 VAL A 50 27.704 -18.410 -24.506 1.00 61.53 C ATOM 784 CG2 VAL A 50 25.695 -19.392 -23.377 1.00 11.50 C ATOM 0 H VAL A 50 26.194 -20.390 -25.803 1.00 55.44 H new ATOM 0 HA VAL A 50 28.585 -21.031 -24.309 1.00 12.41 H new ATOM 0 HB VAL A 50 27.700 -19.470 -22.660 1.00 34.21 H new ATOM 0 HG11 VAL A 50 27.473 -17.450 -24.045 1.00 61.53 H new ATOM 0 HG12 VAL A 50 28.783 -18.505 -24.625 1.00 61.53 H new ATOM 0 HG13 VAL A 50 27.225 -18.468 -25.483 1.00 61.53 H new ATOM 0 HG21 VAL A 50 25.490 -18.418 -22.932 1.00 11.50 H new ATOM 0 HG22 VAL A 50 25.162 -19.478 -24.324 1.00 11.50 H new ATOM 0 HG23 VAL A 50 25.360 -20.178 -22.700 1.00 11.50 H new ATOM 794 N ALA A 51 26.095 -22.859 -23.970 1.00 3.15 N ATOM 795 CA ALA A 51 25.469 -23.955 -23.241 1.00 25.31 C ATOM 796 C ALA A 51 26.518 -24.847 -22.584 1.00 13.34 C ATOM 797 O ALA A 51 27.112 -25.706 -23.233 1.00 52.14 O ATOM 798 CB ALA A 51 24.588 -24.773 -24.173 1.00 71.21 C ATOM 0 H ALA A 51 25.848 -22.814 -24.959 1.00 3.15 H new ATOM 0 HA ALA A 51 24.848 -23.527 -22.454 1.00 25.31 H new ATOM 0 HB1 ALA A 51 24.127 -25.588 -23.615 1.00 71.21 H new ATOM 0 HB2 ALA A 51 23.810 -24.134 -24.592 1.00 71.21 H new ATOM 0 HB3 ALA A 51 25.195 -25.183 -24.980 1.00 71.21 H new ATOM 804 N GLY A 52 26.740 -24.635 -21.290 1.00 25.52 N ATOM 805 CA GLY A 52 27.718 -25.427 -20.567 1.00 22.25 C ATOM 806 C GLY A 52 29.075 -24.755 -20.501 1.00 0.41 C ATOM 807 O GLY A 52 30.088 -25.406 -20.245 1.00 70.03 O ATOM 0 H GLY A 52 26.261 -23.930 -20.730 1.00 25.52 H new ATOM 0 HA2 GLY A 52 27.357 -25.609 -19.555 1.00 22.25 H new ATOM 0 HA3 GLY A 52 27.821 -26.399 -21.048 1.00 22.25 H new ATOM 811 N LYS A 53 29.097 -23.447 -20.734 1.00 40.30 N ATOM 812 CA LYS A 53 30.339 -22.684 -20.701 1.00 3.11 C ATOM 813 C LYS A 53 30.215 -21.481 -19.771 1.00 32.42 C ATOM 814 O LYS A 53 29.152 -21.231 -19.200 1.00 63.43 O ATOM 815 CB LYS A 53 30.712 -22.216 -22.109 1.00 62.15 C ATOM 816 CG LYS A 53 31.035 -23.354 -23.063 1.00 15.22 C ATOM 817 CD LYS A 53 32.520 -23.416 -23.374 1.00 64.42 C ATOM 818 CE LYS A 53 32.936 -22.311 -24.332 1.00 42.24 C ATOM 819 NZ LYS A 53 32.994 -22.790 -25.741 1.00 70.31 N ATOM 0 H LYS A 53 28.268 -22.893 -20.948 1.00 40.30 H new ATOM 0 HA LYS A 53 31.126 -23.336 -20.321 1.00 3.11 H new ATOM 0 HB2 LYS A 53 29.888 -21.632 -22.519 1.00 62.15 H new ATOM 0 HB3 LYS A 53 31.573 -21.551 -22.045 1.00 62.15 H new ATOM 0 HG2 LYS A 53 30.714 -24.299 -22.625 1.00 15.22 H new ATOM 0 HG3 LYS A 53 30.474 -23.225 -23.988 1.00 15.22 H new ATOM 0 HD2 LYS A 53 33.090 -23.331 -22.449 1.00 64.42 H new ATOM 0 HD3 LYS A 53 32.761 -24.386 -23.809 1.00 64.42 H new ATOM 0 HE2 LYS A 53 32.231 -21.483 -24.259 1.00 42.24 H new ATOM 0 HE3 LYS A 53 33.913 -21.925 -24.039 1.00 42.24 H new ATOM 0 HZ1 LYS A 53 33.281 -22.007 -26.362 1.00 70.31 H new ATOM 0 HZ2 LYS A 53 33.685 -23.563 -25.817 1.00 70.31 H new ATOM 0 HZ3 LYS A 53 32.056 -23.135 -26.029 1.00 70.31 H new ATOM 833 N THR A 54 31.307 -20.738 -19.623 1.00 12.23 N ATOM 834 CA THR A 54 31.320 -19.561 -18.762 1.00 74.44 C ATOM 835 C THR A 54 31.556 -18.291 -19.571 1.00 64.23 C ATOM 836 O THR A 54 32.577 -18.155 -20.248 1.00 12.23 O ATOM 837 CB THR A 54 32.404 -19.673 -17.674 1.00 70.12 C ATOM 838 OG1 THR A 54 33.415 -20.601 -18.083 1.00 50.13 O ATOM 839 CG2 THR A 54 31.800 -20.124 -16.353 1.00 10.44 C ATOM 0 H THR A 54 32.194 -20.930 -20.088 1.00 12.23 H new ATOM 0 HA THR A 54 30.342 -19.507 -18.285 1.00 74.44 H new ATOM 0 HB THR A 54 32.850 -18.688 -17.534 1.00 70.12 H new ATOM 0 HG1 THR A 54 34.101 -20.665 -17.386 1.00 50.13 H new ATOM 0 HG21 THR A 54 32.585 -20.196 -15.600 1.00 10.44 H new ATOM 0 HG22 THR A 54 31.052 -19.401 -16.029 1.00 10.44 H new ATOM 0 HG23 THR A 54 31.330 -21.099 -16.482 1.00 10.44 H new ATOM 847 N LEU A 55 30.609 -17.363 -19.497 1.00 72.24 N ATOM 848 CA LEU A 55 30.715 -16.102 -20.223 1.00 31.01 C ATOM 849 C LEU A 55 30.902 -14.934 -19.260 1.00 14.11 C ATOM 850 O LEU A 55 29.960 -14.515 -18.586 1.00 11.54 O ATOM 851 CB LEU A 55 29.468 -15.877 -21.079 1.00 74.24 C ATOM 852 CG LEU A 55 29.676 -15.923 -22.594 1.00 10.04 C ATOM 853 CD1 LEU A 55 30.443 -14.697 -23.064 1.00 64.20 C ATOM 854 CD2 LEU A 55 30.406 -17.197 -22.993 1.00 73.12 C ATOM 0 H LEU A 55 29.759 -17.460 -18.942 1.00 72.24 H new ATOM 0 HA LEU A 55 31.589 -16.157 -20.873 1.00 31.01 H new ATOM 0 HB2 LEU A 55 28.727 -16.630 -20.811 1.00 74.24 H new ATOM 0 HB3 LEU A 55 29.044 -14.907 -20.820 1.00 74.24 H new ATOM 0 HG LEU A 55 28.699 -15.922 -23.077 1.00 10.04 H new ATOM 0 HD11 LEU A 55 30.582 -14.747 -24.144 1.00 64.20 H new ATOM 0 HD12 LEU A 55 29.882 -13.798 -22.811 1.00 64.20 H new ATOM 0 HD13 LEU A 55 31.416 -14.667 -22.574 1.00 64.20 H new ATOM 0 HD21 LEU A 55 30.545 -17.213 -24.074 1.00 73.12 H new ATOM 0 HD22 LEU A 55 31.378 -17.228 -22.501 1.00 73.12 H new ATOM 0 HD23 LEU A 55 29.818 -18.063 -22.690 1.00 73.12 H new ATOM 866 N LEU A 56 32.121 -14.411 -19.202 1.00 24.22 N ATOM 867 CA LEU A 56 32.432 -13.289 -18.323 1.00 31.01 C ATOM 868 C LEU A 56 32.171 -13.651 -16.864 1.00 62.34 C ATOM 869 O LEU A 56 31.909 -12.781 -16.035 1.00 75.13 O ATOM 870 CB LEU A 56 31.601 -12.065 -18.713 1.00 31.33 C ATOM 871 CG LEU A 56 31.731 -11.600 -20.164 1.00 32.24 C ATOM 872 CD1 LEU A 56 30.933 -10.326 -20.389 1.00 14.50 C ATOM 873 CD2 LEU A 56 33.193 -11.387 -20.526 1.00 62.24 C ATOM 0 H LEU A 56 32.911 -14.746 -19.753 1.00 24.22 H new ATOM 0 HA LEU A 56 33.490 -13.054 -18.436 1.00 31.01 H new ATOM 0 HB2 LEU A 56 30.552 -12.285 -18.516 1.00 31.33 H new ATOM 0 HB3 LEU A 56 31.881 -11.238 -18.061 1.00 31.33 H new ATOM 0 HG LEU A 56 31.326 -12.377 -20.813 1.00 32.24 H new ATOM 0 HD11 LEU A 56 31.037 -10.010 -21.427 1.00 14.50 H new ATOM 0 HD12 LEU A 56 29.881 -10.512 -20.170 1.00 14.50 H new ATOM 0 HD13 LEU A 56 31.307 -9.541 -19.731 1.00 14.50 H new ATOM 0 HD21 LEU A 56 33.267 -11.056 -21.562 1.00 62.24 H new ATOM 0 HD22 LEU A 56 33.623 -10.629 -19.872 1.00 62.24 H new ATOM 0 HD23 LEU A 56 33.738 -12.323 -20.404 1.00 62.24 H new ATOM 885 N GLY A 57 32.248 -14.943 -16.558 1.00 12.12 N ATOM 886 CA GLY A 57 32.020 -15.397 -15.199 1.00 34.54 C ATOM 887 C GLY A 57 30.593 -15.858 -14.973 1.00 62.20 C ATOM 888 O GLY A 57 30.280 -16.440 -13.935 1.00 72.52 O ATOM 0 H GLY A 57 32.464 -15.682 -17.227 1.00 12.12 H new ATOM 0 HA2 GLY A 57 32.703 -16.216 -14.973 1.00 34.54 H new ATOM 0 HA3 GLY A 57 32.252 -14.589 -14.506 1.00 34.54 H new ATOM 892 N GLN A 58 29.727 -15.595 -15.946 1.00 63.55 N ATOM 893 CA GLN A 58 28.326 -15.985 -15.847 1.00 72.53 C ATOM 894 C GLN A 58 28.086 -17.331 -16.524 1.00 21.34 C ATOM 895 O GLN A 58 28.515 -17.552 -17.656 1.00 11.12 O ATOM 896 CB GLN A 58 27.431 -14.917 -16.479 1.00 24.40 C ATOM 897 CG GLN A 58 27.681 -13.518 -15.940 1.00 63.11 C ATOM 898 CD GLN A 58 27.866 -13.497 -14.436 1.00 3.54 C ATOM 899 OE1 GLN A 58 29.116 -13.413 -13.994 1.00 40.45 O flip ATOM 900 NE2 GLN A 58 26.897 -13.555 -13.678 1.00 13.23 N flip ATOM 0 H GLN A 58 29.971 -15.114 -16.812 1.00 63.55 H new ATOM 0 HA GLN A 58 28.076 -16.080 -14.790 1.00 72.53 H new ATOM 0 HB2 GLN A 58 27.588 -14.915 -17.558 1.00 24.40 H new ATOM 0 HB3 GLN A 58 26.387 -15.182 -16.309 1.00 24.40 H new ATOM 0 HG2 GLN A 58 28.568 -13.102 -16.417 1.00 63.11 H new ATOM 0 HG3 GLN A 58 26.843 -12.874 -16.208 1.00 63.11 H new ATOM 0 HE21 GLN A 58 25.954 -13.619 -14.060 1.00 13.23 H new ATOM 0 HE22 GLN A 58 27.038 -13.539 -12.668 1.00 13.23 H new ATOM 909 N GLN A 59 27.399 -18.227 -15.822 1.00 1.34 N ATOM 910 CA GLN A 59 27.104 -19.551 -16.355 1.00 31.33 C ATOM 911 C GLN A 59 26.279 -19.452 -17.634 1.00 0.13 C ATOM 912 O GLN A 59 25.329 -18.675 -17.712 1.00 54.25 O ATOM 913 CB GLN A 59 26.356 -20.388 -15.315 1.00 52.41 C ATOM 914 CG GLN A 59 26.315 -21.872 -15.643 1.00 4.54 C ATOM 915 CD GLN A 59 27.659 -22.548 -15.454 1.00 42.43 C ATOM 916 OE1 GLN A 59 27.980 -23.024 -14.365 1.00 44.51 O ATOM 917 NE2 GLN A 59 28.453 -22.594 -16.518 1.00 2.43 N ATOM 0 H GLN A 59 27.037 -18.060 -14.883 1.00 1.34 H new ATOM 0 HA GLN A 59 28.050 -20.038 -16.591 1.00 31.33 H new ATOM 0 HB2 GLN A 59 26.830 -20.252 -14.343 1.00 52.41 H new ATOM 0 HB3 GLN A 59 25.335 -20.016 -15.227 1.00 52.41 H new ATOM 0 HG2 GLN A 59 25.575 -22.360 -15.009 1.00 4.54 H new ATOM 0 HG3 GLN A 59 25.988 -22.004 -16.674 1.00 4.54 H new ATOM 0 HE21 GLN A 59 28.146 -22.187 -17.401 1.00 2.43 H new ATOM 0 HE22 GLN A 59 29.369 -23.037 -16.452 1.00 2.43 H new ATOM 926 N GLY A 60 26.650 -20.245 -18.635 1.00 0.33 N ATOM 927 CA GLY A 60 25.934 -20.230 -19.897 1.00 42.00 C ATOM 928 C GLY A 60 24.852 -21.290 -19.962 1.00 42.53 C ATOM 929 O GLY A 60 24.892 -22.274 -19.223 1.00 52.44 O ATOM 0 H GLY A 60 27.433 -20.897 -18.594 1.00 0.33 H new ATOM 0 HA2 GLY A 60 25.485 -19.248 -20.045 1.00 42.00 H new ATOM 0 HA3 GLY A 60 26.639 -20.385 -20.713 1.00 42.00 H new ATOM 933 N TYR A 61 23.882 -21.088 -20.847 1.00 62.33 N ATOM 934 CA TYR A 61 22.782 -22.032 -21.003 1.00 60.33 C ATOM 935 C TYR A 61 22.305 -22.079 -22.452 1.00 3.22 C ATOM 936 O TYR A 61 22.251 -21.055 -23.132 1.00 43.13 O ATOM 937 CB TYR A 61 21.620 -21.650 -20.084 1.00 64.43 C ATOM 938 CG TYR A 61 21.785 -22.143 -18.664 1.00 54.22 C ATOM 939 CD1 TYR A 61 21.416 -23.434 -18.309 1.00 24.52 C ATOM 940 CD2 TYR A 61 22.309 -21.316 -17.678 1.00 20.30 C ATOM 941 CE1 TYR A 61 21.564 -23.888 -17.012 1.00 70.14 C ATOM 942 CE2 TYR A 61 22.462 -21.762 -16.379 1.00 54.02 C ATOM 943 CZ TYR A 61 22.087 -23.048 -16.051 1.00 62.33 C ATOM 944 OH TYR A 61 22.237 -23.497 -14.759 1.00 41.11 O ATOM 0 H TYR A 61 23.835 -20.279 -21.467 1.00 62.33 H new ATOM 0 HA TYR A 61 23.145 -23.022 -20.727 1.00 60.33 H new ATOM 0 HB2 TYR A 61 21.517 -20.565 -20.074 1.00 64.43 H new ATOM 0 HB3 TYR A 61 20.695 -22.054 -20.495 1.00 64.43 H new ATOM 0 HD1 TYR A 61 21.006 -24.094 -19.059 1.00 24.52 H new ATOM 0 HD2 TYR A 61 22.602 -20.308 -17.931 1.00 20.30 H new ATOM 0 HE1 TYR A 61 21.272 -24.895 -16.752 1.00 70.14 H new ATOM 0 HE2 TYR A 61 22.873 -21.107 -15.625 1.00 54.02 H new ATOM 0 HH TYR A 61 22.620 -22.783 -14.207 1.00 41.11 H new ATOM 954 N ALA A 62 21.960 -23.275 -22.916 1.00 32.20 N ATOM 955 CA ALA A 62 21.485 -23.457 -24.282 1.00 52.40 C ATOM 956 C ALA A 62 20.116 -22.813 -24.477 1.00 62.03 C ATOM 957 O ALA A 62 19.795 -22.328 -25.563 1.00 60.50 O ATOM 958 CB ALA A 62 21.428 -24.937 -24.629 1.00 44.10 C ATOM 0 H ALA A 62 22.001 -24.133 -22.366 1.00 32.20 H new ATOM 0 HA ALA A 62 22.189 -22.965 -24.953 1.00 52.40 H new ATOM 0 HB1 ALA A 62 21.072 -25.057 -25.652 1.00 44.10 H new ATOM 0 HB2 ALA A 62 22.424 -25.371 -24.538 1.00 44.10 H new ATOM 0 HB3 ALA A 62 20.748 -25.445 -23.946 1.00 44.10 H new ATOM 964 N THR A 63 19.311 -22.812 -23.419 1.00 44.31 N ATOM 965 CA THR A 63 17.976 -22.229 -23.475 1.00 25.52 C ATOM 966 C THR A 63 17.567 -21.662 -22.120 1.00 71.54 C ATOM 967 O THR A 63 18.052 -22.105 -21.078 1.00 44.42 O ATOM 968 CB THR A 63 16.929 -23.267 -23.922 1.00 44.11 C ATOM 969 OG1 THR A 63 16.803 -24.294 -22.932 1.00 40.31 O ATOM 970 CG2 THR A 63 17.317 -23.887 -25.256 1.00 43.42 C ATOM 0 H THR A 63 19.560 -23.208 -22.513 1.00 44.31 H new ATOM 0 HA THR A 63 18.013 -21.422 -24.207 1.00 25.52 H new ATOM 0 HB THR A 63 15.973 -22.758 -24.040 1.00 44.11 H new ATOM 0 HG1 THR A 63 16.134 -24.949 -23.223 1.00 40.31 H new ATOM 0 HG21 THR A 63 16.563 -24.617 -25.551 1.00 43.42 H new ATOM 0 HG22 THR A 63 17.383 -23.107 -26.014 1.00 43.42 H new ATOM 0 HG23 THR A 63 18.283 -24.382 -25.160 1.00 43.42 H new ATOM 978 N LEU A 64 16.671 -20.682 -22.141 1.00 71.13 N ATOM 979 CA LEU A 64 16.195 -20.054 -20.913 1.00 73.45 C ATOM 980 C LEU A 64 15.426 -21.053 -20.054 1.00 23.00 C ATOM 981 O LEU A 64 15.189 -20.815 -18.870 1.00 40.32 O ATOM 982 CB LEU A 64 15.303 -18.856 -21.243 1.00 4.43 C ATOM 983 CG LEU A 64 14.138 -19.127 -22.195 1.00 1.03 C ATOM 984 CD1 LEU A 64 12.846 -18.555 -21.633 1.00 53.02 C ATOM 985 CD2 LEU A 64 14.427 -18.546 -23.571 1.00 2.40 C ATOM 0 H LEU A 64 16.259 -20.305 -22.995 1.00 71.13 H new ATOM 0 HA LEU A 64 17.062 -19.710 -20.350 1.00 73.45 H new ATOM 0 HB2 LEU A 64 14.899 -18.462 -20.310 1.00 4.43 H new ATOM 0 HB3 LEU A 64 15.926 -18.074 -21.677 1.00 4.43 H new ATOM 0 HG LEU A 64 14.020 -20.206 -22.296 1.00 1.03 H new ATOM 0 HD11 LEU A 64 12.028 -18.757 -22.324 1.00 53.02 H new ATOM 0 HD12 LEU A 64 12.631 -19.019 -20.670 1.00 53.02 H new ATOM 0 HD13 LEU A 64 12.952 -17.478 -21.501 1.00 53.02 H new ATOM 0 HD21 LEU A 64 13.587 -18.749 -24.235 1.00 2.40 H new ATOM 0 HD22 LEU A 64 14.572 -17.469 -23.488 1.00 2.40 H new ATOM 0 HD23 LEU A 64 15.329 -19.004 -23.977 1.00 2.40 H new ATOM 997 N ALA A 65 15.042 -22.173 -20.658 1.00 11.23 N ATOM 998 CA ALA A 65 14.304 -23.210 -19.947 1.00 3.43 C ATOM 999 C ALA A 65 15.252 -24.239 -19.340 1.00 34.12 C ATOM 1000 O ALA A 65 14.821 -25.295 -18.876 1.00 22.21 O ATOM 1001 CB ALA A 65 13.313 -23.888 -20.881 1.00 44.33 C ATOM 0 H ALA A 65 15.230 -22.385 -21.638 1.00 11.23 H new ATOM 0 HA ALA A 65 13.753 -22.737 -19.134 1.00 3.43 H new ATOM 0 HB1 ALA A 65 12.769 -24.660 -20.336 1.00 44.33 H new ATOM 0 HB2 ALA A 65 12.609 -23.149 -21.263 1.00 44.33 H new ATOM 0 HB3 ALA A 65 13.850 -24.342 -21.714 1.00 44.33 H new ATOM 1007 N ASP A 66 16.542 -23.925 -19.347 1.00 3.10 N ATOM 1008 CA ASP A 66 17.551 -24.823 -18.797 1.00 12.04 C ATOM 1009 C ASP A 66 18.157 -24.244 -17.522 1.00 50.32 C ATOM 1010 O ASP A 66 18.721 -24.971 -16.704 1.00 41.44 O ATOM 1011 CB ASP A 66 18.651 -25.082 -19.827 1.00 72.03 C ATOM 1012 CG ASP A 66 19.608 -26.174 -19.391 1.00 13.12 C ATOM 1013 OD1 ASP A 66 19.222 -26.992 -18.529 1.00 41.31 O ATOM 1014 OD2 ASP A 66 20.742 -26.211 -19.912 1.00 30.15 O ATOM 0 H ASP A 66 16.914 -23.055 -19.728 1.00 3.10 H new ATOM 0 HA ASP A 66 17.065 -25.767 -18.551 1.00 12.04 H new ATOM 0 HB2 ASP A 66 18.196 -25.360 -20.778 1.00 72.03 H new ATOM 0 HB3 ASP A 66 19.209 -24.161 -19.998 1.00 72.03 H new ATOM 1019 N VAL A 67 18.038 -22.930 -17.360 1.00 55.33 N ATOM 1020 CA VAL A 67 18.573 -22.252 -16.186 1.00 25.33 C ATOM 1021 C VAL A 67 17.621 -22.370 -15.001 1.00 40.12 C ATOM 1022 O VAL A 67 16.415 -22.150 -15.118 1.00 62.51 O ATOM 1023 CB VAL A 67 18.840 -20.762 -16.470 1.00 60.11 C ATOM 1024 CG1 VAL A 67 17.564 -20.068 -16.922 1.00 2.02 C ATOM 1025 CG2 VAL A 67 19.420 -20.081 -15.240 1.00 25.01 C ATOM 0 H VAL A 67 17.575 -22.314 -18.028 1.00 55.33 H new ATOM 0 HA VAL A 67 19.516 -22.741 -15.941 1.00 25.33 H new ATOM 0 HB VAL A 67 19.570 -20.689 -17.276 1.00 60.11 H new ATOM 0 HG11 VAL A 67 17.772 -19.016 -17.118 1.00 2.02 H new ATOM 0 HG12 VAL A 67 17.195 -20.541 -17.832 1.00 2.02 H new ATOM 0 HG13 VAL A 67 16.809 -20.149 -16.140 1.00 2.02 H new ATOM 0 HG21 VAL A 67 19.602 -19.029 -15.459 1.00 25.01 H new ATOM 0 HG22 VAL A 67 18.715 -20.163 -14.413 1.00 25.01 H new ATOM 0 HG23 VAL A 67 20.359 -20.563 -14.966 1.00 25.01 H new ATOM 1035 N PRO A 68 18.173 -22.724 -13.831 1.00 71.11 N ATOM 1036 CA PRO A 68 17.390 -22.878 -12.601 1.00 64.02 C ATOM 1037 C PRO A 68 16.880 -21.544 -12.068 1.00 53.32 C ATOM 1038 O PRO A 68 15.732 -21.436 -11.637 1.00 24.12 O ATOM 1039 CB PRO A 68 18.389 -23.499 -11.621 1.00 11.42 C ATOM 1040 CG PRO A 68 19.726 -23.073 -12.122 1.00 32.13 C ATOM 1041 CD PRO A 68 19.603 -23.001 -13.619 1.00 25.23 C ATOM 0 HA PRO A 68 16.496 -23.481 -12.759 1.00 64.02 H new ATOM 0 HB2 PRO A 68 18.217 -23.147 -10.604 1.00 11.42 H new ATOM 0 HB3 PRO A 68 18.301 -24.585 -11.601 1.00 11.42 H new ATOM 0 HG2 PRO A 68 20.008 -22.106 -11.707 1.00 32.13 H new ATOM 0 HG3 PRO A 68 20.498 -23.784 -11.828 1.00 32.13 H new ATOM 0 HD2 PRO A 68 20.231 -22.214 -14.036 1.00 25.23 H new ATOM 0 HD3 PRO A 68 19.906 -23.935 -14.092 1.00 25.23 H new ATOM 1049 N GLU A 69 17.739 -20.530 -12.102 1.00 23.22 N ATOM 1050 CA GLU A 69 17.373 -19.203 -11.621 1.00 44.02 C ATOM 1051 C GLU A 69 16.189 -18.647 -12.407 1.00 22.11 C ATOM 1052 O GLU A 69 16.145 -18.740 -13.634 1.00 14.22 O ATOM 1053 CB GLU A 69 18.565 -18.250 -11.732 1.00 3.24 C ATOM 1054 CG GLU A 69 18.587 -17.175 -10.658 1.00 33.24 C ATOM 1055 CD GLU A 69 19.879 -16.382 -10.652 1.00 11.30 C ATOM 1056 OE1 GLU A 69 20.942 -16.979 -10.923 1.00 0.41 O ATOM 1057 OE2 GLU A 69 19.827 -15.165 -10.377 1.00 5.13 O ATOM 0 H GLU A 69 18.692 -20.602 -12.457 1.00 23.22 H new ATOM 0 HA GLU A 69 17.083 -19.291 -10.574 1.00 44.02 H new ATOM 0 HB2 GLU A 69 19.488 -18.828 -11.675 1.00 3.24 H new ATOM 0 HB3 GLU A 69 18.548 -17.773 -12.712 1.00 3.24 H new ATOM 0 HG2 GLU A 69 17.749 -16.495 -10.812 1.00 33.24 H new ATOM 0 HG3 GLU A 69 18.446 -17.639 -9.682 1.00 33.24 H new ATOM 1064 N LYS A 70 15.231 -18.070 -11.691 1.00 15.41 N ATOM 1065 CA LYS A 70 14.045 -17.497 -12.319 1.00 23.55 C ATOM 1066 C LYS A 70 14.341 -16.109 -12.876 1.00 4.21 C ATOM 1067 O LYS A 70 14.786 -15.219 -12.150 1.00 61.50 O ATOM 1068 CB LYS A 70 12.896 -17.420 -11.311 1.00 4.24 C ATOM 1069 CG LYS A 70 13.197 -16.536 -10.112 1.00 41.05 C ATOM 1070 CD LYS A 70 12.242 -16.811 -8.963 1.00 23.11 C ATOM 1071 CE LYS A 70 12.463 -15.843 -7.811 1.00 25.13 C ATOM 1072 NZ LYS A 70 12.007 -16.412 -6.513 1.00 30.34 N ATOM 0 H LYS A 70 15.252 -17.986 -10.675 1.00 15.41 H new ATOM 0 HA LYS A 70 13.753 -18.145 -13.145 1.00 23.55 H new ATOM 0 HB2 LYS A 70 12.006 -17.043 -11.815 1.00 4.24 H new ATOM 0 HB3 LYS A 70 12.663 -18.426 -10.961 1.00 4.24 H new ATOM 0 HG2 LYS A 70 14.222 -16.705 -9.783 1.00 41.05 H new ATOM 0 HG3 LYS A 70 13.124 -15.488 -10.404 1.00 41.05 H new ATOM 0 HD2 LYS A 70 11.214 -16.730 -9.316 1.00 23.11 H new ATOM 0 HD3 LYS A 70 12.379 -17.834 -8.612 1.00 23.11 H new ATOM 0 HE2 LYS A 70 13.522 -15.592 -7.746 1.00 25.13 H new ATOM 0 HE3 LYS A 70 11.927 -14.915 -8.009 1.00 25.13 H new ATOM 0 HZ1 LYS A 70 12.175 -15.722 -5.753 1.00 30.34 H new ATOM 0 HZ2 LYS A 70 10.991 -16.628 -6.566 1.00 30.34 H new ATOM 0 HZ3 LYS A 70 12.536 -17.284 -6.311 1.00 30.34 H new ATOM 1086 N VAL A 71 14.091 -15.929 -14.169 1.00 35.21 N ATOM 1087 CA VAL A 71 14.328 -14.648 -14.823 1.00 12.22 C ATOM 1088 C VAL A 71 13.267 -13.626 -14.430 1.00 3.52 C ATOM 1089 O VAL A 71 12.087 -13.954 -14.313 1.00 75.24 O ATOM 1090 CB VAL A 71 14.341 -14.794 -16.356 1.00 71.10 C ATOM 1091 CG1 VAL A 71 14.559 -13.443 -17.020 1.00 5.14 C ATOM 1092 CG2 VAL A 71 15.409 -15.788 -16.787 1.00 10.11 C ATOM 0 H VAL A 71 13.724 -16.655 -14.785 1.00 35.21 H new ATOM 0 HA VAL A 71 15.306 -14.299 -14.491 1.00 12.22 H new ATOM 0 HB VAL A 71 13.371 -15.176 -16.675 1.00 71.10 H new ATOM 0 HG11 VAL A 71 14.565 -13.567 -18.103 1.00 5.14 H new ATOM 0 HG12 VAL A 71 13.754 -12.764 -16.737 1.00 5.14 H new ATOM 0 HG13 VAL A 71 15.514 -13.029 -16.697 1.00 5.14 H new ATOM 0 HG21 VAL A 71 15.404 -15.879 -17.873 1.00 10.11 H new ATOM 0 HG22 VAL A 71 16.387 -15.438 -16.456 1.00 10.11 H new ATOM 0 HG23 VAL A 71 15.202 -16.761 -16.341 1.00 10.11 H new ATOM 1102 N ASP A 72 13.696 -12.385 -14.227 1.00 41.31 N ATOM 1103 CA ASP A 72 12.783 -11.312 -13.848 1.00 61.54 C ATOM 1104 C ASP A 72 12.695 -10.259 -14.949 1.00 24.53 C ATOM 1105 O ASP A 72 11.690 -9.562 -15.075 1.00 15.12 O ATOM 1106 CB ASP A 72 13.238 -10.664 -12.540 1.00 64.21 C ATOM 1107 CG ASP A 72 12.277 -9.595 -12.059 1.00 24.04 C ATOM 1108 OD1 ASP A 72 12.345 -8.460 -12.575 1.00 5.32 O ATOM 1109 OD2 ASP A 72 11.457 -9.894 -11.166 1.00 52.23 O ATOM 0 H ASP A 72 14.670 -12.097 -14.318 1.00 41.31 H new ATOM 0 HA ASP A 72 11.793 -11.745 -13.704 1.00 61.54 H new ATOM 0 HB2 ASP A 72 13.337 -11.432 -11.773 1.00 64.21 H new ATOM 0 HB3 ASP A 72 14.226 -10.224 -12.680 1.00 64.21 H new ATOM 1114 N MET A 73 13.756 -10.150 -15.742 1.00 22.11 N ATOM 1115 CA MET A 73 13.798 -9.182 -16.832 1.00 5.14 C ATOM 1116 C MET A 73 14.563 -9.742 -18.027 1.00 52.00 C ATOM 1117 O MET A 73 15.769 -9.975 -17.951 1.00 63.21 O ATOM 1118 CB MET A 73 14.449 -7.880 -16.360 1.00 54.44 C ATOM 1119 CG MET A 73 14.270 -6.725 -17.333 1.00 11.24 C ATOM 1120 SD MET A 73 14.334 -5.117 -16.520 1.00 11.51 S ATOM 1121 CE MET A 73 16.080 -4.999 -16.139 1.00 42.12 C ATOM 0 H MET A 73 14.597 -10.719 -15.650 1.00 22.11 H new ATOM 0 HA MET A 73 12.774 -8.977 -17.143 1.00 5.14 H new ATOM 0 HB2 MET A 73 14.026 -7.601 -15.395 1.00 54.44 H new ATOM 0 HB3 MET A 73 15.514 -8.051 -16.204 1.00 54.44 H new ATOM 0 HG2 MET A 73 15.047 -6.774 -18.096 1.00 11.24 H new ATOM 0 HG3 MET A 73 13.314 -6.831 -17.845 1.00 11.24 H new ATOM 0 HE1 MET A 73 16.331 -3.966 -15.899 1.00 42.12 H new ATOM 0 HE2 MET A 73 16.310 -5.636 -15.285 1.00 42.12 H new ATOM 0 HE3 MET A 73 16.663 -5.323 -17.001 1.00 42.12 H new ATOM 1131 N VAL A 74 13.853 -9.956 -19.130 1.00 71.13 N ATOM 1132 CA VAL A 74 14.465 -10.488 -20.342 1.00 31.10 C ATOM 1133 C VAL A 74 14.969 -9.365 -21.241 1.00 64.34 C ATOM 1134 O VAL A 74 14.183 -8.583 -21.775 1.00 41.13 O ATOM 1135 CB VAL A 74 13.474 -11.360 -21.135 1.00 74.21 C ATOM 1136 CG1 VAL A 74 14.129 -11.900 -22.397 1.00 74.32 C ATOM 1137 CG2 VAL A 74 12.951 -12.496 -20.268 1.00 3.42 C ATOM 0 H VAL A 74 12.853 -9.769 -19.209 1.00 71.13 H new ATOM 0 HA VAL A 74 15.308 -11.104 -20.027 1.00 31.10 H new ATOM 0 HB VAL A 74 12.628 -10.740 -21.430 1.00 74.21 H new ATOM 0 HG11 VAL A 74 13.414 -12.514 -22.944 1.00 74.32 H new ATOM 0 HG12 VAL A 74 14.449 -11.069 -23.025 1.00 74.32 H new ATOM 0 HG13 VAL A 74 14.995 -12.505 -22.127 1.00 74.32 H new ATOM 0 HG21 VAL A 74 12.252 -13.102 -20.845 1.00 3.42 H new ATOM 0 HG22 VAL A 74 13.785 -13.117 -19.940 1.00 3.42 H new ATOM 0 HG23 VAL A 74 12.441 -12.084 -19.397 1.00 3.42 H new ATOM 1147 N ASP A 75 16.286 -9.292 -21.405 1.00 73.31 N ATOM 1148 CA ASP A 75 16.896 -8.266 -22.242 1.00 4.23 C ATOM 1149 C ASP A 75 17.046 -8.754 -23.679 1.00 63.40 C ATOM 1150 O ASP A 75 17.930 -9.555 -23.985 1.00 3.03 O ATOM 1151 CB ASP A 75 18.262 -7.866 -21.681 1.00 30.23 C ATOM 1152 CG ASP A 75 18.193 -6.616 -20.826 1.00 23.13 C ATOM 1153 OD1 ASP A 75 17.073 -6.224 -20.437 1.00 1.42 O ATOM 1154 OD2 ASP A 75 19.260 -6.031 -20.545 1.00 12.42 O ATOM 0 H ASP A 75 16.951 -9.931 -20.969 1.00 73.31 H new ATOM 0 HA ASP A 75 16.241 -7.395 -22.240 1.00 4.23 H new ATOM 0 HB2 ASP A 75 18.662 -8.687 -21.087 1.00 30.23 H new ATOM 0 HB3 ASP A 75 18.956 -7.701 -22.505 1.00 30.23 H new ATOM 1159 N VAL A 76 16.176 -8.268 -24.558 1.00 72.00 N ATOM 1160 CA VAL A 76 16.211 -8.655 -25.963 1.00 42.13 C ATOM 1161 C VAL A 76 16.807 -7.546 -26.824 1.00 32.32 C ATOM 1162 O VAL A 76 16.158 -6.534 -27.088 1.00 32.01 O ATOM 1163 CB VAL A 76 14.803 -8.996 -26.487 1.00 64.01 C ATOM 1164 CG1 VAL A 76 14.882 -9.581 -27.889 1.00 44.10 C ATOM 1165 CG2 VAL A 76 14.101 -9.956 -25.539 1.00 13.21 C ATOM 0 H VAL A 76 15.438 -7.605 -24.322 1.00 72.00 H new ATOM 0 HA VAL A 76 16.841 -9.542 -26.031 1.00 42.13 H new ATOM 0 HB VAL A 76 14.219 -8.077 -26.535 1.00 64.01 H new ATOM 0 HG11 VAL A 76 13.878 -9.816 -28.242 1.00 44.10 H new ATOM 0 HG12 VAL A 76 15.343 -8.856 -28.560 1.00 44.10 H new ATOM 0 HG13 VAL A 76 15.482 -10.491 -27.870 1.00 44.10 H new ATOM 0 HG21 VAL A 76 13.108 -10.186 -25.924 1.00 13.21 H new ATOM 0 HG22 VAL A 76 14.681 -10.875 -25.457 1.00 13.21 H new ATOM 0 HG23 VAL A 76 14.011 -9.495 -24.555 1.00 13.21 H new ATOM 1175 N PHE A 77 18.047 -7.744 -27.259 1.00 73.42 N ATOM 1176 CA PHE A 77 18.731 -6.761 -28.090 1.00 43.03 C ATOM 1177 C PHE A 77 19.167 -7.378 -29.416 1.00 22.31 C ATOM 1178 O PHE A 77 19.679 -6.687 -30.297 1.00 13.55 O ATOM 1179 CB PHE A 77 19.948 -6.197 -27.353 1.00 34.11 C ATOM 1180 CG PHE A 77 19.624 -5.654 -25.991 1.00 10.15 C ATOM 1181 CD1 PHE A 77 18.631 -4.701 -25.828 1.00 32.50 C ATOM 1182 CD2 PHE A 77 20.312 -6.096 -24.872 1.00 64.04 C ATOM 1183 CE1 PHE A 77 18.332 -4.200 -24.576 1.00 13.55 C ATOM 1184 CE2 PHE A 77 20.017 -5.598 -23.617 1.00 44.02 C ATOM 1185 CZ PHE A 77 19.025 -4.649 -23.469 1.00 31.24 C ATOM 0 H PHE A 77 18.598 -8.576 -27.050 1.00 73.42 H new ATOM 0 HA PHE A 77 18.033 -5.950 -28.299 1.00 43.03 H new ATOM 0 HB2 PHE A 77 20.698 -6.981 -27.254 1.00 34.11 H new ATOM 0 HB3 PHE A 77 20.393 -5.405 -27.955 1.00 34.11 H new ATOM 0 HD1 PHE A 77 18.085 -4.346 -26.690 1.00 32.50 H new ATOM 0 HD2 PHE A 77 21.088 -6.839 -24.982 1.00 64.04 H new ATOM 0 HE1 PHE A 77 17.556 -3.457 -24.463 1.00 13.55 H new ATOM 0 HE2 PHE A 77 20.561 -5.951 -22.753 1.00 44.02 H new ATOM 0 HZ PHE A 77 18.791 -4.259 -22.489 1.00 31.24 H new ATOM 1195 N ARG A 78 18.961 -8.684 -29.550 1.00 23.44 N ATOM 1196 CA ARG A 78 19.334 -9.396 -30.766 1.00 62.12 C ATOM 1197 C ARG A 78 18.754 -8.708 -31.998 1.00 40.32 C ATOM 1198 O ARG A 78 19.489 -8.169 -32.824 1.00 44.30 O ATOM 1199 CB ARG A 78 18.850 -10.846 -30.703 1.00 51.22 C ATOM 1200 CG ARG A 78 19.288 -11.580 -29.446 1.00 74.15 C ATOM 1201 CD ARG A 78 18.879 -13.044 -29.486 1.00 65.52 C ATOM 1202 NE ARG A 78 17.487 -13.214 -29.894 1.00 4.21 N ATOM 1203 CZ ARG A 78 16.984 -14.363 -30.329 1.00 73.40 C ATOM 1204 NH1 ARG A 78 17.754 -15.439 -30.412 1.00 70.31 N ATOM 1205 NH2 ARG A 78 15.707 -14.438 -30.682 1.00 33.43 N ATOM 0 H ARG A 78 18.538 -9.271 -28.831 1.00 23.44 H new ATOM 0 HA ARG A 78 20.421 -9.386 -30.843 1.00 62.12 H new ATOM 0 HB2 ARG A 78 17.762 -10.860 -30.761 1.00 51.22 H new ATOM 0 HB3 ARG A 78 19.222 -11.383 -31.575 1.00 51.22 H new ATOM 0 HG2 ARG A 78 20.370 -11.506 -29.338 1.00 74.15 H new ATOM 0 HG3 ARG A 78 18.847 -11.102 -28.571 1.00 74.15 H new ATOM 0 HD2 ARG A 78 19.527 -13.582 -30.177 1.00 65.52 H new ATOM 0 HD3 ARG A 78 19.025 -13.488 -28.501 1.00 65.52 H new ATOM 0 HE ARG A 78 16.867 -12.406 -29.842 1.00 4.21 H new ATOM 0 HH11 ARG A 78 18.736 -15.386 -30.141 1.00 70.31 H new ATOM 0 HH12 ARG A 78 17.364 -16.320 -30.747 1.00 70.31 H new ATOM 0 HH21 ARG A 78 15.111 -13.612 -30.619 1.00 33.43 H new ATOM 0 HH22 ARG A 78 15.321 -15.321 -31.016 1.00 33.43 H new ATOM 1219 N ASN A 79 17.430 -8.731 -32.114 1.00 62.14 N ATOM 1220 CA ASN A 79 16.751 -8.110 -33.246 1.00 62.40 C ATOM 1221 C ASN A 79 15.371 -7.603 -32.840 1.00 50.53 C ATOM 1222 O ASN A 79 14.975 -7.711 -31.680 1.00 13.10 O ATOM 1223 CB ASN A 79 16.621 -9.108 -34.399 1.00 44.41 C ATOM 1224 CG ASN A 79 17.904 -9.239 -35.197 1.00 43.01 C ATOM 1225 OD1 ASN A 79 18.485 -10.321 -35.287 1.00 12.05 O ATOM 1226 ND2 ASN A 79 18.353 -8.134 -35.781 1.00 62.25 N ATOM 0 H ASN A 79 16.806 -9.173 -31.438 1.00 62.14 H new ATOM 0 HA ASN A 79 17.349 -7.260 -33.575 1.00 62.40 H new ATOM 0 HB2 ASN A 79 16.342 -10.084 -34.002 1.00 44.41 H new ATOM 0 HB3 ASN A 79 15.815 -8.791 -35.061 1.00 44.41 H new ATOM 0 HD21 ASN A 79 19.212 -8.161 -36.331 1.00 62.25 H new ATOM 0 HD22 ASN A 79 17.839 -7.259 -35.680 1.00 62.25 H new ATOM 1233 N SER A 80 14.643 -7.048 -33.805 1.00 22.52 N ATOM 1234 CA SER A 80 13.308 -6.521 -33.548 1.00 3.21 C ATOM 1235 C SER A 80 12.301 -7.653 -33.374 1.00 32.22 C ATOM 1236 O SER A 80 11.663 -7.775 -32.329 1.00 2.05 O ATOM 1237 CB SER A 80 12.870 -5.605 -34.692 1.00 42.51 C ATOM 1238 OG SER A 80 12.919 -6.283 -35.935 1.00 54.55 O ATOM 0 H SER A 80 14.956 -6.952 -34.771 1.00 22.52 H new ATOM 0 HA SER A 80 13.343 -5.945 -32.623 1.00 3.21 H new ATOM 0 HB2 SER A 80 11.857 -5.248 -34.509 1.00 42.51 H new ATOM 0 HB3 SER A 80 13.516 -4.727 -34.727 1.00 42.51 H new ATOM 0 HG SER A 80 12.633 -5.677 -36.650 1.00 54.55 H new ATOM 1244 N GLU A 81 12.164 -8.479 -34.407 1.00 12.14 N ATOM 1245 CA GLU A 81 11.233 -9.601 -34.368 1.00 43.04 C ATOM 1246 C GLU A 81 11.592 -10.567 -33.243 1.00 13.13 C ATOM 1247 O GLU A 81 10.732 -11.278 -32.724 1.00 21.14 O ATOM 1248 CB GLU A 81 11.235 -10.339 -35.709 1.00 33.34 C ATOM 1249 CG GLU A 81 10.127 -11.372 -35.836 1.00 2.22 C ATOM 1250 CD GLU A 81 10.077 -12.007 -37.212 1.00 23.33 C ATOM 1251 OE1 GLU A 81 11.110 -12.554 -37.651 1.00 43.02 O ATOM 1252 OE2 GLU A 81 9.004 -11.958 -37.849 1.00 2.22 O ATOM 0 H GLU A 81 12.685 -8.392 -35.280 1.00 12.14 H new ATOM 0 HA GLU A 81 10.235 -9.206 -34.179 1.00 43.04 H new ATOM 0 HB2 GLU A 81 11.136 -9.612 -36.515 1.00 33.34 H new ATOM 0 HB3 GLU A 81 12.198 -10.833 -35.841 1.00 33.34 H new ATOM 0 HG2 GLU A 81 10.273 -12.150 -35.086 1.00 2.22 H new ATOM 0 HG3 GLU A 81 9.168 -10.899 -35.623 1.00 2.22 H new ATOM 1259 N ALA A 82 12.868 -10.586 -32.871 1.00 73.35 N ATOM 1260 CA ALA A 82 13.340 -11.463 -31.807 1.00 44.12 C ATOM 1261 C ALA A 82 12.557 -11.234 -30.519 1.00 22.10 C ATOM 1262 O ALA A 82 12.376 -12.152 -29.720 1.00 62.41 O ATOM 1263 CB ALA A 82 14.828 -11.248 -31.568 1.00 74.32 C ATOM 0 H ALA A 82 13.593 -10.004 -33.291 1.00 73.35 H new ATOM 0 HA ALA A 82 13.178 -12.494 -32.121 1.00 44.12 H new ATOM 0 HB1 ALA A 82 15.168 -11.909 -30.771 1.00 74.32 H new ATOM 0 HB2 ALA A 82 15.379 -11.469 -32.482 1.00 74.32 H new ATOM 0 HB3 ALA A 82 15.004 -10.212 -31.280 1.00 74.32 H new ATOM 1269 N ALA A 83 12.095 -10.003 -30.323 1.00 65.33 N ATOM 1270 CA ALA A 83 11.331 -9.655 -29.133 1.00 14.35 C ATOM 1271 C ALA A 83 10.078 -10.516 -29.013 1.00 23.54 C ATOM 1272 O ALA A 83 9.670 -10.884 -27.911 1.00 53.00 O ATOM 1273 CB ALA A 83 10.958 -8.180 -29.158 1.00 2.34 C ATOM 0 H ALA A 83 12.237 -9.231 -30.974 1.00 65.33 H new ATOM 0 HA ALA A 83 11.957 -9.846 -28.261 1.00 14.35 H new ATOM 0 HB1 ALA A 83 10.387 -7.934 -28.263 1.00 2.34 H new ATOM 0 HB2 ALA A 83 11.865 -7.576 -29.188 1.00 2.34 H new ATOM 0 HB3 ALA A 83 10.354 -7.972 -30.042 1.00 2.34 H new ATOM 1279 N TRP A 84 9.474 -10.834 -30.151 1.00 73.54 N ATOM 1280 CA TRP A 84 8.267 -11.653 -30.173 1.00 54.00 C ATOM 1281 C TRP A 84 8.566 -13.077 -29.718 1.00 64.03 C ATOM 1282 O TRP A 84 7.933 -13.591 -28.797 1.00 51.14 O ATOM 1283 CB TRP A 84 7.662 -11.670 -31.578 1.00 1.51 C ATOM 1284 CG TRP A 84 6.519 -12.628 -31.721 1.00 61.45 C ATOM 1285 CD1 TRP A 84 6.601 -13.972 -31.955 1.00 14.51 C ATOM 1286 CD2 TRP A 84 5.124 -12.317 -31.643 1.00 10.31 C ATOM 1287 NE1 TRP A 84 5.340 -14.514 -32.026 1.00 51.42 N ATOM 1288 CE2 TRP A 84 4.417 -13.519 -31.837 1.00 72.42 C ATOM 1289 CE3 TRP A 84 4.403 -11.139 -31.425 1.00 63.43 C ATOM 1290 CZ2 TRP A 84 3.026 -13.575 -31.821 1.00 73.52 C ATOM 1291 CZ3 TRP A 84 3.023 -11.197 -31.410 1.00 53.31 C ATOM 1292 CH2 TRP A 84 2.346 -12.408 -31.606 1.00 54.42 C ATOM 0 H TRP A 84 9.800 -10.538 -31.071 1.00 73.54 H new ATOM 0 HA TRP A 84 7.548 -11.214 -29.481 1.00 54.00 H new ATOM 0 HB2 TRP A 84 7.319 -10.667 -31.830 1.00 1.51 H new ATOM 0 HB3 TRP A 84 8.438 -11.932 -32.297 1.00 1.51 H new ATOM 0 HD1 TRP A 84 7.521 -14.526 -32.068 1.00 14.51 H new ATOM 0 HE1 TRP A 84 5.126 -15.497 -32.192 1.00 51.42 H new ATOM 0 HE3 TRP A 84 4.916 -10.201 -31.271 1.00 63.43 H new ATOM 0 HZ2 TRP A 84 2.502 -14.507 -31.973 1.00 73.52 H new ATOM 0 HZ3 TRP A 84 2.456 -10.293 -31.244 1.00 53.31 H new ATOM 0 HH2 TRP A 84 1.266 -12.420 -31.587 1.00 54.42 H new ATOM 1303 N GLY A 85 9.537 -13.710 -30.370 1.00 71.34 N ATOM 1304 CA GLY A 85 9.903 -15.070 -30.018 1.00 1.41 C ATOM 1305 C GLY A 85 10.369 -15.190 -28.581 1.00 32.45 C ATOM 1306 O GLY A 85 10.007 -16.136 -27.880 1.00 62.34 O ATOM 0 H GLY A 85 10.076 -13.305 -31.135 1.00 71.34 H new ATOM 0 HA2 GLY A 85 9.047 -15.726 -30.175 1.00 1.41 H new ATOM 0 HA3 GLY A 85 10.695 -15.414 -30.684 1.00 1.41 H new ATOM 1310 N VAL A 86 11.175 -14.231 -28.139 1.00 5.43 N ATOM 1311 CA VAL A 86 11.692 -14.234 -26.775 1.00 42.34 C ATOM 1312 C VAL A 86 10.594 -13.904 -25.771 1.00 31.34 C ATOM 1313 O VAL A 86 10.667 -14.294 -24.606 1.00 21.13 O ATOM 1314 CB VAL A 86 12.844 -13.225 -26.609 1.00 40.44 C ATOM 1315 CG1 VAL A 86 13.415 -13.293 -25.201 1.00 50.52 C ATOM 1316 CG2 VAL A 86 13.928 -13.479 -27.646 1.00 0.10 C ATOM 0 H VAL A 86 11.485 -13.441 -28.705 1.00 5.43 H new ATOM 0 HA VAL A 86 12.068 -15.239 -26.581 1.00 42.34 H new ATOM 0 HB VAL A 86 12.450 -12.221 -26.767 1.00 40.44 H new ATOM 0 HG11 VAL A 86 14.228 -12.573 -25.103 1.00 50.52 H new ATOM 0 HG12 VAL A 86 12.633 -13.058 -24.479 1.00 50.52 H new ATOM 0 HG13 VAL A 86 13.795 -14.297 -25.010 1.00 50.52 H new ATOM 0 HG21 VAL A 86 14.734 -12.757 -27.514 1.00 0.10 H new ATOM 0 HG22 VAL A 86 14.321 -14.488 -27.522 1.00 0.10 H new ATOM 0 HG23 VAL A 86 13.507 -13.374 -28.646 1.00 0.10 H new ATOM 1326 N ALA A 87 9.576 -13.184 -26.230 1.00 72.21 N ATOM 1327 CA ALA A 87 8.460 -12.804 -25.372 1.00 62.33 C ATOM 1328 C ALA A 87 7.601 -14.014 -25.021 1.00 70.11 C ATOM 1329 O ALA A 87 7.383 -14.311 -23.847 1.00 70.40 O ATOM 1330 CB ALA A 87 7.616 -11.733 -26.047 1.00 64.23 C ATOM 0 H ALA A 87 9.501 -12.852 -27.191 1.00 72.21 H new ATOM 0 HA ALA A 87 8.867 -12.399 -24.446 1.00 62.33 H new ATOM 0 HB1 ALA A 87 6.786 -11.459 -25.395 1.00 64.23 H new ATOM 0 HB2 ALA A 87 8.231 -10.854 -26.241 1.00 64.23 H new ATOM 0 HB3 ALA A 87 7.225 -12.118 -26.989 1.00 64.23 H new ATOM 1336 N GLN A 88 7.116 -14.707 -26.046 1.00 74.12 N ATOM 1337 CA GLN A 88 6.279 -15.884 -25.844 1.00 52.13 C ATOM 1338 C GLN A 88 6.971 -16.894 -24.935 1.00 74.43 C ATOM 1339 O GLN A 88 6.351 -17.456 -24.033 1.00 24.25 O ATOM 1340 CB GLN A 88 5.944 -16.534 -27.188 1.00 32.12 C ATOM 1341 CG GLN A 88 7.164 -16.812 -28.050 1.00 64.22 C ATOM 1342 CD GLN A 88 6.800 -17.338 -29.425 1.00 23.35 C ATOM 1343 OE1 GLN A 88 5.887 -16.650 -30.099 1.00 54.40 O flip ATOM 1344 NE2 GLN A 88 7.334 -18.353 -29.875 1.00 42.25 N flip ATOM 0 H GLN A 88 7.288 -14.474 -27.024 1.00 74.12 H new ATOM 0 HA GLN A 88 5.355 -15.564 -25.363 1.00 52.13 H new ATOM 0 HB2 GLN A 88 5.416 -17.470 -27.008 1.00 32.12 H new ATOM 0 HB3 GLN A 88 5.262 -15.884 -27.737 1.00 32.12 H new ATOM 0 HG2 GLN A 88 7.744 -15.896 -28.158 1.00 64.22 H new ATOM 0 HG3 GLN A 88 7.803 -17.537 -27.545 1.00 64.22 H new ATOM 0 HE21 GLN A 88 8.031 -18.851 -29.321 1.00 42.25 H new ATOM 0 HE22 GLN A 88 7.079 -18.696 -30.801 1.00 42.25 H new ATOM 1353 N GLU A 89 8.257 -17.120 -25.181 1.00 24.30 N ATOM 1354 CA GLU A 89 9.032 -18.064 -24.384 1.00 62.55 C ATOM 1355 C GLU A 89 9.075 -17.635 -22.921 1.00 33.12 C ATOM 1356 O GLU A 89 8.874 -18.447 -22.019 1.00 30.55 O ATOM 1357 CB GLU A 89 10.455 -18.183 -24.934 1.00 42.53 C ATOM 1358 CG GLU A 89 10.518 -18.748 -26.343 1.00 64.31 C ATOM 1359 CD GLU A 89 10.621 -20.261 -26.360 1.00 72.11 C ATOM 1360 OE1 GLU A 89 10.268 -20.890 -25.341 1.00 22.45 O ATOM 1361 OE2 GLU A 89 11.053 -20.815 -27.392 1.00 23.50 O ATOM 0 H GLU A 89 8.784 -16.663 -25.925 1.00 24.30 H new ATOM 0 HA GLU A 89 8.544 -19.037 -24.445 1.00 62.55 H new ATOM 0 HB2 GLU A 89 10.922 -17.198 -24.925 1.00 42.53 H new ATOM 0 HB3 GLU A 89 11.040 -18.819 -24.270 1.00 42.53 H new ATOM 0 HG2 GLU A 89 9.628 -18.442 -26.893 1.00 64.31 H new ATOM 0 HG3 GLU A 89 11.377 -18.323 -26.863 1.00 64.31 H new ATOM 1368 N ALA A 90 9.338 -16.352 -22.694 1.00 63.30 N ATOM 1369 CA ALA A 90 9.406 -15.814 -21.341 1.00 41.12 C ATOM 1370 C ALA A 90 8.072 -15.972 -20.620 1.00 12.00 C ATOM 1371 O ALA A 90 8.019 -16.471 -19.496 1.00 31.43 O ATOM 1372 CB ALA A 90 9.819 -14.350 -21.376 1.00 23.01 C ATOM 0 H ALA A 90 9.507 -15.666 -23.430 1.00 63.30 H new ATOM 0 HA ALA A 90 10.157 -16.379 -20.789 1.00 41.12 H new ATOM 0 HB1 ALA A 90 9.866 -13.961 -20.359 1.00 23.01 H new ATOM 0 HB2 ALA A 90 10.799 -14.260 -21.845 1.00 23.01 H new ATOM 0 HB3 ALA A 90 9.088 -13.779 -21.950 1.00 23.01 H new ATOM 1378 N ILE A 91 6.997 -15.543 -21.273 1.00 61.00 N ATOM 1379 CA ILE A 91 5.663 -15.638 -20.693 1.00 41.23 C ATOM 1380 C ILE A 91 5.277 -17.091 -20.438 1.00 12.45 C ATOM 1381 O ILE A 91 4.464 -17.382 -19.561 1.00 74.21 O ATOM 1382 CB ILE A 91 4.605 -14.990 -21.606 1.00 62.11 C ATOM 1383 CG1 ILE A 91 4.929 -13.511 -21.829 1.00 32.40 C ATOM 1384 CG2 ILE A 91 3.217 -15.149 -21.004 1.00 62.40 C ATOM 1385 CD1 ILE A 91 4.458 -12.985 -23.167 1.00 10.35 C ATOM 0 H ILE A 91 7.024 -15.126 -22.204 1.00 61.00 H new ATOM 0 HA ILE A 91 5.692 -15.100 -19.745 1.00 41.23 H new ATOM 0 HB ILE A 91 4.621 -15.496 -22.572 1.00 62.11 H new ATOM 0 HG12 ILE A 91 4.470 -12.923 -21.034 1.00 32.40 H new ATOM 0 HG13 ILE A 91 6.007 -13.367 -21.750 1.00 32.40 H new ATOM 0 HG21 ILE A 91 2.480 -14.686 -21.661 1.00 62.40 H new ATOM 0 HG22 ILE A 91 2.988 -16.209 -20.892 1.00 62.40 H new ATOM 0 HG23 ILE A 91 3.187 -14.666 -20.027 1.00 62.40 H new ATOM 0 HD11 ILE A 91 4.721 -11.931 -23.257 1.00 10.35 H new ATOM 0 HD12 ILE A 91 4.937 -13.548 -23.968 1.00 10.35 H new ATOM 0 HD13 ILE A 91 3.376 -13.096 -23.241 1.00 10.35 H new ATOM 1397 N ALA A 92 5.867 -17.999 -21.208 1.00 2.52 N ATOM 1398 CA ALA A 92 5.588 -19.422 -21.062 1.00 40.33 C ATOM 1399 C ALA A 92 6.168 -19.965 -19.761 1.00 13.45 C ATOM 1400 O ALA A 92 5.471 -20.621 -18.986 1.00 71.11 O ATOM 1401 CB ALA A 92 6.142 -20.193 -22.251 1.00 44.42 C ATOM 0 H ALA A 92 6.541 -17.774 -21.939 1.00 2.52 H new ATOM 0 HA ALA A 92 4.506 -19.553 -21.029 1.00 40.33 H new ATOM 0 HB1 ALA A 92 5.926 -21.254 -22.129 1.00 44.42 H new ATOM 0 HB2 ALA A 92 5.677 -19.831 -23.168 1.00 44.42 H new ATOM 0 HB3 ALA A 92 7.220 -20.046 -22.309 1.00 44.42 H new ATOM 1407 N ILE A 93 7.446 -19.687 -19.526 1.00 71.25 N ATOM 1408 CA ILE A 93 8.118 -20.148 -18.318 1.00 2.10 C ATOM 1409 C ILE A 93 7.629 -19.384 -17.092 1.00 23.21 C ATOM 1410 O ILE A 93 7.694 -19.884 -15.970 1.00 21.13 O ATOM 1411 CB ILE A 93 9.646 -19.993 -18.430 1.00 4.41 C ATOM 1412 CG1 ILE A 93 10.015 -18.530 -18.685 1.00 10.44 C ATOM 1413 CG2 ILE A 93 10.189 -20.882 -19.538 1.00 63.14 C ATOM 1414 CD1 ILE A 93 11.498 -18.252 -18.575 1.00 31.25 C ATOM 0 H ILE A 93 8.037 -19.145 -20.156 1.00 71.25 H new ATOM 0 HA ILE A 93 7.876 -21.205 -18.205 1.00 2.10 H new ATOM 0 HB ILE A 93 10.097 -20.303 -17.488 1.00 4.41 H new ATOM 0 HG12 ILE A 93 9.673 -18.246 -19.680 1.00 10.44 H new ATOM 0 HG13 ILE A 93 9.482 -17.900 -17.973 1.00 10.44 H new ATOM 0 HG21 ILE A 93 11.270 -20.761 -19.605 1.00 63.14 H new ATOM 0 HG22 ILE A 93 9.953 -21.923 -19.318 1.00 63.14 H new ATOM 0 HG23 ILE A 93 9.733 -20.600 -20.487 1.00 63.14 H new ATOM 0 HD11 ILE A 93 11.685 -17.196 -18.768 1.00 31.25 H new ATOM 0 HD12 ILE A 93 11.842 -18.504 -17.572 1.00 31.25 H new ATOM 0 HD13 ILE A 93 12.036 -18.855 -19.306 1.00 31.25 H new ATOM 1426 N GLY A 94 7.138 -18.169 -17.315 1.00 72.12 N ATOM 1427 CA GLY A 94 6.643 -17.356 -16.220 1.00 20.24 C ATOM 1428 C GLY A 94 7.525 -16.154 -15.946 1.00 13.05 C ATOM 1429 O GLY A 94 7.976 -15.951 -14.819 1.00 1.11 O ATOM 0 H GLY A 94 7.074 -17.733 -18.235 1.00 72.12 H new ATOM 0 HA2 GLY A 94 5.633 -17.017 -16.451 1.00 20.24 H new ATOM 0 HA3 GLY A 94 6.576 -17.967 -15.320 1.00 20.24 H new ATOM 1433 N ALA A 95 7.772 -15.356 -16.979 1.00 10.42 N ATOM 1434 CA ALA A 95 8.605 -14.167 -16.844 1.00 22.32 C ATOM 1435 C ALA A 95 7.912 -13.104 -15.998 1.00 62.05 C ATOM 1436 O ALA A 95 6.806 -13.315 -15.501 1.00 53.24 O ATOM 1437 CB ALA A 95 8.954 -13.609 -18.215 1.00 44.04 C ATOM 0 H ALA A 95 7.407 -15.511 -17.919 1.00 10.42 H new ATOM 0 HA ALA A 95 9.526 -14.454 -16.336 1.00 22.32 H new ATOM 0 HB1 ALA A 95 9.576 -12.722 -18.099 1.00 44.04 H new ATOM 0 HB2 ALA A 95 9.498 -14.361 -18.786 1.00 44.04 H new ATOM 0 HB3 ALA A 95 8.038 -13.344 -18.744 1.00 44.04 H new ATOM 1443 N LYS A 96 8.570 -11.961 -15.838 1.00 41.23 N ATOM 1444 CA LYS A 96 8.018 -10.863 -15.053 1.00 73.14 C ATOM 1445 C LYS A 96 8.162 -9.538 -15.795 1.00 11.24 C ATOM 1446 O LYS A 96 7.252 -8.708 -15.787 1.00 42.33 O ATOM 1447 CB LYS A 96 8.717 -10.778 -13.695 1.00 33.43 C ATOM 1448 CG LYS A 96 8.366 -11.921 -12.758 1.00 34.13 C ATOM 1449 CD LYS A 96 8.976 -11.721 -11.381 1.00 2.13 C ATOM 1450 CE LYS A 96 10.252 -12.533 -11.213 1.00 55.42 C ATOM 1451 NZ LYS A 96 10.723 -12.539 -9.801 1.00 22.42 N ATOM 0 H LYS A 96 9.487 -11.771 -16.242 1.00 41.23 H new ATOM 0 HA LYS A 96 6.957 -11.058 -14.897 1.00 73.14 H new ATOM 0 HB2 LYS A 96 9.796 -10.765 -13.851 1.00 33.43 H new ATOM 0 HB3 LYS A 96 8.453 -9.834 -13.218 1.00 33.43 H new ATOM 0 HG2 LYS A 96 7.283 -12.000 -12.669 1.00 34.13 H new ATOM 0 HG3 LYS A 96 8.720 -12.861 -13.181 1.00 34.13 H new ATOM 0 HD2 LYS A 96 9.193 -10.664 -11.228 1.00 2.13 H new ATOM 0 HD3 LYS A 96 8.255 -12.012 -10.617 1.00 2.13 H new ATOM 0 HE2 LYS A 96 10.077 -13.557 -11.542 1.00 55.42 H new ATOM 0 HE3 LYS A 96 11.032 -12.121 -11.854 1.00 55.42 H new ATOM 0 HZ1 LYS A 96 11.379 -13.333 -9.657 1.00 22.42 H new ATOM 0 HZ2 LYS A 96 11.212 -11.645 -9.594 1.00 22.42 H new ATOM 0 HZ3 LYS A 96 9.908 -12.643 -9.164 1.00 22.42 H new ATOM 1465 N THR A 97 9.311 -9.345 -16.436 1.00 35.31 N ATOM 1466 CA THR A 97 9.573 -8.121 -17.182 1.00 64.42 C ATOM 1467 C THR A 97 10.168 -8.429 -18.552 1.00 35.42 C ATOM 1468 O THR A 97 10.733 -9.502 -18.768 1.00 21.24 O ATOM 1469 CB THR A 97 10.533 -7.191 -16.416 1.00 62.52 C ATOM 1470 OG1 THR A 97 10.298 -7.298 -15.008 1.00 2.43 O ATOM 1471 CG2 THR A 97 10.354 -5.747 -16.858 1.00 5.22 C ATOM 0 H THR A 97 10.075 -10.021 -16.453 1.00 35.31 H new ATOM 0 HA THR A 97 8.615 -7.617 -17.309 1.00 64.42 H new ATOM 0 HB THR A 97 11.555 -7.497 -16.637 1.00 62.52 H new ATOM 0 HG1 THR A 97 10.706 -8.122 -14.670 1.00 2.43 H new ATOM 0 HG21 THR A 97 11.042 -5.109 -16.304 1.00 5.22 H new ATOM 0 HG22 THR A 97 10.562 -5.665 -17.925 1.00 5.22 H new ATOM 0 HG23 THR A 97 9.329 -5.431 -16.663 1.00 5.22 H new ATOM 1479 N LEU A 98 10.037 -7.483 -19.475 1.00 12.24 N ATOM 1480 CA LEU A 98 10.562 -7.653 -20.825 1.00 0.11 C ATOM 1481 C LEU A 98 11.126 -6.340 -21.359 1.00 25.41 C ATOM 1482 O LEU A 98 10.421 -5.334 -21.432 1.00 70.21 O ATOM 1483 CB LEU A 98 9.465 -8.167 -21.759 1.00 22.21 C ATOM 1484 CG LEU A 98 9.933 -8.706 -23.111 1.00 44.23 C ATOM 1485 CD1 LEU A 98 10.389 -10.151 -22.982 1.00 3.24 C ATOM 1486 CD2 LEU A 98 8.824 -8.585 -24.146 1.00 62.42 C ATOM 0 H LEU A 98 9.572 -6.590 -19.313 1.00 12.24 H new ATOM 0 HA LEU A 98 11.369 -8.385 -20.785 1.00 0.11 H new ATOM 0 HB2 LEU A 98 8.919 -8.958 -21.245 1.00 22.21 H new ATOM 0 HB3 LEU A 98 8.759 -7.356 -21.938 1.00 22.21 H new ATOM 0 HG LEU A 98 10.781 -8.108 -23.444 1.00 44.23 H new ATOM 0 HD11 LEU A 98 10.718 -10.517 -23.955 1.00 3.24 H new ATOM 0 HD12 LEU A 98 11.215 -10.210 -22.273 1.00 3.24 H new ATOM 0 HD13 LEU A 98 9.561 -10.763 -22.625 1.00 3.24 H new ATOM 0 HD21 LEU A 98 9.175 -8.973 -25.102 1.00 62.42 H new ATOM 0 HD22 LEU A 98 7.956 -9.157 -23.818 1.00 62.42 H new ATOM 0 HD23 LEU A 98 8.546 -7.537 -24.260 1.00 62.42 H new ATOM 1498 N TRP A 99 12.401 -6.359 -21.732 1.00 72.13 N ATOM 1499 CA TRP A 99 13.059 -5.170 -22.262 1.00 63.42 C ATOM 1500 C TRP A 99 13.544 -5.407 -23.688 1.00 43.22 C ATOM 1501 O TRP A 99 14.248 -6.380 -23.962 1.00 31.20 O ATOM 1502 CB TRP A 99 14.236 -4.773 -21.369 1.00 61.53 C ATOM 1503 CG TRP A 99 14.379 -3.291 -21.200 1.00 24.34 C ATOM 1504 CD1 TRP A 99 15.233 -2.468 -21.877 1.00 12.43 C ATOM 1505 CD2 TRP A 99 13.649 -2.458 -20.293 1.00 1.11 C ATOM 1506 NE1 TRP A 99 15.077 -1.172 -21.445 1.00 71.24 N ATOM 1507 CE2 TRP A 99 14.111 -1.140 -20.475 1.00 12.41 C ATOM 1508 CE3 TRP A 99 12.649 -2.697 -19.347 1.00 12.52 C ATOM 1509 CZ2 TRP A 99 13.606 -0.067 -19.744 1.00 64.13 C ATOM 1510 CZ3 TRP A 99 12.149 -1.631 -18.622 1.00 64.03 C ATOM 1511 CH2 TRP A 99 12.628 -0.330 -18.825 1.00 12.44 C ATOM 0 H TRP A 99 12.999 -7.184 -21.677 1.00 72.13 H new ATOM 0 HA TRP A 99 12.332 -4.358 -22.276 1.00 63.42 H new ATOM 0 HB2 TRP A 99 14.111 -5.233 -20.389 1.00 61.53 H new ATOM 0 HB3 TRP A 99 15.156 -5.174 -21.794 1.00 61.53 H new ATOM 0 HD1 TRP A 99 15.928 -2.788 -22.639 1.00 12.43 H new ATOM 0 HE1 TRP A 99 15.597 -0.365 -21.791 1.00 71.24 H new ATOM 0 HE3 TRP A 99 12.273 -3.696 -19.185 1.00 12.52 H new ATOM 0 HZ2 TRP A 99 13.974 0.937 -19.898 1.00 64.13 H new ATOM 0 HZ3 TRP A 99 11.377 -1.804 -17.887 1.00 64.03 H new ATOM 0 HH2 TRP A 99 12.216 0.482 -18.244 1.00 12.44 H new ATOM 1522 N LEU A 100 13.165 -4.512 -24.593 1.00 51.25 N ATOM 1523 CA LEU A 100 13.562 -4.623 -25.993 1.00 30.22 C ATOM 1524 C LEU A 100 14.656 -3.615 -26.330 1.00 71.23 C ATOM 1525 O LEU A 100 15.217 -2.974 -25.442 1.00 72.03 O ATOM 1526 CB LEU A 100 12.354 -4.406 -26.905 1.00 75.22 C ATOM 1527 CG LEU A 100 11.054 -5.085 -26.471 1.00 20.03 C ATOM 1528 CD1 LEU A 100 9.976 -4.900 -27.527 1.00 51.32 C ATOM 1529 CD2 LEU A 100 11.289 -6.564 -26.200 1.00 45.10 C ATOM 0 H LEU A 100 12.583 -3.701 -24.383 1.00 51.25 H new ATOM 0 HA LEU A 100 13.956 -5.626 -26.155 1.00 30.22 H new ATOM 0 HB2 LEU A 100 12.172 -3.334 -26.984 1.00 75.22 H new ATOM 0 HB3 LEU A 100 12.610 -4.760 -27.904 1.00 75.22 H new ATOM 0 HG LEU A 100 10.713 -4.616 -25.548 1.00 20.03 H new ATOM 0 HD11 LEU A 100 9.059 -5.390 -27.200 1.00 51.32 H new ATOM 0 HD12 LEU A 100 9.787 -3.836 -27.672 1.00 51.32 H new ATOM 0 HD13 LEU A 100 10.308 -5.341 -28.467 1.00 51.32 H new ATOM 0 HD21 LEU A 100 10.353 -7.031 -25.892 1.00 45.10 H new ATOM 0 HD22 LEU A 100 11.654 -7.046 -27.107 1.00 45.10 H new ATOM 0 HD23 LEU A 100 12.028 -6.676 -25.407 1.00 45.10 H new ATOM 1541 N GLN A 101 14.952 -3.480 -27.619 1.00 74.00 N ATOM 1542 CA GLN A 101 15.977 -2.549 -28.073 1.00 43.53 C ATOM 1543 C GLN A 101 15.427 -1.128 -28.151 1.00 20.23 C ATOM 1544 O GLN A 101 14.274 -0.918 -28.529 1.00 51.33 O ATOM 1545 CB GLN A 101 16.514 -2.975 -29.440 1.00 64.35 C ATOM 1546 CG GLN A 101 17.754 -2.209 -29.873 1.00 62.52 C ATOM 1547 CD GLN A 101 19.039 -2.890 -29.445 1.00 5.21 C ATOM 1548 OE1 GLN A 101 19.338 -2.832 -28.152 1.00 11.22 O flip ATOM 1549 NE2 GLN A 101 19.757 -3.461 -30.267 1.00 73.32 N flip ATOM 0 H GLN A 101 14.496 -4.004 -28.366 1.00 74.00 H new ATOM 0 HA GLN A 101 16.792 -2.565 -27.349 1.00 43.53 H new ATOM 0 HB2 GLN A 101 16.746 -4.040 -29.414 1.00 64.35 H new ATOM 0 HB3 GLN A 101 15.732 -2.837 -30.187 1.00 64.35 H new ATOM 0 HG2 GLN A 101 17.749 -2.100 -30.958 1.00 62.52 H new ATOM 0 HG3 GLN A 101 17.722 -1.204 -29.451 1.00 62.52 H new ATOM 0 HE21 GLN A 101 19.489 -3.481 -31.251 1.00 73.32 H new ATOM 0 HE22 GLN A 101 20.619 -3.913 -29.964 1.00 73.32 H new ATOM 1558 N LEU A 102 16.258 -0.157 -27.790 1.00 10.23 N ATOM 1559 CA LEU A 102 15.855 1.245 -27.818 1.00 34.11 C ATOM 1560 C LEU A 102 15.858 1.784 -29.245 1.00 31.12 C ATOM 1561 O LEU A 102 16.808 1.573 -29.997 1.00 23.41 O ATOM 1562 CB LEU A 102 16.788 2.082 -26.942 1.00 42.41 C ATOM 1563 CG LEU A 102 16.590 3.597 -27.008 1.00 5.34 C ATOM 1564 CD1 LEU A 102 15.856 4.094 -25.772 1.00 31.40 C ATOM 1565 CD2 LEU A 102 17.930 4.304 -27.154 1.00 1.11 C ATOM 0 H LEU A 102 17.215 -0.314 -27.474 1.00 10.23 H new ATOM 0 HA LEU A 102 14.840 1.314 -27.426 1.00 34.11 H new ATOM 0 HB2 LEU A 102 16.664 1.764 -25.907 1.00 42.41 H new ATOM 0 HB3 LEU A 102 17.817 1.857 -27.223 1.00 42.41 H new ATOM 0 HG LEU A 102 15.983 3.827 -27.883 1.00 5.34 H new ATOM 0 HD11 LEU A 102 15.724 5.174 -25.837 1.00 31.40 H new ATOM 0 HD12 LEU A 102 14.880 3.612 -25.710 1.00 31.40 H new ATOM 0 HD13 LEU A 102 16.437 3.852 -24.882 1.00 31.40 H new ATOM 0 HD21 LEU A 102 17.770 5.381 -27.199 1.00 1.11 H new ATOM 0 HD22 LEU A 102 18.562 4.067 -26.298 1.00 1.11 H new ATOM 0 HD23 LEU A 102 18.419 3.971 -28.069 1.00 1.11 H new ATOM 1577 N GLY A 103 14.788 2.484 -29.610 1.00 70.44 N ATOM 1578 CA GLY A 103 14.689 3.044 -30.945 1.00 53.03 C ATOM 1579 C GLY A 103 13.776 2.237 -31.847 1.00 31.53 C ATOM 1580 O GLY A 103 13.399 2.690 -32.927 1.00 73.03 O ATOM 0 H GLY A 103 13.989 2.673 -29.005 1.00 70.44 H new ATOM 0 HA2 GLY A 103 14.318 4.067 -30.880 1.00 53.03 H new ATOM 0 HA3 GLY A 103 15.683 3.093 -31.390 1.00 53.03 H new ATOM 1584 N VAL A 104 13.421 1.035 -31.403 1.00 74.11 N ATOM 1585 CA VAL A 104 12.547 0.162 -32.178 1.00 32.45 C ATOM 1586 C VAL A 104 11.154 0.092 -31.562 1.00 54.53 C ATOM 1587 O VAL A 104 10.989 0.258 -30.353 1.00 42.33 O ATOM 1588 CB VAL A 104 13.123 -1.263 -32.278 1.00 21.23 C ATOM 1589 CG1 VAL A 104 12.334 -2.089 -33.282 1.00 33.32 C ATOM 1590 CG2 VAL A 104 14.596 -1.216 -32.654 1.00 62.43 C ATOM 0 H VAL A 104 13.725 0.644 -30.511 1.00 74.11 H new ATOM 0 HA VAL A 104 12.478 0.590 -33.178 1.00 32.45 H new ATOM 0 HB VAL A 104 13.035 -1.741 -31.302 1.00 21.23 H new ATOM 0 HG11 VAL A 104 12.756 -3.093 -33.339 1.00 33.32 H new ATOM 0 HG12 VAL A 104 11.293 -2.150 -32.965 1.00 33.32 H new ATOM 0 HG13 VAL A 104 12.387 -1.617 -34.263 1.00 33.32 H new ATOM 0 HG21 VAL A 104 14.987 -2.231 -32.720 1.00 62.43 H new ATOM 0 HG22 VAL A 104 14.710 -0.720 -33.618 1.00 62.43 H new ATOM 0 HG23 VAL A 104 15.148 -0.663 -31.894 1.00 62.43 H new ATOM 1600 N ILE A 105 10.154 -0.154 -32.402 1.00 13.30 N ATOM 1601 CA ILE A 105 8.774 -0.247 -31.940 1.00 43.52 C ATOM 1602 C ILE A 105 8.093 -1.494 -32.491 1.00 71.43 C ATOM 1603 O ILE A 105 7.937 -1.645 -33.702 1.00 63.32 O ATOM 1604 CB ILE A 105 7.959 0.994 -32.350 1.00 73.35 C ATOM 1605 CG1 ILE A 105 8.602 2.263 -31.789 1.00 2.14 C ATOM 1606 CG2 ILE A 105 6.521 0.865 -31.870 1.00 30.12 C ATOM 1607 CD1 ILE A 105 9.383 3.051 -32.817 1.00 71.12 C ATOM 0 H ILE A 105 10.273 -0.292 -33.405 1.00 13.30 H new ATOM 0 HA ILE A 105 8.808 -0.306 -30.852 1.00 43.52 H new ATOM 0 HB ILE A 105 7.954 1.064 -33.438 1.00 73.35 H new ATOM 0 HG12 ILE A 105 7.823 2.900 -31.370 1.00 2.14 H new ATOM 0 HG13 ILE A 105 9.267 1.991 -30.969 1.00 2.14 H new ATOM 0 HG21 ILE A 105 5.958 1.749 -32.167 1.00 30.12 H new ATOM 0 HG22 ILE A 105 6.067 -0.021 -32.315 1.00 30.12 H new ATOM 0 HG23 ILE A 105 6.507 0.774 -30.784 1.00 30.12 H new ATOM 0 HD11 ILE A 105 9.811 3.937 -32.348 1.00 71.12 H new ATOM 0 HD12 ILE A 105 10.184 2.431 -33.219 1.00 71.12 H new ATOM 0 HD13 ILE A 105 8.718 3.354 -33.626 1.00 71.12 H new ATOM 1619 N ASN A 106 7.687 -2.386 -31.593 1.00 13.30 N ATOM 1620 CA ASN A 106 7.020 -3.621 -31.989 1.00 50.11 C ATOM 1621 C ASN A 106 5.683 -3.772 -31.270 1.00 30.21 C ATOM 1622 O ASN A 106 5.632 -4.206 -30.120 1.00 20.14 O ATOM 1623 CB ASN A 106 7.913 -4.826 -31.688 1.00 60.21 C ATOM 1624 CG ASN A 106 7.566 -6.031 -32.542 1.00 13.44 C ATOM 1625 OD1 ASN A 106 6.411 -6.223 -32.923 1.00 30.13 O ATOM 1626 ND2 ASN A 106 8.567 -6.849 -32.846 1.00 13.45 N ATOM 0 H ASN A 106 7.808 -2.277 -30.586 1.00 13.30 H new ATOM 0 HA ASN A 106 6.832 -3.575 -33.062 1.00 50.11 H new ATOM 0 HB2 ASN A 106 8.955 -4.553 -31.856 1.00 60.21 H new ATOM 0 HB3 ASN A 106 7.818 -5.091 -30.635 1.00 60.21 H new ATOM 0 HD21 ASN A 106 8.394 -7.676 -33.417 1.00 13.45 H new ATOM 0 HD22 ASN A 106 9.509 -6.650 -32.508 1.00 13.45 H new ATOM 1633 N GLU A 107 4.603 -3.412 -31.957 1.00 4.31 N ATOM 1634 CA GLU A 107 3.266 -3.508 -31.383 1.00 44.50 C ATOM 1635 C GLU A 107 2.874 -4.965 -31.158 1.00 1.11 C ATOM 1636 O GLU A 107 2.104 -5.277 -30.250 1.00 23.40 O ATOM 1637 CB GLU A 107 2.245 -2.828 -32.298 1.00 32.34 C ATOM 1638 CG GLU A 107 0.917 -2.539 -31.618 1.00 20.01 C ATOM 1639 CD GLU A 107 0.022 -1.638 -32.446 1.00 74.44 C ATOM 1640 OE1 GLU A 107 -0.504 -2.111 -33.476 1.00 52.32 O ATOM 1641 OE2 GLU A 107 -0.153 -0.462 -32.066 1.00 33.23 O ATOM 0 H GLU A 107 4.628 -3.052 -32.911 1.00 4.31 H new ATOM 0 HA GLU A 107 3.274 -3.000 -30.419 1.00 44.50 H new ATOM 0 HB2 GLU A 107 2.666 -1.893 -32.667 1.00 32.34 H new ATOM 0 HB3 GLU A 107 2.069 -3.462 -33.167 1.00 32.34 H new ATOM 0 HG2 GLU A 107 0.400 -3.479 -31.424 1.00 20.01 H new ATOM 0 HG3 GLU A 107 1.102 -2.071 -30.651 1.00 20.01 H new ATOM 1648 N GLN A 108 3.409 -5.851 -31.992 1.00 32.12 N ATOM 1649 CA GLN A 108 3.114 -7.275 -31.885 1.00 13.03 C ATOM 1650 C GLN A 108 3.651 -7.845 -30.576 1.00 61.44 C ATOM 1651 O GLN A 108 2.937 -8.534 -29.849 1.00 30.44 O ATOM 1652 CB GLN A 108 3.714 -8.032 -33.070 1.00 64.50 C ATOM 1653 CG GLN A 108 2.674 -8.689 -33.963 1.00 30.01 C ATOM 1654 CD GLN A 108 1.790 -7.680 -34.668 1.00 53.32 C ATOM 1655 OE1 GLN A 108 0.563 -7.759 -34.602 1.00 74.04 O ATOM 1656 NE2 GLN A 108 2.409 -6.723 -35.349 1.00 5.44 N ATOM 0 H GLN A 108 4.048 -5.608 -32.749 1.00 32.12 H new ATOM 0 HA GLN A 108 2.031 -7.398 -31.896 1.00 13.03 H new ATOM 0 HB2 GLN A 108 4.309 -7.342 -33.667 1.00 64.50 H new ATOM 0 HB3 GLN A 108 4.394 -8.797 -32.695 1.00 64.50 H new ATOM 0 HG2 GLN A 108 3.177 -9.307 -34.706 1.00 30.01 H new ATOM 0 HG3 GLN A 108 2.053 -9.354 -33.363 1.00 30.01 H new ATOM 0 HE21 GLN A 108 3.428 -6.695 -35.377 1.00 5.44 H new ATOM 0 HE22 GLN A 108 1.865 -6.016 -35.844 1.00 5.44 H new ATOM 1665 N ALA A 109 4.914 -7.554 -30.284 1.00 44.02 N ATOM 1666 CA ALA A 109 5.547 -8.037 -29.063 1.00 10.51 C ATOM 1667 C ALA A 109 4.989 -7.322 -27.837 1.00 4.14 C ATOM 1668 O ALA A 109 4.987 -7.870 -26.735 1.00 34.21 O ATOM 1669 CB ALA A 109 7.055 -7.854 -29.142 1.00 44.01 C ATOM 0 H ALA A 109 5.519 -6.986 -30.877 1.00 44.02 H new ATOM 0 HA ALA A 109 5.326 -9.100 -28.964 1.00 10.51 H new ATOM 0 HB1 ALA A 109 7.514 -8.219 -28.223 1.00 44.01 H new ATOM 0 HB2 ALA A 109 7.446 -8.415 -29.991 1.00 44.01 H new ATOM 0 HB3 ALA A 109 7.287 -6.797 -29.268 1.00 44.01 H new ATOM 1675 N ALA A 110 4.519 -6.095 -28.035 1.00 73.14 N ATOM 1676 CA ALA A 110 3.958 -5.306 -26.946 1.00 35.33 C ATOM 1677 C ALA A 110 2.671 -5.934 -26.420 1.00 2.14 C ATOM 1678 O ALA A 110 2.517 -6.141 -25.216 1.00 32.21 O ATOM 1679 CB ALA A 110 3.701 -3.879 -27.405 1.00 50.33 C ATOM 0 H ALA A 110 4.516 -5.626 -28.941 1.00 73.14 H new ATOM 0 HA ALA A 110 4.683 -5.289 -26.132 1.00 35.33 H new ATOM 0 HB1 ALA A 110 3.282 -3.302 -26.581 1.00 50.33 H new ATOM 0 HB2 ALA A 110 4.639 -3.426 -27.726 1.00 50.33 H new ATOM 0 HB3 ALA A 110 2.998 -3.886 -28.238 1.00 50.33 H new ATOM 1685 N VAL A 111 1.749 -6.234 -27.329 1.00 44.11 N ATOM 1686 CA VAL A 111 0.476 -6.838 -26.956 1.00 70.34 C ATOM 1687 C VAL A 111 0.655 -8.302 -26.571 1.00 34.50 C ATOM 1688 O VAL A 111 -0.062 -8.822 -25.715 1.00 31.43 O ATOM 1689 CB VAL A 111 -0.548 -6.742 -28.103 1.00 0.10 C ATOM 1690 CG1 VAL A 111 -0.305 -7.838 -29.130 1.00 11.34 C ATOM 1691 CG2 VAL A 111 -1.966 -6.816 -27.558 1.00 12.43 C ATOM 0 H VAL A 111 1.860 -6.068 -28.329 1.00 44.11 H new ATOM 0 HA VAL A 111 0.101 -6.282 -26.097 1.00 70.34 H new ATOM 0 HB VAL A 111 -0.423 -5.779 -28.599 1.00 0.10 H new ATOM 0 HG11 VAL A 111 -1.038 -7.754 -29.932 1.00 11.34 H new ATOM 0 HG12 VAL A 111 0.698 -7.734 -29.543 1.00 11.34 H new ATOM 0 HG13 VAL A 111 -0.401 -8.813 -28.652 1.00 11.34 H new ATOM 0 HG21 VAL A 111 -2.676 -6.747 -28.382 1.00 12.43 H new ATOM 0 HG22 VAL A 111 -2.106 -7.763 -27.036 1.00 12.43 H new ATOM 0 HG23 VAL A 111 -2.133 -5.992 -26.865 1.00 12.43 H new ATOM 1701 N LEU A 112 1.615 -8.963 -27.208 1.00 21.11 N ATOM 1702 CA LEU A 112 1.889 -10.369 -26.932 1.00 24.04 C ATOM 1703 C LEU A 112 2.104 -10.599 -25.439 1.00 53.10 C ATOM 1704 O LEU A 112 1.834 -11.683 -24.923 1.00 14.11 O ATOM 1705 CB LEU A 112 3.121 -10.832 -27.712 1.00 53.35 C ATOM 1706 CG LEU A 112 3.737 -12.159 -27.269 1.00 3.33 C ATOM 1707 CD1 LEU A 112 2.760 -13.302 -27.491 1.00 33.33 C ATOM 1708 CD2 LEU A 112 5.040 -12.416 -28.012 1.00 21.52 C ATOM 0 H LEU A 112 2.217 -8.548 -27.919 1.00 21.11 H new ATOM 0 HA LEU A 112 1.024 -10.951 -27.251 1.00 24.04 H new ATOM 0 HB2 LEU A 112 2.850 -10.914 -28.765 1.00 53.35 H new ATOM 0 HB3 LEU A 112 3.885 -10.058 -27.639 1.00 53.35 H new ATOM 0 HG LEU A 112 3.956 -12.098 -26.203 1.00 3.33 H new ATOM 0 HD11 LEU A 112 3.216 -14.238 -27.170 1.00 33.33 H new ATOM 0 HD12 LEU A 112 1.853 -13.123 -26.913 1.00 33.33 H new ATOM 0 HD13 LEU A 112 2.509 -13.365 -28.550 1.00 33.33 H new ATOM 0 HD21 LEU A 112 5.465 -13.365 -27.684 1.00 21.52 H new ATOM 0 HD22 LEU A 112 4.846 -12.456 -29.084 1.00 21.52 H new ATOM 0 HD23 LEU A 112 5.744 -11.611 -27.801 1.00 21.52 H new ATOM 1720 N ALA A 113 2.589 -9.571 -24.751 1.00 0.31 N ATOM 1721 CA ALA A 113 2.835 -9.659 -23.317 1.00 23.31 C ATOM 1722 C ALA A 113 1.585 -9.300 -22.522 1.00 34.11 C ATOM 1723 O ALA A 113 1.286 -9.922 -21.502 1.00 2.40 O ATOM 1724 CB ALA A 113 3.992 -8.753 -22.923 1.00 51.41 C ATOM 0 H ALA A 113 2.819 -8.667 -25.164 1.00 0.31 H new ATOM 0 HA ALA A 113 3.099 -10.690 -23.082 1.00 23.31 H new ATOM 0 HB1 ALA A 113 4.164 -8.829 -21.849 1.00 51.41 H new ATOM 0 HB2 ALA A 113 4.892 -9.058 -23.457 1.00 51.41 H new ATOM 0 HB3 ALA A 113 3.750 -7.722 -23.180 1.00 51.41 H new ATOM 1730 N ARG A 114 0.857 -8.293 -22.995 1.00 23.32 N ATOM 1731 CA ARG A 114 -0.360 -7.850 -22.326 1.00 73.44 C ATOM 1732 C ARG A 114 -1.332 -9.012 -22.142 1.00 33.05 C ATOM 1733 O ARG A 114 -2.029 -9.095 -21.131 1.00 32.11 O ATOM 1734 CB ARG A 114 -1.030 -6.733 -23.129 1.00 34.44 C ATOM 1735 CG ARG A 114 -1.398 -5.519 -22.292 1.00 34.12 C ATOM 1736 CD ARG A 114 -1.523 -4.269 -23.149 1.00 32.12 C ATOM 1737 NE ARG A 114 -2.280 -3.217 -22.475 1.00 45.12 N ATOM 1738 CZ ARG A 114 -2.433 -1.993 -22.967 1.00 55.41 C ATOM 1739 NH1 ARG A 114 -1.887 -1.668 -24.131 1.00 23.54 N ATOM 1740 NH2 ARG A 114 -3.136 -1.090 -22.295 1.00 11.31 N ATOM 0 H ARG A 114 1.089 -7.769 -23.839 1.00 23.32 H new ATOM 0 HA ARG A 114 -0.087 -7.468 -21.342 1.00 73.44 H new ATOM 0 HB2 ARG A 114 -0.361 -6.422 -23.931 1.00 34.44 H new ATOM 0 HB3 ARG A 114 -1.931 -7.126 -23.600 1.00 34.44 H new ATOM 0 HG2 ARG A 114 -2.340 -5.703 -21.776 1.00 34.12 H new ATOM 0 HG3 ARG A 114 -0.640 -5.361 -21.525 1.00 34.12 H new ATOM 0 HD2 ARG A 114 -0.528 -3.898 -23.396 1.00 32.12 H new ATOM 0 HD3 ARG A 114 -2.012 -4.522 -24.090 1.00 32.12 H new ATOM 0 HE ARG A 114 -2.714 -3.434 -21.578 1.00 45.12 H new ATOM 0 HH11 ARG A 114 -1.347 -2.359 -24.652 1.00 23.54 H new ATOM 0 HH12 ARG A 114 -2.007 -0.727 -24.505 1.00 23.54 H new ATOM 0 HH21 ARG A 114 -3.559 -1.336 -21.400 1.00 11.31 H new ATOM 0 HH22 ARG A 114 -3.253 -0.150 -22.673 1.00 11.31 H new ATOM 1754 N GLU A 115 -1.373 -9.906 -23.125 1.00 43.51 N ATOM 1755 CA GLU A 115 -2.260 -11.061 -23.070 1.00 74.14 C ATOM 1756 C GLU A 115 -2.067 -11.835 -21.770 1.00 3.15 C ATOM 1757 O GLU A 115 -2.994 -12.470 -21.269 1.00 32.11 O ATOM 1758 CB GLU A 115 -2.010 -11.982 -24.267 1.00 5.25 C ATOM 1759 CG GLU A 115 -2.811 -11.607 -25.502 1.00 2.21 C ATOM 1760 CD GLU A 115 -4.304 -11.565 -25.239 1.00 25.34 C ATOM 1761 OE1 GLU A 115 -4.929 -12.645 -25.196 1.00 13.11 O ATOM 1762 OE2 GLU A 115 -4.846 -10.452 -25.075 1.00 23.11 O ATOM 0 H GLU A 115 -0.802 -9.852 -23.969 1.00 43.51 H new ATOM 0 HA GLU A 115 -3.287 -10.699 -23.107 1.00 74.14 H new ATOM 0 HB2 GLU A 115 -0.948 -11.963 -24.513 1.00 5.25 H new ATOM 0 HB3 GLU A 115 -2.253 -13.006 -23.984 1.00 5.25 H new ATOM 0 HG2 GLU A 115 -2.482 -10.632 -25.862 1.00 2.21 H new ATOM 0 HG3 GLU A 115 -2.606 -12.326 -26.296 1.00 2.21 H new ATOM 1769 N ALA A 116 -0.854 -11.777 -21.228 1.00 54.42 N ATOM 1770 CA ALA A 116 -0.539 -12.470 -19.986 1.00 5.05 C ATOM 1771 C ALA A 116 -0.405 -11.487 -18.827 1.00 74.31 C ATOM 1772 O ALA A 116 -0.570 -11.856 -17.665 1.00 60.41 O ATOM 1773 CB ALA A 116 0.740 -13.279 -20.143 1.00 62.42 C ATOM 0 H ALA A 116 -0.074 -11.257 -21.630 1.00 54.42 H new ATOM 0 HA ALA A 116 -1.361 -13.149 -19.760 1.00 5.05 H new ATOM 0 HB1 ALA A 116 0.963 -13.792 -19.207 1.00 62.42 H new ATOM 0 HB2 ALA A 116 0.610 -14.014 -20.937 1.00 62.42 H new ATOM 0 HB3 ALA A 116 1.564 -12.612 -20.397 1.00 62.42 H new ATOM 1779 N GLY A 117 -0.105 -10.233 -19.152 1.00 73.30 N ATOM 1780 CA GLY A 117 0.046 -9.217 -18.127 1.00 33.20 C ATOM 1781 C GLY A 117 1.491 -8.806 -17.927 1.00 52.31 C ATOM 1782 O GLY A 117 1.777 -7.837 -17.221 1.00 74.43 O ATOM 0 H GLY A 117 0.036 -9.903 -20.107 1.00 73.30 H new ATOM 0 HA2 GLY A 117 -0.543 -8.341 -18.398 1.00 33.20 H new ATOM 0 HA3 GLY A 117 -0.355 -9.592 -17.186 1.00 33.20 H new ATOM 1786 N LEU A 118 2.405 -9.543 -18.548 1.00 3.42 N ATOM 1787 CA LEU A 118 3.830 -9.250 -18.434 1.00 30.14 C ATOM 1788 C LEU A 118 4.114 -7.788 -18.762 1.00 53.20 C ATOM 1789 O LEU A 118 3.419 -7.178 -19.574 1.00 52.54 O ATOM 1790 CB LEU A 118 4.634 -10.159 -19.365 1.00 74.12 C ATOM 1791 CG LEU A 118 5.991 -10.628 -18.839 1.00 53.11 C ATOM 1792 CD1 LEU A 118 5.816 -11.782 -17.864 1.00 15.52 C ATOM 1793 CD2 LEU A 118 6.898 -11.034 -19.991 1.00 71.24 C ATOM 0 H LEU A 118 2.185 -10.347 -19.135 1.00 3.42 H new ATOM 0 HA LEU A 118 4.132 -9.437 -17.404 1.00 30.14 H new ATOM 0 HB2 LEU A 118 4.031 -11.038 -19.591 1.00 74.12 H new ATOM 0 HB3 LEU A 118 4.794 -9.632 -20.306 1.00 74.12 H new ATOM 0 HG LEU A 118 6.460 -9.799 -18.308 1.00 53.11 H new ATOM 0 HD11 LEU A 118 6.792 -12.102 -17.500 1.00 15.52 H new ATOM 0 HD12 LEU A 118 5.204 -11.458 -17.022 1.00 15.52 H new ATOM 0 HD13 LEU A 118 5.326 -12.614 -18.369 1.00 15.52 H new ATOM 0 HD21 LEU A 118 7.859 -11.365 -19.598 1.00 71.24 H new ATOM 0 HD22 LEU A 118 6.435 -11.847 -20.550 1.00 71.24 H new ATOM 0 HD23 LEU A 118 7.051 -10.181 -20.652 1.00 71.24 H new ATOM 1805 N SER A 119 5.140 -7.232 -18.126 1.00 65.35 N ATOM 1806 CA SER A 119 5.516 -5.841 -18.350 1.00 34.02 C ATOM 1807 C SER A 119 6.432 -5.713 -19.563 1.00 25.55 C ATOM 1808 O SER A 119 7.639 -5.941 -19.470 1.00 12.00 O ATOM 1809 CB SER A 119 6.209 -5.272 -17.110 1.00 73.32 C ATOM 1810 OG SER A 119 5.858 -3.914 -16.907 1.00 74.44 O ATOM 0 H SER A 119 5.726 -7.724 -17.451 1.00 65.35 H new ATOM 0 HA SER A 119 4.607 -5.272 -18.543 1.00 34.02 H new ATOM 0 HB2 SER A 119 5.931 -5.857 -16.234 1.00 73.32 H new ATOM 0 HB3 SER A 119 7.290 -5.359 -17.222 1.00 73.32 H new ATOM 0 HG SER A 119 5.286 -3.839 -16.115 1.00 74.44 H new ATOM 1816 N VAL A 120 5.851 -5.348 -20.701 1.00 12.15 N ATOM 1817 CA VAL A 120 6.614 -5.189 -21.933 1.00 1.45 C ATOM 1818 C VAL A 120 7.099 -3.753 -22.097 1.00 12.51 C ATOM 1819 O VAL A 120 6.326 -2.805 -21.955 1.00 11.20 O ATOM 1820 CB VAL A 120 5.778 -5.581 -23.165 1.00 42.13 C ATOM 1821 CG1 VAL A 120 4.547 -4.695 -23.280 1.00 31.23 C ATOM 1822 CG2 VAL A 120 6.622 -5.500 -24.428 1.00 63.43 C ATOM 0 H VAL A 120 4.854 -5.157 -20.795 1.00 12.15 H new ATOM 0 HA VAL A 120 7.475 -5.854 -21.861 1.00 1.45 H new ATOM 0 HB VAL A 120 5.444 -6.611 -23.043 1.00 42.13 H new ATOM 0 HG11 VAL A 120 3.969 -4.987 -24.157 1.00 31.23 H new ATOM 0 HG12 VAL A 120 3.933 -4.807 -22.386 1.00 31.23 H new ATOM 0 HG13 VAL A 120 4.856 -3.654 -23.379 1.00 31.23 H new ATOM 0 HG21 VAL A 120 6.016 -5.780 -25.289 1.00 63.43 H new ATOM 0 HG22 VAL A 120 6.987 -4.481 -24.557 1.00 63.43 H new ATOM 0 HG23 VAL A 120 7.469 -6.181 -24.344 1.00 63.43 H new ATOM 1832 N VAL A 121 8.384 -3.598 -22.398 1.00 24.44 N ATOM 1833 CA VAL A 121 8.973 -2.277 -22.583 1.00 61.53 C ATOM 1834 C VAL A 121 9.809 -2.223 -23.857 1.00 3.42 C ATOM 1835 O VAL A 121 10.911 -2.769 -23.912 1.00 53.41 O ATOM 1836 CB VAL A 121 9.857 -1.883 -21.385 1.00 35.22 C ATOM 1837 CG1 VAL A 121 10.310 -0.437 -21.509 1.00 4.22 C ATOM 1838 CG2 VAL A 121 9.111 -2.106 -20.078 1.00 30.53 C ATOM 0 H VAL A 121 9.038 -4.372 -22.519 1.00 24.44 H new ATOM 0 HA VAL A 121 8.147 -1.570 -22.663 1.00 61.53 H new ATOM 0 HB VAL A 121 10.743 -2.518 -21.385 1.00 35.22 H new ATOM 0 HG11 VAL A 121 10.933 -0.176 -20.654 1.00 4.22 H new ATOM 0 HG12 VAL A 121 10.884 -0.313 -22.427 1.00 4.22 H new ATOM 0 HG13 VAL A 121 9.438 0.217 -21.535 1.00 4.22 H new ATOM 0 HG21 VAL A 121 9.750 -1.823 -19.242 1.00 30.53 H new ATOM 0 HG22 VAL A 121 8.207 -1.497 -20.067 1.00 30.53 H new ATOM 0 HG23 VAL A 121 8.841 -3.158 -19.988 1.00 30.53 H new ATOM 1848 N MET A 122 9.278 -1.559 -24.879 1.00 23.14 N ATOM 1849 CA MET A 122 9.977 -1.431 -26.152 1.00 61.32 C ATOM 1850 C MET A 122 10.564 -0.032 -26.312 1.00 60.53 C ATOM 1851 O MET A 122 10.244 0.877 -25.546 1.00 73.43 O ATOM 1852 CB MET A 122 9.027 -1.734 -27.312 1.00 70.24 C ATOM 1853 CG MET A 122 7.881 -0.743 -27.434 1.00 31.00 C ATOM 1854 SD MET A 122 6.340 -1.375 -26.744 1.00 32.12 S ATOM 1855 CE MET A 122 5.160 -0.216 -27.432 1.00 22.11 C ATOM 0 H MET A 122 8.367 -1.102 -24.850 1.00 23.14 H new ATOM 0 HA MET A 122 10.794 -2.152 -26.163 1.00 61.32 H new ATOM 0 HB2 MET A 122 9.594 -1.738 -28.243 1.00 70.24 H new ATOM 0 HB3 MET A 122 8.618 -2.736 -27.183 1.00 70.24 H new ATOM 0 HG2 MET A 122 8.150 0.182 -26.925 1.00 31.00 H new ATOM 0 HG3 MET A 122 7.730 -0.496 -28.485 1.00 31.00 H new ATOM 0 HE1 MET A 122 4.156 -0.476 -27.095 1.00 22.11 H new ATOM 0 HE2 MET A 122 5.405 0.793 -27.100 1.00 22.11 H new ATOM 0 HE3 MET A 122 5.200 -0.259 -28.520 1.00 22.11 H new ATOM 1865 N ASP A 123 11.424 0.133 -27.311 1.00 61.41 N ATOM 1866 CA ASP A 123 12.055 1.421 -27.572 1.00 1.23 C ATOM 1867 C ASP A 123 12.700 1.976 -26.306 1.00 10.53 C ATOM 1868 O ASP A 123 12.628 3.175 -26.035 1.00 42.42 O ATOM 1869 CB ASP A 123 11.028 2.416 -28.114 1.00 75.10 C ATOM 1870 CG ASP A 123 11.617 3.347 -29.155 1.00 53.22 C ATOM 1871 OD1 ASP A 123 12.537 4.118 -28.809 1.00 55.24 O ATOM 1872 OD2 ASP A 123 11.159 3.304 -30.316 1.00 13.31 O ATOM 0 H ASP A 123 11.700 -0.610 -27.953 1.00 61.41 H new ATOM 0 HA ASP A 123 12.834 1.271 -28.320 1.00 1.23 H new ATOM 0 HB2 ASP A 123 10.192 1.869 -28.551 1.00 75.10 H new ATOM 0 HB3 ASP A 123 10.627 3.005 -27.289 1.00 75.10 H new ATOM 1877 N ARG A 124 13.329 1.097 -25.533 1.00 75.40 N ATOM 1878 CA ARG A 124 13.984 1.499 -24.294 1.00 71.53 C ATOM 1879 C ARG A 124 15.162 0.581 -23.980 1.00 40.11 C ATOM 1880 O ARG A 124 15.065 -0.639 -24.117 1.00 21.13 O ATOM 1881 CB ARG A 124 12.986 1.480 -23.135 1.00 71.10 C ATOM 1882 CG ARG A 124 12.069 2.692 -23.101 1.00 61.31 C ATOM 1883 CD ARG A 124 11.685 3.060 -21.677 1.00 4.34 C ATOM 1884 NE ARG A 124 10.350 3.648 -21.604 1.00 24.11 N ATOM 1885 CZ ARG A 124 9.770 4.014 -20.467 1.00 13.42 C ATOM 1886 NH1 ARG A 124 10.404 3.855 -19.313 1.00 73.03 N ATOM 1887 NH2 ARG A 124 8.552 4.542 -20.482 1.00 43.11 N ATOM 0 H ARG A 124 13.399 0.101 -25.743 1.00 75.40 H new ATOM 0 HA ARG A 124 14.360 2.514 -24.424 1.00 71.53 H new ATOM 0 HB2 ARG A 124 12.379 0.577 -23.204 1.00 71.10 H new ATOM 0 HB3 ARG A 124 13.535 1.424 -22.195 1.00 71.10 H new ATOM 0 HG2 ARG A 124 12.565 3.539 -23.575 1.00 61.31 H new ATOM 0 HG3 ARG A 124 11.169 2.485 -23.680 1.00 61.31 H new ATOM 0 HD2 ARG A 124 11.724 2.169 -21.050 1.00 4.34 H new ATOM 0 HD3 ARG A 124 12.414 3.764 -21.276 1.00 4.34 H new ATOM 0 HE ARG A 124 9.835 3.785 -22.474 1.00 24.11 H new ATOM 0 HH11 ARG A 124 11.340 3.450 -19.297 1.00 73.03 H new ATOM 0 HH12 ARG A 124 9.955 4.137 -18.442 1.00 73.03 H new ATOM 0 HH21 ARG A 124 8.061 4.667 -21.367 1.00 43.11 H new ATOM 0 HH22 ARG A 124 8.107 4.823 -19.608 1.00 43.11 H new ATOM 1901 N CYS A 125 16.273 1.176 -23.560 1.00 13.32 N ATOM 1902 CA CYS A 125 17.470 0.413 -23.227 1.00 64.15 C ATOM 1903 C CYS A 125 17.962 0.756 -21.825 1.00 42.22 C ATOM 1904 O CYS A 125 17.787 1.872 -21.335 1.00 31.10 O ATOM 1905 CB CYS A 125 18.575 0.686 -24.250 1.00 13.54 C ATOM 1906 SG CYS A 125 18.887 -0.686 -25.384 1.00 23.51 S ATOM 0 H CYS A 125 16.369 2.185 -23.442 1.00 13.32 H new ATOM 0 HA CYS A 125 17.214 -0.646 -23.253 1.00 64.15 H new ATOM 0 HB2 CYS A 125 18.308 1.569 -24.830 1.00 13.54 H new ATOM 0 HB3 CYS A 125 19.497 0.921 -23.719 1.00 13.54 H new ATOM 0 HG CYS A 125 18.592 -1.809 -24.798 1.00 23.51 H new ATOM 1912 N PRO A 126 18.592 -0.225 -21.162 1.00 34.11 N ATOM 1913 CA PRO A 126 19.121 -0.051 -19.806 1.00 33.21 C ATOM 1914 C PRO A 126 20.327 0.881 -19.769 1.00 61.44 C ATOM 1915 O PRO A 126 20.567 1.562 -18.773 1.00 61.10 O ATOM 1916 CB PRO A 126 19.528 -1.470 -19.399 1.00 42.35 C ATOM 1917 CG PRO A 126 19.792 -2.171 -20.687 1.00 25.32 C ATOM 1918 CD PRO A 126 18.836 -1.580 -21.685 1.00 12.22 C ATOM 0 HA PRO A 126 18.390 0.405 -19.139 1.00 33.21 H new ATOM 0 HB2 PRO A 126 20.414 -1.461 -18.764 1.00 42.35 H new ATOM 0 HB3 PRO A 126 18.736 -1.963 -18.835 1.00 42.35 H new ATOM 0 HG2 PRO A 126 20.825 -2.028 -21.004 1.00 25.32 H new ATOM 0 HG3 PRO A 126 19.636 -3.245 -20.586 1.00 25.32 H new ATOM 0 HD2 PRO A 126 19.266 -1.553 -22.686 1.00 12.22 H new ATOM 0 HD3 PRO A 126 17.914 -2.158 -21.750 1.00 12.22 H new ATOM 1926 N ALA A 127 21.083 0.906 -20.862 1.00 71.32 N ATOM 1927 CA ALA A 127 22.263 1.756 -20.956 1.00 0.14 C ATOM 1928 C ALA A 127 21.910 3.216 -20.694 1.00 14.24 C ATOM 1929 O ALA A 127 22.673 3.945 -20.059 1.00 32.11 O ATOM 1930 CB ALA A 127 22.915 1.606 -22.322 1.00 22.10 C ATOM 0 H ALA A 127 20.899 0.347 -21.695 1.00 71.32 H new ATOM 0 HA ALA A 127 22.971 1.437 -20.191 1.00 0.14 H new ATOM 0 HB1 ALA A 127 23.795 2.247 -22.377 1.00 22.10 H new ATOM 0 HB2 ALA A 127 23.212 0.568 -22.471 1.00 22.10 H new ATOM 0 HB3 ALA A 127 22.206 1.896 -23.097 1.00 22.10 H new ATOM 1936 N ILE A 128 20.750 3.637 -21.187 1.00 33.14 N ATOM 1937 CA ILE A 128 20.296 5.010 -21.005 1.00 0.20 C ATOM 1938 C ILE A 128 19.311 5.115 -19.845 1.00 64.03 C ATOM 1939 O ILE A 128 19.095 6.196 -19.299 1.00 34.23 O ATOM 1940 CB ILE A 128 19.629 5.556 -22.281 1.00 52.12 C ATOM 1941 CG1 ILE A 128 20.576 5.421 -23.475 1.00 53.55 C ATOM 1942 CG2 ILE A 128 19.218 7.008 -22.085 1.00 25.13 C ATOM 1943 CD1 ILE A 128 19.947 5.818 -24.793 1.00 11.22 C ATOM 0 H ILE A 128 20.108 3.047 -21.716 1.00 33.14 H new ATOM 0 HA ILE A 128 21.180 5.607 -20.783 1.00 0.20 H new ATOM 0 HB ILE A 128 18.733 4.970 -22.484 1.00 52.12 H new ATOM 0 HG12 ILE A 128 21.457 6.039 -23.301 1.00 53.55 H new ATOM 0 HG13 ILE A 128 20.919 4.388 -23.542 1.00 53.55 H new ATOM 0 HG21 ILE A 128 18.748 7.379 -22.996 1.00 25.13 H new ATOM 0 HG22 ILE A 128 18.512 7.078 -21.258 1.00 25.13 H new ATOM 0 HG23 ILE A 128 20.100 7.609 -21.861 1.00 25.13 H new ATOM 0 HD11 ILE A 128 20.675 5.697 -25.595 1.00 11.22 H new ATOM 0 HD12 ILE A 128 19.083 5.184 -24.989 1.00 11.22 H new ATOM 0 HD13 ILE A 128 19.629 6.860 -24.745 1.00 11.22 H new